A0A096MYY6_PAPAN Loading...

Keratocan

AlphaFold DB (A0A2K5NKG3), UniProt , Accession A0A096MYY6, Species PAPAN (Papio anubis, Olive baboon), Gene KERA, Length 352 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	44	Very low	37.6	Very low	243 Å²	243	124.9 Å²	124.9	100%	1.197	69%	0.693	S	S	*	*				0	61.7	0	-82.1	-177.2	-89.6	0	0	111.1
2	A	36.7	Very low	37.3	Very low	93 Å²	93	121.3 Å²	121.3	77%	0.769	67%	0.671	S	S	*	*			trans	-149.1	12.1	171.9	0	0	0	0	0	111.8
3	G	36.4	Very low	37.1	Very low	62 Å²	62	122.1 Å²	122.1	64%	0.639	66%	0.663	S	S	*	*	S	Bend	trans	-106.5	-7.1	-176.2	0	0	0	0	0	114.4
4	T	39.2	Very low	37.1	Very low	113 Å²	113	122.4 Å²	122.4	69%	0.693	66%	0.662	S	S	*	*	S	Bend	trans	-98.4	-7.9	-173.3	-29	0	0	0	0	113
5	I	38.9	Very low	37	Very low	127 Å²	127	120.3 Å²	120.3	65%	0.651	66%	0.655	S	S	*	*	S	Bend	trans	-94.3	-20.1	-176.8	-61	173.9	0	0	0	111.8
6	C	40	Very low	36.9	Very low	92 Å²	92	118.6 Å²	118.6	62%	0.622	65%	0.646	S	S	*	*	H	α-helix	trans	-82	-21.7	-177.6	-149.9	0	0	0	0	113.6
7	F	35.7	Very low	36.9	Very low	149 Å²	149	117.3 Å²	117.3	65%	0.654	64%	0.642	S	S	*	*	H	α-helix	trans	-85.6	-24.1	-177.6	-122.6	-91.8	0	0	0	113.8	L9	F7-L9 VanDerWaalsContact C-N 3.33Å
8	I	37.3	Very low	36.9	Very low	116 Å²	116	117.4 Å²	117.4	60%	0.595	65%	0.647	S	S	*	*	H	α-helix	trans	-74.5	-28.3	174.3	-62.9	176.1	0	0	0	110.7	L12	I8-L12 HydrophobicContact CG2-CD1 4.48Å
9	L	34.8	Very low	36.9	Very low	94 Å²	94	122.6 Å²	122.6	49%	0.492	66%	0.656	S	S	.	*	H	α-helix	trans	-75.7	-23.1	177.1	-86.8	154.3	0	0	0	113.8	F7 F13	F7-L9 VanDerWaalsContact C-N 3.33Å; L9-F13 WeakPolarHBondContact O-CD2 3.08Å; L9-F13 PolarHBondContact O-N 2.96Å
10	W	33.9	Very low	36.7	Very low	185 Å²	185	123 Å²	123	70%	0.701	66%	0.663	S	S	*	*	H	α-helix	trans	-87.1	-24	178.4	-115.1	59.9	0	0	0	114	F13	W10-F13 PolarHBondContact O-N 2.71Å
11	V	36.1	Very low	36.6	Very low	100 Å²	100	128.7 Å²	128.7	61%	0.606	68%	0.675	S	S	*	*	H	α-helix	trans	-77.2	-25.4	173.3	179.6	0	0	0	0	111.7	T15	V11-T15 PolarHBondContact O-OG1 3.4Å
12	L	34	Very low	36	Very low	82 Å²	82	122.1 Å²	122.1	43%	0.429	65%	0.653	S	S	.	*	H	α-helix	trans	-75.6	-30.3	170.7	-76.5	162.1	0	0	0	112.6	I8 I14 T15 D16	I8-L12 HydrophobicContact CG2-CD1 4.48Å; L12-I14 PolarHBondContact O-N 2.98Å; L12-T15 PolarHBondContact O-N 3.23Å; L12-T15 PolarHBondContact O-OG1 3.24Å; L12-D16 WeakPolarHBondContact O-CB 3.49Å; L12-D16 PolarHBondContact O-N 2.83Å
13	F	35.4	Very low	35.9	Very low	131 Å²	131	124 Å²	124	58%	0.575	66%	0.655	S	S	*	*	T	Hydrogen-bonded Turn	trans	-80.7	-4.6	-176.3	-101.8	-85	0	0	0	116.6	L9 W10 T17	L9-F13 WeakPolarHBondContact O-CD2 3.08Å; L9-F13 PolarHBondContact O-N 2.96Å; W10-F13 PolarHBondContact O-N 2.71Å; F13-T17 HydrophobicContact CD1-CG2 4.24Å; F13-T17 WeakPolarHBondContact O-CG2 3.29Å; F13-T17 PolarHBondContact O-OG1 3.39Å
14	I	36.4	Very low	35.6	Very low	127 Å²	127	131.6 Å²	131.6	65%	0.651	66%	0.664	S	S	*	*	T	Hydrogen-bonded Turn	trans	-107.7	-6.8	168.5	-56.6	-179.5	0	0	0	111.3	L12	L12-I14 PolarHBondContact O-N 2.98Å
15	T	36.5	Very low	35.3	Very low	91 Å²	91	133.3 Å²	133.3	56%	0.558	66%	0.664	S	S	*	*	T	Hydrogen-bonded Turn	trans	-98	-19.8	169.7	49.2	0	0	0	0	112.9	V11 L12	V11-T15 PolarHBondContact O-OG1 3.4Å; L12-T15 PolarHBondContact O-N 3.23Å; L12-T15 PolarHBondContact O-OG1 3.24Å
16	D	35	Very low	35	Very low	93 Å²	93	133.6 Å²	133.6	50%	0.497	67%	0.672	S	S	.	*	S	Bend	trans	-100.4	-10.6	179.1	-78.1	-35.4	0	0	0	116.1	L12 V18 W19	L12-D16 WeakPolarHBondContact O-CB 3.49Å; L12-D16 PolarHBondContact O-N 2.83Å; D16-V18 PolarHBondContact O-N 3.28Å; D16-W19 PolarHBondContact O-N 2.04Å
17	T	36.9	Very low	34.8	Very low	96 Å²	96	138 Å²	138	59%	0.589	68%	0.676	S	S	*	*	T	Hydrogen-bonded Turn	trans	-84.2	10.2	179.8	52.9	0	0	0	0	115.1	F13	F13-T17 HydrophobicContact CD1-CG2 4.24Å; F13-T17 WeakPolarHBondContact O-CG2 3.29Å; F13-T17 PolarHBondContact O-OG1 3.39Å
18	V	37.2	Very low	34.9	Very low	120 Å²	120	138.9 Å²	138.9	73%	0.727	68%	0.683	S	S	*	*	T	Hydrogen-bonded Turn	trans	-106.8	-6.4	168.6	-176.3	0	0	0	0	111.9	D16	D16-V18 PolarHBondContact O-N 3.28Å
19	W	36.7	Very low	34.6	Very low	215 Å²	215	139.4 Å²	139.4	81%	0.814	69%	0.691	S	S	*	*	S	Bend	trans	-125.6	42.5	-172.5	-87.1	83.7	0	0	0	114.6	D16	D16-W19 PolarHBondContact O-N 2.04Å
20	T	33.5	Very low	34.9	Very low	130 Å²	130	143.4 Å²	143.4	80%	0.798	71%	0.707	S	S	*	*			trans	-145.6	56.1	156.7	63	0	0	0	0	111.6	S22	T20-S22 PolarHBondContact O-N 3.37Å
21	R	33.6	Very low	35.2	Very low	243 Å²	243	140.6 Å²	140.6	92%	0.917	71%	0.705	S	S	*	*			trans	-82.1	102.2	148	-99.8	-173.1	173.5	-175.4	-0.9	106.3	V23	R21-V23 PolarHBondContact O-N 3.42Å
22	S	31.8	Very low	35.6	Very low	105 Å²	105	141.4 Å²	141.4	73%	0.734	72%	0.716	S	S	*	*			trans	-29.3	121.7	162.7	176.9	0	0	0	0	109.7	T20 R24	T20-S22 PolarHBondContact O-N 3.37Å; S22-R24 PolarHBondContact O-N 3.42Å
23	V	35.2	Very low	36.4	Very low	134 Å²	134	143.1 Å²	143.1	81%	0.812	73%	0.725	S	S	*	*			trans	-58.6	88.8	166.6	177.9	0	0	0	0	105.7	R21 Q25	R21-V23 PolarHBondContact O-N 3.42Å; V23-Q25 PolarHBondContact O-N 3.24Å; V23-Q25 VanDerWaalsContact O-N 3.08Å
24	R	30.1	Very low	36.8	Very low	220 Å²	220	144.2 Å²	144.2	83%	0.83	74%	0.737	S	S	*	*			trans	-65.1	111.4	165.3	-136.3	178.8	-170	-176.6	1.9	103.8	S22 V26	S22-R24 PolarHBondContact O-N 3.42Å; R24-V26 VanDerWaalsContact C-N 3.35Å; R24-V26 PolarHBondContact O-N 3.37Å
25	Q	32.4	Very low	37	Very low	150 Å²	150	145.2 Å²	145.2	70%	0.701	73%	0.733	S	S	*	*			trans	-49.8	104.4	167	-77.6	176.8	-36.7	0	0	107.4	V23 Y27	V23-Q25 PolarHBondContact O-N 3.24Å; V23-Q25 VanDerWaalsContact O-N 3.08Å; Q25-Y27 HydrophobicContact CB-CD2 3.87Å; Q25-Y27 HydrophobicContact CB-CE2 4.17Å; Q25-Y27 HydrophobicContact CG-CD2 4.36Å; Q25-Y27 HydrophobicContact CG-CE2 4.15Å; Q25-Y27 PolarHBondContact O-N 2.82Å; Q25-Y27 VanDerWaalsContact O-N 3.16Å
26	V	31.8	Very low	37.7	Very low	132 Å²	132	144.3 Å²	144.3	80%	0.8	73%	0.727	S	S	*	*			trans	-82.3	82.6	163.1	-178.8	0	0	0	0	104.6	R24	R24-V26 VanDerWaalsContact C-N 3.35Å; R24-V26 PolarHBondContact O-N 3.37Å
27	Y	36.1	Very low	38.5	Very low	184 Å²	184	147.3 Å²	147.3	72%	0.722	74%	0.742	S	S	*	*			trans	-81.5	140.9	155.4	-81.7	-73.6	0	0	0	107.9	Q25	Q25-Y27 HydrophobicContact CB-CD2 3.87Å; Q25-Y27 HydrophobicContact CB-CE2 4.17Å; Q25-Y27 HydrophobicContact CG-CD2 4.36Å; Q25-Y27 HydrophobicContact CG-CE2 4.15Å; Q25-Y27 PolarHBondContact O-N 2.82Å; Q25-Y27 VanDerWaalsContact O-N 3.16Å
28	E	37.7	Very low	39.2	Very low	168 Å²	168	148.8 Å²	148.8	79%	0.785	74%	0.741	S	S	*	*			trans	79.1	89.2	168.7	-62.1	179.2	176.2	0	0	117.5
29	V	31.8	Very low	40.1	Very low	127 Å²	127	144.5 Å²	144.5	77%	0.77	71%	0.714	S	S	*	*				-133.6	110.1	121.6	-177.9	0	0	0	0	106.9	D31	V29-D31 PolarHBondContact O-N 2.94Å; V29-D31 VanDerWaalsContact O-N 3.15Å
30	H	41.6	Very low	41.4	Very low	178 Å²	178	141 Å²	141	82%	0.824	71%	0.705	S	S	*	*			trans	-68.2	99.3	165.6	-89.5	-55.8	0	0	0	108.3
31	D	40.1	Very low	43.7	Very low	126 Å²	126	140.3 Å²	140.3	67%	0.674	69%	0.693	S	S	*	*			trans	-86.5	112.6	151.2	-92.2	-25.6	0	0	0	106.8	V29 D33	V29-D31 PolarHBondContact O-N 2.94Å; V29-D31 VanDerWaalsContact O-N 3.15Å; D31-D33 VanDerWaalsContact C-N 3.26Å; D31-D33 PolarHBondContact O-N 3.04Å
32	S	44.5	Very low	46.6	Very low	117 Å²	117	130.9 Å²	130.9	82%	0.818	66%	0.664	S	S	*	*			trans	-76.8	76.4	175.9	55.4	0	0	0	0	109.6
33	D	49.4	Very low	49.6	Very low	118 Å²	118	126.8 Å²	126.8	63%	0.631	64%	0.635	S	S	*	*			trans	-101.2	138.7	164.1	-77.3	-26.3	0	0	0	109.5	D31 W35	D31-D33 VanDerWaalsContact C-N 3.26Å; D31-D33 PolarHBondContact O-N 3.04Å; D33-W35 PolarHBondContact O-N 2.93Å; D33-W35 PolarHBondContact O-NE1 2.8Å
34	D	43.6	Very low	52.4	Low	155 Å²	155	127.4 Å²	127.4	83%	0.829	64%	0.638	S	S	*	*			trans	-60.2	94.5	-174	-168.5	23.2	0	0	0	111.5
35	W	42.1	Very low	55.5	Low	148 Å²	148	120.8 Å²	120.8	56%	0.561	62%	0.617	S	S	*	*			trans	-81	117.7	-179.8	-62.9	103.7	0	0	0	110.8	D33 D39 R72	D33-W35 PolarHBondContact O-N 2.93Å; D33-W35 PolarHBondContact O-NE1 2.8Å; W35-D39 HydrophobicContact CE3-CB 3.8Å; W35-D39 HydrophobicContact CZ3-CB 4.32Å; W35-R72 HydrophobicContact CZ3-CB 4.48Å
36	T	51.1	Low	58.6	Low	72 Å²	72	114.4 Å²	114.4	44%	0.442	59%	0.589	S	S	.	*			trans	-89.1	158.3	173	64.7	0	0	0	0	110.7	H38 D39	T36-H38 PolarHBondContact O-N 3.08Å; T36-D39 PolarHBondContact N-OD2 3.33Å; T36-D39 WeakPolarHBondContact O-CB 3.42Å; T36-D39 PolarHBondContact O-N 2.03Å; T36-D39 PolarHBondContact OG1-OD2 2.78Å; T36-D39 VanDerWaalsContact OG1-OD2 3.11Å
37	I	51.3	Low	61.7	Low	155 Å²	155	113.1 Å²	113.1	80%	0.795	57%	0.573	S	S	*	*	G	3₁₀ helix	trans	-56.9	-26	179.7	-65.9	171	0	0	0	112.2	D39	I37-D39 VanDerWaalsContact C-N 3.3Å; I37-D39 PolarHBondContact O-N 2.91Å
38	H	52	Low	64.6	Low	127 Å²	127	105.4 Å²	105.4	59%	0.588	55%	0.545	S	S	*	.	G	3₁₀ helix	trans	-70.5	-19.7	176.6	-68	-64.4	0	0	0	114.1	T36 F40 E41	T36-H38 PolarHBondContact O-N 3.08Å; H38-F40 PolarHBondContact O-N 3.45Å; H38-E41 IonicContact ND1-OE1 3.7Å; H38-E41 IonicContact ND1-OE2 3.72Å; H38-E41 PolarHBondContact ND1-OE2 3.23Å; H38-E41 PolarHBondContact O-N 3.44Å
39	D	55.9	Low	67.2	Low	30 Å²	30	98 Å²	98	16%	0.16	51%	0.512	C	S	.	.	G	3₁₀ helix	trans	-70.9	-14.6	-179.7	-69.6	-56.1	0	0	0	113.3	W35 T36 I37 S71 R72	W35-D39 HydrophobicContact CE3-CB 3.8Å; W35-D39 HydrophobicContact CZ3-CB 4.32Å; T36-D39 PolarHBondContact N-OD2 3.33Å; T36-D39 WeakPolarHBondContact O-CB 3.42Å; T36-D39 PolarHBondContact O-N 2.03Å; T36-D39 PolarHBondContact OG1-OD2 2.78Å; T36-D39 VanDerWaalsContact OG1-OD2 3.11Å; I37-D39 VanDerWaalsContact C-N 3.3Å; I37-D39 PolarHBondContact O-N 2.91Å; D39-S71 PolarHBondContact OD1-OG 3.06Å; D39-R72 WeakPolarHBondContact O-CD 3.29Å; D39-R72 PolarHBondContact O-NH1 3.31Å
40	F	64.4	Low	70.1	Confident	142 Å²	142	97.8 Å²	97.8	62%	0.623	51%	0.513	S	S	*	.	G	3₁₀ helix	trans	-100.5	-4.7	176.9	-73.4	-84.3	0	0	0	113.9	H38 C42	H38-F40 PolarHBondContact O-N 3.45Å; F40-C42 PolarHBondContact O-N 3.26Å
41	E	82	Confident	72.6	Confident	115 Å²	115	94.8 Å²	94.8	54%	0.537	51%	0.512	S	S	.	.			trans	-64.3	136.3	177.1	-72.7	-178.9	153.2	0	0	109.7	H38 P70 R72	H38-E41 IonicContact ND1-OE1 3.7Å; H38-E41 IonicContact ND1-OE2 3.72Å; H38-E41 PolarHBondContact ND1-OE2 3.23Å; H38-E41 PolarHBondContact O-N 3.44Å; E41-P70 WeakPolarHBondContact O-CG 3.43Å; E41-R72 PolarHBondContact O-NH1 3.37Å; E41-R72 VanDerWaalsContact O-NH1 3.11Å
42	C	92.8	Very high	75.2	Confident	46 Å²	46	92.7 Å²	92.7	31%	0.311	50%	0.497	S	S	.	.			trans	-109.4	130.3	175.1	-168.9	0	0	0	0	107.5	F40 V44 C48	F40-C42 PolarHBondContact O-N 3.26Å; C42-V44 PolarHBondContact O-N 3.49Å; C42-C48 HydrophobicContact CB-CB 3.82Å; C42-C48 WeakPolarHBondContact CB-SG 3.38Å; C42-C48 WeakPolarHBondContact SG-CB 3.03Å; C42-C48 PolarHBondContact SG-N 2.89Å; C42-C48 CovalentContact SG-SG 2.04Å; C42-C48 PolarHBondContact SG-SG 3.21Å
43	P	94.9	Very high	77.6	Confident	19 Å²	19	90.1 Å²	90.1	12%	0.123	48%	0.478	C	S	.	.			trans	-53.9	133.7	173.9	-25.3	34.3	0	0	0	110.9	E45 C46 L56 P67 A68	P43-E45 HydrophobicContact CB-CG 4.32Å; P43-E45 WeakPolarHBondContact CB-OE2 3.41Å; P43-E45 PolarHBondContact O-N 3.44Å; P43-C46 HydrophobicContact CB-CB 4.16Å; P43-C46 CarbonylContact O-C 3.5Å; P43-C46 PolarHBondContact O-N 2.96Å; P43-L56 HydrophobicContact CG-CD1 4.34Å; P43-L56 HydrophobicContact CG-CD2 4.29Å; P43-P67 HydrophobicContact CB-CB 4.03Å; P43-P67 HydrophobicContact CG-CB 4.29Å; P43-A68 WeakPolarHBondContact CG-O 3.02Å
44	V	94.3	Very high	79.8	Confident	146 Å²	146	86.2 Å²	86.2	89%	0.885	46%	0.458	S	S	*	.	T	Hydrogen-bonded Turn	trans	-64.9	-26.1	-172.1	-65.6	0	0	0	0	112.9	C42 C46	C42-V44 PolarHBondContact O-N 3.49Å; V44-C46 VanDerWaalsContact C-N 3.28Å
45	E	95.4	Very high	82.4	Confident	81 Å²	81	78.8 Å²	78.8	38%	0.379	42%	0.419	S	S	.	.	T	Hydrogen-bonded Turn	trans	-77.6	-13.8	174.8	60.4	-92.9	-125.8	0	0	112.9	P43 R61 L63 P67	P43-E45 HydrophobicContact CB-CG 4.32Å; P43-E45 WeakPolarHBondContact CB-OE2 3.41Å; P43-E45 PolarHBondContact O-N 3.44Å; E45-R61 WeakPolarHBondContact O-CD 3.32Å; E45-R61 PolarHBondContact O-NE 2.87Å; E45-L63 HydrophobicContact CB-CD2 4Å; E45-L63 HydrophobicContact CG-CD2 4.12Å; E45-P67 HydrophobicContact CG-CB 4.13Å; E45-P67 VanDerWaalsContact OE1-CB 3.29Å; E45-P67 WeakPolarHBondContact OE1-CB 3.06Å
46	C	97.6	Very high	85.1	Confident	16 Å²	16	71.8 Å²	71.8	11%	0.108	39%	0.392	C	S	.	.	S	Bend	trans	-117	177.2	-174.3	-60.5	0	0	0	0	112.5	P43 V44 L56 Y57 C58	P43-C46 HydrophobicContact CB-CB 4.16Å; P43-C46 CarbonylContact O-C 3.5Å; P43-C46 PolarHBondContact O-N 2.96Å; V44-C46 VanDerWaalsContact C-N 3.28Å; C46-L56 HydrophobicContact CB-CD1 3.5Å; C46-L56 VanDerWaalsContact CB-CD1 3.5Å; C46-L56 HydrophobicContact CB-CG 4.29Å; C46-Y57 CarbonylContact C-O 3.56Å; C46-Y57 WeakPolarHBondContact CA-O 3.27Å; C46-Y57 WeakPolarHBondContact CB-O 3.04Å; C46-C58 HydrophobicContact CB-CB 4.15Å; C46-C58 WeakPolarHBondContact CB-SG 3.27Å; C46-C58 WeakPolarHBondContact SG-CB 3.12Å; C46-C58 CovalentContact SG-SG 2.03Å; C46-C58 PolarHBondContact SG-SG 3.4Å
47	F	97.1	Very high	87.3	Confident	105 Å²	105	71.2 Å²	71.2	46%	0.461	38%	0.382	S	S	.	.	B	Isolated β-bridge	trans	-126.6	131.8	177.6	174.5	-109.9	0	0	0	111	P49 Y57	F47-P49 HydrophobicContact CE1-CB 3.71Å; F47-P49 HydrophobicContact CE1-CG 4.18Å; F47-P49 HydrophobicContact CZ-CB 3.95Å; F47-Y57 HydrophobicContact CD1-CD2 4.25Å; F47-Y57 PolarHBondContact N-O 2.98Å; F47-Y57 PolarHBondContact O-N 3.32Å
48	C	96	Very high	89.6	Confident	22 Å²	22	63.8 Å²	63.8	15%	0.149	34%	0.344	C	S	.	.			trans	-119.2	104.6	176.2	-55.2	0	0	0	0	108.7	C42 L56 R72	C42-C48 HydrophobicContact CB-CB 3.82Å; C42-C48 WeakPolarHBondContact CB-SG 3.38Å; C42-C48 WeakPolarHBondContact SG-CB 3.03Å; C42-C48 PolarHBondContact SG-N 2.89Å; C42-C48 CovalentContact SG-SG 2.04Å; C42-C48 PolarHBondContact SG-SG 3.21Å; C48-L56 WeakPolarHBondContact SG-CD1 3.28Å; C48-R72 PolarHBondContact SG-NH2 3.39Å; C48-R72 VanDerWaalsContact SG-NH2 3.37Å
49	P	94.2	Very high	91.8	Very high	13 Å²	13	59.5 Å²	59.5	8%	0.084	32%	0.324	C	S	.	.			trans	-69.6	130.3	-178.1	24	-30.9	0	0	0	111.6	F47 S51 F52 Y57	F47-P49 HydrophobicContact CE1-CB 3.71Å; F47-P49 HydrophobicContact CE1-CG 4.18Å; F47-P49 HydrophobicContact CZ-CB 3.95Å; P49-S51 PolarHBondContact O-N 3.37Å; P49-F52 HydrophobicContact CG-CB 4.01Å; P49-F52 CarbonylContact O-C 3.34Å; P49-F52 PolarHBondContact O-N 2.97Å; P49-Y57 HydrophobicContact CG-CD2 4.08Å; P49-Y57 HydrophobicContact CG-CE2 3.64Å
50	P	91.4	Very high	93.8	Very high	122 Å²	122	63.2 Å²	63.2	79%	0.792	34%	0.344	S	S	*	.	T	Hydrogen-bonded Turn	trans	-59.5	-31.6	177.1	-25.9	34.7	0	0	0	113.7	F52	P50-F52 VanDerWaalsContact C-N 3.26Å; P50-F52 PolarHBondContact O-N 2.91Å
51	S	94.9	Very high	95.4	Very high	115 Å²	115	61.4 Å²	61.4	80%	0.804	33%	0.333	S	S	*	.	T	Hydrogen-bonded Turn	trans	-74.5	-15.3	177.3	58.7	0	0	0	0	113.7	P49	P49-S51 PolarHBondContact O-N 3.37Å
52	F	95.3	Very high	96.2	Very high	82 Å²	82	57.8 Å²	57.8	36%	0.36	33%	0.327	S	S	.	.	S	Bend	trans	-144.4	68.2	-179.3	-163.5	-129	0	0	0	110.5	P49 P50 T54 A55 Y75	P49-F52 HydrophobicContact CG-CB 4.01Å; P49-F52 CarbonylContact O-C 3.34Å; P49-F52 PolarHBondContact O-N 2.97Å; P50-F52 VanDerWaalsContact C-N 3.26Å; P50-F52 PolarHBondContact O-N 2.91Å; F52-T54 PolarHBondContact O-N 2.71Å; F52-A55 HydrophobicContact CD1-CB 3.3Å; F52-A55 HydrophobicContact CE1-CB 3.58Å; F52-A55 HydrophobicContact CG-CB 4.32Å; F52-A55 PolarHBondContact O-N 3.11Å; F52-A55 VanDerWaalsContact O-N 3.09Å; F52-Y75 AromaticContact CE1-CD2 3.77Å; F52-Y75 HydrophobicContact CE1-CD2 3.77Å; F52-Y75 HydrophobicContact CE1-CE2 4.15Å; F52-Y75 HydrophobicContact CE1-CG 4.36Å; F52-Y75 HydrophobicContact CE2-CE2 4.39Å; F52-Y75 AromaticContact CZ-CD2 3.62Å; F52-Y75 HydrophobicContact CZ-CD2 3.62Å; F52-Y75 AromaticContact CZ-CE2 3.51Å; F52-Y75 HydrophobicContact CZ-CE2 3.51Å; F52-Y75 HydrophobicContact CZ-CG 4.49Å
53	P	93.8	Very high	96.5	Very high	64 Å²	64	56.8 Å²	56.8	42%	0.416	32%	0.318	S	S	.	.	T	Hydrogen-bonded Turn	trans	-68.6	-11.4	-165.6	27.9	-36.4	0	0	0	114.5	A55 R72	P53-A55 VanDerWaalsContact C-N 3.35Å; P53-R72 PolarHBondContact O-NE 2.98Å
54	T	96.5	Very high	96.6	Very high	35 Å²	35	63.2 Å²	63.2	22%	0.215	35%	0.345	C	S	.	.	T	Hydrogen-bonded Turn	trans	-88.3	0.6	177.1	57.4	0	0	0	0	113.2	F52 I73 W74 Y75	F52-T54 PolarHBondContact O-N 2.71Å; T54-I73 WeakPolarHBondContact O-CA 3.07Å; T54-W74 HydrophobicContact CG2-CG 4.33Å; T54-W74 PolarHBondContact O-N 3.23Å; T54-Y75 PolarHBondContact O-N 3.31Å; T54-Y75 VanDerWaalsContact O-N 3.14Å
55	A	98	Very high	96.8	Very high	0 Å²	0	63.2 Å²	63.2	0%	0	34%	0.335	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-107.3	142.1	174.9	0	0	0	0	0	112.6	F52 P53 Y57 Y75 Y77	F52-A55 HydrophobicContact CD1-CB 3.3Å; F52-A55 HydrophobicContact CE1-CB 3.58Å; F52-A55 HydrophobicContact CG-CB 4.32Å; F52-A55 PolarHBondContact O-N 3.11Å; F52-A55 VanDerWaalsContact O-N 3.09Å; P53-A55 VanDerWaalsContact C-N 3.35Å; A55-Y57 HydrophobicContact CB-CD2 4.23Å; A55-Y57 HydrophobicContact CB-CE2 3.49Å; A55-Y57 VanDerWaalsContact CB-CE2 3.49Å; A55-Y75 WeakPolarHBondContact CA-O 3.2Å; A55-Y77 HydrophobicContact CB-CE2 4.36Å
56	L	98.1	Very high	96.9	Very high	0 Å²	0	59.8 Å²	59.8	0%	0	32%	0.319	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-124.1	114.9	175.7	-179.3	60.9	0	0	0	109.6	P43 C46 C48 I69 I73 Y75 L76 Y77	P43-L56 HydrophobicContact CG-CD1 4.34Å; P43-L56 HydrophobicContact CG-CD2 4.29Å; C46-L56 HydrophobicContact CB-CD1 3.5Å; C46-L56 VanDerWaalsContact CB-CD1 3.5Å; C46-L56 HydrophobicContact CB-CG 4.29Å; C48-L56 WeakPolarHBondContact SG-CD1 3.28Å; L56-I69 HydrophobicContact CD2-CG2 4.47Å; L56-I73 HydrophobicContact CB-CD1 3.9Å; L56-I73 HydrophobicContact CB-CG1 4.03Å; L56-I73 HydrophobicContact CB-CG2 3.83Å; L56-Y75 PolarHBondContact N-O 2.97Å; L56-L76 HydrophobicContact CB-CD1 4.08Å; L56-L76 HydrophobicContact CD2-CD1 3.77Å; L56-L76 HydrophobicContact CG-CD1 4.02Å; L56-Y77 PolarHBondContact O-N 3.06Å
57	Y	98.6	Very high	96.8	Very high	60 Å²	60	59.4 Å²	59.4	24%	0.235	32%	0.316	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-102.8	108.2	-177.3	-66	-91.8	0	0	0	110.8	C46 F47 P49 A55 E59 R61 Y77	C46-Y57 CarbonylContact C-O 3.56Å; C46-Y57 WeakPolarHBondContact CA-O 3.27Å; C46-Y57 WeakPolarHBondContact CB-O 3.04Å; F47-Y57 HydrophobicContact CD1-CD2 4.25Å; F47-Y57 PolarHBondContact N-O 2.98Å; F47-Y57 PolarHBondContact O-N 3.32Å; P49-Y57 HydrophobicContact CG-CD2 4.08Å; P49-Y57 HydrophobicContact CG-CE2 3.64Å; A55-Y57 HydrophobicContact CB-CD2 4.23Å; A55-Y57 HydrophobicContact CB-CE2 3.49Å; A55-Y57 VanDerWaalsContact CB-CE2 3.49Å; Y57-E59 VanDerWaalsContact CA-OE2 3.32Å; Y57-E59 WeakPolarHBondContact CA-OE2 3.35Å; Y57-E59 WeakPolarHBondContact CB-OE2 3.32Å; Y57-R61 PolarHBondContact O-NH2 2.64Å; Y57-Y77 AromaticContact CD1-CD2 3.64Å; Y57-Y77 HydrophobicContact CD1-CD2 3.64Å; Y57-Y77 HydrophobicContact CD1-CE2 4.22Å; Y57-Y77 HydrophobicContact CD1-CG 4.04Å; Y57-Y77 AromaticContact CE1-CD2 3.54Å; Y57-Y77 HydrophobicContact CE1-CD2 3.54Å; Y57-Y77 AromaticContact CE1-CE2 3.62Å; Y57-Y77 HydrophobicContact CE1-CE2 3.62Å; Y57-Y77 HydrophobicContact CE1-CG 4.13Å; Y57-Y77 HydrophobicContact CE2-CD2 4.49Å; Y57-Y77 HydrophobicContact CE2-CE2 4.44Å; Y57-Y77 HydrophobicContact CG-CD2 4.19Å; Y57-Y77 AromaticContact CZ-CE2 3.76Å
58	C	98.5	Very high	96.7	Very high	0 Å²	0	58 Å²	58	0%	0	32%	0.324	C	S	.	.			trans	-126.3	13.5	-177.5	-56.8	0	0	0	0	111.8	C46 L63 Y77 L78 N81	C46-C58 HydrophobicContact CB-CB 4.15Å; C46-C58 WeakPolarHBondContact CB-SG 3.27Å; C46-C58 WeakPolarHBondContact SG-CB 3.12Å; C46-C58 CovalentContact SG-SG 2.03Å; C46-C58 PolarHBondContact SG-SG 3.4Å; C58-L63 HydrophobicContact CB-CD1 3.74Å; C58-L63 WeakPolarHBondContact O-CD1 3.31Å; C58-Y77 CarbonylContact C-O 3.26Å; C58-Y77 VanDerWaalsContact CA-O 3.27Å; C58-Y77 WeakPolarHBondContact CA-O 3.14Å; C58-Y77 VanDerWaalsContact CB-O 3.28Å; C58-Y77 WeakPolarHBondContact CB-O 3.11Å; C58-Y77 PolarHBondContact N-O 3.13Å; C58-L78 HydrophobicContact CB-CD2 3.43Å; C58-L78 VanDerWaalsContact CB-CD2 3.43Å; C58-L78 HydrophobicContact CB-CG 4.21Å; C58-N81 PolarHBondContact O-ND2 2.79Å
59	E	98.5	Very high	96.7	Very high	37 Å²	37	57.3 Å²	57.3	17%	0.173	32%	0.319	C	S	.	.	T	Hydrogen-bonded Turn	trans	-72.4	156.1	-176.9	70.5	-75.6	173.5	0	0	113.9	Y57 R61 Y77 Q79	Y57-E59 VanDerWaalsContact CA-OE2 3.32Å; Y57-E59 WeakPolarHBondContact CA-OE2 3.35Å; Y57-E59 WeakPolarHBondContact CB-OE2 3.32Å; E59-R61 VanDerWaalsContact C-N 3.31Å; E59-R61 WeakPolarHBondContact O-CG 3.48Å; E59-R61 PolarHBondContact O-N 3.28Å; E59-R61 PolarHBondContact O-NH1 2.82Å; E59-R61 IonicContact OE1-NH1 3.95Å; E59-R61 IonicContact OE2-NH1 3.75Å; E59-Y77 PolarHBondContact N-O 2.73Å; E59-Q79 WeakPolarHBondContact CA-O 3.37Å; E59-Q79 HydrophobicContact CB-CG 3.9Å; E59-Q79 VanDerWaalsContact CB-O 3.27Å; E59-Q79 WeakPolarHBondContact CB-O 3.49Å
60	N	98.4	Very high	96.7	Very high	108 Å²	108	57.5 Å²	57.5	58%	0.578	32%	0.32	S	S	*	.	T	Hydrogen-bonded Turn	trans	55.9	34.8	172.3	-52.3	-67.2	0	0	0	115.5	Q79 N80	N60-Q79 PolarHBondContact N-O 3.27Å; N60-Q79 VanDerWaalsContact N-O 3.08Å; N60-N80 WeakPolarHBondContact CA-O 3.33Å; N60-N80 PolarHBondContact N-O 2.99Å; N60-N80 WeakPolarHBondContact OD1-CB 3.48Å; N60-N80 PolarHBondContact OD1-ND2 2.8Å
61	R	98.1	Very high	96.8	Very high	103 Å²	103	52.9 Å²	52.9	39%	0.389	29%	0.291	S	S	.	.	S	Bend	trans	-116.1	0.5	-174.1	-78.8	154.4	169.8	91.4	-6.5	114	E45 Y57 E59 L63 N81	E45-R61 WeakPolarHBondContact O-CD 3.32Å; E45-R61 PolarHBondContact O-NE 2.87Å; Y57-R61 PolarHBondContact O-NH2 2.64Å; E59-R61 VanDerWaalsContact C-N 3.31Å; E59-R61 WeakPolarHBondContact O-CG 3.48Å; E59-R61 PolarHBondContact O-N 3.28Å; E59-R61 PolarHBondContact O-NH1 2.82Å; E59-R61 IonicContact OE1-NH1 3.95Å; E59-R61 IonicContact OE2-NH1 3.75Å; R61-L63 HydrophobicContact CB-CD2 4.07Å; R61-L63 HydrophobicContact CB-CG 3.89Å; R61-L63 PolarHBondContact O-N 3.11Å; R61-N81 PolarHBondContact N-OD1 3.01Å
62	G	98.3	Very high	96.8	Very high	40 Å²	40	48.6 Å²	48.6	41%	0.412	26%	0.257	S	S	.	.			trans	67	25.2	-176.4	0	0	0	0	0	113	N81	G62-N81 PolarHBondContact N-OD1 3.34Å
63	L	98.4	Very high	96.9	Very high	24 Å²	24	44.7 Å²	44.7	13%	0.126	24%	0.24	C	C	.	.			trans	-61.7	137.2	179.2	-58.5	-178.9	0	0	0	110.2	E45 C58 R61 L78 N81 L82 I83	E45-L63 HydrophobicContact CB-CD2 4Å; E45-L63 HydrophobicContact CG-CD2 4.12Å; C58-L63 HydrophobicContact CB-CD1 3.74Å; C58-L63 WeakPolarHBondContact O-CD1 3.31Å; R61-L63 HydrophobicContact CB-CD2 4.07Å; R61-L63 HydrophobicContact CB-CG 3.89Å; R61-L63 PolarHBondContact O-N 3.11Å; L63-L78 HydrophobicContact CD1-CD2 4.06Å; L63-N81 HydrophobicContact CB-CB 4.14Å; L63-N81 PolarHBondContact N-OD1 2.95Å; L63-L82 CarbonylContact O-C 3.58Å; L63-L82 VanDerWaalsContact O-CA 3.27Å; L63-L82 WeakPolarHBondContact O-CA 3.36Å; L63-L82 PolarHBondContact O-N 3.07Å; L63-I83 HydrophobicContact CB-CG1 4.38Å; L63-I83 PolarHBondContact O-N 3.38Å
64	K	98	Very high	97.1	Very high	155 Å²	155	45.7 Å²	45.7	67%	0.674	24%	0.235	S	C	*	.	S	Bend	trans	-100	-19.4	175.2	-64.5	-176.3	179.7	-178.6	0	112.9	L82 I83	K64-L82 HydrophobicContact CG-CB 4.32Å; K64-I83 WeakPolarHBondContact O-CA 3.37Å
65	E	97.4	Very high	97.2	Very high	145 Å²	145	47.1 Å²	47.1	68%	0.678	24%	0.237	S	C	*	.	S	Bend	trans	-134.3	154.6	-175.8	-64.7	-179.4	-172.1	0	0	109.4
66	I	98.1	Very high	97.3	Very high	9 Å²	9	47.1 Å²	47.1	5%	0.046	24%	0.237	C	C	.	.	P	Polyproline II helix	trans	-77.8	122.2	174.3	-59.6	-177.2	0	0	0	107.8	I69 L78 I83 I86 P90 F91 L102	I66-I69 HydrophobicContact CG2-CD1 4.1Å; I66-I69 HydrophobicContact CG2-CG1 4.46Å; I66-L78 HydrophobicContact CD1-CD1 4.49Å; I66-L78 HydrophobicContact CG1-CD1 4.27Å; I66-L78 HydrophobicContact CG2-CD1 3.98Å; I66-I83 HydrophobicContact CD1-CG2 4.41Å; I66-I83 HydrophobicContact CG1-CD1 4.22Å; I66-I83 HydrophobicContact CG1-CG2 3.88Å; I66-I86 HydrophobicContact CD1-CB 4.39Å; I66-I86 HydrophobicContact CD1-CG1 4.3Å; I66-I86 HydrophobicContact CD1-CG2 4.2Å; I66-P90 HydrophobicContact CB-CB 4.46Å; I66-P90 HydrophobicContact CB-CG 4.32Å; I66-P90 HydrophobicContact CG2-CB 3.9Å; I66-P90 HydrophobicContact CG2-CG 4.29Å; I66-F91 HydrophobicContact CD1-CE2 3.95Å; I66-F91 HydrophobicContact CD1-CZ 3.73Å; I66-F91 HydrophobicContact CG2-CE2 4.49Å; I66-F91 HydrophobicContact CG2-CZ 4.13Å; I66-L102 HydrophobicContact CD1-CD2 4.21Å
67	P	95.9	Very high	97.3	Very high	8 Å²	8	49.3 Å²	49.3	5%	0.052	25%	0.246	C	C	.	.	P	Polyproline II helix	trans	-69.1	164.7	179.6	32.3	-37.5	0	0	0	110.9	P43 E45 I69	P43-P67 HydrophobicContact CB-CB 4.03Å; P43-P67 HydrophobicContact CG-CB 4.29Å; E45-P67 HydrophobicContact CG-CB 4.13Å; E45-P67 VanDerWaalsContact OE1-CB 3.29Å; E45-P67 WeakPolarHBondContact OE1-CB 3.06Å; P67-I69 WeakPolarHBondContact O-CG1 3.41Å; P67-I69 PolarHBondContact O-N 3.03Å
68	A	94.6	Very high	97.3	Very high	75 Å²	75	46.5 Å²	46.5	62%	0.62	24%	0.235	S	C	*	.	P	Polyproline II helix	trans	-57.5	130.1	172.1	0	0	0	0	0	110.5	P43 P70	P43-A68 WeakPolarHBondContact CG-O 3.02Å; A68-P70 WeakPolarHBondContact O-CD 3.45Å
69	I	95.9	Very high	97.3	Very high	9 Å²	9	48.1 Å²	48.1	5%	0.046	24%	0.242	C	C	.	.	P	Polyproline II helix	trans	-101	118	-175.7	-55.5	160.8	0	0	0	108.6	L56 I66 P67 I73 L76 P90 F91 A94 L97	L56-I69 HydrophobicContact CD2-CG2 4.47Å; I66-I69 HydrophobicContact CG2-CD1 4.1Å; I66-I69 HydrophobicContact CG2-CG1 4.46Å; P67-I69 WeakPolarHBondContact O-CG1 3.41Å; P67-I69 PolarHBondContact O-N 3.03Å; I69-I73 HydrophobicContact CG2-CB 3.92Å; I69-I73 HydrophobicContact CG2-CG1 4.26Å; I69-I73 HydrophobicContact CG2-CG2 4.18Å; I69-L76 HydrophobicContact CD1-CD2 3.54Å; I69-L76 HydrophobicContact CG1-CD2 4.16Å; I69-P90 WeakPolarHBondContact CB-O 3.41Å; I69-P90 HydrophobicContact CD1-CB 4.26Å; I69-P90 HydrophobicContact CG1-CB 4.44Å; I69-P90 PolarHBondContact N-O 3.33Å; I69-F91 HydrophobicContact CD1-CD1 3.31Å; I69-F91 HydrophobicContact CD1-CE1 3.27Å; I69-F91 HydrophobicContact CD1-CG 4.11Å; I69-F91 HydrophobicContact CD1-CZ 4.04Å; I69-A94 HydrophobicContact CB-CB 3.88Å; I69-A94 HydrophobicContact CG2-CB 3.65Å; I69-L97 HydrophobicContact CD1-CD1 4.26Å; I69-L97 HydrophobicContact CG2-CD1 4.41Å
70	P	94.7	Very high	97.3	Very high	17 Å²	17	49.2 Å²	49.2	11%	0.11	25%	0.25	C	C	.	.	P	Polyproline II helix	trans	-61.4	145.5	176.2	-22.2	32.5	0	0	0	112.5	E41 A68 R72 I73	E41-P70 WeakPolarHBondContact O-CG 3.43Å; A68-P70 WeakPolarHBondContact O-CD 3.45Å; P70-R72 HydrophobicContact CB-CG 4.37Å; P70-R72 PolarHBondContact O-N 2.98Å; P70-R72 VanDerWaalsContact O-N 3.14Å; P70-I73 HydrophobicContact CB-CG1 4.06Å; P70-I73 HydrophobicContact CG-CG1 4.24Å; P70-I73 WeakPolarHBondContact O-CB 3.27Å; P70-I73 WeakPolarHBondContact O-CG1 3.27Å; P70-I73 PolarHBondContact O-N 3.37Å
71	S	93.9	Very high	97.4	Very high	25 Å²	25	44.5 Å²	44.5	18%	0.175	22%	0.224	C	C	.	.	T	Hydrogen-bonded Turn	trans	-56	-33.2	-175.1	61	0	0	0	0	114	D39 I73 N93	D39-S71 PolarHBondContact OD1-OG 3.06Å; S71-I73 VanDerWaalsContact C-N 3.26Å; S71-I73 PolarHBondContact O-N 2.95Å; S71-N93 WeakPolarHBondContact CA-O 2.9Å
72	R	94.4	Very high	97.4	Very high	25 Å²	25	43 Å²	43	9%	0.094	22%	0.223	C	C	.	.	T	Hydrogen-bonded Turn	trans	-71.3	-11.4	179.8	72.6	178.6	-168	-74.8	-3.7	114.8	W35 D39 E41 C48 P53 P70	W35-R72 HydrophobicContact CZ3-CB 4.48Å; D39-R72 WeakPolarHBondContact O-CD 3.29Å; D39-R72 PolarHBondContact O-NH1 3.31Å; E41-R72 PolarHBondContact O-NH1 3.37Å; E41-R72 VanDerWaalsContact O-NH1 3.11Å; C48-R72 PolarHBondContact SG-NH2 3.39Å; C48-R72 VanDerWaalsContact SG-NH2 3.37Å; P53-R72 PolarHBondContact O-NE 2.98Å; P70-R72 HydrophobicContact CB-CG 4.37Å; P70-R72 PolarHBondContact O-N 2.98Å; P70-R72 VanDerWaalsContact O-N 3.14Å
73	I	97.3	Very high	97.4	Very high	0 Å²	0	41 Å²	41	0%	0	20%	0.204	C	C	.	.			trans	-78.2	129.5	-171.3	-60	-56.2	0	0	0	111.4	T54 L56 I69 P70 S71 Y75 Q96 L97	T54-I73 WeakPolarHBondContact O-CA 3.07Å; L56-I73 HydrophobicContact CB-CD1 3.9Å; L56-I73 HydrophobicContact CB-CG1 4.03Å; L56-I73 HydrophobicContact CB-CG2 3.83Å; I69-I73 HydrophobicContact CG2-CB 3.92Å; I69-I73 HydrophobicContact CG2-CG1 4.26Å; I69-I73 HydrophobicContact CG2-CG2 4.18Å; P70-I73 HydrophobicContact CB-CG1 4.06Å; P70-I73 HydrophobicContact CG-CG1 4.24Å; P70-I73 WeakPolarHBondContact O-CB 3.27Å; P70-I73 WeakPolarHBondContact O-CG1 3.27Å; P70-I73 PolarHBondContact O-N 3.37Å; S71-I73 VanDerWaalsContact C-N 3.26Å; S71-I73 PolarHBondContact O-N 2.95Å; I73-Y75 WeakPolarHBondContact CG2-O 3.32Å; I73-Q96 CarbonylContact O-C 3.15Å; I73-L97 HydrophobicContact CG2-CD2 3.91Å; I73-L97 PolarHBondContact O-N 2.86Å
74	W	98.3	Very high	97.4	Very high	84 Å²	84	45.3 Å²	45.3	32%	0.318	22%	0.223	S	C	.	.			trans	-109.8	-31.2	176.9	-65.2	23.2	0	0	0	111.2	T54 Q96 R98 W99	T54-W74 HydrophobicContact CG2-CG 4.33Å; T54-W74 PolarHBondContact O-N 3.23Å; W74-Q96 VanDerWaalsContact CD1-CB 3.46Å; W74-Q96 HydrophobicContact CG-CB 4.37Å; W74-R98 PolarHBondContact O-N 3.13Å; W74-W99 PolarHBondContact O-N 3.47Å; W74-W99 VanDerWaalsContact O-N 3.07Å
75	Y	98.8	Very high	97.4	Very high	65 Å²	65	40.7 Å²	40.7	26%	0.255	21%	0.208	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-122.9	114.8	-175.6	-51.5	-86.7	0	0	0	110.4	F52 T54 A55 L56 I73 W99	F52-Y75 AromaticContact CE1-CD2 3.77Å; F52-Y75 HydrophobicContact CE1-CD2 3.77Å; F52-Y75 HydrophobicContact CE1-CE2 4.15Å; F52-Y75 HydrophobicContact CE1-CG 4.36Å; F52-Y75 HydrophobicContact CE2-CE2 4.39Å; F52-Y75 AromaticContact CZ-CD2 3.62Å; F52-Y75 HydrophobicContact CZ-CD2 3.62Å; F52-Y75 AromaticContact CZ-CE2 3.51Å; F52-Y75 HydrophobicContact CZ-CE2 3.51Å; F52-Y75 HydrophobicContact CZ-CG 4.49Å; T54-Y75 PolarHBondContact O-N 3.31Å; T54-Y75 VanDerWaalsContact O-N 3.14Å; A55-Y75 WeakPolarHBondContact CA-O 3.2Å; L56-Y75 PolarHBondContact N-O 2.97Å; I73-Y75 WeakPolarHBondContact CG2-O 3.32Å; Y75-W99 HydrophobicContact CD1-CB 3.64Å; Y75-W99 HydrophobicContact CD1-CG 4.16Å; Y75-W99 HydrophobicContact CE1-CB 4.32Å; Y75-W99 HydrophobicContact CG-CB 4.49Å
76	L	98.7	Very high	97.4	Very high	0 Å²	0	33.8 Å²	33.8	0%	0	18%	0.175	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-115.4	121.6	-177.3	179.5	60.5	0	0	0	110.7	L56 I69 L78 F91 L97 W99 I100 N101	L56-L76 HydrophobicContact CB-CD1 4.08Å; L56-L76 HydrophobicContact CD2-CD1 3.77Å; L56-L76 HydrophobicContact CG-CD1 4.02Å; I69-L76 HydrophobicContact CD1-CD2 3.54Å; I69-L76 HydrophobicContact CG1-CD2 4.16Å; L76-L78 HydrophobicContact CD1-CD1 3.93Å; L76-L78 HydrophobicContact CD1-CG 4.02Å; L76-L78 HydrophobicContact CD2-CD1 3.59Å; L76-L78 HydrophobicContact CD2-CG 4.49Å; L76-L78 HydrophobicContact CG-CD1 3.65Å; L76-L78 HydrophobicContact CG-CG 4.03Å; L76-F91 HydrophobicContact CD2-CE1 4.12Å; L76-L97 HydrophobicContact CB-CD2 3.92Å; L76-W99 PolarHBondContact N-O 3.28Å; L76-I100 HydrophobicContact CB-CG1 4.32Å; L76-I100 HydrophobicContact CD2-CG1 4.32Å; L76-I100 HydrophobicContact CD2-CG2 4.35Å; L76-N101 PolarHBondContact O-N 3.22Å
77	Y	98.9	Very high	97.4	Very high	47 Å²	47	35 Å²	35	18%	0.184	18%	0.184	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-112.9	108.2	179.5	-59.3	-84.5	0	0	0	110	A55 L56 Y57 C58 E59 W99 N101	A55-Y77 HydrophobicContact CB-CE2 4.36Å; L56-Y77 PolarHBondContact O-N 3.06Å; Y57-Y77 AromaticContact CD1-CD2 3.64Å; Y57-Y77 HydrophobicContact CD1-CD2 3.64Å; Y57-Y77 HydrophobicContact CD1-CE2 4.22Å; Y57-Y77 HydrophobicContact CD1-CG 4.04Å; Y57-Y77 AromaticContact CE1-CD2 3.54Å; Y57-Y77 HydrophobicContact CE1-CD2 3.54Å; Y57-Y77 AromaticContact CE1-CE2 3.62Å; Y57-Y77 HydrophobicContact CE1-CE2 3.62Å; Y57-Y77 HydrophobicContact CE1-CG 4.13Å; Y57-Y77 HydrophobicContact CE2-CD2 4.49Å; Y57-Y77 HydrophobicContact CE2-CE2 4.44Å; Y57-Y77 HydrophobicContact CG-CD2 4.19Å; Y57-Y77 AromaticContact CZ-CE2 3.76Å; C58-Y77 CarbonylContact C-O 3.26Å; C58-Y77 VanDerWaalsContact CA-O 3.27Å; C58-Y77 WeakPolarHBondContact CA-O 3.14Å; C58-Y77 VanDerWaalsContact CB-O 3.28Å; C58-Y77 WeakPolarHBondContact CB-O 3.11Å; C58-Y77 PolarHBondContact N-O 3.13Å; E59-Y77 PolarHBondContact N-O 2.73Å; Y77-W99 AromaticContact CE1-NE1 3.97Å; Y77-N101 HydrophobicContact CD1-CB 4.39Å
78	L	98.8	Very high	97.4	Very high	0 Å²	0	38.4 Å²	38.4	0%	0	20%	0.199	C	C	.	.			trans	-125.3	13.5	-178.2	-75.7	162.3	0	0	0	111.9	C58 L63 I66 L76 N81 I83 N101 L102 N105	C58-L78 HydrophobicContact CB-CD2 3.43Å; C58-L78 VanDerWaalsContact CB-CD2 3.43Å; C58-L78 HydrophobicContact CB-CG 4.21Å; L63-L78 HydrophobicContact CD1-CD2 4.06Å; I66-L78 HydrophobicContact CD1-CD1 4.49Å; I66-L78 HydrophobicContact CG1-CD1 4.27Å; I66-L78 HydrophobicContact CG2-CD1 3.98Å; L76-L78 HydrophobicContact CD1-CD1 3.93Å; L76-L78 HydrophobicContact CD1-CG 4.02Å; L76-L78 HydrophobicContact CD2-CD1 3.59Å; L76-L78 HydrophobicContact CD2-CG 4.49Å; L76-L78 HydrophobicContact CG-CD1 3.65Å; L76-L78 HydrophobicContact CG-CG 4.03Å; L78-N81 PolarHBondContact O-ND2 3.22Å; L78-I83 HydrophobicContact CB-CD1 4.06Å; L78-I83 HydrophobicContact CD2-CD1 3.89Å; L78-I83 HydrophobicContact CG-CD1 4.41Å; L78-N101 CarbonylContact C-O 3.55Å; L78-N101 WeakPolarHBondContact CA-O 3.1Å; L78-N101 WeakPolarHBondContact CB-O 3.2Å; L78-N101 PolarHBondContact N-O 3.41Å; L78-L102 HydrophobicContact CB-CD2 3.71Å; L78-L102 HydrophobicContact CB-CG 4.48Å; L78-L102 HydrophobicContact CD1-CD2 3.78Å; L78-L102 HydrophobicContact CG-CD2 4.4Å; L78-N105 PolarHBondContact O-ND2 3.03Å
79	Q	98.8	Very high	97.4	Very high	34 Å²	34	42.9 Å²	42.9	16%	0.159	21%	0.205	C	C	.	.			trans	-67	156.4	-176.2	67.9	-80.9	2.8	0	0	113.4	E59 N60 N101 N103	E59-Q79 WeakPolarHBondContact CA-O 3.37Å; E59-Q79 HydrophobicContact CB-CG 3.9Å; E59-Q79 VanDerWaalsContact CB-O 3.27Å; E59-Q79 WeakPolarHBondContact CB-O 3.49Å; N60-Q79 PolarHBondContact N-O 3.27Å; N60-Q79 VanDerWaalsContact N-O 3.08Å; Q79-N101 PolarHBondContact N-O 2.78Å; Q79-N101 PolarHBondContact OE1-ND2 3.48Å; Q79-N103 CarbonylContact C-O 3.14Å; Q79-N103 WeakPolarHBondContact CA-O 3.34Å; Q79-N103 HydrophobicContact CB-CB 4.14Å; Q79-N103 VanDerWaalsContact CB-O 3.32Å; Q79-N103 WeakPolarHBondContact CB-O 3.48Å
80	N	98.8	Very high	97.3	Very high	61 Å²	61	43.3 Å²	43.3	33%	0.326	21%	0.208	S	C	.	.	S	Bend	trans	57.1	52.4	179.4	-55.3	-37.9	0	0	0	112.6	N60 N103 K104	N60-N80 WeakPolarHBondContact CA-O 3.33Å; N60-N80 PolarHBondContact N-O 2.99Å; N60-N80 WeakPolarHBondContact OD1-CB 3.48Å; N60-N80 PolarHBondContact OD1-ND2 2.8Å; N80-N103 PolarHBondContact N-O 2.8Å; N80-K104 VanDerWaalsContact CA-O 3.27Å; N80-K104 WeakPolarHBondContact CA-O 3.21Å; N80-K104 PolarHBondContact N-O 3.3Å; N80-K104 VanDerWaalsContact OD1-CB 3.29Å; N80-K104 WeakPolarHBondContact OD1-CB 3.15Å; N80-K104 WeakPolarHBondContact OD1-CD 3.44Å
81	N	98.8	Very high	97.4	Very high	9 Å²	9	42.6 Å²	42.6	5%	0.048	20%	0.203	C	C	.	.	S	Bend	trans	-125.5	-166.9	175.1	-78.6	-55.2	0	0	0	109.9	C58 R61 G62 L63 L78 I83 K104 N105	C58-N81 PolarHBondContact O-ND2 2.79Å; R61-N81 PolarHBondContact N-OD1 3.01Å; G62-N81 PolarHBondContact N-OD1 3.34Å; L63-N81 HydrophobicContact CB-CB 4.14Å; L63-N81 PolarHBondContact N-OD1 2.95Å; L78-N81 PolarHBondContact O-ND2 3.22Å; N81-I83 HydrophobicContact CB-CD1 4.09Å; N81-I83 HydrophobicContact CB-CG1 4.08Å; N81-K104 PolarHBondContact N-O 3.09Å; N81-N105 VanDerWaalsContact CA-OD1 3.31Å; N81-N105 WeakPolarHBondContact CA-OD1 3.49Å; N81-N105 WeakPolarHBondContact CB-OD1 3.35Å; N81-N105 PolarHBondContact N-OD1 3.06Å; N81-N105 PolarHBondContact O-OD1 3.14Å
82	L	98.7	Very high	97.3	Very high	70 Å²	70	47.4 Å²	47.4	37%	0.366	22%	0.223	S	C	.	.			trans	-117.2	29.9	-179.8	-58	174.1	0	0	0	110.9	L63 K64 E84 N105	L63-L82 CarbonylContact O-C 3.58Å; L63-L82 VanDerWaalsContact O-CA 3.27Å; L63-L82 WeakPolarHBondContact O-CA 3.36Å; L63-L82 PolarHBondContact O-N 3.07Å; K64-L82 HydrophobicContact CG-CB 4.32Å; L82-E84 PolarHBondContact O-N 2.89Å; L82-N105 PolarHBondContact N-OD1 2.89Å
83	I	98.8	Very high	97.1	Very high	0 Å²	0	51.6 Å²	51.6	0%	0	25%	0.247	C	C	.	.			trans	-72.9	128.1	-175	-61.4	164	0	0	0	109.4	L63 K64 I66 L78 N81 T85 L102 N105 K106 I107	L63-I83 HydrophobicContact CB-CG1 4.38Å; L63-I83 PolarHBondContact O-N 3.38Å; K64-I83 WeakPolarHBondContact O-CA 3.37Å; I66-I83 HydrophobicContact CD1-CG2 4.41Å; I66-I83 HydrophobicContact CG1-CD1 4.22Å; I66-I83 HydrophobicContact CG1-CG2 3.88Å; L78-I83 HydrophobicContact CB-CD1 4.06Å; L78-I83 HydrophobicContact CD2-CD1 3.89Å; L78-I83 HydrophobicContact CG-CD1 4.41Å; N81-I83 HydrophobicContact CB-CD1 4.09Å; N81-I83 HydrophobicContact CB-CG1 4.08Å; I83-T85 WeakPolarHBondContact CG2-O 3.31Å; I83-L102 HydrophobicContact CD1-CD2 4.27Å; I83-N105 HydrophobicContact CB-CB 4.3Å; I83-N105 WeakPolarHBondContact CB-OD1 3.24Å; I83-N105 PolarHBondContact N-OD1 3.25Å; I83-K106 CarbonylContact O-C 3.24Å; I83-K106 VanDerWaalsContact O-C 3.3Å; I83-K106 WeakPolarHBondContact O-CA 3.29Å; I83-K106 PolarHBondContact O-N 2.83Å; I83-I107 HydrophobicContact CG2-CG1 4.35Å; I83-I107 WeakPolarHBondContact O-CG1 3.3Å; I83-I107 PolarHBondContact O-N 3.17Å
84	E	98.1	Very high	96.9	Very high	114 Å²	114	51.6 Å²	51.6	53%	0.533	25%	0.247	S	C	.	.			trans	-106.5	-23.6	179.5	-69.7	176.4	-160.6	0	0	112.4	L82 K106	L82-E84 PolarHBondContact O-N 2.89Å; E84-K106 HydrophobicContact CG-CB 3.73Å; E84-K106 HydrophobicContact CG-CD 4.49Å
85	T	98.1	Very high	96.7	Very high	57 Å²	57	51.6 Å²	51.6	35%	0.35	26%	0.256	S	S	.	.			trans	-125.7	147.2	-171.9	62	0	0	0	0	112.8	I83 P87 G111	I83-T85 WeakPolarHBondContact CG2-O 3.31Å; T85-P87 WeakPolarHBondContact O-CD 3.39Å; T85-G111 CarbonylContact C-O 3.19Å; T85-G111 WeakPolarHBondContact CA-O 3.21Å; T85-G111 WeakPolarHBondContact CB-O 3.14Å
86	I	98.3	Very high	96.5	Very high	0 Å²	0	51 Å²	51	0%	0	26%	0.256	C	S	.	.	B	Isolated β-bridge	trans	-117.3	84.6	168.5	-51.7	-176.9	0	0	0	106.8	I66 F91 L102 I107 G111 I112 E113 A116 L117 L128	I66-I86 HydrophobicContact CD1-CB 4.39Å; I66-I86 HydrophobicContact CD1-CG1 4.3Å; I66-I86 HydrophobicContact CD1-CG2 4.2Å; I86-F91 HydrophobicContact CG2-CD2 4.48Å; I86-F91 HydrophobicContact CG2-CE2 3.54Å; I86-F91 HydrophobicContact CG2-CZ 4.03Å; I86-L102 HydrophobicContact CD1-CD1 3.8Å; I86-L102 HydrophobicContact CG1-CD1 4.39Å; I86-I107 HydrophobicContact CD1-CD1 4.06Å; I86-I107 HydrophobicContact CD1-CG2 4.05Å; I86-I107 HydrophobicContact CG1-CD1 4.06Å; I86-I107 HydrophobicContact CG1-CG2 4.04Å; I86-G111 PolarHBondContact N-O 3.47Å; I86-I112 HydrophobicContact CB-CG1 4.34Å; I86-I112 HydrophobicContact CB-CG2 4.43Å; I86-I112 HydrophobicContact CD1-CD1 4.16Å; I86-I112 HydrophobicContact CD1-CG1 3.93Å; I86-I112 HydrophobicContact CG1-CG1 4.17Å; I86-E113 PolarHBondContact O-N 2.93Å; I86-A116 HydrophobicContact CG2-CB 4.2Å; I86-A116 WeakPolarHBondContact O-CB 3.15Å; I86-L117 HydrophobicContact CD1-CD2 4.35Å; I86-L117 HydrophobicContact CG2-CD2 4.19Å; I86-L128 HydrophobicContact CD1-CD2 4.21Å
87	P	97.1	Very high	96.5	Very high	34 Å²	34	51 Å²	51	22%	0.221	26%	0.256	C	S	.	.			trans	-74.5	161	176.7	29.3	-32.5	0	0	0	111.6	T85 P90 F91 E113	T85-P87 WeakPolarHBondContact O-CD 3.39Å; P87-P90 HydrophobicContact CG-CG 3.8Å; P87-F91 WeakPolarHBondContact O-CD2 3.41Å; P87-F91 WeakPolarHBondContact O-CE2 3.22Å; P87-E113 WeakPolarHBondContact CA-OE2 3.42Å
88	E	95.6	Very high	96.5	Very high	80 Å²	80	52.4 Å²	52.4	37%	0.374	26%	0.261	S	S	.	.	S	Bend	trans	-71.5	-41.6	178.8	-179.6	168.4	-165.4	0	0	112.3	F91 E92 E113 A116 Q119	E88-F91 PolarHBondContact O-N 3.14Å; E88-E92 PolarHBondContact O-N 2.68Å; E88-E113 HydrophobicContact CB-CG 4.42Å; E88-E113 PolarHBondContact N-OE2 2.97Å; E88-A116 HydrophobicContact CB-CB 4.37Å; E88-Q119 PolarHBondContact O-NE2 3.07Å
89	K	94.8	Very high	96.5	Very high	170 Å²	170	55.5 Å²	55.5	74%	0.739	27%	0.273	S	S	*	.	G	3₁₀ helix	trans	-54.6	-45.6	-169.4	-176.6	179.1	-178.7	-179.3	0	115.4	F91 E92	K89-F91 PolarHBondContact O-N 3.47Å; K89-F91 VanDerWaalsContact O-N 3.13Å; K89-E92 WeakPolarHBondContact O-CB 3.44Å; K89-E92 PolarHBondContact O-N 3.06Å
90	P	94.9	Very high	96.5	Very high	18 Å²	18	53.9 Å²	53.9	12%	0.117	27%	0.265	C	S	.	.	G	3₁₀ helix	trans	-61.8	-22.6	179.7	-26.2	37.6	0	0	0	114.3	I66 I69 P87	I66-P90 HydrophobicContact CB-CB 4.46Å; I66-P90 HydrophobicContact CB-CG 4.32Å; I66-P90 HydrophobicContact CG2-CB 3.9Å; I66-P90 HydrophobicContact CG2-CG 4.29Å; I69-P90 WeakPolarHBondContact CB-O 3.41Å; I69-P90 HydrophobicContact CD1-CB 4.26Å; I69-P90 HydrophobicContact CG1-CB 4.44Å; I69-P90 PolarHBondContact N-O 3.33Å; P87-P90 HydrophobicContact CG-CG 3.8Å
91	F	95.6	Very high	96.5	Very high	2 Å²	2	52 Å²	52	1%	0.009	26%	0.255	C	S	.	.	G	3₁₀ helix	trans	-98.1	-7.2	-175.7	-60.5	-75.8	0	0	0	113.8	I66 I69 L76 I86 P87 E88 K89 N93 A94 L97 I100 L120	I66-F91 HydrophobicContact CD1-CE2 3.95Å; I66-F91 HydrophobicContact CD1-CZ 3.73Å; I66-F91 HydrophobicContact CG2-CE2 4.49Å; I66-F91 HydrophobicContact CG2-CZ 4.13Å; I69-F91 HydrophobicContact CD1-CD1 3.31Å; I69-F91 HydrophobicContact CD1-CE1 3.27Å; I69-F91 HydrophobicContact CD1-CG 4.11Å; I69-F91 HydrophobicContact CD1-CZ 4.04Å; L76-F91 HydrophobicContact CD2-CE1 4.12Å; I86-F91 HydrophobicContact CG2-CD2 4.48Å; I86-F91 HydrophobicContact CG2-CE2 3.54Å; I86-F91 HydrophobicContact CG2-CZ 4.03Å; P87-F91 WeakPolarHBondContact O-CD2 3.41Å; P87-F91 WeakPolarHBondContact O-CE2 3.22Å; E88-F91 PolarHBondContact O-N 3.14Å; K89-F91 PolarHBondContact O-N 3.47Å; K89-F91 VanDerWaalsContact O-N 3.13Å; F91-N93 VanDerWaalsContact C-N 3.29Å; F91-N93 PolarHBondContact O-N 2.74Å; F91-A94 PolarHBondContact O-N 2.76Å; F91-L97 HydrophobicContact CD1-CD1 3.72Å; F91-L97 HydrophobicContact CE1-CD1 4.17Å; F91-I100 HydrophobicContact CE1-CD1 3.98Å; F91-L120 HydrophobicContact CB-CD2 4.09Å; F91-L120 HydrophobicContact CD1-CD1 4.21Å; F91-L120 HydrophobicContact CD1-CD2 4.24Å; F91-L120 HydrophobicContact CG-CD2 4.48Å
92	E	91.9	Very high	96.5	Very high	125 Å²	125	51.7 Å²	51.7	58%	0.584	25%	0.253	S	S	*	.	T	Hydrogen-bonded Turn	trans	-52.8	-44.2	-172.7	-173.3	174.8	-164.3	0	0	112.4	E88 K89	E88-E92 PolarHBondContact O-N 2.68Å; K89-E92 WeakPolarHBondContact O-CB 3.44Å; K89-E92 PolarHBondContact O-N 3.06Å
93	N	89.7	Confident	96.5	Very high	113 Å²	113	49.4 Å²	49.4	60%	0.604	24%	0.242	S	C	*	.	T	Hydrogen-bonded Turn	trans	-96.2	-7.8	179	-66.3	-30.1	0	0	0	113.7	S71 F91 T95	S71-N93 WeakPolarHBondContact CA-O 2.9Å; F91-N93 VanDerWaalsContact C-N 3.29Å; F91-N93 PolarHBondContact O-N 2.74Å; N93-T95 PolarHBondContact O-N 2.96Å
94	A	93.8	Very high	96.5	Very high	0 Å²	0	54.7 Å²	54.7	0%	0	27%	0.265	C	S	.	.			trans	-84.5	47.8	-173.1	0	0	0	0	0	112.6	I69 F91 Q96 L97	I69-A94 HydrophobicContact CB-CB 3.88Å; I69-A94 HydrophobicContact CG2-CB 3.65Å; F91-A94 PolarHBondContact O-N 2.76Å; A94-Q96 PolarHBondContact O-N 3.04Å; A94-Q96 VanDerWaalsContact O-N 3.13Å; A94-L97 HydrophobicContact CB-CD1 3.49Å; A94-L97 VanDerWaalsContact CB-CD1 3.49Å; A94-L97 HydrophobicContact CB-CG 3.93Å; A94-L97 WeakPolarHBondContact O-CG 3.45Å; A94-L97 PolarHBondContact O-N 3.44Å
95	T	93.1	Very high	96.6	Very high	84 Å²	84	49.8 Å²	49.8	52%	0.515	24%	0.242	S	C	.	.	T	Hydrogen-bonded Turn	trans	-68.7	-13.4	-170.9	62.7	0	0	0	0	114.3	N93	N93-T95 PolarHBondContact O-N 2.96Å
96	Q	96.3	Very high	96.6	Very high	52 Å²	52	51.1 Å²	51.1	24%	0.243	24%	0.243	C	C	.	.	T	Hydrogen-bonded Turn	trans	-95.3	-0.5	-178.9	-56.9	-64.6	-25.2	0	0	113.8	I73 W74 A94 R98 K122	I73-Q96 CarbonylContact O-C 3.15Å; W74-Q96 VanDerWaalsContact CD1-CB 3.46Å; W74-Q96 HydrophobicContact CG-CB 4.37Å; A94-Q96 PolarHBondContact O-N 3.04Å; A94-Q96 VanDerWaalsContact O-N 3.13Å; Q96-R98 PolarHBondContact O-N 3.46Å; Q96-K122 VanDerWaalsContact CD-NZ 3.34Å; Q96-K122 VanDerWaalsContact NE2-NZ 3.17Å
97	L	98.3	Very high	96.6	Very high	2 Å²	2	51.1 Å²	51.1	1%	0.01	24%	0.243	C	C	.	.			trans	-58.1	129.3	-179.8	-77.7	170.7	0	0	0	112	I69 I73 L76 F91 A94 I100 L120 K122 L123	I69-L97 HydrophobicContact CD1-CD1 4.26Å; I69-L97 HydrophobicContact CG2-CD1 4.41Å; I73-L97 HydrophobicContact CG2-CD2 3.91Å; I73-L97 PolarHBondContact O-N 2.86Å; L76-L97 HydrophobicContact CB-CD2 3.92Å; F91-L97 HydrophobicContact CD1-CD1 3.72Å; F91-L97 HydrophobicContact CE1-CD1 4.17Å; A94-L97 HydrophobicContact CB-CD1 3.49Å; A94-L97 VanDerWaalsContact CB-CD1 3.49Å; A94-L97 HydrophobicContact CB-CG 3.93Å; A94-L97 WeakPolarHBondContact O-CG 3.45Å; A94-L97 PolarHBondContact O-N 3.44Å; L97-I100 HydrophobicContact CD1-CD1 4.04Å; L97-I100 HydrophobicContact CD1-CG1 4.4Å; L97-I100 HydrophobicContact CD2-CG1 4.43Å; L97-L120 HydrophobicContact CB-CD2 4.42Å; L97-L120 HydrophobicContact CD1-CD2 4.04Å; L97-K122 CarbonylContact O-C 3.47Å; L97-L123 WeakPolarHBondContact O-CA 3.18Å; L97-L123 PolarHBondContact O-N 2.87Å
98	R	98.7	Very high	96.7	Very high	76 Å²	76	51.6 Å²	51.6	29%	0.287	25%	0.245	S	C	.	.			trans	-119.2	-28.4	177.9	-66.2	176.3	-174.6	-88.8	3.3	112.2	W74 Q96 L124 F125	W74-R98 PolarHBondContact O-N 3.13Å; Q96-R98 PolarHBondContact O-N 3.46Å; R98-L124 PolarHBondContact O-N 2.8Å; R98-F125 PolarHBondContact O-N 2.83Å
99	W	98.8	Very high	96.8	Very high	65 Å²	65	49.7 Å²	49.7	25%	0.246	24%	0.238	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-136.9	122.2	-174.7	-176.9	-69	0	0	0	110	W74 Y75 L76 Y77 F125 F127	W74-W99 PolarHBondContact O-N 3.47Å; W74-W99 VanDerWaalsContact O-N 3.07Å; Y75-W99 HydrophobicContact CD1-CB 3.64Å; Y75-W99 HydrophobicContact CD1-CG 4.16Å; Y75-W99 HydrophobicContact CE1-CB 4.32Å; Y75-W99 HydrophobicContact CG-CB 4.49Å; L76-W99 PolarHBondContact N-O 3.28Å; Y77-W99 AromaticContact CE1-NE1 3.97Å; W99-F125 WeakPolarHBondContact CA-O 3.43Å; W99-F125 HydrophobicContact CD2-CB 3.97Å; W99-F125 HydrophobicContact CD2-CD2 4.47Å; W99-F125 HydrophobicContact CD2-CG 4.32Å; W99-F125 HydrophobicContact CE3-CB 3.59Å; W99-F125 HydrophobicContact CE3-CD1 4.09Å; W99-F125 AromaticContact CE3-CD2 3.49Å; W99-F125 HydrophobicContact CE3-CD2 3.49Å; W99-F125 VanDerWaalsContact CE3-CD2 3.49Å; W99-F125 HydrophobicContact CE3-CE2 4.22Å; W99-F125 AromaticContact CE3-CG 3.45Å; W99-F125 HydrophobicContact CE3-CG 3.45Å; W99-F125 VanDerWaalsContact CE3-CG 3.45Å; W99-F125 HydrophobicContact CG-CB 4.41Å; W99-F125 HydrophobicContact CZ3-CB 4.05Å; W99-F125 AromaticContact CZ3-CD1 3.82Å; W99-F125 HydrophobicContact CZ3-CD1 3.82Å; W99-F125 AromaticContact CZ3-CD2 3.98Å; W99-F125 HydrophobicContact CZ3-CD2 3.98Å; W99-F125 HydrophobicContact CZ3-CE1 4.29Å; W99-F125 HydrophobicContact CZ3-CE2 4.44Å; W99-F125 AromaticContact CZ3-CG 3.68Å; W99-F125 HydrophobicContact CZ3-CG 3.68Å; W99-F127 AromaticContact CD2-CE2 3.63Å; W99-F127 HydrophobicContact CD2-CE2 3.63Å; W99-F127 HydrophobicContact CD2-CZ 4.3Å; W99-F127 AromaticContact CE2-CD2 3.98Å; W99-F127 AromaticContact CE2-CE2 3.16Å; W99-F127 AromaticContact CE2-CZ 3.78Å; W99-F127 HydrophobicContact CE3-CE2 4.06Å; W99-F127 HydrophobicContact CE3-CZ 4.34Å; W99-F127 HydrophobicContact CG-CE2 4.27Å; W99-F127 HydrophobicContact CH2-CE1 4.4Å; W99-F127 AromaticContact CH2-CE2 3.67Å; W99-F127 HydrophobicContact CH2-CE2 3.67Å; W99-F127 AromaticContact CH2-CZ 3.34Å; W99-F127 HydrophobicContact CH2-CZ 3.34Å; W99-F127 HydrophobicContact CZ2-CD2 4.16Å; W99-F127 HydrophobicContact CZ2-CE1 4.29Å; W99-F127 AromaticContact CZ2-CE2 3.19Å; W99-F127 HydrophobicContact CZ2-CE2 3.19Å; W99-F127 AromaticContact CZ2-CZ 3.28Å; W99-F127 HydrophobicContact CZ2-CZ 3.28Å; W99-F127 HydrophobicContact CZ3-CE2 4.07Å; W99-F127 AromaticContact CZ3-CZ 3.89Å; W99-F127 HydrophobicContact CZ3-CZ 3.89Å; W99-F127 AromaticContact NE1-CD2 3.91Å; W99-F127 AromaticContact NE1-CE2 3.54Å
100	I	98.9	Very high	96.9	Very high	0 Å²	0	51.9 Å²	51.9	0%	0	24%	0.243	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-127.2	118.4	174.6	-63.3	172.3	0	0	0	108.8	L76 F91 L97 L102 L120 L123 F125 L126 F127	L76-I100 HydrophobicContact CB-CG1 4.32Å; L76-I100 HydrophobicContact CD2-CG1 4.32Å; L76-I100 HydrophobicContact CD2-CG2 4.35Å; F91-I100 HydrophobicContact CE1-CD1 3.98Å; L97-I100 HydrophobicContact CD1-CD1 4.04Å; L97-I100 HydrophobicContact CD1-CG1 4.4Å; L97-I100 HydrophobicContact CD2-CG1 4.43Å; I100-L102 HydrophobicContact CG2-CD1 3.65Å; I100-L102 HydrophobicContact CG2-CG 3.78Å; I100-L120 HydrophobicContact CD1-CD1 3.5Å; I100-L120 VanDerWaalsContact CD1-CD1 3.5Å; I100-L123 HydrophobicContact CB-CD1 4.23Å; I100-L123 HydrophobicContact CD1-CD1 3.64Å; I100-L123 HydrophobicContact CD1-CD2 4.13Å; I100-L123 HydrophobicContact CG1-CD1 3.64Å; I100-F125 PolarHBondContact N-O 3.38Å; I100-L126 HydrophobicContact CB-CD1 4.16Å; I100-L126 HydrophobicContact CG2-CD1 4.23Å; I100-F127 WeakPolarHBondContact O-CD2 3.48Å; I100-F127 PolarHBondContact O-N 3.05Å
101	N	98.9	Very high	97	Very high	22 Å²	22	51.6 Å²	51.6	12%	0.118	24%	0.243	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-105.5	107.8	173.4	-169.9	-10.2	0	0	0	111.1	L76 Y77 L78 Q79 N103 F127	L76-N101 PolarHBondContact O-N 3.22Å; Y77-N101 HydrophobicContact CD1-CB 4.39Å; L78-N101 CarbonylContact C-O 3.55Å; L78-N101 WeakPolarHBondContact CA-O 3.1Å; L78-N101 WeakPolarHBondContact CB-O 3.2Å; L78-N101 PolarHBondContact N-O 3.41Å; Q79-N101 PolarHBondContact N-O 2.78Å; Q79-N101 PolarHBondContact OE1-ND2 3.48Å; N101-N103 VanDerWaalsContact OD1-CB 3.28Å; N101-N103 WeakPolarHBondContact OD1-CB 3.37Å; N101-N103 VanDerWaalsContact OD1-CG 3.29Å; N101-N103 PolarHBondContact OD1-N 3.46Å; N101-F127 HydrophobicContact CB-CD2 4.26Å
102	L	98.9	Very high	97.1	Very high	1 Å²	1	52.9 Å²	52.9	1%	0.005	25%	0.25	C	C	.	.			trans	-114.8	19.3	177.2	-75.3	161.2	0	0	0	111.7	I66 L78 I83 I86 I100 N105 I107 F127 L128 N131	I66-L102 HydrophobicContact CD1-CD2 4.21Å; L78-L102 HydrophobicContact CB-CD2 3.71Å; L78-L102 HydrophobicContact CB-CG 4.48Å; L78-L102 HydrophobicContact CD1-CD2 3.78Å; L78-L102 HydrophobicContact CG-CD2 4.4Å; I83-L102 HydrophobicContact CD1-CD2 4.27Å; I86-L102 HydrophobicContact CD1-CD1 3.8Å; I86-L102 HydrophobicContact CG1-CD1 4.39Å; I100-L102 HydrophobicContact CG2-CD1 3.65Å; I100-L102 HydrophobicContact CG2-CG 3.78Å; L102-N105 PolarHBondContact O-ND2 3.39Å; L102-I107 HydrophobicContact CB-CD1 3.91Å; L102-I107 HydrophobicContact CD1-CD1 4.15Å; L102-I107 HydrophobicContact CD2-CD1 4.02Å; L102-I107 HydrophobicContact CG-CD1 4.26Å; L102-F127 CarbonylContact C-O 3.41Å; L102-F127 WeakPolarHBondContact CA-O 3.35Å; L102-F127 WeakPolarHBondContact CB-O 3.35Å; L102-F127 PolarHBondContact N-O 3.1Å; L102-L128 HydrophobicContact CB-CD2 3.8Å; L102-L128 HydrophobicContact CD1-CD2 3.99Å; L102-N131 PolarHBondContact O-ND2 2.85Å
103	N	98.9	Very high	97.4	Very high	22 Å²	22	51.5 Å²	51.5	12%	0.118	24%	0.243	C	C	.	.			trans	-57.4	148.1	-179.7	-74.4	-3.6	0	0	0	112.1	Q79 N80 N101 N105 F127 L128 E129	Q79-N103 CarbonylContact C-O 3.14Å; Q79-N103 WeakPolarHBondContact CA-O 3.34Å; Q79-N103 HydrophobicContact CB-CB 4.14Å; Q79-N103 VanDerWaalsContact CB-O 3.32Å; Q79-N103 WeakPolarHBondContact CB-O 3.48Å; N80-N103 PolarHBondContact N-O 2.8Å; N101-N103 VanDerWaalsContact OD1-CB 3.28Å; N101-N103 WeakPolarHBondContact OD1-CB 3.37Å; N101-N103 VanDerWaalsContact OD1-CG 3.29Å; N101-N103 PolarHBondContact OD1-N 3.46Å; N103-N105 PolarHBondContact O-ND2 2.98Å; N103-F127 WeakPolarHBondContact OD1-CB 3.36Å; N103-F127 PolarHBondContact OD1-O 2.93Å; N103-L128 PolarHBondContact OD1-N 3.21Å; N103-E129 CarbonylContact C-O 3.52Å; N103-E129 WeakPolarHBondContact CA-O 3.38Å; N103-E129 HydrophobicContact CB-CB 4.5Å; N103-E129 PolarHBondContact ND2-OE1 3Å; N103-E129 WeakPolarHBondContact OD1-CB 3.48Å; N103-E129 PolarHBondContact OD1-N 3.42Å
104	K	98.8	Very high	97.5	Very high	112 Å²	112	55.1 Å²	55.1	49%	0.487	25%	0.254	S	S	.	.	S	Bend	trans	56.5	58	174.4	-63.6	172.5	173.1	-178.5	0	111.8	N80 N81 E129 D130	N80-K104 VanDerWaalsContact CA-O 3.27Å; N80-K104 WeakPolarHBondContact CA-O 3.21Å; N80-K104 PolarHBondContact N-O 3.3Å; N80-K104 VanDerWaalsContact OD1-CB 3.29Å; N80-K104 WeakPolarHBondContact OD1-CB 3.15Å; N80-K104 WeakPolarHBondContact OD1-CD 3.44Å; N81-K104 PolarHBondContact N-O 3.09Å; K104-E129 PolarHBondContact N-O 3.02Å; K104-D130 WeakPolarHBondContact CA-O 3.46Å; K104-D130 HydrophobicContact CB-CB 4.24Å; K104-D130 WeakPolarHBondContact CE-OD2 3.38Å; K104-D130 HydrophobicContact CG-CB 3.47Å; K104-D130 VanDerWaalsContact CG-CB 3.47Å; K104-D130 WeakPolarHBondContact CG-OD2 3.28Å; K104-D130 PolarHBondContact N-O 3.13Å
105	N	98.9	Very high	97.3	Very high	10 Å²	10	55.9 Å²	55.9	5%	0.053	26%	0.262	C	S	.	.	S	Bend	trans	-125.5	-164.1	172.1	-84.5	-71.8	0	0	0	108.7	L78 N81 L82 I83 L102 N103 I107 D130 N131	L78-N105 PolarHBondContact O-ND2 3.03Å; N81-N105 VanDerWaalsContact CA-OD1 3.31Å; N81-N105 WeakPolarHBondContact CA-OD1 3.49Å; N81-N105 WeakPolarHBondContact CB-OD1 3.35Å; N81-N105 PolarHBondContact N-OD1 3.06Å; N81-N105 PolarHBondContact O-OD1 3.14Å; L82-N105 PolarHBondContact N-OD1 2.89Å; I83-N105 HydrophobicContact CB-CB 4.3Å; I83-N105 WeakPolarHBondContact CB-OD1 3.24Å; I83-N105 PolarHBondContact N-OD1 3.25Å; L102-N105 PolarHBondContact O-ND2 3.39Å; N103-N105 PolarHBondContact O-ND2 2.98Å; N105-I107 HydrophobicContact CB-CD1 4.14Å; N105-I107 HydrophobicContact CB-CG1 4.06Å; N105-D130 PolarHBondContact N-O 3.39Å; N105-N131 WeakPolarHBondContact CA-OD1 3.42Å; N105-N131 WeakPolarHBondContact CB-OD1 3.41Å; N105-N131 PolarHBondContact O-OD1 3.16Å
106	K	98.7	Very high	97.4	Very high	85 Å²	85	51.9 Å²	51.9	37%	0.37	24%	0.237	S	C	.	.			trans	-120.3	30.2	-179.7	-63.6	-175	177.2	-177.2	0	111.9	I83 E84 T108 N131	I83-K106 CarbonylContact O-C 3.24Å; I83-K106 VanDerWaalsContact O-C 3.3Å; I83-K106 WeakPolarHBondContact O-CA 3.29Å; I83-K106 PolarHBondContact O-N 2.83Å; E84-K106 HydrophobicContact CG-CB 3.73Å; E84-K106 HydrophobicContact CG-CD 4.49Å; K106-T108 PolarHBondContact O-N 3.35Å; K106-N131 PolarHBondContact N-OD1 3.27Å
107	I	98.8	Very high	97.4	Very high	0 Å²	0	49.6 Å²	49.6	0%	0	23%	0.227	C	C	.	.			trans	-71	130.1	-172.1	-58.6	167	0	0	0	109.4	I83 I86 L102 N105 I112 L128 N131 E132 L133	I83-I107 HydrophobicContact CG2-CG1 4.35Å; I83-I107 WeakPolarHBondContact O-CG1 3.3Å; I83-I107 PolarHBondContact O-N 3.17Å; I86-I107 HydrophobicContact CD1-CD1 4.06Å; I86-I107 HydrophobicContact CD1-CG2 4.05Å; I86-I107 HydrophobicContact CG1-CD1 4.06Å; I86-I107 HydrophobicContact CG1-CG2 4.04Å; L102-I107 HydrophobicContact CB-CD1 3.91Å; L102-I107 HydrophobicContact CD1-CD1 4.15Å; L102-I107 HydrophobicContact CD2-CD1 4.02Å; L102-I107 HydrophobicContact CG-CD1 4.26Å; N105-I107 HydrophobicContact CB-CD1 4.14Å; N105-I107 HydrophobicContact CB-CG1 4.06Å; I107-I112 HydrophobicContact CG2-CD1 4.12Å; I107-I112 HydrophobicContact CG2-CG1 3.86Å; I107-L128 HydrophobicContact CD1-CD2 3.93Å; I107-N131 HydrophobicContact CB-CB 4.38Å; I107-N131 VanDerWaalsContact CB-OD1 3.31Å; I107-N131 WeakPolarHBondContact CB-OD1 3.12Å; I107-N131 WeakPolarHBondContact CG1-OD1 3.14Å; I107-N131 PolarHBondContact N-OD1 3.39Å; I107-E132 CarbonylContact O-C 3.49Å; I107-E132 VanDerWaalsContact O-C 3.27Å; I107-E132 WeakPolarHBondContact O-CA 3.23Å; I107-E132 PolarHBondContact O-N 2.85Å; I107-L133 HydrophobicContact CG2-CD2 4.17Å; I107-L133 PolarHBondContact O-N 3.03Å
108	T	98.4	Very high	97.3	Very high	45 Å²	45	51.6 Å²	51.6	28%	0.276	24%	0.241	S	C	.	.			trans	-112.7	163.6	174.1	66.2	0	0	0	0	110.2	K106 Y110 G111 E132	K106-T108 PolarHBondContact O-N 3.35Å; T108-Y110 PolarHBondContact O-N 3.44Å; T108-G111 PolarHBondContact O-N 3.06Å; T108-G111 VanDerWaalsContact O-N 3.08Å; T108-G111 PolarHBondContact OG1-N 2.81Å; T108-E132 HydrophobicContact CG2-CB 3.92Å
109	N	97.7	Very high	97.1	Very high	39 Å²	39	50.7 Å²	50.7	21%	0.209	24%	0.24	C	C	.	.	G	3₁₀ helix	trans	-58.4	-35.1	176	-69.1	85.5	0	0	0	113.1	G111 I112 L133 E134 E135	N109-G111 VanDerWaalsContact C-N 3.31Å; N109-I112 PolarHBondContact O-N 3Å; N109-L133 WeakPolarHBondContact OD1-CA 3.1Å; N109-E134 PolarHBondContact OD1-N 2.83Å; N109-E135 PolarHBondContact ND2-O 2.89Å; N109-E135 PolarHBondContact OD1-N 3.43Å
110	Y	96.8	Very high	97	Very high	217 Å²	217	47.8 Å²	47.8	85%	0.851	23%	0.229	S	C	*	.	G	3₁₀ helix	trans	-71.6	-25.9	177.5	-61.3	-73.6	0	0	0	113.2	T108 I112	T108-Y110 PolarHBondContact O-N 3.44Å; Y110-I112 VanDerWaalsContact C-N 3.27Å; Y110-I112 PolarHBondContact O-N 3.41Å
111	G	97.3	Very high	96.9	Very high	12 Å²	12	56.1 Å²	56.1	12%	0.124	27%	0.265	C	S	.	.	G	3₁₀ helix	trans	-75.2	-14.9	176	0	0	0	0	0	113.6	T85 I86 T108 N109 E113	T85-G111 CarbonylContact C-O 3.19Å; T85-G111 WeakPolarHBondContact CA-O 3.21Å; T85-G111 WeakPolarHBondContact CB-O 3.14Å; I86-G111 PolarHBondContact N-O 3.47Å; T108-G111 PolarHBondContact O-N 3.06Å; T108-G111 VanDerWaalsContact O-N 3.08Å; T108-G111 PolarHBondContact OG1-N 2.81Å; N109-G111 VanDerWaalsContact C-N 3.31Å; G111-E113 PolarHBondContact O-N 2.72Å
112	I	98	Very high	96.9	Very high	29 Å²	29	59.1 Å²	59.1	15%	0.149	28%	0.277	C	S	.	.	B	Isolated β-bridge	trans	-88.4	109.6	179.1	-55.7	179.3	0	0	0	109	I86 I107 N109 Y110 L117 L133 P137	I86-I112 HydrophobicContact CB-CG1 4.34Å; I86-I112 HydrophobicContact CB-CG2 4.43Å; I86-I112 HydrophobicContact CD1-CD1 4.16Å; I86-I112 HydrophobicContact CD1-CG1 3.93Å; I86-I112 HydrophobicContact CG1-CG1 4.17Å; I107-I112 HydrophobicContact CG2-CD1 4.12Å; I107-I112 HydrophobicContact CG2-CG1 3.86Å; N109-I112 PolarHBondContact O-N 3Å; Y110-I112 VanDerWaalsContact C-N 3.27Å; Y110-I112 PolarHBondContact O-N 3.41Å; I112-L117 HydrophobicContact CG2-CD1 4.06Å; I112-L117 HydrophobicContact CG2-CG 4.33Å; I112-L133 HydrophobicContact CD1-CD2 3.87Å; I112-P137 HydrophobicContact CD1-CB 3.83Å; I112-P137 HydrophobicContact CD1-CG 3.72Å
113	E	97.3	Very high	96.9	Very high	95 Å²	95	59 Å²	59	44%	0.444	28%	0.277	S	S	.	.			trans	-66.5	141.3	177	-174.1	169.8	-167.6	0	0	111	I86 P87 E88 G111 G115 A116	I86-E113 PolarHBondContact O-N 2.93Å; P87-E113 WeakPolarHBondContact CA-OE2 3.42Å; E88-E113 HydrophobicContact CB-CG 4.42Å; E88-E113 PolarHBondContact N-OE2 2.97Å; G111-E113 PolarHBondContact O-N 2.72Å; E113-G115 PolarHBondContact O-N 3.27Å; E113-G115 VanDerWaalsContact O-N 3.12Å; E113-A116 HydrophobicContact CB-CB 4.26Å; E113-A116 WeakPolarHBondContact O-CB 3.49Å; E113-A116 PolarHBondContact O-N 3.08Å; E113-A116 VanDerWaalsContact O-N 3.16Å
114	K	92.4	Very high	96.9	Very high	189 Å²	189	59.5 Å²	59.5	82%	0.822	28%	0.279	S	S	*	.	T	Hydrogen-bonded Turn	trans	-64.2	117.3	-177.5	-175.9	-176.6	179.5	-176	0	109.6
115	G	89.6	Confident	96.9	Very high	17 Å²	17	56.1 Å²	56.1	18%	0.175	27%	0.265	C	S	.	.	T	Hydrogen-bonded Turn	trans	104.9	-24.3	178.2	0	0	0	0	0	113.7	E113 L117 S118 Q119	E113-G115 PolarHBondContact O-N 3.27Å; E113-G115 VanDerWaalsContact O-N 3.12Å; G115-L117 VanDerWaalsContact C-N 3.28Å; G115-L117 PolarHBondContact O-N 3.5Å; G115-L117 VanDerWaalsContact O-N 3.13Å; G115-S118 WeakPolarHBondContact CA-OG 3.29Å; G115-S118 PolarHBondContact O-N 3.12Å; G115-S118 PolarHBondContact O-OG 2.97Å; G115-S118 VanDerWaalsContact O-OG 3.1Å; G115-Q119 PolarHBondContact O-N 3.03Å
116	A	95.9	Very high	96.9	Very high	0 Å²	0	55.7 Å²	55.7	0%	0	26%	0.262	C	S	.	.	T	Hydrogen-bonded Turn	trans	-53.1	-41.2	-172.5	0	0	0	0	0	113.6	I86 E88 E113 Q119	I86-A116 HydrophobicContact CG2-CB 4.2Å; I86-A116 WeakPolarHBondContact O-CB 3.15Å; E88-A116 HydrophobicContact CB-CB 4.37Å; E113-A116 HydrophobicContact CB-CB 4.26Å; E113-A116 WeakPolarHBondContact O-CB 3.49Å; E113-A116 PolarHBondContact O-N 3.08Å; E113-A116 VanDerWaalsContact O-N 3.16Å; A116-Q119 VanDerWaalsContact O-CG 3.31Å; A116-Q119 WeakPolarHBondContact O-CG 3.44Å; A116-Q119 PolarHBondContact O-NE2 2.88Å
117	L	96.3	Very high	96.9	Very high	4 Å²	4	52.6 Å²	52.6	2%	0.021	25%	0.249	C	C	.	.	T	Hydrogen-bonded Turn	trans	-83.7	-42	175.6	-63.1	174.7	0	0	0	112.3	I86 I112 G115 Q119 L120 L126 P137 L140 P141	I86-L117 HydrophobicContact CD1-CD2 4.35Å; I86-L117 HydrophobicContact CG2-CD2 4.19Å; I112-L117 HydrophobicContact CG2-CD1 4.06Å; I112-L117 HydrophobicContact CG2-CG 4.33Å; G115-L117 VanDerWaalsContact C-N 3.28Å; G115-L117 PolarHBondContact O-N 3.5Å; G115-L117 VanDerWaalsContact O-N 3.13Å; L117-Q119 VanDerWaalsContact C-N 3.28Å; L117-Q119 PolarHBondContact O-N 3.37Å; L117-L120 WeakPolarHBondContact O-CB 3.14Å; L117-L120 PolarHBondContact O-N 3.16Å; L117-L120 VanDerWaalsContact O-N 3.16Å; L117-L126 HydrophobicContact CD1-CD2 4.23Å; L117-L126 HydrophobicContact CD2-CD1 4.49Å; L117-L126 HydrophobicContact CD2-CD2 4.3Å; L117-P137 HydrophobicContact CD1-CB 4.15Å; L117-L140 HydrophobicContact CD1-CD2 4.32Å; L117-P141 WeakPolarHBondContact O-CD 3.43Å; L117-P141 VanDerWaalsContact O-CG 3.24Å; L117-P141 WeakPolarHBondContact O-CG 3.41Å
118	S	94.9	Very high	96.9	Very high	43 Å²	43	52.6 Å²	52.6	30%	0.301	25%	0.249	S	C	.	.	T	Hydrogen-bonded Turn	trans	-68.9	-21.6	-172.3	64.1	0	0	0	0	114.8	G115 L120	G115-S118 WeakPolarHBondContact CA-OG 3.29Å; G115-S118 PolarHBondContact O-N 3.12Å; G115-S118 PolarHBondContact O-OG 2.97Å; G115-S118 VanDerWaalsContact O-OG 3.1Å; S118-L120 PolarHBondContact O-N 3.34Å
119	Q	95.3	Very high	96.9	Very high	57 Å²	57	51.8 Å²	51.8	27%	0.266	24%	0.242	S	C	.	.	T	Hydrogen-bonded Turn	trans	-68	-20	174.2	63.7	176.7	-32.5	0	0	113.3	E88 G115 A116 L117 K121	E88-Q119 PolarHBondContact O-NE2 3.07Å; G115-Q119 PolarHBondContact O-N 3.03Å; A116-Q119 VanDerWaalsContact O-CG 3.31Å; A116-Q119 WeakPolarHBondContact O-CG 3.44Å; A116-Q119 PolarHBondContact O-NE2 2.88Å; L117-Q119 VanDerWaalsContact C-N 3.28Å; L117-Q119 PolarHBondContact O-N 3.37Å; Q119-K121 VanDerWaalsContact C-N 3.27Å; Q119-K121 PolarHBondContact O-N 2.99Å
120	L	97.1	Very high	97	Very high	4 Å²	4	52 Å²	52	2%	0.021	24%	0.243	C	C	.	.			trans	-79.1	72.4	-174.9	-59.3	173.2	0	0	0	111.3	F91 L97 I100 L117 S118 K122 L123 P141	F91-L120 HydrophobicContact CB-CD2 4.09Å; F91-L120 HydrophobicContact CD1-CD1 4.21Å; F91-L120 HydrophobicContact CD1-CD2 4.24Å; F91-L120 HydrophobicContact CG-CD2 4.48Å; L97-L120 HydrophobicContact CB-CD2 4.42Å; L97-L120 HydrophobicContact CD1-CD2 4.04Å; I100-L120 HydrophobicContact CD1-CD1 3.5Å; I100-L120 VanDerWaalsContact CD1-CD1 3.5Å; L117-L120 WeakPolarHBondContact O-CB 3.14Å; L117-L120 PolarHBondContact O-N 3.16Å; L117-L120 VanDerWaalsContact O-N 3.16Å; S118-L120 PolarHBondContact O-N 3.34Å; L120-K122 PolarHBondContact O-N 3.19Å; L120-L123 HydrophobicContact CB-CB 3.83Å; L120-L123 HydrophobicContact CB-CD2 4.39Å; L120-L123 HydrophobicContact CD1-CD2 4Å; L120-L123 WeakPolarHBondContact O-CB 3.35Å; L120-L123 PolarHBondContact O-N 3.13Å; L120-P141 VanDerWaalsContact O-CB 3.29Å; L120-P141 WeakPolarHBondContact O-CB 3.27Å
121	K	96.5	Very high	97.1	Very high	176 Å²	176	42.1 Å²	42.1	77%	0.765	21%	0.205	S	C	*	.	T	Hydrogen-bonded Turn	trans	-61.1	-16.4	-172	-65.5	173.1	-171.4	172.5	0	114.7	Q119 S143	Q119-K121 VanDerWaalsContact C-N 3.27Å; Q119-K121 PolarHBondContact O-N 2.99Å; K121-S143 VanDerWaalsContact C-OG 3.28Å; K121-S143 WeakPolarHBondContact O-CB 3.44Å; K121-S143 PolarHBondContact O-OG 3.15Å
122	K	98.3	Very high	97.1	Very high	84 Å²	84	44.9 Å²	44.9	37%	0.365	22%	0.215	S	C	.	.	T	Hydrogen-bonded Turn	trans	-107.4	2.7	178.4	-64.6	-176.2	-177.9	175.3	0	113.8	Q96 L97 L120 L124	Q96-K122 VanDerWaalsContact CD-NZ 3.34Å; Q96-K122 VanDerWaalsContact NE2-NZ 3.17Å; L97-K122 CarbonylContact O-C 3.47Å; L120-K122 PolarHBondContact O-N 3.19Å; K122-L124 PolarHBondContact O-N 3.27Å
123	L	98.7	Very high	97.2	Very high	0 Å²	0	43.5 Å²	43.5	0%	0	21%	0.208	C	C	.	.			trans	-69	122.8	-177.8	-170.6	69.2	0	0	0	111.2	L97 I100 L120 L126 P141 S143 L144	L97-L123 WeakPolarHBondContact O-CA 3.18Å; L97-L123 PolarHBondContact O-N 2.87Å; I100-L123 HydrophobicContact CB-CD1 4.23Å; I100-L123 HydrophobicContact CD1-CD1 3.64Å; I100-L123 HydrophobicContact CD1-CD2 4.13Å; I100-L123 HydrophobicContact CG1-CD1 3.64Å; L120-L123 HydrophobicContact CB-CB 3.83Å; L120-L123 HydrophobicContact CB-CD2 4.39Å; L120-L123 HydrophobicContact CD1-CD2 4Å; L120-L123 WeakPolarHBondContact O-CB 3.35Å; L120-L123 PolarHBondContact O-N 3.13Å; L123-L126 HydrophobicContact CD2-CB 4.19Å; L123-L126 HydrophobicContact CD2-CD1 4.45Å; L123-L126 HydrophobicContact CD2-CD2 4.47Å; L123-P141 HydrophobicContact CB-CB 4.5Å; L123-P141 HydrophobicContact CB-CG 4.08Å; L123-P141 HydrophobicContact CD2-CG 3.78Å; L123-P141 HydrophobicContact CG-CG 4.47Å; L123-S143 PolarHBondContact N-OG 3.12Å; L123-S143 CarbonylContact O-C 3.56Å; L123-S143 VanDerWaalsContact O-C 3.23Å; L123-S143 WeakPolarHBondContact O-CB 3.44Å; L123-S143 PolarHBondContact O-OG 2.8Å; L123-L144 HydrophobicContact CD2-CD2 4.02Å; L123-L144 HydrophobicContact CG-CD2 3.96Å; L123-L144 WeakPolarHBondContact O-CA 3.19Å; L123-L144 PolarHBondContact O-N 2.9Å
124	L	98.8	Very high	97.2	Very high	32 Å²	32	44 Å²	44	17%	0.168	21%	0.21	C	C	.	.			trans	-106.8	-39.1	-178.9	-56	179.9	0	0	0	111.5	R98 K122 S143 E145 Q146	R98-L124 PolarHBondContact O-N 2.8Å; K122-L124 PolarHBondContact O-N 3.27Å; L124-S143 WeakPolarHBondContact CD2-O 3.47Å; L124-E145 HydrophobicContact CB-CG 4.45Å; L124-E145 HydrophobicContact CD2-CG 4.2Å; L124-E145 PolarHBondContact O-N 3.45Å; L124-Q146 PolarHBondContact O-N 3.32Å
125	F	98.9	Very high	97.5	Very high	41 Å²	41	37.6 Å²	37.6	18%	0.18	18%	0.183	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-124.8	120.9	-174.4	-53.3	-93.8	0	0	0	110.9	R98 W99 I100 F127 Q146	R98-F125 PolarHBondContact O-N 2.83Å; W99-F125 WeakPolarHBondContact CA-O 3.43Å; W99-F125 HydrophobicContact CD2-CB 3.97Å; W99-F125 HydrophobicContact CD2-CD2 4.47Å; W99-F125 HydrophobicContact CD2-CG 4.32Å; W99-F125 HydrophobicContact CE3-CB 3.59Å; W99-F125 HydrophobicContact CE3-CD1 4.09Å; W99-F125 AromaticContact CE3-CD2 3.49Å; W99-F125 HydrophobicContact CE3-CD2 3.49Å; W99-F125 VanDerWaalsContact CE3-CD2 3.49Å; W99-F125 HydrophobicContact CE3-CE2 4.22Å; W99-F125 AromaticContact CE3-CG 3.45Å; W99-F125 HydrophobicContact CE3-CG 3.45Å; W99-F125 VanDerWaalsContact CE3-CG 3.45Å; W99-F125 HydrophobicContact CG-CB 4.41Å; W99-F125 HydrophobicContact CZ3-CB 4.05Å; W99-F125 AromaticContact CZ3-CD1 3.82Å; W99-F125 HydrophobicContact CZ3-CD1 3.82Å; W99-F125 AromaticContact CZ3-CD2 3.98Å; W99-F125 HydrophobicContact CZ3-CD2 3.98Å; W99-F125 HydrophobicContact CZ3-CE1 4.29Å; W99-F125 HydrophobicContact CZ3-CE2 4.44Å; W99-F125 AromaticContact CZ3-CG 3.68Å; W99-F125 HydrophobicContact CZ3-CG 3.68Å; I100-F125 PolarHBondContact N-O 3.38Å; F125-F127 HydrophobicContact CB-CE2 3.55Å; F125-F127 HydrophobicContact CB-CZ 3.89Å; F125-F127 HydrophobicContact CD1-CZ 4.4Å; F125-Q146 HydrophobicContact CD1-CB 3.77Å; F125-Q146 HydrophobicContact CD1-CG 3.68Å; F125-Q146 HydrophobicContact CE1-CB 4.3Å; F125-Q146 VanDerWaalsContact CE1-CD 3.47Å; F125-Q146 HydrophobicContact CE1-CG 3.68Å
126	L	98.9	Very high	97.9	Very high	1 Å²	1	36.8 Å²	36.8	1%	0.005	18%	0.175	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-124.8	115	176.8	179.6	58.9	0	0	0	110.3	I100 L117 L123 L128 L140 L144 Q146 L147 Q148	I100-L126 HydrophobicContact CB-CD1 4.16Å; I100-L126 HydrophobicContact CG2-CD1 4.23Å; L117-L126 HydrophobicContact CD1-CD2 4.23Å; L117-L126 HydrophobicContact CD2-CD1 4.49Å; L117-L126 HydrophobicContact CD2-CD2 4.3Å; L123-L126 HydrophobicContact CD2-CB 4.19Å; L123-L126 HydrophobicContact CD2-CD1 4.45Å; L123-L126 HydrophobicContact CD2-CD2 4.47Å; L126-L128 HydrophobicContact CD1-CD1 4.19Å; L126-L128 HydrophobicContact CD1-CG 4.15Å; L126-L128 HydrophobicContact CD2-CD1 3.85Å; L126-L128 HydrophobicContact CG-CD1 3.9Å; L126-L128 HydrophobicContact CG-CG 4.16Å; L126-L140 HydrophobicContact CD2-CD2 4.16Å; L126-L144 HydrophobicContact CB-CD2 3.83Å; L126-Q146 PolarHBondContact N-O 2.86Å; L126-Q146 VanDerWaalsContact N-O 3.1Å; L126-L147 HydrophobicContact CB-CD1 4.24Å; L126-L147 HydrophobicContact CD2-CD1 4.01Å; L126-L147 HydrophobicContact CG-CD1 4.19Å; L126-Q148 PolarHBondContact O-N 2.99Å
127	F	98.9	Very high	98	Very high	19 Å²	19	37 Å²	37	8%	0.083	18%	0.176	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-107.5	117.7	178.1	-48.4	-94.5	0	0	0	110.2	W99 I100 N101 L102 N103 F125 Q148	W99-F127 AromaticContact CD2-CE2 3.63Å; W99-F127 HydrophobicContact CD2-CE2 3.63Å; W99-F127 HydrophobicContact CD2-CZ 4.3Å; W99-F127 AromaticContact CE2-CD2 3.98Å; W99-F127 AromaticContact CE2-CE2 3.16Å; W99-F127 AromaticContact CE2-CZ 3.78Å; W99-F127 HydrophobicContact CE3-CE2 4.06Å; W99-F127 HydrophobicContact CE3-CZ 4.34Å; W99-F127 HydrophobicContact CG-CE2 4.27Å; W99-F127 HydrophobicContact CH2-CE1 4.4Å; W99-F127 AromaticContact CH2-CE2 3.67Å; W99-F127 HydrophobicContact CH2-CE2 3.67Å; W99-F127 AromaticContact CH2-CZ 3.34Å; W99-F127 HydrophobicContact CH2-CZ 3.34Å; W99-F127 HydrophobicContact CZ2-CD2 4.16Å; W99-F127 HydrophobicContact CZ2-CE1 4.29Å; W99-F127 AromaticContact CZ2-CE2 3.19Å; W99-F127 HydrophobicContact CZ2-CE2 3.19Å; W99-F127 AromaticContact CZ2-CZ 3.28Å; W99-F127 HydrophobicContact CZ2-CZ 3.28Å; W99-F127 HydrophobicContact CZ3-CE2 4.07Å; W99-F127 AromaticContact CZ3-CZ 3.89Å; W99-F127 HydrophobicContact CZ3-CZ 3.89Å; W99-F127 AromaticContact NE1-CD2 3.91Å; W99-F127 AromaticContact NE1-CE2 3.54Å; I100-F127 WeakPolarHBondContact O-CD2 3.48Å; I100-F127 PolarHBondContact O-N 3.05Å; N101-F127 HydrophobicContact CB-CD2 4.26Å; L102-F127 CarbonylContact C-O 3.41Å; L102-F127 WeakPolarHBondContact CA-O 3.35Å; L102-F127 WeakPolarHBondContact CB-O 3.35Å; L102-F127 PolarHBondContact N-O 3.1Å; N103-F127 WeakPolarHBondContact OD1-CB 3.36Å; N103-F127 PolarHBondContact OD1-O 2.93Å; F125-F127 HydrophobicContact CB-CE2 3.55Å; F125-F127 HydrophobicContact CB-CZ 3.89Å; F125-F127 HydrophobicContact CD1-CZ 4.4Å; F127-Q148 HydrophobicContact CD1-CB 3.86Å; F127-Q148 HydrophobicContact CD1-CG 3.67Å; F127-Q148 HydrophobicContact CE1-CG 3.88Å
128	L	98.9	Very high	98	Very high	0 Å²	0	39.8 Å²	39.8	0%	0	20%	0.196	C	C	.	.			trans	-131.9	25.3	-178.5	-76.6	167.1	0	0	0	110.8	I86 L102 N103 I107 L126 N131 L133 P137 Q148 L149 N152	I86-L128 HydrophobicContact CD1-CD2 4.21Å; L102-L128 HydrophobicContact CB-CD2 3.8Å; L102-L128 HydrophobicContact CD1-CD2 3.99Å; N103-L128 PolarHBondContact OD1-N 3.21Å; I107-L128 HydrophobicContact CD1-CD2 3.93Å; L126-L128 HydrophobicContact CD1-CD1 4.19Å; L126-L128 HydrophobicContact CD1-CG 4.15Å; L126-L128 HydrophobicContact CD2-CD1 3.85Å; L126-L128 HydrophobicContact CG-CD1 3.9Å; L126-L128 HydrophobicContact CG-CG 4.16Å; L128-N131 PolarHBondContact O-ND2 3.06Å; L128-L133 HydrophobicContact CB-CD1 4.14Å; L128-L133 HydrophobicContact CD1-CD1 4.27Å; L128-P137 HydrophobicContact CD1-CG 4.25Å; L128-Q148 CarbonylContact C-O 3.49Å; L128-Q148 WeakPolarHBondContact CA-O 3.41Å; L128-Q148 PolarHBondContact N-O 2.82Å; L128-L149 HydrophobicContact CB-CD2 3.76Å; L128-L149 HydrophobicContact CD1-CD2 4.02Å; L128-N152 PolarHBondContact O-ND2 3.37Å
129	E	98.9	Very high	98	Very high	28 Å²	28	40.6 Å²	40.6	13%	0.131	20%	0.2	C	C	.	.			trans	-66	154.3	178.4	-55.7	172	-106.3	0	0	111.7	N103 K104 N131 Q148 A150 R151	N103-E129 CarbonylContact C-O 3.52Å; N103-E129 WeakPolarHBondContact CA-O 3.38Å; N103-E129 HydrophobicContact CB-CB 4.5Å; N103-E129 PolarHBondContact ND2-OE1 3Å; N103-E129 WeakPolarHBondContact OD1-CB 3.48Å; N103-E129 PolarHBondContact OD1-N 3.42Å; K104-E129 PolarHBondContact N-O 3.02Å; E129-N131 PolarHBondContact O-N 2.96Å; E129-N131 PolarHBondContact O-ND2 3.43Å; E129-N131 VanDerWaalsContact O-ND2 3.13Å; E129-Q148 HydrophobicContact CG-CB 3.95Å; E129-Q148 PolarHBondContact N-O 3.34Å; E129-A150 CarbonylContact C-O 3.43Å; E129-A150 WeakPolarHBondContact CA-O 3.5Å; E129-A150 WeakPolarHBondContact CB-O 3.31Å; E129-A150 HydrophobicContact CG-CB 4.06Å; E129-R151 IonicContact OE2-CZ 2.96Å; E129-R151 VanDerWaalsContact OE2-CZ 3.25Å; E129-R151 IonicContact OE2-NH1 2.76Å; E129-R151 PolarHBondContact OE2-NH1 3.16Å; E129-R151 IonicContact OE2-NH2 2.68Å; E129-R151 PolarHBondContact OE2-NH2 3.15Å
130	D	98.9	Very high	98.1	Very high	43 Å²	43	38.5 Å²	38.5	23%	0.23	19%	0.191	C	C	.	.	S	Bend	trans	52.8	53.5	179.4	-60.6	-64.3	0	0	0	112.4	K104 N105 A150 R151	K104-D130 WeakPolarHBondContact CA-O 3.46Å; K104-D130 HydrophobicContact CB-CB 4.24Å; K104-D130 WeakPolarHBondContact CE-OD2 3.38Å; K104-D130 HydrophobicContact CG-CB 3.47Å; K104-D130 VanDerWaalsContact CG-CB 3.47Å; K104-D130 WeakPolarHBondContact CG-OD2 3.28Å; K104-D130 PolarHBondContact N-O 3.13Å; N105-D130 PolarHBondContact N-O 3.39Å; D130-A150 PolarHBondContact N-O 3.33Å; D130-R151 VanDerWaalsContact CA-O 3.3Å; D130-R151 WeakPolarHBondContact CA-O 3.47Å; D130-R151 PolarHBondContact N-O 2.83Å; D130-R151 VanDerWaalsContact OD1-CB 3.29Å; D130-R151 WeakPolarHBondContact OD1-CB 3.32Å; D130-R151 VanDerWaalsContact OD1-CD 3.24Å; D130-R151 WeakPolarHBondContact OD1-CD 3.47Å; D130-R151 IonicContact OD1-CZ 3.69Å; D130-R151 IonicContact OD1-NE 2.74Å; D130-R151 PolarHBondContact OD1-NE 2.87Å; D130-R151 IonicContact OD1-NH2 2.73Å; D130-R151 IonicContact OD2-CZ 2.78Å; D130-R151 VanDerWaalsContact OD2-CZ 3.22Å; D130-R151 IonicContact OD2-NE 3.96Å; D130-R151 PolarHBondContact OD2-NE 2.73Å; D130-R151 IonicContact OD2-NH2 3.06Å; D130-R151 PolarHBondContact OD2-NH2 2.95Å
131	N	98.9	Very high	98.1	Very high	10 Å²	10	38.3 Å²	38.3	5%	0.053	19%	0.19	C	C	.	.	S	Bend	trans	-123.9	-167	173.5	-85.3	-81.7	0	0	0	109.7	L102 N105 K106 I107 L128 E129 L133 N152	L102-N131 PolarHBondContact O-ND2 2.85Å; N105-N131 WeakPolarHBondContact CA-OD1 3.42Å; N105-N131 WeakPolarHBondContact CB-OD1 3.41Å; N105-N131 PolarHBondContact O-OD1 3.16Å; K106-N131 PolarHBondContact N-OD1 3.27Å; I107-N131 HydrophobicContact CB-CB 4.38Å; I107-N131 VanDerWaalsContact CB-OD1 3.31Å; I107-N131 WeakPolarHBondContact CB-OD1 3.12Å; I107-N131 WeakPolarHBondContact CG1-OD1 3.14Å; I107-N131 PolarHBondContact N-OD1 3.39Å; L128-N131 PolarHBondContact O-ND2 3.06Å; E129-N131 PolarHBondContact O-N 2.96Å; E129-N131 PolarHBondContact O-ND2 3.43Å; E129-N131 VanDerWaalsContact O-ND2 3.13Å; N131-L133 HydrophobicContact CB-CG 4.43Å; N131-N152 VanDerWaalsContact CA-OD1 3.27Å; N131-N152 WeakPolarHBondContact CA-OD1 3.39Å; N131-N152 WeakPolarHBondContact CB-OD1 3.41Å; N131-N152 PolarHBondContact N-OD1 3.31Å; N131-N152 PolarHBondContact O-OD1 3.37Å; N131-N152 VanDerWaalsContact O-OD1 3.13Å
132	E	98.7	Very high	98.2	Very high	70 Å²	70	38.2 Å²	38.2	33%	0.327	19%	0.185	S	C	.	.			trans	-113.9	30.1	-176.6	-58.4	-156.1	-150.9	0	0	112.7	I107 T108 E134 N152 K153	I107-E132 CarbonylContact O-C 3.49Å; I107-E132 VanDerWaalsContact O-C 3.27Å; I107-E132 WeakPolarHBondContact O-CA 3.23Å; I107-E132 PolarHBondContact O-N 2.85Å; T108-E132 HydrophobicContact CG2-CB 3.92Å; E132-E134 PolarHBondContact O-N 3.37Å; E132-N152 PolarHBondContact N-OD1 3.22Å; E132-K153 IonicContact OE2-NZ 3.87Å; E132-K153 PolarHBondContact OE2-NZ 2.96Å
133	L	98.8	Very high	98.2	Very high	0 Å²	0	35 Å²	35	0%	0	17%	0.173	C	C	.	.			trans	-71	127.9	179.9	-59.3	171.7	0	0	0	110.9	I107 N109 I112 L128 N131 P137 L149 N152 K153 V154	I107-L133 HydrophobicContact CG2-CD2 4.17Å; I107-L133 PolarHBondContact O-N 3.03Å; N109-L133 WeakPolarHBondContact OD1-CA 3.1Å; I112-L133 HydrophobicContact CD1-CD2 3.87Å; L128-L133 HydrophobicContact CB-CD1 4.14Å; L128-L133 HydrophobicContact CD1-CD1 4.27Å; N131-L133 HydrophobicContact CB-CG 4.43Å; L133-P137 HydrophobicContact CD1-CG 3.94Å; L133-P137 HydrophobicContact CD2-CG 4.3Å; L133-L149 HydrophobicContact CD1-CD2 3.51Å; L133-N152 HydrophobicContact CB-CB 4.18Å; L133-N152 WeakPolarHBondContact CB-OD1 3.37Å; L133-N152 WeakPolarHBondContact CG-OD1 3.37Å; L133-N152 PolarHBondContact N-OD1 3.1Å; L133-K153 CarbonylContact O-C 3.3Å; L133-K153 WeakPolarHBondContact O-CA 3.37Å; L133-K153 WeakPolarHBondContact O-CB 3.44Å; L133-K153 PolarHBondContact O-N 2.94Å; L133-V154 HydrophobicContact CB-CG2 4.1Å; L133-V154 PolarHBondContact O-N 3.2Å
134	E	98.6	Very high	98.2	Very high	106 Å²	106	35 Å²	35	50%	0.495	17%	0.173	S	C	.	.	S	Bend	trans	-98.2	-18.6	176.2	-61.5	-170.9	173	0	0	112.8	N109 E132 K153 V154 S155	N109-E134 PolarHBondContact OD1-N 2.83Å; E132-E134 PolarHBondContact O-N 3.37Å; E134-K153 HydrophobicContact CG-CB 4.3Å; E134-V154 CarbonylContact O-C 3.23Å; E134-V154 VanDerWaalsContact O-CA 3.32Å; E134-V154 WeakPolarHBondContact O-CA 3.08Å; E134-S155 PolarHBondContact O-N 2.82Å; E134-S155 PolarHBondContact O-OG 2.99Å
135	E	98.3	Very high	98.2	Very high	54 Å²	54	36.8 Å²	36.8	25%	0.252	18%	0.18	S	C	.	.	B	Isolated β-bridge	trans	-135.9	158.3	174.6	-45.6	-166.3	164.3	0	0	110.5	N109 P137 R156 P158	N109-E135 PolarHBondContact ND2-O 2.89Å; N109-E135 PolarHBondContact OD1-N 3.43Å; E135-P137 WeakPolarHBondContact O-CD 3.37Å; E135-R156 VanDerWaalsContact CA-O 3.3Å; E135-R156 WeakPolarHBondContact CA-O 3.39Å; E135-R156 HydrophobicContact CB-CB 4.45Å; E135-R156 HydrophobicContact CG-CB 4.02Å; E135-R156 WeakPolarHBondContact OE1-CD 3.42Å; E135-R156 IonicContact OE1-CZ 3.02Å; E135-R156 IonicContact OE1-NE 3.68Å; E135-R156 IonicContact OE1-NH1 3.22Å; E135-R156 PolarHBondContact OE1-NH1 3Å; E135-P158 HydrophobicContact CB-CG 4.34Å
136	V	98.3	Very high	98.2	Very high	1 Å²	1	37.3 Å²	37.3	1%	0.006	18%	0.183	C	C	.	.			trans	-64.4	127.2	169.9	-178.8	0	0	0	0	109.1	L140 L149 V154 R156 I157 P158 T161 F162 L173	V136-L140 HydrophobicContact CG1-CD1 4.37Å; V136-L149 HydrophobicContact CG1-CD1 3.9Å; V136-L149 HydrophobicContact CG2-CD1 4.3Å; V136-V154 HydrophobicContact CG2-CG1 3.86Å; V136-R156 PolarHBondContact N-O 3.3Å; V136-R156 VanDerWaalsContact N-O 3.12Å; V136-I157 HydrophobicContact CG2-CB 4.43Å; V136-I157 HydrophobicContact CG2-CG1 3.88Å; V136-I157 HydrophobicContact CG2-CG2 4.34Å; V136-P158 WeakPolarHBondContact O-CD 3.39Å; V136-T161 HydrophobicContact CB-CG2 4.28Å; V136-T161 HydrophobicContact CG1-CG2 3.66Å; V136-F162 HydrophobicContact CG1-CE1 3.83Å; V136-F162 HydrophobicContact CG1-CZ 3.96Å; V136-F162 HydrophobicContact CG2-CZ 4.28Å; V136-L173 HydrophobicContact CG2-CD2 4.02Å
137	P	97.3	Very high	98.2	Very high	3 Å²	3	37.3 Å²	37.3	2%	0.019	18%	0.183	C	C	.	.			trans	-57	140	177.6	-24.2	33.8	0	0	0	111.8	I112 L117 L128 L133 E135 L140 L149	I112-P137 HydrophobicContact CD1-CB 3.83Å; I112-P137 HydrophobicContact CD1-CG 3.72Å; L117-P137 HydrophobicContact CD1-CB 4.15Å; L128-P137 HydrophobicContact CD1-CG 4.25Å; L133-P137 HydrophobicContact CD1-CG 3.94Å; L133-P137 HydrophobicContact CD2-CG 4.3Å; E135-P137 WeakPolarHBondContact O-CD 3.37Å; P137-L140 HydrophobicContact CB-CD2 4.32Å; P137-L140 WeakPolarHBondContact O-CD1 3.24Å; P137-L140 VanDerWaalsContact O-CG 3.27Å; P137-L140 WeakPolarHBondContact O-CG 3.42Å; P137-L149 HydrophobicContact CG-CD2 4.47Å
138	S	95.3	Very high	98.2	Very high	64 Å²	64	37.7 Å²	37.7	45%	0.448	19%	0.185	S	C	.	.	S	Bend	trans	-152.9	137.4	-179.1	-171.6	0	0	0	0	110.2	T161	S138-T161 PolarHBondContact OG-OG1 3.02Å
139	P	96.1	Very high	98.2	Very high	60 Å²	60	37.7 Å²	37.7	39%	0.39	19%	0.185	S	C	.	.	S	Bend	cis	-77.7	151.9	0	31.1	-34.3	0	0	0	113.6
140	L	97.4	Very high	98.2	Very high	12 Å²	12	36.4 Å²	36.4	6%	0.063	18%	0.179	C	C	.	.			trans	-104.4	152.6	174.7	-70	166.3	0	0	0	111.4	L117 L126 V136 P137 L144 L147 T161 F162 L165	L117-L140 HydrophobicContact CD1-CD2 4.32Å; L126-L140 HydrophobicContact CD2-CD2 4.16Å; V136-L140 HydrophobicContact CG1-CD1 4.37Å; P137-L140 HydrophobicContact CB-CD2 4.32Å; P137-L140 WeakPolarHBondContact O-CD1 3.24Å; P137-L140 VanDerWaalsContact O-CG 3.27Å; P137-L140 WeakPolarHBondContact O-CG 3.42Å; L140-L144 HydrophobicContact CB-CD1 4.01Å; L140-L144 HydrophobicContact CD2-CD1 4.18Å; L140-L144 HydrophobicContact CG-CD1 4.48Å; L140-L147 HydrophobicContact CD1-CD2 3.61Å; L140-T161 HydrophobicContact CD1-CG2 4.06Å; L140-F162 HydrophobicContact CD1-CE1 4.49Å; L140-L165 HydrophobicContact CB-CD1 4.21Å; L140-L165 HydrophobicContact CB-CD2 4.12Å; L140-L165 HydrophobicContact CD1-CD1 3.84Å
141	P	96.9	Very high	98.2	Very high	1 Å²	1	38.5 Å²	38.5	1%	0.006	18%	0.184	C	C	.	.			trans	-66.7	134.6	175.6	18.1	-21.8	0	0	0	111.7	L117 L120 L123 S143 L144 L165	L117-P141 WeakPolarHBondContact O-CD 3.43Å; L117-P141 VanDerWaalsContact O-CG 3.24Å; L117-P141 WeakPolarHBondContact O-CG 3.41Å; L120-P141 VanDerWaalsContact O-CB 3.29Å; L120-P141 WeakPolarHBondContact O-CB 3.27Å; L123-P141 HydrophobicContact CB-CB 4.5Å; L123-P141 HydrophobicContact CB-CG 4.08Å; L123-P141 HydrophobicContact CD2-CG 3.78Å; L123-P141 HydrophobicContact CG-CG 4.47Å; P141-S143 PolarHBondContact O-N 3.2Å; P141-L144 HydrophobicContact CG-CD1 4.08Å; P141-L144 HydrophobicContact CG-CD2 4.48Å; P141-L144 HydrophobicContact CG-CG 3.97Å; P141-L144 WeakPolarHBondContact O-CG 3.32Å; P141-L144 PolarHBondContact O-N 3.1Å; P141-L165 VanDerWaalsContact O-CD2 3.32Å; P141-L165 WeakPolarHBondContact O-CD2 3.31Å
142	R	97.4	Very high	98.2	Very high	174 Å²	174	38.6 Å²	38.6	66%	0.657	19%	0.185	S	C	*	.	T	Hydrogen-bonded Turn	trans	-67.1	-19.8	-173.6	-61.5	-177.1	-174.5	174.4	0.5	114.2	L144 N164	R142-L144 VanDerWaalsContact C-N 3.29Å; R142-N164 HydrophobicContact CG-CB 3.98Å
143	S	98.4	Very high	98.2	Very high	17 Å²	17	38.8 Å²	38.8	12%	0.119	18%	0.184	C	C	.	.	T	Hydrogen-bonded Turn	trans	-76.9	-11	179.9	38.7	0	0	0	0	113.9	K121 L123 L124 P141 E145	K121-S143 VanDerWaalsContact C-OG 3.28Å; K121-S143 WeakPolarHBondContact O-CB 3.44Å; K121-S143 PolarHBondContact O-OG 3.15Å; L123-S143 PolarHBondContact N-OG 3.12Å; L123-S143 CarbonylContact O-C 3.56Å; L123-S143 VanDerWaalsContact O-C 3.23Å; L123-S143 WeakPolarHBondContact O-CB 3.44Å; L123-S143 PolarHBondContact O-OG 2.8Å; L124-S143 WeakPolarHBondContact CD2-O 3.47Å; P141-S143 PolarHBondContact O-N 3.2Å; S143-E145 PolarHBondContact O-N 3.13Å
144	L	98.7	Very high	98.2	Very high	0 Å²	0	38.8 Å²	38.8	0%	0	18%	0.184	C	C	.	.			trans	-56	131.3	-175.9	-78.6	174.1	0	0	0	112.5	L123 L126 L140 P141 R142 N167 L168	L123-L144 HydrophobicContact CD2-CD2 4.02Å; L123-L144 HydrophobicContact CG-CD2 3.96Å; L123-L144 WeakPolarHBondContact O-CA 3.19Å; L123-L144 PolarHBondContact O-N 2.9Å; L126-L144 HydrophobicContact CB-CD2 3.83Å; L140-L144 HydrophobicContact CB-CD1 4.01Å; L140-L144 HydrophobicContact CD2-CD1 4.18Å; L140-L144 HydrophobicContact CG-CD1 4.48Å; P141-L144 HydrophobicContact CG-CD1 4.08Å; P141-L144 HydrophobicContact CG-CD2 4.48Å; P141-L144 HydrophobicContact CG-CG 3.97Å; P141-L144 WeakPolarHBondContact O-CG 3.32Å; P141-L144 PolarHBondContact O-N 3.1Å; R142-L144 VanDerWaalsContact C-N 3.29Å; L144-N167 CarbonylContact O-C 3.13Å; L144-N167 VanDerWaalsContact O-C 3.26Å; L144-L168 HydrophobicContact CB-CD1 3.94Å; L144-L168 VanDerWaalsContact O-CA 3.3Å; L144-L168 WeakPolarHBondContact O-CA 3.24Å; L144-L168 PolarHBondContact O-N 3.02Å; L144-L168 VanDerWaalsContact O-N 3.12Å
145	E	98.8	Very high	98.1	Very high	69 Å²	69	35.7 Å²	35.7	32%	0.322	17%	0.174	S	C	.	.	S	Bend	trans	-104.5	-33	172.5	-66.6	-178.5	-171.5	0	0	111.3	L124 S143 N167 T169 L170	L124-E145 HydrophobicContact CB-CG 4.45Å; L124-E145 HydrophobicContact CD2-CG 4.2Å; L124-E145 PolarHBondContact O-N 3.45Å; S143-E145 PolarHBondContact O-N 3.13Å; E145-N167 HydrophobicContact CG-CB 4.45Å; E145-T169 PolarHBondContact O-N 2.81Å; E145-T169 PolarHBondContact O-OG1 3.14Å; E145-L170 PolarHBondContact O-N 2.93Å
146	Q	98.9	Very high	98.1	Very high	52 Å²	52	40.3 Å²	40.3	24%	0.243	19%	0.189	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-136.7	131.3	177.9	-55.2	-166	1.1	0	0	112.3	L124 F125 L126 L170	L124-Q146 PolarHBondContact O-N 3.32Å; F125-Q146 HydrophobicContact CD1-CB 3.77Å; F125-Q146 HydrophobicContact CD1-CG 3.68Å; F125-Q146 HydrophobicContact CE1-CB 4.3Å; F125-Q146 VanDerWaalsContact CE1-CD 3.47Å; F125-Q146 HydrophobicContact CE1-CG 3.68Å; L126-Q146 PolarHBondContact N-O 2.86Å; L126-Q146 VanDerWaalsContact N-O 3.1Å; Q146-L170 HydrophobicContact CB-CB 4.37Å; Q146-L170 HydrophobicContact CG-CB 4.02Å
147	L	98.9	Very high	98.1	Very high	0 Å²	0	40.8 Å²	40.8	0%	0	19%	0.192	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-126.3	116.2	175.3	179.5	59.9	0	0	0	109.8	L126 L140 L149 F162 L168 L170 L171 D172	L126-L147 HydrophobicContact CB-CD1 4.24Å; L126-L147 HydrophobicContact CD2-CD1 4.01Å; L126-L147 HydrophobicContact CG-CD1 4.19Å; L140-L147 HydrophobicContact CD1-CD2 3.61Å; L147-L149 HydrophobicContact CD1-CD1 4.11Å; L147-L149 HydrophobicContact CD1-CD2 4.47Å; L147-L149 HydrophobicContact CD1-CG 4.03Å; L147-L149 HydrophobicContact CD2-CD1 3.74Å; L147-L149 HydrophobicContact CG-CD1 3.77Å; L147-L149 HydrophobicContact CG-CG 4.01Å; L147-F162 HydrophobicContact CD2-CE1 4.35Å; L147-L168 HydrophobicContact CB-CD1 3.96Å; L147-L170 PolarHBondContact N-O 3.38Å; L147-L171 HydrophobicContact CB-CD1 4.13Å; L147-L171 HydrophobicContact CD2-CD1 3.88Å; L147-L171 HydrophobicContact CG-CD1 4.08Å; L147-D172 PolarHBondContact O-N 3.41Å
148	Q	98.9	Very high	98	Very high	28 Å²	28	42.5 Å²	42.5	13%	0.131	20%	0.203	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-113.2	107.9	-176.5	-67.8	-90.3	5.9	0	0	109.3	L126 F127 L128 E129 L170	L126-Q148 PolarHBondContact O-N 2.99Å; F127-Q148 HydrophobicContact CD1-CB 3.86Å; F127-Q148 HydrophobicContact CD1-CG 3.67Å; F127-Q148 HydrophobicContact CE1-CG 3.88Å; L128-Q148 CarbonylContact C-O 3.49Å; L128-Q148 WeakPolarHBondContact CA-O 3.41Å; L128-Q148 PolarHBondContact N-O 2.82Å; E129-Q148 HydrophobicContact CG-CB 3.95Å; E129-Q148 PolarHBondContact N-O 3.34Å; Q148-L170 HydrophobicContact CG-CD2 4.31Å
149	L	98.9	Very high	98	Very high	0 Å²	0	46.2 Å²	46.2	0%	0	21%	0.213	C	C	.	.			trans	-123.3	18.6	-176.3	-70.2	164.8	0	0	0	111.9	L128 L133 V136 P137 L147 N152 D172 L173 N176	L128-L149 HydrophobicContact CB-CD2 3.76Å; L128-L149 HydrophobicContact CD1-CD2 4.02Å; L133-L149 HydrophobicContact CD1-CD2 3.51Å; V136-L149 HydrophobicContact CG1-CD1 3.9Å; V136-L149 HydrophobicContact CG2-CD1 4.3Å; P137-L149 HydrophobicContact CG-CD2 4.47Å; L147-L149 HydrophobicContact CD1-CD1 4.11Å; L147-L149 HydrophobicContact CD1-CD2 4.47Å; L147-L149 HydrophobicContact CD1-CG 4.03Å; L147-L149 HydrophobicContact CD2-CD1 3.74Å; L147-L149 HydrophobicContact CG-CD1 3.77Å; L147-L149 HydrophobicContact CG-CG 4.01Å; L149-N152 PolarHBondContact O-ND2 2.86Å; L149-D172 CarbonylContact C-O 3.53Å; L149-D172 WeakPolarHBondContact CA-O 3.42Å; L149-D172 WeakPolarHBondContact CB-O 3.26Å; L149-D172 PolarHBondContact N-O 2.72Å; L149-L173 HydrophobicContact CB-CD2 4.04Å; L149-L173 HydrophobicContact CD1-CD2 3.95Å; L149-N176 PolarHBondContact O-ND2 3.22Å
150	A	98.9	Very high	97.9	Very high	0 Å²	0	45.1 Å²	45.1	0%	0	21%	0.213	C	C	.	.			trans	-61	151.9	-177.8	0	0	0	0	0	112.1	E129 D130 N152 Q174	E129-A150 CarbonylContact C-O 3.43Å; E129-A150 WeakPolarHBondContact CA-O 3.5Å; E129-A150 WeakPolarHBondContact CB-O 3.31Å; E129-A150 HydrophobicContact CG-CB 4.06Å; D130-A150 PolarHBondContact N-O 3.33Å; A150-N152 PolarHBondContact O-N 3.08Å; A150-N152 PolarHBondContact O-ND2 3.19Å; A150-Q174 CarbonylContact C-O 3.58Å; A150-Q174 WeakPolarHBondContact CA-O 3.18Å; A150-Q174 HydrophobicContact CB-CB 4.09Å
151	R	98.9	Very high	97.8	Very high	88 Å²	88	45 Å²	45	33%	0.332	21%	0.212	S	C	.	.	S	Bend	trans	59	46.3	174.6	-51	-175.5	-68	-69.4	-2.9	112.7	E129 D130 Q174 N175	E129-R151 IonicContact OE2-CZ 2.96Å; E129-R151 VanDerWaalsContact OE2-CZ 3.25Å; E129-R151 IonicContact OE2-NH1 2.76Å; E129-R151 PolarHBondContact OE2-NH1 3.16Å; E129-R151 IonicContact OE2-NH2 2.68Å; E129-R151 PolarHBondContact OE2-NH2 3.15Å; D130-R151 VanDerWaalsContact CA-O 3.3Å; D130-R151 WeakPolarHBondContact CA-O 3.47Å; D130-R151 PolarHBondContact N-O 2.83Å; D130-R151 VanDerWaalsContact OD1-CB 3.29Å; D130-R151 WeakPolarHBondContact OD1-CB 3.32Å; D130-R151 VanDerWaalsContact OD1-CD 3.24Å; D130-R151 WeakPolarHBondContact OD1-CD 3.47Å; D130-R151 IonicContact OD1-CZ 3.69Å; D130-R151 IonicContact OD1-NE 2.74Å; D130-R151 PolarHBondContact OD1-NE 2.87Å; D130-R151 IonicContact OD1-NH2 2.73Å; D130-R151 IonicContact OD2-CZ 2.78Å; D130-R151 VanDerWaalsContact OD2-CZ 3.22Å; D130-R151 IonicContact OD2-NE 3.96Å; D130-R151 PolarHBondContact OD2-NE 2.73Å; D130-R151 IonicContact OD2-NH2 3.06Å; D130-R151 PolarHBondContact OD2-NH2 2.95Å; R151-Q174 PolarHBondContact N-O 3.4Å; R151-N175 VanDerWaalsContact CA-O 3.23Å; R151-N175 WeakPolarHBondContact CA-O 3.31Å; R151-N175 HydrophobicContact CG-CB 4Å; R151-N175 PolarHBondContact N-O 3.49Å
152	N	98.9	Very high	97.8	Very high	12 Å²	12	45 Å²	45	6%	0.064	21%	0.213	C	C	.	.	S	Bend	trans	-113.7	-163.3	170.9	-84.8	-86.2	0	0	0	109.8	L128 N131 E132 L133 L149 A150 V154 N175 N176	L128-N152 PolarHBondContact O-ND2 3.37Å; N131-N152 VanDerWaalsContact CA-OD1 3.27Å; N131-N152 WeakPolarHBondContact CA-OD1 3.39Å; N131-N152 WeakPolarHBondContact CB-OD1 3.41Å; N131-N152 PolarHBondContact N-OD1 3.31Å; N131-N152 PolarHBondContact O-OD1 3.37Å; N131-N152 VanDerWaalsContact O-OD1 3.13Å; E132-N152 PolarHBondContact N-OD1 3.22Å; L133-N152 HydrophobicContact CB-CB 4.18Å; L133-N152 WeakPolarHBondContact CB-OD1 3.37Å; L133-N152 WeakPolarHBondContact CG-OD1 3.37Å; L133-N152 PolarHBondContact N-OD1 3.1Å; L149-N152 PolarHBondContact O-ND2 2.86Å; A150-N152 PolarHBondContact O-N 3.08Å; A150-N152 PolarHBondContact O-ND2 3.19Å; N152-V154 HydrophobicContact CB-CG2 3.99Å; N152-N175 PolarHBondContact N-O 3.02Å; N152-N176 VanDerWaalsContact CA-OD1 3.29Å; N152-N176 WeakPolarHBondContact CA-OD1 3.38Å; N152-N176 WeakPolarHBondContact CB-OD1 3.3Å; N152-N176 PolarHBondContact N-OD1 3.35Å; N152-N176 PolarHBondContact O-OD1 3.34Å
153	K	98.7	Very high	97.7	Very high	73 Å²	73	39 Å²	39	32%	0.317	20%	0.197	S	C	.	.			trans	-112.1	22.1	176.2	-59.6	168.6	-173.2	168.1	0	111.2	E132 L133 E134 S155 N176 K177	E132-K153 IonicContact OE2-NZ 3.87Å; E132-K153 PolarHBondContact OE2-NZ 2.96Å; L133-K153 CarbonylContact O-C 3.3Å; L133-K153 WeakPolarHBondContact O-CA 3.37Å; L133-K153 WeakPolarHBondContact O-CB 3.44Å; L133-K153 PolarHBondContact O-N 2.94Å; E134-K153 HydrophobicContact CG-CB 4.3Å; K153-S155 PolarHBondContact O-N 2.82Å; K153-S155 VanDerWaalsContact O-N 3.15Å; K153-N176 PolarHBondContact N-OD1 3.27Å; K153-K177 HydrophobicContact CB-CD 4.32Å
154	V	98.8	Very high	97.5	Very high	0 Å²	0	42.3 Å²	42.3	0%	0	21%	0.214	C	C	.	.			trans	-62.9	117	-169.6	178	0	0	0	0	110.5	L133 E134 V136 N152 N176 K177 L178	L133-V154 HydrophobicContact CB-CG2 4.1Å; L133-V154 PolarHBondContact O-N 3.2Å; E134-V154 CarbonylContact O-C 3.23Å; E134-V154 VanDerWaalsContact O-CA 3.32Å; E134-V154 WeakPolarHBondContact O-CA 3.08Å; V136-V154 HydrophobicContact CG2-CG1 3.86Å; N152-V154 HydrophobicContact CB-CG2 3.99Å; V154-N176 HydrophobicContact CB-CB 4.12Å; V154-N176 VanDerWaalsContact CB-OD1 3.26Å; V154-N176 WeakPolarHBondContact CB-OD1 3.36Å; V154-N176 WeakPolarHBondContact CG2-OD1 3.48Å; V154-N176 PolarHBondContact N-OD1 3.38Å; V154-K177 CarbonylContact O-C 3.5Å; V154-K177 VanDerWaalsContact O-CA 3.32Å; V154-K177 WeakPolarHBondContact O-CA 3.27Å; V154-K177 PolarHBondContact O-N 2.83Å; V154-L178 HydrophobicContact CG1-CD2 4.08Å; V154-L178 PolarHBondContact O-N 3.03Å
155	S	98.3	Very high	97.5	Very high	42 Å²	42	42.4 Å²	42.4	29%	0.294	21%	0.214	S	C	.	.			trans	-116	-14.1	178.2	62.9	0	0	0	0	112.8	E134 K153 A182	E134-S155 PolarHBondContact O-N 2.82Å; E134-S155 PolarHBondContact O-OG 2.99Å; K153-S155 PolarHBondContact O-N 2.82Å; K153-S155 VanDerWaalsContact O-N 3.15Å; S155-A182 WeakPolarHBondContact O-CB 3.09Å
156	R	97.3	Very high	97.5	Very high	150 Å²	150	42.9 Å²	42.9	57%	0.566	22%	0.216	S	C	*	.	B	Isolated β-bridge	trans	-136.4	147	-177.2	-59.7	175.1	67.3	-160.1	7.8	111.6	E135 V136	E135-R156 VanDerWaalsContact CA-O 3.3Å; E135-R156 WeakPolarHBondContact CA-O 3.39Å; E135-R156 HydrophobicContact CB-CB 4.45Å; E135-R156 HydrophobicContact CG-CB 4.02Å; E135-R156 WeakPolarHBondContact OE1-CD 3.42Å; E135-R156 IonicContact OE1-CZ 3.02Å; E135-R156 IonicContact OE1-NE 3.68Å; E135-R156 IonicContact OE1-NH1 3.22Å; E135-R156 PolarHBondContact OE1-NH1 3Å; V136-R156 PolarHBondContact N-O 3.3Å; V136-R156 VanDerWaalsContact N-O 3.12Å
157	I	97.9	Very high	97.4	Very high	12 Å²	12	44.1 Å²	44.1	6%	0.062	23%	0.225	C	C	.	.			trans	-116.1	109.1	170.9	-55.8	173.2	0	0	0	106.2	V136 F162 L178 F183 T187	V136-I157 HydrophobicContact CG2-CB 4.43Å; V136-I157 HydrophobicContact CG2-CG1 3.88Å; V136-I157 HydrophobicContact CG2-CG2 4.34Å; I157-F162 HydrophobicContact CD1-CE2 4.3Å; I157-F162 HydrophobicContact CG2-CD2 4.24Å; I157-F162 HydrophobicContact CG2-CE2 3.7Å; I157-F162 HydrophobicContact CG2-CZ 4.11Å; I157-L178 HydrophobicContact CD1-CD2 4.28Å; I157-L178 HydrophobicContact CG1-CD2 4.17Å; I157-F183 HydrophobicContact CD1-CD1 3.92Å; I157-F183 HydrophobicContact CD1-CE1 3.7Å; I157-T187 HydrophobicContact CB-CG2 4.46Å; I157-T187 HydrophobicContact CD1-CG2 4Å; I157-T187 HydrophobicContact CG2-CG2 3.98Å
158	P	95.9	Very high	97.4	Very high	39 Å²	39	44.1 Å²	44.1	25%	0.253	23%	0.225	S	C	.	.			trans	-57.9	147.6	180	-23.1	32.5	0	0	0	111.6	E135 V136 G160 T161	E135-P158 HydrophobicContact CB-CG 4.34Å; V136-P158 WeakPolarHBondContact O-CD 3.39Å; P158-G160 PolarHBondContact O-N 3.43Å; P158-T161 WeakPolarHBondContact CB-OG1 3.29Å; P158-T161 WeakPolarHBondContact O-CB 3.36Å; P158-T161 PolarHBondContact O-N 3.25Å; P158-T161 PolarHBondContact O-OG1 3.46Å
159	Q	94.5	Very high	97.4	Very high	141 Å²	141	44.8 Å²	44.8	66%	0.659	23%	0.231	S	C	*	.	T	Hydrogen-bonded Turn	trans	-59.2	133.1	-177.7	-179.6	169.8	17.6	0	0	111	T161	Q159-T161 PolarHBondContact O-N 3.03Å
160	G	94.3	Very high	97.4	Very high	37 Å²	37	45.7 Å²	45.7	38%	0.381	24%	0.236	S	C	.	.	T	Hydrogen-bonded Turn	trans	73.1	5.5	176.4	0	0	0	0	0	115.8	P158 F162 S163	P158-G160 PolarHBondContact O-N 3.43Å; G160-F162 PolarHBondContact O-N 3.38Å; G160-F162 VanDerWaalsContact O-N 3.14Å; G160-S163 VanDerWaalsContact CA-OG 3.26Å; G160-S163 WeakPolarHBondContact CA-OG 3.4Å; G160-S163 WeakPolarHBondContact O-CB 3.47Å; G160-S163 PolarHBondContact O-N 3.3Å; G160-S163 PolarHBondContact O-OG 2.88Å
161	T	96.1	Very high	97.4	Very high	9 Å²	9	45.7 Å²	45.7	6%	0.055	24%	0.236	C	C	.	.	T	Hydrogen-bonded Turn	trans	-51.8	-38.1	178.8	-61.3	0	0	0	0	112.6	V136 S138 L140 P158 Q159	V136-T161 HydrophobicContact CB-CG2 4.28Å; V136-T161 HydrophobicContact CG1-CG2 3.66Å; S138-T161 PolarHBondContact OG-OG1 3.02Å; L140-T161 HydrophobicContact CD1-CG2 4.06Å; P158-T161 WeakPolarHBondContact CB-OG1 3.29Å; P158-T161 WeakPolarHBondContact O-CB 3.36Å; P158-T161 PolarHBondContact O-N 3.25Å; P158-T161 PolarHBondContact O-OG1 3.46Å; Q159-T161 PolarHBondContact O-N 3.03Å
162	F	97.4	Very high	97.4	Very high	2 Å²	2	42.1 Å²	42.1	1%	0.009	22%	0.223	C	C	.	.	T	Hydrogen-bonded Turn	trans	-100.5	2.5	-177.9	-57.5	-37.1	0	0	0	114.5	V136 L140 L147 I157 G160 N164 L165 L171 T187 F188 G190 L191	V136-F162 HydrophobicContact CG1-CE1 3.83Å; V136-F162 HydrophobicContact CG1-CZ 3.96Å; V136-F162 HydrophobicContact CG2-CZ 4.28Å; L140-F162 HydrophobicContact CD1-CE1 4.49Å; L147-F162 HydrophobicContact CD2-CE1 4.35Å; I157-F162 HydrophobicContact CD1-CE2 4.3Å; I157-F162 HydrophobicContact CG2-CD2 4.24Å; I157-F162 HydrophobicContact CG2-CE2 3.7Å; I157-F162 HydrophobicContact CG2-CZ 4.11Å; G160-F162 PolarHBondContact O-N 3.38Å; G160-F162 VanDerWaalsContact O-N 3.14Å; F162-N164 PolarHBondContact O-N 2.99Å; F162-N164 VanDerWaalsContact O-N 3.09Å; F162-L165 HydrophobicContact CD1-CD1 3.82Å; F162-L165 PolarHBondContact O-N 3.35Å; F162-L171 HydrophobicContact CE1-CD2 4.27Å; F162-L171 HydrophobicContact CE2-CD2 3.86Å; F162-L171 HydrophobicContact CZ-CD1 4.34Å; F162-L171 HydrophobicContact CZ-CD2 3.69Å; F162-T187 WeakPolarHBondContact CB-O 3.2Å; F162-T187 HydrophobicContact CD2-CG2 4.09Å; F162-T187 WeakPolarHBondContact CD2-O 3.21Å; F162-T187 HydrophobicContact CE2-CG2 4.25Å; F162-F188 HydrophobicContact CD2-CD1 4.21Å; F162-F188 HydrophobicContact CE2-CD1 4.43Å; F162-F188 HydrophobicContact CE2-CE1 4.28Å; F162-G190 WeakPolarHBondContact O-CA 3.38Å; F162-L191 HydrophobicContact CB-CD1 4.29Å; F162-L191 HydrophobicContact CB-CD2 3.74Å; F162-L191 HydrophobicContact CB-CG 3.92Å; F162-L191 HydrophobicContact CD2-CD1 4.23Å; F162-L191 HydrophobicContact CG-CD1 4.27Å; F162-L191 HydrophobicContact CG-CD2 4.21Å; F162-L191 HydrophobicContact CG-CG 4.41Å
163	S	94.6	Very high	97.4	Very high	48 Å²	48	41.6 Å²	41.6	34%	0.336	22%	0.22	S	C	.	.	T	Hydrogen-bonded Turn	trans	-60.7	-26.6	-169.7	-70.9	0	0	0	0	114.7	G160 G190	G160-S163 VanDerWaalsContact CA-OG 3.26Å; G160-S163 WeakPolarHBondContact CA-OG 3.4Å; G160-S163 WeakPolarHBondContact O-CB 3.47Å; G160-S163 PolarHBondContact O-N 3.3Å; G160-S163 PolarHBondContact O-OG 2.88Å; S163-G190 WeakPolarHBondContact O-CA 3.3Å
164	N	94.6	Very high	97.4	Very high	86 Å²	86	40.5 Å²	40.5	46%	0.46	22%	0.216	S	C	.	.	T	Hydrogen-bonded Turn	trans	-119.6	14.4	-175.7	-59.9	-55.8	0	0	0	113.4	R142 F162 E166	R142-N164 HydrophobicContact CG-CB 3.98Å; F162-N164 PolarHBondContact O-N 2.99Å; F162-N164 VanDerWaalsContact O-N 3.09Å; N164-E166 VanDerWaalsContact C-N 3.28Å; N164-E166 PolarHBondContact O-N 2.99Å
165	L	98.1	Very high	97.4	Very high	2 Å²	2	44 Å²	44	1%	0.01	24%	0.235	C	C	.	.			trans	-93.1	58.6	-179.7	-55.4	-171.5	0	0	0	110.6	L140 P141 F162 N167 L168 L191	L140-L165 HydrophobicContact CB-CD1 4.21Å; L140-L165 HydrophobicContact CB-CD2 4.12Å; L140-L165 HydrophobicContact CD1-CD1 3.84Å; P141-L165 VanDerWaalsContact O-CD2 3.32Å; P141-L165 WeakPolarHBondContact O-CD2 3.31Å; F162-L165 HydrophobicContact CD1-CD1 3.82Å; F162-L165 PolarHBondContact O-N 3.35Å; L165-N167 PolarHBondContact O-N 2.87Å; L165-L168 HydrophobicContact CB-CB 4.1Å; L165-L168 HydrophobicContact CD1-CD2 4.35Å; L165-L168 WeakPolarHBondContact O-CB 3.21Å; L165-L168 PolarHBondContact O-N 3.48Å; L165-L191 HydrophobicContact CB-CD2 3.82Å
166	E	97.9	Very high	97.5	Very high	80 Å²	80	42.7 Å²	42.7	37%	0.374	22%	0.224	S	C	.	.	T	Hydrogen-bonded Turn	trans	-65.8	-28.7	-174	-57	-164.1	-179	0	0	112.5	N164 L168 G190 K192 N193	N164-E166 VanDerWaalsContact C-N 3.28Å; N164-E166 PolarHBondContact O-N 2.99Å; E166-L168 VanDerWaalsContact C-N 3.33Å; E166-G190 WeakPolarHBondContact CA-O 3.38Å; E166-K192 HydrophobicContact CG-CD 4.2Å; E166-K192 WeakPolarHBondContact OE1-CE 3.39Å; E166-K192 IonicContact OE1-NZ 3.65Å; E166-K192 PolarHBondContact OE1-NZ 2.85Å; E166-K192 WeakPolarHBondContact OE2-CD 3.32Å; E166-K192 IonicContact OE2-NZ 3.43Å; E166-K192 PolarHBondContact OE2-NZ 3.23Å; E166-N193 VanDerWaalsContact O-CB 3.3Å; E166-N193 WeakPolarHBondContact O-CB 3.5Å; E166-N193 PolarHBondContact O-N 3.37Å; E166-N193 PolarHBondContact O-ND2 2.76Å
167	N	98.4	Very high	97.5	Very high	78 Å²	78	41.2 Å²	41.2	42%	0.417	22%	0.222	S	C	.	.	T	Hydrogen-bonded Turn	trans	-82.6	-8.7	-179.3	-67.4	-3.8	0	0	0	113.5	L144 E145 L165 T169	L144-N167 CarbonylContact O-C 3.13Å; L144-N167 VanDerWaalsContact O-C 3.26Å; E145-N167 HydrophobicContact CG-CB 4.45Å; L165-N167 PolarHBondContact O-N 2.87Å; N167-T169 PolarHBondContact O-N 3.22Å
168	L	98.8	Very high	97.6	Very high	0 Å²	0	40.7 Å²	40.7	0%	0	22%	0.219	C	C	.	.			trans	-67.8	120.1	-174.7	-162.2	77.2	0	0	0	110	L144 L147 L165 E166 L171 L191 N193 L194	L144-L168 HydrophobicContact CB-CD1 3.94Å; L144-L168 VanDerWaalsContact O-CA 3.3Å; L144-L168 WeakPolarHBondContact O-CA 3.24Å; L144-L168 PolarHBondContact O-N 3.02Å; L144-L168 VanDerWaalsContact O-N 3.12Å; L147-L168 HydrophobicContact CB-CD1 3.96Å; L165-L168 HydrophobicContact CB-CB 4.1Å; L165-L168 HydrophobicContact CD1-CD2 4.35Å; L165-L168 WeakPolarHBondContact O-CB 3.21Å; L165-L168 PolarHBondContact O-N 3.48Å; E166-L168 VanDerWaalsContact C-N 3.33Å; L168-L171 HydrophobicContact CD2-CB 4.08Å; L168-L191 HydrophobicContact CB-CD2 4.08Å; L168-L191 HydrophobicContact CD2-CD2 3.73Å; L168-N193 CarbonylContact O-C 3.42Å; L168-L194 HydrophobicContact CD2-CD1 4.16Å; L168-L194 HydrophobicContact CG-CD1 4.24Å; L168-L194 WeakPolarHBondContact O-CA 3.24Å; L168-L194 PolarHBondContact O-N 3.19Å
169	T	98.9	Very high	97.7	Very high	41 Å²	41	41.4 Å²	41.4	25%	0.252	22%	0.223	S	C	.	.			trans	-104.2	-28	-179.9	61.8	0	0	0	0	112.3	E145 N167 M195 Q196	E145-T169 PolarHBondContact O-N 2.81Å; E145-T169 PolarHBondContact O-OG1 3.14Å; N167-T169 PolarHBondContact O-N 3.22Å; T169-M195 PolarHBondContact O-N 3.04Å; T169-Q196 PolarHBondContact O-N 3.2Å
170	L	98.9	Very high	97.8	Very high	20 Å²	20	37.1 Å²	37.1	11%	0.105	20%	0.204	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-132.7	127.5	179.6	-173.4	156.2	0	0	0	111	E145 Q146 L147 Q148 D172 Q196	E145-L170 PolarHBondContact O-N 2.93Å; Q146-L170 HydrophobicContact CB-CB 4.37Å; Q146-L170 HydrophobicContact CG-CB 4.02Å; L147-L170 PolarHBondContact N-O 3.38Å; Q148-L170 HydrophobicContact CG-CD2 4.31Å; L170-D172 HydrophobicContact CD2-CB 4.15Å; L170-Q196 HydrophobicContact CG-CB 4.32Å; L170-Q196 HydrophobicContact CG-CG 4.4Å
171	L	98.9	Very high	97.9	Very high	0 Å²	0	42 Å²	42	0%	0	22%	0.222	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-125.5	115.6	169.8	177.1	57.5	0	0	0	109.5	L147 F162 L168 L173 F188 L191 L194 Q196 L197 N198	L147-L171 HydrophobicContact CB-CD1 4.13Å; L147-L171 HydrophobicContact CD2-CD1 3.88Å; L147-L171 HydrophobicContact CG-CD1 4.08Å; F162-L171 HydrophobicContact CE1-CD2 4.27Å; F162-L171 HydrophobicContact CE2-CD2 3.86Å; F162-L171 HydrophobicContact CZ-CD1 4.34Å; F162-L171 HydrophobicContact CZ-CD2 3.69Å; L168-L171 HydrophobicContact CD2-CB 4.08Å; L171-L173 HydrophobicContact CD1-CD1 4.31Å; L171-L173 HydrophobicContact CD1-CG 4.12Å; L171-L173 HydrophobicContact CD2-CD1 3.95Å; L171-L173 HydrophobicContact CG-CD1 4.03Å; L171-L173 HydrophobicContact CG-CG 4.16Å; L171-F188 HydrophobicContact CD2-CE1 4.44Å; L171-L191 HydrophobicContact CD2-CD1 4.21Å; L171-L194 HydrophobicContact CB-CD1 3.9Å; L171-Q196 PolarHBondContact N-O 3.35Å; L171-L197 HydrophobicContact CB-CD1 3.96Å; L171-L197 HydrophobicContact CD2-CD1 3.83Å; L171-L197 HydrophobicContact CG-CD1 3.92Å; L171-N198 PolarHBondContact O-N 3.28Å
172	D	98.9	Very high	97.9	Very high	13 Å²	13	41.9 Å²	41.9	7%	0.07	22%	0.222	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-108.7	115.5	175	-158.3	-32.3	0	0	0	111.5	L147 L149 L170 Q174 N198	L147-D172 PolarHBondContact O-N 3.41Å; L149-D172 CarbonylContact C-O 3.53Å; L149-D172 WeakPolarHBondContact CA-O 3.42Å; L149-D172 WeakPolarHBondContact CB-O 3.26Å; L149-D172 PolarHBondContact N-O 2.72Å; L170-D172 HydrophobicContact CD2-CB 4.15Å; D172-Q174 WeakPolarHBondContact OD1-CB 3.43Å; D172-Q174 PolarHBondContact OD1-N 2.94Å; D172-N198 HydrophobicContact CB-CB 4.43Å; D172-N198 PolarHBondContact OD1-ND2 3.32Å; D172-N198 PolarHBondContact OD2-ND2 3.3Å
173	L	98.9	Very high	97.9	Very high	0 Å²	0	42.7 Å²	42.7	0%	0	23%	0.225	C	C	.	.			trans	-121.2	21.5	176.2	-69.6	164.7	0	0	0	110.9	V136 L149 L171 N176 L178 N198 M199 N202	V136-L173 HydrophobicContact CG2-CD2 4.02Å; L149-L173 HydrophobicContact CB-CD2 4.04Å; L149-L173 HydrophobicContact CD1-CD2 3.95Å; L171-L173 HydrophobicContact CD1-CD1 4.31Å; L171-L173 HydrophobicContact CD1-CG 4.12Å; L171-L173 HydrophobicContact CD2-CD1 3.95Å; L171-L173 HydrophobicContact CG-CD1 4.03Å; L171-L173 HydrophobicContact CG-CG 4.16Å; L173-N176 PolarHBondContact O-ND2 3.26Å; L173-L178 HydrophobicContact CB-CD1 3.93Å; L173-L178 HydrophobicContact CD1-CD1 4.05Å; L173-L178 HydrophobicContact CG-CD1 4.45Å; L173-N198 CarbonylContact C-O 3.06Å; L173-N198 WeakPolarHBondContact CA-O 3.12Å; L173-N198 PolarHBondContact N-O 3.49Å; L173-M199 HydrophobicContact CB-CG 4.16Å; L173-M199 HydrophobicContact CD1-CG 4.36Å; L173-N202 PolarHBondContact O-ND2 3.37Å
174	Q	98.9	Very high	97.7	Very high	51 Å²	51	44 Å²	44	24%	0.238	23%	0.226	C	C	.	.			trans	-59.8	144.8	-178.8	-179.1	-179.1	1.1	0	0	112.2	A150 R151 D172 N176 N198 A200	A150-Q174 CarbonylContact C-O 3.58Å; A150-Q174 WeakPolarHBondContact CA-O 3.18Å; A150-Q174 HydrophobicContact CB-CB 4.09Å; R151-Q174 PolarHBondContact N-O 3.4Å; D172-Q174 WeakPolarHBondContact OD1-CB 3.43Å; D172-Q174 PolarHBondContact OD1-N 2.94Å; Q174-N176 PolarHBondContact O-ND2 3.26Å; Q174-N198 PolarHBondContact N-O 2.65Å; Q174-N198 PolarHBondContact OE1-ND2 3.47Å; Q174-N198 VanDerWaalsContact OE1-ND2 3.1Å; Q174-A200 CarbonylContact C-O 3.51Å; Q174-A200 WeakPolarHBondContact CA-O 3.39Å; Q174-A200 HydrophobicContact CG-CB 4.23Å; Q174-A200 WeakPolarHBondContact CG-O 3.32Å
175	N	98.9	Very high	97.4	Very high	74 Å²	74	48.7 Å²	48.7	40%	0.396	24%	0.237	S	C	.	.	S	Bend	trans	57.1	57.2	174.2	-162.2	28.4	0	0	0	112	R151 N152 A200 K201	R151-N175 VanDerWaalsContact CA-O 3.23Å; R151-N175 WeakPolarHBondContact CA-O 3.31Å; R151-N175 HydrophobicContact CG-CB 4Å; R151-N175 PolarHBondContact N-O 3.49Å; N152-N175 PolarHBondContact N-O 3.02Å; N175-A200 PolarHBondContact N-O 3.35Å; N175-K201 WeakPolarHBondContact CA-O 3.43Å; N175-K201 HydrophobicContact CB-CB 4.06Å; N175-K201 HydrophobicContact CB-CD 4.39Å; N175-K201 PolarHBondContact N-O 3.38Å
176	N	98.9	Very high	97.1	Very high	13 Å²	13	51.7 Å²	51.7	7%	0.07	25%	0.254	C	S	.	.	S	Bend	trans	-125.4	-164.6	176.6	-87.1	-69.2	0	0	0	109.3	L149 N152 K153 V154 L173 Q174 K201 N202	L149-N176 PolarHBondContact O-ND2 3.22Å; N152-N176 VanDerWaalsContact CA-OD1 3.29Å; N152-N176 WeakPolarHBondContact CA-OD1 3.38Å; N152-N176 WeakPolarHBondContact CB-OD1 3.3Å; N152-N176 PolarHBondContact N-OD1 3.35Å; N152-N176 PolarHBondContact O-OD1 3.34Å; K153-N176 PolarHBondContact N-OD1 3.27Å; V154-N176 HydrophobicContact CB-CB 4.12Å; V154-N176 VanDerWaalsContact CB-OD1 3.26Å; V154-N176 WeakPolarHBondContact CB-OD1 3.36Å; V154-N176 WeakPolarHBondContact CG2-OD1 3.48Å; V154-N176 PolarHBondContact N-OD1 3.38Å; L173-N176 PolarHBondContact O-ND2 3.26Å; Q174-N176 PolarHBondContact O-ND2 3.26Å; N176-K201 PolarHBondContact N-O 2.93Å; N176-N202 VanDerWaalsContact CA-OD1 3.31Å; N176-N202 WeakPolarHBondContact CA-OD1 3.24Å; N176-N202 WeakPolarHBondContact CB-OD1 3.3Å; N176-N202 PolarHBondContact N-OD1 3.34Å; N176-N202 PolarHBondContact O-OD1 3.49Å
177	K	98.7	Very high	97	Very high	120 Å²	120	48.5 Å²	48.5	52%	0.522	24%	0.24	S	C	.	.			trans	-115.4	29.4	-178.5	-61.1	-176.3	179	178.8	0	112.1	K153 V154 V179 N202	K153-K177 HydrophobicContact CB-CD 4.32Å; V154-K177 CarbonylContact O-C 3.5Å; V154-K177 VanDerWaalsContact O-CA 3.32Å; V154-K177 WeakPolarHBondContact O-CA 3.27Å; V154-K177 PolarHBondContact O-N 2.83Å; K177-V179 PolarHBondContact O-N 2.78Å; K177-N202 PolarHBondContact N-OD1 3.4Å
178	L	98.7	Very high	96.9	Very high	0 Å²	0	45 Å²	45	0%	0	22%	0.221	C	C	.	.			trans	-66.9	134.7	-179.3	-64.6	170.3	0	0	0	110.4	V154 I157 L173 A182 F183 M199 N202 A203 L204	V154-L178 HydrophobicContact CG1-CD2 4.08Å; V154-L178 PolarHBondContact O-N 3.03Å; I157-L178 HydrophobicContact CD1-CD2 4.28Å; I157-L178 HydrophobicContact CG1-CD2 4.17Å; L173-L178 HydrophobicContact CB-CD1 3.93Å; L173-L178 HydrophobicContact CD1-CD1 4.05Å; L173-L178 HydrophobicContact CG-CD1 4.45Å; L178-A182 HydrophobicContact CD2-CB 3.84Å; L178-F183 HydrophobicContact CB-CZ 4.29Å; L178-F183 HydrophobicContact CD1-CZ 4.19Å; L178-M199 HydrophobicContact CD1-CG 4.48Å; L178-N202 HydrophobicContact CB-CB 4.11Å; L178-N202 VanDerWaalsContact CB-OD1 3.31Å; L178-N202 WeakPolarHBondContact CB-OD1 3.3Å; L178-N202 PolarHBondContact N-OD1 3.29Å; L178-A203 CarbonylContact O-C 3.2Å; L178-A203 WeakPolarHBondContact O-CA 3.2Å; L178-A203 PolarHBondContact O-N 3.24Å; L178-L204 HydrophobicContact CB-CD2 4.14Å
179	V	98.4	Very high	96.6	Very high	54 Å²	54	53 Å²	53	33%	0.327	26%	0.256	S	S	.	.			trans	-126.7	169.3	171.6	-62	0	0	0	0	108.7	K177 N181 A182 F183 A203	K177-V179 PolarHBondContact O-N 2.78Å; V179-N181 WeakPolarHBondContact CG2-OD1 3.4Å; V179-N181 PolarHBondContact O-N 3.48Å; V179-N181 VanDerWaalsContact O-N 3.1Å; V179-A182 WeakPolarHBondContact O-CB 3.35Å; V179-A182 PolarHBondContact O-N 3.33Å; V179-F183 WeakPolarHBondContact O-CE2 3.38Å; V179-A203 HydrophobicContact CG1-CB 3.89Å
180	D	97.4	Very high	96.4	Very high	51 Å²	51	51.3 Å²	51.3	27%	0.273	25%	0.247	S	C	.	.	G	3₁₀ helix	trans	-57.5	-32.1	-171.5	-56	-19.1	0	0	0	114.4	A182 F183 R205 N206	D180-A182 PolarHBondContact O-N 2.99Å; D180-F183 WeakPolarHBondContact O-CD2 3.15Å; D180-F183 PolarHBondContact O-N 2.75Å; D180-R205 PolarHBondContact OD1-N 3.29Å; D180-R205 WeakPolarHBondContact OD2-CB 3.14Å; D180-N206 PolarHBondContact OD1-N 2.83Å; D180-N206 VanDerWaalsContact OD1-N 3.15Å; D180-N206 PolarHBondContact OD2-N 3.36Å; D180-N206 PolarHBondContact OD2-ND2 2.85Å
181	N	96.1	Very high	96.4	Very high	139 Å²	139	50.5 Å²	50.5	74%	0.743	24%	0.242	S	C	*	.	G	3₁₀ helix	trans	-77.2	-5.6	179.2	76.4	0.7	0	0	0	114.1	V179 F183	V179-N181 WeakPolarHBondContact CG2-OD1 3.4Å; V179-N181 PolarHBondContact O-N 3.48Å; V179-N181 VanDerWaalsContact O-N 3.1Å; N181-F183 PolarHBondContact O-N 3.01Å
182	A	96.6	Very high	96.3	Very high	7 Å²	7	55.8 Å²	55.8	6%	0.058	27%	0.265	C	S	.	.	G	3₁₀ helix	trans	-69.2	-17.2	172.9	0	0	0	0	0	111.9	S155 L178 V179 D180	S155-A182 WeakPolarHBondContact O-CB 3.09Å; L178-A182 HydrophobicContact CD2-CB 3.84Å; V179-A182 WeakPolarHBondContact O-CB 3.35Å; V179-A182 PolarHBondContact O-N 3.33Å; D180-A182 PolarHBondContact O-N 2.99Å
183	F	96	Very high	96.3	Very high	19 Å²	19	58.8 Å²	58.8	8%	0.083	28%	0.281	C	S	.	.			trans	-105.5	129.5	-178.2	-47.2	-81.9	0	0	0	111.5	I157 L178 V179 D180 N181 T187 F188 M199 L204 P209	I157-F183 HydrophobicContact CD1-CD1 3.92Å; I157-F183 HydrophobicContact CD1-CE1 3.7Å; L178-F183 HydrophobicContact CB-CZ 4.29Å; L178-F183 HydrophobicContact CD1-CZ 4.19Å; V179-F183 WeakPolarHBondContact O-CE2 3.38Å; D180-F183 WeakPolarHBondContact O-CD2 3.15Å; D180-F183 PolarHBondContact O-N 2.75Å; N181-F183 PolarHBondContact O-N 3.01Å; F183-T187 HydrophobicContact CD1-CG2 4.3Å; F183-F188 AromaticContact CD1-CE2 3.78Å; F183-F188 HydrophobicContact CD1-CE2 3.78Å; F183-F188 AromaticContact CD1-CZ 3.65Å; F183-F188 HydrophobicContact CD1-CZ 3.65Å; F183-F188 HydrophobicContact CE1-CE2 4.18Å; F183-F188 AromaticContact CE1-CZ 3.66Å; F183-F188 HydrophobicContact CE1-CZ 3.66Å; F183-M199 HydrophobicContact CE1-SD 3.8Å; F183-M199 HydrophobicContact CZ-SD 3.87Å; F183-L204 HydrophobicContact CE2-CD2 3.46Å; F183-L204 VanDerWaalsContact CE2-CD2 3.46Å; F183-L204 HydrophobicContact CZ-CD2 3.93Å; F183-P209 HydrophobicContact CB-CG 3.93Å
184	Q	91.9	Very high	96.2	Very high	76 Å²	76	58.8 Å²	58.8	36%	0.355	28%	0.281	S	S	.	.			trans	-93.3	165.4	165.5	-61.6	-179.6	-17.7	0	0	109.6	D186 T187	Q184-D186 PolarHBondContact O-N 3.46Å; Q184-T187 PolarHBondContact N-OG1 3.32Å; Q184-T187 PolarHBondContact O-N 2.9Å; Q184-T187 PolarHBondContact O-OG1 3.49Å
185	R	87.8	Confident	96.2	Very high	184 Å²	184	60.4 Å²	60.4	69%	0.694	29%	0.29	S	S	*	.	T	Hydrogen-bonded Turn	trans	-60.7	-18.1	-178	-80.8	-169	-179.7	-146.1	-0.4	114.4	R210	R185-R210 WeakPolarHBondContact O-CD 3.33Å; R185-R210 PolarHBondContact O-NH1 2.78Å
186	D	90.9	Very high	96.2	Very high	65 Å²	65	58.8 Å²	58.8	35%	0.348	28%	0.28	S	S	.	.	T	Hydrogen-bonded Turn	trans	-124.5	13.3	-176.4	60.6	-20.4	0	0	0	112.7	Q184 F188 K189	Q184-D186 PolarHBondContact O-N 3.46Å; D186-F188 PolarHBondContact O-N 3.32Å; D186-F188 VanDerWaalsContact O-N 3.1Å; D186-K189 HydrophobicContact CB-CB 4.09Å; D186-K189 HydrophobicContact CB-CD 4.19Å; D186-K189 VanDerWaalsContact O-CB 3.26Å; D186-K189 WeakPolarHBondContact O-CB 3.44Å; D186-K189 PolarHBondContact O-N 3.28Å
187	T	95.8	Very high	96.2	Very high	14 Å²	14	58.2 Å²	58.2	9%	0.086	28%	0.277	C	S	.	.	T	Hydrogen-bonded Turn	trans	-48.2	-44	-179.3	-69.2	0	0	0	0	112.5	I157 F162 F183 Q184	I157-T187 HydrophobicContact CB-CG2 4.46Å; I157-T187 HydrophobicContact CD1-CG2 4Å; I157-T187 HydrophobicContact CG2-CG2 3.98Å; F162-T187 WeakPolarHBondContact CB-O 3.2Å; F162-T187 HydrophobicContact CD2-CG2 4.09Å; F162-T187 WeakPolarHBondContact CD2-O 3.21Å; F162-T187 HydrophobicContact CE2-CG2 4.25Å; F183-T187 HydrophobicContact CD1-CG2 4.3Å; Q184-T187 PolarHBondContact N-OG1 3.32Å; Q184-T187 PolarHBondContact O-N 2.9Å; Q184-T187 PolarHBondContact O-OG1 3.49Å
188	F	96.7	Very high	96.3	Very high	4 Å²	4	53 Å²	53	2%	0.018	25%	0.254	C	S	.	.	T	Hydrogen-bonded Turn	trans	-99.5	6.6	-176.6	-54	-67.9	0	0	0	114.5	F162 L171 F183 D186 G190 L191 L197 M199 P208 L211 P212	F162-F188 HydrophobicContact CD2-CD1 4.21Å; F162-F188 HydrophobicContact CE2-CD1 4.43Å; F162-F188 HydrophobicContact CE2-CE1 4.28Å; L171-F188 HydrophobicContact CD2-CE1 4.44Å; F183-F188 AromaticContact CD1-CE2 3.78Å; F183-F188 HydrophobicContact CD1-CE2 3.78Å; F183-F188 AromaticContact CD1-CZ 3.65Å; F183-F188 HydrophobicContact CD1-CZ 3.65Å; F183-F188 HydrophobicContact CE1-CE2 4.18Å; F183-F188 AromaticContact CE1-CZ 3.66Å; F183-F188 HydrophobicContact CE1-CZ 3.66Å; D186-F188 PolarHBondContact O-N 3.32Å; D186-F188 VanDerWaalsContact O-N 3.1Å; F188-G190 VanDerWaalsContact C-N 3.27Å; F188-G190 PolarHBondContact O-N 2.84Å; F188-G190 VanDerWaalsContact O-N 3.17Å; F188-L191 HydrophobicContact CB-CD1 4.3Å; F188-L191 HydrophobicContact CD1-CD1 3.78Å; F188-L191 WeakPolarHBondContact O-CB 3.49Å; F188-L191 PolarHBondContact O-N 3.1Å; F188-L191 VanDerWaalsContact O-N 3.1Å; F188-L197 HydrophobicContact CE1-CD2 4.28Å; F188-L197 HydrophobicContact CZ-CD2 4.3Å; F188-M199 HydrophobicContact CZ-CE 4.49Å; F188-M199 HydrophobicContact CZ-SD 4.15Å; F188-P208 HydrophobicContact CE2-CB 4.28Å; F188-L211 HydrophobicContact CD2-CD2 3.87Å; F188-L211 HydrophobicContact CE2-CD2 3.8Å; F188-L211 HydrophobicContact CZ-CD2 4.38Å; F188-P212 HydrophobicContact CB-CG 3.89Å
189	K	92.9	Very high	96.3	Very high	168 Å²	168	53 Å²	53	73%	0.73	25%	0.254	S	S	*	.	T	Hydrogen-bonded Turn	trans	-59.3	-33.7	-169.4	-176	-178.8	176.1	-172.9	0	113.8	D186	D186-K189 HydrophobicContact CB-CB 4.09Å; D186-K189 HydrophobicContact CB-CD 4.19Å; D186-K189 VanDerWaalsContact O-CB 3.26Å; D186-K189 WeakPolarHBondContact O-CB 3.44Å; D186-K189 PolarHBondContact O-N 3.28Å
190	G	95.3	Very high	96.3	Very high	6 Å²	6	50.6 Å²	50.6	6%	0.062	24%	0.24	C	C	.	.	T	Hydrogen-bonded Turn	trans	-80	-12.3	-179	0	0	0	0	0	115.1	F162 S163 E166 F188 K192	F162-G190 WeakPolarHBondContact O-CA 3.38Å; S163-G190 WeakPolarHBondContact O-CA 3.3Å; E166-G190 WeakPolarHBondContact CA-O 3.38Å; F188-G190 VanDerWaalsContact C-N 3.27Å; F188-G190 PolarHBondContact O-N 2.84Å; F188-G190 VanDerWaalsContact O-N 3.17Å; G190-K192 PolarHBondContact O-N 3.47Å
191	L	97.9	Very high	96.4	Very high	2 Å²	2	52.9 Å²	52.9	1%	0.01	25%	0.248	C	C	.	.			trans	-83.1	59.4	-171.5	-59.2	-173.8	0	0	0	112.5	F162 L165 L168 L171 F188 N193 L194 P212	F162-L191 HydrophobicContact CB-CD1 4.29Å; F162-L191 HydrophobicContact CB-CD2 3.74Å; F162-L191 HydrophobicContact CB-CG 3.92Å; F162-L191 HydrophobicContact CD2-CD1 4.23Å; F162-L191 HydrophobicContact CG-CD1 4.27Å; F162-L191 HydrophobicContact CG-CD2 4.21Å; F162-L191 HydrophobicContact CG-CG 4.41Å; L165-L191 HydrophobicContact CB-CD2 3.82Å; L168-L191 HydrophobicContact CB-CD2 4.08Å; L168-L191 HydrophobicContact CD2-CD2 3.73Å; L171-L191 HydrophobicContact CD2-CD1 4.21Å; F188-L191 HydrophobicContact CB-CD1 4.3Å; F188-L191 HydrophobicContact CD1-CD1 3.78Å; F188-L191 WeakPolarHBondContact O-CB 3.49Å; F188-L191 PolarHBondContact O-N 3.1Å; F188-L191 VanDerWaalsContact O-N 3.1Å; L191-N193 VanDerWaalsContact C-N 3.3Å; L191-N193 PolarHBondContact O-N 2.86Å; L191-L194 HydrophobicContact CB-CB 3.96Å; L191-L194 HydrophobicContact CB-CD2 4.45Å; L191-L194 HydrophobicContact CD1-CD1 4.41Å; L191-L194 HydrophobicContact CD1-CD2 3.86Å; L191-L194 PolarHBondContact O-N 3.01Å; L191-P212 HydrophobicContact CB-CG 3.81Å; L191-P212 WeakPolarHBondContact O-CB 3.25Å
192	K	96.7	Very high	96.5	Very high	111 Å²	111	47 Å²	47	48%	0.483	22%	0.217	S	C	.	.	T	Hydrogen-bonded Turn	trans	-62	-32.6	-170	-65.1	179.8	-170.1	163.6	0	113.8	E166 G190 N214	E166-K192 HydrophobicContact CG-CD 4.2Å; E166-K192 WeakPolarHBondContact OE1-CE 3.39Å; E166-K192 IonicContact OE1-NZ 3.65Å; E166-K192 PolarHBondContact OE1-NZ 2.85Å; E166-K192 WeakPolarHBondContact OE2-CD 3.32Å; E166-K192 IonicContact OE2-NZ 3.43Å; E166-K192 PolarHBondContact OE2-NZ 3.23Å; G190-K192 PolarHBondContact O-N 3.47Å; K192-N214 PolarHBondContact O-ND2 3.14Å
193	N	98.2	Very high	96.6	Very high	76 Å²	76	49 Å²	49	41%	0.406	23%	0.233	S	C	.	.	T	Hydrogen-bonded Turn	trans	-104.7	13.9	-178.5	-64.7	-53.5	0	0	0	114	E166 L168 L191 M195	E166-N193 VanDerWaalsContact O-CB 3.3Å; E166-N193 WeakPolarHBondContact O-CB 3.5Å; E166-N193 PolarHBondContact O-N 3.37Å; E166-N193 PolarHBondContact O-ND2 2.76Å; L168-N193 CarbonylContact O-C 3.42Å; L191-N193 VanDerWaalsContact C-N 3.3Å; L191-N193 PolarHBondContact O-N 2.86Å; N193-M195 PolarHBondContact O-N 3.22Å
194	L	98.7	Very high	96.7	Very high	0 Å²	0	48.1 Å²	48.1	0%	0	23%	0.229	C	C	.	.			trans	-66.1	121.4	-178.2	-164.7	77.5	0	0	0	110.9	L168 L171 L191 L197 P212 N214 T215	L168-L194 HydrophobicContact CD2-CD1 4.16Å; L168-L194 HydrophobicContact CG-CD1 4.24Å; L168-L194 WeakPolarHBondContact O-CA 3.24Å; L168-L194 PolarHBondContact O-N 3.19Å; L171-L194 HydrophobicContact CB-CD1 3.9Å; L191-L194 HydrophobicContact CB-CB 3.96Å; L191-L194 HydrophobicContact CB-CD2 4.45Å; L191-L194 HydrophobicContact CD1-CD1 4.41Å; L191-L194 HydrophobicContact CD1-CD2 3.86Å; L191-L194 PolarHBondContact O-N 3.01Å; L194-L197 HydrophobicContact CD2-CB 4.01Å; L194-L197 HydrophobicContact CD2-CD1 4.38Å; L194-L197 HydrophobicContact CD2-CD2 4.48Å; L194-P212 HydrophobicContact CB-CB 4.18Å; L194-P212 HydrophobicContact CB-CG 4.08Å; L194-P212 HydrophobicContact CD2-CG 3.84Å; L194-N214 CarbonylContact O-C 3.39Å; L194-T215 WeakPolarHBondContact O-CA 3.35Å; L194-T215 PolarHBondContact O-N 3.03Å
195	M	98.7	Very high	97	Very high	86 Å²	86	51.9 Å²	51.9	42%	0.424	24%	0.24	S	C	.	.			trans	-105	-34.3	179.5	-64.6	176.7	68.9	0	0	111.4	T169 N193 M216 Q217	T169-M195 PolarHBondContact O-N 3.04Å; N193-M195 PolarHBondContact O-N 3.22Å; M195-M216 HydrophobicContact CE-CE 3.98Å; M195-M216 HydrophobicContact CE-SD 3.59Å; M195-M216 VanDerWaalsContact CE-SD 3.59Å; M195-M216 PolarHBondContact O-N 2.77Å; M195-Q217 PolarHBondContact O-N 3.15Å
196	Q	98.9	Very high	97.5	Very high	40 Å²	40	47.5 Å²	47.5	19%	0.187	23%	0.23	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-128.3	126.4	-177.9	-179.6	174.3	-36.2	0	0	111.3	T169 L170 L171 Q217 F219	T169-Q196 PolarHBondContact O-N 3.2Å; L170-Q196 HydrophobicContact CG-CB 4.32Å; L170-Q196 HydrophobicContact CG-CG 4.4Å; L171-Q196 PolarHBondContact N-O 3.35Å; Q196-Q217 WeakPolarHBondContact CA-O 3.33Å; Q196-Q217 HydrophobicContact CB-CB 4.13Å; Q196-Q217 HydrophobicContact CG-CB 3.96Å; Q196-F219 HydrophobicContact CG-CE2 4.32Å
197	L	98.9	Very high	97.8	Very high	0 Å²	0	45 Å²	45	0%	0	22%	0.217	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-126.1	116.1	173.3	-178.2	58.1	0	0	0	109.8	L171 F188 L194 M199 L211 Q217 L218 F219	L171-L197 HydrophobicContact CB-CD1 3.96Å; L171-L197 HydrophobicContact CD2-CD1 3.83Å; L171-L197 HydrophobicContact CG-CD1 3.92Å; F188-L197 HydrophobicContact CE1-CD2 4.28Å; F188-L197 HydrophobicContact CZ-CD2 4.3Å; L194-L197 HydrophobicContact CD2-CB 4.01Å; L194-L197 HydrophobicContact CD2-CD1 4.38Å; L194-L197 HydrophobicContact CD2-CD2 4.48Å; L197-M199 HydrophobicContact CD1-CE 4.38Å; L197-M199 HydrophobicContact CD1-CG 4.16Å; L197-M199 HydrophobicContact CD1-SD 4.32Å; L197-M199 HydrophobicContact CD2-CE 3.45Å; L197-M199 VanDerWaalsContact CD2-CE 3.45Å; L197-M199 HydrophobicContact CD2-SD 4.27Å; L197-M199 HydrophobicContact CG-CE 3.8Å; L197-M199 HydrophobicContact CG-CG 4.28Å; L197-M199 HydrophobicContact CG-SD 4.37Å; L197-L211 HydrophobicContact CD2-CD2 3.43Å; L197-L211 VanDerWaalsContact CD2-CD2 3.43Å; L197-Q217 PolarHBondContact N-O 3.43Å; L197-L218 HydrophobicContact CB-CD1 4.32Å; L197-L218 HydrophobicContact CD2-CD1 4.29Å; L197-L218 HydrophobicContact CG-CD1 4.41Å; L197-F219 PolarHBondContact O-N 3.12Å
198	N	98.9	Very high	97.8	Very high	10 Å²	10	44.4 Å²	44.4	5%	0.053	21%	0.213	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-109.8	114.5	176.8	-173.3	4.3	0	0	0	110	L171 D172 L173 Q174 A200 F219	L171-N198 PolarHBondContact O-N 3.28Å; D172-N198 HydrophobicContact CB-CB 4.43Å; D172-N198 PolarHBondContact OD1-ND2 3.32Å; D172-N198 PolarHBondContact OD2-ND2 3.3Å; L173-N198 CarbonylContact C-O 3.06Å; L173-N198 WeakPolarHBondContact CA-O 3.12Å; L173-N198 PolarHBondContact N-O 3.49Å; Q174-N198 PolarHBondContact N-O 2.65Å; Q174-N198 PolarHBondContact OE1-ND2 3.47Å; Q174-N198 VanDerWaalsContact OE1-ND2 3.1Å; N198-A200 WeakPolarHBondContact OD1-CB 3.19Å; N198-A200 PolarHBondContact OD1-N 3.24Å; N198-F219 HydrophobicContact CB-CB 4.42Å; N198-F219 HydrophobicContact CB-CD2 4.09Å
199	M	98.8	Very high	97.6	Very high	0 Å²	0	46.7 Å²	46.7	0%	0	23%	0.229	C	C	.	.			trans	-128.2	24.7	174.3	-69	-178.7	-63.5	0	0	110.8	L173 L178 F183 F188 L197 N202 L204 P208 F219 L220 N223	L173-M199 HydrophobicContact CB-CG 4.16Å; L173-M199 HydrophobicContact CD1-CG 4.36Å; L178-M199 HydrophobicContact CD1-CG 4.48Å; F183-M199 HydrophobicContact CE1-SD 3.8Å; F183-M199 HydrophobicContact CZ-SD 3.87Å; F188-M199 HydrophobicContact CZ-CE 4.49Å; F188-M199 HydrophobicContact CZ-SD 4.15Å; L197-M199 HydrophobicContact CD1-CE 4.38Å; L197-M199 HydrophobicContact CD1-CG 4.16Å; L197-M199 HydrophobicContact CD1-SD 4.32Å; L197-M199 HydrophobicContact CD2-CE 3.45Å; L197-M199 VanDerWaalsContact CD2-CE 3.45Å; L197-M199 HydrophobicContact CD2-SD 4.27Å; L197-M199 HydrophobicContact CG-CE 3.8Å; L197-M199 HydrophobicContact CG-CG 4.28Å; L197-M199 HydrophobicContact CG-SD 4.37Å; M199-N202 PolarHBondContact O-ND2 2.99Å; M199-L204 HydrophobicContact CB-CD1 4.33Å; M199-P208 HydrophobicContact CE-CB 3.86Å; M199-P208 HydrophobicContact CE-CG 3.23Å; M199-P208 HydrophobicContact SD-CG 4.43Å; M199-F219 CarbonylContact C-O 3.27Å; M199-F219 PolarHBondContact N-O 3.35Å; M199-L220 HydrophobicContact CB-CD2 4.04Å; M199-L220 HydrophobicContact CE-CD2 3.99Å; M199-N223 PolarHBondContact O-ND2 3.27Å; M199-N223 VanDerWaalsContact O-ND2 3.09Å
200	A	98.9	Very high	97.5	Very high	4 Å²	4	45.5 Å²	45.5	3%	0.033	22%	0.22	C	C	.	.			trans	-63.7	156	177.1	0	0	0	0	0	111.4	Q174 N175 N198 N202 F219 D221	Q174-A200 CarbonylContact C-O 3.51Å; Q174-A200 WeakPolarHBondContact CA-O 3.39Å; Q174-A200 HydrophobicContact CG-CB 4.23Å; Q174-A200 WeakPolarHBondContact CG-O 3.32Å; N175-A200 PolarHBondContact N-O 3.35Å; N198-A200 WeakPolarHBondContact OD1-CB 3.19Å; N198-A200 PolarHBondContact OD1-N 3.24Å; A200-N202 PolarHBondContact O-ND2 3.09Å; A200-F219 PolarHBondContact N-O 3.35Å; A200-D221 CarbonylContact C-O 3.53Å; A200-D221 WeakPolarHBondContact CA-O 3.13Å; A200-D221 HydrophobicContact CB-CB 4.04Å; A200-D221 WeakPolarHBondContact CB-O 3.19Å
201	K	98.9	Very high	97.5	Very high	99 Å²	99	45.5 Å²	45.5	43%	0.43	22%	0.218	S	C	.	.	S	Bend	trans	57	49.7	-179.7	-59.1	179.8	177.5	-176.4	0	112.3	N175 N176 D221 N222	N175-K201 WeakPolarHBondContact CA-O 3.43Å; N175-K201 HydrophobicContact CB-CB 4.06Å; N175-K201 HydrophobicContact CB-CD 4.39Å; N175-K201 PolarHBondContact N-O 3.38Å; N176-K201 PolarHBondContact N-O 2.93Å; K201-D221 PolarHBondContact N-O 2.88Å; K201-N222 WeakPolarHBondContact CA-O 3.34Å; K201-N222 HydrophobicContact CB-CB 4.42Å; K201-N222 HydrophobicContact CG-CB 3.72Å; K201-N222 PolarHBondContact N-O 3.26Å
202	N	98.9	Very high	97.5	Very high	16 Å²	16	46 Å²	46	9%	0.086	22%	0.221	C	C	.	.	S	Bend	trans	-119.5	-164.5	170.8	-81.9	-80.2	0	0	0	109	L173 N176 K177 L178 M199 A200 L204 N222 N223	L173-N202 PolarHBondContact O-ND2 3.37Å; N176-N202 VanDerWaalsContact CA-OD1 3.31Å; N176-N202 WeakPolarHBondContact CA-OD1 3.24Å; N176-N202 WeakPolarHBondContact CB-OD1 3.3Å; N176-N202 PolarHBondContact N-OD1 3.34Å; N176-N202 PolarHBondContact O-OD1 3.49Å; K177-N202 PolarHBondContact N-OD1 3.4Å; L178-N202 HydrophobicContact CB-CB 4.11Å; L178-N202 VanDerWaalsContact CB-OD1 3.31Å; L178-N202 WeakPolarHBondContact CB-OD1 3.3Å; L178-N202 PolarHBondContact N-OD1 3.29Å; M199-N202 PolarHBondContact O-ND2 2.99Å; A200-N202 PolarHBondContact O-ND2 3.09Å; N202-L204 HydrophobicContact CB-CG 4.21Å; N202-N222 PolarHBondContact N-O 3.36Å; N202-N223 VanDerWaalsContact CA-OD1 3.3Å; N202-N223 WeakPolarHBondContact CA-OD1 3.13Å; N202-N223 VanDerWaalsContact CB-OD1 3.24Å; N202-N223 WeakPolarHBondContact CB-OD1 3.44Å; N202-N223 PolarHBondContact N-OD1 2.99Å; N202-N223 PolarHBondContact O-OD1 3.48Å
203	A	98.5	Very high	97.4	Very high	48 Å²	48	43.3 Å²	43.3	40%	0.397	22%	0.22	S	C	.	.			trans	-117.1	36.1	178.9	0	0	0	0	0	112	L178 V179 N223	L178-A203 CarbonylContact O-C 3.2Å; L178-A203 WeakPolarHBondContact O-CA 3.2Å; L178-A203 PolarHBondContact O-N 3.24Å; V179-A203 HydrophobicContact CG1-CB 3.89Å; A203-N223 PolarHBondContact N-OD1 2.89Å
204	L	98.8	Very high	97.4	Very high	1 Å²	1	41.9 Å²	41.9	1%	0.005	21%	0.212	C	C	.	.			trans	-70.3	134.7	178.9	-54.9	-178.1	0	0	0	110.8	L178 F183 M199 N202 P208 L220 N223 S224 I225	L178-L204 HydrophobicContact CB-CD2 4.14Å; F183-L204 HydrophobicContact CE2-CD2 3.46Å; F183-L204 VanDerWaalsContact CE2-CD2 3.46Å; F183-L204 HydrophobicContact CZ-CD2 3.93Å; M199-L204 HydrophobicContact CB-CD1 4.33Å; N202-L204 HydrophobicContact CB-CG 4.21Å; L204-P208 HydrophobicContact CD1-CG 4.34Å; L204-L220 HydrophobicContact CD1-CD2 3.84Å; L204-N223 HydrophobicContact CB-CB 4.17Å; L204-N223 WeakPolarHBondContact CB-OD1 3.48Å; L204-N223 VanDerWaalsContact CG-OD1 3.31Å; L204-N223 WeakPolarHBondContact CG-OD1 3.39Å; L204-N223 PolarHBondContact N-OD1 3.02Å; L204-S224 CarbonylContact O-C 3.32Å; L204-S224 VanDerWaalsContact O-CA 3.27Å; L204-S224 WeakPolarHBondContact O-CA 3.47Å; L204-S224 PolarHBondContact O-N 3.32Å; L204-I225 HydrophobicContact CB-CG1 4.27Å; L204-I225 PolarHBondContact O-N 3.02Å
205	R	98.3	Very high	97.3	Very high	155 Å²	155	41.9 Å²	41.9	59%	0.585	21%	0.212	S	C	*	.	S	Bend	trans	-106.4	-18.8	172.2	-60.7	-177.3	178.9	-170.3	-1	112.6	D180 S224 I225 E226	D180-R205 PolarHBondContact OD1-N 3.29Å; D180-R205 WeakPolarHBondContact OD2-CB 3.14Å; R205-S224 WeakPolarHBondContact CA-O 3.48Å; R205-I225 WeakPolarHBondContact O-CA 3.49Å; R205-E226 PolarHBondContact O-N 3.37Å
206	N	97.9	Very high	97.3	Very high	93 Å²	93	41 Å²	41	50%	0.497	21%	0.207	S	C	.	.	B	Isolated β-bridge	trans	-124.2	157.8	178.7	-69.1	-73.3	0	0	0	111.2	D180	D180-N206 PolarHBondContact OD1-N 2.83Å; D180-N206 VanDerWaalsContact OD1-N 3.15Å; D180-N206 PolarHBondContact OD2-N 3.36Å; D180-N206 PolarHBondContact OD2-ND2 2.85Å
207	M	97.5	Very high	97.3	Very high	11 Å²	11	42 Å²	42	5%	0.054	21%	0.212	C	C	.	.	P	Polyproline II helix	trans	-61.2	137	169.1	-67.5	-65.2	-70.6	0	0	110.5	L218 L220 I225 I228 Y232 L244	M207-L218 HydrophobicContact CE-CD2 4.26Å; M207-L220 HydrophobicContact CE-CD1 3.62Å; M207-L220 HydrophobicContact SD-CD1 3.74Å; M207-I225 HydrophobicContact CG-CG2 4.3Å; M207-I225 HydrophobicContact SD-CD1 4.06Å; M207-I225 HydrophobicContact SD-CG2 4.12Å; M207-I228 HydrophobicContact CG-CB 4.19Å; M207-I228 HydrophobicContact CG-CG1 3.9Å; M207-I228 HydrophobicContact CG-CG2 4.24Å; M207-I228 HydrophobicContact SD-CG1 4.07Å; M207-Y232 HydrophobicContact CB-CD2 4.1Å; M207-Y232 HydrophobicContact CB-CE1 4.45Å; M207-Y232 HydrophobicContact CB-CE2 3.53Å; M207-Y232 HydrophobicContact CE-CD1 3.96Å; M207-Y232 HydrophobicContact CE-CE1 3.35Å; M207-Y232 HydrophobicContact CG-CE2 4.43Å; M207-L244 HydrophobicContact SD-CD2 4Å
208	P	95.9	Very high	97.3	Very high	2 Å²	2	42 Å²	42	1%	0.013	21%	0.212	C	C	.	.	P	Polyproline II helix	trans	-58.1	136.6	178.7	-19.3	25.8	0	0	0	112.1	F188 M199 L204 L211 L220 Y232	F188-P208 HydrophobicContact CE2-CB 4.28Å; M199-P208 HydrophobicContact CE-CB 3.86Å; M199-P208 HydrophobicContact CE-CG 3.23Å; M199-P208 HydrophobicContact SD-CG 4.43Å; L204-P208 HydrophobicContact CD1-CG 4.34Å; P208-L211 HydrophobicContact CB-CD2 3.85Å; P208-L211 HydrophobicContact CB-CG 4.34Å; P208-L211 HydrophobicContact CG-CD2 4.49Å; P208-L220 HydrophobicContact CG-CD2 3.98Å; P208-Y232 VanDerWaalsContact O-CE2 3.27Å; P208-Y232 WeakPolarHBondContact O-CE2 3.49Å; P208-Y232 PolarHBondContact O-OH 3.3Å
209	P	92.7	Very high	97.3	Very high	53 Å²	53	42.2 Å²	42.2	34%	0.344	21%	0.213	S	C	.	.	S	Bend	trans	-76.5	140	-176.8	29.9	-34.3	0	0	0	112.1	F183 L211	F183-P209 HydrophobicContact CB-CG 3.93Å; P209-L211 PolarHBondContact O-N 3.28Å
210	R	90.9	Very high	97.3	Very high	143 Å²	143	42.2 Å²	42.2	54%	0.54	21%	0.213	S	C	.	.	S	Bend	trans	51.2	55.6	166.4	-65.7	166	169.7	-162.8	-0.6	113.9	R185	R185-R210 WeakPolarHBondContact O-CD 3.33Å; R185-R210 PolarHBondContact O-NH1 2.78Å
211	L	95.6	Very high	97.3	Very high	6 Å²	6	43 Å²	43	3%	0.031	22%	0.216	C	C	.	.			trans	-60.9	155.9	173.5	-68.6	-176.8	0	0	0	112.3	F188 L197 P208 P209 L218 Y232 I236	F188-L211 HydrophobicContact CD2-CD2 3.87Å; F188-L211 HydrophobicContact CE2-CD2 3.8Å; F188-L211 HydrophobicContact CZ-CD2 4.38Å; L197-L211 HydrophobicContact CD2-CD2 3.43Å; L197-L211 VanDerWaalsContact CD2-CD2 3.43Å; P208-L211 HydrophobicContact CB-CD2 3.85Å; P208-L211 HydrophobicContact CB-CG 4.34Å; P208-L211 HydrophobicContact CG-CD2 4.49Å; P209-L211 PolarHBondContact O-N 3.28Å; L211-L218 HydrophobicContact CD1-CD1 3.8Å; L211-L218 HydrophobicContact CD1-CD2 3.53Å; L211-L218 HydrophobicContact CD1-CG 4.31Å; L211-Y232 HydrophobicContact CD1-CE1 4.33Å; L211-Y232 WeakPolarHBondContact CD1-OH 3.39Å; L211-Y232 WeakPolarHBondContact CG-OH 3.14Å; L211-I236 HydrophobicContact CB-CG2 3.54Å; L211-I236 HydrophobicContact CD1-CD1 4.34Å
212	P	95.9	Very high	97.3	Very high	12 Å²	12	41.5 Å²	41.5	8%	0.078	21%	0.213	C	C	.	.			trans	-63.6	136.3	178.2	-23.8	36.3	0	0	0	112.7	F188 L191 L194 N214 T215 I236	F188-P212 HydrophobicContact CB-CG 3.89Å; L191-P212 HydrophobicContact CB-CG 3.81Å; L191-P212 WeakPolarHBondContact O-CB 3.25Å; L194-P212 HydrophobicContact CB-CB 4.18Å; L194-P212 HydrophobicContact CB-CG 4.08Å; L194-P212 HydrophobicContact CD2-CG 3.84Å; P212-N214 PolarHBondContact O-N 3.01Å; P212-N214 VanDerWaalsContact O-N 3.07Å; P212-T215 WeakPolarHBondContact O-CB 3.45Å; P212-T215 PolarHBondContact O-N 3.05Å; P212-T215 PolarHBondContact O-OG1 2.73Å; P212-I236 WeakPolarHBondContact O-CG2 3.47Å
213	A	96	Very high	97.3	Very high	54 Å²	54	41.3 Å²	41.3	45%	0.446	21%	0.212	S	C	.	.	T	Hydrogen-bonded Turn	trans	-61.5	-22	-175.8	0	0	0	0	0	114.6	T215 V235	A213-T215 VanDerWaalsContact C-N 3.34Å; A213-V235 WeakPolarHBondContact CA-O 3.36Å
214	N	97.2	Very high	97.4	Very high	46 Å²	46	40.7 Å²	40.7	25%	0.246	21%	0.205	C	C	.	.	T	Hydrogen-bonded Turn	trans	-86.2	0	178.5	-77.7	-34.7	0	0	0	114.4	K192 L194 P212 M216 K238	K192-N214 PolarHBondContact O-ND2 3.14Å; L194-N214 CarbonylContact O-C 3.39Å; P212-N214 PolarHBondContact O-N 3.01Å; P212-N214 VanDerWaalsContact O-N 3.07Å; N214-M216 PolarHBondContact O-N 3.49Å; N214-K238 WeakPolarHBondContact OD1-CE 3.45Å; N214-K238 PolarHBondContact OD1-NZ 2.88Å
215	T	98.2	Very high	97.4	Very high	0 Å²	0	40.6 Å²	40.6	0%	0	21%	0.205	C	C	.	.			trans	-59.9	119.3	179.6	-53.7	0	0	0	0	110.3	L194 P212 A213 L218 K238 V239	L194-T215 WeakPolarHBondContact O-CA 3.35Å; L194-T215 PolarHBondContact O-N 3.03Å; P212-T215 WeakPolarHBondContact O-CB 3.45Å; P212-T215 PolarHBondContact O-N 3.05Å; P212-T215 PolarHBondContact O-OG1 2.73Å; A213-T215 VanDerWaalsContact C-N 3.34Å; T215-L218 HydrophobicContact CG2-CB 4.28Å; T215-K238 CarbonylContact O-C 3.52Å; T215-V239 WeakPolarHBondContact O-CA 3.32Å; T215-V239 PolarHBondContact O-N 2.87Å
216	M	98.6	Very high	97.4	Very high	67 Å²	67	38 Å²	38	33%	0.33	20%	0.199	S	C	.	.			trans	-104.3	-33.2	177	-64.1	-175.7	-175.8	0	0	112.1	M195 N214 K238 A240 F241	M195-M216 HydrophobicContact CE-CE 3.98Å; M195-M216 HydrophobicContact CE-SD 3.59Å; M195-M216 VanDerWaalsContact CE-SD 3.59Å; M195-M216 PolarHBondContact O-N 2.77Å; N214-M216 PolarHBondContact O-N 3.49Å; M216-K238 HydrophobicContact CE-CD 4.46Å; M216-K238 HydrophobicContact CG-CB 4.35Å; M216-A240 PolarHBondContact O-N 2.97Å; M216-F241 PolarHBondContact O-N 3.34Å
217	Q	98.9	Very high	97.3	Very high	62 Å²	62	34.5 Å²	34.5	29%	0.29	19%	0.185	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-122.3	118.2	-179.1	-61.1	-177.7	54.5	0	0	109.3	M195 Q196 L197 F219 F241	M195-Q217 PolarHBondContact O-N 3.15Å; Q196-Q217 WeakPolarHBondContact CA-O 3.33Å; Q196-Q217 HydrophobicContact CB-CB 4.13Å; Q196-Q217 HydrophobicContact CG-CB 3.96Å; L197-Q217 PolarHBondContact N-O 3.43Å; Q217-F219 HydrophobicContact CB-CE1 4.14Å; Q217-F219 HydrophobicContact CB-CE2 4.49Å; Q217-F219 HydrophobicContact CB-CZ 3.91Å; Q217-F219 HydrophobicContact CG-CZ 4.43Å; Q217-F219 VanDerWaalsContact OE1-CZ 3.28Å; Q217-F241 HydrophobicContact CG-CB 4.18Å; Q217-F241 HydrophobicContact CG-CD2 3.88Å; Q217-F241 HydrophobicContact CG-CG 4.36Å
218	L	98.9	Very high	97.4	Very high	0 Å²	0	34.5 Å²	34.5	0%	0	19%	0.185	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-125.1	112.4	178.8	179.2	60.2	0	0	0	109.7	L197 M207 L211 T215 L220 I236 V239 F241 L242 R243	L197-L218 HydrophobicContact CB-CD1 4.32Å; L197-L218 HydrophobicContact CD2-CD1 4.29Å; L197-L218 HydrophobicContact CG-CD1 4.41Å; M207-L218 HydrophobicContact CE-CD2 4.26Å; L211-L218 HydrophobicContact CD1-CD1 3.8Å; L211-L218 HydrophobicContact CD1-CD2 3.53Å; L211-L218 HydrophobicContact CD1-CG 4.31Å; T215-L218 HydrophobicContact CG2-CB 4.28Å; L218-L220 HydrophobicContact CD1-CD1 4.13Å; L218-L220 HydrophobicContact CD1-CG 4.1Å; L218-L220 HydrophobicContact CD2-CD1 3.89Å; L218-L220 HydrophobicContact CG-CD1 3.89Å; L218-L220 HydrophobicContact CG-CG 4.13Å; L218-I236 HydrophobicContact CD2-CD1 4.17Å; L218-V239 HydrophobicContact CB-CG2 4.34Å; L218-F241 PolarHBondContact N-O 3.35Å; L218-L242 HydrophobicContact CB-CD1 4.14Å; L218-L242 HydrophobicContact CD2-CD1 3.93Å; L218-L242 HydrophobicContact CG-CD1 4.13Å; L218-R243 PolarHBondContact O-N 2.9Å
219	F	98.9	Very high	97.4	Very high	15 Å²	15	37.7 Å²	37.7	7%	0.066	21%	0.206	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-111.6	116.6	-179.2	-50.9	-34.6	0	0	0	110.4	Q196 L197 N198 M199 A200 Q217 F241 R243	Q196-F219 HydrophobicContact CG-CE2 4.32Å; L197-F219 PolarHBondContact O-N 3.12Å; N198-F219 HydrophobicContact CB-CB 4.42Å; N198-F219 HydrophobicContact CB-CD2 4.09Å; M199-F219 CarbonylContact C-O 3.27Å; M199-F219 PolarHBondContact N-O 3.35Å; A200-F219 PolarHBondContact N-O 3.35Å; Q217-F219 HydrophobicContact CB-CE1 4.14Å; Q217-F219 HydrophobicContact CB-CE2 4.49Å; Q217-F219 HydrophobicContact CB-CZ 3.91Å; Q217-F219 HydrophobicContact CG-CZ 4.43Å; Q217-F219 VanDerWaalsContact OE1-CZ 3.28Å; F219-F241 HydrophobicContact CE1-CB 4.36Å; F219-R243 HydrophobicContact CD1-CB 3.95Å; F219-R243 HydrophobicContact CD1-CG 3.66Å; F219-R243 HydrophobicContact CE1-CG 4.01Å
220	L	98.9	Very high	97.6	Very high	0 Å²	0	39.8 Å²	39.8	0%	0	21%	0.211	C	C	.	.			trans	-130.6	18.5	-176.4	-70.5	168.7	0	0	0	111.4	M199 L204 M207 P208 L218 N223 I225 R243 L244 N247	M199-L220 HydrophobicContact CB-CD2 4.04Å; M199-L220 HydrophobicContact CE-CD2 3.99Å; L204-L220 HydrophobicContact CD1-CD2 3.84Å; M207-L220 HydrophobicContact CE-CD1 3.62Å; M207-L220 HydrophobicContact SD-CD1 3.74Å; P208-L220 HydrophobicContact CG-CD2 3.98Å; L218-L220 HydrophobicContact CD1-CD1 4.13Å; L218-L220 HydrophobicContact CD1-CG 4.1Å; L218-L220 HydrophobicContact CD2-CD1 3.89Å; L218-L220 HydrophobicContact CG-CD1 3.89Å; L218-L220 HydrophobicContact CG-CG 4.13Å; L220-N223 PolarHBondContact O-ND2 3.1Å; L220-I225 HydrophobicContact CB-CD1 3.98Å; L220-I225 HydrophobicContact CD1-CD1 4.1Å; L220-I225 HydrophobicContact CD2-CD1 4.32Å; L220-I225 HydrophobicContact CG-CD1 4.38Å; L220-R243 WeakPolarHBondContact CA-O 3.11Å; L220-R243 PolarHBondContact N-O 2.94Å; L220-L244 HydrophobicContact CB-CD2 3.71Å; L220-L244 HydrophobicContact CD1-CD2 3.93Å; L220-L244 HydrophobicContact CG-CD2 4.48Å; L220-N247 PolarHBondContact O-ND2 2.85Å
221	D	98.9	Very high	97.7	Very high	19 Å²	19	37.8 Å²	37.8	10%	0.102	21%	0.211	C	C	.	.			trans	-56.4	152.3	179.5	-53	-84	0	0	0	112	A200 K201 N223 R243 N245	A200-D221 CarbonylContact C-O 3.53Å; A200-D221 WeakPolarHBondContact CA-O 3.13Å; A200-D221 HydrophobicContact CB-CB 4.04Å; A200-D221 WeakPolarHBondContact CB-O 3.19Å; K201-D221 PolarHBondContact N-O 2.88Å; D221-N223 PolarHBondContact O-N 3.36Å; D221-N223 PolarHBondContact O-ND2 3.24Å; D221-R243 WeakPolarHBondContact OD1-CB 3.43Å; D221-R243 WeakPolarHBondContact OD2-CB 3.27Å; D221-N245 CarbonylContact C-O 3.03Å; D221-N245 WeakPolarHBondContact CA-O 3.42Å; D221-N245 WeakPolarHBondContact OD1-CB 3.06Å; D221-N245 VanDerWaalsContact OD1-CG 3.31Å; D221-N245 PolarHBondContact OD1-N 2.84Å; D221-N245 VanDerWaalsContact OD1-N 3.1Å; D221-N245 PolarHBondContact OD1-ND2 3.33Å
222	N	98.9	Very high	97.7	Very high	68 Å²	68	38.6 Å²	38.6	36%	0.364	21%	0.214	S	C	.	.	S	Bend	trans	55.3	53.8	174	-63.1	-95.4	0	0	0	112.1	K201 N202 N245 H246	K201-N222 WeakPolarHBondContact CA-O 3.34Å; K201-N222 HydrophobicContact CB-CB 4.42Å; K201-N222 HydrophobicContact CG-CB 3.72Å; K201-N222 PolarHBondContact N-O 3.26Å; N202-N222 PolarHBondContact N-O 3.36Å; N222-N245 PolarHBondContact N-O 3.36Å; N222-H246 VanDerWaalsContact CA-O 3.24Å; N222-H246 WeakPolarHBondContact CA-O 3.31Å; N222-H246 HydrophobicContact CB-CB 4.38Å; N222-H246 PolarHBondContact N-O 3.03Å
223	N	98.9	Very high	97.7	Very high	12 Å²	12	38.6 Å²	38.6	6%	0.064	21%	0.212	C	C	.	.	S	Bend	trans	-120	-159.8	169.6	-83.8	-77.6	0	0	0	108.3	M199 N202 A203 L204 L220 D221 I225 H246 N247	M199-N223 PolarHBondContact O-ND2 3.27Å; M199-N223 VanDerWaalsContact O-ND2 3.09Å; N202-N223 VanDerWaalsContact CA-OD1 3.3Å; N202-N223 WeakPolarHBondContact CA-OD1 3.13Å; N202-N223 VanDerWaalsContact CB-OD1 3.24Å; N202-N223 WeakPolarHBondContact CB-OD1 3.44Å; N202-N223 PolarHBondContact N-OD1 2.99Å; N202-N223 PolarHBondContact O-OD1 3.48Å; A203-N223 PolarHBondContact N-OD1 2.89Å; L204-N223 HydrophobicContact CB-CB 4.17Å; L204-N223 WeakPolarHBondContact CB-OD1 3.48Å; L204-N223 VanDerWaalsContact CG-OD1 3.31Å; L204-N223 WeakPolarHBondContact CG-OD1 3.39Å; L204-N223 PolarHBondContact N-OD1 3.02Å; L220-N223 PolarHBondContact O-ND2 3.1Å; D221-N223 PolarHBondContact O-N 3.36Å; D221-N223 PolarHBondContact O-ND2 3.24Å; N223-I225 HydrophobicContact CB-CD1 4.27Å; N223-I225 HydrophobicContact CB-CG1 4.07Å; N223-H246 PolarHBondContact N-O 3.01Å; N223-N247 WeakPolarHBondContact CA-OD1 3.37Å; N223-N247 WeakPolarHBondContact CB-OD1 3.35Å
224	S	98.7	Very high	97.6	Very high	35 Å²	35	41.6 Å²	41.6	25%	0.245	22%	0.221	C	C	.	.			trans	-125.3	34.7	173.7	-72.3	0	0	0	0	111.1	L204 R205 E226 N247	L204-S224 CarbonylContact O-C 3.32Å; L204-S224 VanDerWaalsContact O-CA 3.27Å; L204-S224 WeakPolarHBondContact O-CA 3.47Å; L204-S224 PolarHBondContact O-N 3.32Å; R205-S224 WeakPolarHBondContact CA-O 3.48Å; S224-E226 PolarHBondContact O-N 2.75Å; S224-N247 PolarHBondContact N-OD1 3.19Å
225	I	98.8	Very high	97.4	Very high	0 Å²	0	43 Å²	43	0%	0	23%	0.231	C	C	.	.			trans	-66.9	122.1	-176	-60.8	169.6	0	0	0	109.5	L204 R205 M207 L220 N223 G227 L244 N247 K248 L249	L204-I225 HydrophobicContact CB-CG1 4.27Å; L204-I225 PolarHBondContact O-N 3.02Å; R205-I225 WeakPolarHBondContact O-CA 3.49Å; M207-I225 HydrophobicContact CG-CG2 4.3Å; M207-I225 HydrophobicContact SD-CD1 4.06Å; M207-I225 HydrophobicContact SD-CG2 4.12Å; L220-I225 HydrophobicContact CB-CD1 3.98Å; L220-I225 HydrophobicContact CD1-CD1 4.1Å; L220-I225 HydrophobicContact CD2-CD1 4.32Å; L220-I225 HydrophobicContact CG-CD1 4.38Å; N223-I225 HydrophobicContact CB-CD1 4.27Å; N223-I225 HydrophobicContact CB-CG1 4.07Å; I225-G227 WeakPolarHBondContact CG2-O 3.4Å; I225-L244 HydrophobicContact CD1-CD2 3.94Å; I225-N247 HydrophobicContact CB-CB 4.34Å; I225-N247 WeakPolarHBondContact CB-OD1 3.25Å; I225-N247 WeakPolarHBondContact CG1-OD1 3.09Å; I225-N247 PolarHBondContact N-OD1 3.07Å; I225-K248 CarbonylContact O-C 3.19Å; I225-K248 VanDerWaalsContact O-C 3.24Å; I225-K248 WeakPolarHBondContact O-CA 3.26Å; I225-K248 PolarHBondContact O-N 3.27Å; I225-L249 HydrophobicContact CG2-CD2 4.07Å; I225-L249 PolarHBondContact O-N 3.31Å
226	E	98.3	Very high	97.3	Very high	101 Å²	101	43 Å²	43	47%	0.472	23%	0.231	S	C	.	.			trans	-97.5	-28	-177.1	-71.8	173.3	-163.6	0	0	112.4	R205 S224 K248 G253	R205-E226 PolarHBondContact O-N 3.37Å; S224-E226 PolarHBondContact O-N 2.75Å; E226-K248 HydrophobicContact CG-CB 3.79Å; E226-K248 HydrophobicContact CG-CD 4.21Å; E226-G253 WeakPolarHBondContact O-CA 3.26Å
227	G	97.6	Very high	97.2	Very high	19 Å²	19	43.3 Å²	43.3	20%	0.196	24%	0.238	C	C	.	.	B	Isolated β-bridge	trans	-156.5	164.7	178.4	0	0	0	0	0	115.3	I225 G253	I225-G227 WeakPolarHBondContact CG2-O 3.4Å; G227-G253 CarbonylContact C-O 3.38Å; G227-G253 WeakPolarHBondContact CA-O 3.48Å
228	I	98.2	Very high	97.1	Very high	10 Å²	10	45 Å²	45	5%	0.051	24%	0.244	C	C	.	.			trans	-117.7	123.4	180	-58.6	171.9	0	0	0	107.5	M207 Y232 F233 L244 L249 G253 L254 F259	M207-I228 HydrophobicContact CG-CB 4.19Å; M207-I228 HydrophobicContact CG-CG1 3.9Å; M207-I228 HydrophobicContact CG-CG2 4.24Å; M207-I228 HydrophobicContact SD-CG1 4.07Å; I228-Y232 HydrophobicContact CG2-CD1 4.49Å; I228-Y232 HydrophobicContact CG2-CG 4.24Å; I228-F233 HydrophobicContact CD1-CZ 4.47Å; I228-F233 HydrophobicContact CG2-CE2 4.07Å; I228-F233 HydrophobicContact CG2-CZ 4.24Å; I228-L244 HydrophobicContact CD1-CD1 3.96Å; I228-L249 HydrophobicContact CD1-CD1 4.45Å; I228-L249 HydrophobicContact CD1-CD2 4.35Å; I228-L249 HydrophobicContact CG1-CD2 4.04Å; I228-G253 PolarHBondContact N-O 2.98Å; I228-L254 HydrophobicContact CD1-CD2 4.26Å; I228-F259 HydrophobicContact CD1-CE1 3.86Å; I228-F259 HydrophobicContact CD1-CZ 3.68Å
229	P	96.8	Very high	97.1	Very high	70 Å²	70	45 Å²	45	46%	0.455	24%	0.244	S	C	.	.			trans	-59.2	151.5	179.2	-25	34.1	0	0	0	113.5	Y232	P229-Y232 HydrophobicContact CB-CD2 4.44Å; P229-Y232 HydrophobicContact CG-CD2 4.12Å; P229-Y232 VanDerWaalsContact O-CB 3.28Å; P229-Y232 WeakPolarHBondContact O-CB 3.35Å; P229-Y232 PolarHBondContact O-N 2.82Å
230	E	96	Very high	97.1	Very high	97 Å²	97	45 Å²	45	45%	0.453	25%	0.247	S	C	.	.	T	Hydrogen-bonded Turn	trans	-57	141.9	170.4	-77	-66.3	175.6	0	0	111.5	Y232 S256	E230-Y232 PolarHBondContact O-N 2.85Å; E230-Y232 VanDerWaalsContact O-N 3.09Å; E230-S256 VanDerWaalsContact OE1-CB 3.23Å; E230-S256 WeakPolarHBondContact OE1-CB 3.38Å; E230-S256 PolarHBondContact OE1-N 2.9Å; E230-S256 PolarHBondContact OE1-OG 3.32Å; E230-S256 PolarHBondContact OE2-OG 3.19Å
231	N	94.1	Very high	97.1	Very high	101 Å²	101	49 Å²	49	54%	0.54	26%	0.264	S	S	.	.	T	Hydrogen-bonded Turn	trans	58.4	16.4	-179.5	-58.9	-60.4	0	0	0	115.4	F233 N234	N231-F233 VanDerWaalsContact C-N 3.27Å; N231-F233 PolarHBondContact O-N 3.3Å; N231-N234 WeakPolarHBondContact CB-ND2 3.41Å; N231-N234 WeakPolarHBondContact O-CB 3.3Å; N231-N234 PolarHBondContact O-N 2.84Å; N231-N234 PolarHBondContact OD1-ND2 3.33Å
232	Y	95.6	Very high	97.1	Very high	23 Å²	23	48 Å²	48	9%	0.09	26%	0.26	C	S	.	.	H	α-helix	trans	-53.9	-43.6	-178.2	-172.8	-93.9	0	0	0	112.7	M207 P208 L211 I228 P229 E230 N234 V235 I236	M207-Y232 HydrophobicContact CB-CD2 4.1Å; M207-Y232 HydrophobicContact CB-CE1 4.45Å; M207-Y232 HydrophobicContact CB-CE2 3.53Å; M207-Y232 HydrophobicContact CE-CD1 3.96Å; M207-Y232 HydrophobicContact CE-CE1 3.35Å; M207-Y232 HydrophobicContact CG-CE2 4.43Å; P208-Y232 VanDerWaalsContact O-CE2 3.27Å; P208-Y232 WeakPolarHBondContact O-CE2 3.49Å; P208-Y232 PolarHBondContact O-OH 3.3Å; L211-Y232 HydrophobicContact CD1-CE1 4.33Å; L211-Y232 WeakPolarHBondContact CD1-OH 3.39Å; L211-Y232 WeakPolarHBondContact CG-OH 3.14Å; I228-Y232 HydrophobicContact CG2-CD1 4.49Å; I228-Y232 HydrophobicContact CG2-CG 4.24Å; P229-Y232 HydrophobicContact CB-CD2 4.44Å; P229-Y232 HydrophobicContact CG-CD2 4.12Å; P229-Y232 VanDerWaalsContact O-CB 3.28Å; P229-Y232 WeakPolarHBondContact O-CB 3.35Å; P229-Y232 PolarHBondContact O-N 2.82Å; E230-Y232 PolarHBondContact O-N 2.85Å; E230-Y232 VanDerWaalsContact O-N 3.09Å; Y232-N234 VanDerWaalsContact C-N 3.26Å; Y232-N234 PolarHBondContact O-N 2.57Å; Y232-V235 PolarHBondContact O-N 3.35Å; Y232-I236 HydrophobicContact CD1-CD1 4.17Å; Y232-I236 HydrophobicContact CE1-CD1 3.78Å
233	F	96	Very high	97.1	Very high	12 Å²	12	49.1 Å²	49.1	5%	0.053	26%	0.258	C	S	.	.	H	α-helix	trans	-73.7	-12	-177.7	-58.3	-67	0	0	0	114.3	I228 N231 V235 I236 V239 L242 F259 V261 I264	I228-F233 HydrophobicContact CD1-CZ 4.47Å; I228-F233 HydrophobicContact CG2-CE2 4.07Å; I228-F233 HydrophobicContact CG2-CZ 4.24Å; N231-F233 VanDerWaalsContact C-N 3.27Å; N231-F233 PolarHBondContact O-N 3.3Å; F233-V235 PolarHBondContact O-N 2.91Å; F233-I236 HydrophobicContact CD1-CD1 3.93Å; F233-I236 HydrophobicContact CD1-CG1 4.16Å; F233-I236 HydrophobicContact CE1-CD1 4.34Å; F233-I236 CarbonylContact O-C 3.56Å; F233-I236 PolarHBondContact O-N 2.97Å; F233-V239 HydrophobicContact CD1-CG1 4.01Å; F233-L242 HydrophobicContact CE1-CD2 3.63Å; F233-L242 HydrophobicContact CZ-CD2 3.63Å; F233-F259 HydrophobicContact CE2-CD1 4Å; F233-F259 HydrophobicContact CE2-CE1 4.04Å; F233-F259 HydrophobicContact CZ-CD1 4.1Å; F233-F259 AromaticContact CZ-CE1 3.88Å; F233-F259 HydrophobicContact CZ-CE1 3.88Å; F233-V261 HydrophobicContact CB-CG1 4.07Å; F233-V261 HydrophobicContact CB-CG2 3.79Å; F233-V261 HydrophobicContact CD2-CG2 3.71Å; F233-V261 HydrophobicContact CG-CG2 3.86Å; F233-I264 HydrophobicContact CE1-CD1 4.41Å
234	N	94.1	Very high	97.1	Very high	116 Å²	116	48.5 Å²	48.5	62%	0.62	26%	0.255	S	S	*	.	H	α-helix	trans	-66.7	-26.1	173.8	-62.5	-2.6	0	0	0	111.5	N231 Y232	N231-N234 WeakPolarHBondContact CB-ND2 3.41Å; N231-N234 WeakPolarHBondContact O-CB 3.3Å; N231-N234 PolarHBondContact O-N 2.84Å; N231-N234 PolarHBondContact OD1-ND2 3.33Å; Y232-N234 VanDerWaalsContact C-N 3.26Å; Y232-N234 PolarHBondContact O-N 2.57Å
235	V	93	Very high	97.1	Very high	76 Å²	76	47.7 Å²	47.7	46%	0.461	25%	0.248	S	C	.	.	H	α-helix	trans	-81.2	-27.6	178.8	-177.6	0	0	0	0	111.8	A213 Y232 F233 P237	A213-V235 WeakPolarHBondContact CA-O 3.36Å; Y232-V235 PolarHBondContact O-N 3.35Å; F233-V235 PolarHBondContact O-N 2.91Å; V235-P237 VanDerWaalsContact O-CD 3.24Å; V235-P237 WeakPolarHBondContact O-CD 2.94Å
236	I	95.6	Very high	97.1	Very high	1 Å²	1	51.6 Å²	51.6	1%	0.005	27%	0.266	C	S	.	.			trans	-118.7	62.5	-179.9	52.8	169.6	0	0	0	111.1	L211 P212 L218 Y232 F233 K238 V239	L211-I236 HydrophobicContact CB-CG2 3.54Å; L211-I236 HydrophobicContact CD1-CD1 4.34Å; P212-I236 WeakPolarHBondContact O-CG2 3.47Å; L218-I236 HydrophobicContact CD2-CD1 4.17Å; Y232-I236 HydrophobicContact CD1-CD1 4.17Å; Y232-I236 HydrophobicContact CE1-CD1 3.78Å; F233-I236 HydrophobicContact CD1-CD1 3.93Å; F233-I236 HydrophobicContact CD1-CG1 4.16Å; F233-I236 HydrophobicContact CE1-CD1 4.34Å; F233-I236 CarbonylContact O-C 3.56Å; F233-I236 PolarHBondContact O-N 2.97Å; I236-K238 PolarHBondContact O-N 3.5Å; I236-V239 HydrophobicContact CD1-CB 4.23Å; I236-V239 HydrophobicContact CD1-CG1 4.14Å; I236-V239 HydrophobicContact CG1-CG1 4.27Å; I236-V239 WeakPolarHBondContact O-CG1 3.42Å; I236-V239 PolarHBondContact O-N 2.91Å
237	P	96.1	Very high	97.1	Very high	72 Å²	72	47.3 Å²	47.3	47%	0.468	25%	0.246	S	C	.	.	T	Hydrogen-bonded Turn	trans	-65.4	-12.8	-169.4	28.7	-37.3	0	0	0	113.9	V235 S263	V235-P237 VanDerWaalsContact O-CD 3.24Å; V235-P237 WeakPolarHBondContact O-CD 2.94Å; P237-S263 WeakPolarHBondContact O-CB 3.46Å; P237-S263 PolarHBondContact O-OG 3.17Å
238	K	97.7	Very high	97.2	Very high	99 Å²	99	50.4 Å²	50.4	43%	0.43	25%	0.254	S	S	.	.	T	Hydrogen-bonded Turn	trans	-98.1	2	-177.4	-60.7	-169.2	-176.9	174.8	0	114.8	N214 T215 M216 I236 A240	N214-K238 WeakPolarHBondContact OD1-CE 3.45Å; N214-K238 PolarHBondContact OD1-NZ 2.88Å; T215-K238 CarbonylContact O-C 3.52Å; M216-K238 HydrophobicContact CE-CD 4.46Å; M216-K238 HydrophobicContact CG-CB 4.35Å; I236-K238 PolarHBondContact O-N 3.5Å; K238-A240 PolarHBondContact O-N 2.93Å
239	V	98.4	Very high	97.2	Very high	0 Å²	0	49.9 Å²	49.9	0%	0	25%	0.252	C	S	.	.			trans	-63.1	119.2	-177.6	64.8	0	0	0	0	110.9	T215 L218 F233 I236 L242 S263 I264	T215-V239 WeakPolarHBondContact O-CA 3.32Å; T215-V239 PolarHBondContact O-N 2.87Å; L218-V239 HydrophobicContact CB-CG2 4.34Å; F233-V239 HydrophobicContact CD1-CG1 4.01Å; I236-V239 HydrophobicContact CD1-CB 4.23Å; I236-V239 HydrophobicContact CD1-CG1 4.14Å; I236-V239 HydrophobicContact CG1-CG1 4.27Å; I236-V239 WeakPolarHBondContact O-CG1 3.42Å; I236-V239 PolarHBondContact O-N 2.91Å; V239-L242 HydrophobicContact CG2-CB 4.4Å; V239-S263 CarbonylContact O-C 3.33Å; V239-S263 VanDerWaalsContact O-CB 3.31Å; V239-S263 WeakPolarHBondContact O-CB 3.18Å; V239-S263 VanDerWaalsContact O-O 3.11Å; V239-S263 PolarHBondContact O-OG 2.96Å; V239-I264 HydrophobicContact CG1-CD1 4.37Å; V239-I264 HydrophobicContact CG1-CG1 3.94Å; V239-I264 WeakPolarHBondContact O-CA 3.3Å; V239-I264 PolarHBondContact O-N 2.81Å
240	A	98.6	Very high	97.3	Very high	15 Å²	15	48.6 Å²	48.6	12%	0.124	25%	0.245	C	C	.	.			trans	-110.6	-34.9	-178	0	0	0	0	0	112.4	M216 K238 S263 L265 D266	M216-A240 PolarHBondContact O-N 2.97Å; K238-A240 PolarHBondContact O-N 2.93Å; A240-S263 WeakPolarHBondContact CA-O 3.37Å; A240-L265 HydrophobicContact CB-CD1 4.47Å; A240-L265 HydrophobicContact CB-CG 4.43Å; A240-L265 PolarHBondContact O-N 2.95Å; A240-D266 PolarHBondContact O-N 2.84Å
241	F	98.9	Very high	97.3	Very high	82 Å²	82	45.6 Å²	45.6	36%	0.36	23%	0.232	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-119.5	110.1	179.3	-58.4	-92.1	0	0	0	109	M216 Q217 L218 F219 D266	M216-F241 PolarHBondContact O-N 3.34Å; Q217-F241 HydrophobicContact CG-CB 4.18Å; Q217-F241 HydrophobicContact CG-CD2 3.88Å; Q217-F241 HydrophobicContact CG-CG 4.36Å; L218-F241 PolarHBondContact N-O 3.35Å; F219-F241 HydrophobicContact CE1-CB 4.36Å; F241-D266 HydrophobicContact CD1-CB 3.56Å; F241-D266 HydrophobicContact CE1-CB 4.04Å; F241-D266 HydrophobicContact CG-CB 4.44Å
242	L	98.9	Very high	97.5	Very high	0 Å²	0	49.1 Å²	49.1	0%	0	25%	0.245	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-117.8	116.5	-179.9	179.5	60.3	0	0	0	109.8	L218 F233 V239 L244 F259 I264 D266 L267 Q268	L218-L242 HydrophobicContact CB-CD1 4.14Å; L218-L242 HydrophobicContact CD2-CD1 3.93Å; L218-L242 HydrophobicContact CG-CD1 4.13Å; F233-L242 HydrophobicContact CE1-CD2 3.63Å; F233-L242 HydrophobicContact CZ-CD2 3.63Å; V239-L242 HydrophobicContact CG2-CB 4.4Å; L242-L244 HydrophobicContact CD1-CD1 4.02Å; L242-L244 HydrophobicContact CD1-CG 4.18Å; L242-L244 HydrophobicContact CD2-CD1 3.87Å; L242-L244 HydrophobicContact CG-CD1 3.91Å; L242-L244 HydrophobicContact CG-CG 4.33Å; L242-F259 HydrophobicContact CD2-CD1 4.25Å; L242-F259 HydrophobicContact CD2-CE1 3.89Å; L242-I264 HydrophobicContact CD2-CD1 4.04Å; L242-D266 PolarHBondContact N-O 3.13Å; L242-L267 HydrophobicContact CB-CD1 4.19Å; L242-L267 HydrophobicContact CD2-CD1 3.85Å; L242-L267 HydrophobicContact CG-CD1 4.11Å; L242-Q268 PolarHBondContact O-N 3.14Å
243	R	98.9	Very high	97.5	Very high	90 Å²	90	48.5 Å²	48.5	34%	0.34	25%	0.246	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-115.2	121	176.5	-58.7	-171.3	175.8	154.3	1.2	111.5	L218 F219 L220 D221 Q268	L218-R243 PolarHBondContact O-N 2.9Å; F219-R243 HydrophobicContact CD1-CB 3.95Å; F219-R243 HydrophobicContact CD1-CG 3.66Å; F219-R243 HydrophobicContact CE1-CG 4.01Å; L220-R243 WeakPolarHBondContact CA-O 3.11Å; L220-R243 PolarHBondContact N-O 2.94Å; D221-R243 WeakPolarHBondContact OD1-CB 3.43Å; D221-R243 WeakPolarHBondContact OD2-CB 3.27Å; R243-Q268 HydrophobicContact CB-CB 4.47Å; R243-Q268 HydrophobicContact CG-CB 4.3Å; R243-Q268 HydrophobicContact CG-CG 4.06Å
244	L	98.9	Very high	97.6	Very high	0 Å²	0	49.1 Å²	49.1	0%	0	25%	0.25	C	C	.	.			trans	-134.7	24.6	-177.9	-78.4	162.8	0	0	0	110.4	M207 L220 I225 I228 L242 N247 L249 Q268 L269 N272	M207-L244 HydrophobicContact SD-CD2 4Å; L220-L244 HydrophobicContact CB-CD2 3.71Å; L220-L244 HydrophobicContact CD1-CD2 3.93Å; L220-L244 HydrophobicContact CG-CD2 4.48Å; I225-L244 HydrophobicContact CD1-CD2 3.94Å; I228-L244 HydrophobicContact CD1-CD1 3.96Å; L242-L244 HydrophobicContact CD1-CD1 4.02Å; L242-L244 HydrophobicContact CD1-CG 4.18Å; L242-L244 HydrophobicContact CD2-CD1 3.87Å; L242-L244 HydrophobicContact CG-CD1 3.91Å; L242-L244 HydrophobicContact CG-CG 4.33Å; L244-N247 PolarHBondContact O-ND2 3.34Å; L244-L249 HydrophobicContact CB-CD1 4.11Å; L244-L249 HydrophobicContact CD1-CD1 4.16Å; L244-Q268 CarbonylContact C-O 3.5Å; L244-Q268 WeakPolarHBondContact CA-O 3.33Å; L244-Q268 PolarHBondContact N-O 2.94Å; L244-L269 HydrophobicContact CB-CD2 3.88Å; L244-L269 HydrophobicContact CD1-CD2 4.12Å; L244-N272 PolarHBondContact O-ND2 2.97Å
245	N	98.9	Very high	97.8	Very high	17 Å²	17	44.2 Å²	44.2	9%	0.091	22%	0.224	C	C	.	.			trans	-63.4	154.8	-179.6	-53.7	-58.9	0	0	0	110.9	D221 N222 N247 Q268 L269 S270	D221-N245 CarbonylContact C-O 3.03Å; D221-N245 WeakPolarHBondContact CA-O 3.42Å; D221-N245 WeakPolarHBondContact OD1-CB 3.06Å; D221-N245 VanDerWaalsContact OD1-CG 3.31Å; D221-N245 PolarHBondContact OD1-N 2.84Å; D221-N245 VanDerWaalsContact OD1-N 3.1Å; D221-N245 PolarHBondContact OD1-ND2 3.33Å; N222-N245 PolarHBondContact N-O 3.36Å; N245-N247 PolarHBondContact O-N 3.05Å; N245-N247 PolarHBondContact O-ND2 3.35Å; N245-Q268 VanDerWaalsContact ND2-CB 3.32Å; N245-Q268 WeakPolarHBondContact ND2-CB 3.15Å; N245-Q268 PolarHBondContact ND2-OE1 2.97Å; N245-Q268 VanDerWaalsContact OD1-C 3.24Å; N245-Q268 VanDerWaalsContact OD1-CB 3.25Å; N245-Q268 WeakPolarHBondContact OD1-CB 3.44Å; N245-L269 PolarHBondContact OD1-N 2.96Å; N245-S270 CarbonylContact C-O 3.55Å; N245-S270 WeakPolarHBondContact CA-O 3.48Å; N245-S270 VanDerWaalsContact OD1-CB 3.3Å; N245-S270 WeakPolarHBondContact OD1-CB 3.46Å; N245-S270 PolarHBondContact OD1-N 2.99Å; N245-S270 PolarHBondContact OD1-OG 2.98Å
246	H	98.9	Very high	97.8	Very high	82 Å²	82	45.4 Å²	45.4	38%	0.38	24%	0.236	S	C	.	.	S	Bend	trans	53.4	56.4	178	-59.9	-88.5	0	0	0	112	N222 N223 S270 H271	N222-H246 VanDerWaalsContact CA-O 3.24Å; N222-H246 WeakPolarHBondContact CA-O 3.31Å; N222-H246 HydrophobicContact CB-CB 4.38Å; N222-H246 PolarHBondContact N-O 3.03Å; N223-H246 PolarHBondContact N-O 3.01Å; H246-S270 PolarHBondContact N-O 3.03Å; H246-H271 WeakPolarHBondContact CA-O 3.34Å; H246-H271 HydrophobicContact CB-CB 4.37Å; H246-H271 AromaticContact CE1-CD2 3.22Å; H246-H271 PolarHBondContact CE1-CD2 2.96Å; H246-H271 AromaticContact CE1-CE1 3.87Å; H246-H271 AromaticContact CE1-CG 3.21Å; H246-H271 AromaticContact CE1-ND1 3.63Å; H246-H271 AromaticContact CE1-NE2 3.64Å; H246-H271 PolarHBondContact N-O 2.86Å; H246-H271 WeakPolarHBondContact ND1-CB 3.38Å; H246-H271 AromaticContact ND1-CD2 3.95Å; H246-H271 AromaticContact ND1-CG 3.53Å; H246-H271 AromaticContact NE2-CD2 3.31Å; H246-H271 PolarHBondContact NE2-CD2 2.99Å; H246-H271 VanDerWaalsContact NE2-CD2 3.31Å; H246-H271 AromaticContact NE2-CG 3.72Å; H246-H271 AromaticContact NE2-NE2 3.9Å
247	N	98.9	Very high	97.6	Very high	11 Å²	11	52.5 Å²	52.5	6%	0.059	26%	0.262	C	S	.	.	S	Bend	trans	-124.6	-166.1	172.9	-86.2	-73.1	0	0	0	109.4	L220 N223 S224 I225 L244 N245 L249 H271 N272	L220-N247 PolarHBondContact O-ND2 2.85Å; N223-N247 WeakPolarHBondContact CA-OD1 3.37Å; N223-N247 WeakPolarHBondContact CB-OD1 3.35Å; S224-N247 PolarHBondContact N-OD1 3.19Å; I225-N247 HydrophobicContact CB-CB 4.34Å; I225-N247 WeakPolarHBondContact CB-OD1 3.25Å; I225-N247 WeakPolarHBondContact CG1-OD1 3.09Å; I225-N247 PolarHBondContact N-OD1 3.07Å; L244-N247 PolarHBondContact O-ND2 3.34Å; N245-N247 PolarHBondContact O-N 3.05Å; N245-N247 PolarHBondContact O-ND2 3.35Å; N247-L249 HydrophobicContact CB-CG 4.43Å; N247-H271 PolarHBondContact N-O 3.24Å; N247-N272 WeakPolarHBondContact CA-OD1 3.22Å; N247-N272 WeakPolarHBondContact CB-OD1 3.12Å; N247-N272 PolarHBondContact N-OD1 2.8Å; N247-N272 PolarHBondContact O-OD1 3.2Å
248	K	98.7	Very high	97.5	Very high	84 Å²	84	49.5 Å²	49.5	37%	0.365	25%	0.245	S	C	.	.			trans	-115.9	23.6	-179.2	-64.1	-175.7	-177.5	179.2	0	112.2	I225 E226 S250 N272	I225-K248 CarbonylContact O-C 3.19Å; I225-K248 VanDerWaalsContact O-C 3.24Å; I225-K248 WeakPolarHBondContact O-CA 3.26Å; I225-K248 PolarHBondContact O-N 3.27Å; E226-K248 HydrophobicContact CG-CB 3.79Å; E226-K248 HydrophobicContact CG-CD 4.21Å; K248-S250 PolarHBondContact O-N 3.23Å; K248-N272 PolarHBondContact N-OD1 3.04Å
249	L	98.7	Very high	97.4	Very high	0 Å²	0	45 Å²	45	0%	0	23%	0.225	C	C	.	.			trans	-62.7	128.6	-178	-64.7	169.7	0	0	0	110	I225 I228 L244 N247 L254 L269 N272 Q273 L274	I225-L249 HydrophobicContact CG2-CD2 4.07Å; I225-L249 PolarHBondContact O-N 3.31Å; I228-L249 HydrophobicContact CD1-CD1 4.45Å; I228-L249 HydrophobicContact CD1-CD2 4.35Å; I228-L249 HydrophobicContact CG1-CD2 4.04Å; L244-L249 HydrophobicContact CB-CD1 4.11Å; L244-L249 HydrophobicContact CD1-CD1 4.16Å; N247-L249 HydrophobicContact CB-CG 4.43Å; L249-L254 HydrophobicContact CD2-CD2 4.49Å; L249-L269 HydrophobicContact CD1-CD2 3.76Å; L249-N272 HydrophobicContact CB-CB 4.23Å; L249-N272 WeakPolarHBondContact CB-OD1 3.49Å; L249-N272 PolarHBondContact N-OD1 3.05Å; L249-Q273 CarbonylContact O-C 3.4Å; L249-Q273 VanDerWaalsContact O-C 3.32Å; L249-Q273 VanDerWaalsContact O-CA 3.28Å; L249-Q273 WeakPolarHBondContact O-CA 3.34Å; L249-Q273 WeakPolarHBondContact O-CB 3.39Å; L249-Q273 PolarHBondContact O-N 2.86Å; L249-L274 HydrophobicContact CB-CD2 4.41Å; L249-L274 PolarHBondContact O-N 3.18Å
250	S	98.1	Very high	97.2	Very high	43 Å²	43	46.9 Å²	46.9	30%	0.301	24%	0.235	S	C	.	.			trans	-117.9	170.6	172.2	67.8	0	0	0	0	109.5	K248 E252 G253 L254	K248-S250 PolarHBondContact O-N 3.23Å; S250-E252 PolarHBondContact O-N 3.42Å; S250-G253 WeakPolarHBondContact O-CA 3.31Å; S250-G253 PolarHBondContact O-N 2.77Å; S250-L254 PolarHBondContact O-N 3.33Å
251	D	97.2	Very high	96.9	Very high	34 Å²	34	47.2 Å²	47.2	18%	0.182	24%	0.236	C	C	.	.	G	3₁₀ helix	trans	-54.3	-40.2	179.6	-62.7	-3.7	0	0	0	112.3	G253 L254 T275 K276	D251-G253 VanDerWaalsContact C-N 3.28Å; D251-G253 PolarHBondContact O-N 2.81Å; D251-L254 PolarHBondContact O-N 3.4Å; D251-T275 PolarHBondContact OD1-N 2.82Å; D251-T275 PolarHBondContact OD2-OG1 3.45Å; D251-K276 PolarHBondContact OD1-N 3.33Å; D251-K276 WeakPolarHBondContact OD2-CD 3.5Å; D251-K276 WeakPolarHBondContact OD2-CG 3.4Å; D251-K276 IonicContact OD2-NZ 3.56Å
252	E	97.1	Very high	96.7	Very high	174 Å²	174	47 Å²	47	81%	0.813	24%	0.244	S	C	*	.	G	3₁₀ helix	trans	-72.9	-20	178	-58.4	-57.9	138.3	0	0	113.1	S250 L254	S250-E252 PolarHBondContact O-N 3.42Å; E252-L254 VanDerWaalsContact C-N 3.3Å
253	G	97.2	Very high	96.6	Very high	11 Å²	11	48.2 Å²	48.2	11%	0.113	25%	0.253	C	S	.	.	G	3₁₀ helix	trans	-80.5	-10.6	175.5	0	0	0	0	0	113.2	E226 G227 I228 S250 D251	E226-G253 WeakPolarHBondContact O-CA 3.26Å; G227-G253 CarbonylContact C-O 3.38Å; G227-G253 WeakPolarHBondContact CA-O 3.48Å; I228-G253 PolarHBondContact N-O 2.98Å; S250-G253 WeakPolarHBondContact O-CA 3.31Å; S250-G253 PolarHBondContact O-N 2.77Å; D251-G253 VanDerWaalsContact C-N 3.28Å; D251-G253 PolarHBondContact O-N 2.81Å
254	L	97.8	Very high	96.5	Very high	25 Å²	25	44 Å²	44	13%	0.131	24%	0.237	C	C	.	.	S	Bend	trans	-88.5	149.5	178.5	-60.1	-173.6	0	0	0	111.2	I228 L249 S250 D251 E252 F259 L274 P278	I228-L254 HydrophobicContact CD1-CD2 4.26Å; L249-L254 HydrophobicContact CD2-CD2 4.49Å; S250-L254 PolarHBondContact O-N 3.33Å; D251-L254 PolarHBondContact O-N 3.4Å; E252-L254 VanDerWaalsContact C-N 3.3Å; L254-F259 HydrophobicContact CD1-CE2 4.15Å; L254-F259 HydrophobicContact CD2-CE2 3.81Å; L254-F259 HydrophobicContact CD2-CZ 3.94Å; L254-L274 HydrophobicContact CD1-CD2 3.72Å; L254-L274 HydrophobicContact CD2-CD2 4.39Å; L254-L274 HydrophobicContact CG-CD2 4.07Å; L254-P278 HydrophobicContact CD1-CB 3.71Å; L254-P278 HydrophobicContact CD1-CG 4.36Å
255	P	96.7	Very high	96.5	Very high	13 Å²	13	46.7 Å²	46.7	8%	0.084	25%	0.251	C	S	.	.			trans	-63.9	154.4	172.1	29.8	-36.7	0	0	0	110.3	R257 G258	P255-R257 PolarHBondContact O-N 3.21Å; P255-R257 VanDerWaalsContact O-N 3.1Å; P255-G258 VanDerWaalsContact CG-O 3.29Å; P255-G258 WeakPolarHBondContact CG-O 3.1Å; P255-G258 WeakPolarHBondContact O-CA 3.26Å; P255-G258 PolarHBondContact O-N 3.1Å
256	S	94.3	Very high	96.5	Very high	101 Å²	101	46.8 Å²	46.8	71%	0.706	25%	0.251	S	S	*	.	T	Hydrogen-bonded Turn	trans	-54.9	-31.5	-178.3	53.7	0	0	0	0	114.2	E230	E230-S256 VanDerWaalsContact OE1-CB 3.23Å; E230-S256 WeakPolarHBondContact OE1-CB 3.38Å; E230-S256 PolarHBondContact OE1-N 2.9Å; E230-S256 PolarHBondContact OE1-OG 3.32Å; E230-S256 PolarHBondContact OE2-OG 3.19Å
257	R	91.6	Very high	96.5	Very high	150 Å²	150	42.9 Å²	42.9	57%	0.566	23%	0.233	S	C	*	.	T	Hydrogen-bonded Turn	trans	-87.5	-0.2	175	-64.8	-170.6	65.3	172.7	-1	114.2	P255 F259 D260	P255-R257 PolarHBondContact O-N 3.21Å; P255-R257 VanDerWaalsContact O-N 3.1Å; R257-F259 PolarHBondContact O-N 3.4Å; R257-D260 IonicContact CZ-OD2 3.74Å; R257-D260 IonicContact NE-OD2 3.79Å; R257-D260 IonicContact NH2-OD2 2.84Å; R257-D260 PolarHBondContact NH2-OD2 2.99Å; R257-D260 WeakPolarHBondContact O-CB 3.48Å; R257-D260 PolarHBondContact O-N 3.17Å
258	G	93.4	Very high	96.5	Very high	9 Å²	9	43.8 Å²	43.8	9%	0.093	24%	0.237	C	C	.	.	T	Hydrogen-bonded Turn	trans	57.1	-130.3	-173.1	0	0	0	0	0	111.7	P255	P255-G258 VanDerWaalsContact CG-O 3.29Å; P255-G258 WeakPolarHBondContact CG-O 3.1Å; P255-G258 WeakPolarHBondContact O-CA 3.26Å; P255-G258 PolarHBondContact O-N 3.1Å
259	F	95.6	Very high	96.5	Very high	4 Å²	4	39.8 Å²	39.8	2%	0.018	22%	0.22	C	C	.	.	B	Isolated β-bridge	trans	-107.5	38.5	177.6	-59.8	-87.7	0	0	0	111.6	I228 F233 L242 L254 R257 V261 I264 L267 L269 P278 R279 S281	I228-F259 HydrophobicContact CD1-CE1 3.86Å; I228-F259 HydrophobicContact CD1-CZ 3.68Å; F233-F259 HydrophobicContact CE2-CD1 4Å; F233-F259 HydrophobicContact CE2-CE1 4.04Å; F233-F259 HydrophobicContact CZ-CD1 4.1Å; F233-F259 AromaticContact CZ-CE1 3.88Å; F233-F259 HydrophobicContact CZ-CE1 3.88Å; L242-F259 HydrophobicContact CD2-CD1 4.25Å; L242-F259 HydrophobicContact CD2-CE1 3.89Å; L254-F259 HydrophobicContact CD1-CE2 4.15Å; L254-F259 HydrophobicContact CD2-CE2 3.81Å; L254-F259 HydrophobicContact CD2-CZ 3.94Å; R257-F259 PolarHBondContact O-N 3.4Å; F259-V261 PolarHBondContact O-N 3.1Å; F259-I264 HydrophobicContact CD1-CD1 4.3Å; F259-L267 HydrophobicContact CB-CD2 3.65Å; F259-L267 HydrophobicContact CD1-CD1 3.97Å; F259-L267 HydrophobicContact CD1-CD2 3.87Å; F259-L267 HydrophobicContact CD2-CD2 3.72Å; F259-L267 HydrophobicContact CE1-CD1 3.97Å; F259-L267 HydrophobicContact CE1-CD2 4.44Å; F259-L267 HydrophobicContact CE2-CD2 4.32Å; F259-L267 HydrophobicContact CG-CD1 4.41Å; F259-L267 HydrophobicContact CG-CD2 3.46Å; F259-L267 VanDerWaalsContact CG-CD2 3.46Å; F259-L267 HydrophobicContact CZ-CD1 4.41Å; F259-L269 HydrophobicContact CD2-CD1 4.11Å; F259-L269 HydrophobicContact CE2-CD1 3.54Å; F259-L269 HydrophobicContact CE2-CD2 4.29Å; F259-L269 HydrophobicContact CZ-CD1 3.94Å; F259-L269 HydrophobicContact CZ-CD2 3.89Å; F259-P278 HydrophobicContact CD2-CB 3.99Å; F259-P278 HydrophobicContact CD2-CG 3.99Å; F259-P278 HydrophobicContact CE2-CB 4.33Å; F259-P278 HydrophobicContact CE2-CG 4.26Å; F259-R279 CarbonylContact C-O 3.47Å; F259-R279 WeakPolarHBondContact CA-O 3.29Å; F259-R279 PolarHBondContact N-O 3.17Å; F259-S281 PolarHBondContact O-N 3.18Å
260	D	93.4	Very high	96.5	Very high	40 Å²	40	40.1 Å²	40.1	21%	0.214	22%	0.222	C	C	.	.			trans	-71.5	64.8	166.7	-173.9	24.7	0	0	0	110.8	R257 R279	R257-D260 IonicContact CZ-OD2 3.74Å; R257-D260 IonicContact NE-OD2 3.79Å; R257-D260 IonicContact NH2-OD2 2.84Å; R257-D260 PolarHBondContact NH2-OD2 2.99Å; R257-D260 WeakPolarHBondContact O-CB 3.48Å; R257-D260 PolarHBondContact O-N 3.17Å; D260-R279 HydrophobicContact CB-CG 4.39Å; D260-R279 IonicContact OD2-NE 3.4Å; D260-R279 IonicContact OD2-NH2 2.83Å
261	V	93.9	Very high	96.5	Very high	22 Å²	22	41.3 Å²	41.3	13%	0.133	22%	0.223	C	C	.	.			trans	-124.2	113	-176.9	-177.9	0	0	0	0	107.4	F233 F259 S263 I264 S281	F233-V261 HydrophobicContact CB-CG1 4.07Å; F233-V261 HydrophobicContact CB-CG2 3.79Å; F233-V261 HydrophobicContact CD2-CG2 3.71Å; F233-V261 HydrophobicContact CG-CG2 3.86Å; F259-V261 PolarHBondContact O-N 3.1Å; V261-S263 WeakPolarHBondContact CG1-OG 3.48Å; V261-S263 PolarHBondContact O-N 3.09Å; V261-I264 HydrophobicContact CB-CD1 3.82Å; V261-I264 HydrophobicContact CB-CG1 4.01Å; V261-I264 HydrophobicContact CG1-CD1 4.01Å; V261-I264 HydrophobicContact CG1-CG1 3.85Å; V261-I264 HydrophobicContact CG2-CD1 4.23Å; V261-I264 PolarHBondContact O-N 3.23Å; V261-S281 WeakPolarHBondContact O-CB 3.47Å
262	S	93.2	Very high	96.6	Very high	76 Å²	76	40.2 Å²	40.2	53%	0.531	22%	0.217	S	C	.	.	T	Hydrogen-bonded Turn	trans	-68.8	-20	-171.9	54.3	0	0	0	0	114.6	S281 H283	S262-S281 WeakPolarHBondContact CA-OG 3.46Å; S262-H283 VanDerWaalsContact O-CB 3.31Å; S262-H283 WeakPolarHBondContact O-CB 3.47Å
263	S	96.6	Very high	96.7	Very high	27 Å²	27	35.6 Å²	35.6	19%	0.189	20%	0.195	C	C	.	.	T	Hydrogen-bonded Turn	trans	-78.9	-25.7	178.3	44.1	0	0	0	0	113.7	P237 V239 A240 V261 L265	P237-S263 WeakPolarHBondContact O-CB 3.46Å; P237-S263 PolarHBondContact O-OG 3.17Å; V239-S263 CarbonylContact O-C 3.33Å; V239-S263 VanDerWaalsContact O-CB 3.31Å; V239-S263 WeakPolarHBondContact O-CB 3.18Å; V239-S263 VanDerWaalsContact O-O 3.11Å; V239-S263 PolarHBondContact O-OG 2.96Å; A240-S263 WeakPolarHBondContact CA-O 3.37Å; V261-S263 WeakPolarHBondContact CG1-OG 3.48Å; V261-S263 PolarHBondContact O-N 3.09Å; S263-L265 PolarHBondContact O-N 3.05Å
264	I	98.2	Very high	96.7	Very high	2 Å²	2	35.1 Å²	35.1	1%	0.01	19%	0.19	C	C	.	.			trans	-73.9	123.5	-177	-59.6	177.5	0	0	0	109.7	F233 V239 L242 F259 V261 L267 L284	F233-I264 HydrophobicContact CE1-CD1 4.41Å; V239-I264 HydrophobicContact CG1-CD1 4.37Å; V239-I264 HydrophobicContact CG1-CG1 3.94Å; V239-I264 WeakPolarHBondContact O-CA 3.3Å; V239-I264 PolarHBondContact O-N 2.81Å; L242-I264 HydrophobicContact CD2-CD1 4.04Å; F259-I264 HydrophobicContact CD1-CD1 4.3Å; V261-I264 HydrophobicContact CB-CD1 3.82Å; V261-I264 HydrophobicContact CB-CG1 4.01Å; V261-I264 HydrophobicContact CG1-CD1 4.01Å; V261-I264 HydrophobicContact CG1-CG1 3.85Å; V261-I264 HydrophobicContact CG2-CD1 4.23Å; V261-I264 PolarHBondContact O-N 3.23Å; I264-L267 HydrophobicContact CG2-CB 4.04Å; I264-L284 HydrophobicContact CB-CD1 4.42Å; I264-L284 HydrophobicContact CG2-CD1 3.69Å
265	L	98.3	Very high	96.7	Very high	56 Å²	56	36.8 Å²	36.8	29%	0.293	20%	0.201	S	C	.	.			trans	-107.8	-36.2	177.8	-56.4	-177.5	0	0	0	111.7	A240 S263 Q285 H286	A240-L265 HydrophobicContact CB-CD1 4.47Å; A240-L265 HydrophobicContact CB-CG 4.43Å; A240-L265 PolarHBondContact O-N 2.95Å; S263-L265 PolarHBondContact O-N 3.05Å; L265-Q285 WeakPolarHBondContact O-CA 3.42Å; L265-Q285 WeakPolarHBondContact O-CB 3.28Å; L265-Q285 PolarHBondContact O-N 3.2Å; L265-H286 PolarHBondContact O-N 3.26Å
266	D	98.8	Very high	96.6	Very high	18 Å²	18	42.4 Å²	42.4	10%	0.096	23%	0.225	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-126	115.8	180	-164.2	-72.1	0	0	0	109.3	A240 F241 L242 Q268 H286	A240-D266 PolarHBondContact O-N 2.84Å; F241-D266 HydrophobicContact CD1-CB 3.56Å; F241-D266 HydrophobicContact CE1-CB 4.04Å; F241-D266 HydrophobicContact CG-CB 4.44Å; L242-D266 PolarHBondContact N-O 3.13Å; D266-Q268 VanDerWaalsContact OD1-CG 3.22Å; D266-Q268 WeakPolarHBondContact OD1-CG 3.13Å; D266-Q268 PolarHBondContact OD1-NE2 2.95Å; D266-H286 IonicContact OD2-CG 3.88Å; D266-H286 IonicContact OD2-ND1 3.81Å; D266-H286 PolarHBondContact OD2-ND1 3.43Å
267	L	98.8	Very high	96.6	Very high	0 Å²	0	38 Å²	38	0%	0	19%	0.194	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-120.9	116.8	-178.5	179	57.7	0	0	0	110.2	L242 F259 I264 L269 L284 H286 L287 H288	L242-L267 HydrophobicContact CB-CD1 4.19Å; L242-L267 HydrophobicContact CD2-CD1 3.85Å; L242-L267 HydrophobicContact CG-CD1 4.11Å; F259-L267 HydrophobicContact CB-CD2 3.65Å; F259-L267 HydrophobicContact CD1-CD1 3.97Å; F259-L267 HydrophobicContact CD1-CD2 3.87Å; F259-L267 HydrophobicContact CD2-CD2 3.72Å; F259-L267 HydrophobicContact CE1-CD1 3.97Å; F259-L267 HydrophobicContact CE1-CD2 4.44Å; F259-L267 HydrophobicContact CE2-CD2 4.32Å; F259-L267 HydrophobicContact CG-CD1 4.41Å; F259-L267 HydrophobicContact CG-CD2 3.46Å; F259-L267 VanDerWaalsContact CG-CD2 3.46Å; F259-L267 HydrophobicContact CZ-CD1 4.41Å; I264-L267 HydrophobicContact CG2-CB 4.04Å; L267-L269 HydrophobicContact CD1-CD1 4.07Å; L267-L269 HydrophobicContact CD1-CD2 4.32Å; L267-L269 HydrophobicContact CD1-CG 3.94Å; L267-L269 HydrophobicContact CD2-CD1 3.82Å; L267-L269 HydrophobicContact CG-CD1 3.83Å; L267-L269 HydrophobicContact CG-CG 4Å; L267-L284 HydrophobicContact CB-CD1 3.73Å; L267-L284 HydrophobicContact CB-CD2 4.28Å; L267-L284 HydrophobicContact CD2-CD2 4.39Å; L267-H286 PolarHBondContact N-O 2.58Å; L267-L287 HydrophobicContact CB-CD1 4.15Å; L267-L287 HydrophobicContact CD2-CD1 3.9Å; L267-L287 HydrophobicContact CG-CD1 4Å; L267-H288 PolarHBondContact O-N 2.8Å
268	Q	98.9	Very high	96.8	Very high	30 Å²	30	31.4 Å²	31.4	14%	0.14	17%	0.17	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-115.1	113.8	-179.9	-44.1	-170.1	6.6	0	0	111.2	L242 R243 L244 N245 D266 H288	L242-Q268 PolarHBondContact O-N 3.14Å; R243-Q268 HydrophobicContact CB-CB 4.47Å; R243-Q268 HydrophobicContact CG-CB 4.3Å; R243-Q268 HydrophobicContact CG-CG 4.06Å; L244-Q268 CarbonylContact C-O 3.5Å; L244-Q268 WeakPolarHBondContact CA-O 3.33Å; L244-Q268 PolarHBondContact N-O 2.94Å; N245-Q268 VanDerWaalsContact ND2-CB 3.32Å; N245-Q268 WeakPolarHBondContact ND2-CB 3.15Å; N245-Q268 PolarHBondContact ND2-OE1 2.97Å; N245-Q268 VanDerWaalsContact OD1-C 3.24Å; N245-Q268 VanDerWaalsContact OD1-CB 3.25Å; N245-Q268 WeakPolarHBondContact OD1-CB 3.44Å; D266-Q268 VanDerWaalsContact OD1-CG 3.22Å; D266-Q268 WeakPolarHBondContact OD1-CG 3.13Å; D266-Q268 PolarHBondContact OD1-NE2 2.95Å; Q268-H288 HydrophobicContact CB-CB 4.41Å
269	L	98.8	Very high	96.9	Very high	0 Å²	0	35.8 Å²	35.8	0%	0	18%	0.184	C	C	.	.			trans	-129	19.4	-176.1	-66.9	168.4	0	0	0	111.5	L244 N245 L249 F259 L267 N272 L274 P278 H288 L289 N292	L244-L269 HydrophobicContact CB-CD2 3.88Å; L244-L269 HydrophobicContact CD1-CD2 4.12Å; N245-L269 PolarHBondContact OD1-N 2.96Å; L249-L269 HydrophobicContact CD1-CD2 3.76Å; F259-L269 HydrophobicContact CD2-CD1 4.11Å; F259-L269 HydrophobicContact CE2-CD1 3.54Å; F259-L269 HydrophobicContact CE2-CD2 4.29Å; F259-L269 HydrophobicContact CZ-CD1 3.94Å; F259-L269 HydrophobicContact CZ-CD2 3.89Å; L267-L269 HydrophobicContact CD1-CD1 4.07Å; L267-L269 HydrophobicContact CD1-CD2 4.32Å; L267-L269 HydrophobicContact CD1-CG 3.94Å; L267-L269 HydrophobicContact CD2-CD1 3.82Å; L267-L269 HydrophobicContact CG-CD1 3.83Å; L267-L269 HydrophobicContact CG-CG 4Å; L269-N272 PolarHBondContact O-ND2 2.96Å; L269-L274 HydrophobicContact CB-CD1 4.29Å; L269-L274 HydrophobicContact CD1-CD1 4.28Å; L269-P278 HydrophobicContact CD1-CG 4.26Å; L269-H288 CarbonylContact C-O 3.23Å; L269-H288 WeakPolarHBondContact CA-O 3.3Å; L269-H288 PolarHBondContact N-O 2.68Å; L269-L289 HydrophobicContact CB-CD2 3.87Å; L269-L289 HydrophobicContact CD1-CD2 4Å; L269-N292 PolarHBondContact O-ND2 3.2Å
270	S	98.8	Very high	96.9	Very high	7 Å²	7	35.6 Å²	35.6	5%	0.049	18%	0.183	C	C	.	.			trans	-61.6	152.3	-179.7	-49.8	0	0	0	0	111.4	N245 H246 N272 H288 D290	N245-S270 CarbonylContact C-O 3.55Å; N245-S270 WeakPolarHBondContact CA-O 3.48Å; N245-S270 VanDerWaalsContact OD1-CB 3.3Å; N245-S270 WeakPolarHBondContact OD1-CB 3.46Å; N245-S270 PolarHBondContact OD1-N 2.99Å; N245-S270 PolarHBondContact OD1-OG 2.98Å; H246-S270 PolarHBondContact N-O 3.03Å; S270-N272 PolarHBondContact O-N 2.85Å; S270-N272 PolarHBondContact O-ND2 3.44Å; S270-H288 PolarHBondContact N-O 2.85Å; S270-H288 WeakPolarHBondContact OG-CB 3.47Å; S270-D290 CarbonylContact C-O 3.55Å; S270-D290 WeakPolarHBondContact CA-O 3.34Å; S270-D290 WeakPolarHBondContact CB-O 3.32Å; S270-D290 WeakPolarHBondContact CB-OD1 3.46Å; S270-D290 VanDerWaalsContact OG-CG 3.27Å; S270-D290 PolarHBondContact OG-OD1 3.32Å
271	H	98.8	Very high	96.9	Very high	69 Å²	69	34.1 Å²	34.1	32%	0.319	18%	0.175	S	C	.	.	S	Bend	trans	55	53.4	179.7	-63.3	-88	0	0	0	113.2	H246 N247 D290 H291	H246-H271 WeakPolarHBondContact CA-O 3.34Å; H246-H271 HydrophobicContact CB-CB 4.37Å; H246-H271 AromaticContact CE1-CD2 3.22Å; H246-H271 PolarHBondContact CE1-CD2 2.96Å; H246-H271 AromaticContact CE1-CE1 3.87Å; H246-H271 AromaticContact CE1-CG 3.21Å; H246-H271 AromaticContact CE1-ND1 3.63Å; H246-H271 AromaticContact CE1-NE2 3.64Å; H246-H271 PolarHBondContact N-O 2.86Å; H246-H271 WeakPolarHBondContact ND1-CB 3.38Å; H246-H271 AromaticContact ND1-CD2 3.95Å; H246-H271 AromaticContact ND1-CG 3.53Å; H246-H271 AromaticContact NE2-CD2 3.31Å; H246-H271 PolarHBondContact NE2-CD2 2.99Å; H246-H271 VanDerWaalsContact NE2-CD2 3.31Å; H246-H271 AromaticContact NE2-CG 3.72Å; H246-H271 AromaticContact NE2-NE2 3.9Å; N247-H271 PolarHBondContact N-O 3.24Å; H271-D290 PolarHBondContact N-O 3.23Å; H271-H291 VanDerWaalsContact CA-O 3.24Å; H271-H291 WeakPolarHBondContact CA-O 3.43Å; H271-H291 VanDerWaalsContact CE1-CB 3.41Å; H271-H291 WeakPolarHBondContact CE1-CB 3.42Å; H271-H291 AromaticContact CE1-CD2 3.69Å; H271-H291 AromaticContact CE1-CG 3.28Å; H271-H291 AromaticContact CE1-ND1 3.65Å; H271-H291 PolarHBondContact N-O 3.45Å; H271-H291 WeakPolarHBondContact ND1-CB 3.45Å; H271-H291 AromaticContact ND1-CG 3.79Å; H271-H291 AromaticContact NE2-CG 3.58Å; H271-H291 AromaticContact NE2-ND1 3.48Å; H271-H291 PolarHBondContact NE2-ND1 2.65Å
272	N	98.8	Very high	96.8	Very high	10 Å²	10	34.5 Å²	34.5	5%	0.053	18%	0.181	C	C	.	.	S	Bend	trans	-120.8	-161.8	171	-84.1	-79.1	0	0	0	109.8	L244 N247 K248 L249 L269 S270 L274 N292	L244-N272 PolarHBondContact O-ND2 2.97Å; N247-N272 WeakPolarHBondContact CA-OD1 3.22Å; N247-N272 WeakPolarHBondContact CB-OD1 3.12Å; N247-N272 PolarHBondContact N-OD1 2.8Å; N247-N272 PolarHBondContact O-OD1 3.2Å; K248-N272 PolarHBondContact N-OD1 3.04Å; L249-N272 HydrophobicContact CB-CB 4.23Å; L249-N272 WeakPolarHBondContact CB-OD1 3.49Å; L249-N272 PolarHBondContact N-OD1 3.05Å; L269-N272 PolarHBondContact O-ND2 2.96Å; S270-N272 PolarHBondContact O-N 2.85Å; S270-N272 PolarHBondContact O-ND2 3.44Å; N272-L274 HydrophobicContact CB-CG 4.37Å; N272-N292 VanDerWaalsContact CA-OD1 3.26Å; N272-N292 WeakPolarHBondContact CA-OD1 3.48Å; N272-N292 WeakPolarHBondContact CB-OD1 3.39Å; N272-N292 PolarHBondContact N-OD1 3.24Å; N272-N292 PolarHBondContact O-OD1 3.03Å
273	Q	98.4	Very high	96.8	Very high	78 Å²	78	35 Å²	35	36%	0.364	18%	0.175	S	C	.	.			trans	-118.9	25.5	-177.7	-54.7	-176.4	58.6	0	0	112.1	L249 N292	L249-Q273 CarbonylContact O-C 3.4Å; L249-Q273 VanDerWaalsContact O-C 3.32Å; L249-Q273 VanDerWaalsContact O-CA 3.28Å; L249-Q273 WeakPolarHBondContact O-CA 3.34Å; L249-Q273 WeakPolarHBondContact O-CB 3.39Å; L249-Q273 PolarHBondContact O-N 2.86Å; Q273-N292 PolarHBondContact N-OD1 2.79Å
274	L	98.3	Very high	96.8	Very high	0 Å²	0	33.9 Å²	33.9	0%	0	17%	0.167	C	C	.	.			trans	-68.5	135.3	-178.9	-58.9	176.2	0	0	0	110.5	L249 L254 L269 N272 L289 N292 K293 I294	L249-L274 HydrophobicContact CB-CD2 4.41Å; L249-L274 PolarHBondContact O-N 3.18Å; L254-L274 HydrophobicContact CD1-CD2 3.72Å; L254-L274 HydrophobicContact CD2-CD2 4.39Å; L254-L274 HydrophobicContact CG-CD2 4.07Å; L269-L274 HydrophobicContact CB-CD1 4.29Å; L269-L274 HydrophobicContact CD1-CD1 4.28Å; N272-L274 HydrophobicContact CB-CG 4.37Å; L274-L289 HydrophobicContact CD1-CD2 3.71Å; L274-N292 HydrophobicContact CB-CB 4.28Å; L274-N292 WeakPolarHBondContact CB-OD1 3.37Å; L274-N292 WeakPolarHBondContact CG-OD1 3.32Å; L274-N292 PolarHBondContact N-OD1 3.19Å; L274-K293 CarbonylContact O-C 3.34Å; L274-K293 VanDerWaalsContact O-C 3.23Å; L274-K293 VanDerWaalsContact O-CA 3.31Å; L274-K293 WeakPolarHBondContact O-CA 3.48Å; L274-K293 PolarHBondContact O-N 3.02Å; L274-I294 PolarHBondContact O-N 3.46Å
275	T	96.9	Very high	96.7	Very high	60 Å²	60	36.5 Å²	36.5	37%	0.368	18%	0.179	S	C	.	.	S	Bend	trans	-105	-13.5	175.6	84.4	0	0	0	0	112.7	D251 K293 I294	D251-T275 PolarHBondContact OD1-N 2.82Å; D251-T275 PolarHBondContact OD2-OG1 3.45Å; T275-K293 WeakPolarHBondContact CA-O 3.48Å; T275-K293 HydrophobicContact CG2-CB 4.34Å; T275-I294 WeakPolarHBondContact O-CA 3.49Å
276	K	95.1	Very high	96.7	Very high	132 Å²	132	36.9 Å²	36.9	57%	0.574	18%	0.179	S	C	*	.	S	Bend	trans	-131.2	151.8	178.1	-62.3	166.1	-165.6	161.2	0	110.1	D251	D251-K276 PolarHBondContact OD1-N 3.33Å; D251-K276 WeakPolarHBondContact OD2-CD 3.5Å; D251-K276 WeakPolarHBondContact OD2-CG 3.4Å; D251-K276 IonicContact OD2-NZ 3.56Å
277	V	94.9	Very high	96.7	Very high	9 Å²	9	36 Å²	36	6%	0.055	18%	0.175	C	C	.	.	P	Polyproline II helix	trans	-69.8	125.8	167.9	-179.3	0	0	0	0	108.7	L289 I294 V297 I302 L327	V277-L289 HydrophobicContact CB-CD1 4.44Å; V277-L289 HydrophobicContact CG1-CD1 3.84Å; V277-L289 HydrophobicContact CG2-CD1 4.24Å; V277-I294 HydrophobicContact CG2-CD1 4.19Å; V277-I294 HydrophobicContact CG2-CG2 4.02Å; V277-V297 HydrophobicContact CG2-CB 4.48Å; V277-V297 HydrophobicContact CG2-CG1 4.3Å; V277-V297 HydrophobicContact CG2-CG2 4.15Å; V277-I302 HydrophobicContact CG1-CB 4.1Å; V277-I302 HydrophobicContact CG1-CD1 3.69Å; V277-I302 HydrophobicContact CG1-CG1 3.82Å; V277-L327 HydrophobicContact CG2-CD2 4.45Å
278	P	95.4	Very high	96.7	Very high	11 Å²	11	37.6 Å²	37.6	7%	0.071	18%	0.182	C	C	.	.	P	Polyproline II helix	trans	-71.1	157.9	178.8	29.8	-35.4	0	0	0	111.8	L254 F259 L269	L254-P278 HydrophobicContact CD1-CB 3.71Å; L254-P278 HydrophobicContact CD1-CG 4.36Å; F259-P278 HydrophobicContact CD2-CB 3.99Å; F259-P278 HydrophobicContact CD2-CG 3.99Å; F259-P278 HydrophobicContact CE2-CB 4.33Å; F259-P278 HydrophobicContact CE2-CG 4.26Å; L269-P278 HydrophobicContact CD1-CG 4.26Å
279	R	94.5	Very high	96.6	Very high	101 Å²	101	36.2 Å²	36.2	38%	0.381	18%	0.175	S	C	.	.	P	Polyproline II helix	trans	-62.7	139.7	168.9	-175	175.2	178.4	166	-0.8	109.6	F259 D260 V301	F259-R279 CarbonylContact C-O 3.47Å; F259-R279 WeakPolarHBondContact CA-O 3.29Å; F259-R279 PolarHBondContact N-O 3.17Å; D260-R279 HydrophobicContact CB-CG 4.39Å; D260-R279 IonicContact OD2-NE 3.4Å; D260-R279 IonicContact OD2-NH2 2.83Å; R279-V301 HydrophobicContact CB-CG1 4.29Å
280	I	95.3	Very high	96.6	Very high	0 Å²	0	36.6 Å²	36.6	0%	0	18%	0.177	C	C	.	.	B	Isolated β-bridge	trans	-129.4	158.3	-179.3	60	168.3	0	0	0	111.4	L284 L287 I302 L322 F344	I280-L284 HydrophobicContact CB-CD2 3.84Å; I280-L284 HydrophobicContact CD1-CD2 3.9Å; I280-L284 HydrophobicContact CG1-CD2 4.49Å; I280-L284 HydrophobicContact CG2-CD2 3.69Å; I280-L287 HydrophobicContact CD1-CD2 4.29Å; I280-L287 HydrophobicContact CG2-CD2 4.08Å; I280-I302 HydrophobicContact CD1-CD1 4.32Å; I280-I302 HydrophobicContact CD1-CG1 3.77Å; I280-I302 HydrophobicContact CG1-CG1 3.93Å; I280-I302 WeakPolarHBondContact CG1-O 3.5Å; I280-L322 HydrophobicContact CD1-CD1 4.46Å; I280-L322 HydrophobicContact CD1-CD2 4.3Å; I280-F344 HydrophobicContact CD1-CE1 4.26Å; I280-F344 HydrophobicContact CD1-CZ 3.99Å
281	S	93.4	Very high	96.6	Very high	8 Å²	8	40 Å²	40	6%	0.056	19%	0.192	C	C	.	.			trans	-75	154.4	171.7	-167.1	0	0	0	0	111.9	F259 V261 S262 H283 L284	F259-S281 PolarHBondContact O-N 3.18Å; V261-S281 WeakPolarHBondContact O-CB 3.47Å; S262-S281 WeakPolarHBondContact CA-OG 3.46Å; S281-H283 PolarHBondContact O-N 3.02Å; S281-H283 PolarHBondContact OG-ND1 3.07Å; S281-L284 PolarHBondContact O-N 2.73Å
282	A	92.2	Very high	96.6	Very high	31 Å²	31	37.2 Å²	37.2	26%	0.256	18%	0.18	S	C	.	.	T	Hydrogen-bonded Turn	trans	-62.3	-17.2	171.6	0	0	0	0	0	113.7	P304 P320 H321	A282-P304 HydrophobicContact CB-CB 4.01Å; A282-P304 HydrophobicContact CB-CG 3.76Å; A282-P320 CarbonylContact O-C 3.58Å; A282-P320 WeakPolarHBondContact O-CA 3.1Å; A282-H321 PolarHBondContact O-N 3.33Å
283	H	93.1	Very high	96.5	Very high	86 Å²	86	41.3 Å²	41.3	40%	0.398	20%	0.197	S	C	.	.	T	Hydrogen-bonded Turn	trans	-85.6	-14.5	-179.1	-60.8	85.6	0	0	0	114	S262 S281 Q285	S262-H283 VanDerWaalsContact O-CB 3.31Å; S262-H283 WeakPolarHBondContact O-CB 3.47Å; S281-H283 PolarHBondContact O-N 3.02Å; S281-H283 PolarHBondContact OG-ND1 3.07Å; H283-Q285 PolarHBondContact O-N 3.27Å
284	L	96.1	Very high	96.4	Very high	4 Å²	4	37.6 Å²	37.6	2%	0.021	18%	0.18	C	C	.	.			trans	-63.3	133.7	-176.4	-171.2	70	0	0	0	110.4	I264 L267 I280 S281 L287 H321 L322	I264-L284 HydrophobicContact CB-CD1 4.42Å; I264-L284 HydrophobicContact CG2-CD1 3.69Å; L267-L284 HydrophobicContact CB-CD1 3.73Å; L267-L284 HydrophobicContact CB-CD2 4.28Å; L267-L284 HydrophobicContact CD2-CD2 4.39Å; I280-L284 HydrophobicContact CB-CD2 3.84Å; I280-L284 HydrophobicContact CD1-CD2 3.9Å; I280-L284 HydrophobicContact CG1-CD2 4.49Å; I280-L284 HydrophobicContact CG2-CD2 3.69Å; S281-L284 PolarHBondContact O-N 2.73Å; L284-L287 HydrophobicContact CD2-CB 4Å; L284-L287 HydrophobicContact CD2-CD1 4.23Å; L284-L287 HydrophobicContact CD2-CD2 4.3Å; L284-L287 HydrophobicContact CD2-CG 4.42Å; L284-H321 CarbonylContact O-C 3.5Å; L284-L322 HydrophobicContact CD2-CD1 4.25Å; L284-L322 HydrophobicContact CG-CD1 4.23Å; L284-L322 WeakPolarHBondContact O-CA 3.37Å; L284-L322 PolarHBondContact O-N 3.05Å
285	Q	96.4	Very high	96.2	Very high	56 Å²	56	44 Å²	44	26%	0.262	21%	0.208	S	C	.	.			trans	-108	-41.8	-176.1	-58.5	-175.2	20.5	0	0	112.3	L265 H283 H321 R323 Y324	L265-Q285 WeakPolarHBondContact O-CA 3.42Å; L265-Q285 WeakPolarHBondContact O-CB 3.28Å; L265-Q285 PolarHBondContact O-N 3.2Å; H283-Q285 PolarHBondContact O-N 3.27Å; Q285-H321 HydrophobicContact CG-CB 4.4Å; Q285-R323 PolarHBondContact O-N 3.09Å; Q285-Y324 PolarHBondContact O-N 3.15Å; Q285-Y324 VanDerWaalsContact O-N 3.14Å
286	H	98.5	Very high	95.9	Very high	65 Å²	65	45 Å²	45	30%	0.301	22%	0.217	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-125	129.5	179.1	-52.1	141.9	0	0	0	110.8	L265 D266 L267	L265-H286 PolarHBondContact O-N 3.26Å; D266-H286 IonicContact OD2-CG 3.88Å; D266-H286 IonicContact OD2-ND1 3.81Å; D266-H286 PolarHBondContact OD2-ND1 3.43Å; L267-H286 PolarHBondContact N-O 2.58Å
287	L	98.4	Very high	95.7	Very high	0 Å²	0	39.1 Å²	39.1	0%	0	19%	0.193	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-128.7	117.1	177	-179.5	54.4	0	0	0	110.4	L267 I280 L284 L289 I302 L322 Y324 L325 R326	L267-L287 HydrophobicContact CB-CD1 4.15Å; L267-L287 HydrophobicContact CD2-CD1 3.9Å; L267-L287 HydrophobicContact CG-CD1 4Å; I280-L287 HydrophobicContact CD1-CD2 4.29Å; I280-L287 HydrophobicContact CG2-CD2 4.08Å; L284-L287 HydrophobicContact CD2-CB 4Å; L284-L287 HydrophobicContact CD2-CD1 4.23Å; L284-L287 HydrophobicContact CD2-CD2 4.3Å; L284-L287 HydrophobicContact CD2-CG 4.42Å; L287-L289 HydrophobicContact CD1-CD1 4.1Å; L287-L289 HydrophobicContact CD1-CD2 4.42Å; L287-L289 HydrophobicContact CD1-CG 3.91Å; L287-L289 HydrophobicContact CD2-CD1 3.71Å; L287-L289 HydrophobicContact CD2-CG 4.41Å; L287-L289 HydrophobicContact CG-CD1 3.79Å; L287-L289 HydrophobicContact CG-CG 3.95Å; L287-I302 HydrophobicContact CD2-CD1 4.49Å; L287-L322 HydrophobicContact CB-CD1 3.85Å; L287-Y324 PolarHBondContact N-O 3.31Å; L287-L325 HydrophobicContact CB-CD1 4.03Å; L287-L325 HydrophobicContact CD2-CD1 3.85Å; L287-L325 HydrophobicContact CG-CD1 3.91Å; L287-L325 WeakPolarHBondContact O-CA 3.44Å; L287-R326 PolarHBondContact O-N 3.06Å
288	H	98.8	Very high	95.5	Very high	33 Å²	33	42.8 Å²	42.8	15%	0.153	21%	0.212	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-108	118.8	174.3	-60.5	-113	0	0	0	110.2	L267 Q268 L269 S270 Y324	L267-H288 PolarHBondContact O-N 2.8Å; Q268-H288 HydrophobicContact CB-CB 4.41Å; L269-H288 CarbonylContact C-O 3.23Å; L269-H288 WeakPolarHBondContact CA-O 3.3Å; L269-H288 PolarHBondContact N-O 2.68Å; S270-H288 PolarHBondContact N-O 2.85Å; S270-H288 WeakPolarHBondContact OG-CB 3.47Å; H288-Y324 AromaticContact CE1-CD1 3.99Å; H288-Y324 AromaticContact CE1-CE1 3.42Å; H288-Y324 VanDerWaalsContact CE1-CE1 3.42Å; H288-Y324 WeakPolarHBondContact CE1-CE1 3.14Å; H288-Y324 AromaticContact ND1-CE1 3.9Å; H288-Y324 AromaticContact NE2-CD1 3.83Å; H288-Y324 AromaticContact NE2-CE1 3.75Å
289	L	98.4	Very high	95.1	Very high	0 Å²	0	43.4 Å²	43.4	0%	0	22%	0.215	C	C	.	.			trans	-132.1	12.5	-179.2	-73.6	168.4	0	0	0	111.5	L269 L274 V277 L287 N292 I294 L325 R326 L327 N330	L269-L289 HydrophobicContact CB-CD2 3.87Å; L269-L289 HydrophobicContact CD1-CD2 4Å; L274-L289 HydrophobicContact CD1-CD2 3.71Å; V277-L289 HydrophobicContact CB-CD1 4.44Å; V277-L289 HydrophobicContact CG1-CD1 3.84Å; V277-L289 HydrophobicContact CG2-CD1 4.24Å; L287-L289 HydrophobicContact CD1-CD1 4.1Å; L287-L289 HydrophobicContact CD1-CD2 4.42Å; L287-L289 HydrophobicContact CD1-CG 3.91Å; L287-L289 HydrophobicContact CD2-CD1 3.71Å; L287-L289 HydrophobicContact CD2-CG 4.41Å; L287-L289 HydrophobicContact CG-CD1 3.79Å; L287-L289 HydrophobicContact CG-CG 3.95Å; L289-N292 PolarHBondContact O-ND2 2.76Å; L289-I294 HydrophobicContact CB-CD1 3.98Å; L289-I294 HydrophobicContact CD1-CD1 4.2Å; L289-I294 HydrophobicContact CD2-CD1 4.34Å; L289-I294 HydrophobicContact CG-CD1 4.42Å; L289-L325 HydrophobicContact CD1-CD1 4.47Å; L289-R326 CarbonylContact C-O 3.18Å; L289-R326 WeakPolarHBondContact CA-O 3.46Å; L289-R326 PolarHBondContact N-O 3.08Å; L289-L327 HydrophobicContact CB-CD2 3.85Å; L289-L327 HydrophobicContact CD1-CD2 4.1Å; L289-N330 PolarHBondContact O-ND2 3.49Å
290	D	98.4	Very high	94.7	Very high	8 Å²	8	44 Å²	44	4%	0.043	24%	0.235	C	C	.	.			trans	-60.9	154	179.5	57.9	-76.7	0	0	0	112.6	S270 H271 N292 R326 D328	S270-D290 CarbonylContact C-O 3.55Å; S270-D290 WeakPolarHBondContact CA-O 3.34Å; S270-D290 WeakPolarHBondContact CB-O 3.32Å; S270-D290 WeakPolarHBondContact CB-OD1 3.46Å; S270-D290 VanDerWaalsContact OG-CG 3.27Å; S270-D290 PolarHBondContact OG-OD1 3.32Å; H271-D290 PolarHBondContact N-O 3.23Å; D290-N292 VanDerWaalsContact C-N 3.32Å; D290-N292 PolarHBondContact O-N 3.43Å; D290-N292 PolarHBondContact O-ND2 2.93Å; D290-R326 HydrophobicContact CB-CG 4.01Å; D290-R326 PolarHBondContact N-O 3.16Å; D290-R326 WeakPolarHBondContact OD1-CD 3.35Å; D290-R326 IonicContact OD1-NE 2.72Å; D290-D328 CarbonylContact C-O 3.52Å; D290-D328 WeakPolarHBondContact CA-O 3.31Å; D290-D328 WeakPolarHBondContact CB-O 3.03Å; D290-D328 WeakPolarHBondContact CB-OD1 3.46Å
291	H	98.4	Very high	94.3	Very high	79 Å²	79	46.9 Å²	46.9	37%	0.366	25%	0.253	S	S	.	.	S	Bend	trans	55.4	43.9	-179.5	-56.8	89	0	0	0	113.6	H271 D328 G329	H271-H291 VanDerWaalsContact CA-O 3.24Å; H271-H291 WeakPolarHBondContact CA-O 3.43Å; H271-H291 VanDerWaalsContact CE1-CB 3.41Å; H271-H291 WeakPolarHBondContact CE1-CB 3.42Å; H271-H291 AromaticContact CE1-CD2 3.69Å; H271-H291 AromaticContact CE1-CG 3.28Å; H271-H291 AromaticContact CE1-ND1 3.65Å; H271-H291 PolarHBondContact N-O 3.45Å; H271-H291 WeakPolarHBondContact ND1-CB 3.45Å; H271-H291 AromaticContact ND1-CG 3.79Å; H271-H291 AromaticContact NE2-CG 3.58Å; H271-H291 AromaticContact NE2-ND1 3.48Å; H271-H291 PolarHBondContact NE2-ND1 2.65Å; H291-D328 PolarHBondContact N-O 2.78Å; H291-G329 WeakPolarHBondContact CA-O 3.24Å
292	N	98.6	Very high	94	Very high	11 Å²	11	46.5 Å²	46.5	6%	0.059	25%	0.25	C	C	.	.	S	Bend	trans	-107.8	-159.2	167.6	-83.5	-85.7	0	0	0	109.8	L269 N272 Q273 L274 L289 D290 I294 N330	L269-N292 PolarHBondContact O-ND2 3.2Å; N272-N292 VanDerWaalsContact CA-OD1 3.26Å; N272-N292 WeakPolarHBondContact CA-OD1 3.48Å; N272-N292 WeakPolarHBondContact CB-OD1 3.39Å; N272-N292 PolarHBondContact N-OD1 3.24Å; N272-N292 PolarHBondContact O-OD1 3.03Å; Q273-N292 PolarHBondContact N-OD1 2.79Å; L274-N292 HydrophobicContact CB-CB 4.28Å; L274-N292 WeakPolarHBondContact CB-OD1 3.37Å; L274-N292 WeakPolarHBondContact CG-OD1 3.32Å; L274-N292 PolarHBondContact N-OD1 3.19Å; L289-N292 PolarHBondContact O-ND2 2.76Å; D290-N292 VanDerWaalsContact C-N 3.32Å; D290-N292 PolarHBondContact O-N 3.43Å; D290-N292 PolarHBondContact O-ND2 2.93Å; N292-I294 HydrophobicContact CB-CD1 4.21Å; N292-I294 HydrophobicContact CB-CG1 4.09Å; N292-N330 VanDerWaalsContact CA-OD1 3.26Å; N292-N330 WeakPolarHBondContact CA-OD1 3.4Å; N292-N330 WeakPolarHBondContact CB-OD1 3.41Å; N292-N330 PolarHBondContact N-OD1 3.27Å; N292-N330 PolarHBondContact O-OD1 3.42Å
293	K	97.8	Very high	93.8	Very high	95 Å²	95	46.9 Å²	46.9	41%	0.413	25%	0.25	S	S	.	.			trans	-118.2	30	177.8	-60.7	177.5	-177.5	172.1	0	111.8	L274 T275 K295 N330	L274-K293 CarbonylContact O-C 3.34Å; L274-K293 VanDerWaalsContact O-C 3.23Å; L274-K293 VanDerWaalsContact O-CA 3.31Å; L274-K293 WeakPolarHBondContact O-CA 3.48Å; L274-K293 PolarHBondContact O-N 3.02Å; T275-K293 WeakPolarHBondContact CA-O 3.48Å; T275-K293 HydrophobicContact CG2-CB 4.34Å; K293-K295 PolarHBondContact O-N 3.29Å; K293-N330 PolarHBondContact N-OD1 2.79Å
294	I	96.4	Very high	93.1	Very high	0 Å²	0	43.5 Å²	43.5	0%	0	24%	0.236	C	C	.	.			trans	-72	127.7	-174	-59.5	169	0	0	0	109.3	L274 T275 V277 L289 N292 S296 L327 N330 E331 I332	L274-I294 PolarHBondContact O-N 3.46Å; T275-I294 WeakPolarHBondContact O-CA 3.49Å; V277-I294 HydrophobicContact CG2-CD1 4.19Å; V277-I294 HydrophobicContact CG2-CG2 4.02Å; L289-I294 HydrophobicContact CB-CD1 3.98Å; L289-I294 HydrophobicContact CD1-CD1 4.2Å; L289-I294 HydrophobicContact CD2-CD1 4.34Å; L289-I294 HydrophobicContact CG-CD1 4.42Å; N292-I294 HydrophobicContact CB-CD1 4.21Å; N292-I294 HydrophobicContact CB-CG1 4.09Å; I294-S296 WeakPolarHBondContact CG2-O 3.45Å; I294-L327 HydrophobicContact CD1-CD2 4.21Å; I294-N330 HydrophobicContact CB-CB 4.17Å; I294-N330 VanDerWaalsContact CB-OD1 3.25Å; I294-N330 WeakPolarHBondContact CB-OD1 3.29Å; I294-N330 WeakPolarHBondContact CG1-OD1 3.4Å; I294-N330 PolarHBondContact N-OD1 2.91Å; I294-E331 CarbonylContact O-C 3.24Å; I294-E331 VanDerWaalsContact O-C 3.24Å; I294-E331 WeakPolarHBondContact O-CA 3.28Å; I294-E331 PolarHBondContact O-N 2.03Å; I294-I332 HydrophobicContact CB-CD1 4.46Å; I294-I332 HydrophobicContact CB-CG1 4.45Å; I294-I332 HydrophobicContact CG2-CD1 4.09Å; I294-I332 HydrophobicContact CG2-CG1 4.16Å; I294-I332 VanDerWaalsContact O-CG1 3.3Å; I294-I332 WeakPolarHBondContact O-CG1 3.43Å; I294-I332 PolarHBondContact O-N 3.17Å
295	K	93.2	Very high	91.7	Very high	134 Å²	134	47 Å²	47	58%	0.583	26%	0.261	S	S	*	.			trans	-96.7	-30.2	-178.7	-65.5	-179	178.7	179.8	0	113.5	K293 E331	K293-K295 PolarHBondContact O-N 3.29Å; K295-E331 WeakPolarHBondContact CE-OE2 2.99Å; K295-E331 HydrophobicContact CG-CB 4.09Å
296	S	90.6	Very high	89.7	Confident	82 Å²	82	49.1 Å²	49.1	57%	0.573	28%	0.279	S	S	*	.			trans	-156.1	155.2	-179.6	63.6	0	0	0	0	111.3	I294	I294-S296 WeakPolarHBondContact CG2-O 3.45Å
297	V	91	Very high	87.3	Confident	9 Å²	9	50.3 Å²	50.3	6%	0.055	30%	0.295	C	S	.	.			trans	-97.2	108.3	175.1	-178.7	0	0	0	0	108.4	V277 V299 I302 L327 I332 L340	V277-V297 HydrophobicContact CG2-CB 4.48Å; V277-V297 HydrophobicContact CG2-CG1 4.3Å; V277-V297 HydrophobicContact CG2-CG2 4.15Å; V297-V299 PolarHBondContact O-N 3.25Å; V297-I302 HydrophobicContact CG1-CG2 4.22Å; V297-L327 HydrophobicContact CG2-CD1 3.78Å; V297-I332 HydrophobicContact CG2-CD1 4.19Å; V297-L340 HydrophobicContact CG1-CD1 4.09Å; V297-L340 HydrophobicContact CG1-CD2 4.45Å
298	N	90.1	Very high	84.8	Confident	86 Å²	86	56.8 Å²	56.8	46%	0.46	33%	0.334	S	S	.	.			trans	-80.9	101.4	174.5	-173.2	-23.2	0	0	0	110	S300 V301 I302	N298-S300 VanDerWaalsContact C-N 3.28Å; N298-S300 PolarHBondContact O-N 3.39Å; N298-S300 PolarHBondContact OD1-N 3.33Å; N298-S300 VanDerWaalsContact OD1-N 3.12Å; N298-V301 HydrophobicContact CB-CB 4.3Å; N298-V301 HydrophobicContact CB-CG2 4.15Å; N298-V301 PolarHBondContact O-N 3.25Å; N298-V301 VanDerWaalsContact O-N 3.1Å; N298-I302 PolarHBondContact O-N 3.3Å; N298-I302 VanDerWaalsContact O-N 3.15Å
299	V	88.2	Confident	82.4	Confident	24 Å²	24	59.3 Å²	59.3	15%	0.145	35%	0.349	C	S	.	.	H	α-helix	trans	-60.1	-36.8	-176.5	-177.3	0	0	0	0	112.2	V297 V301 C303 P337 A339 L340	V297-V299 PolarHBondContact O-N 3.25Å; V299-V301 PolarHBondContact O-N 3.27Å; V299-C303 HydrophobicContact CG1-CB 4.25Å; V299-C303 WeakPolarHBondContact O-CA 3.08Å; V299-C303 WeakPolarHBondContact O-CB 3.27Å; V299-C303 PolarHBondContact O-N 2.75Å; V299-P337 HydrophobicContact CG2-CB 3.7Å; V299-P337 HydrophobicContact CG2-CG 4.07Å; V299-A339 HydrophobicContact CB-CB 4.35Å; V299-A339 HydrophobicContact CG1-CB 3.93Å; V299-A339 HydrophobicContact CG2-CB 4.16Å; V299-L340 HydrophobicContact CG2-CB 4.26Å
300	S	86.3	Confident	79.8	Confident	113 Å²	113	64 Å²	64	79%	0.79	38%	0.379	S	S	*	.	H	α-helix	trans	-66.5	-19.6	179.7	-55.7	0	0	0	0	113.7	N298	N298-S300 VanDerWaalsContact C-N 3.28Å; N298-S300 PolarHBondContact O-N 3.39Å; N298-S300 PolarHBondContact OD1-N 3.33Å; N298-S300 VanDerWaalsContact OD1-N 3.12Å
301	V	85.9	Confident	77.3	Confident	61 Å²	61	68.9 Å²	68.9	37%	0.37	42%	0.42	S	S	.	.	H	α-helix	trans	-93.5	-46.2	178.4	174.8	0	0	0	0	111.5	R279 N298 V299	R279-V301 HydrophobicContact CB-CG1 4.29Å; N298-V301 HydrophobicContact CB-CB 4.3Å; N298-V301 HydrophobicContact CB-CG2 4.15Å; N298-V301 PolarHBondContact O-N 3.25Å; N298-V301 VanDerWaalsContact O-N 3.1Å; V299-V301 PolarHBondContact O-N 3.27Å
302	I	87.7	Confident	74.8	Confident	0 Å²	0	73.9 Å²	73.9	0%	0	44%	0.444	C	S	.	.	H	α-helix	trans	-75.1	-35.4	-178	-165.3	-170.7	0	0	0	111.4	V277 I280 L287 V297 N298 P304 L325 L340 F344	V277-I302 HydrophobicContact CG1-CB 4.1Å; V277-I302 HydrophobicContact CG1-CD1 3.69Å; V277-I302 HydrophobicContact CG1-CG1 3.82Å; I280-I302 HydrophobicContact CD1-CD1 4.32Å; I280-I302 HydrophobicContact CD1-CG1 3.77Å; I280-I302 HydrophobicContact CG1-CG1 3.93Å; I280-I302 WeakPolarHBondContact CG1-O 3.5Å; L287-I302 HydrophobicContact CD2-CD1 4.49Å; V297-I302 HydrophobicContact CG1-CG2 4.22Å; N298-I302 PolarHBondContact O-N 3.3Å; N298-I302 VanDerWaalsContact O-N 3.15Å; I302-P304 WeakPolarHBondContact O-CD 3.26Å; I302-L325 HydrophobicContact CD1-CD2 4.45Å; I302-L340 HydrophobicContact CD1-CD1 4.2Å; I302-L340 HydrophobicContact CG2-CD1 3.8Å; I302-F344 HydrophobicContact CD1-CE2 4.11Å; I302-F344 HydrophobicContact CD1-CZ 4.4Å; I302-F344 HydrophobicContact CG1-CE2 4.17Å; I302-F344 HydrophobicContact CG1-CZ 4.12Å; I302-F344 HydrophobicContact CG2-CE2 4.15Å; I302-F344 WeakPolarHBondContact O-CZ 3.49Å
303	C	86.8	Confident	72.5	Confident	39 Å²	39	82 Å²	82	26%	0.264	47%	0.474	S	S	.	.	S	Bend	trans	-69.1	112.1	177.6	-169	0	0	0	0	108.3	V299 S305 C343	V299-C303 HydrophobicContact CG1-CB 4.25Å; V299-C303 WeakPolarHBondContact O-CA 3.08Å; V299-C303 WeakPolarHBondContact O-CB 3.27Å; V299-C303 PolarHBondContact O-N 2.75Å; C303-S305 PolarHBondContact O-N 2.8Å; C303-C343 WeakPolarHBondContact CA-SG 3.31Å; C303-C343 HydrophobicContact CB-CB 3.91Å; C303-C343 WeakPolarHBondContact CB-SG 3.5Å; C303-C343 WeakPolarHBondContact SG-CB 3.44Å; C303-C343 CovalentContact SG-SG 2.03Å; C303-C343 PolarHBondContact SG-SG 2.8Å
304	P	78.5	Confident	70.2	Confident	14 Å²	14	83.8 Å²	83.8	9%	0.091	49%	0.488	C	S	.	.			trans	-65.2	125.1	-179.6	7.5	0.6	0	0	0	108	A282 I302 P320	A282-P304 HydrophobicContact CB-CB 4.01Å; A282-P304 HydrophobicContact CB-CG 3.76Å; I302-P304 WeakPolarHBondContact O-CD 3.26Å; P304-P320 HydrophobicContact CG-CB 3.96Å; P304-P320 HydrophobicContact CG-CG 3.84Å
305	S	67.4	Low	68	Low	79 Å²	79	86.9 Å²	86.9	55%	0.552	51%	0.51	S	S	*	.			trans	-57	137	174.6	-174.5	0	0	0	0	108.7	C303 S307	C303-S305 PolarHBondContact O-N 2.8Å; S305-S307 PolarHBondContact O-N 2.81Å; S305-S307 PolarHBondContact O-OG 3.45Å
306	P	54.9	Low	66	Low	99 Å²	99	87.3 Å²	87.3	64%	0.643	51%	0.512	S	S	*	.			trans	-71.1	65.6	172.1	29.8	-32.9	0	0	0	109.3	T308 L309	P306-T308 PolarHBondContact O-N 2.85Å; P306-L309 HydrophobicContact CB-CD1 4.24Å
307	S	48.2	Very low	64.2	Low	91 Å²	91	87.4 Å²	87.4	64%	0.636	51%	0.512	S	S	*	.	T	Hydrogen-bonded Turn	trans	-68.8	102.5	164	42.8	0	0	0	0	106.7	S305	S305-S307 PolarHBondContact O-N 2.81Å; S305-S307 PolarHBondContact O-OG 3.45Å
308	T	45.9	Very low	62.7	Low	135 Å²	135	93 Å²	93	83%	0.828	53%	0.533	S	S	*	.	T	Hydrogen-bonded Turn	trans	74.8	55.9	174.4	72.1	0	0	0	0	117.5	P306	P306-T308 PolarHBondContact O-N 2.85Å
309	L	48.5	Very low	62	Low	87 Å²	87	89.5 Å²	89.5	46%	0.455	52%	0.518	S	S	.	.			trans	-101.4	122.8	155.1	-69.8	172.8	0	0	0	109.2	P306 A311 Y318	P306-L309 HydrophobicContact CB-CD1 4.24Å; L309-A311 PolarHBondContact O-N 3.23Å; L309-Y318 WeakPolarHBondContact CD1-O 2.91Å
310	P	42.7	Very low	62.1	Low	99 Å²	99	89.5 Å²	89.5	64%	0.643	52%	0.518	S	S	*	.			trans	-55.1	131.4	171.2	-20.8	31.8	0	0	0	109.1	E312	P310-E312 PolarHBondContact O-N 2.98Å
311	A	46.3	Very low	62.4	Low	109 Å²	109	86.8 Å²	86.8	90%	0.901	49%	0.493	S	S	*	.	T	Hydrogen-bonded Turn	trans	-63.9	15.9	-167	0	0	0	0	0	116.6	L309	L309-A311 PolarHBondContact O-N 3.23Å
312	E	45.7	Very low	62.9	Low	184 Å²	184	83.9 Å²	83.9	86%	0.86	48%	0.475	S	S	*	.	T	Hydrogen-bonded Turn	trans	-144.6	22.8	-167.3	-66.1	-171.1	161.1	0	0	115.3	P310	P310-E312 PolarHBondContact O-N 2.98Å
313	R	51.2	Low	63.2	Low	182 Å²	182	88.5 Å²	88.5	69%	0.687	49%	0.493	S	S	*	.	S	Bend	trans	-128.1	136.4	174.7	-64.9	-172.1	-167.6	-162.5	3.2	112.6	S315 Y318	R313-S315 PolarHBondContact O-N 2.78Å; R313-Y318 HydrophobicContact CB-CD2 4.38Å; R313-Y318 HydrophobicContact CB-CE2 4.33Å
314	D	48.8	Very low	63.7	Low	132 Å²	132	89.6 Å²	89.6	71%	0.706	49%	0.492	S	S	*	.			trans	-40.1	115.8	-172.9	-70.9	-42.6	0	0	0	113.5	F316 S317	D314-F316 PolarHBondContact O-N 3.24Å; D314-S317 PolarHBondContact O-N 3.28Å; D314-S317 VanDerWaalsContact O-N 3.17Å
315	S	51.1	Low	64.5	Low	66 Å²	66	89 Å²	89	46%	0.462	49%	0.488	S	S	.	.	H	α-helix	trans	-58.8	-7.8	178.3	-54.3	0	0	0	0	114.4	R313 G319	R313-S315 PolarHBondContact O-N 2.78Å; S315-G319 PolarHBondContact O-N 3.1Å
316	F	50.1	Low	65.9	Low	142 Å²	142	89 Å²	89	62%	0.623	48%	0.475	S	S	*	.	H	α-helix	trans	-76	-27.7	177.5	-72.8	-77.9	0	0	0	113.5	D314	D314-F316 PolarHBondContact O-N 3.24Å
317	S	53.3	Low	67.9	Low	84 Å²	84	84.3 Å²	84.3	59%	0.587	45%	0.445	S	S	*	.	H	α-helix	trans	-104.1	-11.4	-176.8	-147.8	0	0	0	0	114	D314	D314-S317 PolarHBondContact O-N 3.28Å; D314-S317 VanDerWaalsContact O-N 3.17Å
318	Y	60.1	Low	70.2	Confident	127 Å²	127	81.3 Å²	81.3	50%	0.498	42%	0.422	S	S	.	.	H	α-helix	trans	-131	4.4	-173.7	-62.2	-79.7	0	0	0	114	L309 R313	L309-Y318 WeakPolarHBondContact CD1-O 2.91Å; R313-Y318 HydrophobicContact CB-CD2 4.38Å; R313-Y318 HydrophobicContact CB-CE2 4.33Å
319	G	75.2	Confident	72.6	Confident	13 Å²	13	77.1 Å²	77.1	13%	0.134	41%	0.406	C	S	.	.	S	Bend	trans	-81.9	177.2	177.5	0	0	0	0	0	113.4	S315 H321	S315-G319 PolarHBondContact O-N 3.1Å; G319-H321 PolarHBondContact O-CD2 3.3Å; G319-H321 VanDerWaalsContact O-CD2 3.27Å; G319-H321 PolarHBondContact O-N 3.31Å
320	P	90.5	Very high	74.9	Confident	23 Å²	23	74.2 Å²	74.2	15%	0.149	39%	0.391	C	S	.	.			trans	-56.7	132.9	176	-23.8	34.7	0	0	0	112.7	A282 P304 F344	A282-P320 CarbonylContact O-C 3.58Å; A282-P320 WeakPolarHBondContact O-CA 3.1Å; P304-P320 HydrophobicContact CG-CB 3.96Å; P304-P320 HydrophobicContact CG-CG 3.84Å; P320-F344 HydrophobicContact CB-CD1 3.44Å; P320-F344 VanDerWaalsContact CB-CD1 3.44Å; P320-F344 HydrophobicContact CB-CE1 3.47Å; P320-F344 VanDerWaalsContact CB-CE1 3.47Å; P320-F344 HydrophobicContact CG-CD1 4.42Å; P320-F344 HydrophobicContact CG-CE1 4.37Å
321	H	92.6	Very high	77.4	Confident	56 Å²	56	74.5 Å²	74.5	26%	0.259	38%	0.383	S	S	.	.			trans	-91.5	8.6	-170.4	-65.2	147.5	0	0	0	115.4	A282 L284 Q285 G319 R323	A282-H321 PolarHBondContact O-N 3.33Å; L284-H321 CarbonylContact O-C 3.5Å; Q285-H321 HydrophobicContact CG-CB 4.4Å; G319-H321 PolarHBondContact O-CD2 3.3Å; G319-H321 VanDerWaalsContact O-CD2 3.27Å; G319-H321 PolarHBondContact O-N 3.31Å; H321-R323 WeakPolarHBondContact O-CG 3.41Å; H321-R323 PolarHBondContact O-N 3.27Å
322	L	94.6	Very high	79.5	Confident	1 Å²	1	70.4 Å²	70.4	1%	0.005	35%	0.346	C	S	.	.			trans	-62.9	121.4	-177.5	-165.4	71.1	0	0	0	110.4	I280 L284 L287 L325 F344 L346 L347	I280-L322 HydrophobicContact CD1-CD1 4.46Å; I280-L322 HydrophobicContact CD1-CD2 4.3Å; L284-L322 HydrophobicContact CD2-CD1 4.25Å; L284-L322 HydrophobicContact CG-CD1 4.23Å; L284-L322 WeakPolarHBondContact O-CA 3.37Å; L284-L322 PolarHBondContact O-N 3.05Å; L287-L322 HydrophobicContact CB-CD1 3.85Å; L322-L325 HydrophobicContact CD2-CB 4.27Å; L322-F344 HydrophobicContact CB-CB 4.43Å; L322-F344 HydrophobicContact CB-CD1 3.33Å; L322-F344 HydrophobicContact CB-CE1 3.68Å; L322-F344 HydrophobicContact CB-CG 3.99Å; L322-F344 HydrophobicContact CD2-CD1 4.1Å; L322-F344 HydrophobicContact CD2-CD2 4.29Å; L322-F344 HydrophobicContact CD2-CE1 4.08Å; L322-F344 HydrophobicContact CD2-CE2 4.28Å; L322-F344 HydrophobicContact CD2-CG 4.2Å; L322-F344 HydrophobicContact CD2-CZ 4.18Å; L322-F344 HydrophobicContact CG-CD1 4.36Å; L322-L346 CarbonylContact O-C 3.06Å; L322-L347 HydrophobicContact CD2-CD1 4.25Å; L322-L347 HydrophobicContact CG-CD1 4.14Å; L322-L347 WeakPolarHBondContact O-CA 3.39Å; L322-L347 PolarHBondContact O-N 2.79Å
323	R	95.1	Very high	81.4	Confident	97 Å²	97	70.2 Å²	70.2	37%	0.366	34%	0.343	S	S	.	.			trans	-108.4	-28.8	-179.2	-63.8	-176.7	-179	-168.2	-1.5	112.8	Q285 H321 Q348 A349	Q285-R323 PolarHBondContact O-N 3.09Å; H321-R323 WeakPolarHBondContact O-CG 3.41Å; H321-R323 PolarHBondContact O-N 3.27Å; R323-Q348 PolarHBondContact O-N 2.72Å; R323-A349 PolarHBondContact O-N 2.84Å
324	Y	97.1	Very high	82.8	Confident	61 Å²	61	66.6 Å²	66.6	24%	0.239	34%	0.342	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-137.3	125.9	-176.3	-174.3	-99.3	0	0	0	110.7	Q285 L287 H288 R326 A349 I351	Q285-Y324 PolarHBondContact O-N 3.15Å; Q285-Y324 VanDerWaalsContact O-N 3.14Å; L287-Y324 PolarHBondContact N-O 3.31Å; H288-Y324 AromaticContact CE1-CD1 3.99Å; H288-Y324 AromaticContact CE1-CE1 3.42Å; H288-Y324 VanDerWaalsContact CE1-CE1 3.42Å; H288-Y324 WeakPolarHBondContact CE1-CE1 3.14Å; H288-Y324 AromaticContact ND1-CE1 3.9Å; H288-Y324 AromaticContact NE2-CD1 3.83Å; H288-Y324 AromaticContact NE2-CE1 3.75Å; Y324-R326 HydrophobicContact CD1-CB 4.43Å; Y324-R326 HydrophobicContact CE1-CB 3.6Å; Y324-R326 HydrophobicContact CE1-CG 4.38Å; Y324-R326 WeakPolarHBondContact OH-CD 3.17Å; Y324-A349 HydrophobicContact CD2-CB 3.97Å; Y324-A349 HydrophobicContact CE2-CB 4.2Å; Y324-I351 HydrophobicContact CE2-CG1 4.17Å
325	L	96.1	Very high	84.2	Confident	1 Å²	1	66 Å²	66	1%	0.005	35%	0.345	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-128.3	120	174.6	177	59.2	0	0	0	110	L287 L289 I302 L322 L327 L340 L347 A349 V350 I351	L287-L325 HydrophobicContact CB-CD1 4.03Å; L287-L325 HydrophobicContact CD2-CD1 3.85Å; L287-L325 HydrophobicContact CG-CD1 3.91Å; L287-L325 WeakPolarHBondContact O-CA 3.44Å; L289-L325 HydrophobicContact CD1-CD1 4.47Å; I302-L325 HydrophobicContact CD1-CD2 4.45Å; L322-L325 HydrophobicContact CD2-CB 4.27Å; L325-L327 HydrophobicContact CD1-CD1 4.32Å; L325-L327 HydrophobicContact CD1-CD2 4.36Å; L325-L327 HydrophobicContact CD1-CG 4.07Å; L325-L327 HydrophobicContact CD2-CD1 3.79Å; L325-L327 HydrophobicContact CD2-CG 4.42Å; L325-L327 HydrophobicContact CG-CD1 3.88Å; L325-L327 HydrophobicContact CG-CG 3.98Å; L325-L340 HydrophobicContact CD2-CD2 3.85Å; L325-L347 HydrophobicContact CB-CD1 4.08Å; L325-A349 PolarHBondContact N-O 3.2Å; L325-A349 VanDerWaalsContact N-O 3.13Å; L325-V350 HydrophobicContact CB-CG2 4.47Å; L325-V350 HydrophobicContact CD2-CG1 4.36Å; L325-V350 HydrophobicContact CG-CG1 4.44Å; L325-V350 VanDerWaalsContact O-CA 3.29Å; L325-V350 WeakPolarHBondContact O-CA 3.23Å; L325-I351 PolarHBondContact O-N 3.01Å
326	R	97.1	Very high	85.5	Confident	79 Å²	79	64 Å²	64	30%	0.298	33%	0.331	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-114	123	179.6	-168.3	179	-178.7	175.9	-3.6	111	L287 L289 D290 Y324 D328 I351	L287-R326 PolarHBondContact O-N 3.06Å; L289-R326 CarbonylContact C-O 3.18Å; L289-R326 WeakPolarHBondContact CA-O 3.46Å; L289-R326 PolarHBondContact N-O 3.08Å; D290-R326 HydrophobicContact CB-CG 4.01Å; D290-R326 PolarHBondContact N-O 3.16Å; D290-R326 WeakPolarHBondContact OD1-CD 3.35Å; D290-R326 IonicContact OD1-NE 2.72Å; Y324-R326 HydrophobicContact CD1-CB 4.43Å; Y324-R326 HydrophobicContact CE1-CB 3.6Å; Y324-R326 HydrophobicContact CE1-CG 4.38Å; Y324-R326 WeakPolarHBondContact OH-CD 3.17Å; R326-D328 WeakPolarHBondContact CD-OD1 3.39Å; R326-D328 WeakPolarHBondContact CG-OD1 3.39Å; R326-D328 IonicContact CZ-OD1 3.76Å; R326-D328 IonicContact CZ-OD2 2.85Å; R326-D328 IonicContact NE-OD1 2.9Å; R326-D328 PolarHBondContact NE-OD1 3.29Å; R326-D328 IonicContact NE-OD2 4Å; R326-D328 PolarHBondContact NE-OD2 2.95Å; R326-D328 IonicContact NH2-OD1 3.25Å; R326-D328 IonicContact NH2-OD2 2.76Å; R326-D328 PolarHBondContact NH2-OD2 3.25Å; R326-I351 HydrophobicContact CG-CB 4.12Å
327	L	96.2	Very high	87.1	Confident	1 Å²	1	59.8 Å²	59.8	1%	0.005	32%	0.317	C	S	.	.			trans	-135.9	3.8	-170.8	-71.5	168.9	0	0	0	113.2	V277 L289 I294 V297 L325 N330 I332 V350 I351 I352	V277-L327 HydrophobicContact CG2-CD2 4.45Å; L289-L327 HydrophobicContact CB-CD2 3.85Å; L289-L327 HydrophobicContact CD1-CD2 4.1Å; I294-L327 HydrophobicContact CD1-CD2 4.21Å; V297-L327 HydrophobicContact CG2-CD1 3.78Å; L325-L327 HydrophobicContact CD1-CD1 4.32Å; L325-L327 HydrophobicContact CD1-CD2 4.36Å; L325-L327 HydrophobicContact CD1-CG 4.07Å; L325-L327 HydrophobicContact CD2-CD1 3.79Å; L325-L327 HydrophobicContact CD2-CG 4.42Å; L325-L327 HydrophobicContact CG-CD1 3.88Å; L325-L327 HydrophobicContact CG-CG 3.98Å; L327-N330 WeakPolarHBondContact O-CB 3.39Å; L327-N330 PolarHBondContact O-ND2 3.4Å; L327-I332 HydrophobicContact CB-CD1 3.88Å; L327-I332 HydrophobicContact CD1-CD1 3.98Å; L327-I332 HydrophobicContact CD2-CD1 3.99Å; L327-I332 HydrophobicContact CG-CD1 4.18Å; L327-V350 HydrophobicContact CD1-CG1 4.49Å; L327-I351 CarbonylContact C-O 3.44Å; L327-I351 WeakPolarHBondContact CA-O 3.22Å; L327-I351 WeakPolarHBondContact CB-O 3.39Å; L327-I351 PolarHBondContact N-O 2.76Å; L327-I352 HydrophobicContact CB-CG1 4.31Å
328	D	95.8	Very high	88.5	Confident	28 Å²	28	63 Å²	63	15%	0.15	33%	0.325	C	S	.	.	T	Hydrogen-bonded Turn	trans	-58.7	152.6	178.9	51.9	-57.1	0	0	0	112.9	D290 H291 R326 N330 I351 I352	D290-D328 CarbonylContact C-O 3.52Å; D290-D328 WeakPolarHBondContact CA-O 3.31Å; D290-D328 WeakPolarHBondContact CB-O 3.03Å; D290-D328 WeakPolarHBondContact CB-OD1 3.46Å; H291-D328 PolarHBondContact N-O 2.78Å; R326-D328 WeakPolarHBondContact CD-OD1 3.39Å; R326-D328 WeakPolarHBondContact CG-OD1 3.39Å; R326-D328 IonicContact CZ-OD1 3.76Å; R326-D328 IonicContact CZ-OD2 2.85Å; R326-D328 IonicContact NE-OD1 2.9Å; R326-D328 PolarHBondContact NE-OD1 3.29Å; R326-D328 IonicContact NE-OD2 4Å; R326-D328 PolarHBondContact NE-OD2 2.95Å; R326-D328 IonicContact NH2-OD1 3.25Å; R326-D328 IonicContact NH2-OD2 2.76Å; R326-D328 PolarHBondContact NH2-OD2 3.25Å; D328-N330 PolarHBondContact O-N 3.13Å; D328-I351 HydrophobicContact CB-CG2 4.12Å; D328-I351 PolarHBondContact N-O 3.34Å; D328-I352 VanDerWaalsContact CA-OXT 3.3Å; D328-I352 WeakPolarHBondContact CA-OXT 2.98Å
329	G	96.2	Very high	89.7	Confident	47 Å²	47	59.2 Å²	59.2	49%	0.485	32%	0.32	S	S	.	.	T	Hydrogen-bonded Turn	trans	71	15.5	-178.4	0	0	0	0	0	114.8	H291	H291-G329 WeakPolarHBondContact CA-O 3.24Å
330	N	97.1	Very high	90.3	Very high	26 Å²	26	58.6 Å²	58.6	14%	0.139	31%	0.313	C	S	.	.	S	Bend	trans	-95.3	179.1	168.4	-79	-81.5	0	0	0	111.9	L289 N292 K293 I294 L327 D328 I332	L289-N330 PolarHBondContact O-ND2 3.49Å; N292-N330 VanDerWaalsContact CA-OD1 3.26Å; N292-N330 WeakPolarHBondContact CA-OD1 3.4Å; N292-N330 WeakPolarHBondContact CB-OD1 3.41Å; N292-N330 PolarHBondContact N-OD1 3.27Å; N292-N330 PolarHBondContact O-OD1 3.42Å; K293-N330 PolarHBondContact N-OD1 2.79Å; I294-N330 HydrophobicContact CB-CB 4.17Å; I294-N330 VanDerWaalsContact CB-OD1 3.25Å; I294-N330 WeakPolarHBondContact CB-OD1 3.29Å; I294-N330 WeakPolarHBondContact CG1-OD1 3.4Å; I294-N330 PolarHBondContact N-OD1 2.91Å; L327-N330 WeakPolarHBondContact O-CB 3.39Å; L327-N330 PolarHBondContact O-ND2 3.4Å; D328-N330 PolarHBondContact O-N 3.13Å; N330-I332 HydrophobicContact CB-CD1 4.06Å; N330-I332 HydrophobicContact CB-CG1 3.94Å; N330-I332 PolarHBondContact O-N 3.48Å
331	E	94.8	Very high	90	Very high	106 Å²	106	61.8 Å²	61.8	50%	0.495	33%	0.328	S	S	.	.			trans	-90.6	25	176.2	-62.3	177.2	-153.4	0	0	112.5	I294 K295 K333	I294-E331 CarbonylContact O-C 3.24Å; I294-E331 VanDerWaalsContact O-C 3.24Å; I294-E331 WeakPolarHBondContact O-CA 3.28Å; I294-E331 PolarHBondContact O-N 2.03Å; K295-E331 WeakPolarHBondContact CE-OE2 2.99Å; K295-E331 HydrophobicContact CG-CB 4.09Å; E331-K333 PolarHBondContact O-N 3.42Å
332	I	91.1	Very high	89.7	Confident	22 Å²	22	63.7 Å²	63.7	11%	0.113	34%	0.343	C	S	.	.	P	Polyproline II helix	trans	-75.3	124.7	-175.8	-63	172.5	0	0	0	109.3	I294 V297 L327 N330 P334 V336 I352	I294-I332 HydrophobicContact CB-CD1 4.46Å; I294-I332 HydrophobicContact CB-CG1 4.45Å; I294-I332 HydrophobicContact CG2-CD1 4.09Å; I294-I332 HydrophobicContact CG2-CG1 4.16Å; I294-I332 VanDerWaalsContact O-CG1 3.3Å; I294-I332 WeakPolarHBondContact O-CG1 3.43Å; I294-I332 PolarHBondContact O-N 3.17Å; V297-I332 HydrophobicContact CG2-CD1 4.19Å; L327-I332 HydrophobicContact CB-CD1 3.88Å; L327-I332 HydrophobicContact CD1-CD1 3.98Å; L327-I332 HydrophobicContact CD2-CD1 3.99Å; L327-I332 HydrophobicContact CG-CD1 4.18Å; N330-I332 HydrophobicContact CB-CD1 4.06Å; N330-I332 HydrophobicContact CB-CG1 3.94Å; N330-I332 PolarHBondContact O-N 3.48Å; I332-P334 WeakPolarHBondContact O-CD 3.06Å; I332-V336 HydrophobicContact CG2-CG2 4.26Å; I332-I352 HydrophobicContact CB-CG2 4.42Å; I332-I352 HydrophobicContact CG2-CG2 4.22Å
333	K	84.6	Confident	89.5	Confident	181 Å²	181	64.6 Å²	64.6	79%	0.787	35%	0.349	S	S	*	.	P	Polyproline II helix	trans	-89.9	122.1	169.7	-66.2	-175.5	-179.8	-178.6	0	109.4	E331	E331-K333 PolarHBondContact O-N 3.42Å
334	P	80.6	Confident	89.2	Confident	105 Å²	105	60.1 Å²	60.1	68%	0.682	33%	0.332	S	S	*	.	S	Bend	trans	-57.6	154.2	170.8	-24.5	34.5	0	0	0	112	I332	I332-P334 WeakPolarHBondContact O-CD 3.06Å
335	P	80.1	Confident	88.8	Confident	119 Å²	119	64 Å²	64	77%	0.773	35%	0.347	S	S	*	.	P	Polyproline II helix	cis	-84.7	150.6	1.6	33.4	-34.3	0	0	0	113.2
336	V	78.4	Confident	88.5	Confident	26 Å²	26	66.6 Å²	66.6	16%	0.158	36%	0.36	C	S	.	.	P	Polyproline II helix	trans	-68.5	139.3	166.5	166.1	0	0	0	0	109.6	I332 M338 L340 I352	I332-V336 HydrophobicContact CG2-CG2 4.26Å; V336-M338 PolarHBondContact O-N 3.12Å; V336-L340 HydrophobicContact CG1-CB 4.44Å; V336-L340 HydrophobicContact CG1-CD2 3.52Å; V336-I352 HydrophobicContact CB-CD1 3.93Å; V336-I352 HydrophobicContact CG2-CD1 3.24Å; V336-I352 HydrophobicContact CG2-CG1 3.81Å
337	P	83	Confident	88.2	Confident	52 Å²	52	64 Å²	64	34%	0.338	35%	0.352	S	S	.	.	P	Polyproline II helix	trans	-58.7	128.5	-173.2	-26.6	35.2	0	0	0	113	V299 A339 L340	V299-P337 HydrophobicContact CG2-CB 3.7Å; V299-P337 HydrophobicContact CG2-CG 4.07Å; P337-A339 PolarHBondContact O-N 3.15Å; P337-A339 VanDerWaalsContact O-N 3.08Å; P337-L340 WeakPolarHBondContact O-CB 3.44Å; P337-L340 PolarHBondContact O-N 3.21Å
338	M	82.7	Confident	88	Confident	152 Å²	152	70.8 Å²	70.8	75%	0.749	38%	0.384	S	S	*	.	H	α-helix	trans	-55.7	-28.4	174.7	-71.3	-62.2	-69.2	0	0	112.8	V336 L340 M341 T342	V336-M338 PolarHBondContact O-N 3.12Å; M338-L340 PolarHBondContact O-N 3.31Å; M338-L340 VanDerWaalsContact O-N 3.16Å; M338-M341 PolarHBondContact O-N 3.1Å; M338-T342 PolarHBondContact O-N 2.88Å
339	A	85.9	Confident	87.7	Confident	47 Å²	47	71 Å²	71	39%	0.388	39%	0.389	S	S	.	.	H	α-helix	trans	-59.1	-24.3	175.5	0	0	0	0	0	113.2	V299 P337 T342 C343	V299-A339 HydrophobicContact CB-CB 4.35Å; V299-A339 HydrophobicContact CG1-CB 3.93Å; V299-A339 HydrophobicContact CG2-CB 4.16Å; P337-A339 PolarHBondContact O-N 3.15Å; P337-A339 VanDerWaalsContact O-N 3.08Å; A339-T342 VanDerWaalsContact C-OG1 3.29Å; A339-T342 WeakPolarHBondContact CA-OG1 3.21Å; A339-T342 PolarHBondContact O-N 3.19Å; A339-T342 PolarHBondContact O-OG1 3.2Å; A339-C343 PolarHBondContact O-N 2.77Å; A339-C343 VanDerWaalsContact O-N 3.13Å
340	L	87.3	Confident	87.4	Confident	0 Å²	0	70.3 Å²	70.3	0%	0	38%	0.376	C	S	.	.	H	α-helix	trans	-64.6	-45.2	174.2	-170.6	70.7	0	0	0	111.2	V297 V299 I302 L325 V336 P337 M338 T342 C343 F344	V297-L340 HydrophobicContact CG1-CD1 4.09Å; V297-L340 HydrophobicContact CG1-CD2 4.45Å; V299-L340 HydrophobicContact CG2-CB 4.26Å; I302-L340 HydrophobicContact CD1-CD1 4.2Å; I302-L340 HydrophobicContact CG2-CD1 3.8Å; L325-L340 HydrophobicContact CD2-CD2 3.85Å; V336-L340 HydrophobicContact CG1-CB 4.44Å; V336-L340 HydrophobicContact CG1-CD2 3.52Å; P337-L340 WeakPolarHBondContact O-CB 3.44Å; P337-L340 PolarHBondContact O-N 3.21Å; M338-L340 PolarHBondContact O-N 3.31Å; M338-L340 VanDerWaalsContact O-N 3.16Å; L340-T342 VanDerWaalsContact C-N 3.33Å; L340-T342 PolarHBondContact O-N 3.3Å; L340-C343 PolarHBondContact O-N 3.37Å; L340-F344 HydrophobicContact CD1-CD2 3.75Å; L340-F344 HydrophobicContact CD1-CE2 3.73Å; L340-F344 HydrophobicContact CG-CD2 4.23Å; L340-F344 PolarHBondContact O-N 3.17Å
341	M	84.6	Confident	87.1	Confident	91 Å²	91	72.2 Å²	72.2	45%	0.448	39%	0.386	S	S	.	.	H	α-helix	trans	-67.8	-33.9	178.9	-61.7	-60.4	-171.4	0	0	111.9	M338 C343 F344 L347 V350	M338-M341 PolarHBondContact O-N 3.1Å; M341-C343 VanDerWaalsContact C-N 3.33Å; M341-F344 CarbonylContact O-C 3.46Å; M341-L347 HydrophobicContact SD-CD2 3.93Å; M341-V350 HydrophobicContact CE-CB 4.42Å; M341-V350 HydrophobicContact CE-CG2 3.69Å; M341-V350 HydrophobicContact SD-CG2 4.46Å
342	T	85.9	Confident	86.6	Confident	96 Å²	96	71.9 Å²	71.9	59%	0.589	39%	0.386	S	S	*	.	H	α-helix	trans	-70	-31.2	175.2	51.2	0	0	0	0	113	M338 A339 L340	M338-T342 PolarHBondContact O-N 2.88Å; A339-T342 VanDerWaalsContact C-OG1 3.29Å; A339-T342 WeakPolarHBondContact CA-OG1 3.21Å; A339-T342 PolarHBondContact O-N 3.19Å; A339-T342 PolarHBondContact O-OG1 3.2Å; L340-T342 VanDerWaalsContact C-N 3.33Å; L340-T342 PolarHBondContact O-N 3.3Å
343	C	89.1	Confident	86.4	Confident	19 Å²	19	74.4 Å²	74.4	13%	0.128	40%	0.4	C	S	.	.	H	α-helix	trans	-75.1	-52.2	175.8	178.6	0	0	0	0	111.5	C303 A339 L340 M341 R345	C303-C343 WeakPolarHBondContact CA-SG 3.31Å; C303-C343 HydrophobicContact CB-CB 3.91Å; C303-C343 WeakPolarHBondContact CB-SG 3.5Å; C303-C343 WeakPolarHBondContact SG-CB 3.44Å; C303-C343 CovalentContact SG-SG 2.03Å; C303-C343 PolarHBondContact SG-SG 2.8Å; A339-C343 PolarHBondContact O-N 2.77Å; A339-C343 VanDerWaalsContact O-N 3.13Å; L340-C343 PolarHBondContact O-N 3.37Å; M341-C343 VanDerWaalsContact C-N 3.33Å; C343-R345 PolarHBondContact O-N 2.89Å
344	F	90.5	Very high	86.5	Confident	3 Å²	3	68.7 Å²	68.7	1%	0.013	38%	0.379	C	S	.	.			trans	-99.4	76	-177.6	-60.6	-75.6	0	0	0	110.8	I280 I302 P320 L322 L340 M341 L346 L347	I280-F344 HydrophobicContact CD1-CE1 4.26Å; I280-F344 HydrophobicContact CD1-CZ 3.99Å; I302-F344 HydrophobicContact CD1-CE2 4.11Å; I302-F344 HydrophobicContact CD1-CZ 4.4Å; I302-F344 HydrophobicContact CG1-CE2 4.17Å; I302-F344 HydrophobicContact CG1-CZ 4.12Å; I302-F344 HydrophobicContact CG2-CE2 4.15Å; I302-F344 WeakPolarHBondContact O-CZ 3.49Å; P320-F344 HydrophobicContact CB-CD1 3.44Å; P320-F344 VanDerWaalsContact CB-CD1 3.44Å; P320-F344 HydrophobicContact CB-CE1 3.47Å; P320-F344 VanDerWaalsContact CB-CE1 3.47Å; P320-F344 HydrophobicContact CG-CD1 4.42Å; P320-F344 HydrophobicContact CG-CE1 4.37Å; L322-F344 HydrophobicContact CB-CB 4.43Å; L322-F344 HydrophobicContact CB-CD1 3.33Å; L322-F344 HydrophobicContact CB-CE1 3.68Å; L322-F344 HydrophobicContact CB-CG 3.99Å; L322-F344 HydrophobicContact CD2-CD1 4.1Å; L322-F344 HydrophobicContact CD2-CD2 4.29Å; L322-F344 HydrophobicContact CD2-CE1 4.08Å; L322-F344 HydrophobicContact CD2-CE2 4.28Å; L322-F344 HydrophobicContact CD2-CG 4.2Å; L322-F344 HydrophobicContact CD2-CZ 4.18Å; L322-F344 HydrophobicContact CG-CD1 4.36Å; L340-F344 HydrophobicContact CD1-CD2 3.75Å; L340-F344 HydrophobicContact CD1-CE2 3.73Å; L340-F344 HydrophobicContact CG-CD2 4.23Å; L340-F344 PolarHBondContact O-N 3.17Å; M341-F344 CarbonylContact O-C 3.46Å; F344-L346 PolarHBondContact O-N 3.27Å; F344-L346 VanDerWaalsContact O-N 3.15Å; F344-L347 HydrophobicContact CB-CB 3.94Å; F344-L347 HydrophobicContact CB-CD2 4.16Å; F344-L347 WeakPolarHBondContact O-CB 3.43Å; F344-L347 PolarHBondContact O-N 3.48Å
345	R	88.7	Confident	86.8	Confident	143 Å²	143	66.7 Å²	66.7	54%	0.54	36%	0.362	S	S	.	.	T	Hydrogen-bonded Turn	trans	-64.9	-18.5	-177.3	-61	-177.1	-174.9	175	2.6	114.2	C343	C343-R345 PolarHBondContact O-N 2.89Å
346	L	89.9	Confident	87.2	Confident	56 Å²	56	63.6 Å²	63.6	29%	0.293	34%	0.338	S	S	.	.	T	Hydrogen-bonded Turn	trans	-90.5	0.9	176.9	-60.5	179.4	0	0	0	113.1	L322 F344 Q348	L322-L346 CarbonylContact O-C 3.06Å; F344-L346 PolarHBondContact O-N 3.27Å; F344-L346 VanDerWaalsContact O-N 3.15Å; L346-Q348 WeakPolarHBondContact O-CG 3.33Å; L346-Q348 PolarHBondContact O-N 3.19Å
347	L	90.7	Very high	87.8	Confident	24 Å²	24	66 Å²	66	13%	0.126	35%	0.349	C	S	.	.			trans	-67	114.2	-178.7	-164.3	56.3	0	0	0	109.9	L322 L325 M341 F344 V350	L322-L347 HydrophobicContact CD2-CD1 4.25Å; L322-L347 HydrophobicContact CG-CD1 4.14Å; L322-L347 WeakPolarHBondContact O-CA 3.39Å; L322-L347 PolarHBondContact O-N 2.79Å; L325-L347 HydrophobicContact CB-CD1 4.08Å; M341-L347 HydrophobicContact SD-CD2 3.93Å; F344-L347 HydrophobicContact CB-CB 3.94Å; F344-L347 HydrophobicContact CB-CD2 4.16Å; F344-L347 WeakPolarHBondContact O-CB 3.43Å; F344-L347 PolarHBondContact O-N 3.48Å; L347-V350 HydrophobicContact CD1-CG2 4.34Å; L347-V350 HydrophobicContact CD2-CG2 3.37Å; L347-V350 HydrophobicContact CG-CG2 3.76Å
348	Q	90.6	Very high	88.1	Confident	143 Å²	143	66.9 Å²	66.9	67%	0.668	35%	0.35	S	S	*	.			trans	-92.2	-32.1	-177.1	-62.7	179.2	-16.2	0	0	111.6	R323 L346	R323-Q348 PolarHBondContact O-N 2.72Å; L346-Q348 WeakPolarHBondContact O-CG 3.33Å; L346-Q348 PolarHBondContact O-N 3.19Å
349	A	89.8	Confident	88.5	Confident	32 Å²	32	60.9 Å²	60.9	26%	0.264	32%	0.322	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-146.6	139	-179.3	0	0	0	0	0	111.7	R323 Y324 L325	R323-A349 PolarHBondContact O-N 2.84Å; Y324-A349 HydrophobicContact CD2-CB 3.97Å; Y324-A349 HydrophobicContact CE2-CB 4.2Å; L325-A349 PolarHBondContact N-O 3.2Å; L325-A349 VanDerWaalsContact N-O 3.13Å
350	V	89.9	Confident	88.7	Confident	33 Å²	33	61.9 Å²	61.9	20%	0.2	32%	0.317	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-125.5	119.9	165.6	-172.2	0	0	0	0	107.5	L325 L327 M341 L347 I352	L325-V350 HydrophobicContact CB-CG2 4.47Å; L325-V350 HydrophobicContact CD2-CG1 4.36Å; L325-V350 HydrophobicContact CG-CG1 4.44Å; L325-V350 VanDerWaalsContact O-CA 3.29Å; L325-V350 WeakPolarHBondContact O-CA 3.23Å; L327-V350 HydrophobicContact CD1-CG1 4.49Å; M341-V350 HydrophobicContact CE-CB 4.42Å; M341-V350 HydrophobicContact CE-CG2 3.69Å; M341-V350 HydrophobicContact SD-CG2 4.46Å; L347-V350 HydrophobicContact CD1-CG2 4.34Å; L347-V350 HydrophobicContact CD2-CG2 3.37Å; L347-V350 HydrophobicContact CG-CG2 3.76Å; V350-I352 HydrophobicContact CG1-CD1 3.69Å; V350-I352 HydrophobicContact CG1-CG1 3.88Å
351	I	90.7	Very high	88.8	Confident	67 Å²	67	67.1 Å²	67.1	34%	0.344	34%	0.343	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-105.3	123.7	178.3	-48.2	-58	0	0	0	107.4	Y324 L325 R326 L327 D328	Y324-I351 HydrophobicContact CE2-CG1 4.17Å; L325-I351 PolarHBondContact O-N 3.01Å; R326-I351 HydrophobicContact CG-CB 4.12Å; L327-I351 CarbonylContact C-O 3.44Å; L327-I351 WeakPolarHBondContact CA-O 3.22Å; L327-I351 WeakPolarHBondContact CB-O 3.39Å; L327-I351 PolarHBondContact N-O 2.76Å; D328-I351 HydrophobicContact CB-CG2 4.12Å; D328-I351 PolarHBondContact N-O 3.34Å
352	I	85.3	Confident	89.2	Confident	98 Å²	98	64.9 Å²	64.9	50%	0.503	33%	0.333	S	S	.	.			trans	-133.3	0	-176.8	-60.5	138.8	0	0	0	109.1	L327 D328 I332 V336 V350	L327-I352 HydrophobicContact CB-CG1 4.31Å; D328-I352 VanDerWaalsContact CA-OXT 3.3Å; D328-I352 WeakPolarHBondContact CA-OXT 2.98Å; I332-I352 HydrophobicContact CB-CG2 4.42Å; I332-I352 HydrophobicContact CG2-CG2 4.22Å; V336-I352 HydrophobicContact CB-CD1 3.93Å; V336-I352 HydrophobicContact CG2-CD1 3.24Å; V336-I352 HydrophobicContact CG2-CG1 3.81Å; V350-I352 HydrophobicContact CG1-CD1 3.69Å; V350-I352 HydrophobicContact CG1-CG1 3.88Å

Retrieved 352 of 352 residues in 130.7 ms (Link to these results)

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