A0A087Y0F8_POEFO Loading...

Activator of basal transcription 1

AlphaFold DB , UniProt , Accession A0A087Y0F8, Species POEFO (Poecilia formosa, Amazon molly), Gene n/a, Length 250 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	V	39.1	Very low	34.9	Very low	193 Å²	193	162.9 Å²	162.9	100%	1.17	82%	0.815	S	S	*	*				0	82.3	0	-166.9	0	0	0	0	105.4
2	D	35.6	Very low	34.6	Very low	133 Å²	133	154.9 Å²	154.9	71%	0.711	81%	0.805	S	S	*	*				69.9	124	87.6	-105.5	-34.1	0	0	0	114.4
3	H	36.9	Very low	34.8	Very low	137 Å²	137	154.4 Å²	154.4	63%	0.634	80%	0.796	S	S	*	*			trans	63.9	146.3	148.7	-79.4	52.3	0	0	0	119.7
4	R	34.6	Very low	34.5	Very low	180 Å²	180	153.4 Å²	153.4	68%	0.679	80%	0.8	S	S	*	*			cis	179.7	148.2	-20.7	-141.8	-167.5	-96.2	-155.5	-6.1	105.9
5	D	34.9	Very low	34.7	Very low	125 Å²	125	155.9 Å²	155.9	67%	0.668	81%	0.807	S	S	*	*			trans	66.1	117.2	151.5	-56.4	-26.6	0	0	0	123.7
6	E	35.6	Very low	34.7	Very low	179 Å²	179	158.6 Å²	158.6	84%	0.836	81%	0.814	S	S	*	*				88.3	133.3	116.7	-80.1	-156.2	151.6	0	0	115.1
7	E	35.1	Very low	34.8	Very low	188 Å²	188	156.2 Å²	156.2	88%	0.879	80%	0.803	S	S	*	*				-163.1	161.5	53.9	-138.4	-178.6	-176.8	0	0	112.1
8	A	35.7	Very low	35.1	Very low	90 Å²	90	155.6 Å²	155.6	74%	0.744	80%	0.802	S	S	*	*			trans	-91.4	161	-167.7	0	0	0	0	0	116.2
9	R	31.1	Very low	35.5	Very low	257 Å²	257	152.7 Å²	152.7	97%	0.97	80%	0.797	S	S	*	*			trans	-171.3	131.5	147.1	-103.3	168.7	-157.7	-157.2	6.7	113.7
10	G	31.5	Very low	35.7	Very low	77 Å²	77	152.5 Å²	152.5	79%	0.794	79%	0.792	S	S	*	*			trans	119.2	91.2	162.3	0	0	0	0	0	113.7
11	R	33.9	Very low	36	Very low	233 Å²	233	150.2 Å²	150.2	88%	0.879	79%	0.785	S	S	*	*				83.8	114.7	70.6	-165.6	176.2	-165.3	-131.3	-7.4	114.1	E13	R11-E13 IonicContact NH2-OE1 3.57Å
12	G	31.3	Very low	36	Very low	67 Å²	67	149.1 Å²	149.1	69%	0.691	77%	0.767	S	S	*	*			trans	149.6	79.5	167.4	0	0	0	0	0	111.3
13	E	37.1	Very low	36.3	Very low	148 Å²	148	150.9 Å²	150.9	69%	0.692	77%	0.771	S	S	*	*				66.6	81.5	98.7	-68.2	178.1	-171.3	0	0	112.3	R11	R11-E13 IonicContact NH2-OE1 3.57Å
14	T	30.7	Very low	36.5	Very low	140 Å²	140	151.5 Å²	151.5	86%	0.859	77%	0.774	S	S	*	*				57.4	89.1	94.2	61.3	0	0	0	0	115.9
15	E	37.5	Very low	36.9	Very low	192 Å²	192	145.5 Å²	145.5	90%	0.897	76%	0.763	S	S	*	*			trans	-104.9	114.2	150.3	-73.8	-173.3	164.3	0	0	107.3
16	E	35.3	Very low	37.4	Very low	198 Å²	198	142.2 Å²	142.2	93%	0.925	75%	0.753	S	S	*	*			trans	-170.6	139.9	152.1	-107.9	172.4	-150.8	0	0	110.5
17	D	35.2	Very low	38	Very low	118 Å²	118	137.5 Å²	137.5	63%	0.631	74%	0.74	S	S	*	*			trans	84.7	91	160.1	-153.5	24.3	0	0	0	120.2
18	N	41.1	Very low	38.6	Very low	145 Å²	145	135.8 Å²	135.8	78%	0.775	73%	0.732	S	S	*	*			trans	-141.7	70.8	156.9	-173.7	55.9	0	0	0	109.6
19	S	42.3	Very low	39.3	Very low	101 Å²	101	138.7 Å²	138.7	71%	0.706	73%	0.73	S	S	*	*			trans	-140.6	14.6	174.6	66.7	0	0	0	0	115.3
20	Q	39.4	Very low	40	Very low	148 Å²	148	134.4 Å²	134.4	69%	0.692	72%	0.718	S	S	*	*	S	Bend	trans	-113.9	1.6	-179.1	-69.3	-170	-5.5	0	0	115.3
21	T	41.6	Very low	40.6	Very low	105 Å²	105	132.7 Å²	132.7	64%	0.644	70%	0.701	S	S	*	*	S	Bend	trans	-99	-6.9	-174.5	-20.8	0	0	0	0	114.7
22	E	40.8	Very low	41.6	Very low	171 Å²	171	124.6 Å²	124.6	80%	0.799	68%	0.684	S	S	*	*	H	α-helix	trans	-96.6	-21.4	-178.5	-63.6	-169	171.7	0	0	114
23	E	40.4	Very low	42.5	Very low	169 Å²	169	124.4 Å²	124.4	79%	0.79	68%	0.676	S	S	*	*	H	α-helix	trans	-81.8	-26.8	178.2	-76	-163.7	148.1	0	0	113.9	S27	E23-S27 WeakPolarHBondContact O-CB 3.5Å; E23-S27 PolarHBondContact O-N 3.39Å
24	E	41.4	Very low	43.2	Very low	151 Å²	151	120.3 Å²	120.3	71%	0.706	67%	0.667	S	S	*	*	H	α-helix	trans	-73.9	-35.6	176	-78.5	-159	143.2	0	0	112.8	A26 S27 E28	E24-A26 PolarHBondContact O-N 3.44Å; E24-S27 WeakPolarHBondContact O-CB 3.34Å; E24-S27 PolarHBondContact O-N 3.4Å; E24-E28 PolarHBondContact O-N 3.35Å
25	A	43.5	Very low	44.3	Very low	54 Å²	54	116.4 Å²	116.4	45%	0.446	65%	0.649	S	S	.	*	H	α-helix	trans	-71.2	-30.6	178.7	0	0	0	0	0	113.2	Q29	A25-Q29 WeakPolarHBondContact O-CG 3.47Å; A25-Q29 PolarHBondContact O-N 3.44Å
26	A	45.4	Very low	45.1	Very low	56 Å²	56	109.9 Å²	109.9	46%	0.463	63%	0.628	S	S	.	*	H	α-helix	trans	-78.3	-25.8	175.9	0	0	0	0	0	113.1	E24 K30	E24-A26 PolarHBondContact O-N 3.44Å; A26-K30 PolarHBondContact O-N 3.1Å
27	S	47.5	Very low	45.9	Very low	80 Å²	80	104.2 Å²	104.2	56%	0.559	60%	0.604	S	S	*	*	H	α-helix	trans	-71.5	-43.4	174.4	163.7	0	0	0	0	111.9	E23 E24 K30 G31	E23-S27 WeakPolarHBondContact O-CB 3.5Å; E23-S27 PolarHBondContact O-N 3.39Å; E24-S27 WeakPolarHBondContact O-CB 3.34Å; E24-S27 PolarHBondContact O-N 3.4Å; S27-K30 PolarHBondContact O-N 2.83Å; S27-G31 PolarHBondContact O-N 3.18Å; S27-G31 VanDerWaalsContact O-N 3.08Å
28	E	48.5	Very low	46.8	Very low	151 Å²	151	102.2 Å²	102.2	71%	0.706	59%	0.593	S	S	*	*	H	α-helix	trans	-70.2	-35.2	179.4	-71.2	-170.5	152.5	0	0	113.1	E24 G31 A32	E24-E28 PolarHBondContact O-N 3.35Å; E28-G31 PolarHBondContact O-N 3.47Å; E28-A32 PolarHBondContact O-N 3.19Å
29	Q	49.1	Very low	47.4	Very low	151 Å²	151	100.3 Å²	100.3	71%	0.706	58%	0.58	S	S	*	*	H	α-helix	trans	-72.4	-32.1	177.2	-71.5	-175.8	-4.5	0	0	113	A25 A33	A25-Q29 WeakPolarHBondContact O-CG 3.47Å; A25-Q29 PolarHBondContact O-N 3.44Å; Q29-A33 WeakPolarHBondContact O-CB 3.46Å; Q29-A33 PolarHBondContact O-N 3.02Å
30	K	47.5	Very low	48	Very low	167 Å²	167	99.1 Å²	99.1	73%	0.726	57%	0.568	S	S	*	*	H	α-helix	trans	-72.4	-34.6	171.5	-98	177.2	176	172	0	112.6	A26 S27 A34	A26-K30 PolarHBondContact O-N 3.1Å; S27-K30 PolarHBondContact O-N 2.83Å; K30-A34 WeakPolarHBondContact O-CB 3.29Å; K30-A34 PolarHBondContact O-N 2.78Å
31	G	44.3	Very low	48.4	Very low	41 Å²	41	97.8 Å²	97.8	42%	0.423	56%	0.56	S	S	.	*	H	α-helix	trans	-66.9	-40.6	174.5	0	0	0	0	0	113.2	S27 E28 A35	S27-G31 PolarHBondContact O-N 3.18Å; S27-G31 VanDerWaalsContact O-N 3.08Å; E28-G31 PolarHBondContact O-N 3.47Å; G31-A35 VanDerWaalsContact O-CB 3.31Å; G31-A35 WeakPolarHBondContact O-CB 3.41Å; G31-A35 PolarHBondContact O-N 3.46Å
32	A	53.2	Low	48.9	Very low	63 Å²	63	97.7 Å²	97.7	52%	0.521	55%	0.55	S	S	.	*	H	α-helix	trans	-69.7	-38.4	176.9	0	0	0	0	0	112.9	E28 A36	E28-A32 PolarHBondContact O-N 3.19Å; A32-A36 VanDerWaalsContact O-CB 3.28Å; A32-A36 WeakPolarHBondContact O-CB 3.39Å; A32-A36 PolarHBondContact O-N 3.13Å
33	A	51.4	Low	49.5	Very low	63 Å²	63	97 Å²	97	52%	0.521	55%	0.545	S	S	.	.	H	α-helix	trans	-69.6	-38.2	175.8	0	0	0	0	0	112.4	Q29 A36 D37	Q29-A33 WeakPolarHBondContact O-CB 3.46Å; Q29-A33 PolarHBondContact O-N 3.02Å; A33-A36 PolarHBondContact O-N 2.96Å; A33-D37 VanDerWaalsContact O-CB 3.3Å; A33-D37 WeakPolarHBondContact O-CB 3.46Å; A33-D37 PolarHBondContact O-N 3.32Å
34	A	52	Low	49.9	Very low	62 Å²	62	96 Å²	96	51%	0.512	54%	0.54	S	S	.	.	H	α-helix	trans	-70.1	-34.7	174.9	0	0	0	0	0	112.8	K30 D38	K30-A34 WeakPolarHBondContact O-CB 3.29Å; K30-A34 PolarHBondContact O-N 2.78Å; A34-D38 WeakPolarHBondContact O-CB 3.24Å; A34-D38 PolarHBondContact O-N 3.21Å
35	A	53.8	Low	50.8	Low	59 Å²	59	97.5 Å²	97.5	49%	0.488	54%	0.539	S	S	.	.	H	α-helix	trans	-70.9	-36.9	173.2	0	0	0	0	0	112.5	G31 E39	G31-A35 VanDerWaalsContact O-CB 3.31Å; G31-A35 WeakPolarHBondContact O-CB 3.41Å; G31-A35 PolarHBondContact O-N 3.46Å; A35-E39 WeakPolarHBondContact O-CB 3.43Å; A35-E39 WeakPolarHBondContact O-CG 3.45Å; A35-E39 PolarHBondContact O-N 2.97Å
36	A	54.4	Low	52.1	Low	54 Å²	54	104.3 Å²	104.3	45%	0.446	56%	0.559	S	S	.	*	H	α-helix	trans	-68.2	-38.6	173.8	0	0	0	0	0	112	A32 A33 E39 V40	A32-A36 VanDerWaalsContact O-CB 3.28Å; A32-A36 WeakPolarHBondContact O-CB 3.39Å; A32-A36 PolarHBondContact O-N 3.13Å; A33-A36 PolarHBondContact O-N 2.96Å; A36-E39 PolarHBondContact O-N 3.18Å; A36-V40 VanDerWaalsContact O-CG2 3.23Å; A36-V40 WeakPolarHBondContact O-CG2 3.39Å; A36-V40 PolarHBondContact O-N 3.22Å
37	D	51.7	Low	53.9	Low	80 Å²	80	104.8 Å²	104.8	43%	0.428	56%	0.558	S	S	.	*	H	α-helix	trans	-75.1	-28.6	178.3	-154.4	39.3	0	0	0	112.6	A33 K41	A33-D37 VanDerWaalsContact O-CB 3.3Å; A33-D37 WeakPolarHBondContact O-CB 3.46Å; A33-D37 PolarHBondContact O-N 3.32Å; D37-K41 VanDerWaalsContact O-CB 3.3Å; D37-K41 WeakPolarHBondContact O-CB 3.39Å; D37-K41 WeakPolarHBondContact O-CG 3.16Å; D37-K41 PolarHBondContact O-N 2.91Å; D37-K41 IonicContact OD2-NZ 2.75Å; D37-K41 PolarHBondContact OD2-NZ 2.78Å
38	D	53.2	Low	56	Low	75 Å²	75	103.9 Å²	103.9	40%	0.401	55%	0.549	S	S	.	.	H	α-helix	trans	-72.4	-36	169.6	-170.6	63	0	0	0	112.7	A34 K42	A34-D38 WeakPolarHBondContact O-CB 3.24Å; A34-D38 PolarHBondContact O-N 3.21Å; D38-K42 WeakPolarHBondContact O-CB 3.17Å; D38-K42 WeakPolarHBondContact O-CG 3.43Å; D38-K42 PolarHBondContact O-N 3.36Å; D38-K42 WeakPolarHBondContact OD2-CE 3.29Å; D38-K42 IonicContact OD2-NZ 2.73Å; D38-K42 PolarHBondContact OD2-NZ 3.33Å
39	E	54.1	Low	58.2	Low	106 Å²	106	99.2 Å²	99.2	50%	0.495	53%	0.532	S	S	.	.	H	α-helix	trans	-66.9	-36.2	172.2	-85.6	-69.9	136.4	0	0	112.2	A35 A36 K43	A35-E39 WeakPolarHBondContact O-CB 3.43Å; A35-E39 WeakPolarHBondContact O-CG 3.45Å; A35-E39 PolarHBondContact O-N 2.97Å; A36-E39 PolarHBondContact O-N 3.18Å; E39-K43 WeakPolarHBondContact O-CG 3.38Å; E39-K43 PolarHBondContact O-N 3.47Å
40	V	53.9	Low	60.5	Low	75 Å²	75	92.1 Å²	92.1	46%	0.455	50%	0.499	S	S	.	.	H	α-helix	trans	-74.5	-42.1	175.2	175.8	0	0	0	0	111.1	A36 K42 K43 E44	A36-V40 VanDerWaalsContact O-CG2 3.23Å; A36-V40 WeakPolarHBondContact O-CG2 3.39Å; A36-V40 PolarHBondContact O-N 3.22Å; V40-K42 VanDerWaalsContact C-N 3.33Å; V40-K42 PolarHBondContact O-N 3.33Å; V40-K43 WeakPolarHBondContact O-CB 3.41Å; V40-K43 PolarHBondContact O-N 3.18Å; V40-K43 VanDerWaalsContact O-N 3.1Å; V40-E44 PolarHBondContact O-N 2.99Å
41	K	49	Very low	62.9	Low	120 Å²	120	84.2 Å²	84.2	52%	0.522	47%	0.465	S	S	.	.	H	α-helix	trans	-66.9	-27.7	173.7	-81.1	171.1	178.5	140	0	113.9	D37 K43 E44	D37-K41 VanDerWaalsContact O-CB 3.3Å; D37-K41 WeakPolarHBondContact O-CB 3.39Å; D37-K41 WeakPolarHBondContact O-CG 3.16Å; D37-K41 PolarHBondContact O-N 2.91Å; D37-K41 IonicContact OD2-NZ 2.75Å; D37-K41 PolarHBondContact OD2-NZ 2.78Å; K41-K43 VanDerWaalsContact C-N 3.34Å; K41-E44 PolarHBondContact O-N 3.35Å
42	K	51.4	Low	65.4	Low	103 Å²	103	82.3 Å²	82.3	45%	0.448	45%	0.445	S	S	.	.	H	α-helix	trans	-66.9	-32.4	169.7	-90.4	172.8	-177.4	136.4	0	112.8	D38 V40 E44 R45	D38-K42 WeakPolarHBondContact O-CB 3.17Å; D38-K42 WeakPolarHBondContact O-CG 3.43Å; D38-K42 PolarHBondContact O-N 3.36Å; D38-K42 WeakPolarHBondContact OD2-CE 3.29Å; D38-K42 IonicContact OD2-NZ 2.73Å; D38-K42 PolarHBondContact OD2-NZ 3.33Å; V40-K42 VanDerWaalsContact C-N 3.33Å; V40-K42 PolarHBondContact O-N 3.33Å; K42-E44 VanDerWaalsContact C-N 3.28Å; K42-E44 PolarHBondContact O-N 2.96Å; K42-R45 PolarHBondContact O-N 2.93Å
43	K	53	Low	67.5	Low	156 Å²	156	81.9 Å²	81.9	68%	0.678	43%	0.43	S	S	*	.	H	α-helix	trans	-71.8	-21.4	176.6	-70.5	170.6	-175.3	172.8	0	113	E39 V40 K41	E39-K43 WeakPolarHBondContact O-CG 3.38Å; E39-K43 PolarHBondContact O-N 3.47Å; V40-K43 WeakPolarHBondContact O-CB 3.41Å; V40-K43 PolarHBondContact O-N 3.18Å; V40-K43 VanDerWaalsContact O-N 3.1Å; K41-K43 VanDerWaalsContact C-N 3.34Å
44	E	49.6	Very low	69.6	Low	148 Å²	148	79.1 Å²	79.1	69%	0.692	41%	0.407	S	S	*	.	T	Hydrogen-bonded Turn	trans	-89.9	-5.8	176.5	-64.9	-169.5	163.1	0	0	114.4	V40 K41 K42 K46	V40-E44 PolarHBondContact O-N 2.99Å; K41-E44 PolarHBondContact O-N 3.35Å; K42-E44 VanDerWaalsContact C-N 3.28Å; K42-E44 PolarHBondContact O-N 2.96Å; E44-K46 VanDerWaalsContact C-N 3.34Å; E44-K46 PolarHBondContact O-N 3.38Å
45	R	60.1	Low	71.6	Confident	183 Å²	183	77.2 Å²	77.2	69%	0.691	39%	0.393	S	S	*	.	S	Bend	trans	-65.4	98.7	168	-64.8	-171	-176.5	-155.2	2.8	107.7	K42 C47	K42-R45 PolarHBondContact O-N 2.93Å; R45-C47 PolarHBondContact O-N 2.9Å
46	K	70.5	Confident	73.5	Confident	197 Å²	197	78.7 Å²	78.7	86%	0.857	39%	0.39	S	S	*	.			trans	-29.1	99	177.6	-67.1	177	-178.9	176.5	0	110.7	E44 V48	E44-K46 VanDerWaalsContact C-N 3.34Å; E44-K46 PolarHBondContact O-N 3.38Å; K46-V48 PolarHBondContact O-N 2.84Å
47	C	83.4	Confident	75.3	Confident	67 Å²	67	76.4 Å²	76.4	45%	0.453	37%	0.37	S	S	.	.			trans	-62.3	113.8	-179.6	-71	0	0	0	0	107.6	R45 D111	R45-C47 PolarHBondContact O-N 2.9Å; C47-D111 HydrophobicContact CB-CB 4.46Å
48	V	92.3	Very high	77.1	Confident	60 Å²	60	72.7 Å²	72.7	36%	0.364	35%	0.35	S	S	.	.			trans	-80.4	123.8	177.2	179.2	0	0	0	0	107.2	K46 R110 K112	K46-V48 PolarHBondContact O-N 2.84Å; V48-R110 CarbonylContact C-O 3.56Å; V48-K112 HydrophobicContact CB-CD 4.05Å; V48-K112 HydrophobicContact CB-CG 4.47Å; V48-K112 HydrophobicContact CG1-CD 4.09Å; V48-K112 WeakPolarHBondContact O-CB 3.25Å; V48-K112 PolarHBondContact O-N 3.49Å
49	P	95.2	Very high	78.7	Confident	54 Å²	54	71.9 Å²	71.9	35%	0.351	35%	0.349	S	S	.	.			trans	-62.8	148.8	178.8	26.1	-33.9	0	0	0	110.9	E108 F109 R110	P49-E108 HydrophobicContact CB-CG 4.13Å; P49-F109 CarbonylContact C-O 3.12Å; P49-F109 VanDerWaalsContact CA-O 3.26Å; P49-F109 WeakPolarHBondContact CA-O 3.18Å; P49-R110 WeakPolarHBondContact CA-O 3.23Å
50	G	96.4	Very high	80.2	Confident	1 Å²	1	72.7 Å²	72.7	1%	0.01	35%	0.348	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-128.2	136.8	176.6	0	0	0	0	0	110.8	F109	G50-F109 PolarHBondContact N-O 3.44Å; G50-F109 PolarHBondContact O-N 2.9Å
51	I	97.3	Very high	81.9	Confident	2 Å²	2	69.2 Å²	69.2	1%	0.01	33%	0.327	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-105	137.1	-179.2	-63.4	174.7	0	0	0	110.1	W106 V107 E108 Y144 L145 F148 W150	I51-W106 HydrophobicContact CG2-CB 4.24Å; I51-V107 WeakPolarHBondContact CA-O 3.33Å; I51-E108 HydrophobicContact CG1-CB 4.28Å; I51-E108 HydrophobicContact CG1-CG 4.41Å; I51-Y144 WeakPolarHBondContact O-CD2 3.09Å; I51-L145 HydrophobicContact CG2-CD1 4.31Å; I51-L145 PolarHBondContact O-N 3.37Å; I51-F148 HydrophobicContact CB-CD1 3.97Å; I51-F148 HydrophobicContact CD1-CD1 3.66Å; I51-F148 HydrophobicContact CD1-CE1 3.98Å; I51-F148 HydrophobicContact CG1-CD1 4.39Å; I51-F148 HydrophobicContact CG2-CD1 3.9Å; I51-F148 HydrophobicContact CG2-CE1 4.16Å; I51-W150 HydrophobicContact CD1-CB 4.08Å; I51-W150 HydrophobicContact CD1-CE3 4.2Å
52	I	97.5	Very high	84	Confident	1 Å²	1	72.3 Å²	72.3	1%	0.005	34%	0.335	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-111.4	131.1	173.1	-60.3	-165.4	0	0	0	108.8	W106 V107 F109 A115 V118 I142 K143	I52-W106 WeakPolarHBondContact O-CA 3.32Å; I52-V107 PolarHBondContact N-O 3.05Å; I52-V107 PolarHBondContact O-N 2.98Å; I52-F109 HydrophobicContact CB-CE2 4.41Å; I52-F109 HydrophobicContact CD1-CD2 3.68Å; I52-F109 HydrophobicContact CD1-CE2 3.3Å; I52-F109 HydrophobicContact CD1-CZ 4.11Å; I52-F109 HydrophobicContact CG1-CD2 3.84Å; I52-F109 HydrophobicContact CG1-CE2 3.85Å; I52-A115 HydrophobicContact CD1-CB 4.14Å; I52-A115 VanDerWaalsContact CD1-O 3.32Å; I52-A115 WeakPolarHBondContact CD1-O 3.15Å; I52-A115 HydrophobicContact CG1-CB 3.89Å; I52-V118 HydrophobicContact CD1-CB 3.92Å; I52-V118 HydrophobicContact CD1-CG1 3.76Å; I52-I142 HydrophobicContact CB-CG2 4.42Å; I52-I142 HydrophobicContact CG2-CB 4.39Å; I52-I142 HydrophobicContact CG2-CG2 2.96Å; I52-K143 CarbonylContact C-O 3.5Å; I52-K143 WeakPolarHBondContact CA-O 3.48Å
53	Y	97.4	Very high	86	Confident	54 Å²	54	69.7 Å²	69.7	21%	0.212	33%	0.328	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-90.1	136.5	170.1	174.4	-110.9	0	0	0	110.8	G55 E104 G105 W106 I142 K143	Y53-G55 VanDerWaalsContact CE1-CA 3.47Å; Y53-E104 HydrophobicContact CE2-CB 4.04Å; Y53-E104 HydrophobicContact CE2-CG 4.24Å; Y53-E104 WeakPolarHBondContact OH-CG 3.3Å; Y53-E104 PolarHBondContact OH-OE1 3.36Å; Y53-G105 CarbonylContact C-O 3.53Å; Y53-G105 WeakPolarHBondContact CA-O 3.29Å; Y53-W106 AromaticContact CD2-CE2 3.99Å; Y53-W106 HydrophobicContact CD2-CZ2 4.37Å; Y53-W106 AromaticContact CD2-NE1 3.69Å; Y53-W106 HydrophobicContact CE2-CZ2 4.2Å; Y53-I142 CarbonylContact O-C 3.53Å; Y53-I142 WeakPolarHBondContact O-CA 3.21Å; Y53-K143 HydrophobicContact CD1-CB 4.37Å; Y53-K143 PolarHBondContact N-O 3.12Å; Y53-K143 PolarHBondContact O-N 2.77Å
54	L	96.2	Very high	87.9	Confident	4 Å²	4	69.9 Å²	69.9	2%	0.021	33%	0.329	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-110.6	109.2	173.2	-61.7	174.6	0	0	0	108.1	V57 L66 L81 E104 G105 V107 W140 N141 I142	L54-V57 HydrophobicContact CB-CG2 4.38Å; L54-L66 HydrophobicContact CD1-CD1 3.94Å; L54-L66 HydrophobicContact CD1-CD2 3.42Å; L54-L66 VanDerWaalsContact CD1-CD2 3.42Å; L54-L66 HydrophobicContact CD1-CG 4.3Å; L54-L81 HydrophobicContact CD1-CD2 4.48Å; L54-E104 WeakPolarHBondContact O-CA 3.45Å; L54-G105 PolarHBondContact N-O 3.45Å; L54-G105 PolarHBondContact O-N 3.05Å; L54-V107 HydrophobicContact CD1-CG2 3.85Å; L54-V107 HydrophobicContact CG-CG2 4.46Å; L54-W140 HydrophobicContact CD2-CE3 4.39Å; L54-W140 HydrophobicContact CD2-CZ3 4.31Å; L54-N141 WeakPolarHBondContact CA-O 3.41Å; L54-I142 HydrophobicContact CD2-CB 4.34Å; L54-I142 HydrophobicContact CD2-CD1 3.96Å; L54-I142 HydrophobicContact CD2-CG1 3.61Å; L54-I142 HydrophobicContact CD2-CG2 4.25Å
55	G	94	Very high	89.9	Confident	22 Å²	22	66.7 Å²	66.7	23%	0.227	31%	0.314	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-81.4	-17.1	-177.7	0	0	0	0	0	114.3	Y53 N141	Y53-G55 VanDerWaalsContact CE1-CA 3.47Å; G55-N141 PolarHBondContact N-O 3.29Å
56	H	92.1	Very high	91.5	Very high	90 Å²	90	58 Å²	58	42%	0.417	28%	0.281	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-141.2	129.1	176.6	176.3	-109.9	0	0	0	109.6	N141	H56-N141 HydrophobicContact CB-CB 3.9Å
57	V	92.8	Very high	92.6	Very high	7 Å²	7	52.8 Å²	52.8	4%	0.042	26%	0.256	C	S	.	.			trans	-120	115.3	179.3	179.9	0	0	0	0	109.3	L54 L61 L81 F102	L54-V57 HydrophobicContact CB-CG2 4.38Å; V57-L61 HydrophobicContact CG1-CB 3.92Å; V57-L61 HydrophobicContact CG1-CD2 3.96Å; V57-L61 HydrophobicContact CG1-CG 4.42Å; V57-L81 HydrophobicContact CG1-CD1 4.42Å; V57-L81 HydrophobicContact CG2-CD2 4.26Å; V57-F102 HydrophobicContact CB-CB 4.04Å; V57-F102 HydrophobicContact CG1-CB 3.83Å; V57-F102 HydrophobicContact CG1-CD2 4.43Å; V57-F102 HydrophobicContact CG2-CB 4.44Å
58	P	89.9	Confident	93.1	Very high	1 Å²	1	54.4 Å²	54.4	1%	0.006	26%	0.261	C	S	.	.			trans	-57.2	148.7	179.5	-31.8	36.8	0	0	0	114.7	R60 L61 M127 F135 D138	P58-R60 PolarHBondContact O-N 3.44Å; P58-L61 VanDerWaalsContact O-CB 3.23Å; P58-L61 WeakPolarHBondContact O-CB 3.36Å; P58-L61 PolarHBondContact O-N 2.93Å; P58-M127 HydrophobicContact CG-SD 3.52Å; P58-M127 VanDerWaalsContact CG-SD 3.52Å; P58-F135 HydrophobicContact CB-CD1 3.66Å; P58-F135 HydrophobicContact CB-CE1 3.92Å; P58-F135 HydrophobicContact CG-CD1 4.37Å; P58-D138 HydrophobicContact CB-CB 4.39Å; P58-D138 WeakPolarHBondContact CB-OD2 3.48Å; P58-D138 HydrophobicContact CG-CB 3.71Å
59	P	87.4	Confident	93.1	Very high	59 Å²	59	53.8 Å²	53.8	38%	0.383	26%	0.255	S	S	.	.	T	Hydrogen-bonded Turn	trans	-57.2	133.7	177.4	-22.5	31.5	0	0	0	111.9	L61 F135	P59-L61 PolarHBondContact O-N 2.91Å; P59-F135 WeakPolarHBondContact O-CE1 3.37Å
60	R	85.9	Confident	93	Very high	123 Å²	123	51.3 Å²	51.3	46%	0.464	24%	0.239	S	C	.	.	T	Hydrogen-bonded Turn	trans	70.6	6.1	-176	-45.8	165.2	-69.4	-107.9	-1.2	115.3	P58 R62	P58-R60 PolarHBondContact O-N 3.44Å; R60-R62 PolarHBondContact O-N 3.16Å
61	L	89.4	Confident	92.9	Very high	2 Å²	2	54.7 Å²	54.7	1%	0.01	26%	0.262	C	S	.	.			trans	-68.9	123.4	169.8	-169.1	70.3	0	0	0	109.2	V57 P58 P59 H65 L66 F102 M127 F135	V57-L61 HydrophobicContact CG1-CB 3.92Å; V57-L61 HydrophobicContact CG1-CD2 3.96Å; V57-L61 HydrophobicContact CG1-CG 4.42Å; P58-L61 VanDerWaalsContact O-CB 3.23Å; P58-L61 WeakPolarHBondContact O-CB 3.36Å; P58-L61 PolarHBondContact O-N 2.93Å; P59-L61 PolarHBondContact O-N 2.91Å; L61-H65 HydrophobicContact CD1-CB 4.13Å; L61-L66 HydrophobicContact CD2-CB 4.39Å; L61-L66 HydrophobicContact CD2-CD1 4.37Å; L61-F102 WeakPolarHBondContact O-CD2 3.47Å; L61-F102 WeakPolarHBondContact O-CE2 3.44Å; L61-M127 HydrophobicContact CD1-CE 4.34Å; L61-M127 HydrophobicContact CD2-CE 3.94Å; L61-F135 HydrophobicContact CB-CE1 4.49Å; L61-F135 HydrophobicContact CB-CZ 4.3Å; L61-F135 HydrophobicContact CD1-CD2 4.22Å; L61-F135 HydrophobicContact CD1-CE2 3.78Å; L61-F135 HydrophobicContact CD1-CZ 4Å
62	R	91.6	Very high	92.7	Very high	185 Å²	185	58.9 Å²	58.9	70%	0.698	30%	0.297	S	S	*	.			trans	-103.7	153.3	177.3	-65.1	-171.2	-176.8	-179.9	2	110.5	R60 K64 H65 L66	R60-R62 PolarHBondContact O-N 3.16Å; R62-K64 PolarHBondContact O-N 3.5Å; R62-K64 VanDerWaalsContact O-N 3.12Å; R62-H65 PolarHBondContact O-N 3.35Å; R62-L66 PolarHBondContact O-N 2.91Å
63	P	93.2	Very high	92.5	Very high	47 Å²	47	64.3 Å²	64.3	31%	0.305	32%	0.318	S	S	.	.	H	α-helix	trans	-52.8	-36.7	176.4	-27.1	34	0	0	0	113.9	L66 R67 I79 L81	P63-L66 PolarHBondContact O-N 2.92Å; P63-R67 WeakPolarHBondContact O-CB 3.27Å; P63-R67 PolarHBondContact O-N 2.92Å; P63-I79 HydrophobicContact CB-CB 4.48Å; P63-I79 HydrophobicContact CB-CG2 3.96Å; P63-L81 HydrophobicContact CB-CD1 4.46Å; P63-L81 HydrophobicContact CG-CD1 3.73Å; P63-L81 HydrophobicContact CG-CG 4.07Å
64	K	93.6	Very high	92.4	Very high	161 Å²	161	62.7 Å²	62.7	70%	0.7	32%	0.318	S	S	*	.	H	α-helix	trans	-64.4	-39.6	176.1	-171.1	176.2	-177.8	177.6	0	112.7	R62 R67 N68	R62-K64 PolarHBondContact O-N 3.5Å; R62-K64 VanDerWaalsContact O-N 3.12Å; K64-R67 WeakPolarHBondContact O-CB 3.39Å; K64-R67 PolarHBondContact O-N 3.31Å; K64-N68 PolarHBondContact O-N 2.66Å; K64-N68 VanDerWaalsContact O-N 3.14Å; K64-N68 PolarHBondContact O-OD1 3.05Å
65	H	92.1	Very high	92.4	Very high	80 Å²	80	68.1 Å²	68.1	37%	0.37	34%	0.344	S	S	.	.	H	α-helix	trans	-70.7	-41.7	178.7	-161	77.7	0	0	0	110.9	L61 R62 R67 N68 L69 F135	L61-H65 HydrophobicContact CD1-CB 4.13Å; R62-H65 PolarHBondContact O-N 3.35Å; H65-R67 VanDerWaalsContact C-N 3.31Å; H65-R67 PolarHBondContact O-N 2.88Å; H65-N68 PolarHBondContact O-N 2.98Å; H65-L69 PolarHBondContact O-N 3.37Å; H65-F135 AromaticContact CD2-CE2 3.66Å; H65-F135 AromaticContact NE2-CD2 3.91Å; H65-F135 AromaticContact NE2-CE2 3.68Å
66	L	92.8	Very high	92.5	Very high	0 Å²	0	68.2 Å²	68.2	0%	0	34%	0.339	C	S	.	.	H	α-helix	trans	-58.8	-42.6	173.5	178.5	60.7	0	0	0	111.9	L54 L61 R62 P63 N68 L69 L70 I79 L81 V107 W140	L54-L66 HydrophobicContact CD1-CD1 3.94Å; L54-L66 HydrophobicContact CD1-CD2 3.42Å; L54-L66 VanDerWaalsContact CD1-CD2 3.42Å; L54-L66 HydrophobicContact CD1-CG 4.3Å; L61-L66 HydrophobicContact CD2-CB 4.39Å; L61-L66 HydrophobicContact CD2-CD1 4.37Å; R62-L66 PolarHBondContact O-N 2.91Å; P63-L66 PolarHBondContact O-N 2.92Å; L66-N68 PolarHBondContact O-N 3.34Å; L66-L69 PolarHBondContact O-N 3.42Å; L66-L70 HydrophobicContact CD1-CD1 3.6Å; L66-L70 HydrophobicContact CD1-CG 4.08Å; L66-L70 HydrophobicContact CG-CD1 4.09Å; L66-L70 WeakPolarHBondContact O-CB 3.48Å; L66-L70 PolarHBondContact O-N 3.22Å; L66-I79 HydrophobicContact CD2-CG2 3.94Å; L66-L81 HydrophobicContact CD2-CD2 3.89Å; L66-V107 HydrophobicContact CD2-CG2 3.73Å; L66-V107 HydrophobicContact CG-CG2 4.29Å; L66-W140 HydrophobicContact CD1-CH2 3.65Å; L66-W140 HydrophobicContact CD1-CZ3 3.65Å
67	R	95.3	Very high	92.6	Very high	89 Å²	89	65.4 Å²	65.4	34%	0.336	33%	0.334	S	S	.	.	H	α-helix	trans	-55.7	-51	172.9	-172.9	178.4	-67	-79.6	-3.3	111.1	P63 K64 H65 L69 L70 S71 I76 G77 I79	P63-R67 WeakPolarHBondContact O-CB 3.27Å; P63-R67 PolarHBondContact O-N 2.92Å; K64-R67 WeakPolarHBondContact O-CB 3.39Å; K64-R67 PolarHBondContact O-N 3.31Å; H65-R67 VanDerWaalsContact C-N 3.31Å; H65-R67 PolarHBondContact O-N 2.88Å; R67-L69 VanDerWaalsContact C-N 3.34Å; R67-L69 PolarHBondContact O-N 3.11Å; R67-L70 PolarHBondContact O-N 3.47Å; R67-S71 WeakPolarHBondContact O-CB 3.26Å; R67-S71 PolarHBondContact O-N 3.47Å; R67-I76 HydrophobicContact CB-CD1 4.46Å; R67-I76 HydrophobicContact CG-CD1 4.03Å; R67-I76 PolarHBondContact NH1-O 2.99Å; R67-I76 WeakPolarHBondContact O-CD1 3.47Å; R67-G77 PolarHBondContact NH1-O 3.48Å; R67-G77 VanDerWaalsContact NH1-O 3.08Å; R67-G77 PolarHBondContact NH2-O 2.98Å; R67-I79 HydrophobicContact CB-CD1 3.64Å; R67-I79 HydrophobicContact CG-CD1 4.23Å
68	N	93.4	Very high	92.7	Very high	101 Å²	101	70.5 Å²	70.5	54%	0.54	35%	0.353	S	S	.	.	H	α-helix	trans	-61.8	-41.2	-178.4	-67.1	2.8	0	0	0	112.3	K64 H65 L66	K64-N68 PolarHBondContact O-N 2.66Å; K64-N68 VanDerWaalsContact O-N 3.14Å; K64-N68 PolarHBondContact O-OD1 3.05Å; H65-N68 PolarHBondContact O-N 2.98Å; L66-N68 PolarHBondContact O-N 3.34Å
69	L	92.1	Very high	93.1	Very high	47 Å²	47	71.8 Å²	71.8	25%	0.246	36%	0.359	C	S	.	.	H	α-helix	trans	-63.8	-44.4	177.9	-101.3	63.5	0	0	0	112.1	H65 L66 R67 M127 W140	H65-L69 PolarHBondContact O-N 3.37Å; L66-L69 PolarHBondContact O-N 3.42Å; R67-L69 VanDerWaalsContact C-N 3.34Å; R67-L69 PolarHBondContact O-N 3.11Å; L69-M127 HydrophobicContact CD2-CE 3.86Å; L69-W140 HydrophobicContact CB-CH2 4.29Å; L69-W140 HydrophobicContact CB-CZ2 4.21Å; L69-W140 HydrophobicContact CD2-CH2 4.08Å; L69-W140 HydrophobicContact CD2-CZ2 3.77Å; L69-W140 HydrophobicContact CG-CZ2 4.46Å
70	L	93.3	Very high	93.4	Very high	2 Å²	2	72 Å²	72	1%	0.01	35%	0.354	C	S	.	.	H	α-helix	trans	-84.4	-17.9	-175.6	-69.4	177.2	0	0	0	113.1	L66 R67 A72 Y73 I76 V107 F109 V118 L122 W140	L66-L70 HydrophobicContact CD1-CD1 3.6Å; L66-L70 HydrophobicContact CD1-CG 4.08Å; L66-L70 HydrophobicContact CG-CD1 4.09Å; L66-L70 WeakPolarHBondContact O-CB 3.48Å; L66-L70 PolarHBondContact O-N 3.22Å; R67-L70 PolarHBondContact O-N 3.47Å; L70-A72 PolarHBondContact O-N 3.28Å; L70-A72 VanDerWaalsContact O-N 3.16Å; L70-Y73 HydrophobicContact CD2-CD2 4.45Å; L70-Y73 PolarHBondContact O-N 2.92Å; L70-I76 HydrophobicContact CB-CD1 3.49Å; L70-I76 VanDerWaalsContact CB-CD1 3.49Å; L70-I76 HydrophobicContact CB-CG1 4.37Å; L70-V107 HydrophobicContact CD1-CB 4.46Å; L70-V107 HydrophobicContact CD1-CG1 4.04Å; L70-V107 HydrophobicContact CD1-CG2 4.11Å; L70-F109 HydrophobicContact CB-CZ 4.12Å; L70-F109 HydrophobicContact CD1-CZ 4.25Å; L70-V118 HydrophobicContact CD2-CG1 4.22Å; L70-L122 HydrophobicContact CD2-CD1 3.64Å; L70-W140 HydrophobicContact CD2-CH2 3.92Å; L70-W140 HydrophobicContact CD2-CZ2 4.19Å; L70-W140 HydrophobicContact CD2-CZ3 4.48Å; L70-W140 HydrophobicContact CG-CH2 4.05Å
71	S	94.6	Very high	93.9	Very high	72 Å²	72	66.5 Å²	66.5	50%	0.503	33%	0.334	S	S	.	.	T	Hydrogen-bonded Turn	trans	-64.5	-20.7	-177.6	-171.4	0	0	0	0	112.5	R67 Y73	R67-S71 WeakPolarHBondContact O-CB 3.26Å; R67-S71 PolarHBondContact O-N 3.47Å; S71-Y73 PolarHBondContact O-N 3.44Å
72	A	92.5	Very high	94.1	Very high	90 Å²	90	69.1 Å²	69.1	74%	0.744	35%	0.346	S	S	*	.	T	Hydrogen-bonded Turn	trans	-67	-22.3	174.1	0	0	0	0	0	113	L70	L70-A72 PolarHBondContact O-N 3.28Å; L70-A72 VanDerWaalsContact O-N 3.16Å
73	Y	93.7	Very high	94.1	Very high	114 Å²	114	63.1 Å²	63.1	45%	0.447	33%	0.331	S	S	.	.	T	Hydrogen-bonded Turn	trans	-98.4	-20.5	-177.3	-57.4	-85.2	0	0	0	113.2	L70 S71 V114 V118 L122	L70-Y73 HydrophobicContact CD2-CD2 4.45Å; L70-Y73 PolarHBondContact O-N 2.92Å; S71-Y73 PolarHBondContact O-N 3.44Å; Y73-V114 VanDerWaalsContact O-CG1 3.24Å; Y73-V114 WeakPolarHBondContact O-CG1 3.21Å; Y73-V118 HydrophobicContact CD1-CG2 4.49Å; Y73-V118 HydrophobicContact CG-CG2 4.08Å; Y73-L122 HydrophobicContact CD2-CD1 4.11Å; Y73-L122 HydrophobicContact CE1-CD2 4.24Å; Y73-L122 HydrophobicContact CE2-CD1 3.76Å; Y73-L122 HydrophobicContact CE2-CD2 4.34Å
74	G	94.5	Very high	94	Very high	21 Å²	21	61.7 Å²	61.7	22%	0.216	32%	0.32	C	S	.	.	S	Bend	trans	166.7	-179.3	174.2	0	0	0	0	0	113.9	I76	G74-I76 PolarHBondContact O-N 3.35Å
75	E	95.5	Very high	93.9	Very high	118 Å²	118	58.6 Å²	58.6	55%	0.551	31%	0.312	S	S	*	.			trans	-72.2	124.1	-178.9	-67.3	-177.4	-158	0	0	112.2	R110	E75-R110 HydrophobicContact CB-CB 4.1Å; E75-R110 PolarHBondContact O-N 3.27Å; E75-R110 WeakPolarHBondContact OE2-CD 3.38Å; E75-R110 IonicContact OE2-CZ 2.84Å; E75-R110 IonicContact OE2-NE 2.83Å; E75-R110 IonicContact OE2-NH1 3.19Å; E75-R110 PolarHBondContact OE2-NH1 3.22Å
76	I	96.5	Very high	93.7	Very high	23 Å²	23	63.5 Å²	63.5	12%	0.118	33%	0.327	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-102.4	127.6	-179.1	-56.1	164.9	0	0	0	109.8	R67 L70 G74 I79 V107 F109	R67-I76 HydrophobicContact CB-CD1 4.46Å; R67-I76 HydrophobicContact CG-CD1 4.03Å; R67-I76 PolarHBondContact NH1-O 2.99Å; R67-I76 WeakPolarHBondContact O-CD1 3.47Å; L70-I76 HydrophobicContact CB-CD1 3.49Å; L70-I76 VanDerWaalsContact CB-CD1 3.49Å; L70-I76 HydrophobicContact CB-CG1 4.37Å; G74-I76 PolarHBondContact O-N 3.35Å; I76-I79 HydrophobicContact CG2-CD1 3.87Å; I76-I79 HydrophobicContact CG2-CG1 3.78Å; I76-V107 HydrophobicContact CG2-CG1 3.72Å; I76-F109 HydrophobicContact CG1-CD1 4.49Å; I76-F109 HydrophobicContact CG1-CE1 4.13Å; I76-F109 HydrophobicContact CG1-CZ 4.44Å
77	G	94.5	Very high	93.5	Very high	31 Å²	31	67.7 Å²	67.7	32%	0.32	35%	0.346	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-84.8	-113.2	170.4	0	0	0	0	0	111.4	R67 E108	R67-G77 PolarHBondContact NH1-O 3.48Å; R67-G77 VanDerWaalsContact NH1-O 3.08Å; R67-G77 PolarHBondContact NH2-O 2.98Å; G77-E108 PolarHBondContact N-O 3.5Å
78	R	95.7	Very high	93.1	Very high	115 Å²	115	66.6 Å²	66.6	43%	0.434	35%	0.349	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-82.1	146.8	-176.3	-65.4	171.3	-75.7	-163.7	-5.7	112.3	E108 W150	R78-E108 HydrophobicContact CB-CB 4.36Å; R78-E108 WeakPolarHBondContact CB-OE2 3.43Å; R78-E108 WeakPolarHBondContact CG-OE2 3.43Å; R78-E108 IonicContact CZ-OE1 3.37Å; R78-E108 IonicContact CZ-OE2 3.57Å; R78-E108 PolarHBondContact N-OE2 3.01Å; R78-E108 IonicContact NE-OE1 3.59Å; R78-E108 IonicContact NE-OE2 3.48Å; R78-E108 PolarHBondContact NE-OE2 3.21Å; R78-E108 IonicContact NH2-OE1 2.66Å; R78-E108 PolarHBondContact NH2-OE1 3.2Å; R78-E108 IonicContact NH2-OE2 2.7Å; R78-E108 PolarHBondContact NH2-OE2 3.05Å; R78-E108 PolarHBondContact O-N 3.22Å; R78-W150 HydrophobicContact CB-CD2 3.89Å; R78-W150 HydrophobicContact CB-CE3 3.83Å; R78-W150 HydrophobicContact CB-CH2 3.55Å; R78-W150 HydrophobicContact CB-CZ2 3.63Å; R78-W150 HydrophobicContact CB-CZ3 3.67Å; R78-W150 VanDerWaalsContact CZ-CB 3.4Å; R78-W150 VanDerWaalsContact NH1-CD1 3.26Å; R78-W150 VanDerWaalsContact NH2-CB 3.27Å
79	I	96.7	Very high	92.8	Very high	28 Å²	28	67.6 Å²	67.6	14%	0.144	35%	0.346	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-133.8	129.1	175.8	-57	174.7	0	0	0	107.8	P63 L66 R67 I76 L81 W106 V107	P63-I79 HydrophobicContact CB-CB 4.48Å; P63-I79 HydrophobicContact CB-CG2 3.96Å; L66-I79 HydrophobicContact CD2-CG2 3.94Å; R67-I79 HydrophobicContact CB-CD1 3.64Å; R67-I79 HydrophobicContact CG-CD1 4.23Å; I76-I79 HydrophobicContact CG2-CD1 3.87Å; I76-I79 HydrophobicContact CG2-CG1 3.78Å; I79-L81 HydrophobicContact CG2-CD2 4.49Å; I79-L81 HydrophobicContact CG2-CG 4.45Å; I79-W106 WeakPolarHBondContact CA-O 3.19Å; I79-V107 HydrophobicContact CG1-CG1 4.31Å; I79-V107 HydrophobicContact CG2-CG2 4.33Å
80	F	95.6	Very high	92.6	Very high	63 Å²	63	73.1 Å²	73.1	28%	0.276	36%	0.363	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-131.6	128.9	176.3	179.3	-109.2	0	0	0	107.8	G105 W106 W150 L153 L157	F80-G105 CarbonylContact O-C 3.47Å; F80-G105 VanDerWaalsContact O-CA 3.27Å; F80-G105 WeakPolarHBondContact O-CA 3.28Å; F80-W106 AromaticContact CD1-CE3 3.45Å; F80-W106 HydrophobicContact CD1-CE3 3.45Å; F80-W106 VanDerWaalsContact CD1-CE3 3.45Å; F80-W106 AromaticContact CD1-CZ3 3.54Å; F80-W106 HydrophobicContact CD1-CZ3 3.54Å; F80-W106 HydrophobicContact CE1-CE3 4.1Å; F80-W106 AromaticContact CE1-CZ3 3.68Å; F80-W106 HydrophobicContact CE1-CZ3 3.68Å; F80-W106 HydrophobicContact CG-CE3 4.45Å; F80-W106 PolarHBondContact N-O 2.95Å; F80-W106 PolarHBondContact O-N 3.23Å; F80-W150 HydrophobicContact CB-CH2 3.45Å; F80-W150 VanDerWaalsContact CB-CH2 3.45Å; F80-W150 HydrophobicContact CB-CZ2 3.75Å; F80-L153 HydrophobicContact CB-CD2 4.35Å; F80-L153 HydrophobicContact CD1-CD2 4.05Å; F80-L157 HydrophobicContact CD1-CD1 4.17Å; F80-L157 HydrophobicContact CE1-CD1 3.52Å; F80-L157 HydrophobicContact CZ-CD1 3.73Å
81	L	95.1	Very high	92.4	Very high	8 Å²	8	80.6 Å²	80.6	4%	0.042	40%	0.395	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-118.1	122.8	174.8	-60.8	-177	0	0	0	107.5	L54 V57 P63 L66 I79 P83 F102 E104	L54-L81 HydrophobicContact CD1-CD2 4.48Å; V57-L81 HydrophobicContact CG1-CD1 4.42Å; V57-L81 HydrophobicContact CG2-CD2 4.26Å; P63-L81 HydrophobicContact CB-CD1 4.46Å; P63-L81 HydrophobicContact CG-CD1 3.73Å; P63-L81 HydrophobicContact CG-CG 4.07Å; L66-L81 HydrophobicContact CD2-CD2 3.89Å; I79-L81 HydrophobicContact CG2-CD2 4.49Å; I79-L81 HydrophobicContact CG2-CG 4.45Å; L81-P83 VanDerWaalsContact O-CD 3.31Å; L81-P83 WeakPolarHBondContact O-CD 3.39Å; L81-F102 HydrophobicContact CB-CB 4.01Å; L81-F102 HydrophobicContact CB-CD1 3.33Å; L81-F102 HydrophobicContact CB-CD2 4.23Å; L81-F102 HydrophobicContact CB-CE1 3.77Å; L81-F102 HydrophobicContact CB-CG 3.59Å; L81-F102 HydrophobicContact CB-CZ 4.38Å; L81-F102 HydrophobicContact CD1-CD1 4.42Å; L81-F102 HydrophobicContact CD1-CD2 3.82Å; L81-F102 HydrophobicContact CD1-CE2 4.06Å; L81-F102 HydrophobicContact CD1-CG 4.02Å; L81-F102 HydrophobicContact CD1-CZ 4.46Å; L81-F102 HydrophobicContact CG-CG 4.44Å; L81-F102 WeakPolarHBondContact O-CD1 3.36Å; L81-E104 CarbonylContact C-O 3.56Å; L81-E104 WeakPolarHBondContact CA-O 3.29Å
82	Q	94.1	Very high	92.1	Very high	56 Å²	56	80.1 Å²	80.1	26%	0.262	38%	0.384	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-66.1	115.3	176.9	-169.8	87.4	6.1	0	0	108.1	F102 T103 E104 W106	Q82-F102 CarbonylContact O-C 3.59Å; Q82-F102 WeakPolarHBondContact O-CA 3.41Å; Q82-F102 WeakPolarHBondContact O-CB 3.4Å; Q82-T103 PolarHBondContact O-N 3.37Å; Q82-E104 HydrophobicContact CB-CB 4.1Å; Q82-E104 PolarHBondContact N-O 2.84Å; Q82-W106 HydrophobicContact CB-CH2 4.21Å; Q82-W106 HydrophobicContact CB-CZ3 3.89Å
83	P	92.3	Very high	91.9	Very high	60 Å²	60	81.5 Å²	81.5	39%	0.39	37%	0.373	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-66.3	150.7	172	29.4	-33.3	0	0	0	109.8	L81 F102	L81-P83 VanDerWaalsContact O-CD 3.31Å; L81-P83 WeakPolarHBondContact O-CD 3.39Å; P83-F102 HydrophobicContact CB-CD1 4.48Å
84	E	90.9	Very high	91.7	Very high	16 Å²	16	85.5 Å²	85.5	8%	0.075	39%	0.393	C	S	.	.	P	Polyproline II helix	trans	-54.6	156.5	171.5	68.8	178.2	177	0	0	112.6	R86 V88 R89 K92 D101 T103	E84-R86 PolarHBondContact O-N 2.96Å; E84-V88 WeakPolarHBondContact OE2-CG1 3.28Å; E84-R89 HydrophobicContact CG-CB 4.08Å; E84-R89 WeakPolarHBondContact OE1-CA 3.3Å; E84-R89 WeakPolarHBondContact OE1-CB 3.42Å; E84-K92 IonicContact OE1-NZ 3.91Å; E84-K92 WeakPolarHBondContact OE2-CE 3.35Å; E84-K92 IonicContact OE2-NZ 2.68Å; E84-K92 PolarHBondContact OE2-NZ 3.37Å; E84-D101 PolarHBondContact N-O 3.43Å; E84-T103 HydrophobicContact CB-CG2 4.29Å
85	D	90.4	Very high	91.4	Very high	97 Å²	97	89.5 Å²	89.5	52%	0.519	42%	0.418	S	S	.	.	P	Polyproline II helix	trans	-55.4	142.3	179.1	178.3	38.7	0	0	0	112	Q87 V88 R89	D85-Q87 PolarHBondContact O-N 2.69Å; D85-Q87 VanDerWaalsContact O-N 3.15Å; D85-Q87 VanDerWaalsContact OD2-CB 3.31Å; D85-Q87 WeakPolarHBondContact OD2-CB 3.45Å; D85-Q87 WeakPolarHBondContact OD2-CG 3.47Å; D85-Q87 PolarHBondContact OD2-N 2.9Å; D85-V88 HydrophobicContact CB-CG2 4.33Å; D85-V88 PolarHBondContact O-N 3.46Å; D85-V88 VanDerWaalsContact O-N 3.1Å; D85-R89 PolarHBondContact O-N 3.5Å
86	R	87.7	Confident	91	Very high	183 Å²	183	87 Å²	87	69%	0.691	42%	0.423	S	S	*	.	H	α-helix	trans	-57.7	-32.9	-177	-175.7	172.9	177.5	-106	3.7	111.7	E84 R90	E84-R86 PolarHBondContact O-N 2.96Å; R86-R90 WeakPolarHBondContact O-CB 3.47Å; R86-R90 PolarHBondContact O-N 2.94Å
87	Q	88.3	Confident	90.4	Very high	88 Å²	88	87.6 Å²	87.6	41%	0.411	43%	0.43	S	S	.	.	H	α-helix	trans	-69.4	-44.9	178.2	-57.8	-59.3	-33.5	0	0	111.8	D85 R89 R90 K91	D85-Q87 PolarHBondContact O-N 2.69Å; D85-Q87 VanDerWaalsContact O-N 3.15Å; D85-Q87 VanDerWaalsContact OD2-CB 3.31Å; D85-Q87 WeakPolarHBondContact OD2-CB 3.45Å; D85-Q87 WeakPolarHBondContact OD2-CG 3.47Å; D85-Q87 PolarHBondContact OD2-N 2.9Å; Q87-R89 VanDerWaalsContact C-N 3.33Å; Q87-R89 PolarHBondContact O-N 3.34Å; Q87-R90 PolarHBondContact O-N 3.06Å; Q87-K91 WeakPolarHBondContact O-CG 3.38Å; Q87-K91 PolarHBondContact O-N 2.98Å
88	V	87.5	Confident	89.5	Confident	65 Å²	65	95.2 Å²	95.2	39%	0.394	45%	0.449	S	S	.	.	H	α-helix	trans	-60.7	-46.5	176.2	-179.9	0	0	0	0	109.9	E84 D85 R90 K91 K92	E84-V88 WeakPolarHBondContact OE2-CG1 3.28Å; D85-V88 HydrophobicContact CB-CG2 4.33Å; D85-V88 PolarHBondContact O-N 3.46Å; D85-V88 VanDerWaalsContact O-N 3.1Å; V88-R90 VanDerWaalsContact C-N 3.3Å; V88-R90 PolarHBondContact O-N 2.95Å; V88-K91 PolarHBondContact O-N 3.12Å; V88-K92 HydrophobicContact CG1-CD 4.4Å; V88-K92 PolarHBondContact O-N 3.42Å
89	R	86.8	Confident	88.8	Confident	123 Å²	123	97.3 Å²	97.3	46%	0.464	46%	0.457	S	S	.	.	H	α-helix	trans	-60.1	-39	175.9	-169.1	175	169.8	-171.2	-1.6	112.6	E84 D85 Q87 K92 K93 C100	E84-R89 HydrophobicContact CG-CB 4.08Å; E84-R89 WeakPolarHBondContact OE1-CA 3.3Å; E84-R89 WeakPolarHBondContact OE1-CB 3.42Å; D85-R89 PolarHBondContact O-N 3.5Å; Q87-R89 VanDerWaalsContact C-N 3.33Å; Q87-R89 PolarHBondContact O-N 3.34Å; R89-K92 PolarHBondContact O-N 3.09Å; R89-K93 WeakPolarHBondContact O-CB 3.36Å; R89-K93 PolarHBondContact O-N 3.29Å; R89-C100 PolarHBondContact NE-SG 2.95Å; R89-C100 PolarHBondContact NH2-SG 3.49Å
90	R	88.2	Confident	87.9	Confident	162 Å²	162	98.2 Å²	98.2	61%	0.611	47%	0.465	S	S	*	.	H	α-helix	trans	-66.6	-40.7	177.2	-163.2	174.3	80.3	165.2	3.7	111.6	R86 Q87 V88 K93 K94	R86-R90 WeakPolarHBondContact O-CB 3.47Å; R86-R90 PolarHBondContact O-N 2.94Å; Q87-R90 PolarHBondContact O-N 3.06Å; V88-R90 VanDerWaalsContact C-N 3.3Å; V88-R90 PolarHBondContact O-N 2.95Å; R90-K93 PolarHBondContact O-N 3.44Å; R90-K94 PolarHBondContact O-N 3.34Å
91	K	89.7	Confident	87.5	Confident	159 Å²	159	96.8 Å²	96.8	69%	0.691	46%	0.46	S	S	*	.	H	α-helix	trans	-62.9	-47.8	174.3	-71.1	178.6	-179.9	-178.6	0	111.3	Q87 V88 K93 K94 S95	Q87-K91 WeakPolarHBondContact O-CG 3.38Å; Q87-K91 PolarHBondContact O-N 2.98Å; V88-K91 PolarHBondContact O-N 3.12Å; K91-K93 VanDerWaalsContact C-N 3.32Å; K91-K93 PolarHBondContact O-N 3.32Å; K91-K94 WeakPolarHBondContact O-CB 3.35Å; K91-K94 PolarHBondContact O-N 2.87Å; K91-K94 VanDerWaalsContact O-N 3.13Å; K91-S95 PolarHBondContact O-N 3.4Å
92	K	87.3	Confident	87.4	Confident	62 Å²	62	98.6 Å²	98.6	27%	0.27	47%	0.468	S	S	.	.	H	α-helix	trans	-58.3	-43.2	175.4	-76.5	179.2	175.8	174.8	0	112.1	E84 V88 R89 K94 S95 G96 S97 D101	E84-K92 IonicContact OE1-NZ 3.91Å; E84-K92 WeakPolarHBondContact OE2-CE 3.35Å; E84-K92 IonicContact OE2-NZ 2.68Å; E84-K92 PolarHBondContact OE2-NZ 3.37Å; V88-K92 HydrophobicContact CG1-CD 4.4Å; V88-K92 PolarHBondContact O-N 3.42Å; R89-K92 PolarHBondContact O-N 3.09Å; K92-K94 VanDerWaalsContact C-N 3.32Å; K92-K94 PolarHBondContact O-N 2.94Å; K92-S95 CarbonylContact O-C 3.6Å; K92-S95 WeakPolarHBondContact O-CA 3.46Å; K92-S95 WeakPolarHBondContact O-CB 3.24Å; K92-S95 PolarHBondContact O-N 2.94Å; K92-S95 VanDerWaalsContact O-N 3.1Å; K92-G96 PolarHBondContact O-N 3.28Å; K92-S97 CarbonylContact C-O 3.54Å; K92-S97 PolarHBondContact O-N 3.49Å; K92-S97 VanDerWaalsContact O-O 3.12Å; K92-D101 IonicContact NZ-OD2 2.72Å; K92-D101 PolarHBondContact NZ-OD2 2.9Å
93	K	88.4	Confident	87.4	Confident	119 Å²	119	99.1 Å²	99.1	52%	0.517	48%	0.475	S	S	.	.	H	α-helix	trans	-62.4	-38.6	176.5	-173.5	175.3	178.6	-175	0	112.1	R89 R90 K91 S95 G96 S97	R89-K93 WeakPolarHBondContact O-CB 3.36Å; R89-K93 PolarHBondContact O-N 3.29Å; R90-K93 PolarHBondContact O-N 3.44Å; K91-K93 VanDerWaalsContact C-N 3.32Å; K91-K93 PolarHBondContact O-N 3.32Å; K93-S95 VanDerWaalsContact C-N 3.29Å; K93-S95 PolarHBondContact O-N 3.07Å; K93-G96 PolarHBondContact O-N 3.26Å; K93-G96 VanDerWaalsContact O-N 3.13Å; K93-S97 VanDerWaalsContact CA-O 3.28Å; K93-S97 WeakPolarHBondContact CA-O 3.4Å; K93-S97 PolarHBondContact N-O 2.69Å
94	K	90.4	Very high	87.5	Confident	198 Å²	198	99.6 Å²	99.6	86%	0.861	47%	0.472	S	S	*	.	H	α-helix	trans	-65.1	-34	174.2	-168.5	176.1	-178.5	-178.8	0	112	R90 K91 K92 G96	R90-K94 PolarHBondContact O-N 3.34Å; K91-K94 WeakPolarHBondContact O-CB 3.35Å; K91-K94 PolarHBondContact O-N 2.87Å; K91-K94 VanDerWaalsContact O-N 3.13Å; K92-K94 VanDerWaalsContact C-N 3.32Å; K92-K94 PolarHBondContact O-N 2.94Å; K94-G96 PolarHBondContact O-N 3.44Å
95	S	87.9	Confident	87.7	Confident	106 Å²	106	98.9 Å²	98.9	74%	0.741	47%	0.469	S	S	*	.	T	Hydrogen-bonded Turn	trans	-77.7	3	173.1	-172.4	0	0	0	0	114.1	K91 K92 K93	K91-S95 PolarHBondContact O-N 3.4Å; K92-S95 CarbonylContact O-C 3.6Å; K92-S95 WeakPolarHBondContact O-CA 3.46Å; K92-S95 WeakPolarHBondContact O-CB 3.24Å; K92-S95 PolarHBondContact O-N 2.94Å; K92-S95 VanDerWaalsContact O-N 3.1Å; K93-S95 VanDerWaalsContact C-N 3.29Å; K93-S95 PolarHBondContact O-N 3.07Å
96	G	86.9	Confident	88.1	Confident	64 Å²	64	95.4 Å²	95.4	66%	0.66	45%	0.448	S	S	*	.	T	Hydrogen-bonded Turn	trans	91.3	-7	-179.9	0	0	0	0	0	115.4	K92 K93 K94 R98	K92-G96 PolarHBondContact O-N 3.28Å; K93-G96 PolarHBondContact O-N 3.26Å; K93-G96 VanDerWaalsContact O-N 3.13Å; K94-G96 PolarHBondContact O-N 3.44Å; G96-R98 PolarHBondContact O-N 2.94Å
97	S	84	Confident	88.5	Confident	37 Å²	37	86.7 Å²	86.7	26%	0.259	42%	0.415	S	S	.	.			trans	-87.5	110.6	175.3	-176.6	0	0	0	0	111	K92 K93 R99	K92-S97 CarbonylContact C-O 3.54Å; K92-S97 PolarHBondContact O-N 3.49Å; K92-S97 VanDerWaalsContact O-O 3.12Å; K93-S97 VanDerWaalsContact CA-O 3.28Å; K93-S97 WeakPolarHBondContact CA-O 3.4Å; K93-S97 PolarHBondContact N-O 2.69Å; S97-R99 PolarHBondContact O-N 3.35Å
98	R	76.2	Confident	88.9	Confident	191 Å²	191	83.3 Å²	83.3	72%	0.721	40%	0.4	S	S	*	.			trans	-88.3	10.7	173.3	-58.5	179.1	83.4	100.7	-11.3	113.1	G96	G96-R98 PolarHBondContact O-N 2.94Å
99	R	79.4	Confident	89.4	Confident	158 Å²	158	80.2 Å²	80.2	60%	0.596	38%	0.381	S	S	*	.			trans	-73	144.3	-174.4	-59.7	176.3	-175.9	167.2	3.2	109.7	S97	S97-R99 PolarHBondContact O-N 3.35Å
100	C	78.9	Confident	89.8	Confident	47 Å²	47	82 Å²	82	32%	0.318	39%	0.388	S	S	.	.			trans	-111.8	108	174.4	-56.8	0	0	0	0	106.4	R89	R89-C100 PolarHBondContact NE-SG 2.95Å; R89-C100 PolarHBondContact NH2-SG 3.49Å
101	D	87.3	Confident	90.1	Very high	33 Å²	33	76.1 Å²	76.1	18%	0.176	37%	0.369	C	S	.	.			trans	-88.1	155.6	170.8	-57.4	-41.7	0	0	0	108.4	E84 K92	E84-D101 PolarHBondContact N-O 3.43Å; K92-D101 IonicContact NZ-OD2 2.72Å; K92-D101 PolarHBondContact NZ-OD2 2.9Å
102	F	93.3	Very high	90.4	Very high	47 Å²	47	72.6 Å²	72.6	21%	0.206	35%	0.353	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-109.3	141.6	176.9	-59.9	-79.1	0	0	0	108.1	V57 L61 L81 Q82 P83	V57-F102 HydrophobicContact CB-CB 4.04Å; V57-F102 HydrophobicContact CG1-CB 3.83Å; V57-F102 HydrophobicContact CG1-CD2 4.43Å; V57-F102 HydrophobicContact CG2-CB 4.44Å; L61-F102 WeakPolarHBondContact O-CD2 3.47Å; L61-F102 WeakPolarHBondContact O-CE2 3.44Å; L81-F102 HydrophobicContact CB-CB 4.01Å; L81-F102 HydrophobicContact CB-CD1 3.33Å; L81-F102 HydrophobicContact CB-CD2 4.23Å; L81-F102 HydrophobicContact CB-CE1 3.77Å; L81-F102 HydrophobicContact CB-CG 3.59Å; L81-F102 HydrophobicContact CB-CZ 4.38Å; L81-F102 HydrophobicContact CD1-CD1 4.42Å; L81-F102 HydrophobicContact CD1-CD2 3.82Å; L81-F102 HydrophobicContact CD1-CE2 4.06Å; L81-F102 HydrophobicContact CD1-CG 4.02Å; L81-F102 HydrophobicContact CD1-CZ 4.46Å; L81-F102 HydrophobicContact CG-CG 4.44Å; L81-F102 WeakPolarHBondContact O-CD1 3.36Å; Q82-F102 CarbonylContact O-C 3.59Å; Q82-F102 WeakPolarHBondContact O-CA 3.41Å; Q82-F102 WeakPolarHBondContact O-CB 3.4Å; P83-F102 HydrophobicContact CB-CD1 4.48Å
103	T	93	Very high	90.8	Very high	66 Å²	66	78.3 Å²	78.3	41%	0.405	37%	0.373	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-89.5	-46.5	178.6	51	0	0	0	0	110.5	Q82 E84	Q82-T103 PolarHBondContact O-N 3.37Å; E84-T103 HydrophobicContact CB-CG2 4.29Å
104	E	94.6	Very high	91.1	Very high	71 Å²	71	74.2 Å²	74.2	33%	0.332	36%	0.358	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-138.2	165.4	-171.2	-61.8	177.9	-173.7	0	0	110.4	Y53 L54 L81 Q82 W106	Y53-E104 HydrophobicContact CE2-CB 4.04Å; Y53-E104 HydrophobicContact CE2-CG 4.24Å; Y53-E104 WeakPolarHBondContact OH-CG 3.3Å; Y53-E104 PolarHBondContact OH-OE1 3.36Å; L54-E104 WeakPolarHBondContact O-CA 3.45Å; L81-E104 CarbonylContact C-O 3.56Å; L81-E104 WeakPolarHBondContact CA-O 3.29Å; Q82-E104 HydrophobicContact CB-CB 4.1Å; Q82-E104 PolarHBondContact N-O 2.84Å; E104-W106 HydrophobicContact CB-CH2 4.14Å; E104-W106 HydrophobicContact CB-CZ3 4.4Å
105	G	96.1	Very high	91.4	Very high	0 Å²	0	64.8 Å²	64.8	0%	0	32%	0.317	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-151.9	156.8	177.7	0	0	0	0	0	114.6	Y53 L54 F80	Y53-G105 CarbonylContact C-O 3.53Å; Y53-G105 WeakPolarHBondContact CA-O 3.29Å; L54-G105 PolarHBondContact N-O 3.45Å; L54-G105 PolarHBondContact O-N 3.05Å; F80-G105 CarbonylContact O-C 3.47Å; F80-G105 VanDerWaalsContact O-CA 3.27Å; F80-G105 WeakPolarHBondContact O-CA 3.28Å
106	W	97.1	Very high	91.9	Very high	24 Å²	24	64 Å²	64	9%	0.091	30%	0.3	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-130.7	130.1	173.8	-59.8	-99.4	0	0	0	109.1	I51 I52 Y53 I79 F80 Q82 E104 W150 L153	I51-W106 HydrophobicContact CG2-CB 4.24Å; I52-W106 WeakPolarHBondContact O-CA 3.32Å; Y53-W106 AromaticContact CD2-CE2 3.99Å; Y53-W106 HydrophobicContact CD2-CZ2 4.37Å; Y53-W106 AromaticContact CD2-NE1 3.69Å; Y53-W106 HydrophobicContact CE2-CZ2 4.2Å; I79-W106 WeakPolarHBondContact CA-O 3.19Å; F80-W106 AromaticContact CD1-CE3 3.45Å; F80-W106 HydrophobicContact CD1-CE3 3.45Å; F80-W106 VanDerWaalsContact CD1-CE3 3.45Å; F80-W106 AromaticContact CD1-CZ3 3.54Å; F80-W106 HydrophobicContact CD1-CZ3 3.54Å; F80-W106 HydrophobicContact CE1-CE3 4.1Å; F80-W106 AromaticContact CE1-CZ3 3.68Å; F80-W106 HydrophobicContact CE1-CZ3 3.68Å; F80-W106 HydrophobicContact CG-CE3 4.45Å; F80-W106 PolarHBondContact N-O 2.95Å; F80-W106 PolarHBondContact O-N 3.23Å; Q82-W106 HydrophobicContact CB-CH2 4.21Å; Q82-W106 HydrophobicContact CB-CZ3 3.89Å; E104-W106 HydrophobicContact CB-CH2 4.14Å; E104-W106 HydrophobicContact CB-CZ3 4.4Å; W106-W150 HydrophobicContact CB-CZ3 4.27Å; W106-L153 HydrophobicContact CB-CD2 3.72Å; W106-L153 HydrophobicContact CD2-CD1 3.78Å; W106-L153 HydrophobicContact CD2-CD2 3.73Å; W106-L153 HydrophobicContact CD2-CG 4.43Å; W106-L153 HydrophobicContact CE3-CD1 4.18Å; W106-L153 HydrophobicContact CE3-CD2 4.04Å; W106-L153 HydrophobicContact CG-CD1 4.24Å; W106-L153 HydrophobicContact CG-CD2 3.59Å; W106-L153 HydrophobicContact CH2-CD1 4.22Å; W106-L153 HydrophobicContact CZ2-CD1 3.86Å; W106-L153 HydrophobicContact CZ3-CD1 4.35Å
107	V	97.3	Very high	92.3	Very high	0 Å²	0	69.5 Å²	69.5	0%	0	30%	0.301	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-123.4	123	179	-178.4	0	0	0	0	108.3	I51 I52 L54 L66 L70 I76 I79 F109	I51-V107 WeakPolarHBondContact CA-O 3.33Å; I52-V107 PolarHBondContact N-O 3.05Å; I52-V107 PolarHBondContact O-N 2.98Å; L54-V107 HydrophobicContact CD1-CG2 3.85Å; L54-V107 HydrophobicContact CG-CG2 4.46Å; L66-V107 HydrophobicContact CD2-CG2 3.73Å; L66-V107 HydrophobicContact CG-CG2 4.29Å; L70-V107 HydrophobicContact CD1-CB 4.46Å; L70-V107 HydrophobicContact CD1-CG1 4.04Å; L70-V107 HydrophobicContact CD1-CG2 4.11Å; I76-V107 HydrophobicContact CG2-CG1 3.72Å; I79-V107 HydrophobicContact CG1-CG1 4.31Å; I79-V107 HydrophobicContact CG2-CG2 4.33Å; V107-F109 HydrophobicContact CB-CE2 4.36Å; V107-F109 HydrophobicContact CG1-CD2 4.14Å; V107-F109 HydrophobicContact CG1-CE2 3.68Å; V107-F109 HydrophobicContact CG1-CZ 4.37Å
108	E	97.2	Very high	92.9	Very high	17 Å²	17	67.9 Å²	67.9	8%	0.079	29%	0.29	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-92.5	124.4	173.5	179.8	-177.2	-131	0	0	109.9	P49 I51 G77 R78 W150	P49-E108 HydrophobicContact CB-CG 4.13Å; I51-E108 HydrophobicContact CG1-CB 4.28Å; I51-E108 HydrophobicContact CG1-CG 4.41Å; G77-E108 PolarHBondContact N-O 3.5Å; R78-E108 HydrophobicContact CB-CB 4.36Å; R78-E108 WeakPolarHBondContact CB-OE2 3.43Å; R78-E108 WeakPolarHBondContact CG-OE2 3.43Å; R78-E108 IonicContact CZ-OE1 3.37Å; R78-E108 IonicContact CZ-OE2 3.57Å; R78-E108 PolarHBondContact N-OE2 3.01Å; R78-E108 IonicContact NE-OE1 3.59Å; R78-E108 IonicContact NE-OE2 3.48Å; R78-E108 PolarHBondContact NE-OE2 3.21Å; R78-E108 IonicContact NH2-OE1 2.66Å; R78-E108 PolarHBondContact NH2-OE1 3.2Å; R78-E108 IonicContact NH2-OE2 2.7Å; R78-E108 PolarHBondContact NH2-OE2 3.05Å; R78-E108 PolarHBondContact O-N 3.22Å; E108-W150 HydrophobicContact CB-CE3 4.02Å; E108-W150 HydrophobicContact CB-CZ3 4.25Å
109	F	97	Very high	93.9	Very high	1 Å²	1	59.3 Å²	59.3	0%	0.004	26%	0.259	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-97	146.1	166.6	-74.6	-98.4	0	0	0	109.5	P49 G50 I52 L70 I76 V107 D111 V114 A115 V118	P49-F109 CarbonylContact C-O 3.12Å; P49-F109 VanDerWaalsContact CA-O 3.26Å; P49-F109 WeakPolarHBondContact CA-O 3.18Å; G50-F109 PolarHBondContact N-O 3.44Å; G50-F109 PolarHBondContact O-N 2.9Å; I52-F109 HydrophobicContact CB-CE2 4.41Å; I52-F109 HydrophobicContact CD1-CD2 3.68Å; I52-F109 HydrophobicContact CD1-CE2 3.3Å; I52-F109 HydrophobicContact CD1-CZ 4.11Å; I52-F109 HydrophobicContact CG1-CD2 3.84Å; I52-F109 HydrophobicContact CG1-CE2 3.85Å; L70-F109 HydrophobicContact CB-CZ 4.12Å; L70-F109 HydrophobicContact CD1-CZ 4.25Å; I76-F109 HydrophobicContact CG1-CD1 4.49Å; I76-F109 HydrophobicContact CG1-CE1 4.13Å; I76-F109 HydrophobicContact CG1-CZ 4.44Å; V107-F109 HydrophobicContact CB-CE2 4.36Å; V107-F109 HydrophobicContact CG1-CD2 4.14Å; V107-F109 HydrophobicContact CG1-CE2 3.68Å; V107-F109 HydrophobicContact CG1-CZ 4.37Å; F109-D111 PolarHBondContact O-N 3.48Å; F109-V114 HydrophobicContact CD1-CG1 3.88Å; F109-V114 HydrophobicContact CE1-CG1 4.24Å; F109-A115 HydrophobicContact CB-CB 4.09Å; F109-A115 HydrophobicContact CD2-CB 4.23Å; F109-A115 HydrophobicContact CG-CB 4.31Å; F109-V118 HydrophobicContact CE1-CG2 4.28Å; F109-V118 HydrophobicContact CZ-CG1 4.14Å; F109-V118 HydrophobicContact CZ-CG2 4.33Å
110	R	95.5	Very high	94.7	Very high	160 Å²	160	59 Å²	59	60%	0.604	27%	0.269	S	S	*	.	S	Bend	trans	-64.3	-30.3	178.4	-165.4	172.2	174.1	165.2	-4.1	112.8	V48 P49 E75	V48-R110 CarbonylContact C-O 3.56Å; P49-R110 WeakPolarHBondContact CA-O 3.23Å; E75-R110 HydrophobicContact CB-CB 4.1Å; E75-R110 PolarHBondContact O-N 3.27Å; E75-R110 WeakPolarHBondContact OE2-CD 3.38Å; E75-R110 IonicContact OE2-CZ 2.84Å; E75-R110 IonicContact OE2-NE 2.83Å; E75-R110 IonicContact OE2-NH1 3.19Å; E75-R110 PolarHBondContact OE2-NH1 3.22Å
111	D	95.4	Very high	95.5	Very high	39 Å²	39	60.1 Å²	60.1	21%	0.209	28%	0.277	C	S	.	.			trans	-121.3	125.1	174.6	-175.9	1.3	0	0	0	111.6	C47 F109 R113 V114 A115	C47-D111 HydrophobicContact CB-CB 4.46Å; F109-D111 PolarHBondContact O-N 3.48Å; D111-R113 PolarHBondContact O-N 3Å; D111-R113 WeakPolarHBondContact OD1-CB 3.36Å; D111-R113 WeakPolarHBondContact OD1-CG 3.28Å; D111-R113 PolarHBondContact OD1-N 2.95Å; D111-V114 HydrophobicContact CB-CG2 4.15Å; D111-V114 PolarHBondContact O-N 3.5Å; D111-A115 PolarHBondContact O-N 2.71Å; D111-A115 VanDerWaalsContact O-N 3.1Å
112	K	95.4	Very high	95.8	Very high	84 Å²	84	58.9 Å²	58.9	37%	0.365	27%	0.271	S	S	.	.	H	α-helix	trans	-61.6	-25.1	175.2	70.8	-179.8	178.5	-172.9	0	113.8	V48 A115 K116 Y144	V48-K112 HydrophobicContact CB-CD 4.05Å; V48-K112 HydrophobicContact CB-CG 4.47Å; V48-K112 HydrophobicContact CG1-CD 4.09Å; V48-K112 WeakPolarHBondContact O-CB 3.25Å; V48-K112 PolarHBondContact O-N 3.49Å; K112-A115 PolarHBondContact O-N 2.98Å; K112-K116 WeakPolarHBondContact O-CG 3.25Å; K112-K116 PolarHBondContact O-N 3.4Å; K112-Y144 HydrophobicContact CB-CE2 4.46Å
113	R	95	Very high	95.9	Very high	182 Å²	182	60.4 Å²	60.4	69%	0.687	28%	0.278	S	S	*	.	H	α-helix	trans	-66.7	-44.7	176.6	-60.7	172.1	70.1	-166.3	2.3	110.4	D111 A115 K116 R117	D111-R113 PolarHBondContact O-N 3Å; D111-R113 WeakPolarHBondContact OD1-CB 3.36Å; D111-R113 WeakPolarHBondContact OD1-CG 3.28Å; D111-R113 PolarHBondContact OD1-N 2.95Å; R113-A115 VanDerWaalsContact C-N 3.34Å; R113-K116 PolarHBondContact O-N 2.9Å; R113-R117 PolarHBondContact O-N 3.42Å; R113-R117 VanDerWaalsContact O-N 3.12Å
114	V	95.9	Very high	96	Very high	33 Å²	33	62 Å²	62	20%	0.2	28%	0.284	C	S	.	.	H	α-helix	trans	-61.7	-46.1	173	178.8	0	0	0	0	109.6	Y73 F109 D111 K116 R117 V118	Y73-V114 VanDerWaalsContact O-CG1 3.24Å; Y73-V114 WeakPolarHBondContact O-CG1 3.21Å; F109-V114 HydrophobicContact CD1-CG1 3.88Å; F109-V114 HydrophobicContact CE1-CG1 4.24Å; D111-V114 HydrophobicContact CB-CG2 4.15Å; D111-V114 PolarHBondContact O-N 3.5Å; V114-K116 VanDerWaalsContact C-N 3.31Å; V114-K116 PolarHBondContact O-N 3Å; V114-R117 PolarHBondContact O-N 3.46Å; V114-R117 VanDerWaalsContact O-N 3.13Å; V114-V118 HydrophobicContact CG1-CG2 3.99Å; V114-V118 WeakPolarHBondContact O-CB 3.47Å; V114-V118 VanDerWaalsContact O-CG2 3.29Å; V114-V118 WeakPolarHBondContact O-CG2 3.4Å; V114-V118 PolarHBondContact O-N 2.89Å
115	A	96.7	Very high	95.9	Very high	0 Å²	0	60.7 Å²	60.7	0%	0	28%	0.281	C	S	.	.	H	α-helix	trans	-56.1	-44.4	179.3	0	0	0	0	0	112.9	I52 F109 D111 K112 R113 A119 Y144	I52-A115 HydrophobicContact CD1-CB 4.14Å; I52-A115 VanDerWaalsContact CD1-O 3.32Å; I52-A115 WeakPolarHBondContact CD1-O 3.15Å; I52-A115 HydrophobicContact CG1-CB 3.89Å; F109-A115 HydrophobicContact CB-CB 4.09Å; F109-A115 HydrophobicContact CD2-CB 4.23Å; F109-A115 HydrophobicContact CG-CB 4.31Å; D111-A115 PolarHBondContact O-N 2.71Å; D111-A115 VanDerWaalsContact O-N 3.1Å; K112-A115 PolarHBondContact O-N 2.98Å; R113-A115 VanDerWaalsContact C-N 3.34Å; A115-A119 WeakPolarHBondContact O-CB 3.49Å; A115-A119 PolarHBondContact O-N 3.43Å; A115-Y144 HydrophobicContact CB-CD2 3.9Å; A115-Y144 HydrophobicContact CB-CE2 4.05Å
116	K	96.8	Very high	95.8	Very high	90 Å²	90	64.1 Å²	64.1	39%	0.391	30%	0.303	S	S	.	.	H	α-helix	trans	-62.4	-46.9	176.3	-74.4	179.1	178.7	-168.5	0	112.1	K112 R113 V114 A119 L120 Y144	K112-K116 WeakPolarHBondContact O-CG 3.25Å; K112-K116 PolarHBondContact O-N 3.4Å; R113-K116 PolarHBondContact O-N 2.9Å; V114-K116 VanDerWaalsContact C-N 3.31Å; V114-K116 PolarHBondContact O-N 3Å; K116-A119 PolarHBondContact O-N 3Å; K116-L120 WeakPolarHBondContact O-CG 3.21Å; K116-L120 PolarHBondContact O-N 3.02Å; K116-Y144 HydrophobicContact CD-CE1 4.24Å; K116-Y144 VanDerWaalsContact CE-CE1 3.45Å; K116-Y144 HydrophobicContact CG-CD1 3.76Å; K116-Y144 HydrophobicContact CG-CD2 4.11Å; K116-Y144 HydrophobicContact CG-CE1 3.76Å; K116-Y144 HydrophobicContact CG-CE2 4.12Å; K116-Y144 HydrophobicContact CG-CG 3.93Å
117	R	96.8	Very high	95.4	Very high	179 Å²	179	63.7 Å²	63.7	68%	0.675	30%	0.303	S	S	*	.	H	α-helix	trans	-61.3	-45.6	178.9	-173.2	-171.7	-61.7	172.5	-1.1	111.3	R113 V114 L120 S121	R113-R117 PolarHBondContact O-N 3.42Å; R113-R117 VanDerWaalsContact O-N 3.12Å; V114-R117 PolarHBondContact O-N 3.46Å; V114-R117 VanDerWaalsContact O-N 3.13Å; R117-L120 PolarHBondContact O-N 3.08Å; R117-S121 VanDerWaalsContact O-CB 3.28Å; R117-S121 WeakPolarHBondContact O-CB 3.43Å; R117-S121 PolarHBondContact O-N 3Å
118	V	96.6	Very high	94.7	Very high	4 Å²	4	63.9 Å²	63.9	2%	0.024	30%	0.304	C	S	.	.	H	α-helix	trans	-61.5	-46.6	178.6	171.7	0	0	0	0	110.8	I52 L70 Y73 F109 V114 L120 S121 L122	I52-V118 HydrophobicContact CD1-CB 3.92Å; I52-V118 HydrophobicContact CD1-CG1 3.76Å; L70-V118 HydrophobicContact CD2-CG1 4.22Å; Y73-V118 HydrophobicContact CD1-CG2 4.49Å; Y73-V118 HydrophobicContact CG-CG2 4.08Å; F109-V118 HydrophobicContact CE1-CG2 4.28Å; F109-V118 HydrophobicContact CZ-CG1 4.14Å; F109-V118 HydrophobicContact CZ-CG2 4.33Å; V114-V118 HydrophobicContact CG1-CG2 3.99Å; V114-V118 WeakPolarHBondContact O-CB 3.47Å; V114-V118 VanDerWaalsContact O-CG2 3.29Å; V114-V118 WeakPolarHBondContact O-CG2 3.4Å; V114-V118 PolarHBondContact O-N 2.89Å; V118-L120 VanDerWaalsContact C-N 3.34Å; V118-L120 PolarHBondContact O-N 2.92Å; V118-S121 PolarHBondContact O-N 3.14Å; V118-L122 HydrophobicContact CG1-CD1 3.72Å; V118-L122 HydrophobicContact CG1-CG 4.26Å; V118-L122 VanDerWaalsContact O-CB 3.31Å; V118-L122 WeakPolarHBondContact O-CB 3.13Å; V118-L122 PolarHBondContact O-N 2.98Å
119	A	96.8	Very high	94	Very high	10 Å²	10	69 Å²	69	8%	0.083	34%	0.337	C	S	.	.	H	α-helix	trans	-60.6	-43.2	177.8	0	0	0	0	0	112	A115 K116 H123 I142	A115-A119 WeakPolarHBondContact O-CB 3.49Å; A115-A119 PolarHBondContact O-N 3.43Å; K116-A119 PolarHBondContact O-N 3Å; A119-H123 WeakPolarHBondContact O-CB 3.47Å; A119-H123 PolarHBondContact O-N 3.27Å; A119-I142 HydrophobicContact CB-CG2 4.35Å
120	L	96.1	Very high	93.5	Very high	151 Å²	151	75.8 Å²	75.8	79%	0.791	37%	0.366	S	S	*	.	H	α-helix	trans	-68.3	-38.5	178.2	-69.1	170.8	0	0	0	112.8	K116 R117 V118	K116-L120 WeakPolarHBondContact O-CG 3.21Å; K116-L120 PolarHBondContact O-N 3.02Å; R117-L120 PolarHBondContact O-N 3.08Å; V118-L120 VanDerWaalsContact C-N 3.34Å; V118-L120 PolarHBondContact O-N 2.92Å
121	S	95.2	Very high	92.9	Very high	72 Å²	72	77 Å²	77	50%	0.503	38%	0.376	S	S	.	.	H	α-helix	trans	-84	-34.6	-174.3	-178.3	0	0	0	0	113.8	R117 V118 T125	R117-S121 VanDerWaalsContact O-CB 3.28Å; R117-S121 WeakPolarHBondContact O-CB 3.43Å; R117-S121 PolarHBondContact O-N 3Å; V118-S121 PolarHBondContact O-N 3.14Å; S121-T125 VanDerWaalsContact O-CG2 3.29Å; S121-T125 WeakPolarHBondContact O-CG2 3.46Å
122	L	94.1	Very high	92.5	Very high	7 Å²	7	87.1 Å²	87.1	4%	0.037	41%	0.411	C	S	.	.	H	α-helix	trans	-96	-16.7	-175.8	-68	-173.9	0	0	0	113	L70 Y73 V118 N124 T125 W140 I142	L70-L122 HydrophobicContact CD2-CD1 3.64Å; Y73-L122 HydrophobicContact CD2-CD1 4.11Å; Y73-L122 HydrophobicContact CE1-CD2 4.24Å; Y73-L122 HydrophobicContact CE2-CD1 3.76Å; Y73-L122 HydrophobicContact CE2-CD2 4.34Å; V118-L122 HydrophobicContact CG1-CD1 3.72Å; V118-L122 HydrophobicContact CG1-CG 4.26Å; V118-L122 VanDerWaalsContact O-CB 3.31Å; V118-L122 WeakPolarHBondContact O-CB 3.13Å; V118-L122 PolarHBondContact O-N 2.98Å; L122-N124 PolarHBondContact O-N 3.34Å; L122-T125 WeakPolarHBondContact CA-OG1 3.39Å; L122-T125 PolarHBondContact O-N 3.43Å; L122-T125 VanDerWaalsContact O-N 3.15Å; L122-T125 PolarHBondContact O-OG1 3.47Å; L122-W140 HydrophobicContact CB-CG 4.37Å; L122-W140 WeakPolarHBondContact O-CB 3.29Å; L122-I142 HydrophobicContact CB-CD1 3.83Å; L122-I142 HydrophobicContact CD1-CD1 4.4Å
123	H	96.3	Very high	92	Very high	78 Å²	78	87.3 Å²	87.3	36%	0.361	41%	0.414	S	S	.	.	T	Hydrogen-bonded Turn	trans	-61.3	128.9	178.9	-174.7	43.1	0	0	0	111.2	A119 T125 I142	A119-H123 WeakPolarHBondContact O-CB 3.47Å; A119-H123 PolarHBondContact O-N 3.27Å; H123-T125 PolarHBondContact O-N 3.01Å; H123-I142 PolarHBondContact ND1-N 3.28Å; H123-I142 PolarHBondContact ND1-O 2.92Å
124	N	94.3	Very high	91.4	Very high	100 Å²	100	87 Å²	87	54%	0.535	41%	0.412	S	S	.	.	T	Hydrogen-bonded Turn	trans	63.2	20.8	-177.9	-54.4	-39.6	0	0	0	115.2	L122 W140	L122-N124 PolarHBondContact O-N 3.34Å; N124-W140 WeakPolarHBondContact CA-O 3.42Å; N124-W140 PolarHBondContact N-O 2.89Å
125	T	93.3	Very high	90.9	Very high	44 Å²	44	86.1 Å²	86.1	27%	0.27	41%	0.406	S	S	.	.	S	Bend	trans	-97.6	154.7	171.7	68.9	0	0	0	0	111.3	S121 L122 H123 L139 W140	S121-T125 VanDerWaalsContact O-CG2 3.29Å; S121-T125 WeakPolarHBondContact O-CG2 3.46Å; L122-T125 WeakPolarHBondContact CA-OG1 3.39Å; L122-T125 PolarHBondContact O-N 3.43Å; L122-T125 VanDerWaalsContact O-N 3.15Å; L122-T125 PolarHBondContact O-OG1 3.47Å; H123-T125 PolarHBondContact O-N 3.01Å; T125-L139 WeakPolarHBondContact O-CA 3.42Å; T125-W140 WeakPolarHBondContact O-CB 3.3Å; T125-W140 PolarHBondContact O-N 3.31Å
126	P	92.8	Very high	90.5	Very high	71 Å²	71	89.3 Å²	89.3	46%	0.461	42%	0.42	S	S	.	.	B	Isolated β-bridge	trans	-64.6	138.9	176.3	26.1	-34.1	0	0	0	111.3	G128 L139	P126-G128 VanDerWaalsContact C-N 3.28Å; P126-G128 PolarHBondContact O-N 2.94Å; P126-L139 HydrophobicContact CB-CD2 4.42Å
127	M	88.4	Confident	90	Very high	16 Å²	16	90.3 Å²	90.3	8%	0.079	44%	0.438	C	S	.	.	S	Bend	trans	-70.2	-25.8	-179.6	-69	-167.7	60.6	0	0	113.5	P58 L61 L69 F135 D138 W140	P58-M127 HydrophobicContact CG-SD 3.52Å; P58-M127 VanDerWaalsContact CG-SD 3.52Å; L61-M127 HydrophobicContact CD1-CE 4.34Å; L61-M127 HydrophobicContact CD2-CE 3.94Å; L69-M127 HydrophobicContact CD2-CE 3.86Å; M127-F135 HydrophobicContact CB-CB 4.13Å; M127-F135 WeakPolarHBondContact CB-O 3.42Å; M127-D138 PolarHBondContact N-O 3.16Å; M127-D138 HydrophobicContact SD-CB 4.34Å; M127-W140 HydrophobicContact CE-CD2 4.23Å; M127-W140 HydrophobicContact CE-CE3 3.97Å; M127-W140 HydrophobicContact CE-CH2 3.6Å; M127-W140 HydrophobicContact CE-CZ2 3.84Å; M127-W140 HydrophobicContact CE-CZ3 3.66Å; M127-W140 HydrophobicContact CG-CD2 3.6Å; M127-W140 HydrophobicContact CG-CE3 4.12Å; M127-W140 HydrophobicContact CG-CG 3.74Å; M127-W140 HydrophobicContact CG-CZ2 4.34Å; M127-W140 HydrophobicContact SD-CD2 4.21Å; M127-W140 HydrophobicContact SD-CE3 4.11Å; M127-W140 HydrophobicContact SD-CZ3 4.39Å
128	G	83.8	Confident	89.7	Confident	3 Å²	3	84 Å²	84	3%	0.031	42%	0.418	C	S	.	.			trans	-108.6	142.9	-179.8	0	0	0	0	0	112.9	P126 F136	P126-G128 VanDerWaalsContact C-N 3.28Å; P126-G128 PolarHBondContact O-N 2.94Å; G128-F136 WeakPolarHBondContact O-CD2 3.41Å
129	T	81.8	Confident	89.6	Confident	124 Å²	124	88.2 Å²	88.2	76%	0.761	44%	0.44	S	S	*	.	S	Bend	trans	-89.8	-20.9	174.2	55.2	0	0	0	0	112.7	Q133	T129-Q133 VanDerWaalsContact N-OE1 3.1Å
130	K	86.3	Confident	89.5	Confident	144 Å²	144	88.4 Å²	88.4	63%	0.626	44%	0.438	S	S	*	.	S	Bend	trans	-120.9	137.5	-176.9	-64	179	180	-178.7	0	110.8	R132 Q133 F136	K130-R132 PolarHBondContact O-N 3.45Å; K130-Q133 HydrophobicContact CB-CG 4.17Å; K130-Q133 WeakPolarHBondContact O-CB 3.34Å; K130-Q133 PolarHBondContact O-N 2.92Å; K130-F136 VanDerWaalsContact O-CD2 3.28Å; K130-F136 WeakPolarHBondContact O-CD2 3.3Å
131	K	83.8	Confident	89.5	Confident	186 Å²	186	84.4 Å²	84.4	81%	0.809	42%	0.417	S	S	*	.	T	Hydrogen-bonded Turn	trans	-56.1	-25.7	178	-68.1	-175.6	177.8	-178.7	0	114.6	Q133 F136	K131-Q133 VanDerWaalsContact C-N 3.34Å; K131-F136 HydrophobicContact CG-CD1 4.37Å; K131-F136 HydrophobicContact CG-CE1 3.83Å; K131-F136 HydrophobicContact CG-CE2 4.13Å; K131-F136 HydrophobicContact CG-CZ 3.7Å
132	R	86.3	Confident	89.5	Confident	251 Å²	251	81.1 Å²	81.1	95%	0.947	39%	0.394	S	S	*	.	T	Hydrogen-bonded Turn	trans	-79.8	-11.1	176.7	-67.6	-174	178	-170.1	-0.1	113.8	K130	K130-R132 PolarHBondContact O-N 3.45Å
133	Q	85.1	Confident	89.6	Confident	89 Å²	89	87.1 Å²	87.1	42%	0.416	42%	0.42	S	S	.	.	S	Bend	trans	-74.5	143.5	178.8	-74	178.2	-8.1	0	0	110.9	T129 K130 K131 F135 F136	T129-Q133 VanDerWaalsContact N-OE1 3.1Å; K130-Q133 HydrophobicContact CB-CG 4.17Å; K130-Q133 WeakPolarHBondContact O-CB 3.34Å; K130-Q133 PolarHBondContact O-N 2.92Å; K131-Q133 VanDerWaalsContact C-N 3.34Å; Q133-F135 PolarHBondContact O-N 2.85Å; Q133-F136 WeakPolarHBondContact O-CB 3.42Å; Q133-F136 PolarHBondContact O-N 3.08Å
134	R	83.2	Confident	89.7	Confident	175 Å²	175	85.5 Å²	85.5	66%	0.66	41%	0.411	S	S	*	.	T	Hydrogen-bonded Turn	trans	-60	-31.3	-172.9	-177.5	172.3	-67.2	-79.1	0.8	114.3
135	F	84.8	Confident	89.8	Confident	15 Å²	15	82.5 Å²	82.5	7%	0.066	40%	0.395	C	S	.	.	T	Hydrogen-bonded Turn	trans	-110	24.8	-174.8	-51	-65.6	0	0	0	111.8	P58 P59 L61 H65 M127 Q133 S137 D138	P58-F135 HydrophobicContact CB-CD1 3.66Å; P58-F135 HydrophobicContact CB-CE1 3.92Å; P58-F135 HydrophobicContact CG-CD1 4.37Å; P59-F135 WeakPolarHBondContact O-CE1 3.37Å; L61-F135 HydrophobicContact CB-CE1 4.49Å; L61-F135 HydrophobicContact CB-CZ 4.3Å; L61-F135 HydrophobicContact CD1-CD2 4.22Å; L61-F135 HydrophobicContact CD1-CE2 3.78Å; L61-F135 HydrophobicContact CD1-CZ 4Å; H65-F135 AromaticContact CD2-CE2 3.66Å; H65-F135 AromaticContact NE2-CD2 3.91Å; H65-F135 AromaticContact NE2-CE2 3.68Å; M127-F135 HydrophobicContact CB-CB 4.13Å; M127-F135 WeakPolarHBondContact CB-O 3.42Å; Q133-F135 PolarHBondContact O-N 2.85Å; F135-S137 VanDerWaalsContact C-N 3.34Å; F135-S137 PolarHBondContact O-N 3.49Å; F135-D138 PolarHBondContact O-N 3.31Å
136	F	87.2	Confident	89.9	Confident	67 Å²	67	86.7 Å²	86.7	29%	0.294	41%	0.411	S	S	.	.	T	Hydrogen-bonded Turn	trans	-62	-41	-176.6	177.3	-99.4	0	0	0	112.8	G128 K130 K131 Q133 D138	G128-F136 WeakPolarHBondContact O-CD2 3.41Å; K130-F136 VanDerWaalsContact O-CD2 3.28Å; K130-F136 WeakPolarHBondContact O-CD2 3.3Å; K131-F136 HydrophobicContact CG-CD1 4.37Å; K131-F136 HydrophobicContact CG-CE1 3.83Å; K131-F136 HydrophobicContact CG-CE2 4.13Å; K131-F136 HydrophobicContact CG-CZ 3.7Å; Q133-F136 WeakPolarHBondContact O-CB 3.42Å; Q133-F136 PolarHBondContact O-N 3.08Å; F136-D138 VanDerWaalsContact C-N 3.32Å
137	S	87.5	Confident	90	Very high	110 Å²	110	92.7 Å²	92.7	77%	0.769	43%	0.425	S	S	*	.	T	Hydrogen-bonded Turn	trans	-80.4	-12.8	-178	-49.1	0	0	0	0	113.8	F135	F135-S137 VanDerWaalsContact C-N 3.34Å; F135-S137 PolarHBondContact O-N 3.49Å
138	D	91.3	Very high	90.3	Very high	46 Å²	46	94.5 Å²	94.5	25%	0.246	43%	0.432	C	S	.	.			trans	-84.4	138.3	-178.8	-69.3	-51	0	0	0	110.4	P58 M127 F135 F136	P58-D138 HydrophobicContact CB-CB 4.39Å; P58-D138 WeakPolarHBondContact CB-OD2 3.48Å; P58-D138 HydrophobicContact CG-CB 3.71Å; M127-D138 PolarHBondContact N-O 3.16Å; M127-D138 HydrophobicContact SD-CB 4.34Å; F135-D138 PolarHBondContact O-N 3.31Å; F136-D138 VanDerWaalsContact C-N 3.32Å
139	L	93.9	Very high	90.8	Very high	93 Å²	93	98.6 Å²	98.6	49%	0.487	45%	0.45	S	S	.	.	B	Isolated β-bridge	trans	-95.8	144.1	176	-59.6	177.7	0	0	0	111.1	T125 P126 N141	T125-L139 WeakPolarHBondContact O-CA 3.42Å; P126-L139 HydrophobicContact CB-CD2 4.42Å; L139-N141 PolarHBondContact O-N 2.95Å
140	W	94.4	Very high	91.4	Very high	15 Å²	15	94.5 Å²	94.5	6%	0.057	42%	0.421	C	S	.	.			trans	-68.6	114.3	170.5	-80.8	119.4	0	0	0	111.2	L54 L66 L69 L70 L122 N124 T125 M127 I142	L54-W140 HydrophobicContact CD2-CE3 4.39Å; L54-W140 HydrophobicContact CD2-CZ3 4.31Å; L66-W140 HydrophobicContact CD1-CH2 3.65Å; L66-W140 HydrophobicContact CD1-CZ3 3.65Å; L69-W140 HydrophobicContact CB-CH2 4.29Å; L69-W140 HydrophobicContact CB-CZ2 4.21Å; L69-W140 HydrophobicContact CD2-CH2 4.08Å; L69-W140 HydrophobicContact CD2-CZ2 3.77Å; L69-W140 HydrophobicContact CG-CZ2 4.46Å; L70-W140 HydrophobicContact CD2-CH2 3.92Å; L70-W140 HydrophobicContact CD2-CZ2 4.19Å; L70-W140 HydrophobicContact CD2-CZ3 4.48Å; L70-W140 HydrophobicContact CG-CH2 4.05Å; L122-W140 HydrophobicContact CB-CG 4.37Å; L122-W140 WeakPolarHBondContact O-CB 3.29Å; N124-W140 WeakPolarHBondContact CA-O 3.42Å; N124-W140 PolarHBondContact N-O 2.89Å; T125-W140 WeakPolarHBondContact O-CB 3.3Å; T125-W140 PolarHBondContact O-N 3.31Å; M127-W140 HydrophobicContact CE-CD2 4.23Å; M127-W140 HydrophobicContact CE-CE3 3.97Å; M127-W140 HydrophobicContact CE-CH2 3.6Å; M127-W140 HydrophobicContact CE-CZ2 3.84Å; M127-W140 HydrophobicContact CE-CZ3 3.66Å; M127-W140 HydrophobicContact CG-CD2 3.6Å; M127-W140 HydrophobicContact CG-CE3 4.12Å; M127-W140 HydrophobicContact CG-CG 3.74Å; M127-W140 HydrophobicContact CG-CZ2 4.34Å; M127-W140 HydrophobicContact SD-CD2 4.21Å; M127-W140 HydrophobicContact SD-CE3 4.11Å; M127-W140 HydrophobicContact SD-CZ3 4.39Å; W140-I142 HydrophobicContact CB-CD1 3.95Å; W140-I142 HydrophobicContact CB-CG1 3.93Å; W140-I142 HydrophobicContact CD2-CD1 3.73Å; W140-I142 HydrophobicContact CD2-CG1 4.41Å; W140-I142 HydrophobicContact CE3-CD1 3.44Å; W140-I142 VanDerWaalsContact CE3-CD1 3.44Å; W140-I142 HydrophobicContact CE3-CG1 3.96Å; W140-I142 HydrophobicContact CG-CD1 4.01Å; W140-I142 HydrophobicContact CG-CG1 4.47Å; W140-I142 HydrophobicContact CZ3-CD1 4.1Å
141	N	95.3	Very high	91.8	Very high	66 Å²	66	91.4 Å²	91.4	35%	0.353	41%	0.414	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-103.4	100.2	168.5	-174.8	-13.7	0	0	0	109.3	L54 G55 H56 L139	L54-N141 WeakPolarHBondContact CA-O 3.41Å; G55-N141 PolarHBondContact N-O 3.29Å; H56-N141 HydrophobicContact CB-CB 3.9Å; L139-N141 PolarHBondContact O-N 2.95Å
142	I	95.8	Very high	92.4	Very high	4 Å²	4	86.5 Å²	86.5	2%	0.021	39%	0.394	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-134.4	134.8	-166.6	-52	-166.3	0	0	0	110.4	I52 Y53 L54 A119 L122 H123 W140	I52-I142 HydrophobicContact CB-CG2 4.42Å; I52-I142 HydrophobicContact CG2-CB 4.39Å; I52-I142 HydrophobicContact CG2-CG2 2.96Å; Y53-I142 CarbonylContact O-C 3.53Å; Y53-I142 WeakPolarHBondContact O-CA 3.21Å; L54-I142 HydrophobicContact CD2-CB 4.34Å; L54-I142 HydrophobicContact CD2-CD1 3.96Å; L54-I142 HydrophobicContact CD2-CG1 3.61Å; L54-I142 HydrophobicContact CD2-CG2 4.25Å; A119-I142 HydrophobicContact CB-CG2 4.35Å; L122-I142 HydrophobicContact CB-CD1 3.83Å; L122-I142 HydrophobicContact CD1-CD1 4.4Å; H123-I142 PolarHBondContact ND1-N 3.28Å; H123-I142 PolarHBondContact ND1-O 2.92Å; W140-I142 HydrophobicContact CB-CD1 3.95Å; W140-I142 HydrophobicContact CB-CG1 3.93Å; W140-I142 HydrophobicContact CD2-CD1 3.73Å; W140-I142 HydrophobicContact CD2-CG1 4.41Å; W140-I142 HydrophobicContact CE3-CD1 3.44Å; W140-I142 VanDerWaalsContact CE3-CD1 3.44Å; W140-I142 HydrophobicContact CE3-CG1 3.96Å; W140-I142 HydrophobicContact CG-CD1 4.01Å; W140-I142 HydrophobicContact CG-CG1 4.47Å; W140-I142 HydrophobicContact CZ3-CD1 4.1Å
143	K	96.9	Very high	92.7	Very high	133 Å²	133	75.1 Å²	75.1	58%	0.578	35%	0.352	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-135.5	134.4	174.1	-174.4	176	179.6	177.9	0	111.5	I52 Y53	I52-K143 CarbonylContact C-O 3.5Å; I52-K143 WeakPolarHBondContact CA-O 3.48Å; Y53-K143 HydrophobicContact CD1-CB 4.37Å; Y53-K143 PolarHBondContact N-O 3.12Å; Y53-K143 PolarHBondContact O-N 2.77Å
144	Y	97.6	Very high	93.1	Very high	44 Å²	44	73.5 Å²	73.5	17%	0.173	35%	0.351	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-75.8	133.4	169.7	171.6	-105.8	0	0	0	110.8	I51 K112 A115 K116 H146	I51-Y144 WeakPolarHBondContact O-CD2 3.09Å; K112-Y144 HydrophobicContact CB-CE2 4.46Å; A115-Y144 HydrophobicContact CB-CD2 3.9Å; A115-Y144 HydrophobicContact CB-CE2 4.05Å; K116-Y144 HydrophobicContact CD-CE1 4.24Å; K116-Y144 VanDerWaalsContact CE-CE1 3.45Å; K116-Y144 HydrophobicContact CG-CD1 3.76Å; K116-Y144 HydrophobicContact CG-CD2 4.11Å; K116-Y144 HydrophobicContact CG-CE1 3.76Å; K116-Y144 HydrophobicContact CG-CE2 4.12Å; K116-Y144 HydrophobicContact CG-CG 3.93Å; Y144-H146 HydrophobicContact CE1-CB 4.01Å; Y144-H146 AromaticContact CE1-CD2 3.97Å
145	L	96.5	Very high	93.6	Very high	37 Å²	37	71.3 Å²	71.3	19%	0.194	35%	0.348	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-100.8	111.1	177.2	-60.9	-178	0	0	0	110.4	I51 F148	I51-L145 HydrophobicContact CG2-CD1 4.31Å; I51-L145 PolarHBondContact O-N 3.37Å; L145-F148 HydrophobicContact CB-CB 3.53Å; L145-F148 HydrophobicContact CB-CD1 4.2Å; L145-F148 HydrophobicContact CB-CG 4Å; L145-F148 HydrophobicContact CD1-CB 4.35Å; L145-F148 HydrophobicContact CD1-CD1 3.61Å; L145-F148 HydrophobicContact CD1-CD2 4.42Å; L145-F148 HydrophobicContact CD1-CE1 3.94Å; L145-F148 HydrophobicContact CD1-CG 3.87Å; L145-F148 HydrophobicContact CD1-CZ 4.47Å
146	H	95.4	Very high	94	Very high	131 Å²	131	77.7 Å²	77.7	61%	0.606	37%	0.372	S	S	*	.	T	Hydrogen-bonded Turn	trans	-74.7	138.4	179.9	-169.5	-119.8	0	0	0	111.6	Y144 F148	Y144-H146 HydrophobicContact CE1-CB 4.01Å; Y144-H146 AromaticContact CE1-CD2 3.97Å; H146-F148 PolarHBondContact O-N 2.92Å
147	R	94.3	Very high	94.1	Very high	198 Å²	198	76.9 Å²	76.9	75%	0.747	37%	0.37	S	S	*	.	T	Hydrogen-bonded Turn	trans	55.6	14.6	-179.4	-59.7	169.9	90.8	-144.6	5.7	114.3	H149	R147-H149 PolarHBondContact O-ND1 3.19Å
148	F	95.3	Very high	94.4	Very high	53 Å²	53	74.1 Å²	74.1	23%	0.232	35%	0.354	C	S	.	.			trans	-92.5	127.9	-180	-170.8	-97.9	0	0	0	110.2	I51 L145 H146 H152 L153	I51-F148 HydrophobicContact CB-CD1 3.97Å; I51-F148 HydrophobicContact CD1-CD1 3.66Å; I51-F148 HydrophobicContact CD1-CE1 3.98Å; I51-F148 HydrophobicContact CG1-CD1 4.39Å; I51-F148 HydrophobicContact CG2-CD1 3.9Å; I51-F148 HydrophobicContact CG2-CE1 4.16Å; L145-F148 HydrophobicContact CB-CB 3.53Å; L145-F148 HydrophobicContact CB-CD1 4.2Å; L145-F148 HydrophobicContact CB-CG 4Å; L145-F148 HydrophobicContact CD1-CB 4.35Å; L145-F148 HydrophobicContact CD1-CD1 3.61Å; L145-F148 HydrophobicContact CD1-CD2 4.42Å; L145-F148 HydrophobicContact CD1-CE1 3.94Å; L145-F148 HydrophobicContact CD1-CG 3.87Å; L145-F148 HydrophobicContact CD1-CZ 4.47Å; H146-F148 PolarHBondContact O-N 2.92Å; F148-H152 HydrophobicContact CD2-CB 4.2Å; F148-H152 HydrophobicContact CE2-CB 3.77Å; F148-H152 HydrophobicContact CZ-CB 4.2Å; F148-L153 HydrophobicContact CE1-CB 4.05Å; F148-L153 HydrophobicContact CZ-CB 3.82Å
149	H	93.9	Very high	94.6	Very high	90 Å²	90	78.7 Å²	78.7	42%	0.417	37%	0.369	S	S	.	.			trans	-115.7	156	-179.1	-66.3	55.9	0	0	0	109.2	R147 T151 H152	R147-H149 PolarHBondContact O-ND1 3.19Å; H149-T151 PolarHBondContact O-N 3.15Å; H149-H152 WeakPolarHBondContact O-CB 3.46Å; H149-H152 PolarHBondContact O-N 2.89Å
150	W	94.9	Very high	94.5	Very high	37 Å²	37	78.3 Å²	78.3	14%	0.14	37%	0.365	C	S	.	.	H	α-helix	trans	-61.9	-31.7	-176.6	-170.4	-86.9	0	0	0	112.1	I51 R78 F80 W106 E108 H152 L153 S154	I51-W150 HydrophobicContact CD1-CB 4.08Å; I51-W150 HydrophobicContact CD1-CE3 4.2Å; R78-W150 HydrophobicContact CB-CD2 3.89Å; R78-W150 HydrophobicContact CB-CE3 3.83Å; R78-W150 HydrophobicContact CB-CH2 3.55Å; R78-W150 HydrophobicContact CB-CZ2 3.63Å; R78-W150 HydrophobicContact CB-CZ3 3.67Å; R78-W150 VanDerWaalsContact CZ-CB 3.4Å; R78-W150 VanDerWaalsContact NH1-CD1 3.26Å; R78-W150 VanDerWaalsContact NH2-CB 3.27Å; F80-W150 HydrophobicContact CB-CH2 3.45Å; F80-W150 VanDerWaalsContact CB-CH2 3.45Å; F80-W150 HydrophobicContact CB-CZ2 3.75Å; W106-W150 HydrophobicContact CB-CZ3 4.27Å; E108-W150 HydrophobicContact CB-CE3 4.02Å; E108-W150 HydrophobicContact CB-CZ3 4.25Å; W150-H152 VanDerWaalsContact C-N 3.26Å; W150-H152 PolarHBondContact O-N 2.93Å; W150-L153 HydrophobicContact CH2-CD2 4.34Å; W150-L153 HydrophobicContact CZ2-CD2 4.45Å; W150-L153 HydrophobicContact CZ3-CD2 4.39Å; W150-L153 WeakPolarHBondContact O-CB 3.23Å; W150-L153 PolarHBondContact O-N 3.17Å; W150-L153 VanDerWaalsContact O-N 3.12Å; W150-S154 PolarHBondContact O-N 2.95Å; W150-S154 PolarHBondContact O-OG 3.33Å
151	T	95.3	Very high	94.3	Very high	80 Å²	80	82.3 Å²	82.3	49%	0.491	38%	0.384	S	S	.	.	H	α-helix	trans	-53.7	-43	174.4	48.5	0	0	0	0	111.7	H149 L153 S154 E155	H149-T151 PolarHBondContact O-N 3.15Å; T151-L153 VanDerWaalsContact C-N 3.32Å; T151-L153 PolarHBondContact O-N 3.02Å; T151-S154 WeakPolarHBondContact CA-OG 3.42Å; T151-S154 PolarHBondContact O-N 3.37Å; T151-S154 PolarHBondContact O-OG 3.43Å; T151-E155 WeakPolarHBondContact O-CB 3.5Å; T151-E155 PolarHBondContact O-N 3.03Å
152	H	95.4	Very high	94.3	Very high	82 Å²	82	82.1 Å²	82.1	38%	0.38	39%	0.385	S	S	.	.	H	α-helix	trans	-64.5	-36.7	179.4	-55.5	165.9	0	0	0	112.1	F148 H149 W150 R156	F148-H152 HydrophobicContact CD2-CB 4.2Å; F148-H152 HydrophobicContact CE2-CB 3.77Å; F148-H152 HydrophobicContact CZ-CB 4.2Å; H149-H152 WeakPolarHBondContact O-CB 3.46Å; H149-H152 PolarHBondContact O-N 2.89Å; W150-H152 VanDerWaalsContact C-N 3.26Å; W150-H152 PolarHBondContact O-N 2.93Å; H152-R156 VanDerWaalsContact O-CB 3.29Å; H152-R156 WeakPolarHBondContact O-CB 3.26Å; H152-R156 PolarHBondContact O-N 3.45Å
153	L	93.3	Very high	94.4	Very high	12 Å²	12	83.4 Å²	83.4	6%	0.063	39%	0.393	C	S	.	.	H	α-helix	trans	-65.8	-51.3	175.4	-179.8	63	0	0	0	110.8	F80 W106 F148 W150 T151 E155 R156 L157	F80-L153 HydrophobicContact CB-CD2 4.35Å; F80-L153 HydrophobicContact CD1-CD2 4.05Å; W106-L153 HydrophobicContact CB-CD2 3.72Å; W106-L153 HydrophobicContact CD2-CD1 3.78Å; W106-L153 HydrophobicContact CD2-CD2 3.73Å; W106-L153 HydrophobicContact CD2-CG 4.43Å; W106-L153 HydrophobicContact CE3-CD1 4.18Å; W106-L153 HydrophobicContact CE3-CD2 4.04Å; W106-L153 HydrophobicContact CG-CD1 4.24Å; W106-L153 HydrophobicContact CG-CD2 3.59Å; W106-L153 HydrophobicContact CH2-CD1 4.22Å; W106-L153 HydrophobicContact CZ2-CD1 3.86Å; W106-L153 HydrophobicContact CZ3-CD1 4.35Å; F148-L153 HydrophobicContact CE1-CB 4.05Å; F148-L153 HydrophobicContact CZ-CB 3.82Å; W150-L153 HydrophobicContact CH2-CD2 4.34Å; W150-L153 HydrophobicContact CZ2-CD2 4.45Å; W150-L153 HydrophobicContact CZ3-CD2 4.39Å; W150-L153 WeakPolarHBondContact O-CB 3.23Å; W150-L153 PolarHBondContact O-N 3.17Å; W150-L153 VanDerWaalsContact O-N 3.12Å; T151-L153 VanDerWaalsContact C-N 3.32Å; T151-L153 PolarHBondContact O-N 3.02Å; L153-E155 VanDerWaalsContact C-N 3.32Å; L153-E155 PolarHBondContact O-N 3.3Å; L153-R156 PolarHBondContact O-N 3.24Å; L153-L157 HydrophobicContact CD1-CD1 4.19Å; L153-L157 HydrophobicContact CD1-CG 4.49Å; L153-L157 HydrophobicContact CG-CD1 4.13Å; L153-L157 WeakPolarHBondContact O-CG 3.01Å; L153-L157 PolarHBondContact O-N 3.34Å
154	S	92.6	Very high	94.2	Very high	56 Å²	56	82.2 Å²	82.2	39%	0.392	39%	0.393	S	S	.	.	H	α-helix	trans	-64	-38.4	179.9	49.8	0	0	0	0	112.5	W150 T151 A158	W150-S154 PolarHBondContact O-N 2.95Å; W150-S154 PolarHBondContact O-OG 3.33Å; T151-S154 WeakPolarHBondContact CA-OG 3.42Å; T151-S154 PolarHBondContact O-N 3.37Å; T151-S154 PolarHBondContact O-OG 3.43Å; S154-A158 WeakPolarHBondContact O-CB 3.33Å; S154-A158 PolarHBondContact O-N 2.84Å
155	E	94.4	Very high	94.1	Very high	128 Å²	128	83.9 Å²	83.9	60%	0.598	40%	0.402	S	S	*	.	H	α-helix	trans	-64.2	-47.4	177.7	-179.5	177.8	-165.8	0	0	110.5	T151 L153 L157 A158 Y159	T151-E155 WeakPolarHBondContact O-CB 3.5Å; T151-E155 PolarHBondContact O-N 3.03Å; L153-E155 VanDerWaalsContact C-N 3.32Å; L153-E155 PolarHBondContact O-N 3.3Å; E155-L157 PolarHBondContact O-N 2.76Å; E155-A158 PolarHBondContact O-N 3.14Å; E155-Y159 VanDerWaalsContact O-CB 3.28Å; E155-Y159 WeakPolarHBondContact O-CB 3.5Å; E155-Y159 PolarHBondContact O-N 2.93Å
156	R	93.3	Very high	94.1	Very high	150 Å²	150	88.1 Å²	88.1	57%	0.566	42%	0.42	S	S	*	.	H	α-helix	trans	-59.4	-47.5	177.3	-179.5	63.1	-172.6	-165.3	3.1	112	H152 L153 Y159 E160	H152-R156 VanDerWaalsContact O-CB 3.29Å; H152-R156 WeakPolarHBondContact O-CB 3.26Å; H152-R156 PolarHBondContact O-N 3.45Å; L153-R156 PolarHBondContact O-N 3.24Å; R156-Y159 PolarHBondContact O-N 2.86Å; R156-E160 IonicContact CZ-OE1 3.61Å; R156-E160 IonicContact NE-OE1 2.74Å; R156-E160 PolarHBondContact NE-OE1 3.01Å; R156-E160 IonicContact NH2-OE1 3.46Å; R156-E160 PolarHBondContact NH2-OE1 3.47Å; R156-E160 WeakPolarHBondContact O-CG 3.47Å; R156-E160 PolarHBondContact O-N 3.3Å
157	L	90	Very high	94.2	Very high	49 Å²	49	89.9 Å²	89.9	26%	0.257	42%	0.422	S	S	.	.	H	α-helix	trans	-64.2	-42.4	178.9	-70	171.2	0	0	0	111.9	F80 L153 E155 Q161	F80-L157 HydrophobicContact CD1-CD1 4.17Å; F80-L157 HydrophobicContact CE1-CD1 3.52Å; F80-L157 HydrophobicContact CZ-CD1 3.73Å; L153-L157 HydrophobicContact CD1-CD1 4.19Å; L153-L157 HydrophobicContact CD1-CG 4.49Å; L153-L157 HydrophobicContact CG-CD1 4.13Å; L153-L157 WeakPolarHBondContact O-CG 3.01Å; L153-L157 PolarHBondContact O-N 3.34Å; E155-L157 PolarHBondContact O-N 2.76Å; L157-Q161 WeakPolarHBondContact O-CB 3.36Å; L157-Q161 PolarHBondContact O-N 3.05Å
158	A	92	Very high	94.2	Very high	53 Å²	53	85.1 Å²	85.1	44%	0.438	41%	0.411	S	S	.	.	H	α-helix	trans	-63.6	-44.6	176.3	0	0	0	0	0	111	S154 E155 Q161 T162	S154-A158 WeakPolarHBondContact O-CB 3.33Å; S154-A158 PolarHBondContact O-N 2.84Å; E155-A158 PolarHBondContact O-N 3.14Å; A158-Q161 PolarHBondContact O-N 3.47Å; A158-T162 WeakPolarHBondContact O-CB 3.48Å; A158-T162 WeakPolarHBondContact O-CG2 3.45Å; A158-T162 PolarHBondContact O-N 3.4Å; A158-T162 PolarHBondContact O-OG1 2.83Å
159	Y	95.8	Very high	94.3	Very high	142 Å²	142	90.7 Å²	90.7	56%	0.557	43%	0.43	S	S	*	.	H	α-helix	trans	-58.3	-52.4	177.1	179	-100.6	0	0	0	111.3	E155 R156 Q161 T162 V163	E155-Y159 VanDerWaalsContact O-CB 3.28Å; E155-Y159 WeakPolarHBondContact O-CB 3.5Å; E155-Y159 PolarHBondContact O-N 2.93Å; R156-Y159 PolarHBondContact O-N 2.86Å; Y159-Q161 VanDerWaalsContact C-N 3.29Å; Y159-Q161 PolarHBondContact O-N 3.26Å; Y159-T162 WeakPolarHBondContact CA-OG1 3.43Å; Y159-T162 PolarHBondContact O-N 2.99Å; Y159-T162 VanDerWaalsContact O-N 3.14Å; Y159-T162 PolarHBondContact O-OG1 3.48Å; Y159-V163 HydrophobicContact CD1-CG2 4.21Å; Y159-V163 HydrophobicContact CD2-CG2 4.25Å; Y159-V163 HydrophobicContact CE1-CG2 3.81Å; Y159-V163 HydrophobicContact CE2-CG2 3.84Å; Y159-V163 HydrophobicContact CG-CG2 4.43Å; Y159-V163 WeakPolarHBondContact O-CG2 3.46Å; Y159-V163 PolarHBondContact O-N 3.07Å
160	E	92.1	Very high	94.5	Very high	85 Å²	85	89 Å²	89	40%	0.397	43%	0.432	S	S	.	.	H	α-helix	trans	-57.1	-43.3	178.3	-73.1	178.7	175.9	0	0	112.1	R156 L164	R156-E160 IonicContact CZ-OE1 3.61Å; R156-E160 IonicContact NE-OE1 2.74Å; R156-E160 PolarHBondContact NE-OE1 3.01Å; R156-E160 IonicContact NH2-OE1 3.46Å; R156-E160 PolarHBondContact NH2-OE1 3.47Å; R156-E160 WeakPolarHBondContact O-CG 3.47Å; R156-E160 PolarHBondContact O-N 3.3Å; E160-L164 WeakPolarHBondContact O-CB 3.28Å; E160-L164 PolarHBondContact O-N 3.34Å
161	Q	91	Very high	94.6	Very high	99 Å²	99	93 Å²	93	46%	0.463	45%	0.452	S	S	.	.	H	α-helix	trans	-65.3	-41.2	177.9	-174.6	60.1	65.9	0	0	112.4	L157 A158 Y159 Q165	L157-Q161 WeakPolarHBondContact O-CB 3.36Å; L157-Q161 PolarHBondContact O-N 3.05Å; A158-Q161 PolarHBondContact O-N 3.47Å; Y159-Q161 VanDerWaalsContact C-N 3.29Å; Y159-Q161 PolarHBondContact O-N 3.26Å; Q161-Q165 WeakPolarHBondContact O-CB 3.43Å; Q161-Q165 VanDerWaalsContact O-CG 3.25Å; Q161-Q165 WeakPolarHBondContact O-CG 3.5Å; Q161-Q165 PolarHBondContact O-N 3.4Å
162	T	95.1	Very high	94.7	Very high	61 Å²	61	92.4 Å²	92.4	37%	0.374	45%	0.448	S	S	.	.	H	α-helix	trans	-67.7	-42.9	179.1	60.3	0	0	0	0	111.7	A158 Y159 L164 Q165 Q166	A158-T162 WeakPolarHBondContact O-CB 3.48Å; A158-T162 WeakPolarHBondContact O-CG2 3.45Å; A158-T162 PolarHBondContact O-N 3.4Å; A158-T162 PolarHBondContact O-OG1 2.83Å; Y159-T162 WeakPolarHBondContact CA-OG1 3.43Å; Y159-T162 PolarHBondContact O-N 2.99Å; Y159-T162 VanDerWaalsContact O-N 3.14Å; Y159-T162 PolarHBondContact O-OG1 3.48Å; T162-L164 PolarHBondContact O-N 3.05Å; T162-Q165 PolarHBondContact O-N 2.79Å; T162-Q166 WeakPolarHBondContact O-CB 3.39Å; T162-Q166 VanDerWaalsContact O-CG 3.3Å; T162-Q166 WeakPolarHBondContact O-CG 3.43Å; T162-Q166 PolarHBondContact O-N 3.32Å
163	V	96.6	Very high	94.8	Very high	32 Å²	32	91.8 Å²	91.8	19%	0.194	45%	0.453	C	S	.	.	H	α-helix	trans	-61.3	-46.2	176.8	171.1	0	0	0	0	110.5	Y159 Q165 Q166 R167	Y159-V163 HydrophobicContact CD1-CG2 4.21Å; Y159-V163 HydrophobicContact CD2-CG2 4.25Å; Y159-V163 HydrophobicContact CE1-CG2 3.81Å; Y159-V163 HydrophobicContact CE2-CG2 3.84Å; Y159-V163 HydrophobicContact CG-CG2 4.43Å; Y159-V163 WeakPolarHBondContact O-CG2 3.46Å; Y159-V163 PolarHBondContact O-N 3.07Å; V163-Q165 PolarHBondContact O-N 2.87Å; V163-Q166 PolarHBondContact O-N 3.37Å; V163-R167 WeakPolarHBondContact O-CG 3.41Å; V163-R167 PolarHBondContact O-N 3.01Å
164	L	93.6	Very high	95	Very high	108 Å²	108	96.9 Å²	96.9	57%	0.565	48%	0.477	S	S	*	.	H	α-helix	trans	-62.9	-41.9	177.6	-176.7	134.1	0	0	0	111.8	E160 T162 L168	E160-L164 WeakPolarHBondContact O-CB 3.28Å; E160-L164 PolarHBondContact O-N 3.34Å; T162-L164 PolarHBondContact O-N 3.05Å; L164-L168 WeakPolarHBondContact O-CB 3.5Å; L164-L168 PolarHBondContact O-N 2.99Å
165	Q	95	Very high	95.2	Very high	78 Å²	78	96.6 Å²	96.6	36%	0.364	48%	0.478	S	S	.	.	H	α-helix	trans	-65.6	-40.4	176.3	-76.1	176.7	9.8	0	0	112.6	Q161 T162 V163 L168 R169	Q161-Q165 WeakPolarHBondContact O-CB 3.43Å; Q161-Q165 VanDerWaalsContact O-CG 3.25Å; Q161-Q165 WeakPolarHBondContact O-CG 3.5Å; Q161-Q165 PolarHBondContact O-N 3.4Å; T162-Q165 PolarHBondContact O-N 2.79Å; V163-Q165 PolarHBondContact O-N 2.87Å; Q165-L168 PolarHBondContact O-N 3.39Å; Q165-R169 WeakPolarHBondContact O-CB 3.27Å; Q165-R169 WeakPolarHBondContact O-CG 3.46Å; Q165-R169 PolarHBondContact O-N 3.33Å
166	Q	96.8	Very high	95.3	Very high	126 Å²	126	97.3 Å²	97.3	59%	0.589	48%	0.479	S	S	*	.	H	α-helix	trans	-63.3	-45.4	177.5	-77.2	175.8	-9.7	0	0	111.4	T162 V163 R169 A170	T162-Q166 WeakPolarHBondContact O-CB 3.39Å; T162-Q166 VanDerWaalsContact O-CG 3.3Å; T162-Q166 WeakPolarHBondContact O-CG 3.43Å; T162-Q166 PolarHBondContact O-N 3.32Å; V163-Q166 PolarHBondContact O-N 3.37Å; Q166-R169 PolarHBondContact O-N 3.45Å; Q166-A170 PolarHBondContact O-N 3.45Å
167	R	96.9	Very high	95.5	Very high	169 Å²	169	98.1 Å²	98.1	64%	0.638	49%	0.486	S	S	*	.	H	α-helix	trans	-58.8	-50.4	175.2	-71.9	178.6	-177.2	-171.8	0.3	111.6	V163 R169 A170 E171	V163-R167 WeakPolarHBondContact O-CG 3.41Å; V163-R167 PolarHBondContact O-N 3.01Å; R167-R169 VanDerWaalsContact C-N 3.3Å; R167-R169 PolarHBondContact O-N 2.82Å; R167-A170 WeakPolarHBondContact O-CB 3.41Å; R167-A170 PolarHBondContact O-N 3.24Å; R167-A170 VanDerWaalsContact O-N 3.14Å; R167-E171 WeakPolarHBondContact O-CG 3.35Å; R167-E171 PolarHBondContact O-N 3.06Å
168	L	96.1	Very high	95.8	Very high	97 Å²	97	101.2 Å²	101.2	51%	0.508	50%	0.499	S	S	.	.	H	α-helix	trans	-60.2	-40.4	178.1	-177.6	64.2	0	0	0	112	L164 Q165 E171 V172	L164-L168 WeakPolarHBondContact O-CB 3.5Å; L164-L168 PolarHBondContact O-N 2.99Å; Q165-L168 PolarHBondContact O-N 3.39Å; L168-E171 PolarHBondContact O-N 2.75Å; L168-V172 HydrophobicContact CD1-CG2 4.32Å; L168-V172 HydrophobicContact CG-CG2 4.47Å; L168-V172 WeakPolarHBondContact O-CB 3.31Å; L168-V172 VanDerWaalsContact O-CG2 3.24Å; L168-V172 WeakPolarHBondContact O-CG2 3.4Å; L168-V172 PolarHBondContact O-N 2.89Å
169	R	96.9	Very high	96	Very high	170 Å²	170	102.6 Å²	102.6	64%	0.642	50%	0.503	S	S	*	.	H	α-helix	trans	-63.8	-42	176.2	-76.9	173	-177.2	178.4	3.1	111.8	Q165 Q166 R167 V172 S173	Q165-R169 WeakPolarHBondContact O-CB 3.27Å; Q165-R169 WeakPolarHBondContact O-CG 3.46Å; Q165-R169 PolarHBondContact O-N 3.33Å; Q166-R169 PolarHBondContact O-N 3.45Å; R167-R169 VanDerWaalsContact C-N 3.3Å; R167-R169 PolarHBondContact O-N 2.82Å; R169-V172 PolarHBondContact O-N 2.7Å; R169-S173 VanDerWaalsContact O-CB 3.26Å; R169-S173 WeakPolarHBondContact O-CB 3.18Å; R169-S173 PolarHBondContact O-N 3.37Å; R169-S173 PolarHBondContact O-OG 3.41Å
170	A	97.1	Very high	96	Very high	55 Å²	55	99.4 Å²	99.4	46%	0.455	50%	0.501	S	S	.	.	H	α-helix	trans	-62.2	-48.6	176.5	0	0	0	0	0	111	Q166 R167 V172 S173 Q174	Q166-A170 PolarHBondContact O-N 3.45Å; R167-A170 WeakPolarHBondContact O-CB 3.41Å; R167-A170 PolarHBondContact O-N 3.24Å; R167-A170 VanDerWaalsContact O-N 3.14Å; A170-V172 PolarHBondContact O-N 3.06Å; A170-S173 WeakPolarHBondContact CA-OG 3.47Å; A170-S173 PolarHBondContact O-N 2.89Å; A170-S173 VanDerWaalsContact O-N 3.16Å; A170-S173 PolarHBondContact O-OG 3.42Å; A170-Q174 PolarHBondContact O-N 3.06Å
171	E	97.5	Very high	96.2	Very high	122 Å²	122	101.8 Å²	101.8	57%	0.57	51%	0.51	S	S	*	.	H	α-helix	trans	-58.1	-47.8	176.3	-71.9	171	-160	0	0	111.9	R167 L168 S173 Q174 A175	R167-E171 WeakPolarHBondContact O-CG 3.35Å; R167-E171 PolarHBondContact O-N 3.06Å; L168-E171 PolarHBondContact O-N 2.75Å; E171-S173 VanDerWaalsContact C-N 3.32Å; E171-S173 PolarHBondContact O-N 2.97Å; E171-Q174 PolarHBondContact O-N 3.19Å; E171-A175 PolarHBondContact O-N 2.84Å
172	V	97.3	Very high	96.4	Very high	66 Å²	66	104.7 Å²	104.7	40%	0.4	52%	0.518	S	S	.	.	H	α-helix	trans	-63.1	-39.8	176.7	170.4	0	0	0	0	111.3	L168 R169 A170 Q174 K176	L168-V172 HydrophobicContact CD1-CG2 4.32Å; L168-V172 HydrophobicContact CG-CG2 4.47Å; L168-V172 WeakPolarHBondContact O-CB 3.31Å; L168-V172 VanDerWaalsContact O-CG2 3.24Å; L168-V172 WeakPolarHBondContact O-CG2 3.4Å; L168-V172 PolarHBondContact O-N 2.89Å; R169-V172 PolarHBondContact O-N 2.7Å; A170-V172 PolarHBondContact O-N 3.06Å; V172-Q174 VanDerWaalsContact C-N 3.34Å; V172-K176 HydrophobicContact CG1-CD 4.08Å; V172-K176 HydrophobicContact CG1-CG 4.37Å; V172-K176 WeakPolarHBondContact O-CB 3.48Å; V172-K176 VanDerWaalsContact O-CG 3.29Å; V172-K176 WeakPolarHBondContact O-CG 3.48Å; V172-K176 PolarHBondContact O-N 2.9Å
173	S	96.6	Very high	96.5	Very high	70 Å²	70	106.3 Å²	106.3	49%	0.49	52%	0.524	S	S	.	.	H	α-helix	trans	-65.9	-38.1	178.9	74.8	0	0	0	0	112.1	R169 A170 E171 K177	R169-S173 VanDerWaalsContact O-CB 3.26Å; R169-S173 WeakPolarHBondContact O-CB 3.18Å; R169-S173 PolarHBondContact O-N 3.37Å; R169-S173 PolarHBondContact O-OG 3.41Å; A170-S173 WeakPolarHBondContact CA-OG 3.47Å; A170-S173 PolarHBondContact O-N 2.89Å; A170-S173 VanDerWaalsContact O-N 3.16Å; A170-S173 PolarHBondContact O-OG 3.42Å; E171-S173 VanDerWaalsContact C-N 3.32Å; E171-S173 PolarHBondContact O-N 2.97Å; S173-K177 WeakPolarHBondContact O-CB 3.4Å; S173-K177 PolarHBondContact O-N 3.4Å
174	Q	97.4	Very high	96.5	Very high	118 Å²	118	108 Å²	108	55%	0.551	53%	0.532	S	S	*	.	H	α-helix	trans	-65.2	-51.4	175.8	-178.2	179.5	-8.8	0	0	110.7	A170 E171 V172 K176 K177 E178	A170-Q174 PolarHBondContact O-N 3.06Å; E171-Q174 PolarHBondContact O-N 3.19Å; V172-Q174 VanDerWaalsContact C-N 3.34Å; Q174-K176 VanDerWaalsContact C-N 3.29Å; Q174-K176 PolarHBondContact O-N 3.49Å; Q174-K177 WeakPolarHBondContact O-CB 3.33Å; Q174-K177 PolarHBondContact O-N 2.8Å; Q174-K177 VanDerWaalsContact O-N 3.08Å; Q174-E178 WeakPolarHBondContact CG-OE1 3.31Å; Q174-E178 PolarHBondContact NE2-OE1 3.02Å; Q174-E178 WeakPolarHBondContact O-CG 3.48Å; Q174-E178 PolarHBondContact O-N 3.42Å
175	A	96.9	Very high	96.6	Very high	50 Å²	50	105.8 Å²	105.8	41%	0.413	52%	0.521	S	S	.	.	H	α-helix	trans	-59.1	-40	178.2	0	0	0	0	0	112.3	E171 T179	E171-A175 PolarHBondContact O-N 2.84Å; A175-T179 WeakPolarHBondContact O-CB 3.33Å; A175-T179 PolarHBondContact O-N 3.41Å; A175-T179 PolarHBondContact O-OG1 2.83Å
176	K	97.1	Very high	96.6	Very high	144 Å²	144	105.2 Å²	105.2	63%	0.626	52%	0.522	S	S	*	.	H	α-helix	trans	-65	-41.2	174.7	-77.8	-177.3	176.5	-171.5	0	112.5	V172 Q174 T179 S180	V172-K176 HydrophobicContact CG1-CD 4.08Å; V172-K176 HydrophobicContact CG1-CG 4.37Å; V172-K176 WeakPolarHBondContact O-CB 3.48Å; V172-K176 VanDerWaalsContact O-CG 3.29Å; V172-K176 WeakPolarHBondContact O-CG 3.48Å; V172-K176 PolarHBondContact O-N 2.9Å; Q174-K176 VanDerWaalsContact C-N 3.29Å; Q174-K176 PolarHBondContact O-N 3.49Å; K176-T179 PolarHBondContact O-N 3.21Å; K176-S180 WeakPolarHBondContact O-CB 3.36Å; K176-S180 PolarHBondContact O-N 3.12Å
177	K	97.2	Very high	96.5	Very high	167 Å²	167	105.4 Å²	105.4	73%	0.726	52%	0.523	S	S	*	.	H	α-helix	trans	-63	-45.1	177.5	-174.4	177	-178.8	179.4	0	111	S173 Q174 S180 F181	S173-K177 WeakPolarHBondContact O-CB 3.4Å; S173-K177 PolarHBondContact O-N 3.4Å; Q174-K177 WeakPolarHBondContact O-CB 3.33Å; Q174-K177 PolarHBondContact O-N 2.8Å; Q174-K177 VanDerWaalsContact O-N 3.08Å; K177-S180 PolarHBondContact O-N 2.83Å; K177-F181 VanDerWaalsContact O-CB 3.25Å; K177-F181 WeakPolarHBondContact O-CB 3.37Å; K177-F181 PolarHBondContact O-N 2.74Å
178	E	95.9	Very high	96.4	Very high	113 Å²	113	102.6 Å²	102.6	53%	0.528	52%	0.516	S	S	.	.	H	α-helix	trans	-62.7	-45.5	176.6	-69.9	170.8	-168.8	0	0	111.6	Q174 F181 Y182	Q174-E178 WeakPolarHBondContact CG-OE1 3.31Å; Q174-E178 PolarHBondContact NE2-OE1 3.02Å; Q174-E178 WeakPolarHBondContact O-CG 3.48Å; Q174-E178 PolarHBondContact O-N 3.42Å; E178-F181 PolarHBondContact O-N 3.08Å; E178-Y182 PolarHBondContact O-N 3.1Å
179	T	96.3	Very high	96.3	Very high	83 Å²	83	101 Å²	101	51%	0.509	51%	0.513	S	S	.	.	H	α-helix	trans	-63.2	-46.9	177.3	-54.8	0	0	0	0	111.7	A175 K176 F181 Y182 L183	A175-T179 WeakPolarHBondContact O-CB 3.33Å; A175-T179 PolarHBondContact O-N 3.41Å; A175-T179 PolarHBondContact O-OG1 2.83Å; K176-T179 PolarHBondContact O-N 3.21Å; T179-F181 VanDerWaalsContact C-N 3.3Å; T179-F181 PolarHBondContact O-N 3.38Å; T179-Y182 PolarHBondContact O-N 2.74Å; T179-L183 HydrophobicContact CG2-CD1 4.25Å; T179-L183 WeakPolarHBondContact O-CG 3.46Å; T179-L183 PolarHBondContact O-N 3.08Å
180	S	96	Very high	96.2	Very high	75 Å²	75	94.8 Å²	94.8	52%	0.524	50%	0.498	S	S	.	.	H	α-helix	trans	-63.3	-38.4	178.5	177	0	0	0	0	111.6	K176 K177 L183 N184	K176-S180 WeakPolarHBondContact O-CB 3.36Å; K176-S180 PolarHBondContact O-N 3.12Å; K177-S180 PolarHBondContact O-N 2.83Å; S180-L183 PolarHBondContact O-N 3.22Å; S180-N184 WeakPolarHBondContact O-CB 3.49Å; S180-N184 PolarHBondContact O-N 2.82Å
181	F	96.5	Very high	96	Very high	134 Å²	134	97.9 Å²	97.9	59%	0.588	50%	0.502	S	S	*	.	H	α-helix	trans	-62.1	-44.3	174.3	179.1	-101.7	0	0	0	111.8	K177 E178 T179 N185	K177-F181 VanDerWaalsContact O-CB 3.25Å; K177-F181 WeakPolarHBondContact O-CB 3.37Å; K177-F181 PolarHBondContact O-N 2.74Å; E178-F181 PolarHBondContact O-N 3.08Å; T179-F181 VanDerWaalsContact C-N 3.3Å; T179-F181 PolarHBondContact O-N 3.38Å; F181-N185 WeakPolarHBondContact CE1-ND2 3.43Å; F181-N185 WeakPolarHBondContact CZ-ND2 3.32Å; F181-N185 VanDerWaalsContact O-CG 3.26Å; F181-N185 PolarHBondContact O-N 3.46Å; F181-N185 PolarHBondContact O-ND2 2.99Å
182	Y	95.9	Very high	95.7	Very high	161 Å²	161	97 Å²	97	63%	0.631	50%	0.501	S	S	*	.	H	α-helix	trans	-62.2	-49	176.6	-175.9	-97.8	0	0	0	112	E178 T179 N184 N185 V186	E178-Y182 PolarHBondContact O-N 3.1Å; T179-Y182 PolarHBondContact O-N 2.74Å; Y182-N184 PolarHBondContact O-N 3.42Å; Y182-N185 PolarHBondContact O-N 2.99Å; Y182-V186 HydrophobicContact CD1-CG2 4.14Å; Y182-V186 HydrophobicContact CE1-CG2 3.73Å; Y182-V186 HydrophobicContact CE2-CG2 4.39Å; Y182-V186 WeakPolarHBondContact O-CG2 3.4Å; Y182-V186 PolarHBondContact O-N 2.73Å
183	L	96.8	Very high	95.3	Very high	94 Å²	94	98.7 Å²	98.7	49%	0.492	51%	0.505	S	S	.	.	H	α-helix	trans	-58.3	-47	178.4	-70.3	174.2	0	0	0	111.9	T179 S180 N185 V186 E187	T179-L183 HydrophobicContact CG2-CD1 4.25Å; T179-L183 WeakPolarHBondContact O-CG 3.46Å; T179-L183 PolarHBondContact O-N 3.08Å; S180-L183 PolarHBondContact O-N 3.22Å; L183-N185 VanDerWaalsContact C-N 3.31Å; L183-N185 PolarHBondContact O-N 3.46Å; L183-V186 PolarHBondContact O-N 2.89Å; L183-E187 WeakPolarHBondContact O-CG 3.48Å; L183-E187 PolarHBondContact O-N 3.28Å
184	N	96.3	Very high	95	Very high	69 Å²	69	101.9 Å²	101.9	37%	0.369	51%	0.512	S	S	.	.	H	α-helix	trans	-61.4	-39	178.4	-170.6	-0.2	0	0	0	112	S180 Y182 K188	S180-N184 WeakPolarHBondContact O-CB 3.49Å; S180-N184 PolarHBondContact O-N 2.82Å; Y182-N184 PolarHBondContact O-N 3.42Å; N184-K188 WeakPolarHBondContact O-CB 3.31Å; N184-K188 VanDerWaalsContact O-CG 3.24Å; N184-K188 WeakPolarHBondContact O-CG 3.46Å; N184-K188 PolarHBondContact O-N 3.05Å; N184-K188 WeakPolarHBondContact OD1-CE 3.24Å
185	N	95.8	Very high	94.5	Very high	61 Å²	61	103 Å²	103	33%	0.326	51%	0.511	S	S	.	.	H	α-helix	trans	-68.3	-39	176.9	-71	-12	0	0	0	112.4	F181 Y182 L183 K188 S189	F181-N185 WeakPolarHBondContact CE1-ND2 3.43Å; F181-N185 WeakPolarHBondContact CZ-ND2 3.32Å; F181-N185 VanDerWaalsContact O-CG 3.26Å; F181-N185 PolarHBondContact O-N 3.46Å; F181-N185 PolarHBondContact O-ND2 2.99Å; Y182-N185 PolarHBondContact O-N 2.99Å; L183-N185 VanDerWaalsContact C-N 3.31Å; L183-N185 PolarHBondContact O-N 3.46Å; N185-K188 PolarHBondContact O-N 3.07Å; N185-S189 WeakPolarHBondContact O-CB 3.29Å; N185-S189 PolarHBondContact O-N 2.94Å; N185-S189 PolarHBondContact O-OG 3.02Å
186	V	96.4	Very high	94	Very high	65 Å²	65	108.4 Å²	108.4	39%	0.394	52%	0.521	S	S	.	.	H	α-helix	trans	-63.8	-47.5	174.7	172.8	0	0	0	0	110.4	Y182 L183 K188 S189 A190	Y182-V186 HydrophobicContact CD1-CG2 4.14Å; Y182-V186 HydrophobicContact CE1-CG2 3.73Å; Y182-V186 HydrophobicContact CE2-CG2 4.39Å; Y182-V186 WeakPolarHBondContact O-CG2 3.4Å; Y182-V186 PolarHBondContact O-N 2.73Å; L183-V186 PolarHBondContact O-N 2.89Å; V186-K188 PolarHBondContact O-N 2.94Å; V186-S189 WeakPolarHBondContact CA-OG 3.47Å; V186-S189 PolarHBondContact O-N 3.47Å; V186-S189 VanDerWaalsContact O-N 3.16Å; V186-S189 PolarHBondContact O-OG 3.1Å; V186-A190 PolarHBondContact O-N 3.35Å
187	E	94.6	Very high	93.5	Very high	131 Å²	131	107.5 Å²	107.5	61%	0.612	52%	0.517	S	S	*	.	H	α-helix	trans	-58.5	-44.8	176.1	-73.8	175.1	-176	0	0	112.1	L183 S189 A190 H191	L183-E187 WeakPolarHBondContact O-CG 3.48Å; L183-E187 PolarHBondContact O-N 3.28Å; E187-S189 PolarHBondContact O-N 2.93Å; E187-A190 PolarHBondContact O-N 3.03Å; E187-H191 WeakPolarHBondContact O-CB 3.48Å; E187-H191 PolarHBondContact O-N 2.88Å
188	K	94.6	Very high	92.9	Very high	109 Å²	109	104.6 Å²	104.6	47%	0.474	50%	0.504	S	S	.	.	H	α-helix	trans	-60.3	-44.4	174.1	-76.4	171.2	178.6	170.9	0	112.2	N184 N185 V186 H191 L192	N184-K188 WeakPolarHBondContact O-CB 3.31Å; N184-K188 VanDerWaalsContact O-CG 3.24Å; N184-K188 WeakPolarHBondContact O-CG 3.46Å; N184-K188 PolarHBondContact O-N 3.05Å; N184-K188 WeakPolarHBondContact OD1-CE 3.24Å; N185-K188 PolarHBondContact O-N 3.07Å; V186-K188 PolarHBondContact O-N 2.94Å; K188-H191 PolarHBondContact O-N 3.02Å; K188-L192 WeakPolarHBondContact O-CB 3.39Å; K188-L192 VanDerWaalsContact O-CG 3.29Å; K188-L192 WeakPolarHBondContact O-CG 3.32Å; K188-L192 PolarHBondContact O-N 3.19Å
189	S	93.3	Very high	92	Very high	65 Å²	65	101.1 Å²	101.1	46%	0.455	49%	0.488	S	S	.	.	H	α-helix	trans	-63.8	-41.8	178.2	66.5	0	0	0	0	112.2	N185 V186 E187 L192 E193	N185-S189 WeakPolarHBondContact O-CB 3.29Å; N185-S189 PolarHBondContact O-N 2.94Å; N185-S189 PolarHBondContact O-OG 3.02Å; V186-S189 WeakPolarHBondContact CA-OG 3.47Å; V186-S189 PolarHBondContact O-N 3.47Å; V186-S189 VanDerWaalsContact O-N 3.16Å; V186-S189 PolarHBondContact O-OG 3.1Å; E187-S189 PolarHBondContact O-N 2.93Å; S189-L192 PolarHBondContact O-N 2.83Å; S189-E193 WeakPolarHBondContact O-CB 3.4Å; S189-E193 PolarHBondContact O-N 3.45Å
190	A	94.1	Very high	91	Very high	39 Å²	39	105 Å²	105	32%	0.322	50%	0.5	S	S	.	.	H	α-helix	trans	-63.6	-43.3	175.9	0	0	0	0	0	111	V186 E187 E193 H194	V186-A190 PolarHBondContact O-N 3.35Å; E187-A190 PolarHBondContact O-N 3.03Å; A190-E193 PolarHBondContact O-N 2.79Å; A190-H194 PolarHBondContact O-CD2 2.81Å; A190-H194 PolarHBondContact O-N 2.78Å
191	H	93.3	Very high	90	Very high	119 Å²	119	110.2 Å²	110.2	55%	0.551	51%	0.508	S	S	*	.	H	α-helix	trans	-61.2	-45.8	176.3	-171.3	78.1	0	0	0	112.2	E187 K188 E193 H194 W195	E187-H191 WeakPolarHBondContact O-CB 3.48Å; E187-H191 PolarHBondContact O-N 2.88Å; K188-H191 PolarHBondContact O-N 3.02Å; H191-E193 VanDerWaalsContact C-N 3.35Å; H191-H194 PolarHBondContact O-N 2.8Å; H191-W195 AromaticContact NE2-CD1 3.49Å; H191-W195 AromaticContact NE2-NE1 3.87Å; H191-W195 PolarHBondContact O-N 3.34Å
192	L	90.7	Very high	89.1	Confident	103 Å²	103	108 Å²	108	54%	0.539	50%	0.503	S	S	.	.	H	α-helix	trans	-63.6	-39.1	176.4	-72	172	0	0	0	112	K188 S189 W195 R196	K188-L192 WeakPolarHBondContact O-CB 3.39Å; K188-L192 VanDerWaalsContact O-CG 3.29Å; K188-L192 WeakPolarHBondContact O-CG 3.32Å; K188-L192 PolarHBondContact O-N 3.19Å; S189-L192 PolarHBondContact O-N 2.83Å; L192-W195 PolarHBondContact O-N 2.86Å; L192-R196 WeakPolarHBondContact O-CB 3.33Å; L192-R196 WeakPolarHBondContact O-CG 3.33Å; L192-R196 PolarHBondContact O-N 2.87Å
193	E	90.1	Very high	87.5	Confident	102 Å²	102	103.3 Å²	103.3	48%	0.477	50%	0.503	S	S	.	.	H	α-helix	trans	-65.4	-43.3	176.4	-168.5	-174.2	164.8	0	0	111.6	S189 A190 H191 W195 R196 K197	S189-E193 WeakPolarHBondContact O-CB 3.4Å; S189-E193 PolarHBondContact O-N 3.45Å; A190-E193 PolarHBondContact O-N 2.79Å; H191-E193 VanDerWaalsContact C-N 3.35Å; E193-W195 VanDerWaalsContact C-N 3.32Å; E193-W195 PolarHBondContact O-N 2.9Å; E193-R196 PolarHBondContact O-N 2.99Å; E193-K197 HydrophobicContact CG-CD 4.44Å; E193-K197 WeakPolarHBondContact O-CB 3.5Å; E193-K197 WeakPolarHBondContact O-CG 3.17Å; E193-K197 PolarHBondContact O-N 3.1Å; E193-K197 WeakPolarHBondContact OE1-CE 3.2Å; E193-K197 IonicContact OE1-NZ 2.74Å; E193-K197 PolarHBondContact OE1-NZ 2.94Å
194	H	90.7	Very high	85.6	Confident	138 Å²	138	105 Å²	105	64%	0.639	51%	0.508	S	S	*	.	H	α-helix	trans	-60.1	-42.6	173	-81.2	-65.7	0	0	0	112	A190 H191 K197 K198	A190-H194 PolarHBondContact O-CD2 2.81Å; A190-H194 PolarHBondContact O-N 2.78Å; H191-H194 PolarHBondContact O-N 2.8Å; H194-K197 PolarHBondContact O-N 3.15Å; H194-K198 PolarHBondContact O-N 2.98Å
195	W	86.1	Confident	83.3	Confident	142 Å²	142	111.1 Å²	111.1	54%	0.538	54%	0.535	S	S	.	.	H	α-helix	trans	-62.7	-47.9	175.6	-115.8	99.2	0	0	0	112.1	H191 L192 E193 K197 K198 Q199	H191-W195 AromaticContact NE2-CD1 3.49Å; H191-W195 AromaticContact NE2-NE1 3.87Å; H191-W195 PolarHBondContact O-N 3.34Å; L192-W195 PolarHBondContact O-N 2.86Å; E193-W195 VanDerWaalsContact C-N 3.32Å; E193-W195 PolarHBondContact O-N 2.9Å; W195-K197 PolarHBondContact O-N 3.45Å; W195-K198 PolarHBondContact O-N 3.5Å; W195-Q199 HydrophobicContact CE3-CG 3.63Å; W195-Q199 HydrophobicContact CZ3-CG 3.79Å; W195-Q199 VanDerWaalsContact CZ3-NE2 3.32Å; W195-Q199 WeakPolarHBondContact O-CG 3.48Å; W195-Q199 PolarHBondContact O-N 3.35Å
196	R	85.4	Confident	81.3	Confident	162 Å²	162	113 Å²	113	61%	0.611	55%	0.548	S	S	*	.	H	α-helix	trans	-59.2	-44.8	176.3	-79.1	179.2	177.5	169.4	-4.1	112.1	L192 E193 K198 Q199 H200	L192-R196 WeakPolarHBondContact O-CB 3.33Å; L192-R196 WeakPolarHBondContact O-CG 3.33Å; L192-R196 PolarHBondContact O-N 2.87Å; E193-R196 PolarHBondContact O-N 2.99Å; R196-K198 VanDerWaalsContact C-N 3.32Å; R196-K198 PolarHBondContact O-N 2.98Å; R196-Q199 PolarHBondContact O-N 2.97Å; R196-H200 PolarHBondContact O-CD2 3.49Å; R196-H200 PolarHBondContact O-N 2.92Å
197	K	87.1	Confident	79.3	Confident	125 Å²	125	117.9 Å²	117.9	54%	0.543	57%	0.566	S	S	.	*	H	α-helix	trans	-61.8	-39.4	176.9	-76.6	175.5	-176.4	166.9	0	112.1	E193 H194 W195 R201	E193-K197 HydrophobicContact CG-CD 4.44Å; E193-K197 WeakPolarHBondContact O-CB 3.5Å; E193-K197 WeakPolarHBondContact O-CG 3.17Å; E193-K197 PolarHBondContact O-N 3.1Å; E193-K197 WeakPolarHBondContact OE1-CE 3.2Å; E193-K197 IonicContact OE1-NZ 2.74Å; E193-K197 PolarHBondContact OE1-NZ 2.94Å; H194-K197 PolarHBondContact O-N 3.15Å; W195-K197 PolarHBondContact O-N 3.45Å; K197-R201 PolarHBondContact O-N 3.49Å
198	K	84.9	Confident	77.4	Confident	107 Å²	107	119.1 Å²	119.1	47%	0.465	57%	0.572	S	S	.	*	H	α-helix	trans	-65	-46.7	175.7	-172.9	178.2	178.3	-173.2	0	111.3	H194 W195 R196 R201 D202	H194-K198 PolarHBondContact O-N 2.98Å; W195-K198 PolarHBondContact O-N 3.5Å; R196-K198 VanDerWaalsContact C-N 3.32Å; R196-K198 PolarHBondContact O-N 2.98Å; K198-R201 WeakPolarHBondContact O-CB 3.34Å; K198-R201 PolarHBondContact O-N 3.19Å; K198-D202 WeakPolarHBondContact CG-OD2 3.44Å; K198-D202 VanDerWaalsContact O-CG 3.24Å; K198-D202 PolarHBondContact O-N 2.93Å
199	Q	77.7	Confident	75.7	Confident	39 Å²	39	122 Å²	122	18%	0.182	59%	0.585	C	S	.	*	H	α-helix	trans	-61.9	-44.1	177.9	-71.6	-74.9	-60.4	0	0	112.7	W195 R196 R201 D202 G203 E204	W195-Q199 HydrophobicContact CE3-CG 3.63Å; W195-Q199 HydrophobicContact CZ3-CG 3.79Å; W195-Q199 VanDerWaalsContact CZ3-NE2 3.32Å; W195-Q199 WeakPolarHBondContact O-CG 3.48Å; W195-Q199 PolarHBondContact O-N 3.35Å; R196-Q199 PolarHBondContact O-N 2.97Å; Q199-R201 VanDerWaalsContact C-N 3.27Å; Q199-R201 PolarHBondContact O-N 3.23Å; Q199-D202 PolarHBondContact O-N 3.28Å; Q199-G203 PolarHBondContact O-N 3.02Å; Q199-G203 VanDerWaalsContact O-N 3.1Å; Q199-E204 PolarHBondContact O-N 3.3Å
200	H	74.6	Confident	73.7	Confident	166 Å²	166	124.2 Å²	124.2	77%	0.769	60%	0.596	S	S	*	*	H	α-helix	trans	-61	-33.5	174.3	-91.6	-74.7	0	0	0	113.4	R196	R196-H200 PolarHBondContact O-CD2 3.49Å; R196-H200 PolarHBondContact O-N 2.92Å
201	R	75.9	Confident	72	Confident	184 Å²	184	133.2 Å²	133.2	69%	0.694	62%	0.622	S	S	*	*	H	α-helix	trans	-73.7	-38.2	175.9	-175.7	-175.9	65.2	-162.3	-0.1	112.1	K197 K198 Q199 G203	K197-R201 PolarHBondContact O-N 3.49Å; K198-R201 WeakPolarHBondContact O-CB 3.34Å; K198-R201 PolarHBondContact O-N 3.19Å; Q199-R201 VanDerWaalsContact C-N 3.27Å; Q199-R201 PolarHBondContact O-N 3.23Å; R201-G203 PolarHBondContact O-N 3.42Å
202	D	77.7	Confident	70.2	Confident	88 Å²	88	134.7 Å²	134.7	47%	0.471	63%	0.634	S	S	.	*	H	α-helix	trans	-82	-0.9	-177.3	-59.6	-13.9	0	0	0	111.8	K198 Q199 E204	K198-D202 WeakPolarHBondContact CG-OD2 3.44Å; K198-D202 VanDerWaalsContact O-CG 3.24Å; K198-D202 PolarHBondContact O-N 2.93Å; Q199-D202 PolarHBondContact O-N 3.28Å; D202-E204 VanDerWaalsContact C-N 3.34Å; D202-E204 PolarHBondContact O-N 3.2Å
203	G	61.5	Low	69.1	Low	62 Å²	62	137.8 Å²	137.8	64%	0.639	64%	0.643	S	S	*	*	T	Hydrogen-bonded Turn	trans	79.6	8.2	168.9	0	0	0	0	0	115.5	Q199 R201 Q205	Q199-G203 PolarHBondContact O-N 3.02Å; Q199-G203 VanDerWaalsContact O-N 3.1Å; R201-G203 PolarHBondContact O-N 3.42Å; G203-Q205 PolarHBondContact O-N 3.37Å
204	E	56.8	Low	68.2	Low	130 Å²	130	139.4 Å²	139.4	61%	0.607	66%	0.66	S	S	*	*			trans	-86.5	106	-173.6	-164.4	144.7	-164.2	0	0	110.7	Q199 D202 V206	Q199-E204 PolarHBondContact O-N 3.3Å; D202-E204 VanDerWaalsContact C-N 3.34Å; D202-E204 PolarHBondContact O-N 3.2Å; E204-V206 HydrophobicContact CG-CG2 4.27Å; E204-V206 PolarHBondContact O-N 3.48Å; E204-V206 VanDerWaalsContact O-N 3.13Å
205	Q	48.8	Very low	67	Low	196 Å²	196	140.2 Å²	140.2	92%	0.916	66%	0.664	S	S	*	*			trans	-74.3	97.5	170.2	-77	-173.3	18.5	0	0	109	G203 E207	G203-Q205 PolarHBondContact O-N 3.37Å; Q205-E207 PolarHBondContact O-N 3.24Å
206	V	54.2	Low	66.2	Low	100 Å²	100	144.5 Å²	144.5	61%	0.606	68%	0.68	S	S	*	*			trans	-82.7	112.5	171.9	-176.9	0	0	0	0	108.1	E204 E208	E204-V206 HydrophobicContact CG-CG2 4.27Å; E204-V206 PolarHBondContact O-N 3.48Å; E204-V206 VanDerWaalsContact O-N 3.13Å; V206-E208 PolarHBondContact O-N 3.12Å
207	E	52.6	Low	65.3	Low	168 Å²	168	140.6 Å²	140.6	79%	0.785	67%	0.671	S	S	*	*			trans	-51.8	120.7	161.6	-87.3	-172.3	150.3	0	0	108.3	Q205 K209	Q205-E207 PolarHBondContact O-N 3.24Å; E207-K209 VanDerWaalsContact C-N 3.28Å; E207-K209 PolarHBondContact O-N 3.42Å
208	E	54.6	Low	64.7	Low	157 Å²	157	137 Å²	137	73%	0.734	66%	0.662	S	S	*	*			trans	-61.3	95.4	169.9	-81.5	-169	153.8	0	0	107.9	V206 T210	V206-E208 PolarHBondContact O-N 3.12Å; E208-T210 VanDerWaalsContact C-N 3.28Å; E208-T210 PolarHBondContact O-N 3.39Å
209	K	59.8	Low	64.2	Low	171 Å²	171	138.1 Å²	138.1	74%	0.743	67%	0.671	S	S	*	*			trans	-62.8	96	168.1	-89.3	175.8	176.5	169.5	0	107.6	E207 W211	E207-K209 VanDerWaalsContact C-N 3.28Å; E207-K209 PolarHBondContact O-N 3.42Å; K209-W211 PolarHBondContact O-N 3Å
210	T	50.9	Low	64	Low	110 Å²	110	141 Å²	141	68%	0.675	69%	0.692	S	S	*	*			trans	-65.4	101.7	166.8	50.3	0	0	0	0	106.8	E208 D212	E208-T210 VanDerWaalsContact C-N 3.28Å; E208-T210 PolarHBondContact O-N 3.39Å; T210-D212 PolarHBondContact O-N 3.29Å
211	W	58.9	Low	64.1	Low	229 Å²	229	137.4 Å²	137.4	87%	0.867	68%	0.676	S	S	*	*			trans	-68.8	112.9	168.9	-78.7	71.9	0	0	0	107.4	K209 F213	K209-W211 PolarHBondContact O-N 3Å; W211-F213 PolarHBondContact O-N 2.77Å
212	D	55.9	Low	64.3	Low	150 Å²	150	134.2 Å²	134.2	80%	0.802	67%	0.667	S	S	*	*			trans	-71.5	69.3	176	-61.6	-29.6	0	0	0	110.3	T210 T214	T210-D212 PolarHBondContact O-N 3.29Å; D212-T214 PolarHBondContact O-N 2.98Å
213	F	67.8	Low	64.5	Low	167 Å²	167	136.4 Å²	136.4	73%	0.732	67%	0.674	S	S	*	*			trans	-83.2	105.5	176.4	-174.4	-102.3	0	0	0	109.6	W211 Q215	W211-F213 PolarHBondContact O-N 2.77Å; F213-Q215 HydrophobicContact CD1-CB 4.07Å; F213-Q215 HydrophobicContact CE1-CB 3.99Å; F213-Q215 HydrophobicContact CE1-CG 4.33Å; F213-Q215 PolarHBondContact O-N 3.04Å
214	T	69.9	Low	65.5	Low	136 Å²	136	139.1 Å²	139.1	83%	0.834	67%	0.673	S	S	*	*			trans	-74.2	89.9	171.7	22.1	0	0	0	0	109.8	D212 R216	D212-T214 PolarHBondContact O-N 2.98Å; T214-R216 PolarHBondContact O-N 3.44Å
215	Q	66.4	Low	66.9	Low	155 Å²	155	136.9 Å²	136.9	72%	0.724	67%	0.665	S	S	*	*	P	Polyproline II helix	trans	-66.4	122.9	175.2	-172.8	171.2	-4.8	0	0	110	F213 D217	F213-Q215 HydrophobicContact CD1-CB 4.07Å; F213-Q215 HydrophobicContact CE1-CB 3.99Å; F213-Q215 HydrophobicContact CE1-CG 4.33Å; F213-Q215 PolarHBondContact O-N 3.04Å; Q215-D217 PolarHBondContact O-N 2.74Å
216	R	69.8	Low	68.7	Low	232 Å²	232	134.3 Å²	134.3	88%	0.875	65%	0.651	S	S	*	*	P	Polyproline II helix	trans	-64.1	124.5	172.7	-85.8	-178.9	174.8	143.1	-0.8	109.8	T214 S218	T214-R216 PolarHBondContact O-N 3.44Å; R216-S218 PolarHBondContact O-N 2.87Å
217	D	66.4	Low	70.3	Confident	80 Å²	80	132.3 Å²	132.3	43%	0.428	65%	0.645	S	S	.	*	P	Polyproline II helix	trans	-52.2	134.6	176	-73.3	-16.9	0	0	0	112.3	Q215 K222	Q215-D217 PolarHBondContact O-N 2.74Å; D217-K222 HydrophobicContact CB-CG 3.8Å; D217-K222 WeakPolarHBondContact O-CE 3.44Å
218	S	73.3	Confident	71.9	Confident	49 Å²	49	133.2 Å²	133.2	34%	0.343	64%	0.641	S	S	.	*	P	Polyproline II helix	trans	-63.2	151.8	172.1	62.6	0	0	0	0	111.1	R216 T220 Q221 K222	R216-S218 PolarHBondContact O-N 2.87Å; S218-T220 PolarHBondContact O-N 3.01Å; S218-T220 PolarHBondContact OG-OG1 3.39Å; S218-Q221 PolarHBondContact O-N 2.95Å; S218-Q221 WeakPolarHBondContact OG-CB 3.44Å; S218-Q221 VanDerWaalsContact OG-CG 3.29Å; S218-Q221 WeakPolarHBondContact OG-CG 3.28Å; S218-Q221 PolarHBondContact OG-N 3.16Å; S218-Q221 PolarHBondContact OG-OE1 3Å; S218-K222 PolarHBondContact O-N 2.83Å
219	I	75.9	Confident	73.5	Confident	131 Å²	131	130.4 Å²	130.4	67%	0.672	63%	0.63	S	S	*	*	H	α-helix	trans	-56.2	-40.1	-178.3	-61.3	170.9	0	0	0	110.7	K222 H223	I219-K222 PolarHBondContact O-N 3.33Å; I219-H223 PolarHBondContact O-CD2 3.46Å; I219-H223 PolarHBondContact O-N 3.14Å; I219-H223 VanDerWaalsContact O-N 3.12Å
220	T	72.9	Confident	74.6	Confident	99 Å²	99	127.7 Å²	127.7	61%	0.607	62%	0.622	S	S	*	*	H	α-helix	trans	-63	-42.6	176.3	42.2	0	0	0	0	112.8	S218 H223 L224	S218-T220 PolarHBondContact O-N 3.01Å; S218-T220 PolarHBondContact OG-OG1 3.39Å; T220-H223 PolarHBondContact O-N 3.48Å; T220-L224 PolarHBondContact O-N 3.35Å
221	Q	77.1	Confident	76.2	Confident	92 Å²	92	128.1 Å²	128.1	43%	0.43	62%	0.616	S	S	.	*	H	α-helix	trans	-65.8	-39.2	175.8	-78.2	173.4	-41.5	0	0	112.4	S218 H223 L224 N225	S218-Q221 PolarHBondContact O-N 2.95Å; S218-Q221 WeakPolarHBondContact OG-CB 3.44Å; S218-Q221 VanDerWaalsContact OG-CG 3.29Å; S218-Q221 WeakPolarHBondContact OG-CG 3.28Å; S218-Q221 PolarHBondContact OG-N 3.16Å; S218-Q221 PolarHBondContact OG-OE1 3Å; Q221-H223 VanDerWaalsContact C-N 3.3Å; Q221-H223 PolarHBondContact O-N 3.18Å; Q221-L224 PolarHBondContact O-N 3.04Å; Q221-N225 WeakPolarHBondContact O-CB 3.37Å; Q221-N225 VanDerWaalsContact O-CG 3.26Å; Q221-N225 PolarHBondContact O-N 2.92Å; Q221-N225 PolarHBondContact O-ND2 2.68Å
222	K	79.3	Confident	77.5	Confident	117 Å²	117	123.5 Å²	123.5	51%	0.509	60%	0.604	S	S	.	*	H	α-helix	trans	-60	-41.5	174.6	-70.4	-177.5	179	-179.8	0	112.1	D217 S218 I219 K226	D217-K222 HydrophobicContact CB-CG 3.8Å; D217-K222 WeakPolarHBondContact O-CE 3.44Å; S218-K222 PolarHBondContact O-N 2.83Å; I219-K222 PolarHBondContact O-N 3.33Å; K222-K226 VanDerWaalsContact O-CB 3.27Å; K222-K226 WeakPolarHBondContact O-CB 3.46Å; K222-K226 PolarHBondContact O-N 3.02Å
223	H	81.3	Confident	78.9	Confident	133 Å²	133	121.3 Å²	121.3	62%	0.616	59%	0.589	S	S	*	*	H	α-helix	trans	-65.8	-42.6	177	-79.9	-120.9	0	0	0	112	I219 T220 Q221 K226 A227	I219-H223 PolarHBondContact O-CD2 3.46Å; I219-H223 PolarHBondContact O-N 3.14Å; I219-H223 VanDerWaalsContact O-N 3.12Å; T220-H223 PolarHBondContact O-N 3.48Å; Q221-H223 VanDerWaalsContact C-N 3.3Å; Q221-H223 PolarHBondContact O-N 3.18Å; H223-K226 PolarHBondContact O-N 3.4Å; H223-A227 WeakPolarHBondContact O-CB 3.28Å; H223-A227 PolarHBondContact O-N 3.45Å
224	L	83.8	Confident	79.5	Confident	119 Å²	119	116.2 Å²	116.2	62%	0.623	57%	0.574	S	S	*	*	H	α-helix	trans	-63.3	-45.6	175.9	-77.6	162.1	0	0	0	112.1	T220 Q221 K226 A227 R228	T220-L224 PolarHBondContact O-N 3.35Å; Q221-L224 PolarHBondContact O-N 3.04Å; L224-K226 VanDerWaalsContact C-N 3.35Å; L224-K226 PolarHBondContact O-N 3.19Å; L224-A227 PolarHBondContact O-N 3.33Å; L224-R228 PolarHBondContact O-N 3.01Å
225	N	86.3	Confident	79.9	Confident	83 Å²	83	115.7 Å²	115.7	44%	0.444	56%	0.562	S	S	.	*	H	α-helix	trans	-63.9	-41.3	178.2	-70.7	-15.5	0	0	0	111.3	Q221 R228 L229	Q221-N225 WeakPolarHBondContact O-CB 3.37Å; Q221-N225 VanDerWaalsContact O-CG 3.26Å; Q221-N225 PolarHBondContact O-N 2.92Å; Q221-N225 PolarHBondContact O-ND2 2.68Å; N225-R228 PolarHBondContact O-N 3.12Å; N225-L229 WeakPolarHBondContact O-CB 3.23Å; N225-L229 PolarHBondContact O-N 3.18Å
226	K	86.9	Confident	80.6	Confident	143 Å²	143	111.1 Å²	111.1	62%	0.622	55%	0.547	S	S	*	.	H	α-helix	trans	-62.3	-43.4	174.5	-171.8	174.7	-177	175.8	0	112	K222 H223 L224 R228 L229 M230	K222-K226 VanDerWaalsContact O-CB 3.27Å; K222-K226 WeakPolarHBondContact O-CB 3.46Å; K222-K226 PolarHBondContact O-N 3.02Å; H223-K226 PolarHBondContact O-N 3.4Å; L224-K226 VanDerWaalsContact C-N 3.35Å; L224-K226 PolarHBondContact O-N 3.19Å; K226-R228 VanDerWaalsContact C-N 3.34Å; K226-R228 PolarHBondContact O-N 2.93Å; K226-L229 PolarHBondContact O-N 3.21Å; K226-M230 WeakPolarHBondContact O-CG 3.09Å; K226-M230 PolarHBondContact O-N 3.4Å
227	A	85.9	Confident	81	Confident	57 Å²	57	104.5 Å²	104.5	47%	0.471	53%	0.529	S	S	.	.	H	α-helix	trans	-62.9	-41.2	176.4	0	0	0	0	0	112	H223 L224 M230 Q231	H223-A227 WeakPolarHBondContact O-CB 3.28Å; H223-A227 PolarHBondContact O-N 3.45Å; L224-A227 PolarHBondContact O-N 3.33Å; A227-M230 PolarHBondContact O-N 3.23Å; A227-Q231 WeakPolarHBondContact O-CB 3.31Å; A227-Q231 PolarHBondContact O-N 3.49Å
228	R	87.4	Confident	81.6	Confident	188 Å²	188	105.3 Å²	105.3	71%	0.709	54%	0.537	S	S	*	.	H	α-helix	trans	-62.7	-42.8	175.8	-127.9	179.6	-174.7	-179.3	0.4	112.1	L224 N225 K226 Q231 Q232	L224-R228 PolarHBondContact O-N 3.01Å; N225-R228 PolarHBondContact O-N 3.12Å; K226-R228 VanDerWaalsContact C-N 3.34Å; K226-R228 PolarHBondContact O-N 2.93Å; R228-Q231 PolarHBondContact O-N 3.1Å; R228-Q232 PolarHBondContact O-N 2.9Å
229	L	88	Confident	81.9	Confident	97 Å²	97	105.9 Å²	105.9	51%	0.508	54%	0.541	S	S	.	.	H	α-helix	trans	-63	-47.2	177.4	-163.9	79.6	0	0	0	111	N225 K226 Q231 Q232 E233	N225-L229 WeakPolarHBondContact O-CB 3.23Å; N225-L229 PolarHBondContact O-N 3.18Å; K226-L229 PolarHBondContact O-N 3.21Å; L229-Q231 PolarHBondContact O-N 3.43Å; L229-Q232 PolarHBondContact O-N 3.13Å; L229-Q232 VanDerWaalsContact O-N 3.09Å; L229-E233 PolarHBondContact O-N 3.04Å
230	M	82.9	Confident	81.9	Confident	115 Å²	115	104.1 Å²	104.1	57%	0.567	53%	0.533	S	S	*	.	H	α-helix	trans	-61.5	-32.9	176.3	-70.3	-174.7	82.8	0	0	112.4	K226 A227 S234	K226-M230 WeakPolarHBondContact O-CG 3.09Å; K226-M230 PolarHBondContact O-N 3.4Å; A227-M230 PolarHBondContact O-N 3.23Å; M230-S234 WeakPolarHBondContact O-CB 3.48Å; M230-S234 PolarHBondContact O-N 2.9Å; M230-S234 PolarHBondContact O-OG 3.33Å
231	Q	85.1	Confident	81.8	Confident	118 Å²	118	103.8 Å²	103.8	55%	0.551	53%	0.527	S	S	*	.	H	α-helix	trans	-72.4	-34.4	175.3	-166.2	170.8	18.1	0	0	112.4	A227 R228 L229 S234 Q235	A227-Q231 WeakPolarHBondContact O-CB 3.31Å; A227-Q231 PolarHBondContact O-N 3.49Å; R228-Q231 PolarHBondContact O-N 3.1Å; L229-Q231 PolarHBondContact O-N 3.43Å; Q231-S234 PolarHBondContact O-OG 3.13Å; Q231-Q235 VanDerWaalsContact O-CG 3.28Å; Q231-Q235 WeakPolarHBondContact O-CG 3.38Å; Q231-Q235 PolarHBondContact O-N 3.05Å; Q231-Q235 VanDerWaalsContact O-N 3.08Å
232	Q	86.1	Confident	81.8	Confident	132 Å²	132	101.5 Å²	101.5	62%	0.617	52%	0.523	S	S	*	.	H	α-helix	trans	-73.1	-39.1	176	-164.8	173.7	12.4	0	0	111.8	R228 L229 Q235 S236	R228-Q232 PolarHBondContact O-N 2.9Å; L229-Q232 PolarHBondContact O-N 3.13Å; L229-Q232 VanDerWaalsContact O-N 3.09Å; Q232-Q235 PolarHBondContact O-N 3.43Å; Q232-S236 PolarHBondContact O-N 3.23Å; Q232-S236 PolarHBondContact O-OG 3.34Å
233	E	85	Confident	81.8	Confident	105 Å²	105	103.6 Å²	103.6	49%	0.491	53%	0.532	S	S	.	.	H	α-helix	trans	-62.8	-42.7	171.4	-75	-178.7	167.7	0	0	111.5	L229 Q235 S236 N237	L229-E233 PolarHBondContact O-N 3.04Å; E233-Q235 PolarHBondContact O-N 3.48Å; E233-S236 WeakPolarHBondContact CA-OG 3.43Å; E233-S236 PolarHBondContact O-N 3.13Å; E233-S236 PolarHBondContact O-OG 3.36Å; E233-N237 WeakPolarHBondContact O-CB 3.29Å; E233-N237 PolarHBondContact O-N 3.5Å; E233-N237 PolarHBondContact O-ND2 2.72Å
234	S	80.5	Confident	81.5	Confident	59 Å²	59	101.5 Å²	101.5	41%	0.413	52%	0.524	S	S	.	.	H	α-helix	trans	-66.3	-39.7	177.5	69.3	0	0	0	0	112.5	M230 Q231 N237 V238	M230-S234 WeakPolarHBondContact O-CB 3.48Å; M230-S234 PolarHBondContact O-N 2.9Å; M230-S234 PolarHBondContact O-OG 3.33Å; Q231-S234 PolarHBondContact O-OG 3.13Å; S234-N237 PolarHBondContact O-N 3.4Å; S234-V238 VanDerWaalsContact O-CG2 3.23Å; S234-V238 WeakPolarHBondContact O-CG2 2.98Å; S234-V238 PolarHBondContact O-N 3.43Å
235	Q	78.6	Confident	81	Confident	125 Å²	125	102.9 Å²	102.9	58%	0.584	53%	0.526	S	S	*	.	H	α-helix	trans	-65.3	-40.5	175.9	-74.6	179.6	8.1	0	0	112.8	Q231 Q232 E233 V238 S239	Q231-Q235 VanDerWaalsContact O-CG 3.28Å; Q231-Q235 WeakPolarHBondContact O-CG 3.38Å; Q231-Q235 PolarHBondContact O-N 3.05Å; Q231-Q235 VanDerWaalsContact O-N 3.08Å; Q232-Q235 PolarHBondContact O-N 3.43Å; E233-Q235 PolarHBondContact O-N 3.48Å; Q235-V238 PolarHBondContact O-N 3.33Å; Q235-S239 PolarHBondContact O-N 2.92Å
236	S	80.5	Confident	80	Confident	59 Å²	59	104.2 Å²	104.2	41%	0.413	53%	0.533	S	S	.	.	H	α-helix	trans	-67.4	-41.4	176.2	53.9	0	0	0	0	111.8	Q232 E233 V238 S239 L240	Q232-S236 PolarHBondContact O-N 3.23Å; Q232-S236 PolarHBondContact O-OG 3.34Å; E233-S236 WeakPolarHBondContact CA-OG 3.43Å; E233-S236 PolarHBondContact O-N 3.13Å; E233-S236 PolarHBondContact O-OG 3.36Å; S236-V238 PolarHBondContact O-N 3.39Å; S236-S239 PolarHBondContact O-N 2.84Å; S236-S239 PolarHBondContact O-OG 3.35Å; S236-L240 WeakPolarHBondContact O-CB 3.43Å; S236-L240 PolarHBondContact O-N 2.84Å
237	N	78.8	Confident	78.8	Confident	93 Å²	93	101 Å²	101	50%	0.497	53%	0.528	S	S	.	.	H	α-helix	trans	-63.1	-40	174.4	-71.8	-33.5	0	0	0	112.5	E233 S234 L240 L241	E233-N237 WeakPolarHBondContact O-CB 3.29Å; E233-N237 PolarHBondContact O-N 3.5Å; E233-N237 PolarHBondContact O-ND2 2.72Å; S234-N237 PolarHBondContact O-N 3.4Å; N237-L240 PolarHBondContact O-N 3.37Å; N237-L241 VanDerWaalsContact O-CG 3.29Å; N237-L241 WeakPolarHBondContact O-CG 3.48Å; N237-L241 PolarHBondContact O-N 3.03Å
238	V	79	Confident	77.5	Confident	97 Å²	97	105.2 Å²	105.2	59%	0.588	54%	0.543	S	S	*	.	H	α-helix	trans	-62.7	-42.3	173.9	170.1	0	0	0	0	111.2	S234 Q235 S236 L240 L241 A242	S234-V238 VanDerWaalsContact O-CG2 3.23Å; S234-V238 WeakPolarHBondContact O-CG2 2.98Å; S234-V238 PolarHBondContact O-N 3.43Å; Q235-V238 PolarHBondContact O-N 3.33Å; S236-V238 PolarHBondContact O-N 3.39Å; V238-L240 VanDerWaalsContact C-N 3.28Å; V238-L240 PolarHBondContact O-N 3.34Å; V238-L241 PolarHBondContact O-N 2.88Å; V238-A242 WeakPolarHBondContact O-CB 3.49Å; V238-A242 PolarHBondContact O-N 3.39Å
239	S	78.3	Confident	76.2	Confident	61 Å²	61	104.3 Å²	104.3	43%	0.427	55%	0.547	S	S	.	.	H	α-helix	trans	-64.8	-33	177	81.3	0	0	0	0	112.9	Q235 S236 K243	Q235-S239 PolarHBondContact O-N 2.92Å; S236-S239 PolarHBondContact O-N 2.84Å; S236-S239 PolarHBondContact O-OG 3.35Å; S239-K243 WeakPolarHBondContact O-CG 3.47Å; S239-K243 PolarHBondContact O-N 3.36Å
240	L	76.3	Confident	74.3	Confident	95 Å²	95	108.7 Å²	108.7	50%	0.497	59%	0.586	S	S	.	*	H	α-helix	trans	-74	-44.8	178.6	-162	156.3	0	0	0	110.4	S236 N237 V238 A242 K243 I244	S236-L240 WeakPolarHBondContact O-CB 3.43Å; S236-L240 PolarHBondContact O-N 2.84Å; N237-L240 PolarHBondContact O-N 3.37Å; V238-L240 VanDerWaalsContact C-N 3.28Å; V238-L240 PolarHBondContact O-N 3.34Å; L240-A242 PolarHBondContact O-N 3.15Å; L240-K243 PolarHBondContact O-N 3.23Å; L240-I244 HydrophobicContact CD2-CD1 3.42Å; L240-I244 VanDerWaalsContact CD2-CD1 3.42Å; L240-I244 HydrophobicContact CD2-CG1 4.21Å; L240-I244 WeakPolarHBondContact O-CG1 3.44Å; L240-I244 PolarHBondContact O-N 2.79Å
241	L	72	Confident	73.9	Confident	92 Å²	92	108.4 Å²	108.4	48%	0.482	59%	0.587	S	S	.	*	H	α-helix	trans	-63.3	-41	174	-67.3	172.9	0	0	0	111.8	N237 V238 K243 I244 F245	N237-L241 VanDerWaalsContact O-CG 3.29Å; N237-L241 WeakPolarHBondContact O-CG 3.48Å; N237-L241 PolarHBondContact O-N 3.03Å; V238-L241 PolarHBondContact O-N 2.88Å; L241-K243 VanDerWaalsContact C-N 3.29Å; L241-K243 PolarHBondContact O-N 3.42Å; L241-I244 PolarHBondContact O-N 3.44Å; L241-I244 VanDerWaalsContact O-N 3.15Å; L241-F245 HydrophobicContact CB-CD2 4.41Å; L241-F245 HydrophobicContact CD2-CE2 4.11Å; L241-F245 VanDerWaalsContact O-CD2 3.28Å; L241-F245 WeakPolarHBondContact O-CD2 3.28Å; L241-F245 PolarHBondContact O-N 3.24Å
242	A	76.5	Confident	73.3	Confident	43 Å²	43	107.9 Å²	107.9	36%	0.355	59%	0.589	S	S	.	*	H	α-helix	trans	-60.2	-38.6	174.8	0	0	0	0	0	112.2	V238 L240 N246	V238-A242 WeakPolarHBondContact O-CB 3.49Å; V238-A242 PolarHBondContact O-N 3.39Å; L240-A242 PolarHBondContact O-N 3.15Å; A242-N246 WeakPolarHBondContact O-CB 3.34Å; A242-N246 PolarHBondContact O-N 2.84Å
243	K	77.9	Confident	72.6	Confident	161 Å²	161	106.6 Å²	106.6	70%	0.7	59%	0.587	S	S	*	*	H	α-helix	trans	-67.9	-34.6	174.2	-77.6	175.9	-179.9	177.2	0	113.4	S239 L240 L241 S247	S239-K243 WeakPolarHBondContact O-CG 3.47Å; S239-K243 PolarHBondContact O-N 3.36Å; L240-K243 PolarHBondContact O-N 3.23Å; L241-K243 VanDerWaalsContact C-N 3.29Å; L241-K243 PolarHBondContact O-N 3.42Å; K243-S247 VanDerWaalsContact O-CB 3.3Å; K243-S247 WeakPolarHBondContact O-CB 3.4Å; K243-S247 PolarHBondContact O-OG 2.89Å
244	I	76.5	Confident	71.8	Confident	89 Å²	89	106.6 Å²	106.6	46%	0.456	59%	0.593	S	S	.	*	H	α-helix	trans	-74.1	-39.6	178.8	-68.5	173.2	0	0	0	111.6	L240 L241 S247	L240-I244 HydrophobicContact CD2-CD1 3.42Å; L240-I244 VanDerWaalsContact CD2-CD1 3.42Å; L240-I244 HydrophobicContact CD2-CG1 4.21Å; L240-I244 WeakPolarHBondContact O-CG1 3.44Å; L240-I244 PolarHBondContact O-N 2.79Å; L241-I244 PolarHBondContact O-N 3.44Å; L241-I244 VanDerWaalsContact O-N 3.15Å; I244-S247 PolarHBondContact O-OG 3.19Å; I244-S247 VanDerWaalsContact O-OG 3.12Å
245	F	71.8	Confident	71.3	Confident	149 Å²	149	109.6 Å²	109.6	65%	0.654	60%	0.604	S	S	*	*	H	α-helix	trans	-90.3	-21.7	-174.4	-74.6	-73.6	0	0	0	114.1	L241	L241-F245 HydrophobicContact CB-CD2 4.41Å; L241-F245 HydrophobicContact CD2-CE2 4.11Å; L241-F245 VanDerWaalsContact O-CD2 3.28Å; L241-F245 WeakPolarHBondContact O-CD2 3.28Å; L241-F245 PolarHBondContact O-N 3.24Å
246	N	66.2	Low	70.8	Confident	111 Å²	111	108.6 Å²	108.6	59%	0.594	61%	0.605	S	S	*	*	H	α-helix	trans	-94.6	-6.8	176.5	-64.1	-12.3	0	0	0	113.8	A242 N248	A242-N246 WeakPolarHBondContact O-CB 3.34Å; A242-N246 PolarHBondContact O-N 2.84Å; N246-N248 VanDerWaalsContact C-N 3.25Å; N246-N248 PolarHBondContact O-N 3.05Å
247	S	62.6	Low	70.1	Confident	75 Å²	75	112.1 Å²	112.1	52%	0.524	62%	0.619	S	S	.	*	T	Hydrogen-bonded Turn	trans	-76.5	-8.1	178.3	56.7	0	0	0	0	114.4	K243 I244	K243-S247 VanDerWaalsContact O-CB 3.3Å; K243-S247 WeakPolarHBondContact O-CB 3.4Å; K243-S247 PolarHBondContact O-OG 2.89Å; I244-S247 PolarHBondContact O-OG 3.19Å; I244-S247 VanDerWaalsContact O-OG 3.12Å
248	N	58.6	Low	69.4	Low	146 Å²	146	113.6 Å²	113.6	78%	0.781	63%	0.628	S	S	*	*	T	Hydrogen-bonded Turn	trans	-100.8	12.8	178	-76.7	-19.1	0	0	0	113.7	N246	N246-N248 VanDerWaalsContact C-N 3.25Å; N246-N248 PolarHBondContact O-N 3.05Å
249	Q	59.4	Low	68.6	Low	169 Å²	169	115 Å²	115	79%	0.79	63%	0.632	S	S	*	*			trans	-108.7	79.8	168.2	-75	-171.8	-11.7	0	0	109.3
250	S	47.8	Very low	67.8	Low	189 Å²	189	119.9 Å²	119.9	100%	1.322	65%	0.65	S	S	*	*			trans	-151.6	0	165.2	-59.2	0	0	0	0	108.3

Retrieved 250 of 250 residues in 302.3 ms (Link to these results)

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