A0A096LZ94_POEFO Loading...

NADH dehydrogenase [ubiquinone] 1 beta subcomplex subunit 8, mitochondrial

AlphaFold DB , UniProt , Accession A0A096LZ94, Species POEFO (Poecilia formosa, Amazon molly), Gene n/a, Length 202 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	39.5	Very low	41.8	Very low	247 Å²	247	178 Å²	178	100%	1.217	88%	0.879	S	S	*	*				0	131.7	0	-93.3	164.3	161.3	0	0	108.4
2	R	42.6	Very low	42	Very low	234 Å²	234	172 Å²	172	88%	0.883	86%	0.863	S	S	*	*			trans	-56.1	152.6	172.8	-77	173.2	175.2	166.8	-1.4	110.7
3	T	39.6	Very low	42.7	Very low	126 Å²	126	169.9 Å²	169.9	77%	0.773	86%	0.864	S	S	*	*				169.9	116	106.4	41.1	0	0	0	0	109.8
4	S	39.4	Very low	42.9	Very low	112 Å²	112	167.9 Å²	167.9	78%	0.783	86%	0.857	S	S	*	*				89.7	114.4	109.7	69.7	0	0	0	0	114.9
5	H	46.3	Very low	43.7	Very low	193 Å²	193	169.6 Å²	169.6	89%	0.894	86%	0.863	S	S	*	*			trans	-61.2	143.2	176.2	-73.4	-84.9	0	0	0	113.4
6	S	41.3	Very low	44.3	Very low	117 Å²	117	164.5 Å²	164.5	82%	0.818	86%	0.855	S	S	*	*			trans	-131.3	112.9	159.9	175.9	0	0	0	0	108.4
7	V	48.8	Very low	44.7	Very low	129 Å²	129	158 Å²	158	78%	0.782	84%	0.837	S	S	*	*			trans	-89	117.4	174.4	172.6	0	0	0	0	107.4
8	R	41.5	Very low	45.2	Very low	241 Å²	241	155.1 Å²	155.1	91%	0.909	83%	0.826	S	S	*	*			trans	-99.9	112.2	172.8	-149.9	177.5	-159	-176.8	5.1	109.4
9	Q	38.3	Very low	45.6	Very low	179 Å²	179	149.8 Å²	149.8	84%	0.836	81%	0.813	S	S	*	*	P	Polyproline II helix	trans	-62.5	140	178.2	-73.1	169.8	-23.5	0	0	112.2
10	Q	41.5	Very low	45.7	Very low	193 Å²	193	151 Å²	151	90%	0.902	81%	0.81	S	S	*	*	P	Polyproline II helix	trans	-76.3	137.1	167.2	-69.5	173.5	-13.7	0	0	109.9
11	Q	41	Very low	46.1	Very low	187 Å²	187	151 Å²	151	87%	0.874	81%	0.805	S	S	*	*	P	Polyproline II helix	trans	-101	132.4	166.1	-78.9	-170.9	-16.6	0	0	110.3
12	P	44.6	Very low	46.8	Very low	106 Å²	106	148.9 Å²	148.9	69%	0.688	78%	0.783	S	S	*	*	P	Polyproline II helix	trans	-83.7	143.4	179.3	32.2	-33	0	0	0	112.5	N14	P12-N14 PolarHBondContact O-N 3.49Å
13	V	50.8	Low	47.3	Very low	145 Å²	145	143.1 Å²	143.1	88%	0.879	77%	0.77	S	S	*	*			trans	-80.9	112	174.1	-135.5	0	0	0	0	109	M15	V13-M15 PolarHBondContact O-N 3.48Å
14	N	45.8	Very low	48	Very low	141 Å²	141	140.2 Å²	140.2	75%	0.754	76%	0.758	S	S	*	*			trans	-87	106.3	178.9	-79.6	-26.7	0	0	0	111.6	P12 A16	P12-N14 PolarHBondContact O-N 3.49Å; N14-A16 PolarHBondContact O-N 3.09Å; N14-A16 VanDerWaalsContact O-N 3.09Å
15	M	54.6	Low	48.6	Very low	194 Å²	194	142.9 Å²	142.9	96%	0.956	76%	0.756	S	S	*	*	T	Hydrogen-bonded Turn	trans	-77.1	40.5	173	-90.3	-146	-76.9	0	0	114.3	V13	V13-M15 PolarHBondContact O-N 3.48Å
16	A	52.4	Low	49	Very low	88 Å²	88	137.2 Å²	137.2	73%	0.727	74%	0.742	S	S	*	*	T	Hydrogen-bonded Turn	trans	-103.7	-7.6	-175.7	0	0	0	0	0	115.1	N14	N14-A16 PolarHBondContact O-N 3.09Å; N14-A16 VanDerWaalsContact O-N 3.09Å
17	G	51.9	Low	49.6	Very low	54 Å²	54	138.4 Å²	138.4	56%	0.557	74%	0.739	S	S	*	*	S	Bend	trans	-89.4	-10.8	-169.8	0	0	0	0	0	117
18	V	52.8	Low	49.7	Very low	106 Å²	106	136.5 Å²	136.5	64%	0.642	74%	0.736	S	S	*	*	H	α-helix	trans	-92.5	-20.7	-167.9	-168.3	0	0	0	0	113
19	G	53	Low	50.2	Low	55 Å²	55	134 Å²	134	57%	0.567	73%	0.732	S	S	*	*	H	α-helix	trans	-74.1	-37.1	-178.3	0	0	0	0	0	114.3	L23	G19-L23 PolarHBondContact O-N 3.49Å
20	F	49.1	Very low	50.6	Low	172 Å²	172	128.7 Å²	128.7	75%	0.754	73%	0.725	S	S	*	*	H	α-helix	trans	-74.7	-35	-172.9	-118.5	-89.6	0	0	0	113.5	R22 L23 A24	F20-R22 VanDerWaalsContact C-N 3.32Å; F20-R22 PolarHBondContact O-N 3.45Å; F20-L23 PolarHBondContact O-N 3.17Å; F20-A24 PolarHBondContact O-N 3.43Å
21	Q	52.9	Low	51.2	Low	151 Å²	151	129.8 Å²	129.8	71%	0.706	73%	0.727	S	S	*	*	H	α-helix	trans	-69.7	-28.7	179.9	-70.2	-170.8	-16.9	0	0	112.9	K25	Q21-K25 PolarHBondContact O-N 3.41Å
22	R	54.1	Low	51.5	Low	203 Å²	203	123.8 Å²	123.8	77%	0.766	72%	0.715	S	S	*	*	H	α-helix	trans	-76.4	-35.9	176.3	-72.1	-172.6	169.4	-163.7	-2.2	112.1	F20 K25 A26	F20-R22 VanDerWaalsContact C-N 3.32Å; F20-R22 PolarHBondContact O-N 3.45Å; R22-K25 PolarHBondContact O-N 3.41Å; R22-A26 PolarHBondContact O-N 3.24Å
23	L	53.9	Low	51.8	Low	114 Å²	114	124.6 Å²	124.6	60%	0.597	72%	0.723	S	S	*	*	H	α-helix	trans	-67.6	-41.8	177	-149	94.8	0	0	0	111.9	G19 F20 K25 A26 L27	G19-L23 PolarHBondContact O-N 3.49Å; F20-L23 PolarHBondContact O-N 3.17Å; L23-K25 VanDerWaalsContact C-N 3.34Å; L23-K25 PolarHBondContact O-N 3.42Å; L23-A26 PolarHBondContact O-N 3.26Å; L23-L27 PolarHBondContact O-N 3.2Å
24	A	53.8	Low	52	Low	64 Å²	64	119.8 Å²	119.8	53%	0.529	70%	0.703	S	S	.	*	H	α-helix	trans	-64.1	-36.5	177.7	0	0	0	0	0	112.7	F20 A28	F20-A24 PolarHBondContact O-N 3.43Å; A24-A28 PolarHBondContact O-N 3.44Å
25	K	51.4	Low	51.9	Low	169 Å²	169	119.6 Å²	119.6	74%	0.735	70%	0.701	S	S	*	*	H	α-helix	trans	-72.5	-24.4	175.4	-94.5	179.4	175.3	175.6	0	113.7	Q21 R22 L23	Q21-K25 PolarHBondContact O-N 3.41Å; R22-K25 PolarHBondContact O-N 3.41Å; L23-K25 VanDerWaalsContact C-N 3.34Å; L23-K25 PolarHBondContact O-N 3.42Å
26	A	55.9	Low	51.4	Low	74 Å²	74	115.3 Å²	115.3	61%	0.612	69%	0.69	S	S	*	*	H	α-helix	trans	-76	-37	176.5	0	0	0	0	0	112.2	R22 L23	R22-A26 PolarHBondContact O-N 3.24Å; L23-A26 PolarHBondContact O-N 3.26Å
27	L	53.4	Low	51.1	Low	142 Å²	142	114.4 Å²	114.4	74%	0.743	68%	0.683	S	S	*	*	H	α-helix	trans	-71.4	-28.4	177.7	-83.1	162.3	0	0	0	113.6	L23 K29	L23-L27 PolarHBondContact O-N 3.2Å; L27-K29 VanDerWaalsContact C-N 3.34Å; L27-K29 PolarHBondContact O-N 3.44Å
28	A	51.5	Low	50.8	Low	88 Å²	88	117.9 Å²	117.9	73%	0.727	69%	0.688	S	S	*	*	T	Hydrogen-bonded Turn	trans	-80.3	-7.8	-178.4	0	0	0	0	0	114.8	A24	A24-A28 PolarHBondContact O-N 3.44Å
29	K	50.6	Low	50.5	Low	190 Å²	190	118.1 Å²	118.1	83%	0.826	69%	0.69	S	S	*	*	T	Hydrogen-bonded Turn	trans	-103.6	4	-177.2	-109	178.5	177.6	-176.3	0	114.8	L27 K31	L27-K29 VanDerWaalsContact C-N 3.34Å; L27-K29 PolarHBondContact O-N 3.44Å; K29-K31 PolarHBondContact O-N 3.08Å; K29-K31 VanDerWaalsContact O-N 3.08Å
30	G	48	Very low	50.1	Low	67 Å²	67	119.8 Å²	119.8	69%	0.691	69%	0.693	S	S	*	*			trans	-77.4	87.3	175.4	0	0	0	0	0	112.2	G32	G30-G32 PolarHBondContact O-N 2.94Å
31	K	53.6	Low	50	Low	216 Å²	216	114.4 Å²	114.4	94%	0.939	69%	0.686	S	S	*	*			trans	-75.2	74.7	170.6	-158.9	165.3	-175.2	177.2	0	109.4	K29	K29-K31 PolarHBondContact O-N 3.08Å; K29-K31 VanDerWaalsContact O-N 3.08Å
32	G	46.3	Very low	49.8	Very low	60 Å²	60	112.4 Å²	112.4	62%	0.619	69%	0.687	S	S	*	*			trans	-103.3	94.6	179.8	0	0	0	0	0	112	G30 G34	G30-G32 PolarHBondContact O-N 2.94Å; G32-G34 PolarHBondContact O-N 2.94Å
33	S	52.9	Low	49.9	Very low	123 Å²	123	113.2 Å²	113.2	86%	0.86	69%	0.69	S	S	*	*	T	Hydrogen-bonded Turn	trans	-66.9	15.7	175	-175.4	0	0	0	0	114.7
34	G	53.2	Low	49.7	Very low	45 Å²	45	111.4 Å²	111.4	46%	0.464	69%	0.692	S	S	.	*	T	Hydrogen-bonded Turn	trans	-106	-29.2	-170.1	0	0	0	0	0	115.7	G32	G32-G34 PolarHBondContact O-N 2.94Å
35	L	45.3	Very low	49.5	Very low	136 Å²	136	113.8 Å²	113.8	71%	0.712	71%	0.711	S	S	*	*	H	α-helix	trans	-89.2	-27.9	-172	-78.1	160.2	0	0	0	113.7	A37 L38 V39	L35-A37 VanDerWaalsContact C-N 3.3Å; L35-A37 PolarHBondContact O-N 3.2Å; L35-L38 PolarHBondContact O-N 3.39Å; L35-V39 WeakPolarHBondContact O-CG2 3.44Å; L35-V39 PolarHBondContact O-N 3.45Å
36	S	44.5	Very low	49.9	Very low	104 Å²	104	111 Å²	111	73%	0.727	71%	0.713	S	S	*	*	H	α-helix	trans	-67.9	-30.4	175.1	140	0	0	0	0	112.3	S40	S36-S40 PolarHBondContact O-N 3.28Å
37	A	45.6	Very low	50.1	Low	70 Å²	70	110.1 Å²	110.1	58%	0.579	71%	0.711	S	S	*	*	H	α-helix	trans	-75.3	-32.8	176.6	0	0	0	0	0	112.6	L35 S40	L35-A37 VanDerWaalsContact C-N 3.3Å; L35-A37 PolarHBondContact O-N 3.2Å; A37-S40 PolarHBondContact O-N 3.27Å
38	L	45.7	Very low	51.1	Low	126 Å²	126	106.9 Å²	106.9	66%	0.66	71%	0.705	S	S	*	*	H	α-helix	trans	-70.7	-35.9	175.5	-95.8	162.8	0	0	0	112.6	L35 S40 G41	L35-L38 PolarHBondContact O-N 3.39Å; L38-S40 VanDerWaalsContact C-N 3.35Å; L38-G41 PolarHBondContact O-N 3.26Å
39	V	45	Very low	52.7	Low	112 Å²	112	106.8 Å²	106.8	68%	0.679	70%	0.696	S	S	*	*	H	α-helix	trans	-73.5	-28.1	175.8	178.1	0	0	0	0	111.8	L35 G41	L35-V39 WeakPolarHBondContact O-CG2 3.44Å; L35-V39 PolarHBondContact O-N 3.45Å; V39-G41 PolarHBondContact O-N 3.47Å
40	S	44.8	Very low	54.3	Low	90 Å²	90	106.6 Å²	106.6	63%	0.629	70%	0.695	S	S	*	*	T	Hydrogen-bonded Turn	trans	-71.7	-9.7	172.8	-168.5	0	0	0	0	113.7	S36 A37 L38	S36-S40 PolarHBondContact O-N 3.28Å; A37-S40 PolarHBondContact O-N 3.27Å; L38-S40 VanDerWaalsContact C-N 3.35Å
41	G	48	Very low	56	Low	58 Å²	58	110 Å²	110	60%	0.598	70%	0.697	S	S	*	*	T	Hydrogen-bonded Turn	trans	-90.2	-8.5	180	0	0	0	0	0	114.8	L38 V39 R43	L38-G41 PolarHBondContact O-N 3.26Å; V39-G41 PolarHBondContact O-N 3.47Å; G41-R43 PolarHBondContact O-N 3.07Å
42	C	48.1	Very low	57.6	Low	110 Å²	110	102.4 Å²	102.4	74%	0.743	67%	0.671	S	S	*	*			trans	-85.5	59.6	173.2	-60.5	0	0	0	0	110.2	A44	C42-A44 PolarHBondContact O-N 3.03Å
43	R	56.4	Low	59.8	Low	219 Å²	219	103.8 Å²	103.8	83%	0.826	66%	0.664	S	S	*	*			trans	-60.9	123.3	160.9	-83	-174.9	-103.5	-101.9	0.2	106.6	G41 A45	G41-R43 PolarHBondContact O-N 3.07Å; R43-A45 PolarHBondContact O-N 3.23Å
44	A	49.7	Very low	61.7	Low	77 Å²	77	101.8 Å²	101.8	64%	0.636	65%	0.648	S	S	*	*			trans	-45.1	115.3	177.3	0	0	0	0	0	110.2	C42 S46	C42-A44 PolarHBondContact O-N 3.03Å; A44-S46 PolarHBondContact O-N 2.97Å
45	A	49.5	Very low	63.6	Low	113 Å²	113	101.3 Å²	101.3	93%	0.934	64%	0.643	S	S	*	*	T	Hydrogen-bonded Turn	trans	-70.9	12.7	177.3	0	0	0	0	0	112.9	R43	R43-A45 PolarHBondContact O-N 3.23Å
46	S	59.3	Low	65.9	Low	111 Å²	111	99.1 Å²	99.1	78%	0.776	65%	0.645	S	S	*	*	T	Hydrogen-bonded Turn	trans	-99.5	11.9	178.2	64.3	0	0	0	0	113	A44	A44-S46 PolarHBondContact O-N 2.97Å
47	G	60.7	Low	68.2	Low	55 Å²	55	97.1 Å²	97.1	57%	0.567	62%	0.622	S	S	*	*	S	Bend	trans	-78.4	137.4	178.9	0	0	0	0	0	111.9	T49	G47-T49 PolarHBondContact O-N 3.3Å
48	A	74.4	Confident	70.6	Confident	74 Å²	74	94 Å²	94	61%	0.612	60%	0.596	S	S	*	*	P	Polyproline II helix	trans	-54.1	127.4	167.8	0	0	0	0	0	109.7	S52 L53	A48-S52 WeakPolarHBondContact CB-OG 3.48Å; A48-L53 HydrophobicContact CB-CD2 4.13Å
49	T	85.1	Confident	72.8	Confident	87 Å²	87	95.7 Å²	95.7	53%	0.534	60%	0.597	S	S	.	*	P	Polyproline II helix	trans	-71.3	153.7	172.4	57.5	0	0	0	0	109.2	G47 D51 S52	G47-T49 PolarHBondContact O-N 3.3Å; T49-D51 PolarHBondContact O-N 2.63Å; T49-D51 VanDerWaalsContact O-N 3.15Å; T49-S52 PolarHBondContact N-OG 3.15Å; T49-S52 WeakPolarHBondContact O-CB 3.47Å; T49-S52 PolarHBondContact O-N 3.21Å; T49-S52 PolarHBondContact O-OG 2.77Å
50	K	83.8	Confident	75.2	Confident	185 Å²	185	93.1 Å²	93.1	80%	0.804	58%	0.582	S	S	*	*	G	3₁₀ helix	trans	-55.1	-35.9	178.4	-72.4	-175.8	177.2	-178.6	0	112.1	S52 L53	K50-S52 PolarHBondContact O-N 2.92Å; K50-L53 PolarHBondContact O-N 3.37Å; K50-L53 VanDerWaalsContact O-N 3.13Å
51	D	85.2	Confident	77.6	Confident	139 Å²	139	94 Å²	94	74%	0.743	59%	0.585	S	S	*	*	G	3₁₀ helix	trans	-68.3	-18.1	179.5	-49.7	-31.8	0	0	0	113	T49 K70	T49-D51 PolarHBondContact O-N 2.63Å; T49-D51 VanDerWaalsContact O-N 3.15Å; D51-K70 WeakPolarHBondContact O-CD 3.41Å
52	S	87.3	Confident	79.8	Confident	56 Å²	56	99 Å²	99	39%	0.392	59%	0.593	S	S	.	*	G	3₁₀ helix	trans	-87.6	-11.3	175.3	70.1	0	0	0	0	113.6	A48 T49 K50	A48-S52 WeakPolarHBondContact CB-OG 3.48Å; T49-S52 PolarHBondContact N-OG 3.15Å; T49-S52 WeakPolarHBondContact O-CB 3.47Å; T49-S52 PolarHBondContact O-N 3.21Å; T49-S52 PolarHBondContact O-OG 2.77Å; K50-S52 PolarHBondContact O-N 2.92Å
53	L	91.3	Very high	82	Confident	90 Å²	90	98.2 Å²	98.2	47%	0.471	58%	0.579	S	S	.	*	S	Bend	trans	-86	155.7	-179.8	-61	174.4	0	0	0	111.1	A48 K50 K70	A48-L53 HydrophobicContact CB-CD2 4.13Å; K50-L53 PolarHBondContact O-N 3.37Å; K50-L53 VanDerWaalsContact O-N 3.13Å; L53-K70 PolarHBondContact O-NZ 3.2Å
54	P	93.1	Very high	83.8	Confident	80 Å²	80	92.5 Å²	92.5	52%	0.519	56%	0.557	S	S	.	*			trans	-57.9	145.8	171	-24.7	35.2	0	0	0	112.6	Y71 D90 Y91	P54-Y71 WeakPolarHBondContact CA-OH 3.39Å; P54-Y71 WeakPolarHBondContact CB-OH 3.39Å; P54-D90 WeakPolarHBondContact CA-OD1 3.5Å; P54-Y91 HydrophobicContact CG-CD2 4.47Å
55	G	92.7	Very high	85.9	Confident	36 Å²	36	90.6 Å²	90.6	37%	0.371	54%	0.542	S	S	.	.			trans	-132.9	-163.8	-174.5	0	0	0	0	0	113.2	G89 D90	G55-G89 CarbonylContact O-C 3.57Å; G55-G89 VanDerWaalsContact O-CA 3.25Å; G55-G89 WeakPolarHBondContact O-CA 3.46Å; G55-D90 WeakPolarHBondContact CA-OD2 3.11Å; G55-D90 PolarHBondContact N-OD1 2.76Å; G55-D90 PolarHBondContact N-OD2 3.45Å; G55-D90 PolarHBondContact O-N 2.77Å
56	A	93	Very high	88	Confident	89 Å²	89	88.1 Å²	88.1	74%	0.736	52%	0.521	S	S	*	.	S	Bend	trans	-74.9	158.5	177.2	0	0	0	0	0	111.9	D90	A56-D90 WeakPolarHBondContact O-CB 3.4Å
57	Y	94.5	Very high	89.7	Confident	63 Å²	63	83.1 Å²	83.1	25%	0.247	49%	0.487	C	S	.	.	P	Polyproline II helix	trans	-54.7	128	-179	-179.5	-94.7	0	0	0	112.6	K59 P80 Y81 D83	Y57-K59 HydrophobicContact CD1-CG 4.18Å; Y57-K59 PolarHBondContact O-N 3.24Å; Y57-P80 HydrophobicContact CD2-CB 4.03Å; Y57-P80 HydrophobicContact CD2-CG 4.29Å; Y57-P80 HydrophobicContact CE2-CB 3.67Å; Y57-P80 HydrophobicContact CE2-CG 3.51Å; Y57-Y81 WeakPolarHBondContact CD2-O 3.46Å; Y57-Y81 WeakPolarHBondContact CE2-O 2.96Å; Y57-D83 HydrophobicContact CD1-CB 3.98Å; Y57-D83 HydrophobicContact CD2-CB 4.12Å; Y57-D83 HydrophobicContact CE1-CB 4.25Å; Y57-D83 HydrophobicContact CE2-CB 4.38Å; Y57-D83 HydrophobicContact CG-CB 3.91Å
58	P	94.3	Very high	91.4	Very high	5 Å²	5	80.5 Å²	80.5	3%	0.032	46%	0.46	C	S	.	.	P	Polyproline II helix	trans	-75.5	122.5	-177.6	29.7	-32.9	0	0	0	110.8	E63 Y78 P80 D90	P58-E63 HydrophobicContact CB-CB 3.92Å; P58-Y78 HydrophobicContact CG-CE1 4.01Å; P58-P80 HydrophobicContact CG-CB 4.41Å; P58-P80 HydrophobicContact CG-CG 4.27Å; P58-D90 HydrophobicContact CG-CB 4.49Å
59	K	93.1	Very high	92.3	Very high	160 Å²	160	85.1 Å²	85.1	70%	0.696	47%	0.466	S	S	*	.			trans	-99.5	-32.2	-177.5	-65.7	-179.6	-177.6	-179.6	0	112	Y57 E63	Y57-K59 HydrophobicContact CD1-CG 4.18Å; Y57-K59 PolarHBondContact O-N 3.24Å; K59-E63 PolarHBondContact N-OE2 3.13Å
60	T	95.4	Very high	92.8	Very high	58 Å²	58	83.3 Å²	83.3	36%	0.356	45%	0.451	S	S	.	.	S	Bend	trans	-96	154	-179.4	69.2	0	0	0	0	111.9	E62 E63 R64	T60-E62 PolarHBondContact O-N 3.11Å; T60-E63 PolarHBondContact N-OE2 3.26Å; T60-E63 PolarHBondContact O-N 2.8Å; T60-E63 VanDerWaalsContact OG1-CB 3.31Å; T60-E63 WeakPolarHBondContact OG1-CB 3.41Å; T60-E63 WeakPolarHBondContact OG1-CG 3Å; T60-E63 PolarHBondContact OG1-N 3.28Å; T60-E63 VanDerWaalsContact OG1-N 3.14Å; T60-E63 PolarHBondContact OG1-OE2 3.41Å; T60-R64 WeakPolarHBondContact O-CB 3.44Å; T60-R64 PolarHBondContact O-N 3.34Å
61	P	94.7	Very high	93.3	Very high	108 Å²	108	75.6 Å²	75.6	70%	0.701	42%	0.417	S	S	*	.	H	α-helix	trans	-60.8	-31.9	174.2	-23.7	34.2	0	0	0	113.2	R64 A65	P61-R64 WeakPolarHBondContact O-CB 3.38Å; P61-R64 PolarHBondContact O-N 3.29Å; P61-A65 WeakPolarHBondContact O-CB 3.38Å; P61-A65 PolarHBondContact O-N 2.82Å
62	E	94.3	Very high	93.8	Very high	163 Å²	163	75 Å²	75	76%	0.762	41%	0.414	S	S	*	.	H	α-helix	trans	-69.9	-45.3	177.5	-63.4	-177.2	-177.2	0	0	111.5	T60 R64 A65 A66	T60-E62 PolarHBondContact O-N 3.11Å; E62-R64 VanDerWaalsContact C-N 3.27Å; E62-R64 PolarHBondContact O-N 3.5Å; E62-A65 PolarHBondContact O-N 3.45Å; E62-A66 PolarHBondContact O-N 2.96Å
63	E	93.9	Very high	94.1	Very high	95 Å²	95	74.2 Å²	74.2	44%	0.444	41%	0.405	S	S	.	.	H	α-helix	trans	-60.2	-40.1	172.4	-75.5	164.3	-167.3	0	0	111.2	P58 K59 T60 A66 A67	P58-E63 HydrophobicContact CB-CB 3.92Å; K59-E63 PolarHBondContact N-OE2 3.13Å; T60-E63 PolarHBondContact N-OE2 3.26Å; T60-E63 PolarHBondContact O-N 2.8Å; T60-E63 VanDerWaalsContact OG1-CB 3.31Å; T60-E63 WeakPolarHBondContact OG1-CB 3.41Å; T60-E63 WeakPolarHBondContact OG1-CG 3Å; T60-E63 PolarHBondContact OG1-N 3.28Å; T60-E63 VanDerWaalsContact OG1-N 3.14Å; T60-E63 PolarHBondContact OG1-OE2 3.41Å; E63-A66 PolarHBondContact O-N 3.29Å; E63-A67 WeakPolarHBondContact O-CB 3.38Å; E63-A67 PolarHBondContact O-N 3.35Å
64	R	94.1	Very high	94.3	Very high	98 Å²	98	77.3 Å²	77.3	37%	0.37	41%	0.41	S	S	.	.	H	α-helix	trans	-62	-44.3	175.4	-172.8	178.8	-66.1	-175.4	-1.9	111.7	T60 P61 E62 A66 A67 A68 Y78	T60-R64 WeakPolarHBondContact O-CB 3.44Å; T60-R64 PolarHBondContact O-N 3.34Å; P61-R64 WeakPolarHBondContact O-CB 3.38Å; P61-R64 PolarHBondContact O-N 3.29Å; E62-R64 VanDerWaalsContact C-N 3.27Å; E62-R64 PolarHBondContact O-N 3.5Å; R64-A66 VanDerWaalsContact C-N 3.35Å; R64-A67 PolarHBondContact O-N 3.18Å; R64-A68 WeakPolarHBondContact O-CB 3.41Å; R64-A68 PolarHBondContact O-N 3.22Å; R64-Y78 HydrophobicContact CG-CD1 3.52Å; R64-Y78 HydrophobicContact CG-CE1 3.78Å
65	A	95	Very high	94.4	Very high	38 Å²	38	77 Å²	77	31%	0.314	41%	0.407	S	S	.	.	H	α-helix	trans	-65.7	-38.3	177.3	0	0	0	0	0	112.1	P61 E62 K69 V75	P61-A65 WeakPolarHBondContact O-CB 3.38Å; P61-A65 PolarHBondContact O-N 2.82Å; E62-A65 PolarHBondContact O-N 3.45Å; A65-K69 WeakPolarHBondContact O-CB 3.18Å; A65-K69 PolarHBondContact O-N 3.38Å; A65-V75 HydrophobicContact CB-CG1 4.25Å; A65-V75 HydrophobicContact CB-CG2 3.98Å
66	A	94.1	Very high	94.5	Very high	61 Å²	61	82.2 Å²	82.2	50%	0.504	42%	0.422	S	S	.	.	H	α-helix	trans	-65.9	-42.1	174.1	0	0	0	0	0	112	E62 E63 R64 K69 K70	E62-A66 PolarHBondContact O-N 2.96Å; E63-A66 PolarHBondContact O-N 3.29Å; R64-A66 VanDerWaalsContact C-N 3.35Å; A66-K69 PolarHBondContact O-N 3.05Å; A66-K70 WeakPolarHBondContact O-CB 3.2Å; A66-K70 PolarHBondContact O-N 3.26Å
67	A	94.9	Very high	94.6	Very high	6 Å²	6	82.8 Å²	82.8	5%	0.05	41%	0.412	C	S	.	.	H	α-helix	trans	-65.3	-44.8	176.1	0	0	0	0	0	111.9	E63 R64 K69 K70 Y71 Y78	E63-A67 WeakPolarHBondContact O-CB 3.38Å; E63-A67 PolarHBondContact O-N 3.35Å; R64-A67 PolarHBondContact O-N 3.18Å; A67-K69 VanDerWaalsContact C-N 3.31Å; A67-K69 PolarHBondContact O-N 3.42Å; A67-K70 VanDerWaalsContact O-CB 3.32Å; A67-K70 WeakPolarHBondContact O-CB 3.32Å; A67-K70 PolarHBondContact O-N 3.05Å; A67-K70 VanDerWaalsContact O-N 3.09Å; A67-Y71 WeakPolarHBondContact O-CD2 3.48Å; A67-Y71 PolarHBondContact O-N 2.91Å; A67-Y78 HydrophobicContact CB-CE1 3.98Å; A67-Y78 HydrophobicContact CB-CE2 4.35Å
68	A	95	Very high	94.6	Very high	0 Å²	0	80 Å²	80	0%	0	40%	0.401	C	S	.	.	H	α-helix	trans	-57.3	-45.6	174.4	0	0	0	0	0	111.3	R64 K70 Y71 N72 L73 V75 Y78	R64-A68 WeakPolarHBondContact O-CB 3.41Å; R64-A68 PolarHBondContact O-N 3.22Å; A68-K70 VanDerWaalsContact C-N 3.32Å; A68-K70 PolarHBondContact O-N 2.89Å; A68-Y71 CarbonylContact O-C 3.46Å; A68-Y71 PolarHBondContact O-N 3.38Å; A68-N72 PolarHBondContact O-N 3.33Å; A68-L73 CarbonylContact C-O 3.56Å; A68-L73 PolarHBondContact O-N 3.22Å; A68-V75 HydrophobicContact CB-CB 4.49Å; A68-V75 HydrophobicContact CB-CG2 4.17Å; A68-Y78 HydrophobicContact CB-CD1 4.3Å; A68-Y78 HydrophobicContact CB-CD2 4.46Å; A68-Y78 HydrophobicContact CB-CG 3.88Å
69	K	94.3	Very high	94.7	Very high	171 Å²	171	85.6 Å²	85.6	74%	0.743	43%	0.427	S	S	*	.	H	α-helix	trans	-61.4	-38.8	175	-174.9	178	179.2	-178.7	0	112.4	A65 A66 A67 Y71 N72	A65-K69 WeakPolarHBondContact O-CB 3.18Å; A65-K69 PolarHBondContact O-N 3.38Å; A66-K69 PolarHBondContact O-N 3.05Å; A67-K69 VanDerWaalsContact C-N 3.31Å; A67-K69 PolarHBondContact O-N 3.42Å; K69-Y71 VanDerWaalsContact C-N 3.35Å; K69-N72 PolarHBondContact O-N 2.92Å
70	K	94.6	Very high	94.7	Very high	49 Å²	49	78.9 Å²	78.9	21%	0.213	40%	0.4	C	S	.	.	H	α-helix	trans	-61.4	-40.7	176.6	-178.8	178.5	70.9	178.4	0	112.3	D51 L53 A66 A67 A68 N72 D90	D51-K70 WeakPolarHBondContact O-CD 3.41Å; L53-K70 PolarHBondContact O-NZ 3.2Å; A66-K70 WeakPolarHBondContact O-CB 3.2Å; A66-K70 PolarHBondContact O-N 3.26Å; A67-K70 VanDerWaalsContact O-CB 3.32Å; A67-K70 WeakPolarHBondContact O-CB 3.32Å; A67-K70 PolarHBondContact O-N 3.05Å; A67-K70 VanDerWaalsContact O-N 3.09Å; A68-K70 VanDerWaalsContact C-N 3.32Å; A68-K70 PolarHBondContact O-N 2.89Å; K70-N72 VanDerWaalsContact C-N 3.35Å; K70-D90 VanDerWaalsContact NZ-CG 3.32Å; K70-D90 IonicContact NZ-OD1 3.96Å; K70-D90 PolarHBondContact NZ-OD1 3.09Å; K70-D90 IonicContact NZ-OD2 3.55Å; K70-D90 PolarHBondContact NZ-OD2 2.74Å
71	Y	95.1	Very high	94.7	Very high	23 Å²	23	77.1 Å²	77.1	9%	0.09	39%	0.387	C	S	.	.	T	Hydrogen-bonded Turn	trans	-91.8	12.6	-179.7	-67.4	-71.3	0	0	0	114.1	P54 A67 A68 K69 L73 Y78 D90 Y91 P92	P54-Y71 WeakPolarHBondContact CA-OH 3.39Å; P54-Y71 WeakPolarHBondContact CB-OH 3.39Å; A67-Y71 WeakPolarHBondContact O-CD2 3.48Å; A67-Y71 PolarHBondContact O-N 2.91Å; A68-Y71 CarbonylContact O-C 3.46Å; A68-Y71 PolarHBondContact O-N 3.38Å; K69-Y71 VanDerWaalsContact C-N 3.35Å; Y71-L73 PolarHBondContact O-N 3.36Å; Y71-Y78 HydrophobicContact CD2-CE2 4.03Å; Y71-Y78 HydrophobicContact CE2-CE2 4.47Å; Y71-D90 WeakPolarHBondContact CE2-O 3.35Å; Y71-D90 PolarHBondContact OH-OD1 2.83Å; Y71-Y91 HydrophobicContact CE1-CD2 4.06Å; Y71-Y91 HydrophobicContact CE1-CE2 4.19Å; Y71-P92 HydrophobicContact CD1-CG 4.16Å; Y71-P92 HydrophobicContact CD2-CG 4.37Å; Y71-P92 HydrophobicContact CG-CG 4.04Å
72	N	94.9	Very high	94.6	Very high	126 Å²	126	75 Å²	75	67%	0.674	37%	0.373	S	S	*	.	T	Hydrogen-bonded Turn	trans	57	31	-178.4	-61.9	91.8	0	0	0	113.9	A68 K69 K70	A68-N72 PolarHBondContact O-N 3.33Å; K69-N72 PolarHBondContact O-N 2.92Å; K70-N72 VanDerWaalsContact C-N 3.35Å
73	L	94.8	Very high	94.5	Very high	40 Å²	40	72 Å²	72	21%	0.209	36%	0.362	C	S	.	.			trans	-106.6	158.2	178.3	-71.1	170.4	0	0	0	111.4	A68 Y71 Y78 P92 L94 P120	A68-L73 CarbonylContact C-O 3.56Å; A68-L73 PolarHBondContact O-N 3.22Å; Y71-L73 PolarHBondContact O-N 3.36Å; L73-Y78 HydrophobicContact CD1-CD2 4.11Å; L73-P92 HydrophobicContact CD1-CB 3.61Å; L73-P92 HydrophobicContact CD1-CG 4.04Å; L73-L94 HydrophobicContact CD1-CD2 4.45Å; L73-P120 HydrophobicContact CD1-CG 4.06Å; L73-P120 HydrophobicContact CD2-CG 3.86Å; L73-P120 HydrophobicContact CG-CG 3.96Å
74	R	95.2	Very high	94.3	Very high	154 Å²	154	72.8 Å²	72.8	58%	0.581	37%	0.369	S	S	*	.			trans	-73.4	148.4	167.9	-61.1	176.3	68.2	-160.4	-6	108.7	E76 D77 Y78	R74-E76 IonicContact CZ-OE2 2.58Å; R74-E76 IonicContact NH2-OE2 3.36Å; R74-E76 PolarHBondContact NH2-OE2 2.58Å; R74-E76 PolarHBondContact O-N 3.42Å; R74-D77 HydrophobicContact CB-CB 4.4Å; R74-D77 WeakPolarHBondContact CD-OD2 3.41Å; R74-D77 PolarHBondContact O-N 2.65Å; R74-Y78 WeakPolarHBondContact O-CB 3.13Å; R74-Y78 PolarHBondContact O-N 2.8Å
75	V	94.6	Very high	94.1	Very high	75 Å²	75	71.4 Å²	71.4	46%	0.455	39%	0.386	S	S	.	.	T	Hydrogen-bonded Turn	trans	-61.4	-31.8	-180	-173.4	0	0	0	0	111.7	A65 A68	A65-V75 HydrophobicContact CB-CG1 4.25Å; A65-V75 HydrophobicContact CB-CG2 3.98Å; A68-V75 HydrophobicContact CB-CB 4.49Å; A68-V75 HydrophobicContact CB-CG2 4.17Å
76	E	94.8	Very high	93.8	Very high	145 Å²	145	75.4 Å²	75.4	68%	0.678	40%	0.398	S	S	*	.	T	Hydrogen-bonded Turn	trans	-70.3	-38.9	177.9	-65.1	162.7	-165.4	0	0	112.6	R74 Y78	R74-E76 IonicContact CZ-OE2 2.58Å; R74-E76 IonicContact NH2-OE2 3.36Å; R74-E76 PolarHBondContact NH2-OE2 2.58Å; R74-E76 PolarHBondContact O-N 3.42Å; E76-Y78 VanDerWaalsContact C-N 3.35Å
77	D	94.9	Very high	93.7	Very high	100 Å²	100	75.6 Å²	75.6	54%	0.535	41%	0.406	S	S	.	.	T	Hydrogen-bonded Turn	trans	-87	-9.7	-177.8	-59.2	-38.1	0	0	0	112.3	R74 E79	R74-D77 HydrophobicContact CB-CB 4.4Å; R74-D77 WeakPolarHBondContact CD-OD2 3.41Å; R74-D77 PolarHBondContact O-N 2.65Å; D77-E79 PolarHBondContact O-N 3.05Å
78	Y	95.9	Very high	93.6	Very high	4 Å²	4	76.9 Å²	76.9	2%	0.016	41%	0.41	C	S	.	.			trans	-82.5	104.3	179.8	175.6	-99.2	0	0	0	110.7	P58 R64 A67 A68 Y71 L73 R74 E76 P80 D90 P92	P58-Y78 HydrophobicContact CG-CE1 4.01Å; R64-Y78 HydrophobicContact CG-CD1 3.52Å; R64-Y78 HydrophobicContact CG-CE1 3.78Å; A67-Y78 HydrophobicContact CB-CE1 3.98Å; A67-Y78 HydrophobicContact CB-CE2 4.35Å; A68-Y78 HydrophobicContact CB-CD1 4.3Å; A68-Y78 HydrophobicContact CB-CD2 4.46Å; A68-Y78 HydrophobicContact CB-CG 3.88Å; Y71-Y78 HydrophobicContact CD2-CE2 4.03Å; Y71-Y78 HydrophobicContact CE2-CE2 4.47Å; L73-Y78 HydrophobicContact CD1-CD2 4.11Å; R74-Y78 WeakPolarHBondContact O-CB 3.13Å; R74-Y78 PolarHBondContact O-N 2.8Å; E76-Y78 VanDerWaalsContact C-N 3.35Å; Y78-P80 HydrophobicContact CE1-CB 4.37Å; Y78-P80 HydrophobicContact CE1-CG 4.29Å; Y78-D90 PolarHBondContact OH-O 3.3Å; Y78-P92 HydrophobicContact CD2-CB 4.01Å; Y78-P92 HydrophobicContact CE2-CB 3.99Å
79	E	94.6	Very high	93.5	Very high	124 Å²	124	77.9 Å²	77.9	58%	0.579	42%	0.421	S	S	*	.			trans	-112.6	116.6	170.8	-64.9	-173.8	174.6	0	0	109.5	D77 K93	D77-E79 PolarHBondContact O-N 3.05Å; E79-K93 WeakPolarHBondContact O-CB 3.18Å; E79-K93 PolarHBondContact O-N 3.06Å
80	P	94.3	Very high	93.6	Very high	18 Å²	18	70.4 Å²	70.4	12%	0.117	39%	0.389	C	S	.	.	B	Isolated β-bridge	trans	-76.4	159.1	170.7	31	-33.7	0	0	0	111.2	Y57 P58 Y78	Y57-P80 HydrophobicContact CD2-CB 4.03Å; Y57-P80 HydrophobicContact CD2-CG 4.29Å; Y57-P80 HydrophobicContact CE2-CB 3.67Å; Y57-P80 HydrophobicContact CE2-CG 3.51Å; P58-P80 HydrophobicContact CG-CB 4.41Å; P58-P80 HydrophobicContact CG-CG 4.27Å; Y78-P80 HydrophobicContact CE1-CB 4.37Å; Y78-P80 HydrophobicContact CE1-CG 4.29Å
81	Y	94.6	Very high	93.7	Very high	22 Å²	22	70 Å²	70	9%	0.086	39%	0.386	C	S	.	.	P	Polyproline II helix	trans	-62.4	148.7	168.3	-75.6	-87.6	0	0	0	111.4	Y57 F88 Y91 K93 W123	Y57-Y81 WeakPolarHBondContact CD2-O 3.46Å; Y57-Y81 WeakPolarHBondContact CE2-O 2.96Å; Y81-F88 HydrophobicContact CD1-CD1 4.35Å; Y81-F88 HydrophobicContact CD1-CD2 4.01Å; Y81-F88 HydrophobicContact CD1-CE1 4.34Å; Y81-F88 AromaticContact CD1-CE2 3.97Å; Y81-F88 HydrophobicContact CD1-CE2 3.97Å; Y81-F88 HydrophobicContact CD1-CG 4.2Å; Y81-F88 HydrophobicContact CD1-CZ 4.17Å; Y81-F88 HydrophobicContact CD2-CB 3.9Å; Y81-F88 AromaticContact CD2-CD1 3.99Å; Y81-F88 HydrophobicContact CD2-CD1 3.99Å; Y81-F88 HydrophobicContact CD2-CD2 4.43Å; Y81-F88 AromaticContact CD2-CG 3.88Å; Y81-F88 HydrophobicContact CD2-CG 3.88Å; Y81-F88 HydrophobicContact CE1-CE1 4.38Å; Y81-F88 HydrophobicContact CE1-CZ 4.41Å; Y81-F88 HydrophobicContact CE2-CD1 4.26Å; Y81-F88 HydrophobicContact CG-CB 3.94Å; Y81-F88 HydrophobicContact CG-CD1 4.04Å; Y81-F88 AromaticContact CG-CD2 3.74Å; Y81-F88 HydrophobicContact CG-CD2 3.74Å; Y81-F88 HydrophobicContact CG-CE1 4.49Å; Y81-F88 HydrophobicContact CG-CE2 4.19Å; Y81-F88 AromaticContact CG-CG 3.65Å; Y81-F88 HydrophobicContact CG-CG 3.65Å; Y81-Y91 HydrophobicContact CE2-CD1 4.41Å; Y81-K93 HydrophobicContact CD1-CB 4.26Å; Y81-K93 HydrophobicContact CD1-CD 4.12Å; Y81-K93 HydrophobicContact CD1-CG 4.12Å; Y81-K93 HydrophobicContact CD2-CB 3.97Å; Y81-K93 HydrophobicContact CE1-CB 4.15Å; Y81-K93 HydrophobicContact CE1-CD 4.09Å; Y81-K93 HydrophobicContact CE1-CG 3.74Å; Y81-K93 HydrophobicContact CE2-CB 3.85Å; Y81-K93 HydrophobicContact CE2-CG 4.27Å; Y81-K93 HydrophobicContact CG-CB 4.17Å; Y81-W123 HydrophobicContact CE2-CB 4.17Å; Y81-W123 WeakPolarHBondContact OH-CB 3.47Å
82	P	93.6	Very high	93.7	Very high	64 Å²	64	69 Å²	69	42%	0.416	38%	0.382	S	S	.	.	P	Polyproline II helix	trans	-59.5	140.8	177.5	25.8	-34.2	0	0	0	111.7	N84	P82-N84 PolarHBondContact O-N 3.36Å
83	D	91.4	Very high	93.8	Very high	100 Å²	100	67.4 Å²	67.4	54%	0.535	37%	0.369	S	S	.	.			trans	-78	69.3	-178.6	-167.8	14.9	0	0	0	111.7	Y57	Y57-D83 HydrophobicContact CD1-CB 3.98Å; Y57-D83 HydrophobicContact CD2-CB 4.12Å; Y57-D83 HydrophobicContact CE1-CB 4.25Å; Y57-D83 HydrophobicContact CE2-CB 4.38Å; Y57-D83 HydrophobicContact CG-CB 3.91Å
84	N	90.4	Very high	93.8	Very high	111 Å²	111	67.5 Å²	67.5	59%	0.594	37%	0.37	S	S	*	.	S	Bend	trans	-93	4.9	177.3	-65.4	-18.2	0	0	0	112.9	P82 E86	P82-N84 PolarHBondContact O-N 3.36Å; N84-E86 VanDerWaalsContact C-N 3.32Å; N84-E86 HydrophobicContact CB-CG 4Å; N84-E86 WeakPolarHBondContact CB-OE1 3.46Å; N84-E86 PolarHBondContact ND2-OE1 3.34Å
85	G	89.1	Confident	93.7	Very high	69 Å²	69	67.7 Å²	67.7	71%	0.711	38%	0.378	S	S	*	.	S	Bend	trans	75.4	15.4	-172.5	0	0	0	0	0	114.8	G87	G85-G87 PolarHBondContact O-N 2.88Å
86	E	89.7	Confident	93.7	Very high	122 Å²	122	68 Å²	68	57%	0.57	38%	0.377	S	S	*	.	S	Bend	trans	-74.3	-10.1	179.6	-67.5	175	-136.7	0	0	113.4	N84 F88	N84-E86 VanDerWaalsContact C-N 3.32Å; N84-E86 HydrophobicContact CB-CG 4Å; N84-E86 WeakPolarHBondContact CB-OE1 3.46Å; N84-E86 PolarHBondContact ND2-OE1 3.34Å; E86-F88 HydrophobicContact CB-CD2 3.78Å; E86-F88 HydrophobicContact CB-CE2 3.55Å; E86-F88 HydrophobicContact CB-CZ 4.37Å; E86-F88 HydrophobicContact CG-CE2 4.31Å; E86-F88 WeakPolarHBondContact OE2-CE2 3.33Å
87	G	91.4	Very high	93.8	Very high	65 Å²	65	67.1 Å²	67.1	67%	0.67	37%	0.367	S	S	*	.	S	Bend	trans	91.5	10.1	173.9	0	0	0	0	0	115.8	G85 G89	G85-G87 PolarHBondContact O-N 2.88Å; G87-G89 VanDerWaalsContact C-N 3.33Å; G87-G89 PolarHBondContact O-N 3.43Å
88	F	92.6	Very high	93.8	Very high	33 Å²	33	62.4 Å²	62.4	15%	0.145	34%	0.342	C	S	.	.			trans	-67.4	-30.5	175.8	-59.7	-68.2	0	0	0	113.9	Y81 E86 D90 Y91 W123	Y81-F88 HydrophobicContact CD1-CD1 4.35Å; Y81-F88 HydrophobicContact CD1-CD2 4.01Å; Y81-F88 HydrophobicContact CD1-CE1 4.34Å; Y81-F88 AromaticContact CD1-CE2 3.97Å; Y81-F88 HydrophobicContact CD1-CE2 3.97Å; Y81-F88 HydrophobicContact CD1-CG 4.2Å; Y81-F88 HydrophobicContact CD1-CZ 4.17Å; Y81-F88 HydrophobicContact CD2-CB 3.9Å; Y81-F88 AromaticContact CD2-CD1 3.99Å; Y81-F88 HydrophobicContact CD2-CD1 3.99Å; Y81-F88 HydrophobicContact CD2-CD2 4.43Å; Y81-F88 AromaticContact CD2-CG 3.88Å; Y81-F88 HydrophobicContact CD2-CG 3.88Å; Y81-F88 HydrophobicContact CE1-CE1 4.38Å; Y81-F88 HydrophobicContact CE1-CZ 4.41Å; Y81-F88 HydrophobicContact CE2-CD1 4.26Å; Y81-F88 HydrophobicContact CG-CB 3.94Å; Y81-F88 HydrophobicContact CG-CD1 4.04Å; Y81-F88 AromaticContact CG-CD2 3.74Å; Y81-F88 HydrophobicContact CG-CD2 3.74Å; Y81-F88 HydrophobicContact CG-CE1 4.49Å; Y81-F88 HydrophobicContact CG-CE2 4.19Å; Y81-F88 AromaticContact CG-CG 3.65Å; Y81-F88 HydrophobicContact CG-CG 3.65Å; E86-F88 HydrophobicContact CB-CD2 3.78Å; E86-F88 HydrophobicContact CB-CE2 3.55Å; E86-F88 HydrophobicContact CB-CZ 4.37Å; E86-F88 HydrophobicContact CG-CE2 4.31Å; E86-F88 WeakPolarHBondContact OE2-CE2 3.33Å; F88-D90 PolarHBondContact O-N 3.05Å; F88-Y91 WeakPolarHBondContact O-CB 3.19Å; F88-Y91 PolarHBondContact O-N 3.02Å; F88-W123 AromaticContact CD1-CD2 3.62Å; F88-W123 HydrophobicContact CD1-CD2 3.62Å; F88-W123 AromaticContact CD1-CE2 3.56Å; F88-W123 AromaticContact CD1-CE3 3.77Å; F88-W123 HydrophobicContact CD1-CE3 3.77Å; F88-W123 HydrophobicContact CD1-CG 4.25Å; F88-W123 AromaticContact CD1-CH2 3.78Å; F88-W123 HydrophobicContact CD1-CH2 3.78Å; F88-W123 AromaticContact CD1-CZ2 3.65Å; F88-W123 HydrophobicContact CD1-CZ2 3.65Å; F88-W123 AromaticContact CD1-CZ3 3.84Å; F88-W123 HydrophobicContact CD1-CZ3 3.84Å; F88-W123 AromaticContact CE1-CD1 3.86Å; F88-W123 AromaticContact CE1-CD2 3.75Å; F88-W123 HydrophobicContact CE1-CD2 3.75Å; F88-W123 AromaticContact CE1-CE2 3.41Å; F88-W123 VanDerWaalsContact CE1-CE2 3.41Å; F88-W123 HydrophobicContact CE1-CE3 4.37Å; F88-W123 HydrophobicContact CE1-CG 4.04Å; F88-W123 HydrophobicContact CE1-CH2 4.36Å; F88-W123 AromaticContact CE1-CZ2 3.75Å; F88-W123 HydrophobicContact CE1-CZ2 3.75Å; F88-W123 AromaticContact CE1-NE1 3.53Å
89	G	93.7	Very high	93.7	Very high	21 Å²	21	62.8 Å²	62.8	22%	0.216	34%	0.344	C	S	.	.	T	Hydrogen-bonded Turn	trans	64.7	-127.3	-179.7	0	0	0	0	0	112.6	G55 G87	G55-G89 CarbonylContact O-C 3.57Å; G55-G89 VanDerWaalsContact O-CA 3.25Å; G55-G89 WeakPolarHBondContact O-CA 3.46Å; G87-G89 VanDerWaalsContact C-N 3.33Å; G87-G89 PolarHBondContact O-N 3.43Å
90	D	95.4	Very high	93.7	Very high	13 Å²	13	59.6 Å²	59.6	7%	0.07	33%	0.329	C	S	.	.	T	Hydrogen-bonded Turn	trans	-94	11.7	177.3	66.8	14.7	0	0	0	114.8	P54 G55 A56 P58 K70 Y71 Y78 F88	P54-D90 WeakPolarHBondContact CA-OD1 3.5Å; G55-D90 WeakPolarHBondContact CA-OD2 3.11Å; G55-D90 PolarHBondContact N-OD1 2.76Å; G55-D90 PolarHBondContact N-OD2 3.45Å; G55-D90 PolarHBondContact O-N 2.77Å; A56-D90 WeakPolarHBondContact O-CB 3.4Å; P58-D90 HydrophobicContact CG-CB 4.49Å; K70-D90 VanDerWaalsContact NZ-CG 3.32Å; K70-D90 IonicContact NZ-OD1 3.96Å; K70-D90 PolarHBondContact NZ-OD1 3.09Å; K70-D90 IonicContact NZ-OD2 3.55Å; K70-D90 PolarHBondContact NZ-OD2 2.74Å; Y71-D90 WeakPolarHBondContact CE2-O 3.35Å; Y71-D90 PolarHBondContact OH-OD1 2.83Å; Y78-D90 PolarHBondContact OH-O 3.3Å; F88-D90 PolarHBondContact O-N 3.05Å
91	Y	96.1	Very high	93.8	Very high	40 Å²	40	61.9 Å²	61.9	16%	0.157	34%	0.338	C	S	.	.			trans	-65	135.6	-178.4	-157	-96	0	0	0	111.5	P54 Y71 Y81 F88 K93 M121 W123	P54-Y91 HydrophobicContact CG-CD2 4.47Å; Y71-Y91 HydrophobicContact CE1-CD2 4.06Å; Y71-Y91 HydrophobicContact CE1-CE2 4.19Å; Y81-Y91 HydrophobicContact CE2-CD1 4.41Å; F88-Y91 WeakPolarHBondContact O-CB 3.19Å; F88-Y91 PolarHBondContact O-N 3.02Å; Y91-K93 PolarHBondContact O-N 3.2Å; Y91-M121 WeakPolarHBondContact CE1-O 3.2Å; Y91-M121 VanDerWaalsContact CZ-O 3.25Å; Y91-M121 PolarHBondContact OH-O 3.21Å; Y91-W123 HydrophobicContact CD1-CB 4.32Å; Y91-W123 AromaticContact CD1-CE3 3.82Å; Y91-W123 HydrophobicContact CD1-CE3 3.82Å; Y91-W123 HydrophobicContact CE1-CB 4.24Å; Y91-W123 HydrophobicContact CE1-CE3 4.33Å; Y91-W123 AromaticContact CG-CE3 4Å; Y91-W123 HydrophobicContact CG-CE3 4Å; Y91-W123 HydrophobicContact CG-CZ3 4.39Å
92	P	96.2	Very high	93.8	Very high	2 Å²	2	64.2 Å²	64.2	1%	0.013	35%	0.346	C	S	.	.	B	Isolated β-bridge	trans	-69.1	132.5	-179.3	27.2	-33.8	0	0	0	111.4	Y71 L73 Y78 L94 P120	Y71-P92 HydrophobicContact CD1-CG 4.16Å; Y71-P92 HydrophobicContact CD2-CG 4.37Å; Y71-P92 HydrophobicContact CG-CG 4.04Å; L73-P92 HydrophobicContact CD1-CB 3.61Å; L73-P92 HydrophobicContact CD1-CG 4.04Å; Y78-P92 HydrophobicContact CD2-CB 4.01Å; Y78-P92 HydrophobicContact CE2-CB 3.99Å; P92-L94 HydrophobicContact CB-CD2 4.4Å; P92-L94 PolarHBondContact O-N 3.25Å; P92-P120 HydrophobicContact CG-CB 4.12Å
93	K	95.8	Very high	94	Very high	93 Å²	93	64.8 Å²	64.8	40%	0.404	35%	0.346	S	S	.	.			trans	-80.9	92.8	168.9	-175.8	-179.3	178.6	-173.6	0	108.9	E79 Y81 Y91	E79-K93 WeakPolarHBondContact O-CB 3.18Å; E79-K93 PolarHBondContact O-N 3.06Å; Y81-K93 HydrophobicContact CD1-CB 4.26Å; Y81-K93 HydrophobicContact CD1-CD 4.12Å; Y81-K93 HydrophobicContact CD1-CG 4.12Å; Y81-K93 HydrophobicContact CD2-CB 3.97Å; Y81-K93 HydrophobicContact CE1-CB 4.15Å; Y81-K93 HydrophobicContact CE1-CD 4.09Å; Y81-K93 HydrophobicContact CE1-CG 3.74Å; Y81-K93 HydrophobicContact CE2-CB 3.85Å; Y81-K93 HydrophobicContact CE2-CG 4.27Å; Y81-K93 HydrophobicContact CG-CB 4.17Å; Y91-K93 PolarHBondContact O-N 3.2Å
94	L	94.9	Very high	94.2	Very high	42 Å²	42	63.4 Å²	63.4	22%	0.22	34%	0.343	C	S	.	.			trans	-74.1	162.9	172.9	-60.4	-178.1	0	0	0	110.7	L73 P92 D96 P120	L73-L94 HydrophobicContact CD1-CD2 4.45Å; P92-L94 HydrophobicContact CB-CD2 4.4Å; P92-L94 PolarHBondContact O-N 3.25Å; L94-D96 PolarHBondContact O-N 3.1Å; L94-P120 HydrophobicContact CD1-CB 4.25Å; L94-P120 HydrophobicContact CD1-CG 4.2Å; L94-P120 WeakPolarHBondContact CD1-O 2.99Å; L94-P120 HydrophobicContact CD2-CG 4.15Å
95	Q	94	Very high	94.5	Very high	159 Å²	159	68.9 Å²	68.9	74%	0.743	36%	0.355	S	S	*	.			trans	-62.8	134.5	174.7	-63.3	179.9	-6.9	0	0	110.2	R97 H122	Q95-R97 HydrophobicContact CB-CG 4.12Å; Q95-R97 PolarHBondContact O-N 3.5Å; Q95-H122 PolarHBondContact O-CD2 3.32Å
96	D	95	Very high	94.9	Very high	81 Å²	81	71.3 Å²	71.3	43%	0.433	34%	0.344	S	S	.	.			trans	-70.9	69.1	178.3	-73.5	-60.8	0	0	0	111.4	L94 H122 Y128	L94-D96 PolarHBondContact O-N 3.1Å; D96-H122 IonicContact OD1-CE1 3.45Å; D96-H122 PolarHBondContact OD1-CE1 3.33Å; D96-H122 VanDerWaalsContact OD1-CE1 3.29Å; D96-H122 IonicContact OD1-NE2 3.57Å; D96-H122 PolarHBondContact OD1-NE2 3.2Å; D96-Y128 HydrophobicContact CB-CE2 4.34Å
97	R	95.5	Very high	95.2	Very high	127 Å²	127	74.6 Å²	74.6	48%	0.479	36%	0.356	S	S	.	.			trans	-121.4	132.4	-179.3	-64.1	-61.2	-167.3	166.7	-6.7	110.1	Q95 E101	Q95-R97 HydrophobicContact CB-CG 4.12Å; Q95-R97 PolarHBondContact O-N 3.5Å; R97-E101 WeakPolarHBondContact CD-OE1 3.2Å; R97-E101 WeakPolarHBondContact CD-OE2 3.48Å; R97-E101 IonicContact CZ-OE1 3.06Å; R97-E101 IonicContact CZ-OE2 3Å; R97-E101 IonicContact NE-OE2 3.54Å; R97-E101 IonicContact NH1-OE1 3.53Å; R97-E101 PolarHBondContact NH1-OE1 2.93Å; R97-E101 IonicContact NH1-OE2 4Å; R97-E101 PolarHBondContact NH1-OE2 3.44Å
98	S	94.9	Very high	95.5	Very high	1 Å²	1	73.2 Å²	73.2	1%	0.007	33%	0.331	C	S	.	.			trans	-71.3	156.7	176.7	72.6	0	0	0	0	112.2	H100 E101 V133 D134 T135	S98-H100 PolarHBondContact O-N 2.88Å; S98-H100 VanDerWaalsContact O-N 3.1Å; S98-E101 PolarHBondContact O-N 2.57Å; S98-V133 WeakPolarHBondContact CB-O 3.32Å; S98-D134 PolarHBondContact OG-OD1 2.83Å; S98-T135 WeakPolarHBondContact CB-OG1 3.32Å; S98-T135 PolarHBondContact N-OG1 2.96Å; S98-T135 PolarHBondContact OG-N 3.39Å; S98-T135 VanDerWaalsContact OG-N 3.14Å; S98-T135 PolarHBondContact OG-OG1 2.87Å; S98-T135 VanDerWaalsContact OG-OG1 3.07Å
99	Q	95.5	Very high	95.7	Very high	12 Å²	12	76.3 Å²	76.3	6%	0.056	35%	0.349	C	S	.	.	T	Hydrogen-bonded Turn	trans	-67.8	-10.5	178.3	-62.4	-62.8	78.4	0	0	113.4	E101 R102 L113 F125 Y128	Q99-E101 VanDerWaalsContact C-N 3.33Å; Q99-R102 VanDerWaalsContact OE1-NE 3.12Å; Q99-L113 PolarHBondContact NE2-O 2.82Å; Q99-F125 HydrophobicContact CG-CE2 3.9Å; Q99-Y128 WeakPolarHBondContact CG-O 3.1Å; Q99-Y128 PolarHBondContact N-O 3.35Å; Q99-Y128 VanDerWaalsContact N-O 3.13Å
100	H	94.4	Very high	95.8	Very high	56 Å²	56	78.6 Å²	78.6	26%	0.259	35%	0.354	S	S	.	.	T	Hydrogen-bonded Turn	trans	-66.7	-33.4	173.8	-69.9	95.7	0	0	0	113	S98 R102 R114 R130 D134	S98-H100 PolarHBondContact O-N 2.88Å; S98-H100 VanDerWaalsContact O-N 3.1Å; H100-R102 VanDerWaalsContact C-N 3.31Å; H100-R102 PolarHBondContact O-N 3.34Å; H100-R114 PolarHBondContact O-NH1 3.1Å; H100-R130 VanDerWaalsContact CE1-C 3.44Å; H100-R130 WeakPolarHBondContact CE1-CA 3.24Å; H100-R130 PolarHBondContact CE1-O 3.02Å; H100-R130 WeakPolarHBondContact NE2-CG 3.21Å; H100-R130 PolarHBondContact NE2-O 3Å; H100-D134 VanDerWaalsContact CB-OD1 3.24Å; H100-D134 WeakPolarHBondContact CB-OD1 3.38Å; H100-D134 IonicContact CG-OD1 3.05Å; H100-D134 IonicContact CG-OD2 3.71Å; H100-D134 IonicContact ND1-OD1 3.65Å
101	E	95.1	Very high	95.7	Very high	67 Å²	67	82.2 Å²	82.2	31%	0.313	38%	0.378	S	S	.	.	S	Bend	trans	-75.2	-20.8	-176.4	-67.2	-172.9	-140.4	0	0	113.1	R97 S98 Q99 T135	R97-E101 WeakPolarHBondContact CD-OE1 3.2Å; R97-E101 WeakPolarHBondContact CD-OE2 3.48Å; R97-E101 IonicContact CZ-OE1 3.06Å; R97-E101 IonicContact CZ-OE2 3Å; R97-E101 IonicContact NE-OE2 3.54Å; R97-E101 IonicContact NH1-OE1 3.53Å; R97-E101 PolarHBondContact NH1-OE1 2.93Å; R97-E101 IonicContact NH1-OE2 4Å; R97-E101 PolarHBondContact NH1-OE2 3.44Å; S98-E101 PolarHBondContact O-N 2.57Å; Q99-E101 VanDerWaalsContact C-N 3.33Å; E101-T135 WeakPolarHBondContact OE1-CB 3.34Å; E101-T135 PolarHBondContact OE1-OG1 2.96Å
102	R	95.6	Very high	95.5	Very high	70 Å²	70	84.7 Å²	84.7	26%	0.264	39%	0.394	S	S	.	.	S	Bend	trans	-65	144.5	177.9	-69.7	-171.1	170.6	-136.2	-3.6	111.3	Q99 H100 P104 W108 R114 E119	Q99-R102 VanDerWaalsContact OE1-NE 3.12Å; H100-R102 VanDerWaalsContact C-N 3.31Å; H100-R102 PolarHBondContact O-N 3.34Å; R102-P104 WeakPolarHBondContact O-CD 3.46Å; R102-P104 VanDerWaalsContact O-N 3.16Å; R102-W108 HydrophobicContact CB-CH2 4.46Å; R102-W108 HydrophobicContact CB-CZ2 3.92Å; R102-W108 VanDerWaalsContact NH1-CZ3 3.27Å; R102-R114 HydrophobicContact CB-CB 4.06Å; R102-R114 WeakPolarHBondContact CD-O 3.25Å; R102-R114 PolarHBondContact NH1-O 3.48Å; R102-R114 PolarHBondContact O-NH1 3.22Å; R102-E119 IonicContact CZ-OE2 3.18Å; R102-E119 IonicContact NH1-OE1 3.88Å; R102-E119 IonicContact NH1-OE2 3.62Å; R102-E119 PolarHBondContact NH1-OE2 3.11Å; R102-E119 IonicContact NH2-OE2 3.29Å; R102-E119 PolarHBondContact NH2-OE2 3.47Å
103	D	96.3	Very high	95.4	Very high	76 Å²	76	86.4 Å²	86.4	41%	0.406	40%	0.403	S	S	.	.			trans	-52.9	118.1	-177.6	-180	12.1	0	0	0	111.5	W105 Y106 W108	D103-W105 VanDerWaalsContact C-N 3.26Å; D103-W105 PolarHBondContact O-N 3.27Å; D103-W105 WeakPolarHBondContact OD1-CB 3.49Å; D103-W105 VanDerWaalsContact OD1-CD1 3.31Å; D103-W105 PolarHBondContact OD1-N 2.92Å; D103-Y106 PolarHBondContact OD2-N 2.61Å; D103-W108 PolarHBondContact O-NE1 3.44Å
104	P	95.9	Very high	95.4	Very high	72 Å²	72	83.9 Å²	83.9	47%	0.468	39%	0.391	S	S	.	.	S	Bend	trans	-71.7	-17.8	177.6	28.5	-34.9	0	0	0	113.8	R102	R102-P104 WeakPolarHBondContact O-CD 3.46Å; R102-P104 VanDerWaalsContact O-N 3.16Å
105	W	96.9	Very high	95.4	Very high	225 Å²	225	83.8 Å²	83.8	85%	0.852	39%	0.387	S	S	*	.	S	Bend	trans	-92.9	-24.5	-172.3	-54.4	112.6	0	0	0	113.5	D103	D103-W105 VanDerWaalsContact C-N 3.26Å; D103-W105 PolarHBondContact O-N 3.27Å; D103-W105 WeakPolarHBondContact OD1-CB 3.49Å; D103-W105 VanDerWaalsContact OD1-CD1 3.31Å; D103-W105 PolarHBondContact OD1-N 2.92Å
106	Y	97.6	Very high	95.5	Very high	120 Å²	120	77.2 Å²	77.2	47%	0.471	36%	0.358	S	S	.	.	S	Bend	trans	-61.8	139.3	171	179.6	-95.9	0	0	0	111.3	D103 W108 N116	D103-Y106 PolarHBondContact OD2-N 2.61Å; Y106-W108 AromaticContact CD1-CD2 3.46Å; Y106-W108 HydrophobicContact CD1-CD2 3.46Å; Y106-W108 VanDerWaalsContact CD1-CD2 3.46Å; Y106-W108 AromaticContact CD1-CE2 3.54Å; Y106-W108 AromaticContact CD1-CE3 3.74Å; Y106-W108 HydrophobicContact CD1-CE3 3.74Å; Y106-W108 AromaticContact CD1-CG 3.83Å; Y106-W108 HydrophobicContact CD1-CG 3.83Å; Y106-W108 HydrophobicContact CD1-CH2 4.16Å; Y106-W108 AromaticContact CD1-CZ2 3.9Å; Y106-W108 HydrophobicContact CD1-CZ2 3.9Å; Y106-W108 HydrophobicContact CD1-CZ3 4.08Å; Y106-W108 AromaticContact CD1-NE1 3.91Å; Y106-W108 AromaticContact CE1-CD2 3.93Å; Y106-W108 HydrophobicContact CE1-CD2 3.93Å; Y106-W108 AromaticContact CE1-CE3 3.76Å; Y106-W108 HydrophobicContact CE1-CE3 3.76Å; Y106-W108 HydrophobicContact CE1-CG 4.36Å; Y106-W108 HydrophobicContact CE1-CZ3 4.11Å; Y106-W108 HydrophobicContact CG-CZ2 4.47Å; Y106-W108 PolarHBondContact O-N 3Å; Y106-W108 VanDerWaalsContact O-N 3.11Å; Y106-W108 PolarHBondContact O-NE1 3.42Å; Y106-N116 WeakPolarHBondContact CE1-OD1 3.38Å
107	K	97.3	Very high	95.6	Very high	191 Å²	191	83.7 Å²	83.7	83%	0.83	38%	0.376	S	S	*	.			trans	-83.2	85.8	178.9	-67.5	-178.1	-179.3	178	0	110.3
108	W	97.1	Very high	95.4	Very high	36 Å²	36	79.2 Å²	79.2	14%	0.136	37%	0.369	C	S	.	.			trans	-67.9	147.2	175.7	-57.2	95.3	0	0	0	112.5	R102 D103 Y106 H110 R114 N116	R102-W108 HydrophobicContact CB-CH2 4.46Å; R102-W108 HydrophobicContact CB-CZ2 3.92Å; R102-W108 VanDerWaalsContact NH1-CZ3 3.27Å; D103-W108 PolarHBondContact O-NE1 3.44Å; Y106-W108 AromaticContact CD1-CD2 3.46Å; Y106-W108 HydrophobicContact CD1-CD2 3.46Å; Y106-W108 VanDerWaalsContact CD1-CD2 3.46Å; Y106-W108 AromaticContact CD1-CE2 3.54Å; Y106-W108 AromaticContact CD1-CE3 3.74Å; Y106-W108 HydrophobicContact CD1-CE3 3.74Å; Y106-W108 AromaticContact CD1-CG 3.83Å; Y106-W108 HydrophobicContact CD1-CG 3.83Å; Y106-W108 HydrophobicContact CD1-CH2 4.16Å; Y106-W108 AromaticContact CD1-CZ2 3.9Å; Y106-W108 HydrophobicContact CD1-CZ2 3.9Å; Y106-W108 HydrophobicContact CD1-CZ3 4.08Å; Y106-W108 AromaticContact CD1-NE1 3.91Å; Y106-W108 AromaticContact CE1-CD2 3.93Å; Y106-W108 HydrophobicContact CE1-CD2 3.93Å; Y106-W108 AromaticContact CE1-CE3 3.76Å; Y106-W108 HydrophobicContact CE1-CE3 3.76Å; Y106-W108 HydrophobicContact CE1-CG 4.36Å; Y106-W108 HydrophobicContact CE1-CZ3 4.11Å; Y106-W108 HydrophobicContact CG-CZ2 4.47Å; Y106-W108 PolarHBondContact O-N 3Å; Y106-W108 VanDerWaalsContact O-N 3.11Å; Y106-W108 PolarHBondContact O-NE1 3.42Å; W108-H110 VanDerWaalsContact C-N 3.26Å; W108-H110 PolarHBondContact O-N 2.91Å; W108-R114 HydrophobicContact CD2-CB 4.05Å; W108-R114 VanDerWaalsContact CE3-C 3.48Å; W108-R114 VanDerWaalsContact CG-CA 3.48Å; W108-R114 HydrophobicContact CG-CB 4.04Å; W108-N116 WeakPolarHBondContact CZ3-ND2 3.41Å
109	D	96.7	Very high	95.4	Very high	99 Å²	99	81.9 Å²	81.9	53%	0.529	38%	0.382	S	S	.	.	S	Bend	trans	-62.1	-36.2	172.4	-63.8	-38.3	0	0	0	112.2	P111 N116 W117	D109-P111 WeakPolarHBondContact O-CD 3.36Å; D109-N116 PolarHBondContact N-OD1 2.98Å; D109-N116 WeakPolarHBondContact OD2-CA 3.45Å; D109-W117 WeakPolarHBondContact OD2-CB 3.38Å; D109-W117 PolarHBondContact OD2-N 3.13Å
110	H	94.8	Very high	95.3	Very high	68 Å²	68	82.6 Å²	82.6	32%	0.315	39%	0.387	S	S	.	.	B	Isolated β-bridge	trans	-112.8	90.2	169.4	-62.2	-74.4	0	0	0	109.7	W108 D112 L113 R114 R115	W108-H110 VanDerWaalsContact C-N 3.26Å; W108-H110 PolarHBondContact O-N 2.91Å; H110-D112 VanDerWaalsContact C-N 3.29Å; H110-D112 PolarHBondContact O-N 3.49Å; H110-L113 HydrophobicContact CB-CB 4.22Å; H110-L113 PolarHBondContact O-N 2.82Å; H110-R114 WeakPolarHBondContact O-CA 3.31Å; H110-R114 PolarHBondContact O-N 3.35Å; H110-R115 PolarHBondContact CD2-NH2 3.5Å; H110-R115 PolarHBondContact N-O 3.14Å; H110-R115 PolarHBondContact NE2-NH2 3.22Å; H110-R115 VanDerWaalsContact NE2-NH2 3.2Å; H110-R115 PolarHBondContact O-N 2.96Å
111	P	94.6	Very high	95.4	Very high	89 Å²	89	83.2 Å²	83.2	58%	0.578	39%	0.391	S	S	*	.	T	Hydrogen-bonded Turn	trans	-65.2	-28.7	-174.7	-23.1	33.3	0	0	0	114.6	D109	D109-P111 WeakPolarHBondContact O-CD 3.36Å
112	D	92.3	Very high	95.4	Very high	92 Å²	92	80.8 Å²	80.8	49%	0.492	38%	0.38	S	S	.	.	T	Hydrogen-bonded Turn	trans	-67	-42.9	176.5	60.3	-34.2	0	0	0	111.6	H110 R130	H110-D112 VanDerWaalsContact C-N 3.29Å; H110-D112 PolarHBondContact O-N 3.49Å; D112-R130 PolarHBondContact O-NH1 3.06Å
113	L	93.5	Very high	95.4	Very high	39 Å²	39	82.8 Å²	82.8	20%	0.204	39%	0.387	C	S	.	.	T	Hydrogen-bonded Turn	trans	-92.9	-10.9	-179.1	-61.3	177.4	0	0	0	113.8	Q99 H110 R115 F125 L129	Q99-L113 PolarHBondContact NE2-O 2.82Å; H110-L113 HydrophobicContact CB-CB 4.22Å; H110-L113 PolarHBondContact O-N 2.82Å; L113-R115 HydrophobicContact CB-CB 4.36Å; L113-F125 HydrophobicContact CB-CZ 4.16Å; L113-F125 HydrophobicContact CD1-CE1 4.22Å; L113-F125 HydrophobicContact CD1-CZ 3.99Å; L113-F125 HydrophobicContact CD2-CE1 4.23Å; L113-F125 HydrophobicContact CD2-CZ 3.93Å; L113-F125 HydrophobicContact CG-CZ 4.23Å; L113-L129 HydrophobicContact CD2-CD2 4.17Å; L113-L129 HydrophobicContact CD2-CG 4.48Å
114	R	95.4	Very high	95.3	Very high	40 Å²	40	82 Å²	82	15%	0.151	38%	0.383	C	S	.	.	T	Hydrogen-bonded Turn	trans	51.8	52.8	-170.9	-61.3	-171.9	-172.4	157.3	7.7	112.8	H100 R102 W108 H110	H100-R114 PolarHBondContact O-NH1 3.1Å; R102-R114 HydrophobicContact CB-CB 4.06Å; R102-R114 WeakPolarHBondContact CD-O 3.25Å; R102-R114 PolarHBondContact NH1-O 3.48Å; R102-R114 PolarHBondContact O-NH1 3.22Å; W108-R114 HydrophobicContact CD2-CB 4.05Å; W108-R114 VanDerWaalsContact CE3-C 3.48Å; W108-R114 VanDerWaalsContact CG-CA 3.48Å; W108-R114 HydrophobicContact CG-CB 4.04Å; H110-R114 WeakPolarHBondContact O-CA 3.31Å; H110-R114 PolarHBondContact O-N 3.35Å
115	R	95.3	Very high	95.3	Very high	39 Å²	39	79.6 Å²	79.6	15%	0.147	37%	0.366	C	S	.	.	B	Isolated β-bridge	trans	-135.4	142.8	-175.1	-168.5	-175	66.3	85.6	4.3	111.3	H110 L113 E119	H110-R115 PolarHBondContact CD2-NH2 3.5Å; H110-R115 PolarHBondContact N-O 3.14Å; H110-R115 PolarHBondContact NE2-NH2 3.22Å; H110-R115 VanDerWaalsContact NE2-NH2 3.2Å; H110-R115 PolarHBondContact O-N 2.96Å; L113-R115 HydrophobicContact CB-CB 4.36Å; R115-E119 HydrophobicContact CG-CB 4.42Å
116	N	96.6	Very high	95.2	Very high	22 Å²	22	73.4 Å²	73.4	12%	0.118	35%	0.349	C	S	.	.			trans	-92.2	160.8	172.2	-60.6	-41.4	0	0	0	112.2	Y106 W108 D109 E119	Y106-N116 WeakPolarHBondContact CE1-OD1 3.38Å; W108-N116 WeakPolarHBondContact CZ3-ND2 3.41Å; D109-N116 PolarHBondContact N-OD1 2.98Å; D109-N116 WeakPolarHBondContact OD2-CA 3.45Å; N116-E119 HydrophobicContact CB-CG 3.97Å; N116-E119 WeakPolarHBondContact CB-OE1 3.41Å; N116-E119 PolarHBondContact N-OE2 2.95Å; N116-E119 PolarHBondContact ND2-OE1 3.11Å
117	W	95.4	Very high	95.1	Very high	217 Å²	217	70.9 Å²	70.9	82%	0.822	34%	0.342	S	S	*	.	T	Hydrogen-bonded Turn	trans	-68.2	137.8	171.1	-171.9	90	0	0	0	110.6	D109 E119	D109-W117 WeakPolarHBondContact OD2-CB 3.38Å; D109-W117 PolarHBondContact OD2-N 3.13Å; W117-E119 VanDerWaalsContact C-N 3.27Å; W117-E119 PolarHBondContact O-N 3.29Å
118	G	92.6	Very high	95	Very high	33 Å²	33	62.9 Å²	62.9	34%	0.34	31%	0.307	S	S	.	.	T	Hydrogen-bonded Turn	trans	80.8	-6.9	-178.2	0	0	0	0	0	115.8
119	E	94.4	Very high	94.9	Very high	57 Å²	57	63.2 Å²	63.2	27%	0.266	31%	0.311	S	S	.	.	P	Polyproline II helix	trans	-71.4	134.7	170.7	-72.5	179.3	-178.9	0	0	110.9	R102 R115 N116 W117	R102-E119 IonicContact CZ-OE2 3.18Å; R102-E119 IonicContact NH1-OE1 3.88Å; R102-E119 IonicContact NH1-OE2 3.62Å; R102-E119 PolarHBondContact NH1-OE2 3.11Å; R102-E119 IonicContact NH2-OE2 3.29Å; R102-E119 PolarHBondContact NH2-OE2 3.47Å; R115-E119 HydrophobicContact CG-CB 4.42Å; N116-E119 HydrophobicContact CB-CG 3.97Å; N116-E119 WeakPolarHBondContact CB-OE1 3.41Å; N116-E119 PolarHBondContact N-OE2 2.95Å; N116-E119 PolarHBondContact ND2-OE1 3.11Å; W117-E119 VanDerWaalsContact C-N 3.27Å; W117-E119 PolarHBondContact O-N 3.29Å
120	P	94.7	Very high	94.7	Very high	26 Å²	26	63.7 Å²	63.7	17%	0.169	31%	0.306	C	S	.	.	P	Polyproline II helix	trans	-62.5	141	173.6	27.3	-33.9	0	0	0	110.2	L73 P92 L94	L73-P120 HydrophobicContact CD1-CG 4.06Å; L73-P120 HydrophobicContact CD2-CG 3.86Å; L73-P120 HydrophobicContact CG-CG 3.96Å; P92-P120 HydrophobicContact CG-CB 4.12Å; L94-P120 HydrophobicContact CD1-CB 4.25Å; L94-P120 HydrophobicContact CD1-CG 4.2Å; L94-P120 WeakPolarHBondContact CD1-O 2.99Å; L94-P120 HydrophobicContact CD2-CG 4.15Å
121	M	94.5	Very high	94.7	Very high	69 Å²	69	66.2 Å²	66.2	34%	0.34	33%	0.326	S	S	.	.	P	Polyproline II helix	trans	-87.7	142.9	-178.6	-173.3	168.1	-69.4	0	0	109.9	Y91 F125	Y91-M121 WeakPolarHBondContact CE1-O 3.2Å; Y91-M121 VanDerWaalsContact CZ-O 3.25Å; Y91-M121 PolarHBondContact OH-O 3.21Å; M121-F125 HydrophobicContact CE-CD1 4.14Å; M121-F125 HydrophobicContact CE-CE1 4.16Å; M121-F125 HydrophobicContact CE-CG 4.49Å; M121-F125 HydrophobicContact CG-CB 3.45Å; M121-F125 VanDerWaalsContact CG-CB 3.45Å; M121-F125 HydrophobicContact CG-CD1 4.02Å; M121-F125 HydrophobicContact CG-CD2 3.85Å; M121-F125 HydrophobicContact CG-CG 3.51Å; M121-F125 HydrophobicContact SD-CB 3.91Å; M121-F125 HydrophobicContact SD-CD1 3.58Å; M121-F125 VanDerWaalsContact SD-CD1 3.58Å; M121-F125 HydrophobicContact SD-CD2 4.47Å; M121-F125 HydrophobicContact SD-CE1 4.21Å; M121-F125 HydrophobicContact SD-CG 3.73Å
122	H	96	Very high	94.7	Very high	16 Å²	16	69.6 Å²	69.6	7%	0.074	33%	0.327	C	S	.	.	P	Polyproline II helix	trans	-62.2	145.5	172.6	-168.7	-84	0	0	0	110.1	Q95 D96 N124 F125 Y128	Q95-H122 PolarHBondContact O-CD2 3.32Å; D96-H122 IonicContact OD1-CE1 3.45Å; D96-H122 PolarHBondContact OD1-CE1 3.33Å; D96-H122 VanDerWaalsContact OD1-CE1 3.29Å; D96-H122 IonicContact OD1-NE2 3.57Å; D96-H122 PolarHBondContact OD1-NE2 3.2Å; H122-N124 PolarHBondContact ND1-N 3.15Å; H122-N124 PolarHBondContact O-N 3.19Å; H122-F125 HydrophobicContact CB-CB 4.35Å; H122-F125 WeakPolarHBondContact O-CB 3.38Å; H122-F125 PolarHBondContact O-N 3.28Å; H122-F125 VanDerWaalsContact O-N 3.1Å; H122-Y128 AromaticContact CE1-CD2 3.83Å; H122-Y128 AromaticContact CE1-CE2 3.51Å; H122-Y128 AromaticContact ND1-CD2 3.68Å; H122-Y128 AromaticContact ND1-CE2 3.87Å; H122-Y128 AromaticContact NE2-CE2 3.97Å
123	W	95	Very high	94.9	Very high	112 Å²	112	68.6 Å²	68.6	42%	0.424	32%	0.324	S	S	.	.	T	Hydrogen-bonded Turn	trans	-57.5	-53.5	178.6	177	-89.9	0	0	0	111.4	Y81 F88 Y91 F125	Y81-W123 HydrophobicContact CE2-CB 4.17Å; Y81-W123 WeakPolarHBondContact OH-CB 3.47Å; F88-W123 AromaticContact CD1-CD2 3.62Å; F88-W123 HydrophobicContact CD1-CD2 3.62Å; F88-W123 AromaticContact CD1-CE2 3.56Å; F88-W123 AromaticContact CD1-CE3 3.77Å; F88-W123 HydrophobicContact CD1-CE3 3.77Å; F88-W123 HydrophobicContact CD1-CG 4.25Å; F88-W123 AromaticContact CD1-CH2 3.78Å; F88-W123 HydrophobicContact CD1-CH2 3.78Å; F88-W123 AromaticContact CD1-CZ2 3.65Å; F88-W123 HydrophobicContact CD1-CZ2 3.65Å; F88-W123 AromaticContact CD1-CZ3 3.84Å; F88-W123 HydrophobicContact CD1-CZ3 3.84Å; F88-W123 AromaticContact CE1-CD1 3.86Å; F88-W123 AromaticContact CE1-CD2 3.75Å; F88-W123 HydrophobicContact CE1-CD2 3.75Å; F88-W123 AromaticContact CE1-CE2 3.41Å; F88-W123 VanDerWaalsContact CE1-CE2 3.41Å; F88-W123 HydrophobicContact CE1-CE3 4.37Å; F88-W123 HydrophobicContact CE1-CG 4.04Å; F88-W123 HydrophobicContact CE1-CH2 4.36Å; F88-W123 AromaticContact CE1-CZ2 3.75Å; F88-W123 HydrophobicContact CE1-CZ2 3.75Å; F88-W123 AromaticContact CE1-NE1 3.53Å; Y91-W123 HydrophobicContact CD1-CB 4.32Å; Y91-W123 AromaticContact CD1-CE3 3.82Å; Y91-W123 HydrophobicContact CD1-CE3 3.82Å; Y91-W123 HydrophobicContact CE1-CB 4.24Å; Y91-W123 HydrophobicContact CE1-CE3 4.33Å; Y91-W123 AromaticContact CG-CE3 4Å; Y91-W123 HydrophobicContact CG-CE3 4Å; Y91-W123 HydrophobicContact CG-CZ3 4.39Å; W123-F125 PolarHBondContact O-N 3.13Å; W123-F125 VanDerWaalsContact O-N 3.13Å
124	N	95.6	Very high	95	Very high	59 Å²	59	70 Å²	70	32%	0.316	33%	0.332	S	S	.	.	T	Hydrogen-bonded Turn	trans	-84.7	41.8	172.6	-60.4	-44.1	0	0	0	112.5	H122 D126 M127 Y128	H122-N124 PolarHBondContact ND1-N 3.15Å; H122-N124 PolarHBondContact O-N 3.19Å; N124-D126 PolarHBondContact O-N 3.18Å; N124-M127 HydrophobicContact CB-CB 4.24Å; N124-M127 HydrophobicContact CB-CE 4.16Å; N124-M127 PolarHBondContact O-N 3.29Å; N124-Y128 HydrophobicContact CB-CE2 4.48Å; N124-Y128 WeakPolarHBondContact O-CD2 3.35Å; N124-Y128 PolarHBondContact O-N 2.76Å
125	F	94.8	Very high	95	Very high	23 Å²	23	70.1 Å²	70.1	10%	0.101	34%	0.337	C	S	.	.	T	Hydrogen-bonded Turn	trans	-59.5	-36.1	179.9	178.9	-103.5	0	0	0	111.7	Q99 L113 M121 H122 W123 M127 Y128 L129	Q99-F125 HydrophobicContact CG-CE2 3.9Å; L113-F125 HydrophobicContact CB-CZ 4.16Å; L113-F125 HydrophobicContact CD1-CE1 4.22Å; L113-F125 HydrophobicContact CD1-CZ 3.99Å; L113-F125 HydrophobicContact CD2-CE1 4.23Å; L113-F125 HydrophobicContact CD2-CZ 3.93Å; L113-F125 HydrophobicContact CG-CZ 4.23Å; M121-F125 HydrophobicContact CE-CD1 4.14Å; M121-F125 HydrophobicContact CE-CE1 4.16Å; M121-F125 HydrophobicContact CE-CG 4.49Å; M121-F125 HydrophobicContact CG-CB 3.45Å; M121-F125 VanDerWaalsContact CG-CB 3.45Å; M121-F125 HydrophobicContact CG-CD1 4.02Å; M121-F125 HydrophobicContact CG-CD2 3.85Å; M121-F125 HydrophobicContact CG-CG 3.51Å; M121-F125 HydrophobicContact SD-CB 3.91Å; M121-F125 HydrophobicContact SD-CD1 3.58Å; M121-F125 VanDerWaalsContact SD-CD1 3.58Å; M121-F125 HydrophobicContact SD-CD2 4.47Å; M121-F125 HydrophobicContact SD-CE1 4.21Å; M121-F125 HydrophobicContact SD-CG 3.73Å; H122-F125 HydrophobicContact CB-CB 4.35Å; H122-F125 WeakPolarHBondContact O-CB 3.38Å; H122-F125 PolarHBondContact O-N 3.28Å; H122-F125 VanDerWaalsContact O-N 3.1Å; W123-F125 PolarHBondContact O-N 3.13Å; W123-F125 VanDerWaalsContact O-N 3.13Å; F125-M127 VanDerWaalsContact C-N 3.26Å; F125-M127 PolarHBondContact O-N 3.06Å; F125-Y128 CarbonylContact O-C 3.34Å; F125-Y128 PolarHBondContact O-N 3.48Å; F125-L129 HydrophobicContact CD1-CD1 4.36Å; F125-L129 HydrophobicContact CE1-CD1 4.41Å; F125-L129 WeakPolarHBondContact O-CD1 3.42Å; F125-L129 PolarHBondContact O-N 2.65Å
126	D	94.8	Very high	95	Very high	94 Å²	94	70.9 Å²	70.9	50%	0.503	35%	0.349	S	S	.	.	T	Hydrogen-bonded Turn	trans	-59	-32.4	177.5	72.8	-44.4	0	0	0	113.4	N124 L129 R132	N124-D126 PolarHBondContact O-N 3.18Å; D126-L129 VanDerWaalsContact C-CD1 3.48Å; D126-L129 HydrophobicContact CB-CD1 4.49Å; D126-L129 WeakPolarHBondContact O-CD1 3.45Å; D126-R132 WeakPolarHBondContact O-CD 3.38Å; D126-R132 PolarHBondContact O-NE 3.07Å; D126-R132 VanDerWaalsContact O-NE 3.11Å
127	M	96.1	Very high	94.9	Very high	68 Å²	68	75 Å²	75	34%	0.335	38%	0.376	S	S	.	.	T	Hydrogen-bonded Turn	trans	-79.4	-37	175.8	-175.8	177	72.1	0	0	112.4	N124 F125 L129 R132 V133	N124-M127 HydrophobicContact CB-CB 4.24Å; N124-M127 HydrophobicContact CB-CE 4.16Å; N124-M127 PolarHBondContact O-N 3.29Å; F125-M127 VanDerWaalsContact C-N 3.26Å; F125-M127 PolarHBondContact O-N 3.06Å; M127-L129 VanDerWaalsContact C-N 3.32Å; M127-L129 PolarHBondContact O-N 3.25Å; M127-R132 WeakPolarHBondContact O-CB 3.35Å; M127-V133 HydrophobicContact CG-CB 4.11Å; M127-V133 HydrophobicContact CG-CG2 3.72Å; M127-V133 PolarHBondContact O-N 3.2Å; M127-V133 VanDerWaalsContact O-N 3.15Å; M127-V133 HydrophobicContact SD-CG2 4.47Å
128	Y	96	Very high	94.9	Very high	22 Å²	22	67.7 Å²	67.7	9%	0.086	36%	0.358	C	S	.	.	S	Bend	trans	-90.7	14.4	-175.2	-73	-41.5	0	0	0	114.4	D96 Q99 H122 N124 F125 V133 T135	D96-Y128 HydrophobicContact CB-CE2 4.34Å; Q99-Y128 WeakPolarHBondContact CG-O 3.1Å; Q99-Y128 PolarHBondContact N-O 3.35Å; Q99-Y128 VanDerWaalsContact N-O 3.13Å; H122-Y128 AromaticContact CE1-CD2 3.83Å; H122-Y128 AromaticContact CE1-CE2 3.51Å; H122-Y128 AromaticContact ND1-CD2 3.68Å; H122-Y128 AromaticContact ND1-CE2 3.87Å; H122-Y128 AromaticContact NE2-CE2 3.97Å; N124-Y128 HydrophobicContact CB-CE2 4.48Å; N124-Y128 WeakPolarHBondContact O-CD2 3.35Å; N124-Y128 PolarHBondContact O-N 2.76Å; F125-Y128 CarbonylContact O-C 3.34Å; F125-Y128 PolarHBondContact O-N 3.48Å; Y128-V133 HydrophobicContact CE1-CG1 4.45Å; Y128-T135 HydrophobicContact CD1-CG2 4.24Å; Y128-T135 HydrophobicContact CE1-CG2 3.64Å
129	L	94.3	Very high	95.1	Very high	44 Å²	44	72.6 Å²	72.6	23%	0.23	38%	0.384	C	S	.	.	S	Bend	trans	-56.9	151.6	167.7	-88.8	96.8	0	0	0	111	L113 F125 D126 M127 T131 R132	L113-L129 HydrophobicContact CD2-CD2 4.17Å; L113-L129 HydrophobicContact CD2-CG 4.48Å; F125-L129 HydrophobicContact CD1-CD1 4.36Å; F125-L129 HydrophobicContact CE1-CD1 4.41Å; F125-L129 WeakPolarHBondContact O-CD1 3.42Å; F125-L129 PolarHBondContact O-N 2.65Å; D126-L129 VanDerWaalsContact C-CD1 3.48Å; D126-L129 HydrophobicContact CB-CD1 4.49Å; D126-L129 WeakPolarHBondContact O-CD1 3.45Å; M127-L129 VanDerWaalsContact C-N 3.32Å; M127-L129 PolarHBondContact O-N 3.25Å; L129-T131 PolarHBondContact O-N 2.55Å; L129-R132 HydrophobicContact CB-CG 4.49Å; L129-R132 PolarHBondContact O-N 2.82Å
130	R	92.8	Very high	95.2	Very high	109 Å²	109	72.6 Å²	72.6	41%	0.411	39%	0.388	S	S	.	.	T	Hydrogen-bonded Turn	trans	-60.4	-12.2	175.5	-158.2	175.5	68.4	-161	2.5	114.1	H100 D112	H100-R130 VanDerWaalsContact CE1-C 3.44Å; H100-R130 WeakPolarHBondContact CE1-CA 3.24Å; H100-R130 PolarHBondContact CE1-O 3.02Å; H100-R130 WeakPolarHBondContact NE2-CG 3.21Å; H100-R130 PolarHBondContact NE2-O 3Å; D112-R130 PolarHBondContact O-NH1 3.06Å
131	T	93.8	Very high	95.4	Very high	120 Å²	120	75.2 Å²	75.2	74%	0.736	41%	0.405	S	S	*	.	T	Hydrogen-bonded Turn	trans	-96.8	-0.5	178	53.4	0	0	0	0	113.4	L129	L129-T131 PolarHBondContact O-N 2.55Å
132	R	94.6	Very high	95.4	Very high	161 Å²	161	80.2 Å²	80.2	61%	0.608	42%	0.42	S	S	*	.	S	Bend	trans	-128.6	-123.3	-169.3	-63.4	-175.3	-170.2	-117	4.6	111.8	D126 M127 L129	D126-R132 WeakPolarHBondContact O-CD 3.38Å; D126-R132 PolarHBondContact O-NE 3.07Å; D126-R132 VanDerWaalsContact O-NE 3.11Å; M127-R132 WeakPolarHBondContact O-CB 3.35Å; L129-R132 HydrophobicContact CB-CG 4.49Å; L129-R132 PolarHBondContact O-N 2.82Å
133	V	96.1	Very high	95.5	Very high	70 Å²	70	82.7 Å²	82.7	42%	0.424	44%	0.439	S	S	.	.			trans	-77.7	126.8	-172	-178.7	0	0	0	0	109.3	S98 M127 Y128	S98-V133 WeakPolarHBondContact CB-O 3.32Å; M127-V133 HydrophobicContact CG-CB 4.11Å; M127-V133 HydrophobicContact CG-CG2 3.72Å; M127-V133 PolarHBondContact O-N 3.2Å; M127-V133 VanDerWaalsContact O-N 3.15Å; M127-V133 HydrophobicContact SD-CG2 4.47Å; Y128-V133 HydrophobicContact CE1-CG1 4.45Å
134	D	95.6	Very high	95.6	Very high	70 Å²	70	79.7 Å²	79.7	37%	0.374	43%	0.434	S	S	.	.			trans	-106.2	133.5	175	-172.4	9.6	0	0	0	110.2	S98 H100 S136	S98-D134 PolarHBondContact OG-OD1 2.83Å; H100-D134 VanDerWaalsContact CB-OD1 3.24Å; H100-D134 WeakPolarHBondContact CB-OD1 3.38Å; H100-D134 IonicContact CG-OD1 3.05Å; H100-D134 IonicContact CG-OD2 3.71Å; H100-D134 IonicContact ND1-OD1 3.65Å; D134-S136 WeakPolarHBondContact OD1-CB 3.37Å; D134-S136 PolarHBondContact OD1-N 3.14Å; D134-S136 PolarHBondContact OD1-OG 2.77Å; D134-S136 WeakPolarHBondContact OD2-CB 3.15Å; D134-S136 PolarHBondContact OD2-OG 3.46Å
135	T	95.9	Very high	95.7	Very high	42 Å²	42	80.7 Å²	80.7	26%	0.258	44%	0.437	S	S	.	.			trans	-107	4.3	176.8	57.8	0	0	0	0	112.4	S98 E101 Y128	S98-T135 WeakPolarHBondContact CB-OG1 3.32Å; S98-T135 PolarHBondContact N-OG1 2.96Å; S98-T135 PolarHBondContact OG-N 3.39Å; S98-T135 VanDerWaalsContact OG-N 3.14Å; S98-T135 PolarHBondContact OG-OG1 2.87Å; S98-T135 VanDerWaalsContact OG-OG1 3.07Å; E101-T135 WeakPolarHBondContact OE1-CB 3.34Å; E101-T135 PolarHBondContact OE1-OG1 2.96Å; Y128-T135 HydrophobicContact CD1-CG2 4.24Å; Y128-T135 HydrophobicContact CE1-CG2 3.64Å
136	S	95.4	Very high	95.8	Very high	55 Å²	55	84.4 Å²	84.4	39%	0.385	45%	0.451	S	S	.	.	P	Polyproline II helix	trans	-54.1	139.3	-178.3	69.8	0	0	0	0	111.5	D134 S138	D134-S136 WeakPolarHBondContact OD1-CB 3.37Å; D134-S136 PolarHBondContact OD1-N 3.14Å; D134-S136 PolarHBondContact OD1-OG 2.77Å; D134-S136 WeakPolarHBondContact OD2-CB 3.15Å; D134-S136 PolarHBondContact OD2-OG 3.46Å; S136-S138 PolarHBondContact O-N 3.24Å
137	P	95.4	Very high	96	Very high	107 Å²	107	87.1 Å²	87.1	70%	0.695	46%	0.458	S	S	*	.	P	Polyproline II helix	trans	-66.6	123.9	-174.8	25.8	-33.5	0	0	0	110.6
138	S	95.7	Very high	96	Very high	64 Å²	64	89.9 Å²	89.9	45%	0.448	47%	0.47	S	S	.	.	P	Polyproline II helix	trans	-80.5	149.2	172.2	56.9	0	0	0	0	111.3	S136 V140	S136-S138 PolarHBondContact O-N 3.24Å; S138-V140 PolarHBondContact O-N 3.26Å; S138-V140 PolarHBondContact OG-O 2.76Å
139	P	96.6	Very high	96.2	Very high	136 Å²	136	93.3 Å²	93.3	88%	0.883	49%	0.489	S	S	*	.	S	Bend	trans	-66.5	-22.7	177.8	26.2	-34.6	0	0	0	112.9
140	V	96.8	Very high	96.3	Very high	58 Å²	58	97.2 Å²	97.2	35%	0.352	51%	0.505	S	S	.	.	S	Bend	trans	-108.6	135.1	177.8	-176.2	0	0	0	0	109.4	S138 T144 M145	S138-V140 PolarHBondContact O-N 3.26Å; S138-V140 PolarHBondContact OG-O 2.76Å; V140-T144 HydrophobicContact CG1-CG2 4.01Å; V140-M145 HydrophobicContact CB-CG 3.97Å; V140-M145 HydrophobicContact CB-SD 4.39Å; V140-M145 HydrophobicContact CG1-CG 3.72Å
141	P	97.2	Very high	96.6	Very high	81 Å²	81	94.2 Å²	94.2	53%	0.526	51%	0.507	S	S	.	.			trans	-59	139.3	173.4	-24	32.9	0	0	0	112.5	S143 T144 M145	P141-S143 VanDerWaalsContact C-N 3.3Å; P141-S143 PolarHBondContact O-N 3.01Å; P141-T144 WeakPolarHBondContact O-CB 3.43Å; P141-T144 PolarHBondContact O-N 3.22Å; P141-M145 PolarHBondContact O-N 3.19Å
142	W	95.8	Very high	96.8	Very high	173 Å²	173	94.5 Å²	94.5	66%	0.655	50%	0.499	S	S	*	.	H	α-helix	trans	-51.4	-45.2	-178.8	-175.7	-114.8	0	0	0	113.4	T144 M145 W146	W142-T144 VanDerWaalsContact C-N 3.26Å; W142-T144 PolarHBondContact O-N 3.15Å; W142-M145 HydrophobicContact CE3-SD 4.37Å; W142-M145 PolarHBondContact O-N 3.4Å; W142-W146 AromaticContact CD1-CD1 3.89Å; W142-W146 AromaticContact CD2-CD1 3.65Å; W142-W146 AromaticContact CD2-NE1 3.48Å; W142-W146 AromaticContact CE2-CD1 3.46Å; W142-W146 VanDerWaalsContact CE2-CD1 3.46Å; W142-W146 AromaticContact CE2-CE2 4Å; W142-W146 AromaticContact CE2-NE1 2.89Å; W142-W146 AromaticContact CE3-NE1 3.91Å; W142-W146 AromaticContact CG-CD1 4Å; W142-W146 HydrophobicContact CH2-CZ2 4.3Å; W142-W146 AromaticContact CH2-NE1 3.37Å; W142-W146 AromaticContact CZ2-CD1 3.9Å; W142-W146 AromaticContact CZ2-CE2 3.67Å; W142-W146 AromaticContact CZ2-CZ2 3.89Å; W142-W146 HydrophobicContact CZ2-CZ2 3.89Å; W142-W146 AromaticContact CZ2-NE1 2.87Å; W142-W146 AromaticContact CZ3-NE1 3.85Å; W142-W146 AromaticContact NE1-CD1 3.54Å; W142-W146 AromaticContact NE1-NE1 3.27Å; W142-W146 VanDerWaalsContact O-CD1 3.32Å; W142-W146 PolarHBondContact O-N 3.2Å; W142-W146 VanDerWaalsContact O-N 3.15Å
143	S	97.1	Very high	97	Very high	68 Å²	68	89.9 Å²	89.9	48%	0.476	49%	0.488	S	S	.	.	H	α-helix	trans	-62.2	-33.4	-179.3	64	0	0	0	0	113	P141 K147	P141-S143 VanDerWaalsContact C-N 3.3Å; P141-S143 PolarHBondContact O-N 3.01Å; S143-K147 WeakPolarHBondContact O-CD 3.38Å; S143-K147 VanDerWaalsContact O-CG 3.23Å; S143-K147 WeakPolarHBondContact O-CG 3.31Å; S143-K147 PolarHBondContact O-N 2.92Å
144	T	97.6	Very high	97.1	Very high	50 Å²	50	88.4 Å²	88.4	31%	0.307	49%	0.488	S	S	.	.	H	α-helix	trans	-72.1	-43	176.8	-58.6	0	0	0	0	111	V140 P141 W142 W146 K147 Q148	V140-T144 HydrophobicContact CG1-CG2 4.01Å; P141-T144 WeakPolarHBondContact O-CB 3.43Å; P141-T144 PolarHBondContact O-N 3.22Å; W142-T144 VanDerWaalsContact C-N 3.26Å; W142-T144 PolarHBondContact O-N 3.15Å; T144-W146 VanDerWaalsContact C-N 3.33Å; T144-W146 PolarHBondContact O-N 3.28Å; T144-K147 PolarHBondContact O-N 3.43Å; T144-Q148 HydrophobicContact CG2-CG 4.47Å; T144-Q148 WeakPolarHBondContact O-CG 3.42Å; T144-Q148 PolarHBondContact O-N 2.89Å
145	M	97.6	Very high	97.3	Very high	80 Å²	80	90.5 Å²	90.5	39%	0.394	49%	0.494	S	S	.	.	H	α-helix	trans	-56.8	-47.2	177.4	-63.6	173.9	67.5	0	0	111.3	V140 P141 W142 Q148 L149	V140-M145 HydrophobicContact CB-CG 3.97Å; V140-M145 HydrophobicContact CB-SD 4.39Å; V140-M145 HydrophobicContact CG1-CG 3.72Å; P141-M145 PolarHBondContact O-N 3.19Å; W142-M145 HydrophobicContact CE3-SD 4.37Å; W142-M145 PolarHBondContact O-N 3.4Å; M145-Q148 PolarHBondContact O-N 3.39Å; M145-L149 WeakPolarHBondContact O-CB 3.23Å; M145-L149 PolarHBondContact O-N 3.3Å
146	W	97.6	Very high	97.4	Very high	101 Å²	101	92.1 Å²	92.1	38%	0.383	50%	0.499	S	S	.	.	H	α-helix	trans	-66.9	-40.1	179.3	-81.2	92.9	0	0	0	113.7	W142 T144 Q148 L149 F150	W142-W146 AromaticContact CD1-CD1 3.89Å; W142-W146 AromaticContact CD2-CD1 3.65Å; W142-W146 AromaticContact CD2-NE1 3.48Å; W142-W146 AromaticContact CE2-CD1 3.46Å; W142-W146 VanDerWaalsContact CE2-CD1 3.46Å; W142-W146 AromaticContact CE2-CE2 4Å; W142-W146 AromaticContact CE2-NE1 2.89Å; W142-W146 AromaticContact CE3-NE1 3.91Å; W142-W146 AromaticContact CG-CD1 4Å; W142-W146 HydrophobicContact CH2-CZ2 4.3Å; W142-W146 AromaticContact CH2-NE1 3.37Å; W142-W146 AromaticContact CZ2-CD1 3.9Å; W142-W146 AromaticContact CZ2-CE2 3.67Å; W142-W146 AromaticContact CZ2-CZ2 3.89Å; W142-W146 HydrophobicContact CZ2-CZ2 3.89Å; W142-W146 AromaticContact CZ2-NE1 2.87Å; W142-W146 AromaticContact CZ3-NE1 3.85Å; W142-W146 AromaticContact NE1-CD1 3.54Å; W142-W146 AromaticContact NE1-NE1 3.27Å; W142-W146 VanDerWaalsContact O-CD1 3.32Å; W142-W146 PolarHBondContact O-N 3.2Å; W142-W146 VanDerWaalsContact O-N 3.15Å; T144-W146 VanDerWaalsContact C-N 3.33Å; T144-W146 PolarHBondContact O-N 3.28Å; W146-Q148 VanDerWaalsContact C-N 3.31Å; W146-Q148 PolarHBondContact O-N 3.46Å; W146-L149 PolarHBondContact O-N 3.22Å; W146-F150 HydrophobicContact CB-CD2 4.45Å; W146-F150 HydrophobicContact CD2-CE2 4.08Å; W146-F150 AromaticContact CE3-CD2 3.61Å; W146-F150 HydrophobicContact CE3-CD2 3.61Å; W146-F150 HydrophobicContact CE3-CE1 4.36Å; W146-F150 AromaticContact CE3-CE2 2.99Å; W146-F150 HydrophobicContact CE3-CE2 2.99Å; W146-F150 AromaticContact CE3-CZ 3.44Å; W146-F150 HydrophobicContact CE3-CZ 3.44Å; W146-F150 VanDerWaalsContact CE3-CZ 3.44Å; W146-F150 HydrophobicContact CH2-CZ 4.44Å; W146-F150 HydrophobicContact CZ3-CD2 4.28Å; W146-F150 HydrophobicContact CZ3-CE1 4.14Å; W146-F150 AromaticContact CZ3-CE2 3.33Å; W146-F150 HydrophobicContact CZ3-CE2 3.33Å; W146-F150 AromaticContact CZ3-CZ 3.22Å; W146-F150 HydrophobicContact CZ3-CZ 3.22Å; W146-F150 WeakPolarHBondContact O-CB 3.48Å; W146-F150 WeakPolarHBondContact O-CD2 3.34Å; W146-F150 PolarHBondContact O-N 2.92Å
147	K	97.6	Very high	97.5	Very high	151 Å²	151	94.9 Å²	94.9	66%	0.657	51%	0.509	S	S	*	.	H	α-helix	trans	-61.5	-42.3	176.1	-74.1	170.5	-172	177	0	111.5	S143 T144 G151	S143-K147 WeakPolarHBondContact O-CD 3.38Å; S143-K147 VanDerWaalsContact O-CG 3.23Å; S143-K147 WeakPolarHBondContact O-CG 3.31Å; S143-K147 PolarHBondContact O-N 2.92Å; T144-K147 PolarHBondContact O-N 3.43Å; K147-G151 WeakPolarHBondContact O-CA 3.39Å; K147-G151 PolarHBondContact O-N 3.45Å
148	Q	97.8	Very high	97.6	Very high	125 Å²	125	94.8 Å²	94.8	58%	0.584	50%	0.498	S	S	*	.	H	α-helix	trans	-68.5	-45.8	178	-70.8	174.6	-5.7	0	0	111.5	T144 M145 W146 G151 F152	T144-Q148 HydrophobicContact CG2-CG 4.47Å; T144-Q148 WeakPolarHBondContact O-CG 3.42Å; T144-Q148 PolarHBondContact O-N 2.89Å; M145-Q148 PolarHBondContact O-N 3.39Å; W146-Q148 VanDerWaalsContact C-N 3.31Å; W146-Q148 PolarHBondContact O-N 3.46Å; Q148-G151 PolarHBondContact O-N 3.02Å; Q148-F152 VanDerWaalsContact O-CB 3.31Å; Q148-F152 WeakPolarHBondContact O-CB 3.5Å; Q148-F152 PolarHBondContact O-N 2.87Å
149	L	98.3	Very high	97.7	Very high	94 Å²	94	95.2 Å²	95.2	49%	0.492	49%	0.493	S	S	.	.	H	α-helix	trans	-59.9	-53.5	178.5	178.2	62.5	0	0	0	111.5	M145 W146 F152 V153	M145-L149 WeakPolarHBondContact O-CB 3.23Å; M145-L149 PolarHBondContact O-N 3.3Å; W146-L149 PolarHBondContact O-N 3.22Å; L149-F152 PolarHBondContact O-N 2.91Å; L149-V153 HydrophobicContact CD1-CG2 4.18Å; L149-V153 WeakPolarHBondContact O-CB 3.4Å; L149-V153 WeakPolarHBondContact O-CG2 3.43Å; L149-V153 PolarHBondContact O-N 3.35Å
150	F	98.2	Very high	97.8	Very high	127 Å²	127	95.6 Å²	95.6	56%	0.557	48%	0.481	S	S	*	.	H	α-helix	trans	-69.5	-34.6	-179.9	-75.6	-52.5	0	0	0	112.9	W146 G154	W146-F150 HydrophobicContact CB-CD2 4.45Å; W146-F150 HydrophobicContact CD2-CE2 4.08Å; W146-F150 AromaticContact CE3-CD2 3.61Å; W146-F150 HydrophobicContact CE3-CD2 3.61Å; W146-F150 HydrophobicContact CE3-CE1 4.36Å; W146-F150 AromaticContact CE3-CE2 2.99Å; W146-F150 HydrophobicContact CE3-CE2 2.99Å; W146-F150 AromaticContact CE3-CZ 3.44Å; W146-F150 HydrophobicContact CE3-CZ 3.44Å; W146-F150 VanDerWaalsContact CE3-CZ 3.44Å; W146-F150 HydrophobicContact CH2-CZ 4.44Å; W146-F150 HydrophobicContact CZ3-CD2 4.28Å; W146-F150 HydrophobicContact CZ3-CE1 4.14Å; W146-F150 AromaticContact CZ3-CE2 3.33Å; W146-F150 HydrophobicContact CZ3-CE2 3.33Å; W146-F150 AromaticContact CZ3-CZ 3.22Å; W146-F150 HydrophobicContact CZ3-CZ 3.22Å; W146-F150 WeakPolarHBondContact O-CB 3.48Å; W146-F150 WeakPolarHBondContact O-CD2 3.34Å; W146-F150 PolarHBondContact O-N 2.92Å; F150-G154 WeakPolarHBondContact O-CA 3.11Å; F150-G154 PolarHBondContact O-N 2.93Å
151	G	98.3	Very high	97.8	Very high	45 Å²	45	98.9 Å²	98.9	46%	0.464	49%	0.489	S	S	.	.	H	α-helix	trans	-60.3	-46.5	173.3	0	0	0	0	0	111.4	K147 Q148 F155	K147-G151 WeakPolarHBondContact O-CA 3.39Å; K147-G151 PolarHBondContact O-N 3.45Å; Q148-G151 PolarHBondContact O-N 3.02Å; G151-F155 WeakPolarHBondContact O-CB 3.48Å; G151-F155 PolarHBondContact O-N 2.81Å
152	F	98.4	Very high	97.9	Very high	127 Å²	127	98.4 Å²	98.4	56%	0.557	48%	0.48	S	S	*	.	H	α-helix	trans	-65.3	-52.4	177.4	176.2	-101	0	0	0	112.2	Q148 L149 G154 F155 M156	Q148-F152 VanDerWaalsContact O-CB 3.31Å; Q148-F152 WeakPolarHBondContact O-CB 3.5Å; Q148-F152 PolarHBondContact O-N 2.87Å; L149-F152 PolarHBondContact O-N 2.91Å; F152-G154 PolarHBondContact O-N 3.46Å; F152-F155 PolarHBondContact O-N 3.1Å; F152-M156 HydrophobicContact CD1-CG 4.31Å; F152-M156 HydrophobicContact CD2-CG 4.12Å; F152-M156 HydrophobicContact CE1-CG 3.91Å; F152-M156 HydrophobicContact CE2-CG 3.7Å; F152-M156 HydrophobicContact CE2-SD 4.02Å; F152-M156 HydrophobicContact CG-CG 4.42Å; F152-M156 HydrophobicContact CZ-CE 4.22Å; F152-M156 HydrophobicContact CZ-CG 3.59Å; F152-M156 HydrophobicContact CZ-SD 4.11Å; F152-M156 WeakPolarHBondContact O-CB 3.15Å; F152-M156 VanDerWaalsContact O-CG 3.3Å; F152-M156 WeakPolarHBondContact O-CG 3.37Å; F152-M156 PolarHBondContact O-N 3.21Å
153	V	98.5	Very high	97.9	Very high	63 Å²	63	92.1 Å²	92.1	38%	0.382	47%	0.469	S	S	.	.	H	α-helix	trans	-61.3	-45.8	-178.9	172.2	0	0	0	0	110.7	L149 F155 M156 L157	L149-V153 HydrophobicContact CD1-CG2 4.18Å; L149-V153 WeakPolarHBondContact O-CB 3.4Å; L149-V153 WeakPolarHBondContact O-CG2 3.43Å; L149-V153 PolarHBondContact O-N 3.35Å; V153-F155 PolarHBondContact O-N 3.37Å; V153-M156 PolarHBondContact O-N 3.41Å; V153-L157 HydrophobicContact CG1-CD1 3.97Å; V153-L157 HydrophobicContact CG1-CG 4.43Å; V153-L157 WeakPolarHBondContact O-CB 3.37Å; V153-L157 VanDerWaalsContact O-CG 3.3Å; V153-L157 WeakPolarHBondContact O-CG 3.44Å; V153-L157 PolarHBondContact O-N 3.26Å
154	G	98.4	Very high	97.9	Very high	40 Å²	40	95.7 Å²	95.7	41%	0.412	48%	0.478	S	S	.	.	H	α-helix	trans	-61.3	-43.2	177.5	0	0	0	0	0	112.4	F150 F152 F158	F150-G154 WeakPolarHBondContact O-CA 3.11Å; F150-G154 PolarHBondContact O-N 2.93Å; F152-G154 PolarHBondContact O-N 3.46Å; G154-F158 WeakPolarHBondContact O-CB 3.3Å; G154-F158 PolarHBondContact O-N 3.19Å
155	F	98.5	Very high	97.9	Very high	114 Å²	114	98.9 Å²	98.9	50%	0.5	49%	0.488	S	S	.	.	H	α-helix	trans	-65	-44	176.9	179.7	-103.9	0	0	0	112.4	G151 F152 V153 F158 M159	G151-F155 WeakPolarHBondContact O-CB 3.48Å; G151-F155 PolarHBondContact O-N 2.81Å; F152-F155 PolarHBondContact O-N 3.1Å; V153-F155 PolarHBondContact O-N 3.37Å; F155-F158 WeakPolarHBondContact O-CB 3.37Å; F155-F158 PolarHBondContact O-N 2.98Å; F155-M159 HydrophobicContact CD1-CG 4.17Å; F155-M159 HydrophobicContact CE1-CG 3.7Å; F155-M159 HydrophobicContact CE1-SD 4.4Å; F155-M159 HydrophobicContact CE2-CE 3.85Å; F155-M159 HydrophobicContact CE2-CG 4.07Å; F155-M159 HydrophobicContact CE2-SD 4.2Å; F155-M159 HydrophobicContact CZ-CE 4.08Å; F155-M159 HydrophobicContact CZ-CG 3.64Å; F155-M159 HydrophobicContact CZ-SD 3.81Å; F155-M159 WeakPolarHBondContact O-CG 3.48Å; F155-M159 PolarHBondContact O-N 2.91Å
156	M	98.4	Very high	97.8	Very high	75 Å²	75	102.6 Å²	102.6	37%	0.369	50%	0.502	S	S	.	.	H	α-helix	trans	-63.4	-44.7	178.5	-70.8	-65	-81	0	0	111.5	F152 V153 F158 M159 F160	F152-M156 HydrophobicContact CD1-CG 4.31Å; F152-M156 HydrophobicContact CD2-CG 4.12Å; F152-M156 HydrophobicContact CE1-CG 3.91Å; F152-M156 HydrophobicContact CE2-CG 3.7Å; F152-M156 HydrophobicContact CE2-SD 4.02Å; F152-M156 HydrophobicContact CG-CG 4.42Å; F152-M156 HydrophobicContact CZ-CE 4.22Å; F152-M156 HydrophobicContact CZ-CG 3.59Å; F152-M156 HydrophobicContact CZ-SD 4.11Å; F152-M156 WeakPolarHBondContact O-CB 3.15Å; F152-M156 VanDerWaalsContact O-CG 3.3Å; F152-M156 WeakPolarHBondContact O-CG 3.37Å; F152-M156 PolarHBondContact O-N 3.21Å; V153-M156 PolarHBondContact O-N 3.41Å; M156-F158 VanDerWaalsContact C-N 3.29Å; M156-F158 PolarHBondContact O-N 3.36Å; M156-M159 PolarHBondContact O-N 2.88Å; M156-F160 HydrophobicContact CE-CE2 4.45Å; M156-F160 WeakPolarHBondContact O-CD2 3.49Å; M156-F160 PolarHBondContact O-N 2.89Å
157	L	98.3	Very high	97.7	Very high	114 Å²	114	101.8 Å²	101.8	60%	0.597	51%	0.51	S	S	*	.	H	α-helix	trans	-60.6	-40.5	175.5	-71	173.9	0	0	0	111.8	V153 F160 Y161	V153-L157 HydrophobicContact CG1-CD1 3.97Å; V153-L157 HydrophobicContact CG1-CG 4.43Å; V153-L157 WeakPolarHBondContact O-CB 3.37Å; V153-L157 VanDerWaalsContact O-CG 3.3Å; V153-L157 WeakPolarHBondContact O-CG 3.44Å; V153-L157 PolarHBondContact O-N 3.26Å; L157-F160 PolarHBondContact O-N 3.01Å; L157-Y161 WeakPolarHBondContact O-CB 3.48Å; L157-Y161 PolarHBondContact O-N 3.47Å
158	F	98	Very high	97.6	Very high	105 Å²	105	100.4 Å²	100.4	46%	0.461	52%	0.519	S	S	.	.	H	α-helix	trans	-64.1	-42.2	175	173.3	-109.8	0	0	0	112.4	G154 F155 M156 Y161 M162	G154-F158 WeakPolarHBondContact O-CB 3.3Å; G154-F158 PolarHBondContact O-N 3.19Å; F155-F158 WeakPolarHBondContact O-CB 3.37Å; F155-F158 PolarHBondContact O-N 2.98Å; M156-F158 VanDerWaalsContact C-N 3.29Å; M156-F158 PolarHBondContact O-N 3.36Å; F158-Y161 WeakPolarHBondContact O-CB 3.49Å; F158-Y161 PolarHBondContact O-N 3.44Å; F158-M162 HydrophobicContact CD1-SD 4.24Å; F158-M162 HydrophobicContact CE1-CG 4.28Å; F158-M162 HydrophobicContact CE1-SD 3.43Å; F158-M162 WeakPolarHBondContact CE1-SD 3.35Å; F158-M162 HydrophobicContact CE2-CG 4.16Å; F158-M162 HydrophobicContact CE2-SD 4.19Å; F158-M162 HydrophobicContact CZ-CG 3.97Å; F158-M162 HydrophobicContact CZ-SD 3.4Å; F158-M162 WeakPolarHBondContact CZ-SD 3.42Å; F158-M162 WeakPolarHBondContact O-CG 3.3Å; F158-M162 PolarHBondContact O-N 2.95Å
159	M	97.8	Very high	97.4	Very high	72 Å²	72	103.3 Å²	103.3	36%	0.355	53%	0.526	S	S	.	.	H	α-helix	trans	-64.3	-39.6	175.2	-70.8	-67.6	103.8	0	0	112.2	F155 M156 M162 G163	F155-M159 HydrophobicContact CD1-CG 4.17Å; F155-M159 HydrophobicContact CE1-CG 3.7Å; F155-M159 HydrophobicContact CE1-SD 4.4Å; F155-M159 HydrophobicContact CE2-CE 3.85Å; F155-M159 HydrophobicContact CE2-CG 4.07Å; F155-M159 HydrophobicContact CE2-SD 4.2Å; F155-M159 HydrophobicContact CZ-CE 4.08Å; F155-M159 HydrophobicContact CZ-CG 3.64Å; F155-M159 HydrophobicContact CZ-SD 3.81Å; F155-M159 WeakPolarHBondContact O-CG 3.48Å; F155-M159 PolarHBondContact O-N 2.91Å; M156-M159 PolarHBondContact O-N 2.88Å; M159-M162 HydrophobicContact CE-SD 3.51Å; M159-M162 VanDerWaalsContact CE-SD 3.51Å; M159-M162 PolarHBondContact O-N 3.27Å; M159-G163 PolarHBondContact O-N 2.95Å
160	F	97.5	Very high	97.3	Very high	144 Å²	144	105.6 Å²	105.6	63%	0.632	53%	0.534	S	S	*	.	H	α-helix	trans	-62.9	-43.3	173.3	-78.9	-61.9	0	0	0	111.9	M156 L157 M162 G163 E164	M156-F160 HydrophobicContact CE-CE2 4.45Å; M156-F160 WeakPolarHBondContact O-CD2 3.49Å; M156-F160 PolarHBondContact O-N 2.89Å; L157-F160 PolarHBondContact O-N 3.01Å; F160-M162 VanDerWaalsContact C-N 3.31Å; F160-M162 PolarHBondContact O-N 2.77Å; F160-G163 PolarHBondContact O-N 2.94Å; F160-G163 VanDerWaalsContact O-N 3.15Å; F160-E164 PolarHBondContact O-N 3.18Å
161	Y	97.8	Very high	97.1	Very high	128 Å²	128	105.1 Å²	105.1	50%	0.502	54%	0.544	S	S	.	.	H	α-helix	trans	-58.9	-42.9	173.9	171.9	-100.4	0	0	0	111.9	L157 F158 E164 K165	L157-Y161 WeakPolarHBondContact O-CB 3.48Å; L157-Y161 PolarHBondContact O-N 3.47Å; F158-Y161 WeakPolarHBondContact O-CB 3.49Å; F158-Y161 PolarHBondContact O-N 3.44Å; Y161-E164 PolarHBondContact O-N 3.24Å; Y161-K165 HydrophobicContact CE1-CG 4.29Å; Y161-K165 HydrophobicContact CE2-CG 4.39Å; Y161-K165 PolarHBondContact O-N 2.84Å; Y161-K165 VanDerWaalsContact O-N 3.17Å; Y161-K165 WeakPolarHBondContact OH-CE 3.45Å
162	M	97.6	Very high	96.9	Very high	71 Å²	71	109.4 Å²	109.4	35%	0.35	56%	0.555	S	S	.	*	H	α-helix	trans	-63.6	-41.9	173.7	-73.5	-172.9	66.1	0	0	112.3	F158 M159 F160 E164 K165 F166	F158-M162 HydrophobicContact CD1-SD 4.24Å; F158-M162 HydrophobicContact CE1-CG 4.28Å; F158-M162 HydrophobicContact CE1-SD 3.43Å; F158-M162 WeakPolarHBondContact CE1-SD 3.35Å; F158-M162 HydrophobicContact CE2-CG 4.16Å; F158-M162 HydrophobicContact CE2-SD 4.19Å; F158-M162 HydrophobicContact CZ-CG 3.97Å; F158-M162 HydrophobicContact CZ-SD 3.4Å; F158-M162 WeakPolarHBondContact CZ-SD 3.42Å; F158-M162 WeakPolarHBondContact O-CG 3.3Å; F158-M162 PolarHBondContact O-N 2.95Å; M159-M162 HydrophobicContact CE-SD 3.51Å; M159-M162 VanDerWaalsContact CE-SD 3.51Å; M159-M162 PolarHBondContact O-N 3.27Å; F160-M162 VanDerWaalsContact C-N 3.31Å; F160-M162 PolarHBondContact O-N 2.77Å; M162-E164 PolarHBondContact O-N 3.41Å; M162-K165 PolarHBondContact O-N 3.08Å; M162-K165 VanDerWaalsContact O-N 3.12Å; M162-F166 WeakPolarHBondContact O-CD2 3.39Å; M162-F166 PolarHBondContact O-N 3.11Å
163	G	97.3	Very high	96.5	Very high	41 Å²	41	106.9 Å²	106.9	42%	0.423	56%	0.557	S	S	.	*	H	α-helix	trans	-61.7	-31.6	176.7	0	0	0	0	0	113.2	M159 F160 F166 P167	M159-G163 PolarHBondContact O-N 2.95Å; F160-G163 PolarHBondContact O-N 2.94Å; F160-G163 VanDerWaalsContact O-N 3.15Å; G163-F166 CarbonylContact O-C 3.59Å; G163-P167 WeakPolarHBondContact O-CA 3.23Å
164	E	96.5	Very high	96.2	Very high	142 Å²	142	109.5 Å²	109.5	66%	0.664	58%	0.576	S	S	*	*	H	α-helix	trans	-71.6	-38.2	172.9	-168.1	-173.6	159.7	0	0	112.2	F160 Y161 M162	F160-E164 PolarHBondContact O-N 3.18Å; Y161-E164 PolarHBondContact O-N 3.24Å; M162-E164 PolarHBondContact O-N 3.41Å
165	K	96.7	Very high	95.9	Very high	117 Å²	117	115.1 Å²	115.1	51%	0.509	59%	0.589	S	S	.	*	H	α-helix	trans	-73.2	-30.5	176.8	-65.4	-55.6	-178.6	-167.8	0	113.4	Y161 M162 P167	Y161-K165 HydrophobicContact CE1-CG 4.29Å; Y161-K165 HydrophobicContact CE2-CG 4.39Å; Y161-K165 PolarHBondContact O-N 2.84Å; Y161-K165 VanDerWaalsContact O-N 3.17Å; Y161-K165 WeakPolarHBondContact OH-CE 3.45Å; M162-K165 PolarHBondContact O-N 3.08Å; M162-K165 VanDerWaalsContact O-N 3.12Å; K165-P167 VanDerWaalsContact O-CD 3.31Å; K165-P167 WeakPolarHBondContact O-CD 3.35Å
166	F	95.9	Very high	95.6	Very high	159 Å²	159	114.8 Å²	114.8	70%	0.697	59%	0.589	S	S	*	*	S	Bend	trans	-120.6	68.4	178.8	-58.5	-73.2	0	0	0	110.4	M162 G163 S168	M162-F166 WeakPolarHBondContact O-CD2 3.39Å; M162-F166 PolarHBondContact O-N 3.11Å; G163-F166 CarbonylContact O-C 3.59Å; F166-S168 PolarHBondContact O-N 3.36Å
167	P	95.5	Very high	95.3	Very high	83 Å²	83	115.1 Å²	115.1	54%	0.539	59%	0.586	S	S	.	*			trans	-68.9	134.7	-177.8	29.4	-34.1	0	0	0	110	G163 K165	G163-P167 WeakPolarHBondContact O-CA 3.23Å; K165-P167 VanDerWaalsContact O-CD 3.31Å; K165-P167 WeakPolarHBondContact O-CD 3.35Å
168	S	95.1	Very high	94.9	Very high	122 Å²	122	113.2 Å²	113.2	85%	0.853	58%	0.581	S	S	*	*			trans	-77.6	131.6	166.9	-174.4	0	0	0	0	109.1	F166	F166-S168 PolarHBondContact O-N 3.36Å
169	Y	94.9	Very high	94.5	Very high	187 Å²	187	116.7 Å²	116.7	73%	0.733	59%	0.592	S	S	*	*			trans	-133.1	154.8	174.5	62	-87.6	0	0	0	110.1
170	Q	95.1	Very high	94.1	Very high	141 Å²	141	115.8 Å²	115.8	66%	0.659	59%	0.589	S	S	*	*			trans	-76.8	136.8	172.7	-65.4	-62.9	-40.1	0	0	109	I172	Q170-I172 HydrophobicContact CB-CD1 3.94Å; Q170-I172 HydrophobicContact CB-CG1 4.1Å; Q170-I172 PolarHBondContact O-N 3.04Å
171	P	94.8	Very high	93.8	Very high	118 Å²	118	112.4 Å²	112.4	77%	0.766	58%	0.577	S	S	*	*	S	Bend	trans	-76.3	61	-177.8	33.6	-36.9	0	0	0	111.1
172	I	94.3	Very high	93.5	Very high	135 Å²	135	108.4 Å²	108.4	69%	0.692	56%	0.564	S	S	*	*			trans	-124.4	141.1	-177.5	-53.8	173	0	0	0	106.9	Q170	Q170-I172 HydrophobicContact CB-CD1 3.94Å; Q170-I172 HydrophobicContact CB-CG1 4.1Å; Q170-I172 PolarHBondContact O-N 3.04Å
173	A	90.1	Very high	93.2	Very high	73 Å²	73	108 Å²	108	60%	0.603	56%	0.56	S	S	*	*	P	Polyproline II helix	trans	-57.6	154.7	172.9	0	0	0	0	0	111.3
174	P	91.8	Very high	92.9	Very high	119 Å²	119	111.3 Å²	111.3	77%	0.773	57%	0.567	S	S	*	*	P	Polyproline II helix	trans	-56.8	143.9	174.7	24.6	-34.7	0	0	0	110.9	Q176	P174-Q176 PolarHBondContact O-N 2.85Å
175	K	92.6	Very high	92.6	Very high	158 Å²	158	110.3 Å²	110.3	69%	0.687	56%	0.562	S	S	*	*	P	Polyproline II helix	trans	-62.5	120.8	-179.4	-176.6	162.7	173.3	-177.1	0	110.3	Y177	K175-Y177 HydrophobicContact CB-CE2 4.13Å; K175-Y177 HydrophobicContact CD-CE1 4.2Å; K175-Y177 HydrophobicContact CD-CE2 4.37Å; K175-Y177 WeakPolarHBondContact CD-OH 3.39Å; K175-Y177 HydrophobicContact CG-CE1 4.25Å; K175-Y177 HydrophobicContact CG-CE2 3.93Å; K175-Y177 WeakPolarHBondContact O-CD2 3.25Å
176	Q	91.5	Very high	92.4	Very high	107 Å²	107	110.6 Å²	110.6	50%	0.5	56%	0.563	S	S	.	*	P	Polyproline II helix	trans	-80.7	139.7	177.2	-67.3	178.4	-7	0	0	110.6	P174 N199	P174-Q176 PolarHBondContact O-N 2.85Å; Q176-N199 HydrophobicContact CB-CB 4.43Å; Q176-N199 HydrophobicContact CG-CB 4.47Å
177	Y	91.6	Very high	92.2	Very high	81 Å²	81	106.3 Å²	106.3	32%	0.318	56%	0.564	S	S	.	*			trans	-129.3	139.7	178.2	-67.2	-77.8	0	0	0	110.1	K175 N181 L182 N199	K175-Y177 HydrophobicContact CB-CE2 4.13Å; K175-Y177 HydrophobicContact CD-CE1 4.2Å; K175-Y177 HydrophobicContact CD-CE2 4.37Å; K175-Y177 WeakPolarHBondContact CD-OH 3.39Å; K175-Y177 HydrophobicContact CG-CE1 4.25Å; K175-Y177 HydrophobicContact CG-CE2 3.93Å; K175-Y177 WeakPolarHBondContact O-CD2 3.25Å; Y177-N181 VanDerWaalsContact CD2-OD1 3.25Å; Y177-N181 WeakPolarHBondContact CD2-OD1 3.28Å; Y177-L182 HydrophobicContact CD1-CD1 3.54Å; Y177-L182 HydrophobicContact CE1-CD1 4.22Å; Y177-L182 HydrophobicContact CG-CD1 4.03Å; Y177-N199 PolarHBondContact O-ND2 3.29Å
178	P	90.8	Very high	92	Very high	74 Å²	74	103.3 Å²	103.3	48%	0.481	55%	0.548	S	S	.	.	H	α-helix	trans	-71.7	176.2	177.3	31.6	-35.7	0	0	0	112.1	N180 N181 L182	P178-N180 PolarHBondContact O-N 3.39Å; P178-N181 PolarHBondContact O-N 3.33Å; P178-L182 PolarHBondContact O-N 2.96Å
179	Y	89.8	Confident	91.8	Very high	179 Å²	179	100.6 Å²	100.6	70%	0.702	52%	0.524	S	S	*	.	H	α-helix	trans	53.8	54.1	173.7	-50.7	-65.2	0	0	0	114	N181 L182 Y183	Y179-N181 PolarHBondContact O-N 3.35Å; Y179-L182 PolarHBondContact O-N 3.15Å; Y179-Y183 PolarHBondContact O-N 2.93Å
180	N	89.4	Confident	91.5	Very high	52 Å²	52	97 Å²	97	28%	0.278	52%	0.524	S	S	.	.	H	α-helix	trans	51.9	52.5	-178.6	-61.4	-31.1	0	0	0	112.4	P178 P194 V197	P178-N180 PolarHBondContact O-N 3.39Å; N180-P194 HydrophobicContact CB-CB 4.42Å; N180-P194 HydrophobicContact CB-CG 4Å; N180-V197 PolarHBondContact OD1-N 3.22Å
181	N	91.6	Very high	91.1	Very high	74 Å²	74	94.6 Å²	94.6	40%	0.396	53%	0.527	S	S	.	.	H	α-helix	trans	62	38.2	-177.5	-167.2	22.1	0	0	0	114.4	Y177 P178 Y179 K186	Y177-N181 VanDerWaalsContact CD2-OD1 3.25Å; Y177-N181 WeakPolarHBondContact CD2-OD1 3.28Å; P178-N181 PolarHBondContact O-N 3.33Å; Y179-N181 PolarHBondContact O-N 3.35Å; N181-K186 VanDerWaalsContact CG-NZ 3.3Å; N181-K186 WeakPolarHBondContact O-CD 3.4Å; N181-K186 WeakPolarHBondContact O-CE 3.25Å; N181-K186 PolarHBondContact O-NZ 3.35Å; N181-K186 PolarHBondContact OD1-NZ 2.94Å
182	L	91.8	Very high	90.8	Very high	44 Å²	44	95.4 Å²	95.4	23%	0.23	52%	0.519	C	S	.	.	H	α-helix	trans	57.3	47.6	-177.8	-62.8	158.6	0	0	0	111.9	Y177 P178 Y179 L184 E185 K186	Y177-L182 HydrophobicContact CD1-CD1 3.54Å; Y177-L182 HydrophobicContact CE1-CD1 4.22Å; Y177-L182 HydrophobicContact CG-CD1 4.03Å; P178-L182 PolarHBondContact O-N 2.96Å; Y179-L182 PolarHBondContact O-N 3.15Å; L182-L184 PolarHBondContact O-N 3.43Å; L182-E185 VanDerWaalsContact CA-OE2 3.23Å; L182-E185 WeakPolarHBondContact CA-OE2 3.47Å; L182-E185 HydrophobicContact CB-CB 4.25Å; L182-E185 HydrophobicContact CD2-CG 4.32Å; L182-E185 PolarHBondContact O-N 3.3Å; L182-K186 HydrophobicContact CB-CG 4.38Å; L182-K186 WeakPolarHBondContact O-CB 3.45Å; L182-K186 WeakPolarHBondContact O-CG 3.5Å; L182-K186 PolarHBondContact O-N 3.47Å
183	Y	90.3	Very high	90.2	Very high	63 Å²	63	93.8 Å²	93.8	25%	0.247	53%	0.526	C	S	.	.	T	Hydrogen-bonded Turn	trans	-57.3	-47.8	-171.6	176.4	-107.6	0	0	0	112.6	Y179 G188 D189 P194	Y179-Y183 PolarHBondContact O-N 2.93Å; Y183-G188 VanDerWaalsContact CZ-CA 3.48Å; Y183-G188 VanDerWaalsContact O-CA 3.25Å; Y183-G188 WeakPolarHBondContact O-CA 3.31Å; Y183-G188 PolarHBondContact O-N 3.39Å; Y183-D189 WeakPolarHBondContact CE1-O 3.49Å; Y183-D189 PolarHBondContact OH-N 3.46Å; Y183-D189 PolarHBondContact OH-O 2.75Å; Y183-P194 HydrophobicContact CD1-CB 3.87Å; Y183-P194 HydrophobicContact CD1-CG 3.6Å; Y183-P194 HydrophobicContact CD2-CB 3.68Å; Y183-P194 HydrophobicContact CD2-CG 4.29Å; Y183-P194 HydrophobicContact CE1-CB 4.08Å; Y183-P194 HydrophobicContact CE1-CG 4.05Å; Y183-P194 HydrophobicContact CE2-CB 3.91Å; Y183-P194 HydrophobicContact CG-CB 3.65Å; Y183-P194 HydrophobicContact CG-CG 3.72Å
184	L	90.6	Very high	90	Very high	109 Å²	109	92.3 Å²	92.3	57%	0.571	51%	0.51	S	S	*	.	T	Hydrogen-bonded Turn	trans	-70.2	-40	-178.1	-66.6	174.1	0	0	0	111.3	L182 K186 G187 P190	L182-L184 PolarHBondContact O-N 3.43Å; L184-K186 VanDerWaalsContact C-N 3.33Å; L184-K186 PolarHBondContact O-N 2.96Å; L184-G187 PolarHBondContact O-N 3.17Å; L184-P190 HydrophobicContact CD2-CB 4.1Å
185	E	91.3	Very high	89.6	Confident	122 Å²	122	95 Å²	95	57%	0.57	51%	0.513	S	S	*	.	T	Hydrogen-bonded Turn	trans	-72.4	-26.6	-177.8	-57.7	82.2	172.5	0	0	112.6	L182 G187	L182-E185 VanDerWaalsContact CA-OE2 3.23Å; L182-E185 WeakPolarHBondContact CA-OE2 3.47Å; L182-E185 HydrophobicContact CB-CB 4.25Å; L182-E185 HydrophobicContact CD2-CG 4.32Å; L182-E185 PolarHBondContact O-N 3.3Å; E185-G187 VanDerWaalsContact C-N 3.26Å
186	K	92.8	Very high	89.2	Confident	123 Å²	123	94.1 Å²	94.1	54%	0.535	51%	0.511	S	S	.	.	T	Hydrogen-bonded Turn	trans	-85.3	7.7	173.1	-70.8	179.4	-176.2	161.3	0	113.8	N181 L182 L184	N181-K186 VanDerWaalsContact CG-NZ 3.3Å; N181-K186 WeakPolarHBondContact O-CD 3.4Å; N181-K186 WeakPolarHBondContact O-CE 3.25Å; N181-K186 PolarHBondContact O-NZ 3.35Å; N181-K186 PolarHBondContact OD1-NZ 2.94Å; L182-K186 HydrophobicContact CB-CG 4.38Å; L182-K186 WeakPolarHBondContact O-CB 3.45Å; L182-K186 WeakPolarHBondContact O-CG 3.5Å; L182-K186 PolarHBondContact O-N 3.47Å; L184-K186 VanDerWaalsContact C-N 3.33Å; L184-K186 PolarHBondContact O-N 2.96Å
187	G	91.7	Very high	89	Confident	69 Å²	69	92.6 Å²	92.6	71%	0.711	51%	0.509	S	S	*	.	T	Hydrogen-bonded Turn	trans	87.9	24.6	176.6	0	0	0	0	0	114.6	L184 E185	L184-G187 PolarHBondContact O-N 3.17Å; E185-G187 VanDerWaalsContact C-N 3.26Å
188	G	90.4	Very high	88.8	Confident	20 Å²	20	94.7 Å²	94.7	21%	0.206	52%	0.519	C	S	.	.			trans	-63.4	154.3	170.5	0	0	0	0	0	112.7	Y183 P190	Y183-G188 VanDerWaalsContact CZ-CA 3.48Å; Y183-G188 VanDerWaalsContact O-CA 3.25Å; Y183-G188 WeakPolarHBondContact O-CA 3.31Å; Y183-G188 PolarHBondContact O-N 3.39Å; G188-P190 WeakPolarHBondContact O-CD 3.4Å
189	D	90.7	Very high	88.6	Confident	65 Å²	65	94.4 Å²	94.4	35%	0.348	51%	0.514	S	S	.	.			trans	-78.4	115.3	-178.1	-177.1	-3.6	0	0	0	110	Y183 A191 K192	Y183-D189 WeakPolarHBondContact CE1-O 3.49Å; Y183-D189 PolarHBondContact OH-N 3.46Å; Y183-D189 PolarHBondContact OH-O 2.75Å; D189-A191 PolarHBondContact O-N 3.12Å; D189-A191 VanDerWaalsContact O-N 3.11Å; D189-A191 WeakPolarHBondContact OD1-CB 3.43Å; D189-A191 PolarHBondContact OD1-N 2.87Å; D189-A191 VanDerWaalsContact OD1-N 3.1Å; D189-K192 HydrophobicContact CB-CB 4.47Å; D189-K192 HydrophobicContact CB-CD 4.32Å; D189-K192 HydrophobicContact CB-CG 4.47Å; D189-K192 PolarHBondContact O-N 3.19Å; D189-K192 VanDerWaalsContact O-N 3.08Å; D189-K192 WeakPolarHBondContact OD2-CD 3.31Å; D189-K192 VanDerWaalsContact OD2-CE 3.28Å; D189-K192 WeakPolarHBondContact OD2-CE 3.43Å; D189-K192 IonicContact OD2-NZ 2.8Å
190	P	88.2	Confident	88.5	Confident	112 Å²	112	94 Å²	94	73%	0.727	51%	0.512	S	S	*	.	T	Hydrogen-bonded Turn	trans	-65.6	-17	-176.9	28.4	-36.1	0	0	0	113.1	L184 G188 K192	L184-P190 HydrophobicContact CD2-CB 4.1Å; G188-P190 WeakPolarHBondContact O-CD 3.4Å; P190-K192 VanDerWaalsContact C-N 3.29Å
191	A	88.3	Confident	88.3	Confident	89 Å²	89	101.2 Å²	101.2	74%	0.736	54%	0.544	S	S	*	.	T	Hydrogen-bonded Turn	trans	-80.2	-10.7	177.8	0	0	0	0	0	113.3	D189	D189-A191 PolarHBondContact O-N 3.12Å; D189-A191 VanDerWaalsContact O-N 3.11Å; D189-A191 WeakPolarHBondContact OD1-CB 3.43Å; D189-A191 PolarHBondContact OD1-N 2.87Å; D189-A191 VanDerWaalsContact OD1-N 3.1Å
192	K	86.9	Confident	87.8	Confident	135 Å²	135	108.2 Å²	108.2	59%	0.587	58%	0.58	S	S	*	*	S	Bend	trans	-116.4	130.3	-177.4	-65.6	176.6	-173	164	0	109.8	D189 P190 P194	D189-K192 HydrophobicContact CB-CB 4.47Å; D189-K192 HydrophobicContact CB-CD 4.32Å; D189-K192 HydrophobicContact CB-CG 4.47Å; D189-K192 PolarHBondContact O-N 3.19Å; D189-K192 VanDerWaalsContact O-N 3.08Å; D189-K192 WeakPolarHBondContact OD2-CD 3.31Å; D189-K192 VanDerWaalsContact OD2-CE 3.28Å; D189-K192 WeakPolarHBondContact OD2-CE 3.43Å; D189-K192 IonicContact OD2-NZ 2.8Å; P190-K192 VanDerWaalsContact C-N 3.29Å; K192-P194 VanDerWaalsContact O-CD 3.31Å; K192-P194 WeakPolarHBondContact O-CD 3.32Å
193	A	81.6	Confident	87.6	Confident	102 Å²	102	111.5 Å²	111.5	84%	0.843	60%	0.597	S	S	*	*	P	Polyproline II helix	trans	-71.1	119.3	171.5	0	0	0	0	0	108.8
194	P	86.3	Confident	87.4	Confident	41 Å²	41	114 Å²	114	27%	0.266	62%	0.615	S	S	.	*	P	Polyproline II helix	trans	-70.1	161.2	173	31.2	-36.1	0	0	0	110.6	N180 Y183 K192 E196	N180-P194 HydrophobicContact CB-CB 4.42Å; N180-P194 HydrophobicContact CB-CG 4Å; Y183-P194 HydrophobicContact CD1-CB 3.87Å; Y183-P194 HydrophobicContact CD1-CG 3.6Å; Y183-P194 HydrophobicContact CD2-CB 3.68Å; Y183-P194 HydrophobicContact CD2-CG 4.29Å; Y183-P194 HydrophobicContact CE1-CB 4.08Å; Y183-P194 HydrophobicContact CE1-CG 4.05Å; Y183-P194 HydrophobicContact CE2-CB 3.91Å; Y183-P194 HydrophobicContact CG-CB 3.65Å; Y183-P194 HydrophobicContact CG-CG 3.72Å; K192-P194 VanDerWaalsContact O-CD 3.31Å; K192-P194 WeakPolarHBondContact O-CD 3.32Å; P194-E196 PolarHBondContact O-N 3.02Å
195	E	83.6	Confident	87.2	Confident	177 Å²	177	114.3 Å²	114.3	83%	0.827	62%	0.618	S	S	*	*	P	Polyproline II helix	trans	-59.4	135.7	170.7	-64.2	-177	171.2	0	0	110.5	V197	E195-V197 PolarHBondContact O-N 3.47Å
196	E	84.3	Confident	87	Confident	139 Å²	139	113.8 Å²	113.8	65%	0.65	62%	0.621	S	S	*	*			trans	-71.3	112	-178.3	-71	-171.8	-180	0	0	111	P194 K198	P194-E196 PolarHBondContact O-N 3.02Å; E196-K198 WeakPolarHBondContact OE2-CE 3.5Å; E196-K198 IonicContact OE2-NZ 2.74Å; E196-K198 PolarHBondContact OE2-NZ 2.8Å
197	V	88.1	Confident	86.7	Confident	75 Å²	75	113.3 Å²	113.3	46%	0.455	63%	0.626	S	S	.	*			trans	-102.3	103.2	173.9	-176.2	0	0	0	0	108.7	N180 E195	N180-V197 PolarHBondContact OD1-N 3.22Å; E195-V197 PolarHBondContact O-N 3.47Å
198	K	85.6	Confident	86.3	Confident	125 Å²	125	116.2 Å²	116.2	54%	0.543	62%	0.62	S	S	.	*			trans	-94.4	124	179.4	-66.1	177.6	-176.4	162.8	0	110.5	E196 Y200	E196-K198 WeakPolarHBondContact OE2-CE 3.5Å; E196-K198 IonicContact OE2-NZ 2.74Å; E196-K198 PolarHBondContact OE2-NZ 2.8Å; K198-Y200 HydrophobicContact CB-CE2 3.94Å; K198-Y200 WeakPolarHBondContact CD-OH 3.05Å
199	N	88.5	Confident	86	Confident	68 Å²	68	123.1 Å²	123.1	36%	0.364	65%	0.65	S	S	.	*			trans	-101.6	127.2	170.6	-56.1	-47.2	0	0	0	108.1	Q176 Y177	Q176-N199 HydrophobicContact CB-CB 4.43Å; Q176-N199 HydrophobicContact CG-CB 4.47Å; Y177-N199 PolarHBondContact O-ND2 3.29Å
200	Y	85.9	Confident	85.7	Confident	169 Å²	169	127.5 Å²	127.5	66%	0.663	67%	0.673	S	S	*	*			trans	-107.7	151.6	177.2	-58.9	-79.4	0	0	0	110.1	K198	K198-Y200 HydrophobicContact CB-CE2 3.94Å; K198-Y200 WeakPolarHBondContact CD-OH 3.05Å
201	E	85.3	Confident	85.5	Confident	204 Å²	204	128.8 Å²	128.8	95%	0.953	67%	0.669	S	S	*	*			trans	-70.1	137.1	171.1	-64.2	-178	175	0	0	109.7
202	I	81.1	Confident	85.2	Confident	222 Å²	222	132.5 Å²	132.5	100%	1.138	66%	0.663	S	S	*	*			trans	-103.1	0	-179	-61.1	166.3	0	0	0	109.1

Retrieved 202 of 202 residues in 190.5 ms (Link to these results)

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