A0A096MIU8_RAT Loading...

ethanolamine kinase

AlphaFold DB , UniProt , Accession A0A096MIU8, Species RAT (Rattus norvegicus, Rat), Gene Etnk2, Length 191 aa.

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(Predicted Aligned Error values between residue pairs)

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Site	Residue	pLDDT	pLDDT confidence	pLDDT₁₀	pLDDT10 confidence	SASA	SASA [Å²]	SASA₁₀	SASA10 [Å²]	RSA	RSA unformatted	RSA₁₀	RSA10 unformatted	Surface	Surface10 (not used)	Disorder (not used)	Disorder	Sec. str.	Secondary structure	Isomer	Phi (φ)	Psi (ψ)	Omega (ω)	Chi 1 (χ₁)	Chi 2 (χ₂)	Chi 3 (χ₃)	Chi 4 (χ₄)	Chi 5 (χ₅)	Tau (τ)	Contacts (colored by PAE)	Contact details
1	M	40.8	Very low	41.5	Very low	250 Å²	250	131.4 Å²	131.4	100%	1.232	85%	0.845	S	S	*	*				0	109.1	0	-66.3	-171.5	-168.8	0	0	107.1
2	A	37.3	Very low	40.9	Very low	103 Å²	103	128.8 Å²	128.8	85%	0.851	83%	0.833	S	S	*	*			trans	-104.6	128.5	-176.8	0	0	0	0	0	109
3	V	42.9	Very low	40.5	Very low	140 Å²	140	127.9 Å²	127.9	85%	0.848	83%	0.828	S	S	*	*	P	Polyproline II helix	trans	-85.1	128.1	179.6	-179.1	0	0	0	0	108.4
4	P	53	Low	40	Very low	106 Å²	106	132.1 Å²	132.1	69%	0.688	83%	0.827	S	S	*	*	P	Polyproline II helix	trans	-75.6	152.4	178.1	29.8	-33.1	0	0	0	112.1
5	P	43.1	Very low	39.7	Very low	130 Å²	130	138.9 Å²	138.9	84%	0.844	83%	0.833	S	S	*	*	P	Polyproline II helix	trans	-71.9	137.2	178.5	28.5	-32.8	0	0	0	112
6	S	42.7	Very low	39.5	Very low	118 Å²	118	141.1 Å²	141.1	83%	0.825	84%	0.838	S	S	*	*	P	Polyproline II helix	trans	-74.7	145.2	-179.9	30.8	0	0	0	0	113.1
7	A	46.5	Very low	38.9	Very low	84 Å²	84	145.8 Å²	145.8	69%	0.694	84%	0.838	S	S	*	*	P	Polyproline II helix	trans	-65.4	150.9	-178.5	0	0	0	0	0	113.4
8	P	40.2	Very low	39	Very low	127 Å²	127	151 Å²	151	83%	0.825	84%	0.842	S	S	*	*	P	Polyproline II helix	trans	-71.4	133.6	176.5	28.3	-32	0	0	0	111.4
9	V	41	Very low	38.9	Very low	132 Å²	132	151.2 Å²	151.2	80%	0.8	84%	0.835	S	S	*	*	P	Polyproline II helix	trans	-81.7	141.8	179.7	-163.4	0	0	0	0	109.7
10	P	34.6	Very low	38.6	Very low	121 Å²	121	152.6 Å²	152.6	79%	0.786	84%	0.836	S	S	*	*	P	Polyproline II helix	trans	-75.4	130.9	-172.3	-7.6	24.2	0	0	0	112
11	C	34.7	Very low	38.3	Very low	134 Å²	134	149.9 Å²	149.9	91%	0.905	83%	0.834	S	S	*	*	P	Polyproline II helix	trans	-75.1	125.4	167.4	-98.5	0	0	0	0	110.6
12	S	33.7	Very low	38.1	Very low	100 Å²	100	142 Å²	142	70%	0.699	80%	0.802	S	S	*	*	P	Polyproline II helix	trans	-63.6	143.8	178	-170.9	0	0	0	0	112.3	F14	S12-F14 PolarHBondContact O-N 3.08Å
13	P	36.8	Very low	38.2	Very low	118 Å²	118	143.4 Å²	143.4	77%	0.766	80%	0.802	S	S	*	*	S	Bend	trans	-90.5	88	-170.3	35.3	-30.2	0	0	0	110.5
14	F	32.3	Very low	37.9	Very low	187 Å²	187	145.1 Å²	145.1	82%	0.82	80%	0.801	S	S	*	*			trans	-137.9	18.8	175.8	-104.8	-79.1	0	0	0	116.1	S12	S12-F14 PolarHBondContact O-N 3.08Å
15	Y	36.6	Very low	36.9	Very low	233 Å²	233	144.9 Å²	144.9	91%	0.914	80%	0.801	S	S	*	*	S	Bend	trans	-118.2	19.2	178.2	-97.2	-72.6	0	0	0	116.9
16	L	36	Very low	36.7	Very low	175 Å²	175	144 Å²	144	92%	0.916	80%	0.798	S	S	*	*			trans	-133.7	72.8	168.3	-92	157.4	0	0	0	110.5
17	R	29.9	Very low	36.3	Very low	220 Å²	220	150.2 Å²	150.2	83%	0.83	80%	0.803	S	S	*	*			trans	-105	103.9	154	-157.1	175.8	-141.3	-177.2	5.2	108	Q19	R17-Q19 PolarHBondContact O-N 3.5Å
18	R	40.5	Very low	35.5	Very low	240 Å²	240	151.1 Å²	151.1	91%	0.906	81%	0.805	S	S	*	*			trans	-47	119.3	156.7	-90.9	-179.5	172.2	-168.1	-1	108.6
19	Q	36.6	Very low	35.1	Very low	154 Å²	154	154.7 Å²	154.7	72%	0.72	81%	0.813	S	S	*	*			trans	-136.7	93	150.3	-93.3	176.7	-16.3	0	0	105	R17	R17-Q19 PolarHBondContact O-N 3.5Å
20	E	32.2	Very low	35.1	Very low	180 Å²	180	156.4 Å²	156.4	84%	0.841	81%	0.812	S	S	*	*				89.9	111.1	100.1	-81.6	-174.5	174.3	0	0	110.1	C22	E20-C22 PolarHBondContact O-N 3.04Å
21	A	32.6	Very low	35.5	Very low	96 Å²	96	160.1 Å²	160.1	79%	0.793	82%	0.819	S	S	*	*			trans	-60.5	121.4	-178.7	0	0	0	0	0	109.7
22	C	36.1	Very low	35.3	Very low	83 Å²	83	163.4 Å²	163.4	56%	0.561	82%	0.818	S	S	*	*			trans	-58.8	123.3	159.6	-177.7	0	0	0	0	107.3	E20 Q24	E20-C22 PolarHBondContact O-N 3.04Å; C22-Q24 PolarHBondContact O-N 3.46Å
23	P	39.7	Very low	35.4	Very low	133 Å²	133	163 Å²	163	86%	0.864	82%	0.82	S	S	*	*	T	Hydrogen-bonded Turn	trans	-72.4	12.8	-172.6	28.5	-33.4	0	0	0	113.7
24	Q	37.8	Very low	35.3	Very low	177 Å²	177	164.1 Å²	164.1	83%	0.827	83%	0.825	S	S	*	*	T	Hydrogen-bonded Turn	trans	-138.6	16	-172.7	-150.2	159.3	-10.6	0	0	116.3	C22	C22-Q24 PolarHBondContact O-N 3.46Å
25	C	31.2	Very low	35.3	Very low	100 Å²	100	159.4 Å²	159.4	68%	0.676	82%	0.821	S	S	*	*			trans	-125.3	93.7	176	-66.6	0	0	0	0	111.2	W27	C25-W27 PolarHBondContact O-N 3.44Å
26	S	39.1	Very low	35.6	Very low	112 Å²	112	154.6 Å²	154.6	78%	0.783	82%	0.821	S	S	*	*			trans	-92.4	81.5	171	60.4	0	0	0	0	110.4
27	W	33.7	Very low	35.7	Very low	248 Å²	248	150 Å²	150	94%	0.939	81%	0.808	S	S	*	*			trans	-130.2	82.3	162.2	-68.6	98.4	0	0	0	108.2	C25	C25-W27 PolarHBondContact O-N 3.44Å
28	S	30.9	Very low	36.3	Very low	104 Å²	104	145.2 Å²	145.2	73%	0.727	81%	0.808	S	S	*	*			trans	-90.7	122.4	159.8	-74.7	0	0	0	0	108.2	E30	S28-E30 PolarHBondContact O-N 3.46Å
29	M	32.3	Very low	36	Very low	201 Å²	201	139.2 Å²	139.2	99%	0.99	80%	0.802	S	S	*	*			trans	-72	100.4	160.2	-113.5	171	-177.4	0	0	106.8
30	E	39.7	Very low	35.7	Very low	169 Å²	169	142.9 Å²	142.9	79%	0.79	81%	0.809	S	S	*	*			trans	-121.7	111.3	168.4	-139.7	145.4	117.7	0	0	108.9	S28 K32	S28-E30 PolarHBondContact O-N 3.46Å; E30-K32 PolarHBondContact O-N 3.24Å
31	E	42.4	Very low	36.1	Very low	198 Å²	198	141.5 Å²	141.5	93%	0.925	80%	0.803	S	S	*	*			trans	-76.8	109.2	174.3	-156.3	-176.2	132.1	0	0	107.9
32	K	31.1	Very low	36.6	Very low	204 Å²	204	141.8 Å²	141.8	89%	0.887	80%	0.797	S	S	*	*			trans	-155.2	126.1	162.4	-118.1	-178.9	-174	-177.9	0	111.9	E30	E30-K32 PolarHBondContact O-N 3.24Å
33	A	37	Very low	37.1	Very low	91 Å²	91	143.6 Å²	143.6	75%	0.752	81%	0.807	S	S	*	*			trans	-78.4	155.6	-179.8	0	0	0	0	0	113.4
34	V	33.7	Very low	37.7	Very low	141 Å²	141	139.5 Å²	139.5	86%	0.855	79%	0.789	S	S	*	*			trans	78	102.4	159.6	-159.1	0	0	0	0	117.9
35	A	31.3	Very low	38.3	Very low	89 Å²	89	136.2 Å²	136.2	74%	0.736	78%	0.783	S	S	*	*				164.8	140.5	110.3	0	0	0	0	0	110.1	A37	A35-A37 PolarHBondContact O-N 2.95Å
36	S	44.6	Very low	39.1	Very low	132 Å²	132	137.7 Å²	137.7	92%	0.923	79%	0.792	S	S	*	*			trans	-38.4	101.8	174.7	165.2	0	0	0	0	113.5
37	A	37.2	Very low	39.9	Very low	77 Å²	77	141.4 Å²	141.4	64%	0.636	79%	0.788	S	S	*	*			trans	-118.2	116.2	158	0	0	0	0	0	106.6	A35 C39	A35-A37 PolarHBondContact O-N 2.95Å; A37-C39 VanDerWaalsContact C-N 3.3Å; A37-C39 PolarHBondContact O-N 3.44Å
38	S	41.9	Very low	41.1	Very low	121 Å²	121	133.4 Å²	133.4	85%	0.846	78%	0.775	S	S	*	*			trans	-61.3	95.8	168.7	53.9	0	0	0	0	108.2	W40	S38-W40 PolarHBondContact O-N 3.07Å
39	C	34.2	Very low	43.1	Very low	114 Å²	114	133 Å²	133	77%	0.77	78%	0.778	S	S	*	*			trans	-65.8	106.8	170.2	-65.7	0	0	0	0	107.2	A37 E41	A37-C39 VanDerWaalsContact C-N 3.3Å; A37-C39 PolarHBondContact O-N 3.44Å; C39-E41 VanDerWaalsContact C-N 3.32Å; C39-E41 PolarHBondContact O-N 2.82Å
40	W	31.5	Very low	45.6	Very low	231 Å²	231	124.9 Å²	124.9	88%	0.875	74%	0.74	S	S	*	*			trans	-65.1	98	167	-175.1	-80.3	0	0	0	107.4	S38	S38-W40 PolarHBondContact O-N 3.07Å
41	E	40.4	Very low	48	Very low	150 Å²	150	120.1 Å²	120.1	70%	0.701	72%	0.723	S	S	*	*			trans	-68.5	128.3	167.3	-71.5	-167.2	103.3	0	0	107.9	C39	C39-E41 VanDerWaalsContact C-N 3.32Å; C39-E41 PolarHBondContact O-N 2.82Å
42	P	42	Very low	50.3	Low	103 Å²	103	115.4 Å²	115.4	67%	0.669	71%	0.711	S	S	*	*			trans	-59.7	141.2	171.1	26.5	-31.5	0	0	0	108	G44	P42-G44 PolarHBondContact O-N 3.18Å
43	P	47	Very low	53.2	Low	121 Å²	121	107.8 Å²	107.8	79%	0.786	68%	0.678	S	S	*	*			trans	-61.3	104.6	175.5	24	-30.4	0	0	0	107.8
44	G	52.3	Low	55.6	Low	46 Å²	46	107.7 Å²	107.7	47%	0.474	68%	0.677	S	S	.	*			trans	-57.3	161.7	171.2	0	0	0	0	0	110	P42	P42-G44 PolarHBondContact O-N 3.18Å
45	P	50.8	Low	58.3	Low	108 Å²	108	101.8 Å²	101.8	70%	0.701	64%	0.64	S	S	*	*	S	Bend	trans	-49.5	144.4	175.7	22.4	-32.8	0	0	0	109.9	R47	P45-R47 PolarHBondContact O-N 3.39Å
46	P	48	Very low	61	Low	132 Å²	132	100.2 Å²	100.2	86%	0.857	63%	0.628	S	S	*	*			trans	-50.1	111.1	-174.8	17.9	-30	0	0	0	109	A48	P46-A48 PolarHBondContact O-N 3.38Å
47	R	55.7	Low	63.2	Low	190 Å²	190	94.1 Å²	94.1	72%	0.717	59%	0.585	S	S	*	*			trans	-63.5	103.6	-176.5	-71.8	178.9	174	171.2	0.3	106.3	P45 A49	P45-R47 PolarHBondContact O-N 3.39Å; R47-A49 PolarHBondContact O-N 3.45Å
48	A	59.6	Low	65.7	Low	79 Å²	79	95.1 Å²	95.1	65%	0.653	58%	0.58	S	S	*	*			trans	-59.2	110.8	172.9	0	0	0	0	0	107.2	P46 V50 Q131	P46-A48 PolarHBondContact O-N 3.38Å; A48-V50 PolarHBondContact O-N 3.22Å; A48-V50 VanDerWaalsContact O-N 3.12Å; A48-Q131 PolarHBondContact O-NE2 3.4Å; A48-Q131 VanDerWaalsContact O-NE2 3.13Å
49	A	72.9	Confident	67.7	Low	95 Å²	95	91.7 Å²	91.7	79%	0.785	55%	0.55	S	S	*	*	P	Polyproline II helix	trans	-59.8	118.4	175.6	0	0	0	0	0	107.5	R47	R47-A49 PolarHBondContact O-N 3.45Å
50	V	84.7	Confident	70.1	Confident	32 Å²	32	92.1 Å²	92.1	19%	0.194	55%	0.545	C	S	.	.	P	Polyproline II helix	trans	-72	130.6	177.1	168.3	0	0	0	0	107.4	A48 C52 Q131 L142 T145	A48-V50 PolarHBondContact O-N 3.22Å; A48-V50 VanDerWaalsContact O-N 3.12Å; V50-C52 PolarHBondContact O-N 3.07Å; V50-Q131 HydrophobicContact CG2-CG 4.34Å; V50-L142 HydrophobicContact CB-CD2 4.37Å; V50-L142 HydrophobicContact CG1-CD2 3.88Å; V50-L142 HydrophobicContact CG1-CG 3.96Å; V50-L142 HydrophobicContact CG2-CB 4.47Å; V50-L142 HydrophobicContact CG2-CD2 3.9Å; V50-L142 HydrophobicContact CG2-CG 4.31Å; V50-T145 HydrophobicContact CG1-CG2 4.13Å
51	P	90.4	Very high	72.8	Confident	69 Å²	69	84.9 Å²	84.9	45%	0.448	52%	0.523	S	S	.	.	P	Polyproline II helix	trans	-54.3	133.8	176.1	-25.3	33.2	0	0	0	111.1	F53 Y143 C144 T145	P51-F53 HydrophobicContact CB-CE2 4.45Å; P51-F53 HydrophobicContact CB-CZ 4.42Å; P51-Y143 WeakPolarHBondContact CD-O 3.43Å; P51-C144 HydrophobicContact CB-CB 4.19Å; P51-C144 CarbonylContact O-C 3.6Å; P51-C144 WeakPolarHBondContact O-CA 3.49Å; P51-C144 VanDerWaalsContact O-CB 3.24Å; P51-C144 WeakPolarHBondContact O-CB 3.36Å; P51-T145 PolarHBondContact O-N 3.34Å
52	C	90	Very high	75.2	Confident	98 Å²	98	77.8 Å²	77.8	66%	0.662	49%	0.49	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-116.1	122.2	175.5	-176.2	0	0	0	0	109.1	V50 T145	V50-C52 PolarHBondContact O-N 3.07Å; C52-T145 CarbonylContact C-O 3.5Å; C52-T145 WeakPolarHBondContact CA-O 3.36Å
53	F	91.2	Very high	77.6	Confident	44 Å²	44	76.2 Å²	76.2	19%	0.193	48%	0.476	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-101.2	132.3	177.5	-62.5	-68.5	0	0	0	110.8	P51 I55 L69 E72 L73 C144 T145 F146	P51-F53 HydrophobicContact CB-CE2 4.45Å; P51-F53 HydrophobicContact CB-CZ 4.42Å; F53-I55 HydrophobicContact CB-CB 4.42Å; F53-I55 HydrophobicContact CB-CD1 4.04Å; F53-I55 HydrophobicContact CB-CG1 4.14Å; F53-I55 PolarHBondContact O-N 2.78Å; F53-L69 HydrophobicContact CB-CD2 4.22Å; F53-L69 HydrophobicContact CD2-CD2 4.03Å; F53-L69 HydrophobicContact CG-CD2 4.42Å; F53-E72 HydrophobicContact CD1-CB 4.43Å; F53-E72 HydrophobicContact CD1-CG 4.47Å; F53-E72 HydrophobicContact CE1-CB 3.78Å; F53-E72 HydrophobicContact CE1-CG 4.2Å; F53-E72 HydrophobicContact CE2-CB 4.34Å; F53-E72 HydrophobicContact CZ-CB 3.72Å; F53-L73 HydrophobicContact CE2-CD2 3.84Å; F53-L73 HydrophobicContact CE2-CG 4.21Å; F53-L73 HydrophobicContact CZ-CD2 4.34Å; F53-C144 HydrophobicContact CD2-CB 3.69Å; F53-C144 HydrophobicContact CE2-CB 3.46Å; F53-C144 VanDerWaalsContact CE2-CB 3.46Å; F53-T145 PolarHBondContact N-O 3.08Å; F53-F146 HydrophobicContact CB-CB 4.41Å; F53-F146 VanDerWaalsContact O-CA 3.26Å; F53-F146 WeakPolarHBondContact O-CA 3.44Å
54	A	88.6	Confident	79.8	Confident	89 Å²	89	73.6 Å²	73.6	74%	0.736	46%	0.459	S	S	*	.			trans	-76.7	47.1	172.3	0	0	0	0	0	111.9	Q147	A54-Q147 PolarHBondContact O-NE2 3.3Å
55	I	89.1	Confident	81.7	Confident	17 Å²	17	71.8 Å²	71.8	9%	0.087	44%	0.44	C	S	.	.			trans	-107	126.8	178	-64.2	170.4	0	0	0	107.7	F53 V57 L69 E72 F146 Q147	F53-I55 HydrophobicContact CB-CB 4.42Å; F53-I55 HydrophobicContact CB-CD1 4.04Å; F53-I55 HydrophobicContact CB-CG1 4.14Å; F53-I55 PolarHBondContact O-N 2.78Å; I55-V57 HydrophobicContact CG2-CG2 4.41Å; I55-L69 HydrophobicContact CB-CD2 4.17Å; I55-L69 HydrophobicContact CD1-CD2 3.82Å; I55-L69 HydrophobicContact CD1-CG 4.35Å; I55-L69 HydrophobicContact CG2-CD2 4.32Å; I55-L69 HydrophobicContact CG2-CG 4.34Å; I55-E72 HydrophobicContact CD1-CG 4.47Å; I55-F146 WeakPolarHBondContact O-CB 3.44Å; I55-Q147 PolarHBondContact O-N 2.93Å; I55-Q147 VanDerWaalsContact O-N 3.14Å
56	A	89.6	Confident	83.7	Confident	57 Å²	57	66.6 Å²	66.6	47%	0.471	41%	0.407	S	S	.	.	P	Polyproline II helix	trans	-94.1	131.1	164.4	0	0	0	0	0	109
57	V	90.9	Very high	85.8	Confident	4 Å²	4	62.5 Å²	62.5	2%	0.024	38%	0.377	C	S	.	.	P	Polyproline II helix	trans	-99.2	129.1	173.6	179	0	0	0	0	108.3	I55 Q59 I62 L69 V112 F146 N148	I55-V57 HydrophobicContact CG2-CG2 4.41Å; V57-Q59 PolarHBondContact O-N 3.04Å; V57-I62 HydrophobicContact CG1-CB 4.1Å; V57-I62 HydrophobicContact CG1-CG2 4.34Å; V57-L69 HydrophobicContact CG2-CD1 3.69Å; V57-V112 HydrophobicContact CB-CG2 4.07Å; V57-V112 HydrophobicContact CG1-CG2 3.71Å; V57-F146 HydrophobicContact CB-CE2 4.02Å; V57-F146 HydrophobicContact CG2-CD2 3.93Å; V57-F146 HydrophobicContact CG2-CE2 3.56Å; V57-F146 HydrophobicContact CG2-CZ 4.08Å; V57-N148 PolarHBondContact N-OD1 3.31Å; V57-N148 PolarHBondContact O-ND2 3.33Å
58	D	88.9	Confident	87.7	Confident	98 Å²	98	60 Å²	60	52%	0.524	37%	0.367	S	S	.	.	P	Polyproline II helix	trans	-61.8	132.4	174	-170	-31	0	0	0	109.3	D60 D61 I62	D58-D60 PolarHBondContact OD1-N 3.16Å; D58-D61 CarbonylContact O-C 3.51Å; D58-I62 WeakPolarHBondContact O-CA 3.22Å; D58-I62 WeakPolarHBondContact O-CG2 3.46Å; D58-I62 PolarHBondContact O-N 2.98Å
59	Q	84.1	Confident	89.3	Confident	48 Å²	48	56.2 Å²	56.2	22%	0.224	34%	0.336	C	S	.	.	S	Bend	trans	-67.5	-41.1	178.5	-66.4	-176.2	63.8	0	0	110.1	V57 K94 V112 Y113 E115	V57-Q59 PolarHBondContact O-N 3.04Å; Q59-K94 HydrophobicContact CB-CD 4.37Å; Q59-K94 WeakPolarHBondContact O-CD 3.2Å; Q59-K94 VanDerWaalsContact O-CE 3.24Å; Q59-K94 WeakPolarHBondContact O-CE 3.23Å; Q59-K94 PolarHBondContact O-NZ 2.82Å; Q59-V112 HydrophobicContact CG-CG1 4.12Å; Q59-Y113 PolarHBondContact OE1-O 3Å; Q59-E115 VanDerWaalsContact OE1-N 3.14Å
60	D	84.9	Confident	90.3	Very high	124 Å²	124	51.9 Å²	51.9	66%	0.663	30%	0.3	S	S	*	.	S	Bend	trans	-73.5	-40.5	-173.9	-67.7	-28.5	0	0	0	111.8	D58 K94	D58-D60 PolarHBondContact OD1-N 3.16Å; D60-K94 IonicContact OD1-NZ 3.82Å; D60-K94 PolarHBondContact OD1-NZ 3.42Å
61	D	88.4	Confident	90.8	Very high	79 Å²	79	57.4 Å²	57.4	42%	0.422	32%	0.317	S	S	.	.			trans	-120.4	91.2	171.3	-170.4	13.9	0	0	0	113.1	D58 L63 P64	D58-D61 CarbonylContact O-C 3.51Å; D61-L63 VanDerWaalsContact C-N 3.31Å; D61-L63 PolarHBondContact O-N 3.45Å; D61-L63 PolarHBondContact OD1-N 2.8Å; D61-P64 VanDerWaalsContact OD1-CD 3.29Å; D61-P64 WeakPolarHBondContact OD1-CD 3.49Å; D61-P64 VanDerWaalsContact OD2-CD 3.28Å; D61-P64 WeakPolarHBondContact OD2-CD 3.37Å; D61-P64 WeakPolarHBondContact OD2-CG 3.38Å
62	I	90.3	Very high	90.9	Very high	1 Å²	1	59.8 Å²	59.8	1%	0.005	32%	0.323	C	S	.	.	H	α-helix	trans	-73.7	-19.8	-178.5	65	-172	0	0	0	113.6	V57 D58 A66 R86 K94 L96 V112	V57-I62 HydrophobicContact CG1-CB 4.1Å; V57-I62 HydrophobicContact CG1-CG2 4.34Å; D58-I62 WeakPolarHBondContact O-CA 3.22Å; D58-I62 WeakPolarHBondContact O-CG2 3.46Å; D58-I62 PolarHBondContact O-N 2.98Å; I62-A66 VanDerWaalsContact O-CB 3.24Å; I62-A66 WeakPolarHBondContact O-CB 3.21Å; I62-A66 PolarHBondContact O-N 3.28Å; I62-R86 HydrophobicContact CD1-CG 4.19Å; I62-K94 HydrophobicContact CG2-CB 4.19Å; I62-K94 HydrophobicContact CG2-CD 4.35Å; I62-L96 HydrophobicContact CD1-CB 3.71Å; I62-L96 HydrophobicContact CD1-CD1 3.97Å; I62-L96 HydrophobicContact CD1-CG 4.31Å; I62-L96 HydrophobicContact CG1-CB 4.28Å; I62-L96 HydrophobicContact CG1-CD1 4.26Å; I62-L96 HydrophobicContact CG1-CD2 4.34Å; I62-V112 HydrophobicContact CB-CG2 4.38Å; I62-V112 HydrophobicContact CG2-CB 4.41Å; I62-V112 HydrophobicContact CG2-CG2 3.89Å
63	L	91.2	Very high	91	Very high	70 Å²	70	56.3 Å²	56.3	37%	0.366	30%	0.297	S	S	.	.	H	α-helix	trans	-68.4	-47.5	-166.8	-178.9	150.2	0	0	0	113	D61 G65 A66 L67	D61-L63 VanDerWaalsContact C-N 3.31Å; D61-L63 PolarHBondContact O-N 3.45Å; D61-L63 PolarHBondContact OD1-N 2.8Å; L63-G65 VanDerWaalsContact C-N 3.32Å; L63-G65 PolarHBondContact O-N 3.49Å; L63-A66 PolarHBondContact O-N 2.88Å; L63-L67 HydrophobicContact CD2-CD1 3.69Å; L63-L67 HydrophobicContact CD2-CG 4.37Å; L63-L67 HydrophobicContact CG-CD1 4.41Å; L63-L67 WeakPolarHBondContact O-CG 3.44Å; L63-L67 PolarHBondContact O-N 3.09Å
64	P	93.3	Very high	91	Very high	65 Å²	65	56.4 Å²	56.4	42%	0.422	30%	0.296	S	S	.	.	H	α-helix	trans	-60.8	-41.7	177.7	-23.3	33.3	0	0	0	112.5	D61 R68	D61-P64 VanDerWaalsContact OD1-CD 3.29Å; D61-P64 WeakPolarHBondContact OD1-CD 3.49Å; D61-P64 VanDerWaalsContact OD2-CD 3.28Å; D61-P64 WeakPolarHBondContact OD2-CD 3.37Å; D61-P64 WeakPolarHBondContact OD2-CG 3.38Å; P64-R68 WeakPolarHBondContact O-CG 3.32Å; P64-R68 PolarHBondContact O-N 3.48Å
65	G	92.6	Very high	91.1	Very high	8 Å²	8	56.8 Å²	56.8	8%	0.082	29%	0.291	C	S	.	.	H	α-helix	trans	-66.9	-42.6	177.9	0	0	0	0	0	112.3	L63 R68 L69	L63-G65 VanDerWaalsContact C-N 3.32Å; L63-G65 PolarHBondContact O-N 3.49Å; G65-R68 WeakPolarHBondContact O-CB 3.41Å; G65-R68 PolarHBondContact O-N 2.92Å; G65-L69 WeakPolarHBondContact O-CG 3.41Å; G65-L69 PolarHBondContact O-N 3.18Å; G65-L69 VanDerWaalsContact O-N 3.09Å
66	A	92.7	Very high	91.2	Very high	0 Å²	0	64.2 Å²	64.2	0%	0	33%	0.325	C	S	.	.	H	α-helix	trans	-60.4	-47	174.9	0	0	0	0	0	111.9	I62 L63 R68 L69 I70 L96 V110	I62-A66 VanDerWaalsContact O-CB 3.24Å; I62-A66 WeakPolarHBondContact O-CB 3.21Å; I62-A66 PolarHBondContact O-N 3.28Å; L63-A66 PolarHBondContact O-N 2.88Å; A66-R68 VanDerWaalsContact C-N 3.28Å; A66-R68 PolarHBondContact O-N 2.73Å; A66-L69 WeakPolarHBondContact O-CB 3.28Å; A66-L69 PolarHBondContact O-N 3.31Å; A66-L69 VanDerWaalsContact O-N 3.08Å; A66-I70 WeakPolarHBondContact O-CG1 3.42Å; A66-I70 PolarHBondContact O-N 2.95Å; A66-L96 HydrophobicContact CB-CD2 3.48Å; A66-L96 VanDerWaalsContact CB-CD2 3.48Å; A66-V110 HydrophobicContact CB-CB 4.36Å; A66-V110 HydrophobicContact CB-CG1 4.24Å; A66-V110 HydrophobicContact CB-CG2 4.04Å
67	L	93.3	Very high	91.3	Very high	46 Å²	46	63.4 Å²	63.4	24%	0.241	31%	0.31	C	S	.	.	H	α-helix	trans	-62.2	-34.7	178.5	-69.6	177.5	0	0	0	112.7	L63 I70 R71 V82 T84	L63-L67 HydrophobicContact CD2-CD1 3.69Å; L63-L67 HydrophobicContact CD2-CG 4.37Å; L63-L67 HydrophobicContact CG-CD1 4.41Å; L63-L67 WeakPolarHBondContact O-CG 3.44Å; L63-L67 PolarHBondContact O-N 3.09Å; L67-I70 PolarHBondContact O-N 3.08Å; L67-R71 WeakPolarHBondContact O-CG 3.16Å; L67-R71 PolarHBondContact O-N 2.87Å; L67-V82 HydrophobicContact CD2-CB 4.34Å; L67-V82 HydrophobicContact CD2-CG1 3.93Å; L67-T84 HydrophobicContact CD2-CG2 4.49Å
68	R	94.3	Very high	91.3	Very high	136 Å²	136	69 Å²	69	51%	0.513	33%	0.334	S	S	.	.	H	α-helix	trans	-62.9	-45.1	172.2	-71.5	174.4	65.5	-167.2	0.1	111.6	P64 G65 A66 I70 R71 E72	P64-R68 WeakPolarHBondContact O-CG 3.32Å; P64-R68 PolarHBondContact O-N 3.48Å; G65-R68 WeakPolarHBondContact O-CB 3.41Å; G65-R68 PolarHBondContact O-N 2.92Å; A66-R68 VanDerWaalsContact C-N 3.28Å; A66-R68 PolarHBondContact O-N 2.73Å; R68-I70 VanDerWaalsContact C-N 3.34Å; R68-I70 PolarHBondContact O-N 3.3Å; R68-R71 PolarHBondContact O-N 3.16Å; R68-E72 PolarHBondContact O-N 3.41Å
69	L	94.4	Very high	91.2	Very high	0 Å²	0	67.4 Å²	67.4	0%	0	33%	0.329	C	S	.	.	H	α-helix	trans	-61.8	-41.8	176	-70.2	164	0	0	0	111.8	F53 I55 V57 G65 A66 R71 E72 L73 V110 F146	F53-L69 HydrophobicContact CB-CD2 4.22Å; F53-L69 HydrophobicContact CD2-CD2 4.03Å; F53-L69 HydrophobicContact CG-CD2 4.42Å; I55-L69 HydrophobicContact CB-CD2 4.17Å; I55-L69 HydrophobicContact CD1-CD2 3.82Å; I55-L69 HydrophobicContact CD1-CG 4.35Å; I55-L69 HydrophobicContact CG2-CD2 4.32Å; I55-L69 HydrophobicContact CG2-CG 4.34Å; V57-L69 HydrophobicContact CG2-CD1 3.69Å; G65-L69 WeakPolarHBondContact O-CG 3.41Å; G65-L69 PolarHBondContact O-N 3.18Å; G65-L69 VanDerWaalsContact O-N 3.09Å; A66-L69 WeakPolarHBondContact O-CB 3.28Å; A66-L69 PolarHBondContact O-N 3.31Å; A66-L69 VanDerWaalsContact O-N 3.08Å; L69-R71 VanDerWaalsContact C-N 3.33Å; L69-R71 PolarHBondContact O-N 3.4Å; L69-E72 PolarHBondContact O-N 2.91Å; L69-L73 WeakPolarHBondContact O-CB 3.29Å; L69-L73 WeakPolarHBondContact O-CG 3.32Å; L69-L73 PolarHBondContact O-N 3.16Å; L69-V110 HydrophobicContact CD1-CG1 4.06Å; L69-F146 HydrophobicContact CD1-CD1 3.6Å; L69-F146 HydrophobicContact CD1-CD2 4.38Å; L69-F146 HydrophobicContact CD1-CE1 3.62Å; L69-F146 HydrophobicContact CD1-CE2 4.4Å; L69-F146 HydrophobicContact CD1-CG 4Å; L69-F146 HydrophobicContact CD1-CZ 4.03Å; L69-F146 HydrophobicContact CD2-CB 3.98Å; L69-F146 HydrophobicContact CD2-CD1 4Å; L69-F146 HydrophobicContact CD2-CG 4.12Å; L69-F146 HydrophobicContact CG-CD1 4.49Å
70	I	94.3	Very high	91.4	Very high	4 Å²	4	72.2 Å²	72.2	2%	0.021	35%	0.352	C	S	.	.	H	α-helix	trans	-64.8	-37	179.2	-64.5	-59.5	0	0	0	111.7	A66 L67 R68 E72 L73 R74 W77 V82 C98 V108	A66-I70 WeakPolarHBondContact O-CG1 3.42Å; A66-I70 PolarHBondContact O-N 2.95Å; L67-I70 PolarHBondContact O-N 3.08Å; R68-I70 VanDerWaalsContact C-N 3.34Å; R68-I70 PolarHBondContact O-N 3.3Å; I70-E72 VanDerWaalsContact C-N 3.28Å; I70-E72 PolarHBondContact O-N 3.08Å; I70-L73 PolarHBondContact O-N 2.89Å; I70-R74 CarbonylContact O-C 3.53Å; I70-R74 WeakPolarHBondContact O-CA 3.5Å; I70-R74 PolarHBondContact O-N 2.82Å; I70-W77 HydrophobicContact CG2-CD2 4.35Å; I70-W77 HydrophobicContact CG2-CE3 3.47Å; I70-W77 VanDerWaalsContact CG2-CE3 3.47Å; I70-W77 HydrophobicContact CG2-CZ3 3.91Å; I70-V82 HydrophobicContact CG2-CG2 4.46Å; I70-C98 HydrophobicContact CD1-CB 3.66Å; I70-C98 HydrophobicContact CG1-CB 3.68Å; I70-V108 HydrophobicContact CD1-CB 3.66Å; I70-V108 HydrophobicContact CD1-CG1 3.74Å; I70-V108 HydrophobicContact CD1-CG2 4.05Å
71	R	93.4	Very high	91.6	Very high	148 Å²	148	69.8 Å²	69.8	56%	0.558	34%	0.336	S	S	*	.	H	α-helix	trans	-59.5	-39.5	174.6	-73.8	172.6	-179	166.4	1	112.4	L67 R68 L69 P75	L67-R71 WeakPolarHBondContact O-CG 3.16Å; L67-R71 PolarHBondContact O-N 2.87Å; R68-R71 PolarHBondContact O-N 3.16Å; L69-R71 VanDerWaalsContact C-N 3.33Å; L69-R71 PolarHBondContact O-N 3.4Å; R71-P75 WeakPolarHBondContact O-CA 3.38Å
72	E	92.6	Very high	91.8	Very high	120 Å²	120	67 Å²	67	56%	0.561	32%	0.322	S	S	*	.	H	α-helix	trans	-72.6	-42.8	176.3	-60.7	-60.1	148.2	0	0	111.9	F53 I55 R68 L69 I70	F53-E72 HydrophobicContact CD1-CB 4.43Å; F53-E72 HydrophobicContact CD1-CG 4.47Å; F53-E72 HydrophobicContact CE1-CB 3.78Å; F53-E72 HydrophobicContact CE1-CG 4.2Å; F53-E72 HydrophobicContact CE2-CB 4.34Å; F53-E72 HydrophobicContact CZ-CB 3.72Å; I55-E72 HydrophobicContact CD1-CG 4.47Å; R68-E72 PolarHBondContact O-N 3.41Å; L69-E72 PolarHBondContact O-N 2.91Å; I70-E72 VanDerWaalsContact C-N 3.28Å; I70-E72 PolarHBondContact O-N 3.08Å
73	L	92.3	Very high	91.9	Very high	25 Å²	25	73 Å²	73	13%	0.131	35%	0.345	C	S	.	.	H	α-helix	trans	-74.5	-31.9	-176.9	-74.3	178.2	0	0	0	113.9	F53 L69 I70 V108 C144 C151	F53-L73 HydrophobicContact CE2-CD2 3.84Å; F53-L73 HydrophobicContact CE2-CG 4.21Å; F53-L73 HydrophobicContact CZ-CD2 4.34Å; L69-L73 WeakPolarHBondContact O-CB 3.29Å; L69-L73 WeakPolarHBondContact O-CG 3.32Å; L69-L73 PolarHBondContact O-N 3.16Å; I70-L73 PolarHBondContact O-N 2.89Å; L73-V108 HydrophobicContact CD1-CG1 4.17Å; L73-C144 HydrophobicContact CD2-CB 3.88Å; L73-C151 HydrophobicContact CD1-CB 3.89Å
74	R	91.8	Very high	91.9	Very high	46 Å²	46	72.2 Å²	72.2	17%	0.174	34%	0.342	C	S	.	.			trans	-141.7	73.8	-173	-66.4	-62.9	-176.2	-75.5	-8.7	109.9	I70 H76 W77 D106 Y143	I70-R74 CarbonylContact O-C 3.53Å; I70-R74 WeakPolarHBondContact O-CA 3.5Å; I70-R74 PolarHBondContact O-N 2.82Å; R74-H76 PolarHBondContact O-N 3.33Å; R74-H76 VanDerWaalsContact O-N 3.08Å; R74-W77 HydrophobicContact CB-CB 4.22Å; R74-W77 HydrophobicContact CB-CD2 3.74Å; R74-W77 HydrophobicContact CB-CE3 4.34Å; R74-W77 HydrophobicContact CB-CG 3.66Å; R74-W77 HydrophobicContact CG-CD2 4.05Å; R74-W77 HydrophobicContact CG-CG 4.39Å; R74-W77 HydrophobicContact CG-CZ2 4.12Å; R74-W77 PolarHBondContact O-N 2.79Å; R74-D106 WeakPolarHBondContact CD-OD2 3.17Å; R74-D106 IonicContact CZ-OD1 3.38Å; R74-D106 IonicContact CZ-OD2 3.81Å; R74-D106 IonicContact NE-OD1 3.16Å; R74-D106 PolarHBondContact NE-OD1 3.09Å; R74-D106 VanDerWaalsContact NE-OD1 3.16Å; R74-D106 IonicContact NE-OD2 2.82Å; R74-D106 PolarHBondContact NE-OD2 2.95Å; R74-D106 IonicContact NH2-OD1 2.73Å; R74-D106 PolarHBondContact NH2-OD1 2.84Å; R74-D106 IonicContact NH2-OD2 3.91Å; R74-Y143 VanDerWaalsContact NH2-CE1 3.27Å
75	P	90.7	Very high	91.8	Very high	96 Å²	96	70.9 Å²	70.9	62%	0.623	33%	0.33	S	S	*	.	T	Hydrogen-bonded Turn	trans	-63.3	-18.6	-179.6	25.4	-35.1	0	0	0	113.6	R71 W77	R71-P75 WeakPolarHBondContact O-CA 3.38Å; P75-W77 VanDerWaalsContact C-N 3.34Å
76	H	91	Very high	91.6	Very high	174 Å²	174	75.7 Å²	75.7	81%	0.806	35%	0.346	S	S	*	.	T	Hydrogen-bonded Turn	trans	-79	-15.4	177.5	-55.8	92.4	0	0	0	113.4	R74 K78	R74-H76 PolarHBondContact O-N 3.33Å; R74-H76 VanDerWaalsContact O-N 3.08Å; H76-K78 PolarHBondContact O-N 2.87Å
77	W	92.8	Very high	91.2	Very high	39 Å²	39	77.2 Å²	77.2	15%	0.148	35%	0.353	C	S	.	.	S	Bend	trans	-78.4	123.7	179	-71.5	13.1	0	0	0	109.9	I70 R74 P75 V82 C98 V100 D106 V108	I70-W77 HydrophobicContact CG2-CD2 4.35Å; I70-W77 HydrophobicContact CG2-CE3 3.47Å; I70-W77 VanDerWaalsContact CG2-CE3 3.47Å; I70-W77 HydrophobicContact CG2-CZ3 3.91Å; R74-W77 HydrophobicContact CB-CB 4.22Å; R74-W77 HydrophobicContact CB-CD2 3.74Å; R74-W77 HydrophobicContact CB-CE3 4.34Å; R74-W77 HydrophobicContact CB-CG 3.66Å; R74-W77 HydrophobicContact CG-CD2 4.05Å; R74-W77 HydrophobicContact CG-CG 4.39Å; R74-W77 HydrophobicContact CG-CZ2 4.12Å; R74-W77 PolarHBondContact O-N 2.79Å; P75-W77 VanDerWaalsContact C-N 3.34Å; W77-V82 HydrophobicContact CB-CG2 4.14Å; W77-V82 HydrophobicContact CE3-CG1 4.42Å; W77-V82 HydrophobicContact CE3-CG2 3.87Å; W77-C98 HydrophobicContact CZ3-CB 4.47Å; W77-V100 HydrophobicContact CD2-CG2 3.69Å; W77-V100 HydrophobicContact CE3-CG2 3.91Å; W77-V100 HydrophobicContact CG-CG2 3.99Å; W77-V100 HydrophobicContact CZ2-CG2 4.4Å; W77-V100 HydrophobicContact CZ3-CG2 4.37Å; W77-D106 VanDerWaalsContact CH2-O 3.22Å; W77-D106 WeakPolarHBondContact CH2-O 3.26Å; W77-D106 HydrophobicContact CZ2-CB 4.05Å; W77-D106 VanDerWaalsContact CZ2-O 3.23Å; W77-D106 WeakPolarHBondContact CZ2-O 3.47Å; W77-D106 WeakPolarHBondContact CZ2-OD2 3.24Å; W77-V108 HydrophobicContact CH2-CG2 4.32Å
78	K	89.8	Confident	90.1	Very high	123 Å²	123	83.4 Å²	83.4	54%	0.535	38%	0.377	S	S	.	.			trans	-73	129.8	173.7	-65.3	-179.2	-176.7	172	0	109.2	H76 E80 Q81 V82	H76-K78 PolarHBondContact O-N 2.87Å; K78-E80 PolarHBondContact O-N 3.34Å; K78-Q81 HydrophobicContact CB-CB 4.43Å; K78-Q81 HydrophobicContact CB-CG 4.12Å; K78-Q81 PolarHBondContact O-N 2.81Å; K78-V82 PolarHBondContact O-N 3.36Å
79	P	86.4	Confident	88.6	Confident	64 Å²	64	81.7 Å²	81.7	42%	0.416	38%	0.379	S	S	.	.	G	3₁₀ helix	trans	-52.9	-32	-178.2	-27.2	34.9	0	0	0	114	Q81 V82	P79-Q81 VanDerWaalsContact C-N 3.29Å; P79-Q81 PolarHBondContact O-N 3.37Å; P79-V82 PolarHBondContact O-N 2.88Å
80	E	89	Confident	87.1	Confident	149 Å²	149	84 Å²	84	70%	0.696	40%	0.402	S	S	*	.	G	3₁₀ helix	trans	-72.9	-21.9	-178.2	-54.7	71.9	-149.8	0	0	112.9	K78	K78-E80 PolarHBondContact O-N 3.34Å
81	Q	90.1	Very high	85.5	Confident	73 Å²	73	92 Å²	92	34%	0.341	44%	0.443	S	S	.	.	G	3₁₀ helix	trans	-93.8	-13	-179.5	-64.8	179.2	-38.2	0	0	112.6	K78 P79 R83 V100	K78-Q81 HydrophobicContact CB-CB 4.43Å; K78-Q81 HydrophobicContact CB-CG 4.12Å; K78-Q81 PolarHBondContact O-N 2.81Å; P79-Q81 VanDerWaalsContact C-N 3.29Å; P79-Q81 PolarHBondContact O-N 3.37Å; Q81-R83 PolarHBondContact O-N 2.87Å; Q81-V100 HydrophobicContact CB-CG1 4.25Å
82	V	91.8	Very high	84.1	Confident	20 Å²	20	88.3 Å²	88.3	12%	0.121	44%	0.437	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-74.9	113.2	-179.4	-175.8	0	0	0	0	109.4	L67 I70 W77 K78 P79 C98	L67-V82 HydrophobicContact CD2-CB 4.34Å; L67-V82 HydrophobicContact CD2-CG1 3.93Å; I70-V82 HydrophobicContact CG2-CG2 4.46Å; W77-V82 HydrophobicContact CB-CG2 4.14Å; W77-V82 HydrophobicContact CE3-CG1 4.42Å; W77-V82 HydrophobicContact CE3-CG2 3.87Å; K78-V82 PolarHBondContact O-N 3.36Å; P79-V82 PolarHBondContact O-N 2.88Å; V82-C98 HydrophobicContact CG1-CB 4.22Å
83	R	92.4	Very high	83.2	Confident	128 Å²	128	84.6 Å²	84.6	48%	0.483	42%	0.421	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-91.8	151.1	168.7	-62.1	-58.2	-167.6	-173.2	-3.4	110	Q81 C98 Y99 E101	Q81-R83 PolarHBondContact O-N 2.87Å; R83-C98 WeakPolarHBondContact O-CA 3.27Å; R83-Y99 HydrophobicContact CB-CD1 4.43Å; R83-Y99 HydrophobicContact CB-CD2 4.23Å; R83-Y99 HydrophobicContact CB-CE1 3.98Å; R83-Y99 HydrophobicContact CB-CE2 3.78Å; R83-Y99 HydrophobicContact CG-CE2 4.4Å; R83-Y99 PolarHBondContact N-O 3.42Å; R83-Y99 PolarHBondContact O-N 3.32Å; R83-E101 HydrophobicContact CG-CG 3.99Å; R83-E101 IonicContact CZ-OE1 3.54Å; R83-E101 IonicContact NE-OE1 2.82Å; R83-E101 PolarHBondContact NE-OE1 2.9Å; R83-E101 IonicContact NH2-OE1 3.39Å; R83-E101 PolarHBondContact NH2-OE1 3.31Å
84	T	91.6	Very high	82.9	Confident	52 Å²	52	86.2 Å²	86.2	32%	0.319	43%	0.427	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-131.7	138	179.8	63.6	0	0	0	0	111.6	L67 L96 A97	L67-T84 HydrophobicContact CD2-CG2 4.49Å; T84-L96 HydrophobicContact CG2-CD2 4.14Å; T84-A97 CarbonylContact C-O 3.32Å; T84-A97 WeakPolarHBondContact CA-O 3.46Å
85	K	90.4	Very high	82.8	Confident	38 Å²	38	84.6 Å²	84.6	17%	0.165	42%	0.422	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-124.5	124.9	172.1	-177.7	170.9	-177.9	167.3	0	110.4	L96 A97 Y99 T189 W190	K85-L96 CarbonylContact O-C 3.39Å; K85-L96 WeakPolarHBondContact O-CA 3.48Å; K85-A97 HydrophobicContact CB-CB 4.39Å; K85-A97 PolarHBondContact N-O 2.94Å; K85-A97 PolarHBondContact O-N 3.39Å; K85-Y99 HydrophobicContact CB-CE1 4.33Å; K85-T189 PolarHBondContact NZ-O 2.97Å; K85-T189 VanDerWaalsContact NZ-O 3.08Å; K85-W190 HydrophobicContact CB-CE3 4.29Å; K85-W190 HydrophobicContact CB-CH2 4.45Å; K85-W190 HydrophobicContact CB-CZ3 3.63Å; K85-W190 HydrophobicContact CD-CD2 4.17Å; K85-W190 HydrophobicContact CD-CE3 3.42Å; K85-W190 VanDerWaalsContact CD-CE3 3.42Å; K85-W190 HydrophobicContact CD-CH2 4.02Å; K85-W190 HydrophobicContact CD-CZ3 3.34Å; K85-W190 HydrophobicContact CG-CE3 4.47Å; K85-W190 HydrophobicContact CG-CZ3 4.08Å
86	R	88.4	Confident	82.8	Confident	109 Å²	109	80.2 Å²	80.2	41%	0.411	39%	0.393	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-93.3	127.3	177.9	-172.3	172.2	-178	166.4	4.2	110.3	I62 L96	I62-R86 HydrophobicContact CD1-CG 4.19Å; R86-L96 HydrophobicContact CB-CD1 3.86Å; R86-L96 HydrophobicContact CG-CD1 4.44Å
87	F	84.1	Confident	82.9	Confident	32 Å²	32	72 Å²	72	14%	0.14	36%	0.355	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-93.7	125.9	173.4	-57	-89.4	0	0	0	109	L95 A97 L109 W190	F87-L95 HydrophobicContact CB-CB 4.21Å; F87-L95 HydrophobicContact CB-CD2 4.26Å; F87-L95 HydrophobicContact CD2-CB 4.14Å; F87-L95 HydrophobicContact CD2-CD2 3.6Å; F87-L95 HydrophobicContact CD2-CG 3.74Å; F87-L95 HydrophobicContact CE2-CD2 4.13Å; F87-L95 HydrophobicContact CE2-CG 4.35Å; F87-L95 HydrophobicContact CG-CD2 4.02Å; F87-L95 HydrophobicContact CG-CG 4.47Å; F87-L95 PolarHBondContact N-O 2.83Å; F87-A97 HydrophobicContact CE2-CB 3.72Å; F87-A97 HydrophobicContact CZ-CB 4.18Å; F87-L109 HydrophobicContact CE2-CD2 3.87Å; F87-L109 HydrophobicContact CZ-CD2 4.46Å; F87-W190 HydrophobicContact CZ-CH2 4.35Å
88	K	70.9	Confident	82.9	Confident	176 Å²	176	70.1 Å²	70.1	77%	0.765	35%	0.348	S	S	*	.			trans	-102.2	-6.6	-174.7	-58.1	-176.5	-166.7	178.9	0	113.8	G90	K88-G90 VanDerWaalsContact C-N 3.32Å; K88-G90 PolarHBondContact O-N 2.85Å
89	D	63.2	Low	83.1	Confident	100 Å²	100	65.8 Å²	65.8	54%	0.535	33%	0.328	S	S	.	.			trans	-86.8	9.5	-171	-72	-8.1	0	0	0	115.3
90	G	62.8	Low	83.4	Confident	47 Å²	47	63.4 Å²	63.4	49%	0.485	31%	0.313	S	S	.	.			trans	-87.3	128.4	176.2	0	0	0	0	0	111.1	K88 T92	K88-G90 VanDerWaalsContact C-N 3.32Å; K88-G90 PolarHBondContact O-N 2.85Å; G90-T92 VanDerWaalsContact C-N 3.34Å
91	I	60.4	Low	83.1	Confident	174 Å²	174	62.3 Å²	62.3	89%	0.892	31%	0.307	S	S	*	.	S	Bend	trans	-63.7	-43.6	173.7	-58.9	175.3	0	0	0	110.2
92	T	62.9	Low	82.6	Confident	70 Å²	70	66.8 Å²	66.8	43%	0.429	33%	0.328	S	S	.	.	S	Bend	trans	-124.3	-20.3	-166.1	-33	0	0	0	0	114.3	G90 G114 T117	G90-T92 VanDerWaalsContact C-N 3.34Å; T92-G114 WeakPolarHBondContact O-CA 3.45Å; T92-G114 PolarHBondContact O-N 3.14Å; T92-G114 VanDerWaalsContact O-N 3.17Å; T92-T117 HydrophobicContact CG2-CG2 3.21Å
93	N	75.1	Confident	82.1	Confident	42 Å²	42	69.5 Å²	69.5	23%	0.225	34%	0.342	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-119.1	132.4	-175.9	-59	-67.9	0	0	0	110.6	R111	N93-R111 HydrophobicContact CB-CG 4.1Å; N93-R111 PolarHBondContact ND2-NH2 2.91Å
94	K	85.6	Confident	81.5	Confident	58 Å²	58	67 Å²	67	25%	0.252	34%	0.337	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-86	132.3	173.9	-60.3	-178.9	-173.4	-174.2	0	107.9	Q59 D60 I62 V112	Q59-K94 HydrophobicContact CB-CD 4.37Å; Q59-K94 WeakPolarHBondContact O-CD 3.2Å; Q59-K94 VanDerWaalsContact O-CE 3.24Å; Q59-K94 WeakPolarHBondContact O-CE 3.23Å; Q59-K94 PolarHBondContact O-NZ 2.82Å; D60-K94 IonicContact OD1-NZ 3.82Å; D60-K94 PolarHBondContact OD1-NZ 3.42Å; I62-K94 HydrophobicContact CG2-CB 4.19Å; I62-K94 HydrophobicContact CG2-CD 4.35Å; K94-V112 HydrophobicContact CB-CB 4.42Å; K94-V112 PolarHBondContact N-O 2.96Å; K94-V112 VanDerWaalsContact N-O 3.08Å; K94-V112 PolarHBondContact O-N 2.85Å
95	L	88.8	Confident	81.1	Confident	13 Å²	13	75 Å²	75	7%	0.068	36%	0.361	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-130.8	130.3	-174.4	-173.6	75.4	0	0	0	110.9	F87 L109 V110 R111 Y152 Q183	F87-L95 HydrophobicContact CB-CB 4.21Å; F87-L95 HydrophobicContact CB-CD2 4.26Å; F87-L95 HydrophobicContact CD2-CB 4.14Å; F87-L95 HydrophobicContact CD2-CD2 3.6Å; F87-L95 HydrophobicContact CD2-CG 3.74Å; F87-L95 HydrophobicContact CE2-CD2 4.13Å; F87-L95 HydrophobicContact CE2-CG 4.35Å; F87-L95 HydrophobicContact CG-CD2 4.02Å; F87-L95 HydrophobicContact CG-CG 4.47Å; F87-L95 PolarHBondContact N-O 2.83Å; L95-L109 HydrophobicContact CD1-CB 4.21Å; L95-L109 HydrophobicContact CD1-CD2 4.47Å; L95-L109 HydrophobicContact CD2-CD2 4.42Å; L95-L109 HydrophobicContact CG-CD2 4.42Å; L95-V110 WeakPolarHBondContact CA-O 3.24Å; L95-R111 HydrophobicContact CD1-CB 3.78Å; L95-R111 HydrophobicContact CD1-CG 4.42Å; L95-Y152 HydrophobicContact CD1-CE1 4.43Å; L95-Q183 HydrophobicContact CD2-CG 3.96Å
96	L	92.1	Very high	80.9	Confident	4 Å²	4	75.2 Å²	75.2	2%	0.021	36%	0.364	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-124.8	129.4	175.4	-164.7	77.3	0	0	0	109.6	I62 A66 T84 K85 R86 V110	I62-L96 HydrophobicContact CD1-CB 3.71Å; I62-L96 HydrophobicContact CD1-CD1 3.97Å; I62-L96 HydrophobicContact CD1-CG 4.31Å; I62-L96 HydrophobicContact CG1-CB 4.28Å; I62-L96 HydrophobicContact CG1-CD1 4.26Å; I62-L96 HydrophobicContact CG1-CD2 4.34Å; A66-L96 HydrophobicContact CB-CD2 3.48Å; A66-L96 VanDerWaalsContact CB-CD2 3.48Å; T84-L96 HydrophobicContact CG2-CD2 4.14Å; K85-L96 CarbonylContact O-C 3.39Å; K85-L96 WeakPolarHBondContact O-CA 3.48Å; R86-L96 HydrophobicContact CB-CD1 3.86Å; R86-L96 HydrophobicContact CG-CD1 4.44Å; L96-V110 HydrophobicContact CB-CB 4.42Å; L96-V110 PolarHBondContact N-O 3.12Å; L96-V110 PolarHBondContact O-N 3.13Å
97	A	92.4	Very high	81	Confident	0 Å²	0	70 Å²	70	0%	0	34%	0.344	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-87.6	134.9	163.1	0	0	0	0	0	109.6	T84 K85 F87 Y99 V108 L109 W190	T84-A97 CarbonylContact C-O 3.32Å; T84-A97 WeakPolarHBondContact CA-O 3.46Å; K85-A97 HydrophobicContact CB-CB 4.39Å; K85-A97 PolarHBondContact N-O 2.94Å; K85-A97 PolarHBondContact O-N 3.39Å; F87-A97 HydrophobicContact CE2-CB 3.72Å; F87-A97 HydrophobicContact CZ-CB 4.18Å; A97-Y99 HydrophobicContact CB-CD1 4.44Å; A97-V108 WeakPolarHBondContact CA-O 3.31Å; A97-L109 HydrophobicContact CB-CD2 3.83Å; A97-W190 HydrophobicContact CB-CH2 4.03Å; A97-W190 HydrophobicContact CB-CZ3 4.41Å
98	C	93.6	Very high	81.5	Confident	0 Å²	0	68.5 Å²	68.5	0%	0	34%	0.338	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-117.7	127.5	168.4	-59	0	0	0	0	108.7	I70 W77 V82 R83 V108	I70-C98 HydrophobicContact CD1-CB 3.66Å; I70-C98 HydrophobicContact CG1-CB 3.68Å; W77-C98 HydrophobicContact CZ3-CB 4.47Å; V82-C98 HydrophobicContact CG1-CB 4.22Å; R83-C98 WeakPolarHBondContact O-CA 3.27Å; C98-V108 PolarHBondContact N-O 3.01Å; C98-V108 PolarHBondContact O-N 3.17Å
99	Y	93.3	Very high	82.6	Confident	33 Å²	33	60.1 Å²	60.1	13%	0.129	30%	0.301	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-152.8	162.8	-176.2	62.2	-80.1	0	0	0	111.4	R83 K85 A97 W190	R83-Y99 HydrophobicContact CB-CD1 4.43Å; R83-Y99 HydrophobicContact CB-CD2 4.23Å; R83-Y99 HydrophobicContact CB-CE1 3.98Å; R83-Y99 HydrophobicContact CB-CE2 3.78Å; R83-Y99 HydrophobicContact CG-CE2 4.4Å; R83-Y99 PolarHBondContact N-O 3.42Å; R83-Y99 PolarHBondContact O-N 3.32Å; K85-Y99 HydrophobicContact CB-CE1 4.33Å; A97-Y99 HydrophobicContact CB-CD1 4.44Å; Y99-W190 HydrophobicContact CD1-CZ3 4.02Å; Y99-W190 AromaticContact CE1-CE3 3.94Å; Y99-W190 HydrophobicContact CE1-CE3 3.94Å; Y99-W190 HydrophobicContact CE1-CH2 4.37Å; Y99-W190 AromaticContact CE1-CZ3 3.43Å; Y99-W190 HydrophobicContact CE1-CZ3 3.43Å; Y99-W190 VanDerWaalsContact CE1-CZ3 3.43Å; Y99-W190 AromaticContact CZ-CE3 3.83Å; Y99-W190 AromaticContact CZ-CZ3 3.82Å
100	V	91.7	Very high	84	Confident	14 Å²	14	55.4 Å²	55.4	9%	0.085	28%	0.276	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-106.6	137.1	168.1	179.8	0	0	0	0	107.3	W77 Q81 E102 D103	W77-V100 HydrophobicContact CD2-CG2 3.69Å; W77-V100 HydrophobicContact CE3-CG2 3.91Å; W77-V100 HydrophobicContact CG-CG2 3.99Å; W77-V100 HydrophobicContact CZ2-CG2 4.4Å; W77-V100 HydrophobicContact CZ3-CG2 4.37Å; Q81-V100 HydrophobicContact CB-CG1 4.25Å; V100-E102 HydrophobicContact CG1-CB 4.17Å; V100-E102 HydrophobicContact CG1-CG 4.37Å; V100-E102 PolarHBondContact O-N 3.41Å; V100-D103 CarbonylContact O-C 3.56Å; V100-D103 PolarHBondContact O-N 2.94Å
101	E	83.4	Confident	85.4	Confident	126 Å²	126	56.1 Å²	56.1	59%	0.589	26%	0.264	S	S	*	.	T	Hydrogen-bonded Turn	trans	-57.8	-31.3	-176.9	-73.1	173.9	-156.3	0	0	112.8	R83 D103	R83-E101 HydrophobicContact CG-CG 3.99Å; R83-E101 IonicContact CZ-OE1 3.54Å; R83-E101 IonicContact NE-OE1 2.82Å; R83-E101 PolarHBondContact NE-OE1 2.9Å; R83-E101 IonicContact NH2-OE1 3.39Å; R83-E101 PolarHBondContact NH2-OE1 3.31Å; E101-D103 VanDerWaalsContact C-N 3.32Å; E101-D103 PolarHBondContact O-N 2.77Å
102	E	80.3	Confident	86.8	Confident	166 Å²	166	47.9 Å²	47.9	78%	0.776	22%	0.222	S	C	*	.	T	Hydrogen-bonded Turn	trans	-66.6	-30	178.6	-61.1	177.5	-174.3	0	0	112.9	V100	V100-E102 HydrophobicContact CG1-CB 4.17Å; V100-E102 HydrophobicContact CG1-CG 4.37Å; V100-E102 PolarHBondContact O-N 3.41Å
103	D	80.4	Confident	87.9	Confident	77 Å²	77	45.2 Å²	45.2	41%	0.412	20%	0.204	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-145	89.9	-178.8	-168.2	-0.4	0	0	0	112.8	V100 E101 R105 D106	V100-D103 CarbonylContact O-C 3.56Å; V100-D103 PolarHBondContact O-N 2.94Å; E101-D103 VanDerWaalsContact C-N 3.32Å; E101-D103 PolarHBondContact O-N 2.77Å; D103-R105 PolarHBondContact O-N 3.38Å; D103-R105 WeakPolarHBondContact OD1-CA 3.19Å; D103-R105 WeakPolarHBondContact OD1-CB 3.43Å; D103-R105 PolarHBondContact OD1-N 3.38Å; D103-D106 PolarHBondContact O-N 2.93Å
104	M	80.7	Confident	87.9	Confident	76 Å²	76	43.8 Å²	43.8	37%	0.374	20%	0.199	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-69.4	-12.7	173.4	-64.4	-167.8	75.2	0	0	113.9	D106 C107 W190	M104-D106 VanDerWaalsContact C-N 3.35Å; M104-C107 WeakPolarHBondContact O-CB 3.45Å; M104-C107 PolarHBondContact O-N 3.38Å; M104-W190 HydrophobicContact CE-CD2 3.68Å; M104-W190 HydrophobicContact CE-CE3 4.18Å; M104-W190 HydrophobicContact CE-CG 3.9Å; M104-W190 HydrophobicContact CE-CH2 4.48Å; M104-W190 HydrophobicContact CE-CZ2 4Å
105	R	82.3	Confident	87	Confident	221 Å²	221	47.4 Å²	47.4	83%	0.834	22%	0.217	S	C	*	.	E	Extended strand (participates in β ladder)	trans	-76	-27.2	-179.9	-58	178	177.4	170.3	1	111.7	D103 C107	D103-R105 PolarHBondContact O-N 3.38Å; D103-R105 WeakPolarHBondContact OD1-CA 3.19Å; D103-R105 WeakPolarHBondContact OD1-CB 3.43Å; D103-R105 PolarHBondContact OD1-N 3.38Å; R105-C107 PolarHBondContact O-N 3.31Å
106	D	86.6	Confident	85.6	Confident	41 Å²	41	55.7 Å²	55.7	22%	0.219	25%	0.248	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-88.9	19.5	174	-160.6	30.9	0	0	0	112.5	R74 W77 D103 M104 V108	R74-D106 WeakPolarHBondContact CD-OD2 3.17Å; R74-D106 IonicContact CZ-OD1 3.38Å; R74-D106 IonicContact CZ-OD2 3.81Å; R74-D106 IonicContact NE-OD1 3.16Å; R74-D106 PolarHBondContact NE-OD1 3.09Å; R74-D106 VanDerWaalsContact NE-OD1 3.16Å; R74-D106 IonicContact NE-OD2 2.82Å; R74-D106 PolarHBondContact NE-OD2 2.95Å; R74-D106 IonicContact NH2-OD1 2.73Å; R74-D106 PolarHBondContact NH2-OD1 2.84Å; R74-D106 IonicContact NH2-OD2 3.91Å; W77-D106 VanDerWaalsContact CH2-O 3.22Å; W77-D106 WeakPolarHBondContact CH2-O 3.26Å; W77-D106 HydrophobicContact CZ2-CB 4.05Å; W77-D106 VanDerWaalsContact CZ2-O 3.23Å; W77-D106 WeakPolarHBondContact CZ2-O 3.47Å; W77-D106 WeakPolarHBondContact CZ2-OD2 3.24Å; D103-D106 PolarHBondContact O-N 2.93Å; M104-D106 VanDerWaalsContact C-N 3.35Å; D106-V108 PolarHBondContact O-N 2.82Å
107	C	91.4	Very high	84	Confident	0 Å²	0	56.5 Å²	56.5	0%	0	25%	0.253	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-63.4	132.2	177.4	177.2	0	0	0	0	111.7	M104 R105 Y154	M104-C107 WeakPolarHBondContact O-CB 3.45Å; M104-C107 PolarHBondContact O-N 3.38Å; R105-C107 PolarHBondContact O-N 3.31Å; C107-Y154 HydrophobicContact CB-CG 4.31Å; C107-Y154 PolarHBondContact O-N 2.85Å; C107-Y154 VanDerWaalsContact O-N 3.16Å
108	V	93.7	Very high	82.3	Confident	0 Å²	0	63.3 Å²	63.3	0%	0	28%	0.284	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-108.1	123.5	-179.4	-179.9	0	0	0	0	109.8	I70 L73 W77 A97 C98 D106 V110 Y143 C151	I70-V108 HydrophobicContact CD1-CB 3.66Å; I70-V108 HydrophobicContact CD1-CG1 3.74Å; I70-V108 HydrophobicContact CD1-CG2 4.05Å; L73-V108 HydrophobicContact CD1-CG1 4.17Å; W77-V108 HydrophobicContact CH2-CG2 4.32Å; A97-V108 WeakPolarHBondContact CA-O 3.31Å; C98-V108 PolarHBondContact N-O 3.01Å; C98-V108 PolarHBondContact O-N 3.17Å; D106-V108 PolarHBondContact O-N 2.82Å; V108-V110 HydrophobicContact CG1-CG2 4.5Å; V108-Y143 HydrophobicContact CB-CD2 4.47Å; V108-Y143 HydrophobicContact CB-CE2 4.35Å; V108-Y143 HydrophobicContact CG1-CD2 3.95Å; V108-Y143 HydrophobicContact CG1-CE2 4.3Å; V108-Y143 HydrophobicContact CG2-CD2 4.08Å; V108-Y143 HydrophobicContact CG2-CE2 3.83Å; V108-C151 HydrophobicContact CG1-CB 3.98Å
109	L	93.5	Very high	80.4	Confident	0 Å²	0	69.5 Å²	69.5	0%	0	32%	0.317	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-90.3	121.7	170.9	-70	177.8	0	0	0	110.2	F87 L95 A97 C151 Y152 Y154 Q183	F87-L109 HydrophobicContact CE2-CD2 3.87Å; F87-L109 HydrophobicContact CZ-CD2 4.46Å; L95-L109 HydrophobicContact CD1-CB 4.21Å; L95-L109 HydrophobicContact CD1-CD2 4.47Å; L95-L109 HydrophobicContact CD2-CD2 4.42Å; L95-L109 HydrophobicContact CG-CD2 4.42Å; A97-L109 HydrophobicContact CB-CD2 3.83Å; L109-C151 CarbonylContact O-C 3.34Å; L109-C151 WeakPolarHBondContact O-CA 3.46Å; L109-Y152 HydrophobicContact CB-CD1 4.29Å; L109-Y152 HydrophobicContact CB-CD2 4.21Å; L109-Y152 HydrophobicContact CB-CE1 4.13Å; L109-Y152 HydrophobicContact CB-CE2 4.03Å; L109-Y152 HydrophobicContact CB-CG 4.36Å; L109-Y152 WeakPolarHBondContact CB-O 3.33Å; L109-Y152 HydrophobicContact CD1-CD2 3.98Å; L109-Y152 HydrophobicContact CD1-CE2 3.36Å; L109-Y152 HydrophobicContact CG-CE2 4.34Å; L109-Y152 PolarHBondContact N-O 3.48Å; L109-Y152 PolarHBondContact O-N 2.77Å; L109-Y154 HydrophobicContact CD1-CD2 4.01Å; L109-Y154 HydrophobicContact CD2-CD2 4.03Å; L109-Y154 HydrophobicContact CG-CD2 4.14Å; L109-Q183 HydrophobicContact CD1-CG 3.82Å
110	V	93.2	Very high	78.6	Confident	1 Å²	1	75.5 Å²	75.5	1%	0.006	35%	0.351	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-101.4	109	173.7	-173.6	0	0	0	0	108.1	A66 L69 L95 L96 V108 V112 F146	A66-V110 HydrophobicContact CB-CB 4.36Å; A66-V110 HydrophobicContact CB-CG1 4.24Å; A66-V110 HydrophobicContact CB-CG2 4.04Å; L69-V110 HydrophobicContact CD1-CG1 4.06Å; L95-V110 WeakPolarHBondContact CA-O 3.24Å; L96-V110 HydrophobicContact CB-CB 4.42Å; L96-V110 PolarHBondContact N-O 3.12Å; L96-V110 PolarHBondContact O-N 3.13Å; V108-V110 HydrophobicContact CG1-CG2 4.5Å; V110-V112 HydrophobicContact CG1-CG2 4.43Å; V110-F146 HydrophobicContact CG1-CE1 4.07Å; V110-F146 HydrophobicContact CG1-CZ 3.99Å
111	R	91.6	Very high	77.2	Confident	63 Å²	63	77.7 Å²	77.7	24%	0.238	36%	0.364	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-103	117.8	175.9	179.8	175.7	173.6	-165.9	-7.4	109.2	N93 L95 E126 G149 L150 Y152	N93-R111 HydrophobicContact CB-CG 4.1Å; N93-R111 PolarHBondContact ND2-NH2 2.91Å; L95-R111 HydrophobicContact CD1-CB 3.78Å; L95-R111 HydrophobicContact CD1-CG 4.42Å; R111-E126 IonicContact NH1-OE1 4Å; R111-E126 IonicContact NH2-OE1 3.05Å; R111-G149 WeakPolarHBondContact O-CA 3.48Å; R111-L150 HydrophobicContact CB-CD1 4.12Å; R111-L150 PolarHBondContact N-O 3.02Å; R111-L150 PolarHBondContact O-N 2.94Å; R111-Y152 HydrophobicContact CB-CE1 3.88Å
112	V	89.6	Confident	76.8	Confident	1 Å²	1	75.9 Å²	75.9	1%	0.006	36%	0.358	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-99.9	128.7	173.8	-173.2	0	0	0	0	107.8	V57 Q59 I62 K94 V110 F146	V57-V112 HydrophobicContact CB-CG2 4.07Å; V57-V112 HydrophobicContact CG1-CG2 3.71Å; Q59-V112 HydrophobicContact CG-CG1 4.12Å; I62-V112 HydrophobicContact CB-CG2 4.38Å; I62-V112 HydrophobicContact CG2-CB 4.41Å; I62-V112 HydrophobicContact CG2-CG2 3.89Å; K94-V112 HydrophobicContact CB-CB 4.42Å; K94-V112 PolarHBondContact N-O 2.96Å; K94-V112 VanDerWaalsContact N-O 3.08Å; K94-V112 PolarHBondContact O-N 2.85Å; V110-V112 HydrophobicContact CG1-CG2 4.43Å; V112-F146 HydrophobicContact CG2-CE2 4.48Å; V112-F146 HydrophobicContact CG2-CZ 4.23Å
113	Y	85.8	Confident	76.7	Confident	14 Å²	14	70.7 Å²	70.7	6%	0.055	33%	0.331	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-71.8	136.2	177.5	-56.7	-49.8	0	0	0	110.2	Q59 R123 E126 N148 G149 L150	Q59-Y113 PolarHBondContact OE1-O 3Å; Y113-R123 VanDerWaalsContact CE1-NH1 3.3Å; Y113-R123 VanDerWaalsContact CZ-NH1 3.35Å; Y113-E126 WeakPolarHBondContact CE1-OE2 3.39Å; Y113-E126 VanDerWaalsContact CZ-OE2 3.25Å; Y113-E126 PolarHBondContact OH-OE2 2.94Å; Y113-N148 WeakPolarHBondContact CD2-O 3.24Å; Y113-N148 PolarHBondContact N-O 3.05Å; Y113-G149 VanDerWaalsContact CD2-CA 3.49Å; Y113-L150 VanDerWaalsContact OH-CD2 3.22Å; Y113-L150 WeakPolarHBondContact OH-CD2 3.45Å
114	G	76.3	Confident	76.7	Confident	12 Å²	12	73.6 Å²	73.6	12%	0.124	34%	0.342	C	S	.	.	P	Polyproline II helix	trans	-76.7	159.5	174	0	0	0	0	0	112.5	T92 T117	T92-G114 WeakPolarHBondContact O-CA 3.45Å; T92-G114 PolarHBondContact O-N 3.14Å; T92-G114 VanDerWaalsContact O-N 3.17Å; G114-T117 PolarHBondContact O-N 3.26Å; G114-T117 PolarHBondContact O-OG1 2.93Å
115	E	66.4	Low	76.7	Confident	133 Å²	133	72.9 Å²	72.9	62%	0.621	34%	0.34	S	S	*	.	T	Hydrogen-bonded Turn	trans	-49.4	144.5	172.7	-61.2	-172.6	165.1	0	0	111.7	Q59 T117	Q59-E115 VanDerWaalsContact OE1-N 3.14Å; E115-T117 PolarHBondContact O-N 3.02Å
116	W	60.2	Low	76.8	Confident	188 Å²	188	64.1 Å²	64.1	71%	0.712	31%	0.309	S	S	*	.	T	Hydrogen-bonded Turn	trans	71.1	-0.6	175.9	-45.2	95	0	0	0	116.7	E118 L119	W116-E118 VanDerWaalsContact C-N 3.35Å; W116-L119 HydrophobicContact CE3-CD1 3.84Å; W116-L119 HydrophobicContact CZ3-CD1 4.33Å
117	T	58.4	Low	76.7	Confident	21 Å²	21	64 Å²	64	13%	0.129	31%	0.308	C	S	.	.	G	3₁₀ helix	trans	-74.7	-22.5	176	54.1	0	0	0	0	114.3	T92 G114 E115 L119 L120 V121 R123	T92-T117 HydrophobicContact CG2-CG2 3.21Å; G114-T117 PolarHBondContact O-N 3.26Å; G114-T117 PolarHBondContact O-OG1 2.93Å; E115-T117 PolarHBondContact O-N 3.02Å; T117-L119 VanDerWaalsContact C-N 3.34Å; T117-L119 PolarHBondContact O-N 3.47Å; T117-L120 PolarHBondContact O-N 2.94Å; T117-V121 WeakPolarHBondContact O-CB 3.43Å; T117-V121 WeakPolarHBondContact O-CG2 3.43Å; T117-V121 PolarHBondContact O-N 3Å; T117-V121 VanDerWaalsContact O-N 3.16Å; T117-R123 PolarHBondContact OG1-NH2 3.13Å
118	E	56	Low	76.5	Confident	142 Å²	142	69 Å²	69	66%	0.664	33%	0.327	S	S	*	.	G	3₁₀ helix	trans	-73.2	-22	-178.9	62.5	-160.1	-171	0	0	114.2	W116 L120	W116-E118 VanDerWaalsContact C-N 3.35Å; E118-L120 PolarHBondContact O-N 3.26Å
119	L	53.8	Low	76.2	Confident	131 Å²	131	72.5 Å²	72.5	69%	0.686	35%	0.345	S	S	*	.	G	3₁₀ helix	trans	-72.7	-16.7	174.7	-65.6	174.2	0	0	0	112.7	W116 T117	W116-L119 HydrophobicContact CE3-CD1 3.84Å; W116-L119 HydrophobicContact CZ3-CD1 4.33Å; T117-L119 VanDerWaalsContact C-N 3.34Å; T117-L119 PolarHBondContact O-N 3.47Å
120	L	55.8	Low	76	Confident	159 Å²	159	73.9 Å²	73.9	83%	0.832	35%	0.351	S	S	*	.	T	Hydrogen-bonded Turn	trans	-116	-14.5	-175.5	-61.6	173.7	0	0	0	113	T117 E118	T117-L120 PolarHBondContact O-N 2.94Å; E118-L120 PolarHBondContact O-N 3.26Å
121	V	62.4	Low	75.7	Confident	60 Å²	60	76.4 Å²	76.4	36%	0.364	36%	0.363	S	S	.	.			trans	-133.6	116.9	-169.6	-174.2	0	0	0	0	111.9	T117 R123	T117-V121 WeakPolarHBondContact O-CB 3.43Å; T117-V121 WeakPolarHBondContact O-CG2 3.43Å; T117-V121 PolarHBondContact O-N 3Å; T117-V121 VanDerWaalsContact O-N 3.16Å; V121-R123 PolarHBondContact O-N 3.16Å
122	D	74.9	Confident	75.6	Confident	87 Å²	87	78.2 Å²	78.2	47%	0.465	38%	0.377	S	S	.	.			trans	-71.4	114.1	167.7	176.9	-13.8	0	0	0	110.1	E124 N125 E126 R128	D122-E124 WeakPolarHBondContact OD1-CA 2.87Å; D122-E124 WeakPolarHBondContact OD1-CB 3.27Å; D122-E124 PolarHBondContact OD1-N 3.3Å; D122-N125 HydrophobicContact CB-CB 3.86Å; D122-N125 PolarHBondContact O-N 2.83Å; D122-N125 PolarHBondContact OD1-N 2.72Å; D122-E126 PolarHBondContact O-N 3.28Å; D122-R128 IonicContact OD2-NH2 3.76Å
123	R	77.8	Confident	75.5	Confident	58 Å²	58	82.2 Å²	82.2	22%	0.219	40%	0.398	C	S	.	.	H	α-helix	trans	-66.8	-36.9	-178.2	-53.7	-55.5	-176.1	168.9	1.7	112.5	Y113 T117 V121 N125 E126 I127	Y113-R123 VanDerWaalsContact CE1-NH1 3.3Å; Y113-R123 VanDerWaalsContact CZ-NH1 3.35Å; T117-R123 PolarHBondContact OG1-NH2 3.13Å; V121-R123 PolarHBondContact O-N 3.16Å; R123-N125 VanDerWaalsContact C-N 3.34Å; R123-E126 PolarHBondContact O-N 3.21Å; R123-I127 WeakPolarHBondContact O-CD1 3.35Å; R123-I127 VanDerWaalsContact O-CG1 3.24Å; R123-I127 WeakPolarHBondContact O-CG1 3.31Å; R123-I127 PolarHBondContact O-N 3.29Å
124	E	79.9	Confident	75.5	Confident	137 Å²	137	87 Å²	87	64%	0.64	42%	0.416	S	S	*	.	H	α-helix	trans	-68.7	-40	179.1	-63.3	174	-178.9	0	0	110.1	D122 I127 R128	D122-E124 WeakPolarHBondContact OD1-CA 2.87Å; D122-E124 WeakPolarHBondContact OD1-CB 3.27Å; D122-E124 PolarHBondContact OD1-N 3.3Å; E124-I127 PolarHBondContact O-N 3.41Å; E124-R128 WeakPolarHBondContact O-CB 3.49Å; E124-R128 VanDerWaalsContact O-CG 3.3Å; E124-R128 WeakPolarHBondContact O-CG 3.22Å; E124-R128 PolarHBondContact O-N 2.87Å; E124-R128 PolarHBondContact O-NE 2.88Å
125	N	81.6	Confident	76	Confident	61 Å²	61	90.1 Å²	90.1	33%	0.326	44%	0.441	S	S	.	.	H	α-helix	trans	-66.3	-39.1	173.8	-162.7	59	0	0	0	112	D122 R123 R128 N129	D122-N125 HydrophobicContact CB-CB 3.86Å; D122-N125 PolarHBondContact O-N 2.83Å; D122-N125 PolarHBondContact OD1-N 2.72Å; R123-N125 VanDerWaalsContact C-N 3.34Å; N125-R128 PolarHBondContact O-N 3.14Å; N125-R128 PolarHBondContact OD1-NH1 3.08Å; N125-N129 PolarHBondContact ND2-ND2 2.92Å; N125-N129 VanDerWaalsContact ND2-ND2 3.18Å; N125-N129 VanDerWaalsContact O-CB 3.3Å; N125-N129 WeakPolarHBondContact O-CB 3.14Å; N125-N129 PolarHBondContact O-N 2.67Å; N125-N129 PolarHBondContact O-ND2 2.8Å
126	E	83.4	Confident	77	Confident	38 Å²	38	90.6 Å²	90.6	18%	0.178	44%	0.443	C	S	.	.	H	α-helix	trans	-58.2	-49	173.7	-173.4	178.3	-156.1	0	0	110.8	R111 Y113 D122 R123 R128 N129 F130	R111-E126 IonicContact NH1-OE1 4Å; R111-E126 IonicContact NH2-OE1 3.05Å; Y113-E126 WeakPolarHBondContact CE1-OE2 3.39Å; Y113-E126 VanDerWaalsContact CZ-OE2 3.25Å; Y113-E126 PolarHBondContact OH-OE2 2.94Å; D122-E126 PolarHBondContact O-N 3.28Å; R123-E126 PolarHBondContact O-N 3.21Å; E126-R128 PolarHBondContact O-N 2.64Å; E126-N129 PolarHBondContact O-N 3.37Å; E126-F130 VanDerWaalsContact O-CB 3.3Å; E126-F130 WeakPolarHBondContact O-CB 3Å; E126-F130 PolarHBondContact O-N 3.02Å
127	I	85.7	Confident	78.1	Confident	39 Å²	39	83.3 Å²	83.3	20%	0.2	43%	0.426	C	S	.	.	H	α-helix	trans	-62.6	-45.5	179	-64.1	158.2	0	0	0	110.8	R123 E124 N129 F130 Q131 L142 T145	R123-I127 WeakPolarHBondContact O-CD1 3.35Å; R123-I127 VanDerWaalsContact O-CG1 3.24Å; R123-I127 WeakPolarHBondContact O-CG1 3.31Å; R123-I127 PolarHBondContact O-N 3.29Å; E124-I127 PolarHBondContact O-N 3.41Å; I127-N129 PolarHBondContact O-N 3.43Å; I127-F130 WeakPolarHBondContact O-CB 3.4Å; I127-F130 PolarHBondContact O-N 2.79Å; I127-Q131 WeakPolarHBondContact O-CG 3.41Å; I127-Q131 PolarHBondContact O-N 2.67Å; I127-L142 HydrophobicContact CG2-CD2 4.16Å; I127-T145 HydrophobicContact CD1-CG2 3.62Å; I127-T145 HydrophobicContact CG1-CG2 3.77Å
128	R	86.6	Confident	79.3	Confident	104 Å²	104	85 Å²	85	39%	0.392	44%	0.438	S	S	.	.	H	α-helix	trans	-59	-47.1	177.3	-78.4	-174.5	-84	109.3	-4.4	111.6	D122 E124 N125 E126 F130 Q131 L132	D122-R128 IonicContact OD2-NH2 3.76Å; E124-R128 WeakPolarHBondContact O-CB 3.49Å; E124-R128 VanDerWaalsContact O-CG 3.3Å; E124-R128 WeakPolarHBondContact O-CG 3.22Å; E124-R128 PolarHBondContact O-N 2.87Å; E124-R128 PolarHBondContact O-NE 2.88Å; N125-R128 PolarHBondContact O-N 3.14Å; N125-R128 PolarHBondContact OD1-NH1 3.08Å; E126-R128 PolarHBondContact O-N 2.64Å; R128-F130 VanDerWaalsContact C-N 3.33Å; R128-F130 PolarHBondContact O-N 3.04Å; R128-Q131 PolarHBondContact O-N 2.86Å; R128-L132 WeakPolarHBondContact O-CB 3.17Å; R128-L132 PolarHBondContact O-N 2.99Å
129	N	87.4	Confident	80.8	Confident	74 Å²	74	78.8 Å²	78.8	40%	0.396	41%	0.41	S	S	.	.	H	α-helix	trans	-64.7	-39.9	178	-70.2	-21.8	0	0	0	111.4	N125 E126 I127 Q131 L132 L133	N125-N129 PolarHBondContact ND2-ND2 2.92Å; N125-N129 VanDerWaalsContact ND2-ND2 3.18Å; N125-N129 VanDerWaalsContact O-CB 3.3Å; N125-N129 WeakPolarHBondContact O-CB 3.14Å; N125-N129 PolarHBondContact O-N 2.67Å; N125-N129 PolarHBondContact O-ND2 2.8Å; E126-N129 PolarHBondContact O-N 3.37Å; I127-N129 PolarHBondContact O-N 3.43Å; N129-Q131 PolarHBondContact O-N 2.97Å; N129-L132 PolarHBondContact O-N 3.31Å; N129-L133 WeakPolarHBondContact O-CB 3.19Å; N129-L133 VanDerWaalsContact O-CG 3.25Å; N129-L133 WeakPolarHBondContact O-CG 3.41Å; N129-L133 PolarHBondContact O-N 3.4Å
130	F	88.7	Confident	82.5	Confident	29 Å²	29	73.1 Å²	73.1	13%	0.127	38%	0.382	C	S	.	.	H	α-helix	trans	-61.8	-45.7	178	-157.6	-77.8	0	0	0	111.5	E126 I127 R128 L133 R134 A139 P140 L142 Y152	E126-F130 VanDerWaalsContact O-CB 3.3Å; E126-F130 WeakPolarHBondContact O-CB 3Å; E126-F130 PolarHBondContact O-N 3.02Å; I127-F130 WeakPolarHBondContact O-CB 3.4Å; I127-F130 PolarHBondContact O-N 2.79Å; R128-F130 VanDerWaalsContact C-N 3.33Å; R128-F130 PolarHBondContact O-N 3.04Å; F130-L133 PolarHBondContact O-N 3.38Å; F130-R134 WeakPolarHBondContact O-CB 2.84Å; F130-R134 PolarHBondContact O-N 3.49Å; F130-A139 HydrophobicContact CD1-CB 4.36Å; F130-A139 HydrophobicContact CE1-CB 4.35Å; F130-P140 HydrophobicContact CE1-CG 4.43Å; F130-P140 WeakPolarHBondContact CE1-O 3.47Å; F130-P140 HydrophobicContact CZ-CG 3.83Å; F130-L142 HydrophobicContact CD1-CB 3.83Å; F130-L142 HydrophobicContact CD1-CD1 4.28Å; F130-L142 HydrophobicContact CD1-CD2 4.23Å; F130-L142 HydrophobicContact CD1-CG 4.35Å; F130-L142 HydrophobicContact CE1-CB 3.77Å; F130-L142 HydrophobicContact CE1-CD1 4.1Å; F130-L142 HydrophobicContact CE1-CG 4.42Å; F130-L142 HydrophobicContact CZ-CD1 4.43Å; F130-Y152 HydrophobicContact CZ-CD2 4.38Å; F130-Y152 HydrophobicContact CZ-CG 4.09Å
131	Q	87.2	Confident	84.1	Confident	53 Å²	53	70.9 Å²	70.9	25%	0.248	37%	0.365	C	S	.	.	H	α-helix	trans	-63.1	-42.5	175.8	-71.3	179.9	-31.8	0	0	112.1	A48 V50 I127 R128 N129 R134 A135	A48-Q131 PolarHBondContact O-NE2 3.4Å; A48-Q131 VanDerWaalsContact O-NE2 3.13Å; V50-Q131 HydrophobicContact CG2-CG 4.34Å; I127-Q131 WeakPolarHBondContact O-CG 3.41Å; I127-Q131 PolarHBondContact O-N 2.67Å; R128-Q131 PolarHBondContact O-N 2.86Å; N129-Q131 PolarHBondContact O-N 2.97Å; Q131-R134 WeakPolarHBondContact O-CB 3.41Å; Q131-R134 PolarHBondContact O-N 3.25Å; Q131-A135 PolarHBondContact O-N 3.48Å
132	L	88.9	Confident	85.5	Confident	102 Å²	102	69 Å²	69	53%	0.534	35%	0.353	S	S	.	.	H	α-helix	trans	-62.2	-49.1	177.1	179.9	63.2	0	0	0	111.3	R128 N129 R134 A135 H136	R128-L132 WeakPolarHBondContact O-CB 3.17Å; R128-L132 PolarHBondContact O-N 2.99Å; N129-L132 PolarHBondContact O-N 3.31Å; L132-R134 PolarHBondContact O-N 3.33Å; L132-A135 WeakPolarHBondContact O-CB 3.3Å; L132-A135 PolarHBondContact O-N 2.99Å; L132-A135 VanDerWaalsContact O-N 3.13Å; L132-H136 PolarHBondContact O-CD2 3.5Å; L132-H136 PolarHBondContact O-N 2.86Å
133	L	87.6	Confident	86.4	Confident	85 Å²	85	65.9 Å²	65.9	45%	0.445	34%	0.335	S	S	.	.	H	α-helix	trans	-60	-36.7	176.5	-70.8	169.6	0	0	0	111.2	N129 F130 H136 G137 C138 A139	N129-L133 WeakPolarHBondContact O-CB 3.19Å; N129-L133 VanDerWaalsContact O-CG 3.25Å; N129-L133 WeakPolarHBondContact O-CG 3.41Å; N129-L133 PolarHBondContact O-N 3.4Å; F130-L133 PolarHBondContact O-N 3.38Å; L133-H136 CarbonylContact O-C 3.53Å; L133-H136 PolarHBondContact O-N 3.35Å; L133-G137 PolarHBondContact O-N 2.86Å; L133-G137 VanDerWaalsContact O-N 3.16Å; L133-C138 HydrophobicContact CB-CB 4.21Å; L133-C138 HydrophobicContact CD2-CB 3.99Å; L133-C138 PolarHBondContact O-N 3.48Å; L133-A139 HydrophobicContact CB-CB 3.52Å; L133-A139 PolarHBondContact O-N 2.6Å
134	R	87	Confident	87.2	Confident	113 Å²	113	63.1 Å²	63.1	43%	0.426	32%	0.324	S	S	.	.	H	α-helix	trans	-64.2	-40.9	176.4	177.1	58.7	-177.4	110.9	-14.6	112	F130 Q131 L132 H136 G137 A139 P140	F130-R134 WeakPolarHBondContact O-CB 2.84Å; F130-R134 PolarHBondContact O-N 3.49Å; Q131-R134 WeakPolarHBondContact O-CB 3.41Å; Q131-R134 PolarHBondContact O-N 3.25Å; L132-R134 PolarHBondContact O-N 3.33Å; R134-H136 PolarHBondContact O-N 2.86Å; R134-G137 PolarHBondContact O-N 3.34Å; R134-A139 HydrophobicContact CB-CB 4.36Å; R134-A139 WeakPolarHBondContact CD-O 3.24Å; R134-P140 WeakPolarHBondContact CD-O 2.95Å
135	A	86.5	Confident	87.8	Confident	79 Å²	79	57.2 Å²	57.2	65%	0.653	30%	0.298	S	S	*	.	H	α-helix	trans	-60.8	-28.4	176.6	0	0	0	0	0	112.2	Q131 L132	Q131-A135 PolarHBondContact O-N 3.48Å; L132-A135 WeakPolarHBondContact O-CB 3.3Å; L132-A135 PolarHBondContact O-N 2.99Å; L132-A135 VanDerWaalsContact O-N 3.13Å
136	H	87.4	Confident	88.3	Confident	143 Å²	143	54.8 Å²	54.8	66%	0.662	28%	0.284	S	S	*	.	T	Hydrogen-bonded Turn	trans	-93.8	4.5	174.5	-70.8	-75.4	0	0	0	114.5	L132 L133 R134 C138	L132-H136 PolarHBondContact O-CD2 3.5Å; L132-H136 PolarHBondContact O-N 2.86Å; L133-H136 CarbonylContact O-C 3.53Å; L133-H136 PolarHBondContact O-N 3.35Å; R134-H136 PolarHBondContact O-N 2.86Å; H136-C138 VanDerWaalsContact C-N 3.28Å; H136-C138 PolarHBondContact O-N 3.48Å
137	G	83.4	Confident	88.5	Confident	34 Å²	34	59.1 Å²	59.1	35%	0.351	31%	0.305	S	S	.	.	T	Hydrogen-bonded Turn	trans	73.8	15.7	-179.5	0	0	0	0	0	114.7	L133 R134	L133-G137 PolarHBondContact O-N 2.86Å; L133-G137 VanDerWaalsContact O-N 3.16Å; R134-G137 PolarHBondContact O-N 3.34Å
138	C	83.3	Confident	88.7	Confident	58 Å²	58	58.9 Å²	58.9	39%	0.392	30%	0.304	S	S	.	.	S	Bend	trans	-99.4	-6	-177.8	-62.4	0	0	0	0	113.8	L133 H136	L133-C138 HydrophobicContact CB-CB 4.21Å; L133-C138 HydrophobicContact CD2-CB 3.99Å; L133-C138 PolarHBondContact O-N 3.48Å; H136-C138 VanDerWaalsContact C-N 3.28Å; H136-C138 PolarHBondContact O-N 3.48Å
139	A	86.6	Confident	88.9	Confident	10 Å²	10	54 Å²	54	8%	0.083	29%	0.286	C	S	.	.	S	Bend	trans	-134.9	157.3	177.8	0	0	0	0	0	111.5	F130 L133 R134	F130-A139 HydrophobicContact CD1-CB 4.36Å; F130-A139 HydrophobicContact CE1-CB 4.35Å; L133-A139 HydrophobicContact CB-CB 3.52Å; L133-A139 PolarHBondContact O-N 2.6Å; R134-A139 HydrophobicContact CB-CB 4.36Å; R134-A139 WeakPolarHBondContact CD-O 3.24Å
140	P	89.9	Confident	89.1	Confident	13 Å²	13	50.5 Å²	50.5	8%	0.084	27%	0.267	C	S	.	.	P	Polyproline II helix	trans	-68.5	168.1	176.6	2.7	6.6	0	0	0	111.4	F130 R134 L142 Y152 E153 M155	F130-P140 HydrophobicContact CE1-CG 4.43Å; F130-P140 WeakPolarHBondContact CE1-O 3.47Å; F130-P140 HydrophobicContact CZ-CG 3.83Å; R134-P140 WeakPolarHBondContact CD-O 2.95Å; P140-L142 PolarHBondContact O-N 2.94Å; P140-Y152 HydrophobicContact CB-CD2 4.16Å; P140-Y152 HydrophobicContact CG-CD2 3.67Å; P140-Y152 HydrophobicContact CG-CE2 4.27Å; P140-E153 HydrophobicContact CB-CB 3.89Å; P140-M155 HydrophobicContact CB-CE 3.77Å; P140-M155 HydrophobicContact CB-CG 3.84Å; P140-M155 HydrophobicContact CB-SD 3.88Å; P140-M155 VanDerWaalsContact CD-CE 3.44Å; P140-M155 HydrophobicContact CG-CE 3.44Å; P140-M155 VanDerWaalsContact CG-CE 3.44Å; P140-M155 HydrophobicContact CG-CG 4.26Å; P140-M155 HydrophobicContact CG-SD 4.23Å
141	K	90.4	Very high	89.4	Confident	111 Å²	111	49.1 Å²	49.1	48%	0.483	26%	0.261	S	S	.	.	P	Polyproline II helix	trans	-65.3	127.1	167.5	-174.1	176.9	178.7	-179.3	0	110.5	Y143 Y152 E153	K141-Y143 HydrophobicContact CD-CD1 4.38Å; K141-Y143 HydrophobicContact CD-CE1 3.97Å; K141-Y143 HydrophobicContact CG-CD1 4.47Å; K141-Y143 HydrophobicContact CG-CE1 4.33Å; K141-Y152 CarbonylContact O-C 3.57Å; K141-Y152 VanDerWaalsContact O-CA 3.31Å; K141-Y152 WeakPolarHBondContact O-CA 3.41Å; K141-Y152 WeakPolarHBondContact O-CB 3.25Å; K141-E153 HydrophobicContact CB-CB 4.04Å; K141-E153 VanDerWaalsContact CB-OE2 3.27Å; K141-E153 WeakPolarHBondContact CB-OE2 3.19Å; K141-E153 PolarHBondContact N-OE2 2.96Å; K141-E153 PolarHBondContact O-N 3.42Å
142	L	92.3	Very high	89.7	Confident	20 Å²	20	47.4 Å²	47.4	11%	0.105	25%	0.252	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-84	123.9	169.6	-169.7	62.9	0	0	0	108.9	V50 I127 F130 P140 T145 L150 C151	V50-L142 HydrophobicContact CB-CD2 4.37Å; V50-L142 HydrophobicContact CG1-CD2 3.88Å; V50-L142 HydrophobicContact CG1-CG 3.96Å; V50-L142 HydrophobicContact CG2-CB 4.47Å; V50-L142 HydrophobicContact CG2-CD2 3.9Å; V50-L142 HydrophobicContact CG2-CG 4.31Å; I127-L142 HydrophobicContact CG2-CD2 4.16Å; F130-L142 HydrophobicContact CD1-CB 3.83Å; F130-L142 HydrophobicContact CD1-CD1 4.28Å; F130-L142 HydrophobicContact CD1-CD2 4.23Å; F130-L142 HydrophobicContact CD1-CG 4.35Å; F130-L142 HydrophobicContact CE1-CB 3.77Å; F130-L142 HydrophobicContact CE1-CD1 4.1Å; F130-L142 HydrophobicContact CE1-CG 4.42Å; F130-L142 HydrophobicContact CZ-CD1 4.43Å; P140-L142 PolarHBondContact O-N 2.94Å; L142-T145 HydrophobicContact CD2-CG2 4.36Å; L142-L150 HydrophobicContact CD1-CB 4.07Å; L142-L150 HydrophobicContact CD1-CD1 4.34Å; L142-L150 HydrophobicContact CD1-CD2 4.34Å; L142-C151 WeakPolarHBondContact CD1-O 3.3Å
143	Y	93.3	Very high	89.8	Confident	22 Å²	22	45.3 Å²	45.3	9%	0.086	24%	0.24	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-89.1	-47.9	179.9	-63.6	-58.1	0	0	0	112.1	P51 R74 V108 K141 C151 Y152 E153	P51-Y143 WeakPolarHBondContact CD-O 3.43Å; R74-Y143 VanDerWaalsContact NH2-CE1 3.27Å; V108-Y143 HydrophobicContact CB-CD2 4.47Å; V108-Y143 HydrophobicContact CB-CE2 4.35Å; V108-Y143 HydrophobicContact CG1-CD2 3.95Å; V108-Y143 HydrophobicContact CG1-CE2 4.3Å; V108-Y143 HydrophobicContact CG2-CD2 4.08Å; V108-Y143 HydrophobicContact CG2-CE2 3.83Å; K141-Y143 HydrophobicContact CD-CD1 4.38Å; K141-Y143 HydrophobicContact CD-CE1 3.97Å; K141-Y143 HydrophobicContact CG-CD1 4.47Å; K141-Y143 HydrophobicContact CG-CE1 4.33Å; Y143-C151 PolarHBondContact N-O 3.41Å; Y143-Y152 VanDerWaalsContact CE2-C 3.44Å; Y143-E153 HydrophobicContact CE2-CB 4.12Å; Y143-E153 VanDerWaalsContact CE2-N 3.33Å
144	C	93.3	Very high	89.8	Confident	0 Å²	0	42.4 Å²	42.4	0%	0	22%	0.223	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-160.5	168.9	176.6	70	0	0	0	0	111.7	P51 F53 L73 C151	P51-C144 HydrophobicContact CB-CB 4.19Å; P51-C144 CarbonylContact O-C 3.6Å; P51-C144 WeakPolarHBondContact O-CA 3.49Å; P51-C144 VanDerWaalsContact O-CB 3.24Å; P51-C144 WeakPolarHBondContact O-CB 3.36Å; F53-C144 HydrophobicContact CD2-CB 3.69Å; F53-C144 HydrophobicContact CE2-CB 3.46Å; F53-C144 VanDerWaalsContact CE2-CB 3.46Å; L73-C144 HydrophobicContact CD2-CB 3.88Å; C144-C151 PolarHBondContact N-O 2.86Å; C144-C151 PolarHBondContact O-N 3.17Å; C144-C151 VanDerWaalsContact SG-CB 3.59Å
145	T	93.1	Very high	89.6	Confident	13 Å²	13	38.7 Å²	38.7	8%	0.08	21%	0.211	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-115	157.6	165.8	57.7	0	0	0	0	109.4	V50 P51 C52 F53 I127 L142 L150	V50-T145 HydrophobicContact CG1-CG2 4.13Å; P51-T145 PolarHBondContact O-N 3.34Å; C52-T145 CarbonylContact C-O 3.5Å; C52-T145 WeakPolarHBondContact CA-O 3.36Å; F53-T145 PolarHBondContact N-O 3.08Å; I127-T145 HydrophobicContact CD1-CG2 3.62Å; I127-T145 HydrophobicContact CG1-CG2 3.77Å; L142-T145 HydrophobicContact CD2-CG2 4.36Å; T145-L150 HydrophobicContact CG2-CB 4.3Å
146	F	92.3	Very high	89.2	Confident	10 Å²	10	43 Å²	43	4%	0.044	22%	0.217	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-143.6	175.3	173.5	59.4	-91.8	0	0	0	109.7	F53 I55 V57 L69 V110 V112 N148 G149	F53-F146 HydrophobicContact CB-CB 4.41Å; F53-F146 VanDerWaalsContact O-CA 3.26Å; F53-F146 WeakPolarHBondContact O-CA 3.44Å; I55-F146 WeakPolarHBondContact O-CB 3.44Å; V57-F146 HydrophobicContact CB-CE2 4.02Å; V57-F146 HydrophobicContact CG2-CD2 3.93Å; V57-F146 HydrophobicContact CG2-CE2 3.56Å; V57-F146 HydrophobicContact CG2-CZ 4.08Å; L69-F146 HydrophobicContact CD1-CD1 3.6Å; L69-F146 HydrophobicContact CD1-CD2 4.38Å; L69-F146 HydrophobicContact CD1-CE1 3.62Å; L69-F146 HydrophobicContact CD1-CE2 4.4Å; L69-F146 HydrophobicContact CD1-CG 4Å; L69-F146 HydrophobicContact CD1-CZ 4.03Å; L69-F146 HydrophobicContact CD2-CB 3.98Å; L69-F146 HydrophobicContact CD2-CD1 4Å; L69-F146 HydrophobicContact CD2-CG 4.12Å; L69-F146 HydrophobicContact CG-CD1 4.49Å; V110-F146 HydrophobicContact CG1-CE1 4.07Å; V110-F146 HydrophobicContact CG1-CZ 3.99Å; V112-F146 HydrophobicContact CG2-CE2 4.48Å; V112-F146 HydrophobicContact CG2-CZ 4.23Å; F146-N148 WeakPolarHBondContact CD2-OD1 3.3Å; F146-N148 VanDerWaalsContact CE2-OD1 3.31Å; F146-N148 WeakPolarHBondContact CE2-OD1 3.39Å; F146-N148 PolarHBondContact O-N 2.71Å; F146-G149 VanDerWaalsContact CE2-CA 3.41Å; F146-G149 VanDerWaalsContact CE2-N 3.32Å; F146-G149 PolarHBondContact N-O 3.35Å; F146-G149 PolarHBondContact O-N 2.92Å; F146-G149 VanDerWaalsContact O-O 3.09Å
147	Q	88.4	Confident	88.4	Confident	130 Å²	130	36.8 Å²	36.8	61%	0.607	19%	0.192	S	C	*	.	T	Hydrogen-bonded Turn	trans	-52.9	-36.4	-165.9	-68.3	-176.5	0.4	0	0	113.8	A54 I55	A54-Q147 PolarHBondContact O-NE2 3.3Å; I55-Q147 PolarHBondContact O-N 2.93Å; I55-Q147 VanDerWaalsContact O-N 3.14Å
148	N	88.9	Confident	87.7	Confident	34 Å²	34	38.6 Å²	38.6	18%	0.182	20%	0.196	C	C	.	.	T	Hydrogen-bonded Turn	trans	-130.4	33.5	-177	66.8	-35.1	0	0	0	113.5	V57 Y113 F146	V57-N148 PolarHBondContact N-OD1 3.31Å; V57-N148 PolarHBondContact O-ND2 3.33Å; Y113-N148 WeakPolarHBondContact CD2-O 3.24Å; Y113-N148 PolarHBondContact N-O 3.05Å; F146-N148 WeakPolarHBondContact CD2-OD1 3.3Å; F146-N148 VanDerWaalsContact CE2-OD1 3.31Å; F146-N148 WeakPolarHBondContact CE2-OD1 3.39Å; F146-N148 PolarHBondContact O-N 2.71Å
149	G	90.4	Very high	87	Confident	1 Å²	1	36.2 Å²	36.2	1%	0.01	18%	0.181	C	C	.	.	E	Extended strand (participates in β ladder)	trans	172.8	-168.4	178.2	0	0	0	0	0	115.5	R111 Y113 F146	R111-G149 WeakPolarHBondContact O-CA 3.48Å; Y113-G149 VanDerWaalsContact CD2-CA 3.49Å; F146-G149 VanDerWaalsContact CE2-CA 3.41Å; F146-G149 VanDerWaalsContact CE2-N 3.32Å; F146-G149 PolarHBondContact N-O 3.35Å; F146-G149 PolarHBondContact O-N 2.92Å; F146-G149 VanDerWaalsContact O-O 3.09Å
150	L	92.5	Very high	86.2	Confident	0 Å²	0	39.2 Å²	39.2	0%	0	20%	0.195	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-146.1	156.2	179.1	53.5	74.8	0	0	0	112.6	R111 Y113 L142 T145 Y152	R111-L150 HydrophobicContact CB-CD1 4.12Å; R111-L150 PolarHBondContact N-O 3.02Å; R111-L150 PolarHBondContact O-N 2.94Å; Y113-L150 VanDerWaalsContact OH-CD2 3.22Å; Y113-L150 WeakPolarHBondContact OH-CD2 3.45Å; L142-L150 HydrophobicContact CD1-CB 4.07Å; L142-L150 HydrophobicContact CD1-CD1 4.34Å; L142-L150 HydrophobicContact CD1-CD2 4.34Å; T145-L150 HydrophobicContact CG2-CB 4.3Å; L150-Y152 HydrophobicContact CD1-CD1 3.26Å; L150-Y152 HydrophobicContact CD1-CE1 3.59Å; L150-Y152 HydrophobicContact CD1-CG 4.36Å
151	C	93.9	Very high	85.3	Confident	0 Å²	0	38.9 Å²	38.9	0%	0	19%	0.194	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-116.5	127.7	176.4	-63.7	0	0	0	0	110.7	L73 V108 L109 L142 Y143 C144	L73-C151 HydrophobicContact CD1-CB 3.89Å; V108-C151 HydrophobicContact CG1-CB 3.98Å; L109-C151 CarbonylContact O-C 3.34Å; L109-C151 WeakPolarHBondContact O-CA 3.46Å; L142-C151 WeakPolarHBondContact CD1-O 3.3Å; Y143-C151 PolarHBondContact N-O 3.41Å; C144-C151 PolarHBondContact N-O 2.86Å; C144-C151 PolarHBondContact O-N 3.17Å; C144-C151 VanDerWaalsContact SG-CB 3.59Å
152	Y	93.6	Very high	84.6	Confident	18 Å²	18	38.2 Å²	38.2	7%	0.071	20%	0.201	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-141.6	165.5	-178.2	61.3	-82.1	0	0	0	112.6	L95 L109 R111 F130 P140 K141 Y143 L150 Q183	L95-Y152 HydrophobicContact CD1-CE1 4.43Å; L109-Y152 HydrophobicContact CB-CD1 4.29Å; L109-Y152 HydrophobicContact CB-CD2 4.21Å; L109-Y152 HydrophobicContact CB-CE1 4.13Å; L109-Y152 HydrophobicContact CB-CE2 4.03Å; L109-Y152 HydrophobicContact CB-CG 4.36Å; L109-Y152 WeakPolarHBondContact CB-O 3.33Å; L109-Y152 HydrophobicContact CD1-CD2 3.98Å; L109-Y152 HydrophobicContact CD1-CE2 3.36Å; L109-Y152 HydrophobicContact CG-CE2 4.34Å; L109-Y152 PolarHBondContact N-O 3.48Å; L109-Y152 PolarHBondContact O-N 2.77Å; R111-Y152 HydrophobicContact CB-CE1 3.88Å; F130-Y152 HydrophobicContact CZ-CD2 4.38Å; F130-Y152 HydrophobicContact CZ-CG 4.09Å; P140-Y152 HydrophobicContact CB-CD2 4.16Å; P140-Y152 HydrophobicContact CG-CD2 3.67Å; P140-Y152 HydrophobicContact CG-CE2 4.27Å; K141-Y152 CarbonylContact O-C 3.57Å; K141-Y152 VanDerWaalsContact O-CA 3.31Å; K141-Y152 WeakPolarHBondContact O-CA 3.41Å; K141-Y152 WeakPolarHBondContact O-CB 3.25Å; Y143-Y152 VanDerWaalsContact CE2-C 3.44Å; L150-Y152 HydrophobicContact CD1-CD1 3.26Å; L150-Y152 HydrophobicContact CD1-CE1 3.59Å; L150-Y152 HydrophobicContact CD1-CG 4.36Å; Y152-Q183 PolarHBondContact OH-OE1 3.4Å; Y152-Q183 VanDerWaalsContact OH-OE1 3.14Å
153	E	91.6	Very high	83.8	Confident	57 Å²	57	42.3 Å²	42.3	27%	0.266	22%	0.219	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-61.1	133	179.2	175.7	177.6	-153	0	0	111.8	P140 K141 Y143 M155	P140-E153 HydrophobicContact CB-CB 3.89Å; K141-E153 HydrophobicContact CB-CB 4.04Å; K141-E153 VanDerWaalsContact CB-OE2 3.27Å; K141-E153 WeakPolarHBondContact CB-OE2 3.19Å; K141-E153 PolarHBondContact N-OE2 2.96Å; K141-E153 PolarHBondContact O-N 3.42Å; Y143-E153 HydrophobicContact CE2-CB 4.12Å; Y143-E153 VanDerWaalsContact CE2-N 3.33Å; E153-M155 PolarHBondContact O-N 3.37Å
154	Y	88.1	Confident	82.8	Confident	25 Å²	25	43.8 Å²	43.8	10%	0.098	23%	0.227	C	C	.	.			trans	-68.6	123.5	166.7	177.3	-102.6	0	0	0	109.9	C107 L109 Q156 Q183 R184 W190	C107-Y154 HydrophobicContact CB-CG 4.31Å; C107-Y154 PolarHBondContact O-N 2.85Å; C107-Y154 VanDerWaalsContact O-N 3.16Å; L109-Y154 HydrophobicContact CD1-CD2 4.01Å; L109-Y154 HydrophobicContact CD2-CD2 4.03Å; L109-Y154 HydrophobicContact CG-CD2 4.14Å; Y154-Q156 HydrophobicContact CE1-CB 4.4Å; Y154-Q183 HydrophobicContact CD2-CB 4.44Å; Y154-Q183 HydrophobicContact CE2-CB 4.06Å; Y154-R184 VanDerWaalsContact OH-CG 3.27Å; Y154-R184 WeakPolarHBondContact OH-CG 3.2Å; Y154-R184 PolarHBondContact OH-NE 3.19Å; Y154-W190 HydrophobicContact CE1-CZ2 4.36Å; Y154-W190 HydrophobicContact CE2-CZ2 4.09Å; Y154-W190 AromaticContact CZ-CZ2 3.85Å
155	M	83.2	Confident	81.9	Confident	35 Å²	35	49.4 Å²	49.4	17%	0.172	26%	0.256	C	S	.	.			trans	-108	126.9	173.1	-62.7	-153.3	-76.3	0	0	110.7	P140 E153 G157 S181	P140-M155 HydrophobicContact CB-CE 3.77Å; P140-M155 HydrophobicContact CB-CG 3.84Å; P140-M155 HydrophobicContact CB-SD 3.88Å; P140-M155 VanDerWaalsContact CD-CE 3.44Å; P140-M155 HydrophobicContact CG-CE 3.44Å; P140-M155 VanDerWaalsContact CG-CE 3.44Å; P140-M155 HydrophobicContact CG-CG 4.26Å; P140-M155 HydrophobicContact CG-SD 4.23Å; E153-M155 PolarHBondContact O-N 3.37Å; M155-G157 PolarHBondContact O-N 3.44Å; M155-S181 WeakPolarHBondContact CB-OG 3.41Å; M155-S181 WeakPolarHBondContact CE-OG 3.48Å; M155-S181 PolarHBondContact SD-OG 3.18Å; M155-S181 VanDerWaalsContact SD-OG 3.38Å
156	Q	76.7	Confident	81	Confident	168 Å²	168	59.1 Å²	59.1	79%	0.785	29%	0.291	S	S	*	.			trans	-70.7	119.8	177.2	-170.5	175	18.2	0	0	109.9	Y154	Y154-Q156 HydrophobicContact CE1-CB 4.4Å
157	G	72.1	Confident	80.1	Confident	13 Å²	13	63 Å²	63	13%	0.134	31%	0.309	C	S	.	.			trans	-171.6	161.2	178.9	0	0	0	0	0	111.4	M155 R184	M155-G157 PolarHBondContact O-N 3.44Å; G157-R184 WeakPolarHBondContact O-CB 3.39Å; G157-R184 PolarHBondContact O-N 3.2Å
158	V	67.4	Low	79.2	Confident	72 Å²	72	61.5 Å²	61.5	44%	0.436	31%	0.311	S	S	.	.	P	Polyproline II helix	trans	-101.3	125.2	172.4	-176.1	0	0	0	0	108.9	R184	V158-R184 CarbonylContact C-O 3.55Å; V158-R184 WeakPolarHBondContact CA-O 3.29Å
159	A	68.2	Low	78.3	Confident	8 Å²	8	66.6 Å²	66.6	7%	0.066	33%	0.334	C	S	.	.	P	Polyproline II helix	trans	-70.7	129.5	173.9	0	0	0	0	0	109.6	G161 L182 R184 R185	A159-G161 PolarHBondContact O-N 2.76Å; A159-L182 HydrophobicContact CB-CB 4Å; A159-L182 HydrophobicContact CB-CD2 3.85Å; A159-L182 HydrophobicContact CB-CG 3.85Å; A159-R184 PolarHBondContact N-O 3.28Å; A159-R185 HydrophobicContact CB-CB 4.42Å; A159-R185 HydrophobicContact CB-CG 3.82Å
160	L	70.4	Confident	77.2	Confident	74 Å²	74	69.4 Å²	69.4	39%	0.387	35%	0.348	S	S	.	.	P	Polyproline II helix	trans	-65.9	122	178	-59	177.6	0	0	0	108.8	H164 L170	L160-H164 HydrophobicContact CB-CB 4.09Å; L160-H164 HydrophobicContact CD2-CB 4.08Å; L160-L170 HydrophobicContact CD2-CD1 4.18Å
161	G	71.6	Confident	75.6	Confident	6 Å²	6	76.1 Å²	76.1	6%	0.062	38%	0.377	C	S	.	.	P	Polyproline II helix	trans	-78.2	168	166.4	0	0	0	0	0	112.7	A159 E163 H164	A159-G161 PolarHBondContact O-N 2.76Å; G161-E163 VanDerWaalsContact CA-OE1 3.26Å; G161-E163 WeakPolarHBondContact CA-OE1 3.26Å; G161-E163 PolarHBondContact O-N 3.15Å; G161-E163 VanDerWaalsContact O-N 3.16Å; G161-H164 PolarHBondContact N-ND1 3.4Å; G161-H164 WeakPolarHBondContact O-CB 3.33Å; G161-H164 PolarHBondContact O-N 2.92Å; G161-H164 PolarHBondContact O-ND1 3.03Å
162	P	75.7	Confident	73.7	Confident	97 Å²	97	85.8 Å²	85.8	63%	0.63	41%	0.414	S	S	*	.	G	3₁₀ helix	trans	-55.1	-32.8	-177.1	-25.4	34.4	0	0	0	114.4	H164 I165	P162-H164 VanDerWaalsContact C-N 3.28Å; P162-H164 PolarHBondContact O-N 3.38Å; P162-I165 WeakPolarHBondContact O-CB 3.4Å; P162-I165 PolarHBondContact O-N 3.44Å
163	E	74.7	Confident	71.4	Confident	105 Å²	105	88.5 Å²	88.5	49%	0.491	44%	0.436	S	S	.	.	G	3₁₀ helix	trans	-60.1	-36.4	176.9	61.6	-71.4	162.7	0	0	112.8	G161 I165 R166	G161-E163 VanDerWaalsContact CA-OE1 3.26Å; G161-E163 WeakPolarHBondContact CA-OE1 3.26Å; G161-E163 PolarHBondContact O-N 3.15Å; G161-E163 VanDerWaalsContact O-N 3.16Å; E163-I165 PolarHBondContact O-N 3.28Å; E163-R166 PolarHBondContact O-N 3.38Å
164	H	71.9	Confident	69.1	Low	54 Å²	54	90.2 Å²	90.2	25%	0.25	45%	0.452	C	S	.	.	G	3₁₀ helix	trans	-69.8	-20.5	-179.2	-60	104.1	0	0	0	112.5	L160 G161 P162 R166 E167 L170	L160-H164 HydrophobicContact CB-CB 4.09Å; L160-H164 HydrophobicContact CD2-CB 4.08Å; G161-H164 PolarHBondContact N-ND1 3.4Å; G161-H164 WeakPolarHBondContact O-CB 3.33Å; G161-H164 PolarHBondContact O-N 2.92Å; G161-H164 PolarHBondContact O-ND1 3.03Å; P162-H164 VanDerWaalsContact C-N 3.28Å; P162-H164 PolarHBondContact O-N 3.38Å; H164-R166 PolarHBondContact O-N 3.16Å; H164-E167 PolarHBondContact O-N 3.24Å; H164-L170 HydrophobicContact CB-CD1 3.63Å; H164-L170 WeakPolarHBondContact O-CD1 3.3Å
165	I	75.6	Confident	67	Low	118 Å²	118	95 Å²	95	61%	0.605	49%	0.486	S	S	*	.	G	3₁₀ helix	trans	-64.8	-21.9	178.7	-57.9	173.7	0	0	0	111.2	P162 E163 F171	P162-I165 WeakPolarHBondContact O-CB 3.4Å; P162-I165 PolarHBondContact O-N 3.44Å; E163-I165 PolarHBondContact O-N 3.28Å; I165-F171 HydrophobicContact CG2-CZ 4.3Å; I165-F171 WeakPolarHBondContact O-CE2 3.35Å; I165-F171 WeakPolarHBondContact O-CZ 3.14Å
166	R	74.5	Confident	64.9	Low	217 Å²	217	104.4 Å²	104.4	82%	0.819	52%	0.519	S	S	*	.	G	3₁₀ helix	trans	-88.6	-5.5	-178.8	-62.3	-177.3	-179.7	141.6	0	113.7	E163 H164 P168	E163-R166 PolarHBondContact O-N 3.38Å; H164-R166 PolarHBondContact O-N 3.16Å; R166-P168 VanDerWaalsContact O-CD 3.29Å; R166-P168 WeakPolarHBondContact O-CD 3.48Å
167	E	73	Confident	63.3	Low	90 Å²	90	100.4 Å²	100.4	42%	0.421	51%	0.506	S	S	.	.			trans	-91.6	107.8	-176.3	-67.6	179.2	-160.6	0	0	111.4	H164 Q169 L170 F171	H164-E167 PolarHBondContact O-N 3.24Å; E167-Q169 PolarHBondContact O-N 3.2Å; E167-L170 HydrophobicContact CB-CD1 4Å; E167-L170 HydrophobicContact CB-CG 4.18Å; E167-L170 PolarHBondContact O-N 3.28Å; E167-L170 VanDerWaalsContact O-N 3.15Å; E167-F171 WeakPolarHBondContact O-CD2 3.44Å
168	P	68.6	Low	61.6	Low	99 Å²	99	103.7 Å²	103.7	64%	0.643	53%	0.525	S	S	*	.	H	α-helix	trans	-62.9	-23.6	-174.4	-21.5	33.8	0	0	0	113.7	R166 L170 F171 R172	R166-P168 VanDerWaalsContact O-CD 3.29Å; R166-P168 WeakPolarHBondContact O-CD 3.48Å; P168-L170 VanDerWaalsContact C-N 3.29Å; P168-L170 PolarHBondContact O-N 3.07Å; P168-F171 PolarHBondContact O-N 3.07Å; P168-R172 PolarHBondContact O-N 3.17Å
169	Q	71.4	Confident	60.2	Low	142 Å²	142	103 Å²	103	66%	0.664	53%	0.527	S	S	*	.	H	α-helix	trans	-69.5	-26.4	-178.6	-58.9	-63.2	-15.2	0	0	112.5	E167 F171	E167-Q169 PolarHBondContact O-N 3.2Å; Q169-F171 VanDerWaalsContact C-N 3.35Å
170	L	65.8	Low	58.8	Low	59 Å²	59	110 Å²	110	31%	0.309	55%	0.552	S	S	.	*	H	α-helix	trans	-72.2	-30.1	177.8	-67.5	176.2	0	0	0	112.1	L160 H164 E167 P168	L160-L170 HydrophobicContact CD2-CD1 4.18Å; H164-L170 HydrophobicContact CB-CD1 3.63Å; H164-L170 WeakPolarHBondContact O-CD1 3.3Å; E167-L170 HydrophobicContact CB-CD1 4Å; E167-L170 HydrophobicContact CB-CG 4.18Å; E167-L170 PolarHBondContact O-N 3.28Å; E167-L170 VanDerWaalsContact O-N 3.15Å; P168-L170 VanDerWaalsContact C-N 3.29Å; P168-L170 PolarHBondContact O-N 3.07Å
171	F	59.3	Low	57.3	Low	141 Å²	141	107.7 Å²	107.7	62%	0.618	54%	0.542	S	S	*	.	H	α-helix	trans	-86.8	-16.1	179	-55.7	-79.5	0	0	0	113.9	I165 E167 P168 Q169	I165-F171 HydrophobicContact CG2-CZ 4.3Å; I165-F171 WeakPolarHBondContact O-CE2 3.35Å; I165-F171 WeakPolarHBondContact O-CZ 3.14Å; E167-F171 WeakPolarHBondContact O-CD2 3.44Å; P168-F171 PolarHBondContact O-N 3.07Å; Q169-F171 VanDerWaalsContact C-N 3.35Å
172	R	53.8	Low	56.1	Low	203 Å²	203	112.1 Å²	112.1	77%	0.766	56%	0.564	S	S	*	*	S	Bend	trans	-90.3	-9.7	-174.7	-164	174.5	-178.1	-178.6	1.4	113.8	P168	P168-R172 PolarHBondContact O-N 3.17Å
173	S	46.1	Very low	54.7	Low	76 Å²	76	109.9 Å²	109.9	53%	0.531	55%	0.545	S	S	.	.	S	Bend	trans	-75.1	128.5	-178.8	60.7	0	0	0	0	111.6
174	P	43.1	Very low	53.4	Low	92 Å²	92	108.3 Å²	108.3	60%	0.597	53%	0.534	S	S	*	.			trans	-63.8	152.1	174.4	24.8	-31.1	0	0	0	110.2	R176	P174-R176 PolarHBondContact O-N 3.16Å
175	P	43	Very low	51.8	Low	125 Å²	125	111.5 Å²	111.5	81%	0.812	54%	0.544	S	S	*	.	T	Hydrogen-bonded Turn	trans	-74.4	67.9	-177.5	33.3	-35	0	0	0	109.9
176	R	41	Very low	50	Low	234 Å²	234	108.6 Å²	108.6	88%	0.883	54%	0.543	S	S	*	.	T	Hydrogen-bonded Turn	trans	-108.9	-8.5	169.2	-92.2	-176.2	158.5	-176.7	-5.2	112.2	P174	P174-R176 PolarHBondContact O-N 3.16Å
177	V	41.4	Very low	48.2	Very low	83 Å²	83	104.8 Å²	104.8	50%	0.503	54%	0.544	S	S	.	.	S	Bend	trans	-92.5	128.1	165	-156	0	0	0	0	105	A179	V177-A179 PolarHBondContact O-N 3.38Å
178	P	38.1	Very low	46.8	Very low	83 Å²	83	104.5 Å²	104.5	54%	0.539	54%	0.543	S	S	.	.			trans	-48	125.4	165.9	21.3	-30.8	0	0	0	105.9	R180	P178-R180 PolarHBondContact O-N 3.49Å
179	A	36.8	Very low	45.5	Very low	58 Å²	58	103.9 Å²	103.9	48%	0.479	54%	0.537	S	S	.	.			trans	-37.6	111.8	-176.4	0	0	0	0	0	107.3	V177 S181	V177-A179 PolarHBondContact O-N 3.38Å; A179-S181 VanDerWaalsContact O-CA 3.3Å; A179-S181 WeakPolarHBondContact O-CA 3.35Å; A179-S181 PolarHBondContact O-N 2.88Å
180	R	38.4	Very low	44.2	Very low	155 Å²	155	99.8 Å²	99.8	59%	0.585	52%	0.516	S	S	*	.			trans	-51.1	97.7	-171.6	-82.4	-178.8	173	-139.6	0.9	107	P178 L182	P178-R180 PolarHBondContact O-N 3.49Å; R180-L182 PolarHBondContact O-N 3.33Å; R180-L182 VanDerWaalsContact O-N 3.08Å
181	S	38.7	Very low	42.5	Very low	24 Å²	24	108.2 Å²	108.2	17%	0.168	55%	0.554	C	S	.	*			trans	-76.4	114.3	-164.9	19.5	0	0	0	0	106.8	M155 A179 Q183	M155-S181 WeakPolarHBondContact CB-OG 3.41Å; M155-S181 WeakPolarHBondContact CE-OG 3.48Å; M155-S181 PolarHBondContact SD-OG 3.18Å; M155-S181 VanDerWaalsContact SD-OG 3.38Å; A179-S181 VanDerWaalsContact O-CA 3.3Å; A179-S181 WeakPolarHBondContact O-CA 3.35Å; A179-S181 PolarHBondContact O-N 2.88Å; S181-Q183 PolarHBondContact O-N 2.86Å
182	L	46.6	Very low	41.7	Very low	100 Å²	100	106.6 Å²	106.6	52%	0.524	55%	0.551	S	S	.	*			trans	-60.9	92.7	-176.4	-80.8	90.4	0	0	0	109.8	A159 R180	A159-L182 HydrophobicContact CB-CB 4Å; A159-L182 HydrophobicContact CB-CD2 3.85Å; A159-L182 HydrophobicContact CB-CG 3.85Å; R180-L182 PolarHBondContact O-N 3.33Å; R180-L182 VanDerWaalsContact O-N 3.08Å
183	Q	47.9	Very low	41	Very low	50 Å²	50	101.5 Å²	101.5	23%	0.234	54%	0.539	C	S	.	.			trans	-147.3	27	163.5	-128.5	87.4	55.4	0	0	114.6	L95 L109 Y152 Y154 S181	L95-Q183 HydrophobicContact CD2-CG 3.96Å; L109-Q183 HydrophobicContact CD1-CG 3.82Å; Y152-Q183 PolarHBondContact OH-OE1 3.4Å; Y152-Q183 VanDerWaalsContact OH-OE1 3.14Å; Y154-Q183 HydrophobicContact CD2-CB 4.44Å; Y154-Q183 HydrophobicContact CE2-CB 4.06Å; S181-Q183 PolarHBondContact O-N 2.86Å
184	R	46.5	Very low	40.8	Very low	71 Å²	71	102.9 Å²	102.9	27%	0.268	54%	0.54	S	S	.	.			trans	-143.2	114.3	153.7	-62.9	174.9	150.2	-101.5	20.6	110.3	Y154 G157 V158 A159 E188	Y154-R184 VanDerWaalsContact OH-CG 3.27Å; Y154-R184 WeakPolarHBondContact OH-CG 3.2Å; Y154-R184 PolarHBondContact OH-NE 3.19Å; G157-R184 WeakPolarHBondContact O-CB 3.39Å; G157-R184 PolarHBondContact O-N 3.2Å; V158-R184 CarbonylContact C-O 3.55Å; V158-R184 WeakPolarHBondContact CA-O 3.29Å; A159-R184 PolarHBondContact N-O 3.28Å; R184-E188 PolarHBondContact NH1-O 2.97Å
185	R	39.4	Very low	40.6	Very low	122 Å²	122	103.6 Å²	103.6	46%	0.46	54%	0.536	S	S	.	.			trans	-78	140.7	159	-114.8	179.9	-72.3	-115.9	8.1	108.1	A159 T187	A159-R185 HydrophobicContact CB-CB 4.42Å; A159-R185 HydrophobicContact CB-CG 3.82Å; R185-T187 PolarHBondContact O-N 3.39Å
186	G	36.6	Very low	40.5	Very low	57 Å²	57	102.3 Å²	102.3	59%	0.588	52%	0.519	S	S	*	.	T	Hydrogen-bonded Turn	trans	-63	104.3	-174.1	0	0	0	0	0	111.4
187	T	36.8	Very low	40.4	Very low	136 Å²	136	93.5 Å²	93.5	83%	0.834	50%	0.495	S	S	*	.	T	Hydrogen-bonded Turn	trans	164.4	-14.6	147.8	46.4	0	0	0	0	111.7	R185 T189	R185-T187 PolarHBondContact O-N 3.39Å; T187-T189 PolarHBondContact O-N 3.23Å; T187-T189 VanDerWaalsContact O-N 3.09Å
188	E	44.2	Very low	40.4	Very low	84 Å²	84	94.2 Å²	94.2	39%	0.393	49%	0.494	S	S	.	.			trans	-81.2	97.9	-179.4	-65.5	-174	139.3	0	0	111.8	R184	R184-E188 PolarHBondContact NH1-O 2.97Å
189	T	40	Very low	40.5	Very low	86 Å²	86	95.1 Å²	95.1	53%	0.528	49%	0.491	S	S	.	.			trans	-57.7	146.7	161.2	36	0	0	0	0	109.9	K85 T187 E191	K85-T189 PolarHBondContact NZ-O 2.97Å; K85-T189 VanDerWaalsContact NZ-O 3.08Å; T187-T189 PolarHBondContact O-N 3.23Å; T187-T189 VanDerWaalsContact O-N 3.09Å; T189-E191 PolarHBondContact O-N 3.23Å; T189-E191 VanDerWaalsContact O-N 3.16Å; T189-E191 PolarHBondContact OG1-OE2 3.23Å
190	W	43.8	Very low	40.9	Very low	57 Å²	57	98.2 Å²	98.2	22%	0.216	49%	0.492	C	S	.	.			trans	-79.8	83.9	162.1	-62.8	100.7	0	0	0	105	K85 F87 A97 Y99 M104 Y154	K85-W190 HydrophobicContact CB-CE3 4.29Å; K85-W190 HydrophobicContact CB-CH2 4.45Å; K85-W190 HydrophobicContact CB-CZ3 3.63Å; K85-W190 HydrophobicContact CD-CD2 4.17Å; K85-W190 HydrophobicContact CD-CE3 3.42Å; K85-W190 VanDerWaalsContact CD-CE3 3.42Å; K85-W190 HydrophobicContact CD-CH2 4.02Å; K85-W190 HydrophobicContact CD-CZ3 3.34Å; K85-W190 HydrophobicContact CG-CE3 4.47Å; K85-W190 HydrophobicContact CG-CZ3 4.08Å; F87-W190 HydrophobicContact CZ-CH2 4.35Å; A97-W190 HydrophobicContact CB-CH2 4.03Å; A97-W190 HydrophobicContact CB-CZ3 4.41Å; Y99-W190 HydrophobicContact CD1-CZ3 4.02Å; Y99-W190 AromaticContact CE1-CE3 3.94Å; Y99-W190 HydrophobicContact CE1-CE3 3.94Å; Y99-W190 HydrophobicContact CE1-CH2 4.37Å; Y99-W190 AromaticContact CE1-CZ3 3.43Å; Y99-W190 HydrophobicContact CE1-CZ3 3.43Å; Y99-W190 VanDerWaalsContact CE1-CZ3 3.43Å; Y99-W190 AromaticContact CZ-CE3 3.83Å; Y99-W190 AromaticContact CZ-CZ3 3.82Å; M104-W190 HydrophobicContact CE-CD2 3.68Å; M104-W190 HydrophobicContact CE-CE3 4.18Å; M104-W190 HydrophobicContact CE-CG 3.9Å; M104-W190 HydrophobicContact CE-CH2 4.48Å; M104-W190 HydrophobicContact CE-CZ2 4Å; Y154-W190 HydrophobicContact CE1-CZ2 4.36Å; Y154-W190 HydrophobicContact CE2-CZ2 4.09Å; Y154-W190 AromaticContact CZ-CZ2 3.85Å
191	E	31.5	Very low	41.1	Very low	236 Å²	236	93 Å²	93	100%	1.103	48%	0.483	S	S	*	.			trans	-107.3	0	166.9	-78.3	174.5	124	0	0	108.9	T189	T189-E191 PolarHBondContact O-N 3.23Å; T189-E191 VanDerWaalsContact O-N 3.16Å; T189-E191 PolarHBondContact OG1-OE2 3.23Å

Retrieved 191 of 191 residues in 190.7 ms (Link to these results)

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