FGF16_HUMAN Loading...

Fibroblast growth factor 16

Plays an important role in the regulation of embryonic development, cell proliferation and cell differentiation, and is required for normal cardiomyocyte proliferation and heart development.

AlphaFold DB , UniProt , Accession O43320, Species HUMAN (Homo sapiens, Human), Gene FGF16, Length 207 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	46.1	Very low	40.3	Very low	240 Å²	240	133.1 Å²	133.1	100%	1.182	82%	0.816	S	S	*	*				0	121	0	-73.1	171.7	163.4	0	0	106
2	A	47.1	Very low	39.5	Very low	95 Å²	95	134.4 Å²	134.4	79%	0.785	81%	0.814	S	S	*	*			trans	63.5	131.2	-173.4	0	0	0	0	0	114
3	E	38.1	Very low	39.5	Very low	185 Å²	185	140.4 Å²	140.4	86%	0.864	81%	0.814	S	S	*	*			cis	63	134.6	6	-48.4	-149.2	140.1	0	0	115.5
4	V	48.1	Very low	39	Very low	139 Å²	139	142.1 Å²	142.1	84%	0.842	82%	0.818	S	S	*	*			cis	-143	162.3	12.3	179.8	0	0	0	0	106.6
5	G	33.9	Very low	39.2	Very low	70 Å²	70	141.9 Å²	141.9	72%	0.722	81%	0.812	S	S	*	*			cis	131.1	144.4	4	0	0	0	0	0	111.4
6	G	41.8	Very low	38.9	Very low	69 Å²	69	144.8 Å²	144.8	71%	0.711	82%	0.816	S	S	*	*			trans	119.5	111.7	-170.6	0	0	0	0	0	112.4
7	V	41.2	Very low	38.4	Very low	122 Å²	122	139.8 Å²	139.8	74%	0.739	80%	0.804	S	S	*	*			cis	83.4	135	19.2	-53.3	0	0	0	0	119.1
8	F	36.5	Very low	38.4	Very low	200 Å²	200	143.9 Å²	143.9	88%	0.877	81%	0.812	S	S	*	*			trans	72.8	148.6	174	-52.8	-69.9	0	0	0	118.2
9	A	35.9	Very low	38.2	Very low	85 Å²	85	142.9 Å²	142.9	70%	0.702	82%	0.815	S	S	*	*			cis	-163.9	158.3	-24.7	0	0	0	0	0	110.2
10	S	34.2	Very low	38.4	Very low	110 Å²	110	141 Å²	141	77%	0.769	81%	0.81	S	S	*	*			trans	-75.1	136.6	168.7	50.1	0	0	0	0	111.9
11	L	40	Very low	38.2	Very low	149 Å²	149	139.8 Å²	139.8	78%	0.78	81%	0.811	S	S	*	*			trans	-143.8	108.3	169.3	-96.7	169.3	0	0	0	110
12	D	30.8	Very low	38	Very low	149 Å²	149	136.4 Å²	136.4	80%	0.797	80%	0.797	S	S	*	*			trans	-72.1	144.2	169.2	-60	-75.5	0	0	0	110.9
13	W	40.1	Very low	37.5	Very low	212 Å²	212	135 Å²	135	80%	0.803	79%	0.791	S	S	*	*			trans	-136.1	80	173.2	-94.4	70.4	0	0	0	110.1	L15	W13-L15 HydrophobicContact CE3-CD1 4.14Å; W13-L15 HydrophobicContact CZ3-CD1 3.97Å; W13-L15 PolarHBondContact O-N 3.06Å
14	D	32.2	Very low	37.4	Very low	164 Å²	164	134.5 Å²	134.5	88%	0.877	79%	0.794	S	S	*	*			trans	-69.9	118.1	158.8	-91.4	-45.8	0	0	0	109
15	L	42.1	Very low	37.4	Very low	139 Å²	139	133.4 Å²	133.4	73%	0.728	79%	0.788	S	S	*	*			trans	-149.5	131.9	163.1	-125.9	143.4	0	0	0	112.6	W13	W13-L15 HydrophobicContact CE3-CD1 4.14Å; W13-L15 HydrophobicContact CZ3-CD1 3.97Å; W13-L15 PolarHBondContact O-N 3.06Å
16	H	33.9	Very low	37.7	Very low	188 Å²	188	135.7 Å²	135.7	87%	0.87	79%	0.79	S	S	*	*			trans	-63.5	138.7	-162.7	-68.7	-91	0	0	0	115.4
17	G	30.6	Very low	38	Very low	60 Å²	60	139.3 Å²	139.3	62%	0.619	79%	0.792	S	S	*	*			trans	97.8	112.7	133.3	0	0	0	0	0	116.9
18	F	37.8	Very low	38.2	Very low	214 Å²	214	136.8 Å²	136.8	94%	0.939	78%	0.784	S	S	*	*				-155.9	116.8	123.7	-93.6	-64.4	0	0	0	109.2
19	S	34.7	Very low	38.8	Very low	125 Å²	125	133.9 Å²	133.9	87%	0.874	78%	0.777	S	S	*	*			trans	-82.4	121.7	170.8	-177.2	0	0	0	0	109.4
20	S	42.4	Very low	39.8	Very low	104 Å²	104	133.6 Å²	133.6	73%	0.727	77%	0.771	S	S	*	*			trans	-143	117.3	161.1	59.5	0	0	0	0	109.9	L22	S20-L22 PolarHBondContact O-N 3.1Å
21	S	35	Very low	41.2	Very low	117 Å²	117	132.6 Å²	132.6	82%	0.818	76%	0.762	S	S	*	*			trans	-82.1	105.8	-176.2	54.3	0	0	0	0	111
22	L	41.8	Very low	42.6	Very low	169 Å²	169	127.8 Å²	127.8	89%	0.885	75%	0.747	S	S	*	*			trans	-118.2	95.9	164	-73.1	174	0	0	0	108.6	S20	S20-L22 PolarHBondContact O-N 3.1Å
23	G	35.2	Very low	44.7	Very low	64 Å²	64	125.5 Å²	125.5	66%	0.66	73%	0.731	S	S	*	*			trans	-74	160.4	-177.5	0	0	0	0	0	113.5	V25	G23-V25 PolarHBondContact O-N 2.76Å
24	N	37.2	Very low	46.3	Very low	175 Å²	175	117.7 Å²	117.7	94%	0.936	71%	0.705	S	S	*	*			trans	-57	108.5	170.9	-87.8	-10.4	0	0	0	110.9
25	V	47.3	Very low	48.4	Very low	117 Å²	117	113.9 Å²	113.9	71%	0.709	68%	0.684	S	S	*	*			trans	-92.6	116.7	166.8	-178.4	0	0	0	0	108.3	G23 L27	G23-V25 PolarHBondContact O-N 2.76Å; V25-L27 PolarHBondContact O-N 3.17Å
26	P	41.2	Very low	49.9	Very low	118 Å²	118	113 Å²	113	77%	0.766	68%	0.676	S	S	*	*			trans	-67.4	126.9	174	27.5	-32.9	0	0	0	110.1	A28	P26-A28 PolarHBondContact O-N 3Å
27	L	47	Very low	52	Low	145 Å²	145	107.6 Å²	107.6	76%	0.759	65%	0.648	S	S	*	*			trans	-73.1	89.4	-176.1	-90.9	87.1	0	0	0	113	V25 V101	V25-L27 PolarHBondContact O-N 3.17Å; L27-V101 HydrophobicContact CD2-CG2 4.2Å
28	A	46.8	Very low	54.1	Low	69 Å²	69	105.5 Å²	105.5	57%	0.57	62%	0.623	S	S	*	*			trans	49	78.7	137	0	0	0	0	0	118.9	P26	P26-A28 PolarHBondContact O-N 3Å
29	D	49.4	Very low	55.7	Low	138 Å²	138	97.4 Å²	97.4	74%	0.738	60%	0.6	S	S	*	*			trans	-98.9	15.5	153.8	-104.8	-31.5	0	0	0	112.1	P31 R136	D29-P31 WeakPolarHBondContact O-CD 3.46Å; D29-R136 IonicContact OD1-NH2 3.83Å; D29-R136 PolarHBondContact OD1-NH2 2.87Å
30	S	57	Low	57.7	Low	80 Å²	80	95.9 Å²	95.9	56%	0.559	58%	0.579	S	S	*	*			trans	-72.9	115.8	-179.7	-63.1	0	0	0	0	112.3	G32 F33	S30-G32 VanDerWaalsContact C-N 3.25Å; S30-G32 PolarHBondContact O-N 3.09Å; S30-G32 VanDerWaalsContact O-N 3.14Å; S30-F33 PolarHBondContact O-N 3.2Å
31	P	61.9	Low	59	Low	89 Å²	89	92.3 Å²	92.3	58%	0.578	55%	0.551	S	S	*	*	H	α-helix	trans	-65.7	-23.2	-170.9	24.2	-34.3	0	0	0	114.5	D29 F33 L34 N35	D29-P31 WeakPolarHBondContact O-CD 3.46Å; P31-F33 VanDerWaalsContact C-N 3.33Å; P31-F33 PolarHBondContact O-N 2.76Å; P31-L34 PolarHBondContact O-N 2.53Å; P31-N35 PolarHBondContact O-N 2.86Å
32	G	69.9	Low	60.4	Low	47 Å²	47	89.1 Å²	89.1	49%	0.485	52%	0.524	S	S	.	.	H	α-helix	trans	-59.9	-39.5	175.8	0	0	0	0	0	113.4	S30 L34 N35 E36	S30-G32 VanDerWaalsContact C-N 3.25Å; S30-G32 PolarHBondContact O-N 3.09Å; S30-G32 VanDerWaalsContact O-N 3.14Å; G32-L34 VanDerWaalsContact C-N 3.33Å; G32-L34 PolarHBondContact O-N 2.66Å; G32-N35 PolarHBondContact O-N 3.33Å; G32-E36 PolarHBondContact O-N 3.07Å
33	F	75.8	Confident	61.3	Low	102 Å²	102	82.9 Å²	82.9	45%	0.447	50%	0.5	S	S	.	.	H	α-helix	trans	-63.8	-38.1	-179.1	179	-100	0	0	0	112.4	S30 P31 R37	S30-F33 PolarHBondContact O-N 3.2Å; P31-F33 VanDerWaalsContact C-N 3.33Å; P31-F33 PolarHBondContact O-N 2.76Å; F33-R37 WeakPolarHBondContact O-CB 3.29Å; F33-R37 PolarHBondContact O-N 3.02Å
34	L	72.9	Confident	62.5	Low	48 Å²	48	87 Å²	87	25%	0.251	50%	0.499	S	S	.	.	H	α-helix	trans	-69.5	-43.2	176.5	-61.2	-178.3	0	0	0	111.2	P31 G32 E36 R37 L38 A100 L103	P31-L34 PolarHBondContact O-N 2.53Å; G32-L34 VanDerWaalsContact C-N 3.33Å; G32-L34 PolarHBondContact O-N 2.66Å; L34-E36 PolarHBondContact O-N 3.3Å; L34-R37 PolarHBondContact O-N 2.86Å; L34-L38 VanDerWaalsContact O-CB 3.3Å; L34-L38 WeakPolarHBondContact O-CB 3.39Å; L34-L38 WeakPolarHBondContact O-CD1 3.38Å; L34-L38 WeakPolarHBondContact O-CG 3.35Å; L34-L38 PolarHBondContact O-N 3.14Å; L34-A100 HydrophobicContact CD2-CB 4.22Å; L34-L103 HydrophobicContact CD1-CD1 3.76Å; L34-L103 HydrophobicContact CD2-CD1 3.73Å; L34-L103 HydrophobicContact CG-CD1 4.43Å
35	N	75.8	Confident	63.5	Low	84 Å²	84	82 Å²	82	45%	0.449	47%	0.472	S	S	.	.	H	α-helix	trans	-61.3	-43.3	176.5	-70.2	-13.7	0	0	0	111.8	P31 G32 L38 G39	P31-N35 PolarHBondContact O-N 2.86Å; G32-N35 PolarHBondContact O-N 3.33Å; N35-L38 PolarHBondContact O-N 3.43Å; N35-G39 PolarHBondContact O-N 2.87Å
36	E	75	Confident	63.8	Low	121 Å²	121	83.3 Å²	83.3	57%	0.565	47%	0.471	S	S	*	.	H	α-helix	trans	-64.1	-47.1	177	-162.6	-164.8	113.4	0	0	111.4	G32 L34 L38 G39 Q40	G32-E36 PolarHBondContact O-N 3.07Å; L34-E36 PolarHBondContact O-N 3.3Å; E36-L38 PolarHBondContact O-N 3.39Å; E36-G39 PolarHBondContact O-N 3.24Å; E36-Q40 WeakPolarHBondContact O-CG 3.4Å; E36-Q40 PolarHBondContact O-N 2.91Å; E36-Q40 PolarHBondContact OE1-NE2 3.37Å
37	R	76.3	Confident	64	Low	73 Å²	73	87.6 Å²	87.6	28%	0.275	47%	0.472	S	S	.	.	H	α-helix	trans	-67.1	-33.8	179	-177	158	168.8	-175.9	-9.1	113.1	F33 L34 I41 S98 L99	F33-R37 WeakPolarHBondContact O-CB 3.29Å; F33-R37 PolarHBondContact O-N 3.02Å; L34-R37 PolarHBondContact O-N 2.86Å; R37-I41 HydrophobicContact CG-CD1 3.82Å; R37-I41 HydrophobicContact CG-CG1 4.48Å; R37-I41 WeakPolarHBondContact O-CB 3.24Å; R37-I41 WeakPolarHBondContact O-CD1 3.38Å; R37-I41 WeakPolarHBondContact O-CG1 3.43Å; R37-I41 PolarHBondContact O-N 2.89Å; R37-S98 PolarHBondContact NH2-O 3.16Å; R37-L99 WeakPolarHBondContact CD-O 3.37Å; R37-L99 PolarHBondContact NE-O 3.26Å; R37-L99 PolarHBondContact NH1-O 3.09Å; R37-L99 PolarHBondContact NH2-O 3.24Å
38	L	76.2	Confident	63.7	Low	17 Å²	17	84.3 Å²	84.3	9%	0.089	47%	0.473	C	S	.	.	H	α-helix	trans	-61.1	-49.7	170.1	-74	166.3	0	0	0	110.3	L34 N35 E36 Q40 I41 E42 L99 L129 R131 V134	L34-L38 VanDerWaalsContact O-CB 3.3Å; L34-L38 WeakPolarHBondContact O-CB 3.39Å; L34-L38 WeakPolarHBondContact O-CD1 3.38Å; L34-L38 WeakPolarHBondContact O-CG 3.35Å; L34-L38 PolarHBondContact O-N 3.14Å; N35-L38 PolarHBondContact O-N 3.43Å; E36-L38 PolarHBondContact O-N 3.39Å; L38-Q40 PolarHBondContact O-N 3.43Å; L38-I41 PolarHBondContact O-N 2.84Å; L38-I41 VanDerWaalsContact O-N 3.13Å; L38-E42 PolarHBondContact O-N 3.13Å; L38-L99 HydrophobicContact CD2-CD1 4.14Å; L38-L129 HydrophobicContact CD2-CD1 4.45Å; L38-L129 HydrophobicContact CD2-CD2 3.93Å; L38-L129 HydrophobicContact CD2-CG 3.72Å; L38-R131 HydrophobicContact CD1-CG 4Å; L38-V134 HydrophobicContact CD1-CG2 4.32Å; L38-V134 HydrophobicContact CD2-CG2 3.88Å
39	G	71.7	Confident	63.4	Low	44 Å²	44	84.9 Å²	84.9	45%	0.454	47%	0.473	S	S	.	.	H	α-helix	trans	-60.9	-41.6	176.3	0	0	0	0	0	113.7	N35 E36 I41 G43	N35-G39 PolarHBondContact O-N 2.87Å; E36-G39 PolarHBondContact O-N 3.24Å; G39-I41 VanDerWaalsContact C-N 3.3Å; G39-I41 PolarHBondContact O-N 3.14Å; G39-G43 PolarHBondContact O-N 3.46Å
40	Q	75.8	Confident	63.4	Low	92 Å²	92	83.4 Å²	83.4	43%	0.43	47%	0.471	S	S	.	.	H	α-helix	trans	-61.9	-36.7	173.7	-71.3	-175.9	27.5	0	0	112.5	E36 L38 K44	E36-Q40 WeakPolarHBondContact O-CG 3.4Å; E36-Q40 PolarHBondContact O-N 2.91Å; E36-Q40 PolarHBondContact OE1-NE2 3.37Å; L38-Q40 PolarHBondContact O-N 3.43Å; Q40-K44 WeakPolarHBondContact O-CD 3.42Å; Q40-K44 VanDerWaalsContact O-CG 3.3Å; Q40-K44 WeakPolarHBondContact O-CG 3.44Å; Q40-K44 PolarHBondContact O-N 3.2Å
41	I	69.1	Low	63.2	Low	30 Å²	30	83.9 Å²	83.9	15%	0.154	47%	0.47	C	S	.	.	H	α-helix	trans	-77	-46.1	-179.9	-71.2	168.8	0	0	0	110.3	R37 L38 G39 G43 K44 L45 L99 L129	R37-I41 HydrophobicContact CG-CD1 3.82Å; R37-I41 HydrophobicContact CG-CG1 4.48Å; R37-I41 WeakPolarHBondContact O-CB 3.24Å; R37-I41 WeakPolarHBondContact O-CD1 3.38Å; R37-I41 WeakPolarHBondContact O-CG1 3.43Å; R37-I41 PolarHBondContact O-N 2.89Å; L38-I41 PolarHBondContact O-N 2.84Å; L38-I41 VanDerWaalsContact O-N 3.13Å; G39-I41 VanDerWaalsContact C-N 3.3Å; G39-I41 PolarHBondContact O-N 3.14Å; I41-G43 VanDerWaalsContact C-N 3.3Å; I41-G43 PolarHBondContact O-N 2.84Å; I41-K44 PolarHBondContact O-N 3.42Å; I41-K44 VanDerWaalsContact O-N 3.14Å; I41-L45 HydrophobicContact CG2-CD1 3.57Å; I41-L45 HydrophobicContact CG2-CG 4.32Å; I41-L45 WeakPolarHBondContact O-CB 3.28Å; I41-L45 WeakPolarHBondContact O-CD1 3.44Å; I41-L45 VanDerWaalsContact O-CG 3.25Å; I41-L45 WeakPolarHBondContact O-CG 3.45Å; I41-L45 PolarHBondContact O-N 3.01Å; I41-L99 HydrophobicContact CD1-CD2 3.4Å; I41-L99 VanDerWaalsContact CD1-CD2 3.4Å; I41-L129 HydrophobicContact CB-CD2 4.08Å; I41-L129 HydrophobicContact CG2-CD2 3.42Å; I41-L129 VanDerWaalsContact CG2-CD2 3.42Å
42	E	66	Low	63	Low	50 Å²	50	83.8 Å²	83.8	23%	0.234	47%	0.465	C	S	.	.	H	α-helix	trans	-57.7	-42	172.6	-73.2	-149.8	129.4	0	0	111.9	L38 K44 L45 Q46 K128 L129	L38-E42 PolarHBondContact O-N 3.13Å; E42-K44 VanDerWaalsContact C-N 3.34Å; E42-K44 PolarHBondContact O-N 3.01Å; E42-L45 PolarHBondContact O-N 3.45Å; E42-Q46 WeakPolarHBondContact O-CB 3.39Å; E42-Q46 VanDerWaalsContact O-CG 3.29Å; E42-Q46 WeakPolarHBondContact O-CG 3.46Å; E42-Q46 PolarHBondContact O-N 3.49Å; E42-K128 WeakPolarHBondContact OE1-CB 3.27Å; E42-L129 HydrophobicContact CG-CB 3.85Å; E42-L129 PolarHBondContact OE1-N 3.33Å
43	G	60	Low	62.5	Low	37 Å²	37	88.2 Å²	88.2	38%	0.381	47%	0.471	S	S	.	.	H	α-helix	trans	-62.2	-37.4	175.7	0	0	0	0	0	113.7	G39 I41 R47	G39-G43 PolarHBondContact O-N 3.46Å; I41-G43 VanDerWaalsContact C-N 3.3Å; I41-G43 PolarHBondContact O-N 2.84Å; G43-R47 VanDerWaalsContact O-CB 3.24Å; G43-R47 WeakPolarHBondContact O-CB 3.14Å; G43-R47 PolarHBondContact O-N 3.37Å; G43-R47 VanDerWaalsContact O-N 3.1Å
44	K	61	Low	61.9	Low	150 Å²	150	86 Å²	86	65%	0.652	47%	0.472	S	S	*	.	H	α-helix	trans	-73.7	-30.5	174.9	-76.1	169.5	-178.8	167.8	0	113.1	Q40 I41 E42	Q40-K44 WeakPolarHBondContact O-CD 3.42Å; Q40-K44 VanDerWaalsContact O-CG 3.3Å; Q40-K44 WeakPolarHBondContact O-CG 3.44Å; Q40-K44 PolarHBondContact O-N 3.2Å; I41-K44 PolarHBondContact O-N 3.42Å; I41-K44 VanDerWaalsContact O-N 3.14Å; E42-K44 VanDerWaalsContact C-N 3.34Å; E42-K44 PolarHBondContact O-N 3.01Å
45	L	58.2	Low	61.3	Low	71 Å²	71	87.1 Å²	87.1	37%	0.372	48%	0.476	S	S	.	.	H	α-helix	trans	-78.1	-36.4	177.2	-70.3	159.8	0	0	0	112.4	I41 E42 Y114	I41-L45 HydrophobicContact CG2-CD1 3.57Å; I41-L45 HydrophobicContact CG2-CG 4.32Å; I41-L45 WeakPolarHBondContact O-CB 3.28Å; I41-L45 WeakPolarHBondContact O-CD1 3.44Å; I41-L45 VanDerWaalsContact O-CG 3.25Å; I41-L45 WeakPolarHBondContact O-CG 3.45Å; I41-L45 PolarHBondContact O-N 3.01Å; E42-L45 PolarHBondContact O-N 3.45Å; L45-Y114 VanDerWaalsContact CD1-OH 3.3Å; L45-Y114 WeakPolarHBondContact CD1-OH 3.36Å
46	Q	53.2	Low	60.6	Low	145 Å²	145	87.3 Å²	87.3	68%	0.678	48%	0.476	S	S	*	.	H	α-helix	trans	-74.7	-36.7	176.2	-70.4	174.6	48.9	0	0	112	E42 G48	E42-Q46 WeakPolarHBondContact O-CB 3.39Å; E42-Q46 VanDerWaalsContact O-CG 3.29Å; E42-Q46 WeakPolarHBondContact O-CG 3.46Å; E42-Q46 PolarHBondContact O-N 3.49Å; Q46-G48 VanDerWaalsContact C-N 3.33Å; Q46-G48 PolarHBondContact O-N 2.84Å
47	R	46	Very low	60.4	Low	207 Å²	207	86.1 Å²	86.1	78%	0.781	47%	0.469	S	S	*	.	S	Bend	trans	-84.3	76.5	176.5	-167.9	176	-65.7	-163.3	-0.7	110.3	G43 S49	G43-R47 VanDerWaalsContact O-CB 3.24Å; G43-R47 WeakPolarHBondContact O-CB 3.14Å; G43-R47 PolarHBondContact O-N 3.37Å; G43-R47 VanDerWaalsContact O-N 3.1Å; R47-S49 PolarHBondContact O-N 2.98Å
48	G	38.9	Very low	60	Low	77 Å²	77	82.9 Å²	82.9	79%	0.794	46%	0.458	S	S	*	.			trans	-62.7	71.9	-177.6	0	0	0	0	0	114.9	Q46	Q46-G48 VanDerWaalsContact C-N 3.33Å; Q46-G48 PolarHBondContact O-N 2.84Å
49	S	41.2	Very low	59.6	Low	80 Å²	80	83.6 Å²	83.6	56%	0.559	46%	0.462	S	S	*	.			trans	-99.9	126.4	171.4	-178.1	0	0	0	0	109.7	R47 T51	R47-S49 PolarHBondContact O-N 2.98Å; S49-T51 PolarHBondContact O-N 3.47Å
50	P	48.7	Very low	59.8	Low	108 Å²	108	87.1 Å²	87.1	70%	0.701	47%	0.47	S	S	*	.			trans	-68.1	98.6	171.5	29.3	-32.2	0	0	0	108.8
51	T	54.4	Low	60.2	Low	89 Å²	89	88.1 Å²	88.1	55%	0.546	47%	0.47	S	S	.	.			trans	-103.6	100.9	156.6	41.9	0	0	0	0	106.5	S49 F53 A54 H55	S49-T51 PolarHBondContact O-N 3.47Å; T51-F53 PolarHBondContact O-N 2.74Å; T51-A54 WeakPolarHBondContact O-CA 3.38Å; T51-A54 WeakPolarHBondContact O-CB 3.25Å; T51-A54 PolarHBondContact O-N 2.93Å; T51-A54 WeakPolarHBondContact OG1-CB 3.48Å; T51-H55 PolarHBondContact O-N 2.83Å
52	D	57.4	Low	61.4	Low	87 Å²	87	88.1 Å²	88.1	47%	0.465	47%	0.468	S	S	.	.	H	α-helix	trans	-51.6	-37.7	-169.7	-45.1	-18.8	0	0	0	111.9	A54 H55 L56 Y206	D52-A54 VanDerWaalsContact C-N 3.34Å; D52-A54 PolarHBondContact O-N 3.4Å; D52-H55 PolarHBondContact O-N 3.4Å; D52-L56 VanDerWaalsContact O-CB 3.27Å; D52-L56 WeakPolarHBondContact O-CB 3.3Å; D52-L56 PolarHBondContact O-N 3.48Å; D52-Y206 HydrophobicContact CB-CE1 3.74Å; D52-Y206 PolarHBondContact OD1-OH 3.45Å
53	F	59.3	Low	62.8	Low	140 Å²	140	89.9 Å²	89.9	61%	0.614	47%	0.472	S	S	*	.	H	α-helix	trans	-65.1	-30.6	176.6	-170.2	-131.4	0	0	0	114.2	T51 K57	T51-F53 PolarHBondContact O-N 2.74Å; F53-K57 HydrophobicContact CE1-CD 4.45Å; F53-K57 VanDerWaalsContact CZ-NZ 3.26Å; F53-K57 WeakPolarHBondContact O-CB 3.38Å; F53-K57 WeakPolarHBondContact O-CD 3.41Å; F53-K57 VanDerWaalsContact O-CG 3.23Å; F53-K57 WeakPolarHBondContact O-CG 3.37Å; F53-K57 PolarHBondContact O-N 3.46Å; F53-K57 VanDerWaalsContact O-N 3.15Å
54	A	62.9	Low	64.6	Low	57 Å²	57	88.1 Å²	88.1	47%	0.471	45%	0.454	S	S	.	.	H	α-helix	trans	-74.6	-42.7	172.2	0	0	0	0	0	110.9	T51 D52 K57 G58	T51-A54 WeakPolarHBondContact O-CA 3.38Å; T51-A54 WeakPolarHBondContact O-CB 3.25Å; T51-A54 PolarHBondContact O-N 2.93Å; T51-A54 WeakPolarHBondContact OG1-CB 3.48Å; D52-A54 VanDerWaalsContact C-N 3.34Å; D52-A54 PolarHBondContact O-N 3.4Å; A54-K57 PolarHBondContact O-N 3.18Å; A54-G58 PolarHBondContact O-N 3.12Å
55	H	61.2	Low	66.4	Low	71 Å²	71	81 Å²	81	33%	0.329	42%	0.423	S	S	.	.	H	α-helix	trans	-63.1	-46.8	176	-174.7	-135.1	0	0	0	111.7	T51 D52 K57 G58 I59	T51-H55 PolarHBondContact O-N 2.83Å; D52-H55 PolarHBondContact O-N 3.4Å; H55-K57 VanDerWaalsContact C-N 3.32Å; H55-K57 PolarHBondContact O-N 2.83Å; H55-G58 CarbonylContact O-C 3.49Å; H55-G58 WeakPolarHBondContact O-CA 3.34Å; H55-G58 PolarHBondContact O-N 3.27Å; H55-I59 WeakPolarHBondContact O-CG1 3.46Å; H55-I59 PolarHBondContact O-N 2.96Å
56	L	60.2	Low	68.3	Low	87 Å²	87	81 Å²	81	46%	0.455	42%	0.419	S	S	.	.	H	α-helix	trans	-60.6	-39	175.7	-173.4	64.9	0	0	0	112	D52 G58 I59 L60	D52-L56 VanDerWaalsContact O-CB 3.27Å; D52-L56 WeakPolarHBondContact O-CB 3.3Å; D52-L56 PolarHBondContact O-N 3.48Å; L56-G58 VanDerWaalsContact C-N 3.32Å; L56-G58 PolarHBondContact O-N 2.98Å; L56-I59 PolarHBondContact O-N 2.82Å; L56-L60 HydrophobicContact CG-CD1 4.4Å; L56-L60 VanDerWaalsContact O-CG 3.31Å; L56-L60 WeakPolarHBondContact O-CG 3.22Å; L56-L60 PolarHBondContact O-N 2.94Å
57	K	71	Confident	70.4	Confident	96 Å²	96	74.1 Å²	74.1	42%	0.417	39%	0.387	S	S	.	.	H	α-helix	trans	-63.5	-35.7	171.4	-82	173.8	175.3	175.6	0	112.6	F53 A54 H55 R61	F53-K57 HydrophobicContact CE1-CD 4.45Å; F53-K57 VanDerWaalsContact CZ-NZ 3.26Å; F53-K57 WeakPolarHBondContact O-CB 3.38Å; F53-K57 WeakPolarHBondContact O-CD 3.41Å; F53-K57 VanDerWaalsContact O-CG 3.23Å; F53-K57 WeakPolarHBondContact O-CG 3.37Å; F53-K57 PolarHBondContact O-N 3.46Å; F53-K57 VanDerWaalsContact O-N 3.15Å; A54-K57 PolarHBondContact O-N 3.18Å; H55-K57 VanDerWaalsContact C-N 3.32Å; H55-K57 PolarHBondContact O-N 2.83Å; K57-R61 WeakPolarHBondContact O-CB 3.3Å; K57-R61 VanDerWaalsContact O-CD 3.25Å; K57-R61 WeakPolarHBondContact O-CD 3.44Å; K57-R61 WeakPolarHBondContact O-CG 3.23Å; K57-R61 PolarHBondContact O-N 2.65Å
58	G	67.7	Low	72.9	Confident	5 Å²	5	67.6 Å²	67.6	5%	0.052	36%	0.362	C	S	.	.	H	α-helix	trans	-62.9	-48.7	170	0	0	0	0	0	112.1	A54 H55 L56 L60 R61 R62 E95	A54-G58 PolarHBondContact O-N 3.12Å; H55-G58 CarbonylContact O-C 3.49Å; H55-G58 WeakPolarHBondContact O-CA 3.34Å; H55-G58 PolarHBondContact O-N 3.27Å; L56-G58 VanDerWaalsContact C-N 3.32Å; L56-G58 PolarHBondContact O-N 2.98Å; G58-L60 PolarHBondContact O-N 3.32Å; G58-R61 CarbonylContact O-C 3.58Å; G58-R61 WeakPolarHBondContact O-CA 3.49Å; G58-R61 WeakPolarHBondContact O-CB 3.42Å; G58-R61 PolarHBondContact O-N 3.1Å; G58-R62 PolarHBondContact O-N 2.92Å; G58-E95 WeakPolarHBondContact CA-OE1 3.44Å
59	I	67.3	Low	75.7	Confident	32 Å²	32	65.2 Å²	65.2	16%	0.164	33%	0.332	C	S	.	.	H	α-helix	trans	-55.3	-49	176.3	-65.7	168.8	0	0	0	111.2	H55 L56 R61 R62 L203	H55-I59 WeakPolarHBondContact O-CG1 3.46Å; H55-I59 PolarHBondContact O-N 2.96Å; L56-I59 PolarHBondContact O-N 2.82Å; I59-R61 PolarHBondContact O-N 2.99Å; I59-R61 VanDerWaalsContact O-N 3.08Å; I59-R62 WeakPolarHBondContact O-CB 3.47Å; I59-R62 WeakPolarHBondContact O-CG 3.07Å; I59-R62 PolarHBondContact O-N 3.13Å; I59-L203 HydrophobicContact CD1-CD1 4.19Å; I59-L203 HydrophobicContact CG2-CD1 4.45Å
60	L	76	Confident	78.4	Confident	118 Å²	118	62 Å²	62	62%	0.618	31%	0.312	S	S	*	.	T	Hydrogen-bonded Turn	trans	-63.5	-14.4	177.7	-68.2	170.3	0	0	0	113.8	L56 G58 R63	L56-L60 HydrophobicContact CG-CD1 4.4Å; L56-L60 VanDerWaalsContact O-CG 3.31Å; L56-L60 WeakPolarHBondContact O-CG 3.22Å; L56-L60 PolarHBondContact O-N 2.94Å; G58-L60 PolarHBondContact O-N 3.32Å; L60-R63 PolarHBondContact O-NH1 2.81Å; L60-R63 PolarHBondContact O-NH2 3.01Å
61	R	85.3	Confident	80.8	Confident	114 Å²	114	57.4 Å²	57.4	43%	0.43	28%	0.281	S	S	.	.	T	Hydrogen-bonded Turn	trans	-104.1	4.4	176.8	-69.5	168.4	171.7	-159.8	-3.6	113.8	K57 G58 I59 F96	K57-R61 WeakPolarHBondContact O-CB 3.3Å; K57-R61 VanDerWaalsContact O-CD 3.25Å; K57-R61 WeakPolarHBondContact O-CD 3.44Å; K57-R61 WeakPolarHBondContact O-CG 3.23Å; K57-R61 PolarHBondContact O-N 2.65Å; G58-R61 CarbonylContact O-C 3.58Å; G58-R61 WeakPolarHBondContact O-CA 3.49Å; G58-R61 WeakPolarHBondContact O-CB 3.42Å; G58-R61 PolarHBondContact O-N 3.1Å; I59-R61 PolarHBondContact O-N 2.99Å; I59-R61 VanDerWaalsContact O-N 3.08Å; R61-F96 WeakPolarHBondContact CD-O 3.41Å; R61-F96 PolarHBondContact O-N 2.82Å; R61-F96 VanDerWaalsContact O-N 3.09Å
62	R	93.5	Very high	82.9	Confident	29 Å²	29	53.5 Å²	53.5	11%	0.109	26%	0.256	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-68.7	127.5	171.1	-65.9	175.1	176.5	177.1	-3.4	110	G58 I59 I93 L94 V109 V191 M199 D202	G58-R62 PolarHBondContact O-N 2.92Å; I59-R62 WeakPolarHBondContact O-CB 3.47Å; I59-R62 WeakPolarHBondContact O-CG 3.07Å; I59-R62 PolarHBondContact O-N 3.13Å; R62-I93 HydrophobicContact CB-CG2 4.47Å; R62-L94 CarbonylContact C-O 3.59Å; R62-L94 WeakPolarHBondContact CA-O 3.47Å; R62-V109 HydrophobicContact CG-CG2 4.19Å; R62-V191 HydrophobicContact CB-CG2 4.4Å; R62-M199 PolarHBondContact NH1-SD 3.32Å; R62-D202 IonicContact CZ-OD2 2.75Å; R62-D202 IonicContact NH1-OD2 2.84Å; R62-D202 PolarHBondContact NH1-OD2 2.71Å; R62-D202 IonicContact NH2-OD2 2.72Å; R62-D202 PolarHBondContact NH2-OD2 2.76Å
63	R	95.5	Very high	84.9	Confident	88 Å²	88	49.4 Å²	49.4	33%	0.332	23%	0.234	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-140.5	159.3	-178.4	-64.2	-63.8	179.3	-81	-3.4	110.4	L60 L94 F96 P188 R189 V191	L60-R63 PolarHBondContact O-NH1 2.81Å; L60-R63 PolarHBondContact O-NH2 3.01Å; R63-L94 PolarHBondContact N-O 3.06Å; R63-L94 PolarHBondContact O-N 3.14Å; R63-F96 HydrophobicContact CB-CD2 3.94Å; R63-F96 HydrophobicContact CB-CE2 3.9Å; R63-F96 HydrophobicContact CG-CD2 4.11Å; R63-F96 HydrophobicContact CG-CE2 4.41Å; R63-P188 HydrophobicContact CG-CB 4.5Å; R63-R189 WeakPolarHBondContact CA-O 3.5Å; R63-R189 WeakPolarHBondContact CB-O 3.35Å; R63-R189 WeakPolarHBondContact CD-O 3.49Å; R63-V191 VanDerWaalsContact C-CG2 3.49Å
64	Q	97.7	Very high	86.7	Confident	0 Å²	0	43.3 Å²	43.3	0%	0	21%	0.208	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-99.9	142.4	159.4	-57.2	176.9	77.3	0	0	108.3	D87 H88 I93 R189 P190 V191	Q64-D87 PolarHBondContact NE2-OD1 3.09Å; Q64-D87 VanDerWaalsContact NE2-OD1 3.1Å; Q64-D87 PolarHBondContact OE1-OD1 3.15Å; Q64-H88 PolarHBondContact NE2-CE1 3.48Å; Q64-H88 PolarHBondContact NE2-ND1 3.14Å; Q64-H88 PolarHBondContact NE2-NE2 3.18Å; Q64-I93 HydrophobicContact CG-CD1 4.05Å; Q64-R189 HydrophobicContact CB-CB 4.26Å; Q64-R189 PolarHBondContact N-O 3.3Å; Q64-R189 PolarHBondContact O-N 3.46Å; Q64-P190 PolarHBondContact NE2-O 2.65Å; Q64-V191 HydrophobicContact CG-CG2 4.08Å
65	L	97.9	Very high	88.4	Confident	0 Å²	0	40.6 Å²	40.6	0%	0	19%	0.185	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-110.4	95	-177.4	-164.4	57.9	0	0	0	111.8	H72 L73 L94 F96 I106 Y147 F186 P188	L65-H72 WeakPolarHBondContact O-CA 3.43Å; L65-L73 HydrophobicContact CB-CB 4.43Å; L65-L73 PolarHBondContact O-N 3.09Å; L65-L94 HydrophobicContact CB-CD1 3.77Å; L65-L94 HydrophobicContact CD2-CD1 4.49Å; L65-F96 HydrophobicContact CD1-CZ 3.83Å; L65-F96 HydrophobicContact CD2-CZ 4.08Å; L65-F96 HydrophobicContact CG-CZ 4.42Å; L65-I106 HydrophobicContact CD2-CD1 3.85Å; L65-Y147 HydrophobicContact CD1-CE2 3.9Å; L65-Y147 HydrophobicContact CD2-CD2 4.36Å; L65-Y147 HydrophobicContact CD2-CE2 4.05Å; L65-Y147 HydrophobicContact CG-CE2 4.46Å; L65-F186 HydrophobicContact CD1-CB 3.73Å; L65-F186 HydrophobicContact CD2-CB 4.48Å; L65-F186 HydrophobicContact CD2-CD1 4.28Å; L65-F186 HydrophobicContact CD2-CG 4.49Å; L65-F186 HydrophobicContact CG-CB 3.84Å; L65-F186 HydrophobicContact CG-CD1 3.79Å; L65-F186 HydrophobicContact CG-CG 4.1Å; L65-P188 HydrophobicContact CD1-CB 4.38Å; L65-P188 HydrophobicContact CD1-CG 4.02Å
66	Y	98.3	Very high	90.2	Very high	72 Å²	72	39.7 Å²	39.7	28%	0.282	18%	0.18	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-87.9	109	-171.9	175.7	-100.9	0	0	0	112.2	F71 H72 Y144 F186 L187	Y66-F71 CarbonylContact C-O 3.46Å; Y66-H72 AromaticContact CD2-CD2 3.89Å; Y66-H72 AromaticContact CD2-NE2 3.51Å; Y66-Y144 HydrophobicContact CD1-CE1 4.45Å; Y66-F186 CarbonylContact O-C 3.45Å; Y66-F186 VanDerWaalsContact O-CA 3.28Å; Y66-F186 WeakPolarHBondContact O-CA 3.45Å; Y66-L187 HydrophobicContact CD1-CB 4.29Å; Y66-L187 PolarHBondContact N-O 2.87Å; Y66-L187 PolarHBondContact O-N 2.8Å
67	C	98.5	Very high	92	Very high	0 Å²	0	39.1 Å²	39.1	0%	0	18%	0.182	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-68.8	142.4	171.2	-164.8	0	0	0	0	111.3	T69 G70 F71 L165 F183 H185 F186	C67-T69 PolarHBondContact O-N 2.81Å; C67-T69 PolarHBondContact SG-OG1 3.42Å; C67-G70 PolarHBondContact O-N 3.4Å; C67-F71 WeakPolarHBondContact CB-O 3.39Å; C67-F71 PolarHBondContact N-O 2.98Å; C67-L165 HydrophobicContact CB-CB 4.13Å; C67-L165 HydrophobicContact CB-CD1 4Å; C67-L165 HydrophobicContact CB-CG 4.42Å; C67-F183 PolarHBondContact SG-O 3.37Å; C67-H185 WeakPolarHBondContact CA-O 3.41Å; C67-F186 HydrophobicContact CB-CD1 3.65Å; C67-F186 HydrophobicContact CB-CE1 3.44Å; C67-F186 VanDerWaalsContact CB-CE1 3.44Å; C67-F186 HydrophobicContact CB-CG 4.39Å; C67-F186 HydrophobicContact CB-CZ 3.99Å
68	R	97.6	Very high	93.3	Very high	69 Å²	69	40.1 Å²	40.1	26%	0.26	19%	0.192	S	C	.	.	T	Hydrogen-bonded Turn	trans	-65.9	-0.5	177.8	-154.3	165.5	-178.9	167.7	-7.3	113.9	E141 N142 Y144 K182 H185	R68-E141 PolarHBondContact NH1-O 3.45Å; R68-N142 PolarHBondContact NH2-ND2 2.69Å; R68-Y144 HydrophobicContact CB-CD1 4.02Å; R68-Y144 HydrophobicContact CB-CE1 3.52Å; R68-Y144 HydrophobicContact CG-CD1 4.28Å; R68-Y144 HydrophobicContact CG-CE1 3.63Å; R68-Y144 HydrophobicContact CG-CE2 4.24Å; R68-K182 WeakPolarHBondContact CB-O 3.48Å; R68-H185 HydrophobicContact CB-CB 3.95Å; R68-H185 WeakPolarHBondContact CD-CE1 3.34Å; R68-H185 PolarHBondContact N-O 2.8Å; R68-H185 PolarHBondContact NE-CE1 2.93Å; R68-H185 PolarHBondContact NH1-CE1 3.09Å; R68-H185 PolarHBondContact NH1-ND1 3.44Å
69	T	97.8	Very high	94.7	Very high	27 Å²	27	40.7 Å²	40.7	17%	0.166	20%	0.198	C	C	.	.	T	Hydrogen-bonded Turn	trans	-83.7	-6.6	165.4	50.2	0	0	0	0	114	C67 F71 L165 N166 K167 F183	C67-T69 PolarHBondContact O-N 2.81Å; C67-T69 PolarHBondContact SG-OG1 3.42Å; T69-F71 WeakPolarHBondContact O-CE2 3.3Å; T69-L165 WeakPolarHBondContact CG2-O 3.25Å; T69-L165 PolarHBondContact OG1-O 3.15Å; T69-N166 PolarHBondContact OG1-O 3.46Å; T69-K167 HydrophobicContact CG2-CG 4.37Å; T69-F183 HydrophobicContact CG2-CB 3.96Å
70	G	98.2	Very high	96.2	Very high	13 Å²	13	41.8 Å²	41.8	13%	0.134	21%	0.206	C	C	.	.	T	Hydrogen-bonded Turn	trans	98.2	31.3	174.6	0	0	0	0	0	115.1	C67 R85	C67-G70 PolarHBondContact O-N 3.4Å; G70-R85 PolarHBondContact O-NH1 2.75Å
71	F	98.7	Very high	97.3	Very high	11 Å²	11	36.2 Å²	36.2	5%	0.048	18%	0.177	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-138.9	140	-176.4	-59.7	-96.3	0	0	0	111.9	Y66 C67 T69 G83 T84 R85 L165 K167 D168	Y66-F71 CarbonylContact C-O 3.46Å; C67-F71 WeakPolarHBondContact CB-O 3.39Å; C67-F71 PolarHBondContact N-O 2.98Å; T69-F71 WeakPolarHBondContact O-CE2 3.3Å; F71-G83 WeakPolarHBondContact CD1-O 3.37Å; F71-T84 CarbonylContact C-O 3.54Å; F71-T84 VanDerWaalsContact CA-O 3.25Å; F71-T84 WeakPolarHBondContact CA-O 3.43Å; F71-R85 HydrophobicContact CD1-CG 3.76Å; F71-R85 HydrophobicContact CE1-CG 3.68Å; F71-R85 HydrophobicContact CZ-CG 4.38Å; F71-L165 HydrophobicContact CB-CD1 4.1Å; F71-K167 VanDerWaalsContact CE2-O 3.27Å; F71-K167 WeakPolarHBondContact CE2-O 3.5Å; F71-K167 WeakPolarHBondContact CZ-O 3.37Å; F71-D168 WeakPolarHBondContact CZ-O 3.11Å
72	H	98.7	Very high	97.9	Very high	8 Å²	8	34.7 Å²	34.7	4%	0.037	18%	0.175	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-80.4	134.8	165.2	-58.5	111.7	0	0	0	110.3	L65 Y66 G83 T84 H86 R189	L65-H72 WeakPolarHBondContact O-CA 3.43Å; Y66-H72 AromaticContact CD2-CD2 3.89Å; Y66-H72 AromaticContact CD2-NE2 3.51Å; H72-G83 CarbonylContact O-C 3.43Å; H72-G83 VanDerWaalsContact O-CA 3.3Å; H72-G83 WeakPolarHBondContact O-CA 3.22Å; H72-T84 HydrophobicContact CB-CG2 4.12Å; H72-T84 PolarHBondContact N-O 2.81Å; H72-T84 PolarHBondContact O-N 2.63Å; H72-H86 PolarHBondContact ND1-O 3.38Å; H72-R189 PolarHBondContact CE1-NH1 3.49Å; H72-R189 PolarHBondContact NE2-NH1 3.21Å
73	L	98.8	Very high	98.2	Very high	0 Å²	0	34 Å²	34	0%	0	18%	0.176	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-70.9	128.1	172.6	-174.9	133.4	0	0	0	110.7	L65 I75 V81 G92 L94 L115 V163 L165 F186	L65-L73 HydrophobicContact CB-CB 4.43Å; L65-L73 PolarHBondContact O-N 3.09Å; L73-I75 HydrophobicContact CD2-CD1 4.3Å; L73-I75 HydrophobicContact CD2-CG1 3.97Å; L73-V81 HydrophobicContact CD1-CG1 3.93Å; L73-V81 HydrophobicContact CD2-CG1 4.33Å; L73-V81 HydrophobicContact CG-CG1 4.01Å; L73-G92 WeakPolarHBondContact O-CA 3.43Å; L73-L94 HydrophobicContact CD2-CD1 3.85Å; L73-L115 HydrophobicContact CD2-CD1 4.45Å; L73-L115 HydrophobicContact CD2-CD2 4.28Å; L73-V163 HydrophobicContact CD1-CG1 3.92Å; L73-L165 HydrophobicContact CB-CD1 4.16Å; L73-L165 HydrophobicContact CD1-CD2 4.42Å; L73-L165 HydrophobicContact CD1-CG 4.48Å; L73-F186 HydrophobicContact CB-CE1 4.3Å; L73-F186 HydrophobicContact CD1-CE1 4.21Å; L73-F186 HydrophobicContact CD1-CZ 4.47Å
74	E	98.6	Very high	98.3	Very high	12 Å²	12	30.5 Å²	30.5	6%	0.056	17%	0.165	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-114.4	146.5	177.6	-61	-165	111.7	0	0	111.4	F76 V81 H82 T84 S89 F91	E74-F76 HydrophobicContact CB-CD2 4.14Å; E74-F76 HydrophobicContact CB-CE2 3.62Å; E74-F76 HydrophobicContact CB-CZ 4.4Å; E74-F76 HydrophobicContact CG-CE2 4.41Å; E74-F76 WeakPolarHBondContact OE2-CE2 3.46Å; E74-F76 VanDerWaalsContact OE2-CZ 3.32Å; E74-F76 WeakPolarHBondContact OE2-CZ 3.5Å; E74-V81 WeakPolarHBondContact O-CA 3.32Å; E74-H82 PolarHBondContact N-O 3.42Å; E74-H82 PolarHBondContact O-N 3.11Å; E74-T84 HydrophobicContact CG-CG2 3.59Å; E74-T84 VanDerWaalsContact OE2-CB 3.32Å; E74-T84 WeakPolarHBondContact OE2-CB 3.25Å; E74-S89 VanDerWaalsContact OE1-CB 3.23Å; E74-S89 WeakPolarHBondContact OE1-CB 3.2Å; E74-S89 PolarHBondContact OE1-OG 3.42Å; E74-F91 WeakPolarHBondContact CA-O 3.4Å; E74-F91 HydrophobicContact CB-CB 4Å; E74-F91 HydrophobicContact CG-CB 4.36Å
75	I	98.7	Very high	98.3	Very high	0 Å²	0	37.9 Å²	37.9	0%	0	19%	0.193	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-125	105.3	175.4	-52.3	176.1	0	0	0	108.2	L73 F91 L94 S111 L113 L115	L73-I75 HydrophobicContact CD2-CD1 4.3Å; L73-I75 HydrophobicContact CD2-CG1 3.97Å; I75-F91 PolarHBondContact N-O 2.97Å; I75-F91 VanDerWaalsContact N-O 3.09Å; I75-L94 HydrophobicContact CD1-CD2 3.96Å; I75-L94 HydrophobicContact CG1-CD2 4.1Å; I75-S111 VanDerWaalsContact O-CB 3.22Å; I75-S111 WeakPolarHBondContact O-CB 3.29Å; I75-S111 PolarHBondContact O-OG 2.93Å; I75-L113 HydrophobicContact CG2-CB 3.97Å; I75-L115 HydrophobicContact CD1-CB 3.84Å; I75-L115 HydrophobicContact CD1-CD1 4.5Å
76	F	98.5	Very high	98.3	Very high	52 Å²	52	44.1 Å²	44.1	23%	0.228	22%	0.222	C	C	.	.			trans	-83.2	152.8	-173.2	-75.7	-98.5	0	0	0	112.5	E74 N78 G79 T80 H82 F91 L113	E74-F76 HydrophobicContact CB-CD2 4.14Å; E74-F76 HydrophobicContact CB-CE2 3.62Å; E74-F76 HydrophobicContact CB-CZ 4.4Å; E74-F76 HydrophobicContact CG-CE2 4.41Å; E74-F76 WeakPolarHBondContact OE2-CE2 3.46Å; E74-F76 VanDerWaalsContact OE2-CZ 3.32Å; E74-F76 WeakPolarHBondContact OE2-CZ 3.5Å; F76-N78 WeakPolarHBondContact CB-OD1 3.18Å; F76-N78 PolarHBondContact O-N 2.87Å; F76-N78 VanDerWaalsContact O-N 3.1Å; F76-G79 PolarHBondContact O-N 2.97Å; F76-T80 PolarHBondContact N-O 2.85Å; F76-H82 HydrophobicContact CE2-CB 4.22Å; F76-F91 AromaticContact CD1-CD2 3.6Å; F76-F91 HydrophobicContact CD1-CD2 3.6Å; F76-F91 AromaticContact CD1-CE2 3.83Å; F76-F91 HydrophobicContact CD1-CE2 3.83Å; F76-F91 HydrophobicContact CD1-CG 4.01Å; F76-F91 HydrophobicContact CD1-CZ 4.43Å; F76-F91 AromaticContact CE1-CD2 3.28Å; F76-F91 HydrophobicContact CE1-CD2 3.28Å; F76-F91 AromaticContact CE1-CE2 3.61Å; F76-F91 HydrophobicContact CE1-CE2 3.61Å; F76-F91 HydrophobicContact CE1-CG 4.06Å; F76-F91 HydrophobicContact CG-CD2 4.41Å; F76-F91 HydrophobicContact CG-CG 4.43Å; F76-F91 AromaticContact CZ-CD2 3.85Å; F76-F91 HydrophobicContact CZ-CD2 3.85Å; F76-F91 HydrophobicContact CZ-CG 4.5Å; F76-L113 WeakPolarHBondContact O-CD1 3.32Å
77	P	98	Very high	98.2	Very high	76 Å²	76	43.8 Å²	43.8	49%	0.494	23%	0.225	S	C	.	.	T	Hydrogen-bonded Turn	trans	-61.6	-17.9	-179.4	-24.4	34.5	0	0	0	115.7	G79 F91	P77-G79 VanDerWaalsContact C-N 3.3Å; P77-F91 HydrophobicContact CG-CD1 4.36Å; P77-F91 HydrophobicContact CG-CE1 3.8Å
78	N	98	Very high	98	Very high	117 Å²	117	44.7 Å²	44.7	63%	0.626	23%	0.229	S	C	*	.	T	Hydrogen-bonded Turn	trans	-80	-7.2	173	66.2	-11	0	0	0	113.4	F76 T80	F76-N78 WeakPolarHBondContact CB-OD1 3.18Å; F76-N78 PolarHBondContact O-N 2.87Å; F76-N78 VanDerWaalsContact O-N 3.1Å; N78-T80 PolarHBondContact ND2-OG1 2.74Å; N78-T80 PolarHBondContact OD1-N 3.33Å; N78-T80 PolarHBondContact OD1-OG1 3.37Å; N78-T80 VanDerWaalsContact OD1-OG1 3.12Å
79	G	98.2	Very high	98	Very high	17 Å²	17	42.7 Å²	42.7	18%	0.175	23%	0.225	C	C	.	.	S	Bend	trans	91.6	4.3	-176.7	0	0	0	0	0	115.8	F76 P77 G125	F76-G79 PolarHBondContact O-N 2.97Å; P77-G79 VanDerWaalsContact C-N 3.3Å; G79-G125 PolarHBondContact O-N 3.25Å
80	T	98.5	Very high	97.8	Very high	54 Å²	54	48.5 Å²	48.5	33%	0.331	24%	0.244	S	C	.	.			trans	-84.3	152.1	174.2	66.6	0	0	0	0	112.3	F76 N78	F76-T80 PolarHBondContact N-O 2.85Å; N78-T80 PolarHBondContact ND2-OG1 2.74Å; N78-T80 PolarHBondContact OD1-N 3.33Å; N78-T80 PolarHBondContact OD1-OG1 3.37Å; N78-T80 VanDerWaalsContact OD1-OG1 3.12Å
81	V	98.8	Very high	97.8	Very high	2 Å²	2	49.8 Å²	49.8	1%	0.012	25%	0.246	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-122.7	126.5	-179.6	177.2	0	0	0	0	108.8	L73 E74 L115 L123 P171	L73-V81 HydrophobicContact CD1-CG1 3.93Å; L73-V81 HydrophobicContact CD2-CG1 4.33Å; L73-V81 HydrophobicContact CG-CG1 4.01Å; E74-V81 WeakPolarHBondContact O-CA 3.32Å; V81-L115 HydrophobicContact CG1-CD1 4.03Å; V81-L115 HydrophobicContact CG2-CD1 3.79Å; V81-L123 HydrophobicContact CB-CB 4.09Å; V81-L123 HydrophobicContact CG1-CB 4.1Å; V81-L123 HydrophobicContact CG1-CD1 4.32Å; V81-L123 HydrophobicContact CG2-CB 4.35Å; V81-P171 WeakPolarHBondContact O-CD 3.46Å; V81-P171 VanDerWaalsContact O-CG 3.29Å; V81-P171 WeakPolarHBondContact O-CG 3.45Å
82	H	98.1	Very high	97.7	Very high	81 Å²	81	49.3 Å²	49.3	38%	0.375	24%	0.244	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-142.6	172.5	-176.9	-71.6	-84.6	0	0	0	111.7	E74 F76	E74-H82 PolarHBondContact N-O 3.42Å; E74-H82 PolarHBondContact O-N 3.11Å; F76-H82 HydrophobicContact CE2-CB 4.22Å
83	G	98.5	Very high	97.6	Very high	14 Å²	14	49.1 Å²	49.1	14%	0.144	24%	0.243	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-109.5	131.1	172.9	0	0	0	0	0	112.6	F71 H72 G169	F71-G83 WeakPolarHBondContact CD1-O 3.37Å; H72-G83 CarbonylContact O-C 3.43Å; H72-G83 VanDerWaalsContact O-CA 3.3Å; H72-G83 WeakPolarHBondContact O-CA 3.22Å; G83-G169 WeakPolarHBondContact CA-O 3.23Å; G83-G169 PolarHBondContact N-O 3.26Å
84	T	98.5	Very high	97.5	Very high	16 Å²	16	49.1 Å²	49.1	10%	0.098	24%	0.243	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-117.5	145.8	174.5	-168.2	0	0	0	0	112.2	F71 H72 E74 H86	F71-T84 CarbonylContact C-O 3.54Å; F71-T84 VanDerWaalsContact CA-O 3.25Å; F71-T84 WeakPolarHBondContact CA-O 3.43Å; H72-T84 HydrophobicContact CB-CG2 4.12Å; H72-T84 PolarHBondContact N-O 2.81Å; H72-T84 PolarHBondContact O-N 2.63Å; E74-T84 HydrophobicContact CG-CG2 3.59Å; E74-T84 VanDerWaalsContact OE2-CB 3.32Å; E74-T84 WeakPolarHBondContact OE2-CB 3.25Å; T84-H86 VanDerWaalsContact C-N 3.3Å; T84-H86 HydrophobicContact CG2-CB 4.48Å; T84-H86 PolarHBondContact OG1-N 3.16Å; T84-H86 PolarHBondContact OG1-ND1 3.32Å
85	R	98.2	Very high	97.4	Very high	154 Å²	154	50.2 Å²	50.2	58%	0.581	25%	0.249	S	C	*	.			trans	-80.9	-11	173.1	-60.8	-156.9	-177.5	-78.1	5.9	113.4	G70 F71	G70-R85 PolarHBondContact O-NH1 2.75Å; F71-R85 HydrophobicContact CD1-CG 3.76Å; F71-R85 HydrophobicContact CE1-CG 3.68Å; F71-R85 HydrophobicContact CZ-CG 4.38Å
86	H	96.9	Very high	97.2	Very high	132 Å²	132	51.4 Å²	51.4	61%	0.611	25%	0.254	S	S	*	.			trans	-73.9	127.3	-175.9	-57.9	92	0	0	0	111.2	H72 T84	H72-H86 PolarHBondContact ND1-O 3.38Å; T84-H86 VanDerWaalsContact C-N 3.3Å; T84-H86 HydrophobicContact CG2-CB 4.48Å; T84-H86 PolarHBondContact OG1-N 3.16Å; T84-H86 PolarHBondContact OG1-ND1 3.32Å
87	D	96.1	Very high	97	Very high	64 Å²	64	49.8 Å²	49.8	34%	0.342	25%	0.248	S	C	.	.	T	Hydrogen-bonded Turn	trans	-73	136.2	168.9	-179.5	62.9	0	0	0	109.2	Q64 S89 R189 K195	Q64-D87 PolarHBondContact NE2-OD1 3.09Å; Q64-D87 VanDerWaalsContact NE2-OD1 3.1Å; Q64-D87 PolarHBondContact OE1-OD1 3.15Å; D87-S89 VanDerWaalsContact C-N 3.28Å; D87-S89 PolarHBondContact O-N 3.13Å; D87-R189 IonicContact OD1-CZ 3.27Å; D87-R189 VanDerWaalsContact OD1-CZ 3.27Å; D87-R189 IonicContact OD1-NH1 2.71Å; D87-R189 PolarHBondContact OD1-NH1 3.36Å; D87-R189 IonicContact OD1-NH2 2.87Å; D87-R189 PolarHBondContact OD1-NH2 3.15Å; D87-K195 IonicContact OD2-NZ 2.82Å; D87-K195 PolarHBondContact OD2-NZ 2.81Å
88	H	95.3	Very high	96.7	Very high	20 Å²	20	48.3 Å²	48.3	9%	0.093	24%	0.239	C	C	.	.	T	Hydrogen-bonded Turn	trans	58.6	31.3	-176	-64.3	77	0	0	0	115.1	Q64 D192 K195 L196	Q64-H88 PolarHBondContact NE2-CE1 3.48Å; Q64-H88 PolarHBondContact NE2-ND1 3.14Å; Q64-H88 PolarHBondContact NE2-NE2 3.18Å; H88-D192 PolarHBondContact NE2-N 3.31Å; H88-K195 HydrophobicContact CB-CB 3.99Å; H88-K195 HydrophobicContact CB-CD 4.19Å; H88-K195 VanDerWaalsContact ND1-CD 3.31Å; H88-K195 WeakPolarHBondContact ND1-CD 3.47Å; H88-L196 HydrophobicContact CB-CD2 4.28Å
89	S	95.9	Very high	96.4	Very high	26 Å²	26	43 Å²	43	18%	0.182	21%	0.21	C	C	.	.			trans	-58.6	139.6	171.8	-169.1	0	0	0	0	111.9	E74 D87 F91 G92	E74-S89 VanDerWaalsContact OE1-CB 3.23Å; E74-S89 WeakPolarHBondContact OE1-CB 3.2Å; E74-S89 PolarHBondContact OE1-OG 3.42Å; D87-S89 VanDerWaalsContact C-N 3.28Å; D87-S89 PolarHBondContact O-N 3.13Å; S89-F91 VanDerWaalsContact C-N 3.3Å; S89-F91 PolarHBondContact O-N 3.15Å; S89-G92 WeakPolarHBondContact O-CA 3.3Å; S89-G92 PolarHBondContact O-N 3.28Å
90	R	94.8	Very high	96.2	Very high	149 Å²	149	43.2 Å²	43.2	56%	0.562	21%	0.211	S	C	*	.	G	3₁₀ helix	trans	-51.3	-43.6	-174.6	-178.1	176.3	176.6	-159.1	-16.5	113.5	D110	R90-D110 HydrophobicContact CG-CB 4.2Å; R90-D110 IonicContact CZ-OD1 2.87Å; R90-D110 VanDerWaalsContact CZ-OD1 3.27Å; R90-D110 IonicContact CZ-OD2 2.91Å; R90-D110 VanDerWaalsContact CZ-OD2 3.3Å; R90-D110 IonicContact NE-OD1 3.97Å; R90-D110 PolarHBondContact NE-OD1 2.98Å; R90-D110 VanDerWaalsContact NE-OD1 3.09Å; R90-D110 IonicContact NE-OD2 3.87Å; R90-D110 PolarHBondContact NE-OD2 2.83Å; R90-D110 VanDerWaalsContact NH2-CG 3.31Å; R90-D110 IonicContact NH2-OD1 2.74Å; R90-D110 PolarHBondContact NH2-OD1 3.24Å; R90-D110 IonicContact NH2-OD2 3.64Å; R90-D110 PolarHBondContact NH2-OD2 3.36Å
91	F	96.9	Very high	95.9	Very high	41 Å²	41	46.6 Å²	46.6	18%	0.18	23%	0.231	C	C	.	.	G	3₁₀ helix	trans	-90.8	-6.4	-178.2	-52.4	-63.7	0	0	0	113.4	E74 I75 F76 P77 S89 D110	E74-F91 WeakPolarHBondContact CA-O 3.4Å; E74-F91 HydrophobicContact CB-CB 4Å; E74-F91 HydrophobicContact CG-CB 4.36Å; I75-F91 PolarHBondContact N-O 2.97Å; I75-F91 VanDerWaalsContact N-O 3.09Å; F76-F91 AromaticContact CD1-CD2 3.6Å; F76-F91 HydrophobicContact CD1-CD2 3.6Å; F76-F91 AromaticContact CD1-CE2 3.83Å; F76-F91 HydrophobicContact CD1-CE2 3.83Å; F76-F91 HydrophobicContact CD1-CG 4.01Å; F76-F91 HydrophobicContact CD1-CZ 4.43Å; F76-F91 AromaticContact CE1-CD2 3.28Å; F76-F91 HydrophobicContact CE1-CD2 3.28Å; F76-F91 AromaticContact CE1-CE2 3.61Å; F76-F91 HydrophobicContact CE1-CE2 3.61Å; F76-F91 HydrophobicContact CE1-CG 4.06Å; F76-F91 HydrophobicContact CG-CD2 4.41Å; F76-F91 HydrophobicContact CG-CG 4.43Å; F76-F91 AromaticContact CZ-CD2 3.85Å; F76-F91 HydrophobicContact CZ-CD2 3.85Å; F76-F91 HydrophobicContact CZ-CG 4.5Å; P77-F91 HydrophobicContact CG-CD1 4.36Å; P77-F91 HydrophobicContact CG-CE1 3.8Å; S89-F91 VanDerWaalsContact C-N 3.3Å; S89-F91 PolarHBondContact O-N 3.15Å; F91-D110 HydrophobicContact CD1-CB 4.31Å; F91-D110 VanDerWaalsContact CE1-OD1 3.28Å; F91-D110 WeakPolarHBondContact CE1-OD1 3.16Å
92	G	97.6	Very high	95.6	Very high	0 Å²	0	48.2 Å²	48.2	0%	0	25%	0.248	C	C	.	.	G	3₁₀ helix	trans	-93	5.6	176.4	0	0	0	0	0	114.7	L73 S89	L73-G92 WeakPolarHBondContact O-CA 3.43Å; S89-G92 WeakPolarHBondContact O-CA 3.3Å; S89-G92 PolarHBondContact O-N 3.28Å
93	I	96.6	Very high	95.5	Very high	4 Å²	4	45 Å²	45	2%	0.021	23%	0.233	C	C	.	.			trans	-90.5	113.3	172.3	-49.1	-55.1	0	0	0	109	R62 Q64 V109 V191 L196 M199	R62-I93 HydrophobicContact CB-CG2 4.47Å; Q64-I93 HydrophobicContact CG-CD1 4.05Å; I93-V109 HydrophobicContact CG2-CB 4.44Å; I93-V109 HydrophobicContact CG2-CG2 4.14Å; I93-V109 WeakPolarHBondContact O-CG2 3.28Å; I93-V109 PolarHBondContact O-N 2.84Å; I93-V191 HydrophobicContact CD1-CG1 4.28Å; I93-V191 HydrophobicContact CD1-CG2 4.14Å; I93-V191 HydrophobicContact CG2-CG1 4.27Å; I93-V191 HydrophobicContact CG2-CG2 4.12Å; I93-L196 HydrophobicContact CD1-CD1 3.86Å; I93-L196 HydrophobicContact CD1-CD2 4.02Å; I93-L196 HydrophobicContact CG1-CD1 3.8Å; I93-L196 HydrophobicContact CG1-CD2 3.89Å; I93-L196 HydrophobicContact CG2-CD1 4.22Å; I93-M199 HydrophobicContact CG2-CE 3.65Å
94	L	97.2	Very high	95.5	Very high	0 Å²	0	44.7 Å²	44.7	0%	0	23%	0.228	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-121.1	135.3	-169.5	-48.2	179	0	0	0	111.4	R62 R63 L65 L73 I75 F96 I106 R107	R62-L94 CarbonylContact C-O 3.59Å; R62-L94 WeakPolarHBondContact CA-O 3.47Å; R63-L94 PolarHBondContact N-O 3.06Å; R63-L94 PolarHBondContact O-N 3.14Å; L65-L94 HydrophobicContact CB-CD1 3.77Å; L65-L94 HydrophobicContact CD2-CD1 4.49Å; L73-L94 HydrophobicContact CD2-CD1 3.85Å; I75-L94 HydrophobicContact CD1-CD2 3.96Å; I75-L94 HydrophobicContact CG1-CD2 4.1Å; L94-F96 HydrophobicContact CB-CE2 4.38Å; L94-I106 HydrophobicContact CB-CG2 3.87Å; L94-I106 HydrophobicContact CD1-CG2 3.72Å; L94-I106 HydrophobicContact CG-CG2 4.29Å; L94-R107 CarbonylContact C-O 3.48Å; L94-R107 VanDerWaalsContact CA-O 3.25Å; L94-R107 WeakPolarHBondContact CA-O 3.35Å
95	E	95.4	Very high	95.4	Very high	36 Å²	36	43.9 Å²	43.9	17%	0.168	22%	0.223	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-90.3	124.7	171.9	174	175.8	-142.6	0	0	110.2	G58 I97 R107 V109	G58-E95 WeakPolarHBondContact CA-OE1 3.44Å; E95-I97 HydrophobicContact CG-CG1 4.15Å; E95-R107 HydrophobicContact CB-CB 4.37Å; E95-R107 PolarHBondContact N-O 3.45Å; E95-R107 PolarHBondContact O-N 2.91Å; E95-R107 IonicContact OE2-NH1 2.65Å; E95-R107 PolarHBondContact OE2-NH1 2.75Å; E95-R107 VanDerWaalsContact OE2-NH1 3.09Å; E95-V109 HydrophobicContact CB-CG2 4.04Å
96	F	94.8	Very high	95.4	Very high	24 Å²	24	36.6 Å²	36.6	11%	0.105	20%	0.196	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-92.6	115.8	178.7	-87.6	-115.4	0	0	0	111.6	R61 R63 L65 L94 I104 I106 Y147	R61-F96 WeakPolarHBondContact CD-O 3.41Å; R61-F96 PolarHBondContact O-N 2.82Å; R61-F96 VanDerWaalsContact O-N 3.09Å; R63-F96 HydrophobicContact CB-CD2 3.94Å; R63-F96 HydrophobicContact CB-CE2 3.9Å; R63-F96 HydrophobicContact CG-CD2 4.11Å; R63-F96 HydrophobicContact CG-CE2 4.41Å; L65-F96 HydrophobicContact CD1-CZ 3.83Å; L65-F96 HydrophobicContact CD2-CZ 4.08Å; L65-F96 HydrophobicContact CG-CZ 4.42Å; L94-F96 HydrophobicContact CB-CE2 4.38Å; F96-I104 HydrophobicContact CD1-CD1 3.6Å; F96-I104 HydrophobicContact CE1-CD1 3.51Å; F96-I106 HydrophobicContact CE1-CD1 4.35Å; F96-I106 HydrophobicContact CE1-CG1 4.33Å; F96-I106 HydrophobicContact CE2-CG2 4.27Å; F96-I106 HydrophobicContact CZ-CD1 4.11Å; F96-I106 HydrophobicContact CZ-CG1 4.25Å; F96-Y147 HydrophobicContact CE1-CE1 4.29Å
97	I	93.9	Very high	95.4	Very high	19 Å²	19	33.5 Å²	33.5	10%	0.097	18%	0.179	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-108.3	103.5	-176	-56.6	173.2	0	0	0	109	E95 L99 I104 S105 R107 Y114	E95-I97 HydrophobicContact CG-CG1 4.15Å; I97-L99 HydrophobicContact CG2-CD2 3.97Å; I97-L99 PolarHBondContact O-N 2.87Å; I97-I104 CarbonylContact O-C 3.58Å; I97-I104 VanDerWaalsContact O-CA 3.26Å; I97-I104 WeakPolarHBondContact O-CA 3.29Å; I97-S105 PolarHBondContact N-O 2.91Å; I97-S105 PolarHBondContact O-N 2.95Å; I97-R107 HydrophobicContact CD1-CB 4.26Å; I97-Y114 HydrophobicContact CD1-CD1 4.44Å; I97-Y114 HydrophobicContact CD1-CE1 3.79Å
98	S	92.9	Very high	95.5	Very high	45 Å²	45	30.4 Å²	30.4	32%	0.315	16%	0.162	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-65.6	125.4	172.9	167	0	0	0	0	111.3	R37 A100	R37-S98 PolarHBondContact NH2-O 3.16Å; S98-A100 PolarHBondContact OG-O 2.7Å
99	L	92.4	Very high	95.4	Very high	4 Å²	4	31.1 Å²	31.1	2%	0.021	17%	0.168	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-108.7	-26.5	179.7	-61.4	-176.3	0	0	0	113.1	R37 L38 I41 I97 L103 L129 V134	R37-L99 WeakPolarHBondContact CD-O 3.37Å; R37-L99 PolarHBondContact NE-O 3.26Å; R37-L99 PolarHBondContact NH1-O 3.09Å; R37-L99 PolarHBondContact NH2-O 3.24Å; L38-L99 HydrophobicContact CD2-CD1 4.14Å; I41-L99 HydrophobicContact CD1-CD2 3.4Å; I41-L99 VanDerWaalsContact CD1-CD2 3.4Å; I97-L99 HydrophobicContact CG2-CD2 3.97Å; I97-L99 PolarHBondContact O-N 2.87Å; L99-L103 HydrophobicContact CB-CB 4.36Å; L99-L103 PolarHBondContact N-O 2.82Å; L99-L129 HydrophobicContact CD2-CD2 4.36Å; L99-V134 HydrophobicContact CD1-CB 4.21Å; L99-V134 HydrophobicContact CD1-CG1 3.89Å; L99-V134 HydrophobicContact CD1-CG2 3.65Å
100	A	92.2	Very high	95.4	Very high	22 Å²	22	32.5 Å²	32.5	18%	0.182	17%	0.174	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-158.3	-168.4	166.9	0	0	0	0	0	109.7	L34 S98 G102 L103	L34-A100 HydrophobicContact CD2-CB 4.22Å; S98-A100 PolarHBondContact OG-O 2.7Å; A100-G102 PolarHBondContact O-N 2.79Å; A100-L103 HydrophobicContact CB-CB 3.87Å; A100-L103 HydrophobicContact CB-CD1 3.91Å; A100-L103 HydrophobicContact CB-CG 3.97Å; A100-L103 PolarHBondContact N-O 3.09Å; A100-L103 VanDerWaalsContact N-O 3.07Å; A100-L103 PolarHBondContact O-N 2.98Å
101	V	92.3	Very high	95.4	Very high	126 Å²	126	26.4 Å²	26.4	76%	0.764	15%	0.153	S	C	*	.	T	Hydrogen-bonded Turn	trans	-64.2	123.4	161.7	180	0	0	0	0	107.7	L27 L103	L27-V101 HydrophobicContact CD2-CG2 4.2Å; V101-L103 PolarHBondContact O-N 2.74Å; V101-L103 VanDerWaalsContact O-N 3.09Å
102	G	93.5	Very high	95.4	Very high	35 Å²	35	25.6 Å²	25.6	36%	0.361	16%	0.157	S	C	.	.	T	Hydrogen-bonded Turn	trans	65.7	5.5	-178.8	0	0	0	0	0	116.1	A100 R136 E137	A100-G102 PolarHBondContact O-N 2.79Å; G102-R136 CarbonylContact O-C 3.46Å; G102-R136 WeakPolarHBondContact O-CA 3.3Å; G102-E137 PolarHBondContact O-N 2.98Å
103	L	96.4	Very high	95.4	Very high	13 Å²	13	26.2 Å²	26.2	7%	0.068	16%	0.16	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-117.1	133.2	174.9	-55.8	-174.7	0	0	0	111.1	L34 L99 A100 V101 F135 R136 T150	L34-L103 HydrophobicContact CD1-CD1 3.76Å; L34-L103 HydrophobicContact CD2-CD1 3.73Å; L34-L103 HydrophobicContact CG-CD1 4.43Å; L99-L103 HydrophobicContact CB-CB 4.36Å; L99-L103 PolarHBondContact N-O 2.82Å; A100-L103 HydrophobicContact CB-CB 3.87Å; A100-L103 HydrophobicContact CB-CD1 3.91Å; A100-L103 HydrophobicContact CB-CG 3.97Å; A100-L103 PolarHBondContact N-O 3.09Å; A100-L103 VanDerWaalsContact N-O 3.07Å; A100-L103 PolarHBondContact O-N 2.98Å; V101-L103 PolarHBondContact O-N 2.74Å; V101-L103 VanDerWaalsContact O-N 3.09Å; L103-F135 WeakPolarHBondContact CA-O 3.3Å; L103-R136 HydrophobicContact CD2-CB 3.72Å; L103-R136 HydrophobicContact CD2-CG 3.88Å; L103-T150 HydrophobicContact CD2-CG2 3.68Å
104	I	96.8	Very high	95.5	Very high	8 Å²	8	26.6 Å²	26.6	4%	0.041	16%	0.161	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-135.9	164.6	-179.7	69.4	164.6	0	0	0	112.2	F96 I97 I106 F135 E137 Y147	F96-I104 HydrophobicContact CD1-CD1 3.6Å; F96-I104 HydrophobicContact CE1-CD1 3.51Å; I97-I104 CarbonylContact O-C 3.58Å; I97-I104 VanDerWaalsContact O-CA 3.26Å; I97-I104 WeakPolarHBondContact O-CA 3.29Å; I104-I106 HydrophobicContact CD1-CD1 3.93Å; I104-I106 HydrophobicContact CD1-CG1 3.65Å; I104-I106 HydrophobicContact CG1-CG1 4.37Å; I104-F135 HydrophobicContact CG1-CB 4.49Å; I104-F135 PolarHBondContact N-O 2.92Å; I104-F135 PolarHBondContact O-N 2.77Å; I104-E137 HydrophobicContact CG1-CB 4.45Å; I104-E137 HydrophobicContact CG2-CB 4.48Å; I104-Y147 HydrophobicContact CD1-CD1 3.82Å; I104-Y147 HydrophobicContact CD1-CE1 3.42Å; I104-Y147 VanDerWaalsContact CD1-CE1 3.42Å; I104-Y147 HydrophobicContact CG1-CD1 4.36Å; I104-Y147 HydrophobicContact CG1-CE1 4.32Å
105	S	97.4	Very high	95.6	Very high	0 Å²	0	26.6 Å²	26.6	0%	0	16%	0.161	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-119.8	158.8	151.7	-165.5	0	0	0	0	109.8	I97 L129 C133	I97-S105 PolarHBondContact N-O 2.91Å; I97-S105 PolarHBondContact O-N 2.95Å; S105-L129 VanDerWaalsContact OG-CD1 3.25Å; S105-L129 WeakPolarHBondContact OG-CD1 3.42Å; S105-C133 WeakPolarHBondContact CA-O 3.45Å; S105-C133 WeakPolarHBondContact CB-O 3.37Å; S105-C133 PolarHBondContact OG-O 2.69Å
106	I	98.1	Very high	95.7	Very high	0 Å²	0	24.9 Å²	24.9	0%	0	15%	0.153	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-125.7	126.5	-176.2	-56	176	0	0	0	106.8	L65 L94 F96 I104 Y114 L115 Y147	L65-I106 HydrophobicContact CD2-CD1 3.85Å; L94-I106 HydrophobicContact CB-CG2 3.87Å; L94-I106 HydrophobicContact CD1-CG2 3.72Å; L94-I106 HydrophobicContact CG-CG2 4.29Å; F96-I106 HydrophobicContact CE1-CD1 4.35Å; F96-I106 HydrophobicContact CE1-CG1 4.33Å; F96-I106 HydrophobicContact CE2-CG2 4.27Å; F96-I106 HydrophobicContact CZ-CD1 4.11Å; F96-I106 HydrophobicContact CZ-CG1 4.25Å; I104-I106 HydrophobicContact CD1-CD1 3.93Å; I104-I106 HydrophobicContact CD1-CG1 3.65Å; I104-I106 HydrophobicContact CG1-CG1 4.37Å; I106-Y114 CarbonylContact O-C 3.5Å; I106-Y114 WeakPolarHBondContact O-CA 3.44Å; I106-L115 HydrophobicContact CB-CB 4.2Å; I106-L115 HydrophobicContact CD1-CD2 4.22Å; I106-L115 PolarHBondContact O-N 2.83Å; I106-Y147 HydrophobicContact CD1-CD1 4.48Å
107	R	97.6	Very high	95.9	Very high	67 Å²	67	23.8 Å²	23.8	25%	0.253	15%	0.148	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-123.3	129.3	-175.9	-174.1	-168.6	178	-147.4	1	110.9	L94 E95 I97 V109 G112 L113 Y114	L94-R107 CarbonylContact C-O 3.48Å; L94-R107 VanDerWaalsContact CA-O 3.25Å; L94-R107 WeakPolarHBondContact CA-O 3.35Å; E95-R107 HydrophobicContact CB-CB 4.37Å; E95-R107 PolarHBondContact N-O 3.45Å; E95-R107 PolarHBondContact O-N 2.91Å; E95-R107 IonicContact OE2-NH1 2.65Å; E95-R107 PolarHBondContact OE2-NH1 2.75Å; E95-R107 VanDerWaalsContact OE2-NH1 3.09Å; I97-R107 HydrophobicContact CD1-CB 4.26Å; R107-V109 PolarHBondContact O-N 2.86Å; R107-G112 PolarHBondContact NE-O 3.07Å; R107-L113 CarbonylContact C-O 3.52Å; R107-L113 VanDerWaalsContact CA-O 3.29Å; R107-L113 WeakPolarHBondContact CA-O 3.46Å; R107-L113 WeakPolarHBondContact CG-O 3.29Å; R107-Y114 HydrophobicContact CB-CD1 3.86Å; R107-Y114 HydrophobicContact CB-CE1 3.88Å; R107-Y114 HydrophobicContact CG-CD1 3.98Å; R107-Y114 HydrophobicContact CG-CE1 3.73Å; R107-Y114 PolarHBondContact NE-OH 3.41Å
108	G	97.5	Very high	96.1	Very high	0 Å²	0	24.6 Å²	24.6	0%	0	15%	0.153	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-67.5	124.8	171	0	0	0	0	0	109.9	G112 L113	G108-G112 WeakPolarHBondContact O-CA 3.48Å; G108-G112 PolarHBondContact O-N 2.82Å; G108-L113 PolarHBondContact N-O 3.49Å
109	V	94.3	Very high	96.4	Very high	35 Å²	35	29.1 Å²	29.1	21%	0.212	17%	0.169	C	C	.	.	T	Hydrogen-bonded Turn	trans	-70	-42.4	-174.7	-179.6	0	0	0	0	111.4	R62 I93 E95 R107 M199	R62-V109 HydrophobicContact CG-CG2 4.19Å; I93-V109 HydrophobicContact CG2-CB 4.44Å; I93-V109 HydrophobicContact CG2-CG2 4.14Å; I93-V109 WeakPolarHBondContact O-CG2 3.28Å; I93-V109 PolarHBondContact O-N 2.84Å; E95-V109 HydrophobicContact CB-CG2 4.04Å; R107-V109 PolarHBondContact O-N 2.86Å; V109-M199 HydrophobicContact CB-CE 4.33Å; V109-M199 HydrophobicContact CG1-CE 3.83Å; V109-M199 HydrophobicContact CG1-SD 4.18Å
110	D	94.1	Very high	96.6	Very high	55 Å²	55	37 Å²	37	29%	0.294	20%	0.199	S	C	.	.	T	Hydrogen-bonded Turn	trans	-77	-40.4	-178.1	-168.6	-92.4	0	0	0	113.1	R90 F91	R90-D110 HydrophobicContact CG-CB 4.2Å; R90-D110 IonicContact CZ-OD1 2.87Å; R90-D110 VanDerWaalsContact CZ-OD1 3.27Å; R90-D110 IonicContact CZ-OD2 2.91Å; R90-D110 VanDerWaalsContact CZ-OD2 3.3Å; R90-D110 IonicContact NE-OD1 3.97Å; R90-D110 PolarHBondContact NE-OD1 2.98Å; R90-D110 VanDerWaalsContact NE-OD1 3.09Å; R90-D110 IonicContact NE-OD2 3.87Å; R90-D110 PolarHBondContact NE-OD2 2.83Å; R90-D110 VanDerWaalsContact NH2-CG 3.31Å; R90-D110 IonicContact NH2-OD1 2.74Å; R90-D110 PolarHBondContact NH2-OD1 3.24Å; R90-D110 IonicContact NH2-OD2 3.64Å; R90-D110 PolarHBondContact NH2-OD2 3.36Å; F91-D110 HydrophobicContact CD1-CB 4.31Å; F91-D110 VanDerWaalsContact CE1-OD1 3.28Å; F91-D110 WeakPolarHBondContact CE1-OD1 3.16Å
111	S	96.2	Very high	96.9	Very high	20 Å²	20	36 Å²	36	14%	0.14	19%	0.19	C	C	.	.	T	Hydrogen-bonded Turn	trans	-80.3	-19.7	177.2	53.8	0	0	0	0	113.5	I75 L113	I75-S111 VanDerWaalsContact O-CB 3.22Å; I75-S111 WeakPolarHBondContact O-CB 3.29Å; I75-S111 PolarHBondContact O-OG 2.93Å; S111-L113 PolarHBondContact O-N 3.09Å; S111-L113 VanDerWaalsContact O-N 3.15Å
112	G	95.6	Very high	97.2	Very high	24 Å²	24	33.9 Å²	33.9	25%	0.247	17%	0.172	C	C	.	.			trans	71.5	-5.5	-176.4	0	0	0	0	0	115.2	R107 G108	R107-G112 PolarHBondContact NE-O 3.07Å; G108-G112 WeakPolarHBondContact O-CA 3.48Å; G108-G112 PolarHBondContact O-N 2.82Å
113	L	98.3	Very high	97.5	Very high	13 Å²	13	33.1 Å²	33.1	7%	0.068	16%	0.159	C	C	.	.	P	Polyproline II helix	trans	-83.6	149	-172.4	-55.8	-178.2	0	0	0	112.5	I75 F76 R107 G108 S111 S126 K127	I75-L113 HydrophobicContact CG2-CB 3.97Å; F76-L113 WeakPolarHBondContact O-CD1 3.32Å; R107-L113 CarbonylContact C-O 3.52Å; R107-L113 VanDerWaalsContact CA-O 3.29Å; R107-L113 WeakPolarHBondContact CA-O 3.46Å; R107-L113 WeakPolarHBondContact CG-O 3.29Å; G108-L113 PolarHBondContact N-O 3.49Å; S111-L113 PolarHBondContact O-N 3.09Å; S111-L113 VanDerWaalsContact O-N 3.15Å; L113-S126 CarbonylContact C-O 3.53Å; L113-S126 VanDerWaalsContact CA-O 3.28Å; L113-S126 WeakPolarHBondContact CA-O 3.33Å; L113-S126 WeakPolarHBondContact CB-O 3.43Å; L113-K127 HydrophobicContact CD2-CB 4.36Å; L113-K127 HydrophobicContact CD2-CG 3.65Å
114	Y	98.6	Very high	97.6	Very high	13 Å²	13	35.5 Å²	35.5	5%	0.051	17%	0.168	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-86.5	139.4	172	-55.4	-82.4	0	0	0	110.3	L45 I97 I106 R107 G116 G125 S126 L129	L45-Y114 VanDerWaalsContact CD1-OH 3.3Å; L45-Y114 WeakPolarHBondContact CD1-OH 3.36Å; I97-Y114 HydrophobicContact CD1-CD1 4.44Å; I97-Y114 HydrophobicContact CD1-CE1 3.79Å; I106-Y114 CarbonylContact O-C 3.5Å; I106-Y114 WeakPolarHBondContact O-CA 3.44Å; R107-Y114 HydrophobicContact CB-CD1 3.86Å; R107-Y114 HydrophobicContact CB-CE1 3.88Å; R107-Y114 HydrophobicContact CG-CD1 3.98Å; R107-Y114 HydrophobicContact CG-CE1 3.73Å; R107-Y114 PolarHBondContact NE-OH 3.41Å; Y114-G116 PolarHBondContact O-N 2.91Å; Y114-G125 CarbonylContact O-C 3.51Å; Y114-G125 WeakPolarHBondContact O-CA 3.35Å; Y114-S126 PolarHBondContact N-O 3.21Å; Y114-S126 PolarHBondContact O-N 3.25Å; Y114-L129 HydrophobicContact CD1-CD1 3.77Å; Y114-L129 HydrophobicContact CD2-CB 4.43Å; Y114-L129 HydrophobicContact CE1-CD1 4.18Å; Y114-L129 HydrophobicContact CE2-CB 4.4Å; Y114-L129 HydrophobicContact CG-CD1 4.16Å
115	L	98.8	Very high	97.7	Very high	0 Å²	0	35.6 Å²	35.6	0%	0	17%	0.171	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-61.5	126.1	164.7	-175.6	62.7	0	0	0	108.2	L73 I75 V81 I106 L123 C133 F135 V163	L73-L115 HydrophobicContact CD2-CD1 4.45Å; L73-L115 HydrophobicContact CD2-CD2 4.28Å; I75-L115 HydrophobicContact CD1-CB 3.84Å; I75-L115 HydrophobicContact CD1-CD1 4.5Å; V81-L115 HydrophobicContact CG1-CD1 4.03Å; V81-L115 HydrophobicContact CG2-CD1 3.79Å; I106-L115 HydrophobicContact CB-CB 4.2Å; I106-L115 HydrophobicContact CD1-CD2 4.22Å; I106-L115 PolarHBondContact O-N 2.83Å; L115-L123 HydrophobicContact CD1-CB 4.41Å; L115-L123 HydrophobicContact CD1-CD2 4.4Å; L115-C133 WeakPolarHBondContact O-CA 3.39Å; L115-C133 VanDerWaalsContact O-CB 3.32Å; L115-C133 WeakPolarHBondContact O-CB 3.37Å; L115-C133 PolarHBondContact O-SG 2.87Å; L115-F135 HydrophobicContact CB-CE2 4.07Å; L115-F135 HydrophobicContact CB-CZ 4.5Å; L115-F135 HydrophobicContact CD2-CE2 3.99Å; L115-F135 HydrophobicContact CD2-CZ 4.08Å; L115-F135 HydrophobicContact CG-CE2 3.9Å; L115-F135 HydrophobicContact CG-CZ 3.89Å; L115-F135 WeakPolarHBondContact O-CE2 3.4Å; L115-V163 HydrophobicContact CD2-CG1 4.18Å; L115-V163 HydrophobicContact CD2-CG2 4.14Å
116	G	98.7	Very high	97.7	Very high	0 Å²	0	36.1 Å²	36.1	0%	0	18%	0.175	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-120.7	155.2	170.9	0	0	0	0	0	110.9	Y114 L123 Y124 E132	Y114-G116 PolarHBondContact O-N 2.91Å; G116-L123 WeakPolarHBondContact O-CA 3.21Å; G116-Y124 PolarHBondContact N-O 2.99Å; G116-Y124 PolarHBondContact O-N 3.39Å; G116-E132 WeakPolarHBondContact CA-O 3.36Å
117	M	98.8	Very high	97.7	Very high	0 Å²	0	44.9 Å²	44.9	0%	0	21%	0.213	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-128.8	121.5	167.1	-178.2	-171.2	-70.7	0	0	109.4	E122 L123 E132 F135 Y152 Y161 Y162 V163	M117-E122 WeakPolarHBondContact CA-O 3.37Å; M117-L123 HydrophobicContact CB-CD2 4.1Å; M117-L123 HydrophobicContact CE-CD2 3.7Å; M117-L123 HydrophobicContact CG-CD2 4.31Å; M117-E132 PolarHBondContact N-O 3.35Å; M117-E132 WeakPolarHBondContact O-CB 3.38Å; M117-F135 HydrophobicContact CB-CE1 3.97Å; M117-F135 HydrophobicContact CB-CZ 4.26Å; M117-Y152 WeakPolarHBondContact O-CE2 3.46Å; M117-Y161 VanDerWaalsContact SD-CB 3.56Å; M117-Y161 HydrophobicContact SD-CD2 4.22Å; M117-Y161 HydrophobicContact SD-CG 4.45Å; M117-Y162 VanDerWaalsContact CE-C 3.46Å; M117-Y162 WeakPolarHBondContact CE-O 3.48Å; M117-V163 HydrophobicContact CE-CG2 4.19Å
118	N	98.4	Very high	97.6	Very high	36 Å²	36	48 Å²	48	19%	0.193	23%	0.228	C	C	.	.			trans	-82.9	178.1	-179.6	75.2	9.3	0	0	0	113.1	R120 G121 E122 Y124 E132 Y152	N118-R120 PolarHBondContact O-N 2.79Å; N118-R120 WeakPolarHBondContact OD1-CA 3.48Å; N118-R120 WeakPolarHBondContact OD1-CB 3.28Å; N118-R120 PolarHBondContact OD1-N 3.5Å; N118-G121 WeakPolarHBondContact O-CA 3.22Å; N118-G121 PolarHBondContact O-N 2.9Å; N118-G121 PolarHBondContact OD1-N 3.39Å; N118-E122 PolarHBondContact N-O 3.34Å; N118-E122 VanDerWaalsContact N-O 3.13Å; N118-E122 PolarHBondContact ND2-OE2 2.79Å; N118-E122 WeakPolarHBondContact OD1-CB 3.18Å; N118-E122 PolarHBondContact OD1-N 3.27Å; N118-Y124 HydrophobicContact CB-CD1 4.48Å; N118-Y124 HydrophobicContact CB-CE1 4.22Å; N118-E132 WeakPolarHBondContact CA-OE1 3.28Å; N118-Y152 WeakPolarHBondContact O-CD2 3.25Å
119	E	97.7	Very high	97.6	Very high	141 Å²	141	48.2 Å²	48.2	66%	0.659	23%	0.229	S	C	*	.	T	Hydrogen-bonded Turn	trans	-57.9	-27.1	179.1	-174.5	171.8	-140.8	0	0	114.4	G121 Y152 Y161	E119-G121 PolarHBondContact O-N 2.83Å; E119-Y152 HydrophobicContact CB-CD1 4.15Å; E119-Y152 HydrophobicContact CB-CE1 3.58Å; E119-Y152 HydrophobicContact CB-CE2 4.37Å; E119-Y152 HydrophobicContact CG-CD1 4.16Å; E119-Y152 HydrophobicContact CG-CE1 3.79Å; E119-Y152 VanDerWaalsContact N-CE2 3.31Å; E119-Y161 WeakPolarHBondContact O-CE2 3.26Å
120	R	97.7	Very high	97.7	Very high	169 Å²	169	48.9 Å²	48.9	64%	0.638	23%	0.234	S	C	*	.	T	Hydrogen-bonded Turn	trans	-79.9	-2.6	174.3	-58.8	175.8	177.8	-174.4	0	112.7	N118 E122 Y175	N118-R120 PolarHBondContact O-N 2.79Å; N118-R120 WeakPolarHBondContact OD1-CA 3.48Å; N118-R120 WeakPolarHBondContact OD1-CB 3.28Å; N118-R120 PolarHBondContact OD1-N 3.5Å; R120-E122 VanDerWaalsContact C-N 3.25Å; R120-E122 HydrophobicContact CB-CG 3.86Å; R120-E122 WeakPolarHBondContact CD-OE1 3.32Å; R120-E122 WeakPolarHBondContact CD-OE2 3.26Å; R120-E122 IonicContact NH1-OE1 3.09Å; R120-E122 PolarHBondContact O-N 3.21Å; R120-Y175 VanDerWaalsContact O-CD1 3.23Å; R120-Y175 WeakPolarHBondContact O-CD1 3.39Å
121	G	98.3	Very high	97.8	Very high	0 Å²	0	52.3 Å²	52.3	0%	0	24%	0.242	C	C	.	.			trans	73.8	12.1	-172.4	0	0	0	0	0	113.8	N118 E119 E173 G174	N118-G121 WeakPolarHBondContact O-CA 3.22Å; N118-G121 PolarHBondContact O-N 2.9Å; N118-G121 PolarHBondContact OD1-N 3.39Å; E119-G121 PolarHBondContact O-N 2.83Å; G121-E173 CarbonylContact O-C 3.56Å; G121-E173 WeakPolarHBondContact O-CA 3.11Å; G121-G174 PolarHBondContact O-N 3.42Å
122	E	98.7	Very high	97.9	Very high	83 Å²	83	53.4 Å²	53.4	39%	0.388	25%	0.245	S	C	.	.			trans	-76.3	133.8	179.6	-59.5	159.7	162.6	0	0	109.4	M117 N118 R120	M117-E122 WeakPolarHBondContact CA-O 3.37Å; N118-E122 PolarHBondContact N-O 3.34Å; N118-E122 VanDerWaalsContact N-O 3.13Å; N118-E122 PolarHBondContact ND2-OE2 2.79Å; N118-E122 WeakPolarHBondContact OD1-CB 3.18Å; N118-E122 PolarHBondContact OD1-N 3.27Å; R120-E122 VanDerWaalsContact C-N 3.25Å; R120-E122 HydrophobicContact CB-CG 3.86Å; R120-E122 WeakPolarHBondContact CD-OE1 3.32Å; R120-E122 WeakPolarHBondContact CD-OE2 3.26Å; R120-E122 IonicContact NH1-OE1 3.09Å; R120-E122 PolarHBondContact O-N 3.21Å
123	L	98.9	Very high	98.1	Very high	18 Å²	18	52.3 Å²	52.3	9%	0.094	23%	0.234	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-86.8	132.8	178.4	-63	177.8	0	0	0	110.8	V81 L115 G116 M117 V163 P171	V81-L123 HydrophobicContact CB-CB 4.09Å; V81-L123 HydrophobicContact CG1-CB 4.1Å; V81-L123 HydrophobicContact CG1-CD1 4.32Å; V81-L123 HydrophobicContact CG2-CB 4.35Å; L115-L123 HydrophobicContact CD1-CB 4.41Å; L115-L123 HydrophobicContact CD1-CD2 4.4Å; G116-L123 WeakPolarHBondContact O-CA 3.21Å; M117-L123 HydrophobicContact CB-CD2 4.1Å; M117-L123 HydrophobicContact CE-CD2 3.7Å; M117-L123 HydrophobicContact CG-CD2 4.31Å; L123-V163 HydrophobicContact CD1-CG1 3.88Å; L123-V163 HydrophobicContact CD2-CB 4.45Å; L123-V163 HydrophobicContact CD2-CG1 4.28Å; L123-V163 HydrophobicContact CD2-CG2 4.11Å; L123-P171 HydrophobicContact CB-CB 4.46Å; L123-P171 HydrophobicContact CD1-CB 4.34Å
124	Y	98.8	Very high	98	Very high	64 Å²	64	51.9 Å²	51.9	25%	0.251	23%	0.232	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-146.3	165.7	-178.4	77.3	-86.6	0	0	0	112.8	G116 N118 E132	G116-Y124 PolarHBondContact N-O 2.99Å; G116-Y124 PolarHBondContact O-N 3.39Å; N118-Y124 HydrophobicContact CB-CD1 4.48Å; N118-Y124 HydrophobicContact CB-CE1 4.22Å; Y124-E132 WeakPolarHBondContact CE1-OE2 3.13Å; Y124-E132 VanDerWaalsContact CZ-OE2 3.32Å; Y124-E132 PolarHBondContact OH-OE2 2.79Å
125	G	98.7	Very high	98	Very high	10 Å²	10	51.3 Å²	51.3	10%	0.103	23%	0.229	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-96.2	109.2	172.3	0	0	0	0	0	112.1	G79 Y114	G79-G125 PolarHBondContact O-N 3.25Å; Y114-G125 CarbonylContact O-C 3.51Å; Y114-G125 WeakPolarHBondContact O-CA 3.35Å
126	S	98.5	Very high	98	Very high	11 Å²	11	55.5 Å²	55.5	8%	0.077	25%	0.245	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-85.9	141.5	176.7	179.5	0	0	0	0	112.7	L113 Y114 K128 C133	L113-S126 CarbonylContact C-O 3.53Å; L113-S126 VanDerWaalsContact CA-O 3.28Å; L113-S126 WeakPolarHBondContact CA-O 3.33Å; L113-S126 WeakPolarHBondContact CB-O 3.43Å; Y114-S126 PolarHBondContact N-O 3.21Å; Y114-S126 PolarHBondContact O-N 3.25Å; S126-K128 VanDerWaalsContact C-N 3.32Å; S126-K128 WeakPolarHBondContact CB-O 3.47Å; S126-K128 PolarHBondContact OG-N 3.48Å; S126-K128 VanDerWaalsContact OG-N 3.09Å; S126-K128 PolarHBondContact OG-O 2.99Å; S126-C133 WeakPolarHBondContact CB-SG 3.48Å
127	K	97.6	Very high	97.9	Very high	183 Å²	183	57.9 Å²	57.9	80%	0.796	26%	0.256	S	S	*	.	S	Bend	trans	-78.1	-12.6	171.2	-67	-179	179.5	-179.9	0	114	L113	L113-K127 HydrophobicContact CD2-CB 4.36Å; L113-K127 HydrophobicContact CD2-CG 3.65Å
128	K	96.4	Very high	97.8	Very high	132 Å²	132	60.9 Å²	60.9	57%	0.574	27%	0.27	S	S	*	.	S	Bend	trans	-131.5	156.1	-176.8	-71.4	-167.7	178.1	-171.6	0	111.5	E42 S126 T130	E42-K128 WeakPolarHBondContact OE1-CB 3.27Å; S126-K128 VanDerWaalsContact C-N 3.32Å; S126-K128 WeakPolarHBondContact CB-O 3.47Å; S126-K128 PolarHBondContact OG-N 3.48Å; S126-K128 VanDerWaalsContact OG-N 3.09Å; S126-K128 PolarHBondContact OG-O 2.99Å; K128-T130 VanDerWaalsContact C-N 3.31Å; K128-T130 HydrophobicContact CB-CG2 4.16Å; K128-T130 PolarHBondContact O-N 3.03Å
129	L	96.2	Very high	97.6	Very high	5 Å²	5	66.4 Å²	66.4	3%	0.026	29%	0.293	C	S	.	.			trans	-87.6	74.2	-180	-176.5	63.8	0	0	0	109.6	L38 I41 E42 L99 S105 Y114 C133	L38-L129 HydrophobicContact CD2-CD1 4.45Å; L38-L129 HydrophobicContact CD2-CD2 3.93Å; L38-L129 HydrophobicContact CD2-CG 3.72Å; I41-L129 HydrophobicContact CB-CD2 4.08Å; I41-L129 HydrophobicContact CG2-CD2 3.42Å; I41-L129 VanDerWaalsContact CG2-CD2 3.42Å; E42-L129 HydrophobicContact CG-CB 3.85Å; E42-L129 PolarHBondContact OE1-N 3.33Å; L99-L129 HydrophobicContact CD2-CD2 4.36Å; S105-L129 VanDerWaalsContact OG-CD1 3.25Å; S105-L129 WeakPolarHBondContact OG-CD1 3.42Å; Y114-L129 HydrophobicContact CD1-CD1 3.77Å; Y114-L129 HydrophobicContact CD2-CB 4.43Å; Y114-L129 HydrophobicContact CE1-CD1 4.18Å; Y114-L129 HydrophobicContact CE2-CB 4.4Å; Y114-L129 HydrophobicContact CG-CD1 4.16Å; L129-C133 HydrophobicContact CD1-CB 4.11Å
130	T	96.3	Very high	97.2	Very high	50 Å²	50	61.4 Å²	61.4	31%	0.307	27%	0.269	S	S	.	.			trans	-80.8	172.4	-179.5	72.1	0	0	0	0	111.4	K128 E132 C133	K128-T130 VanDerWaalsContact C-N 3.31Å; K128-T130 HydrophobicContact CB-CG2 4.16Å; K128-T130 PolarHBondContact O-N 3.03Å; T130-E132 PolarHBondContact O-N 3.42Å; T130-E132 PolarHBondContact OG1-N 3.05Å; T130-C133 WeakPolarHBondContact O-CB 3.49Å; T130-C133 PolarHBondContact O-N 3.23Å
131	R	97	Very high	96.6	Very high	127 Å²	127	59.5 Å²	59.5	48%	0.479	27%	0.268	S	S	.	.	G	3₁₀ helix	trans	-63.9	-23.4	173.1	-68.2	-178.4	64.8	-146.7	-1.9	113.4	L38 C133 V134 L151	L38-R131 HydrophobicContact CD1-CG 4Å; R131-C133 PolarHBondContact O-N 3.29Å; R131-V134 PolarHBondContact O-N 2.9Å; R131-L151 HydrophobicContact CB-CD2 4.35Å
132	E	98.3	Very high	96	Very high	43 Å²	43	64.3 Å²	64.3	20%	0.201	29%	0.294	C	S	.	.	G	3₁₀ helix	trans	-70.2	-17.9	172.5	-62.1	-169	140.8	0	0	112.8	G116 M117 N118 Y124 T130 V134 L151 Y152	G116-E132 WeakPolarHBondContact CA-O 3.36Å; M117-E132 PolarHBondContact N-O 3.35Å; M117-E132 WeakPolarHBondContact O-CB 3.38Å; N118-E132 WeakPolarHBondContact CA-OE1 3.28Å; Y124-E132 WeakPolarHBondContact CE1-OE2 3.13Å; Y124-E132 VanDerWaalsContact CZ-OE2 3.32Å; Y124-E132 PolarHBondContact OH-OE2 2.79Å; T130-E132 PolarHBondContact O-N 3.42Å; T130-E132 PolarHBondContact OG1-N 3.05Å; E132-V134 VanDerWaalsContact C-N 3.33Å; E132-L151 HydrophobicContact CG-CD2 4.14Å; E132-Y152 HydrophobicContact CG-CE2 4.06Å; E132-Y152 PolarHBondContact OE1-OH 3Å
133	C	98.5	Very high	95.5	Very high	0 Å²	0	70.4 Å²	70.4	0%	0	31%	0.313	C	S	.	.	G	3₁₀ helix	trans	-92.5	12.8	178.1	-58.7	0	0	0	0	113.6	S105 L115 S126 L129 T130 R131	S105-C133 WeakPolarHBondContact CA-O 3.45Å; S105-C133 WeakPolarHBondContact CB-O 3.37Å; S105-C133 PolarHBondContact OG-O 2.69Å; L115-C133 WeakPolarHBondContact O-CA 3.39Å; L115-C133 VanDerWaalsContact O-CB 3.32Å; L115-C133 WeakPolarHBondContact O-CB 3.37Å; L115-C133 PolarHBondContact O-SG 2.87Å; S126-C133 WeakPolarHBondContact CB-SG 3.48Å; L129-C133 HydrophobicContact CD1-CB 4.11Å; T130-C133 WeakPolarHBondContact O-CB 3.49Å; T130-C133 PolarHBondContact O-N 3.23Å; R131-C133 PolarHBondContact O-N 3.29Å
134	V	98.2	Very high	95.3	Very high	5 Å²	5	71.1 Å²	71.1	3%	0.03	32%	0.315	C	S	.	.			trans	-111.6	114.7	-176.9	-175.5	0	0	0	0	110.3	L38 L99 R131 E132 T150	L38-V134 HydrophobicContact CD1-CG2 4.32Å; L38-V134 HydrophobicContact CD2-CG2 3.88Å; L99-V134 HydrophobicContact CD1-CB 4.21Å; L99-V134 HydrophobicContact CD1-CG1 3.89Å; L99-V134 HydrophobicContact CD1-CG2 3.65Å; R131-V134 PolarHBondContact O-N 2.9Å; E132-V134 VanDerWaalsContact C-N 3.33Å; V134-T150 WeakPolarHBondContact CB-OG1 3.32Å; V134-T150 HydrophobicContact CG1-CG2 3.91Å; V134-T150 WeakPolarHBondContact O-CG2 3.42Å; V134-T150 PolarHBondContact O-N 2.86Å; V134-T150 PolarHBondContact O-OG1 2.99Å
135	F	98.6	Very high	95.3	Very high	0 Å²	0	68.5 Å²	68.5	0%	0	31%	0.305	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-112.2	140.7	-179	-57.2	-81.1	0	0	0	111.6	L103 I104 L115 M117 A148 V163	L103-F135 WeakPolarHBondContact CA-O 3.3Å; I104-F135 HydrophobicContact CG1-CB 4.49Å; I104-F135 PolarHBondContact N-O 2.92Å; I104-F135 PolarHBondContact O-N 2.77Å; L115-F135 HydrophobicContact CB-CE2 4.07Å; L115-F135 HydrophobicContact CB-CZ 4.5Å; L115-F135 HydrophobicContact CD2-CE2 3.99Å; L115-F135 HydrophobicContact CD2-CZ 4.08Å; L115-F135 HydrophobicContact CG-CE2 3.9Å; L115-F135 HydrophobicContact CG-CZ 3.89Å; L115-F135 WeakPolarHBondContact O-CE2 3.4Å; M117-F135 HydrophobicContact CB-CE1 3.97Å; M117-F135 HydrophobicContact CB-CZ 4.26Å; F135-A148 CarbonylContact C-O 3.55Å; F135-A148 WeakPolarHBondContact CA-O 3.49Å; F135-V163 HydrophobicContact CD1-CG2 3.74Å; F135-V163 HydrophobicContact CE1-CG2 3.53Å; F135-V163 HydrophobicContact CG-CG2 4.48Å; F135-V163 HydrophobicContact CZ-CG2 4.12Å
136	R	98	Very high	95.2	Very high	88 Å²	88	68 Å²	68	33%	0.332	30%	0.3	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-82.8	112.4	165.8	-170.2	173.5	-68.8	-133.5	1.4	108	D29 G102 L103 Q138 A148 T150	D29-R136 IonicContact OD1-NH2 3.83Å; D29-R136 PolarHBondContact OD1-NH2 2.87Å; G102-R136 CarbonylContact O-C 3.46Å; G102-R136 WeakPolarHBondContact O-CA 3.3Å; L103-R136 HydrophobicContact CD2-CB 3.72Å; L103-R136 HydrophobicContact CD2-CG 3.88Å; R136-Q138 HydrophobicContact CG-CG 4.44Å; R136-A148 HydrophobicContact CB-CB 4.45Å; R136-A148 PolarHBondContact N-O 3.38Å; R136-A148 PolarHBondContact O-N 2.98Å; R136-T150 HydrophobicContact CB-CG2 4.22Å
137	E	97.4	Very high	95.3	Very high	51 Å²	51	67.5 Å²	67.5	24%	0.238	30%	0.297	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-81.9	130.3	172.8	177.6	166.3	-125.7	0	0	109.2	G102 I104 N145 T146 Y147	G102-E137 PolarHBondContact O-N 2.98Å; I104-E137 HydrophobicContact CG1-CB 4.45Å; I104-E137 HydrophobicContact CG2-CB 4.48Å; E137-N145 HydrophobicContact CG-CB 4.28Å; E137-N145 PolarHBondContact OE1-ND2 3.2Å; E137-T146 WeakPolarHBondContact CA-O 3.32Å; E137-Y147 HydrophobicContact CB-CD1 4.03Å; E137-Y147 HydrophobicContact CB-CE1 3.73Å; E137-Y147 HydrophobicContact CG-CD1 4.27Å; E137-Y147 HydrophobicContact CG-CE1 3.54Å; E137-Y147 WeakPolarHBondContact OE1-CE1 3.46Å; E137-Y147 VanDerWaalsContact OE1-CZ 3.27Å; E137-Y147 PolarHBondContact OE1-OH 2.94Å
138	Q	96.4	Very high	95.3	Very high	62 Å²	62	58.8 Å²	58.8	29%	0.29	26%	0.259	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-135.4	137.4	172.3	-63.7	-169.9	-17.8	0	0	111	R136 N145 T146 R179	R136-Q138 HydrophobicContact CG-CG 4.44Å; Q138-N145 CarbonylContact O-C 3.5Å; Q138-N145 VanDerWaalsContact O-CA 3.24Å; Q138-N145 WeakPolarHBondContact O-CA 3.38Å; Q138-T146 PolarHBondContact N-O 2.88Å; Q138-T146 PolarHBondContact O-N 3.49Å; Q138-T146 PolarHBondContact O-OG1 2.54Å; Q138-R179 VanDerWaalsContact OE1-NH2 3.08Å
139	F	93.5	Very high	95.4	Very high	152 Å²	152	52.8 Å²	52.8	67%	0.667	23%	0.233	S	C	*	.	E	Extended strand (participates in β ladder)	trans	-63.4	143.6	169.7	-71.2	-74.3	0	0	0	111.9	N145 R179	F139-N145 WeakPolarHBondContact CD1-OD1 3.23Å; F139-R179 PolarHBondContact O-NH2 2.76Å
140	E	89.4	Confident	95.4	Very high	36 Å²	36	54.9 Å²	54.9	17%	0.168	25%	0.247	C	C	.	.			trans	-133.5	167.9	174.5	-167.7	63.7	-64.1	0	0	108.9	Y144 T146 R179	E140-Y144 CarbonylContact C-O 3.45Å; E140-Y144 WeakPolarHBondContact CA-O 3.14Å; E140-Y144 WeakPolarHBondContact CB-O 3.47Å; E140-Y144 PolarHBondContact N-O 2.81Å; E140-Y144 VanDerWaalsContact O-O 3.05Å; E140-T146 HydrophobicContact CB-CG2 4.24Å; E140-T146 HydrophobicContact CG-CG2 4.35Å; E140-R179 IonicContact OE1-CZ 2.98Å; E140-R179 IonicContact OE1-NH1 3.27Å; E140-R179 PolarHBondContact OE1-NH1 2.78Å; E140-R179 IonicContact OE2-CZ 3.3Å; E140-R179 IonicContact OE2-NH1 2.74Å; E140-R179 PolarHBondContact OE2-NH1 2.99Å
141	E	84.3	Confident	95.5	Very high	129 Å²	129	55.2 Å²	55.2	60%	0.603	25%	0.246	S	C	*	.	G	3₁₀ helix	trans	-53.7	142.8	-176.9	-54.9	178.3	167.8	0	0	114.1	R68	R68-E141 PolarHBondContact NH1-O 3.45Å
142	N	86.2	Confident	95.5	Very high	102 Å²	102	51.2 Å²	51.2	55%	0.545	23%	0.232	S	C	.	.	G	3₁₀ helix	trans	67.1	38.3	175.2	-45	-97.7	0	0	0	114.1	R68 Y144	R68-N142 PolarHBondContact NH2-ND2 2.69Å; N142-Y144 HydrophobicContact CB-CD2 4.2Å; N142-Y144 HydrophobicContact CB-CE2 4.44Å; N142-Y144 VanDerWaalsContact O-CD2 3.27Å; N142-Y144 WeakPolarHBondContact O-CD2 3.39Å; N142-Y144 PolarHBondContact O-N 2.92Å
143	W	87.5	Confident	95.4	Very high	210 Å²	210	53.9 Å²	53.9	80%	0.795	24%	0.242	S	C	*	.	G	3₁₀ helix	trans	64	15.5	178.7	-50.9	98.9	0	0	0	115.6	L187	W143-L187 HydrophobicContact CB-CD1 4.22Å; W143-L187 WeakPolarHBondContact O-CD1 3.45Å
144	Y	96.3	Very high	95.3	Very high	34 Å²	34	55.3 Å²	55.3	13%	0.133	25%	0.249	C	C	.	.			trans	-81.6	148.5	167.5	-72.2	-95.4	0	0	0	109.4	Y66 R68 E140 N142 H185 F186 L187	Y66-Y144 HydrophobicContact CD1-CE1 4.45Å; R68-Y144 HydrophobicContact CB-CD1 4.02Å; R68-Y144 HydrophobicContact CB-CE1 3.52Å; R68-Y144 HydrophobicContact CG-CD1 4.28Å; R68-Y144 HydrophobicContact CG-CE1 3.63Å; R68-Y144 HydrophobicContact CG-CE2 4.24Å; E140-Y144 CarbonylContact C-O 3.45Å; E140-Y144 WeakPolarHBondContact CA-O 3.14Å; E140-Y144 WeakPolarHBondContact CB-O 3.47Å; E140-Y144 PolarHBondContact N-O 2.81Å; E140-Y144 VanDerWaalsContact O-O 3.05Å; N142-Y144 HydrophobicContact CB-CD2 4.2Å; N142-Y144 HydrophobicContact CB-CE2 4.44Å; N142-Y144 VanDerWaalsContact O-CD2 3.27Å; N142-Y144 WeakPolarHBondContact O-CD2 3.39Å; N142-Y144 PolarHBondContact O-N 2.92Å; Y144-H185 HydrophobicContact CD1-CB 3.78Å; Y144-H185 HydrophobicContact CG-CB 4.01Å; Y144-F186 CarbonylContact C-O 3.49Å; Y144-F186 WeakPolarHBondContact CA-O 3.07Å; Y144-L187 HydrophobicContact CD1-CB 4.01Å; Y144-L187 HydrophobicContact CE1-CB 3.83Å
145	N	97.5	Very high	95.1	Very high	8 Å²	8	60.9 Å²	60.9	4%	0.043	29%	0.288	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-111	157.1	169	-68.9	-3.2	0	0	0	109.7	E137 Q138 F139 Y147 F186	E137-N145 HydrophobicContact CG-CB 4.28Å; E137-N145 PolarHBondContact OE1-ND2 3.2Å; Q138-N145 CarbonylContact O-C 3.5Å; Q138-N145 VanDerWaalsContact O-CA 3.24Å; Q138-N145 WeakPolarHBondContact O-CA 3.38Å; F139-N145 WeakPolarHBondContact CD1-OD1 3.23Å; N145-Y147 HydrophobicContact CB-CE1 4.49Å; N145-Y147 HydrophobicContact CB-CE2 4.01Å; N145-F186 PolarHBondContact N-O 2.8Å; N145-F186 PolarHBondContact O-N 2.59Å
146	T	98.2	Very high	94.8	Very high	0 Å²	0	66.9 Å²	66.9	0%	0	32%	0.32	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-113	145.4	167.2	56.8	0	0	0	0	109.1	E137 Q138 E140 R179	E137-T146 WeakPolarHBondContact CA-O 3.32Å; Q138-T146 PolarHBondContact N-O 2.88Å; Q138-T146 PolarHBondContact O-N 3.49Å; Q138-T146 PolarHBondContact O-OG1 2.54Å; E140-T146 HydrophobicContact CB-CG2 4.24Å; E140-T146 HydrophobicContact CG-CG2 4.35Å; T146-R179 HydrophobicContact CG2-CG 4.12Å
147	Y	98.6	Very high	94.6	Very high	0 Å²	0	65.3 Å²	65.3	0%	0	32%	0.323	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-122.2	102	-177.8	-62.8	-73.9	0	0	0	109.6	L65 F96 I104 I106 E137 N145 Y162 V163 F186 P188	L65-Y147 HydrophobicContact CD1-CE2 3.9Å; L65-Y147 HydrophobicContact CD2-CD2 4.36Å; L65-Y147 HydrophobicContact CD2-CE2 4.05Å; L65-Y147 HydrophobicContact CG-CE2 4.46Å; F96-Y147 HydrophobicContact CE1-CE1 4.29Å; I104-Y147 HydrophobicContact CD1-CD1 3.82Å; I104-Y147 HydrophobicContact CD1-CE1 3.42Å; I104-Y147 VanDerWaalsContact CD1-CE1 3.42Å; I104-Y147 HydrophobicContact CG1-CD1 4.36Å; I104-Y147 HydrophobicContact CG1-CE1 4.32Å; I106-Y147 HydrophobicContact CD1-CD1 4.48Å; E137-Y147 HydrophobicContact CB-CD1 4.03Å; E137-Y147 HydrophobicContact CB-CE1 3.73Å; E137-Y147 HydrophobicContact CG-CD1 4.27Å; E137-Y147 HydrophobicContact CG-CE1 3.54Å; E137-Y147 WeakPolarHBondContact OE1-CE1 3.46Å; E137-Y147 VanDerWaalsContact OE1-CZ 3.27Å; E137-Y147 PolarHBondContact OE1-OH 2.94Å; N145-Y147 HydrophobicContact CB-CE1 4.49Å; N145-Y147 HydrophobicContact CB-CE2 4.01Å; Y147-Y162 WeakPolarHBondContact O-CA 3.45Å; Y147-V163 PolarHBondContact O-N 3.04Å; Y147-F186 HydrophobicContact CD2-CB 4.33Å; Y147-F186 HydrophobicContact CD2-CD2 4.3Å; Y147-F186 HydrophobicContact CE2-CB 3.95Å; Y147-P188 WeakPolarHBondContact OH-CG 3.33Å
148	A	98.5	Very high	94.2	Very high	1 Å²	1	68.6 Å²	68.6	1%	0.008	34%	0.338	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-94.1	140.9	-179.7	0	0	0	0	0	111.2	F135 R136 T150 Q160 Y161 Y162	F135-A148 CarbonylContact C-O 3.55Å; F135-A148 WeakPolarHBondContact CA-O 3.49Å; R136-A148 HydrophobicContact CB-CB 4.45Å; R136-A148 PolarHBondContact N-O 3.38Å; R136-A148 PolarHBondContact O-N 2.98Å; A148-T150 PolarHBondContact O-N 2.93Å; A148-Q160 HydrophobicContact CB-CB 3.87Å; A148-Q160 HydrophobicContact CB-CG 4.27Å; A148-Q160 VanDerWaalsContact CB-OE1 3.26Å; A148-Y161 CarbonylContact C-O 3.54Å; A148-Y161 WeakPolarHBondContact CA-O 3.36Å; A148-Y162 HydrophobicContact CB-CD1 4.12Å; A148-Y162 HydrophobicContact CB-CE1 3.93Å
149	S	98.3	Very high	94.1	Very high	5 Å²	5	69.6 Å²	69.6	4%	0.035	34%	0.339	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-60.5	136	168.2	179.1	0	0	0	0	110.4	L151 Y152 Y161	S149-L151 VanDerWaalsContact C-N 3.28Å; S149-L151 PolarHBondContact OG-N 3.2Å; S149-L151 VanDerWaalsContact OG-N 3.14Å; S149-Y152 PolarHBondContact OG-N 2.94Å; S149-Y152 VanDerWaalsContact OG-N 3.09Å; S149-Y161 PolarHBondContact N-O 2.95Å
150	T	97.3	Very high	94.3	Very high	50 Å²	50	64.9 Å²	64.9	31%	0.307	32%	0.319	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-80.9	-8.8	171.2	56.6	0	0	0	0	113.6	L103 V134 R136 A148	L103-T150 HydrophobicContact CD2-CG2 3.68Å; V134-T150 WeakPolarHBondContact CB-OG1 3.32Å; V134-T150 HydrophobicContact CG1-CG2 3.91Å; V134-T150 WeakPolarHBondContact O-CG2 3.42Å; V134-T150 PolarHBondContact O-N 2.86Å; V134-T150 PolarHBondContact O-OG1 2.99Å; R136-T150 HydrophobicContact CB-CG2 4.22Å; A148-T150 PolarHBondContact O-N 2.93Å
151	L	97.2	Very high	94.7	Very high	57 Å²	57	64.8 Å²	64.8	30%	0.298	32%	0.318	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-110.6	-32.3	-175.1	-170.2	57.8	0	0	0	112.8	R131 E132 S149	R131-L151 HydrophobicContact CB-CD2 4.35Å; E132-L151 HydrophobicContact CG-CD2 4.14Å; S149-L151 VanDerWaalsContact C-N 3.28Å; S149-L151 PolarHBondContact OG-N 3.2Å; S149-L151 VanDerWaalsContact OG-N 3.14Å
152	Y	97.9	Very high	95.4	Very high	43 Å²	43	59.3 Å²	59.3	17%	0.169	29%	0.292	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-119.7	128.5	-170.7	-57.4	-60	0	0	0	114	M117 N118 E119 E132 S149 Y161	M117-Y152 WeakPolarHBondContact O-CE2 3.46Å; N118-Y152 WeakPolarHBondContact O-CD2 3.25Å; E119-Y152 HydrophobicContact CB-CD1 4.15Å; E119-Y152 HydrophobicContact CB-CE1 3.58Å; E119-Y152 HydrophobicContact CB-CE2 4.37Å; E119-Y152 HydrophobicContact CG-CD1 4.16Å; E119-Y152 HydrophobicContact CG-CE1 3.79Å; E119-Y152 VanDerWaalsContact N-CE2 3.31Å; E132-Y152 HydrophobicContact CG-CE2 4.06Å; E132-Y152 PolarHBondContact OE1-OH 3Å; S149-Y152 PolarHBondContact OG-N 2.94Å; S149-Y152 VanDerWaalsContact OG-N 3.09Å; Y152-Y161 PolarHBondContact O-N 3.19Å; Y152-Y161 VanDerWaalsContact O-N 3.14Å
153	K	96.9	Very high	96	Very high	98 Å²	98	54.5 Å²	54.5	43%	0.426	27%	0.266	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-151.3	159.3	-179.9	51.6	167.8	170.7	162	0	109.2	E158 R159	K153-E158 WeakPolarHBondContact CE-OE1 3.48Å; K153-E158 IonicContact NZ-OE1 3.45Å; K153-E158 PolarHBondContact NZ-OE1 3.1Å; K153-E158 IonicContact NZ-OE2 3.88Å; K153-E158 PolarHBondContact NZ-OE2 2.81Å; K153-R159 CarbonylContact C-O 3.57Å; K153-R159 VanDerWaalsContact CA-O 3.3Å; K153-R159 WeakPolarHBondContact CA-O 3.18Å; K153-R159 WeakPolarHBondContact CB-O 3.32Å
154	H	96.2	Very high	96.6	Very high	30 Å²	30	44.5 Å²	44.5	14%	0.139	23%	0.228	C	C	.	.			trans	-68.5	128.8	170	-67.6	-97.4	0	0	0	110	D156 E158 R159 Y161 Y175	H154-D156 VanDerWaalsContact C-N 3.32Å; H154-D156 VanDerWaalsContact CB-OD1 3.29Å; H154-D156 WeakPolarHBondContact CB-OD1 3.5Å; H154-D156 PolarHBondContact O-N 3.15Å; H154-E158 PolarHBondContact O-N 3.07Å; H154-E158 VanDerWaalsContact O-N 3.16Å; H154-R159 HydrophobicContact CB-CB 4.21Å; H154-R159 PolarHBondContact CD2-NE 2.86Å; H154-R159 PolarHBondContact CD2-NH2 3.22Å; H154-R159 PolarHBondContact CD2-O 3.37Å; H154-R159 VanDerWaalsContact CD2-O 3.28Å; H154-R159 PolarHBondContact CE1-NH2 3.09Å; H154-R159 PolarHBondContact N-O 3.08Å; H154-R159 PolarHBondContact ND1-NH2 3.28Å; H154-R159 PolarHBondContact NE2-NE 2.78Å; H154-R159 PolarHBondContact NE2-NH2 3.37Å; H154-Y161 AromaticContact CD2-CD1 3.78Å; H154-Y161 AromaticContact CD2-CE1 3.47Å; H154-Y161 VanDerWaalsContact CD2-CE1 3.47Å; H154-Y161 WeakPolarHBondContact CD2-CE1 3.21Å; H154-Y161 AromaticContact CG-CE1 3.97Å; H154-Y161 AromaticContact NE2-CD1 3.93Å; H154-Y161 AromaticContact NE2-CE1 3.57Å; H154-Y175 PolarHBondContact CE1-O 2.95Å; H154-Y175 PolarHBondContact NE2-O 2.8Å
155	S	92.2	Very high	96.7	Very high	122 Å²	122	42.9 Å²	42.9	85%	0.853	22%	0.222	S	C	*	.	T	Hydrogen-bonded Turn	trans	-75.6	-15.1	-176.5	49.7	0	0	0	0	114.6
156	D	94	Very high	96.7	Very high	127 Å²	127	43.7 Å²	43.7	68%	0.679	23%	0.226	S	C	*	.	T	Hydrogen-bonded Turn	trans	-86.4	-24	179.8	69.8	-25.6	0	0	0	113.7	H154	H154-D156 VanDerWaalsContact C-N 3.32Å; H154-D156 VanDerWaalsContact CB-OD1 3.29Å; H154-D156 WeakPolarHBondContact CB-OD1 3.5Å; H154-D156 PolarHBondContact O-N 3.15Å
157	S	92.2	Very high	96.7	Very high	55 Å²	55	52.3 Å²	52.3	39%	0.385	26%	0.263	S	S	.	.	T	Hydrogen-bonded Turn	trans	-146.2	7.4	-159.3	58.3	0	0	0	0	114.4	R159	S157-R159 PolarHBondContact O-N 3.03Å
158	E	89.6	Confident	96.7	Very high	120 Å²	120	57.7 Å²	57.7	56%	0.561	29%	0.292	S	S	*	.			trans	54.7	6.9	-174.7	-71.8	-66	104.3	0	0	115.3	K153 H154 Q160	K153-E158 WeakPolarHBondContact CE-OE1 3.48Å; K153-E158 IonicContact NZ-OE1 3.45Å; K153-E158 PolarHBondContact NZ-OE1 3.1Å; K153-E158 IonicContact NZ-OE2 3.88Å; K153-E158 PolarHBondContact NZ-OE2 2.81Å; H154-E158 PolarHBondContact O-N 3.07Å; H154-E158 VanDerWaalsContact O-N 3.16Å; E158-Q160 PolarHBondContact O-N 2.87Å
159	R	95.3	Very high	96.7	Very high	82 Å²	82	57.9 Å²	57.9	31%	0.309	29%	0.294	S	S	.	.			trans	-65.3	111	-176.1	176.6	176.6	60.4	-119.3	-4.3	109.9	K153 H154 S157	K153-R159 CarbonylContact C-O 3.57Å; K153-R159 VanDerWaalsContact CA-O 3.3Å; K153-R159 WeakPolarHBondContact CA-O 3.18Å; K153-R159 WeakPolarHBondContact CB-O 3.32Å; H154-R159 HydrophobicContact CB-CB 4.21Å; H154-R159 PolarHBondContact CD2-NE 2.86Å; H154-R159 PolarHBondContact CD2-NH2 3.22Å; H154-R159 PolarHBondContact CD2-O 3.37Å; H154-R159 VanDerWaalsContact CD2-O 3.28Å; H154-R159 PolarHBondContact CE1-NH2 3.09Å; H154-R159 PolarHBondContact N-O 3.08Å; H154-R159 PolarHBondContact ND1-NH2 3.28Å; H154-R159 PolarHBondContact NE2-NE 2.78Å; H154-R159 PolarHBondContact NE2-NH2 3.37Å; S157-R159 PolarHBondContact O-N 3.03Å
160	Q	97.4	Very high	96.7	Very high	53 Å²	53	59.3 Å²	59.3	25%	0.248	31%	0.305	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-58.9	150.2	174.9	-69.1	166.2	-11	0	0	112.4	A148 E158 Y162	A148-Q160 HydrophobicContact CB-CB 3.87Å; A148-Q160 HydrophobicContact CB-CG 4.27Å; A148-Q160 VanDerWaalsContact CB-OE1 3.26Å; E158-Q160 PolarHBondContact O-N 2.87Å; Q160-Y162 HydrophobicContact CB-CE2 3.92Å; Q160-Y162 VanDerWaalsContact O-CD2 3.26Å; Q160-Y162 WeakPolarHBondContact O-CD2 3.4Å; Q160-Y162 VanDerWaalsContact O-CE2 3.28Å; Q160-Y162 WeakPolarHBondContact O-CE2 3.5Å; Q160-Y162 PolarHBondContact OE1-OH 3.39Å
161	Y	98.4	Very high	96.7	Very high	34 Å²	34	59 Å²	59	13%	0.133	30%	0.304	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-85.2	128.5	168.9	-68.1	7	0	0	0	109.6	M117 E119 A148 S149 Y152 H154 G174 Y175	M117-Y161 VanDerWaalsContact SD-CB 3.56Å; M117-Y161 HydrophobicContact SD-CD2 4.22Å; M117-Y161 HydrophobicContact SD-CG 4.45Å; E119-Y161 WeakPolarHBondContact O-CE2 3.26Å; A148-Y161 CarbonylContact C-O 3.54Å; A148-Y161 WeakPolarHBondContact CA-O 3.36Å; S149-Y161 PolarHBondContact N-O 2.95Å; Y152-Y161 PolarHBondContact O-N 3.19Å; Y152-Y161 VanDerWaalsContact O-N 3.14Å; H154-Y161 AromaticContact CD2-CD1 3.78Å; H154-Y161 AromaticContact CD2-CE1 3.47Å; H154-Y161 VanDerWaalsContact CD2-CE1 3.47Å; H154-Y161 WeakPolarHBondContact CD2-CE1 3.21Å; H154-Y161 AromaticContact CG-CE1 3.97Å; H154-Y161 AromaticContact NE2-CD1 3.93Å; H154-Y161 AromaticContact NE2-CE1 3.57Å; Y161-G174 WeakPolarHBondContact CA-O 3.49Å; Y161-Y175 VanDerWaalsContact CZ-CB 3.49Å
162	Y	98.7	Very high	96.8	Very high	15 Å²	15	58.5 Å²	58.5	6%	0.059	30%	0.298	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-106.5	142.7	-178.3	-65.6	-97.2	0	0	0	112.2	M117 Y147 A148 Q160 A164 G174 T177 R179 T184	M117-Y162 VanDerWaalsContact CE-C 3.46Å; M117-Y162 WeakPolarHBondContact CE-O 3.48Å; Y147-Y162 WeakPolarHBondContact O-CA 3.45Å; A148-Y162 HydrophobicContact CB-CD1 4.12Å; A148-Y162 HydrophobicContact CB-CE1 3.93Å; Q160-Y162 HydrophobicContact CB-CE2 3.92Å; Q160-Y162 VanDerWaalsContact O-CD2 3.26Å; Q160-Y162 WeakPolarHBondContact O-CD2 3.4Å; Q160-Y162 VanDerWaalsContact O-CE2 3.28Å; Q160-Y162 WeakPolarHBondContact O-CE2 3.5Å; Q160-Y162 PolarHBondContact OE1-OH 3.39Å; Y162-A164 PolarHBondContact O-N 3.32Å; Y162-G174 WeakPolarHBondContact O-CA 3.25Å; Y162-T177 WeakPolarHBondContact CB-OG1 3.28Å; Y162-T177 PolarHBondContact N-OG1 3.35Å; Y162-T177 VanDerWaalsContact N-OG1 3.15Å; Y162-R179 HydrophobicContact CE1-CB 4.16Å; Y162-R179 HydrophobicContact CE1-CG 3.9Å; Y162-R179 HydrophobicContact CE2-CB 4.23Å; Y162-T184 HydrophobicContact CG-CG2 4.21Å
163	V	98.8	Very high	96.8	Very high	0 Å²	0	59 Å²	59	0%	0	30%	0.302	C	S	.	.			trans	-56.4	135.8	163.5	179.2	0	0	0	0	107.9	L73 L115 M117 L123 F135 Y147 F186	L73-V163 HydrophobicContact CD1-CG1 3.92Å; L115-V163 HydrophobicContact CD2-CG1 4.18Å; L115-V163 HydrophobicContact CD2-CG2 4.14Å; M117-V163 HydrophobicContact CE-CG2 4.19Å; L123-V163 HydrophobicContact CD1-CG1 3.88Å; L123-V163 HydrophobicContact CD2-CB 4.45Å; L123-V163 HydrophobicContact CD2-CG1 4.28Å; L123-V163 HydrophobicContact CD2-CG2 4.11Å; F135-V163 HydrophobicContact CD1-CG2 3.74Å; F135-V163 HydrophobicContact CE1-CG2 3.53Å; F135-V163 HydrophobicContact CG-CG2 4.48Å; F135-V163 HydrophobicContact CZ-CG2 4.12Å; Y147-V163 PolarHBondContact O-N 3.04Å; V163-F186 HydrophobicContact CB-CE2 4.43Å; V163-F186 HydrophobicContact CG1-CE2 4.07Å; V163-F186 HydrophobicContact CG1-CZ 3.95Å; V163-F186 WeakPolarHBondContact O-CE2 3.5Å
164	A	98.8	Very high	96.9	Very high	0 Å²	0	54.4 Å²	54.4	0%	0	28%	0.281	C	S	.	.			trans	-156	149.2	-179.8	0	0	0	0	0	114.2	Y162 R172 T177 F183 T184	Y162-A164 PolarHBondContact O-N 3.32Å; A164-R172 HydrophobicContact CB-CB 3.8Å; A164-R172 HydrophobicContact CB-CG 4.35Å; A164-R172 PolarHBondContact O-N 2.76Å; A164-T177 HydrophobicContact CB-CG2 3.86Å; A164-F183 WeakPolarHBondContact CA-O 3.39Å; A164-F183 HydrophobicContact CB-CB 4.42Å; A164-F183 HydrophobicContact CB-CD2 3.82Å; A164-F183 VanDerWaalsContact CB-O 3.3Å; A164-F183 WeakPolarHBondContact CB-O 3.36Å; A164-T184 HydrophobicContact CB-CG2 4.25Å
165	L	98.8	Very high	96.9	Very high	0 Å²	0	57.9 Å²	57.9	0%	0	29%	0.294	C	S	.	.	B	Isolated β-bridge	trans	-121.8	128.3	170.9	-64.9	178.6	0	0	0	110.3	C67 T69 F71 L73 S170 F183 F186	C67-L165 HydrophobicContact CB-CB 4.13Å; C67-L165 HydrophobicContact CB-CD1 4Å; C67-L165 HydrophobicContact CB-CG 4.42Å; T69-L165 WeakPolarHBondContact CG2-O 3.25Å; T69-L165 PolarHBondContact OG1-O 3.15Å; F71-L165 HydrophobicContact CB-CD1 4.1Å; L73-L165 HydrophobicContact CB-CD1 4.16Å; L73-L165 HydrophobicContact CD1-CD2 4.42Å; L73-L165 HydrophobicContact CD1-CG 4.48Å; L165-S170 WeakPolarHBondContact CA-O 3.34Å; L165-F183 PolarHBondContact N-O 2.94Å; L165-F183 WeakPolarHBondContact O-CB 3.49Å; L165-F186 HydrophobicContact CD1-CE1 4.01Å; L165-F186 HydrophobicContact CG-CE1 4.08Å; L165-F186 HydrophobicContact CG-CZ 4.08Å
166	N	98.5	Very high	97.2	Very high	26 Å²	26	57.5 Å²	57.5	14%	0.139	27%	0.274	C	S	.	.			trans	-67.1	175.1	177.5	-70.1	-50.7	0	0	0	112.1	T69 D168 G169 S170 P171 R172	T69-N166 PolarHBondContact OG1-O 3.46Å; N166-D168 WeakPolarHBondContact CB-OD1 3.41Å; N166-D168 PolarHBondContact O-N 3.35Å; N166-G169 PolarHBondContact O-N 2.9Å; N166-S170 WeakPolarHBondContact CB-OG 3.46Å; N166-S170 PolarHBondContact N-O 2.92Å; N166-S170 PolarHBondContact ND2-OG 3.47Å; N166-P171 PolarHBondContact ND2-O 2.78Å; N166-R172 WeakPolarHBondContact OD1-CD 3.27Å; N166-R172 PolarHBondContact OD1-NH1 3.21Å
167	K	98	Very high	97.4	Very high	180 Å²	180	51.5 Å²	51.5	78%	0.783	24%	0.242	S	C	*	.	T	Hydrogen-bonded Turn	trans	-68.1	-14.5	-178.3	-69.7	-174.9	-180	179.5	0	114.6	T69 F71	T69-K167 HydrophobicContact CG2-CG 4.37Å; F71-K167 VanDerWaalsContact CE2-O 3.27Å; F71-K167 WeakPolarHBondContact CE2-O 3.5Å; F71-K167 WeakPolarHBondContact CZ-O 3.37Å
168	D	98	Very high	97.6	Very high	113 Å²	113	53.7 Å²	53.7	60%	0.604	24%	0.244	S	C	*	.	T	Hydrogen-bonded Turn	trans	-96.5	-8.6	177	55.4	7.4	0	0	0	113	F71 N166 S170	F71-D168 WeakPolarHBondContact CZ-O 3.11Å; N166-D168 WeakPolarHBondContact CB-OD1 3.41Å; N166-D168 PolarHBondContact O-N 3.35Å; D168-S170 WeakPolarHBondContact OD1-CB 3.31Å; D168-S170 PolarHBondContact OD1-N 3.18Å; D168-S170 PolarHBondContact OD1-OG 3.24Å; D168-S170 PolarHBondContact OD2-OG 3.46Å
169	G	97.9	Very high	97.9	Very high	5 Å²	5	51.7 Å²	51.7	5%	0.052	23%	0.232	C	C	.	.	S	Bend	trans	90.1	1.9	-174.4	0	0	0	0	0	114.3	G83 N166	G83-G169 WeakPolarHBondContact CA-O 3.23Å; G83-G169 PolarHBondContact N-O 3.26Å; N166-G169 PolarHBondContact O-N 2.9Å
170	S	98.4	Very high	97.9	Very high	36 Å²	36	53.7 Å²	53.7	25%	0.252	24%	0.244	S	C	.	.			trans	-68.8	147	171.5	62.5	0	0	0	0	111.4	L165 N166 D168	L165-S170 WeakPolarHBondContact CA-O 3.34Å; N166-S170 WeakPolarHBondContact CB-OG 3.46Å; N166-S170 PolarHBondContact N-O 2.92Å; N166-S170 PolarHBondContact ND2-OG 3.47Å; D168-S170 WeakPolarHBondContact OD1-CB 3.31Å; D168-S170 PolarHBondContact OD1-N 3.18Å; D168-S170 PolarHBondContact OD1-OG 3.24Å; D168-S170 PolarHBondContact OD2-OG 3.46Å
171	P	98.4	Very high	97.9	Very high	44 Å²	44	53.8 Å²	53.8	29%	0.286	25%	0.245	S	C	.	.	B	Isolated β-bridge	trans	-61	146.7	167.7	29.6	-36	0	0	0	110	V81 L123 N166	V81-P171 WeakPolarHBondContact O-CD 3.46Å; V81-P171 VanDerWaalsContact O-CG 3.29Å; V81-P171 WeakPolarHBondContact O-CG 3.45Å; L123-P171 HydrophobicContact CB-CB 4.46Å; L123-P171 HydrophobicContact CD1-CB 4.34Å; N166-P171 PolarHBondContact ND2-O 2.78Å
172	R	98.5	Very high	97.8	Very high	46 Å²	46	58.8 Å²	58.8	17%	0.174	27%	0.267	C	S	.	.			trans	-114.6	138.2	176.3	-176.4	179.7	-173.4	75.5	8.3	110.4	A164 N166 G174 R176 T177 F183	A164-R172 HydrophobicContact CB-CB 3.8Å; A164-R172 HydrophobicContact CB-CG 4.35Å; A164-R172 PolarHBondContact O-N 2.76Å; N166-R172 WeakPolarHBondContact OD1-CD 3.27Å; N166-R172 PolarHBondContact OD1-NH1 3.21Å; R172-G174 PolarHBondContact O-N 3.31Å; R172-R176 PolarHBondContact NE-O 2.92Å; R172-R176 PolarHBondContact NH2-O 3.3Å; R172-T177 HydrophobicContact CG-CG2 4.4Å; R172-F183 VanDerWaalsContact NE-CZ 3.31Å
173	E	98.4	Very high	97.8	Very high	54 Å²	54	59.8 Å²	59.8	25%	0.252	27%	0.272	S	S	.	.			trans	-67.7	122.4	-179	-41	92.4	123.4	0	0	110.1	G121 Y175 R176	G121-E173 CarbonylContact O-C 3.56Å; G121-E173 WeakPolarHBondContact O-CA 3.11Å; E173-Y175 HydrophobicContact CB-CD1 3.66Å; E173-Y175 HydrophobicContact CB-CE1 3.47Å; E173-Y175 VanDerWaalsContact CB-CE1 3.47Å; E173-Y175 HydrophobicContact CG-CE1 4.12Å; E173-Y175 PolarHBondContact O-N 2.8Å; E173-Y175 VanDerWaalsContact O-N 3.11Å; E173-R176 HydrophobicContact CB-CG 4.3Å; E173-R176 WeakPolarHBondContact O-CB 3.37Å; E173-R176 PolarHBondContact O-N 2.94Å; E173-R176 WeakPolarHBondContact OE1-CD 3.4Å; E173-R176 IonicContact OE1-CZ 3.09Å; E173-R176 IonicContact OE1-NE 3.37Å; E173-R176 IonicContact OE1-NH1 3.54Å; E173-R176 PolarHBondContact OE1-NH1 2.83Å; E173-R176 VanDerWaalsContact OE2-CD 3.28Å; E173-R176 WeakPolarHBondContact OE2-CD 3.32Å; E173-R176 IonicContact OE2-CZ 2.65Å; E173-R176 IonicContact OE2-NE 2.83Å; E173-R176 IonicContact OE2-NH1 3.81Å; E173-R176 PolarHBondContact OE2-NH1 3.24Å
174	G	98.3	Very high	97.7	Very high	0 Å²	0	59.8 Å²	59.8	0%	0	27%	0.272	C	S	.	.	G	3₁₀ helix	trans	-58	-29.6	-170.3	0	0	0	0	0	114.5	G121 Y161 Y162 R172 R176 T177	G121-G174 PolarHBondContact O-N 3.42Å; Y161-G174 WeakPolarHBondContact CA-O 3.49Å; Y162-G174 WeakPolarHBondContact O-CA 3.25Å; R172-G174 PolarHBondContact O-N 3.31Å; G174-R176 PolarHBondContact O-N 3.13Å; G174-T177 WeakPolarHBondContact O-CB 3.45Å; G174-T177 PolarHBondContact O-N 3.36Å; G174-T177 PolarHBondContact O-OG1 3.34Å
175	Y	97.5	Very high	97.7	Very high	104 Å²	104	60.5 Å²	60.5	41%	0.408	28%	0.275	S	S	.	.	G	3₁₀ helix	trans	-65.6	-21.4	174.5	79.7	-83.3	0	0	0	113.1	R120 H154 Y161 E173 T177	R120-Y175 VanDerWaalsContact O-CD1 3.23Å; R120-Y175 WeakPolarHBondContact O-CD1 3.39Å; H154-Y175 PolarHBondContact CE1-O 2.95Å; H154-Y175 PolarHBondContact NE2-O 2.8Å; Y161-Y175 VanDerWaalsContact CZ-CB 3.49Å; E173-Y175 HydrophobicContact CB-CD1 3.66Å; E173-Y175 HydrophobicContact CB-CE1 3.47Å; E173-Y175 VanDerWaalsContact CB-CE1 3.47Å; E173-Y175 HydrophobicContact CG-CE1 4.12Å; E173-Y175 PolarHBondContact O-N 2.8Å; E173-Y175 VanDerWaalsContact O-N 3.11Å; Y175-T177 VanDerWaalsContact C-N 3.3Å; Y175-T177 PolarHBondContact O-N 3.28Å
176	R	97.7	Very high	97.7	Very high	114 Å²	114	60.5 Å²	60.5	43%	0.43	28%	0.275	S	S	.	.	G	3₁₀ helix	trans	-94.9	28.7	-178.3	-52.2	170.8	79.2	-160.3	10.8	112.5	R172 E173 G174	R172-R176 PolarHBondContact NE-O 2.92Å; R172-R176 PolarHBondContact NH2-O 3.3Å; E173-R176 HydrophobicContact CB-CG 4.3Å; E173-R176 WeakPolarHBondContact O-CB 3.37Å; E173-R176 PolarHBondContact O-N 2.94Å; E173-R176 WeakPolarHBondContact OE1-CD 3.4Å; E173-R176 IonicContact OE1-CZ 3.09Å; E173-R176 IonicContact OE1-NE 3.37Å; E173-R176 IonicContact OE1-NH1 3.54Å; E173-R176 PolarHBondContact OE1-NH1 2.83Å; E173-R176 VanDerWaalsContact OE2-CD 3.28Å; E173-R176 WeakPolarHBondContact OE2-CD 3.32Å; E173-R176 IonicContact OE2-CZ 2.65Å; E173-R176 IonicContact OE2-NE 2.83Å; E173-R176 IonicContact OE2-NH1 3.81Å; E173-R176 PolarHBondContact OE2-NH1 3.24Å; G174-R176 PolarHBondContact O-N 3.13Å
177	T	98	Very high	97.7	Very high	1 Å²	1	61.7 Å²	61.7	1%	0.006	28%	0.281	C	S	.	.			trans	-126.8	160.2	-173.4	71.7	0	0	0	0	113.3	Y162 A164 R172 G174 Y175 F183 T184	Y162-T177 WeakPolarHBondContact CB-OG1 3.28Å; Y162-T177 PolarHBondContact N-OG1 3.35Å; Y162-T177 VanDerWaalsContact N-OG1 3.15Å; A164-T177 HydrophobicContact CB-CG2 3.86Å; R172-T177 HydrophobicContact CG-CG2 4.4Å; G174-T177 WeakPolarHBondContact O-CB 3.45Å; G174-T177 PolarHBondContact O-N 3.36Å; G174-T177 PolarHBondContact O-OG1 3.34Å; Y175-T177 VanDerWaalsContact C-N 3.3Å; Y175-T177 PolarHBondContact O-N 3.28Å; T177-F183 HydrophobicContact CG2-CD2 4.43Å; T177-F183 HydrophobicContact CG2-CE2 3.98Å; T177-T184 HydrophobicContact CG2-CG2 4.13Å
178	K	96.9	Very high	97.6	Very high	101 Å²	101	54.9 Å²	54.9	44%	0.439	26%	0.256	S	S	.	.			trans	-143.8	144.8	170.3	-54	-177	-179.6	-176.1	0	108.2	H180 Q181	K178-H180 VanDerWaalsContact C-N 3.31Å; K178-H180 PolarHBondContact O-N 2.86Å; K178-H180 VanDerWaalsContact O-N 3.13Å; K178-Q181 HydrophobicContact CB-CG 4.08Å; K178-Q181 WeakPolarHBondContact O-CB 3.33Å; K178-Q181 PolarHBondContact O-N 2.83Å
179	R	95.9	Very high	97.5	Very high	78 Å²	78	53 Å²	53	29%	0.294	24%	0.24	S	C	.	.	T	Hydrogen-bonded Turn	trans	-45.9	-45.2	-174.2	-160.9	-178.1	-177.3	-85.2	3.7	115.1	Q138 F139 E140 T146 Y162 Q181 T184 H185	Q138-R179 VanDerWaalsContact OE1-NH2 3.08Å; F139-R179 PolarHBondContact O-NH2 2.76Å; E140-R179 IonicContact OE1-CZ 2.98Å; E140-R179 IonicContact OE1-NH1 3.27Å; E140-R179 PolarHBondContact OE1-NH1 2.78Å; E140-R179 IonicContact OE2-CZ 3.3Å; E140-R179 IonicContact OE2-NH1 2.74Å; E140-R179 PolarHBondContact OE2-NH1 2.99Å; T146-R179 HydrophobicContact CG2-CG 4.12Å; Y162-R179 HydrophobicContact CE1-CB 4.16Å; Y162-R179 HydrophobicContact CE1-CG 3.9Å; Y162-R179 HydrophobicContact CE2-CB 4.23Å; R179-Q181 VanDerWaalsContact C-N 3.26Å; R179-Q181 PolarHBondContact O-N 2.83Å; R179-T184 PolarHBondContact O-OG1 3.31Å; R179-H185 PolarHBondContact O-CD2 3.35Å
180	H	95	Very high	97.3	Very high	124 Å²	124	57.4 Å²	57.4	57%	0.574	27%	0.268	S	S	*	.	T	Hydrogen-bonded Turn	trans	-75.9	-2.6	-178	59.4	-112.6	0	0	0	115.3	K178 H185	K178-H180 VanDerWaalsContact C-N 3.31Å; K178-H180 PolarHBondContact O-N 2.86Å; K178-H180 VanDerWaalsContact O-N 3.13Å; H180-H185 PolarHBondContact O-NE2 2.8Å
181	Q	96.8	Very high	97	Very high	54 Å²	54	57.1 Å²	57.1	25%	0.252	26%	0.264	S	S	.	.	S	Bend	trans	-85	124.7	-175.5	-66.8	179.4	-49	0	0	109.9	K178 R179 F183 T184 H185	K178-Q181 HydrophobicContact CB-CG 4.08Å; K178-Q181 WeakPolarHBondContact O-CB 3.33Å; K178-Q181 PolarHBondContact O-N 2.83Å; R179-Q181 VanDerWaalsContact C-N 3.26Å; R179-Q181 PolarHBondContact O-N 2.83Å; Q181-F183 HydrophobicContact CB-CD2 4.03Å; Q181-F183 HydrophobicContact CB-CE1 4.16Å; Q181-F183 HydrophobicContact CB-CE2 3.57Å; Q181-F183 HydrophobicContact CB-CG 4.49Å; Q181-F183 HydrophobicContact CB-CZ 3.66Å; Q181-F183 HydrophobicContact CG-CE2 4.33Å; Q181-F183 HydrophobicContact CG-CZ 4.08Å; Q181-F183 PolarHBondContact O-N 3.48Å; Q181-F183 VanDerWaalsContact OE1-CE2 3.28Å; Q181-T184 PolarHBondContact O-N 3.47Å; Q181-T184 PolarHBondContact O-OG1 3.07Å; Q181-H185 PolarHBondContact O-CD2 3.1Å
182	K	96.7	Very high	96.6	Very high	139 Å²	139	57.8 Å²	57.8	60%	0.604	27%	0.266	S	S	*	.	G	3₁₀ helix	trans	-49.8	-27.8	-173.8	-64.1	-177.5	-179.4	-179.9	0	115.1	R68 T184 H185	R68-K182 WeakPolarHBondContact CB-O 3.48Å; K182-T184 VanDerWaalsContact C-N 3.27Å; K182-T184 PolarHBondContact O-N 2.72Å; K182-H185 PolarHBondContact O-N 2.75Å
183	F	97.8	Very high	95.8	Very high	37 Å²	37	59 Å²	59	16%	0.162	28%	0.279	C	S	.	.	G	3₁₀ helix	trans	-72.2	-13.7	175.7	48.1	-118.7	0	0	0	114.9	C67 T69 A164 L165 R172 T177 Q181	C67-F183 PolarHBondContact SG-O 3.37Å; T69-F183 HydrophobicContact CG2-CB 3.96Å; A164-F183 WeakPolarHBondContact CA-O 3.39Å; A164-F183 HydrophobicContact CB-CB 4.42Å; A164-F183 HydrophobicContact CB-CD2 3.82Å; A164-F183 VanDerWaalsContact CB-O 3.3Å; A164-F183 WeakPolarHBondContact CB-O 3.36Å; L165-F183 PolarHBondContact N-O 2.94Å; L165-F183 WeakPolarHBondContact O-CB 3.49Å; R172-F183 VanDerWaalsContact NE-CZ 3.31Å; T177-F183 HydrophobicContact CG2-CD2 4.43Å; T177-F183 HydrophobicContact CG2-CE2 3.98Å; Q181-F183 HydrophobicContact CB-CD2 4.03Å; Q181-F183 HydrophobicContact CB-CE1 4.16Å; Q181-F183 HydrophobicContact CB-CE2 3.57Å; Q181-F183 HydrophobicContact CB-CG 4.49Å; Q181-F183 HydrophobicContact CB-CZ 3.66Å; Q181-F183 HydrophobicContact CG-CE2 4.33Å; Q181-F183 HydrophobicContact CG-CZ 4.08Å; Q181-F183 PolarHBondContact O-N 3.48Å; Q181-F183 VanDerWaalsContact OE1-CE2 3.28Å
184	T	98.3	Very high	95.1	Very high	0 Å²	0	61 Å²	61	0%	0	30%	0.299	C	S	.	.	G	3₁₀ helix	trans	-93.4	-8.9	172.4	68.9	0	0	0	0	113	Y162 A164 T177 R179 Q181 K182 F186	Y162-T184 HydrophobicContact CG-CG2 4.21Å; A164-T184 HydrophobicContact CB-CG2 4.25Å; T177-T184 HydrophobicContact CG2-CG2 4.13Å; R179-T184 PolarHBondContact O-OG1 3.31Å; Q181-T184 PolarHBondContact O-N 3.47Å; Q181-T184 PolarHBondContact O-OG1 3.07Å; K182-T184 VanDerWaalsContact C-N 3.27Å; K182-T184 PolarHBondContact O-N 2.72Å; T184-F186 WeakPolarHBondContact O-CD2 3.24Å
185	H	98.3	Very high	94.3	Very high	15 Å²	15	65.7 Å²	65.7	7%	0.069	32%	0.32	C	S	.	.			trans	-88.6	118.7	-177.4	-60.5	-171.6	0	0	0	109.1	C67 R68 Y144 R179 H180 Q181 K182	C67-H185 WeakPolarHBondContact CA-O 3.41Å; R68-H185 HydrophobicContact CB-CB 3.95Å; R68-H185 WeakPolarHBondContact CD-CE1 3.34Å; R68-H185 PolarHBondContact N-O 2.8Å; R68-H185 PolarHBondContact NE-CE1 2.93Å; R68-H185 PolarHBondContact NH1-CE1 3.09Å; R68-H185 PolarHBondContact NH1-ND1 3.44Å; Y144-H185 HydrophobicContact CD1-CB 3.78Å; Y144-H185 HydrophobicContact CG-CB 4.01Å; R179-H185 PolarHBondContact O-CD2 3.35Å; H180-H185 PolarHBondContact O-NE2 2.8Å; Q181-H185 PolarHBondContact O-CD2 3.1Å; K182-H185 PolarHBondContact O-N 2.75Å
186	F	98.5	Very high	93.3	Very high	0 Å²	0	61.2 Å²	61.2	0%	0	30%	0.303	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-124.8	137.7	177.7	-67.4	-101.1	0	0	0	112.2	L65 Y66 C67 L73 Y144 N145 Y147 V163 L165 T184	L65-F186 HydrophobicContact CD1-CB 3.73Å; L65-F186 HydrophobicContact CD2-CB 4.48Å; L65-F186 HydrophobicContact CD2-CD1 4.28Å; L65-F186 HydrophobicContact CD2-CG 4.49Å; L65-F186 HydrophobicContact CG-CB 3.84Å; L65-F186 HydrophobicContact CG-CD1 3.79Å; L65-F186 HydrophobicContact CG-CG 4.1Å; Y66-F186 CarbonylContact O-C 3.45Å; Y66-F186 VanDerWaalsContact O-CA 3.28Å; Y66-F186 WeakPolarHBondContact O-CA 3.45Å; C67-F186 HydrophobicContact CB-CD1 3.65Å; C67-F186 HydrophobicContact CB-CE1 3.44Å; C67-F186 VanDerWaalsContact CB-CE1 3.44Å; C67-F186 HydrophobicContact CB-CG 4.39Å; C67-F186 HydrophobicContact CB-CZ 3.99Å; L73-F186 HydrophobicContact CB-CE1 4.3Å; L73-F186 HydrophobicContact CD1-CE1 4.21Å; L73-F186 HydrophobicContact CD1-CZ 4.47Å; Y144-F186 CarbonylContact C-O 3.49Å; Y144-F186 WeakPolarHBondContact CA-O 3.07Å; N145-F186 PolarHBondContact N-O 2.8Å; N145-F186 PolarHBondContact O-N 2.59Å; Y147-F186 HydrophobicContact CD2-CB 4.33Å; Y147-F186 HydrophobicContact CD2-CD2 4.3Å; Y147-F186 HydrophobicContact CE2-CB 3.95Å; V163-F186 HydrophobicContact CB-CE2 4.43Å; V163-F186 HydrophobicContact CG1-CE2 4.07Å; V163-F186 HydrophobicContact CG1-CZ 3.95Å; V163-F186 WeakPolarHBondContact O-CE2 3.5Å; L165-F186 HydrophobicContact CD1-CE1 4.01Å; L165-F186 HydrophobicContact CG-CE1 4.08Å; L165-F186 HydrophobicContact CG-CZ 4.08Å; T184-F186 WeakPolarHBondContact O-CD2 3.24Å
187	L	97.4	Very high	91.6	Very high	50 Å²	50	61 Å²	61	26%	0.262	32%	0.316	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-102.7	116.5	175.8	176.2	65.1	0	0	0	109.5	Y66 W143 Y144 R189	Y66-L187 HydrophobicContact CD1-CB 4.29Å; Y66-L187 PolarHBondContact N-O 2.87Å; Y66-L187 PolarHBondContact O-N 2.8Å; W143-L187 HydrophobicContact CB-CD1 4.22Å; W143-L187 WeakPolarHBondContact O-CD1 3.45Å; Y144-L187 HydrophobicContact CD1-CB 4.01Å; Y144-L187 HydrophobicContact CE1-CB 3.83Å; L187-R189 HydrophobicContact CD2-CG 4.13Å; L187-R189 HydrophobicContact CG-CG 4.12Å; L187-R189 PolarHBondContact O-N 3.26Å; L187-R189 VanDerWaalsContact O-N 3.09Å
188	P	96.1	Very high	90	Very high	38 Å²	38	64.3 Å²	64.3	25%	0.247	34%	0.339	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-69	101.5	170.9	-19.9	33.7	0	0	0	110.8	R63 L65 Y147	R63-P188 HydrophobicContact CG-CB 4.5Å; L65-P188 HydrophobicContact CD1-CB 4.38Å; L65-P188 HydrophobicContact CD1-CG 4.02Å; Y147-P188 WeakPolarHBondContact OH-CG 3.33Å
189	R	96.2	Very high	88	Confident	72 Å²	72	60.6 Å²	60.6	27%	0.272	32%	0.324	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-88.1	149	178.1	-68.1	179.4	66.1	-118.4	-5.6	111	R63 Q64 H72 D87 L187	R63-R189 WeakPolarHBondContact CA-O 3.5Å; R63-R189 WeakPolarHBondContact CB-O 3.35Å; R63-R189 WeakPolarHBondContact CD-O 3.49Å; Q64-R189 HydrophobicContact CB-CB 4.26Å; Q64-R189 PolarHBondContact N-O 3.3Å; Q64-R189 PolarHBondContact O-N 3.46Å; H72-R189 PolarHBondContact CE1-NH1 3.49Å; H72-R189 PolarHBondContact NE2-NH1 3.21Å; D87-R189 IonicContact OD1-CZ 3.27Å; D87-R189 VanDerWaalsContact OD1-CZ 3.27Å; D87-R189 IonicContact OD1-NH1 2.71Å; D87-R189 PolarHBondContact OD1-NH1 3.36Å; D87-R189 IonicContact OD1-NH2 2.87Å; D87-R189 PolarHBondContact OD1-NH2 3.15Å; L187-R189 HydrophobicContact CD2-CG 4.13Å; L187-R189 HydrophobicContact CG-CG 4.12Å; L187-R189 PolarHBondContact O-N 3.26Å; L187-R189 VanDerWaalsContact O-N 3.09Å
190	P	93.9	Very high	85.9	Confident	98 Å²	98	58.8 Å²	58.8	64%	0.636	32%	0.323	S	S	*	.			trans	-64.7	163.1	174.9	28.6	-35.4	0	0	0	112.1	Q64	Q64-P190 PolarHBondContact NE2-O 2.65Å
191	V	93.2	Very high	83.9	Confident	30 Å²	30	61.7 Å²	61.7	18%	0.182	33%	0.329	C	S	.	.			trans	-114.1	125	172.7	173.2	0	0	0	0	108.2	R62 R63 Q64 I93 P193 L196	R62-V191 HydrophobicContact CB-CG2 4.4Å; R63-V191 VanDerWaalsContact C-CG2 3.49Å; Q64-V191 HydrophobicContact CG-CG2 4.08Å; I93-V191 HydrophobicContact CD1-CG1 4.28Å; I93-V191 HydrophobicContact CD1-CG2 4.14Å; I93-V191 HydrophobicContact CG2-CG1 4.27Å; I93-V191 HydrophobicContact CG2-CG2 4.12Å; V191-P193 WeakPolarHBondContact O-CD 3Å; V191-L196 HydrophobicContact CG1-CD1 3.44Å; V191-L196 VanDerWaalsContact CG1-CD1 3.44Å
192	D	89.2	Confident	82	Confident	59 Å²	59	61.6 Å²	61.6	32%	0.316	33%	0.33	S	S	.	.			trans	-88.6	114.1	173.6	177.8	-9.2	0	0	0	108.9	H88 S194 K195	H88-D192 PolarHBondContact NE2-N 3.31Å; D192-S194 VanDerWaalsContact CG-OG 3.23Å; D192-S194 PolarHBondContact O-N 3.29Å; D192-S194 WeakPolarHBondContact OD1-CB 3.27Å; D192-S194 PolarHBondContact OD1-N 3.25Å; D192-S194 PolarHBondContact OD1-OG 2.91Å; D192-S194 PolarHBondContact OD2-OG 2.93Å; D192-K195 HydrophobicContact CB-CD 4.08Å; D192-K195 HydrophobicContact CB-CG 4.21Å; D192-K195 PolarHBondContact O-N 3.24Å
193	P	81.7	Confident	80	Confident	71 Å²	71	58.7 Å²	58.7	46%	0.461	32%	0.32	S	S	.	.	G	3₁₀ helix	trans	-61.3	-27.7	-179.7	-23.6	34.8	0	0	0	113.6	V191 K195 L196	V191-P193 WeakPolarHBondContact O-CD 3Å; P193-K195 PolarHBondContact O-N 2.81Å; P193-L196 PolarHBondContact O-N 2.86Å
194	S	82.8	Confident	77.7	Confident	95 Å²	95	64.2 Å²	64.2	66%	0.664	35%	0.345	S	S	*	.	G	3₁₀ helix	trans	-67.5	-25.4	-177.9	73.2	0	0	0	0	112.9	D192 L196	D192-S194 VanDerWaalsContact CG-OG 3.23Å; D192-S194 PolarHBondContact O-N 3.29Å; D192-S194 WeakPolarHBondContact OD1-CB 3.27Å; D192-S194 PolarHBondContact OD1-N 3.25Å; D192-S194 PolarHBondContact OD1-OG 2.91Å; D192-S194 PolarHBondContact OD2-OG 2.93Å; S194-L196 VanDerWaalsContact C-N 3.31Å; S194-L196 PolarHBondContact O-N 2.97Å
195	K	83.1	Confident	75.6	Confident	100 Å²	100	71.6 Å²	71.6	44%	0.435	38%	0.379	S	S	.	.	G	3₁₀ helix	trans	-83.1	0.1	179.1	-66.8	-178.8	178.8	-179.9	0	114.2	D87 H88 D192 P193 P197	D87-K195 IonicContact OD2-NZ 2.82Å; D87-K195 PolarHBondContact OD2-NZ 2.81Å; H88-K195 HydrophobicContact CB-CB 3.99Å; H88-K195 HydrophobicContact CB-CD 4.19Å; H88-K195 VanDerWaalsContact ND1-CD 3.31Å; H88-K195 WeakPolarHBondContact ND1-CD 3.47Å; D192-K195 HydrophobicContact CB-CD 4.08Å; D192-K195 HydrophobicContact CB-CG 4.21Å; D192-K195 PolarHBondContact O-N 3.24Å; P193-K195 PolarHBondContact O-N 2.81Å; K195-P197 WeakPolarHBondContact O-CD 3.33Å
196	L	75.8	Confident	72.8	Confident	9 Å²	9	76.7 Å²	76.7	5%	0.047	40%	0.398	C	S	.	.			trans	-123.7	85.6	-173.1	-63.7	177.3	0	0	0	111.7	H88 I93 V191 P193 S194 S198 M199 S200	H88-L196 HydrophobicContact CB-CD2 4.28Å; I93-L196 HydrophobicContact CD1-CD1 3.86Å; I93-L196 HydrophobicContact CD1-CD2 4.02Å; I93-L196 HydrophobicContact CG1-CD1 3.8Å; I93-L196 HydrophobicContact CG1-CD2 3.89Å; I93-L196 HydrophobicContact CG2-CD1 4.22Å; V191-L196 HydrophobicContact CG1-CD1 3.44Å; V191-L196 VanDerWaalsContact CG1-CD1 3.44Å; P193-L196 PolarHBondContact O-N 2.86Å; S194-L196 VanDerWaalsContact C-N 3.31Å; S194-L196 PolarHBondContact O-N 2.97Å; L196-S198 PolarHBondContact O-N 2.33Å; L196-M199 HydrophobicContact CB-CB 3.79Å; L196-M199 HydrophobicContact CB-CG 3.58Å; L196-M199 HydrophobicContact CD1-CE 3.95Å; L196-M199 HydrophobicContact CD1-CG 3.9Å; L196-M199 HydrophobicContact CG-CG 4.35Å; L196-M199 WeakPolarHBondContact O-CB 3.37Å; L196-M199 PolarHBondContact O-N 2.89Å; L196-S200 PolarHBondContact O-N 3.42Å
197	P	62.7	Low	70	Confident	111 Å²	111	90.8 Å²	90.8	72%	0.721	45%	0.452	S	S	*	.	T	Hydrogen-bonded Turn	trans	-57.3	-26.7	-174.9	-27.8	35.8	0	0	0	115.5	K195	K195-P197 WeakPolarHBondContact O-CD 3.33Å
198	S	63	Low	68.6	Low	69 Å²	69	92.8 Å²	92.8	48%	0.483	46%	0.461	S	S	.	.	T	Hydrogen-bonded Turn	trans	-70.9	-33.8	173.4	47.2	0	0	0	0	113	L196	L196-S198 PolarHBondContact O-N 2.33Å
199	M	56.7	Low	67.2	Low	24 Å²	24	95.7 Å²	95.7	12%	0.118	47%	0.472	C	S	.	.	T	Hydrogen-bonded Turn	trans	-86.8	-20.2	-170.1	-59	-83.7	-118.6	0	0	113.1	R62 I93 V109 L196 R201 D202	R62-M199 PolarHBondContact NH1-SD 3.32Å; I93-M199 HydrophobicContact CG2-CE 3.65Å; V109-M199 HydrophobicContact CB-CE 4.33Å; V109-M199 HydrophobicContact CG1-CE 3.83Å; V109-M199 HydrophobicContact CG1-SD 4.18Å; L196-M199 HydrophobicContact CB-CB 3.79Å; L196-M199 HydrophobicContact CB-CG 3.58Å; L196-M199 HydrophobicContact CD1-CE 3.95Å; L196-M199 HydrophobicContact CD1-CG 3.9Å; L196-M199 HydrophobicContact CG-CG 4.35Å; L196-M199 WeakPolarHBondContact O-CB 3.37Å; L196-M199 PolarHBondContact O-N 2.89Å; M199-R201 PolarHBondContact O-N 3.22Å; M199-R201 VanDerWaalsContact O-N 3.15Å; M199-D202 WeakPolarHBondContact O-CB 3.31Å; M199-D202 PolarHBondContact O-N 3.38Å; M199-D202 VanDerWaalsContact O-N 3.1Å
200	S	51.2	Low	65.5	Low	39 Å²	39	97 Å²	97	27%	0.273	48%	0.483	S	S	.	.	H	α-helix	trans	-54.6	-30.9	171.8	-55	0	0	0	0	111.9	L196 L203 F204	L196-S200 PolarHBondContact O-N 3.42Å; S200-L203 PolarHBondContact O-N 3.21Å; S200-F204 WeakPolarHBondContact O-CD2 3.21Å; S200-F204 PolarHBondContact O-N 2.63Å
201	R	53.6	Low	63.9	Low	186 Å²	186	96.9 Å²	96.9	70%	0.702	47%	0.474	S	S	*	.	H	α-helix	trans	-64.4	-42.9	176.9	-66.9	-175.8	176.3	-174.4	-1.8	112.4	M199 L203 H205	M199-R201 PolarHBondContact O-N 3.22Å; M199-R201 VanDerWaalsContact O-N 3.15Å; R201-L203 PolarHBondContact O-N 2.84Å; R201-H205 PolarHBondContact O-N 2.87Å; R201-H205 PolarHBondContact O-ND1 3.27Å
202	D	57	Low	62	Low	51 Å²	51	101.1 Å²	101.1	27%	0.273	49%	0.493	S	S	.	.	H	α-helix	trans	-56.8	-36.3	176.4	-66.3	0.1	0	0	0	111.9	R62 M199 Y206	R62-D202 IonicContact CZ-OD2 2.75Å; R62-D202 IonicContact NH1-OD2 2.84Å; R62-D202 PolarHBondContact NH1-OD2 2.71Å; R62-D202 IonicContact NH2-OD2 2.72Å; R62-D202 PolarHBondContact NH2-OD2 2.76Å; M199-D202 WeakPolarHBondContact O-CB 3.31Å; M199-D202 PolarHBondContact O-N 3.38Å; M199-D202 VanDerWaalsContact O-N 3.1Å; D202-Y206 WeakPolarHBondContact O-CD2 3.32Å
203	L	53.2	Low	60.2	Low	78 Å²	78	103.9 Å²	103.9	41%	0.408	51%	0.505	S	S	.	.	H	α-helix	trans	-90.3	-30.9	-171.3	-138.2	74.4	0	0	0	113.1	I59 S200 R201	I59-L203 HydrophobicContact CD1-CD1 4.19Å; I59-L203 HydrophobicContact CG2-CD1 4.45Å; S200-L203 PolarHBondContact O-N 3.21Å; R201-L203 PolarHBondContact O-N 2.84Å
204	F	50.4	Low	58.7	Low	154 Å²	154	106.3 Å²	106.3	68%	0.675	51%	0.508	S	S	*	.	H	α-helix	trans	-94.8	-3.1	-176.8	-66.7	-57.2	0	0	0	115.1	S200 Y206	S200-F204 WeakPolarHBondContact O-CD2 3.21Å; S200-F204 PolarHBondContact O-N 2.63Å; F204-Y206 PolarHBondContact O-N 3.25Å
205	H	52.9	Low	56.9	Low	155 Å²	155	107.2 Å²	107.2	72%	0.718	50%	0.496	S	S	*	.	T	Hydrogen-bonded Turn	trans	-84.6	12.7	166.3	-73.5	74.2	0	0	0	113.3	R201	R201-H205 PolarHBondContact O-N 2.87Å; R201-H205 PolarHBondContact O-ND1 3.27Å
206	Y	41.4	Very low	54.7	Low	121 Å²	121	107.8 Å²	107.8	48%	0.475	50%	0.501	S	S	.	.			trans	-117.9	40.3	-179.4	-86.6	-86.7	0	0	0	112.2	D52 D202 F204	D52-Y206 HydrophobicContact CB-CE1 3.74Å; D52-Y206 PolarHBondContact OD1-OH 3.45Å; D202-Y206 WeakPolarHBondContact O-CD2 3.32Å; F204-Y206 PolarHBondContact O-N 3.25Å
207	R	38.2	Very low	52.7	Low	296 Å²	296	116.7 Å²	116.7	100%	1.117	54%	0.542	S	S	*	.			trans	-145.3	0	179.8	-149.9	-177.1	-163.1	-138.8	2.5	112.5

Retrieved 207 of 207 residues in 1384.1 ms (Link to these results)

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