A0A087X656_POEFO Loading...

Cyclin Y

AlphaFold DB , UniProt , Accession A0A087X656, Species POEFO (Poecilia formosa, Amazon molly), Gene n/a, Length 348 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	33.9	Very low	34.7	Very low	247 Å²	247	132.6 Å²	132.6	100%	1.217	84%	0.841	S	S	*	*				0	127.7	0	-70.6	-173.4	-167.6	0	0	107.6
2	G	34	Very low	34.5	Very low	69 Å²	69	130.9 Å²	130.9	71%	0.711	84%	0.836	S	S	*	*			trans	52.4	107.7	164.4	0	0	0	0	0	118.8
3	N	30.6	Very low	34.3	Very low	157 Å²	157	130.8 Å²	130.8	84%	0.84	84%	0.837	S	S	*	*				-179.6	147	101.6	-99.8	2.8	0	0	0	113.8
4	T	39.8	Very low	34	Very low	124 Å²	124	136.1 Å²	136.1	76%	0.761	84%	0.841	S	S	*	*			trans	-35.4	138.9	169	51.1	0	0	0	0	118.8
5	T	40.2	Very low	33.7	Very low	137 Å²	137	140.3 Å²	140.3	84%	0.84	85%	0.846	S	S	*	*			trans	-142.4	102.9	155.2	48	0	0	0	0	108
6	S	37.4	Very low	33.5	Very low	116 Å²	116	146.6 Å²	146.6	81%	0.811	85%	0.85	S	S	*	*				60.3	105	89.8	-173.9	0	0	0	0	114.9
7	C	34.2	Very low	33.3	Very low	119 Å²	119	152.8 Å²	152.8	80%	0.804	86%	0.856	S	S	*	*			trans	-66	148.6	164.4	-58.8	0	0	0	0	111.7
8	C	35.5	Very low	32.9	Very low	124 Å²	124	151.1 Å²	151.1	84%	0.838	86%	0.856	S	S	*	*			trans	-164.4	128.1	143	-96.3	0	0	0	0	110.4
9	V	32.8	Very low	32.7	Very low	138 Å²	138	149.7 Å²	149.7	84%	0.836	85%	0.846	S	S	*	*			trans	-84.6	130	176.5	171.7	0	0	0	0	108.7
10	S	31.1	Very low	32.6	Very low	116 Å²	116	151 Å²	151	81%	0.811	84%	0.844	S	S	*	*			trans	-107.7	118.2	175.8	-51.7	0	0	0	0	110.2
11	S	32.2	Very low	32.5	Very low	112 Å²	112	149.6 Å²	149.6	78%	0.783	84%	0.844	S	S	*	*	P	Polyproline II helix	trans	-84.6	135.9	178.9	-51.4	0	0	0	0	112.1
12	S	32.7	Very low	32.2	Very low	112 Å²	112	149.9 Å²	149.9	78%	0.783	83%	0.832	S	S	*	*	P	Polyproline II helix	trans	-69.6	148.1	172.1	-59.2	0	0	0	0	112.4
13	P	31.5	Very low	32	Very low	130 Å²	130	154.1 Å²	154.1	84%	0.844	84%	0.837	S	S	*	*	P	Polyproline II helix	trans	-82.4	142.3	-169	31.6	-33.4	0	0	0	113.9
14	K	29.9	Very low	32.1	Very low	204 Å²	204	153.4 Å²	153.4	89%	0.887	83%	0.829	S	S	*	*	P	Polyproline II helix	trans	-91.1	123	175.2	-66.4	178.2	178.1	178.2	0	110.7	R16	K14-R16 PolarHBondContact O-N 2.84Å
15	H	29.8	Very low	31.7	Very low	200 Å²	200	153.7 Å²	153.7	93%	0.926	83%	0.833	S	S	*	*	P	Polyproline II helix	trans	-75.7	118.4	168.5	-107.1	-68	0	0	0	110.9
16	R	30.1	Very low	30.9	Very low	240 Å²	240	155.7 Å²	155.7	91%	0.906	83%	0.826	S	S	*	*	P	Polyproline II helix	trans	-92.3	132.6	169.5	-84.4	-177.3	169.7	-179.2	-2.8	110.4	K14	K14-R16 PolarHBondContact O-N 2.84Å
17	R	30.4	Very low	30.6	Very low	252 Å²	252	160.4 Å²	160.4	95%	0.951	83%	0.827	S	S	*	*	P	Polyproline II helix	trans	-81.8	146.4	165	-75	177.6	169.9	172.9	-3.8	110.3
18	S	26.8	Very low	30.6	Very low	122 Å²	122	159 Å²	159	85%	0.853	82%	0.816	S	S	*	*			trans	-140.1	150.8	169.8	178.3	0	0	0	0	109.5
19	N	27.9	Very low	30.3	Very low	126 Å²	126	161.3 Å²	161.3	67%	0.674	81%	0.814	S	S	*	*			trans	-102.7	166.8	-153.9	-63.1	-20.1	0	0	0	116.5
20	H	30.5	Very low	30.4	Very low	175 Å²	175	160.1 Å²	160.1	81%	0.81	81%	0.81	S	S	*	*			trans	89	116.4	140.7	-71	-56.4	0	0	0	123.4
21	S	30.5	Very low	30.5	Very low	121 Å²	121	163.3 Å²	163.3	85%	0.846	81%	0.811	S	S	*	*				172.5	138.5	121.7	48.2	0	0	0	0	107.6
22	R	29.5	Very low	30.4	Very low	254 Å²	254	166.2 Å²	166.2	96%	0.958	82%	0.817	S	S	*	*			cis	-168.8	156.9	36.1	-170.8	176.6	-172.1	175.3	1.7	109.1
23	L	29.8	Very low	30.2	Very low	157 Å²	157	165.8 Å²	165.8	82%	0.822	81%	0.814	S	S	*	*			trans	-94.2	142.5	-164.9	-72.5	160.8	0	0	0	117.2
24	E	31.3	Very low	30.4	Very low	142 Å²	142	171.2 Å²	171.2	66%	0.664	82%	0.818	S	S	*	*			trans	65.8	148.3	132.4	-72.2	-57.2	136.7	0	0	123.1	Y26	E24-Y26 PolarHBondContact OE2-N 3.23Å
25	P	31.2	Very low	30.8	Very low	130 Å²	130	170.6 Å²	170.6	84%	0.844	82%	0.818	S	S	*	*				-143.9	139.2	51.2	37.2	-14.6	0	0	0	121.8
26	Y	24.7	Very low	31	Very low	179 Å²	179	168.3 Å²	168.3	70%	0.702	81%	0.813	S	S	*	*			trans	-9.1	134.9	147.1	-155	-119.4	0	0	0	124.1	E24	E24-Y26 PolarHBondContact OE2-N 3.23Å
27	R	29.8	Very low	31.4	Very low	216 Å²	216	163.7 Å²	163.7	82%	0.815	81%	0.811	S	S	*	*				150.5	156.4	126.7	-86.5	-158.1	174.8	-179.9	-0.6	115.1
28	P	34.9	Very low	31.6	Very low	90 Å²	90	154.7 Å²	154.7	58%	0.584	80%	0.798	S	S	*	*				-141.5	171.5	-67.2	40.9	-18.9	0	0	0	115.9
29	E	28.7	Very low	32.5	Very low	172 Å²	172	154.8 Å²	154.8	80%	0.804	80%	0.797	S	S	*	*			trans	75.2	156.8	158.4	-58.4	-74.3	142.8	0	0	121.1
30	P	34.4	Very low	33.2	Very low	113 Å²	113	156.2 Å²	156.2	73%	0.734	80%	0.804	S	S	*	*			cis	-129.2	175.9	-23.3	28.5	-6	0	0	0	114.6
31	E	33.8	Very low	34.2	Very low	182 Å²	182	156.1 Å²	156.1	85%	0.85	81%	0.809	S	S	*	*			trans	-44.5	138.7	-175.9	-56.8	172.2	146.9	0	0	118.7
32	L	30.2	Very low	35.2	Very low	173 Å²	173	157.5 Å²	157.5	91%	0.906	80%	0.802	S	S	*	*			trans	-136.9	113.7	144.9	-85.5	171.8	0	0	0	110.6
33	S	28	Very low	36.3	Very low	103 Å²	103	151.7 Å²	151.7	72%	0.72	79%	0.785	S	S	*	*			trans	11.7	118.2	161.5	54.6	0	0	0	0	119.5	E35	S33-E35 PolarHBondContact O-N 3.41Å
34	R	37.3	Very low	37.4	Very low	245 Å²	245	151.8 Å²	151.8	93%	0.925	79%	0.785	S	S	*	*			trans	-64.5	105.9	154.1	-73.8	173.7	162.3	174.9	-4.5	109.5
35	E	36.5	Very low	38.2	Very low	190 Å²	190	148.6 Å²	148.6	89%	0.888	78%	0.779	S	S	*	*			trans	-162.2	142	145.2	-107.8	161.8	-154.6	0	0	107.5	S33	S33-E35 PolarHBondContact O-N 3.41Å
36	D	35.6	Very low	39.1	Very low	152 Å²	152	146.8 Å²	146.8	81%	0.813	76%	0.762	S	S	*	*			trans	87.1	77.5	169.4	-133.6	17.5	0	0	0	118.5
37	T	37.8	Very low	40.8	Very low	143 Å²	143	148.8 Å²	148.8	88%	0.877	77%	0.768	S	S	*	*			trans	-142.9	65.8	144.5	-43.8	0	0	0	0	108.9	C39	T37-C39 PolarHBondContact O-N 2.93Å
38	G	35.3	Very low	41.9	Very low	64 Å²	64	147 Å²	147	66%	0.66	77%	0.769	S	S	*	*			trans	-82.6	95.4	163.6	0	0	0	0	0	109.3	N40	G38-N40 VanDerWaalsContact C-N 3.34Å; G38-N40 PolarHBondContact O-N 3.49Å
39	C	45.2	Very low	42.7	Very low	124 Å²	124	148.7 Å²	148.7	84%	0.838	77%	0.773	S	S	*	*			trans	-66.6	92	169	45.4	0	0	0	0	109.8	T37	T37-C39 PolarHBondContact O-N 2.93Å
40	N	41.8	Very low	43.4	Very low	156 Å²	156	148.2 Å²	148.2	83%	0.834	77%	0.774	S	S	*	*			trans	-108.4	96.8	176.8	-141.3	-14.8	0	0	0	108.6	G38 Q42	G38-N40 VanDerWaalsContact C-N 3.34Å; G38-N40 PolarHBondContact O-N 3.49Å; N40-Q42 PolarHBondContact O-N 3.41Å
41	L	51.3	Low	44.2	Very low	172 Å²	172	148 Å²	148	90%	0.901	77%	0.767	S	S	*	*			trans	-79.6	110.8	172.8	-84.9	159.9	0	0	0	108.4
42	Q	52.5	Low	44.7	Very low	150 Å²	150	146.9 Å²	146.9	70%	0.701	77%	0.767	S	S	*	*			trans	-68.5	131.3	-178.3	-161.6	167.9	6.1	0	0	111.1	N40 D46	N40-Q42 PolarHBondContact O-N 3.41Å; Q42-D46 HydrophobicContact CG-CB 4.03Å; Q42-D46 PolarHBondContact NE2-O 3.26Å
43	H	51.7	Low	45.1	Very low	132 Å²	132	144.8 Å²	144.8	61%	0.611	76%	0.756	S	S	*	*			trans	-82.2	151.1	-178.1	-163.6	-103.8	0	0	0	110.5	S45 D46	H43-S45 PolarHBondContact ND1-OG 2.65Å; H43-S45 PolarHBondContact O-N 3.07Å; H43-S45 VanDerWaalsContact O-N 3.08Å; H43-D46 WeakPolarHBondContact CB-OD2 3.37Å; H43-D46 PolarHBondContact N-OD2 2.8Å; H43-D46 WeakPolarHBondContact O-CB 3.39Å; H43-D46 PolarHBondContact O-N 2.65Å
44	I	53.2	Low	45.7	Very low	160 Å²	160	146.4 Å²	146.4	82%	0.821	76%	0.764	S	S	*	*	G	3₁₀ helix	trans	-60.9	-25	-173	-63.4	170	0	0	0	112.6	D46	I44-D46 VanDerWaalsContact C-N 3.26Å; I44-D46 PolarHBondContact O-N 3.08Å
45	S	49.1	Very low	46	Very low	75 Å²	75	142.2 Å²	142.2	52%	0.524	76%	0.757	S	S	.	*	G	3₁₀ helix	trans	-69.2	-19.5	173.4	50.5	0	0	0	0	114.3	H43 R47	H43-S45 PolarHBondContact ND1-OG 2.65Å; H43-S45 PolarHBondContact O-N 3.07Å; H43-S45 VanDerWaalsContact O-N 3.08Å; S45-R47 VanDerWaalsContact C-N 3.29Å; S45-R47 PolarHBondContact O-N 3.49Å
46	D	49.1	Very low	46.9	Very low	91 Å²	91	141.5 Å²	141.5	49%	0.487	75%	0.753	S	S	.	*	G	3₁₀ helix	trans	-97.5	15.9	-168.5	-49.1	-18.6	0	0	0	111.5	Q42 H43 I44	Q42-D46 HydrophobicContact CG-CB 4.03Å; Q42-D46 PolarHBondContact NE2-O 3.26Å; H43-D46 WeakPolarHBondContact CB-OD2 3.37Å; H43-D46 PolarHBondContact N-OD2 2.8Å; H43-D46 WeakPolarHBondContact O-CB 3.39Å; H43-D46 PolarHBondContact O-N 2.65Å; I44-D46 VanDerWaalsContact C-N 3.26Å; I44-D46 PolarHBondContact O-N 3.08Å
47	R	60.2	Low	48.3	Very low	221 Å²	221	141.1 Å²	141.1	83%	0.834	74%	0.742	S	S	*	*			trans	-101.2	20.1	-176.3	-145	178.6	-174.9	137.9	-0.4	112.9	S45	S45-R47 VanDerWaalsContact C-N 3.29Å; S45-R47 PolarHBondContact O-N 3.49Å
48	E	54	Low	50.3	Low	178 Å²	178	135.1 Å²	135.1	83%	0.832	70%	0.704	S	S	*	*			trans	-91.8	130.9	174.9	-68.2	-169.2	164.5	0	0	111.5
49	N	51.1	Low	52.6	Low	127 Å²	127	134 Å²	134	68%	0.679	69%	0.686	S	S	*	*			trans	73.3	81.4	174.2	-69.4	-3.8	0	0	0	118.9	D51	N49-D51 VanDerWaalsContact CG-OD2 3.22Å; N49-D51 PolarHBondContact ND2-OD2 2.69Å; N49-D51 PolarHBondContact O-N 3.24Å; N49-D51 PolarHBondContact OD1-OD2 3.33Å
50	I	44.4	Very low	54.4	Low	161 Å²	161	128.1 Å²	128.1	83%	0.826	65%	0.646	S	S	*	*			trans	-88.3	69.5	137.9	-59.7	174.1	0	0	0	106.4
51	D	49.7	Very low	56.5	Low	109 Å²	109	122.9 Å²	122.9	58%	0.583	62%	0.618	S	S	*	*			trans	-85	116.7	160	-77.6	-35.3	0	0	0	105.5	N49	N49-D51 VanDerWaalsContact CG-OD2 3.22Å; N49-D51 PolarHBondContact ND2-OD2 2.69Å; N49-D51 PolarHBondContact O-N 3.24Å; N49-D51 PolarHBondContact OD1-OD2 3.33Å
52	D	44.1	Very low	58.1	Low	159 Å²	159	117.7 Å²	117.7	85%	0.85	59%	0.588	S	S	*	*			trans	142	32.7	163.5	-71.3	-21.7	0	0	0	114.3
53	L	39	Very low	59.5	Low	128 Å²	128	113 Å²	113	67%	0.67	57%	0.571	S	S	*	*	S	Bend	trans	-109.6	142	147.2	-71	169.8	0	0	0	107.4	M55	L53-M55 PolarHBondContact O-N 2.68Å
54	P	40.5	Very low	60.9	Low	137 Å²	137	117.4 Å²	117.4	89%	0.89	58%	0.583	S	S	*	*			trans	-70.2	76.1	173.5	30.1	-30.9	0	0	0	107.9	E56	P54-E56 PolarHBondContact O-N 3.36Å
55	M	44.8	Very low	62.4	Low	157 Å²	157	110.7 Å²	110.7	77%	0.773	55%	0.551	S	S	*	*			trans	-73.2	118.9	178.4	-164.1	165.3	-80.6	0	0	106.5	L53 Y57	L53-M55 PolarHBondContact O-N 2.68Å; M55-Y57 PolarHBondContact O-N 2.82Å
56	E	53.7	Low	64.2	Low	175 Å²	175	109.9 Å²	109.9	82%	0.818	55%	0.545	S	S	*	.			trans	-49.6	125.2	175.7	-152.2	166	-165.1	0	0	109.1	P54 N58	P54-E56 PolarHBondContact O-N 3.36Å; E56-N58 PolarHBondContact O-N 3.36Å
57	Y	66.1	Low	66.2	Low	144 Å²	144	105.6 Å²	105.6	57%	0.565	52%	0.522	S	S	*	.			trans	-68.5	95.1	-164.3	-170.3	-98.1	0	0	0	111.1	M55 P59 H62 A65	M55-Y57 PolarHBondContact O-N 2.82Å; Y57-P59 VanDerWaalsContact O-CD 3.26Å; Y57-P59 WeakPolarHBondContact O-CD 3.39Å; Y57-H62 HydrophobicContact CE1-CB 4.07Å; Y57-H62 HydrophobicContact CE2-CB 4.41Å; Y57-H62 AromaticContact CE2-CD2 3.41Å; Y57-H62 VanDerWaalsContact CE2-CD2 3.41Å; Y57-H62 WeakPolarHBondContact CE2-CD2 3.39Å; Y57-H62 AromaticContact CE2-CG 3.89Å; Y57-H62 AromaticContact CE2-NE2 3.83Å; Y57-H62 AromaticContact CZ-CD2 3.41Å; Y57-H62 VanDerWaalsContact CZ-CD2 3.41Å; Y57-H62 AromaticContact CZ-CG 3.4Å; Y57-H62 AromaticContact CZ-ND1 3.78Å; Y57-H62 AromaticContact CZ-NE2 3.78Å; Y57-H62 PolarHBondContact OH-CD2 3.27Å; Y57-H62 PolarHBondContact OH-CE1 3.27Å; Y57-H62 PolarHBondContact OH-ND1 3.25Å; Y57-H62 PolarHBondContact OH-NE2 3.46Å; Y57-A65 HydrophobicContact CE1-CB 4.1Å
58	N	79.6	Confident	67.8	Low	18 Å²	18	96.6 Å²	96.6	10%	0.096	49%	0.49	C	S	.	.			trans	-71.4	117.8	178.6	-173.6	-19.3	0	0	0	110.7	E56 S60 D61 T209 Y210	E56-N58 PolarHBondContact O-N 3.36Å; N58-S60 PolarHBondContact O-N 3.47Å; N58-S60 WeakPolarHBondContact OD1-CB 3.46Å; N58-S60 PolarHBondContact OD1-N 2.87Å; N58-S60 PolarHBondContact OD1-OG 3.44Å; N58-D61 PolarHBondContact O-N 2.87Å; N58-T209 HydrophobicContact CB-CG2 4.18Å; N58-T209 VanDerWaalsContact CG-CG2 3.47Å; N58-T209 WeakPolarHBondContact ND2-CB 3.45Å; N58-T209 VanDerWaalsContact ND2-CG2 3.28Å; N58-T209 WeakPolarHBondContact ND2-CG2 3.39Å; N58-Y210 HydrophobicContact CB-CE1 4.21Å; N58-Y210 VanDerWaalsContact ND2-CD1 3.29Å; N58-Y210 WeakPolarHBondContact ND2-CD1 3.38Å; N58-Y210 WeakPolarHBondContact ND2-CE1 3.43Å
59	P	83.3	Confident	69.6	Low	41 Å²	41	88.1 Å²	88.1	27%	0.266	45%	0.451	S	S	.	.	T	Hydrogen-bonded Turn	trans	-57.1	-31.5	177.9	-23.7	34.5	0	0	0	113.7	Y57 D61 H62 A65 S66 I68 K281	Y57-P59 VanDerWaalsContact O-CD 3.26Å; Y57-P59 WeakPolarHBondContact O-CD 3.39Å; P59-D61 VanDerWaalsContact C-N 3.27Å; P59-D61 PolarHBondContact O-N 3.11Å; P59-H62 PolarHBondContact O-N 3.03Å; P59-A65 HydrophobicContact CB-CB 3.93Å; P59-S66 WeakPolarHBondContact CB-O 3.4Å; P59-I68 HydrophobicContact CB-CG1 4.27Å; P59-I68 HydrophobicContact CG-CG1 4.39Å; P59-K281 PolarHBondContact O-NZ 3.14Å
60	S	84.3	Confident	71.5	Confident	0 Å²	0	83.3 Å²	83.3	0%	0	43%	0.425	C	S	.	.	T	Hydrogen-bonded Turn	trans	-67.9	-24.6	-176.4	-60.6	0	0	0	0	113.9	N58 E205 V278 Y282	N58-S60 PolarHBondContact O-N 3.47Å; N58-S60 WeakPolarHBondContact OD1-CB 3.46Å; N58-S60 PolarHBondContact OD1-N 2.87Å; N58-S60 PolarHBondContact OD1-OG 3.44Å; S60-E205 WeakPolarHBondContact OG-CB 3.36Å; S60-V278 WeakPolarHBondContact O-CG1 3.49Å; S60-Y282 WeakPolarHBondContact CA-OH 3.36Å; S60-Y282 VanDerWaalsContact CB-OH 3.29Å; S60-Y282 WeakPolarHBondContact CB-OH 3.24Å; S60-Y282 PolarHBondContact OG-OH 3.08Å; S60-Y282 VanDerWaalsContact OG-OH 3.06Å
61	D	84.8	Confident	73.7	Confident	46 Å²	46	78.5 Å²	78.5	25%	0.246	41%	0.406	C	S	.	.	T	Hydrogen-bonded Turn	trans	-92.2	-20.3	178.5	-62.4	-51.8	0	0	0	113	N58 P59 R206 Y210 N271 V278	N58-D61 PolarHBondContact O-N 2.87Å; P59-D61 VanDerWaalsContact C-N 3.27Å; P59-D61 PolarHBondContact O-N 3.11Å; D61-R206 IonicContact OD1-CZ 3.71Å; D61-R206 VanDerWaalsContact OD1-CZ 3.23Å; D61-R206 IonicContact OD1-NE 3.24Å; D61-R206 PolarHBondContact OD1-NE 3.09Å; D61-R206 IonicContact OD1-NH2 2.69Å; D61-R206 PolarHBondContact OD1-NH2 2.98Å; D61-Y210 PolarHBondContact OD1-OH 3.32Å; D61-Y210 WeakPolarHBondContact OD2-CE1 3.48Å; D61-Y210 PolarHBondContact OD2-OH 2.91Å; D61-N271 PolarHBondContact OD1-ND2 3.22Å; D61-V278 WeakPolarHBondContact O-CG2 3.38Å
62	H	85	Confident	75.6	Confident	62 Å²	62	74.6 Å²	74.6	29%	0.287	38%	0.384	S	S	.	.			trans	-99.8	120.8	-172	-155.2	-77.1	0	0	0	112.7	Y57 P59 R64 A65 K281	Y57-H62 HydrophobicContact CE1-CB 4.07Å; Y57-H62 HydrophobicContact CE2-CB 4.41Å; Y57-H62 AromaticContact CE2-CD2 3.41Å; Y57-H62 VanDerWaalsContact CE2-CD2 3.41Å; Y57-H62 WeakPolarHBondContact CE2-CD2 3.39Å; Y57-H62 AromaticContact CE2-CG 3.89Å; Y57-H62 AromaticContact CE2-NE2 3.83Å; Y57-H62 AromaticContact CZ-CD2 3.41Å; Y57-H62 VanDerWaalsContact CZ-CD2 3.41Å; Y57-H62 AromaticContact CZ-CG 3.4Å; Y57-H62 AromaticContact CZ-ND1 3.78Å; Y57-H62 AromaticContact CZ-NE2 3.78Å; Y57-H62 PolarHBondContact OH-CD2 3.27Å; Y57-H62 PolarHBondContact OH-CE1 3.27Å; Y57-H62 PolarHBondContact OH-ND1 3.25Å; Y57-H62 PolarHBondContact OH-NE2 3.46Å; P59-H62 PolarHBondContact O-N 3.03Å; H62-R64 PolarHBondContact ND1-N 3.24Å; H62-R64 PolarHBondContact O-N 2.89Å; H62-R64 VanDerWaalsContact O-N 3.13Å; H62-A65 HydrophobicContact CB-CB 4.17Å; H62-A65 PolarHBondContact O-N 3.5Å; H62-K281 WeakPolarHBondContact O-CD 3.39Å; H62-K281 PolarHBondContact O-NZ 3.29Å
63	P	81.9	Confident	77.8	Confident	52 Å²	52	67.2 Å²	67.2	34%	0.338	34%	0.344	S	S	.	.	T	Hydrogen-bonded Turn	trans	-68	-18.3	-174.2	27	-35.9	0	0	0	114.4
64	R	81.7	Confident	79.7	Confident	225 Å²	225	66.7 Å²	66.7	85%	0.849	34%	0.338	S	S	*	.	T	Hydrogen-bonded Turn	trans	-96.3	-13	178.8	-61.6	-178.9	67.5	178.5	0.6	114.4	H62	H62-R64 PolarHBondContact ND1-N 3.24Å; H62-R64 PolarHBondContact O-N 2.89Å; H62-R64 VanDerWaalsContact O-N 3.13Å
65	A	85.2	Confident	81	Confident	19 Å²	19	63.9 Å²	63.9	16%	0.157	32%	0.319	C	S	.	.	S	Bend	trans	-74.5	155.7	175.1	0	0	0	0	0	109.6	Y57 P59 H62 K281	Y57-A65 HydrophobicContact CE1-CB 4.1Å; P59-A65 HydrophobicContact CB-CB 3.93Å; H62-A65 HydrophobicContact CB-CB 4.17Å; H62-A65 PolarHBondContact O-N 3.5Å; A65-K281 VanDerWaalsContact O-CD 3.23Å; A65-K281 WeakPolarHBondContact O-CD 3.48Å; A65-K281 WeakPolarHBondContact O-CE 3.41Å; A65-K281 PolarHBondContact O-NZ 3.14Å
66	S	85.4	Confident	81.9	Confident	58 Å²	58	57.1 Å²	57.1	41%	0.406	29%	0.286	S	S	.	.	P	Polyproline II helix	trans	-67.8	151.7	165.8	-179	0	0	0	0	109.9	P59 K281	P59-S66 WeakPolarHBondContact CB-O 3.4Å; S66-K281 PolarHBondContact O-NZ 3.48Å
67	T	92.1	Very high	82.2	Confident	1 Å²	1	49.6 Å²	49.6	1%	0.006	25%	0.252	C	S	.	.	P	Polyproline II helix	trans	-68.7	156	165	57.3	0	0	0	0	111.5	F69 L70 S71 K281 Y282 D285	T67-F69 HydrophobicContact CG2-CD1 4.15Å; T67-F69 HydrophobicContact CG2-CE1 3.54Å; T67-F69 HydrophobicContact CG2-CZ 4.14Å; T67-F69 VanDerWaalsContact OG1-CD1 3.31Å; T67-F69 WeakPolarHBondContact OG1-CD1 3.34Å; T67-F69 WeakPolarHBondContact OG1-CE1 2.99Å; T67-F69 WeakPolarHBondContact OG1-CZ 3.49Å; T67-L70 PolarHBondContact O-N 2.8Å; T67-L70 VanDerWaalsContact OG1-CB 3.24Å; T67-L70 WeakPolarHBondContact OG1-CB 3.23Å; T67-S71 PolarHBondContact O-N 3.21Å; T67-K281 HydrophobicContact CG2-CD 4.48Å; T67-K281 HydrophobicContact CG2-CG 4.37Å; T67-Y282 HydrophobicContact CG2-CD1 3.77Å; T67-Y282 HydrophobicContact CG2-CD2 3.92Å; T67-Y282 HydrophobicContact CG2-CE1 3.69Å; T67-Y282 HydrophobicContact CG2-CE2 3.89Å; T67-Y282 HydrophobicContact CG2-CG 3.86Å; T67-D285 HydrophobicContact CG2-CB 4.09Å; T67-D285 VanDerWaalsContact CG2-OD2 3.3Å; T67-D285 WeakPolarHBondContact CG2-OD2 3.39Å; T67-D285 PolarHBondContact N-OD2 3.39Å; T67-D285 PolarHBondContact OG1-OD2 3.41Å
68	I	92.3	Very high	81.8	Confident	31 Å²	31	51.1 Å²	51.1	16%	0.159	26%	0.256	C	S	.	.	H	α-helix	trans	-72.9	-36.7	-177.4	-53.4	174.5	0	0	0	110.1	P59 L70 S71 K72 E205 T209	P59-I68 HydrophobicContact CB-CG1 4.27Å; P59-I68 HydrophobicContact CG-CG1 4.39Å; I68-L70 PolarHBondContact O-N 3.37Å; I68-S71 PolarHBondContact O-N 3.1Å; I68-S71 PolarHBondContact O-OG 3.42Å; I68-K72 HydrophobicContact CG2-CD 4.47Å; I68-K72 WeakPolarHBondContact O-CB 3.49Å; I68-K72 PolarHBondContact O-N 2.89Å; I68-E205 HydrophobicContact CB-CG 4.46Å; I68-E205 WeakPolarHBondContact CB-OE1 3.42Å; I68-E205 HydrophobicContact CD1-CB 4.22Å; I68-E205 PolarHBondContact N-OE1 2.74Å; I68-E205 PolarHBondContact N-OE2 3.5Å; I68-T209 WeakPolarHBondContact CD1-OG1 2.68Å
69	F	93.4	Very high	80.8	Confident	0 Å²	0	56.3 Å²	56.3	0%	0	28%	0.28	C	S	.	.	H	α-helix	trans	-62.1	-35.8	175.3	72.4	-103.1	0	0	0	111.5	T67 K72 S73 A134 H138 L201 E205 Y282 D285 L286 L289	T67-F69 HydrophobicContact CG2-CD1 4.15Å; T67-F69 HydrophobicContact CG2-CE1 3.54Å; T67-F69 HydrophobicContact CG2-CZ 4.14Å; T67-F69 VanDerWaalsContact OG1-CD1 3.31Å; T67-F69 WeakPolarHBondContact OG1-CD1 3.34Å; T67-F69 WeakPolarHBondContact OG1-CE1 2.99Å; T67-F69 WeakPolarHBondContact OG1-CZ 3.49Å; F69-K72 PolarHBondContact O-N 3.42Å; F69-S73 WeakPolarHBondContact O-CB 3.44Å; F69-S73 PolarHBondContact O-N 3.18Å; F69-A134 HydrophobicContact CB-CB 3.68Å; F69-A134 HydrophobicContact CD1-CB 4.16Å; F69-A134 HydrophobicContact CD2-CB 3.89Å; F69-A134 HydrophobicContact CG-CB 3.66Å; F69-H138 WeakPolarHBondContact CB-NE2 3.49Å; F69-L201 HydrophobicContact CD1-CD2 3.64Å; F69-L201 HydrophobicContact CD1-CG 4.21Å; F69-L201 HydrophobicContact CE1-CD2 3.56Å; F69-L201 HydrophobicContact CE1-CG 4.4Å; F69-L201 HydrophobicContact CG-CD2 4.46Å; F69-L201 HydrophobicContact CZ-CD2 4.35Å; F69-E205 WeakPolarHBondContact CB-OE1 3.5Å; F69-E205 VanDerWaalsContact CD1-OE1 3.25Å; F69-E205 WeakPolarHBondContact CD1-OE1 3.34Å; F69-E205 PolarHBondContact N-OE1 2.82Å; F69-Y282 AromaticContact CE1-CD1 3.97Å; F69-Y282 HydrophobicContact CE1-CD1 3.97Å; F69-Y282 HydrophobicContact CE1-CE1 4.26Å; F69-D285 HydrophobicContact CE1-CB 4.39Å; F69-D285 HydrophobicContact CE2-CB 4.15Å; F69-D285 HydrophobicContact CZ-CB 3.55Å; F69-L286 HydrophobicContact CE1-CD2 4.49Å; F69-L286 HydrophobicContact CE1-CG 4.38Å; F69-L286 HydrophobicContact CE2-CD2 4.25Å; F69-L286 HydrophobicContact CE2-CG 4.48Å; F69-L286 HydrophobicContact CZ-CD2 4.01Å; F69-L286 HydrophobicContact CZ-CG 3.86Å; F69-L289 HydrophobicContact CD2-CD2 3.84Å; F69-L289 HydrophobicContact CE2-CB 4.15Å; F69-L289 HydrophobicContact CE2-CD2 3.99Å
70	L	90.8	Very high	79.6	Confident	27 Å²	27	58.7 Å²	58.7	14%	0.141	29%	0.286	C	S	.	.	H	α-helix	trans	-71.3	-41.9	-177.1	-174.1	63.8	0	0	0	109.8	T67 I68 S73 Q74 D285	T67-L70 PolarHBondContact O-N 2.8Å; T67-L70 VanDerWaalsContact OG1-CB 3.24Å; T67-L70 WeakPolarHBondContact OG1-CB 3.23Å; I68-L70 PolarHBondContact O-N 3.37Å; L70-S73 PolarHBondContact O-N 2.88Å; L70-S73 PolarHBondContact O-OG 3.37Å; L70-Q74 WeakPolarHBondContact O-CG 3.29Å; L70-D285 HydrophobicContact CD2-CB 4.05Å
71	S	90.9	Very high	78.4	Confident	60 Å²	60	67.2 Å²	67.2	42%	0.42	32%	0.318	S	S	.	.	H	α-helix	trans	-62.3	-47	172.9	59.8	0	0	0	0	111.3	T67 I68 S73 Q74	T67-S71 PolarHBondContact O-N 3.21Å; I68-S71 PolarHBondContact O-N 3.1Å; I68-S71 PolarHBondContact O-OG 3.42Å; S71-S73 PolarHBondContact O-N 3Å; S71-Q74 PolarHBondContact O-N 2.95Å; S71-Q74 VanDerWaalsContact O-N 3.16Å
72	K	89.6	Confident	76.9	Confident	27 Å²	27	70.6 Å²	70.6	12%	0.117	33%	0.331	C	S	.	.	H	α-helix	trans	-60.6	-29.1	176.1	-75.2	-170.5	173.9	-173.7	0	113.3	I68 F69 Q74 T75 N141 D214	I68-K72 HydrophobicContact CG2-CD 4.47Å; I68-K72 WeakPolarHBondContact O-CB 3.49Å; I68-K72 PolarHBondContact O-N 2.89Å; F69-K72 PolarHBondContact O-N 3.42Å; K72-Q74 PolarHBondContact O-N 2.96Å; K72-T75 PolarHBondContact O-OG1 3.08Å; K72-N141 HydrophobicContact CB-CB 4.3Å; K72-N141 WeakPolarHBondContact CD-O 3.37Å; K72-N141 VanDerWaalsContact CE-O 3.27Å; K72-N141 WeakPolarHBondContact CE-O 3.3Å; K72-N141 PolarHBondContact O-ND2 3.15Å; K72-D214 IonicContact NZ-OD1 2.82Å
73	S	89.3	Confident	75.5	Confident	3 Å²	3	70.2 Å²	70.2	2%	0.021	34%	0.335	C	S	.	.	H	α-helix	trans	-74	-21	178.1	76.9	0	0	0	0	114.8	F69 L70 S71 T75 D76 V77 L289	F69-S73 WeakPolarHBondContact O-CB 3.44Å; F69-S73 PolarHBondContact O-N 3.18Å; L70-S73 PolarHBondContact O-N 2.88Å; L70-S73 PolarHBondContact O-OG 3.37Å; S71-S73 PolarHBondContact O-N 3Å; S73-T75 PolarHBondContact O-N 2.94Å; S73-D76 PolarHBondContact O-N 2.96Å; S73-V77 WeakPolarHBondContact O-CG2 3.3Å; S73-V77 PolarHBondContact O-N 3.43Å; S73-L289 WeakPolarHBondContact OG-CD1 3.23Å
74	Q	79.6	Confident	74.1	Confident	118 Å²	118	73.2 Å²	73.2	55%	0.551	35%	0.348	S	S	*	.	H	α-helix	trans	-71.3	-28.3	-170.1	-72.9	177.1	26.1	0	0	113.8	L70 S71 K72 V77 R78	L70-Q74 WeakPolarHBondContact O-CG 3.29Å; S71-Q74 PolarHBondContact O-N 2.95Å; S71-Q74 VanDerWaalsContact O-N 3.16Å; K72-Q74 PolarHBondContact O-N 2.96Å; Q74-V77 PolarHBondContact O-N 3.23Å; Q74-R78 WeakPolarHBondContact O-CB 3.28Å; Q74-R78 PolarHBondContact O-N 3.48Å
75	T	68.4	Low	72.7	Confident	77 Å²	77	70.4 Å²	70.4	47%	0.472	34%	0.339	S	S	.	.	H	α-helix	trans	-57.3	-51.3	175.9	50.1	0	0	0	0	110.6	K72 S73 R78 E79 N141	K72-T75 PolarHBondContact O-OG1 3.08Å; S73-T75 PolarHBondContact O-N 2.94Å; T75-R78 PolarHBondContact O-N 3.41Å; T75-E79 PolarHBondContact O-N 2.81Å; T75-N141 PolarHBondContact OG1-ND2 3.06Å
76	D	63.6	Low	71.2	Confident	15 Å²	15	74.4 Å²	74.4	8%	0.08	36%	0.356	C	S	.	.	H	α-helix	trans	-66.5	-40.6	178.6	-99.1	37.5	0	0	0	113.2	S73 R78 E79 K80 Y137 K140	S73-D76 PolarHBondContact O-N 2.96Å; D76-R78 VanDerWaalsContact C-N 3.28Å; D76-R78 PolarHBondContact O-N 3Å; D76-E79 PolarHBondContact O-N 3.17Å; D76-K80 WeakPolarHBondContact O-CB 3.23Å; D76-K80 WeakPolarHBondContact O-CG 3.36Å; D76-K80 PolarHBondContact O-N 3.5Å; D76-Y137 HydrophobicContact CB-CE1 3.72Å; D76-Y137 WeakPolarHBondContact OD2-CE1 3.27Å; D76-K140 IonicContact OD1-NZ 3.49Å; D76-K140 PolarHBondContact OD1-NZ 3.25Å; D76-K140 IonicContact OD2-NZ 3.32Å; D76-K140 PolarHBondContact OD2-NZ 2.73Å
77	V	59.7	Low	69.5	Low	18 Å²	18	75.8 Å²	75.8	11%	0.109	36%	0.359	C	S	.	.	H	α-helix	trans	-64.4	-37.2	178.4	174.7	0	0	0	0	110.6	S73 Q74 K80 R81 A292	S73-V77 WeakPolarHBondContact O-CG2 3.3Å; S73-V77 PolarHBondContact O-N 3.43Å; Q74-V77 PolarHBondContact O-N 3.23Å; V77-K80 PolarHBondContact O-N 2.9Å; V77-R81 WeakPolarHBondContact O-CB 3.26Å; V77-R81 VanDerWaalsContact O-CG 3.31Å; V77-R81 WeakPolarHBondContact O-CG 3.01Å; V77-R81 PolarHBondContact O-N 3.26Å; V77-A292 HydrophobicContact CG2-CB 4.18Å
78	R	58	Low	67.5	Low	175 Å²	175	82.3 Å²	82.3	66%	0.66	39%	0.389	S	S	*	.	H	α-helix	trans	-66.8	-40.2	176.1	-166.3	176.7	-175.1	-169.2	2.1	111.5	Q74 T75 D76 R81 K82	Q74-R78 WeakPolarHBondContact O-CB 3.28Å; Q74-R78 PolarHBondContact O-N 3.48Å; T75-R78 PolarHBondContact O-N 3.41Å; D76-R78 VanDerWaalsContact C-N 3.28Å; D76-R78 PolarHBondContact O-N 3Å; R78-R81 PolarHBondContact O-N 3.45Å; R78-K82 WeakPolarHBondContact O-CG 3.12Å; R78-K82 PolarHBondContact O-N 3.11Å
79	E	57.1	Low	65.4	Low	128 Å²	128	88 Å²	88	60%	0.598	41%	0.413	S	S	*	.	H	α-helix	trans	-65.5	-45	173.8	-72.8	-173.2	168.2	0	0	112.5	T75 D76 R81 K82 S83	T75-E79 PolarHBondContact O-N 2.81Å; D76-E79 PolarHBondContact O-N 3.17Å; E79-R81 VanDerWaalsContact C-N 3.32Å; E79-R81 PolarHBondContact O-N 2.95Å; E79-K82 WeakPolarHBondContact O-CB 3.46Å; E79-K82 PolarHBondContact O-N 3.24Å; E79-K82 VanDerWaalsContact O-N 3.16Å; E79-S83 PolarHBondContact O-N 3.05Å; E79-S83 PolarHBondContact O-OG 3.38Å
80	K	59.6	Low	63.1	Low	91 Å²	91	91.8 Å²	91.8	40%	0.396	44%	0.436	S	S	.	.	H	α-helix	trans	-59.9	-40.1	174.5	-73.4	177.7	-173.8	176.7	0	112.1	D76 V77 S83 L84 N293	D76-K80 WeakPolarHBondContact O-CB 3.23Å; D76-K80 WeakPolarHBondContact O-CG 3.36Å; D76-K80 PolarHBondContact O-N 3.5Å; V77-K80 PolarHBondContact O-N 2.9Å; K80-S83 PolarHBondContact O-N 3.09Å; K80-S83 PolarHBondContact O-OG 3.11Å; K80-L84 WeakPolarHBondContact O-CB 3.32Å; K80-L84 WeakPolarHBondContact O-CD1 3.33Å; K80-L84 VanDerWaalsContact O-CG 3.24Å; K80-L84 WeakPolarHBondContact O-CG 3.22Å; K80-L84 PolarHBondContact O-N 2.92Å; K80-N293 PolarHBondContact NZ-OD1 2.96Å
81	R	58.3	Low	60.8	Low	178 Å²	178	95 Å²	95	67%	0.672	45%	0.45	S	S	*	.	H	α-helix	trans	-66.4	-38.8	175.1	-75.4	177.6	-177.6	171.8	3.1	112.1	V77 R78 E79 Y85	V77-R81 WeakPolarHBondContact O-CB 3.26Å; V77-R81 VanDerWaalsContact O-CG 3.31Å; V77-R81 WeakPolarHBondContact O-CG 3.01Å; V77-R81 PolarHBondContact O-N 3.26Å; R78-R81 PolarHBondContact O-N 3.45Å; E79-R81 VanDerWaalsContact C-N 3.32Å; E79-R81 PolarHBondContact O-N 2.95Å; R81-Y85 WeakPolarHBondContact O-CB 3.36Å; R81-Y85 PolarHBondContact O-N 3.44Å
82	K	53.1	Low	58.6	Low	117 Å²	117	98.3 Å²	98.3	51%	0.509	46%	0.462	S	S	.	.	H	α-helix	trans	-66	-43.7	174.1	-74.8	175.6	178.1	-177.4	0	111.8	R78 E79 Y85 I86	R78-K82 WeakPolarHBondContact O-CG 3.12Å; R78-K82 PolarHBondContact O-N 3.11Å; E79-K82 WeakPolarHBondContact O-CB 3.46Å; E79-K82 PolarHBondContact O-N 3.24Å; E79-K82 VanDerWaalsContact O-N 3.16Å; K82-Y85 PolarHBondContact O-N 2.94Å; K82-I86 VanDerWaalsContact O-CG1 3.29Å; K82-I86 WeakPolarHBondContact O-CG1 3.23Å; K82-I86 PolarHBondContact O-N 3.4Å
83	S	54.9	Low	56.4	Low	54 Å²	54	101.8 Å²	101.8	38%	0.378	49%	0.49	S	S	.	.	H	α-helix	trans	-67.9	-38.3	178.7	71.4	0	0	0	0	112.2	E79 K80 Y85 I86 N87	E79-S83 PolarHBondContact O-N 3.05Å; E79-S83 PolarHBondContact O-OG 3.38Å; K80-S83 PolarHBondContact O-N 3.09Å; K80-S83 PolarHBondContact O-OG 3.11Å; S83-Y85 VanDerWaalsContact C-N 3.35Å; S83-I86 PolarHBondContact O-N 2.73Å; S83-N87 VanDerWaalsContact O-CB 3.28Å; S83-N87 WeakPolarHBondContact O-CB 3.36Å; S83-N87 PolarHBondContact O-N 3.39Å; S83-N87 PolarHBondContact O-ND2 2.89Å
84	L	53.9	Low	54	Low	116 Å²	116	107.7 Å²	107.7	61%	0.607	52%	0.517	S	S	*	.	H	α-helix	trans	-62.7	-39.5	171.5	-76.7	164.1	0	0	0	112.2	K80 H88	K80-L84 WeakPolarHBondContact O-CB 3.32Å; K80-L84 WeakPolarHBondContact O-CD1 3.33Å; K80-L84 VanDerWaalsContact O-CG 3.24Å; K80-L84 WeakPolarHBondContact O-CG 3.22Å; K80-L84 PolarHBondContact O-N 2.92Å; L84-H88 VanDerWaalsContact O-CB 3.27Å; L84-H88 WeakPolarHBondContact O-CB 3.38Å; L84-H88 PolarHBondContact O-N 3.15Å
85	Y	51.3	Low	52.2	Low	166 Å²	166	109.9 Å²	109.9	65%	0.651	53%	0.533	S	S	*	.	H	α-helix	trans	-66.4	-43	176	-172.5	-94.3	0	0	0	112.1	R81 K82 S83 H88 F89	R81-Y85 WeakPolarHBondContact O-CB 3.36Å; R81-Y85 PolarHBondContact O-N 3.44Å; K82-Y85 PolarHBondContact O-N 2.94Å; S83-Y85 VanDerWaalsContact C-N 3.35Å; Y85-H88 PolarHBondContact O-N 2.99Å; Y85-F89 PolarHBondContact O-N 2.99Å; Y85-F89 VanDerWaalsContact O-N 3.11Å
86	I	55.1	Low	50.7	Low	102 Å²	102	113.6 Å²	113.6	52%	0.523	54%	0.542	S	S	.	.	H	α-helix	trans	-64.6	-45.8	176.5	-67.7	165.1	0	0	0	110.7	K82 S83 H88 F89 T90	K82-I86 VanDerWaalsContact O-CG1 3.29Å; K82-I86 WeakPolarHBondContact O-CG1 3.23Å; K82-I86 PolarHBondContact O-N 3.4Å; S83-I86 PolarHBondContact O-N 2.73Å; I86-H88 VanDerWaalsContact C-N 3.3Å; I86-H88 PolarHBondContact O-N 3.33Å; I86-F89 PolarHBondContact O-N 3.03Å; I86-F89 VanDerWaalsContact O-N 3.09Å; I86-T90 PolarHBondContact O-N 3.31Å; I86-T90 PolarHBondContact O-OG1 3.36Å
87	N	48.3	Very low	49.5	Very low	87 Å²	87	121.9 Å²	121.9	47%	0.465	58%	0.58	S	S	.	*	H	α-helix	trans	-65.3	-33.1	177.9	-70	-16.5	0	0	0	112.3	S83 F89 T90 H91	S83-N87 VanDerWaalsContact O-CB 3.28Å; S83-N87 WeakPolarHBondContact O-CB 3.36Å; S83-N87 PolarHBondContact O-N 3.39Å; S83-N87 PolarHBondContact O-ND2 2.89Å; N87-F89 VanDerWaalsContact C-N 3.31Å; N87-T90 WeakPolarHBondContact CA-OG1 3.22Å; N87-T90 PolarHBondContact O-OG1 3.48Å; N87-H91 WeakPolarHBondContact O-CB 3.3Å; N87-H91 PolarHBondContact O-CD2 3.45Å; N87-H91 PolarHBondContact O-N 2.9Å
88	H	50.6	Low	48.6	Very low	138 Å²	138	127.3 Å²	127.3	64%	0.639	60%	0.604	S	S	*	*	H	α-helix	trans	-71	-27.1	174.3	-160.2	-56.5	0	0	0	112.1	L84 Y85 I86 I92	L84-H88 VanDerWaalsContact O-CB 3.27Å; L84-H88 WeakPolarHBondContact O-CB 3.38Å; L84-H88 PolarHBondContact O-N 3.15Å; Y85-H88 PolarHBondContact O-N 2.99Å; I86-H88 VanDerWaalsContact C-N 3.3Å; I86-H88 PolarHBondContact O-N 3.33Å; H88-I92 WeakPolarHBondContact O-CG1 3.37Å
89	F	47.9	Very low	47.7	Very low	151 Å²	151	125.1 Å²	125.1	66%	0.662	61%	0.612	S	S	*	*	H	α-helix	trans	-79.7	-33.8	175.6	-148.9	-92.3	0	0	0	112.1	Y85 I86 N87	Y85-F89 PolarHBondContact O-N 2.99Å; Y85-F89 VanDerWaalsContact O-N 3.11Å; I86-F89 PolarHBondContact O-N 3.03Å; I86-F89 VanDerWaalsContact O-N 3.09Å; N87-F89 VanDerWaalsContact C-N 3.31Å
90	T	45.3	Very low	46.7	Very low	80 Å²	80	121.5 Å²	121.5	49%	0.491	61%	0.61	S	S	.	*	H	α-helix	trans	-79.4	-26.6	176.1	54.8	0	0	0	0	113.5	I86 N87 S93	I86-T90 PolarHBondContact O-N 3.31Å; I86-T90 PolarHBondContact O-OG1 3.36Å; N87-T90 WeakPolarHBondContact CA-OG1 3.22Å; N87-T90 PolarHBondContact O-OG1 3.48Å; T90-S93 PolarHBondContact O-OG 2.92Å
91	H	43.1	Very low	46.1	Very low	94 Å²	94	122.8 Å²	122.8	44%	0.435	63%	0.627	S	S	.	*	G	3₁₀ helix	trans	-83.3	-2	176.3	-93	-82.7	0	0	0	115.5	N87 S93 E94 H98	N87-H91 WeakPolarHBondContact O-CB 3.3Å; N87-H91 PolarHBondContact O-CD2 3.45Å; N87-H91 PolarHBondContact O-N 2.9Å; H91-S93 PolarHBondContact O-N 2.89Å; H91-E94 PolarHBondContact O-N 2.7Å; H91-H98 AromaticContact CE1-NE2 3.98Å
92	I	44.7	Very low	45.7	Very low	129 Å²	129	122.8 Å²	122.8	66%	0.662	64%	0.64	S	S	*	*	G	3₁₀ helix	trans	-65.9	-13	170	-71.4	166.8	0	0	0	111.3	H88	H88-I92 WeakPolarHBondContact O-CG1 3.37Å
93	S	42	Very low	45.8	Very low	101 Å²	101	128.7 Å²	128.7	71%	0.706	66%	0.659	S	S	*	*	G	3₁₀ helix	trans	-98.8	-7.1	176.5	65.2	0	0	0	0	116.4	T90 H91	T90-S93 PolarHBondContact O-OG 2.92Å; H91-S93 PolarHBondContact O-N 2.89Å
94	E	40.5	Very low	46.1	Very low	126 Å²	126	133 Å²	133	59%	0.589	67%	0.667	S	S	*	*			trans	-141.5	109.1	-179.4	-71.9	-168.3	172.2	0	0	114	H91 K96	H91-E94 PolarHBondContact O-N 2.7Å; E94-K96 PolarHBondContact O-N 3.05Å
95	N	40.6	Very low	46.8	Very low	165 Å²	165	132.9 Å²	132.9	88%	0.882	66%	0.661	S	S	*	*			trans	-59.6	91.1	169.2	-94.7	-23.5	0	0	0	111.5
96	K	37.8	Very low	47.9	Very low	154 Å²	154	133 Å²	133	67%	0.67	66%	0.662	S	S	*	*			trans	-133.1	126.2	159.3	-79.4	-176.1	-179.8	166.3	0	111.2	E94 H98	E94-K96 PolarHBondContact O-N 3.05Å; K96-H98 PolarHBondContact O-N 2.81Å; K96-H98 VanDerWaalsContact O-N 3.07Å
97	H	38	Very low	49.2	Very low	190 Å²	190	131.4 Å²	131.4	88%	0.88	66%	0.66	S	S	*	*			trans	-66.7	99.1	178.9	-68.9	13	0	0	0	110.4
98	H	39.8	Very low	50.8	Low	132 Å²	132	130.2 Å²	130.2	61%	0.611	66%	0.658	S	S	*	*			trans	-91.1	145.1	160.6	-67.4	-60.9	0	0	0	109.4	H91 K96 G100	H91-H98 AromaticContact CE1-NE2 3.98Å; K96-H98 PolarHBondContact O-N 2.81Å; K96-H98 VanDerWaalsContact O-N 3.07Å; H98-G100 PolarHBondContact O-N 3.22Å
99	P	39.5	Very low	52.1	Low	128 Å²	128	130.7 Å²	130.7	83%	0.831	68%	0.675	S	S	*	*			trans	-64	107.2	170.6	27	-28.8	0	0	0	107
100	G	37.1	Very low	53.7	Low	53 Å²	53	128.7 Å²	128.7	55%	0.546	68%	0.68	S	S	.	*			trans	-57.3	160	179.7	0	0	0	0	0	111.7	H98 L102	H98-G100 PolarHBondContact O-N 3.22Å; G100-L102 PolarHBondContact O-N 2.78Å
101	P	47.2	Very low	55.4	Low	118 Å²	118	127.5 Å²	127.5	77%	0.766	67%	0.673	S	S	*	*			trans	-52.2	131.9	175.8	21.6	-31.2	0	0	0	109.5	R103	P101-R103 PolarHBondContact O-N 2.87Å
102	L	49.5	Very low	57.4	Low	177 Å²	177	127.1 Å²	127.1	93%	0.927	67%	0.673	S	S	*	*			trans	-42.7	112.9	176.8	-81.6	139.2	0	0	0	109	G100 R104	G100-L102 PolarHBondContact O-N 2.78Å; L102-R104 PolarHBondContact O-N 2.66Å
103	R	54.7	Low	59.2	Low	241 Å²	241	123 Å²	123	91%	0.909	65%	0.65	S	S	*	*	P	Polyproline II helix	trans	-53	117.2	178.9	-113.3	-171.9	171.7	-151.2	-0.9	107.9	P101 K105	P101-R103 PolarHBondContact O-N 2.87Å; R103-K105 PolarHBondContact O-N 3.41Å; R103-K105 VanDerWaalsContact O-N 3.09Å
104	R	60.4	Low	61	Low	146 Å²	146	121.5 Å²	121.5	55%	0.551	63%	0.634	S	S	*	*	P	Polyproline II helix	trans	-53.5	118.9	174.4	-161.7	176.5	-131.2	153.3	-1.8	107.1	L102 Y106 E291	L102-R104 PolarHBondContact O-N 2.66Å; R104-Y106 HydrophobicContact CB-CE1 4.43Å; R104-Y106 HydrophobicContact CB-CE2 4.15Å; R104-Y106 HydrophobicContact CG-CE1 4.18Å; R104-Y106 WeakPolarHBondContact O-CD2 3.44Å; R104-Y106 WeakPolarHBondContact O-CE2 3.35Å; R104-E291 IonicContact CZ-OE2 2.64Å; R104-E291 IonicContact NH2-OE2 2.77Å; R104-E291 PolarHBondContact NH2-OE2 3.42Å
105	K	69.3	Low	62.9	Low	112 Å²	112	116.9 Å²	116.9	49%	0.487	61%	0.613	S	S	.	*	P	Polyproline II helix	trans	-78.4	134.4	178.8	-61	-178.3	-171	171.2	0	107.6	R103 F113 L299	R103-K105 PolarHBondContact O-N 3.41Å; R103-K105 VanDerWaalsContact O-N 3.09Å; K105-F113 HydrophobicContact CB-CD1 4.29Å; K105-F113 HydrophobicContact CB-CD2 4.44Å; K105-F113 HydrophobicContact CB-CE1 4.45Å; K105-F113 HydrophobicContact CB-CG 4.28Å; K105-F113 HydrophobicContact CD-CD1 3.97Å; K105-F113 HydrophobicContact CD-CE1 3.78Å; K105-F113 HydrophobicContact CD-CZ 4.43Å; K105-L299 HydrophobicContact CB-CB 4.5Å; K105-L299 HydrophobicContact CB-CD1 4.25Å; K105-L299 HydrophobicContact CD-CB 4.44Å; K105-L299 PolarHBondContact NZ-O 3.17Å; K105-L299 VanDerWaalsContact NZ-O 3.13Å; K105-L299 WeakPolarHBondContact O-CD1 3.49Å
106	Y	74.6	Confident	64.5	Low	170 Å²	170	113.6 Å²	113.6	67%	0.667	60%	0.596	S	S	*	*			trans	-116.3	141.2	-179.5	-59.1	-80.4	0	0	0	109.5	R104 F113	R104-Y106 HydrophobicContact CB-CE1 4.43Å; R104-Y106 HydrophobicContact CB-CE2 4.15Å; R104-Y106 HydrophobicContact CG-CE1 4.18Å; R104-Y106 WeakPolarHBondContact O-CD2 3.44Å; R104-Y106 WeakPolarHBondContact O-CE2 3.35Å; Y106-F113 WeakPolarHBondContact O-CD2 3.48Å
107	S	83.2	Confident	66.8	Low	68 Å²	68	106.5 Å²	106.5	48%	0.476	57%	0.565	S	S	.	*			trans	-67.3	143.7	171.5	-62.5	0	0	0	0	110.7	T111 F113	S107-T111 CarbonylContact C-O 3.08Å; S107-T111 WeakPolarHBondContact CA-O 3.37Å; S107-F113 PolarHBondContact OG-N 3.21Å
108	S	81.7	Confident	69.1	Low	61 Å²	61	100.5 Å²	100.5	43%	0.427	54%	0.542	S	S	.	.			trans	-120.6	176	172.6	70.5	0	0	0	0	110.3	S110 T111	S108-S110 PolarHBondContact O-N 2.97Å; S108-S110 PolarHBondContact OG-N 3.18Å; S108-S110 PolarHBondContact OG-OG 2.78Å; S108-T111 PolarHBondContact N-O 3.48Å; S108-T111 PolarHBondContact O-N 2.53Å; S108-T111 PolarHBondContact OG-N 2.9Å
109	C	77.6	Confident	71.5	Confident	149 Å²	149	96.7 Å²	96.7	100%	1.007	53%	0.528	S	S	*	.	S	Bend	trans	-61.7	-22.5	175.2	-58.4	0	0	0	0	113.6
110	S	81.1	Confident	73.7	Confident	109 Å²	109	95.3 Å²	95.3	76%	0.762	52%	0.521	S	S	*	.	S	Bend	trans	-104.6	-22.4	-178.6	53.6	0	0	0	0	114	S108	S108-S110 PolarHBondContact O-N 2.97Å; S108-S110 PolarHBondContact OG-N 3.18Å; S108-S110 PolarHBondContact OG-OG 2.78Å
111	T	81.6	Confident	76.1	Confident	55 Å²	55	98.2 Å²	98.2	34%	0.337	52%	0.521	S	S	.	.			trans	-137.3	113.1	-176	-52.5	0	0	0	0	110.2	S107 S108 F113 P301	S107-T111 CarbonylContact C-O 3.08Å; S107-T111 WeakPolarHBondContact CA-O 3.37Å; S108-T111 PolarHBondContact N-O 3.48Å; S108-T111 PolarHBondContact O-N 2.53Å; S108-T111 PolarHBondContact OG-N 2.9Å; T111-F113 HydrophobicContact CG2-CD2 4.21Å; T111-F113 HydrophobicContact CG2-CE2 3.68Å; T111-F113 HydrophobicContact CG2-CZ 3.86Å; T111-P301 HydrophobicContact CG2-CB 4.29Å
112	I	84.6	Confident	78.2	Confident	85 Å²	85	93 Å²	93	44%	0.436	49%	0.487	S	S	.	.			trans	-94	128.3	173	-57.1	175.8	0	0	0	107.9	L114 L302	I112-L114 HydrophobicContact CG2-CD2 3.82Å; I112-L114 HydrophobicContact CG2-CG 3.98Å; I112-L302 HydrophobicContact CB-CB 4.25Å; I112-L302 HydrophobicContact CB-CD2 4.41Å; I112-L302 HydrophobicContact CD1-CD2 4.44Å; I112-L302 WeakPolarHBondContact O-CB 3.3Å; I112-L302 PolarHBondContact O-N 3.27Å
113	F	82.4	Confident	80.2	Confident	44 Å²	44	87.3 Å²	87.3	19%	0.193	46%	0.458	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-100.4	126.6	171.1	-71.2	-87.5	0	0	0	109.4	K105 Y106 S107 T111 L299 E300 P301	K105-F113 HydrophobicContact CB-CD1 4.29Å; K105-F113 HydrophobicContact CB-CD2 4.44Å; K105-F113 HydrophobicContact CB-CE1 4.45Å; K105-F113 HydrophobicContact CB-CG 4.28Å; K105-F113 HydrophobicContact CD-CD1 3.97Å; K105-F113 HydrophobicContact CD-CE1 3.78Å; K105-F113 HydrophobicContact CD-CZ 4.43Å; Y106-F113 WeakPolarHBondContact O-CD2 3.48Å; S107-F113 PolarHBondContact OG-N 3.21Å; T111-F113 HydrophobicContact CG2-CD2 4.21Å; T111-F113 HydrophobicContact CG2-CE2 3.68Å; T111-F113 HydrophobicContact CG2-CZ 3.86Å; F113-L299 HydrophobicContact CB-CB 4.16Å; F113-E300 WeakPolarHBondContact CA-O 3.14Å; F113-P301 HydrophobicContact CD1-CG 4.24Å; F113-P301 HydrophobicContact CE1-CB 4.36Å; F113-P301 HydrophobicContact CE1-CG 3.75Å
114	L	79.3	Confident	82.1	Confident	68 Å²	68	79 Å²	79	36%	0.356	43%	0.431	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-124.5	155.1	176.3	-60.1	-179.8	0	0	0	109.7	I112 E300 L302 L310	I112-L114 HydrophobicContact CG2-CD2 3.82Å; I112-L114 HydrophobicContact CG2-CG 3.98Å; L114-E300 PolarHBondContact N-O 2.93Å; L114-E300 PolarHBondContact O-N 3.46Å; L114-L302 HydrophobicContact CD1-CD1 3.88Å; L114-L302 HydrophobicContact CD1-CD2 4.49Å; L114-L310 HydrophobicContact CD1-CD1 4.16Å
115	D	80.3	Confident	83.6	Confident	29 Å²	29	77.7 Å²	77.7	16%	0.155	43%	0.429	C	S	.	.			trans	-100.1	154.8	156.9	57.9	53.7	0	0	0	110.3	S117 R287 F297 L299	D115-S117 PolarHBondContact O-N 3.03Å; D115-S117 VanDerWaalsContact O-N 3.12Å; D115-S117 PolarHBondContact OD1-N 3.07Å; D115-R287 IonicContact OD1-CZ 3.54Å; D115-R287 IonicContact OD1-NH1 3.23Å; D115-R287 PolarHBondContact OD1-NH1 2.99Å; D115-R287 IonicContact OD1-NH2 3.36Å; D115-R287 PolarHBondContact OD1-NH2 3.5Å; D115-R287 IonicContact OD2-CZ 3.74Å; D115-R287 IonicContact OD2-NH1 2.9Å; D115-R287 IonicContact OD2-NH2 3.81Å; D115-R287 PolarHBondContact OD2-NH2 3.24Å; D115-F297 HydrophobicContact CB-CB 3.44Å; D115-F297 VanDerWaalsContact CB-CB 3.44Å; D115-F297 HydrophobicContact CB-CG 4.18Å; D115-L299 HydrophobicContact CB-CD2 4.28Å
116	D	75.8	Confident	84.6	Confident	97 Å²	97	74.7 Å²	74.7	52%	0.519	42%	0.415	S	S	.	.	S	Bend	trans	-83.5	30.8	179.4	-67	-18.4	0	0	0	111.4	K306	D116-K306 IonicContact OD1-NZ 2.66Å; D116-K306 PolarHBondContact OD1-NZ 3.21Å; D116-K306 IonicContact OD2-NZ 3.39Å; D116-K306 PolarHBondContact OD2-NZ 2.95Å
117	S	84.3	Confident	85.6	Confident	4 Å²	4	67 Å²	67	3%	0.028	39%	0.385	C	S	.	.			trans	-123	110.9	-179.9	-169.2	0	0	0	0	109.1	D115 N123 Y283 R287 F297	D115-S117 PolarHBondContact O-N 3.03Å; D115-S117 VanDerWaalsContact O-N 3.12Å; D115-S117 PolarHBondContact OD1-N 3.07Å; S117-N123 PolarHBondContact OG-N 2.85Å; S117-Y283 VanDerWaalsContact C-OH 3.25Å; S117-Y283 PolarHBondContact O-OH 3.38Å; S117-R287 PolarHBondContact O-NH1 3.17Å; S117-F297 VanDerWaalsContact CB-CE1 3.49Å; S117-F297 WeakPolarHBondContact OG-CE1 3.42Å
118	T	87.2	Confident	86.2	Confident	64 Å²	64	64.1 Å²	64.1	39%	0.393	37%	0.365	S	S	.	.	B	Isolated β-bridge	trans	-116.7	164.3	177.7	65.7	0	0	0	0	110.2	S120 Q121 P122 Y283	T118-S120 PolarHBondContact O-N 3.25Å; T118-S120 PolarHBondContact OG1-OG 3.35Å; T118-Q121 PolarHBondContact N-O 3.18Å; T118-Q121 CarbonylContact O-C 3.15Å; T118-Q121 PolarHBondContact O-N 3.34Å; T118-Q121 VanDerWaalsContact O-N 3.11Å; T118-Q121 PolarHBondContact OG1-N 3.17Å; T118-P122 WeakPolarHBondContact O-CA 3.44Å; T118-Y283 VanDerWaalsContact CA-OH 3.26Å; T118-Y283 WeakPolarHBondContact CA-OH 3.16Å; T118-Y283 PolarHBondContact N-OH 2.98Å; T118-Y283 WeakPolarHBondContact O-CE2 3.37Å; T118-Y283 PolarHBondContact O-OH 3.06Å
119	V	89.6	Confident	86.9	Confident	53 Å²	53	64 Å²	64	32%	0.321	36%	0.357	S	S	.	.	T	Hydrogen-bonded Turn	trans	-59.4	-33.9	176.9	66.3	0	0	0	0	111.7	Y279 A280 Y283	V119-Y279 HydrophobicContact CG2-CD1 4.28Å; V119-Y279 HydrophobicContact CG2-CE1 3.97Å; V119-Y279 WeakPolarHBondContact O-CE1 3.39Å; V119-Y279 PolarHBondContact O-OH 3.33Å; V119-A280 HydrophobicContact CG2-CB 4.16Å; V119-Y283 HydrophobicContact CB-CD1 3.75Å; V119-Y283 HydrophobicContact CB-CE1 3.76Å; V119-Y283 HydrophobicContact CB-CG 4.31Å; V119-Y283 HydrophobicContact CG2-CD1 3.81Å; V119-Y283 HydrophobicContact CG2-CE1 4.35Å; V119-Y283 HydrophobicContact CG2-CG 4.09Å; V119-Y283 PolarHBondContact N-OH 3.11Å
120	S	86.9	Confident	87.7	Confident	98 Å²	98	57.1 Å²	57.1	69%	0.685	31%	0.31	S	S	*	.	T	Hydrogen-bonded Turn	trans	-84.9	-15.1	177.9	49.7	0	0	0	0	114.3	T118	T118-S120 PolarHBondContact O-N 3.25Å; T118-S120 PolarHBondContact OG1-OG 3.35Å
121	Q	88	Confident	88.5	Confident	114 Å²	114	52 Å²	52	53%	0.533	27%	0.274	S	S	.	.	B	Isolated β-bridge	trans	-149.7	76.3	179.8	-166.6	176.6	17.8	0	0	108.7	T118	T118-Q121 PolarHBondContact N-O 3.18Å; T118-Q121 CarbonylContact O-C 3.15Å; T118-Q121 PolarHBondContact O-N 3.34Å; T118-Q121 VanDerWaalsContact O-N 3.11Å; T118-Q121 PolarHBondContact OG1-N 3.17Å
122	P	91	Very high	89.3	Confident	10 Å²	10	49.3 Å²	49.3	7%	0.065	26%	0.258	C	S	.	.			trans	-73.1	147.4	179.8	12.2	-4	0	0	0	111	T118 L124 A194 E195 I198 Y279 Y283	T118-P122 WeakPolarHBondContact O-CA 3.44Å; P122-L124 PolarHBondContact O-N 2.84Å; P122-A194 HydrophobicContact CB-CB 3.81Å; P122-A194 HydrophobicContact CG-CB 3.74Å; P122-A194 WeakPolarHBondContact O-CB 3.5Å; P122-E195 VanDerWaalsContact CD-OE1 3.31Å; P122-E195 WeakPolarHBondContact CD-OE1 3.49Å; P122-E195 HydrophobicContact CG-CG 3.95Å; P122-I198 HydrophobicContact CB-CD1 4.28Å; P122-I198 HydrophobicContact CG-CD1 4Å; P122-Y279 WeakPolarHBondContact CG-OH 3.3Å; P122-Y283 HydrophobicContact CB-CD2 4.28Å; P122-Y283 HydrophobicContact CB-CE2 3.97Å
123	N	91.6	Very high	89.9	Confident	57 Å²	57	45.5 Å²	45.5	31%	0.305	24%	0.238	S	C	.	.			trans	-78.6	110.9	175.7	-172.5	-71.2	0	0	0	112.1	S117 K125 Y126 T127 F297	S117-N123 PolarHBondContact OG-N 2.85Å; N123-K125 PolarHBondContact O-N 3.43Å; N123-K125 PolarHBondContact OD1-N 3.15Å; N123-Y126 HydrophobicContact CB-CD2 3.99Å; N123-Y126 PolarHBondContact O-N 3.44Å; N123-Y126 VanDerWaalsContact O-N 3.13Å; N123-Y126 WeakPolarHBondContact OD1-CD2 3.46Å; N123-Y126 PolarHBondContact OD1-N 2.98Å; N123-T127 PolarHBondContact O-N 3.06Å; N123-T127 PolarHBondContact O-OG1 3.11Å; N123-F297 HydrophobicContact CB-CE1 4.28Å
124	L	93.3	Very high	90.6	Very high	65 Å²	65	43.4 Å²	43.4	34%	0.34	23%	0.229	S	C	.	.	H	α-helix	trans	-47.7	-49.9	-177	180	61.9	0	0	0	114.3	P122 Y126 T127 I128 F187 A194	P122-L124 PolarHBondContact O-N 2.84Å; L124-Y126 VanDerWaalsContact C-N 3.31Å; L124-Y126 PolarHBondContact O-N 3.07Å; L124-T127 PolarHBondContact O-N 3.49Å; L124-I128 HydrophobicContact CD1-CD1 3.62Å; L124-I128 HydrophobicContact CD1-CG1 3.97Å; L124-I128 HydrophobicContact CG-CD1 3.9Å; L124-I128 WeakPolarHBondContact O-CG1 3.36Å; L124-I128 PolarHBondContact O-N 3.08Å; L124-F187 HydrophobicContact CD1-CD1 3.95Å; L124-A194 HydrophobicContact CB-CB 4.04Å; L124-A194 HydrophobicContact CD1-CB 4.19Å
125	K	92.3	Very high	91.5	Very high	119 Å²	119	40.2 Å²	40.2	52%	0.517	21%	0.212	S	C	.	.	H	α-helix	trans	-61.1	-41.7	-175.4	179	-179.1	178.2	-179.4	0	111.7	N123 K129	N123-K125 PolarHBondContact O-N 3.43Å; N123-K125 PolarHBondContact OD1-N 3.15Å; K125-K129 WeakPolarHBondContact O-CG 3.41Å; K125-K129 PolarHBondContact O-N 3Å
126	Y	91.1	Very high	92.3	Very high	50 Å²	50	41.4 Å²	41.4	20%	0.196	22%	0.215	C	C	.	.	H	α-helix	trans	-79.3	-38.2	179.9	-67.7	-75.4	0	0	0	111.4	N123 L124 I128 K129 C130 F297 P298	N123-Y126 HydrophobicContact CB-CD2 3.99Å; N123-Y126 PolarHBondContact O-N 3.44Å; N123-Y126 VanDerWaalsContact O-N 3.13Å; N123-Y126 WeakPolarHBondContact OD1-CD2 3.46Å; N123-Y126 PolarHBondContact OD1-N 2.98Å; L124-Y126 VanDerWaalsContact C-N 3.31Å; L124-Y126 PolarHBondContact O-N 3.07Å; Y126-I128 PolarHBondContact O-N 3.08Å; Y126-K129 WeakPolarHBondContact O-CB 3.48Å; Y126-K129 PolarHBondContact O-N 2.8Å; Y126-K129 VanDerWaalsContact O-N 3.14Å; Y126-C130 PolarHBondContact O-N 2.73Å; Y126-C130 PolarHBondContact O-SG 3.47Å; Y126-F297 HydrophobicContact CD1-CD1 4.5Å; Y126-F297 AromaticContact CD2-CD1 3.77Å; Y126-F297 HydrophobicContact CD2-CD1 3.77Å; Y126-F297 HydrophobicContact CD2-CE1 4.08Å; Y126-F297 AromaticContact CG-CD1 3.79Å; Y126-F297 HydrophobicContact CG-CD1 3.79Å; Y126-F297 AromaticContact CG-CE1 3.85Å; Y126-F297 HydrophobicContact CG-CE1 3.85Å; Y126-P298 VanDerWaalsContact OH-CD 3.29Å; Y126-P298 WeakPolarHBondContact OH-CD 3.22Å
127	T	95.2	Very high	93.2	Very high	7 Å²	7	36.9 Å²	36.9	4%	0.043	19%	0.191	C	C	.	.	H	α-helix	trans	-58.2	-47.5	175.4	-56.5	0	0	0	0	111.2	N123 L124 K129 C130 V131 A197 I198	N123-T127 PolarHBondContact O-N 3.06Å; N123-T127 PolarHBondContact O-OG1 3.11Å; L124-T127 PolarHBondContact O-N 3.49Å; T127-K129 VanDerWaalsContact C-N 3.29Å; T127-K129 PolarHBondContact O-N 3.21Å; T127-C130 PolarHBondContact O-N 3.17Å; T127-C130 VanDerWaalsContact O-N 3.07Å; T127-V131 HydrophobicContact CG2-CG2 4.21Å; T127-V131 WeakPolarHBondContact O-CG2 3.34Å; T127-V131 PolarHBondContact O-N 3.48Å; T127-A197 HydrophobicContact CG2-CB 3.91Å; T127-I198 HydrophobicContact CG2-CD1 4.25Å; T127-I198 HydrophobicContact CG2-CG1 3.78Å
128	I	96.4	Very high	93.7	Very high	8 Å²	8	36.7 Å²	36.7	4%	0.041	19%	0.189	C	C	.	.	H	α-helix	trans	-58.7	-40.1	176.4	-69.1	171.9	0	0	0	111.6	L124 Y126 C130 A132 Y180 V183 R184 F187	L124-I128 HydrophobicContact CD1-CD1 3.62Å; L124-I128 HydrophobicContact CD1-CG1 3.97Å; L124-I128 HydrophobicContact CG-CD1 3.9Å; L124-I128 WeakPolarHBondContact O-CG1 3.36Å; L124-I128 PolarHBondContact O-N 3.08Å; Y126-I128 PolarHBondContact O-N 3.08Å; I128-C130 VanDerWaalsContact C-N 3.34Å; I128-C130 PolarHBondContact O-N 2.73Å; I128-A132 VanDerWaalsContact O-CB 3.28Å; I128-A132 WeakPolarHBondContact O-CB 3.29Å; I128-A132 PolarHBondContact O-N 3.3Å; I128-Y180 HydrophobicContact CG2-CD2 3.8Å; I128-Y180 HydrophobicContact CG2-CE2 3.78Å; I128-V183 HydrophobicContact CG2-CB 4.27Å; I128-V183 HydrophobicContact CG2-CG1 3.88Å; I128-R184 HydrophobicContact CG2-CB 4.19Å; I128-F187 HydrophobicContact CD1-CB 3.66Å; I128-F187 HydrophobicContact CD1-CD1 4.1Å; I128-F187 HydrophobicContact CD1-CG 3.86Å; I128-F187 HydrophobicContact CG1-CD1 4.36Å; I128-F187 HydrophobicContact CG1-CG 4.31Å
129	K	95.3	Very high	94	Very high	60 Å²	60	33.7 Å²	33.7	26%	0.261	17%	0.171	S	C	.	.	H	α-helix	trans	-62.7	-41.1	176	-73.7	177.8	176.5	-172.6	0	112.3	K125 Y126 T127 L133 Y180	K125-K129 WeakPolarHBondContact O-CG 3.41Å; K125-K129 PolarHBondContact O-N 3Å; Y126-K129 WeakPolarHBondContact O-CB 3.48Å; Y126-K129 PolarHBondContact O-N 2.8Å; Y126-K129 VanDerWaalsContact O-N 3.14Å; T127-K129 VanDerWaalsContact C-N 3.29Å; T127-K129 PolarHBondContact O-N 3.21Å; K129-L133 WeakPolarHBondContact O-CB 3.26Å; K129-L133 PolarHBondContact O-N 2.8Å; K129-L133 VanDerWaalsContact O-N 3.09Å; K129-Y180 HydrophobicContact CB-CE2 4.42Å; K129-Y180 HydrophobicContact CG-CD2 3.87Å; K129-Y180 HydrophobicContact CG-CE2 3.44Å; K129-Y180 VanDerWaalsContact CG-CE2 3.44Å
130	C	95.1	Very high	94.2	Very high	3 Å²	3	34.8 Å²	34.8	2%	0.02	17%	0.171	C	C	.	.	H	α-helix	trans	-72.4	-41.5	-179	-58.4	0	0	0	0	111.2	Y126 T127 I128 L133 A134 L286 A290	Y126-C130 PolarHBondContact O-N 2.73Å; Y126-C130 PolarHBondContact O-SG 3.47Å; T127-C130 PolarHBondContact O-N 3.17Å; T127-C130 VanDerWaalsContact O-N 3.07Å; I128-C130 VanDerWaalsContact C-N 3.34Å; I128-C130 PolarHBondContact O-N 2.73Å; C130-L133 WeakPolarHBondContact O-CB 3.34Å; C130-L133 PolarHBondContact O-N 2.65Å; C130-A134 PolarHBondContact O-N 2.7Å; C130-L286 HydrophobicContact CB-CB 4.35Å; C130-L286 HydrophobicContact CB-CD2 3.76Å; C130-A290 WeakPolarHBondContact SG-CB 3.32Å
131	V	97.7	Very high	94.4	Very high	1 Å²	1	32 Å²	32	1%	0.006	15%	0.149	C	C	.	.	H	α-helix	trans	-62	-45	174.6	171	0	0	0	0	110.6	T127 L133 A134 I135 A197 L201 L286	T127-V131 HydrophobicContact CG2-CG2 4.21Å; T127-V131 WeakPolarHBondContact O-CG2 3.34Å; T127-V131 PolarHBondContact O-N 3.48Å; V131-L133 VanDerWaalsContact C-N 3.26Å; V131-L133 PolarHBondContact O-N 3.29Å; V131-A134 WeakPolarHBondContact O-CB 3.13Å; V131-A134 PolarHBondContact O-N 3.45Å; V131-A134 VanDerWaalsContact O-N 3.13Å; V131-I135 HydrophobicContact CG1-CD1 3.88Å; V131-I135 HydrophobicContact CG1-CG1 4.5Å; V131-I135 WeakPolarHBondContact O-CG1 3.3Å; V131-I135 PolarHBondContact O-N 3.44Å; V131-A197 HydrophobicContact CG2-CB 4.24Å; V131-L201 HydrophobicContact CG2-CD2 4.43Å; V131-L286 HydrophobicContact CG2-CD1 3.96Å; V131-L286 HydrophobicContact CG2-CD2 4.31Å
132	A	97.9	Very high	94.5	Very high	0 Å²	0	30.1 Å²	30.1	0%	0	14%	0.137	C	C	.	.	H	α-helix	trans	-61.3	-35	175	0	0	0	0	0	112.7	I128 Y136 I179 Y180	I128-A132 VanDerWaalsContact O-CB 3.28Å; I128-A132 WeakPolarHBondContact O-CB 3.29Å; I128-A132 PolarHBondContact O-N 3.3Å; A132-Y136 WeakPolarHBondContact O-CB 3.49Å; A132-Y136 PolarHBondContact O-N 3.42Å; A132-I179 HydrophobicContact CB-CG2 4.06Å; A132-Y180 HydrophobicContact CB-CD2 4.45Å
133	L	96.6	Very high	94.1	Very high	4 Å²	4	33.3 Å²	33.3	2%	0.021	15%	0.153	C	C	.	.	H	α-helix	trans	-70	-39.2	173.9	-177.4	61.2	0	0	0	112.2	K129 C130 V131 Y136 Y137 Q176 L289 N293 L295	K129-L133 WeakPolarHBondContact O-CB 3.26Å; K129-L133 PolarHBondContact O-N 2.8Å; K129-L133 VanDerWaalsContact O-N 3.09Å; C130-L133 WeakPolarHBondContact O-CB 3.34Å; C130-L133 PolarHBondContact O-N 2.65Å; V131-L133 VanDerWaalsContact C-N 3.26Å; V131-L133 PolarHBondContact O-N 3.29Å; L133-Y136 HydrophobicContact CD1-CD1 4.09Å; L133-Y136 WeakPolarHBondContact O-CB 3.4Å; L133-Y136 PolarHBondContact O-N 3.18Å; L133-Y137 HydrophobicContact CD1-CD2 4.02Å; L133-Y137 HydrophobicContact CD1-CE2 3.51Å; L133-Y137 HydrophobicContact CD2-CE2 4.1Å; L133-Y137 HydrophobicContact CG-CD2 3.94Å; L133-Y137 HydrophobicContact CG-CE2 3.62Å; L133-Y137 VanDerWaalsContact O-CD2 3.25Å; L133-Y137 WeakPolarHBondContact O-CD2 3.25Å; L133-Y137 PolarHBondContact O-N 3.06Å; L133-Q176 HydrophobicContact CD1-CG 4.29Å; L133-L289 HydrophobicContact CB-CD2 4.31Å; L133-L289 HydrophobicContact CD2-CD1 4.42Å; L133-L289 HydrophobicContact CD2-CD2 4.12Å; L133-L289 HydrophobicContact CD2-CG 3.97Å; L133-L289 HydrophobicContact CG-CD2 4.08Å; L133-L289 HydrophobicContact CG-CG 4.41Å; L133-N293 HydrophobicContact CD2-CB 3.79Å; L133-L295 HydrophobicContact CD2-CD1 3.66Å
134	A	97.4	Very high	93.2	Very high	0 Å²	0	38.3 Å²	38.3	0%	0	18%	0.178	C	C	.	.	H	α-helix	trans	-61.8	-46.7	175	0	0	0	0	0	111.2	F69 C130 V131 Y136 Y137 H138 L201 L286 L289	F69-A134 HydrophobicContact CB-CB 3.68Å; F69-A134 HydrophobicContact CD1-CB 4.16Å; F69-A134 HydrophobicContact CD2-CB 3.89Å; F69-A134 HydrophobicContact CG-CB 3.66Å; C130-A134 PolarHBondContact O-N 2.7Å; V131-A134 WeakPolarHBondContact O-CB 3.13Å; V131-A134 PolarHBondContact O-N 3.45Å; V131-A134 VanDerWaalsContact O-N 3.13Å; A134-Y136 VanDerWaalsContact C-N 3.33Å; A134-Y136 PolarHBondContact O-N 3.4Å; A134-Y137 PolarHBondContact O-N 3.32Å; A134-H138 PolarHBondContact O-CD2 3.37Å; A134-H138 VanDerWaalsContact O-CD2 3.3Å; A134-H138 PolarHBondContact O-N 2.92Å; A134-L201 HydrophobicContact CB-CD1 4.04Å; A134-L201 HydrophobicContact CB-CD2 3.8Å; A134-L286 HydrophobicContact CB-CD2 4.26Å; A134-L289 HydrophobicContact CB-CD2 4.09Å
135	I	97.9	Very high	91.8	Very high	1 Å²	1	41.9 Å²	41.9	1%	0.005	20%	0.198	C	C	.	.	H	α-helix	trans	-60.3	-43.9	174.5	-64.7	164.4	0	0	0	110.7	V131 Y137 H138 I139 I179 V183 L204 I215 V224	V131-I135 HydrophobicContact CG1-CD1 3.88Å; V131-I135 HydrophobicContact CG1-CG1 4.5Å; V131-I135 WeakPolarHBondContact O-CG1 3.3Å; V131-I135 PolarHBondContact O-N 3.44Å; I135-Y137 VanDerWaalsContact C-N 3.29Å; I135-Y137 PolarHBondContact O-N 3.07Å; I135-H138 WeakPolarHBondContact O-CB 3.5Å; I135-H138 PolarHBondContact O-N 2.9Å; I135-H138 VanDerWaalsContact O-N 3.14Å; I135-I139 HydrophobicContact CG2-CD1 4.12Å; I135-I139 WeakPolarHBondContact O-CG1 3.46Å; I135-I139 PolarHBondContact O-N 3.48Å; I135-I179 HydrophobicContact CB-CG2 4.01Å; I135-I179 HydrophobicContact CD1-CG2 4.29Å; I135-I179 HydrophobicContact CG2-CD1 4.28Å; I135-I179 HydrophobicContact CG2-CG2 3.8Å; I135-V183 HydrophobicContact CD1-CG2 4.31Å; I135-L204 HydrophobicContact CD1-CD1 4.27Å; I135-L204 HydrophobicContact CG1-CD1 3.88Å; I135-I215 HydrophobicContact CG2-CD1 3.9Å; I135-V224 HydrophobicContact CD1-CG1 4.32Å; I135-V224 HydrophobicContact CD1-CG2 3.84Å; I135-V224 HydrophobicContact CG1-CG2 4.45Å; I135-V224 HydrophobicContact CG2-CG2 4.01Å
136	Y	96.9	Very high	90.1	Very high	55 Å²	55	40 Å²	40	22%	0.216	21%	0.212	C	C	.	.	H	α-helix	trans	-56.1	-43.6	175.3	172.1	-101.6	0	0	0	112.2	A132 L133 A134 H138 I139 K140 Q176 I179	A132-Y136 WeakPolarHBondContact O-CB 3.49Å; A132-Y136 PolarHBondContact O-N 3.42Å; L133-Y136 HydrophobicContact CD1-CD1 4.09Å; L133-Y136 WeakPolarHBondContact O-CB 3.4Å; L133-Y136 PolarHBondContact O-N 3.18Å; A134-Y136 VanDerWaalsContact C-N 3.33Å; A134-Y136 PolarHBondContact O-N 3.4Å; Y136-H138 VanDerWaalsContact C-N 3.35Å; Y136-I139 PolarHBondContact O-N 3Å; Y136-K140 HydrophobicContact CE1-CB 4.42Å; Y136-K140 HydrophobicContact CE1-CD 3.89Å; Y136-K140 VanDerWaalsContact O-CB 3.32Å; Y136-K140 WeakPolarHBondContact O-CB 3.43Å; Y136-K140 PolarHBondContact O-N 3.05Å; Y136-Q176 HydrophobicContact CD2-CB 4.12Å; Y136-Q176 HydrophobicContact CG-CB 4.09Å; Y136-I179 HydrophobicContact CD2-CD1 4.27Å
137	Y	95.6	Very high	89.1	Confident	2 Å²	2	42.2 Å²	42.2	1%	0.008	22%	0.22	C	C	.	.	H	α-helix	trans	-68.5	-33.2	177.4	-79	-53.4	0	0	0	113.4	D76 L133 A134 I135 I139 N141 L289 N293	D76-Y137 HydrophobicContact CB-CE1 3.72Å; D76-Y137 WeakPolarHBondContact OD2-CE1 3.27Å; L133-Y137 HydrophobicContact CD1-CD2 4.02Å; L133-Y137 HydrophobicContact CD1-CE2 3.51Å; L133-Y137 HydrophobicContact CD2-CE2 4.1Å; L133-Y137 HydrophobicContact CG-CD2 3.94Å; L133-Y137 HydrophobicContact CG-CE2 3.62Å; L133-Y137 VanDerWaalsContact O-CD2 3.25Å; L133-Y137 WeakPolarHBondContact O-CD2 3.25Å; L133-Y137 PolarHBondContact O-N 3.06Å; A134-Y137 PolarHBondContact O-N 3.32Å; I135-Y137 VanDerWaalsContact C-N 3.29Å; I135-Y137 PolarHBondContact O-N 3.07Å; Y137-I139 VanDerWaalsContact C-N 3.32Å; Y137-N141 WeakPolarHBondContact O-CB 3.3Å; Y137-N141 PolarHBondContact O-N 3.1Å; Y137-L289 HydrophobicContact CD2-CD1 4Å; Y137-L289 HydrophobicContact CE2-CD1 3.84Å; Y137-N293 PolarHBondContact OH-OD1 3.12Å
138	H	94.9	Very high	87.9	Confident	0 Å²	0	48 Å²	48	0%	0	25%	0.248	C	C	.	.	H	α-helix	trans	-61.6	-41.3	171.9	-81.3	-65	0	0	0	112.4	F69 A134 I135 Y136 R142 E205 L208 I215	F69-H138 WeakPolarHBondContact CB-NE2 3.49Å; A134-H138 PolarHBondContact O-CD2 3.37Å; A134-H138 VanDerWaalsContact O-CD2 3.3Å; A134-H138 PolarHBondContact O-N 2.92Å; I135-H138 WeakPolarHBondContact O-CB 3.5Å; I135-H138 PolarHBondContact O-N 2.9Å; I135-H138 VanDerWaalsContact O-N 3.14Å; Y136-H138 VanDerWaalsContact C-N 3.35Å; H138-R142 WeakPolarHBondContact O-CA 3.45Å; H138-R142 WeakPolarHBondContact O-CB 3.23Å; H138-R142 PolarHBondContact O-N 2.82Å; H138-E205 IonicContact CE1-OE1 2.93Å; H138-E205 PolarHBondContact CE1-OE1 2.92Å; H138-E205 IonicContact NE2-OE1 2.9Å; H138-E205 PolarHBondContact NE2-OE1 2.74Å; H138-L208 HydrophobicContact CB-CD1 4.46Å; H138-I215 HydrophobicContact CB-CG2 3.45Å; H138-I215 VanDerWaalsContact CB-CG2 3.45Å
139	I	94.4	Very high	87.1	Confident	1 Å²	1	52.5 Å²	52.5	1%	0.005	27%	0.272	C	S	.	.	H	α-helix	trans	-72.3	-53.5	178.2	-59.9	166.1	0	0	0	110.7	I135 Y136 Y137 N141 R142 D173 P174 I179 I215 W220	I135-I139 HydrophobicContact CG2-CD1 4.12Å; I135-I139 WeakPolarHBondContact O-CG1 3.46Å; I135-I139 PolarHBondContact O-N 3.48Å; Y136-I139 PolarHBondContact O-N 3Å; Y137-I139 VanDerWaalsContact C-N 3.32Å; I139-N141 VanDerWaalsContact C-N 3.31Å; I139-N141 PolarHBondContact O-N 3.41Å; I139-R142 WeakPolarHBondContact O-CB 3.42Å; I139-R142 WeakPolarHBondContact O-CD 3.06Å; I139-R142 VanDerWaalsContact O-CG 3.3Å; I139-R142 WeakPolarHBondContact O-CG 3.42Å; I139-R142 PolarHBondContact O-N 3.4Å; I139-R142 PolarHBondContact O-NH1 2.86Å; I139-D173 HydrophobicContact CG2-CB 4.28Å; I139-P174 HydrophobicContact CD1-CG 3.67Å; I139-I179 HydrophobicContact CD1-CD1 3.82Å; I139-I215 HydrophobicContact CB-CG2 4.39Å; I139-I215 HydrophobicContact CD1-CD1 4.3Å; I139-I215 HydrophobicContact CD1-CG1 4.36Å; I139-I215 HydrophobicContact CG1-CB 4.22Å; I139-I215 HydrophobicContact CG1-CD1 4.07Å; I139-I215 HydrophobicContact CG1-CG1 3.84Å; I139-I215 HydrophobicContact CG1-CG2 3.6Å; I139-W220 HydrophobicContact CD1-CB 3.71Å; I139-W220 HydrophobicContact CD1-CD2 4.47Å; I139-W220 HydrophobicContact CD1-CG 3.98Å; I139-W220 HydrophobicContact CG1-CB 4.39Å
140	K	92.7	Very high	86.8	Confident	76 Å²	76	51.7 Å²	51.7	33%	0.33	27%	0.27	S	S	.	.	H	α-helix	trans	-60.2	-41.8	-174.6	-171.4	-166.9	-178.8	-169.3	0	112.1	D76 Y136	D76-K140 IonicContact OD1-NZ 3.49Å; D76-K140 PolarHBondContact OD1-NZ 3.25Å; D76-K140 IonicContact OD2-NZ 3.32Å; D76-K140 PolarHBondContact OD2-NZ 2.73Å; Y136-K140 HydrophobicContact CE1-CB 4.42Å; Y136-K140 HydrophobicContact CE1-CD 3.89Å; Y136-K140 VanDerWaalsContact O-CB 3.32Å; Y136-K140 WeakPolarHBondContact O-CB 3.43Å; Y136-K140 PolarHBondContact O-N 3.05Å
141	N	91.5	Very high	86.7	Confident	39 Å²	39	57 Å²	57	21%	0.209	30%	0.298	C	S	.	.	T	Hydrogen-bonded Turn	trans	-110.5	40	-176.3	-57.8	-23.5	0	0	0	110.4	K72 T75 Y137 I139	K72-N141 HydrophobicContact CB-CB 4.3Å; K72-N141 WeakPolarHBondContact CD-O 3.37Å; K72-N141 VanDerWaalsContact CE-O 3.27Å; K72-N141 WeakPolarHBondContact CE-O 3.3Å; K72-N141 PolarHBondContact O-ND2 3.15Å; T75-N141 PolarHBondContact OG1-ND2 3.06Å; Y137-N141 WeakPolarHBondContact O-CB 3.3Å; Y137-N141 PolarHBondContact O-N 3.1Å; I139-N141 VanDerWaalsContact C-N 3.31Å; I139-N141 PolarHBondContact O-N 3.41Å
142	R	89.6	Confident	86.6	Confident	74 Å²	74	57.7 Å²	57.7	28%	0.279	30%	0.302	S	S	.	.			trans	-67.1	151.4	171.1	67.6	-172.7	174.2	-85.2	11.7	111	H138 I139 D173 D214	H138-R142 WeakPolarHBondContact O-CA 3.45Å; H138-R142 WeakPolarHBondContact O-CB 3.23Å; H138-R142 PolarHBondContact O-N 2.82Å; I139-R142 WeakPolarHBondContact O-CB 3.42Å; I139-R142 WeakPolarHBondContact O-CD 3.06Å; I139-R142 VanDerWaalsContact O-CG 3.3Å; I139-R142 WeakPolarHBondContact O-CG 3.42Å; I139-R142 PolarHBondContact O-N 3.4Å; I139-R142 PolarHBondContact O-NH1 2.86Å; R142-D173 IonicContact CZ-OD1 2.92Å; R142-D173 VanDerWaalsContact CZ-OD1 3.3Å; R142-D173 IonicContact CZ-OD2 2.7Å; R142-D173 IonicContact NH1-OD1 3.6Å; R142-D173 PolarHBondContact NH1-OD1 3.35Å; R142-D173 IonicContact NH1-OD2 3.84Å; R142-D173 PolarHBondContact NH1-OD2 3.31Å; R142-D173 IonicContact NH2-OD1 3.51Å; R142-D173 PolarHBondContact NH2-OD1 2.72Å; R142-D173 IonicContact NH2-OD2 3.74Å; R142-D214 HydrophobicContact CB-CB 4.36Å
143	D	82.9	Confident	86.5	Confident	77 Å²	77	57.7 Å²	57.7	41%	0.412	30%	0.302	S	S	.	.			trans	-71.5	139.3	170.4	-63.7	-33.1	0	0	0	108	R147	D143-R147 IonicContact OD2-CZ 3.96Å; D143-R147 IonicContact OD2-NE 3.98Å; D143-R147 IonicContact OD2-NH2 3.05Å; D143-R147 PolarHBondContact OD2-NH2 3.05Å
144	I	72	Confident	86.3	Confident	162 Å²	162	59.1 Å²	59.1	83%	0.831	31%	0.309	S	S	*	.			trans	-84	-7.3	-179.7	-57	168.2	0	0	0	110.3	G146	I144-G146 VanDerWaalsContact C-N 3.26Å; I144-G146 PolarHBondContact O-N 2.89Å
145	D	64.8	Low	85.9	Confident	140 Å²	140	59.7 Å²	59.7	75%	0.749	31%	0.312	S	S	*	.	S	Bend	trans	-74.9	74	-176.1	-67.4	-22.3	0	0	0	111.2	R147	D145-R147 WeakPolarHBondContact O-CG 3.38Å; D145-R147 PolarHBondContact O-N 3.48Å
146	G	57.3	Low	85.6	Confident	80 Å²	80	66 Å²	66	83%	0.825	34%	0.34	S	S	*	.			trans	44.1	25.3	150.9	0	0	0	0	0	118.8	I144	I144-G146 VanDerWaalsContact C-N 3.26Å; I144-G146 PolarHBondContact O-N 2.89Å
147	R	68.2	Low	85.3	Confident	96 Å²	96	68.1 Å²	68.1	36%	0.362	35%	0.354	S	S	.	.	P	Polyproline II helix	trans	-61.8	148.6	-177.6	-71	-155.4	-158.2	-113.4	1.4	110.6	D143 D145 L149 E212 D214	D143-R147 IonicContact OD2-CZ 3.96Å; D143-R147 IonicContact OD2-NE 3.98Å; D143-R147 IonicContact OD2-NH2 3.05Å; D143-R147 PolarHBondContact OD2-NH2 3.05Å; D145-R147 WeakPolarHBondContact O-CG 3.38Å; D145-R147 PolarHBondContact O-N 3.48Å; R147-L149 PolarHBondContact O-N 3.23Å; R147-E212 WeakPolarHBondContact CB-O 3.45Å; R147-E212 VanDerWaalsContact CD-O 3.22Å; R147-E212 WeakPolarHBondContact CD-O 3.35Å; R147-D214 HydrophobicContact CB-CB 4.24Å; R147-D214 WeakPolarHBondContact CD-OD2 3.44Å; R147-D214 VanDerWaalsContact CG-OD2 3.23Å; R147-D214 WeakPolarHBondContact CG-OD2 3.32Å; R147-D214 IonicContact NE-OD2 3.09Å; R147-D214 PolarHBondContact NE-OD2 3.48Å; R147-D214 VanDerWaalsContact NE-OD2 3.09Å
148	M	70.6	Confident	85.2	Confident	128 Å²	128	70.4 Å²	70.4	63%	0.631	37%	0.365	S	S	*	.	P	Polyproline II helix	trans	-60	131.6	-170.5	-71.6	-165.1	70.5	0	0	111.5	L150	M148-L150 HydrophobicContact CE-CD2 4.25Å
149	L	79.3	Confident	85	Confident	103 Å²	103	73.3 Å²	73.3	54%	0.539	38%	0.383	S	S	.	.	P	Polyproline II helix	trans	-92.3	122.5	161.7	-66.2	176	0	0	0	107.4	R147	R147-L149 PolarHBondContact O-N 3.23Å
150	L	89.1	Confident	84.8	Confident	44 Å²	44	73.7 Å²	73.7	23%	0.23	39%	0.386	C	S	.	.	P	Polyproline II helix	trans	-96.1	133.1	173.8	-60.4	-175.4	0	0	0	109.7	M148 I152 F153 D154 I213 L267	M148-L150 HydrophobicContact CE-CD2 4.25Å; L150-I152 HydrophobicContact CB-CG2 4.13Å; L150-I152 PolarHBondContact O-N 3Å; L150-I152 VanDerWaalsContact O-N 3.15Å; L150-F153 HydrophobicContact CB-CD2 4Å; L150-F153 HydrophobicContact CB-CE2 4.47Å; L150-F153 HydrophobicContact CD1-CD2 4.41Å; L150-F153 HydrophobicContact CD1-CE2 4.09Å; L150-F153 PolarHBondContact O-N 3.41Å; L150-D154 PolarHBondContact O-N 3.41Å; L150-I213 HydrophobicContact CD1-CD1 3.45Å; L150-I213 VanDerWaalsContact CD1-CD1 3.45Å; L150-I213 HydrophobicContact CG-CD1 3.73Å; L150-L267 HydrophobicContact CD1-CD1 3.65Å; L150-L267 HydrophobicContact CD1-CD2 3.85Å; L150-L267 HydrophobicContact CD1-CG 4.41Å
151	D	93.3	Very high	84.4	Confident	113 Å²	113	72.2 Å²	72.2	60%	0.604	39%	0.385	S	S	*	.	G	3₁₀ helix	trans	-52.2	-39.2	-178.1	-67.9	-4.7	0	0	0	112.7	F153 D154 L157 H158	D151-F153 PolarHBondContact O-N 3.29Å; D151-F153 VanDerWaalsContact O-N 3.08Å; D151-D154 WeakPolarHBondContact O-CB 3.5Å; D151-D154 PolarHBondContact O-N 3.24Å; D151-L157 HydrophobicContact CB-CD1 3.68Å; D151-H158 PolarHBondContact O-CD2 2.9Å
152	I	95.5	Very high	83.6	Confident	17 Å²	17	78.7 Å²	78.7	9%	0.087	41%	0.411	C	S	.	.	G	3₁₀ helix	trans	-58.4	-26.6	179.9	-170.4	59	0	0	0	113.6	L150 R222 E259 L260 Q263	L150-I152 HydrophobicContact CB-CG2 4.13Å; L150-I152 PolarHBondContact O-N 3Å; L150-I152 VanDerWaalsContact O-N 3.15Å; I152-R222 WeakPolarHBondContact O-CD 3.33Å; I152-E259 HydrophobicContact CD1-CG 4.02Å; I152-L260 HydrophobicContact CG1-CD1 4.05Å; I152-Q263 HydrophobicContact CD1-CG 4.5Å; I152-Q263 HydrophobicContact CG1-CB 4.06Å; I152-Q263 HydrophobicContact CG1-CG 4.02Å; I152-Q263 HydrophobicContact CG2-CB 4.34Å
153	F	95.6	Very high	83	Confident	0 Å²	0	79 Å²	79	0%	0	43%	0.425	C	S	.	.	G	3₁₀ helix	trans	-95.8	-8.8	178.7	-58.6	-50.1	0	0	0	113.4	L150 D151 E155 L207 I213 N219 R222 I223 L260 F264 L267	L150-F153 HydrophobicContact CB-CD2 4Å; L150-F153 HydrophobicContact CB-CE2 4.47Å; L150-F153 HydrophobicContact CD1-CD2 4.41Å; L150-F153 HydrophobicContact CD1-CE2 4.09Å; L150-F153 PolarHBondContact O-N 3.41Å; D151-F153 PolarHBondContact O-N 3.29Å; D151-F153 VanDerWaalsContact O-N 3.08Å; F153-E155 PolarHBondContact O-N 2.59Å; F153-L207 HydrophobicContact CE2-CD1 4.42Å; F153-L207 HydrophobicContact CE2-CD2 4.07Å; F153-L207 HydrophobicContact CZ-CD1 4.09Å; F153-L207 HydrophobicContact CZ-CD2 3.88Å; F153-I213 HydrophobicContact CD2-CD1 4.11Å; F153-I213 HydrophobicContact CE2-CD1 3.78Å; F153-N219 HydrophobicContact CB-CB 3.92Å; F153-N219 VanDerWaalsContact O-CA 3.22Å; F153-N219 WeakPolarHBondContact O-CA 3.25Å; F153-N219 WeakPolarHBondContact O-CB 3.41Å; F153-R222 HydrophobicContact CB-CB 4.22Å; F153-R222 HydrophobicContact CD1-CB 4.16Å; F153-R222 WeakPolarHBondContact O-CB 3.48Å; F153-R222 WeakPolarHBondContact O-CG 3.38Å; F153-I223 HydrophobicContact CB-CG1 4.05Å; F153-I223 HydrophobicContact CD1-CG1 3.82Å; F153-I223 HydrophobicContact CD2-CD1 4.41Å; F153-I223 HydrophobicContact CD2-CG1 4.02Å; F153-I223 HydrophobicContact CE1-CG1 4.25Å; F153-I223 HydrophobicContact CE2-CG1 4.42Å; F153-I223 HydrophobicContact CG-CD1 4.44Å; F153-I223 HydrophobicContact CG-CG1 3.7Å; F153-L260 HydrophobicContact CD1-CD1 3.89Å; F153-L260 HydrophobicContact CE1-CD1 3.73Å; F153-F264 AromaticContact CE1-CD2 3.94Å; F153-F264 HydrophobicContact CE1-CD2 3.94Å; F153-F264 HydrophobicContact CE1-CE2 4.46Å; F153-F264 HydrophobicContact CZ-CD2 4.09Å; F153-L267 HydrophobicContact CE2-CD1 3.56Å; F153-L267 HydrophobicContact CZ-CD1 3.6Å
154	D	93	Very high	82.8	Confident	33 Å²	33	84.2 Å²	84.2	18%	0.176	45%	0.446	C	S	.	.			trans	-69.8	120.4	-179.7	-174.3	-57.9	0	0	0	110.9	L150 D151 K156 L157 H158 Y169	L150-D154 PolarHBondContact O-N 3.41Å; D151-D154 WeakPolarHBondContact O-CB 3.5Å; D151-D154 PolarHBondContact O-N 3.24Å; D154-K156 VanDerWaalsContact C-N 3.3Å; D154-K156 PolarHBondContact O-N 3.44Å; D154-K156 VanDerWaalsContact OD1-CA 3.3Å; D154-K156 WeakPolarHBondContact OD1-CA 3.35Å; D154-K156 VanDerWaalsContact OD1-CB 3.23Å; D154-K156 WeakPolarHBondContact OD1-CB 3.32Å; D154-K156 PolarHBondContact OD1-N 3.07Å; D154-L157 HydrophobicContact CB-CB 4.11Å; D154-L157 HydrophobicContact CB-CD1 3.92Å; D154-L157 HydrophobicContact CB-CG 3.98Å; D154-L157 PolarHBondContact O-N 3.28Å; D154-L157 PolarHBondContact OD1-N 3.13Å; D154-H158 PolarHBondContact O-N 2.94Å; D154-Y169 PolarHBondContact OD1-OH 2.96Å; D154-Y169 PolarHBondContact OD2-OH 2.73Å
155	E	89.9	Confident	83.4	Confident	12 Å²	12	77.9 Å²	77.9	6%	0.056	42%	0.415	C	S	.	.	T	Hydrogen-bonded Turn	trans	-68.3	-26.6	-178.3	-173.8	172.7	177.4	0	0	113.1	F153 H158 P159 V165 Y169 A218 K221	F153-E155 PolarHBondContact O-N 2.59Å; E155-H158 CarbonylContact O-C 3.54Å; E155-H158 VanDerWaalsContact O-C 3.23Å; E155-P159 WeakPolarHBondContact O-CA 3.25Å; E155-P159 VanDerWaalsContact O-N 3.15Å; E155-V165 HydrophobicContact CG-CG2 4.18Å; E155-Y169 HydrophobicContact CB-CD2 4.41Å; E155-Y169 HydrophobicContact CB-CE2 4.4Å; E155-A218 VanDerWaalsContact CB-O 3.26Å; E155-A218 WeakPolarHBondContact CB-O 3.24Å; E155-A218 PolarHBondContact N-O 3.31Å; E155-K221 WeakPolarHBondContact OE1-CD 3.36Å; E155-K221 IonicContact OE1-NZ 3.05Å; E155-K221 PolarHBondContact OE1-NZ 3.3Å; E155-K221 WeakPolarHBondContact OE2-CD 3.45Å; E155-K221 IonicContact OE2-NZ 3.91Å; E155-K221 PolarHBondContact OE2-NZ 2.96Å
156	K	90.6	Very high	84.4	Confident	135 Å²	135	74.8 Å²	74.8	59%	0.587	40%	0.403	S	S	*	.	T	Hydrogen-bonded Turn	trans	-76.7	-40.8	177.4	-177.7	-179.2	179.4	-178.6	0	111.6	D154 H158 V165 Y169	D154-K156 VanDerWaalsContact C-N 3.3Å; D154-K156 PolarHBondContact O-N 3.44Å; D154-K156 VanDerWaalsContact OD1-CA 3.3Å; D154-K156 WeakPolarHBondContact OD1-CA 3.35Å; D154-K156 VanDerWaalsContact OD1-CB 3.23Å; D154-K156 WeakPolarHBondContact OD1-CB 3.32Å; D154-K156 PolarHBondContact OD1-N 3.07Å; K156-H158 VanDerWaalsContact C-N 3.3Å; K156-V165 HydrophobicContact CB-CG1 4.33Å; K156-Y169 HydrophobicContact CB-CE1 4.03Å; K156-Y169 HydrophobicContact CB-CE2 4.02Å; K156-Y169 HydrophobicContact CD-CE1 3.99Å
157	L	91.8	Very high	85.8	Confident	99 Å²	99	75.7 Å²	75.7	52%	0.518	40%	0.402	S	S	.	.	T	Hydrogen-bonded Turn	trans	-68.1	-36.8	174.7	-63.4	-179.8	0	0	0	111.1	D151 D154	D151-L157 HydrophobicContact CB-CD1 3.68Å; D154-L157 HydrophobicContact CB-CB 4.11Å; D154-L157 HydrophobicContact CB-CD1 3.92Å; D154-L157 HydrophobicContact CB-CG 3.98Å; D154-L157 PolarHBondContact O-N 3.28Å; D154-L157 PolarHBondContact OD1-N 3.13Å
158	H	92.6	Very high	86.7	Confident	50 Å²	50	74.2 Å²	74.2	23%	0.231	40%	0.402	C	S	.	.	S	Bend	trans	-132.1	84.1	-178	-54.3	-103.9	0	0	0	111.1	D151 D154 E155 K156 R222 D256	D151-H158 PolarHBondContact O-CD2 2.9Å; D154-H158 PolarHBondContact O-N 2.94Å; E155-H158 CarbonylContact O-C 3.54Å; E155-H158 VanDerWaalsContact O-C 3.23Å; K156-H158 VanDerWaalsContact C-N 3.3Å; H158-R222 VanDerWaalsContact C-NH2 3.3Å; H158-R222 VanDerWaalsContact CB-NE 3.26Å; H158-R222 PolarHBondContact O-NE 3.43Å; H158-R222 PolarHBondContact O-NH2 3.24Å; H158-D256 IonicContact CE1-OD1 3.69Å; H158-D256 IonicContact CG-OD1 2.9Å; H158-D256 IonicContact ND1-OD1 2.8Å; H158-D256 PolarHBondContact ND1-OD1 3.21Å
159	P	91	Very high	87.5	Confident	60 Å²	60	70.1 Å²	70.1	39%	0.39	38%	0.38	S	S	.	.			trans	-69.6	147.4	-176.8	26.6	-33.9	0	0	0	112.7	E155 V165	E155-P159 WeakPolarHBondContact O-CA 3.25Å; E155-P159 VanDerWaalsContact O-N 3.15Å; P159-V165 HydrophobicContact CB-CG2 4.12Å
160	L	89.6	Confident	88	Confident	10 Å²	10	69 Å²	69	5%	0.052	37%	0.374	C	S	.	.	S	Bend	trans	-99.6	1	176.8	-56.1	179.9	0	0	0	113.3	F182 K221 R222 L225 I252	L160-F182 HydrophobicContact CD1-CE2 4.18Å; L160-F182 HydrophobicContact CD1-CZ 4.03Å; L160-K221 HydrophobicContact CD1-CB 3.41Å; L160-K221 VanDerWaalsContact CD1-CB 3.41Å; L160-K221 HydrophobicContact CD1-CD 4.2Å; L160-K221 HydrophobicContact CD1-CG 4.45Å; L160-R222 HydrophobicContact CD1-CG 4.47Å; L160-R222 HydrophobicContact CD2-CG 4.32Å; L160-L225 HydrophobicContact CD1-CD2 4.43Å; L160-L225 HydrophobicContact CD2-CD2 3.76Å; L160-I252 HydrophobicContact CB-CD1 4.14Å; L160-I252 HydrophobicContact CD2-CD1 3.34Å; L160-I252 HydrophobicContact CD2-CG1 4.29Å; L160-I252 HydrophobicContact CG-CD1 4.32Å
161	S	85.1	Confident	87.9	Confident	45 Å²	45	73.5 Å²	73.5	32%	0.315	39%	0.392	S	S	.	.	S	Bend	trans	-153.4	154.2	-177.6	65.5	0	0	0	0	111.8	S163	S161-S163 VanDerWaalsContact C-N 3.25Å; S161-S163 PolarHBondContact O-N 3.2Å; S161-S163 PolarHBondContact OG-OG 2.63Å; S161-S163 VanDerWaalsContact OG-OG 3.05Å
162	K	73.3	Confident	87.8	Confident	174 Å²	174	75.9 Å²	75.9	76%	0.757	39%	0.393	S	S	*	.	S	Bend	trans	-56.7	-24.6	172.8	-97.8	175.3	-137.3	-155.6	0	116.9	E164 D251	K162-E164 PolarHBondContact O-N 2.75Å; K162-D251 WeakPolarHBondContact CB-OD2 3.34Å; K162-D251 VanDerWaalsContact CE-CG 3.41Å; K162-D251 WeakPolarHBondContact CE-OD1 3.31Å; K162-D251 HydrophobicContact CG-CB 4.38Å; K162-D251 VanDerWaalsContact CG-CG 3.5Å; K162-D251 VanDerWaalsContact CG-OD2 3.25Å; K162-D251 WeakPolarHBondContact CG-OD2 3.32Å; K162-D251 PolarHBondContact N-OD2 3.43Å; K162-D251 IonicContact NZ-OD1 3.66Å
163	S	78.2	Confident	87.7	Confident	81 Å²	81	78 Å²	78	57%	0.566	41%	0.405	S	S	*	.	S	Bend	trans	-68.4	130.4	178.3	50.1	0	0	0	0	109.3	S161 V165	S161-S163 VanDerWaalsContact C-N 3.25Å; S161-S163 PolarHBondContact O-N 3.2Å; S161-S163 PolarHBondContact OG-OG 2.63Å; S161-S163 VanDerWaalsContact OG-OG 3.05Å; S163-V165 PolarHBondContact O-N 3.2Å
164	E	78.1	Confident	87.6	Confident	186 Å²	186	78.3 Å²	78.3	87%	0.869	41%	0.407	S	S	*	.	P	Polyproline II helix	trans	-51.3	129.6	172.3	-72.1	-174	172	0	0	109.6	K162 P166	K162-E164 PolarHBondContact O-N 2.75Å; E164-P166 WeakPolarHBondContact O-CD 3.48Å
165	V	84.6	Confident	87.7	Confident	29 Å²	29	82.7 Å²	82.7	18%	0.176	43%	0.427	C	S	.	.	P	Polyproline II helix	trans	-63.6	120.8	175.4	178.3	0	0	0	0	107	E155 K156 P159 S163 Y169	E155-V165 HydrophobicContact CG-CG2 4.18Å; K156-V165 HydrophobicContact CB-CG1 4.33Å; P159-V165 HydrophobicContact CB-CG2 4.12Å; S163-V165 PolarHBondContact O-N 3.2Å; V165-Y169 VanDerWaalsContact CG1-CB 3.45Å; V165-Y169 HydrophobicContact CG1-CD1 3.85Å; V165-Y169 HydrophobicContact CG1-CD2 3.58Å; V165-Y169 HydrophobicContact CG1-CE2 4.29Å; V165-Y169 HydrophobicContact CG1-CG 3.32Å
166	P	86.4	Confident	88	Confident	76 Å²	76	85.3 Å²	85.3	49%	0.494	44%	0.439	S	S	.	.	P	Polyproline II helix	trans	-55	148.9	-177.9	-27.1	35.5	0	0	0	112	E164 D168 Y169	E164-P166 WeakPolarHBondContact O-CD 3.48Å; P166-D168 WeakPolarHBondContact CB-OD1 3.22Å; P166-D168 PolarHBondContact O-N 3.34Å; P166-D168 VanDerWaalsContact O-N 3.08Å; P166-Y169 VanDerWaalsContact O-CB 3.3Å; P166-Y169 WeakPolarHBondContact O-CB 3.26Å; P166-Y169 VanDerWaalsContact O-CD1 3.25Å; P166-Y169 WeakPolarHBondContact O-CD1 3.34Å; P166-Y169 PolarHBondContact O-N 2.57Å; P166-Y169 VanDerWaalsContact O-N 3.08Å
167	A	85.9	Confident	88.2	Confident	98 Å²	98	84.4 Å²	84.4	81%	0.81	44%	0.435	S	S	*	.	T	Hydrogen-bonded Turn	trans	-63.5	-17.2	179.4	0	0	0	0	0	113.4
168	D	87.9	Confident	88.4	Confident	65 Å²	65	84.3 Å²	84.3	35%	0.348	43%	0.432	S	S	.	.	T	Hydrogen-bonded Turn	trans	-108	17.5	178.5	61.6	-23.9	0	0	0	113.5	P166 D170 K171 Y172	P166-D168 WeakPolarHBondContact CB-OD1 3.22Å; P166-D168 PolarHBondContact O-N 3.34Å; P166-D168 VanDerWaalsContact O-N 3.08Å; D168-D170 PolarHBondContact O-N 3.29Å; D168-D170 VanDerWaalsContact O-N 3.11Å; D168-K171 HydrophobicContact CB-CB 4.43Å; D168-K171 HydrophobicContact CB-CD 3.86Å; D168-K171 HydrophobicContact CB-CG 4.13Å; D168-K171 WeakPolarHBondContact O-CB 3.5Å; D168-K171 PolarHBondContact O-N 2.86Å; D168-Y172 HydrophobicContact CB-CE2 4.28Å; D168-Y172 WeakPolarHBondContact OD2-CE2 3.39Å
169	Y	87.2	Confident	88.7	Confident	42 Å²	42	82 Å²	82	17%	0.165	42%	0.421	C	S	.	.	T	Hydrogen-bonded Turn	trans	-56.6	-26.8	-178.1	77.8	-68.1	0	0	0	114.7	D154 E155 K156 V165 P166 P217 A218	D154-Y169 PolarHBondContact OD1-OH 2.96Å; D154-Y169 PolarHBondContact OD2-OH 2.73Å; E155-Y169 HydrophobicContact CB-CD2 4.41Å; E155-Y169 HydrophobicContact CB-CE2 4.4Å; K156-Y169 HydrophobicContact CB-CE1 4.03Å; K156-Y169 HydrophobicContact CB-CE2 4.02Å; K156-Y169 HydrophobicContact CD-CE1 3.99Å; V165-Y169 VanDerWaalsContact CG1-CB 3.45Å; V165-Y169 HydrophobicContact CG1-CD1 3.85Å; V165-Y169 HydrophobicContact CG1-CD2 3.58Å; V165-Y169 HydrophobicContact CG1-CE2 4.29Å; V165-Y169 HydrophobicContact CG1-CG 3.32Å; P166-Y169 VanDerWaalsContact O-CB 3.3Å; P166-Y169 WeakPolarHBondContact O-CB 3.26Å; P166-Y169 VanDerWaalsContact O-CD1 3.25Å; P166-Y169 WeakPolarHBondContact O-CD1 3.34Å; P166-Y169 PolarHBondContact O-N 2.57Å; P166-Y169 VanDerWaalsContact O-N 3.08Å; Y169-P217 WeakPolarHBondContact O-CB 3.33Å; Y169-A218 HydrophobicContact CD2-CB 4.16Å; Y169-A218 HydrophobicContact CE2-CB 3.52Å
170	D	88.6	Confident	89	Confident	79 Å²	79	81 Å²	81	42%	0.422	41%	0.41	S	S	.	.	T	Hydrogen-bonded Turn	trans	-88.1	-10.4	-179.5	64.7	-19.7	0	0	0	113.3	D168 A218	D168-D170 PolarHBondContact O-N 3.29Å; D168-D170 VanDerWaalsContact O-N 3.11Å; D170-A218 HydrophobicContact CB-CB 3.92Å
171	K	88.3	Confident	89.4	Confident	139 Å²	139	86.6 Å²	86.6	60%	0.604	43%	0.43	S	S	*	.	T	Hydrogen-bonded Turn	trans	-85.6	-32.9	-171.4	-61.1	-167.7	-175.3	171.9	0	114.4	D168	D168-K171 HydrophobicContact CB-CB 4.43Å; D168-K171 HydrophobicContact CB-CD 3.86Å; D168-K171 HydrophobicContact CB-CG 4.13Å; D168-K171 WeakPolarHBondContact O-CB 3.5Å; D168-K171 PolarHBondContact O-N 2.86Å
172	Y	90.5	Very high	89.9	Confident	163 Å²	163	86 Å²	86	64%	0.639	42%	0.422	S	S	*	.	S	Bend	trans	-117.1	120.7	-168	-60.2	-71.1	0	0	0	112.1	D168 P217	D168-Y172 HydrophobicContact CB-CE2 4.28Å; D168-Y172 WeakPolarHBondContact OD2-CE2 3.39Å; Y172-P217 WeakPolarHBondContact O-CB 3.03Å
173	D	93.1	Very high	91.1	Very high	61 Å²	61	77.8 Å²	77.8	33%	0.326	39%	0.386	S	S	.	.	P	Polyproline II helix	trans	-59.5	134	174.8	-69.2	4.5	0	0	0	111.4	I139 R142 P217	I139-D173 HydrophobicContact CG2-CB 4.28Å; R142-D173 IonicContact CZ-OD1 2.92Å; R142-D173 VanDerWaalsContact CZ-OD1 3.3Å; R142-D173 IonicContact CZ-OD2 2.7Å; R142-D173 IonicContact NH1-OD1 3.6Å; R142-D173 PolarHBondContact NH1-OD1 3.35Å; R142-D173 IonicContact NH1-OD2 3.84Å; R142-D173 PolarHBondContact NH1-OD2 3.31Å; R142-D173 IonicContact NH2-OD1 3.51Å; R142-D173 PolarHBondContact NH2-OD1 2.72Å; R142-D173 IonicContact NH2-OD2 3.74Å; D173-P217 VanDerWaalsContact OD1-CG 3.23Å; D173-P217 WeakPolarHBondContact OD1-CG 3.31Å
174	P	94.6	Very high	92	Very high	8 Å²	8	79.2 Å²	79.2	5%	0.052	38%	0.379	C	S	.	.	P	Polyproline II helix	trans	-66.6	141.3	178.3	29	-35.9	0	0	0	111	I139 Q178 I179 W220	I139-P174 HydrophobicContact CD1-CG 3.67Å; P174-Q178 HydrophobicContact CB-CB 4.46Å; P174-I179 HydrophobicContact CB-CG1 4.15Å; P174-I179 HydrophobicContact CG-CD1 4.06Å; P174-I179 HydrophobicContact CG-CG1 4.06Å; P174-W220 HydrophobicContact CB-CZ2 3.97Å; P174-W220 HydrophobicContact CG-CD2 4.2Å; P174-W220 HydrophobicContact CG-CG 4.26Å; P174-W220 HydrophobicContact CG-CZ2 4.32Å
175	E	95.3	Very high	92.9	Very high	125 Å²	125	73.9 Å²	73.9	58%	0.584	36%	0.36	S	S	*	.	P	Polyproline II helix	trans	-64.1	147	168.7	-65	-175.4	176.8	0	0	110.5	K177 Q178 I179	E175-K177 PolarHBondContact O-N 3.29Å; E175-Q178 HydrophobicContact CB-CG 4.35Å; E175-Q178 WeakPolarHBondContact O-CB 3.15Å; E175-Q178 PolarHBondContact O-N 3.38Å; E175-I179 PolarHBondContact O-N 3.32Å
176	Q	94.6	Very high	93.4	Very high	66 Å²	66	72.6 Å²	72.6	31%	0.308	35%	0.352	S	S	.	.	H	α-helix	trans	-49.1	-35.6	173.2	-172.7	-163.5	-7.5	0	0	112.4	L133 Y136 Q178 I179 Y180	L133-Q176 HydrophobicContact CD1-CG 4.29Å; Y136-Q176 HydrophobicContact CD2-CB 4.12Å; Y136-Q176 HydrophobicContact CG-CB 4.09Å; Q176-Q178 VanDerWaalsContact C-N 3.35Å; Q176-Q178 PolarHBondContact O-N 3.2Å; Q176-I179 PolarHBondContact O-N 3.3Å; Q176-Y180 WeakPolarHBondContact O-CB 3.31Å; Q176-Y180 PolarHBondContact O-N 2.96Å
177	K	95.7	Very high	93.9	Very high	117 Å²	117	69 Å²	69	51%	0.509	33%	0.329	S	S	.	.	H	α-helix	trans	-66	-34.6	179.1	-171.2	178.7	-177.7	-177.1	0	112.8	E175 R181	E175-K177 PolarHBondContact O-N 3.29Å; K177-R181 VanDerWaalsContact CE-NH2 3.35Å; K177-R181 WeakPolarHBondContact O-CB 3.5Å; K177-R181 VanDerWaalsContact O-CG 3.24Å; K177-R181 WeakPolarHBondContact O-CG 3.4Å; K177-R181 PolarHBondContact O-N 2.79Å
178	Q	96.2	Very high	94.4	Very high	97 Å²	97	68.8 Å²	68.8	45%	0.453	32%	0.321	S	S	.	.	H	α-helix	trans	-69.1	-46.8	176.7	-67.5	171.2	-67.3	0	0	110.2	P174 E175 Q176 Y180 R181 F182	P174-Q178 HydrophobicContact CB-CB 4.46Å; E175-Q178 HydrophobicContact CB-CG 4.35Å; E175-Q178 WeakPolarHBondContact O-CB 3.15Å; E175-Q178 PolarHBondContact O-N 3.38Å; Q176-Q178 VanDerWaalsContact C-N 3.35Å; Q176-Q178 PolarHBondContact O-N 3.2Å; Q178-Y180 PolarHBondContact O-N 3.32Å; Q178-R181 PolarHBondContact O-N 3.37Å; Q178-F182 PolarHBondContact O-N 3.06Å
179	I	97.9	Very high	94.7	Very high	0 Å²	0	68.2 Å²	68.2	0%	0	33%	0.325	C	S	.	.	H	α-helix	trans	-59.3	-48.8	175.6	-56.4	167.5	0	0	0	110.4	A132 I135 Y136 I139 P174 E175 Q176 R181 F182 V183 W220	A132-I179 HydrophobicContact CB-CG2 4.06Å; I135-I179 HydrophobicContact CB-CG2 4.01Å; I135-I179 HydrophobicContact CD1-CG2 4.29Å; I135-I179 HydrophobicContact CG2-CD1 4.28Å; I135-I179 HydrophobicContact CG2-CG2 3.8Å; Y136-I179 HydrophobicContact CD2-CD1 4.27Å; I139-I179 HydrophobicContact CD1-CD1 3.82Å; P174-I179 HydrophobicContact CB-CG1 4.15Å; P174-I179 HydrophobicContact CG-CD1 4.06Å; P174-I179 HydrophobicContact CG-CG1 4.06Å; E175-I179 PolarHBondContact O-N 3.32Å; Q176-I179 PolarHBondContact O-N 3.3Å; I179-R181 VanDerWaalsContact C-N 3.34Å; I179-R181 PolarHBondContact O-N 3.29Å; I179-F182 PolarHBondContact O-N 3.29Å; I179-V183 HydrophobicContact CG2-CG2 4.42Å; I179-V183 WeakPolarHBondContact O-CG2 3.34Å; I179-V183 PolarHBondContact O-N 3.14Å; I179-W220 HydrophobicContact CB-CZ3 4.2Å; I179-W220 HydrophobicContact CG1-CE3 4.2Å; I179-W220 HydrophobicContact CG1-CH2 4.16Å; I179-W220 HydrophobicContact CG1-CZ3 3.96Å; I179-W220 HydrophobicContact CG2-CZ3 4.24Å
180	Y	97.8	Very high	95	Very high	39 Å²	39	66.8 Å²	66.8	15%	0.153	32%	0.322	C	S	.	.	H	α-helix	trans	-58.3	-43.5	177.5	168.9	-104.4	0	0	0	112.6	I128 K129 A132 Q176 Q178 R184	I128-Y180 HydrophobicContact CG2-CD2 3.8Å; I128-Y180 HydrophobicContact CG2-CE2 3.78Å; K129-Y180 HydrophobicContact CB-CE2 4.42Å; K129-Y180 HydrophobicContact CG-CD2 3.87Å; K129-Y180 HydrophobicContact CG-CE2 3.44Å; K129-Y180 VanDerWaalsContact CG-CE2 3.44Å; A132-Y180 HydrophobicContact CB-CD2 4.45Å; Q176-Y180 WeakPolarHBondContact O-CB 3.31Å; Q176-Y180 PolarHBondContact O-N 2.96Å; Q178-Y180 PolarHBondContact O-N 3.32Å; Y180-R184 HydrophobicContact CE2-CB 4.44Å; Y180-R184 WeakPolarHBondContact O-CB 3.48Å; Y180-R184 PolarHBondContact O-N 3.03Å; Y180-R184 WeakPolarHBondContact OH-CD 3.46Å
181	R	97.4	Very high	95.2	Very high	129 Å²	129	70.8 Å²	70.8	49%	0.487	34%	0.338	S	S	.	.	H	α-helix	trans	-62.3	-44.7	177.5	-79.6	171.6	173.7	-179.9	-5.6	111.1	K177 Q178 I179 T185	K177-R181 VanDerWaalsContact CE-NH2 3.35Å; K177-R181 WeakPolarHBondContact O-CB 3.5Å; K177-R181 VanDerWaalsContact O-CG 3.24Å; K177-R181 WeakPolarHBondContact O-CG 3.4Å; K177-R181 PolarHBondContact O-N 2.79Å; Q178-R181 PolarHBondContact O-N 3.37Å; I179-R181 VanDerWaalsContact C-N 3.34Å; I179-R181 PolarHBondContact O-N 3.29Å; R181-T185 WeakPolarHBondContact O-CB 2.88Å; R181-T185 PolarHBondContact O-N 3.36Å; R181-T185 PolarHBondContact O-OG1 2.86Å
182	F	97	Very high	95.6	Very high	31 Å²	31	64.3 Å²	64.3	14%	0.136	31%	0.31	C	S	.	.	H	α-helix	trans	-59.4	-56.1	178.7	-178.5	-106.2	0	0	0	111.6	L160 Q178 I179 R184 T185 L186 W220 K221 V224 L225	L160-F182 HydrophobicContact CD1-CE2 4.18Å; L160-F182 HydrophobicContact CD1-CZ 4.03Å; Q178-F182 PolarHBondContact O-N 3.06Å; I179-F182 PolarHBondContact O-N 3.29Å; F182-R184 PolarHBondContact O-N 2.85Å; F182-T185 PolarHBondContact O-N 2.75Å; F182-L186 HydrophobicContact CD1-CD1 4.21Å; F182-L186 HydrophobicContact CE1-CD1 3.69Å; F182-L186 HydrophobicContact CE2-CD1 4.29Å; F182-L186 HydrophobicContact CZ-CD1 3.75Å; F182-L186 PolarHBondContact O-N 2.9Å; F182-W220 HydrophobicContact CB-CH2 3.99Å; F182-W220 HydrophobicContact CB-CZ3 4.05Å; F182-W220 HydrophobicContact CD1-CH2 4.49Å; F182-W220 AromaticContact CD1-CZ3 3.87Å; F182-W220 HydrophobicContact CD1-CZ3 3.87Å; F182-W220 HydrophobicContact CG-CH2 4.25Å; F182-W220 HydrophobicContact CG-CZ3 4.09Å; F182-K221 HydrophobicContact CE1-CB 4.41Å; F182-K221 HydrophobicContact CE2-CB 4.46Å; F182-K221 HydrophobicContact CE2-CD 4.49Å; F182-K221 HydrophobicContact CZ-CB 4.12Å; F182-V224 HydrophobicContact CD1-CG1 4.05Å; F182-V224 HydrophobicContact CE1-CB 4.17Å; F182-V224 HydrophobicContact CE1-CG1 3.92Å; F182-L225 HydrophobicContact CZ-CB 4.34Å
183	V	98.2	Very high	95.8	Very high	2 Å²	2	58.9 Å²	58.9	1%	0.012	29%	0.294	C	S	.	.	H	α-helix	trans	-58.8	-47.2	178.8	179.6	0	0	0	0	110.7	I128 I135 I179 T185 L186 F187 V224	I128-V183 HydrophobicContact CG2-CB 4.27Å; I128-V183 HydrophobicContact CG2-CG1 3.88Å; I135-V183 HydrophobicContact CD1-CG2 4.31Å; I179-V183 HydrophobicContact CG2-CG2 4.42Å; I179-V183 WeakPolarHBondContact O-CG2 3.34Å; I179-V183 PolarHBondContact O-N 3.14Å; V183-T185 VanDerWaalsContact C-N 3.33Å; V183-T185 PolarHBondContact O-N 3.34Å; V183-L186 PolarHBondContact O-N 3.49Å; V183-F187 HydrophobicContact CG1-CD2 3.65Å; V183-F187 HydrophobicContact CG1-CE2 3.72Å; V183-F187 VanDerWaalsContact O-CD2 3.26Å; V183-F187 WeakPolarHBondContact O-CD2 3.36Å; V183-F187 PolarHBondContact O-N 3.48Å; V183-V224 HydrophobicContact CG2-CG1 3.87Å
184	R	97.3	Very high	95.9	Very high	111 Å²	111	56.1 Å²	56.1	42%	0.419	28%	0.28	S	S	.	.	H	α-helix	trans	-60.8	-40.3	-180	-174.9	-172.5	67.5	172.1	1.8	112.6	I128 Y180 F182 S188	I128-R184 HydrophobicContact CG2-CB 4.19Å; Y180-R184 HydrophobicContact CE2-CB 4.44Å; Y180-R184 WeakPolarHBondContact O-CB 3.48Å; Y180-R184 PolarHBondContact O-N 3.03Å; Y180-R184 WeakPolarHBondContact OH-CD 3.46Å; F182-R184 PolarHBondContact O-N 2.85Å; R184-S188 WeakPolarHBondContact O-CB 3.33Å; R184-S188 PolarHBondContact O-N 3.24Å
185	T	96	Very high	96	Very high	75 Å²	75	57.8 Å²	57.8	46%	0.46	29%	0.287	S	S	.	.	H	α-helix	trans	-62	-46	178.8	-65.4	0	0	0	0	110.6	R181 F182 V183 S188 A189	R181-T185 WeakPolarHBondContact O-CB 2.88Å; R181-T185 PolarHBondContact O-N 3.36Å; R181-T185 PolarHBondContact O-OG1 2.86Å; F182-T185 PolarHBondContact O-N 2.75Å; V183-T185 VanDerWaalsContact C-N 3.33Å; V183-T185 PolarHBondContact O-N 3.34Å; T185-S188 PolarHBondContact O-N 3.33Å; T185-A189 VanDerWaalsContact O-CB 3.23Å; T185-A189 WeakPolarHBondContact O-CB 3.45Å; T185-A189 PolarHBondContact O-N 3.16Å
186	L	96.2	Very high	96.1	Very high	1 Å²	1	51.8 Å²	51.8	1%	0.005	26%	0.259	C	S	.	.	H	α-helix	trans	-62.9	-50.7	177.9	-66.7	173.4	0	0	0	111.7	F182 V183 S188 A189 A190 L225 I228 Y245 I248 L249	F182-L186 HydrophobicContact CD1-CD1 4.21Å; F182-L186 HydrophobicContact CE1-CD1 3.69Å; F182-L186 HydrophobicContact CE2-CD1 4.29Å; F182-L186 HydrophobicContact CZ-CD1 3.75Å; F182-L186 PolarHBondContact O-N 2.9Å; V183-L186 PolarHBondContact O-N 3.49Å; L186-S188 VanDerWaalsContact C-N 3.32Å; L186-S188 PolarHBondContact O-N 3.17Å; L186-A189 PolarHBondContact O-N 2.75Å; L186-A190 WeakPolarHBondContact O-CB 3.25Å; L186-A190 PolarHBondContact O-N 3.01Å; L186-L225 HydrophobicContact CD1-CD1 4.01Å; L186-L225 HydrophobicContact CD2-CD1 4.33Å; L186-I228 HydrophobicContact CB-CD1 4.39Å; L186-I228 HydrophobicContact CD1-CD1 3.67Å; L186-Y245 HydrophobicContact CD2-CD1 4.47Å; L186-I248 HydrophobicContact CD2-CG2 4.16Å; L186-L249 HydrophobicContact CD2-CD1 4.17Å; L186-L249 HydrophobicContact CD2-CD2 4.46Å; L186-L249 HydrophobicContact CD2-CG 4.33Å
187	F	96.6	Very high	96.2	Very high	2 Å²	2	48.7 Å²	48.7	1%	0.009	24%	0.244	C	C	.	.	H	α-helix	trans	-61.5	-40.1	179.5	-86.6	-105.5	0	0	0	112.5	L124 I128 V183 Q191 L192 T193 C196 A197 I228	L124-F187 HydrophobicContact CD1-CD1 3.95Å; I128-F187 HydrophobicContact CD1-CB 3.66Å; I128-F187 HydrophobicContact CD1-CD1 4.1Å; I128-F187 HydrophobicContact CD1-CG 3.86Å; I128-F187 HydrophobicContact CG1-CD1 4.36Å; I128-F187 HydrophobicContact CG1-CG 4.31Å; V183-F187 HydrophobicContact CG1-CD2 3.65Å; V183-F187 HydrophobicContact CG1-CE2 3.72Å; V183-F187 VanDerWaalsContact O-CD2 3.26Å; V183-F187 WeakPolarHBondContact O-CD2 3.36Å; V183-F187 PolarHBondContact O-N 3.48Å; F187-Q191 CarbonylContact O-C 3.57Å; F187-Q191 WeakPolarHBondContact O-CA 3.49Å; F187-Q191 PolarHBondContact O-N 3.41Å; F187-L192 HydrophobicContact CB-CB 4.41Å; F187-L192 HydrophobicContact CD1-CB 3.43Å; F187-L192 VanDerWaalsContact CD1-CB 3.43Å; F187-L192 HydrophobicContact CD1-CD1 4.27Å; F187-L192 HydrophobicContact CD1-CG 4.45Å; F187-L192 HydrophobicContact CD2-CD1 4.29Å; F187-L192 HydrophobicContact CE1-CB 3.7Å; F187-L192 HydrophobicContact CE1-CD1 4.21Å; F187-L192 HydrophobicContact CE2-CD1 4.3Å; F187-L192 HydrophobicContact CG-CB 4.02Å; F187-L192 HydrophobicContact CG-CD1 4.28Å; F187-L192 HydrophobicContact CZ-CD1 4.23Å; F187-L192 PolarHBondContact O-N 3.27Å; F187-T193 WeakPolarHBondContact CE1-O 3.12Å; F187-C196 HydrophobicContact CE1-CB 4.17Å; F187-A197 HydrophobicContact CD1-CB 4.41Å; F187-A197 HydrophobicContact CE1-CB 3.53Å; F187-A197 VanDerWaalsContact CZ-CA 3.46Å; F187-A197 HydrophobicContact CZ-CB 3.6Å; F187-I228 HydrophobicContact CD2-CD1 4.33Å; F187-I228 HydrophobicContact CE2-CD1 3.81Å; F187-I228 HydrophobicContact CE2-CG1 3.88Å; F187-I228 HydrophobicContact CE2-CG2 4.31Å
188	S	95.8	Very high	96.3	Very high	93 Å²	93	43.1 Å²	43.1	65%	0.65	22%	0.22	S	C	*	.	H	α-helix	trans	-71.2	-36.4	179.4	-173.4	0	0	0	0	112.6	R184 T185 L186	R184-S188 WeakPolarHBondContact O-CB 3.33Å; R184-S188 PolarHBondContact O-N 3.24Å; T185-S188 PolarHBondContact O-N 3.33Å; L186-S188 VanDerWaalsContact C-N 3.32Å; L186-S188 PolarHBondContact O-N 3.17Å
189	A	94	Very high	96.4	Very high	52 Å²	52	38.5 Å²	38.5	43%	0.43	20%	0.198	S	C	.	.	H	α-helix	trans	-80.2	-38.3	-177.2	0	0	0	0	0	112	T185 L186 Q191 I248	T185-A189 VanDerWaalsContact O-CB 3.23Å; T185-A189 WeakPolarHBondContact O-CB 3.45Å; T185-A189 PolarHBondContact O-N 3.16Å; L186-A189 PolarHBondContact O-N 2.75Å; A189-Q191 VanDerWaalsContact C-N 3.32Å; A189-I248 HydrophobicContact CB-CB 4.46Å; A189-I248 HydrophobicContact CB-CD1 3.65Å; A189-I248 HydrophobicContact CB-CG1 3.74Å; A189-I248 HydrophobicContact CB-CG2 3.87Å
190	A	93.9	Very high	96.4	Very high	12 Å²	12	38.6 Å²	38.6	10%	0.099	20%	0.199	C	C	.	.	T	Hydrogen-bonded Turn	trans	-87.6	4.3	175.9	0	0	0	0	0	113.7	L186 L192 V240 Y245 I248	L186-A190 WeakPolarHBondContact O-CB 3.25Å; L186-A190 PolarHBondContact O-N 3.01Å; A190-L192 VanDerWaalsContact C-N 3.27Å; A190-L192 HydrophobicContact CB-CD1 4.23Å; A190-L192 HydrophobicContact CB-CD2 4.1Å; A190-L192 HydrophobicContact CB-CG 3.83Å; A190-L192 PolarHBondContact O-N 3.03Å; A190-V240 HydrophobicContact CB-CG1 4.33Å; A190-V240 HydrophobicContact CB-CG2 4.31Å; A190-Y245 HydrophobicContact CB-CE1 4.27Å; A190-I248 HydrophobicContact CB-CD1 4.02Å
191	Q	94	Very high	96.4	Very high	164 Å²	164	36.7 Å²	36.7	77%	0.766	19%	0.192	S	C	*	.	T	Hydrogen-bonded Turn	trans	54.9	35.6	178.5	-55.4	-173.6	13.9	0	0	115	F187 A189	F187-Q191 CarbonylContact O-C 3.57Å; F187-Q191 WeakPolarHBondContact O-CA 3.49Å; F187-Q191 PolarHBondContact O-N 3.41Å; A189-Q191 VanDerWaalsContact C-N 3.32Å
192	L	95.2	Very high	96.5	Very high	3 Å²	3	30.6 Å²	30.6	2%	0.016	17%	0.168	C	C	.	.			trans	-77.4	152.2	-174.6	-56.1	179.1	0	0	0	113.1	F187 A190 C196 I228 V240	F187-L192 HydrophobicContact CB-CB 4.41Å; F187-L192 HydrophobicContact CD1-CB 3.43Å; F187-L192 VanDerWaalsContact CD1-CB 3.43Å; F187-L192 HydrophobicContact CD1-CD1 4.27Å; F187-L192 HydrophobicContact CD1-CG 4.45Å; F187-L192 HydrophobicContact CD2-CD1 4.29Å; F187-L192 HydrophobicContact CE1-CB 3.7Å; F187-L192 HydrophobicContact CE1-CD1 4.21Å; F187-L192 HydrophobicContact CE2-CD1 4.3Å; F187-L192 HydrophobicContact CG-CB 4.02Å; F187-L192 HydrophobicContact CG-CD1 4.28Å; F187-L192 HydrophobicContact CZ-CD1 4.23Å; F187-L192 PolarHBondContact O-N 3.27Å; A190-L192 VanDerWaalsContact C-N 3.27Å; A190-L192 HydrophobicContact CB-CD1 4.23Å; A190-L192 HydrophobicContact CB-CD2 4.1Å; A190-L192 HydrophobicContact CB-CG 3.83Å; A190-L192 PolarHBondContact O-N 3.03Å; L192-C196 HydrophobicContact CB-CB 4.48Å; L192-I228 HydrophobicContact CD1-CG2 3.68Å; L192-V240 HydrophobicContact CD2-CG2 4.23Å
193	T	95.3	Very high	96.5	Very high	49 Å²	49	29.1 Å²	29.1	30%	0.301	16%	0.162	S	C	.	.			trans	-86.5	169.3	-176.3	63.6	0	0	0	0	114	F187 E195 C196 A197	F187-T193 WeakPolarHBondContact CE1-O 3.12Å; T193-E195 VanDerWaalsContact C-N 3.31Å; T193-E195 VanDerWaalsContact CB-OE2 3.3Å; T193-E195 WeakPolarHBondContact CB-OE2 3.43Å; T193-C196 WeakPolarHBondContact O-CB 3.32Å; T193-C196 PolarHBondContact O-N 3.45Å; T193-C196 PolarHBondContact OG1-N 3.18Å; T193-A197 PolarHBondContact O-N 2.94Å
194	A	95.7	Very high	96.5	Very high	3 Å²	3	29 Å²	29	3%	0.025	16%	0.162	C	C	.	.	H	α-helix	trans	-71.6	-33.2	-178.1	0	0	0	0	0	111.6	P122 L124 A197 I198	P122-A194 HydrophobicContact CB-CB 3.81Å; P122-A194 HydrophobicContact CG-CB 3.74Å; P122-A194 WeakPolarHBondContact O-CB 3.5Å; L124-A194 HydrophobicContact CB-CB 4.04Å; L124-A194 HydrophobicContact CD1-CB 4.19Å; A194-A197 WeakPolarHBondContact O-CB 3.42Å; A194-A197 PolarHBondContact O-N 3.15Å; A194-I198 PolarHBondContact O-N 3.29Å
195	E	96.1	Very high	96.5	Very high	42 Å²	42	23.8 Å²	23.8	20%	0.196	14%	0.142	C	C	.	.	H	α-helix	trans	-63.6	-42.8	176.2	-59.1	84.5	165.2	0	0	110.2	P122 T193 A197 I198 V199 W235 Y279	P122-E195 VanDerWaalsContact CD-OE1 3.31Å; P122-E195 WeakPolarHBondContact CD-OE1 3.49Å; P122-E195 HydrophobicContact CG-CG 3.95Å; T193-E195 VanDerWaalsContact C-N 3.31Å; T193-E195 VanDerWaalsContact CB-OE2 3.3Å; T193-E195 WeakPolarHBondContact CB-OE2 3.43Å; E195-A197 PolarHBondContact O-N 2.97Å; E195-I198 WeakPolarHBondContact O-CB 3.4Å; E195-I198 PolarHBondContact O-N 3.21Å; E195-V199 WeakPolarHBondContact O-CG2 3.47Å; E195-V199 PolarHBondContact O-N 3.16Å; E195-W235 HydrophobicContact CB-CZ2 4.01Å; E195-W235 HydrophobicContact CG-CZ2 4.44Å; E195-Y279 HydrophobicContact CB-CE2 4.12Å; E195-Y279 VanDerWaalsContact CG-OH 3.32Å; E195-Y279 WeakPolarHBondContact CG-OH 3.48Å
196	C	96.9	Very high	96.5	Very high	0 Å²	0	20.4 Å²	20.4	0%	0	12%	0.12	C	C	.	.	H	α-helix	trans	-57.9	-35.7	172.7	-175.6	0	0	0	0	112.2	F187 L192 T193 I198 V199 T200	F187-C196 HydrophobicContact CE1-CB 4.17Å; L192-C196 HydrophobicContact CB-CB 4.48Å; T193-C196 WeakPolarHBondContact O-CB 3.32Å; T193-C196 PolarHBondContact O-N 3.45Å; T193-C196 PolarHBondContact OG1-N 3.18Å; C196-I198 VanDerWaalsContact C-N 3.34Å; C196-I198 PolarHBondContact O-N 3.05Å; C196-V199 PolarHBondContact O-N 3.46Å; C196-T200 WeakPolarHBondContact O-CB 3.46Å; C196-T200 PolarHBondContact O-N 3.35Å; C196-T200 PolarHBondContact O-OG1 3.24Å
197	A	97.6	Very high	96.5	Very high	0 Å²	0	20.3 Å²	20.3	0%	0	12%	0.12	C	C	.	.	H	α-helix	trans	-67.5	-34.1	176.4	0	0	0	0	0	112.7	T127 V131 F187 T193 A194 E195 T200 L201	T127-A197 HydrophobicContact CG2-CB 3.91Å; V131-A197 HydrophobicContact CG2-CB 4.24Å; F187-A197 HydrophobicContact CD1-CB 4.41Å; F187-A197 HydrophobicContact CE1-CB 3.53Å; F187-A197 VanDerWaalsContact CZ-CA 3.46Å; F187-A197 HydrophobicContact CZ-CB 3.6Å; T193-A197 PolarHBondContact O-N 2.94Å; A194-A197 WeakPolarHBondContact O-CB 3.42Å; A194-A197 PolarHBondContact O-N 3.15Å; E195-A197 PolarHBondContact O-N 2.97Å; A197-T200 WeakPolarHBondContact O-CB 3.46Å; A197-L201 PolarHBondContact O-N 2.93Å
198	I	97.7	Very high	96.3	Very high	0 Å²	0	20.8 Å²	20.8	0%	0	12%	0.123	C	C	.	.	H	α-helix	trans	-70.5	-45.8	176	-64.4	163.1	0	0	0	109.5	P122 T127 A194 E195 C196 T200 L201 V202 Y279 Y283 L286	P122-I198 HydrophobicContact CB-CD1 4.28Å; P122-I198 HydrophobicContact CG-CD1 4Å; T127-I198 HydrophobicContact CG2-CD1 4.25Å; T127-I198 HydrophobicContact CG2-CG1 3.78Å; A194-I198 PolarHBondContact O-N 3.29Å; E195-I198 WeakPolarHBondContact O-CB 3.4Å; E195-I198 PolarHBondContact O-N 3.21Å; C196-I198 VanDerWaalsContact C-N 3.34Å; C196-I198 PolarHBondContact O-N 3.05Å; I198-T200 VanDerWaalsContact C-N 3.31Å; I198-T200 PolarHBondContact O-N 3.17Å; I198-L201 WeakPolarHBondContact O-CB 3.41Å; I198-L201 PolarHBondContact O-N 3.07Å; I198-L201 VanDerWaalsContact O-N 3.09Å; I198-V202 PolarHBondContact O-N 3.36Å; I198-Y279 HydrophobicContact CB-CD2 4.24Å; I198-Y279 HydrophobicContact CB-CE2 3.76Å; I198-Y279 HydrophobicContact CD1-CE2 3.89Å; I198-Y279 WeakPolarHBondContact CD1-OH 3.31Å; I198-Y279 HydrophobicContact CG1-CE2 4.43Å; I198-Y279 HydrophobicContact CG2-CD2 3.76Å; I198-Y279 HydrophobicContact CG2-CE2 3.73Å; I198-Y279 HydrophobicContact CG2-CG 4.48Å; I198-Y283 HydrophobicContact CD1-CD2 3.94Å; I198-L286 HydrophobicContact CG1-CD1 4.05Å
199	V	97.8	Very high	96.2	Very high	0 Å²	0	18.6 Å²	18.6	0%	0	11%	0.105	C	C	.	.	H	α-helix	trans	-60.8	-39.7	176.1	175.3	0	0	0	0	111.7	E195 C196 L201 V202 Y203 A231 W235 V274 Y279	E195-V199 WeakPolarHBondContact O-CG2 3.47Å; E195-V199 PolarHBondContact O-N 3.16Å; C196-V199 PolarHBondContact O-N 3.46Å; V199-L201 PolarHBondContact O-N 3.38Å; V199-V202 WeakPolarHBondContact O-CB 3.42Å; V199-V202 PolarHBondContact O-N 3.48Å; V199-V202 VanDerWaalsContact O-N 3.09Å; V199-Y203 HydrophobicContact CG1-CD2 4.08Å; V199-Y203 HydrophobicContact CG1-CE1 4.12Å; V199-Y203 HydrophobicContact CG1-CE2 3.6Å; V199-Y203 PolarHBondContact O-N 3.32Å; V199-A231 HydrophobicContact CB-CB 4.18Å; V199-A231 HydrophobicContact CG1-CB 3.86Å; V199-W235 HydrophobicContact CG2-CB 4.34Å; V199-W235 HydrophobicContact CG2-CD2 3.83Å; V199-W235 HydrophobicContact CG2-CE3 3.78Å; V199-W235 HydrophobicContact CG2-CG 4.06Å; V199-W235 HydrophobicContact CG2-CZ3 4.41Å; V199-V274 HydrophobicContact CG1-CG2 4.26Å; V199-Y279 HydrophobicContact CG2-CD2 4.32Å
200	T	98.3	Very high	96.1	Very high	2 Å²	2	18.9 Å²	18.9	1%	0.012	10%	0.096	C	C	.	.	H	α-helix	trans	-53.1	-44.1	173.1	-61.2	0	0	0	0	111.3	C196 A197 I198 Y203 L204 A227 I228 A231	C196-T200 WeakPolarHBondContact O-CB 3.46Å; C196-T200 PolarHBondContact O-N 3.35Å; C196-T200 PolarHBondContact O-OG1 3.24Å; A197-T200 WeakPolarHBondContact O-CB 3.46Å; I198-T200 VanDerWaalsContact C-N 3.31Å; I198-T200 PolarHBondContact O-N 3.17Å; T200-Y203 PolarHBondContact O-N 2.86Å; T200-L204 WeakPolarHBondContact O-CB 3.36Å; T200-L204 PolarHBondContact O-N 3.19Å; T200-A227 HydrophobicContact CG2-CB 3.81Å; T200-I228 HydrophobicContact CG2-CG1 3.53Å; T200-A231 WeakPolarHBondContact OG1-CB 3.45Å
201	L	98.1	Very high	96	Very high	0 Å²	0	19.5 Å²	19.5	0%	0	10%	0.101	C	C	.	.	H	α-helix	trans	-70.7	-33.2	-179.6	-172.4	59.3	0	0	0	112.6	F69 V131 A134 A197 I198 V199 E205 Y282 L286	F69-L201 HydrophobicContact CD1-CD2 3.64Å; F69-L201 HydrophobicContact CD1-CG 4.21Å; F69-L201 HydrophobicContact CE1-CD2 3.56Å; F69-L201 HydrophobicContact CE1-CG 4.4Å; F69-L201 HydrophobicContact CG-CD2 4.46Å; F69-L201 HydrophobicContact CZ-CD2 4.35Å; V131-L201 HydrophobicContact CG2-CD2 4.43Å; A134-L201 HydrophobicContact CB-CD1 4.04Å; A134-L201 HydrophobicContact CB-CD2 3.8Å; A197-L201 PolarHBondContact O-N 2.93Å; I198-L201 WeakPolarHBondContact O-CB 3.41Å; I198-L201 PolarHBondContact O-N 3.07Å; I198-L201 VanDerWaalsContact O-N 3.09Å; V199-L201 PolarHBondContact O-N 3.38Å; L201-E205 PolarHBondContact O-N 3.42Å; L201-E205 VanDerWaalsContact O-N 3.07Å; L201-Y282 HydrophobicContact CB-CD1 4.38Å; L201-Y282 HydrophobicContact CD2-CD1 4.2Å; L201-Y282 HydrophobicContact CG-CD1 4.09Å; L201-Y282 HydrophobicContact CG-CE1 4.12Å; L201-L286 HydrophobicContact CD2-CD1 4.1Å; L201-L286 HydrophobicContact CD2-CD2 3.75Å; L201-L286 HydrophobicContact CD2-CG 4.1Å
202	V	98.1	Very high	95.8	Very high	0 Å²	0	17.3 Å²	17.3	0%	0	9%	0.09	C	C	.	.	H	α-helix	trans	-60.6	-50.7	171.7	179.7	0	0	0	0	110.1	I198 V199 L204 E205 R206 V274 V278 Y282	I198-V202 PolarHBondContact O-N 3.36Å; V199-V202 WeakPolarHBondContact O-CB 3.42Å; V199-V202 PolarHBondContact O-N 3.48Å; V199-V202 VanDerWaalsContact O-N 3.09Å; V202-L204 VanDerWaalsContact C-N 3.33Å; V202-L204 PolarHBondContact O-N 2.91Å; V202-E205 PolarHBondContact O-N 3.03Å; V202-R206 WeakPolarHBondContact O-CG 3.23Å; V202-R206 PolarHBondContact O-N 2.88Å; V202-V274 HydrophobicContact CG1-CG1 4.45Å; V202-V274 HydrophobicContact CG1-CG2 4.1Å; V202-V274 HydrophobicContact CG2-CG1 4.31Å; V202-V278 HydrophobicContact CG1-CG1 4.22Å; V202-V278 HydrophobicContact CG2-CG1 4.4Å; V202-Y282 HydrophobicContact CB-CE2 4.43Å; V202-Y282 HydrophobicContact CG1-CE2 4.41Å; V202-Y282 HydrophobicContact CG2-CD1 3.9Å; V202-Y282 HydrophobicContact CG2-CD2 3.63Å; V202-Y282 HydrophobicContact CG2-CE1 4.06Å; V202-Y282 HydrophobicContact CG2-CE2 3.76Å; V202-Y282 HydrophobicContact CG2-CG 3.7Å
203	Y	98.3	Very high	95.6	Very high	1 Å²	1	17.2 Å²	17.2	0%	0.004	9%	0.09	C	C	.	.	H	α-helix	trans	-64.9	-36.5	-179.8	-67.7	-14.9	0	0	0	113	V199 T200 R206 L207 L230 A231 V234 L268 I272 V274	V199-Y203 HydrophobicContact CG1-CD2 4.08Å; V199-Y203 HydrophobicContact CG1-CE1 4.12Å; V199-Y203 HydrophobicContact CG1-CE2 3.6Å; V199-Y203 PolarHBondContact O-N 3.32Å; T200-Y203 PolarHBondContact O-N 2.86Å; Y203-R206 PolarHBondContact O-N 3.44Å; Y203-L207 WeakPolarHBondContact O-CB 3.13Å; Y203-L207 PolarHBondContact O-N 3.17Å; Y203-L230 HydrophobicContact CD2-CB 3.83Å; Y203-L230 HydrophobicContact CE2-CB 3.91Å; Y203-A231 HydrophobicContact CD2-CB 4.15Å; Y203-A231 HydrophobicContact CE2-CB 4.2Å; Y203-V234 WeakPolarHBondContact OH-CG1 3.32Å; Y203-L268 HydrophobicContact CD1-CD2 3.96Å; Y203-L268 HydrophobicContact CG-CD2 3.99Å; Y203-I272 PolarHBondContact OH-O 2.97Å; Y203-V274 HydrophobicContact CD1-CG2 4.45Å; Y203-V274 HydrophobicContact CE1-CG2 3.63Å
204	L	97.9	Very high	95.4	Very high	0 Å²	0	15.7 Å²	15.7	0%	0	8%	0.08	C	C	.	.	H	α-helix	trans	-60.8	-50.7	173.3	-174	153.1	0	0	0	110.9	I135 T200 V202 R206 L207 L208 I215 I223 V224 A227	I135-L204 HydrophobicContact CD1-CD1 4.27Å; I135-L204 HydrophobicContact CG1-CD1 3.88Å; T200-L204 WeakPolarHBondContact O-CB 3.36Å; T200-L204 PolarHBondContact O-N 3.19Å; V202-L204 VanDerWaalsContact C-N 3.33Å; V202-L204 PolarHBondContact O-N 2.91Å; L204-R206 VanDerWaalsContact C-N 3.35Å; L204-R206 PolarHBondContact O-N 2.93Å; L204-L207 WeakPolarHBondContact O-CB 3.33Å; L204-L207 PolarHBondContact O-N 3.28Å; L204-L208 HydrophobicContact CD2-CD1 3.64Å; L204-L208 HydrophobicContact CD2-CG 4.08Å; L204-L208 WeakPolarHBondContact O-CG 3.48Å; L204-L208 PolarHBondContact O-N 3.34Å; L204-I215 HydrophobicContact CD1-CD1 4.4Å; L204-I223 HydrophobicContact CD1-CG2 4.31Å; L204-I223 HydrophobicContact CG-CG2 4.2Å; L204-V224 HydrophobicContact CD1-CG2 3.99Å; L204-A227 HydrophobicContact CB-CB 4.3Å
205	E	96.5	Very high	95.3	Very high	0 Å²	0	15.5 Å²	15.5	0%	0	8%	0.079	C	C	.	.	H	α-helix	trans	-69.2	-32.1	-179.5	-68	-166	160.9	0	0	113.5	S60 I68 F69 H138 L201 V202 L208 T209 Y282	S60-E205 WeakPolarHBondContact OG-CB 3.36Å; I68-E205 HydrophobicContact CB-CG 4.46Å; I68-E205 WeakPolarHBondContact CB-OE1 3.42Å; I68-E205 HydrophobicContact CD1-CB 4.22Å; I68-E205 PolarHBondContact N-OE1 2.74Å; I68-E205 PolarHBondContact N-OE2 3.5Å; F69-E205 WeakPolarHBondContact CB-OE1 3.5Å; F69-E205 VanDerWaalsContact CD1-OE1 3.25Å; F69-E205 WeakPolarHBondContact CD1-OE1 3.34Å; F69-E205 PolarHBondContact N-OE1 2.82Å; H138-E205 IonicContact CE1-OE1 2.93Å; H138-E205 PolarHBondContact CE1-OE1 2.92Å; H138-E205 IonicContact NE2-OE1 2.9Å; H138-E205 PolarHBondContact NE2-OE1 2.74Å; L201-E205 PolarHBondContact O-N 3.42Å; L201-E205 VanDerWaalsContact O-N 3.07Å; V202-E205 PolarHBondContact O-N 3.03Å; E205-L208 PolarHBondContact O-N 2.94Å; E205-T209 PolarHBondContact O-N 3.36Å; E205-T209 VanDerWaalsContact O-N 3.11Å; E205-T209 PolarHBondContact O-OG1 3.04Å; E205-Y282 HydrophobicContact CG-CE1 4.42Å; E205-Y282 WeakPolarHBondContact OE2-CE1 3.16Å; E205-Y282 VanDerWaalsContact OE2-CZ 3.28Å; E205-Y282 PolarHBondContact OE2-OH 3.16Å
206	R	96.6	Very high	95.2	Very high	4 Å²	4	14.3 Å²	14.3	2%	0.015	8%	0.075	C	C	.	.	H	α-helix	trans	-58.5	-48.6	168.9	-78.6	-178.5	171.7	164	2.5	111.1	D61 V202 Y203 L204 L208 T209 Y210 L268 N271 N273	D61-R206 IonicContact OD1-CZ 3.71Å; D61-R206 VanDerWaalsContact OD1-CZ 3.23Å; D61-R206 IonicContact OD1-NE 3.24Å; D61-R206 PolarHBondContact OD1-NE 3.09Å; D61-R206 IonicContact OD1-NH2 2.69Å; D61-R206 PolarHBondContact OD1-NH2 2.98Å; V202-R206 WeakPolarHBondContact O-CG 3.23Å; V202-R206 PolarHBondContact O-N 2.88Å; Y203-R206 PolarHBondContact O-N 3.44Å; L204-R206 VanDerWaalsContact C-N 3.35Å; L204-R206 PolarHBondContact O-N 2.93Å; R206-L208 PolarHBondContact O-N 3.06Å; R206-T209 PolarHBondContact O-N 3.01Å; R206-Y210 HydrophobicContact CB-CD2 4.41Å; R206-Y210 HydrophobicContact CB-CE2 4.25Å; R206-Y210 HydrophobicContact CG-CE2 4.38Å; R206-Y210 WeakPolarHBondContact O-CB 3.5Å; R206-Y210 PolarHBondContact O-N 3.18Å; R206-L268 HydrophobicContact CB-CG 4.35Å; R206-N271 PolarHBondContact NH1-O 2.9Å; R206-N273 PolarHBondContact NH1-O 3.04Å; R206-N273 PolarHBondContact NH2-O 2.97Å
207	L	95.7	Very high	94.9	Very high	0 Å²	0	14.6 Å²	14.6	0%	0	8%	0.076	C	C	.	.	H	α-helix	trans	-56.7	-51.4	177	-174.2	83.1	0	0	0	111.3	F153 Y203 L204 T209 A211 I223 F264 L267 L268	F153-L207 HydrophobicContact CE2-CD1 4.42Å; F153-L207 HydrophobicContact CE2-CD2 4.07Å; F153-L207 HydrophobicContact CZ-CD1 4.09Å; F153-L207 HydrophobicContact CZ-CD2 3.88Å; Y203-L207 WeakPolarHBondContact O-CB 3.13Å; Y203-L207 PolarHBondContact O-N 3.17Å; L204-L207 WeakPolarHBondContact O-CB 3.33Å; L204-L207 PolarHBondContact O-N 3.28Å; L207-T209 PolarHBondContact O-N 3.09Å; L207-T209 VanDerWaalsContact O-N 3.17Å; L207-A211 VanDerWaalsContact O-CB 3.3Å; L207-A211 WeakPolarHBondContact O-CB 3.46Å; L207-A211 PolarHBondContact O-N 3.19Å; L207-I223 HydrophobicContact CD2-CB 4.42Å; L207-I223 HydrophobicContact CD2-CD1 4.4Å; L207-I223 HydrophobicContact CD2-CG1 4.09Å; L207-I223 HydrophobicContact CD2-CG2 3.72Å; L207-F264 HydrophobicContact CB-CE1 4.25Å; L207-F264 HydrophobicContact CB-CZ 3.94Å; L207-F264 HydrophobicContact CD1-CD1 4.32Å; L207-F264 HydrophobicContact CD1-CD2 4.35Å; L207-F264 HydrophobicContact CD1-CE1 4.2Å; L207-F264 HydrophobicContact CD1-CE2 4.2Å; L207-F264 HydrophobicContact CD1-CG 4.42Å; L207-F264 HydrophobicContact CD1-CZ 4.13Å; L207-F264 HydrophobicContact CD2-CD2 4.36Å; L207-F264 HydrophobicContact CD2-CE2 3.64Å; L207-F264 HydrophobicContact CD2-CZ 3.84Å; L207-F264 HydrophobicContact CG-CE2 4.36Å; L207-F264 HydrophobicContact CG-CZ 4.19Å; L207-L267 HydrophobicContact CD1-CB 3.52Å; L207-L267 HydrophobicContact CD1-CD1 3.77Å; L207-L267 HydrophobicContact CD1-CG 4.3Å; L207-L268 HydrophobicContact CB-CD1 3.92Å; L207-L268 HydrophobicContact CD1-CD1 3.82Å
208	L	93.4	Very high	94.7	Very high	12 Å²	12	14.8 Å²	14.8	6%	0.063	8%	0.078	C	C	.	.	H	α-helix	trans	-58.6	-32.3	-178	-61.4	-178.1	0	0	0	112.1	H138 L204 E205 R206 E212 I213 I215	H138-L208 HydrophobicContact CB-CD1 4.46Å; L204-L208 HydrophobicContact CD2-CD1 3.64Å; L204-L208 HydrophobicContact CD2-CG 4.08Å; L204-L208 WeakPolarHBondContact O-CG 3.48Å; L204-L208 PolarHBondContact O-N 3.34Å; E205-L208 PolarHBondContact O-N 2.94Å; R206-L208 PolarHBondContact O-N 3.06Å; L208-E212 WeakPolarHBondContact O-CA 3.43Å; L208-E212 PolarHBondContact O-N 3.32Å; L208-I213 VanDerWaalsContact CA-O 3.32Å; L208-I213 WeakPolarHBondContact CA-O 3.23Å; L208-I213 WeakPolarHBondContact CB-O 3.48Å; L208-I213 WeakPolarHBondContact CD2-O 3.38Å; L208-I213 PolarHBondContact O-N 3.41Å; L208-I215 HydrophobicContact CD2-CB 4.11Å
209	T	92.2	Very high	94.5	Very high	47 Å²	47	15 Å²	15	29%	0.288	8%	0.079	S	C	.	.	H	α-helix	trans	-87.7	-48.4	-178.2	-46.6	0	0	0	0	112.5	N58 I68 E205 R206 L207 E212	N58-T209 HydrophobicContact CB-CG2 4.18Å; N58-T209 VanDerWaalsContact CG-CG2 3.47Å; N58-T209 WeakPolarHBondContact ND2-CB 3.45Å; N58-T209 VanDerWaalsContact ND2-CG2 3.28Å; N58-T209 WeakPolarHBondContact ND2-CG2 3.39Å; I68-T209 WeakPolarHBondContact CD1-OG1 2.68Å; E205-T209 PolarHBondContact O-N 3.36Å; E205-T209 VanDerWaalsContact O-N 3.11Å; E205-T209 PolarHBondContact O-OG1 3.04Å; R206-T209 PolarHBondContact O-N 3.01Å; L207-T209 PolarHBondContact O-N 3.09Å; L207-T209 VanDerWaalsContact O-N 3.17Å; T209-E212 PolarHBondContact O-N 3.04Å
210	Y	93.6	Very high	94.4	Very high	58 Å²	58	15.6 Å²	15.6	23%	0.227	8%	0.082	C	C	.	.	H	α-helix	trans	-71.5	-37.6	-175.7	-67.3	-10.3	0	0	0	113.1	N58 D61 R206 E212 N271	N58-Y210 HydrophobicContact CB-CE1 4.21Å; N58-Y210 VanDerWaalsContact ND2-CD1 3.29Å; N58-Y210 WeakPolarHBondContact ND2-CD1 3.38Å; N58-Y210 WeakPolarHBondContact ND2-CE1 3.43Å; D61-Y210 PolarHBondContact OD1-OH 3.32Å; D61-Y210 WeakPolarHBondContact OD2-CE1 3.48Å; D61-Y210 PolarHBondContact OD2-OH 2.91Å; R206-Y210 HydrophobicContact CB-CD2 4.41Å; R206-Y210 HydrophobicContact CB-CE2 4.25Å; R206-Y210 HydrophobicContact CG-CE2 4.38Å; R206-Y210 WeakPolarHBondContact O-CB 3.5Å; R206-Y210 PolarHBondContact O-N 3.18Å; Y210-E212 VanDerWaalsContact C-N 3.34Å; Y210-N271 HydrophobicContact CE2-CB 4.18Å; Y210-N271 PolarHBondContact OH-ND2 3.43Å
211	A	90.9	Very high	94.3	Very high	24 Å²	24	18.1 Å²	18.1	20%	0.198	9%	0.092	C	C	.	.	S	Bend	trans	-91.4	-3.2	178	0	0	0	0	0	112.4	L207 I213 L267	L207-A211 VanDerWaalsContact O-CB 3.3Å; L207-A211 WeakPolarHBondContact O-CB 3.46Å; L207-A211 PolarHBondContact O-N 3.19Å; A211-I213 HydrophobicContact CB-CD1 3.55Å; A211-I213 HydrophobicContact CB-CG1 3.73Å; A211-I213 WeakPolarHBondContact O-CG1 3.3Å; A211-I213 PolarHBondContact O-N 2.93Å; A211-L267 HydrophobicContact CB-CB 4.34Å; A211-L267 HydrophobicContact CB-CD2 3.9Å
212	E	90.4	Very high	94.2	Very high	118 Å²	118	18.1 Å²	18.1	55%	0.551	9%	0.092	S	C	*	.			trans	48.5	45	-174.1	-55.8	-170.6	127.2	0	0	112.3	R147 L208 T209 Y210	R147-E212 WeakPolarHBondContact CB-O 3.45Å; R147-E212 VanDerWaalsContact CD-O 3.22Å; R147-E212 WeakPolarHBondContact CD-O 3.35Å; L208-E212 WeakPolarHBondContact O-CA 3.43Å; L208-E212 PolarHBondContact O-N 3.32Å; T209-E212 PolarHBondContact O-N 3.04Å; Y210-E212 VanDerWaalsContact C-N 3.34Å
213	I	90.9	Very high	94.1	Very high	1 Å²	1	18.1 Å²	18.1	1%	0.005	9%	0.092	C	C	.	.	P	Polyproline II helix	trans	-103.8	139.5	179.7	-62.9	171.8	0	0	0	108.8	L150 F153 L208 A211 I223	L150-I213 HydrophobicContact CD1-CD1 3.45Å; L150-I213 VanDerWaalsContact CD1-CD1 3.45Å; L150-I213 HydrophobicContact CG-CD1 3.73Å; F153-I213 HydrophobicContact CD2-CD1 4.11Å; F153-I213 HydrophobicContact CE2-CD1 3.78Å; L208-I213 VanDerWaalsContact CA-O 3.32Å; L208-I213 WeakPolarHBondContact CA-O 3.23Å; L208-I213 WeakPolarHBondContact CB-O 3.48Å; L208-I213 WeakPolarHBondContact CD2-O 3.38Å; L208-I213 PolarHBondContact O-N 3.41Å; A211-I213 HydrophobicContact CB-CD1 3.55Å; A211-I213 HydrophobicContact CB-CG1 3.73Å; A211-I213 WeakPolarHBondContact O-CG1 3.3Å; A211-I213 PolarHBondContact O-N 2.93Å; I213-I223 HydrophobicContact CG2-CD1 4.12Å
214	D	91.6	Very high	94.1	Very high	17 Å²	17	18.1 Å²	18.1	9%	0.091	9%	0.092	C	C	.	.	P	Polyproline II helix	trans	-96.5	145.5	165.6	-85.9	-57.5	0	0	0	111.4	K72 R142 R147 N219	K72-D214 IonicContact NZ-OD1 2.82Å; R142-D214 HydrophobicContact CB-CB 4.36Å; R147-D214 HydrophobicContact CB-CB 4.24Å; R147-D214 WeakPolarHBondContact CD-OD2 3.44Å; R147-D214 VanDerWaalsContact CG-OD2 3.23Å; R147-D214 WeakPolarHBondContact CG-OD2 3.32Å; R147-D214 IonicContact NE-OD2 3.09Å; R147-D214 PolarHBondContact NE-OD2 3.48Å; R147-D214 VanDerWaalsContact NE-OD2 3.09Å; D214-N219 PolarHBondContact O-ND2 3.13Å
215	I	93.3	Very high	94.1	Very high	0 Å²	0	18.1 Å²	18.1	0%	0	9%	0.092	C	C	.	.	P	Polyproline II helix	trans	-84	126.3	173.3	-165.2	174.1	0	0	0	109.8	I135 H138 I139 L204 L208 N219 W220 I223 V224	I135-I215 HydrophobicContact CG2-CD1 3.9Å; H138-I215 HydrophobicContact CB-CG2 3.45Å; H138-I215 VanDerWaalsContact CB-CG2 3.45Å; I139-I215 HydrophobicContact CB-CG2 4.39Å; I139-I215 HydrophobicContact CD1-CD1 4.3Å; I139-I215 HydrophobicContact CD1-CG1 4.36Å; I139-I215 HydrophobicContact CG1-CB 4.22Å; I139-I215 HydrophobicContact CG1-CD1 4.07Å; I139-I215 HydrophobicContact CG1-CG1 3.84Å; I139-I215 HydrophobicContact CG1-CG2 3.6Å; L204-I215 HydrophobicContact CD1-CD1 4.4Å; L208-I215 HydrophobicContact CD2-CB 4.11Å; I215-N219 WeakPolarHBondContact CA-OD1 3.41Å; I215-W220 HydrophobicContact CD1-CB 3.72Å; I215-W220 HydrophobicContact CG1-CB 3.54Å; I215-I223 HydrophobicContact CD1-CG2 4.37Å; I215-I223 HydrophobicContact CG1-CD1 4.34Å; I215-V224 HydrophobicContact CD1-CG2 4.35Å
216	C	92.5	Very high	94.2	Very high	17 Å²	17	18.1 Å²	18.1	12%	0.115	9%	0.092	C	C	.	.			trans	-136.7	171.6	-172.4	77	0	0	0	0	111	A218 N219 W220	C216-A218 PolarHBondContact O-N 3.44Å; C216-N219 PolarHBondContact N-OD1 3.33Å; C216-N219 PolarHBondContact O-N 3.29Å; C216-N219 PolarHBondContact O-OD1 2.98Å; C216-N219 PolarHBondContact SG-ND2 3.46Å; C216-N219 PolarHBondContact SG-OD1 2.99Å; C216-W220 WeakPolarHBondContact O-CB 3.17Å; C216-W220 PolarHBondContact O-N 2.73Å; C216-W220 VanDerWaalsContact O-N 3.07Å
217	P	92.5	Very high	94.3	Very high	5 Å²	5	17.9 Å²	17.9	3%	0.032	9%	0.092	C	C	.	.	T	Hydrogen-bonded Turn	trans	-56.5	-32.4	-179.3	-26	35.8	0	0	0	114.2	Y169 Y172 D173	Y169-P217 WeakPolarHBondContact O-CB 3.33Å; Y172-P217 WeakPolarHBondContact O-CB 3.03Å; D173-P217 VanDerWaalsContact OD1-CG 3.23Å; D173-P217 WeakPolarHBondContact OD1-CG 3.31Å
218	A	91.9	Very high	94.4	Very high	5 Å²	5	17.9 Å²	17.9	4%	0.041	9%	0.092	C	C	.	.	T	Hydrogen-bonded Turn	trans	-77.2	-23.7	-177.5	0	0	0	0	0	114.5	E155 Y169 D170 C216	E155-A218 VanDerWaalsContact CB-O 3.26Å; E155-A218 WeakPolarHBondContact CB-O 3.24Å; E155-A218 PolarHBondContact N-O 3.31Å; Y169-A218 HydrophobicContact CD2-CB 4.16Å; Y169-A218 HydrophobicContact CE2-CB 3.52Å; D170-A218 HydrophobicContact CB-CB 3.92Å; C216-A218 PolarHBondContact O-N 3.44Å
219	N	94.1	Very high	94.5	Very high	4 Å²	4	17.3 Å²	17.3	2%	0.021	9%	0.089	C	C	.	.	T	Hydrogen-bonded Turn	trans	-123.4	-13.7	-167.7	73.9	10.2	0	0	0	115.2	F153 D214 I215 C216 K221 R222 I223	F153-N219 HydrophobicContact CB-CB 3.92Å; F153-N219 VanDerWaalsContact O-CA 3.22Å; F153-N219 WeakPolarHBondContact O-CA 3.25Å; F153-N219 WeakPolarHBondContact O-CB 3.41Å; D214-N219 PolarHBondContact O-ND2 3.13Å; I215-N219 WeakPolarHBondContact CA-OD1 3.41Å; C216-N219 PolarHBondContact N-OD1 3.33Å; C216-N219 PolarHBondContact O-N 3.29Å; C216-N219 PolarHBondContact O-OD1 2.98Å; C216-N219 PolarHBondContact SG-ND2 3.46Å; C216-N219 PolarHBondContact SG-OD1 2.99Å; N219-K221 VanDerWaalsContact C-N 3.3Å; N219-K221 PolarHBondContact O-N 3.19Å; N219-R222 PolarHBondContact O-N 3Å; N219-I223 HydrophobicContact CB-CD1 4.21Å; N219-I223 PolarHBondContact O-N 3.04Å
220	W	95.6	Very high	94.7	Very high	13 Å²	13	15.2 Å²	15.2	5%	0.049	8%	0.076	C	C	.	.	H	α-helix	trans	-60.9	-36.4	-167.4	72.3	-86.7	0	0	0	113.6	I139 P174 I179 F182 I215 C216 V224	I139-W220 HydrophobicContact CD1-CB 3.71Å; I139-W220 HydrophobicContact CD1-CD2 4.47Å; I139-W220 HydrophobicContact CD1-CG 3.98Å; I139-W220 HydrophobicContact CG1-CB 4.39Å; P174-W220 HydrophobicContact CB-CZ2 3.97Å; P174-W220 HydrophobicContact CG-CD2 4.2Å; P174-W220 HydrophobicContact CG-CG 4.26Å; P174-W220 HydrophobicContact CG-CZ2 4.32Å; I179-W220 HydrophobicContact CB-CZ3 4.2Å; I179-W220 HydrophobicContact CG1-CE3 4.2Å; I179-W220 HydrophobicContact CG1-CH2 4.16Å; I179-W220 HydrophobicContact CG1-CZ3 3.96Å; I179-W220 HydrophobicContact CG2-CZ3 4.24Å; F182-W220 HydrophobicContact CB-CH2 3.99Å; F182-W220 HydrophobicContact CB-CZ3 4.05Å; F182-W220 HydrophobicContact CD1-CH2 4.49Å; F182-W220 AromaticContact CD1-CZ3 3.87Å; F182-W220 HydrophobicContact CD1-CZ3 3.87Å; F182-W220 HydrophobicContact CG-CH2 4.25Å; F182-W220 HydrophobicContact CG-CZ3 4.09Å; I215-W220 HydrophobicContact CD1-CB 3.72Å; I215-W220 HydrophobicContact CG1-CB 3.54Å; C216-W220 WeakPolarHBondContact O-CB 3.17Å; C216-W220 PolarHBondContact O-N 2.73Å; C216-W220 VanDerWaalsContact O-N 3.07Å; W220-V224 HydrophobicContact CE3-CG2 4.44Å; W220-V224 VanDerWaalsContact O-CB 3.31Å; W220-V224 WeakPolarHBondContact O-CB 3.35Å; W220-V224 WeakPolarHBondContact O-CG2 3.42Å; W220-V224 PolarHBondContact O-N 3.46Å
221	K	95.6	Very high	94.8	Very high	54 Å²	54	12.5 Å²	12.5	24%	0.235	7%	0.065	C	C	.	.	H	α-helix	trans	-66.1	-42.2	-178.4	-60.8	-166.3	-171.7	106.1	0	111.4	E155 L160 F182 N219 L225	E155-K221 WeakPolarHBondContact OE1-CD 3.36Å; E155-K221 IonicContact OE1-NZ 3.05Å; E155-K221 PolarHBondContact OE1-NZ 3.3Å; E155-K221 WeakPolarHBondContact OE2-CD 3.45Å; E155-K221 IonicContact OE2-NZ 3.91Å; E155-K221 PolarHBondContact OE2-NZ 2.96Å; L160-K221 HydrophobicContact CD1-CB 3.41Å; L160-K221 VanDerWaalsContact CD1-CB 3.41Å; L160-K221 HydrophobicContact CD1-CD 4.2Å; L160-K221 HydrophobicContact CD1-CG 4.45Å; F182-K221 HydrophobicContact CE1-CB 4.41Å; F182-K221 HydrophobicContact CE2-CB 4.46Å; F182-K221 HydrophobicContact CE2-CD 4.49Å; F182-K221 HydrophobicContact CZ-CB 4.12Å; N219-K221 VanDerWaalsContact C-N 3.3Å; N219-K221 PolarHBondContact O-N 3.19Å; K221-L225 VanDerWaalsContact O-CB 3.26Å; K221-L225 WeakPolarHBondContact O-CB 3.38Å; K221-L225 PolarHBondContact O-N 2.82Å
222	R	96	Very high	95	Very high	1 Å²	1	11.3 Å²	11.3	0%	0.004	6%	0.055	C	C	.	.	H	α-helix	trans	-70.1	-42.9	179.6	-70.8	-133.8	149.8	-144.7	-8.8	112.2	I152 F153 H158 L160 N219 V224 L225 G226 D256	I152-R222 WeakPolarHBondContact O-CD 3.33Å; F153-R222 HydrophobicContact CB-CB 4.22Å; F153-R222 HydrophobicContact CD1-CB 4.16Å; F153-R222 WeakPolarHBondContact O-CB 3.48Å; F153-R222 WeakPolarHBondContact O-CG 3.38Å; H158-R222 VanDerWaalsContact C-NH2 3.3Å; H158-R222 VanDerWaalsContact CB-NE 3.26Å; H158-R222 PolarHBondContact O-NE 3.43Å; H158-R222 PolarHBondContact O-NH2 3.24Å; L160-R222 HydrophobicContact CD1-CG 4.47Å; L160-R222 HydrophobicContact CD2-CG 4.32Å; N219-R222 PolarHBondContact O-N 3Å; R222-V224 PolarHBondContact O-N 2.91Å; R222-L225 PolarHBondContact O-N 2.87Å; R222-G226 PolarHBondContact O-N 3.47Å; R222-D256 IonicContact CZ-OD1 2.86Å; R222-D256 IonicContact CZ-OD2 2.65Å; R222-D256 VanDerWaalsContact CZ-OD2 3.24Å; R222-D256 IonicContact NH1-OD1 2.86Å; R222-D256 PolarHBondContact NH1-OD1 3.07Å; R222-D256 IonicContact NH1-OD2 2.59Å; R222-D256 PolarHBondContact NH1-OD2 2.94Å; R222-D256 IonicContact NH2-OD1 3.35Å; R222-D256 IonicContact NH2-OD2 2.73Å; R222-D256 PolarHBondContact NH2-OD2 3.49Å
223	I	97.4	Very high	95.1	Very high	0 Å²	0	8.3 Å²	8.3	0%	0	4%	0.04	C	C	.	.	H	α-helix	trans	-59.3	-48.2	174.5	-70.2	176.4	0	0	0	110.4	F153 L204 L207 I213 I215 N219 L225 G226 A227 F264	F153-I223 HydrophobicContact CB-CG1 4.05Å; F153-I223 HydrophobicContact CD1-CG1 3.82Å; F153-I223 HydrophobicContact CD2-CD1 4.41Å; F153-I223 HydrophobicContact CD2-CG1 4.02Å; F153-I223 HydrophobicContact CE1-CG1 4.25Å; F153-I223 HydrophobicContact CE2-CG1 4.42Å; F153-I223 HydrophobicContact CG-CD1 4.44Å; F153-I223 HydrophobicContact CG-CG1 3.7Å; L204-I223 HydrophobicContact CD1-CG2 4.31Å; L204-I223 HydrophobicContact CG-CG2 4.2Å; L207-I223 HydrophobicContact CD2-CB 4.42Å; L207-I223 HydrophobicContact CD2-CD1 4.4Å; L207-I223 HydrophobicContact CD2-CG1 4.09Å; L207-I223 HydrophobicContact CD2-CG2 3.72Å; I213-I223 HydrophobicContact CG2-CD1 4.12Å; I215-I223 HydrophobicContact CD1-CG2 4.37Å; I215-I223 HydrophobicContact CG1-CD1 4.34Å; N219-I223 HydrophobicContact CB-CD1 4.21Å; N219-I223 PolarHBondContact O-N 3.04Å; I223-L225 PolarHBondContact O-N 3.29Å; I223-G226 PolarHBondContact O-N 3Å; I223-A227 WeakPolarHBondContact O-CB 3.49Å; I223-A227 PolarHBondContact O-N 3.17Å; I223-F264 WeakPolarHBondContact O-CE2 3.24Å
224	V	98.2	Very high	95.1	Very high	0 Å²	0	11.4 Å²	11.4	0%	0	6%	0.059	C	C	.	.	H	α-helix	trans	-64.8	-40.9	179.2	172.1	0	0	0	0	111.2	I135 F182 V183 L204 I215 W220 R222 A227 I228	I135-V224 HydrophobicContact CD1-CG1 4.32Å; I135-V224 HydrophobicContact CD1-CG2 3.84Å; I135-V224 HydrophobicContact CG1-CG2 4.45Å; I135-V224 HydrophobicContact CG2-CG2 4.01Å; F182-V224 HydrophobicContact CD1-CG1 4.05Å; F182-V224 HydrophobicContact CE1-CB 4.17Å; F182-V224 HydrophobicContact CE1-CG1 3.92Å; V183-V224 HydrophobicContact CG2-CG1 3.87Å; L204-V224 HydrophobicContact CD1-CG2 3.99Å; I215-V224 HydrophobicContact CD1-CG2 4.35Å; W220-V224 HydrophobicContact CE3-CG2 4.44Å; W220-V224 VanDerWaalsContact O-CB 3.31Å; W220-V224 WeakPolarHBondContact O-CB 3.35Å; W220-V224 WeakPolarHBondContact O-CG2 3.42Å; W220-V224 PolarHBondContact O-N 3.46Å; R222-V224 PolarHBondContact O-N 2.91Å; V224-A227 PolarHBondContact O-N 2.8Å; V224-I228 HydrophobicContact CG1-CD1 3.8Å; V224-I228 HydrophobicContact CG1-CG1 4.48Å; V224-I228 VanDerWaalsContact O-CG1 3.22Å; V224-I228 WeakPolarHBondContact O-CG1 3.45Å; V224-I228 PolarHBondContact O-N 2.69Å
225	L	97.8	Very high	95	Very high	0 Å²	0	15.4 Å²	15.4	0%	0	7%	0.073	C	C	.	.	H	α-helix	trans	-60.3	-51.2	175.5	179.2	59.5	0	0	0	111.2	L160 F182 L186 K221 R222 I223 A227 I228 L229 Y245 L249 I252 M257 L260	L160-L225 HydrophobicContact CD1-CD2 4.43Å; L160-L225 HydrophobicContact CD2-CD2 3.76Å; F182-L225 HydrophobicContact CZ-CB 4.34Å; L186-L225 HydrophobicContact CD1-CD1 4.01Å; L186-L225 HydrophobicContact CD2-CD1 4.33Å; K221-L225 VanDerWaalsContact O-CB 3.26Å; K221-L225 WeakPolarHBondContact O-CB 3.38Å; K221-L225 PolarHBondContact O-N 2.82Å; R222-L225 PolarHBondContact O-N 2.87Å; I223-L225 PolarHBondContact O-N 3.29Å; L225-A227 VanDerWaalsContact C-N 3.33Å; L225-A227 PolarHBondContact O-N 2.97Å; L225-I228 PolarHBondContact O-N 3.43Å; L225-I228 VanDerWaalsContact O-N 3.1Å; L225-L229 HydrophobicContact CD1-CG 4.35Å; L225-L229 HydrophobicContact CG-CD1 4.34Å; L225-L229 HydrophobicContact CG-CG 4.47Å; L225-L229 WeakPolarHBondContact O-CG 3.36Å; L225-L229 PolarHBondContact O-N 2.94Å; L225-Y245 HydrophobicContact CD1-CD1 4.42Å; L225-L249 HydrophobicContact CD1-CD1 3.98Å; L225-L249 HydrophobicContact CD2-CD1 3.78Å; L225-I252 HydrophobicContact CD2-CD1 4.3Å; L225-M257 HydrophobicContact CD1-CE 4.49Å; L225-M257 HydrophobicContact CD2-CE 4.03Å; L225-M257 HydrophobicContact CD2-SD 4.05Å; L225-M257 HydrophobicContact CG-CE 4.21Å; L225-L260 HydrophobicContact CB-CD2 4.37Å; L225-L260 HydrophobicContact CD2-CD2 3.96Å; L225-L260 HydrophobicContact CG-CD2 4.04Å
226	G	97.7	Very high	94.6	Very high	0 Å²	0	16.9 Å²	16.9	0%	0	8%	0.081	C	C	.	.	H	α-helix	trans	-57.1	-43.8	178.6	0	0	0	0	0	112.8	R222 I223 I228 L229 L230	R222-G226 PolarHBondContact O-N 3.47Å; I223-G226 PolarHBondContact O-N 3Å; G226-I228 VanDerWaalsContact C-N 3.34Å; G226-I228 PolarHBondContact O-N 3.36Å; G226-L229 PolarHBondContact O-N 3.31Å; G226-L230 PolarHBondContact O-N 3.37Å
227	A	98.3	Very high	94	Very high	0 Å²	0	24.2 Å²	24.2	0%	0	12%	0.119	C	C	.	.	H	α-helix	trans	-62	-40	176.1	0	0	0	0	0	112.5	T200 L204 I223 V224 L225 A231 F264	T200-A227 HydrophobicContact CG2-CB 3.81Å; L204-A227 HydrophobicContact CB-CB 4.3Å; I223-A227 WeakPolarHBondContact O-CB 3.49Å; I223-A227 PolarHBondContact O-N 3.17Å; V224-A227 PolarHBondContact O-N 2.8Å; L225-A227 VanDerWaalsContact C-N 3.33Å; L225-A227 PolarHBondContact O-N 2.97Å; A227-A231 VanDerWaalsContact O-CB 3.32Å; A227-A231 WeakPolarHBondContact O-CB 3.33Å; A227-A231 PolarHBondContact O-N 3.29Å; A227-F264 HydrophobicContact CB-CE1 4.42Å; A227-F264 HydrophobicContact CB-CE2 4.11Å; A227-F264 HydrophobicContact CB-CZ 3.65Å; A227-F264 VanDerWaalsContact N-CE2 3.31Å
228	I	97.8	Very high	93.4	Very high	0 Å²	0	31.5 Å²	31.5	0%	0	15%	0.152	C	C	.	.	H	α-helix	trans	-67.1	-43.6	177.9	-70.2	169.7	0	0	0	111.1	L186 F187 L192 T200 V224 L225 G226 L230 A231 S232 Y245	L186-I228 HydrophobicContact CB-CD1 4.39Å; L186-I228 HydrophobicContact CD1-CD1 3.67Å; F187-I228 HydrophobicContact CD2-CD1 4.33Å; F187-I228 HydrophobicContact CE2-CD1 3.81Å; F187-I228 HydrophobicContact CE2-CG1 3.88Å; F187-I228 HydrophobicContact CE2-CG2 4.31Å; L192-I228 HydrophobicContact CD1-CG2 3.68Å; T200-I228 HydrophobicContact CG2-CG1 3.53Å; V224-I228 HydrophobicContact CG1-CD1 3.8Å; V224-I228 HydrophobicContact CG1-CG1 4.48Å; V224-I228 VanDerWaalsContact O-CG1 3.22Å; V224-I228 WeakPolarHBondContact O-CG1 3.45Å; V224-I228 PolarHBondContact O-N 2.69Å; L225-I228 PolarHBondContact O-N 3.43Å; L225-I228 VanDerWaalsContact O-N 3.1Å; G226-I228 VanDerWaalsContact C-N 3.34Å; G226-I228 PolarHBondContact O-N 3.36Å; I228-L230 VanDerWaalsContact C-N 3.31Å; I228-L230 PolarHBondContact O-N 3.11Å; I228-A231 PolarHBondContact O-N 3.37Å; I228-S232 WeakPolarHBondContact O-CB 3.33Å; I228-S232 PolarHBondContact O-N 3.44Å; I228-S232 PolarHBondContact O-OG 3.01Å; I228-Y245 HydrophobicContact CG2-CE1 4.31Å
229	L	96	Very high	92.7	Very high	0 Å²	0	33.7 Å²	33.7	0%	0	17%	0.171	C	C	.	.	H	α-helix	trans	-58.6	-43.2	178.6	-67.1	167.9	0	0	0	112	L225 G226 S232 K233 Y245 M257 L260	L225-L229 HydrophobicContact CD1-CG 4.35Å; L225-L229 HydrophobicContact CG-CD1 4.34Å; L225-L229 HydrophobicContact CG-CG 4.47Å; L225-L229 WeakPolarHBondContact O-CG 3.36Å; L225-L229 PolarHBondContact O-N 2.94Å; G226-L229 PolarHBondContact O-N 3.31Å; L229-S232 PolarHBondContact O-OG 3.24Å; L229-S232 VanDerWaalsContact O-OG 3.05Å; L229-K233 WeakPolarHBondContact O-CG 3.48Å; L229-K233 PolarHBondContact O-N 2.95Å; L229-Y245 HydrophobicContact CD2-CD1 3.84Å; L229-Y245 HydrophobicContact CD2-CD2 3.4Å; L229-Y245 HydrophobicContact CD2-CE1 3.97Å; L229-Y245 HydrophobicContact CD2-CE2 3.55Å; L229-Y245 HydrophobicContact CD2-CG 3.54Å; L229-M257 HydrophobicContact CD1-CE 3.08Å; L229-M257 HydrophobicContact CD2-CE 3.61Å; L229-M257 HydrophobicContact CG-CE 3.85Å; L229-L260 HydrophobicContact CD1-CD2 4.17Å; L229-L260 HydrophobicContact CD1-CG 4.47Å
230	L	96.4	Very high	92.4	Very high	3 Å²	3	34.5 Å²	34.5	2%	0.016	18%	0.176	C	C	.	.	H	α-helix	trans	-71.2	-43	178.5	-66.6	-168.1	0	0	0	111.6	Y203 G226 I228 S232 K233 V234 E261 F264 L265 L268	Y203-L230 HydrophobicContact CD2-CB 3.83Å; Y203-L230 HydrophobicContact CE2-CB 3.91Å; G226-L230 PolarHBondContact O-N 3.37Å; I228-L230 VanDerWaalsContact C-N 3.31Å; I228-L230 PolarHBondContact O-N 3.11Å; L230-S232 VanDerWaalsContact C-N 3.33Å; L230-S232 PolarHBondContact O-N 3.18Å; L230-K233 PolarHBondContact O-N 3.25Å; L230-V234 WeakPolarHBondContact O-CG2 3.26Å; L230-V234 PolarHBondContact O-N 2.9Å; L230-E261 HydrophobicContact CD2-CG 3.64Å; L230-F264 HydrophobicContact CD1-CB 4.01Å; L230-F264 HydrophobicContact CD1-CD1 3.26Å; L230-F264 HydrophobicContact CD1-CE1 4.02Å; L230-F264 HydrophobicContact CD1-CG 3.94Å; L230-F264 HydrophobicContact CG-CD1 4.19Å; L230-L265 HydrophobicContact CD1-CD2 3.89Å; L230-L265 HydrophobicContact CD1-CG 3.97Å; L230-L265 HydrophobicContact CD2-CD1 4.02Å; L230-L265 HydrophobicContact CD2-CD2 3.83Å; L230-L265 HydrophobicContact CD2-CG 3.59Å; L230-L265 HydrophobicContact CG-CG 4.47Å; L230-L268 HydrophobicContact CD1-CD2 4.11Å
231	A	96.5	Very high	92.1	Very high	0 Å²	0	43 Å²	43	0%	0	21%	0.208	C	C	.	.	H	α-helix	trans	-60.9	-43	179	0	0	0	0	0	111.7	V199 T200 Y203 A227 I228 K233 V234 W235	V199-A231 HydrophobicContact CB-CB 4.18Å; V199-A231 HydrophobicContact CG1-CB 3.86Å; T200-A231 WeakPolarHBondContact OG1-CB 3.45Å; Y203-A231 HydrophobicContact CD2-CB 4.15Å; Y203-A231 HydrophobicContact CE2-CB 4.2Å; A227-A231 VanDerWaalsContact O-CB 3.32Å; A227-A231 WeakPolarHBondContact O-CB 3.33Å; A227-A231 PolarHBondContact O-N 3.29Å; I228-A231 PolarHBondContact O-N 3.37Å; A231-K233 VanDerWaalsContact C-N 3.28Å; A231-K233 PolarHBondContact O-N 3.05Å; A231-V234 PolarHBondContact O-N 3.28Å; A231-W235 VanDerWaalsContact O-CB 3.23Å; A231-W235 WeakPolarHBondContact O-CB 3.41Å; A231-W235 PolarHBondContact O-N 3.45Å
232	S	94.7	Very high	92	Very high	0 Å²	0	41 Å²	41	0%	0	20%	0.2	C	C	.	.	H	α-helix	trans	-67.5	-26.5	-179.5	64.6	0	0	0	0	113.5	I228 L229 L230 D236 Y245	I228-S232 WeakPolarHBondContact O-CB 3.33Å; I228-S232 PolarHBondContact O-N 3.44Å; I228-S232 PolarHBondContact O-OG 3.01Å; L229-S232 PolarHBondContact O-OG 3.24Å; L229-S232 VanDerWaalsContact O-OG 3.05Å; L230-S232 VanDerWaalsContact C-N 3.33Å; L230-S232 PolarHBondContact O-N 3.18Å; S232-D236 WeakPolarHBondContact O-CB 3.47Å; S232-D236 PolarHBondContact O-N 3.44Å; S232-Y245 WeakPolarHBondContact CB-OH 3.23Å; S232-Y245 PolarHBondContact OG-OH 2.89Å
233	K	92.3	Very high	91.8	Very high	55 Å²	55	44.4 Å²	44.4	24%	0.239	22%	0.221	C	C	.	.	H	α-helix	trans	-84.3	-33.8	176.6	-74.3	174.7	-178.6	143	0	114	L229 L230 A231 N242 E261	L229-K233 WeakPolarHBondContact O-CG 3.48Å; L229-K233 PolarHBondContact O-N 2.95Å; L230-K233 PolarHBondContact O-N 3.25Å; A231-K233 VanDerWaalsContact C-N 3.28Å; A231-K233 PolarHBondContact O-N 3.05Å; K233-N242 PolarHBondContact NZ-ND2 3.48Å; K233-N242 PolarHBondContact NZ-OD1 3.35Å; K233-E261 WeakPolarHBondContact CD-OE1 3.49Å; K233-E261 WeakPolarHBondContact CE-OE1 3.47Å; K233-E261 IonicContact NZ-OE1 3.87Å; K233-E261 PolarHBondContact NZ-OE1 2.91Å; K233-E261 IonicContact NZ-OE2 2.76Å; K233-E261 PolarHBondContact NZ-OE2 3.07Å
234	V	91.9	Very high	91.6	Very high	65 Å²	65	47.1 Å²	47.1	39%	0.394	24%	0.235	S	C	.	.	H	α-helix	trans	-87.2	-34.2	-175.7	177.8	0	0	0	0	111.5	Y203 L230 A231 I272	Y203-V234 WeakPolarHBondContact OH-CG1 3.32Å; L230-V234 WeakPolarHBondContact O-CG2 3.26Å; L230-V234 PolarHBondContact O-N 2.9Å; A231-V234 PolarHBondContact O-N 3.28Å; V234-I272 HydrophobicContact CG2-CB 4.24Å; V234-I272 HydrophobicContact CG2-CD1 4.03Å
235	W	89.5	Confident	91.3	Very high	101 Å²	101	47.1 Å²	47.1	38%	0.383	24%	0.235	S	C	.	.	H	α-helix	trans	-101.4	-31.2	-172.5	-169.5	-92.3	0	0	0	114.1	E195 V199 A231 Y279	E195-W235 HydrophobicContact CB-CZ2 4.01Å; E195-W235 HydrophobicContact CG-CZ2 4.44Å; V199-W235 HydrophobicContact CG2-CB 4.34Å; V199-W235 HydrophobicContact CG2-CD2 3.83Å; V199-W235 HydrophobicContact CG2-CE3 3.78Å; V199-W235 HydrophobicContact CG2-CG 4.06Å; V199-W235 HydrophobicContact CG2-CZ3 4.41Å; A231-W235 VanDerWaalsContact O-CB 3.23Å; A231-W235 WeakPolarHBondContact O-CB 3.41Å; A231-W235 PolarHBondContact O-N 3.45Å; W235-Y279 HydrophobicContact CH2-CD2 4.47Å; W235-Y279 HydrophobicContact CZ2-CE2 4.44Å
236	D	83.9	Confident	91.1	Very high	31 Å²	31	48 Å²	48	17%	0.166	24%	0.241	C	C	.	.			trans	-87.6	129.5	-177.8	-146.2	-47.4	0	0	0	110.9	S232 Q238	S232-D236 WeakPolarHBondContact O-CB 3.47Å; S232-D236 PolarHBondContact O-N 3.44Å; D236-Q238 PolarHBondContact O-N 3.19Å; D236-Q238 PolarHBondContact OD1-N 2.98Å; D236-Q238 VanDerWaalsContact OD1-N 3.11Å
237	D	79.6	Confident	90.8	Very high	171 Å²	171	54 Å²	54	91%	0.914	27%	0.269	S	S	*	.	S	Bend	trans	-68.1	-22.9	174.7	-72.1	-31.1	0	0	0	111.2
238	Q	80.1	Confident	90.5	Very high	158 Å²	158	56.3 Å²	56.3	74%	0.738	28%	0.281	S	S	*	.	S	Bend	trans	-101.8	75.9	171.7	-64.2	-171.6	8.3	0	0	109.8	D236 V240	D236-Q238 PolarHBondContact O-N 3.19Å; D236-Q238 PolarHBondContact OD1-N 2.98Å; D236-Q238 VanDerWaalsContact OD1-N 3.11Å; Q238-V240 PolarHBondContact O-N 3.27Å
239	A	77.8	Confident	90.1	Very high	52 Å²	52	57.5 Å²	57.5	43%	0.43	29%	0.287	S	S	.	.	P	Polyproline II helix	trans	-58	124.3	-179.5	0	0	0	0	0	111.7
240	V	87.1	Confident	89.3	Confident	20 Å²	20	65.7 Å²	65.7	12%	0.121	32%	0.323	C	S	.	.	P	Polyproline II helix	trans	-83	132.5	176.1	-178.7	0	0	0	0	108.9	A190 L192 Q238 D244 Y245	A190-V240 HydrophobicContact CB-CG1 4.33Å; A190-V240 HydrophobicContact CB-CG2 4.31Å; L192-V240 HydrophobicContact CD2-CG2 4.23Å; Q238-V240 PolarHBondContact O-N 3.27Å; V240-D244 HydrophobicContact CG1-CB 3.6Å; V240-Y245 HydrophobicContact CB-CE2 3.86Å; V240-Y245 HydrophobicContact CG1-CD2 3.91Å; V240-Y245 HydrophobicContact CG1-CE2 3.5Å
241	W	90.4	Very high	88.6	Confident	191 Å²	191	68.7 Å²	68.7	72%	0.723	34%	0.339	S	S	*	.	P	Polyproline II helix	trans	-83.5	154.4	-175.7	-62.2	58.9	0	0	0	109.7	V243 D244 Y245	W241-V243 PolarHBondContact O-N 3.23Å; W241-V243 VanDerWaalsContact O-N 3.17Å; W241-D244 WeakPolarHBondContact CB-OD2 3.24Å; W241-D244 PolarHBondContact N-OD2 3.41Å; W241-D244 WeakPolarHBondContact O-CB 3.37Å; W241-D244 PolarHBondContact O-N 2.91Å; W241-Y245 PolarHBondContact O-N 3.31Å
242	N	92.7	Very high	88.3	Confident	13 Å²	13	69.3 Å²	69.3	7%	0.07	34%	0.342	C	S	.	.	H	α-helix	trans	-59.7	-31	178.5	-73.9	-17.3	0	0	0	112.8	K233 D244 Y245 C246 M257 N258 E261	K233-N242 PolarHBondContact NZ-ND2 3.48Å; K233-N242 PolarHBondContact NZ-OD1 3.35Å; N242-D244 PolarHBondContact O-N 3.34Å; N242-Y245 WeakPolarHBondContact O-CB 3.33Å; N242-Y245 PolarHBondContact O-N 3.39Å; N242-Y245 VanDerWaalsContact O-N 3.16Å; N242-C246 PolarHBondContact O-N 3.21Å; N242-C246 PolarHBondContact O-SG 3Å; N242-M257 HydrophobicContact CB-CB 4.11Å; N242-N258 PolarHBondContact ND2-OD1 3.48Å; N242-E261 PolarHBondContact ND2-OE2 3.45Å
243	V	92.9	Very high	88.2	Confident	73 Å²	73	73 Å²	73	44%	0.442	36%	0.364	S	S	.	.	H	α-helix	trans	-60.9	-34.6	174.5	-178.7	0	0	0	0	111.7	W241 C246 Q247 V254	W241-V243 PolarHBondContact O-N 3.23Å; W241-V243 VanDerWaalsContact O-N 3.17Å; V243-C246 WeakPolarHBondContact O-CB 3.4Å; V243-C246 PolarHBondContact O-N 2.94Å; V243-Q247 WeakPolarHBondContact O-CG 3.34Å; V243-Q247 PolarHBondContact O-N 2.93Å; V243-Q247 VanDerWaalsContact O-N 3.15Å; V243-V254 HydrophobicContact CG2-CG1 4.17Å; V243-V254 HydrophobicContact CG2-CG2 4Å
244	D	92.5	Very high	88.3	Confident	56 Å²	56	72.4 Å²	72.4	30%	0.299	37%	0.366	S	S	.	.	H	α-helix	trans	-68.6	-38.2	177.4	-55.9	-42.6	0	0	0	110.5	V240 W241 N242 C246 Q247 I248	V240-D244 HydrophobicContact CG1-CB 3.6Å; W241-D244 WeakPolarHBondContact CB-OD2 3.24Å; W241-D244 PolarHBondContact N-OD2 3.41Å; W241-D244 WeakPolarHBondContact O-CB 3.37Å; W241-D244 PolarHBondContact O-N 2.91Å; N242-D244 PolarHBondContact O-N 3.34Å; D244-C246 VanDerWaalsContact C-N 3.33Å; D244-C246 PolarHBondContact O-N 2.95Å; D244-Q247 WeakPolarHBondContact O-CB 3.1Å; D244-Q247 PolarHBondContact O-N 3.25Å; D244-I248 WeakPolarHBondContact O-CG1 3.41Å; D244-I248 PolarHBondContact O-N 3.43Å
245	Y	92.6	Very high	88.4	Confident	0 Å²	0	75.8 Å²	75.8	0%	0	38%	0.377	C	S	.	.	H	α-helix	trans	-64.4	-36.2	172.8	-73.9	-84.6	0	0	0	112.6	L186 A190 L225 I228 L229 S232 V240 W241 N242 Q247 I248 L249	L186-Y245 HydrophobicContact CD2-CD1 4.47Å; A190-Y245 HydrophobicContact CB-CE1 4.27Å; L225-Y245 HydrophobicContact CD1-CD1 4.42Å; I228-Y245 HydrophobicContact CG2-CE1 4.31Å; L229-Y245 HydrophobicContact CD2-CD1 3.84Å; L229-Y245 HydrophobicContact CD2-CD2 3.4Å; L229-Y245 HydrophobicContact CD2-CE1 3.97Å; L229-Y245 HydrophobicContact CD2-CE2 3.55Å; L229-Y245 HydrophobicContact CD2-CG 3.54Å; S232-Y245 WeakPolarHBondContact CB-OH 3.23Å; S232-Y245 PolarHBondContact OG-OH 2.89Å; V240-Y245 HydrophobicContact CB-CE2 3.86Å; V240-Y245 HydrophobicContact CG1-CD2 3.91Å; V240-Y245 HydrophobicContact CG1-CE2 3.5Å; W241-Y245 PolarHBondContact O-N 3.31Å; N242-Y245 WeakPolarHBondContact O-CB 3.33Å; N242-Y245 PolarHBondContact O-N 3.39Å; N242-Y245 VanDerWaalsContact O-N 3.16Å; Y245-Q247 VanDerWaalsContact C-N 3.25Å; Y245-Q247 PolarHBondContact O-N 3.2Å; Y245-I248 HydrophobicContact CD1-CD1 4.4Å; Y245-I248 PolarHBondContact O-N 3Å; Y245-L249 PolarHBondContact O-N 3.36Å
246	C	92.6	Very high	88.7	Confident	18 Å²	18	72.1 Å²	72.1	12%	0.122	37%	0.365	C	S	.	.	H	α-helix	trans	-63.5	-29	170.8	-64.2	0	0	0	0	112.4	N242 V243 D244 L249 K250 I252 M257	N242-C246 PolarHBondContact O-N 3.21Å; N242-C246 PolarHBondContact O-SG 3Å; V243-C246 WeakPolarHBondContact O-CB 3.4Å; V243-C246 PolarHBondContact O-N 2.94Å; D244-C246 VanDerWaalsContact C-N 3.33Å; D244-C246 PolarHBondContact O-N 2.95Å; C246-L249 CarbonylContact O-C 3.23Å; C246-L249 VanDerWaalsContact O-O 3.07Å; C246-K250 WeakPolarHBondContact O-CA 3.04Å; C246-K250 PolarHBondContact O-N 2.99Å; C246-I252 PolarHBondContact SG-O 2.84Å; C246-M257 VanDerWaalsContact SG-CG 3.6Å
247	Q	91.3	Very high	89.3	Confident	128 Å²	128	70.6 Å²	70.6	60%	0.598	36%	0.357	S	S	*	.	H	α-helix	trans	-72.2	-33.1	174.1	-64.2	173.3	18.5	0	0	112.2	V243 D244 Y245 K250	V243-Q247 WeakPolarHBondContact O-CG 3.34Å; V243-Q247 PolarHBondContact O-N 2.93Å; V243-Q247 VanDerWaalsContact O-N 3.15Å; D244-Q247 WeakPolarHBondContact O-CB 3.1Å; D244-Q247 PolarHBondContact O-N 3.25Å; Y245-Q247 VanDerWaalsContact C-N 3.25Å; Y245-Q247 PolarHBondContact O-N 3.2Å; Q247-K250 WeakPolarHBondContact O-CG 3.49Å
248	I	91.3	Very high	90.1	Very high	47 Å²	47	66.1 Å²	66.1	24%	0.241	33%	0.333	C	S	.	.	H	α-helix	trans	-73	-47.9	176	-58.7	167.6	0	0	0	109.8	L186 A189 A190 D244 Y245	L186-I248 HydrophobicContact CD2-CG2 4.16Å; A189-I248 HydrophobicContact CB-CB 4.46Å; A189-I248 HydrophobicContact CB-CD1 3.65Å; A189-I248 HydrophobicContact CB-CG1 3.74Å; A189-I248 HydrophobicContact CB-CG2 3.87Å; A190-I248 HydrophobicContact CB-CD1 4.02Å; D244-I248 WeakPolarHBondContact O-CG1 3.41Å; D244-I248 PolarHBondContact O-N 3.43Å; Y245-I248 HydrophobicContact CD1-CD1 4.4Å; Y245-I248 PolarHBondContact O-N 3Å
249	L	90.6	Very high	90.9	Very high	25 Å²	25	61.8 Å²	61.8	13%	0.131	31%	0.312	C	S	.	.	S	Bend	trans	-105.4	73.4	178.3	-58	174.2	0	0	0	108.6	L186 L225 Y245 C246 D251 I252	L186-L249 HydrophobicContact CD2-CD1 4.17Å; L186-L249 HydrophobicContact CD2-CD2 4.46Å; L186-L249 HydrophobicContact CD2-CG 4.33Å; L225-L249 HydrophobicContact CD1-CD1 3.98Å; L225-L249 HydrophobicContact CD2-CD1 3.78Å; Y245-L249 PolarHBondContact O-N 3.36Å; C246-L249 CarbonylContact O-C 3.23Å; C246-L249 VanDerWaalsContact O-O 3.07Å; L249-D251 PolarHBondContact O-N 3.1Å; L249-I252 HydrophobicContact CB-CD1 3.5Å; L249-I252 VanDerWaalsContact CB-CD1 3.5Å; L249-I252 HydrophobicContact CB-CG1 3.98Å; L249-I252 HydrophobicContact CD1-CD1 3.47Å; L249-I252 VanDerWaalsContact CD1-CD1 3.47Å; L249-I252 HydrophobicContact CG-CD1 4.09Å; L249-I252 PolarHBondContact O-N 2.95Å
250	K	79.4	Confident	91.8	Very high	173 Å²	173	59.3 Å²	59.3	75%	0.752	29%	0.292	S	S	*	.	T	Hydrogen-bonded Turn	trans	-49.6	-11.5	-167.6	-65.3	-174.4	179.4	-175.6	0	117.4	C246 Q247	C246-K250 WeakPolarHBondContact O-CA 3.04Å; C246-K250 PolarHBondContact O-N 2.99Å; Q247-K250 WeakPolarHBondContact O-CG 3.49Å
251	D	81.8	Confident	92.3	Very high	66 Å²	66	60 Å²	60	35%	0.353	29%	0.294	S	S	.	.	T	Hydrogen-bonded Turn	trans	-115.9	3.6	-168.6	-54.3	-36.1	0	0	0	112.7	K162 L249	K162-D251 WeakPolarHBondContact CB-OD2 3.34Å; K162-D251 VanDerWaalsContact CE-CG 3.41Å; K162-D251 WeakPolarHBondContact CE-OD1 3.31Å; K162-D251 HydrophobicContact CG-CB 4.38Å; K162-D251 VanDerWaalsContact CG-CG 3.5Å; K162-D251 VanDerWaalsContact CG-OD2 3.25Å; K162-D251 WeakPolarHBondContact CG-OD2 3.32Å; K162-D251 PolarHBondContact N-OD2 3.43Å; K162-D251 IonicContact NZ-OD1 3.66Å; L249-D251 PolarHBondContact O-N 3.1Å
252	I	89.9	Confident	92.6	Very high	12 Å²	12	55.9 Å²	55.9	6%	0.062	28%	0.278	C	S	.	.			trans	-100.8	135	177.3	-51.8	176.1	0	0	0	109.5	L160 L225 C246 L249 D256 M257	L160-I252 HydrophobicContact CB-CD1 4.14Å; L160-I252 HydrophobicContact CD2-CD1 3.34Å; L160-I252 HydrophobicContact CD2-CG1 4.29Å; L160-I252 HydrophobicContact CG-CD1 4.32Å; L225-I252 HydrophobicContact CD2-CD1 4.3Å; C246-I252 PolarHBondContact SG-O 2.84Å; L249-I252 HydrophobicContact CB-CD1 3.5Å; L249-I252 VanDerWaalsContact CB-CD1 3.5Å; L249-I252 HydrophobicContact CB-CG1 3.98Å; L249-I252 HydrophobicContact CD1-CD1 3.47Å; L249-I252 VanDerWaalsContact CD1-CD1 3.47Å; L249-I252 HydrophobicContact CG-CD1 4.09Å; L249-I252 PolarHBondContact O-N 2.95Å; I252-D256 HydrophobicContact CG2-CB 4.03Å; I252-D256 VanDerWaalsContact CG2-OD2 3.22Å; I252-D256 WeakPolarHBondContact CG2-OD2 3.43Å; I252-M257 HydrophobicContact CB-CG 4.48Å; I252-M257 HydrophobicContact CB-SD 4.31Å; I252-M257 HydrophobicContact CD1-SD 4.08Å; I252-M257 HydrophobicContact CG2-CG 3.72Å; I252-M257 HydrophobicContact CG2-SD 3.6Å; I252-M257 VanDerWaalsContact CG2-SD 3.6Å
253	T	92.1	Very high	92.9	Very high	77 Å²	77	57.4 Å²	57.4	47%	0.472	29%	0.285	S	S	.	.			trans	-77.8	153.8	176.3	68.4	0	0	0	0	111.2	E255 D256 M257	T253-E255 WeakPolarHBondContact CB-OE2 3.36Å; T253-E255 PolarHBondContact O-N 3.17Å; T253-D256 PolarHBondContact O-N 2.85Å; T253-D256 WeakPolarHBondContact OG1-CB 3.42Å; T253-D256 PolarHBondContact OG1-N 3.3Å; T253-D256 VanDerWaalsContact OG1-N 3.15Å; T253-M257 WeakPolarHBondContact O-CG 3.28Å; T253-M257 PolarHBondContact O-N 2.99Å; T253-M257 VanDerWaalsContact O-N 3.11Å
254	V	93.9	Very high	93.1	Very high	44 Å²	44	54 Å²	54	27%	0.267	26%	0.264	S	S	.	.	H	α-helix	trans	-64.9	-33.1	177.8	-179.9	0	0	0	0	110.1	V243 M257 N258	V243-V254 HydrophobicContact CG2-CG1 4.17Å; V243-V254 HydrophobicContact CG2-CG2 4Å; V254-M257 PolarHBondContact O-N 3.09Å; V254-N258 WeakPolarHBondContact O-CB 3.49Å; V254-N258 PolarHBondContact O-N 3.37Å; V254-N258 PolarHBondContact O-ND2 3.48Å
255	E	95.1	Very high	93.3	Very high	135 Å²	135	53 Å²	53	63%	0.631	26%	0.259	S	S	*	.	H	α-helix	trans	-62.5	-46.2	176.2	-63.5	71.8	-157.4	0	0	111.8	T253 M257 N258 E259	T253-E255 WeakPolarHBondContact CB-OE2 3.36Å; T253-E255 PolarHBondContact O-N 3.17Å; E255-M257 VanDerWaalsContact C-N 3.34Å; E255-N258 PolarHBondContact O-N 3.25Å; E255-E259 WeakPolarHBondContact O-CB 3.32Å; E255-E259 PolarHBondContact O-N 2.86Å
256	D	95.4	Very high	93.5	Very high	24 Å²	24	56.8 Å²	56.8	13%	0.128	28%	0.276	C	S	.	.	H	α-helix	trans	-64.3	-40.3	176.7	-179.9	72.6	0	0	0	111.3	H158 R222 I252 T253 E259 L260	H158-D256 IonicContact CE1-OD1 3.69Å; H158-D256 IonicContact CG-OD1 2.9Å; H158-D256 IonicContact ND1-OD1 2.8Å; H158-D256 PolarHBondContact ND1-OD1 3.21Å; R222-D256 IonicContact CZ-OD1 2.86Å; R222-D256 IonicContact CZ-OD2 2.65Å; R222-D256 VanDerWaalsContact CZ-OD2 3.24Å; R222-D256 IonicContact NH1-OD1 2.86Å; R222-D256 PolarHBondContact NH1-OD1 3.07Å; R222-D256 IonicContact NH1-OD2 2.59Å; R222-D256 PolarHBondContact NH1-OD2 2.94Å; R222-D256 IonicContact NH2-OD1 3.35Å; R222-D256 IonicContact NH2-OD2 2.73Å; R222-D256 PolarHBondContact NH2-OD2 3.49Å; I252-D256 HydrophobicContact CG2-CB 4.03Å; I252-D256 VanDerWaalsContact CG2-OD2 3.22Å; I252-D256 WeakPolarHBondContact CG2-OD2 3.43Å; T253-D256 PolarHBondContact O-N 2.85Å; T253-D256 WeakPolarHBondContact OG1-CB 3.42Å; T253-D256 PolarHBondContact OG1-N 3.3Å; T253-D256 VanDerWaalsContact OG1-N 3.15Å; D256-E259 PolarHBondContact O-N 2.94Å; D256-L260 WeakPolarHBondContact O-CB 3.24Å; D256-L260 PolarHBondContact O-N 3.3Å
257	M	95.5	Very high	93.7	Very high	0 Å²	0	57.6 Å²	57.6	0%	0	28%	0.279	C	S	.	.	H	α-helix	trans	-63.9	-44.5	175.8	-71.9	-53.2	-37.2	0	0	113	L225 L229 N242 C246 I252 T253 V254 E255 E259 L260 E261	L225-M257 HydrophobicContact CD1-CE 4.49Å; L225-M257 HydrophobicContact CD2-CE 4.03Å; L225-M257 HydrophobicContact CD2-SD 4.05Å; L225-M257 HydrophobicContact CG-CE 4.21Å; L229-M257 HydrophobicContact CD1-CE 3.08Å; L229-M257 HydrophobicContact CD2-CE 3.61Å; L229-M257 HydrophobicContact CG-CE 3.85Å; N242-M257 HydrophobicContact CB-CB 4.11Å; C246-M257 VanDerWaalsContact SG-CG 3.6Å; I252-M257 HydrophobicContact CB-CG 4.48Å; I252-M257 HydrophobicContact CB-SD 4.31Å; I252-M257 HydrophobicContact CD1-SD 4.08Å; I252-M257 HydrophobicContact CG2-CG 3.72Å; I252-M257 HydrophobicContact CG2-SD 3.6Å; I252-M257 VanDerWaalsContact CG2-SD 3.6Å; T253-M257 WeakPolarHBondContact O-CG 3.28Å; T253-M257 PolarHBondContact O-N 2.99Å; T253-M257 VanDerWaalsContact O-N 3.11Å; V254-M257 PolarHBondContact O-N 3.09Å; E255-M257 VanDerWaalsContact C-N 3.34Å; M257-E259 VanDerWaalsContact C-N 3.33Å; M257-L260 HydrophobicContact CE-CD2 4.33Å; M257-L260 PolarHBondContact O-N 3.35Å; M257-E261 PolarHBondContact O-N 2.93Å
258	N	96.8	Very high	93.9	Very high	76 Å²	76	51.5 Å²	51.5	41%	0.406	25%	0.251	S	S	.	.	H	α-helix	trans	-63.9	-40.7	177.4	-71.7	-21.5	0	0	0	111.1	N242 V254 E255 E261 R262	N242-N258 PolarHBondContact ND2-OD1 3.48Å; V254-N258 WeakPolarHBondContact O-CB 3.49Å; V254-N258 PolarHBondContact O-N 3.37Å; V254-N258 PolarHBondContact O-ND2 3.48Å; E255-N258 PolarHBondContact O-N 3.25Å; N258-E261 PolarHBondContact O-N 3.01Å; N258-R262 WeakPolarHBondContact O-CB 3.49Å; N258-R262 PolarHBondContact O-N 2.89Å
259	E	97.4	Very high	94.1	Very high	67 Å²	67	55.6 Å²	55.6	31%	0.313	27%	0.269	S	S	.	.	H	α-helix	trans	-68.2	-43.1	178.5	-177	58.7	-164.8	0	0	111.4	I152 E255 D256 M257 E261 R262 Q263	I152-E259 HydrophobicContact CD1-CG 4.02Å; E255-E259 WeakPolarHBondContact O-CB 3.32Å; E255-E259 PolarHBondContact O-N 2.86Å; D256-E259 PolarHBondContact O-N 2.94Å; M257-E259 VanDerWaalsContact C-N 3.33Å; E259-E261 VanDerWaalsContact C-N 3.3Å; E259-E261 PolarHBondContact O-N 2.95Å; E259-R262 VanDerWaalsContact CD-NH2 3.27Å; E259-R262 PolarHBondContact O-N 3.3Å; E259-R262 IonicContact OE1-CZ 3.51Å; E259-R262 IonicContact OE1-NE 3.74Å; E259-R262 IonicContact OE1-NH2 2.65Å; E259-R262 PolarHBondContact OE1-NH2 2.94Å; E259-R262 IonicContact OE2-CZ 3.4Å; E259-R262 IonicContact OE2-NE 2.87Å; E259-R262 PolarHBondContact OE2-NE 3.39Å; E259-R262 IonicContact OE2-NH2 3.07Å; E259-R262 PolarHBondContact OE2-NH2 3.4Å; E259-Q263 HydrophobicContact CG-CG 4.31Å; E259-Q263 WeakPolarHBondContact O-CB 3.31Å; E259-Q263 VanDerWaalsContact O-CG 3.24Å; E259-Q263 WeakPolarHBondContact O-CG 3.44Å; E259-Q263 PolarHBondContact O-N 3.49Å; E259-Q263 WeakPolarHBondContact OE1-CG 3.41Å; E259-Q263 PolarHBondContact OE1-NE2 3.04Å
260	L	97.4	Very high	94.3	Very high	0 Å²	0	60.8 Å²	60.8	0%	0	29%	0.291	C	S	.	.	H	α-helix	trans	-57.3	-44.8	173.7	177.6	62.2	0	0	0	111.4	I152 F153 L225 L229 D256 M257 F264	I152-L260 HydrophobicContact CG1-CD1 4.05Å; F153-L260 HydrophobicContact CD1-CD1 3.89Å; F153-L260 HydrophobicContact CE1-CD1 3.73Å; L225-L260 HydrophobicContact CB-CD2 4.37Å; L225-L260 HydrophobicContact CD2-CD2 3.96Å; L225-L260 HydrophobicContact CG-CD2 4.04Å; L229-L260 HydrophobicContact CD1-CD2 4.17Å; L229-L260 HydrophobicContact CD1-CG 4.47Å; D256-L260 WeakPolarHBondContact O-CB 3.24Å; D256-L260 PolarHBondContact O-N 3.3Å; M257-L260 HydrophobicContact CE-CD2 4.33Å; M257-L260 PolarHBondContact O-N 3.35Å; L260-F264 VanDerWaalsContact O-CB 3.3Å; L260-F264 WeakPolarHBondContact O-CB 3.46Å; L260-F264 PolarHBondContact O-N 3.48Å
261	E	96.6	Very high	95.1	Very high	36 Å²	36	54.9 Å²	54.9	17%	0.168	27%	0.268	C	S	.	.	H	α-helix	trans	-61.1	-48.4	175.9	179.1	-178.7	-164.2	0	0	112.3	L230 K233 N242 M257 N258 E259 F264 L265	L230-E261 HydrophobicContact CD2-CG 3.64Å; K233-E261 WeakPolarHBondContact CD-OE1 3.49Å; K233-E261 WeakPolarHBondContact CE-OE1 3.47Å; K233-E261 IonicContact NZ-OE1 3.87Å; K233-E261 PolarHBondContact NZ-OE1 2.91Å; K233-E261 IonicContact NZ-OE2 2.76Å; K233-E261 PolarHBondContact NZ-OE2 3.07Å; N242-E261 PolarHBondContact ND2-OE2 3.45Å; M257-E261 PolarHBondContact O-N 2.93Å; N258-E261 PolarHBondContact O-N 3.01Å; E259-E261 VanDerWaalsContact C-N 3.3Å; E259-E261 PolarHBondContact O-N 2.95Å; E261-F264 PolarHBondContact O-N 2.94Å; E261-L265 HydrophobicContact CG-CD1 4.27Å; E261-L265 PolarHBondContact O-N 3.48Å
262	R	97.4	Very high	95.7	Very high	103 Å²	103	54.6 Å²	54.6	39%	0.389	27%	0.266	S	S	.	.	H	α-helix	trans	-60.1	-49.2	-179.3	-174.1	-176.9	71.8	80.7	-5.1	111.2	N258 E259 F264 L265 E266	N258-R262 WeakPolarHBondContact O-CB 3.49Å; N258-R262 PolarHBondContact O-N 2.89Å; E259-R262 VanDerWaalsContact CD-NH2 3.27Å; E259-R262 PolarHBondContact O-N 3.3Å; E259-R262 IonicContact OE1-CZ 3.51Å; E259-R262 IonicContact OE1-NE 3.74Å; E259-R262 IonicContact OE1-NH2 2.65Å; E259-R262 PolarHBondContact OE1-NH2 2.94Å; E259-R262 IonicContact OE2-CZ 3.4Å; E259-R262 IonicContact OE2-NE 2.87Å; E259-R262 PolarHBondContact OE2-NE 3.39Å; E259-R262 IonicContact OE2-NH2 3.07Å; E259-R262 PolarHBondContact OE2-NH2 3.4Å; R262-F264 VanDerWaalsContact C-N 3.34Å; R262-F264 PolarHBondContact O-N 3.02Å; R262-L265 PolarHBondContact O-N 3.24Å; R262-E266 IonicContact CZ-OE1 3.74Å; R262-E266 IonicContact NH1-OE1 2.65Å; R262-E266 PolarHBondContact NH1-OE1 3.21Å; R262-E266 IonicContact NH1-OE2 3.08Å; R262-E266 PolarHBondContact NH1-OE2 2.88Å; R262-E266 VanDerWaalsContact NH1-OE2 3.08Å; R262-E266 WeakPolarHBondContact O-CG 3.33Å; R262-E266 PolarHBondContact O-N 2.87Å
263	Q	97.4	Very high	95.9	Very high	46 Å²	46	59.5 Å²	59.5	22%	0.215	29%	0.292	C	S	.	.	H	α-helix	trans	-61.9	-42.1	178.6	-69.6	-69.9	-23	0	0	111.3	I152 E259 L265 E266 L267	I152-Q263 HydrophobicContact CD1-CG 4.5Å; I152-Q263 HydrophobicContact CG1-CB 4.06Å; I152-Q263 HydrophobicContact CG1-CG 4.02Å; I152-Q263 HydrophobicContact CG2-CB 4.34Å; E259-Q263 HydrophobicContact CG-CG 4.31Å; E259-Q263 WeakPolarHBondContact O-CB 3.31Å; E259-Q263 VanDerWaalsContact O-CG 3.24Å; E259-Q263 WeakPolarHBondContact O-CG 3.44Å; E259-Q263 PolarHBondContact O-N 3.49Å; E259-Q263 WeakPolarHBondContact OE1-CG 3.41Å; E259-Q263 PolarHBondContact OE1-NE2 3.04Å; Q263-L265 PolarHBondContact O-N 2.83Å; Q263-E266 PolarHBondContact O-N 3.39Å; Q263-L267 WeakPolarHBondContact O-CB 3.5Å; Q263-L267 VanDerWaalsContact O-CG 3.23Å; Q263-L267 WeakPolarHBondContact O-CG 3.42Å; Q263-L267 PolarHBondContact O-N 3.27Å
264	F	97.6	Very high	96.1	Very high	0 Å²	0	56.6 Å²	56.6	0%	0	27%	0.274	C	S	.	.	H	α-helix	trans	-63.1	-41.9	177.5	-153.8	-68.1	0	0	0	111.6	F153 L207 I223 A227 L230 L260 E261 R262 E266 L267 L268	F153-F264 AromaticContact CE1-CD2 3.94Å; F153-F264 HydrophobicContact CE1-CD2 3.94Å; F153-F264 HydrophobicContact CE1-CE2 4.46Å; F153-F264 HydrophobicContact CZ-CD2 4.09Å; L207-F264 HydrophobicContact CB-CE1 4.25Å; L207-F264 HydrophobicContact CB-CZ 3.94Å; L207-F264 HydrophobicContact CD1-CD1 4.32Å; L207-F264 HydrophobicContact CD1-CD2 4.35Å; L207-F264 HydrophobicContact CD1-CE1 4.2Å; L207-F264 HydrophobicContact CD1-CE2 4.2Å; L207-F264 HydrophobicContact CD1-CG 4.42Å; L207-F264 HydrophobicContact CD1-CZ 4.13Å; L207-F264 HydrophobicContact CD2-CD2 4.36Å; L207-F264 HydrophobicContact CD2-CE2 3.64Å; L207-F264 HydrophobicContact CD2-CZ 3.84Å; L207-F264 HydrophobicContact CG-CE2 4.36Å; L207-F264 HydrophobicContact CG-CZ 4.19Å; I223-F264 WeakPolarHBondContact O-CE2 3.24Å; A227-F264 HydrophobicContact CB-CE1 4.42Å; A227-F264 HydrophobicContact CB-CE2 4.11Å; A227-F264 HydrophobicContact CB-CZ 3.65Å; A227-F264 VanDerWaalsContact N-CE2 3.31Å; L230-F264 HydrophobicContact CD1-CB 4.01Å; L230-F264 HydrophobicContact CD1-CD1 3.26Å; L230-F264 HydrophobicContact CD1-CE1 4.02Å; L230-F264 HydrophobicContact CD1-CG 3.94Å; L230-F264 HydrophobicContact CG-CD1 4.19Å; L260-F264 VanDerWaalsContact O-CB 3.3Å; L260-F264 WeakPolarHBondContact O-CB 3.46Å; L260-F264 PolarHBondContact O-N 3.48Å; E261-F264 PolarHBondContact O-N 2.94Å; R262-F264 VanDerWaalsContact C-N 3.34Å; R262-F264 PolarHBondContact O-N 3.02Å; F264-E266 PolarHBondContact O-N 3.31Å; F264-L267 PolarHBondContact O-N 2.94Å; F264-L268 HydrophobicContact CD1-CD1 3.55Å; F264-L268 HydrophobicContact CD1-CD2 4.06Å; F264-L268 HydrophobicContact CD1-CG 4.38Å; F264-L268 HydrophobicContact CE1-CD1 3.36Å; F264-L268 HydrophobicContact CE1-CD2 3.89Å; F264-L268 HydrophobicContact CE1-CG 4.27Å; F264-L268 HydrophobicContact CZ-CD1 4.37Å; F264-L268 WeakPolarHBondContact O-CB 3.28Å; F264-L268 WeakPolarHBondContact O-CD1 3.44Å; F264-L268 PolarHBondContact O-N 3.18Å
265	L	97.1	Very high	96.1	Very high	37 Å²	37	56.9 Å²	56.9	19%	0.194	28%	0.277	C	S	.	.	H	α-helix	trans	-61.6	-42.4	175.3	-79.6	166.6	0	0	0	112.7	L230 E261 R262 Q263 L268 Q269 F270 I272	L230-L265 HydrophobicContact CD1-CD2 3.89Å; L230-L265 HydrophobicContact CD1-CG 3.97Å; L230-L265 HydrophobicContact CD2-CD1 4.02Å; L230-L265 HydrophobicContact CD2-CD2 3.83Å; L230-L265 HydrophobicContact CD2-CG 3.59Å; L230-L265 HydrophobicContact CG-CG 4.47Å; E261-L265 HydrophobicContact CG-CD1 4.27Å; E261-L265 PolarHBondContact O-N 3.48Å; R262-L265 PolarHBondContact O-N 3.24Å; Q263-L265 PolarHBondContact O-N 2.83Å; L265-L268 CarbonylContact O-C 3.58Å; L265-L268 PolarHBondContact O-N 3.16Å; L265-Q269 PolarHBondContact O-N 3.03Å; L265-F270 HydrophobicContact CB-CD1 4.26Å; L265-F270 HydrophobicContact CB-CE1 4.09Å; L265-F270 PolarHBondContact O-N 2.96Å; L265-I272 HydrophobicContact CD2-CG2 3.63Å
266	E	97.1	Very high	96.1	Very high	78 Å²	78	55.4 Å²	55.4	36%	0.364	28%	0.281	S	S	.	.	H	α-helix	trans	-64.1	-44	178	-75.4	172.3	-166.8	0	0	111.5	R262 Q263 F264 L268 Q269 F270	R262-E266 IonicContact CZ-OE1 3.74Å; R262-E266 IonicContact NH1-OE1 2.65Å; R262-E266 PolarHBondContact NH1-OE1 3.21Å; R262-E266 IonicContact NH1-OE2 3.08Å; R262-E266 PolarHBondContact NH1-OE2 2.88Å; R262-E266 VanDerWaalsContact NH1-OE2 3.08Å; R262-E266 WeakPolarHBondContact O-CG 3.33Å; R262-E266 PolarHBondContact O-N 2.87Å; Q263-E266 PolarHBondContact O-N 3.39Å; F264-E266 PolarHBondContact O-N 3.31Å; E266-L268 VanDerWaalsContact C-N 3.25Å; E266-L268 PolarHBondContact O-N 2.97Å; E266-Q269 WeakPolarHBondContact O-CA 3.33Å; E266-Q269 PolarHBondContact O-N 3.17Å; E266-F270 HydrophobicContact CG-CE2 4.26Å; E266-F270 HydrophobicContact CG-CZ 3.93Å
267	L	96.1	Very high	96	Very high	35 Å²	35	57.1 Å²	57.1	18%	0.183	30%	0.295	C	S	.	.	H	α-helix	trans	-66.7	-27.4	176.1	-66.4	170.4	0	0	0	112.7	L150 F153 L207 A211 Q263 F264 Q269	L150-L267 HydrophobicContact CD1-CD1 3.65Å; L150-L267 HydrophobicContact CD1-CD2 3.85Å; L150-L267 HydrophobicContact CD1-CG 4.41Å; F153-L267 HydrophobicContact CE2-CD1 3.56Å; F153-L267 HydrophobicContact CZ-CD1 3.6Å; L207-L267 HydrophobicContact CD1-CB 3.52Å; L207-L267 HydrophobicContact CD1-CD1 3.77Å; L207-L267 HydrophobicContact CD1-CG 4.3Å; A211-L267 HydrophobicContact CB-CB 4.34Å; A211-L267 HydrophobicContact CB-CD2 3.9Å; Q263-L267 WeakPolarHBondContact O-CB 3.5Å; Q263-L267 VanDerWaalsContact O-CG 3.23Å; Q263-L267 WeakPolarHBondContact O-CG 3.42Å; Q263-L267 PolarHBondContact O-N 3.27Å; F264-L267 PolarHBondContact O-N 2.94Å; L267-Q269 PolarHBondContact O-N 3.24Å
268	L	95.6	Very high	96	Very high	0 Å²	0	57.2 Å²	57.2	0%	0	30%	0.296	C	S	.	.	T	Hydrogen-bonded Turn	trans	-78.2	-1.7	170.2	-96.5	59.1	0	0	0	113.3	Y203 R206 L207 L230 F264 L265 E266 F270 N271	Y203-L268 HydrophobicContact CD1-CD2 3.96Å; Y203-L268 HydrophobicContact CG-CD2 3.99Å; R206-L268 HydrophobicContact CB-CG 4.35Å; L207-L268 HydrophobicContact CB-CD1 3.92Å; L207-L268 HydrophobicContact CD1-CD1 3.82Å; L230-L268 HydrophobicContact CD1-CD2 4.11Å; F264-L268 HydrophobicContact CD1-CD1 3.55Å; F264-L268 HydrophobicContact CD1-CD2 4.06Å; F264-L268 HydrophobicContact CD1-CG 4.38Å; F264-L268 HydrophobicContact CE1-CD1 3.36Å; F264-L268 HydrophobicContact CE1-CD2 3.89Å; F264-L268 HydrophobicContact CE1-CG 4.27Å; F264-L268 HydrophobicContact CZ-CD1 4.37Å; F264-L268 WeakPolarHBondContact O-CB 3.28Å; F264-L268 WeakPolarHBondContact O-CD1 3.44Å; F264-L268 PolarHBondContact O-N 3.18Å; L265-L268 CarbonylContact O-C 3.58Å; L265-L268 PolarHBondContact O-N 3.16Å; E266-L268 VanDerWaalsContact C-N 3.25Å; E266-L268 PolarHBondContact O-N 2.97Å; L268-F270 PolarHBondContact O-N 2.81Å; L268-F270 VanDerWaalsContact O-N 3.11Å; L268-N271 WeakPolarHBondContact O-CB 3.29Å; L268-N271 PolarHBondContact O-N 3.3Å
269	Q	95.8	Very high	96	Very high	134 Å²	134	54.3 Å²	54.3	63%	0.626	28%	0.279	S	S	*	.	T	Hydrogen-bonded Turn	trans	51.6	33.1	-173	-56.4	179.8	-17.8	0	0	111.7	L265 E266 L267 N271	L265-Q269 PolarHBondContact O-N 3.03Å; E266-Q269 WeakPolarHBondContact O-CA 3.33Å; E266-Q269 PolarHBondContact O-N 3.17Å; L267-Q269 PolarHBondContact O-N 3.24Å; Q269-N271 PolarHBondContact O-N 3.12Å; Q269-N271 VanDerWaalsContact O-N 3.1Å
270	F	95.2	Very high	95.8	Very high	133 Å²	133	52.3 Å²	52.3	58%	0.583	27%	0.274	S	S	*	.	T	Hydrogen-bonded Turn	trans	58	15.9	-174.3	-54.4	-89.8	0	0	0	115	L265 E266 L268 I272	L265-F270 HydrophobicContact CB-CD1 4.26Å; L265-F270 HydrophobicContact CB-CE1 4.09Å; L265-F270 PolarHBondContact O-N 2.96Å; E266-F270 HydrophobicContact CG-CE2 4.26Å; E266-F270 HydrophobicContact CG-CZ 3.93Å; L268-F270 PolarHBondContact O-N 2.81Å; L268-F270 VanDerWaalsContact O-N 3.11Å; F270-I272 VanDerWaalsContact C-N 3.25Å; F270-I272 PolarHBondContact O-N 3.42Å
271	N	94.8	Very high	95.7	Very high	50 Å²	50	53.1 Å²	53.1	27%	0.267	28%	0.278	S	S	.	.			trans	-77.2	76.3	172.3	-175.3	14.6	0	0	0	111.1	D61 R206 Y210 L268 Q269	D61-N271 PolarHBondContact OD1-ND2 3.22Å; R206-N271 PolarHBondContact NH1-O 2.9Å; Y210-N271 HydrophobicContact CE2-CB 4.18Å; Y210-N271 PolarHBondContact OH-ND2 3.43Å; L268-N271 WeakPolarHBondContact O-CB 3.29Å; L268-N271 PolarHBondContact O-N 3.3Å; Q269-N271 PolarHBondContact O-N 3.12Å; Q269-N271 VanDerWaalsContact O-N 3.1Å
272	I	94.8	Very high	95.7	Very high	60 Å²	60	51.4 Å²	51.4	31%	0.308	27%	0.27	S	S	.	.			trans	-93	-8.4	177.3	61.1	169.6	0	0	0	112.9	Y203 V234 L265 F270 V274	Y203-I272 PolarHBondContact OH-O 2.97Å; V234-I272 HydrophobicContact CG2-CB 4.24Å; V234-I272 HydrophobicContact CG2-CD1 4.03Å; L265-I272 HydrophobicContact CD2-CG2 3.63Å; F270-I272 VanDerWaalsContact C-N 3.25Å; F270-I272 PolarHBondContact O-N 3.42Å; I272-V274 PolarHBondContact O-N 2.9Å
273	N	94.8	Very high	95.7	Very high	114 Å²	114	46.9 Å²	46.9	61%	0.61	25%	0.253	S	S	*	.			trans	-71.3	126.2	-179.5	-175.8	34.6	0	0	0	110	R206	R206-N273 PolarHBondContact NH1-O 3.04Å; R206-N273 PolarHBondContact NH2-O 2.97Å
274	V	95.6	Very high	95.5	Very high	16 Å²	16	50 Å²	50	10%	0.097	27%	0.266	C	S	.	.			trans	-117	98.3	174.7	-176.5	0	0	0	0	108.6	V199 V202 Y203 I272 V278	V199-V274 HydrophobicContact CG1-CG2 4.26Å; V202-V274 HydrophobicContact CG1-CG1 4.45Å; V202-V274 HydrophobicContact CG1-CG2 4.1Å; V202-V274 HydrophobicContact CG2-CG1 4.31Å; Y203-V274 HydrophobicContact CD1-CG2 4.45Å; Y203-V274 HydrophobicContact CE1-CG2 3.63Å; I272-V274 PolarHBondContact O-N 2.9Å; V274-V278 HydrophobicContact CG1-CB 4.36Å; V274-V278 HydrophobicContact CG1-CG1 4.29Å
275	P	95	Very high	95.4	Very high	50 Å²	50	51.4 Å²	51.4	33%	0.325	27%	0.273	S	S	.	.			trans	-59.2	148.2	175.7	-23.8	33.4	0	0	0	111.7	S277 V278 Y279	P275-S277 PolarHBondContact O-N 3.11Å; P275-V278 HydrophobicContact CB-CG2 4.29Å; P275-V278 HydrophobicContact CG-CG2 4.21Å; P275-V278 WeakPolarHBondContact O-CB 3.49Å; P275-V278 PolarHBondContact O-N 2.93Å; P275-Y279 PolarHBondContact O-N 3.26Å
276	S	94	Very high	95.2	Very high	105 Å²	105	50 Å²	50	73%	0.734	27%	0.265	S	S	*	.	H	α-helix	trans	-56.5	-29.4	179.2	-50.1	0	0	0	0	113.2	A280	S276-A280 VanDerWaalsContact O-CB 3.24Å; S276-A280 WeakPolarHBondContact O-CB 3.32Å; S276-A280 PolarHBondContact O-N 3.44Å
277	S	93.9	Very high	94.9	Very high	60 Å²	60	48.3 Å²	48.3	42%	0.42	26%	0.256	S	S	.	.	H	α-helix	trans	-69.1	-38.3	175.6	54.1	0	0	0	0	112.9	P275 K281	P275-S277 PolarHBondContact O-N 3.11Å; S277-K281 WeakPolarHBondContact O-CB 3.5Å; S277-K281 PolarHBondContact O-N 3.44Å
278	V	95.1	Very high	94.6	Very high	1 Å²	1	49.5 Å²	49.5	1%	0.006	27%	0.267	C	S	.	.	H	α-helix	trans	-68.9	-47.9	175.1	176.4	0	0	0	0	109.1	S60 D61 V202 V274 P275 A280 K281 Y282	S60-V278 WeakPolarHBondContact O-CG1 3.49Å; D61-V278 WeakPolarHBondContact O-CG2 3.38Å; V202-V278 HydrophobicContact CG1-CG1 4.22Å; V202-V278 HydrophobicContact CG2-CG1 4.4Å; V274-V278 HydrophobicContact CG1-CB 4.36Å; V274-V278 HydrophobicContact CG1-CG1 4.29Å; P275-V278 HydrophobicContact CB-CG2 4.29Å; P275-V278 HydrophobicContact CG-CG2 4.21Å; P275-V278 WeakPolarHBondContact O-CB 3.49Å; P275-V278 PolarHBondContact O-N 2.93Å; V278-A280 VanDerWaalsContact C-N 3.33Å; V278-A280 PolarHBondContact O-N 3.2Å; V278-K281 WeakPolarHBondContact O-CB 3.32Å; V278-K281 PolarHBondContact O-N 3.13Å; V278-Y282 HydrophobicContact CG1-CD2 3.94Å; V278-Y282 HydrophobicContact CG1-CE2 3.86Å; V278-Y282 WeakPolarHBondContact O-CD2 3.19Å; V278-Y282 PolarHBondContact O-N 3.41Å
279	Y	96.4	Very high	94.4	Very high	16 Å²	16	49.6 Å²	49.6	6%	0.063	27%	0.268	C	S	.	.	H	α-helix	trans	-53.8	-48.8	174.4	175.6	-87.1	0	0	0	112.2	V119 P122 E195 I198 V199 W235 P275 K281 Y282 Y283	V119-Y279 HydrophobicContact CG2-CD1 4.28Å; V119-Y279 HydrophobicContact CG2-CE1 3.97Å; V119-Y279 WeakPolarHBondContact O-CE1 3.39Å; V119-Y279 PolarHBondContact O-OH 3.33Å; P122-Y279 WeakPolarHBondContact CG-OH 3.3Å; E195-Y279 HydrophobicContact CB-CE2 4.12Å; E195-Y279 VanDerWaalsContact CG-OH 3.32Å; E195-Y279 WeakPolarHBondContact CG-OH 3.48Å; I198-Y279 HydrophobicContact CB-CD2 4.24Å; I198-Y279 HydrophobicContact CB-CE2 3.76Å; I198-Y279 HydrophobicContact CD1-CE2 3.89Å; I198-Y279 WeakPolarHBondContact CD1-OH 3.31Å; I198-Y279 HydrophobicContact CG1-CE2 4.43Å; I198-Y279 HydrophobicContact CG2-CD2 3.76Å; I198-Y279 HydrophobicContact CG2-CE2 3.73Å; I198-Y279 HydrophobicContact CG2-CG 4.48Å; V199-Y279 HydrophobicContact CG2-CD2 4.32Å; W235-Y279 HydrophobicContact CH2-CD2 4.47Å; W235-Y279 HydrophobicContact CZ2-CE2 4.44Å; P275-Y279 PolarHBondContact O-N 3.26Å; Y279-K281 VanDerWaalsContact C-N 3.35Å; Y279-K281 PolarHBondContact O-N 3.45Å; Y279-Y282 PolarHBondContact O-N 2.99Å; Y279-Y283 PolarHBondContact O-N 3.34Å
280	A	94.9	Very high	94	Very high	25 Å²	25	43.2 Å²	43.2	21%	0.207	24%	0.238	C	C	.	.	H	α-helix	trans	-62.3	-41.1	179.8	0	0	0	0	0	112.2	V119 S276 V278 Y283 F284	V119-A280 HydrophobicContact CG2-CB 4.16Å; S276-A280 VanDerWaalsContact O-CB 3.24Å; S276-A280 WeakPolarHBondContact O-CB 3.32Å; S276-A280 PolarHBondContact O-N 3.44Å; V278-A280 VanDerWaalsContact C-N 3.33Å; V278-A280 PolarHBondContact O-N 3.2Å; A280-Y283 WeakPolarHBondContact O-CB 3.35Å; A280-Y283 PolarHBondContact O-N 2.76Å; A280-F284 HydrophobicContact CB-CE2 4.36Å; A280-F284 WeakPolarHBondContact O-CD2 3.37Å; A280-F284 PolarHBondContact O-N 3.22Å
281	K	94.7	Very high	93.6	Very high	16 Å²	16	40.8 Å²	40.8	7%	0.07	23%	0.228	C	C	.	.	H	α-helix	trans	-54.6	-55.3	172.4	165.4	-168.2	156.1	169.7	0	110.8	P59 H62 A65 S66 T67 S277 V278 Y279 Y283 F284 D285	P59-K281 PolarHBondContact O-NZ 3.14Å; H62-K281 WeakPolarHBondContact O-CD 3.39Å; H62-K281 PolarHBondContact O-NZ 3.29Å; A65-K281 VanDerWaalsContact O-CD 3.23Å; A65-K281 WeakPolarHBondContact O-CD 3.48Å; A65-K281 WeakPolarHBondContact O-CE 3.41Å; A65-K281 PolarHBondContact O-NZ 3.14Å; S66-K281 PolarHBondContact O-NZ 3.48Å; T67-K281 HydrophobicContact CG2-CD 4.48Å; T67-K281 HydrophobicContact CG2-CG 4.37Å; S277-K281 WeakPolarHBondContact O-CB 3.5Å; S277-K281 PolarHBondContact O-N 3.44Å; V278-K281 WeakPolarHBondContact O-CB 3.32Å; V278-K281 PolarHBondContact O-N 3.13Å; Y279-K281 VanDerWaalsContact C-N 3.35Å; Y279-K281 PolarHBondContact O-N 3.45Å; K281-Y283 VanDerWaalsContact C-N 3.29Å; K281-Y283 PolarHBondContact O-N 2.89Å; K281-F284 PolarHBondContact O-N 2.87Å; K281-D285 WeakPolarHBondContact O-CB 3.17Å; K281-D285 PolarHBondContact O-N 2.97Å
282	Y	97.3	Very high	93.2	Very high	0 Å²	0	40.5 Å²	40.5	0%	0	23%	0.233	C	C	.	.	H	α-helix	trans	-60.2	-39.7	-178.9	-86	-102.2	0	0	0	112.1	S60 T67 F69 L201 V202 E205 V278 Y279 L286	S60-Y282 WeakPolarHBondContact CA-OH 3.36Å; S60-Y282 VanDerWaalsContact CB-OH 3.29Å; S60-Y282 WeakPolarHBondContact CB-OH 3.24Å; S60-Y282 PolarHBondContact OG-OH 3.08Å; S60-Y282 VanDerWaalsContact OG-OH 3.06Å; T67-Y282 HydrophobicContact CG2-CD1 3.77Å; T67-Y282 HydrophobicContact CG2-CD2 3.92Å; T67-Y282 HydrophobicContact CG2-CE1 3.69Å; T67-Y282 HydrophobicContact CG2-CE2 3.89Å; T67-Y282 HydrophobicContact CG2-CG 3.86Å; F69-Y282 AromaticContact CE1-CD1 3.97Å; F69-Y282 HydrophobicContact CE1-CD1 3.97Å; F69-Y282 HydrophobicContact CE1-CE1 4.26Å; L201-Y282 HydrophobicContact CB-CD1 4.38Å; L201-Y282 HydrophobicContact CD2-CD1 4.2Å; L201-Y282 HydrophobicContact CG-CD1 4.09Å; L201-Y282 HydrophobicContact CG-CE1 4.12Å; V202-Y282 HydrophobicContact CB-CE2 4.43Å; V202-Y282 HydrophobicContact CG1-CE2 4.41Å; V202-Y282 HydrophobicContact CG2-CD1 3.9Å; V202-Y282 HydrophobicContact CG2-CD2 3.63Å; V202-Y282 HydrophobicContact CG2-CE1 4.06Å; V202-Y282 HydrophobicContact CG2-CE2 3.76Å; V202-Y282 HydrophobicContact CG2-CG 3.7Å; E205-Y282 HydrophobicContact CG-CE1 4.42Å; E205-Y282 WeakPolarHBondContact OE2-CE1 3.16Å; E205-Y282 VanDerWaalsContact OE2-CZ 3.28Å; E205-Y282 PolarHBondContact OE2-OH 3.16Å; V278-Y282 HydrophobicContact CG1-CD2 3.94Å; V278-Y282 HydrophobicContact CG1-CE2 3.86Å; V278-Y282 WeakPolarHBondContact O-CD2 3.19Å; V278-Y282 PolarHBondContact O-N 3.41Å; Y279-Y282 PolarHBondContact O-N 2.99Å; Y282-L286 WeakPolarHBondContact O-CB 3.49Å; Y282-L286 VanDerWaalsContact O-CG 3.31Å; Y282-L286 WeakPolarHBondContact O-CG 3.27Å; Y282-L286 PolarHBondContact O-N 2.97Å
283	Y	95.6	Very high	92.8	Very high	9 Å²	9	38.6 Å²	38.6	4%	0.035	22%	0.223	C	C	.	.	H	α-helix	trans	-58.5	-50.4	174.4	171.5	-98.4	0	0	0	112.4	S117 T118 V119 P122 I198 Y279 A280 K281 L286 R287	S117-Y283 VanDerWaalsContact C-OH 3.25Å; S117-Y283 PolarHBondContact O-OH 3.38Å; T118-Y283 VanDerWaalsContact CA-OH 3.26Å; T118-Y283 WeakPolarHBondContact CA-OH 3.16Å; T118-Y283 PolarHBondContact N-OH 2.98Å; T118-Y283 WeakPolarHBondContact O-CE2 3.37Å; T118-Y283 PolarHBondContact O-OH 3.06Å; V119-Y283 HydrophobicContact CB-CD1 3.75Å; V119-Y283 HydrophobicContact CB-CE1 3.76Å; V119-Y283 HydrophobicContact CB-CG 4.31Å; V119-Y283 HydrophobicContact CG2-CD1 3.81Å; V119-Y283 HydrophobicContact CG2-CE1 4.35Å; V119-Y283 HydrophobicContact CG2-CG 4.09Å; V119-Y283 PolarHBondContact N-OH 3.11Å; P122-Y283 HydrophobicContact CB-CD2 4.28Å; P122-Y283 HydrophobicContact CB-CE2 3.97Å; I198-Y283 HydrophobicContact CD1-CD2 3.94Å; Y279-Y283 PolarHBondContact O-N 3.34Å; A280-Y283 WeakPolarHBondContact O-CB 3.35Å; A280-Y283 PolarHBondContact O-N 2.76Å; K281-Y283 VanDerWaalsContact C-N 3.29Å; K281-Y283 PolarHBondContact O-N 2.89Å; Y283-L286 PolarHBondContact O-N 2.87Å; Y283-R287 VanDerWaalsContact CE1-CD 3.45Å; Y283-R287 HydrophobicContact CE1-CG 4.46Å; Y283-R287 HydrophobicContact CE2-CG 4.49Å; Y283-R287 WeakPolarHBondContact O-CG 3.49Å; Y283-R287 PolarHBondContact O-N 3.15Å; Y283-R287 VanDerWaalsContact O-N 3.1Å; Y283-R287 WeakPolarHBondContact OH-CD 3.5Å; Y283-R287 PolarHBondContact OH-NH1 3.18Å
284	F	93.9	Very high	92.2	Very high	112 Å²	112	39.7 Å²	39.7	49%	0.491	23%	0.229	S	C	.	.	H	α-helix	trans	-69.9	-35.6	-179.2	-70.4	-59.7	0	0	0	112.8	A280 K281 R287 S288	A280-F284 HydrophobicContact CB-CE2 4.36Å; A280-F284 WeakPolarHBondContact O-CD2 3.37Å; A280-F284 PolarHBondContact O-N 3.22Å; K281-F284 PolarHBondContact O-N 2.87Å; F284-R287 PolarHBondContact O-N 3.2Å; F284-S288 PolarHBondContact O-N 2.93Å; F284-S288 PolarHBondContact O-OG 3.09Å
285	D	94.8	Very high	91.6	Very high	28 Å²	28	41.1 Å²	41.1	15%	0.15	24%	0.236	C	C	.	.	H	α-helix	trans	-67.7	-37.2	176.2	-74	-8.6	0	0	0	111.2	T67 F69 L70 K281 S288 L289	T67-D285 HydrophobicContact CG2-CB 4.09Å; T67-D285 VanDerWaalsContact CG2-OD2 3.3Å; T67-D285 WeakPolarHBondContact CG2-OD2 3.39Å; T67-D285 PolarHBondContact N-OD2 3.39Å; T67-D285 PolarHBondContact OG1-OD2 3.41Å; F69-D285 HydrophobicContact CE1-CB 4.39Å; F69-D285 HydrophobicContact CE2-CB 4.15Å; F69-D285 HydrophobicContact CZ-CB 3.55Å; L70-D285 HydrophobicContact CD2-CB 4.05Å; K281-D285 WeakPolarHBondContact O-CB 3.17Å; K281-D285 PolarHBondContact O-N 2.97Å; D285-S288 WeakPolarHBondContact O-CB 3.41Å; D285-S288 PolarHBondContact O-N 2.85Å; D285-L289 WeakPolarHBondContact O-CB 3.42Å; D285-L289 PolarHBondContact O-N 3.11Å
286	L	94	Very high	90.4	Very high	7 Å²	7	41.9 Å²	41.9	4%	0.037	24%	0.243	C	C	.	.	H	α-helix	trans	-64.4	-39.6	173.1	-81.2	169.8	0	0	0	112.1	F69 C130 V131 A134 I198 L201 Y282 Y283 L289 A290	F69-L286 HydrophobicContact CE1-CD2 4.49Å; F69-L286 HydrophobicContact CE1-CG 4.38Å; F69-L286 HydrophobicContact CE2-CD2 4.25Å; F69-L286 HydrophobicContact CE2-CG 4.48Å; F69-L286 HydrophobicContact CZ-CD2 4.01Å; F69-L286 HydrophobicContact CZ-CG 3.86Å; C130-L286 HydrophobicContact CB-CB 4.35Å; C130-L286 HydrophobicContact CB-CD2 3.76Å; V131-L286 HydrophobicContact CG2-CD1 3.96Å; V131-L286 HydrophobicContact CG2-CD2 4.31Å; A134-L286 HydrophobicContact CB-CD2 4.26Å; I198-L286 HydrophobicContact CG1-CD1 4.05Å; L201-L286 HydrophobicContact CD2-CD1 4.1Å; L201-L286 HydrophobicContact CD2-CD2 3.75Å; L201-L286 HydrophobicContact CD2-CG 4.1Å; Y282-L286 WeakPolarHBondContact O-CB 3.49Å; Y282-L286 VanDerWaalsContact O-CG 3.31Å; Y282-L286 WeakPolarHBondContact O-CG 3.27Å; Y282-L286 PolarHBondContact O-N 2.97Å; Y283-L286 PolarHBondContact O-N 2.87Å; L286-L289 WeakPolarHBondContact O-CB 3.4Å; L286-L289 PolarHBondContact O-N 3.38Å; L286-A290 WeakPolarHBondContact O-CB 3.49Å; L286-A290 PolarHBondContact O-N 3.28Å
287	R	89.8	Confident	89.3	Confident	43 Å²	43	37.7 Å²	37.7	16%	0.162	21%	0.211	C	C	.	.	H	α-helix	trans	-63.3	-44.4	173.5	-70.4	-177	64.2	107.7	5.4	111.6	D115 S117 Y283 F284 L289 A290 E291 F297	D115-R287 IonicContact OD1-CZ 3.54Å; D115-R287 IonicContact OD1-NH1 3.23Å; D115-R287 PolarHBondContact OD1-NH1 2.99Å; D115-R287 IonicContact OD1-NH2 3.36Å; D115-R287 PolarHBondContact OD1-NH2 3.5Å; D115-R287 IonicContact OD2-CZ 3.74Å; D115-R287 IonicContact OD2-NH1 2.9Å; D115-R287 IonicContact OD2-NH2 3.81Å; D115-R287 PolarHBondContact OD2-NH2 3.24Å; S117-R287 PolarHBondContact O-NH1 3.17Å; Y283-R287 VanDerWaalsContact CE1-CD 3.45Å; Y283-R287 HydrophobicContact CE1-CG 4.46Å; Y283-R287 HydrophobicContact CE2-CG 4.49Å; Y283-R287 WeakPolarHBondContact O-CG 3.49Å; Y283-R287 PolarHBondContact O-N 3.15Å; Y283-R287 VanDerWaalsContact O-N 3.1Å; Y283-R287 WeakPolarHBondContact OH-CD 3.5Å; Y283-R287 PolarHBondContact OH-NH1 3.18Å; F284-R287 PolarHBondContact O-N 3.2Å; R287-L289 VanDerWaalsContact C-N 3.3Å; R287-L289 PolarHBondContact O-N 3.02Å; R287-A290 WeakPolarHBondContact O-CB 3.41Å; R287-A290 PolarHBondContact O-N 3.19Å; R287-A290 VanDerWaalsContact O-N 3.16Å; R287-E291 WeakPolarHBondContact O-CG 3.33Å; R287-E291 PolarHBondContact O-N 3.48Å; R287-F297 HydrophobicContact CG-CE2 3.99Å; R287-F297 HydrophobicContact CG-CZ 4.42Å
288	S	90.3	Very high	88.3	Confident	61 Å²	61	38.1 Å²	38.1	43%	0.427	21%	0.212	S	C	.	.	H	α-helix	trans	-58.1	-43.4	175.2	-56.5	0	0	0	0	111.6	F284 D285 E291 A292	F284-S288 PolarHBondContact O-N 2.93Å; F284-S288 PolarHBondContact O-OG 3.09Å; D285-S288 WeakPolarHBondContact O-CB 3.41Å; D285-S288 PolarHBondContact O-N 2.85Å; S288-E291 PolarHBondContact O-N 3.31Å; S288-A292 PolarHBondContact O-N 3.45Å
289	L	91.1	Very high	87.4	Confident	1 Å²	1	40.5 Å²	40.5	1%	0.005	23%	0.225	C	C	.	.	H	α-helix	trans	-62.2	-42.7	175.4	-176.9	69.5	0	0	0	112.2	F69 S73 L133 A134 Y137 D285 L286 R287 A292 N293	F69-L289 HydrophobicContact CD2-CD2 3.84Å; F69-L289 HydrophobicContact CE2-CB 4.15Å; F69-L289 HydrophobicContact CE2-CD2 3.99Å; S73-L289 WeakPolarHBondContact OG-CD1 3.23Å; L133-L289 HydrophobicContact CB-CD2 4.31Å; L133-L289 HydrophobicContact CD2-CD1 4.42Å; L133-L289 HydrophobicContact CD2-CD2 4.12Å; L133-L289 HydrophobicContact CD2-CG 3.97Å; L133-L289 HydrophobicContact CG-CD2 4.08Å; L133-L289 HydrophobicContact CG-CG 4.41Å; A134-L289 HydrophobicContact CB-CD2 4.09Å; Y137-L289 HydrophobicContact CD2-CD1 4Å; Y137-L289 HydrophobicContact CE2-CD1 3.84Å; D285-L289 WeakPolarHBondContact O-CB 3.42Å; D285-L289 PolarHBondContact O-N 3.11Å; L286-L289 WeakPolarHBondContact O-CB 3.4Å; L286-L289 PolarHBondContact O-N 3.38Å; R287-L289 VanDerWaalsContact C-N 3.3Å; R287-L289 PolarHBondContact O-N 3.02Å; L289-A292 PolarHBondContact O-N 2.88Å; L289-N293 PolarHBondContact O-N 3.3Å; L289-N293 PolarHBondContact O-ND2 3.21Å
290	A	88.8	Confident	86.7	Confident	0 Å²	0	44.2 Å²	44.2	0%	0	24%	0.243	C	C	.	.	H	α-helix	trans	-62	-46.4	179	0	0	0	0	0	111.5	C130 L286 R287 N293 N294 L295	C130-A290 WeakPolarHBondContact SG-CB 3.32Å; L286-A290 WeakPolarHBondContact O-CB 3.49Å; L286-A290 PolarHBondContact O-N 3.28Å; R287-A290 WeakPolarHBondContact O-CB 3.41Å; R287-A290 PolarHBondContact O-N 3.19Å; R287-A290 VanDerWaalsContact O-N 3.16Å; A290-N293 CarbonylContact O-C 3.59Å; A290-N293 PolarHBondContact O-N 2.92Å; A290-N294 PolarHBondContact O-N 2.95Å; A290-L295 HydrophobicContact CB-CB 4.2Å; A290-L295 PolarHBondContact O-N 3.06Å
291	E	85.8	Confident	86.1	Confident	82 Å²	82	46.7 Å²	46.7	38%	0.383	26%	0.257	S	S	.	.	H	α-helix	trans	-61.8	-42.9	177.2	-73	-173	-159.4	0	0	112.2	R104 R287 S288 N293 N294	R104-E291 IonicContact CZ-OE2 2.64Å; R104-E291 IonicContact NH2-OE2 2.77Å; R104-E291 PolarHBondContact NH2-OE2 3.42Å; R287-E291 WeakPolarHBondContact O-CG 3.33Å; R287-E291 PolarHBondContact O-N 3.48Å; S288-E291 PolarHBondContact O-N 3.31Å; E291-N293 PolarHBondContact O-N 3.49Å; E291-N294 PolarHBondContact O-N 2.9Å
292	A	86.4	Confident	85.6	Confident	44 Å²	44	48.3 Å²	48.3	36%	0.364	27%	0.266	S	S	.	.	H	α-helix	trans	-63.9	-22.7	178	0	0	0	0	0	113.4	V77 S288 L289	V77-A292 HydrophobicContact CG2-CB 4.18Å; S288-A292 PolarHBondContact O-N 3.45Å; L289-A292 PolarHBondContact O-N 2.88Å
293	N	86.3	Confident	85.1	Confident	20 Å²	20	50.6 Å²	50.6	11%	0.107	28%	0.282	C	S	.	.	T	Hydrogen-bonded Turn	trans	-111.7	15.5	-176.8	-73	-79.2	0	0	0	113.9	K80 L133 Y137 L289 A290 E291 L295	K80-N293 PolarHBondContact NZ-OD1 2.96Å; L133-N293 HydrophobicContact CD2-CB 3.79Å; Y137-N293 PolarHBondContact OH-OD1 3.12Å; L289-N293 PolarHBondContact O-N 3.3Å; L289-N293 PolarHBondContact O-ND2 3.21Å; A290-N293 CarbonylContact O-C 3.59Å; A290-N293 PolarHBondContact O-N 2.92Å; E291-N293 PolarHBondContact O-N 3.49Å; N293-L295 HydrophobicContact CB-CD1 4.49Å; N293-L295 HydrophobicContact CB-CG 4.35Å; N293-L295 PolarHBondContact O-N 3.18Å; N293-L295 VanDerWaalsContact O-N 3.15Å
294	N	83	Confident	84.7	Confident	138 Å²	138	59.6 Å²	59.6	74%	0.738	32%	0.316	S	S	*	.	T	Hydrogen-bonded Turn	trans	54.8	28.9	-178	-54.2	-61	0	0	0	113.6	A290 E291 S296	A290-N294 PolarHBondContact O-N 2.95Å; E291-N294 PolarHBondContact O-N 2.9Å; N294-S296 VanDerWaalsContact C-N 3.25Å
295	L	81.7	Confident	84.3	Confident	46 Å²	46	59.4 Å²	59.4	24%	0.241	32%	0.32	C	S	.	.			trans	-93.9	13.2	169.9	-60.8	178.8	0	0	0	111.2	L133 A290 N293	L133-L295 HydrophobicContact CD2-CD1 3.66Å; A290-L295 HydrophobicContact CB-CB 4.2Å; A290-L295 PolarHBondContact O-N 3.06Å; N293-L295 HydrophobicContact CB-CD1 4.49Å; N293-L295 HydrophobicContact CB-CG 4.35Å; N293-L295 PolarHBondContact O-N 3.18Å; N293-L295 VanDerWaalsContact O-N 3.15Å
296	S	70	Confident	83.9	Confident	65 Å²	65	61.1 Å²	61.1	46%	0.455	33%	0.326	S	S	.	.			trans	-58.5	145.6	-174.6	53.4	0	0	0	0	111.8	N294	N294-S296 VanDerWaalsContact C-N 3.25Å
297	F	71.9	Confident	83.5	Confident	18 Å²	18	62.5 Å²	62.5	8%	0.079	34%	0.338	C	S	.	.			trans	-60.3	136.8	178.4	-54.7	-97.4	0	0	0	109.3	D115 S117 N123 Y126 R287 L299	D115-F297 HydrophobicContact CB-CB 3.44Å; D115-F297 VanDerWaalsContact CB-CB 3.44Å; D115-F297 HydrophobicContact CB-CG 4.18Å; S117-F297 VanDerWaalsContact CB-CE1 3.49Å; S117-F297 WeakPolarHBondContact OG-CE1 3.42Å; N123-F297 HydrophobicContact CB-CE1 4.28Å; Y126-F297 HydrophobicContact CD1-CD1 4.5Å; Y126-F297 AromaticContact CD2-CD1 3.77Å; Y126-F297 HydrophobicContact CD2-CD1 3.77Å; Y126-F297 HydrophobicContact CD2-CE1 4.08Å; Y126-F297 AromaticContact CG-CD1 3.79Å; Y126-F297 HydrophobicContact CG-CD1 3.79Å; Y126-F297 AromaticContact CG-CE1 3.85Å; Y126-F297 HydrophobicContact CG-CE1 3.85Å; R287-F297 HydrophobicContact CG-CE2 3.99Å; R287-F297 HydrophobicContact CG-CZ 4.42Å; F297-L299 PolarHBondContact O-N 2.97Å
298	P	72.3	Confident	83.5	Confident	68 Å²	68	65.3 Å²	65.3	44%	0.442	35%	0.354	S	S	.	.			trans	-62.2	115.5	174.3	24.7	-30.9	0	0	0	108.8	Y126 E300	Y126-P298 VanDerWaalsContact OH-CD 3.29Å; Y126-P298 WeakPolarHBondContact OH-CD 3.22Å; P298-E300 PolarHBondContact O-N 3.43Å
299	L	77.3	Confident	83.4	Confident	51 Å²	51	69.4 Å²	69.4	27%	0.267	36%	0.364	S	S	.	.			trans	-74.8	120.2	174.3	-73	177.5	0	0	0	109.7	K105 F113 D115 F297	K105-L299 HydrophobicContact CB-CB 4.5Å; K105-L299 HydrophobicContact CB-CD1 4.25Å; K105-L299 HydrophobicContact CD-CB 4.44Å; K105-L299 PolarHBondContact NZ-O 3.17Å; K105-L299 VanDerWaalsContact NZ-O 3.13Å; K105-L299 WeakPolarHBondContact O-CD1 3.49Å; F113-L299 HydrophobicContact CB-CB 4.16Å; D115-L299 HydrophobicContact CB-CD2 4.28Å; F297-L299 PolarHBondContact O-N 2.97Å
300	E	80.7	Confident	83.1	Confident	95 Å²	95	73.6 Å²	73.6	44%	0.444	39%	0.385	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-108.2	142.3	177.7	-66.1	-172.7	173	0	0	110.4	F113 L114 P298 L302 K306	F113-E300 WeakPolarHBondContact CA-O 3.14Å; L114-E300 PolarHBondContact N-O 2.93Å; L114-E300 PolarHBondContact O-N 3.46Å; P298-E300 PolarHBondContact O-N 3.43Å; E300-L302 PolarHBondContact O-N 3.19Å; E300-K306 IonicContact OE2-NZ 3.3Å
301	P	82.8	Confident	83.1	Confident	76 Å²	76	78.3 Å²	78.3	49%	0.494	41%	0.407	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-57.5	135.5	170.2	-17	28.1	0	0	0	110.3	T111 F113 S303	T111-P301 HydrophobicContact CG2-CB 4.29Å; F113-P301 HydrophobicContact CD1-CG 4.24Å; F113-P301 HydrophobicContact CE1-CB 4.36Å; F113-P301 HydrophobicContact CE1-CG 3.75Å; P301-S303 PolarHBondContact O-N 3.43Å
302	L	83.9	Confident	83.3	Confident	50 Å²	50	77.2 Å²	77.2	26%	0.262	41%	0.412	S	S	.	.			trans	-61.9	112	174	177.4	63.6	0	0	0	109.3	I112 L114 E300 K306 A307 L310	I112-L302 HydrophobicContact CB-CB 4.25Å; I112-L302 HydrophobicContact CB-CD2 4.41Å; I112-L302 HydrophobicContact CD1-CD2 4.44Å; I112-L302 WeakPolarHBondContact O-CB 3.3Å; I112-L302 PolarHBondContact O-N 3.27Å; L114-L302 HydrophobicContact CD1-CD1 3.88Å; L114-L302 HydrophobicContact CD1-CD2 4.49Å; E300-L302 PolarHBondContact O-N 3.19Å; L302-K306 HydrophobicContact CD1-CB 3.6Å; L302-A307 HydrophobicContact CD1-CB 4.36Å; L302-A307 HydrophobicContact CD2-CB 3.91Å; L302-A307 HydrophobicContact CG-CB 4.02Å; L302-L310 HydrophobicContact CD1-CD1 3.93Å
303	S	86.7	Confident	83.2	Confident	49 Å²	49	78.5 Å²	78.5	34%	0.343	41%	0.413	S	S	.	.			trans	-72	156.7	176.6	75.6	0	0	0	0	111.2	P301 D305 K306 A307	P301-S303 PolarHBondContact O-N 3.43Å; S303-D305 VanDerWaalsContact C-N 3.26Å; S303-D305 PolarHBondContact O-N 2.81Å; S303-K306 PolarHBondContact O-N 2.93Å; S303-K306 WeakPolarHBondContact OG-CB 3.18Å; S303-K306 WeakPolarHBondContact OG-CG 3.46Å; S303-K306 PolarHBondContact OG-N 3.31Å; S303-K306 VanDerWaalsContact OG-N 3.15Å; S303-A307 WeakPolarHBondContact O-CB 3.45Å; S303-A307 PolarHBondContact O-N 2.64Å
304	R	86.4	Confident	83.2	Confident	198 Å²	198	79.9 Å²	79.9	75%	0.747	43%	0.427	S	S	*	.	H	α-helix	trans	-57.7	-40.7	177.4	-170.1	177.6	179.9	-178	-0.3	111.8	A307 Q308	R304-A307 PolarHBondContact O-N 3.39Å; R304-Q308 WeakPolarHBondContact O-CG 3.26Å; R304-Q308 PolarHBondContact O-N 3.16Å
305	D	87.3	Confident	83.4	Confident	107 Å²	107	80.7 Å²	80.7	57%	0.572	42%	0.42	S	S	*	.	H	α-helix	trans	-68.2	-42.5	179.2	-56.9	-22.8	0	0	0	111.6	S303 A307 Q308 K309	S303-D305 VanDerWaalsContact C-N 3.26Å; S303-D305 PolarHBondContact O-N 2.81Å; D305-A307 VanDerWaalsContact C-N 3.33Å; D305-Q308 PolarHBondContact O-N 3.34Å; D305-K309 WeakPolarHBondContact O-CG 3.2Å; D305-K309 PolarHBondContact O-N 3.24Å
306	K	84.6	Confident	83.6	Confident	64 Å²	64	82.1 Å²	82.1	28%	0.278	43%	0.427	S	S	.	.	H	α-helix	trans	-61.5	-43.6	174.1	-76.7	-178	176.9	-171.7	0	110.2	D116 E300 L302 S303 Q308 K309 L310	D116-K306 IonicContact OD1-NZ 2.66Å; D116-K306 PolarHBondContact OD1-NZ 3.21Å; D116-K306 IonicContact OD2-NZ 3.39Å; D116-K306 PolarHBondContact OD2-NZ 2.95Å; E300-K306 IonicContact OE2-NZ 3.3Å; L302-K306 HydrophobicContact CD1-CB 3.6Å; S303-K306 PolarHBondContact O-N 2.93Å; S303-K306 WeakPolarHBondContact OG-CB 3.18Å; S303-K306 WeakPolarHBondContact OG-CG 3.46Å; S303-K306 PolarHBondContact OG-N 3.31Å; S303-K306 VanDerWaalsContact OG-N 3.15Å; K306-Q308 PolarHBondContact O-N 3.12Å; K306-K309 PolarHBondContact O-N 3.32Å; K306-L310 WeakPolarHBondContact O-CB 3.33Å; K306-L310 VanDerWaalsContact O-CG 3.31Å; K306-L310 WeakPolarHBondContact O-CG 3.41Å; K306-L310 PolarHBondContact O-N 3.29Å
307	A	86.3	Confident	84.1	Confident	36 Å²	36	81.1 Å²	81.1	30%	0.298	42%	0.419	S	S	.	.	H	α-helix	trans	-61	-45.2	177.8	0	0	0	0	0	112.3	L302 S303 R304 D305 K309 L310 E311	L302-A307 HydrophobicContact CD1-CB 4.36Å; L302-A307 HydrophobicContact CD2-CB 3.91Å; L302-A307 HydrophobicContact CG-CB 4.02Å; S303-A307 WeakPolarHBondContact O-CB 3.45Å; S303-A307 PolarHBondContact O-N 2.64Å; R304-A307 PolarHBondContact O-N 3.39Å; D305-A307 VanDerWaalsContact C-N 3.33Å; A307-K309 PolarHBondContact O-N 3.19Å; A307-L310 PolarHBondContact O-N 3.42Å; A307-E311 WeakPolarHBondContact O-CB 3.42Å; A307-E311 PolarHBondContact O-N 3.19Å
308	Q	89.8	Confident	84.5	Confident	103 Å²	103	84 Å²	84	48%	0.481	44%	0.436	S	S	.	.	H	α-helix	trans	-62.8	-42	177.5	-75.2	177.4	-12.2	0	0	112.4	R304 D305 K306 E311 A312	R304-Q308 WeakPolarHBondContact O-CG 3.26Å; R304-Q308 PolarHBondContact O-N 3.16Å; D305-Q308 PolarHBondContact O-N 3.34Å; K306-Q308 PolarHBondContact O-N 3.12Å; Q308-E311 PolarHBondContact O-N 3.04Å; Q308-A312 WeakPolarHBondContact O-CB 3.48Å; Q308-A312 PolarHBondContact O-N 2.96Å
309	K	87.4	Confident	84.9	Confident	147 Å²	147	87.9 Å²	87.9	64%	0.639	45%	0.445	S	S	*	.	H	α-helix	trans	-61.2	-47.8	174.7	-72.9	178.6	-179.4	-174.9	0	111.4	D305 K306 A307 E311 A312 I313	D305-K309 WeakPolarHBondContact O-CG 3.2Å; D305-K309 PolarHBondContact O-N 3.24Å; K306-K309 PolarHBondContact O-N 3.32Å; A307-K309 PolarHBondContact O-N 3.19Å; K309-E311 VanDerWaalsContact C-N 3.33Å; K309-E311 PolarHBondContact O-N 3.32Å; K309-A312 PolarHBondContact O-N 3.17Å; K309-I313 WeakPolarHBondContact O-CG1 3.41Å; K309-I313 PolarHBondContact O-N 2.94Å
310	L	86.3	Confident	84.9	Confident	88 Å²	88	89.5 Å²	89.5	46%	0.461	45%	0.449	S	S	.	.	H	α-helix	trans	-61.6	-40.5	178	-71.4	172.8	0	0	0	111.9	L114 L302 K306 A307 I313 A314	L114-L310 HydrophobicContact CD1-CD1 4.16Å; L302-L310 HydrophobicContact CD1-CD1 3.93Å; K306-L310 WeakPolarHBondContact O-CB 3.33Å; K306-L310 VanDerWaalsContact O-CG 3.31Å; K306-L310 WeakPolarHBondContact O-CG 3.41Å; K306-L310 PolarHBondContact O-N 3.29Å; A307-L310 PolarHBondContact O-N 3.42Å; L310-I313 PolarHBondContact O-N 3.35Å; L310-A314 WeakPolarHBondContact O-CB 3.45Å; L310-A314 PolarHBondContact O-N 3.23Å
311	E	88.5	Confident	84.6	Confident	99 Å²	99	90.4 Å²	90.4	46%	0.463	45%	0.451	S	S	.	.	H	α-helix	trans	-65.3	-40.8	176.5	-168.6	-178.1	178.2	0	0	111.9	A307 Q308 K309 A314 R315	A307-E311 WeakPolarHBondContact O-CB 3.42Å; A307-E311 PolarHBondContact O-N 3.19Å; Q308-E311 PolarHBondContact O-N 3.04Å; K309-E311 VanDerWaalsContact C-N 3.33Å; K309-E311 PolarHBondContact O-N 3.32Å; E311-A314 PolarHBondContact O-N 3.32Å; E311-R315 VanDerWaalsContact O-CG 3.31Å; E311-R315 WeakPolarHBondContact O-CG 3.43Å; E311-R315 PolarHBondContact O-N 2.9Å; E311-R315 IonicContact OE1-CZ 2.8Å; E311-R315 IonicContact OE1-NE 3.87Å; E311-R315 PolarHBondContact OE1-NE 2.77Å; E311-R315 IonicContact OE1-NH2 2.73Å; E311-R315 PolarHBondContact OE1-NH2 2.74Å
312	A	88.8	Confident	84.3	Confident	59 Å²	59	90.7 Å²	90.7	49%	0.488	45%	0.449	S	S	.	.	H	α-helix	trans	-61.5	-44.3	175	0	0	0	0	0	111.8	Q308 K309 R315 L316	Q308-A312 WeakPolarHBondContact O-CB 3.48Å; Q308-A312 PolarHBondContact O-N 2.96Å; K309-A312 PolarHBondContact O-N 3.17Å; A312-R315 PolarHBondContact O-N 3.48Å; A312-L316 PolarHBondContact O-N 2.97Å; A312-L316 VanDerWaalsContact O-N 3.08Å
313	I	85.1	Confident	83.8	Confident	72 Å²	72	94.1 Å²	94.1	37%	0.369	47%	0.465	S	S	.	.	H	α-helix	trans	-61.8	-45.3	175.5	-65.9	165.1	0	0	0	110.5	K309 L310 R315 L316 C317	K309-I313 WeakPolarHBondContact O-CG1 3.41Å; K309-I313 PolarHBondContact O-N 2.94Å; L310-I313 PolarHBondContact O-N 3.35Å; I313-R315 PolarHBondContact O-N 3.08Å; I313-L316 WeakPolarHBondContact O-CB 3.29Å; I313-L316 PolarHBondContact O-N 3.05Å; I313-C317 PolarHBondContact O-N 3.01Å
314	A	85.9	Confident	82.9	Confident	49 Å²	49	99.6 Å²	99.6	41%	0.405	48%	0.478	S	S	.	.	H	α-helix	trans	-60.4	-46.8	178.9	0	0	0	0	0	112.1	L310 E311 L316 C317 D318	L310-A314 WeakPolarHBondContact O-CB 3.45Å; L310-A314 PolarHBondContact O-N 3.23Å; E311-A314 PolarHBondContact O-N 3.32Å; A314-L316 VanDerWaalsContact C-N 3.28Å; A314-L316 PolarHBondContact O-N 3.43Å; A314-C317 WeakPolarHBondContact O-CB 3.32Å; A314-C317 PolarHBondContact O-N 2.96Å; A314-D318 PolarHBondContact O-N 3.25Å
315	R	88.4	Confident	82.1	Confident	155 Å²	155	96.3 Å²	96.3	59%	0.585	47%	0.469	S	S	*	.	H	α-helix	trans	-59.5	-38.7	176.3	-71.6	173.8	-176.8	-171.5	1.6	112.2	E311 A312 I313 K319	E311-R315 VanDerWaalsContact O-CG 3.31Å; E311-R315 WeakPolarHBondContact O-CG 3.43Å; E311-R315 PolarHBondContact O-N 2.9Å; E311-R315 IonicContact OE1-CZ 2.8Å; E311-R315 IonicContact OE1-NE 3.87Å; E311-R315 PolarHBondContact OE1-NE 2.77Å; E311-R315 IonicContact OE1-NH2 2.73Å; E311-R315 PolarHBondContact OE1-NH2 2.74Å; A312-R315 PolarHBondContact O-N 3.48Å; I313-R315 PolarHBondContact O-N 3.08Å; R315-K319 WeakPolarHBondContact O-CG 3.05Å; R315-K319 PolarHBondContact O-N 2.94Å
316	L	85.2	Confident	81	Confident	76 Å²	76	95.8 Å²	95.8	40%	0.398	47%	0.466	S	S	.	.	H	α-helix	trans	-65.5	-46.2	176.1	-165.4	99.8	0	0	0	111	A312 I313 A314 D318 K319 Y320	A312-L316 PolarHBondContact O-N 2.97Å; A312-L316 VanDerWaalsContact O-N 3.08Å; I313-L316 WeakPolarHBondContact O-CB 3.29Å; I313-L316 PolarHBondContact O-N 3.05Å; A314-L316 VanDerWaalsContact C-N 3.28Å; A314-L316 PolarHBondContact O-N 3.43Å; L316-D318 VanDerWaalsContact C-N 3.34Å; L316-D318 PolarHBondContact O-N 2.96Å; L316-K319 WeakPolarHBondContact O-CB 3.48Å; L316-K319 PolarHBondContact O-N 3.09Å; L316-Y320 HydrophobicContact CD2-CD2 4.21Å; L316-Y320 HydrophobicContact CD2-CE2 3.33Å; L316-Y320 HydrophobicContact CG-CD2 4.17Å; L316-Y320 HydrophobicContact CG-CE2 3.54Å; L316-Y320 WeakPolarHBondContact O-CD2 3.16Å; L316-Y320 PolarHBondContact O-N 2.96Å
317	C	80.1	Confident	79.9	Confident	43 Å²	43	95.5 Å²	95.5	29%	0.291	48%	0.475	S	S	.	.	H	α-helix	trans	-59.4	-41.3	176.5	-80.9	0	0	0	0	112.9	I313 A314 Y320 K321	I313-C317 PolarHBondContact O-N 3.01Å; A314-C317 WeakPolarHBondContact O-CB 3.32Å; A314-C317 PolarHBondContact O-N 2.96Å; C317-Y320 PolarHBondContact O-N 2.96Å; C317-K321 WeakPolarHBondContact O-CG 3.47Å; C317-K321 PolarHBondContact O-N 3Å
318	D	81.8	Confident	78.6	Confident	80 Å²	80	102.1 Å²	102.1	43%	0.428	50%	0.497	S	S	.	.	H	α-helix	trans	-67.5	-40.5	177.9	-72.9	-22.7	0	0	0	112.1	A314 L316 Y320 K321 D322	A314-D318 PolarHBondContact O-N 3.25Å; L316-D318 VanDerWaalsContact C-N 3.34Å; L316-D318 PolarHBondContact O-N 2.96Å; D318-Y320 VanDerWaalsContact C-N 3.27Å; D318-Y320 PolarHBondContact O-N 3.45Å; D318-K321 WeakPolarHBondContact O-CB 3.31Å; D318-K321 PolarHBondContact O-N 2.96Å; D318-K321 VanDerWaalsContact O-N 3.12Å; D318-K321 IonicContact OD1-NZ 2.78Å; D318-K321 PolarHBondContact OD1-NZ 3.25Å; D318-D322 PolarHBondContact O-N 3.44Å
319	K	80.1	Confident	77	Confident	148 Å²	148	105.5 Å²	105.5	64%	0.643	51%	0.511	S	S	*	.	H	α-helix	trans	-56.7	-41.8	170.6	-73	178.7	-179.2	-175.8	0	112	R315 L316 D322 M323	R315-K319 WeakPolarHBondContact O-CG 3.05Å; R315-K319 PolarHBondContact O-N 2.94Å; L316-K319 WeakPolarHBondContact O-CB 3.48Å; L316-K319 PolarHBondContact O-N 3.09Å; K319-D322 PolarHBondContact O-N 3.07Å; K319-M323 VanDerWaalsContact O-CG 3.3Å; K319-M323 WeakPolarHBondContact O-CG 3.38Å; K319-M323 PolarHBondContact O-N 3.33Å
320	Y	76.6	Confident	75.5	Confident	85 Å²	85	108.8 Å²	108.8	33%	0.333	52%	0.519	S	S	.	.	H	α-helix	trans	-66.8	-37.8	176.3	-70.1	-51.5	0	0	0	113.1	L316 C317 D318 D322 M323 R324	L316-Y320 HydrophobicContact CD2-CD2 4.21Å; L316-Y320 HydrophobicContact CD2-CE2 3.33Å; L316-Y320 HydrophobicContact CG-CD2 4.17Å; L316-Y320 HydrophobicContact CG-CE2 3.54Å; L316-Y320 WeakPolarHBondContact O-CD2 3.16Å; L316-Y320 PolarHBondContact O-N 2.96Å; C317-Y320 PolarHBondContact O-N 2.96Å; D318-Y320 VanDerWaalsContact C-N 3.27Å; D318-Y320 PolarHBondContact O-N 3.45Å; Y320-D322 VanDerWaalsContact C-N 3.3Å; Y320-D322 PolarHBondContact O-N 3.37Å; Y320-M323 PolarHBondContact O-N 2.96Å; Y320-R324 WeakPolarHBondContact O-CB 3.43Å; Y320-R324 PolarHBondContact O-N 3.49Å
321	K	75.8	Confident	73.8	Confident	115 Å²	115	108.9 Å²	108.9	50%	0.5	53%	0.527	S	S	.	.	H	α-helix	trans	-61.6	-42.1	173.5	-71.3	174.4	-166.8	155.2	0	111	C317 D318 R324 K325	C317-K321 WeakPolarHBondContact O-CG 3.47Å; C317-K321 PolarHBondContact O-N 3Å; D318-K321 WeakPolarHBondContact O-CB 3.31Å; D318-K321 PolarHBondContact O-N 2.96Å; D318-K321 VanDerWaalsContact O-N 3.12Å; D318-K321 IonicContact OD1-NZ 2.78Å; D318-K321 PolarHBondContact OD1-NZ 3.25Å; K321-R324 PolarHBondContact O-N 3.35Å; K321-K325 WeakPolarHBondContact O-CG 3.31Å; K321-K325 PolarHBondContact O-N 3.49Å
322	D	76.2	Confident	72.1	Confident	82 Å²	82	111 Å²	111	44%	0.439	55%	0.547	S	S	.	.	H	α-helix	trans	-68.1	-41.3	179	-70.3	-20.6	0	0	0	111.7	D318 K319 Y320 R324 K325 L326	D318-D322 PolarHBondContact O-N 3.44Å; K319-D322 PolarHBondContact O-N 3.07Å; Y320-D322 VanDerWaalsContact C-N 3.3Å; Y320-D322 PolarHBondContact O-N 3.37Å; D322-R324 VanDerWaalsContact C-N 3.35Å; D322-R324 PolarHBondContact O-N 2.89Å; D322-K325 PolarHBondContact O-N 2.81Å; D322-K325 IonicContact OD1-NZ 2.74Å; D322-L326 WeakPolarHBondContact O-CB 3.5Å; D322-L326 WeakPolarHBondContact O-CD1 3.38Å; D322-L326 WeakPolarHBondContact O-CG 3.32Å; D322-L326 PolarHBondContact O-N 3.41Å
323	M	72.1	Confident	70.3	Confident	122 Å²	122	112.9 Å²	112.9	60%	0.601	56%	0.556	S	S	*	*	H	α-helix	trans	-60	-42	170.8	-70.6	-120.7	-68.4	0	0	112.2	K319 Y320 L326 A327	K319-M323 VanDerWaalsContact O-CG 3.3Å; K319-M323 WeakPolarHBondContact O-CG 3.38Å; K319-M323 PolarHBondContact O-N 3.33Å; Y320-M323 PolarHBondContact O-N 2.96Å; M323-L326 PolarHBondContact O-N 3.02Å; M323-A327 WeakPolarHBondContact O-CB 3.41Å; M323-A327 PolarHBondContact O-N 3.13Å
324	R	67.8	Low	68.5	Low	164 Å²	164	113.8 Å²	113.8	62%	0.619	57%	0.574	S	S	*	*	H	α-helix	trans	-62	-43	173.6	-83.3	-176.6	179.1	-173	0.1	112.3	Y320 K321 D322 L326 A327 K328	Y320-R324 WeakPolarHBondContact O-CB 3.43Å; Y320-R324 PolarHBondContact O-N 3.49Å; K321-R324 PolarHBondContact O-N 3.35Å; D322-R324 VanDerWaalsContact C-N 3.35Å; D322-R324 PolarHBondContact O-N 2.89Å; R324-L326 VanDerWaalsContact C-N 3.34Å; R324-A327 PolarHBondContact O-N 2.83Å; R324-K328 WeakPolarHBondContact O-CB 3.39Å; R324-K328 WeakPolarHBondContact O-CG 3.35Å; R324-K328 PolarHBondContact O-N 3.2Å
325	K	70.1	Confident	66.7	Low	129 Å²	129	118.1 Å²	118.1	56%	0.561	59%	0.59	S	S	*	*	H	α-helix	trans	-62.8	-41.2	175.6	-73.4	173.5	-176.5	169.9	0	111.2	K321 D322 K329	K321-K325 WeakPolarHBondContact O-CG 3.31Å; K321-K325 PolarHBondContact O-N 3.49Å; D322-K325 PolarHBondContact O-N 2.81Å; D322-K325 IonicContact OD1-NZ 2.74Å; K325-K329 VanDerWaalsContact O-CG 3.32Å; K325-K329 WeakPolarHBondContact O-CG 3.37Å; K325-K329 PolarHBondContact O-N 3.39Å; K325-K329 VanDerWaalsContact O-N 3.12Å
326	L	65	Low	64.7	Low	95 Å²	95	118.1 Å²	118.1	50%	0.497	60%	0.602	S	S	.	*	H	α-helix	trans	-67.3	-40.5	176.7	-74.9	161.4	0	0	0	112.1	D322 M323 R324 K329 R330	D322-L326 WeakPolarHBondContact O-CB 3.5Å; D322-L326 WeakPolarHBondContact O-CD1 3.38Å; D322-L326 WeakPolarHBondContact O-CG 3.32Å; D322-L326 PolarHBondContact O-N 3.41Å; M323-L326 PolarHBondContact O-N 3.02Å; R324-L326 VanDerWaalsContact C-N 3.34Å; L326-K329 WeakPolarHBondContact O-CB 3.37Å; L326-K329 PolarHBondContact O-N 3.4Å; L326-R330 WeakPolarHBondContact O-CG 3.45Å; L326-R330 PolarHBondContact O-N 2.66Å
327	A	60.5	Low	62.7	Low	59 Å²	59	121.6 Å²	121.6	49%	0.488	62%	0.62	S	S	.	*	H	α-helix	trans	-65.5	-44	176.2	0	0	0	0	0	111.9	M323 R324 K329 R330 S331	M323-A327 WeakPolarHBondContact O-CB 3.41Å; M323-A327 PolarHBondContact O-N 3.13Å; R324-A327 PolarHBondContact O-N 2.83Å; A327-K329 PolarHBondContact O-N 3.47Å; A327-R330 PolarHBondContact O-N 3.05Å; A327-S331 PolarHBondContact O-N 2.96Å
328	K	58.8	Low	60.8	Low	174 Å²	174	127.1 Å²	127.1	76%	0.757	64%	0.644	S	S	*	*	H	α-helix	trans	-60.9	-30.5	172.5	-76.5	-174.4	176.6	-170.3	0	113	R324 R330	R324-K328 WeakPolarHBondContact O-CB 3.39Å; R324-K328 WeakPolarHBondContact O-CG 3.35Å; R324-K328 PolarHBondContact O-N 3.2Å; K328-R330 VanDerWaalsContact C-N 3.31Å
329	K	57.7	Low	58.8	Low	175 Å²	175	129.1 Å²	129.1	76%	0.761	66%	0.659	S	S	*	*	H	α-helix	trans	-76.2	-15.8	173.7	-75.1	178.6	178.5	-171.8	0	113.5	K325 L326 A327	K325-K329 VanDerWaalsContact O-CG 3.32Å; K325-K329 WeakPolarHBondContact O-CG 3.37Å; K325-K329 PolarHBondContact O-N 3.39Å; K325-K329 VanDerWaalsContact O-N 3.12Å; L326-K329 WeakPolarHBondContact O-CB 3.37Å; L326-K329 PolarHBondContact O-N 3.4Å; A327-K329 PolarHBondContact O-N 3.47Å
330	R	55.4	Low	57	Low	216 Å²	216	127.1 Å²	127.1	82%	0.815	66%	0.658	S	S	*	*	H	α-helix	trans	-104.4	-7.9	-176.3	-75.7	-176.9	176.6	-174.4	-0.5	114.5	L326 A327 K328 V332	L326-R330 WeakPolarHBondContact O-CG 3.45Å; L326-R330 PolarHBondContact O-N 2.66Å; A327-R330 PolarHBondContact O-N 3.05Å; K328-R330 VanDerWaalsContact C-N 3.31Å; R330-V332 PolarHBondContact O-N 3.4Å
331	S	50.8	Low	55.2	Low	89 Å²	89	133.7 Å²	133.7	62%	0.622	68%	0.683	S	S	*	*			trans	-92.1	81.1	176.9	60	0	0	0	0	111.8	A327	A327-S331 PolarHBondContact O-N 2.96Å
332	V	52.3	Low	53.8	Low	145 Å²	145	136.8 Å²	136.8	88%	0.879	69%	0.691	S	S	*	*			trans	-140.8	87.9	154	-170.5	0	0	0	0	108.2	R330	R330-V332 PolarHBondContact O-N 3.4Å
333	S	50.6	Low	52.2	Low	98 Å²	98	137.6 Å²	137.6	69%	0.685	70%	0.702	S	S	*	*			trans	-164.2	129.5	149.7	-179.3	0	0	0	0	107.7	D335	S333-D335 PolarHBondContact O-N 3.36Å
334	A	46.8	Very low	50.9	Low	90 Å²	90	134.4 Å²	134.4	74%	0.744	69%	0.691	S	S	*	*	T	Hydrogen-bonded Turn	trans	-75.8	-3	-167	0	0	0	0	0	114.7
335	D	48.3	Very low	49.6	Very low	140 Å²	140	130.6 Å²	130.6	75%	0.749	69%	0.694	S	S	*	*	T	Hydrogen-bonded Turn	trans	-99.7	7.2	-164.9	-65.4	-31.2	0	0	0	115.7	S333	S333-D335 PolarHBondContact O-N 3.36Å
336	N	47.3	Very low	48.3	Very low	155 Å²	155	129.1 Å²	129.1	83%	0.829	69%	0.692	S	S	*	*			trans	-141.9	74.5	176.4	-96.5	-26.8	0	0	0	112.1	M338	N336-M338 PolarHBondContact O-N 2.87Å
337	L	42.6	Very low	47	Very low	149 Å²	149	132.3 Å²	132.3	78%	0.78	71%	0.707	S	S	*	*			trans	-75.1	73.5	169.3	-95.7	148.4	0	0	0	110.8	V339	L337-V339 HydrophobicContact CD2-CG2 3.97Å
338	M	39.8	Very low	45.9	Very low	160 Å²	160	135.8 Å²	135.8	79%	0.788	73%	0.728	S	S	*	*			trans	-98.5	97	153.3	-71.3	-72.9	-100.1	0	0	106.3	N336 V340	N336-M338 PolarHBondContact O-N 2.87Å; M338-V340 HydrophobicContact CB-CG2 4.29Å; M338-V340 PolarHBondContact O-N 3.15Å
339	V	39.7	Very low	45.3	Very low	122 Å²	122	133.9 Å²	133.9	74%	0.739	73%	0.727	S	S	*	*			trans	-68.1	83.8	172	-179.6	0	0	0	0	107.4	L337 R341	L337-V339 HydrophobicContact CD2-CG2 3.97Å; V339-R341 VanDerWaalsContact C-N 3.3Å; V339-R341 PolarHBondContact O-N 3.23Å
340	V	42.1	Very low	44.6	Very low	106 Å²	106	131.7 Å²	131.7	64%	0.642	73%	0.725	S	S	*	*			trans	-76.8	90.3	173	-163.7	0	0	0	0	107.2	M338 W342	M338-V340 HydrophobicContact CB-CG2 4.29Å; M338-V340 PolarHBondContact O-N 3.15Å; V340-W342 VanDerWaalsContact CG1-CD1 3.5Å; V340-W342 PolarHBondContact O-N 3.33Å
341	R	40.7	Very low	44	Very low	223 Å²	223	127.1 Å²	127.1	84%	0.842	72%	0.72	S	S	*	*			trans	-66.5	94.9	169.7	-168.5	177	-175.9	-175.8	1.6	108	V339	V339-R341 VanDerWaalsContact C-N 3.3Å; V339-R341 PolarHBondContact O-N 3.23Å
342	W	45.6	Very low	43.6	Very low	179 Å²	179	129.3 Å²	129.3	68%	0.678	73%	0.726	S	S	*	*			trans	-88.4	105.4	179.2	-119.1	81.9	0	0	0	110.7	V340 P344	V340-W342 VanDerWaalsContact CG1-CD1 3.5Å; V340-W342 PolarHBondContact O-N 3.33Å; W342-P344 HydrophobicContact CE3-CB 4.32Å; W342-P344 HydrophobicContact CE3-CG 4.42Å; W342-P344 HydrophobicContact CZ3-CB 4.18Å
343	C	43.4	Very low	43.1	Very low	99 Å²	99	128.3 Å²	128.3	67%	0.669	72%	0.716	S	S	*	*			trans	-110.3	95.9	170	-66.2	0	0	0	0	108.9	A345	C343-A345 PolarHBondContact O-N 3.06Å; C343-A345 VanDerWaalsContact O-N 3.17Å
344	P	44	Very low	42.6	Very low	55 Å²	55	130.3 Å²	130.3	36%	0.357	72%	0.718	S	S	.	*			trans	-73.2	109.9	170.5	27.3	-26.7	0	0	0	108.4	W342 I346	W342-P344 HydrophobicContact CE3-CB 4.32Å; W342-P344 HydrophobicContact CE3-CG 4.42Å; W342-P344 HydrophobicContact CZ3-CB 4.18Å; P344-I346 PolarHBondContact O-N 3.06Å
345	A	40.3	Very low	42.3	Very low	84 Å²	84	133.2 Å²	133.2	69%	0.694	72%	0.716	S	S	*	*			trans	-69.6	120.3	163.7	0	0	0	0	0	108	C343 I347	C343-A345 PolarHBondContact O-N 3.06Å; C343-A345 VanDerWaalsContact O-N 3.17Å; A345-I347 VanDerWaalsContact C-N 3.35Å; A345-I347 HydrophobicContact CB-CG1 4.37Å; A345-I347 PolarHBondContact O-N 3.24Å
346	I	43.7	Very low	41.8	Very low	99 Å²	99	132.7 Å²	132.7	51%	0.508	71%	0.714	S	S	.	*			trans	-85.1	89	167.5	-57.4	174.5	0	0	0	105.4	P344 S348	P344-I346 PolarHBondContact O-N 3.06Å; I346-S348 PolarHBondContact O-N 3.37Å
347	I	36.1	Very low	41.3	Very low	162 Å²	162	130.8 Å²	130.8	83%	0.831	70%	0.704	S	S	*	*			trans	-69.7	112.6	170.2	-54.1	174.3	0	0	0	106	A345	A345-I347 VanDerWaalsContact C-N 3.35Å; A345-I347 HydrophobicContact CB-CG1 4.37Å; A345-I347 PolarHBondContact O-N 3.24Å
348	S	38.2	Very low	41.2	Very low	132 Å²	132	129.2 Å²	129.2	92%	0.923	70%	0.697	S	S	*	*			trans	-107.2	0	173	-61	0	0	0	0	110.6	I346	I346-S348 PolarHBondContact O-N 3.37Å

Retrieved 348 of 348 residues in 374.5 ms (Link to these results)

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