A0A096NEE0_PAPAN Loading...

Ankyrin repeat and death domain containing 1B

AlphaFold DB , UniProt , Accession A0A096NEE0, Species PAPAN (Papio anubis, Olive baboon), Gene ANKDD1B, Length 528 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	35.8	Very low	26.6	Very low	227 Å²	227	153.2 Å²	153.2	100%	1.118	87%	0.868	S	S	*	*				0	72.4	0	-69.6	-178.7	172.5	0	0	106.4
2	D	27.4	Very low	26.4	Very low	144 Å²	144	148.1 Å²	148.1	77%	0.77	86%	0.859	S	S	*	*				67.7	123.4	82.1	-71.9	-42.2	0	0	0	110.4
3	L	28.4	Very low	26.6	Very low	162 Å²	162	147.7 Å²	147.7	85%	0.848	86%	0.86	S	S	*	*			cis	-158.8	156.2	23.6	-103.6	149.6	0	0	0	110.9
4	A	26.9	Very low	26.7	Very low	100 Å²	100	146.7 Å²	146.7	83%	0.826	86%	0.857	S	S	*	*			trans	-72.2	159.9	168.5	0	0	0	0	0	113.1
5	G	26	Very low	26.7	Very low	80 Å²	80	142 Å²	142	83%	0.825	85%	0.852	S	S	*	*			trans	-162.5	89.3	166.9	0	0	0	0	0	112.9
6	R	26.7	Very low	26.7	Very low	256 Å²	256	137.3 Å²	137.3	97%	0.966	84%	0.842	S	S	*	*			trans	-77.2	139.4	163	-98.2	178	170.7	-177.5	-0.9	109.5
7	S	25.5	Very low	26.7	Very low	123 Å²	123	139.7 Å²	139.7	86%	0.86	85%	0.847	S	S	*	*			trans	-153.8	138.1	139	69.7	0	0	0	0	112.4
8	R	24.5	Very low	26.7	Very low	251 Å²	251	141.9 Å²	141.9	95%	0.947	85%	0.852	S	S	*	*			trans	-80.8	145.3	-179	-76.9	169.3	150.7	172.3	-8	112.7
9	G	22.9	Very low	26.7	Very low	63 Å²	63	144.1 Å²	144.1	65%	0.649	86%	0.858	S	S	*	*				72.4	123.3	128.6	0	0	0	0	0	120.1
10	H	24.1	Very low	26.8	Very low	201 Å²	201	140.4 Å²	140.4	93%	0.931	85%	0.851	S	S	*	*				-175.6	160.4	93.4	-94.9	75.7	0	0	0	111
11	G	24.5	Very low	26.7	Very low	78 Å²	78	138.6 Å²	138.6	80%	0.804	85%	0.851	S	S	*	*			trans	-64	150.8	-164.1	0	0	0	0	0	116.5
12	A	24.6	Very low	26.3	Very low	92 Å²	92	132.7 Å²	132.7	76%	0.76	84%	0.838	S	S	*	*			trans	-142.4	111.8	147.5	0	0	0	0	0	107.8	V14	A12-V14 PolarHBondContact O-N 3.11Å
13	T	28.7	Very low	26.2	Very low	143 Å²	143	131 Å²	131	88%	0.877	84%	0.844	S	S	*	*			trans	-52	120.7	167.4	40.3	0	0	0	0	111.5
14	V	27.3	Very low	26.1	Very low	134 Å²	134	128.3 Å²	128.3	81%	0.812	85%	0.846	S	S	*	*			trans	-134.4	101.1	157.9	-170.5	0	0	0	0	104.3	A12	A12-V14 PolarHBondContact O-N 3.11Å
15	G	26.7	Very low	26	Very low	76 Å²	76	128.2 Å²	128.2	78%	0.784	85%	0.845	S	S	*	*			cis	83.6	66.6	29.9	0	0	0	0	0	110
16	G	26.5	Very low	26	Very low	67 Å²	67	134.8 Å²	134.8	69%	0.691	85%	0.85	S	S	*	*			trans	107.7	109.7	160.4	0	0	0	0	0	116.2
17	L	27.2	Very low	25.9	Very low	178 Å²	178	125.9 Å²	125.9	93%	0.932	84%	0.838	S	S	*	*				168.4	71.3	125.3	-96	145.9	0	0	0	110.5
18	L	26.1	Very low	25.8	Very low	180 Å²	180	128.4 Å²	128.4	94%	0.942	84%	0.841	S	S	*	*			trans	-141.4	46.7	159.3	-93.2	170.6	0	0	0	110.1
19	L	27.3	Very low	25.8	Very low	183 Å²	183	128.3 Å²	128.3	96%	0.958	84%	0.841	S	S	*	*			trans	-97.7	81.6	157.2	-99.1	155.4	0	0	0	106.8
20	G	28.2	Very low	26	Very low	69 Å²	69	132.7 Å²	132.7	71%	0.711	84%	0.844	S	S	*	*			trans	-162.2	31.6	-172	0	0	0	0	0	114.9
21	A	26.1	Very low	26.1	Very low	104 Å²	104	129.8 Å²	129.8	86%	0.86	84%	0.836	S	S	*	*	S	Bend	trans	-162.1	25.4	169.2	0	0	0	0	0	114.5
22	A	26.5	Very low	26.2	Very low	103 Å²	103	133.9 Å²	133.9	85%	0.851	84%	0.839	S	S	*	*			trans	-132.7	37.7	-176.3	0	0	0	0	0	113.6
23	A	26.1	Very low	26.1	Very low	107 Å²	107	140.9 Å²	140.9	88%	0.884	85%	0.845	S	S	*	*			trans	-133.4	41.5	176.8	0	0	0	0	0	112.7
24	A	26.2	Very low	25.9	Very low	107 Å²	107	137.4 Å²	137.4	88%	0.884	84%	0.838	S	S	*	*	S	Bend	trans	-133.7	29	174.3	0	0	0	0	0	112.7
25	A	24.7	Very low	26	Very low	98 Å²	98	136 Å²	136	81%	0.81	84%	0.841	S	S	*	*			trans	-136.6	61	177.3	0	0	0	0	0	110.5
26	K	25.5	Very low	25.9	Very low	217 Å²	217	139.4 Å²	139.4	94%	0.943	84%	0.841	S	S	*	*	S	Bend	trans	-160.2	107.9	160.3	-127.3	177.1	-177.2	178.1	0	110
27	G	25.4	Very low	26.1	Very low	69 Å²	69	141.2 Å²	141.2	71%	0.711	85%	0.849	S	S	*	*			trans	130.3	85	169.5	0	0	0	0	0	112.1
28	L	23.7	Very low	26.2	Very low	176 Å²	176	139.6 Å²	139.6	92%	0.921	84%	0.84	S	S	*	*			trans	175.5	81.1	143.2	-93.3	153.4	0	0	0	107.7
29	R	24.3	Very low	26.3	Very low	249 Å²	249	134.7 Å²	134.7	94%	0.94	82%	0.819	S	S	*	*			trans	-131.3	84.3	161.3	-116.5	-163.1	-172.3	-159.8	2.7	106.2
30	E	25.9	Very low	26.6	Very low	155 Å²	155	127.5 Å²	127.5	72%	0.724	78%	0.779	S	S	*	*			trans	-169.9	134.3	158.8	-66	-165.1	167.5	0	0	104.2
31	D	25.9	Very low	26.5	Very low	141 Å²	141	134.5 Å²	134.5	75%	0.754	78%	0.784	S	S	*	*			cis	-163.1	137.9	-15.3	-106	-30	0	0	0	104.2
32	L	26.5	Very low	26.6	Very low	164 Å²	164	132.9 Å²	132.9	86%	0.859	77%	0.771	S	S	*	*			trans	-88.7	119.6	162.3	-79.8	166.2	0	0	0	107.1
33	R	23.5	Very low	26.9	Very low	239 Å²	239	131.4 Å²	131.4	90%	0.902	75%	0.748	S	S	*	*			trans	-178	127.7	145.8	-107.1	174	-74.6	-149.8	4.1	111.2
34	G	23.8	Very low	27	Very low	70 Å²	70	131.1 Å²	131.1	72%	0.722	74%	0.74	S	S	*	*			trans	75.9	119.3	145.2	0	0	0	0	0	117.1	D36	G34-D36 PolarHBondContact O-N 3.47Å
35	A	30.7	Very low	27.1	Very low	105 Å²	105	136.4 Å²	136.4	87%	0.868	74%	0.737	S	S	*	*			trans	-63.1	99	159.7	0	0	0	0	0	109.2
36	D	23.3	Very low	27.5	Very low	147 Å²	147	137.6 Å²	137.6	79%	0.786	73%	0.729	S	S	*	*			trans	-147.4	138.6	161.2	-85.8	-41.4	0	0	0	108.1	G34 L38	G34-D36 PolarHBondContact O-N 3.47Å; D36-L38 PolarHBondContact O-N 3.13Å
37	A	31.6	Very low	27.5	Very low	104 Å²	104	133.2 Å²	133.2	86%	0.86	72%	0.722	S	S	*	*			trans	-37.9	106.7	-168.9	0	0	0	0	0	114.8
38	L	27.9	Very low	27.7	Very low	145 Å²	145	139.7 Å²	139.7	76%	0.759	73%	0.731	S	S	*	*			trans	-65.7	129.6	176.1	-75.6	167.9	0	0	0	110.6	D36	D36-L38 PolarHBondContact O-N 3.13Å
39	P	28.6	Very low	27.8	Very low	77 Å²	77	143.1 Å²	143.1	50%	0.5	73%	0.731	S	S	.	*			trans	-71.3	146.1	-178.6	26.6	-31.7	0	0	0	111.9	R41 A42	P39-R41 PolarHBondContact O-N 3.19Å; P39-A42 PolarHBondContact O-N 3.32Å
40	W	33.3	Very low	28	Very low	31 Å²	31	141.7 Å²	141.7	12%	0.117	73%	0.732	C	S	.	*	G	3₁₀ helix	trans	-35.1	-10	171.6	-171.7	-89.9	0	0	0	118.6	R102 F107 L140 W143	W40-R102 VanDerWaalsContact CE2-NH1 3.27Å; W40-R102 VanDerWaalsContact CZ2-NH1 3.28Å; W40-F107 HydrophobicContact CZ2-CD1 4.4Å; W40-F107 HydrophobicContact CZ2-CE1 4.36Å; W40-L140 HydrophobicContact CH2-CD1 3.82Å; W40-L140 HydrophobicContact CH2-CD2 3.81Å; W40-L140 HydrophobicContact CH2-CG 4.46Å; W40-L140 HydrophobicContact CZ3-CD1 4.36Å; W40-L140 HydrophobicContact CZ3-CD2 3.91Å; W40-W143 HydrophobicContact CE3-CH2 4.45Å; W40-W143 AromaticContact CE3-CZ3 3.85Å; W40-W143 HydrophobicContact CE3-CZ3 3.85Å; W40-W143 HydrophobicContact CZ3-CZ3 4.09Å
41	R	27	Very low	28.1	Very low	217 Å²	217	137.6 Å²	137.6	82%	0.819	73%	0.731	S	S	*	*	G	3₁₀ helix	trans	-79.9	-12	177.9	-69.6	-172	179.7	-158.4	1	114.1	P39 L43 S44	P39-R41 PolarHBondContact O-N 3.19Å; R41-L43 VanDerWaalsContact C-N 3.26Å; R41-L43 PolarHBondContact O-N 3.35Å; R41-S44 PolarHBondContact O-OG 3.48Å
42	A	27.6	Very low	28.2	Very low	70 Å²	70	139.5 Å²	139.5	58%	0.579	74%	0.74	S	S	*	*	G	3₁₀ helix	trans	-72	-13.9	-178.1	0	0	0	0	0	114.7	P39 S44 R45	P39-A42 PolarHBondContact O-N 3.32Å; A42-S44 PolarHBondContact O-N 3.44Å; A42-R45 PolarHBondContact O-N 3.27Å
43	L	33.5	Very low	28.4	Very low	71 Å²	71	135.4 Å²	135.4	37%	0.372	74%	0.738	S	S	.	*	G	3₁₀ helix	trans	-69.4	-10.2	177.2	-71	169.3	0	0	0	114	R41	R41-L43 VanDerWaalsContact C-N 3.26Å; R41-L43 PolarHBondContact O-N 3.35Å
44	S	28.2	Very low	28.6	Very low	102 Å²	102	133.2 Å²	133.2	71%	0.713	74%	0.738	S	S	*	*	G	3₁₀ helix	trans	-95.7	5.1	178.8	48.2	0	0	0	0	115	R41 A42	R41-S44 PolarHBondContact O-OG 3.48Å; A42-S44 PolarHBondContact O-N 3.44Å
45	R	28.8	Very low	28.8	Very low	218 Å²	218	138.4 Å²	138.4	82%	0.823	74%	0.744	S	S	*	*			trans	-118.5	70.7	173.4	-73.7	-172.3	177.3	-176.8	1.5	111.7	A42	A42-R45 PolarHBondContact O-N 3.27Å
46	I	32.3	Very low	28.8	Very low	123 Å²	123	141.7 Å²	141.7	63%	0.631	75%	0.747	S	S	*	*	S	Bend	trans	-100.7	133	153.7	-60.8	172.2	0	0	0	105.4	K48	I46-K48 PolarHBondContact O-N 3.35Å; I46-K48 VanDerWaalsContact O-N 3.12Å
47	P	25.8	Very low	29	Very low	125 Å²	125	140.1 Å²	140.1	81%	0.812	74%	0.742	S	S	*	*	P	Polyproline II helix	trans	-59.9	120.3	-175.8	22.1	-31.4	0	0	0	110.6	R49	P47-R49 PolarHBondContact O-N 3.16Å
48	K	29.1	Very low	29.3	Very low	205 Å²	205	142.1 Å²	142.1	89%	0.891	74%	0.744	S	S	*	*	P	Polyproline II helix	trans	-55.8	130.1	174	-76.2	-177.6	173.5	-175.9	0	109.6	I46 K50	I46-K48 PolarHBondContact O-N 3.35Å; I46-K48 VanDerWaalsContact O-N 3.12Å; K48-K50 PolarHBondContact O-N 2.81Å
49	R	26.8	Very low	29.5	Very low	247 Å²	247	141.1 Å²	141.1	93%	0.932	74%	0.744	S	S	*	*	P	Polyproline II helix	trans	-56.8	131.4	159.8	-90.4	-178.3	171.1	-179	-2.3	108.2	P47 G51	P47-R49 PolarHBondContact O-N 3.16Å; R49-G51 PolarHBondContact O-N 3.39Å; R49-G51 VanDerWaalsContact O-N 3.1Å
50	K	28.7	Very low	30	Very low	220 Å²	220	142.6 Å²	142.6	96%	0.957	76%	0.763	S	S	*	*			trans	-60	111.2	170.9	-89.4	-179.1	174.4	178.3	0	108.9	K48	K48-K50 PolarHBondContact O-N 2.81Å
51	G	27.3	Very low	30.1	Very low	68 Å²	68	143.8 Å²	143.8	70%	0.701	79%	0.785	S	S	*	*			trans	-144.8	144.2	167.4	0	0	0	0	0	107	R49	R49-G51 PolarHBondContact O-N 3.39Å; R49-G51 VanDerWaalsContact O-N 3.1Å
52	L	27.6	Very low	30.8	Very low	181 Å²	181	141.6 Å²	141.6	95%	0.948	78%	0.783	S	S	*	*			trans	-52.3	149.3	-162.6	-71	142.5	0	0	0	114.6
53	G	30.5	Very low	31.9	Very low	79 Å²	79	144.3 Å²	144.3	81%	0.814	78%	0.784	S	S	*	*			trans	-64.1	148.1	-168.2	0	0	0	0	0	114.7
54	E	27.8	Very low	33.6	Very low	192 Å²	192	146.6 Å²	146.6	90%	0.897	80%	0.796	S	S	*	*			trans	-129.1	125.5	158.2	-76.6	-177.2	159.2	0	0	107.5
55	E	28.3	Very low	36.3	Very low	179 Å²	179	142.3 Å²	142.3	84%	0.836	77%	0.765	S	S	*	*			trans	-64.5	142.4	173.6	-67.5	174.3	146.1	0	0	110	T57	E55-T57 VanDerWaalsContact C-N 3.34Å; E55-T57 PolarHBondContact O-N 3.13Å
56	D	30.4	Very low	39.3	Very low	175 Å²	175	136.7 Å²	136.7	94%	0.936	75%	0.751	S	S	*	*			trans	-62.7	90.7	171	-86.4	-40.4	0	0	0	110.1
57	T	27.5	Very low	42.1	Very low	113 Å²	113	135.5 Å²	135.5	69%	0.693	75%	0.751	S	S	*	*			trans	-98.7	111.1	158.7	52.4	0	0	0	0	109.3	E55 V59	E55-T57 VanDerWaalsContact C-N 3.34Å; E55-T57 PolarHBondContact O-N 3.13Å; T57-V59 PolarHBondContact O-N 3.32Å
58	T	39.3	Very low	45.3	Very low	147 Å²	147	132.1 Å²	132.1	90%	0.902	73%	0.726	S	S	*	*			trans	-55	103.7	170	47.9	0	0	0	0	110.7
59	V	31.1	Very low	48.5	Very low	123 Å²	123	123.4 Å²	123.4	75%	0.745	69%	0.688	S	S	*	*			trans	-107.7	110.6	164.9	-173.1	0	0	0	0	107.7	T57 G61	T57-V59 PolarHBondContact O-N 3.32Å; V59-G61 PolarHBondContact O-N 2.86Å
60	A	39.9	Very low	51.7	Low	109 Å²	109	116.3 Å²	116.3	90%	0.901	66%	0.662	S	S	*	*			trans	-61	96.5	168.3	0	0	0	0	0	109.1
61	G	34.6	Very low	54.9	Low	56 Å²	56	108.3 Å²	108.3	58%	0.577	63%	0.633	S	S	*	*			trans	-112.6	106.9	175.3	0	0	0	0	0	110.4	V59	V59-G61 PolarHBondContact O-N 2.86Å
62	H	41.4	Very low	58.3	Low	170 Å²	170	105.2 Å²	105.2	79%	0.787	60%	0.601	S	S	*	*			trans	21.9	111.3	161.5	-72.8	-86.1	0	0	0	118.3	L64	H62-L64 PolarHBondContact O-N 3.25Å; H62-L64 VanDerWaalsContact O-N 3.1Å
63	E	50.4	Low	61.6	Low	128 Å²	128	97 Å²	97	60%	0.598	56%	0.558	S	S	*	*			trans	-60.9	110.6	160	-69.2	-172.5	138.6	0	0	109.4	L65 R70	E63-L65 PolarHBondContact O-N 3.15Å; E63-R70 IonicContact OE1-CZ 3.14Å; E63-R70 IonicContact OE1-NH1 2.75Å; E63-R70 PolarHBondContact OE1-NH1 3.07Å; E63-R70 IonicContact OE1-NH2 2.74Å; E63-R70 PolarHBondContact OE1-NH2 2.97Å; E63-R70 IonicContact OE2-NH2 2.68Å
64	L	70.6	Confident	64.7	Low	118 Å²	118	97.4 Å²	97.4	62%	0.618	54%	0.541	S	S	*	.			trans	-73	-12.5	179.5	-78.4	160.1	0	0	0	113.9	H62	H62-L64 PolarHBondContact O-N 3.25Å; H62-L64 VanDerWaalsContact O-N 3.1Å
65	L	84.1	Confident	68	Low	12 Å²	12	88.4 Å²	88.4	6%	0.063	50%	0.499	C	S	.	.	S	Bend	trans	-111.4	135.9	179.7	-75	178.5	0	0	0	110.9	E63 E69 R70 A96 V97 N98	E63-L65 PolarHBondContact O-N 3.15Å; L65-E69 HydrophobicContact CB-CB 4.5Å; L65-E69 HydrophobicContact CD2-CB 3.93Å; L65-R70 HydrophobicContact CB-CB 4.43Å; L65-R70 HydrophobicContact CD1-CB 4.45Å; L65-A96 HydrophobicContact CD2-CB 3.5Å; L65-A96 VanDerWaalsContact CD2-CB 3.5Å; L65-V97 WeakPolarHBondContact CD2-O 3.41Å; L65-V97 WeakPolarHBondContact CG-O 3.29Å; L65-N98 HydrophobicContact CD1-CB 3.59Å; L65-N98 HydrophobicContact CG-CB 4.29Å
66	L	91.5	Very high	71.4	Confident	101 Å²	101	79.9 Å²	79.9	53%	0.529	46%	0.459	S	S	.	.			trans	-64.8	153.4	166.6	-61.5	175	0	0	0	110.6	N68 E69 R70	L66-N68 VanDerWaalsContact C-N 3.27Å; L66-N68 WeakPolarHBondContact CB-OD1 3.46Å; L66-N68 PolarHBondContact O-N 2.64Å; L66-E69 HydrophobicContact CB-CB 4.48Å; L66-E69 HydrophobicContact CB-CG 4.08Å; L66-E69 PolarHBondContact N-OE2 3.11Å; L66-E69 PolarHBondContact O-N 3.48Å; L66-E69 VanDerWaalsContact O-N 3.08Å; L66-R70 PolarHBondContact O-N 2.82Å
67	P	92.6	Very high	74.5	Confident	97 Å²	97	75.2 Å²	75.2	63%	0.63	43%	0.431	S	S	*	.	H	α-helix	trans	-56.7	-36.3	-178.7	-28.6	35.7	0	0	0	114.6	S71	P67-S71 WeakPolarHBondContact O-CB 3.44Å; P67-S71 PolarHBondContact O-N 2.86Å; P67-S71 PolarHBondContact O-OG 3.16Å
68	N	92.8	Very high	77.8	Confident	54 Å²	54	73.4 Å²	73.4	29%	0.289	42%	0.423	S	S	.	.	H	α-helix	trans	-69.6	-39.6	175.8	60.7	-15	0	0	0	112.1	L66 S71 F72	L66-N68 VanDerWaalsContact C-N 3.27Å; L66-N68 WeakPolarHBondContact CB-OD1 3.46Å; L66-N68 PolarHBondContact O-N 2.64Å; N68-S71 PolarHBondContact O-N 3.5Å; N68-F72 WeakPolarHBondContact O-CB 3.48Å; N68-F72 PolarHBondContact O-N 3.37Å
69	E	95.3	Very high	80.6	Confident	22 Å²	22	69 Å²	69	10%	0.103	39%	0.394	C	S	.	.	H	α-helix	trans	-66.7	-42.1	176.3	-62.9	169.4	157.1	0	0	111.5	L65 L66 S71 F72 Q73 V92 N93 A96	L65-E69 HydrophobicContact CB-CB 4.5Å; L65-E69 HydrophobicContact CD2-CB 3.93Å; L66-E69 HydrophobicContact CB-CB 4.48Å; L66-E69 HydrophobicContact CB-CG 4.08Å; L66-E69 PolarHBondContact N-OE2 3.11Å; L66-E69 PolarHBondContact O-N 3.48Å; L66-E69 VanDerWaalsContact O-N 3.08Å; E69-S71 VanDerWaalsContact C-N 3.33Å; E69-S71 PolarHBondContact O-N 3.24Å; E69-F72 PolarHBondContact O-N 2.94Å; E69-Q73 WeakPolarHBondContact O-CG 3.47Å; E69-Q73 PolarHBondContact O-N 3.02Å; E69-V92 HydrophobicContact CB-CG2 4.25Å; E69-V92 HydrophobicContact CG-CG2 3.75Å; E69-N93 WeakPolarHBondContact OE1-CB 3.4Å; E69-A96 HydrophobicContact CB-CB 3.87Å; E69-A96 VanDerWaalsContact CD-CB 3.46Å; E69-A96 HydrophobicContact CG-CB 3.8Å
70	R	95	Very high	83.8	Confident	98 Å²	98	66.2 Å²	66.2	37%	0.37	38%	0.375	S	S	.	.	H	α-helix	trans	-59.5	-45.2	171.5	-179.4	-178	-65.2	-179	-0.5	111.4	E63 L65 L66 F72 Q73 N74	E63-R70 IonicContact OE1-CZ 3.14Å; E63-R70 IonicContact OE1-NH1 2.75Å; E63-R70 PolarHBondContact OE1-NH1 3.07Å; E63-R70 IonicContact OE1-NH2 2.74Å; E63-R70 PolarHBondContact OE1-NH2 2.97Å; E63-R70 IonicContact OE2-NH2 2.68Å; L65-R70 HydrophobicContact CB-CB 4.43Å; L65-R70 HydrophobicContact CD1-CB 4.45Å; L66-R70 PolarHBondContact O-N 2.82Å; R70-F72 VanDerWaalsContact C-N 3.31Å; R70-F72 PolarHBondContact O-N 3.11Å; R70-Q73 PolarHBondContact O-N 2.78Å; R70-N74 WeakPolarHBondContact O-CB 3.46Å; R70-N74 PolarHBondContact O-N 3.23Å; R70-N74 PolarHBondContact O-ND2 3.47Å
71	S	95.9	Very high	86.5	Confident	52 Å²	52	63.4 Å²	63.4	36%	0.364	34%	0.344	S	S	.	.	H	α-helix	trans	-63	-39.7	177.8	-60.1	0	0	0	0	111.4	P67 N68 E69 N74 A75	P67-S71 WeakPolarHBondContact O-CB 3.44Å; P67-S71 PolarHBondContact O-N 2.86Å; P67-S71 PolarHBondContact O-OG 3.16Å; N68-S71 PolarHBondContact O-N 3.5Å; E69-S71 VanDerWaalsContact C-N 3.33Å; E69-S71 PolarHBondContact O-N 3.24Å; S71-N74 PolarHBondContact O-N 3.09Å; S71-A75 WeakPolarHBondContact O-CB 3.34Å; S71-A75 PolarHBondContact O-N 3.2Å
72	F	97.4	Very high	89.5	Confident	3 Å²	3	66.8 Å²	66.8	1%	0.013	35%	0.349	C	S	.	.	H	α-helix	trans	-65.1	-44.8	176.3	-175.7	-98.8	0	0	0	112.1	N68 E69 R70 N74 A75 A76 M84 L87 S88 V92 I94 A104 F119 L120	N68-F72 WeakPolarHBondContact O-CB 3.48Å; N68-F72 PolarHBondContact O-N 3.37Å; E69-F72 PolarHBondContact O-N 2.94Å; R70-F72 VanDerWaalsContact C-N 3.31Å; R70-F72 PolarHBondContact O-N 3.11Å; F72-N74 VanDerWaalsContact C-N 3.32Å; F72-N74 PolarHBondContact O-N 3.25Å; F72-A75 WeakPolarHBondContact O-CB 3.46Å; F72-A75 PolarHBondContact O-N 3.35Å; F72-A76 PolarHBondContact O-N 2.8Å; F72-M84 HydrophobicContact CD2-CB 4.32Å; F72-M84 HydrophobicContact CD2-CG 4.34Å; F72-M84 HydrophobicContact CE2-CB 3.81Å; F72-M84 HydrophobicContact CE2-CE 4.3Å; F72-M84 HydrophobicContact CE2-CG 4.08Å; F72-M84 WeakPolarHBondContact CE2-O 3.47Å; F72-M84 HydrophobicContact CZ-CE 3.99Å; F72-L87 HydrophobicContact CB-CD1 3.99Å; F72-L87 HydrophobicContact CD2-CB 3.91Å; F72-L87 HydrophobicContact CD2-CD1 4.44Å; F72-S88 WeakPolarHBondContact CE2-OG 3.45Å; F72-V92 HydrophobicContact CB-CG1 4.43Å; F72-V92 HydrophobicContact CB-CG2 4Å; F72-V92 HydrophobicContact CD1-CG1 4.42Å; F72-V92 HydrophobicContact CD2-CG1 3.79Å; F72-V92 HydrophobicContact CE2-CG1 4.1Å; F72-V92 HydrophobicContact CG-CG1 3.96Å; F72-V92 HydrophobicContact CG-CG2 4.33Å; F72-I94 HydrophobicContact CE1-CB 4.36Å; F72-I94 HydrophobicContact CE1-CG1 4.16Å; F72-I94 HydrophobicContact CE1-CG2 4.2Å; F72-I94 HydrophobicContact CZ-CG1 4.04Å; F72-A104 HydrophobicContact CD1-CB 3.85Å; F72-A104 HydrophobicContact CE1-CB 3.72Å; F72-F119 HydrophobicContact CE2-CE1 4.21Å; F72-F119 HydrophobicContact CZ-CE1 4.14Å; F72-L120 HydrophobicContact CE1-CD2 3.61Å; F72-L120 HydrophobicContact CZ-CD2 3.65Å
73	Q	96.5	Very high	92.1	Very high	10 Å²	10	61.8 Å²	61.8	5%	0.047	33%	0.328	C	S	.	.	H	α-helix	trans	-61.1	-40.7	173.7	-71	-166.5	1.7	0	0	112.1	E69 R70 A76 K77 A96 N98 R102 A104 F107	E69-Q73 WeakPolarHBondContact O-CG 3.47Å; E69-Q73 PolarHBondContact O-N 3.02Å; R70-Q73 PolarHBondContact O-N 2.78Å; Q73-A76 PolarHBondContact O-N 2.78Å; Q73-K77 VanDerWaalsContact O-CB 3.28Å; Q73-K77 WeakPolarHBondContact O-CB 3.27Å; Q73-K77 PolarHBondContact O-N 2.98Å; Q73-A96 PolarHBondContact NE2-O 3.47Å; Q73-N98 PolarHBondContact OE1-ND2 2.95Å; Q73-R102 PolarHBondContact NE2-O 2.86Å; Q73-A104 HydrophobicContact CG-CB 4.15Å; Q73-F107 HydrophobicContact CB-CD2 4.33Å; Q73-F107 HydrophobicContact CB-CE2 4.43Å
74	N	96.6	Very high	94.3	Very high	87 Å²	87	55.7 Å²	55.7	47%	0.465	30%	0.299	S	S	.	.	H	α-helix	trans	-64.9	-40	175.8	-75.1	-24.6	0	0	0	111.8	R70 S71 F72 K77 S78	R70-N74 WeakPolarHBondContact O-CB 3.46Å; R70-N74 PolarHBondContact O-N 3.23Å; R70-N74 PolarHBondContact O-ND2 3.47Å; S71-N74 PolarHBondContact O-N 3.09Å; F72-N74 VanDerWaalsContact C-N 3.32Å; F72-N74 PolarHBondContact O-N 3.25Å; N74-K77 WeakPolarHBondContact O-CB 3.35Å; N74-K77 PolarHBondContact O-N 2.72Å; N74-S78 PolarHBondContact O-N 3.49Å; N74-S78 PolarHBondContact O-OG 3.44Å
75	A	97.8	Very high	95.5	Very high	2 Å²	2	54.8 Å²	54.8	2%	0.017	29%	0.292	C	S	.	.	H	α-helix	trans	-61.6	-45.8	175	0	0	0	0	0	111.6	S71 F72 K77 S78 N79 N80 L83 M84	S71-A75 WeakPolarHBondContact O-CB 3.34Å; S71-A75 PolarHBondContact O-N 3.2Å; F72-A75 WeakPolarHBondContact O-CB 3.46Å; F72-A75 PolarHBondContact O-N 3.35Å; A75-K77 VanDerWaalsContact C-N 3.33Å; A75-K77 PolarHBondContact O-N 3.23Å; A75-S78 CarbonylContact O-C 3.49Å; A75-S78 PolarHBondContact O-N 2.87Å; A75-S78 PolarHBondContact O-OG 3.42Å; A75-N79 PolarHBondContact O-N 3.38Å; A75-N80 HydrophobicContact CB-CB 4.32Å; A75-N80 PolarHBondContact O-N 3.07Å; A75-L83 HydrophobicContact CB-CB 4.06Å; A75-L83 HydrophobicContact CB-CD2 3.83Å; A75-L83 HydrophobicContact CB-CG 3.9Å; A75-M84 HydrophobicContact CB-CG 3.63Å
76	A	97.8	Very high	96.1	Very high	0 Å²	0	60.7 Å²	60.7	0%	0	32%	0.317	C	S	.	.	H	α-helix	trans	-61	-41.5	173.9	0	0	0	0	0	112.4	F72 Q73 S78 N79 M84 A104 L120	F72-A76 PolarHBondContact O-N 2.8Å; Q73-A76 PolarHBondContact O-N 2.78Å; A76-S78 VanDerWaalsContact C-N 3.26Å; A76-S78 PolarHBondContact O-N 3.3Å; A76-N79 PolarHBondContact O-N 3.06Å; A76-M84 WeakPolarHBondContact CA-SD 3.29Å; A76-M84 HydrophobicContact CB-CE 3.74Å; A76-M84 HydrophobicContact CB-SD 3.92Å; A76-A104 HydrophobicContact CB-CB 3.79Å; A76-L120 HydrophobicContact CB-CD1 4.22Å
77	K	96.5	Very high	96.2	Very high	78 Å²	78	57 Å²	57	34%	0.339	30%	0.298	S	S	.	.	H	α-helix	trans	-65.3	-25.6	176.6	-173.7	-179.5	174.1	-172.2	0	113.6	Q73 N74 A75 F107 H113	Q73-K77 VanDerWaalsContact O-CB 3.28Å; Q73-K77 WeakPolarHBondContact O-CB 3.27Å; Q73-K77 PolarHBondContact O-N 2.98Å; N74-K77 WeakPolarHBondContact O-CB 3.35Å; N74-K77 PolarHBondContact O-N 2.72Å; A75-K77 VanDerWaalsContact C-N 3.33Å; A75-K77 PolarHBondContact O-N 3.23Å; K77-F107 HydrophobicContact CB-CB 3.76Å; K77-F107 HydrophobicContact CB-CD1 4.49Å; K77-F107 HydrophobicContact CB-CG 4.18Å; K77-F107 HydrophobicContact CD-CD1 3.92Å; K77-F107 HydrophobicContact CD-CE1 4.32Å; K77-F107 HydrophobicContact CD-CG 4.35Å; K77-F107 HydrophobicContact CG-CB 4.11Å; K77-F107 HydrophobicContact CG-CD1 4.14Å; K77-F107 HydrophobicContact CG-CG 4.31Å; K77-H113 PolarHBondContact O-CD2 3.49Å; K77-H113 PolarHBondContact O-NE2 3.37Å; K77-H113 VanDerWaalsContact O-NE2 3.1Å
78	S	97.2	Very high	96.1	Very high	75 Å²	75	53.7 Å²	53.7	52%	0.524	28%	0.277	S	S	.	.	T	Hydrogen-bonded Turn	trans	-105.2	8.2	178.6	67.2	0	0	0	0	113.6	N74 A75 A76 N80	N74-S78 PolarHBondContact O-N 3.49Å; N74-S78 PolarHBondContact O-OG 3.44Å; A75-S78 CarbonylContact O-C 3.49Å; A75-S78 PolarHBondContact O-N 2.87Å; A75-S78 PolarHBondContact O-OG 3.42Å; A76-S78 VanDerWaalsContact C-N 3.26Å; A76-S78 PolarHBondContact O-N 3.3Å; S78-N80 PolarHBondContact O-N 3.24Å
79	N	97.3	Very high	95.9	Very high	55 Å²	55	58.6 Å²	58.6	29%	0.294	30%	0.298	S	S	.	.	T	Hydrogen-bonded Turn	trans	54.7	32.4	-174.1	-157.2	40.4	0	0	0	114.6	A75 A76 L81 H113 A116	A75-N79 PolarHBondContact O-N 3.38Å; A76-N79 PolarHBondContact O-N 3.06Å; N79-L81 PolarHBondContact O-N 2.82Å; N79-H113 HydrophobicContact CB-CB 3.95Å; N79-A116 WeakPolarHBondContact OD1-CB 3.37Å; N79-A116 PolarHBondContact OD1-N 3.44Å
80	N	97.9	Very high	95.5	Very high	64 Å²	64	62.6 Å²	62.6	34%	0.342	32%	0.32	S	S	.	.			trans	-87.5	86.6	178.9	-174.2	-22.1	0	0	0	110	A75 S78 L83 M84	A75-N80 HydrophobicContact CB-CB 4.32Å; A75-N80 PolarHBondContact O-N 3.07Å; S78-N80 PolarHBondContact O-N 3.24Å; N80-L83 HydrophobicContact CB-CB 4.27Å; N80-L83 VanDerWaalsContact CG-CB 3.49Å; N80-L83 PolarHBondContact O-N 3.04Å; N80-L83 VanDerWaalsContact OD1-CB 3.3Å; N80-L83 WeakPolarHBondContact OD1-CB 3.26Å; N80-L83 PolarHBondContact OD1-N 3.45Å; N80-M84 VanDerWaalsContact O-CG 3.3Å; N80-M84 WeakPolarHBondContact O-CG 3.31Å; N80-M84 PolarHBondContact O-N 2.82Å; N80-M84 VanDerWaalsContact O-N 3.12Å
81	L	97.3	Very high	95.1	Very high	50 Å²	50	67.5 Å²	67.5	26%	0.262	34%	0.344	S	S	.	.	H	α-helix	trans	-63.7	-43.4	-177.5	-76.6	-174.5	0	0	0	113.4	N79 L83 M84 E85 A116 F119	N79-L81 PolarHBondContact O-N 2.82Å; L81-L83 PolarHBondContact O-N 3.34Å; L81-M84 HydrophobicContact CD2-SD 4.2Å; L81-M84 CarbonylContact O-C 3.56Å; L81-M84 WeakPolarHBondContact O-CA 3.45Å; L81-M84 WeakPolarHBondContact O-CB 3.33Å; L81-M84 PolarHBondContact O-N 2.8Å; L81-E85 PolarHBondContact O-N 3.44Å; L81-A116 HydrophobicContact CD2-CB 4.49Å; L81-F119 HydrophobicContact CD2-CB 3.81Å; L81-F119 HydrophobicContact CD2-CD2 4.42Å; L81-F119 HydrophobicContact CD2-CG 4.18Å
82	D	96.8	Very high	94.9	Very high	126 Å²	126	65.6 Å²	65.6	67%	0.674	33%	0.33	S	S	*	.	H	α-helix	trans	-57.4	-41.2	-179.5	-56	-28	0	0	0	111.2	K86	D82-K86 WeakPolarHBondContact O-CB 3.5Å; D82-K86 PolarHBondContact O-N 2.88Å
83	L	96.7	Very high	94.8	Very high	66 Å²	66	69.4 Å²	69.4	35%	0.346	35%	0.351	S	S	.	.	H	α-helix	trans	-71.2	-35.8	176.4	-175.9	58.3	0	0	0	111.9	A75 N80 L81 L87	A75-L83 HydrophobicContact CB-CB 4.06Å; A75-L83 HydrophobicContact CB-CD2 3.83Å; A75-L83 HydrophobicContact CB-CG 3.9Å; N80-L83 HydrophobicContact CB-CB 4.27Å; N80-L83 VanDerWaalsContact CG-CB 3.49Å; N80-L83 PolarHBondContact O-N 3.04Å; N80-L83 VanDerWaalsContact OD1-CB 3.3Å; N80-L83 WeakPolarHBondContact OD1-CB 3.26Å; N80-L83 PolarHBondContact OD1-N 3.45Å; L81-L83 PolarHBondContact O-N 3.34Å; L83-L87 HydrophobicContact CD1-CD1 3.91Å; L83-L87 HydrophobicContact CD1-CG 3.99Å; L83-L87 HydrophobicContact CG-CD1 3.85Å; L83-L87 HydrophobicContact CG-CG 4.35Å; L83-L87 VanDerWaalsContact O-CB 3.28Å; L83-L87 WeakPolarHBondContact O-CB 3.29Å; L83-L87 WeakPolarHBondContact O-CG 3.28Å; L83-L87 PolarHBondContact O-N 3.06Å
84	M	97.4	Very high	94.7	Very high	0 Å²	0	70.2 Å²	70.2	0%	0	36%	0.355	C	S	.	.	H	α-helix	trans	-64.6	-43.4	174.3	-69.3	173.7	72.6	0	0	111.7	F72 A75 A76 N80 L81 L87 S88 A116 F119 L120	F72-M84 HydrophobicContact CD2-CB 4.32Å; F72-M84 HydrophobicContact CD2-CG 4.34Å; F72-M84 HydrophobicContact CE2-CB 3.81Å; F72-M84 HydrophobicContact CE2-CE 4.3Å; F72-M84 HydrophobicContact CE2-CG 4.08Å; F72-M84 WeakPolarHBondContact CE2-O 3.47Å; F72-M84 HydrophobicContact CZ-CE 3.99Å; A75-M84 HydrophobicContact CB-CG 3.63Å; A76-M84 WeakPolarHBondContact CA-SD 3.29Å; A76-M84 HydrophobicContact CB-CE 3.74Å; A76-M84 HydrophobicContact CB-SD 3.92Å; N80-M84 VanDerWaalsContact O-CG 3.3Å; N80-M84 WeakPolarHBondContact O-CG 3.31Å; N80-M84 PolarHBondContact O-N 2.82Å; N80-M84 VanDerWaalsContact O-N 3.12Å; L81-M84 HydrophobicContact CD2-SD 4.2Å; L81-M84 CarbonylContact O-C 3.56Å; L81-M84 WeakPolarHBondContact O-CA 3.45Å; L81-M84 WeakPolarHBondContact O-CB 3.33Å; L81-M84 PolarHBondContact O-N 2.8Å; M84-L87 PolarHBondContact O-N 3.09Å; M84-S88 WeakPolarHBondContact O-CB 3.23Å; M84-S88 PolarHBondContact O-N 3.42Å; M84-S88 PolarHBondContact O-OG 2.93Å; M84-A116 HydrophobicContact CE-CB 4.23Å; M84-A116 HydrophobicContact SD-CB 3.91Å; M84-F119 HydrophobicContact CB-CD1 4.31Å; M84-F119 HydrophobicContact CB-CE1 4.01Å; M84-F119 HydrophobicContact CB-CZ 4.32Å; M84-F119 HydrophobicContact CE-CD1 3.59Å; M84-F119 HydrophobicContact CE-CE1 4.14Å; M84-F119 HydrophobicContact CE-CG 4.38Å; M84-L120 HydrophobicContact CE-CD1 3.97Å; M84-L120 HydrophobicContact CE-CD2 3.73Å; M84-L120 HydrophobicContact CE-CG 3.62Å
85	E	95.8	Very high	94.6	Very high	98 Å²	98	68.3 Å²	68.3	46%	0.458	35%	0.345	S	S	.	.	H	α-helix	trans	-59.3	-55	175.3	-79.2	175.7	-171.5	0	0	110.8	L81 L87 S88 E89 F119	L81-E85 PolarHBondContact O-N 3.44Å; E85-L87 VanDerWaalsContact C-N 3.28Å; E85-L87 PolarHBondContact O-N 3.04Å; E85-S88 WeakPolarHBondContact O-CB 3.42Å; E85-S88 PolarHBondContact O-N 3.38Å; E85-E89 PolarHBondContact O-N 2.82Å; E85-F119 HydrophobicContact CB-CE2 4.49Å; E85-F119 HydrophobicContact CG-CD2 4.22Å; E85-F119 HydrophobicContact CG-CE2 3.47Å; E85-F119 VanDerWaalsContact CG-CE2 3.47Å; E85-F119 HydrophobicContact CG-CZ 4.17Å
86	K	95.4	Very high	94.5	Very high	137 Å²	137	68.5 Å²	68.5	60%	0.596	35%	0.346	S	S	*	.	H	α-helix	trans	-58.3	-37.7	179.2	-174.2	176.3	-177.4	175.8	0	113.4	D82 N90	D82-K86 WeakPolarHBondContact O-CB 3.5Å; D82-K86 PolarHBondContact O-N 2.88Å; K86-N90 PolarHBondContact O-ND2 3.48Å; K86-N90 VanDerWaalsContact O-ND2 3.11Å
87	L	93.7	Very high	94.4	Very high	23 Å²	23	71 Å²	71	12%	0.12	36%	0.362	C	S	.	.	H	α-helix	trans	-76.2	-27.8	177.5	-71.1	174	0	0	0	112.3	F72 L83 M84 E85 N90 V92	F72-L87 HydrophobicContact CB-CD1 3.99Å; F72-L87 HydrophobicContact CD2-CB 3.91Å; F72-L87 HydrophobicContact CD2-CD1 4.44Å; L83-L87 HydrophobicContact CD1-CD1 3.91Å; L83-L87 HydrophobicContact CD1-CG 3.99Å; L83-L87 HydrophobicContact CG-CD1 3.85Å; L83-L87 HydrophobicContact CG-CG 4.35Å; L83-L87 VanDerWaalsContact O-CB 3.28Å; L83-L87 WeakPolarHBondContact O-CB 3.29Å; L83-L87 WeakPolarHBondContact O-CG 3.28Å; L83-L87 PolarHBondContact O-N 3.06Å; M84-L87 PolarHBondContact O-N 3.09Å; E85-L87 VanDerWaalsContact C-N 3.28Å; E85-L87 PolarHBondContact O-N 3.04Å; L87-N90 PolarHBondContact O-N 3.03Å; L87-V92 WeakPolarHBondContact O-CB 3.33Å; L87-V92 WeakPolarHBondContact O-CG1 3.43Å
88	S	90.1	Very high	94.3	Very high	27 Å²	27	68.5 Å²	68.5	19%	0.189	35%	0.352	C	S	.	.	H	α-helix	trans	-69.3	-34.4	176.9	-60.5	0	0	0	0	112.5	F72 M84 E85 N90 K91 F119	F72-S88 WeakPolarHBondContact CE2-OG 3.45Å; M84-S88 WeakPolarHBondContact O-CB 3.23Å; M84-S88 PolarHBondContact O-N 3.42Å; M84-S88 PolarHBondContact O-OG 2.93Å; E85-S88 WeakPolarHBondContact O-CB 3.42Å; E85-S88 PolarHBondContact O-N 3.38Å; S88-N90 PolarHBondContact O-N 3.24Å; S88-K91 PolarHBondContact O-N 3.39Å; S88-F119 WeakPolarHBondContact OG-CZ 3.27Å
89	E	90.2	Very high	94.1	Very high	158 Å²	158	68.8 Å²	68.8	74%	0.738	35%	0.348	S	S	*	.	H	α-helix	trans	-58.3	-30	172.1	-66.7	176.2	166.9	0	0	112.5	E85 K91	E85-E89 PolarHBondContact O-N 2.82Å; E89-K91 PolarHBondContact O-N 3.05Å
90	N	86.9	Confident	94	Very high	105 Å²	105	70.8 Å²	70.8	56%	0.561	36%	0.356	S	S	*	.	T	Hydrogen-bonded Turn	trans	-86	22.5	-179.9	-66.7	-50.7	0	0	0	113.9	K86 L87 S88 V92	K86-N90 PolarHBondContact O-ND2 3.48Å; K86-N90 VanDerWaalsContact O-ND2 3.11Å; L87-N90 PolarHBondContact O-N 3.03Å; S88-N90 PolarHBondContact O-N 3.24Å; N90-V92 VanDerWaalsContact C-N 3.27Å; N90-V92 PolarHBondContact O-N 2.9Å
91	K	85.2	Confident	93.9	Very high	202 Å²	202	71 Å²	71	88%	0.878	36%	0.358	S	S	*	.	T	Hydrogen-bonded Turn	trans	54.1	36.9	179.1	-59.4	-177.6	177.9	179.2	0	113.8	S88 E89	S88-K91 PolarHBondContact O-N 3.39Å; E89-K91 PolarHBondContact O-N 3.05Å
92	V	93.1	Very high	93.8	Very high	12 Å²	12	69.6 Å²	69.6	7%	0.073	35%	0.349	C	S	.	.			trans	-61.7	139	174.7	73.7	0	0	0	0	110.6	E69 F72 L87 N90 I94	E69-V92 HydrophobicContact CB-CG2 4.25Å; E69-V92 HydrophobicContact CG-CG2 3.75Å; F72-V92 HydrophobicContact CB-CG1 4.43Å; F72-V92 HydrophobicContact CB-CG2 4Å; F72-V92 HydrophobicContact CD1-CG1 4.42Å; F72-V92 HydrophobicContact CD2-CG1 3.79Å; F72-V92 HydrophobicContact CE2-CG1 4.1Å; F72-V92 HydrophobicContact CG-CG1 3.96Å; F72-V92 HydrophobicContact CG-CG2 4.33Å; L87-V92 WeakPolarHBondContact O-CB 3.33Å; L87-V92 WeakPolarHBondContact O-CG1 3.43Å; N90-V92 VanDerWaalsContact C-N 3.27Å; N90-V92 PolarHBondContact O-N 2.9Å; V92-I94 PolarHBondContact O-N 3.45Å; V92-I94 VanDerWaalsContact O-N 3.09Å
93	N	94.3	Very high	93.9	Very high	82 Å²	82	63.6 Å²	63.6	44%	0.439	32%	0.317	S	S	.	.			trans	-74	102.4	172.8	178.9	8.1	0	0	0	109.8	E69 N95 A96	E69-N93 WeakPolarHBondContact OE1-CB 3.4Å; N93-N95 PolarHBondContact O-N 3.27Å; N93-N95 VanDerWaalsContact O-N 3.14Å; N93-N95 PolarHBondContact OD1-N 3.05Å; N93-A96 HydrophobicContact CB-CB 4.18Å; N93-A96 WeakPolarHBondContact O-CB 3.47Å; N93-A96 PolarHBondContact O-N 3.01Å; N93-A96 PolarHBondContact OD1-N 3.02Å
94	I	94.5	Very high	93.9	Very high	27 Å²	27	60.5 Å²	60.5	14%	0.138	30%	0.3	C	S	.	.	T	Hydrogen-bonded Turn	trans	-58.5	-27.5	179.5	-64.5	177.5	0	0	0	112.3	F72 V92 L120 H123 A125	F72-I94 HydrophobicContact CE1-CB 4.36Å; F72-I94 HydrophobicContact CE1-CG1 4.16Å; F72-I94 HydrophobicContact CE1-CG2 4.2Å; F72-I94 HydrophobicContact CZ-CG1 4.04Å; V92-I94 PolarHBondContact O-N 3.45Å; V92-I94 VanDerWaalsContact O-N 3.09Å; I94-L120 HydrophobicContact CG2-CD2 3.68Å; I94-H123 HydrophobicContact CD1-CB 3.44Å; I94-H123 VanDerWaalsContact CD1-CB 3.44Å; I94-A125 HydrophobicContact CG2-CB 3.76Å
95	N	95.7	Very high	94	Very high	47 Å²	47	60.5 Å²	60.5	25%	0.251	30%	0.301	S	S	.	.	T	Hydrogen-bonded Turn	trans	-96.7	9.8	-178.6	-62.4	-49.6	0	0	0	113.1	N93 V97 R126	N93-N95 PolarHBondContact O-N 3.27Å; N93-N95 VanDerWaalsContact O-N 3.14Å; N93-N95 PolarHBondContact OD1-N 3.05Å; N95-V97 PolarHBondContact O-N 3.48Å; N95-R126 WeakPolarHBondContact OD1-CB 3.4Å; N95-R126 PolarHBondContact OD1-N 3.31Å
96	A	95.5	Very high	94.1	Very high	6 Å²	6	55.9 Å²	55.9	5%	0.05	28%	0.279	C	S	.	.			trans	-57.5	138.5	175.1	0	0	0	0	0	110.2	L65 E69 Q73 N93	L65-A96 HydrophobicContact CD2-CB 3.5Å; L65-A96 VanDerWaalsContact CD2-CB 3.5Å; E69-A96 HydrophobicContact CB-CB 3.87Å; E69-A96 VanDerWaalsContact CD-CB 3.46Å; E69-A96 HydrophobicContact CG-CB 3.8Å; Q73-A96 PolarHBondContact NE2-O 3.47Å; N93-A96 HydrophobicContact CB-CB 4.18Å; N93-A96 WeakPolarHBondContact O-CB 3.47Å; N93-A96 PolarHBondContact O-N 3.01Å; N93-A96 PolarHBondContact OD1-N 3.02Å
97	V	95.6	Very high	94.2	Very high	54 Å²	54	50.3 Å²	50.3	33%	0.327	26%	0.255	S	S	.	.			trans	-112.2	139.2	-177.4	-67.9	0	0	0	0	110.8	L65 N95 R102 T103 V129	L65-V97 WeakPolarHBondContact CD2-O 3.41Å; L65-V97 WeakPolarHBondContact CG-O 3.29Å; N95-V97 PolarHBondContact O-N 3.48Å; V97-R102 WeakPolarHBondContact CA-O 3.25Å; V97-T103 HydrophobicContact CG1-CG2 3.76Å; V97-V129 HydrophobicContact CG1-CG1 4.1Å
98	N	93.9	Very high	94.5	Very high	25 Å²	25	49.2 Å²	49.2	13%	0.134	25%	0.249	C	C	.	.			trans	-82.9	-175.2	171.9	63.7	27.1	0	0	0	112	L65 Q73 M100 N101 R102 F107	L65-N98 HydrophobicContact CD1-CB 3.59Å; L65-N98 HydrophobicContact CG-CB 4.29Å; Q73-N98 PolarHBondContact OE1-ND2 2.95Å; N98-M100 PolarHBondContact O-N 3.21Å; N98-M100 WeakPolarHBondContact OD1-CA 3Å; N98-M100 WeakPolarHBondContact OD1-CB 3.48Å; N98-M100 PolarHBondContact OD1-N 3.27Å; N98-N101 WeakPolarHBondContact O-CA 3.43Å; N98-N101 PolarHBondContact O-N 3.45Å; N98-R102 PolarHBondContact N-O 2.89Å; N98-R102 PolarHBondContact OD1-N 3.12Å; N98-R102 VanDerWaalsContact OD1-N 3.09Å; N98-F107 VanDerWaalsContact ND2-CE2 3.34Å; N98-F107 WeakPolarHBondContact ND2-CE2 3.48Å; N98-F107 WeakPolarHBondContact ND2-CZ 3.11Å
99	N	93.6	Very high	94.9	Very high	81 Å²	81	48 Å²	48	43%	0.433	24%	0.24	S	C	.	.	T	Hydrogen-bonded Turn	trans	-62.2	-5.5	179	-57.2	12.8	0	0	0	114.3	K132	N99-K132 WeakPolarHBondContact O-CD 3.17Å; N99-K132 WeakPolarHBondContact O-CE 3.32Å; N99-K132 PolarHBondContact O-NZ 2.95Å
100	M	93.9	Very high	95.1	Very high	96 Å²	96	40.9 Å²	40.9	47%	0.473	21%	0.21	S	C	.	.	T	Hydrogen-bonded Turn	trans	-106	11.7	172.2	-64.8	-64.8	-171.6	0	0	112.6	N98 R102 D131 K132	N98-M100 PolarHBondContact O-N 3.21Å; N98-M100 WeakPolarHBondContact OD1-CA 3Å; N98-M100 WeakPolarHBondContact OD1-CB 3.48Å; N98-M100 PolarHBondContact OD1-N 3.27Å; M100-R102 HydrophobicContact CB-CG 4.11Å; M100-R102 PolarHBondContact O-N 3.08Å; M100-D131 WeakPolarHBondContact O-CA 3.26Å; M100-D131 WeakPolarHBondContact O-CB 3.5Å; M100-K132 PolarHBondContact O-N 3.37Å; M100-K132 HydrophobicContact SD-CD 4.26Å
101	N	95.8	Very high	95.5	Very high	69 Å²	69	41 Å²	41	37%	0.369	20%	0.202	S	C	.	.	S	Bend	trans	59.3	26.5	-171.2	-67.2	1.8	0	0	0	113.8	N98 K132	N98-N101 WeakPolarHBondContact O-CA 3.43Å; N98-N101 PolarHBondContact O-N 3.45Å; N101-K132 HydrophobicContact CB-CG 4.33Å
102	R	96.4	Very high	96	Very high	21 Å²	21	34.5 Å²	34.5	8%	0.079	18%	0.177	C	C	.	.			trans	-98.3	135.3	-178.5	-66.5	172.5	167.6	172.6	-13.5	111.6	W40 Q73 V97 N98 M100 H106 F107 D131	W40-R102 VanDerWaalsContact CE2-NH1 3.27Å; W40-R102 VanDerWaalsContact CZ2-NH1 3.28Å; Q73-R102 PolarHBondContact NE2-O 2.86Å; V97-R102 WeakPolarHBondContact CA-O 3.25Å; N98-R102 PolarHBondContact N-O 2.89Å; N98-R102 PolarHBondContact OD1-N 3.12Å; N98-R102 VanDerWaalsContact OD1-N 3.09Å; M100-R102 HydrophobicContact CB-CG 4.11Å; M100-R102 PolarHBondContact O-N 3.08Å; R102-H106 HydrophobicContact CB-CB 4.1Å; R102-H106 HydrophobicContact CG-CB 4.34Å; R102-F107 HydrophobicContact CB-CE2 4.12Å; R102-F107 HydrophobicContact CB-CZ 4.24Å; R102-D131 HydrophobicContact CG-CB 3.58Å; R102-D131 IonicContact CZ-OD2 3.68Å; R102-D131 VanDerWaalsContact CZ-OD2 3.25Å; R102-D131 IonicContact NE-OD2 3.3Å; R102-D131 PolarHBondContact NE-OD2 3.36Å; R102-D131 IonicContact NH2-OD2 2.87Å; R102-D131 PolarHBondContact NH2-OD2 2.99Å
103	T	97.9	Very high	96.2	Very high	0 Å²	0	36 Å²	36	0%	0	18%	0.183	C	C	.	.			trans	-91.5	171.9	173	66.7	0	0	0	0	111.7	V97 L105 H106 F107 V129	V97-T103 HydrophobicContact CG1-CG2 3.76Å; T103-L105 PolarHBondContact O-N 2.96Å; T103-L105 PolarHBondContact OG1-N 3.24Å; T103-H106 PolarHBondContact N-ND1 3.07Å; T103-H106 WeakPolarHBondContact O-CB 3.44Å; T103-H106 PolarHBondContact O-N 2.9Å; T103-H106 PolarHBondContact OG1-ND1 3.45Å; T103-F107 VanDerWaalsContact O-CD2 3.31Å; T103-F107 WeakPolarHBondContact O-CD2 3.2Å; T103-V129 HydrophobicContact CG2-CB 4.12Å; T103-V129 HydrophobicContact CG2-CG1 3.89Å; T103-V129 HydrophobicContact CG2-CG2 4.19Å
104	A	98	Very high	96.3	Very high	0 Å²	0	34.5 Å²	34.5	0%	0	18%	0.175	C	C	.	.	H	α-helix	trans	-54.9	-37.3	170.8	0	0	0	0	0	112.3	F72 Q73 A76 H106 F107 A108 L120	F72-A104 HydrophobicContact CD1-CB 3.85Å; F72-A104 HydrophobicContact CE1-CB 3.72Å; Q73-A104 HydrophobicContact CG-CB 4.15Å; A76-A104 HydrophobicContact CB-CB 3.79Å; A104-H106 PolarHBondContact O-N 3.01Å; A104-F107 PolarHBondContact O-N 2.88Å; A104-A108 PolarHBondContact O-N 2.84Å; A104-L120 HydrophobicContact CB-CD1 4.17Å; A104-L120 HydrophobicContact CB-CD2 4Å
105	L	98.6	Very high	96.5	Very high	1 Å²	1	35.9 Å²	35.9	1%	0.005	19%	0.187	C	C	.	.	H	α-helix	trans	-65.3	-36.6	179.7	-172.4	63.9	0	0	0	112.6	T103 F107 A108 V109 V117 L120 L121 A125 V127 V137 L153	T103-L105 PolarHBondContact O-N 2.96Å; T103-L105 PolarHBondContact OG1-N 3.24Å; L105-F107 VanDerWaalsContact C-N 3.28Å; L105-F107 PolarHBondContact O-N 3.01Å; L105-A108 PolarHBondContact O-N 2.9Å; L105-V109 HydrophobicContact CD1-CG2 3.94Å; L105-V109 HydrophobicContact CG-CG2 4.1Å; L105-V109 WeakPolarHBondContact O-CB 3.3Å; L105-V109 VanDerWaalsContact O-CG2 3.23Å; L105-V109 WeakPolarHBondContact O-CG2 3.29Å; L105-V109 PolarHBondContact O-N 2.96Å; L105-V117 HydrophobicContact CD1-CG1 4.2Å; L105-V117 HydrophobicContact CD1-CG2 4.42Å; L105-L120 HydrophobicContact CB-CD1 4.12Å; L105-L120 HydrophobicContact CD1-CB 3.92Å; L105-L120 HydrophobicContact CD1-CD1 3.98Å; L105-L121 HydrophobicContact CD1-CD2 4.34Å; L105-L121 HydrophobicContact CD1-CG 4.49Å; L105-L121 HydrophobicContact CD2-CD2 3.97Å; L105-A125 HydrophobicContact CB-CB 4.42Å; L105-A125 HydrophobicContact CD2-CB 4.17Å; L105-V127 HydrophobicContact CD2-CG1 3.89Å; L105-V137 HydrophobicContact CB-CG1 4.43Å; L105-V137 HydrophobicContact CD2-CG1 4Å; L105-V137 HydrophobicContact CD2-CG2 4.48Å; L105-V137 HydrophobicContact CG-CG1 3.88Å; L105-L153 HydrophobicContact CD2-CD2 4.28Å
106	H	98.4	Very high	96.6	Very high	1 Å²	1	33.7 Å²	33.7	1%	0.005	18%	0.175	C	C	.	.	H	α-helix	trans	-57.9	-43.3	173.7	-71.7	77.9	0	0	0	111.5	R102 T103 A104 G110 V129 L135 L140	R102-H106 HydrophobicContact CB-CB 4.1Å; R102-H106 HydrophobicContact CG-CB 4.34Å; T103-H106 PolarHBondContact N-ND1 3.07Å; T103-H106 WeakPolarHBondContact O-CB 3.44Å; T103-H106 PolarHBondContact O-N 2.9Å; T103-H106 PolarHBondContact OG1-ND1 3.45Å; A104-H106 PolarHBondContact O-N 3.01Å; H106-G110 PolarHBondContact O-N 2.99Å; H106-V129 PolarHBondContact CE1-O 2.94Å; H106-V129 PolarHBondContact NE2-O 3.49Å; H106-L135 PolarHBondContact NE2-O 3.2Å; H106-L140 HydrophobicContact CB-CD1 3.84Å; H106-L140 WeakPolarHBondContact O-CD1 3.29Å
107	F	98	Very high	96.7	Very high	20 Å²	20	33.4 Å²	33.4	9%	0.088	17%	0.173	C	C	.	.	H	α-helix	trans	-70.2	-43.7	179.9	-68.2	-66.5	0	0	0	112.7	W40 Q73 K77 N98 R102 T103 A104 L105 R111	W40-F107 HydrophobicContact CZ2-CD1 4.4Å; W40-F107 HydrophobicContact CZ2-CE1 4.36Å; Q73-F107 HydrophobicContact CB-CD2 4.33Å; Q73-F107 HydrophobicContact CB-CE2 4.43Å; K77-F107 HydrophobicContact CB-CB 3.76Å; K77-F107 HydrophobicContact CB-CD1 4.49Å; K77-F107 HydrophobicContact CB-CG 4.18Å; K77-F107 HydrophobicContact CD-CD1 3.92Å; K77-F107 HydrophobicContact CD-CE1 4.32Å; K77-F107 HydrophobicContact CD-CG 4.35Å; K77-F107 HydrophobicContact CG-CB 4.11Å; K77-F107 HydrophobicContact CG-CD1 4.14Å; K77-F107 HydrophobicContact CG-CG 4.31Å; N98-F107 VanDerWaalsContact ND2-CE2 3.34Å; N98-F107 WeakPolarHBondContact ND2-CE2 3.48Å; N98-F107 WeakPolarHBondContact ND2-CZ 3.11Å; R102-F107 HydrophobicContact CB-CE2 4.12Å; R102-F107 HydrophobicContact CB-CZ 4.24Å; T103-F107 VanDerWaalsContact O-CD2 3.31Å; T103-F107 WeakPolarHBondContact O-CD2 3.2Å; A104-F107 PolarHBondContact O-N 2.88Å; L105-F107 VanDerWaalsContact C-N 3.28Å; L105-F107 PolarHBondContact O-N 3.01Å; F107-R111 WeakPolarHBondContact O-CB 3.36Å; F107-R111 WeakPolarHBondContact O-CG 3.47Å; F107-R111 PolarHBondContact O-N 2.97Å; F107-R111 VanDerWaalsContact O-N 3.13Å
108	A	98.4	Very high	96.9	Very high	0 Å²	0	33.7 Å²	33.7	0%	0	17%	0.173	C	C	.	.	H	α-helix	trans	-61.8	-46.7	178.1	0	0	0	0	0	111.4	A104 L105 R111 N112 H113 A116 V117 L120	A104-A108 PolarHBondContact O-N 2.84Å; L105-A108 PolarHBondContact O-N 2.9Å; A108-R111 PolarHBondContact O-N 3.48Å; A108-N112 PolarHBondContact O-N 2.9Å; A108-N112 VanDerWaalsContact O-N 3.16Å; A108-H113 PolarHBondContact O-N 3.45Å; A108-A116 HydrophobicContact CB-CB 3.88Å; A108-V117 HydrophobicContact CB-CG2 3.76Å; A108-L120 HydrophobicContact CB-CD1 3.88Å
109	V	98.3	Very high	97.1	Very high	0 Å²	0	33.3 Å²	33.3	0%	0	17%	0.17	C	C	.	.	H	α-helix	trans	-65.2	-47.9	178.1	171.3	0	0	0	0	111.5	L105 R111 N112 V117 V137 L140 A141 S144 V149 L153	L105-V109 HydrophobicContact CD1-CG2 3.94Å; L105-V109 HydrophobicContact CG-CG2 4.1Å; L105-V109 WeakPolarHBondContact O-CB 3.3Å; L105-V109 VanDerWaalsContact O-CG2 3.23Å; L105-V109 WeakPolarHBondContact O-CG2 3.29Å; L105-V109 PolarHBondContact O-N 2.96Å; V109-R111 PolarHBondContact O-N 3.26Å; V109-R111 VanDerWaalsContact O-N 3.13Å; V109-N112 PolarHBondContact O-N 3.24Å; V109-V117 HydrophobicContact CB-CG2 4.48Å; V109-V117 HydrophobicContact CG2-CG1 4.41Å; V109-V117 HydrophobicContact CG2-CG2 3.71Å; V109-V137 HydrophobicContact CG1-CB 4.48Å; V109-V137 WeakPolarHBondContact CG1-O 3.47Å; V109-V137 HydrophobicContact CG2-CB 4.22Å; V109-V137 HydrophobicContact CG2-CG1 4.33Å; V109-L140 HydrophobicContact CG1-CB 3.76Å; V109-A141 HydrophobicContact CG1-CB 3.86Å; V109-S144 PolarHBondContact O-OG 3.29Å; V109-V149 HydrophobicContact CB-CG1 4.23Å; V109-V149 HydrophobicContact CG1-CG1 3.81Å; V109-V149 HydrophobicContact CG2-CG1 3.86Å; V109-L153 HydrophobicContact CG1-CD1 4.1Å; V109-L153 HydrophobicContact CG2-CD1 4.07Å; V109-L153 HydrophobicContact CG2-CD2 4.22Å
110	G	95.1	Very high	97.3	Very high	10 Å²	10	29.4 Å²	29.4	10%	0.103	15%	0.149	C	C	.	.	H	α-helix	trans	-63.4	-18.6	-179.5	0	0	0	0	0	114.5	H106	H106-G110 PolarHBondContact O-N 2.99Å
111	R	95	Very high	97.5	Very high	108 Å²	108	26.1 Å²	26.1	41%	0.408	13%	0.133	S	C	.	.	T	Hydrogen-bonded Turn	trans	-105.2	3.4	175.6	-67.7	-68.6	-179.1	148.2	-2.6	113.7	F107 A108 V109 H113	F107-R111 WeakPolarHBondContact O-CB 3.36Å; F107-R111 WeakPolarHBondContact O-CG 3.47Å; F107-R111 PolarHBondContact O-N 2.97Å; F107-R111 VanDerWaalsContact O-N 3.13Å; A108-R111 PolarHBondContact O-N 3.48Å; V109-R111 PolarHBondContact O-N 3.26Å; V109-R111 VanDerWaalsContact O-N 3.13Å; R111-H113 VanDerWaalsContact C-N 3.3Å; R111-H113 VanDerWaalsContact CB-CD2 3.45Å; R111-H113 WeakPolarHBondContact CB-CD2 3.36Å; R111-H113 WeakPolarHBondContact CB-NE2 3.38Å; R111-H113 PolarHBondContact O-N 3.39Å; R111-H113 PolarHBondContact O-ND1 3.3Å
112	N	95.6	Very high	97.6	Very high	64 Å²	64	29.5 Å²	29.5	34%	0.342	14%	0.144	S	C	.	.	T	Hydrogen-bonded Turn	trans	52.5	47.3	-175.3	-170.3	27.1	0	0	0	112.6	A108 V109 L114 S146 V149	A108-N112 PolarHBondContact O-N 2.9Å; A108-N112 VanDerWaalsContact O-N 3.16Å; V109-N112 PolarHBondContact O-N 3.24Å; N112-L114 PolarHBondContact O-N 3.2Å; N112-L114 WeakPolarHBondContact OD1-CD1 3.38Å; N112-S146 VanDerWaalsContact CG-CB 3.46Å; N112-S146 WeakPolarHBondContact OD1-CB 3.44Å; N112-S146 PolarHBondContact OD1-OG 2.63Å; N112-V149 WeakPolarHBondContact OD1-CG2 3.4Å
113	H	97.3	Very high	97.6	Very high	45 Å²	45	32.7 Å²	32.7	21%	0.208	16%	0.16	C	C	.	.			trans	-93.6	82	177.4	-70.2	-25.7	0	0	0	109.9	K77 N79 A108 R111 S115 A116 V117	K77-H113 PolarHBondContact O-CD2 3.49Å; K77-H113 PolarHBondContact O-NE2 3.37Å; K77-H113 VanDerWaalsContact O-NE2 3.1Å; N79-H113 HydrophobicContact CB-CB 3.95Å; A108-H113 PolarHBondContact O-N 3.45Å; R111-H113 VanDerWaalsContact C-N 3.3Å; R111-H113 VanDerWaalsContact CB-CD2 3.45Å; R111-H113 WeakPolarHBondContact CB-CD2 3.36Å; R111-H113 WeakPolarHBondContact CB-NE2 3.38Å; R111-H113 PolarHBondContact O-N 3.39Å; R111-H113 PolarHBondContact O-ND1 3.3Å; H113-S115 VanDerWaalsContact C-N 3.3Å; H113-S115 PolarHBondContact O-N 3.48Å; H113-A116 HydrophobicContact CB-CB 4.03Å; H113-A116 PolarHBondContact O-N 3.38Å; H113-V117 WeakPolarHBondContact O-CG2 3.38Å; H113-V117 PolarHBondContact O-N 2.98Å
114	L	97	Very high	97.5	Very high	50 Å²	50	41 Å²	41	26%	0.262	20%	0.196	S	C	.	.	H	α-helix	trans	-52.8	-46.1	-172.1	-73.3	89.7	0	0	0	112.9	N112 V117 D118 E148 V149 M152	N112-L114 PolarHBondContact O-N 3.2Å; N112-L114 WeakPolarHBondContact OD1-CD1 3.38Å; L114-V117 WeakPolarHBondContact O-CB 3.47Å; L114-V117 PolarHBondContact O-N 2.87Å; L114-D118 WeakPolarHBondContact O-CB 3.44Å; L114-D118 PolarHBondContact O-N 3.33Å; L114-E148 HydrophobicContact CD2-CB 3.94Å; L114-E148 HydrophobicContact CD2-CG 3.65Å; L114-E148 WeakPolarHBondContact CD2-OE1 3.03Å; L114-E148 WeakPolarHBondContact CD2-OE2 3.24Å; L114-V149 HydrophobicContact CG-CG2 4.15Å; L114-M152 HydrophobicContact CB-CE 4.35Å; L114-M152 HydrophobicContact CG-CE 4.34Å
115	S	98	Very high	97.4	Very high	56 Å²	56	41.5 Å²	41.5	39%	0.392	20%	0.2	S	C	.	.	H	α-helix	trans	-65.4	-43.4	-177.8	-33.3	0	0	0	0	111.8	H113 V117 D118 F119	H113-S115 VanDerWaalsContact C-N 3.3Å; H113-S115 PolarHBondContact O-N 3.48Å; S115-V117 VanDerWaalsContact C-N 3.34Å; S115-V117 PolarHBondContact O-N 3.23Å; S115-D118 PolarHBondContact O-N 3.45Å; S115-F119 WeakPolarHBondContact O-CB 3.48Å; S115-F119 PolarHBondContact O-N 2.96Å
116	A	98.3	Very high	97.4	Very high	0 Å²	0	47.4 Å²	47.4	0%	0	22%	0.222	C	C	.	.	H	α-helix	trans	-64.3	-37.3	173.3	0	0	0	0	0	112.4	N79 L81 M84 A108 H113 L120	N79-A116 WeakPolarHBondContact OD1-CB 3.37Å; N79-A116 PolarHBondContact OD1-N 3.44Å; L81-A116 HydrophobicContact CD2-CB 4.49Å; M84-A116 HydrophobicContact CE-CB 4.23Å; M84-A116 HydrophobicContact SD-CB 3.91Å; A108-A116 HydrophobicContact CB-CB 3.88Å; H113-A116 HydrophobicContact CB-CB 4.03Å; H113-A116 PolarHBondContact O-N 3.38Å; A116-L120 WeakPolarHBondContact O-CB 3.38Å; A116-L120 VanDerWaalsContact O-CD1 3.31Å; A116-L120 WeakPolarHBondContact O-CD1 3.32Å; A116-L120 WeakPolarHBondContact O-CG 3.5Å; A116-L120 PolarHBondContact O-N 3.24Å
117	V	98.6	Very high	97.4	Very high	0 Å²	0	48.1 Å²	48.1	0%	0	23%	0.227	C	C	.	.	H	α-helix	trans	-63	-51.4	174.3	172.3	0	0	0	0	110.7	L105 A108 V109 H113 L114 S115 F119 L120 L121 V149 M152	L105-V117 HydrophobicContact CD1-CG1 4.2Å; L105-V117 HydrophobicContact CD1-CG2 4.42Å; A108-V117 HydrophobicContact CB-CG2 3.76Å; V109-V117 HydrophobicContact CB-CG2 4.48Å; V109-V117 HydrophobicContact CG2-CG1 4.41Å; V109-V117 HydrophobicContact CG2-CG2 3.71Å; H113-V117 WeakPolarHBondContact O-CG2 3.38Å; H113-V117 PolarHBondContact O-N 2.98Å; L114-V117 WeakPolarHBondContact O-CB 3.47Å; L114-V117 PolarHBondContact O-N 2.87Å; S115-V117 VanDerWaalsContact C-N 3.34Å; S115-V117 PolarHBondContact O-N 3.23Å; V117-F119 VanDerWaalsContact C-N 3.34Å; V117-F119 PolarHBondContact O-N 3.01Å; V117-L120 PolarHBondContact O-N 3.49Å; V117-L121 HydrophobicContact CG1-CD1 3.78Å; V117-L121 HydrophobicContact CG1-CG 4.24Å; V117-L121 VanDerWaalsContact O-CG 3.29Å; V117-L121 WeakPolarHBondContact O-CG 3.49Å; V117-L121 PolarHBondContact O-N 2.95Å; V117-V149 HydrophobicContact CG1-CG1 4.27Å; V117-V149 HydrophobicContact CG2-CG1 4.31Å; V117-V149 HydrophobicContact CG2-CG2 4.33Å; V117-M152 HydrophobicContact CB-CE 4.1Å; V117-M152 HydrophobicContact CG1-CE 3.77Å; V117-M152 HydrophobicContact CG1-SD 4.32Å
118	D	98.4	Very high	97.4	Very high	61 Å²	61	51.5 Å²	51.5	33%	0.326	25%	0.246	S	C	.	.	H	α-helix	trans	-58	-45.9	178.1	176.4	63.4	0	0	0	111.5	L114 S115 L120 L121 K122 M152	L114-D118 WeakPolarHBondContact O-CB 3.44Å; L114-D118 PolarHBondContact O-N 3.33Å; S115-D118 PolarHBondContact O-N 3.45Å; D118-L120 PolarHBondContact O-N 3.14Å; D118-L121 PolarHBondContact O-N 3.09Å; D118-K122 WeakPolarHBondContact O-CB 3.29Å; D118-K122 WeakPolarHBondContact O-CG 3.33Å; D118-K122 PolarHBondContact O-N 3.38Å; D118-K122 VanDerWaalsContact OD1-CE 3.29Å; D118-K122 WeakPolarHBondContact OD1-CE 3.4Å; D118-K122 IonicContact OD1-NZ 2.68Å; D118-K122 WeakPolarHBondContact OD2-CE 3.42Å; D118-K122 IonicContact OD2-NZ 2.66Å; D118-K122 PolarHBondContact OD2-NZ 3.29Å; D118-M152 HydrophobicContact CB-SD 4.16Å
119	F	98.3	Very high	97.3	Very high	16 Å²	16	52.5 Å²	52.5	7%	0.07	25%	0.252	C	S	.	.	H	α-helix	trans	-54.7	-51.5	174.3	178.8	-85.5	0	0	0	111.6	F72 L81 M84 E85 S88 S115 V117 L121 K122 H123	F72-F119 HydrophobicContact CE2-CE1 4.21Å; F72-F119 HydrophobicContact CZ-CE1 4.14Å; L81-F119 HydrophobicContact CD2-CB 3.81Å; L81-F119 HydrophobicContact CD2-CD2 4.42Å; L81-F119 HydrophobicContact CD2-CG 4.18Å; M84-F119 HydrophobicContact CB-CD1 4.31Å; M84-F119 HydrophobicContact CB-CE1 4.01Å; M84-F119 HydrophobicContact CB-CZ 4.32Å; M84-F119 HydrophobicContact CE-CD1 3.59Å; M84-F119 HydrophobicContact CE-CE1 4.14Å; M84-F119 HydrophobicContact CE-CG 4.38Å; E85-F119 HydrophobicContact CB-CE2 4.49Å; E85-F119 HydrophobicContact CG-CD2 4.22Å; E85-F119 HydrophobicContact CG-CE2 3.47Å; E85-F119 VanDerWaalsContact CG-CE2 3.47Å; E85-F119 HydrophobicContact CG-CZ 4.17Å; S88-F119 WeakPolarHBondContact OG-CZ 3.27Å; S115-F119 WeakPolarHBondContact O-CB 3.48Å; S115-F119 PolarHBondContact O-N 2.96Å; V117-F119 VanDerWaalsContact C-N 3.34Å; V117-F119 PolarHBondContact O-N 3.01Å; F119-L121 PolarHBondContact O-N 2.81Å; F119-K122 PolarHBondContact O-N 3.36Å; F119-H123 AromaticContact CD1-ND1 3.93Å; F119-H123 AromaticContact CD2-CE1 3.73Å; F119-H123 AromaticContact CD2-ND1 3.94Å; F119-H123 AromaticContact CE1-CE1 4Å; F119-H123 AromaticContact CE1-ND1 3.75Å; F119-H123 AromaticContact CE2-CE1 3.24Å; F119-H123 WeakPolarHBondContact CE2-CE1 3.48Å; F119-H123 AromaticContact CE2-ND1 3.74Å; F119-H123 AromaticContact CZ-CE1 3.4Å; F119-H123 VanDerWaalsContact CZ-CE1 3.4Å; F119-H123 WeakPolarHBondContact CZ-CE1 3.45Å; F119-H123 AromaticContact CZ-ND1 3.65Å; F119-H123 AromaticContact CZ-NE2 3.9Å; F119-H123 PolarHBondContact O-N 2.82Å; F119-H123 VanDerWaalsContact O-N 3.1Å; F119-H123 PolarHBondContact O-ND1 3.3Å
120	L	98.5	Very high	97.3	Very high	0 Å²	0	54.3 Å²	54.3	0%	0	27%	0.267	C	S	.	.	H	α-helix	trans	-64.2	-41	-177.5	-72.3	166.2	0	0	0	111.9	F72 A76 M84 I94 A104 L105 A108 A116 V117 D118 H123 K124 A125	F72-L120 HydrophobicContact CE1-CD2 3.61Å; F72-L120 HydrophobicContact CZ-CD2 3.65Å; A76-L120 HydrophobicContact CB-CD1 4.22Å; M84-L120 HydrophobicContact CE-CD1 3.97Å; M84-L120 HydrophobicContact CE-CD2 3.73Å; M84-L120 HydrophobicContact CE-CG 3.62Å; I94-L120 HydrophobicContact CG2-CD2 3.68Å; A104-L120 HydrophobicContact CB-CD1 4.17Å; A104-L120 HydrophobicContact CB-CD2 4Å; L105-L120 HydrophobicContact CB-CD1 4.12Å; L105-L120 HydrophobicContact CD1-CB 3.92Å; L105-L120 HydrophobicContact CD1-CD1 3.98Å; A108-L120 HydrophobicContact CB-CD1 3.88Å; A116-L120 WeakPolarHBondContact O-CB 3.38Å; A116-L120 VanDerWaalsContact O-CD1 3.31Å; A116-L120 WeakPolarHBondContact O-CD1 3.32Å; A116-L120 WeakPolarHBondContact O-CG 3.5Å; A116-L120 PolarHBondContact O-N 3.24Å; V117-L120 PolarHBondContact O-N 3.49Å; D118-L120 PolarHBondContact O-N 3.14Å; L120-H123 CarbonylContact O-C 3.51Å; L120-H123 PolarHBondContact O-N 3.3Å; L120-K124 PolarHBondContact O-N 3.01Å; L120-A125 HydrophobicContact CB-CB 3.86Å; L120-A125 WeakPolarHBondContact O-CB 3.18Å; L120-A125 PolarHBondContact O-N 3.36Å
121	L	98.1	Very high	97.4	Very high	26 Å²	26	54.1 Å²	54.1	14%	0.136	26%	0.264	C	S	.	.	H	α-helix	trans	-69	-39.2	178.6	-65.8	178.4	0	0	0	112.2	L105 V117 D118 F119 H123 K124 V127 M152 L153 A156	L105-L121 HydrophobicContact CD1-CD2 4.34Å; L105-L121 HydrophobicContact CD1-CG 4.49Å; L105-L121 HydrophobicContact CD2-CD2 3.97Å; V117-L121 HydrophobicContact CG1-CD1 3.78Å; V117-L121 HydrophobicContact CG1-CG 4.24Å; V117-L121 VanDerWaalsContact O-CG 3.29Å; V117-L121 WeakPolarHBondContact O-CG 3.49Å; V117-L121 PolarHBondContact O-N 2.95Å; D118-L121 PolarHBondContact O-N 3.09Å; F119-L121 PolarHBondContact O-N 2.81Å; L121-H123 PolarHBondContact O-N 3.23Å; L121-K124 PolarHBondContact O-N 2.83Å; L121-V127 HydrophobicContact CD2-CG1 3.63Å; L121-M152 HydrophobicContact CD1-CB 3.8Å; L121-L153 HydrophobicContact CD1-CD2 4.33Å; L121-L153 HydrophobicContact CD2-CD2 4.22Å; L121-A156 HydrophobicContact CD1-CB 4.19Å; L121-A156 HydrophobicContact CD2-CB 3.78Å; L121-A156 HydrophobicContact CG-CB 4.45Å
122	K	97.4	Very high	97.5	Very high	140 Å²	140	54 Å²	54	61%	0.609	27%	0.266	S	S	*	.	H	α-helix	trans	-58.5	-37.1	171.8	-78.3	172.8	175.7	165.4	0	111.8	D118 F119 K124	D118-K122 WeakPolarHBondContact O-CB 3.29Å; D118-K122 WeakPolarHBondContact O-CG 3.33Å; D118-K122 PolarHBondContact O-N 3.38Å; D118-K122 VanDerWaalsContact OD1-CE 3.29Å; D118-K122 WeakPolarHBondContact OD1-CE 3.4Å; D118-K122 IonicContact OD1-NZ 2.68Å; D118-K122 WeakPolarHBondContact OD2-CE 3.42Å; D118-K122 IonicContact OD2-NZ 2.66Å; D118-K122 PolarHBondContact OD2-NZ 3.29Å; F119-K122 PolarHBondContact O-N 3.36Å; K122-K124 PolarHBondContact O-N 3.36Å
123	H	96.2	Very high	97.5	Very high	89 Å²	89	55 Å²	55	41%	0.412	27%	0.268	S	S	.	.	T	Hydrogen-bonded Turn	trans	-88	22.1	175.4	-64.4	81.9	0	0	0	114	I94 F119 L120 L121 A125	I94-H123 HydrophobicContact CD1-CB 3.44Å; I94-H123 VanDerWaalsContact CD1-CB 3.44Å; F119-H123 AromaticContact CD1-ND1 3.93Å; F119-H123 AromaticContact CD2-CE1 3.73Å; F119-H123 AromaticContact CD2-ND1 3.94Å; F119-H123 AromaticContact CE1-CE1 4Å; F119-H123 AromaticContact CE1-ND1 3.75Å; F119-H123 AromaticContact CE2-CE1 3.24Å; F119-H123 WeakPolarHBondContact CE2-CE1 3.48Å; F119-H123 AromaticContact CE2-ND1 3.74Å; F119-H123 AromaticContact CZ-CE1 3.4Å; F119-H123 VanDerWaalsContact CZ-CE1 3.4Å; F119-H123 WeakPolarHBondContact CZ-CE1 3.45Å; F119-H123 AromaticContact CZ-ND1 3.65Å; F119-H123 AromaticContact CZ-NE2 3.9Å; F119-H123 PolarHBondContact O-N 2.82Å; F119-H123 VanDerWaalsContact O-N 3.1Å; F119-H123 PolarHBondContact O-ND1 3.3Å; L120-H123 CarbonylContact O-C 3.51Å; L120-H123 PolarHBondContact O-N 3.3Å; L121-H123 PolarHBondContact O-N 3.23Å; H123-A125 VanDerWaalsContact C-N 3.29Å; H123-A125 PolarHBondContact O-N 3.4Å
124	K	95.1	Very high	97.5	Very high	175 Å²	175	53.5 Å²	53.5	76%	0.761	27%	0.265	S	S	*	.	T	Hydrogen-bonded Turn	trans	58.1	35.7	172.4	-51.7	-60.5	-176.8	-178	0	114	L120 L121 K122 R126	L120-K124 PolarHBondContact O-N 3.01Å; L121-K124 PolarHBondContact O-N 2.83Å; K122-K124 PolarHBondContact O-N 3.36Å; K124-R126 PolarHBondContact O-N 3.41Å
125	A	97.8	Very high	97.6	Very high	9 Å²	9	51.5 Å²	51.5	7%	0.074	26%	0.255	C	S	.	.			trans	-56.1	137	167.8	0	0	0	0	0	110.5	I94 L105 L120 H123	I94-A125 HydrophobicContact CG2-CB 3.76Å; L105-A125 HydrophobicContact CB-CB 4.42Å; L105-A125 HydrophobicContact CD2-CB 4.17Å; L120-A125 HydrophobicContact CB-CB 3.86Å; L120-A125 WeakPolarHBondContact O-CB 3.18Å; L120-A125 PolarHBondContact O-N 3.36Å; H123-A125 VanDerWaalsContact C-N 3.29Å; H123-A125 PolarHBondContact O-N 3.4Å
126	R	98	Very high	97.6	Very high	126 Å²	126	49.5 Å²	49.5	48%	0.475	24%	0.24	S	C	.	.			trans	-69.8	131.1	178.2	-75.5	-176	67.9	176.8	5.7	110.7	N95 K124 D128 V129	N95-R126 WeakPolarHBondContact OD1-CB 3.4Å; N95-R126 PolarHBondContact OD1-N 3.31Å; K124-R126 PolarHBondContact O-N 3.41Å; R126-D128 WeakPolarHBondContact CB-OD1 3.46Å; R126-D128 IonicContact CZ-OD1 2.9Å; R126-D128 IonicContact CZ-OD2 3.4Å; R126-D128 IonicContact NE-OD1 3.74Å; R126-D128 PolarHBondContact NE-OD1 3.25Å; R126-D128 IonicContact NE-OD2 3.59Å; R126-D128 IonicContact NH2-OD1 3.01Å; R126-D128 PolarHBondContact NH2-OD1 2.89Å; R126-D128 IonicContact NH2-OD2 2.68Å; R126-D128 PolarHBondContact NH2-OD2 3.44Å; R126-V129 HydrophobicContact CB-CG2 3.75Å
127	V	98.2	Very high	97.6	Very high	16 Å²	16	49.5 Å²	49.5	10%	0.097	24%	0.24	C	C	.	.	S	Bend	trans	-100.4	-8.1	179.7	-64.9	0	0	0	0	113.2	L105 L121 V137 L153 A156 A158	L105-V127 HydrophobicContact CD2-CG1 3.89Å; L121-V127 HydrophobicContact CD2-CG1 3.63Å; V127-V137 HydrophobicContact CB-CG2 4.04Å; V127-V137 HydrophobicContact CG1-CG2 4.45Å; V127-V137 WeakPolarHBondContact O-CG2 3.4Å; V127-L153 HydrophobicContact CG1-CD2 4.12Å; V127-A156 HydrophobicContact CG1-CB 4.16Å; V127-A158 HydrophobicContact CB-CB 3.74Å; V127-A158 HydrophobicContact CG1-CB 4.4Å; V127-A158 HydrophobicContact CG2-CB 3.86Å
128	D	97	Very high	97.6	Very high	91 Å²	91	49.5 Å²	49.5	49%	0.487	24%	0.24	S	C	.	.			trans	-96.3	-5.6	-176.9	66.7	-32.5	0	0	0	113.5	R126 A130	R126-D128 WeakPolarHBondContact CB-OD1 3.46Å; R126-D128 IonicContact CZ-OD1 2.9Å; R126-D128 IonicContact CZ-OD2 3.4Å; R126-D128 IonicContact NE-OD1 3.74Å; R126-D128 PolarHBondContact NE-OD1 3.25Å; R126-D128 IonicContact NE-OD2 3.59Å; R126-D128 IonicContact NH2-OD1 3.01Å; R126-D128 PolarHBondContact NH2-OD1 2.89Å; R126-D128 IonicContact NH2-OD2 2.68Å; R126-D128 PolarHBondContact NH2-OD2 3.44Å; D128-A130 PolarHBondContact O-N 3.39Å
129	V	97.8	Very high	97.6	Very high	20 Å²	20	46.7 Å²	46.7	12%	0.121	23%	0.225	C	C	.	.			trans	-68.2	127	178.8	-178.9	0	0	0	0	109.1	V97 T103 H106 R126	V97-V129 HydrophobicContact CG1-CG1 4.1Å; T103-V129 HydrophobicContact CG2-CB 4.12Å; T103-V129 HydrophobicContact CG2-CG1 3.89Å; T103-V129 HydrophobicContact CG2-CG2 4.19Å; H106-V129 PolarHBondContact CE1-O 2.94Å; H106-V129 PolarHBondContact NE2-O 3.49Å; R126-V129 HydrophobicContact CB-CG2 3.75Å
130	A	97.8	Very high	97.6	Very high	39 Å²	39	46.1 Å²	46.1	32%	0.322	22%	0.222	S	C	.	.			trans	-103.2	139.5	174.1	0	0	0	0	0	110.7	D128 T136	D128-A130 PolarHBondContact O-N 3.39Å; A130-T136 HydrophobicContact CB-CG2 3.92Å
131	D	97	Very high	97.6	Very high	6 Å²	6	46.1 Å²	46.1	3%	0.032	22%	0.222	C	C	.	.			trans	-73.1	179.5	173.6	86.4	-0.5	0	0	0	112.1	M100 R102 H133 G134 L135	M100-D131 WeakPolarHBondContact O-CA 3.26Å; M100-D131 WeakPolarHBondContact O-CB 3.5Å; R102-D131 HydrophobicContact CG-CB 3.58Å; R102-D131 IonicContact CZ-OD2 3.68Å; R102-D131 VanDerWaalsContact CZ-OD2 3.25Å; R102-D131 IonicContact NE-OD2 3.3Å; R102-D131 PolarHBondContact NE-OD2 3.36Å; R102-D131 IonicContact NH2-OD2 2.87Å; R102-D131 PolarHBondContact NH2-OD2 2.99Å; D131-H133 PolarHBondContact O-N 2.97Å; D131-H133 WeakPolarHBondContact OD1-CA 3.34Å; D131-H133 WeakPolarHBondContact OD1-CB 3.47Å; D131-H133 IonicContact OD1-CD2 3.56Å; D131-H133 PolarHBondContact OD1-N 3.08Å; D131-G134 PolarHBondContact O-N 3.49Å; D131-G134 PolarHBondContact OD1-N 3.25Å; D131-L135 PolarHBondContact N-O 3.03Å; D131-L135 WeakPolarHBondContact OD1-CB 3.42Å; D131-L135 PolarHBondContact OD1-N 3.24Å
132	K	97	Very high	97.6	Very high	105 Å²	105	44.9 Å²	44.9	46%	0.457	22%	0.216	S	C	.	.	T	Hydrogen-bonded Turn	trans	-58.7	-14	-179.4	-83.6	-170.1	173.1	174.9	0	115.2	N99 M100 N101 Q165	N99-K132 WeakPolarHBondContact O-CD 3.17Å; N99-K132 WeakPolarHBondContact O-CE 3.32Å; N99-K132 PolarHBondContact O-NZ 2.95Å; M100-K132 PolarHBondContact O-N 3.37Å; M100-K132 HydrophobicContact SD-CD 4.26Å; N101-K132 HydrophobicContact CB-CG 4.33Å; K132-Q165 PolarHBondContact O-NE2 2.96Å; K132-Q165 PolarHBondContact O-OE1 3.42Å
133	H	96.4	Very high	97.6	Very high	85 Å²	85	41.5 Å²	41.5	39%	0.394	20%	0.199	S	C	.	.	T	Hydrogen-bonded Turn	trans	-103.6	6.7	176.5	-56.2	-69.5	0	0	0	112.5	D131 L135 N164 Q165	D131-H133 PolarHBondContact O-N 2.97Å; D131-H133 WeakPolarHBondContact OD1-CA 3.34Å; D131-H133 WeakPolarHBondContact OD1-CB 3.47Å; D131-H133 IonicContact OD1-CD2 3.56Å; D131-H133 PolarHBondContact OD1-N 3.08Å; H133-L135 VanDerWaalsContact C-N 3.29Å; H133-L135 HydrophobicContact CB-CD1 4.43Å; H133-L135 HydrophobicContact CB-CG 4.25Å; H133-N164 WeakPolarHBondContact O-CB 3.44Å; H133-Q165 WeakPolarHBondContact O-CB 3.31Å; H133-Q165 WeakPolarHBondContact O-CG 3.37Å; H133-Q165 PolarHBondContact O-N 3.37Å
134	G	97.6	Very high	97.5	Very high	13 Å²	13	38.8 Å²	38.8	13%	0.134	19%	0.19	C	C	.	.	S	Bend	trans	77.4	11.4	-173.5	0	0	0	0	0	113.5	D131 T136 N164	D131-G134 PolarHBondContact O-N 3.49Å; D131-G134 PolarHBondContact OD1-N 3.25Å; G134-T136 PolarHBondContact O-N 2.82Å; G134-N164 WeakPolarHBondContact O-CA 3.47Å
135	L	98.3	Very high	97.5	Very high	9 Å²	9	31.5 Å²	31.5	5%	0.047	17%	0.165	C	C	.	.			trans	-79.7	115.5	179.3	-60.1	171.3	0	0	0	110.2	H106 D131 H133 H139 L140 N164 F173	H106-L135 PolarHBondContact NE2-O 3.2Å; D131-L135 PolarHBondContact N-O 3.03Å; D131-L135 WeakPolarHBondContact OD1-CB 3.42Å; D131-L135 PolarHBondContact OD1-N 3.24Å; H133-L135 VanDerWaalsContact C-N 3.29Å; H133-L135 HydrophobicContact CB-CD1 4.43Å; H133-L135 HydrophobicContact CB-CG 4.25Å; L135-H139 HydrophobicContact CD2-CB 3.93Å; L135-L140 HydrophobicContact CD1-CD2 4.44Å; L135-N164 HydrophobicContact CD2-CB 3.83Å; L135-F173 HydrophobicContact CD2-CE1 4.04Å; L135-F173 HydrophobicContact CD2-CE2 3.92Å; L135-F173 HydrophobicContact CD2-CZ 3.38Å
136	T	98.3	Very high	97.3	Very high	13 Å²	13	31.6 Å²	31.6	8%	0.08	17%	0.165	C	C	.	.			trans	-88.7	171.6	165.5	65	0	0	0	0	111.5	A130 G134 V138 H139 L140 A162	A130-T136 HydrophobicContact CB-CG2 3.92Å; G134-T136 PolarHBondContact O-N 2.82Å; T136-V138 VanDerWaalsContact C-N 3.27Å; T136-V138 PolarHBondContact O-N 2.99Å; T136-V138 WeakPolarHBondContact OG1-CG2 3.2Å; T136-H139 PolarHBondContact N-ND1 3.41Å; T136-H139 VanDerWaalsContact N-ND1 3.12Å; T136-H139 WeakPolarHBondContact O-CB 3.5Å; T136-H139 PolarHBondContact O-N 3.39Å; T136-H139 VanDerWaalsContact O-N 3.12Å; T136-H139 PolarHBondContact OG1-CE1 3.19Å; T136-H139 PolarHBondContact OG1-ND1 3.37Å; T136-L140 PolarHBondContact O-N 3.46Å; T136-A162 HydrophobicContact CG2-CB 4.25Å
137	V	98.1	Very high	97.3	Very high	0 Å²	0	27 Å²	27	0%	0	15%	0.15	C	C	.	.	H	α-helix	trans	-61.9	-27.5	-179.5	-65.9	0	0	0	0	114.1	L105 V109 V127 L140 A141 L153 A158	L105-V137 HydrophobicContact CB-CG1 4.43Å; L105-V137 HydrophobicContact CD2-CG1 4Å; L105-V137 HydrophobicContact CD2-CG2 4.48Å; L105-V137 HydrophobicContact CG-CG1 3.88Å; V109-V137 HydrophobicContact CG1-CB 4.48Å; V109-V137 WeakPolarHBondContact CG1-O 3.47Å; V109-V137 HydrophobicContact CG2-CB 4.22Å; V109-V137 HydrophobicContact CG2-CG1 4.33Å; V127-V137 HydrophobicContact CB-CG2 4.04Å; V127-V137 HydrophobicContact CG1-CG2 4.45Å; V127-V137 WeakPolarHBondContact O-CG2 3.4Å; V137-L140 PolarHBondContact O-N 3.14Å; V137-A141 WeakPolarHBondContact O-CB 3.4Å; V137-A141 PolarHBondContact O-N 3.25Å; V137-L153 HydrophobicContact CB-CD1 3.92Å; V137-L153 HydrophobicContact CB-CD2 4.13Å; V137-L153 HydrophobicContact CG2-CD1 3.96Å; V137-L153 HydrophobicContact CG2-CD2 3.7Å; V137-L153 HydrophobicContact CG2-CG 4.38Å; V137-L153 WeakPolarHBondContact O-CD1 3.33Å; V137-A158 HydrophobicContact CG2-CB 4.49Å
138	V	98.3	Very high	97.3	Very high	1 Å²	1	31.9 Å²	31.9	1%	0.006	17%	0.172	C	C	.	.	H	α-helix	trans	-67	-36.6	174.6	-67.9	0	0	0	0	112.1	T136 L140 A141 A142 M150 A158 D159 A162	T136-V138 VanDerWaalsContact C-N 3.27Å; T136-V138 PolarHBondContact O-N 2.99Å; T136-V138 WeakPolarHBondContact OG1-CG2 3.2Å; V138-L140 VanDerWaalsContact C-N 3.33Å; V138-A141 PolarHBondContact O-N 3.14Å; V138-A142 WeakPolarHBondContact O-CB 3.18Å; V138-A142 PolarHBondContact O-N 3.25Å; V138-M150 HydrophobicContact CG1-SD 4.43Å; V138-M150 WeakPolarHBondContact O-CE 3.31Å; V138-A158 HydrophobicContact CG1-CB 3.57Å; V138-D159 VanDerWaalsContact CG2-O 3.25Å; V138-D159 WeakPolarHBondContact CG2-O 3.15Å; V138-A162 HydrophobicContact CG2-CB 4.32Å
139	H	98.5	Very high	97.3	Very high	1 Å²	1	27.5 Å²	27.5	1%	0.005	15%	0.148	C	C	.	.	H	α-helix	trans	-64.5	-42.6	174.4	-58.7	103.4	0	0	0	110.5	L135 T136 A142 W143 A162 M168 F173	L135-H139 HydrophobicContact CD2-CB 3.93Å; T136-H139 PolarHBondContact N-ND1 3.41Å; T136-H139 VanDerWaalsContact N-ND1 3.12Å; T136-H139 WeakPolarHBondContact O-CB 3.5Å; T136-H139 PolarHBondContact O-N 3.39Å; T136-H139 VanDerWaalsContact O-N 3.12Å; T136-H139 PolarHBondContact OG1-CE1 3.19Å; T136-H139 PolarHBondContact OG1-ND1 3.37Å; H139-A142 PolarHBondContact O-N 3.09Å; H139-W143 VanDerWaalsContact O-CB 3.31Å; H139-W143 WeakPolarHBondContact O-CB 3.44Å; H139-W143 PolarHBondContact O-N 3.01Å; H139-A162 PolarHBondContact NE2-O 3.03Å; H139-A162 VanDerWaalsContact NE2-O 3.11Å; H139-M168 PolarHBondContact NE2-O 3.4Å; H139-F173 HydrophobicContact CB-CD2 3.94Å; H139-F173 HydrophobicContact CB-CE2 3.99Å; H139-F173 AromaticContact CD2-CD2 3.58Å; H139-F173 AromaticContact CD2-CE2 3.43Å; H139-F173 VanDerWaalsContact CD2-CE2 3.43Å; H139-F173 WeakPolarHBondContact CD2-CE2 3.42Å; H139-F173 AromaticContact CG-CE2 3.99Å
140	L	98	Very high	97.4	Very high	4 Å²	4	26.6 Å²	26.6	2%	0.021	14%	0.143	C	C	.	.	H	α-helix	trans	-66.7	-38.7	179	-61	-179.2	0	0	0	112.4	W40 H106 V109 L135 T136 V137 V138 W143 S144	W40-L140 HydrophobicContact CH2-CD1 3.82Å; W40-L140 HydrophobicContact CH2-CD2 3.81Å; W40-L140 HydrophobicContact CH2-CG 4.46Å; W40-L140 HydrophobicContact CZ3-CD1 4.36Å; W40-L140 HydrophobicContact CZ3-CD2 3.91Å; H106-L140 HydrophobicContact CB-CD1 3.84Å; H106-L140 WeakPolarHBondContact O-CD1 3.29Å; V109-L140 HydrophobicContact CG1-CB 3.76Å; L135-L140 HydrophobicContact CD1-CD2 4.44Å; T136-L140 PolarHBondContact O-N 3.46Å; V137-L140 PolarHBondContact O-N 3.14Å; V138-L140 VanDerWaalsContact C-N 3.33Å; L140-W143 PolarHBondContact O-N 3.31Å; L140-S144 VanDerWaalsContact O-CB 3.31Å; L140-S144 WeakPolarHBondContact O-CB 3.17Å; L140-S144 PolarHBondContact O-N 2.54Å; L140-S144 PolarHBondContact O-OG 3.48Å; L140-S144 VanDerWaalsContact O-OG 3.11Å
141	A	98.3	Very high	97.4	Very high	0 Å²	0	28.4 Å²	28.4	0%	0	15%	0.147	C	C	.	.	H	α-helix	trans	-66.9	-41.2	174.9	0	0	0	0	0	111.7	V109 V137 V138 W143 S144 G145 V149 M150 L153	V109-A141 HydrophobicContact CG1-CB 3.86Å; V137-A141 WeakPolarHBondContact O-CB 3.4Å; V137-A141 PolarHBondContact O-N 3.25Å; V138-A141 PolarHBondContact O-N 3.14Å; A141-W143 VanDerWaalsContact C-N 3.33Å; A141-S144 PolarHBondContact O-N 2.9Å; A141-S144 PolarHBondContact O-OG 3.13Å; A141-G145 PolarHBondContact O-N 3.38Å; A141-V149 HydrophobicContact CB-CG1 4.09Å; A141-M150 HydrophobicContact CB-CB 4.37Å; A141-M150 HydrophobicContact CB-CE 3.94Å; A141-M150 HydrophobicContact CB-SD 4.4Å; A141-L153 HydrophobicContact CB-CD1 3.73Å
142	A	98.4	Very high	97.5	Very high	0 Å²	0	29.8 Å²	29.8	0%	0	15%	0.153	C	C	.	.	H	α-helix	trans	-64.4	-37.9	174.8	0	0	0	0	0	112.3	V138 H139 M150 A170 F173 A174 H179 I182	V138-A142 WeakPolarHBondContact O-CB 3.18Å; V138-A142 PolarHBondContact O-N 3.25Å; H139-A142 PolarHBondContact O-N 3.09Å; A142-M150 HydrophobicContact CB-CE 3.81Å; A142-A170 HydrophobicContact CB-CB 4Å; A142-A170 VanDerWaalsContact CB-O 3.26Å; A142-A170 WeakPolarHBondContact CB-O 3.2Å; A142-F173 HydrophobicContact CB-CB 3.99Å; A142-A174 HydrophobicContact CB-CB 4.26Å; A142-H179 PolarHBondContact O-CD2 3.1Å; A142-I182 HydrophobicContact CB-CG2 4.19Å
143	W	96.8	Very high	97.6	Very high	69 Å²	69	24.8 Å²	24.8	26%	0.261	13%	0.131	S	C	.	.	H	α-helix	trans	-73.4	-37.7	176.7	177.9	63.4	0	0	0	113.2	W40 H139 L140 A141 G145 F173 H179	W40-W143 HydrophobicContact CE3-CH2 4.45Å; W40-W143 AromaticContact CE3-CZ3 3.85Å; W40-W143 HydrophobicContact CE3-CZ3 3.85Å; W40-W143 HydrophobicContact CZ3-CZ3 4.09Å; H139-W143 VanDerWaalsContact O-CB 3.31Å; H139-W143 WeakPolarHBondContact O-CB 3.44Å; H139-W143 PolarHBondContact O-N 3.01Å; L140-W143 PolarHBondContact O-N 3.31Å; A141-W143 VanDerWaalsContact C-N 3.33Å; W143-G145 VanDerWaalsContact C-N 3.35Å; W143-F173 HydrophobicContact CB-CB 4.26Å; W143-F173 HydrophobicContact CB-CD1 4.17Å; W143-H179 PolarHBondContact O-CD2 3.4Å; W143-H179 VanDerWaalsContact O-CD2 3.3Å; W143-H179 PolarHBondContact O-NE2 2.9Å
144	S	94.8	Very high	97.7	Very high	32 Å²	32	22 Å²	22	22%	0.224	12%	0.121	C	C	.	.	H	α-helix	trans	-79.1	-18.2	178.9	71	0	0	0	0	113.5	V109 L140 A141	V109-S144 PolarHBondContact O-OG 3.29Å; L140-S144 VanDerWaalsContact O-CB 3.31Å; L140-S144 WeakPolarHBondContact O-CB 3.17Å; L140-S144 PolarHBondContact O-N 2.54Å; L140-S144 PolarHBondContact O-OG 3.48Å; L140-S144 VanDerWaalsContact O-OG 3.11Å; A141-S144 PolarHBondContact O-N 2.9Å; A141-S144 PolarHBondContact O-OG 3.13Å
145	G	94.6	Very high	97.7	Very high	23 Å²	23	30.6 Å²	30.6	24%	0.237	15%	0.154	C	C	.	.	T	Hydrogen-bonded Turn	trans	83.5	6.5	173.6	0	0	0	0	0	115.7	A141 W143 L147 H179	A141-G145 PolarHBondContact O-N 3.38Å; W143-G145 VanDerWaalsContact C-N 3.35Å; G145-L147 PolarHBondContact O-N 3.2Å; G145-L147 VanDerWaalsContact O-N 3.17Å; G145-H179 WeakPolarHBondContact CA-CD2 3.28Å; G145-H179 VanDerWaalsContact CA-CE1 3.42Å; G145-H179 WeakPolarHBondContact CA-CE1 3.31Å; G145-H179 VanDerWaalsContact CA-ND1 3.26Å; G145-H179 WeakPolarHBondContact CA-ND1 3.45Å; G145-H179 WeakPolarHBondContact CA-NE2 3.36Å; G145-H179 PolarHBondContact N-CD2 3.11Å; G145-H179 PolarHBondContact N-NE2 3.25Å
146	S	93.9	Very high	97.7	Very high	10 Å²	10	32.4 Å²	32.4	7%	0.07	17%	0.17	C	C	.	.			trans	-82.5	98.4	-178.1	-175.6	0	0	0	0	111.4	N112 E148 V149 M150	N112-S146 VanDerWaalsContact CG-CB 3.46Å; N112-S146 WeakPolarHBondContact OD1-CB 3.44Å; N112-S146 PolarHBondContact OD1-OG 2.63Å; S146-E148 PolarHBondContact O-N 2.78Å; S146-V149 PolarHBondContact O-N 3.37Å; S146-V149 VanDerWaalsContact OG-CG2 3.3Å; S146-V149 WeakPolarHBondContact OG-CG2 3.27Å; S146-V149 PolarHBondContact OG-N 3.04Å; S146-M150 PolarHBondContact O-N 3.48Å
147	L	97.8	Very high	97.7	Very high	29 Å²	29	34.6 Å²	34.6	15%	0.152	20%	0.195	C	C	.	.	H	α-helix	trans	-59.7	-36.9	175.3	180	62.6	0	0	0	111.7	G145 M150 L151 R181 I182 Y185	G145-L147 PolarHBondContact O-N 3.2Å; G145-L147 VanDerWaalsContact O-N 3.17Å; L147-M150 WeakPolarHBondContact O-CB 3.08Å; L147-M150 PolarHBondContact O-N 3.48Å; L147-L151 HydrophobicContact CD1-CG 4.34Å; L147-L151 HydrophobicContact CG-CD1 4.08Å; L147-L151 HydrophobicContact CG-CG 4.36Å; L147-L151 WeakPolarHBondContact O-CB 3.29Å; L147-L151 VanDerWaalsContact O-CG 3.25Å; L147-L151 WeakPolarHBondContact O-CG 3.31Å; L147-L151 PolarHBondContact O-N 3.33Å; L147-R181 HydrophobicContact CD2-CB 4.28Å; L147-I182 HydrophobicContact CB-CD1 4.09Å; L147-I182 HydrophobicContact CD1-CD1 4.03Å; L147-Y185 HydrophobicContact CD1-CD1 3.89Å; L147-Y185 HydrophobicContact CD1-CD2 4.33Å; L147-Y185 HydrophobicContact CD1-CG 3.65Å
148	E	98.3	Very high	97.7	Very high	119 Å²	119	34.6 Å²	34.6	56%	0.556	20%	0.196	S	C	*	.	H	α-helix	trans	-65	-43.4	178.2	-168.8	170.3	170.9	0	0	111.8	L114 S146 M150 L151 M152	L114-E148 HydrophobicContact CD2-CB 3.94Å; L114-E148 HydrophobicContact CD2-CG 3.65Å; L114-E148 WeakPolarHBondContact CD2-OE1 3.03Å; L114-E148 WeakPolarHBondContact CD2-OE2 3.24Å; S146-E148 PolarHBondContact O-N 2.78Å; E148-M150 VanDerWaalsContact C-N 3.35Å; E148-L151 PolarHBondContact O-N 3.28Å; E148-M152 WeakPolarHBondContact O-CG 3.49Å; E148-M152 PolarHBondContact O-N 3.3Å
149	V	98.4	Very high	97.7	Very high	0 Å²	0	39 Å²	39	0%	0	22%	0.219	C	C	.	.	H	α-helix	trans	-64	-41.6	173	171.9	0	0	0	0	111.2	V109 N112 L114 V117 A141 S146 L151 M152 L153	V109-V149 HydrophobicContact CB-CG1 4.23Å; V109-V149 HydrophobicContact CG1-CG1 3.81Å; V109-V149 HydrophobicContact CG2-CG1 3.86Å; N112-V149 WeakPolarHBondContact OD1-CG2 3.4Å; L114-V149 HydrophobicContact CG-CG2 4.15Å; V117-V149 HydrophobicContact CG1-CG1 4.27Å; V117-V149 HydrophobicContact CG2-CG1 4.31Å; V117-V149 HydrophobicContact CG2-CG2 4.33Å; A141-V149 HydrophobicContact CB-CG1 4.09Å; S146-V149 PolarHBondContact O-N 3.37Å; S146-V149 VanDerWaalsContact OG-CG2 3.3Å; S146-V149 WeakPolarHBondContact OG-CG2 3.27Å; S146-V149 PolarHBondContact OG-N 3.04Å; V149-L151 VanDerWaalsContact C-N 3.34Å; V149-L151 PolarHBondContact O-N 3.45Å; V149-M152 HydrophobicContact CB-CE 4.25Å; V149-M152 HydrophobicContact CG2-CE 3.74Å; V149-M152 PolarHBondContact O-N 3.36Å; V149-L153 HydrophobicContact CG1-CD1 3.91Å; V149-L153 HydrophobicContact CG1-CG 4.22Å; V149-L153 WeakPolarHBondContact O-CB 3.49Å; V149-L153 VanDerWaalsContact O-CG 3.24Å; V149-L153 WeakPolarHBondContact O-CG 2.81Å; V149-L153 PolarHBondContact O-N 3.11Å
150	M	98.6	Very high	97.6	Very high	1 Å²	1	40.6 Å²	40.6	1%	0.005	23%	0.227	C	C	.	.	H	α-helix	trans	-57.7	-46.6	174.8	-177.1	64	78.8	0	0	111.6	V138 A141 A142 S146 L147 E148 M152 L153 V154 I182 Y185	V138-M150 HydrophobicContact CG1-SD 4.43Å; V138-M150 WeakPolarHBondContact O-CE 3.31Å; A141-M150 HydrophobicContact CB-CB 4.37Å; A141-M150 HydrophobicContact CB-CE 3.94Å; A141-M150 HydrophobicContact CB-SD 4.4Å; A142-M150 HydrophobicContact CB-CE 3.81Å; S146-M150 PolarHBondContact O-N 3.48Å; L147-M150 WeakPolarHBondContact O-CB 3.08Å; L147-M150 PolarHBondContact O-N 3.48Å; E148-M150 VanDerWaalsContact C-N 3.35Å; M150-M152 PolarHBondContact O-N 3.11Å; M150-L153 PolarHBondContact O-N 3.07Å; M150-V154 HydrophobicContact CG-CG2 4.48Å; M150-V154 WeakPolarHBondContact O-CG2 3.44Å; M150-V154 PolarHBondContact O-N 2.96Å; M150-V154 HydrophobicContact SD-CG2 4.3Å; M150-I182 HydrophobicContact CB-CD1 3.67Å; M150-I182 HydrophobicContact CE-CD1 4.28Å; M150-I182 HydrophobicContact CE-CG2 3.9Å; M150-I182 HydrophobicContact CG-CD1 4.07Å; M150-Y185 HydrophobicContact CG-CD1 3.95Å; M150-Y185 HydrophobicContact CG-CE1 3.94Å
151	L	98.6	Very high	97.6	Very high	76 Å²	76	46.1 Å²	46.1	40%	0.398	25%	0.247	S	C	.	.	H	α-helix	trans	-59.7	-45.2	176.7	-72.5	165.6	0	0	0	111.7	L147 E148 V149 L153 V154 K155 Y185	L147-L151 HydrophobicContact CD1-CG 4.34Å; L147-L151 HydrophobicContact CG-CD1 4.08Å; L147-L151 HydrophobicContact CG-CG 4.36Å; L147-L151 WeakPolarHBondContact O-CB 3.29Å; L147-L151 VanDerWaalsContact O-CG 3.25Å; L147-L151 WeakPolarHBondContact O-CG 3.31Å; L147-L151 PolarHBondContact O-N 3.33Å; E148-L151 PolarHBondContact O-N 3.28Å; V149-L151 VanDerWaalsContact C-N 3.34Å; V149-L151 PolarHBondContact O-N 3.45Å; L151-L153 VanDerWaalsContact C-N 3.35Å; L151-L153 PolarHBondContact O-N 2.95Å; L151-V154 PolarHBondContact O-N 3.41Å; L151-K155 WeakPolarHBondContact O-CB 3.37Å; L151-K155 PolarHBondContact O-N 3.22Å; L151-Y185 HydrophobicContact CD2-CD2 4.06Å; L151-Y185 HydrophobicContact CD2-CE1 4.14Å; L151-Y185 HydrophobicContact CD2-CE2 3.38Å; L151-Y185 VanDerWaalsContact CD2-CZ 3.42Å
152	M	98.5	Very high	97.6	Very high	35 Å²	35	46.8 Å²	46.8	17%	0.172	25%	0.253	C	S	.	.	H	α-helix	trans	-59.5	-44.5	175.8	-72.4	-169.6	-73.1	0	0	112	L114 V117 D118 L121 E148 V149 M150 K155 A156	L114-M152 HydrophobicContact CB-CE 4.35Å; L114-M152 HydrophobicContact CG-CE 4.34Å; V117-M152 HydrophobicContact CB-CE 4.1Å; V117-M152 HydrophobicContact CG1-CE 3.77Å; V117-M152 HydrophobicContact CG1-SD 4.32Å; D118-M152 HydrophobicContact CB-SD 4.16Å; L121-M152 HydrophobicContact CD1-CB 3.8Å; E148-M152 WeakPolarHBondContact O-CG 3.49Å; E148-M152 PolarHBondContact O-N 3.3Å; V149-M152 HydrophobicContact CB-CE 4.25Å; V149-M152 HydrophobicContact CG2-CE 3.74Å; V149-M152 PolarHBondContact O-N 3.36Å; M150-M152 PolarHBondContact O-N 3.11Å; M152-K155 PolarHBondContact O-N 3.3Å; M152-A156 WeakPolarHBondContact O-CB 3.47Å; M152-A156 PolarHBondContact O-N 3.27Å
153	L	98.6	Very high	97.6	Very high	0 Å²	0	52.3 Å²	52.3	0%	0	28%	0.277	C	S	.	.	H	α-helix	trans	-67.3	-43.1	179.7	-68.4	174.7	0	0	0	112.4	L105 V109 L121 V127 V137 A141 V149 M150 L151 A156 G157 A158	L105-L153 HydrophobicContact CD2-CD2 4.28Å; V109-L153 HydrophobicContact CG1-CD1 4.1Å; V109-L153 HydrophobicContact CG2-CD1 4.07Å; V109-L153 HydrophobicContact CG2-CD2 4.22Å; L121-L153 HydrophobicContact CD1-CD2 4.33Å; L121-L153 HydrophobicContact CD2-CD2 4.22Å; V127-L153 HydrophobicContact CG1-CD2 4.12Å; V137-L153 HydrophobicContact CB-CD1 3.92Å; V137-L153 HydrophobicContact CB-CD2 4.13Å; V137-L153 HydrophobicContact CG2-CD1 3.96Å; V137-L153 HydrophobicContact CG2-CD2 3.7Å; V137-L153 HydrophobicContact CG2-CG 4.38Å; V137-L153 WeakPolarHBondContact O-CD1 3.33Å; A141-L153 HydrophobicContact CB-CD1 3.73Å; V149-L153 HydrophobicContact CG1-CD1 3.91Å; V149-L153 HydrophobicContact CG1-CG 4.22Å; V149-L153 WeakPolarHBondContact O-CB 3.49Å; V149-L153 VanDerWaalsContact O-CG 3.24Å; V149-L153 WeakPolarHBondContact O-CG 2.81Å; V149-L153 PolarHBondContact O-N 3.11Å; M150-L153 PolarHBondContact O-N 3.07Å; L151-L153 VanDerWaalsContact C-N 3.35Å; L151-L153 PolarHBondContact O-N 2.95Å; L153-A156 CarbonylContact O-C 3.6Å; L153-A156 WeakPolarHBondContact O-CA 3.42Å; L153-A156 PolarHBondContact O-N 3.45Å; L153-A156 VanDerWaalsContact O-N 3.14Å; L153-G157 PolarHBondContact O-N 3.32Å; L153-A158 HydrophobicContact CB-CB 3.99Å; L153-A158 WeakPolarHBondContact O-CB 3.41Å; L153-A158 PolarHBondContact O-N 2.66Å
154	V	98.3	Very high	97.6	Very high	27 Å²	27	49.8 Å²	49.8	16%	0.164	27%	0.268	C	S	.	.	H	α-helix	trans	-62.2	-44	175.9	170.6	0	0	0	0	110.6	M150 L151 A156 G157 Q160 Y185 L190	M150-V154 HydrophobicContact CG-CG2 4.48Å; M150-V154 WeakPolarHBondContact O-CG2 3.44Å; M150-V154 PolarHBondContact O-N 2.96Å; M150-V154 HydrophobicContact SD-CG2 4.3Å; L151-V154 PolarHBondContact O-N 3.41Å; V154-A156 PolarHBondContact O-N 2.89Å; V154-G157 PolarHBondContact O-N 3.22Å; V154-Q160 HydrophobicContact CG2-CG 3.76Å; V154-Y185 HydrophobicContact CG2-CE1 4.12Å; V154-L190 HydrophobicContact CG1-CD1 4.38Å; V154-L190 HydrophobicContact CG1-CD2 4.45Å; V154-L190 HydrophobicContact CG2-CD1 4.26Å
155	K	98.1	Very high	97.8	Very high	194 Å²	194	54.4 Å²	54.4	84%	0.843	29%	0.286	S	S	*	.	H	α-helix	trans	-61.9	-31.2	174.5	-176.1	174.5	177.1	178.1	0	112.6	L151 M152 G157	L151-K155 WeakPolarHBondContact O-CB 3.37Å; L151-K155 PolarHBondContact O-N 3.22Å; M152-K155 PolarHBondContact O-N 3.3Å; K155-G157 PolarHBondContact O-N 3.17Å
156	A	98.2	Very high	97.9	Very high	46 Å²	46	56.7 Å²	56.7	38%	0.38	29%	0.293	S	S	.	.	T	Hydrogen-bonded Turn	trans	-80.6	2.6	174.4	0	0	0	0	0	114	L121 V127 M152 L153 V154	L121-A156 HydrophobicContact CD1-CB 4.19Å; L121-A156 HydrophobicContact CD2-CB 3.78Å; L121-A156 HydrophobicContact CG-CB 4.45Å; V127-A156 HydrophobicContact CG1-CB 4.16Å; M152-A156 WeakPolarHBondContact O-CB 3.47Å; M152-A156 PolarHBondContact O-N 3.27Å; L153-A156 CarbonylContact O-C 3.6Å; L153-A156 WeakPolarHBondContact O-CA 3.42Å; L153-A156 PolarHBondContact O-N 3.45Å; L153-A156 VanDerWaalsContact O-N 3.14Å; V154-A156 PolarHBondContact O-N 2.89Å
157	G	97.8	Very high	98.1	Very high	59 Å²	59	56.5 Å²	56.5	61%	0.608	29%	0.293	S	S	*	.	T	Hydrogen-bonded Turn	trans	84.6	20.8	175.9	0	0	0	0	0	114.8	L153 V154 K155 D159	L153-G157 PolarHBondContact O-N 3.32Å; V154-G157 PolarHBondContact O-N 3.22Å; K155-G157 PolarHBondContact O-N 3.17Å; G157-D159 PolarHBondContact O-N 3.47Å
158	A	98.1	Very high	98.2	Very high	1 Å²	1	55.6 Å²	55.6	1%	0.008	29%	0.288	C	S	.	.			trans	-67	126.9	177.6	0	0	0	0	0	111	V127 V137 V138 L153 Q160	V127-A158 HydrophobicContact CB-CB 3.74Å; V127-A158 HydrophobicContact CG1-CB 4.4Å; V127-A158 HydrophobicContact CG2-CB 3.86Å; V137-A158 HydrophobicContact CG2-CB 4.49Å; V138-A158 HydrophobicContact CG1-CB 3.57Å; L153-A158 HydrophobicContact CB-CB 3.99Å; L153-A158 WeakPolarHBondContact O-CB 3.41Å; L153-A158 PolarHBondContact O-N 2.66Å; A158-Q160 PolarHBondContact O-N 3.45Å; A158-Q160 PolarHBondContact O-NE2 3.21Å
159	D	98.1	Very high	98.2	Very high	92 Å²	92	50 Å²	50	49%	0.492	26%	0.262	S	S	.	.			trans	-63.5	115.2	-178.9	177	18.4	0	0	0	112	V138 G157 R161 A162	V138-D159 VanDerWaalsContact CG2-O 3.25Å; V138-D159 WeakPolarHBondContact CG2-O 3.15Å; G157-D159 PolarHBondContact O-N 3.47Å; D159-R161 VanDerWaalsContact C-N 3.3Å; D159-R161 WeakPolarHBondContact OD1-CB 3.3Å; D159-R161 PolarHBondContact OD1-N 2.97Å; D159-A162 PolarHBondContact OD2-N 3.18Å
160	Q	97.6	Very high	98.2	Very high	36 Å²	36	50 Å²	50	17%	0.168	26%	0.262	C	S	.	.	T	Hydrogen-bonded Turn	trans	-79	-14.1	-179.7	-50.9	89.9	35.5	0	0	113.2	V154 A158 L190 L192	V154-Q160 HydrophobicContact CG2-CG 3.76Å; A158-Q160 PolarHBondContact O-N 3.45Å; A158-Q160 PolarHBondContact O-NE2 3.21Å; Q160-L190 HydrophobicContact CG-CD1 4.17Å; Q160-L192 HydrophobicContact CB-CD1 3.66Å; Q160-L192 HydrophobicContact CG-CD1 4.3Å
161	R	97.9	Very high	98.2	Very high	119 Å²	119	50 Å²	50	45%	0.449	26%	0.262	S	S	.	.	T	Hydrogen-bonded Turn	trans	-94.3	1.5	178.7	-67.5	-175.7	165.8	84.2	4.6	113.3	D159 D194 L195	D159-R161 VanDerWaalsContact C-N 3.3Å; D159-R161 WeakPolarHBondContact OD1-CB 3.3Å; D159-R161 PolarHBondContact OD1-N 2.97Å; R161-D194 IonicContact CZ-OD1 3.03Å; R161-D194 IonicContact CZ-OD2 3.25Å; R161-D194 IonicContact NE-OD1 2.86Å; R161-D194 IonicContact NE-OD2 3.62Å; R161-D194 PolarHBondContact NE-OD2 3.41Å; R161-D194 IonicContact NH2-OD1 3.91Å; R161-D194 PolarHBondContact NH2-OD1 3.3Å; R161-D194 IonicContact NH2-OD2 2.83Å; R161-D194 PolarHBondContact NH2-OD2 2.92Å; R161-L195 HydrophobicContact CG-CD2 4.15Å
162	A	97.6	Very high	98.2	Very high	15 Å²	15	46.4 Å²	46.4	12%	0.124	24%	0.244	C	C	.	.			trans	-52.9	143.5	174.9	0	0	0	0	0	110.9	T136 V138 H139 D159 N169	T136-A162 HydrophobicContact CG2-CB 4.25Å; V138-A162 HydrophobicContact CG2-CB 4.32Å; H139-A162 PolarHBondContact NE2-O 3.03Å; H139-A162 VanDerWaalsContact NE2-O 3.11Å; D159-A162 PolarHBondContact OD2-N 3.18Å; A162-N169 WeakPolarHBondContact O-CA 3.32Å; A162-N169 WeakPolarHBondContact O-CB 3.5Å
163	K	98.3	Very high	98.2	Very high	116 Å²	116	45.6 Å²	45.6	50%	0.504	24%	0.239	S	C	.	.			trans	-123.1	144.3	174.2	-68.2	-177.1	177.1	-171.4	0	109.7	M168 N169	K163-M168 CarbonylContact C-O 3.36Å; K163-M168 WeakPolarHBondContact CA-O 3.44Å; K163-N169 HydrophobicContact CG-CB 4.28Å
164	N	98.3	Very high	98.2	Very high	15 Å²	15	45.6 Å²	45.6	8%	0.08	24%	0.239	C	C	.	.			trans	-81	-177.7	170.4	85.5	-23.8	0	0	0	111.4	H133 G134 L135 D166 G167 M168	H133-N164 WeakPolarHBondContact O-CB 3.44Å; G134-N164 WeakPolarHBondContact O-CA 3.47Å; L135-N164 HydrophobicContact CD2-CB 3.83Å; N164-D166 PolarHBondContact ND2-OD2 2.99Å; N164-D166 PolarHBondContact O-N 3.31Å; N164-D166 WeakPolarHBondContact OD1-CA 3.32Å; N164-D166 PolarHBondContact OD1-N 2.84Å; N164-G167 PolarHBondContact O-N 3.47Å; N164-G167 PolarHBondContact OD1-N 2.9Å; N164-M168 PolarHBondContact N-O 3.26Å; N164-M168 WeakPolarHBondContact OD1-CA 3.17Å; N164-M168 WeakPolarHBondContact OD1-CB 3.45Å; N164-M168 PolarHBondContact OD1-N 3.31Å; N164-M168 PolarHBondContact OD1-O 3.15Å
165	Q	97.9	Very high	98.2	Very high	129 Å²	129	44.3 Å²	44.3	60%	0.603	23%	0.231	S	C	*	.	T	Hydrogen-bonded Turn	trans	-64.2	-21.5	178.8	-74	172.6	-2.3	0	0	114.5	K132 H133 G167	K132-Q165 PolarHBondContact O-NE2 2.96Å; K132-Q165 PolarHBondContact O-OE1 3.42Å; H133-Q165 WeakPolarHBondContact O-CB 3.31Å; H133-Q165 WeakPolarHBondContact O-CG 3.37Å; H133-Q165 PolarHBondContact O-N 3.37Å; Q165-G167 VanDerWaalsContact C-N 3.27Å
166	D	97.3	Very high	98.2	Very high	71 Å²	71	36.6 Å²	36.6	38%	0.38	20%	0.198	S	C	.	.	T	Hydrogen-bonded Turn	trans	-89.7	9	174.2	-58.2	-59.5	0	0	0	111.9	N164 M168 D199 E200	N164-D166 PolarHBondContact ND2-OD2 2.99Å; N164-D166 PolarHBondContact O-N 3.31Å; N164-D166 WeakPolarHBondContact OD1-CA 3.32Å; N164-D166 PolarHBondContact OD1-N 2.84Å; D166-M168 HydrophobicContact CB-CG 4.23Å; D166-M168 HydrophobicContact CB-SD 4.48Å; D166-M168 PolarHBondContact O-N 3.31Å; D166-D199 WeakPolarHBondContact O-CB 3.45Å; D166-E200 VanDerWaalsContact C-CG 3.41Å; D166-E200 VanDerWaalsContact O-CB 3.3Å; D166-E200 WeakPolarHBondContact O-CB 3.36Å; D166-E200 WeakPolarHBondContact O-CG 3.34Å; D166-E200 PolarHBondContact O-N 2.92Å
167	G	98.1	Very high	98.2	Very high	7 Å²	7	35.8 Å²	35.8	7%	0.072	19%	0.19	C	C	.	.	S	Bend	trans	72.9	4.3	-177.8	0	0	0	0	0	114.7	N164 Q165	N164-G167 PolarHBondContact O-N 3.47Å; N164-G167 PolarHBondContact OD1-N 2.9Å; Q165-G167 VanDerWaalsContact C-N 3.27Å
168	M	98.8	Very high	98.2	Very high	9 Å²	9	35.1 Å²	35.1	4%	0.044	17%	0.172	C	C	.	.			trans	-75.9	133.8	178.9	-62.5	178.1	69	0	0	110.6	H139 K163 N164 D166 H172 F173 D199 L208	H139-M168 PolarHBondContact NE2-O 3.4Å; K163-M168 CarbonylContact C-O 3.36Å; K163-M168 WeakPolarHBondContact CA-O 3.44Å; N164-M168 PolarHBondContact N-O 3.26Å; N164-M168 WeakPolarHBondContact OD1-CA 3.17Å; N164-M168 WeakPolarHBondContact OD1-CB 3.45Å; N164-M168 PolarHBondContact OD1-N 3.31Å; N164-M168 PolarHBondContact OD1-O 3.15Å; D166-M168 HydrophobicContact CB-CG 4.23Å; D166-M168 HydrophobicContact CB-SD 4.48Å; D166-M168 PolarHBondContact O-N 3.31Å; M168-H172 HydrophobicContact CB-CB 3.93Å; M168-H172 HydrophobicContact CE-CB 3.71Å; M168-H172 HydrophobicContact CG-CB 4.22Å; M168-F173 HydrophobicContact CB-CD2 4.32Å; M168-F173 HydrophobicContact CB-CE2 3.64Å; M168-F173 HydrophobicContact CB-CZ 4.13Å; M168-F173 HydrophobicContact CE-CD1 4.42Å; M168-F173 HydrophobicContact CE-CE1 4.25Å; M168-F173 HydrophobicContact CE-CE2 4.33Å; M168-F173 HydrophobicContact CE-CZ 4.18Å; M168-F173 HydrophobicContact SD-CZ 4.24Å; M168-D199 HydrophobicContact CG-CB 3.85Å; M168-L208 HydrophobicContact CE-CD1 3.75Å
169	N	98.6	Very high	98.3	Very high	3 Å²	3	37.4 Å²	37.4	2%	0.016	18%	0.183	C	C	.	.			trans	-106.6	-179.2	172.1	63.8	32.3	0	0	0	111.3	A162 K163 L171 H172 F173 L195	A162-N169 WeakPolarHBondContact O-CA 3.32Å; A162-N169 WeakPolarHBondContact O-CB 3.5Å; K163-N169 HydrophobicContact CG-CB 4.28Å; N169-L171 VanDerWaalsContact C-N 3.25Å; N169-L171 PolarHBondContact O-N 3.31Å; N169-L171 WeakPolarHBondContact OD1-CB 3.14Å; N169-L171 PolarHBondContact OD1-N 3.35Å; N169-H172 VanDerWaalsContact CG-ND1 3.28Å; N169-H172 PolarHBondContact N-ND1 3.37Å; N169-H172 WeakPolarHBondContact O-CB 3.46Å; N169-H172 PolarHBondContact O-N 3.42Å; N169-H172 PolarHBondContact OD1-N 3.31Å; N169-H172 PolarHBondContact OD1-ND1 2.98Å; N169-F173 VanDerWaalsContact O-CD2 3.32Å; N169-F173 WeakPolarHBondContact O-CD2 3.32Å; N169-F173 PolarHBondContact O-N 3.3Å; N169-L195 HydrophobicContact CB-CD2 4.27Å; N169-L195 PolarHBondContact ND2-O 3.1Å
170	A	98.4	Very high	98.3	Very high	0 Å²	0	33.7 Å²	33.7	0%	0	16%	0.163	C	C	.	.	H	α-helix	trans	-53.8	-36.1	-179.9	0	0	0	0	0	114.2	A142 H172 F173 A174 L186	A142-A170 HydrophobicContact CB-CB 4Å; A142-A170 VanDerWaalsContact CB-O 3.26Å; A142-A170 WeakPolarHBondContact CB-O 3.2Å; A170-H172 VanDerWaalsContact C-N 3.33Å; A170-H172 PolarHBondContact O-N 2.85Å; A170-F173 PolarHBondContact O-N 3.47Å; A170-A174 WeakPolarHBondContact O-CB 3.44Å; A170-A174 PolarHBondContact O-N 2.92Å; A170-L186 HydrophobicContact CB-CD1 3.94Å
171	L	98.8	Very high	98.3	Very high	0 Å²	0	39.9 Å²	39.9	0%	0	19%	0.185	C	C	.	.	H	α-helix	trans	-65.3	-37	178.5	-174.4	65.2	0	0	0	111.9	N169 A175 V183 L186 I187 L195 N196 P205	N169-L171 VanDerWaalsContact C-N 3.25Å; N169-L171 PolarHBondContact O-N 3.31Å; N169-L171 WeakPolarHBondContact OD1-CB 3.14Å; N169-L171 PolarHBondContact OD1-N 3.35Å; L171-A175 VanDerWaalsContact O-CB 3.32Å; L171-A175 WeakPolarHBondContact O-CB 3.36Å; L171-A175 PolarHBondContact O-N 3.04Å; L171-V183 HydrophobicContact CD1-CB 4.28Å; L171-V183 HydrophobicContact CD1-CG1 3.88Å; L171-V183 HydrophobicContact CD1-CG2 3.95Å; L171-L186 HydrophobicContact CB-CD1 4.4Å; L171-I187 HydrophobicContact CD1-CD1 4.13Å; L171-I187 HydrophobicContact CD1-CG1 4.06Å; L171-I187 HydrophobicContact CD2-CD1 3.95Å; L171-L195 HydrophobicContact CB-CB 3.9Å; L171-L195 HydrophobicContact CB-CD1 4.3Å; L171-L195 HydrophobicContact CD2-CB 3.83Å; L171-N196 HydrophobicContact CD2-CB 4.2Å; L171-P205 HydrophobicContact CB-CG 4.25Å; L171-P205 HydrophobicContact CD2-CB 4.44Å; L171-P205 HydrophobicContact CD2-CG 3.79Å; L171-P205 HydrophobicContact CG-CB 4.06Å; L171-P205 HydrophobicContact CG-CG 3.69Å
172	H	98.9	Very high	98.4	Very high	1 Å²	1	34.2 Å²	34.2	1%	0.005	16%	0.164	C	C	.	.	H	α-helix	trans	-63.9	-46.2	175.5	-66.7	81.3	0	0	0	111.9	M168 N169 A170 A175 Q176 Q197 R203 L208	M168-H172 HydrophobicContact CB-CB 3.93Å; M168-H172 HydrophobicContact CE-CB 3.71Å; M168-H172 HydrophobicContact CG-CB 4.22Å; N169-H172 VanDerWaalsContact CG-ND1 3.28Å; N169-H172 PolarHBondContact N-ND1 3.37Å; N169-H172 WeakPolarHBondContact O-CB 3.46Å; N169-H172 PolarHBondContact O-N 3.42Å; N169-H172 PolarHBondContact OD1-N 3.31Å; N169-H172 PolarHBondContact OD1-ND1 2.98Å; A170-H172 VanDerWaalsContact C-N 3.33Å; A170-H172 PolarHBondContact O-N 2.85Å; H172-A175 PolarHBondContact O-N 2.81Å; H172-Q176 VanDerWaalsContact O-CB 3.22Å; H172-Q176 WeakPolarHBondContact O-CB 3.45Å; H172-Q176 PolarHBondContact O-N 3.06Å; H172-Q197 PolarHBondContact CE1-O 3.3Å; H172-Q197 PolarHBondContact NE2-O 3.23Å; H172-R203 PolarHBondContact NE2-O 3.34Å; H172-L208 HydrophobicContact CB-CD1 3.78Å
173	F	98.6	Very high	98.4	Very high	17 Å²	17	33.5 Å²	33.5	8%	0.075	16%	0.158	C	C	.	.	H	α-helix	trans	-65.6	-42.5	179.2	-75.1	-81	0	0	0	111.8	L135 H139 A142 W143 M168 N169 A170 Q176 S177	L135-F173 HydrophobicContact CD2-CE1 4.04Å; L135-F173 HydrophobicContact CD2-CE2 3.92Å; L135-F173 HydrophobicContact CD2-CZ 3.38Å; H139-F173 HydrophobicContact CB-CD2 3.94Å; H139-F173 HydrophobicContact CB-CE2 3.99Å; H139-F173 AromaticContact CD2-CD2 3.58Å; H139-F173 AromaticContact CD2-CE2 3.43Å; H139-F173 VanDerWaalsContact CD2-CE2 3.43Å; H139-F173 WeakPolarHBondContact CD2-CE2 3.42Å; H139-F173 AromaticContact CG-CE2 3.99Å; A142-F173 HydrophobicContact CB-CB 3.99Å; W143-F173 HydrophobicContact CB-CB 4.26Å; W143-F173 HydrophobicContact CB-CD1 4.17Å; M168-F173 HydrophobicContact CB-CD2 4.32Å; M168-F173 HydrophobicContact CB-CE2 3.64Å; M168-F173 HydrophobicContact CB-CZ 4.13Å; M168-F173 HydrophobicContact CE-CD1 4.42Å; M168-F173 HydrophobicContact CE-CE1 4.25Å; M168-F173 HydrophobicContact CE-CE2 4.33Å; M168-F173 HydrophobicContact CE-CZ 4.18Å; M168-F173 HydrophobicContact SD-CZ 4.24Å; N169-F173 VanDerWaalsContact O-CD2 3.32Å; N169-F173 WeakPolarHBondContact O-CD2 3.32Å; N169-F173 PolarHBondContact O-N 3.3Å; A170-F173 PolarHBondContact O-N 3.47Å; F173-Q176 PolarHBondContact O-N 3.42Å; F173-S177 WeakPolarHBondContact O-CB 3.48Å; F173-S177 PolarHBondContact O-N 3.3Å; F173-S177 VanDerWaalsContact O-N 3.07Å; F173-S177 PolarHBondContact O-OG 2.83Å
174	A	98.8	Very high	98.4	Very high	0 Å²	0	30.4 Å²	30.4	0%	0	15%	0.145	C	C	.	.	H	α-helix	trans	-62.2	-45.1	176.6	0	0	0	0	0	111.7	A142 A170 S177 N178 H179 I182 V183	A142-A174 HydrophobicContact CB-CB 4.26Å; A170-A174 WeakPolarHBondContact O-CB 3.44Å; A170-A174 PolarHBondContact O-N 2.92Å; A174-S177 CarbonylContact O-C 3.58Å; A174-S177 PolarHBondContact O-N 3.22Å; A174-N178 PolarHBondContact O-N 3.1Å; A174-N178 VanDerWaalsContact O-N 3.11Å; A174-H179 HydrophobicContact CB-CB 4.42Å; A174-H179 PolarHBondContact O-N 3.35Å; A174-I182 HydrophobicContact CB-CB 3.95Å; A174-I182 HydrophobicContact CB-CG2 3.68Å; A174-V183 HydrophobicContact CB-CG2 3.7Å
175	A	98.8	Very high	98.5	Very high	0 Å²	0	30.8 Å²	30.8	0%	0	15%	0.146	C	C	.	.	H	α-helix	trans	-64.8	-44.7	177.3	0	0	0	0	0	112.5	L171 H172 S177 N178 P205 M217 L221	L171-A175 VanDerWaalsContact O-CB 3.32Å; L171-A175 WeakPolarHBondContact O-CB 3.36Å; L171-A175 PolarHBondContact O-N 3.04Å; H172-A175 PolarHBondContact O-N 2.81Å; A175-S177 PolarHBondContact O-N 3.35Å; A175-N178 PolarHBondContact O-N 3.25Å; A175-P205 HydrophobicContact CB-CB 3.67Å; A175-P205 WeakPolarHBondContact CB-O 3.4Å; A175-M217 HydrophobicContact CB-CG 4.12Å; A175-M217 HydrophobicContact CB-SD 4.26Å; A175-L221 HydrophobicContact CB-CD1 4.18Å
176	Q	98.4	Very high	98.5	Very high	32 Å²	32	24.7 Å²	24.7	15%	0.15	12%	0.117	C	C	.	.	H	α-helix	trans	-63.4	-23.4	177.7	-176.5	176.3	78.1	0	0	113.1	H172 F173 L208 R212 H214	H172-Q176 VanDerWaalsContact O-CB 3.22Å; H172-Q176 WeakPolarHBondContact O-CB 3.45Å; H172-Q176 PolarHBondContact O-N 3.06Å; F173-Q176 PolarHBondContact O-N 3.42Å; Q176-L208 HydrophobicContact CB-CB 4.19Å; Q176-L208 HydrophobicContact CB-CD1 4.4Å; Q176-R212 HydrophobicContact CG-CG 4.03Å; Q176-H214 PolarHBondContact O-NE2 2.98Å; Q176-H214 VanDerWaalsContact O-NE2 3.16Å
177	S	97.8	Very high	98.6	Very high	30 Å²	30	21.4 Å²	21.4	21%	0.21	10%	0.1	C	C	.	.	T	Hydrogen-bonded Turn	trans	-112.4	14.2	-178.1	-62.8	0	0	0	0	114	F173 A174 A175 H179	F173-S177 WeakPolarHBondContact O-CB 3.48Å; F173-S177 PolarHBondContact O-N 3.3Å; F173-S177 VanDerWaalsContact O-N 3.07Å; F173-S177 PolarHBondContact O-OG 2.83Å; A174-S177 CarbonylContact O-C 3.58Å; A174-S177 PolarHBondContact O-N 3.22Å; A175-S177 PolarHBondContact O-N 3.35Å; S177-H179 VanDerWaalsContact C-N 3.28Å; S177-H179 WeakPolarHBondContact CB-CD2 3.46Å; S177-H179 WeakPolarHBondContact CB-NE2 3.17Å; S177-H179 PolarHBondContact O-N 2.87Å; S177-H179 PolarHBondContact O-NE2 3.13Å
178	N	98.4	Very high	98.5	Very high	44 Å²	44	24.9 Å²	24.9	24%	0.235	11%	0.114	C	C	.	.	T	Hydrogen-bonded Turn	trans	58.1	30.1	179.1	-159.3	50.3	0	0	0	115.1	A174 A175 V180 H214 E216 M217	A174-N178 PolarHBondContact O-N 3.1Å; A174-N178 VanDerWaalsContact O-N 3.11Å; A175-N178 PolarHBondContact O-N 3.25Å; N178-V180 VanDerWaalsContact C-N 3.34Å; N178-V180 PolarHBondContact O-N 3.28Å; N178-H214 HydrophobicContact CB-CB 4.13Å; N178-H214 WeakPolarHBondContact OD1-CB 3.21Å; N178-E216 PolarHBondContact ND2-OE2 2.89Å; N178-M217 VanDerWaalsContact OD1-CB 3.26Å; N178-M217 WeakPolarHBondContact OD1-CB 3.44Å; N178-M217 PolarHBondContact OD1-N 2.9Å
179	H	98.6	Very high	98.5	Very high	50 Å²	50	29.6 Å²	29.6	23%	0.231	14%	0.139	C	C	.	.			trans	-89.2	71.8	-178.5	-64.3	-51.8	0	0	0	111.7	A142 W143 G145 A174 S177 R181 I182 V183	A142-H179 PolarHBondContact O-CD2 3.1Å; W143-H179 PolarHBondContact O-CD2 3.4Å; W143-H179 VanDerWaalsContact O-CD2 3.3Å; W143-H179 PolarHBondContact O-NE2 2.9Å; G145-H179 WeakPolarHBondContact CA-CD2 3.28Å; G145-H179 VanDerWaalsContact CA-CE1 3.42Å; G145-H179 WeakPolarHBondContact CA-CE1 3.31Å; G145-H179 VanDerWaalsContact CA-ND1 3.26Å; G145-H179 WeakPolarHBondContact CA-ND1 3.45Å; G145-H179 WeakPolarHBondContact CA-NE2 3.36Å; G145-H179 PolarHBondContact N-CD2 3.11Å; G145-H179 PolarHBondContact N-NE2 3.25Å; A174-H179 HydrophobicContact CB-CB 4.42Å; A174-H179 PolarHBondContact O-N 3.35Å; S177-H179 VanDerWaalsContact C-N 3.28Å; S177-H179 WeakPolarHBondContact CB-CD2 3.46Å; S177-H179 WeakPolarHBondContact CB-NE2 3.17Å; S177-H179 PolarHBondContact O-N 2.87Å; S177-H179 PolarHBondContact O-NE2 3.13Å; H179-R181 VanDerWaalsContact C-N 3.29Å; H179-R181 PolarHBondContact O-N 3.45Å; H179-I182 HydrophobicContact CB-CB 4.27Å; H179-I182 HydrophobicContact CB-CG1 4.04Å; H179-I182 WeakPolarHBondContact O-CB 3.32Å; H179-I182 PolarHBondContact O-N 3.07Å; H179-V183 PolarHBondContact O-N 3.03Å
180	V	98.6	Very high	98.5	Very high	13 Å²	13	31.7 Å²	31.7	8%	0.079	15%	0.15	C	C	.	.	H	α-helix	trans	-51.5	-43.6	-175.1	165.1	0	0	0	0	112.9	N178 I182 V183 E184 E216 M217 K220	N178-V180 VanDerWaalsContact C-N 3.34Å; N178-V180 PolarHBondContact O-N 3.28Å; V180-I182 VanDerWaalsContact C-N 3.28Å; V180-I182 PolarHBondContact O-N 3.25Å; V180-V183 WeakPolarHBondContact O-CA 3.36Å; V180-V183 WeakPolarHBondContact O-CB 3.28Å; V180-V183 PolarHBondContact O-N 3.32Å; V180-E184 HydrophobicContact CG1-CG 4.36Å; V180-E184 WeakPolarHBondContact O-CG 3.35Å; V180-E184 PolarHBondContact O-N 3.03Å; V180-E216 HydrophobicContact CG2-CG 3.94Å; V180-M217 HydrophobicContact CB-CE 4.34Å; V180-M217 HydrophobicContact CG2-CE 3.72Å; V180-M217 HydrophobicContact CG2-SD 4.41Å; V180-K220 HydrophobicContact CG1-CB 4.39Å; V180-K220 HydrophobicContact CG1-CD 4.12Å; V180-K220 HydrophobicContact CG1-CG 3.91Å; V180-K220 HydrophobicContact CG2-CB 4.4Å
181	R	98.6	Very high	98.5	Very high	167 Å²	167	38.8 Å²	38.8	63%	0.63	18%	0.183	S	C	*	.	H	α-helix	trans	-63.8	-31.9	-179.5	-64.6	-175.6	67.3	-166.4	1.8	113.3	L147 H179 Y185	L147-R181 HydrophobicContact CD2-CB 4.28Å; H179-R181 VanDerWaalsContact C-N 3.29Å; H179-R181 PolarHBondContact O-N 3.45Å; R181-Y185 WeakPolarHBondContact O-CB 3.4Å; R181-Y185 PolarHBondContact O-N 3.43Å; R181-Y185 VanDerWaalsContact O-N 3.08Å
182	I	98.7	Very high	98.4	Very high	0 Å²	0	39.1 Å²	39.1	0%	0	19%	0.185	C	C	.	.	H	α-helix	trans	-69.7	-41.8	173.6	-62.7	-69.6	0	0	0	109.7	A142 L147 M150 A174 H179 V180 Y185 L186	A142-I182 HydrophobicContact CB-CG2 4.19Å; L147-I182 HydrophobicContact CB-CD1 4.09Å; L147-I182 HydrophobicContact CD1-CD1 4.03Å; M150-I182 HydrophobicContact CB-CD1 3.67Å; M150-I182 HydrophobicContact CE-CD1 4.28Å; M150-I182 HydrophobicContact CE-CG2 3.9Å; M150-I182 HydrophobicContact CG-CD1 4.07Å; A174-I182 HydrophobicContact CB-CB 3.95Å; A174-I182 HydrophobicContact CB-CG2 3.68Å; H179-I182 HydrophobicContact CB-CB 4.27Å; H179-I182 HydrophobicContact CB-CG1 4.04Å; H179-I182 WeakPolarHBondContact O-CB 3.32Å; H179-I182 PolarHBondContact O-N 3.07Å; V180-I182 VanDerWaalsContact C-N 3.28Å; V180-I182 PolarHBondContact O-N 3.25Å; I182-Y185 PolarHBondContact O-N 3.44Å; I182-L186 HydrophobicContact CG2-CD1 3.84Å; I182-L186 HydrophobicContact CG2-CG 4.18Å; I182-L186 WeakPolarHBondContact O-CB 3.42Å; I182-L186 VanDerWaalsContact O-CG 3.27Å; I182-L186 WeakPolarHBondContact O-CG 3.48Å; I182-L186 PolarHBondContact O-N 3.5Å
183	V	98.8	Very high	98.3	Very high	0 Å²	0	44.9 Å²	44.9	0%	0	21%	0.21	C	C	.	.	H	α-helix	trans	-61.4	-46.7	176.9	173.1	0	0	0	0	111.1	L171 A174 H179 V180 Y185 L186 I187 M217 L221 L224	L171-V183 HydrophobicContact CD1-CB 4.28Å; L171-V183 HydrophobicContact CD1-CG1 3.88Å; L171-V183 HydrophobicContact CD1-CG2 3.95Å; A174-V183 HydrophobicContact CB-CG2 3.7Å; H179-V183 PolarHBondContact O-N 3.03Å; V180-V183 WeakPolarHBondContact O-CA 3.36Å; V180-V183 WeakPolarHBondContact O-CB 3.28Å; V180-V183 PolarHBondContact O-N 3.32Å; V183-Y185 PolarHBondContact O-N 2.6Å; V183-L186 PolarHBondContact O-N 2.99Å; V183-I187 HydrophobicContact CG1-CG1 4.25Å; V183-I187 VanDerWaalsContact O-CB 3.31Å; V183-I187 WeakPolarHBondContact O-CB 3.2Å; V183-I187 VanDerWaalsContact O-CG1 3.23Å; V183-I187 WeakPolarHBondContact O-CG1 3.47Å; V183-I187 PolarHBondContact O-N 3.42Å; V183-M217 HydrophobicContact CB-CE 4.5Å; V183-M217 HydrophobicContact CB-SD 4.32Å; V183-M217 HydrophobicContact CG1-SD 4.48Å; V183-M217 HydrophobicContact CG2-CE 3.68Å; V183-M217 HydrophobicContact CG2-SD 3.67Å; V183-L221 HydrophobicContact CG1-CD2 3.83Å; V183-L224 HydrophobicContact CG1-CD1 3.75Å
184	E	98.6	Very high	98.3	Very high	51 Å²	51	47.5 Å²	47.5	24%	0.238	22%	0.224	C	C	.	.	H	α-helix	trans	-57.2	-49.9	175.2	-71.4	175.2	158.2	0	0	111.3	V180 L186 I187 Q188 K220	V180-E184 HydrophobicContact CG1-CG 4.36Å; V180-E184 WeakPolarHBondContact O-CG 3.35Å; V180-E184 PolarHBondContact O-N 3.03Å; E184-L186 PolarHBondContact O-N 3.41Å; E184-I187 PolarHBondContact O-N 2.94Å; E184-Q188 WeakPolarHBondContact O-CA 3.38Å; E184-Q188 VanDerWaalsContact O-CB 3.28Å; E184-Q188 WeakPolarHBondContact O-CB 3.47Å; E184-Q188 PolarHBondContact O-N 3.16Å; E184-K220 HydrophobicContact CG-CD 4.05Å; E184-K220 VanDerWaalsContact OE1-CE 3.29Å; E184-K220 WeakPolarHBondContact OE1-CE 3.41Å; E184-K220 IonicContact OE1-NZ 2.6Å; E184-K220 PolarHBondContact OE1-NZ 3.36Å
185	Y	98.7	Very high	98.2	Very high	23 Å²	23	47.7 Å²	47.7	9%	0.09	23%	0.225	C	C	.	.	I	π-helix	trans	-59.5	-46.7	178.2	177.4	-113.3	0	0	0	112.8	L147 M150 L151 V154 R181 I182 V183 I187 D189 L190	L147-Y185 HydrophobicContact CD1-CD1 3.89Å; L147-Y185 HydrophobicContact CD1-CD2 4.33Å; L147-Y185 HydrophobicContact CD1-CG 3.65Å; M150-Y185 HydrophobicContact CG-CD1 3.95Å; M150-Y185 HydrophobicContact CG-CE1 3.94Å; L151-Y185 HydrophobicContact CD2-CD2 4.06Å; L151-Y185 HydrophobicContact CD2-CE1 4.14Å; L151-Y185 HydrophobicContact CD2-CE2 3.38Å; L151-Y185 VanDerWaalsContact CD2-CZ 3.42Å; V154-Y185 HydrophobicContact CG2-CE1 4.12Å; R181-Y185 WeakPolarHBondContact O-CB 3.4Å; R181-Y185 PolarHBondContact O-N 3.43Å; R181-Y185 VanDerWaalsContact O-N 3.08Å; I182-Y185 PolarHBondContact O-N 3.44Å; V183-Y185 PolarHBondContact O-N 2.6Å; Y185-I187 VanDerWaalsContact C-N 3.35Å; Y185-I187 PolarHBondContact O-N 3.04Å; Y185-D189 HydrophobicContact CD2-CB 3.65Å; Y185-D189 WeakPolarHBondContact CD2-OD2 3.45Å; Y185-D189 HydrophobicContact CE2-CB 3.99Å; Y185-D189 WeakPolarHBondContact O-CB 3.42Å; Y185-D189 PolarHBondContact O-N 2.97Å; Y185-L190 HydrophobicContact CD1-CD1 4.25Å; Y185-L190 HydrophobicContact CD1-CG 4.5Å; Y185-L190 HydrophobicContact CE1-CD1 3.62Å; Y185-L190 HydrophobicContact CE1-CG 4Å; Y185-L190 HydrophobicContact CE2-CD2 4.26Å; Y185-L190 HydrophobicContact CE2-CG 4.16Å; Y185-L190 PolarHBondContact O-N 3.09Å
186	L	98.6	Very high	98.2	Very high	0 Å²	0	48.7 Å²	48.7	0%	0	23%	0.231	C	C	.	.	I	π-helix	trans	-63.6	-39.3	179.2	-69.3	174.3	0	0	0	112.2	A170 L171 I182 V183 E184 L190 L192 L195	A170-L186 HydrophobicContact CB-CD1 3.94Å; L171-L186 HydrophobicContact CB-CD1 4.4Å; I182-L186 HydrophobicContact CG2-CD1 3.84Å; I182-L186 HydrophobicContact CG2-CG 4.18Å; I182-L186 WeakPolarHBondContact O-CB 3.42Å; I182-L186 VanDerWaalsContact O-CG 3.27Å; I182-L186 WeakPolarHBondContact O-CG 3.48Å; I182-L186 PolarHBondContact O-N 3.5Å; V183-L186 PolarHBondContact O-N 2.99Å; E184-L186 PolarHBondContact O-N 3.41Å; L186-L190 HydrophobicContact CD2-CD1 4.23Å; L186-L192 HydrophobicContact CD2-CD1 4.22Å; L186-L192 VanDerWaalsContact O-CB 3.3Å; L186-L192 WeakPolarHBondContact O-CB 3.45Å; L186-L192 PolarHBondContact O-N 3.39Å; L186-L195 HydrophobicContact CB-CD1 4.44Å; L186-L195 HydrophobicContact CD1-CD1 4.36Å; L186-L195 HydrophobicContact CD2-CD1 4.4Å
187	I	98.6	Very high	98.1	Very high	3 Å²	3	51.7 Å²	51.7	2%	0.015	25%	0.245	C	C	.	.	I	π-helix	trans	-92.3	-41.9	-170.2	-62.6	-60.9	0	0	0	113	L171 V183 E184 Y185 H191 K193 L224 L226	L171-I187 HydrophobicContact CD1-CD1 4.13Å; L171-I187 HydrophobicContact CD1-CG1 4.06Å; L171-I187 HydrophobicContact CD2-CD1 3.95Å; V183-I187 HydrophobicContact CG1-CG1 4.25Å; V183-I187 VanDerWaalsContact O-CB 3.31Å; V183-I187 WeakPolarHBondContact O-CB 3.2Å; V183-I187 VanDerWaalsContact O-CG1 3.23Å; V183-I187 WeakPolarHBondContact O-CG1 3.47Å; V183-I187 PolarHBondContact O-N 3.42Å; E184-I187 PolarHBondContact O-N 2.94Å; Y185-I187 VanDerWaalsContact C-N 3.35Å; Y185-I187 PolarHBondContact O-N 3.04Å; I187-H191 WeakPolarHBondContact O-CA 3.21Å; I187-K193 HydrophobicContact CG2-CG 4.08Å; I187-L224 HydrophobicContact CB-CD1 4.27Å; I187-L224 HydrophobicContact CG2-CB 4.44Å; I187-L224 HydrophobicContact CG2-CD1 4.17Å; I187-L224 HydrophobicContact CG2-CD2 4.31Å; I187-L226 HydrophobicContact CD1-CD1 3.73Å; I187-L226 HydrophobicContact CG1-CD1 3.75Å; I187-L226 HydrophobicContact CG2-CD1 4.21Å
188	Q	97.8	Very high	98.2	Very high	80 Å²	80	52.7 Å²	52.7	37%	0.374	25%	0.251	S	S	.	.	I	π-helix	trans	-93	-46.7	-175	-61.2	-177.5	-56.6	0	0	111.5	E184 H191 L224	E184-Q188 WeakPolarHBondContact O-CA 3.38Å; E184-Q188 VanDerWaalsContact O-CB 3.28Å; E184-Q188 WeakPolarHBondContact O-CB 3.47Å; E184-Q188 PolarHBondContact O-N 3.16Å; Q188-H191 PolarHBondContact O-CE1 3.06Å; Q188-H191 PolarHBondContact O-ND1 3.47Å; Q188-L224 HydrophobicContact CG-CD2 3.74Å
189	D	98	Very high	98.2	Very high	108 Å²	108	51 Å²	51	58%	0.578	24%	0.241	S	C	*	.	I	π-helix	trans	-84.9	-41.3	-174.5	-62.8	-5	0	0	0	111.9	Y185	Y185-D189 HydrophobicContact CD2-CB 3.65Å; Y185-D189 WeakPolarHBondContact CD2-OD2 3.45Å; Y185-D189 HydrophobicContact CE2-CB 3.99Å; Y185-D189 WeakPolarHBondContact O-CB 3.42Å; Y185-D189 PolarHBondContact O-N 2.97Å
190	L	98.1	Very high	98.1	Very high	47 Å²	47	54 Å²	54	25%	0.246	26%	0.256	C	S	.	.	S	Bend	trans	-92.3	-5.9	177.3	-60.9	-174.1	0	0	0	113.9	V154 Q160 Y185 L186 L192	V154-L190 HydrophobicContact CG1-CD1 4.38Å; V154-L190 HydrophobicContact CG1-CD2 4.45Å; V154-L190 HydrophobicContact CG2-CD1 4.26Å; Q160-L190 HydrophobicContact CG-CD1 4.17Å; Y185-L190 HydrophobicContact CD1-CD1 4.25Å; Y185-L190 HydrophobicContact CD1-CG 4.5Å; Y185-L190 HydrophobicContact CE1-CD1 3.62Å; Y185-L190 HydrophobicContact CE1-CG 4Å; Y185-L190 HydrophobicContact CE2-CD2 4.26Å; Y185-L190 HydrophobicContact CE2-CG 4.16Å; Y185-L190 PolarHBondContact O-N 3.09Å; L186-L190 HydrophobicContact CD2-CD1 4.23Å; L190-L192 HydrophobicContact CB-CD1 3.79Å; L190-L192 HydrophobicContact CB-CG 3.68Å; L190-L192 HydrophobicContact CD1-CD1 3.91Å; L190-L192 WeakPolarHBondContact O-CG 2.75Å; L190-L192 PolarHBondContact O-N 3.39Å
191	H	97.9	Very high	98.1	Very high	148 Å²	148	58.4 Å²	58.4	69%	0.685	27%	0.274	S	S	*	.			trans	54.9	30	-179.6	-56.9	-55.5	0	0	0	114.9	I187 Q188 K193	I187-H191 WeakPolarHBondContact O-CA 3.21Å; Q188-H191 PolarHBondContact O-CE1 3.06Å; Q188-H191 PolarHBondContact O-ND1 3.47Å; H191-K193 VanDerWaalsContact C-N 3.28Å; H191-K193 PolarHBondContact O-N 3.32Å
192	L	97.9	Very high	98.1	Very high	8 Å²	8	51.1 Å²	51.1	4%	0.042	25%	0.251	C	S	.	.			trans	-88.1	50.6	-174.2	-55	175.6	0	0	0	113	Q160 L186 L190 D194 L195	Q160-L192 HydrophobicContact CB-CD1 3.66Å; Q160-L192 HydrophobicContact CG-CD1 4.3Å; L186-L192 HydrophobicContact CD2-CD1 4.22Å; L186-L192 VanDerWaalsContact O-CB 3.3Å; L186-L192 WeakPolarHBondContact O-CB 3.45Å; L186-L192 PolarHBondContact O-N 3.39Å; L190-L192 HydrophobicContact CB-CD1 3.79Å; L190-L192 HydrophobicContact CB-CG 3.68Å; L190-L192 HydrophobicContact CD1-CD1 3.91Å; L190-L192 WeakPolarHBondContact O-CG 2.75Å; L190-L192 PolarHBondContact O-N 3.39Å; L192-D194 PolarHBondContact O-N 3.34Å; L192-L195 HydrophobicContact CB-CD1 3.66Å; L192-L195 HydrophobicContact CB-CG 3.84Å; L192-L195 HydrophobicContact CD1-CD1 3.98Å; L192-L195 HydrophobicContact CG-CD1 4.48Å; L192-L195 WeakPolarHBondContact O-CB 3.42Å; L192-L195 WeakPolarHBondContact O-CG 3.19Å; L192-L195 PolarHBondContact O-N 2.91Å
193	K	96.6	Very high	98	Very high	122 Å²	122	52.1 Å²	52.1	53%	0.53	26%	0.255	S	S	.	.	G	3₁₀ helix	trans	-61.3	-23.3	177.5	-73.2	-173.1	176.6	-173.6	0	113.1	I187 H191 L195 N196	I187-K193 HydrophobicContact CG2-CG 4.08Å; H191-K193 VanDerWaalsContact C-N 3.28Å; H191-K193 PolarHBondContact O-N 3.32Å; K193-L195 PolarHBondContact O-N 3.46Å; K193-L195 VanDerWaalsContact O-N 3.16Å; K193-N196 WeakPolarHBondContact O-CB 2.95Å; K193-N196 PolarHBondContact O-N 2.88Å; K193-N196 VanDerWaalsContact O-N 3.11Å
194	D	97.6	Very high	98	Very high	71 Å²	71	53.3 Å²	53.3	38%	0.38	26%	0.26	S	S	.	.	G	3₁₀ helix	trans	-64.2	-11.8	174.5	64	-65.6	0	0	0	113.6	R161 L192 N196 Q197	R161-D194 IonicContact CZ-OD1 3.03Å; R161-D194 IonicContact CZ-OD2 3.25Å; R161-D194 IonicContact NE-OD1 2.86Å; R161-D194 IonicContact NE-OD2 3.62Å; R161-D194 PolarHBondContact NE-OD2 3.41Å; R161-D194 IonicContact NH2-OD1 3.91Å; R161-D194 PolarHBondContact NH2-OD1 3.3Å; R161-D194 IonicContact NH2-OD2 2.83Å; R161-D194 PolarHBondContact NH2-OD2 2.92Å; L192-D194 PolarHBondContact O-N 3.34Å; D194-N196 PolarHBondContact O-N 2.94Å; D194-Q197 VanDerWaalsContact O-CG 3.24Å; D194-Q197 WeakPolarHBondContact O-CG 3.27Å
195	L	97.9	Very high	98	Very high	4 Å²	4	50.9 Å²	50.9	2%	0.021	25%	0.249	C	C	.	.	G	3₁₀ helix	trans	-71.1	-16.5	171.3	-63.3	178.5	0	0	0	113.4	R161 N169 L171 L186 L192 K193 Q197	R161-L195 HydrophobicContact CG-CD2 4.15Å; N169-L195 HydrophobicContact CB-CD2 4.27Å; N169-L195 PolarHBondContact ND2-O 3.1Å; L171-L195 HydrophobicContact CB-CB 3.9Å; L171-L195 HydrophobicContact CB-CD1 4.3Å; L171-L195 HydrophobicContact CD2-CB 3.83Å; L186-L195 HydrophobicContact CB-CD1 4.44Å; L186-L195 HydrophobicContact CD1-CD1 4.36Å; L186-L195 HydrophobicContact CD2-CD1 4.4Å; L192-L195 HydrophobicContact CB-CD1 3.66Å; L192-L195 HydrophobicContact CB-CG 3.84Å; L192-L195 HydrophobicContact CD1-CD1 3.98Å; L192-L195 HydrophobicContact CG-CD1 4.48Å; L192-L195 WeakPolarHBondContact O-CB 3.42Å; L192-L195 WeakPolarHBondContact O-CG 3.19Å; L192-L195 PolarHBondContact O-N 2.91Å; K193-L195 PolarHBondContact O-N 3.46Å; K193-L195 VanDerWaalsContact O-N 3.16Å; L195-Q197 PolarHBondContact O-N 3.34Å
196	N	98.1	Very high	98	Very high	22 Å²	22	50.2 Å²	50.2	12%	0.118	25%	0.246	C	C	.	.			trans	-78.2	61	178.9	-169.9	28.4	0	0	0	112.2	L171 K193 D194 P205 L226	L171-N196 HydrophobicContact CD2-CB 4.2Å; K193-N196 WeakPolarHBondContact O-CB 2.95Å; K193-N196 PolarHBondContact O-N 2.88Å; K193-N196 VanDerWaalsContact O-N 3.11Å; D194-N196 PolarHBondContact O-N 2.94Å; N196-P205 WeakPolarHBondContact OD1-CD 3.5Å; N196-L226 HydrophobicContact CB-CD2 4.02Å; N196-L226 PolarHBondContact ND2-O 3.01Å
197	Q	97.4	Very high	98	Very high	94 Å²	94	50.2 Å²	50.2	44%	0.439	25%	0.246	S	C	.	.			trans	-114.4	156.4	177.5	-62.6	-59.6	-35.1	0	0	109.4	H172 D194 L195	H172-Q197 PolarHBondContact CE1-O 3.3Å; H172-Q197 PolarHBondContact NE2-O 3.23Å; D194-Q197 VanDerWaalsContact O-CG 3.24Å; D194-Q197 WeakPolarHBondContact O-CG 3.27Å; L195-Q197 PolarHBondContact O-N 3.34Å
198	P	98.3	Very high	98	Very high	51 Å²	51	50.1 Å²	50.1	33%	0.331	25%	0.246	S	C	.	.			trans	-66.4	146.6	174.9	26.5	-33.7	0	0	0	112.3	K204	P198-K204 HydrophobicContact CB-CG 4.43Å
199	D	98.2	Very high	98	Very high	8 Å²	8	46.3 Å²	46.3	4%	0.043	23%	0.228	C	C	.	.			trans	-71.5	-178.8	164.3	79	-4.6	0	0	0	111.7	D166 M168 K201 G202 R203	D166-D199 WeakPolarHBondContact O-CB 3.45Å; M168-D199 HydrophobicContact CG-CB 3.85Å; D199-K201 PolarHBondContact O-N 3.1Å; D199-K201 VanDerWaalsContact OD1-C 3.28Å; D199-K201 VanDerWaalsContact OD1-CA 3.23Å; D199-K201 WeakPolarHBondContact OD1-CA 3.37Å; D199-K201 WeakPolarHBondContact OD1-CB 3.32Å; D199-K201 PolarHBondContact OD1-N 3.17Å; D199-G202 PolarHBondContact O-N 3.45Å; D199-G202 PolarHBondContact OD1-N 2.95Å; D199-G202 VanDerWaalsContact OD1-N 3.1Å; D199-R203 PolarHBondContact N-O 3.25Å; D199-R203 WeakPolarHBondContact OD1-CB 3.3Å; D199-R203 PolarHBondContact OD1-N 3.17Å; D199-R203 IonicContact OD1-NE 2.87Å; D199-R203 IonicContact OD2-CZ 3.76Å; D199-R203 IonicContact OD2-NE 3.04Å; D199-R203 PolarHBondContact OD2-NE 3.45Å; D199-R203 VanDerWaalsContact OD2-NE 3.11Å; D199-R203 IonicContact OD2-NH2 2.81Å; D199-R203 PolarHBondContact OD2-NH2 3.23Å
200	E	98.1	Very high	98	Very high	114 Å²	114	41.1 Å²	41.1	53%	0.533	20%	0.2	S	C	.	.	T	Hydrogen-bonded Turn	trans	-65.2	-8	177.1	-73.2	-61.3	155	0	0	113.9	D166 K233	D166-E200 VanDerWaalsContact C-CG 3.41Å; D166-E200 VanDerWaalsContact O-CB 3.3Å; D166-E200 WeakPolarHBondContact O-CB 3.36Å; D166-E200 WeakPolarHBondContact O-CG 3.34Å; D166-E200 PolarHBondContact O-N 2.92Å; E200-K233 WeakPolarHBondContact O-CD 3.31Å; E200-K233 WeakPolarHBondContact O-CE 3.41Å; E200-K233 PolarHBondContact O-NZ 3.12Å; E200-K233 IonicContact OE2-NZ 3.17Å
201	K	97.5	Very high	98.1	Very high	105 Å²	105	40 Å²	40	46%	0.457	19%	0.194	S	C	.	.	T	Hydrogen-bonded Turn	trans	-102.2	7.7	171.2	-61.6	-176.3	-172.7	171.3	0	112.3	D199 R203 D232 K233	D199-K201 PolarHBondContact O-N 3.1Å; D199-K201 VanDerWaalsContact OD1-C 3.28Å; D199-K201 VanDerWaalsContact OD1-CA 3.23Å; D199-K201 WeakPolarHBondContact OD1-CA 3.37Å; D199-K201 WeakPolarHBondContact OD1-CB 3.32Å; D199-K201 PolarHBondContact OD1-N 3.17Å; K201-R203 VanDerWaalsContact C-N 3.28Å; K201-R203 HydrophobicContact CB-CG 4.29Å; K201-D232 WeakPolarHBondContact O-CB 3.4Å; K201-K233 WeakPolarHBondContact O-CB 3.29Å; K201-K233 WeakPolarHBondContact O-CG 3.25Å; K201-K233 PolarHBondContact O-N 3.46Å
202	G	97.9	Very high	98.1	Very high	15 Å²	15	38.5 Å²	38.5	16%	0.155	18%	0.182	C	C	.	.	S	Bend	trans	79.7	7.2	-177.5	0	0	0	0	0	113.5	D199	D199-G202 PolarHBondContact O-N 3.45Å; D199-G202 PolarHBondContact OD1-N 2.95Å; D199-G202 VanDerWaalsContact OD1-N 3.1Å
203	R	98.4	Very high	98.1	Very high	21 Å²	21	39 Å²	39	8%	0.079	19%	0.189	C	C	.	.			trans	-92.3	117.3	-173.9	-60.3	175.5	-59	168.9	6.8	110.2	H172 D199 K201 L207 L208 E211 D232	H172-R203 PolarHBondContact NE2-O 3.34Å; D199-R203 PolarHBondContact N-O 3.25Å; D199-R203 WeakPolarHBondContact OD1-CB 3.3Å; D199-R203 PolarHBondContact OD1-N 3.17Å; D199-R203 IonicContact OD1-NE 2.87Å; D199-R203 IonicContact OD2-CZ 3.76Å; D199-R203 IonicContact OD2-NE 3.04Å; D199-R203 PolarHBondContact OD2-NE 3.45Å; D199-R203 VanDerWaalsContact OD2-NE 3.11Å; D199-R203 IonicContact OD2-NH2 2.81Å; D199-R203 PolarHBondContact OD2-NH2 3.23Å; K201-R203 VanDerWaalsContact C-N 3.28Å; K201-R203 HydrophobicContact CB-CG 4.29Å; R203-L207 HydrophobicContact CB-CB 4.21Å; R203-L207 HydrophobicContact CB-CD2 4.48Å; R203-L207 HydrophobicContact CG-CD2 4.39Å; R203-L208 HydrophobicContact CB-CD2 4.05Å; R203-L208 HydrophobicContact CB-CG 4.4Å; R203-L208 VanDerWaalsContact CZ-CD2 3.44Å; R203-E211 IonicContact CZ-OE2 3.47Å; R203-E211 IonicContact NH1-OE1 2.72Å; R203-E211 IonicContact NH1-OE2 3.49Å; R203-E211 PolarHBondContact NH1-OE2 3.37Å; R203-D232 HydrophobicContact CG-CB 3.63Å
204	K	98.4	Very high	98.2	Very high	25 Å²	25	35.5 Å²	35.5	11%	0.109	17%	0.174	C	C	.	.			trans	-72.8	161.5	164.5	-70.7	-173.4	-178.8	173.4	0	110.8	P198 F206 L207 L208 T228 E230	P198-K204 HydrophobicContact CB-CG 4.43Å; K204-F206 PolarHBondContact O-N 2.98Å; K204-F206 VanDerWaalsContact O-N 3.1Å; K204-L207 WeakPolarHBondContact O-CB 3.22Å; K204-L207 PolarHBondContact O-N 2.96Å; K204-L208 PolarHBondContact O-N 3.44Å; K204-T228 HydrophobicContact CB-CG2 4.22Å; K204-T228 HydrophobicContact CD-CG2 4.11Å; K204-E230 WeakPolarHBondContact CE-OE2 3.31Å; K204-E230 IonicContact NZ-OE1 2.94Å; K204-E230 PolarHBondContact NZ-OE1 3.27Å; K204-E230 IonicContact NZ-OE2 3.89Å; K204-E230 PolarHBondContact NZ-OE2 3.41Å
205	P	98.6	Very high	98.2	Very high	0 Å²	0	34 Å²	34	0%	0	17%	0.167	C	C	.	.	H	α-helix	trans	-49.8	-36.7	176.6	-29.7	35.5	0	0	0	114.5	L171 A175 N196 L207 L208 A209	L171-P205 HydrophobicContact CB-CG 4.25Å; L171-P205 HydrophobicContact CD2-CB 4.44Å; L171-P205 HydrophobicContact CD2-CG 3.79Å; L171-P205 HydrophobicContact CG-CB 4.06Å; L171-P205 HydrophobicContact CG-CG 3.69Å; A175-P205 HydrophobicContact CB-CB 3.67Å; A175-P205 WeakPolarHBondContact CB-O 3.4Å; N196-P205 WeakPolarHBondContact OD1-CD 3.5Å; P205-L207 PolarHBondContact O-N 2.73Å; P205-L208 PolarHBondContact O-N 3.38Å; P205-A209 PolarHBondContact O-N 3.44Å
206	F	98.4	Very high	98.2	Very high	8 Å²	8	38.8 Å²	38.8	4%	0.035	19%	0.19	C	C	.	.	H	α-helix	trans	-59.7	-41.7	176.2	-173.1	-102.6	0	0	0	113.2	K204 L208 A209 A210 I218 L221 H227 T228 A238 L254	K204-F206 PolarHBondContact O-N 2.98Å; K204-F206 VanDerWaalsContact O-N 3.1Å; F206-L208 VanDerWaalsContact C-N 3.31Å; F206-L208 PolarHBondContact O-N 3.32Å; F206-A209 PolarHBondContact O-N 3.45Å; F206-A210 PolarHBondContact O-N 2.88Å; F206-A210 VanDerWaalsContact O-N 3.08Å; F206-I218 HydrophobicContact CE2-CB 4.5Å; F206-I218 HydrophobicContact CE2-CG2 3.82Å; F206-I218 HydrophobicContact CZ-CG2 4.05Å; F206-L221 HydrophobicContact CB-CD1 4.24Å; F206-L221 HydrophobicContact CD2-CB 3.87Å; F206-L221 HydrophobicContact CD2-CD1 4.25Å; F206-H227 HydrophobicContact CD2-CB 4.02Å; F206-H227 HydrophobicContact CE1-CB 4.29Å; F206-H227 HydrophobicContact CE2-CB 3.7Å; F206-H227 HydrophobicContact CG-CB 4.43Å; F206-H227 HydrophobicContact CZ-CB 3.85Å; F206-T228 HydrophobicContact CB-CG2 4.22Å; F206-T228 HydrophobicContact CD1-CG2 4.11Å; F206-A238 HydrophobicContact CD1-CB 4.05Å; F206-A238 HydrophobicContact CE1-CB 3.74Å; F206-L254 HydrophobicContact CE1-CD2 3.87Å; F206-L254 HydrophobicContact CZ-CD2 3.62Å
207	L	98.3	Very high	98.3	Very high	1 Å²	1	37.8 Å²	37.8	1%	0.005	18%	0.184	C	C	.	.	H	α-helix	trans	-65.5	-36.5	177	-88	63.2	0	0	0	111.2	R203 K204 P205 A210 E211 T228 D232 L241	R203-L207 HydrophobicContact CB-CB 4.21Å; R203-L207 HydrophobicContact CB-CD2 4.48Å; R203-L207 HydrophobicContact CG-CD2 4.39Å; K204-L207 WeakPolarHBondContact O-CB 3.22Å; K204-L207 PolarHBondContact O-N 2.96Å; P205-L207 PolarHBondContact O-N 2.73Å; L207-A210 PolarHBondContact O-N 3.44Å; L207-E211 WeakPolarHBondContact O-CB 3.18Å; L207-E211 PolarHBondContact O-N 2.92Å; L207-T228 HydrophobicContact CD1-CG2 3.24Å; L207-D232 HydrophobicContact CD2-CB 4.08Å; L207-L241 HydrophobicContact CB-CD1 3.69Å; L207-L241 HydrophobicContact CD2-CD1 4.15Å; L207-L241 HydrophobicContact CG-CD1 3.92Å
208	L	98.6	Very high	98.3	Very high	0 Å²	0	33.3 Å²	33.3	0%	0	16%	0.163	C	C	.	.	H	α-helix	trans	-69.1	-37.3	176.9	-59.8	179.2	0	0	0	112.3	M168 H172 Q176 R203 K204 P205 F206 A210 E211 R212	M168-L208 HydrophobicContact CE-CD1 3.75Å; H172-L208 HydrophobicContact CB-CD1 3.78Å; Q176-L208 HydrophobicContact CB-CB 4.19Å; Q176-L208 HydrophobicContact CB-CD1 4.4Å; R203-L208 HydrophobicContact CB-CD2 4.05Å; R203-L208 HydrophobicContact CB-CG 4.4Å; R203-L208 VanDerWaalsContact CZ-CD2 3.44Å; K204-L208 PolarHBondContact O-N 3.44Å; P205-L208 PolarHBondContact O-N 3.38Å; F206-L208 VanDerWaalsContact C-N 3.31Å; F206-L208 PolarHBondContact O-N 3.32Å; L208-A210 VanDerWaalsContact C-N 3.34Å; L208-E211 PolarHBondContact O-N 3.09Å; L208-R212 VanDerWaalsContact O-CG 3.28Å; L208-R212 WeakPolarHBondContact O-CG 3.23Å; L208-R212 PolarHBondContact O-N 3.08Å; L208-R212 VanDerWaalsContact O-N 3.13Å
209	A	98.6	Very high	98.3	Very high	0 Å²	0	35.3 Å²	35.3	0%	0	17%	0.168	C	C	.	.	H	α-helix	trans	-62.9	-42.7	173.6	0	0	0	0	0	111.2	P205 F206 R212 G213 H214 M217 I218 L221	P205-A209 PolarHBondContact O-N 3.44Å; F206-A209 PolarHBondContact O-N 3.45Å; A209-R212 PolarHBondContact O-N 3.47Å; A209-G213 PolarHBondContact O-N 3.42Å; A209-H214 PolarHBondContact O-N 3.46Å; A209-M217 HydrophobicContact CB-CB 4.01Å; A209-M217 HydrophobicContact CB-CG 3.58Å; A209-I218 HydrophobicContact CB-CG1 4.04Å; A209-L221 HydrophobicContact CB-CD1 4.2Å
210	A	98.3	Very high	98.3	Very high	0 Å²	0	37.1 Å²	37.1	0%	0	18%	0.176	C	C	.	.	H	α-helix	trans	-64.9	-45.8	174.9	0	0	0	0	0	112.9	F206 L207 L208 R212 G213 I218 A238 A242 L254	F206-A210 PolarHBondContact O-N 2.88Å; F206-A210 VanDerWaalsContact O-N 3.08Å; L207-A210 PolarHBondContact O-N 3.44Å; L208-A210 VanDerWaalsContact C-N 3.34Å; A210-R212 PolarHBondContact O-N 3.49Å; A210-G213 PolarHBondContact O-N 3.39Å; A210-I218 HydrophobicContact CB-CD1 4.36Å; A210-A238 HydrophobicContact CB-CB 3.65Å; A210-A238 WeakPolarHBondContact CB-O 3.14Å; A210-A242 HydrophobicContact CB-CB 4.44Å; A210-A242 VanDerWaalsContact O-CA 3.32Å; A210-A242 WeakPolarHBondContact O-CA 3.49Å; A210-A242 WeakPolarHBondContact O-CB 3.29Å; A210-L254 HydrophobicContact CB-CD1 4.03Å
211	E	98.4	Very high	98.3	Very high	24 Å²	24	31.7 Å²	31.7	11%	0.112	15%	0.151	C	C	.	.	H	α-helix	trans	-56.4	-32.2	175.4	-171.1	177.2	-166.5	0	0	112.1	R203 L207 L208 L241 H245 H247	R203-E211 IonicContact CZ-OE2 3.47Å; R203-E211 IonicContact NH1-OE1 2.72Å; R203-E211 IonicContact NH1-OE2 3.49Å; R203-E211 PolarHBondContact NH1-OE2 3.37Å; L207-E211 WeakPolarHBondContact O-CB 3.18Å; L207-E211 PolarHBondContact O-N 2.92Å; L208-E211 PolarHBondContact O-N 3.09Å; E211-L241 HydrophobicContact CB-CB 3.95Å; E211-L241 HydrophobicContact CB-CD1 4.4Å; E211-L241 HydrophobicContact CG-CB 4.4Å; E211-H245 PolarHBondContact O-CD2 3.22Å; E211-H245 VanDerWaalsContact O-CD2 3.27Å; E211-H247 PolarHBondContact O-CD2 3.36Å; E211-H247 PolarHBondContact O-NE2 3.27Å
212	R	98.4	Very high	98.2	Very high	116 Å²	116	27.9 Å²	27.9	44%	0.438	14%	0.136	S	C	.	.	T	Hydrogen-bonded Turn	trans	-94.8	-2.2	178.9	-61.4	-64.2	-171.9	-171.4	-0	114.4	Q176 L208 A209 A210 H214 H247	Q176-R212 HydrophobicContact CG-CG 4.03Å; L208-R212 VanDerWaalsContact O-CG 3.28Å; L208-R212 WeakPolarHBondContact O-CG 3.23Å; L208-R212 PolarHBondContact O-N 3.08Å; L208-R212 VanDerWaalsContact O-N 3.13Å; A209-R212 PolarHBondContact O-N 3.47Å; A210-R212 PolarHBondContact O-N 3.49Å; R212-H214 VanDerWaalsContact C-N 3.28Å; R212-H214 VanDerWaalsContact CB-CD2 3.43Å; R212-H214 WeakPolarHBondContact CB-CD2 3.44Å; R212-H214 WeakPolarHBondContact CB-NE2 3.45Å; R212-H214 PolarHBondContact O-N 3.29Å; R212-H247 VanDerWaalsContact C-NE2 3.33Å; R212-H247 PolarHBondContact O-NE2 3.22Å
213	G	98.1	Very high	98.2	Very high	17 Å²	17	34 Å²	34	18%	0.175	16%	0.158	C	C	.	.	T	Hydrogen-bonded Turn	trans	69	24.4	179.2	0	0	0	0	0	114.4	A209 A210 V215 H247	A209-G213 PolarHBondContact O-N 3.42Å; A210-G213 PolarHBondContact O-N 3.39Å; G213-V215 PolarHBondContact O-N 3.01Å; G213-H247 WeakPolarHBondContact CA-CD2 3.4Å; G213-H247 PolarHBondContact N-CD2 2.81Å
214	H	98.6	Very high	98.1	Very high	50 Å²	50	33.5 Å²	33.5	23%	0.231	16%	0.157	C	C	.	.			trans	-81.9	84.1	-175.6	-68.4	-28.1	0	0	0	111.2	Q176 N178 A209 R212 E216 M217 I218	Q176-H214 PolarHBondContact O-NE2 2.98Å; Q176-H214 VanDerWaalsContact O-NE2 3.16Å; N178-H214 HydrophobicContact CB-CB 4.13Å; N178-H214 WeakPolarHBondContact OD1-CB 3.21Å; A209-H214 PolarHBondContact O-N 3.46Å; R212-H214 VanDerWaalsContact C-N 3.28Å; R212-H214 VanDerWaalsContact CB-CD2 3.43Å; R212-H214 WeakPolarHBondContact CB-CD2 3.44Å; R212-H214 WeakPolarHBondContact CB-NE2 3.45Å; R212-H214 PolarHBondContact O-N 3.29Å; H214-E216 PolarHBondContact O-N 3.4Å; H214-M217 HydrophobicContact CB-CB 3.87Å; H214-M217 PolarHBondContact O-N 3.34Å; H214-I218 WeakPolarHBondContact O-CG1 3.46Å; H214-I218 PolarHBondContact O-N 3.09Å
215	V	98.3	Very high	98	Very high	38 Å²	38	38.2 Å²	38.2	23%	0.23	18%	0.184	C	C	.	.	H	α-helix	trans	-53.1	-50.5	-177.8	174.5	0	0	0	0	112.2	G213 M217 I218 E219 P249 A250 V253	G213-V215 PolarHBondContact O-N 3.01Å; V215-M217 VanDerWaalsContact C-N 3.3Å; V215-M217 PolarHBondContact O-N 3.11Å; V215-I218 WeakPolarHBondContact O-CB 3.38Å; V215-I218 PolarHBondContact O-N 3.46Å; V215-I218 VanDerWaalsContact O-N 3.09Å; V215-E219 HydrophobicContact CG1-CG 4.39Å; V215-E219 WeakPolarHBondContact O-CG 3.47Å; V215-E219 PolarHBondContact O-N 3.08Å; V215-P249 HydrophobicContact CG2-CB 3.76Å; V215-A250 HydrophobicContact CG2-CB 4.26Å; V215-V253 HydrophobicContact CG1-CG2 3.8Å
216	E	98.4	Very high	97.9	Very high	106 Å²	106	38.5 Å²	38.5	50%	0.495	19%	0.185	S	C	.	.	H	α-helix	trans	-58.3	-42.3	-179.4	-169.5	-166.3	176.3	0	0	111.8	N178 V180 H214 K220	N178-E216 PolarHBondContact ND2-OE2 2.89Å; V180-E216 HydrophobicContact CG2-CG 3.94Å; H214-E216 PolarHBondContact O-N 3.4Å; E216-K220 VanDerWaalsContact O-CB 3.29Å; E216-K220 WeakPolarHBondContact O-CB 3.45Å; E216-K220 PolarHBondContact O-N 2.88Å
217	M	98.7	Very high	97.7	Very high	0 Å²	0	43 Å²	43	0%	0	21%	0.206	C	C	.	.	H	α-helix	trans	-67.4	-40.2	175.7	-175.8	60.6	64.6	0	0	112.6	A175 N178 V180 V183 A209 H214 V215 K220 L221	A175-M217 HydrophobicContact CB-CG 4.12Å; A175-M217 HydrophobicContact CB-SD 4.26Å; N178-M217 VanDerWaalsContact OD1-CB 3.26Å; N178-M217 WeakPolarHBondContact OD1-CB 3.44Å; N178-M217 PolarHBondContact OD1-N 2.9Å; V180-M217 HydrophobicContact CB-CE 4.34Å; V180-M217 HydrophobicContact CG2-CE 3.72Å; V180-M217 HydrophobicContact CG2-SD 4.41Å; V183-M217 HydrophobicContact CB-CE 4.5Å; V183-M217 HydrophobicContact CB-SD 4.32Å; V183-M217 HydrophobicContact CG1-SD 4.48Å; V183-M217 HydrophobicContact CG2-CE 3.68Å; V183-M217 HydrophobicContact CG2-SD 3.67Å; A209-M217 HydrophobicContact CB-CB 4.01Å; A209-M217 HydrophobicContact CB-CG 3.58Å; H214-M217 HydrophobicContact CB-CB 3.87Å; H214-M217 PolarHBondContact O-N 3.34Å; V215-M217 VanDerWaalsContact C-N 3.3Å; V215-M217 PolarHBondContact O-N 3.11Å; M217-K220 PolarHBondContact O-N 2.84Å; M217-L221 HydrophobicContact CG-CD1 3.86Å; M217-L221 HydrophobicContact CG-CG 4.2Å; M217-L221 WeakPolarHBondContact O-CB 3.44Å; M217-L221 VanDerWaalsContact O-CG 3.29Å; M217-L221 WeakPolarHBondContact O-CG 3.42Å; M217-L221 PolarHBondContact O-N 3.38Å; M217-L221 HydrophobicContact SD-CD1 4.09Å; M217-L221 HydrophobicContact SD-CD2 4.42Å; M217-L221 HydrophobicContact SD-CG 3.92Å
218	I	98.3	Very high	97.5	Very high	0 Å²	0	43.6 Å²	43.6	0%	0	21%	0.21	C	C	.	.	H	α-helix	trans	-58.4	-52.3	175.8	-68.6	165.4	0	0	0	109.2	F206 A209 A210 H214 V215 K220 L221 T222 A250 V253 L254	F206-I218 HydrophobicContact CE2-CB 4.5Å; F206-I218 HydrophobicContact CE2-CG2 3.82Å; F206-I218 HydrophobicContact CZ-CG2 4.05Å; A209-I218 HydrophobicContact CB-CG1 4.04Å; A210-I218 HydrophobicContact CB-CD1 4.36Å; H214-I218 WeakPolarHBondContact O-CG1 3.46Å; H214-I218 PolarHBondContact O-N 3.09Å; V215-I218 WeakPolarHBondContact O-CB 3.38Å; V215-I218 PolarHBondContact O-N 3.46Å; V215-I218 VanDerWaalsContact O-N 3.09Å; I218-K220 VanDerWaalsContact C-N 3.32Å; I218-K220 PolarHBondContact O-N 3.37Å; I218-L221 PolarHBondContact O-N 3.28Å; I218-T222 PolarHBondContact O-N 3.45Å; I218-T222 PolarHBondContact O-OG1 2.86Å; I218-T222 VanDerWaalsContact O-OG1 3.05Å; I218-A250 HydrophobicContact CD1-CB 3.72Å; I218-V253 HydrophobicContact CG2-CG1 4.12Å; I218-L254 HydrophobicContact CD1-CG 4.43Å; I218-L254 HydrophobicContact CG2-CD2 3.9Å; I218-L254 HydrophobicContact CG2-CG 4.45Å
219	E	97.7	Very high	97.1	Very high	93 Å²	93	47.9 Å²	47.9	44%	0.435	24%	0.24	S	C	.	.	H	α-helix	trans	-60	-42.6	178.7	-68.2	176.9	155.9	0	0	111.8	V215 T222 F223 V253	V215-E219 HydrophobicContact CG1-CG 4.39Å; V215-E219 WeakPolarHBondContact O-CG 3.47Å; V215-E219 PolarHBondContact O-N 3.08Å; E219-T222 PolarHBondContact O-N 2.8Å; E219-F223 WeakPolarHBondContact O-CB 3.49Å; E219-F223 PolarHBondContact O-N 3.3Å; E219-V253 HydrophobicContact CG-CG1 3.87Å
220	K	98.4	Very high	96.9	Very high	47 Å²	47	52.7 Å²	52.7	20%	0.204	26%	0.262	C	S	.	.	H	α-helix	trans	-62.7	-48	177	-176	62.4	49.4	168.7	0	112.1	V180 E184 E216 M217 I218 T222 F223 L224	V180-K220 HydrophobicContact CG1-CB 4.39Å; V180-K220 HydrophobicContact CG1-CD 4.12Å; V180-K220 HydrophobicContact CG1-CG 3.91Å; V180-K220 HydrophobicContact CG2-CB 4.4Å; E184-K220 HydrophobicContact CG-CD 4.05Å; E184-K220 VanDerWaalsContact OE1-CE 3.29Å; E184-K220 WeakPolarHBondContact OE1-CE 3.41Å; E184-K220 IonicContact OE1-NZ 2.6Å; E184-K220 PolarHBondContact OE1-NZ 3.36Å; E216-K220 VanDerWaalsContact O-CB 3.29Å; E216-K220 WeakPolarHBondContact O-CB 3.45Å; E216-K220 PolarHBondContact O-N 2.88Å; M217-K220 PolarHBondContact O-N 2.84Å; I218-K220 VanDerWaalsContact C-N 3.32Å; I218-K220 PolarHBondContact O-N 3.37Å; K220-T222 VanDerWaalsContact C-N 3.3Å; K220-T222 PolarHBondContact O-N 2.97Å; K220-F223 WeakPolarHBondContact O-CB 3.35Å; K220-F223 PolarHBondContact O-N 3.06Å; K220-L224 HydrophobicContact CD-CD1 4.21Å; K220-L224 HydrophobicContact CD-CG 4.32Å; K220-L224 HydrophobicContact CG-CD1 4.05Å; K220-L224 WeakPolarHBondContact O-CG 3.5Å; K220-L224 PolarHBondContact O-N 3.38Å
221	L	97.8	Very high	96.8	Very high	0 Å²	0	56.5 Å²	56.5	0%	0	28%	0.279	C	S	.	.	H	α-helix	trans	-64.8	-36.3	179.3	-71.7	173.8	0	0	0	111.1	A175 V183 F206 A209 M217 I218 L224 N225 L226	A175-L221 HydrophobicContact CB-CD1 4.18Å; V183-L221 HydrophobicContact CG1-CD2 3.83Å; F206-L221 HydrophobicContact CB-CD1 4.24Å; F206-L221 HydrophobicContact CD2-CB 3.87Å; F206-L221 HydrophobicContact CD2-CD1 4.25Å; A209-L221 HydrophobicContact CB-CD1 4.2Å; M217-L221 HydrophobicContact CG-CD1 3.86Å; M217-L221 HydrophobicContact CG-CG 4.2Å; M217-L221 WeakPolarHBondContact O-CB 3.44Å; M217-L221 VanDerWaalsContact O-CG 3.29Å; M217-L221 WeakPolarHBondContact O-CG 3.42Å; M217-L221 PolarHBondContact O-N 3.38Å; M217-L221 HydrophobicContact SD-CD1 4.09Å; M217-L221 HydrophobicContact SD-CD2 4.42Å; M217-L221 HydrophobicContact SD-CG 3.92Å; I218-L221 PolarHBondContact O-N 3.28Å; L221-L224 PolarHBondContact O-N 3.31Å; L221-N225 PolarHBondContact O-N 3.21Å; L221-L226 HydrophobicContact CB-CB 4.38Å; L221-L226 HydrophobicContact CD2-CB 4.06Å; L221-L226 HydrophobicContact CD2-CD1 3.85Å; L221-L226 WeakPolarHBondContact O-CA 3.36Å; L221-L226 PolarHBondContact O-N 2.8Å
222	T	96.5	Very high	96.7	Very high	24 Å²	24	55.9 Å²	55.9	15%	0.147	28%	0.276	C	S	.	.	H	α-helix	trans	-61.9	-49.5	170.6	-57.4	0	0	0	0	111.1	I218 E219 K220 L224 N225 Q257	I218-T222 PolarHBondContact O-N 3.45Å; I218-T222 PolarHBondContact O-OG1 2.86Å; I218-T222 VanDerWaalsContact O-OG1 3.05Å; E219-T222 PolarHBondContact O-N 2.8Å; K220-T222 VanDerWaalsContact C-N 3.3Å; K220-T222 PolarHBondContact O-N 2.97Å; T222-L224 PolarHBondContact O-N 2.64Å; T222-N225 WeakPolarHBondContact O-CA 3.47Å; T222-N225 PolarHBondContact O-N 3.43Å; T222-Q257 VanDerWaalsContact CB-OE1 3.24Å; T222-Q257 PolarHBondContact OG1-OE1 2.9Å
223	F	96.8	Very high	96.6	Very high	143 Å²	143	56.7 Å²	56.7	63%	0.627	28%	0.283	S	S	*	.	H	α-helix	trans	-57.1	-36.7	178.1	175.1	-97.2	0	0	0	112.6	E219 K220 N225	E219-F223 WeakPolarHBondContact O-CB 3.49Å; E219-F223 PolarHBondContact O-N 3.3Å; K220-F223 WeakPolarHBondContact O-CB 3.35Å; K220-F223 PolarHBondContact O-N 3.06Å; F223-N225 PolarHBondContact O-N 3.46Å
224	L	97.4	Very high	96.4	Very high	11 Å²	11	61.2 Å²	61.2	6%	0.058	30%	0.3	C	S	.	.	T	Hydrogen-bonded Turn	trans	-79	1.9	176.4	-65.8	174.7	0	0	0	114	V183 I187 Q188 K220 L221 T222 L226	V183-L224 HydrophobicContact CG1-CD1 3.75Å; I187-L224 HydrophobicContact CB-CD1 4.27Å; I187-L224 HydrophobicContact CG2-CB 4.44Å; I187-L224 HydrophobicContact CG2-CD1 4.17Å; I187-L224 HydrophobicContact CG2-CD2 4.31Å; Q188-L224 HydrophobicContact CG-CD2 3.74Å; K220-L224 HydrophobicContact CD-CD1 4.21Å; K220-L224 HydrophobicContact CD-CG 4.32Å; K220-L224 HydrophobicContact CG-CD1 4.05Å; K220-L224 WeakPolarHBondContact O-CG 3.5Å; K220-L224 PolarHBondContact O-N 3.38Å; L221-L224 PolarHBondContact O-N 3.31Å; T222-L224 PolarHBondContact O-N 2.64Å; L224-L226 VanDerWaalsContact C-N 3.34Å; L224-L226 HydrophobicContact CB-CD1 4.15Å; L224-L226 HydrophobicContact CB-CG 4.05Å
225	N	95.9	Very high	96.2	Very high	124 Å²	124	58.9 Å²	58.9	66%	0.663	29%	0.289	S	S	*	.	T	Hydrogen-bonded Turn	trans	58	41	-173.2	-61.4	-63.8	0	0	0	113.4	L221 T222 F223	L221-N225 PolarHBondContact O-N 3.21Å; T222-N225 WeakPolarHBondContact O-CA 3.47Å; T222-N225 PolarHBondContact O-N 3.43Å; F223-N225 PolarHBondContact O-N 3.46Å
226	L	96.8	Very high	96.2	Very high	7 Å²	7	57.4 Å²	57.4	4%	0.037	28%	0.28	C	S	.	.			trans	-111.8	6	177	-57.5	-178.8	0	0	0	113.3	I187 N196 L221 L224	I187-L226 HydrophobicContact CD1-CD1 3.73Å; I187-L226 HydrophobicContact CG1-CD1 3.75Å; I187-L226 HydrophobicContact CG2-CD1 4.21Å; N196-L226 HydrophobicContact CB-CD2 4.02Å; N196-L226 PolarHBondContact ND2-O 3.01Å; L221-L226 HydrophobicContact CB-CB 4.38Å; L221-L226 HydrophobicContact CD2-CB 4.06Å; L221-L226 HydrophobicContact CD2-CD1 3.85Å; L221-L226 WeakPolarHBondContact O-CA 3.36Å; L221-L226 PolarHBondContact O-N 2.8Å; L224-L226 VanDerWaalsContact C-N 3.34Å; L224-L226 HydrophobicContact CB-CD1 4.15Å; L224-L226 HydrophobicContact CB-CG 4.05Å
227	H	94.1	Very high	96.1	Very high	102 Å²	102	52.5 Å²	52.5	47%	0.472	26%	0.257	S	S	.	.			trans	-61.9	159.1	169.6	69.1	-88.4	0	0	0	110.9	F206	F206-H227 HydrophobicContact CD2-CB 4.02Å; F206-H227 HydrophobicContact CE1-CB 4.29Å; F206-H227 HydrophobicContact CE2-CB 3.7Å; F206-H227 HydrophobicContact CG-CB 4.43Å; F206-H227 HydrophobicContact CZ-CB 3.85Å
228	T	93.1	Very high	96	Very high	13 Å²	13	52.5 Å²	52.5	8%	0.08	26%	0.257	C	S	.	.			trans	-149.4	141.9	-177.7	-171.9	0	0	0	0	111.2	K204 F206 L207 E230	K204-T228 HydrophobicContact CB-CG2 4.22Å; K204-T228 HydrophobicContact CD-CG2 4.11Å; F206-T228 HydrophobicContact CB-CG2 4.22Å; F206-T228 HydrophobicContact CD1-CG2 4.11Å; L207-T228 HydrophobicContact CD1-CG2 3.24Å; T228-E230 VanDerWaalsContact OG1-CB 3.31Å; T228-E230 WeakPolarHBondContact OG1-CB 3.01Å; T228-E230 WeakPolarHBondContact OG1-CG 3.32Å; T228-E230 PolarHBondContact OG1-N 3.3Å; T228-E230 VanDerWaalsContact OG1-N 3.12Å
229	S	91.5	Very high	95.9	Very high	90 Å²	90	52.6 Å²	52.6	63%	0.629	26%	0.257	S	S	*	.			trans	-92.3	-7.4	166.6	57	0	0	0	0	112.6
230	E	93.1	Very high	95.9	Very high	101 Å²	101	48.2 Å²	48.2	47%	0.472	24%	0.237	S	C	.	.			trans	-61.6	144	176.5	-63.6	172	-151.3	0	0	111.7	K204 T228	K204-E230 WeakPolarHBondContact CE-OE2 3.31Å; K204-E230 IonicContact NZ-OE1 2.94Å; K204-E230 PolarHBondContact NZ-OE1 3.27Å; K204-E230 IonicContact NZ-OE2 3.89Å; K204-E230 PolarHBondContact NZ-OE2 3.41Å; T228-E230 VanDerWaalsContact OG1-CB 3.31Å; T228-E230 WeakPolarHBondContact OG1-CB 3.01Å; T228-E230 WeakPolarHBondContact OG1-CG 3.32Å; T228-E230 PolarHBondContact OG1-N 3.3Å; T228-E230 VanDerWaalsContact OG1-N 3.12Å
231	K	95.6	Very high	95.8	Very high	80 Å²	80	46 Å²	46	35%	0.348	23%	0.228	S	C	.	.			trans	-93.7	153.9	-178.2	-69	169.9	176.5	-174.9	0	111.2	G235 N236 T237 E263 M264	K231-G235 VanDerWaalsContact CD-O 3.22Å; K231-G235 WeakPolarHBondContact CD-O 3.33Å; K231-G235 WeakPolarHBondContact CG-O 3.43Å; K231-N236 WeakPolarHBondContact CA-O 3.41Å; K231-T237 HydrophobicContact CD-CG2 4.47Å; K231-T237 HydrophobicContact CG-CG2 3.89Å; K231-E263 WeakPolarHBondContact CE-OE1 3.16Å; K231-E263 IonicContact NZ-OE1 3.41Å; K231-E263 PolarHBondContact NZ-OE1 2.95Å; K231-M264 PolarHBondContact NZ-O 3.16Å
232	D	97.1	Very high	95.8	Very high	12 Å²	12	46 Å²	46	6%	0.064	23%	0.228	C	C	.	.			trans	-69.1	177.1	165.8	76.5	4.7	0	0	0	111.6	K201 R203 L207 E234 G235 N236	K201-D232 WeakPolarHBondContact O-CB 3.4Å; R203-D232 HydrophobicContact CG-CB 3.63Å; L207-D232 HydrophobicContact CD2-CB 4.08Å; D232-E234 PolarHBondContact O-N 2.66Å; D232-E234 VanDerWaalsContact O-N 3.09Å; D232-E234 WeakPolarHBondContact OD1-CA 3.37Å; D232-E234 WeakPolarHBondContact OD1-CB 3.43Å; D232-E234 PolarHBondContact OD1-N 3.18Å; D232-G235 PolarHBondContact O-N 3.2Å; D232-G235 PolarHBondContact OD1-N 3.18Å; D232-G235 VanDerWaalsContact OD1-N 3.12Å; D232-N236 PolarHBondContact N-O 3.49Å; D232-N236 WeakPolarHBondContact OD1-CB 3.45Å; D232-N236 PolarHBondContact OD1-N 2.99Å; D232-N236 PolarHBondContact OD1-ND2 3Å; D232-N236 PolarHBondContact OD2-ND2 3.43Å; D232-N236 VanDerWaalsContact OD2-ND2 3.13Å
233	K	96.8	Very high	95.9	Very high	132 Å²	132	44.9 Å²	44.9	57%	0.574	22%	0.221	S	C	*	.	T	Hydrogen-bonded Turn	trans	-65.3	-7.7	178.9	-73.6	-175.8	-177.7	178.6	0	114.5	E200 K201	E200-K233 WeakPolarHBondContact O-CD 3.31Å; E200-K233 WeakPolarHBondContact O-CE 3.41Å; E200-K233 PolarHBondContact O-NZ 3.12Å; E200-K233 IonicContact OE2-NZ 3.17Å; K201-K233 WeakPolarHBondContact O-CB 3.29Å; K201-K233 WeakPolarHBondContact O-CG 3.25Å; K201-K233 PolarHBondContact O-N 3.46Å
234	E	93.3	Very high	95.9	Very high	113 Å²	113	41.7 Å²	41.7	53%	0.528	21%	0.207	S	C	.	.	T	Hydrogen-bonded Turn	trans	-101.9	5.7	172.6	-66	175.9	-170.9	0	0	111.3	D232 N236	D232-E234 PolarHBondContact O-N 2.66Å; D232-E234 VanDerWaalsContact O-N 3.09Å; D232-E234 WeakPolarHBondContact OD1-CA 3.37Å; D232-E234 WeakPolarHBondContact OD1-CB 3.43Å; D232-E234 PolarHBondContact OD1-N 3.18Å; E234-N236 VanDerWaalsContact C-N 3.31Å; E234-N236 WeakPolarHBondContact CB-ND2 3.5Å; E234-N236 PolarHBondContact O-N 3.11Å; E234-N236 PolarHBondContact OE2-ND2 2.6Å
235	G	95.7	Very high	95.9	Very high	0 Å²	0	45.2 Å²	45.2	0%	0	22%	0.222	C	C	.	.			trans	77.4	9.9	-176.5	0	0	0	0	0	114.5	K231 D232 N265	K231-G235 VanDerWaalsContact CD-O 3.22Å; K231-G235 WeakPolarHBondContact CD-O 3.33Å; K231-G235 WeakPolarHBondContact CG-O 3.43Å; D232-G235 PolarHBondContact O-N 3.2Å; D232-G235 PolarHBondContact OD1-N 3.18Å; D232-G235 VanDerWaalsContact OD1-N 3.12Å; G235-N265 VanDerWaalsContact O-CA 3.23Å; G235-N265 WeakPolarHBondContact O-CA 3.4Å; G235-N265 WeakPolarHBondContact O-CB 3.44Å
236	N	96.7	Very high	96	Very high	8 Å²	8	40.2 Å²	40.2	4%	0.043	20%	0.2	C	C	.	.			trans	-79.3	133.8	-177.9	-56.7	-54.9	0	0	0	110.8	K231 D232 E234 H240 L241 N265	K231-N236 WeakPolarHBondContact CA-O 3.41Å; D232-N236 PolarHBondContact N-O 3.49Å; D232-N236 WeakPolarHBondContact OD1-CB 3.45Å; D232-N236 PolarHBondContact OD1-N 2.99Å; D232-N236 PolarHBondContact OD1-ND2 3Å; D232-N236 PolarHBondContact OD2-ND2 3.43Å; D232-N236 VanDerWaalsContact OD2-ND2 3.13Å; E234-N236 VanDerWaalsContact C-N 3.31Å; E234-N236 WeakPolarHBondContact CB-ND2 3.5Å; E234-N236 PolarHBondContact O-N 3.11Å; E234-N236 PolarHBondContact OE2-ND2 2.6Å; N236-H240 HydrophobicContact CB-CB 3.84Å; N236-L241 HydrophobicContact CB-CD2 3.98Å; N236-L241 HydrophobicContact CB-CG 4.1Å; N236-N265 PolarHBondContact OD1-ND2 2.83Å
237	T	96.3	Very high	96	Very high	2 Å²	2	42.4 Å²	42.4	1%	0.012	21%	0.21	C	C	.	.			trans	-85.4	173.7	167.1	69.3	0	0	0	0	111	K231 L239 H240 L241 E263	K231-T237 HydrophobicContact CD-CG2 4.47Å; K231-T237 HydrophobicContact CG-CG2 3.89Å; T237-L239 PolarHBondContact O-N 3.22Å; T237-L239 PolarHBondContact OG1-N 3.47Å; T237-H240 PolarHBondContact N-ND1 2.9Å; T237-H240 PolarHBondContact O-N 3.21Å; T237-H240 VanDerWaalsContact O-N 3.17Å; T237-H240 PolarHBondContact OG1-ND1 2.98Å; T237-L241 WeakPolarHBondContact O-CG 3.49Å; T237-L241 PolarHBondContact O-N 2.99Å; T237-L241 VanDerWaalsContact O-N 3.12Å; T237-E263 HydrophobicContact CG2-CG 4.41Å
238	A	96.8	Very high	96.1	Very high	1 Å²	1	39 Å²	39	1%	0.008	20%	0.198	C	C	.	.	H	α-helix	trans	-53.1	-40	171.6	0	0	0	0	0	112.5	F206 A210 L241 A242 L254	F206-A238 HydrophobicContact CD1-CB 4.05Å; F206-A238 HydrophobicContact CE1-CB 3.74Å; A210-A238 HydrophobicContact CB-CB 3.65Å; A210-A238 WeakPolarHBondContact CB-O 3.14Å; A238-L241 PolarHBondContact O-N 3.09Å; A238-A242 WeakPolarHBondContact O-CB 3.42Å; A238-A242 PolarHBondContact O-N 3.29Å; A238-L254 HydrophobicContact CB-CD1 4.08Å; A238-L254 HydrophobicContact CB-CD2 3.94Å
239	L	96.6	Very high	96.3	Very high	1 Å²	1	42.1 Å²	42.1	1%	0.005	22%	0.218	C	C	.	.	H	α-helix	trans	-62.8	-44.8	178.3	-170.8	70	0	0	0	111.9	T237 L241 A242 A243 V251 L254 L255 Q259 S271	T237-L239 PolarHBondContact O-N 3.22Å; T237-L239 PolarHBondContact OG1-N 3.47Å; L239-L241 VanDerWaalsContact C-N 3.34Å; L239-L241 PolarHBondContact O-N 3.23Å; L239-A242 PolarHBondContact O-N 3.43Å; L239-A243 VanDerWaalsContact O-CB 3.23Å; L239-A243 WeakPolarHBondContact O-CB 3.4Å; L239-A243 PolarHBondContact O-N 3.19Å; L239-V251 HydrophobicContact CD1-CB 4.23Å; L239-V251 HydrophobicContact CD1-CG1 3.58Å; L239-V251 HydrophobicContact CD1-CG2 4.29Å; L239-L254 HydrophobicContact CD1-CB 4.36Å; L239-L255 HydrophobicContact CD1-CD2 3.96Å; L239-L255 HydrophobicContact CD1-CG 3.99Å; L239-L255 HydrophobicContact CD2-CD2 3.88Å; L239-Q259 HydrophobicContact CB-CG 4.16Å; L239-Q259 HydrophobicContact CD2-CG 4.33Å; L239-S271 WeakPolarHBondContact CG-OG 3.39Å
240	H	97.1	Very high	96.6	Very high	1 Å²	1	37.9 Å²	37.9	1%	0.005	19%	0.188	C	C	.	.	H	α-helix	trans	-60.4	-43.5	176.8	-67.8	95.3	0	0	0	111.6	N236 T237 A243 K244 E263 N265 I269 S271 I274	N236-H240 HydrophobicContact CB-CB 3.84Å; T237-H240 PolarHBondContact N-ND1 2.9Å; T237-H240 PolarHBondContact O-N 3.21Å; T237-H240 VanDerWaalsContact O-N 3.17Å; T237-H240 PolarHBondContact OG1-ND1 2.98Å; H240-A243 PolarHBondContact O-N 3.43Å; H240-K244 WeakPolarHBondContact O-CB 3.37Å; H240-K244 PolarHBondContact O-N 3.11Å; H240-E263 PolarHBondContact CE1-O 3.32Å; H240-E263 PolarHBondContact NE2-O 3.32Å; H240-N265 PolarHBondContact NE2-N 3.36Å; H240-I269 PolarHBondContact NE2-O 2.96Å; H240-I269 VanDerWaalsContact NE2-O 3.11Å; H240-S271 WeakPolarHBondContact CA-OG 3.42Å; H240-S271 PolarHBondContact N-OG 3.24Å; H240-I274 HydrophobicContact CB-CD1 3.91Å
241	L	97.8	Very high	96.8	Very high	2 Å²	2	33 Å²	33	1%	0.01	17%	0.166	C	C	.	.	H	α-helix	trans	-68.5	-42.6	-179.6	-65.6	176	0	0	0	112.2	L207 E211 N236 T237 A238 L239 A243 K244	L207-L241 HydrophobicContact CB-CD1 3.69Å; L207-L241 HydrophobicContact CD2-CD1 4.15Å; L207-L241 HydrophobicContact CG-CD1 3.92Å; E211-L241 HydrophobicContact CB-CB 3.95Å; E211-L241 HydrophobicContact CB-CD1 4.4Å; E211-L241 HydrophobicContact CG-CB 4.4Å; N236-L241 HydrophobicContact CB-CD2 3.98Å; N236-L241 HydrophobicContact CB-CG 4.1Å; T237-L241 WeakPolarHBondContact O-CG 3.49Å; T237-L241 PolarHBondContact O-N 2.99Å; T237-L241 VanDerWaalsContact O-N 3.12Å; A238-L241 PolarHBondContact O-N 3.09Å; L239-L241 VanDerWaalsContact C-N 3.34Å; L239-L241 PolarHBondContact O-N 3.23Å; L241-A243 VanDerWaalsContact C-N 3.32Å; L241-A243 PolarHBondContact O-N 2.88Å; L241-K244 WeakPolarHBondContact O-CB 3.36Å; L241-K244 PolarHBondContact O-N 2.94Å
242	A	98	Very high	96.8	Very high	0 Å²	0	34.4 Å²	34.4	0%	0	17%	0.173	C	C	.	.	H	α-helix	trans	-63.7	-39.5	174	0	0	0	0	0	111.5	A210 A238 L239 H245 G246 H247 A250 V251 L254	A210-A242 HydrophobicContact CB-CB 4.44Å; A210-A242 VanDerWaalsContact O-CA 3.32Å; A210-A242 WeakPolarHBondContact O-CA 3.49Å; A210-A242 WeakPolarHBondContact O-CB 3.29Å; A238-A242 WeakPolarHBondContact O-CB 3.42Å; A238-A242 PolarHBondContact O-N 3.29Å; L239-A242 PolarHBondContact O-N 3.43Å; A242-H245 PolarHBondContact O-N 3.21Å; A242-G246 PolarHBondContact O-N 3.24Å; A242-G246 VanDerWaalsContact O-N 3.15Å; A242-H247 PolarHBondContact O-N 2.83Å; A242-A250 HydrophobicContact CB-CB 4.33Å; A242-V251 HydrophobicContact CB-CG2 3.67Å; A242-L254 HydrophobicContact CB-CD1 3.97Å
243	A	97.8	Very high	96.7	Very high	0 Å²	0	34.9 Å²	34.9	0%	0	18%	0.177	C	C	.	.	H	α-helix	trans	-67.6	-35	178.1	0	0	0	0	0	113.3	L239 H240 L241 H245 G246 I274 A275 H280 L283	L239-A243 VanDerWaalsContact O-CB 3.23Å; L239-A243 WeakPolarHBondContact O-CB 3.4Å; L239-A243 PolarHBondContact O-N 3.19Å; H240-A243 PolarHBondContact O-N 3.43Å; L241-A243 VanDerWaalsContact C-N 3.32Å; L241-A243 PolarHBondContact O-N 2.88Å; A243-H245 PolarHBondContact O-N 3.45Å; A243-G246 PolarHBondContact O-N 3.13Å; A243-G246 VanDerWaalsContact O-N 3.15Å; A243-I274 HydrophobicContact CB-CG2 4.46Å; A243-A275 HydrophobicContact CB-CB 4.5Å; A243-H280 PolarHBondContact O-CD2 3.41Å; A243-H280 VanDerWaalsContact O-CD2 3.24Å; A243-L283 HydrophobicContact CB-CD2 3.86Å
244	K	97.5	Very high	96.6	Very high	76 Å²	76	28.9 Å²	28.9	33%	0.33	15%	0.151	S	C	.	.	H	α-helix	trans	-54.1	-36.5	175.5	-170.7	178.4	-179.3	176.6	0	112.9	H240 L241 I274 N278 H280	H240-K244 WeakPolarHBondContact O-CB 3.37Å; H240-K244 PolarHBondContact O-N 3.11Å; L241-K244 WeakPolarHBondContact O-CB 3.36Å; L241-K244 PolarHBondContact O-N 2.94Å; K244-I274 HydrophobicContact CB-CG2 3.76Å; K244-I274 HydrophobicContact CG-CG2 4.3Å; K244-N278 PolarHBondContact O-ND2 2.95Å; K244-H280 PolarHBondContact O-NE2 2.96Å
245	H	96.1	Very high	96.6	Very high	84 Å²	84	25.1 Å²	25.1	39%	0.389	13%	0.134	S	C	.	.	T	Hydrogen-bonded Turn	trans	-107.7	8.5	-178.5	-65.5	-45.6	0	0	0	114	E211 A242 A243 H247	E211-H245 PolarHBondContact O-CD2 3.22Å; E211-H245 VanDerWaalsContact O-CD2 3.27Å; A242-H245 PolarHBondContact O-N 3.21Å; A243-H245 PolarHBondContact O-N 3.45Å; H245-H247 VanDerWaalsContact C-N 3.32Å; H245-H247 VanDerWaalsContact CB-NE2 3.35Å; H245-H247 WeakPolarHBondContact CB-NE2 3.43Å; H245-H247 PolarHBondContact O-N 3.1Å
246	G	97.4	Very high	96.2	Very high	19 Å²	19	29.9 Å²	29.9	20%	0.196	16%	0.164	C	C	.	.	T	Hydrogen-bonded Turn	trans	71.8	25.4	171.1	0	0	0	0	0	113.7	A242 A243 S248 H280	A242-G246 PolarHBondContact O-N 3.24Å; A242-G246 VanDerWaalsContact O-N 3.15Å; A243-G246 PolarHBondContact O-N 3.13Å; A243-G246 VanDerWaalsContact O-N 3.15Å; G246-S248 VanDerWaalsContact C-N 3.26Å; G246-S248 PolarHBondContact O-N 3.2Å; G246-H280 WeakPolarHBondContact CA-CD2 3.31Å; G246-H280 PolarHBondContact N-CD2 3.38Å; G246-H280 VanDerWaalsContact N-CD2 3.28Å; G246-H280 PolarHBondContact N-NE2 2.89Å
247	H	98.2	Very high	95.2	Very high	54 Å²	54	32.7 Å²	32.7	25%	0.25	18%	0.176	C	C	.	.			trans	-78.4	71.8	-176.7	-63.7	-50.6	0	0	0	111.5	E211 R212 G213 A242 H245 A250 V251	E211-H247 PolarHBondContact O-CD2 3.36Å; E211-H247 PolarHBondContact O-NE2 3.27Å; R212-H247 VanDerWaalsContact C-NE2 3.33Å; R212-H247 PolarHBondContact O-NE2 3.22Å; G213-H247 WeakPolarHBondContact CA-CD2 3.4Å; G213-H247 PolarHBondContact N-CD2 2.81Å; A242-H247 PolarHBondContact O-N 2.83Å; H245-H247 VanDerWaalsContact C-N 3.32Å; H245-H247 VanDerWaalsContact CB-NE2 3.35Å; H245-H247 WeakPolarHBondContact CB-NE2 3.43Å; H245-H247 PolarHBondContact O-N 3.1Å; H247-A250 HydrophobicContact CB-CB 3.94Å; H247-A250 WeakPolarHBondContact O-CB 3.5Å; H247-A250 PolarHBondContact O-N 3.33Å; H247-V251 PolarHBondContact O-N 3.37Å
248	S	96.5	Very high	93.9	Very high	30 Å²	30	44.3 Å²	44.3	21%	0.21	22%	0.22	C	C	.	.	H	α-helix	trans	-51.2	-44.8	-176.9	-53.7	0	0	0	0	114.3	G246 A250 V251 Q252 L283	G246-S248 VanDerWaalsContact C-N 3.26Å; G246-S248 PolarHBondContact O-N 3.2Å; S248-A250 VanDerWaalsContact C-N 3.33Å; S248-A250 PolarHBondContact O-N 3.39Å; S248-V251 PolarHBondContact O-N 3.28Å; S248-Q252 WeakPolarHBondContact O-CB 3.46Å; S248-Q252 PolarHBondContact O-N 3.13Å; S248-L283 WeakPolarHBondContact OG-CA 3.35Å; S248-L283 WeakPolarHBondContact OG-CB 3.39Å
249	P	97.4	Very high	92.9	Very high	79 Å²	79	45.9 Å²	45.9	51%	0.513	23%	0.227	S	C	.	.	H	α-helix	trans	-62.5	-38.3	177.6	-24.7	36.5	0	0	0	113.3	V215 Q252 V253	V215-P249 HydrophobicContact CG2-CB 3.76Å; P249-Q252 PolarHBondContact O-N 3.33Å; P249-V253 PolarHBondContact O-N 3.43Å; P249-V253 VanDerWaalsContact O-N 3.08Å
250	A	97.5	Very high	92.5	Very high	0 Å²	0	50.3 Å²	50.3	0%	0	25%	0.251	C	S	.	.	H	α-helix	trans	-68.6	-41.8	176.4	0	0	0	0	0	111.4	V215 I218 A242 H247 S248 Q252 V253 L254	V215-A250 HydrophobicContact CG2-CB 4.26Å; I218-A250 HydrophobicContact CD1-CB 3.72Å; A242-A250 HydrophobicContact CB-CB 4.33Å; H247-A250 HydrophobicContact CB-CB 3.94Å; H247-A250 WeakPolarHBondContact O-CB 3.5Å; H247-A250 PolarHBondContact O-N 3.33Å; S248-A250 VanDerWaalsContact C-N 3.33Å; S248-A250 PolarHBondContact O-N 3.39Å; A250-Q252 VanDerWaalsContact C-N 3.32Å; A250-Q252 PolarHBondContact O-N 3.09Å; A250-V253 PolarHBondContact O-N 2.99Å; A250-L254 WeakPolarHBondContact O-CB 3.04Å; A250-L254 WeakPolarHBondContact O-CG 3.43Å; A250-L254 PolarHBondContact O-N 2.77Å
251	V	96.8	Very high	92.1	Very high	0 Å²	0	51.3 Å²	51.3	0%	0	26%	0.256	C	S	.	.	H	α-helix	trans	-60	-43.3	174.3	171.2	0	0	0	0	110.9	L239 A242 H247 S248 V253 L254 L255 L283 F286 L287	L239-V251 HydrophobicContact CD1-CB 4.23Å; L239-V251 HydrophobicContact CD1-CG1 3.58Å; L239-V251 HydrophobicContact CD1-CG2 4.29Å; A242-V251 HydrophobicContact CB-CG2 3.67Å; H247-V251 PolarHBondContact O-N 3.37Å; S248-V251 PolarHBondContact O-N 3.28Å; V251-V253 PolarHBondContact O-N 2.98Å; V251-L254 PolarHBondContact O-N 3.4Å; V251-L255 HydrophobicContact CG1-CD1 4.13Å; V251-L255 HydrophobicContact CG1-CG 4.49Å; V251-L255 WeakPolarHBondContact O-CG 3.1Å; V251-L255 PolarHBondContact O-N 2.9Å; V251-L283 HydrophobicContact CB-CD1 3.81Å; V251-L283 HydrophobicContact CG1-CD1 3.65Å; V251-L283 HydrophobicContact CG2-CD1 3.83Å; V251-L283 HydrophobicContact CG2-CD2 4.21Å; V251-F286 HydrophobicContact CG1-CD1 4.17Å; V251-F286 HydrophobicContact CG1-CE1 3.88Å; V251-L287 HydrophobicContact CG1-CD2 3.96Å
252	Q	95.1	Very high	91.7	Very high	108 Å²	108	53.7 Å²	53.7	51%	0.505	27%	0.269	S	S	.	.	H	α-helix	trans	-59	-48.7	176.5	-174.3	179.3	3.6	0	0	111.8	S248 P249 A250 L254 L255 T256 F286	S248-Q252 WeakPolarHBondContact O-CB 3.46Å; S248-Q252 PolarHBondContact O-N 3.13Å; P249-Q252 PolarHBondContact O-N 3.33Å; A250-Q252 VanDerWaalsContact C-N 3.32Å; A250-Q252 PolarHBondContact O-N 3.09Å; Q252-L254 VanDerWaalsContact C-N 3.35Å; Q252-L254 PolarHBondContact O-N 3.35Å; Q252-L255 PolarHBondContact O-N 2.91Å; Q252-T256 WeakPolarHBondContact O-CG2 3.49Å; Q252-T256 PolarHBondContact O-N 3.2Å; Q252-F286 HydrophobicContact CB-CE1 4.25Å; Q252-F286 HydrophobicContact CB-CE2 4.45Å; Q252-F286 HydrophobicContact CB-CZ 3.87Å; Q252-F286 HydrophobicContact CG-CE2 4.24Å; Q252-F286 HydrophobicContact CG-CZ 3.94Å
253	V	95.4	Very high	91.4	Very high	22 Å²	22	55.9 Å²	55.9	13%	0.133	28%	0.279	C	S	.	.	H	α-helix	trans	-66.2	-35.2	177.9	171.1	0	0	0	0	112.5	V215 I218 E219 P249 A250 V251 T256	V215-V253 HydrophobicContact CG1-CG2 3.8Å; I218-V253 HydrophobicContact CG2-CG1 4.12Å; E219-V253 HydrophobicContact CG-CG1 3.87Å; P249-V253 PolarHBondContact O-N 3.43Å; P249-V253 VanDerWaalsContact O-N 3.08Å; A250-V253 PolarHBondContact O-N 2.99Å; V251-V253 PolarHBondContact O-N 2.98Å; V253-T256 PolarHBondContact O-N 2.93Å; V253-T256 PolarHBondContact O-OG1 3.2Å
254	L	95.2	Very high	91	Very high	6 Å²	6	58.3 Å²	58.3	3%	0.031	29%	0.291	C	S	.	.	H	α-helix	trans	-66.4	-38.5	176.2	-71.7	167.5	0	0	0	112	F206 A210 I218 A238 L239 A242 A250 V251 Q252 Q257	F206-L254 HydrophobicContact CE1-CD2 3.87Å; F206-L254 HydrophobicContact CZ-CD2 3.62Å; A210-L254 HydrophobicContact CB-CD1 4.03Å; I218-L254 HydrophobicContact CD1-CG 4.43Å; I218-L254 HydrophobicContact CG2-CD2 3.9Å; I218-L254 HydrophobicContact CG2-CG 4.45Å; A238-L254 HydrophobicContact CB-CD1 4.08Å; A238-L254 HydrophobicContact CB-CD2 3.94Å; L239-L254 HydrophobicContact CD1-CB 4.36Å; A242-L254 HydrophobicContact CB-CD1 3.97Å; A250-L254 WeakPolarHBondContact O-CB 3.04Å; A250-L254 WeakPolarHBondContact O-CG 3.43Å; A250-L254 PolarHBondContact O-N 2.77Å; V251-L254 PolarHBondContact O-N 3.4Å; Q252-L254 VanDerWaalsContact C-N 3.35Å; Q252-L254 PolarHBondContact O-N 3.35Å; L254-Q257 PolarHBondContact O-N 3.16Å
255	L	92.6	Very high	90.7	Very high	34 Å²	34	55 Å²	55	18%	0.178	28%	0.277	C	S	.	.	H	α-helix	trans	-72.1	-27.7	178.9	-70.5	178.1	0	0	0	113.1	L239 V251 Q252 Q257 I261 F286 L287 E290	L239-L255 HydrophobicContact CD1-CD2 3.96Å; L239-L255 HydrophobicContact CD1-CG 3.99Å; L239-L255 HydrophobicContact CD2-CD2 3.88Å; V251-L255 HydrophobicContact CG1-CD1 4.13Å; V251-L255 HydrophobicContact CG1-CG 4.49Å; V251-L255 WeakPolarHBondContact O-CG 3.1Å; V251-L255 PolarHBondContact O-N 2.9Å; Q252-L255 PolarHBondContact O-N 2.91Å; L255-Q257 PolarHBondContact O-N 3.13Å; L255-I261 HydrophobicContact CD1-CD1 3.96Å; L255-I261 HydrophobicContact CD1-CG1 4.25Å; L255-I261 HydrophobicContact CD2-CB 3.92Å; L255-I261 HydrophobicContact CD2-CG1 4.15Å; L255-F286 HydrophobicContact CD1-CE1 3.81Å; L255-F286 HydrophobicContact CD1-CZ 4.23Å; L255-L287 HydrophobicContact CD1-CD2 4.32Å; L255-E290 HydrophobicContact CD1-CG 4.45Å
256	T	88.5	Confident	90.5	Very high	101 Å²	101	57.6 Å²	57.6	62%	0.62	29%	0.29	S	S	*	.	H	α-helix	trans	-70.2	-22	173.5	61.3	0	0	0	0	112.9	Q252 V253	Q252-T256 WeakPolarHBondContact O-CG2 3.49Å; Q252-T256 PolarHBondContact O-N 3.2Å; V253-T256 PolarHBondContact O-N 2.93Å; V253-T256 PolarHBondContact O-OG1 3.2Å
257	Q	75.4	Confident	90.1	Very high	66 Å²	66	61 Å²	61	31%	0.308	30%	0.303	S	S	.	.	T	Hydrogen-bonded Turn	trans	-104.1	25.4	-173.6	-64.1	-167.9	-12.6	0	0	114.3	T222 L254 L255	T222-Q257 VanDerWaalsContact CB-OE1 3.24Å; T222-Q257 PolarHBondContact OG1-OE1 2.9Å; L254-Q257 PolarHBondContact O-N 3.16Å; L255-Q257 PolarHBondContact O-N 3.13Å
258	W	68	Low	89.6	Confident	246 Å²	246	61.6 Å²	61.6	93%	0.932	31%	0.308	S	S	*	.	S	Bend	trans	74	71	177	-54.3	-72.7	0	0	0	115.8
259	Q	75.3	Confident	89.3	Confident	34 Å²	34	61.9 Å²	61.9	16%	0.159	31%	0.306	C	S	.	.			trans	-119.6	135.4	158.1	-156.6	78.1	38.2	0	0	110.1	L239 I261 E263	L239-Q259 HydrophobicContact CB-CG 4.16Å; L239-Q259 HydrophobicContact CD2-CG 4.33Å; Q259-I261 PolarHBondContact O-N 3.12Å; Q259-E263 PolarHBondContact NE2-OE2 3.4Å
260	D	88.1	Confident	89.1	Confident	95 Å²	95	58.4 Å²	58.4	51%	0.508	28%	0.284	S	S	.	.			trans	-65.2	113.9	168.8	178.2	3.9	0	0	0	109.1	N262 E263	D260-N262 PolarHBondContact O-N 2.8Å; D260-N262 VanDerWaalsContact O-N 3.17Å; D260-N262 WeakPolarHBondContact OD1-CB 3.18Å; D260-N262 PolarHBondContact OD1-N 2.82Å; D260-E263 HydrophobicContact CB-CB 4.19Å; D260-E263 VanDerWaalsContact O-CB 3.31Å; D260-E263 WeakPolarHBondContact O-CB 3.11Å; D260-E263 PolarHBondContact O-N 3.4Å; D260-E263 VanDerWaalsContact O-N 3.09Å
261	I	89.5	Confident	89	Confident	21 Å²	21	58.4 Å²	58.4	11%	0.108	28%	0.284	C	S	.	.	T	Hydrogen-bonded Turn	trans	-59	-25.8	179.7	-166.5	172.2	0	0	0	112.5	L255 Q259 L287 E290 V292	L255-I261 HydrophobicContact CD1-CD1 3.96Å; L255-I261 HydrophobicContact CD1-CG1 4.25Å; L255-I261 HydrophobicContact CD2-CB 3.92Å; L255-I261 HydrophobicContact CD2-CG1 4.15Å; Q259-I261 PolarHBondContact O-N 3.12Å; I261-L287 HydrophobicContact CD1-CD2 3.8Å; I261-L287 HydrophobicContact CG1-CD2 3.95Å; I261-E290 HydrophobicContact CD1-CB 3.53Å; I261-E290 HydrophobicContact CD1-CG 4.44Å; I261-V292 HydrophobicContact CD1-CB 4.11Å; I261-V292 HydrophobicContact CD1-CG2 4.4Å; I261-V292 HydrophobicContact CG1-CB 4.47Å; I261-V292 HydrophobicContact CG1-CG2 4.23Å
262	N	89.6	Confident	88.9	Confident	53 Å²	53	58.5 Å²	58.5	28%	0.283	29%	0.285	S	S	.	.	T	Hydrogen-bonded Turn	trans	-97.5	3.4	-177.7	-61.2	-52	0	0	0	113.1	D260 M264 V292 D293	D260-N262 PolarHBondContact O-N 2.8Å; D260-N262 VanDerWaalsContact O-N 3.17Å; D260-N262 WeakPolarHBondContact OD1-CB 3.18Å; D260-N262 PolarHBondContact OD1-N 2.82Å; N262-M264 PolarHBondContact O-N 3.07Å; N262-V292 WeakPolarHBondContact OD1-CG2 3.49Å; N262-D293 WeakPolarHBondContact OD1-CB 3.49Å; N262-D293 PolarHBondContact OD1-N 3.03Å
263	E	90.6	Very high	88.8	Confident	45 Å²	45	53.5 Å²	53.5	21%	0.21	26%	0.262	C	S	.	.			trans	-58.2	136.2	178.2	-171.9	170.5	-179	0	0	110.4	K231 T237 H240 Q259 D260	K231-E263 WeakPolarHBondContact CE-OE1 3.16Å; K231-E263 IonicContact NZ-OE1 3.41Å; K231-E263 PolarHBondContact NZ-OE1 2.95Å; T237-E263 HydrophobicContact CG2-CG 4.41Å; H240-E263 PolarHBondContact CE1-O 3.32Å; H240-E263 PolarHBondContact NE2-O 3.32Å; Q259-E263 PolarHBondContact NE2-OE2 3.4Å; D260-E263 HydrophobicContact CB-CB 4.19Å; D260-E263 VanDerWaalsContact O-CB 3.31Å; D260-E263 WeakPolarHBondContact O-CB 3.11Å; D260-E263 PolarHBondContact O-N 3.4Å; D260-E263 VanDerWaalsContact O-N 3.09Å
264	M	90.9	Very high	88.8	Confident	51 Å²	51	53.4 Å²	53.4	25%	0.251	26%	0.26	S	S	.	.	B	Isolated β-bridge	trans	-105.1	146.8	178.8	-62.7	-165.7	-79.2	0	0	111.5	K231 N262 N268 V298	K231-M264 PolarHBondContact NZ-O 3.16Å; N262-M264 PolarHBondContact O-N 3.07Å; M264-N268 HydrophobicContact SD-CB 4.13Å; M264-V298 HydrophobicContact CE-CG2 3.85Å
265	N	91.1	Very high	88.9	Confident	8 Å²	8	53.1 Å²	53.1	4%	0.043	26%	0.259	C	S	.	.			trans	-76.7	-179.3	170	72.1	6.1	0	0	0	112.4	G235 N236 H240 L267 N268 I269	G235-N265 VanDerWaalsContact O-CA 3.23Å; G235-N265 WeakPolarHBondContact O-CA 3.4Å; G235-N265 WeakPolarHBondContact O-CB 3.44Å; N236-N265 PolarHBondContact OD1-ND2 2.83Å; H240-N265 PolarHBondContact NE2-N 3.36Å; N265-L267 PolarHBondContact O-N 2.89Å; N265-L267 VanDerWaalsContact O-N 3.11Å; N265-L267 VanDerWaalsContact OD1-C 3.29Å; N265-L267 VanDerWaalsContact OD1-CA 3.32Å; N265-L267 WeakPolarHBondContact OD1-CA 3.46Å; N265-L267 WeakPolarHBondContact OD1-CB 3.22Å; N265-L267 PolarHBondContact OD1-N 3.18Å; N265-N268 PolarHBondContact O-N 2.91Å; N265-N268 PolarHBondContact OD1-N 2.89Å; N265-I269 PolarHBondContact N-O 3.49Å; N265-I269 VanDerWaalsContact N-O 3.13Å; N265-I269 WeakPolarHBondContact OD1-CB 3.38Å; N265-I269 PolarHBondContact OD1-N 3.12Å; N265-I269 PolarHBondContact OD1-O 3.33Å
266	E	91.1	Very high	89.1	Confident	138 Å²	138	51.5 Å²	51.5	65%	0.645	25%	0.25	S	S	*	.	T	Hydrogen-bonded Turn	trans	-62.1	-19.7	178.9	-78.2	178.7	-179.3	0	0	113	N268	E266-N268 VanDerWaalsContact C-N 3.31Å
267	L	88.6	Confident	89.4	Confident	91 Å²	91	53.3 Å²	53.3	48%	0.476	25%	0.246	S	C	.	.	T	Hydrogen-bonded Turn	trans	-89.7	14.3	172.3	-59.3	178.4	0	0	0	112.2	N265 I269 K301	N265-L267 PolarHBondContact O-N 2.89Å; N265-L267 VanDerWaalsContact O-N 3.11Å; N265-L267 VanDerWaalsContact OD1-C 3.29Å; N265-L267 VanDerWaalsContact OD1-CA 3.32Å; N265-L267 WeakPolarHBondContact OD1-CA 3.46Å; N265-L267 WeakPolarHBondContact OD1-CB 3.22Å; N265-L267 PolarHBondContact OD1-N 3.18Å; L267-I269 HydrophobicContact CB-CD1 3.89Å; L267-I269 HydrophobicContact CB-CG1 3.87Å; L267-I269 HydrophobicContact CD1-CD1 4.33Å; L267-I269 WeakPolarHBondContact O-CG1 3.2Å; L267-I269 PolarHBondContact O-N 3.01Å; L267-K301 VanDerWaalsContact C-NZ 3.3Å; L267-K301 WeakPolarHBondContact O-CD 3.49Å; L267-K301 VanDerWaalsContact O-CE 3.27Å; L267-K301 WeakPolarHBondContact O-CE 3.42Å; L267-K301 PolarHBondContact O-NZ 3.04Å
268	N	89.3	Confident	90.5	Very high	66 Å²	66	53.7 Å²	53.7	35%	0.353	25%	0.25	S	C	.	.	S	Bend	trans	50.6	38.5	-176.5	-60.7	-32	0	0	0	112.4	M264 N265 E266	M264-N268 HydrophobicContact SD-CB 4.13Å; N265-N268 PolarHBondContact O-N 2.91Å; N265-N268 PolarHBondContact OD1-N 2.89Å; E266-N268 VanDerWaalsContact C-N 3.31Å
269	I	90.1	Very high	91.9	Very high	35 Å²	35	42.9 Å²	42.9	18%	0.179	22%	0.215	C	C	.	.			trans	-110.8	129.3	177.3	-53	-179.7	0	0	0	107.7	H240 N265 L267 Q273 I274	H240-I269 PolarHBondContact NE2-O 2.96Å; H240-I269 VanDerWaalsContact NE2-O 3.11Å; N265-I269 PolarHBondContact N-O 3.49Å; N265-I269 VanDerWaalsContact N-O 3.13Å; N265-I269 WeakPolarHBondContact OD1-CB 3.38Å; N265-I269 PolarHBondContact OD1-N 3.12Å; N265-I269 PolarHBondContact OD1-O 3.33Å; L267-I269 HydrophobicContact CB-CD1 3.89Å; L267-I269 HydrophobicContact CB-CG1 3.87Å; L267-I269 HydrophobicContact CD1-CD1 4.33Å; L267-I269 WeakPolarHBondContact O-CG1 3.2Å; L267-I269 PolarHBondContact O-N 3.01Å; I269-Q273 HydrophobicContact CG2-CB 3.66Å; I269-I274 HydrophobicContact CG2-CD1 4.46Å; I269-I274 HydrophobicContact CG2-CG1 3.71Å
270	S	92.8	Very high	92.9	Very high	6 Å²	6	43.8 Å²	43.8	4%	0.042	22%	0.219	C	C	.	.	B	Isolated β-bridge	trans	-85	163.2	174.8	73.6	0	0	0	0	112.6	L272 Q273 I274	S270-L272 PolarHBondContact O-N 3.36Å; S270-Q273 PolarHBondContact O-N 2.95Å; S270-Q273 VanDerWaalsContact O-N 3.16Å; S270-Q273 PolarHBondContact OG-N 3.26Å; S270-I274 PolarHBondContact O-N 3.27Å; S270-I274 VanDerWaalsContact O-N 3.07Å
271	S	94.4	Very high	93.4	Very high	1 Å²	1	40.2 Å²	40.2	1%	0.007	20%	0.202	C	C	.	.	H	α-helix	trans	-60.1	-34.4	174.5	-64.4	0	0	0	0	112.6	L239 H240 I274 A275	L239-S271 WeakPolarHBondContact CG-OG 3.39Å; H240-S271 WeakPolarHBondContact CA-OG 3.42Å; H240-S271 PolarHBondContact N-OG 3.24Å; S271-I274 PolarHBondContact O-N 3.25Å; S271-A275 WeakPolarHBondContact O-CB 3.4Å; S271-A275 PolarHBondContact O-N 2.93Å
272	L	95.1	Very high	93.7	Very high	2 Å²	2	43.7 Å²	43.7	1%	0.01	23%	0.228	C	C	.	.	H	α-helix	trans	-60.4	-49.8	172.5	177.8	68.4	0	0	0	111.4	S270 I274 A275 T276 V284 L287 V292 L294 P304	S270-L272 PolarHBondContact O-N 3.36Å; L272-I274 VanDerWaalsContact C-N 3.3Å; L272-I274 PolarHBondContact O-N 3.03Å; L272-A275 PolarHBondContact O-N 2.95Å; L272-T276 WeakPolarHBondContact O-CB 3.35Å; L272-T276 PolarHBondContact O-N 3.44Å; L272-T276 PolarHBondContact O-OG1 3.45Å; L272-V284 HydrophobicContact CD1-CG1 4.02Å; L272-V284 HydrophobicContact CD1-CG2 4.49Å; L272-L287 HydrophobicContact CB-CD1 4.27Å; L272-L287 HydrophobicContact CD1-CB 4.01Å; L272-L287 HydrophobicContact CD1-CD1 4.19Å; L272-V292 HydrophobicContact CB-CG2 4.25Å; L272-V292 HydrophobicContact CD2-CG1 3.78Å; L272-V292 HydrophobicContact CD2-CG2 4.2Å; L272-L294 HydrophobicContact CD2-CD2 3.77Å; L272-P304 HydrophobicContact CD2-CB 4.39Å; L272-P304 HydrophobicContact CD2-CG 3.93Å; L272-P304 HydrophobicContact CG-CG 4.38Å
273	Q	93.6	Very high	94.1	Very high	3 Å²	3	41.2 Å²	41.2	1%	0.014	22%	0.215	C	C	.	.	H	α-helix	trans	-61.8	-38.3	179	-77.5	172	-52.3	0	0	112.3	I269 S270 T276 R277 E302 P304 L307	I269-Q273 HydrophobicContact CG2-CB 3.66Å; S270-Q273 PolarHBondContact O-N 2.95Å; S270-Q273 VanDerWaalsContact O-N 3.16Å; S270-Q273 PolarHBondContact OG-N 3.26Å; Q273-T276 PolarHBondContact O-N 2.98Å; Q273-R277 VanDerWaalsContact O-CB 3.27Å; Q273-R277 WeakPolarHBondContact O-CB 3.46Å; Q273-R277 PolarHBondContact O-N 3.34Å; Q273-E302 PolarHBondContact NE2-O 2.89Å; Q273-P304 HydrophobicContact CG-CG 4Å; Q273-L307 HydrophobicContact CB-CD1 3.7Å; Q273-L307 HydrophobicContact CG-CD1 3.83Å
274	I	95.4	Very high	94.5	Very high	20 Å²	20	39 Å²	39	10%	0.103	21%	0.205	C	C	.	.	H	α-helix	trans	-62.1	-48.4	174.5	-68.5	179.5	0	0	0	110.6	H240 A243 K244 I269 S270 S271 L272 T276 R277 N278	H240-I274 HydrophobicContact CB-CD1 3.91Å; A243-I274 HydrophobicContact CB-CG2 4.46Å; K244-I274 HydrophobicContact CB-CG2 3.76Å; K244-I274 HydrophobicContact CG-CG2 4.3Å; I269-I274 HydrophobicContact CG2-CD1 4.46Å; I269-I274 HydrophobicContact CG2-CG1 3.71Å; S270-I274 PolarHBondContact O-N 3.27Å; S270-I274 VanDerWaalsContact O-N 3.07Å; S271-I274 PolarHBondContact O-N 3.25Å; L272-I274 VanDerWaalsContact C-N 3.3Å; L272-I274 PolarHBondContact O-N 3.03Å; I274-T276 VanDerWaalsContact C-N 3.34Å; I274-T276 PolarHBondContact O-N 3.32Å; I274-R277 PolarHBondContact O-N 3.2Å; I274-N278 PolarHBondContact O-N 2.94Å; I274-N278 PolarHBondContact O-ND2 3.33Å
275	A	97.4	Very high	94.7	Very high	0 Å²	0	40.4 Å²	40.4	0%	0	21%	0.213	C	C	.	.	H	α-helix	trans	-61.7	-43.4	178.4	0	0	0	0	0	111.7	A243 S271 L272 N278 G279 H280 L283 V284 L287	A243-A275 HydrophobicContact CB-CB 4.5Å; S271-A275 WeakPolarHBondContact O-CB 3.4Å; S271-A275 PolarHBondContact O-N 2.93Å; L272-A275 PolarHBondContact O-N 2.95Å; A275-N278 PolarHBondContact O-N 3.43Å; A275-G279 PolarHBondContact O-N 3.22Å; A275-H280 HydrophobicContact CB-CB 4.47Å; A275-H280 PolarHBondContact O-N 2.95Å; A275-L283 HydrophobicContact CB-CD2 3.67Å; A275-L283 HydrophobicContact CB-CG 3.97Å; A275-V284 HydrophobicContact CB-CG2 3.93Å; A275-L287 HydrophobicContact CB-CD1 4.21Å
276	T	96.6	Very high	94.9	Very high	0 Å²	0	41.9 Å²	41.9	0%	0	22%	0.219	C	C	.	.	H	α-helix	trans	-63.1	-47	177.9	-64.8	0	0	0	0	112.4	L272 Q273 I274 N278 G279 P304 L307 A308 H313 V316 L320	L272-T276 WeakPolarHBondContact O-CB 3.35Å; L272-T276 PolarHBondContact O-N 3.44Å; L272-T276 PolarHBondContact O-OG1 3.45Å; Q273-T276 PolarHBondContact O-N 2.98Å; I274-T276 VanDerWaalsContact C-N 3.34Å; I274-T276 PolarHBondContact O-N 3.32Å; T276-N278 PolarHBondContact O-N 3.05Å; T276-G279 PolarHBondContact O-N 3.4Å; T276-G279 VanDerWaalsContact O-N 3.14Å; T276-P304 HydrophobicContact CG2-CB 4.31Å; T276-P304 WeakPolarHBondContact CG2-O 3.48Å; T276-L307 HydrophobicContact CG2-CB 4.08Å; T276-A308 HydrophobicContact CG2-CB 3.71Å; T276-H313 PolarHBondContact O-CD2 3.43Å; T276-H313 VanDerWaalsContact O-CD2 3.25Å; T276-V316 HydrophobicContact CG2-CG1 3.67Å; T276-L320 HydrophobicContact CG2-CD1 4.26Å
277	R	95.6	Very high	95.1	Very high	139 Å²	139	35.3 Å²	35.3	53%	0.525	19%	0.189	S	C	.	.	H	α-helix	trans	-59.8	-36.6	178.2	-178.5	176.4	-179.4	167.3	0.9	112.3	Q273 I274 H313	Q273-R277 VanDerWaalsContact O-CB 3.27Å; Q273-R277 WeakPolarHBondContact O-CB 3.46Å; Q273-R277 PolarHBondContact O-N 3.34Å; I274-R277 PolarHBondContact O-N 3.2Å; R277-H313 PolarHBondContact O-CD2 3.43Å; R277-H313 PolarHBondContact O-NE2 2.87Å
278	N	96.6	Very high	95.3	Very high	74 Å²	74	32.2 Å²	32.2	40%	0.396	17%	0.172	S	C	.	.	H	α-helix	trans	-88.6	-1.9	-179.8	-67	-63	0	0	0	113.9	K244 I274 A275 T276 H280	K244-N278 PolarHBondContact O-ND2 2.95Å; I274-N278 PolarHBondContact O-N 2.94Å; I274-N278 PolarHBondContact O-ND2 3.33Å; A275-N278 PolarHBondContact O-N 3.43Å; T276-N278 PolarHBondContact O-N 3.05Å; N278-H280 WeakPolarHBondContact CB-NE2 2.99Å
279	G	97.4	Very high	95.5	Very high	19 Å²	19	32.7 Å²	32.7	20%	0.196	18%	0.181	C	C	.	.	T	Hydrogen-bonded Turn	trans	79.7	19.6	173.5	0	0	0	0	0	115.2	A275 T276 A281 H313	A275-G279 PolarHBondContact O-N 3.22Å; T276-G279 PolarHBondContact O-N 3.4Å; T276-G279 VanDerWaalsContact O-N 3.14Å; G279-A281 VanDerWaalsContact C-N 3.26Å; G279-A281 PolarHBondContact O-N 3.09Å; G279-H313 VanDerWaalsContact CA-CD2 3.42Å; G279-H313 WeakPolarHBondContact CA-CD2 3.49Å; G279-H313 VanDerWaalsContact CA-CG 3.43Å; G279-H313 WeakPolarHBondContact CA-ND1 3.26Å; G279-H313 WeakPolarHBondContact CA-NE2 3.5Å; G279-H313 PolarHBondContact N-CD2 2.97Å; G279-H313 PolarHBondContact N-NE2 2.91Å
280	H	98.3	Very high	95.5	Very high	53 Å²	53	35.6 Å²	35.6	25%	0.245	19%	0.194	C	C	.	.			trans	-78.6	70.5	-176.6	-60.8	-48.1	0	0	0	111.6	A243 K244 G246 A275 N278 S282 L283 V284	A243-H280 PolarHBondContact O-CD2 3.41Å; A243-H280 VanDerWaalsContact O-CD2 3.24Å; K244-H280 PolarHBondContact O-NE2 2.96Å; G246-H280 WeakPolarHBondContact CA-CD2 3.31Å; G246-H280 PolarHBondContact N-CD2 3.38Å; G246-H280 VanDerWaalsContact N-CD2 3.28Å; G246-H280 PolarHBondContact N-NE2 2.89Å; A275-H280 HydrophobicContact CB-CB 4.47Å; A275-H280 PolarHBondContact O-N 2.95Å; N278-H280 WeakPolarHBondContact CB-NE2 2.99Å; H280-S282 VanDerWaalsContact C-N 3.33Å; H280-S282 PolarHBondContact O-N 3.42Å; H280-L283 HydrophobicContact CB-CB 4Å; H280-L283 WeakPolarHBondContact O-CB 3.48Å; H280-L283 PolarHBondContact O-N 3.35Å; H280-V284 WeakPolarHBondContact O-CG2 3.27Å; H280-V284 PolarHBondContact O-N 2.94Å
281	A	97.1	Very high	94.9	Very high	20 Å²	20	42.4 Å²	42.4	17%	0.165	23%	0.23	C	C	.	.	H	α-helix	trans	-54.6	-42.3	-171.8	0	0	0	0	0	114.2	G279 L283 V284 N285 V316	G279-A281 VanDerWaalsContact C-N 3.26Å; G279-A281 PolarHBondContact O-N 3.09Å; A281-L283 VanDerWaalsContact C-N 3.32Å; A281-L283 PolarHBondContact O-N 3.12Å; A281-V284 PolarHBondContact O-N 2.91Å; A281-N285 PolarHBondContact O-N 3.33Å; A281-N285 PolarHBondContact O-ND2 3.46Å; A281-V316 HydrophobicContact CB-CG2 3.98Å
282	S	96.9	Very high	94.5	Very high	93 Å²	93	42.9 Å²	42.9	65%	0.65	23%	0.233	S	C	*	.	H	α-helix	trans	-62.4	-39.5	177.1	-52.6	0	0	0	0	112.3	H280 F286	H280-S282 VanDerWaalsContact C-N 3.33Å; H280-S282 PolarHBondContact O-N 3.42Å; S282-F286 PolarHBondContact O-N 3.2Å
283	L	97.8	Very high	93.9	Very high	1 Å²	1	45.8 Å²	45.8	1%	0.005	25%	0.248	C	C	.	.	H	α-helix	trans	-70.8	-40.8	175.6	175.5	59.4	0	0	0	111.4	A243 S248 V251 A275 H280 A281 N285 F286 L287	A243-L283 HydrophobicContact CB-CD2 3.86Å; S248-L283 WeakPolarHBondContact OG-CA 3.35Å; S248-L283 WeakPolarHBondContact OG-CB 3.39Å; V251-L283 HydrophobicContact CB-CD1 3.81Å; V251-L283 HydrophobicContact CG1-CD1 3.65Å; V251-L283 HydrophobicContact CG2-CD1 3.83Å; V251-L283 HydrophobicContact CG2-CD2 4.21Å; A275-L283 HydrophobicContact CB-CD2 3.67Å; A275-L283 HydrophobicContact CB-CG 3.97Å; H280-L283 HydrophobicContact CB-CB 4Å; H280-L283 WeakPolarHBondContact O-CB 3.48Å; H280-L283 PolarHBondContact O-N 3.35Å; A281-L283 VanDerWaalsContact C-N 3.32Å; A281-L283 PolarHBondContact O-N 3.12Å; L283-N285 VanDerWaalsContact C-N 3.34Å; L283-N285 PolarHBondContact O-N 3.4Å; L283-F286 HydrophobicContact CD1-CD1 4.16Å; L283-F286 WeakPolarHBondContact O-CB 3.44Å; L283-F286 PolarHBondContact O-N 3.33Å; L283-L287 HydrophobicContact CD1-CD1 4.12Å; L283-L287 HydrophobicContact CD1-CD2 4.45Å; L283-L287 HydrophobicContact CD1-CG 3.97Å; L283-L287 HydrophobicContact CG-CD1 4Å; L283-L287 HydrophobicContact CG-CG 4.3Å; L283-L287 WeakPolarHBondContact O-CG 3.31Å; L283-L287 PolarHBondContact O-N 2.72Å
284	V	97.8	Very high	93.2	Very high	0 Å²	0	47 Å²	47	0%	0	26%	0.255	C	S	.	.	H	α-helix	trans	-59.6	-46.7	176.1	171.9	0	0	0	0	110.6	L272 A275 H280 A281 F286 L287 L288 V316 L320	L272-V284 HydrophobicContact CD1-CG1 4.02Å; L272-V284 HydrophobicContact CD1-CG2 4.49Å; A275-V284 HydrophobicContact CB-CG2 3.93Å; H280-V284 WeakPolarHBondContact O-CG2 3.27Å; H280-V284 PolarHBondContact O-N 2.94Å; A281-V284 PolarHBondContact O-N 2.91Å; V284-F286 VanDerWaalsContact C-N 3.29Å; V284-F286 PolarHBondContact O-N 2.99Å; V284-L287 PolarHBondContact O-N 3.23Å; V284-L288 HydrophobicContact CG1-CD1 3.66Å; V284-L288 HydrophobicContact CG1-CG 4.16Å; V284-L288 WeakPolarHBondContact O-CB 3.47Å; V284-L288 WeakPolarHBondContact O-CG 3.34Å; V284-L288 PolarHBondContact O-N 2.88Å; V284-V316 HydrophobicContact CB-CG1 4.38Å; V284-V316 HydrophobicContact CG1-CG1 4.06Å; V284-V316 HydrophobicContact CG2-CG1 4.01Å; V284-V316 HydrophobicContact CG2-CG2 4.42Å; V284-L320 HydrophobicContact CG1-CD2 4.43Å
285	N	96.1	Very high	92	Very high	80 Å²	80	52.3 Å²	52.3	43%	0.428	28%	0.279	S	S	.	.	H	α-helix	trans	-56.6	-44.1	175.5	-76.2	-24.7	0	0	0	112.3	A281 L283 L288 S289 S319	A281-N285 PolarHBondContact O-N 3.33Å; A281-N285 PolarHBondContact O-ND2 3.46Å; L283-N285 VanDerWaalsContact C-N 3.34Å; L283-N285 PolarHBondContact O-N 3.4Å; N285-L288 PolarHBondContact O-N 3.36Å; N285-S289 PolarHBondContact O-N 3.18Å; N285-S289 PolarHBondContact O-OG 3.3Å; N285-S319 WeakPolarHBondContact OD1-CB 3.49Å; N285-S319 PolarHBondContact OD1-OG 3.13Å
286	F	95.6	Very high	90.4	Very high	38 Å²	38	54.7 Å²	54.7	17%	0.167	29%	0.29	C	S	.	.	H	α-helix	trans	-62.5	-48	176.6	172.8	-106	0	0	0	112	V251 Q252 L255 S282 L283 V284 L288 S289 E290	V251-F286 HydrophobicContact CG1-CD1 4.17Å; V251-F286 HydrophobicContact CG1-CE1 3.88Å; Q252-F286 HydrophobicContact CB-CE1 4.25Å; Q252-F286 HydrophobicContact CB-CE2 4.45Å; Q252-F286 HydrophobicContact CB-CZ 3.87Å; Q252-F286 HydrophobicContact CG-CE2 4.24Å; Q252-F286 HydrophobicContact CG-CZ 3.94Å; L255-F286 HydrophobicContact CD1-CE1 3.81Å; L255-F286 HydrophobicContact CD1-CZ 4.23Å; S282-F286 PolarHBondContact O-N 3.2Å; L283-F286 HydrophobicContact CD1-CD1 4.16Å; L283-F286 WeakPolarHBondContact O-CB 3.44Å; L283-F286 PolarHBondContact O-N 3.33Å; V284-F286 VanDerWaalsContact C-N 3.29Å; V284-F286 PolarHBondContact O-N 2.99Å; F286-L288 VanDerWaalsContact C-N 3.28Å; F286-L288 PolarHBondContact O-N 3.22Å; F286-S289 WeakPolarHBondContact CA-OG 3.48Å; F286-S289 PolarHBondContact O-N 3.43Å; F286-S289 VanDerWaalsContact O-N 3.11Å; F286-S289 PolarHBondContact O-OG 3.48Å; F286-E290 HydrophobicContact CE1-CG 4.28Å; F286-E290 HydrophobicContact CE2-CG 4Å; F286-E290 HydrophobicContact CZ-CG 3.88Å; F286-E290 WeakPolarHBondContact O-CG 3.23Å; F286-E290 PolarHBondContact O-N 3.48Å
287	L	94.8	Very high	88.7	Confident	1 Å²	1	64 Å²	64	1%	0.005	33%	0.331	C	S	.	.	H	α-helix	trans	-62.5	-36.3	178.2	-67.8	172.7	0	0	0	112.1	V251 L255 I261 L272 A275 L283 V284 E290 V292	V251-L287 HydrophobicContact CG1-CD2 3.96Å; L255-L287 HydrophobicContact CD1-CD2 4.32Å; I261-L287 HydrophobicContact CD1-CD2 3.8Å; I261-L287 HydrophobicContact CG1-CD2 3.95Å; L272-L287 HydrophobicContact CB-CD1 4.27Å; L272-L287 HydrophobicContact CD1-CB 4.01Å; L272-L287 HydrophobicContact CD1-CD1 4.19Å; A275-L287 HydrophobicContact CB-CD1 4.21Å; L283-L287 HydrophobicContact CD1-CD1 4.12Å; L283-L287 HydrophobicContact CD1-CD2 4.45Å; L283-L287 HydrophobicContact CD1-CG 3.97Å; L283-L287 HydrophobicContact CG-CD1 4Å; L283-L287 HydrophobicContact CG-CG 4.3Å; L283-L287 WeakPolarHBondContact O-CG 3.31Å; L283-L287 PolarHBondContact O-N 2.72Å; V284-L287 PolarHBondContact O-N 3.23Å; L287-E290 PolarHBondContact O-N 2.91Å; L287-V292 WeakPolarHBondContact O-CB 3.46Å; L287-V292 VanDerWaalsContact O-CG1 3.32Å; L287-V292 WeakPolarHBondContact O-CG1 3.44Å
288	L	93.6	Very high	87.2	Confident	25 Å²	25	60.4 Å²	60.4	13%	0.131	32%	0.324	C	S	.	.	H	α-helix	trans	-66.4	-35.4	174.8	-68.4	169.6	0	0	0	112.2	V284 N285 F286 E290 N291 V292 L294 L320 A323	V284-L288 HydrophobicContact CG1-CD1 3.66Å; V284-L288 HydrophobicContact CG1-CG 4.16Å; V284-L288 WeakPolarHBondContact O-CB 3.47Å; V284-L288 WeakPolarHBondContact O-CG 3.34Å; V284-L288 PolarHBondContact O-N 2.88Å; N285-L288 PolarHBondContact O-N 3.36Å; F286-L288 VanDerWaalsContact C-N 3.28Å; F286-L288 PolarHBondContact O-N 3.22Å; L288-E290 VanDerWaalsContact C-N 3.26Å; L288-E290 PolarHBondContact O-N 3.27Å; L288-N291 PolarHBondContact O-N 2.58Å; L288-V292 HydrophobicContact CD2-CG1 4.07Å; L288-L294 HydrophobicContact CD2-CD2 3.7Å; L288-L320 HydrophobicContact CD1-CD2 4.13Å; L288-L320 HydrophobicContact CD2-CD2 4.08Å; L288-A323 HydrophobicContact CB-CB 4.26Å; L288-A323 HydrophobicContact CD1-CB 3.86Å; L288-A323 HydrophobicContact CD2-CB 3.97Å; L288-A323 HydrophobicContact CG-CB 4.25Å
289	S	92.7	Very high	85.3	Confident	77 Å²	77	65.7 Å²	65.7	54%	0.538	35%	0.346	S	S	.	.	H	α-helix	trans	-70.6	-20.3	175.2	57.9	0	0	0	0	113.8	N285 F286 N291	N285-S289 PolarHBondContact O-N 3.18Å; N285-S289 PolarHBondContact O-OG 3.3Å; F286-S289 WeakPolarHBondContact CA-OG 3.48Å; F286-S289 PolarHBondContact O-N 3.43Å; F286-S289 VanDerWaalsContact O-N 3.11Å; F286-S289 PolarHBondContact O-OG 3.48Å; S289-N291 VanDerWaalsContact C-N 3.25Å; S289-N291 PolarHBondContact O-N 3.12Å
290	E	90.2	Very high	83.4	Confident	95 Å²	95	67 Å²	67	44%	0.444	35%	0.351	S	S	.	.	T	Hydrogen-bonded Turn	trans	-88	20.8	177.6	-63.8	-60.8	137.6	0	0	113	L255 I261 F286 L287 L288 V292	L255-E290 HydrophobicContact CD1-CG 4.45Å; I261-E290 HydrophobicContact CD1-CB 3.53Å; I261-E290 HydrophobicContact CD1-CG 4.44Å; F286-E290 HydrophobicContact CE1-CG 4.28Å; F286-E290 HydrophobicContact CE2-CG 4Å; F286-E290 HydrophobicContact CZ-CG 3.88Å; F286-E290 WeakPolarHBondContact O-CG 3.23Å; F286-E290 PolarHBondContact O-N 3.48Å; L287-E290 PolarHBondContact O-N 2.91Å; L288-E290 VanDerWaalsContact C-N 3.26Å; L288-E290 PolarHBondContact O-N 3.27Å; E290-V292 VanDerWaalsContact C-N 3.3Å; E290-V292 PolarHBondContact O-N 3.47Å
291	N	80.8	Confident	82.1	Confident	150 Å²	150	68.6 Å²	68.6	80%	0.802	36%	0.357	S	S	*	.	T	Hydrogen-bonded Turn	trans	53.1	40.1	179.2	-62.9	-50.2	0	0	0	114.3	L288 S289	L288-N291 PolarHBondContact O-N 2.58Å; S289-N291 VanDerWaalsContact C-N 3.25Å; S289-N291 PolarHBondContact O-N 3.12Å
292	V	85.2	Confident	81.6	Confident	11 Å²	11	70.3 Å²	70.3	7%	0.067	36%	0.362	C	S	.	.			trans	-56.4	142.2	173.6	69.4	0	0	0	0	111.5	I261 N262 L272 L287 L288 E290 L294	I261-V292 HydrophobicContact CD1-CB 4.11Å; I261-V292 HydrophobicContact CD1-CG2 4.4Å; I261-V292 HydrophobicContact CG1-CB 4.47Å; I261-V292 HydrophobicContact CG1-CG2 4.23Å; N262-V292 WeakPolarHBondContact OD1-CG2 3.49Å; L272-V292 HydrophobicContact CB-CG2 4.25Å; L272-V292 HydrophobicContact CD2-CG1 3.78Å; L272-V292 HydrophobicContact CD2-CG2 4.2Å; L287-V292 WeakPolarHBondContact O-CB 3.46Å; L287-V292 VanDerWaalsContact O-CG1 3.32Å; L287-V292 WeakPolarHBondContact O-CG1 3.44Å; L288-V292 HydrophobicContact CD2-CG1 4.07Å; E290-V292 VanDerWaalsContact C-N 3.3Å; E290-V292 PolarHBondContact O-N 3.47Å; V292-L294 HydrophobicContact CG1-CD2 4.11Å; V292-L294 PolarHBondContact O-N 3.23Å
293	D	81.4	Confident	81.3	Confident	62 Å²	62	66.3 Å²	66.3	33%	0.332	33%	0.334	S	S	.	.			trans	-71.8	115.3	177.5	-171.1	-1	0	0	0	110	N262 H295	N262-D293 WeakPolarHBondContact OD1-CB 3.49Å; N262-D293 PolarHBondContact OD1-N 3.03Å; D293-H295 WeakPolarHBondContact OD1-CA 3.47Å; D293-H295 PolarHBondContact OD1-N 2.68Å
294	L	79	Confident	81.1	Confident	30 Å²	30	66.3 Å²	66.3	16%	0.157	33%	0.334	C	S	.	.			trans	-84.1	-17	177	-63.7	-178.8	0	0	0	112.4	L272 L288 V292 H325	L272-L294 HydrophobicContact CD2-CD2 3.77Å; L288-L294 HydrophobicContact CD2-CD2 3.7Å; V292-L294 HydrophobicContact CG1-CD2 4.11Å; V292-L294 PolarHBondContact O-N 3.23Å; L294-H325 HydrophobicContact CD1-CB 4.22Å
295	H	70.7	Confident	81	Confident	131 Å²	131	66.3 Å²	66.3	61%	0.606	33%	0.334	S	S	*	.	S	Bend	trans	-106.9	84.4	-175.5	-64.1	-70.6	0	0	0	110.3	D293 K297	D293-H295 WeakPolarHBondContact OD1-CA 3.47Å; D293-H295 PolarHBondContact OD1-N 2.68Å; H295-K297 PolarHBondContact O-N 3.32Å
296	Q	64.1	Low	80.9	Confident	50 Å²	50	62.5 Å²	62.5	23%	0.234	31%	0.314	C	S	.	.			trans	-62.6	130.2	179.7	-69.2	171.9	27.1	0	0	111.3	V298	Q296-V298 PolarHBondContact O-N 2.71Å; Q296-V298 VanDerWaalsContact O-N 3.14Å
297	K	61	Low	80.9	Confident	195 Å²	195	61.8 Å²	61.8	85%	0.848	31%	0.311	S	S	*	.	S	Bend	trans	-67.4	-9.2	178.5	-63.8	176.9	-178.4	172.1	0	114	H295	H295-K297 PolarHBondContact O-N 3.32Å
298	V	64.8	Low	81	Confident	63 Å²	63	61.7 Å²	61.7	38%	0.382	31%	0.311	S	S	.	.	S	Bend	trans	-112.2	106.2	-176.6	-175.1	0	0	0	0	109.5	M264 Q296	M264-V298 HydrophobicContact CE-CG2 3.85Å; Q296-V298 PolarHBondContact O-N 2.71Å; Q296-V298 VanDerWaalsContact O-N 3.14Å
299	E	57.1	Low	81.1	Confident	185 Å²	185	60.6 Å²	60.6	86%	0.864	31%	0.306	S	S	*	.	T	Hydrogen-bonded Turn	trans	-77.2	138.2	178	-66.6	-163.8	164.5	0	0	112.7
300	P	57.4	Low	81.3	Confident	46 Å²	46	60.5 Å²	60.5	30%	0.299	30%	0.298	S	S	.	.	T	Hydrogen-bonded Turn		-119.3	144.6	-58.7	31.2	-21.3	0	0	0	112.1	Q332	P300-Q332 HydrophobicContact CG-CB 4.43Å; P300-Q332 HydrophobicContact CG-CG 3.69Å; P300-Q332 WeakPolarHBondContact O-CG 3.37Å; P300-Q332 PolarHBondContact O-NE2 3.45Å
301	K	70.9	Confident	81.6	Confident	88 Å²	88	58.9 Å²	58.9	38%	0.383	29%	0.293	S	S	.	.	S	Bend	trans	-94.5	158.3	146	-72.8	179.2	177.8	-175.8	0	107.1	L267 S303	L267-K301 VanDerWaalsContact C-NZ 3.3Å; L267-K301 WeakPolarHBondContact O-CD 3.49Å; L267-K301 VanDerWaalsContact O-CE 3.27Å; L267-K301 WeakPolarHBondContact O-CE 3.42Å; L267-K301 PolarHBondContact O-NZ 3.04Å; K301-S303 PolarHBondContact O-N 2.51Å
302	E	85.3	Confident	82.3	Confident	55 Å²	55	55.7 Å²	55.7	26%	0.257	28%	0.276	S	S	.	.			trans	-45.4	130.7	-175	-62.4	-70.1	170.4	0	0	112.7	Q273 H306 L307 I310 N331	Q273-E302 PolarHBondContact NE2-O 2.89Å; E302-H306 HydrophobicContact CB-CB 4.07Å; E302-H306 VanDerWaalsContact OE2-CB 3.29Å; E302-H306 WeakPolarHBondContact OE2-CB 3.44Å; E302-H306 IonicContact OE2-CD2 3.26Å; E302-H306 IonicContact OE2-CG 2.76Å; E302-L307 HydrophobicContact CB-CD2 3.78Å; E302-L307 HydrophobicContact CB-CG 3.91Å; E302-L307 HydrophobicContact CG-CD2 4.46Å; E302-I310 HydrophobicContact CG-CD1 4.03Å; E302-N331 PolarHBondContact OE1-ND2 3Å; E302-N331 VanDerWaalsContact OE2-CB 3.31Å; E302-N331 WeakPolarHBondContact OE2-CB 3.41Å; E302-N331 PolarHBondContact OE2-ND2 3.14Å; E302-N331 VanDerWaalsContact OE2-ND2 3.15Å
303	S	90.8	Very high	82.9	Confident	10 Å²	10	57.4 Å²	57.4	7%	0.07	28%	0.283	C	S	.	.			trans	-63.8	161.3	178	80.9	0	0	0	0	111.4	K301 L305 H306 L307 I329	K301-S303 PolarHBondContact O-N 2.51Å; S303-L305 PolarHBondContact O-N 2.85Å; S303-L305 PolarHBondContact OG-N 3.39Å; S303-H306 WeakPolarHBondContact O-CB 3.19Å; S303-H306 PolarHBondContact O-N 3.17Å; S303-H306 VanDerWaalsContact O-N 3.1Å; S303-H306 PolarHBondContact OG-N 2.85Å; S303-H306 PolarHBondContact OG-ND1 3.09Å; S303-L307 WeakPolarHBondContact O-CG 3.42Å; S303-L307 PolarHBondContact O-N 3.21Å; S303-I329 WeakPolarHBondContact OG-CG2 3.43Å
304	P	93.6	Very high	83.6	Confident	1 Å²	1	56.8 Å²	56.8	1%	0.006	28%	0.279	C	S	.	.	H	α-helix	trans	-50.7	-43.8	174.3	-27	34.8	0	0	0	112.5	L272 Q273 T276 H306 L307 A308 L320	L272-P304 HydrophobicContact CD2-CB 4.39Å; L272-P304 HydrophobicContact CD2-CG 3.93Å; L272-P304 HydrophobicContact CG-CG 4.38Å; Q273-P304 HydrophobicContact CG-CG 4Å; T276-P304 HydrophobicContact CG2-CB 4.31Å; T276-P304 WeakPolarHBondContact CG2-O 3.48Å; P304-H306 PolarHBondContact O-N 3.38Å; P304-L307 PolarHBondContact O-N 2.7Å; P304-A308 PolarHBondContact O-N 3.2Å; P304-L320 HydrophobicContact CB-CD1 4.01Å; P304-L320 HydrophobicContact CB-CD2 4.03Å
305	L	95	Very high	84.5	Confident	0 Å²	0	59.4 Å²	59.4	0%	0	30%	0.296	C	S	.	.	H	α-helix	trans	-66.2	-39.3	179.8	-173.5	57.3	0	0	0	112.7	S303 A308 V309 V317 L320 L321 P337	S303-L305 PolarHBondContact O-N 2.85Å; S303-L305 PolarHBondContact OG-N 3.39Å; L305-A308 PolarHBondContact O-N 3.36Å; L305-V309 WeakPolarHBondContact O-CG2 3.47Å; L305-V309 PolarHBondContact O-N 2.99Å; L305-V317 HydrophobicContact CD1-CB 4.38Å; L305-V317 HydrophobicContact CD1-CG1 4.01Å; L305-V317 HydrophobicContact CD1-CG2 4.22Å; L305-L320 HydrophobicContact CB-CD1 4.19Å; L305-L320 HydrophobicContact CD1-CB 4.29Å; L305-L320 HydrophobicContact CD1-CD1 4.2Å; L305-L321 HydrophobicContact CD2-CD2 4.09Å; L305-P337 HydrophobicContact CB-CG 4.31Å; L305-P337 HydrophobicContact CD2-CB 4.23Å; L305-P337 HydrophobicContact CD2-CG 3.68Å; L305-P337 HydrophobicContact CG-CB 4.04Å; L305-P337 HydrophobicContact CG-CG 3.72Å
306	H	94.8	Very high	85.8	Confident	0 Å²	0	53.1 Å²	53.1	0%	0	27%	0.267	C	S	.	.	H	α-helix	trans	-60.4	-46.6	170.9	-72.3	101.7	0	0	0	111.8	E302 S303 P304 A308 V309 I310 I329 Q335	E302-H306 HydrophobicContact CB-CB 4.07Å; E302-H306 VanDerWaalsContact OE2-CB 3.29Å; E302-H306 WeakPolarHBondContact OE2-CB 3.44Å; E302-H306 IonicContact OE2-CD2 3.26Å; E302-H306 IonicContact OE2-CG 2.76Å; S303-H306 WeakPolarHBondContact O-CB 3.19Å; S303-H306 PolarHBondContact O-N 3.17Å; S303-H306 VanDerWaalsContact O-N 3.1Å; S303-H306 PolarHBondContact OG-N 2.85Å; S303-H306 PolarHBondContact OG-ND1 3.09Å; P304-H306 PolarHBondContact O-N 3.38Å; H306-A308 VanDerWaalsContact C-N 3.32Å; H306-A308 PolarHBondContact O-N 3.06Å; H306-V309 PolarHBondContact O-N 3.49Å; H306-I310 HydrophobicContact CB-CD1 4.48Å; H306-I310 WeakPolarHBondContact O-CB 3.5Å; H306-I310 WeakPolarHBondContact O-CG1 3.27Å; H306-I310 PolarHBondContact O-N 2.68Å; H306-I329 PolarHBondContact CE1-O 3.46Å; H306-Q335 PolarHBondContact NE2-O 3.12Å
307	L	94.8	Very high	87.4	Confident	22 Å²	22	50.8 Å²	50.8	12%	0.115	26%	0.256	C	S	.	.	H	α-helix	trans	-60.8	-40.7	178.9	-69.6	172.9	0	0	0	112	Q273 T276 E302 S303 P304 N311	Q273-L307 HydrophobicContact CB-CD1 3.7Å; Q273-L307 HydrophobicContact CG-CD1 3.83Å; T276-L307 HydrophobicContact CG2-CB 4.08Å; E302-L307 HydrophobicContact CB-CD2 3.78Å; E302-L307 HydrophobicContact CB-CG 3.91Å; E302-L307 HydrophobicContact CG-CD2 4.46Å; S303-L307 WeakPolarHBondContact O-CG 3.42Å; S303-L307 PolarHBondContact O-N 3.21Å; P304-L307 PolarHBondContact O-N 2.7Å; L307-N311 WeakPolarHBondContact O-CB 3.48Å; L307-N311 PolarHBondContact O-N 3.07Å; L307-N311 VanDerWaalsContact O-N 3.1Å; L307-N311 PolarHBondContact O-ND2 2.93Å
308	A	97.2	Very high	89.1	Confident	0 Å²	0	45 Å²	45	0%	0	23%	0.234	C	C	.	.	H	α-helix	trans	-62.7	-42.7	176.1	0	0	0	0	0	111.6	T276 P304 L305 H306 N312 H313 V316 V317 L320	T276-A308 HydrophobicContact CG2-CB 3.71Å; P304-A308 PolarHBondContact O-N 3.2Å; L305-A308 PolarHBondContact O-N 3.36Å; H306-A308 VanDerWaalsContact C-N 3.32Å; H306-A308 PolarHBondContact O-N 3.06Å; A308-N312 PolarHBondContact O-N 3.12Å; A308-N312 VanDerWaalsContact O-N 3.12Å; A308-H313 PolarHBondContact O-N 2.95Å; A308-V316 HydrophobicContact CB-CB 4.23Å; A308-V316 HydrophobicContact CB-CG1 3.93Å; A308-V317 HydrophobicContact CB-CG2 3.58Å; A308-L320 HydrophobicContact CB-CD1 4.16Å
309	V	97.2	Very high	90.6	Very high	2 Å²	2	42.6 Å²	42.6	1%	0.012	22%	0.221	C	C	.	.	H	α-helix	trans	-67	-49	177.3	168.7	0	0	0	0	111.6	L305 H306 N311 N312 V317 P337 V340 A341 L349 L353	L305-V309 WeakPolarHBondContact O-CG2 3.47Å; L305-V309 PolarHBondContact O-N 2.99Å; H306-V309 PolarHBondContact O-N 3.49Å; V309-N311 VanDerWaalsContact C-N 3.25Å; V309-N311 PolarHBondContact O-N 3.35Å; V309-N312 PolarHBondContact O-N 3.42Å; V309-N312 VanDerWaalsContact O-N 3.13Å; V309-V317 HydrophobicContact CG2-CG2 4.01Å; V309-P337 HydrophobicContact CG2-CB 4.16Å; V309-V340 HydrophobicContact CG1-CB 4.09Å; V309-V340 HydrophobicContact CG1-CG1 3.95Å; V309-A341 HydrophobicContact CG1-CB 3.78Å; V309-L349 HydrophobicContact CB-CD1 4.49Å; V309-L349 HydrophobicContact CG1-CD1 4.15Å; V309-L349 WeakPolarHBondContact O-CD1 3.49Å; V309-L353 HydrophobicContact CG2-CD1 4.21Å
310	I	95.8	Very high	92.5	Very high	74 Å²	74	33.8 Å²	33.8	38%	0.379	18%	0.18	S	C	.	.	H	α-helix	trans	-57.5	-39.9	-179.9	-69.5	166.2	0	0	0	111.2	E302 H306 V340	E302-I310 HydrophobicContact CG-CD1 4.03Å; H306-I310 HydrophobicContact CB-CD1 4.48Å; H306-I310 WeakPolarHBondContact O-CB 3.5Å; H306-I310 WeakPolarHBondContact O-CG1 3.27Å; H306-I310 PolarHBondContact O-N 2.68Å; I310-V340 HydrophobicContact CD1-CG1 4.44Å; I310-V340 HydrophobicContact CG1-CG1 3.56Å
311	N	95.8	Very high	94.3	Very high	62 Å²	62	33.2 Å²	33.2	33%	0.332	17%	0.174	S	C	.	.	T	Hydrogen-bonded Turn	trans	-94.8	6.9	-177	-63.7	-86.1	0	0	0	113.6	L307 V309 H313	L307-N311 WeakPolarHBondContact O-CB 3.48Å; L307-N311 PolarHBondContact O-N 3.07Å; L307-N311 VanDerWaalsContact O-N 3.1Å; L307-N311 PolarHBondContact O-ND2 2.93Å; V309-N311 VanDerWaalsContact C-N 3.25Å; V309-N311 PolarHBondContact O-N 3.35Å; N311-H313 VanDerWaalsContact CB-CD2 3.48Å; N311-H313 WeakPolarHBondContact CB-CD2 3.27Å; N311-H313 WeakPolarHBondContact CB-NE2 3.47Å
312	N	96.3	Very high	95.4	Very high	83 Å²	83	34 Å²	34	44%	0.444	19%	0.19	S	C	.	.	T	Hydrogen-bonded Turn	trans	58	44.5	178.1	-170.8	25.6	0	0	0	115.2	A308 V309 I314 N346	A308-N312 PolarHBondContact O-N 3.12Å; A308-N312 VanDerWaalsContact O-N 3.12Å; V309-N312 PolarHBondContact O-N 3.42Å; V309-N312 VanDerWaalsContact O-N 3.13Å; N312-I314 PolarHBondContact O-N 2.74Å; N312-N346 PolarHBondContact ND2-ND2 3.42Å; N312-N346 PolarHBondContact OD1-ND2 3.46Å
313	H	97.6	Very high	95.7	Very high	46 Å²	46	33.2 Å²	33.2	21%	0.213	19%	0.193	C	C	.	.			trans	-100.4	74.2	177.8	-62.3	-50	0	0	0	111.2	T276 R277 G279 A308 N311 T315 V316 V317	T276-H313 PolarHBondContact O-CD2 3.43Å; T276-H313 VanDerWaalsContact O-CD2 3.25Å; R277-H313 PolarHBondContact O-CD2 3.43Å; R277-H313 PolarHBondContact O-NE2 2.87Å; G279-H313 VanDerWaalsContact CA-CD2 3.42Å; G279-H313 WeakPolarHBondContact CA-CD2 3.49Å; G279-H313 VanDerWaalsContact CA-CG 3.43Å; G279-H313 WeakPolarHBondContact CA-ND1 3.26Å; G279-H313 WeakPolarHBondContact CA-NE2 3.5Å; G279-H313 PolarHBondContact N-CD2 2.97Å; G279-H313 PolarHBondContact N-NE2 2.91Å; A308-H313 PolarHBondContact O-N 2.95Å; N311-H313 VanDerWaalsContact CB-CD2 3.48Å; N311-H313 WeakPolarHBondContact CB-CD2 3.27Å; N311-H313 WeakPolarHBondContact CB-NE2 3.47Å; H313-T315 VanDerWaalsContact C-N 3.27Å; H313-T315 PolarHBondContact O-N 3.49Å; H313-V316 HydrophobicContact CB-CB 3.91Å; H313-V316 HydrophobicContact CB-CG2 3.89Å; H313-V316 WeakPolarHBondContact O-CA 3.11Å; H313-V316 WeakPolarHBondContact O-CB 3.38Å; H313-V316 PolarHBondContact O-N 2.88Å; H313-V317 PolarHBondContact O-N 3.38Å
314	I	96.3	Very high	95.6	Very high	49 Å²	49	41.3 Å²	41.3	25%	0.251	23%	0.23	S	C	.	.	H	α-helix	trans	-56	-39.2	-175.7	-63	151.3	0	0	0	112.5	N312 V316 V317 N318 E348 L349	N312-I314 PolarHBondContact O-N 2.74Å; I314-V316 VanDerWaalsContact C-N 3.31Å; I314-V316 PolarHBondContact O-N 3.09Å; I314-V317 WeakPolarHBondContact O-CB 3.43Å; I314-V317 PolarHBondContact O-N 3.47Å; I314-N318 PolarHBondContact O-N 2.91Å; I314-N318 PolarHBondContact O-ND2 3.12Å; I314-E348 HydrophobicContact CD1-CB 3.81Å; I314-E348 HydrophobicContact CD1-CG 3.59Å; I314-E348 HydrophobicContact CG1-CG 4.33Å; I314-L349 HydrophobicContact CB-CD2 4.37Å; I314-L349 HydrophobicContact CG1-CD2 3.58Å; I314-L349 HydrophobicContact CG1-CG 3.99Å
315	T	97.8	Very high	95.4	Very high	85 Å²	85	41.7 Å²	41.7	52%	0.521	23%	0.232	S	C	.	.	H	α-helix	trans	-61.8	-40	176.8	48.1	0	0	0	0	111.8	H313 N318 S319	H313-T315 VanDerWaalsContact C-N 3.27Å; H313-T315 PolarHBondContact O-N 3.49Å; T315-N318 PolarHBondContact O-N 2.99Å; T315-S319 PolarHBondContact O-N 3.21Å; T315-S319 PolarHBondContact O-OG 2.79Å; T315-S319 VanDerWaalsContact O-OG 3.12Å
316	V	98.1	Very high	95.3	Very high	0 Å²	0	45 Å²	45	0%	0	25%	0.249	C	C	.	.	H	α-helix	trans	-70	-37.1	175.4	-180	0	0	0	0	111.6	T276 A281 V284 A308 H313 I314 S319 L320	T276-V316 HydrophobicContact CG2-CG1 3.67Å; A281-V316 HydrophobicContact CB-CG2 3.98Å; V284-V316 HydrophobicContact CB-CG1 4.38Å; V284-V316 HydrophobicContact CG1-CG1 4.06Å; V284-V316 HydrophobicContact CG2-CG1 4.01Å; V284-V316 HydrophobicContact CG2-CG2 4.42Å; A308-V316 HydrophobicContact CB-CB 4.23Å; A308-V316 HydrophobicContact CB-CG1 3.93Å; H313-V316 HydrophobicContact CB-CB 3.91Å; H313-V316 HydrophobicContact CB-CG2 3.89Å; H313-V316 WeakPolarHBondContact O-CA 3.11Å; H313-V316 WeakPolarHBondContact O-CB 3.38Å; H313-V316 PolarHBondContact O-N 2.88Å; I314-V316 VanDerWaalsContact C-N 3.31Å; I314-V316 PolarHBondContact O-N 3.09Å; V316-S319 WeakPolarHBondContact O-CB 3.44Å; V316-S319 PolarHBondContact O-N 3.38Å; V316-L320 HydrophobicContact CG1-CD1 4.05Å; V316-L320 HydrophobicContact CG1-CG 4.39Å; V316-L320 WeakPolarHBondContact O-CG 3.36Å; V316-L320 PolarHBondContact O-N 3.41Å
317	V	97.9	Very high	95.3	Very high	0 Å²	0	46 Å²	46	0%	0	26%	0.255	C	S	.	.	H	α-helix	trans	-58	-49.5	172.3	170.2	0	0	0	0	110.2	L305 A308 V309 H313 I314 S319 L320 L321 L349 T352 L353	L305-V317 HydrophobicContact CD1-CB 4.38Å; L305-V317 HydrophobicContact CD1-CG1 4.01Å; L305-V317 HydrophobicContact CD1-CG2 4.22Å; A308-V317 HydrophobicContact CB-CG2 3.58Å; V309-V317 HydrophobicContact CG2-CG2 4.01Å; H313-V317 PolarHBondContact O-N 3.38Å; I314-V317 WeakPolarHBondContact O-CB 3.43Å; I314-V317 PolarHBondContact O-N 3.47Å; V317-S319 VanDerWaalsContact C-N 3.34Å; V317-S319 PolarHBondContact O-N 2.7Å; V317-L320 PolarHBondContact O-N 3.21Å; V317-L321 HydrophobicContact CG1-CD1 3.76Å; V317-L321 HydrophobicContact CG1-CG 4.27Å; V317-L321 VanDerWaalsContact O-CG 3.28Å; V317-L321 WeakPolarHBondContact O-CG 3.23Å; V317-L321 PolarHBondContact O-N 3.12Å; V317-L349 HydrophobicContact CB-CD2 4.41Å; V317-L349 HydrophobicContact CG2-CD2 3.78Å; V317-T352 HydrophobicContact CG1-CG2 3.99Å; V317-L353 HydrophobicContact CG1-CD2 4.4Å
318	N	97.1	Very high	95.3	Very high	73 Å²	73	47.3 Å²	47.3	39%	0.39	26%	0.262	S	S	.	.	H	α-helix	trans	-58.9	-45.1	177.1	-70.3	-28.9	0	0	0	111.8	I314 T315 L320 L321 S322 T352	I314-N318 PolarHBondContact O-N 2.91Å; I314-N318 PolarHBondContact O-ND2 3.12Å; T315-N318 PolarHBondContact O-N 2.99Å; N318-L320 PolarHBondContact O-N 2.94Å; N318-L321 PolarHBondContact O-N 3.17Å; N318-S322 WeakPolarHBondContact O-CB 3.24Å; N318-S322 PolarHBondContact O-N 2.89Å; N318-S322 PolarHBondContact O-OG 3.27Å; N318-S322 VanDerWaalsContact O-OG 3.08Å; N318-T352 WeakPolarHBondContact OD1-CG2 3.35Å
319	S	96.8	Very high	95.1	Very high	14 Å²	14	48.7 Å²	48.7	10%	0.098	27%	0.269	C	S	.	.	H	α-helix	trans	-55.2	-47.9	174.9	-67.8	0	0	0	0	113	N285 T315 V316 V317 S322 A323	N285-S319 WeakPolarHBondContact OD1-CB 3.49Å; N285-S319 PolarHBondContact OD1-OG 3.13Å; T315-S319 PolarHBondContact O-N 3.21Å; T315-S319 PolarHBondContact O-OG 2.79Å; T315-S319 VanDerWaalsContact O-OG 3.12Å; V316-S319 WeakPolarHBondContact O-CB 3.44Å; V316-S319 PolarHBondContact O-N 3.38Å; V317-S319 VanDerWaalsContact C-N 3.34Å; V317-S319 PolarHBondContact O-N 2.7Å; S319-S322 PolarHBondContact O-N 3.37Å; S319-A323 PolarHBondContact O-N 2.94Å; S319-A323 VanDerWaalsContact O-N 3.09Å
320	L	95.8	Very high	94.9	Very high	0 Å²	0	52.5 Å²	52.5	0%	0	29%	0.289	C	S	.	.	H	α-helix	trans	-66.8	-41.1	-179.9	-70.9	167.8	0	0	0	112.1	T276 V284 L288 P304 L305 A308 V316 V317 N318 A323 Q324 H325	T276-L320 HydrophobicContact CG2-CD1 4.26Å; V284-L320 HydrophobicContact CG1-CD2 4.43Å; L288-L320 HydrophobicContact CD1-CD2 4.13Å; L288-L320 HydrophobicContact CD2-CD2 4.08Å; P304-L320 HydrophobicContact CB-CD1 4.01Å; P304-L320 HydrophobicContact CB-CD2 4.03Å; L305-L320 HydrophobicContact CB-CD1 4.19Å; L305-L320 HydrophobicContact CD1-CB 4.29Å; L305-L320 HydrophobicContact CD1-CD1 4.2Å; A308-L320 HydrophobicContact CB-CD1 4.16Å; V316-L320 HydrophobicContact CG1-CD1 4.05Å; V316-L320 HydrophobicContact CG1-CG 4.39Å; V316-L320 WeakPolarHBondContact O-CG 3.36Å; V316-L320 PolarHBondContact O-N 3.41Å; V317-L320 PolarHBondContact O-N 3.21Å; N318-L320 PolarHBondContact O-N 2.94Å; L320-A323 CarbonylContact O-C 3.53Å; L320-A323 PolarHBondContact O-N 3.44Å; L320-Q324 PolarHBondContact O-N 3.33Å; L320-H325 HydrophobicContact CB-CB 4.13Å; L320-H325 WeakPolarHBondContact O-CB 3.48Å; L320-H325 PolarHBondContact O-N 3.24Å
321	L	94.7	Very high	94.7	Very high	34 Å²	34	49.2 Å²	49.2	18%	0.178	27%	0.272	C	S	.	.	H	α-helix	trans	-66.4	-40.5	177	-66.6	175.3	0	0	0	111.7	L305 V317 N318 A323 Q324 I327 T352 L353 A356	L305-L321 HydrophobicContact CD2-CD2 4.09Å; V317-L321 HydrophobicContact CG1-CD1 3.76Å; V317-L321 HydrophobicContact CG1-CG 4.27Å; V317-L321 VanDerWaalsContact O-CG 3.28Å; V317-L321 WeakPolarHBondContact O-CG 3.23Å; V317-L321 PolarHBondContact O-N 3.12Å; N318-L321 PolarHBondContact O-N 3.17Å; L321-A323 PolarHBondContact O-N 3.43Å; L321-Q324 PolarHBondContact O-N 2.95Å; L321-I327 HydrophobicContact CD2-CB 4.03Å; L321-I327 HydrophobicContact CD2-CD1 3.86Å; L321-I327 HydrophobicContact CD2-CG1 3.87Å; L321-T352 HydrophobicContact CD1-CG2 4.02Å; L321-L353 HydrophobicContact CD1-CD2 4.44Å; L321-A356 HydrophobicContact CD1-CB 3.9Å; L321-A356 HydrophobicContact CD2-CB 4.5Å
322	S	93.8	Very high	94.4	Very high	104 Å²	104	52.5 Å²	52.5	73%	0.727	29%	0.285	S	S	*	.	H	α-helix	trans	-63.1	-30.3	173.8	-65.2	0	0	0	0	112.7	N318 S319 Q324	N318-S322 WeakPolarHBondContact O-CB 3.24Å; N318-S322 PolarHBondContact O-N 2.89Å; N318-S322 PolarHBondContact O-OG 3.27Å; N318-S322 VanDerWaalsContact O-OG 3.08Å; S319-S322 PolarHBondContact O-N 3.37Å; S322-Q324 PolarHBondContact O-N 3.39Å
323	A	91.6	Very high	94.1	Very high	39 Å²	39	54.3 Å²	54.3	32%	0.322	29%	0.289	S	S	.	.	T	Hydrogen-bonded Turn	trans	-83.6	15.2	173.3	0	0	0	0	0	113.8	L288 S319 L320 L321 H325	L288-A323 HydrophobicContact CB-CB 4.26Å; L288-A323 HydrophobicContact CD1-CB 3.86Å; L288-A323 HydrophobicContact CD2-CB 3.97Å; L288-A323 HydrophobicContact CG-CB 4.25Å; S319-A323 PolarHBondContact O-N 2.94Å; S319-A323 VanDerWaalsContact O-N 3.09Å; L320-A323 CarbonylContact O-C 3.53Å; L320-A323 PolarHBondContact O-N 3.44Å; L321-A323 PolarHBondContact O-N 3.43Å; A323-H325 PolarHBondContact O-N 3.15Å
324	Q	89.5	Confident	93.9	Very high	180 Å²	180	56.5 Å²	56.5	84%	0.841	30%	0.299	S	S	*	.	T	Hydrogen-bonded Turn	trans	57	29.4	179.3	-55.7	-178.1	2.3	0	0	114.1	L320 L321 S322 D326	L320-Q324 PolarHBondContact O-N 3.33Å; L321-Q324 PolarHBondContact O-N 2.95Å; S322-Q324 PolarHBondContact O-N 3.39Å; Q324-D326 PolarHBondContact O-N 3.21Å
325	H	90.5	Very high	93.9	Very high	8 Å²	8	55.3 Å²	55.3	4%	0.037	29%	0.293	C	S	.	.			trans	-60.7	137.8	169.6	-164.2	80.4	0	0	0	109.6	L294 L320 A323 I327	L294-H325 HydrophobicContact CD1-CB 4.22Å; L320-H325 HydrophobicContact CB-CB 4.13Å; L320-H325 WeakPolarHBondContact O-CB 3.48Å; L320-H325 PolarHBondContact O-N 3.24Å; A323-H325 PolarHBondContact O-N 3.15Å; H325-I327 PolarHBondContact O-N 3.48Å
326	D	92.5	Very high	93.8	Very high	70 Å²	70	51.3 Å²	51.3	37%	0.374	27%	0.268	S	S	.	.			trans	-58.1	111.9	-178.1	178.4	12.4	0	0	0	110.8	Q324 N328 I329	Q324-D326 PolarHBondContact O-N 3.21Å; D326-N328 PolarHBondContact O-N 3.04Å; D326-N328 PolarHBondContact OD1-N 3.4Å; D326-I329 HydrophobicContact CB-CB 4.2Å; D326-I329 WeakPolarHBondContact O-CB 3.46Å; D326-I329 WeakPolarHBondContact O-CG2 3.35Å; D326-I329 PolarHBondContact O-N 3.2Å; D326-I329 PolarHBondContact OD1-N 2.83Å; D326-I329 PolarHBondContact OD2-N 3.49Å
327	I	94.9	Very high	93.8	Very high	22 Å²	22	51.3 Å²	51.3	11%	0.113	27%	0.268	C	S	.	.	T	Hydrogen-bonded Turn	trans	-68.7	-22.1	-179.8	-168.3	168.7	0	0	0	112.4	L321 H325 P337 L353 A356 C358	L321-I327 HydrophobicContact CD2-CB 4.03Å; L321-I327 HydrophobicContact CD2-CD1 3.86Å; L321-I327 HydrophobicContact CD2-CG1 3.87Å; H325-I327 PolarHBondContact O-N 3.48Å; I327-P337 WeakPolarHBondContact O-CD 3.48Å; I327-L353 HydrophobicContact CD1-CD2 4.17Å; I327-L353 HydrophobicContact CG1-CD2 4.05Å; I327-A356 HydrophobicContact CD1-CB 3.45Å; I327-A356 VanDerWaalsContact CD1-CB 3.45Å; I327-C358 HydrophobicContact CD1-CB 3.7Å; I327-C358 HydrophobicContact CG1-CB 3.85Å; I327-C358 HydrophobicContact CG2-CB 4.5Å
328	N	94.9	Very high	93.8	Very high	49 Å²	49	51.3 Å²	51.3	26%	0.262	27%	0.268	S	S	.	.	T	Hydrogen-bonded Turn	trans	-104.3	12.8	-178.2	-60.5	-41.6	0	0	0	112.5	D326 L330 D359	D326-N328 PolarHBondContact O-N 3.04Å; D326-N328 PolarHBondContact OD1-N 3.4Å; N328-L330 WeakPolarHBondContact O-CD2 3.4Å; N328-L330 PolarHBondContact O-N 3.07Å; N328-D359 WeakPolarHBondContact OD1-CB 3.47Å; N328-D359 PolarHBondContact OD1-N 3.37Å
329	I	93.1	Very high	93.8	Very high	29 Å²	29	47.9 Å²	47.9	15%	0.149	25%	0.25	C	C	.	.			trans	-52.1	141	177.7	-171.1	158.7	0	0	0	111	S303 H306 D326 T336 P337	S303-I329 WeakPolarHBondContact OG-CG2 3.43Å; H306-I329 PolarHBondContact CE1-O 3.46Å; D326-I329 HydrophobicContact CB-CB 4.2Å; D326-I329 WeakPolarHBondContact O-CB 3.46Å; D326-I329 WeakPolarHBondContact O-CG2 3.35Å; D326-I329 PolarHBondContact O-N 3.2Å; D326-I329 PolarHBondContact OD1-N 2.83Å; D326-I329 PolarHBondContact OD2-N 3.49Å; I329-T336 WeakPolarHBondContact O-CA 3.39Å; I329-P337 HydrophobicContact CG2-CG 3.96Å; I329-P337 VanDerWaalsContact O-CD 3.29Å; I329-P337 WeakPolarHBondContact O-CD 3.4Å
330	L	92.4	Very high	93.8	Very high	82 Å²	82	47.9 Å²	47.9	43%	0.429	25%	0.249	S	C	.	.			trans	-106.8	134.2	-174.1	-57.4	175.7	0	0	0	111	N328 Q335 T336	N328-L330 WeakPolarHBondContact O-CD2 3.4Å; N328-L330 PolarHBondContact O-N 3.07Å; L330-Q335 WeakPolarHBondContact CA-O 3.36Å; L330-T336 HydrophobicContact CD2-CG2 3.59Å
331	N	91.1	Very high	93.9	Very high	5 Å²	5	47.9 Å²	47.9	3%	0.027	25%	0.249	C	C	.	.			trans	-88.4	-172.6	172	75.9	6.4	0	0	0	112.5	E302 K333 Q334 Q335	E302-N331 PolarHBondContact OE1-ND2 3Å; E302-N331 VanDerWaalsContact OE2-CB 3.31Å; E302-N331 WeakPolarHBondContact OE2-CB 3.41Å; E302-N331 PolarHBondContact OE2-ND2 3.14Å; E302-N331 VanDerWaalsContact OE2-ND2 3.15Å; N331-K333 PolarHBondContact O-N 3.31Å; N331-K333 WeakPolarHBondContact OD1-CA 3.32Å; N331-K333 WeakPolarHBondContact OD1-CB 3.32Å; N331-K333 PolarHBondContact OD1-N 3.49Å; N331-Q334 WeakPolarHBondContact O-CA 3.4Å; N331-Q334 PolarHBondContact O-N 2.67Å; N331-Q334 PolarHBondContact OD1-N 3.49Å; N331-Q335 PolarHBondContact N-O 3.29Å; N331-Q335 WeakPolarHBondContact OD1-CB 3.46Å; N331-Q335 PolarHBondContact OD1-N 3.48Å
332	Q	89.1	Confident	94	Very high	130 Å²	130	46.3 Å²	46.3	61%	0.607	24%	0.241	S	C	*	.	T	Hydrogen-bonded Turn	trans	-56.8	-25.5	179.4	-68.3	-171.6	-18.2	0	0	114.6	P300 Q334	P300-Q332 HydrophobicContact CG-CB 4.43Å; P300-Q332 HydrophobicContact CG-CG 3.69Å; P300-Q332 WeakPolarHBondContact O-CG 3.37Å; P300-Q332 PolarHBondContact O-NE2 3.45Å; Q332-Q334 VanDerWaalsContact C-N 3.31Å
333	K	91.1	Very high	94.1	Very high	121 Å²	121	44.3 Å²	44.3	53%	0.526	22%	0.222	S	C	.	.	T	Hydrogen-bonded Turn	trans	-94.7	12	178.8	-64.1	177.9	-178.1	173.4	0	112	N331 Q335 K365	N331-K333 PolarHBondContact O-N 3.31Å; N331-K333 WeakPolarHBondContact OD1-CA 3.32Å; N331-K333 WeakPolarHBondContact OD1-CB 3.32Å; N331-K333 PolarHBondContact OD1-N 3.49Å; K333-Q335 HydrophobicContact CB-CG 3.82Å; K333-Q335 PolarHBondContact O-N 3.25Å; K333-K365 WeakPolarHBondContact O-CB 3.48Å; K333-K365 PolarHBondContact O-N 3.18Å
334	Q	93.5	Very high	94.2	Very high	93 Å²	93	45.9 Å²	45.9	44%	0.435	23%	0.23	S	C	.	.	S	Bend	trans	56.8	25.6	-171.8	-61.2	-70.7	-18.8	0	0	112.2	N331 Q332 D364 K365	N331-Q334 WeakPolarHBondContact O-CA 3.4Å; N331-Q334 PolarHBondContact O-N 2.67Å; N331-Q334 PolarHBondContact OD1-N 3.49Å; Q332-Q334 VanDerWaalsContact C-N 3.31Å; Q334-D364 WeakPolarHBondContact O-CA 3.26Å; Q334-K365 HydrophobicContact CB-CB 4.2Å; Q334-K365 HydrophobicContact CG-CB 4.31Å
335	Q	95.1	Very high	94.4	Very high	23 Å²	23	38.2 Å²	38.2	11%	0.107	20%	0.199	C	C	.	.			trans	-87	140.5	178.4	-65.4	-179.4	-62.1	0	0	109.5	H306 L330 N331 K333 H339 V340 D364	H306-Q335 PolarHBondContact NE2-O 3.12Å; L330-Q335 WeakPolarHBondContact CA-O 3.36Å; N331-Q335 PolarHBondContact N-O 3.29Å; N331-Q335 WeakPolarHBondContact OD1-CB 3.46Å; N331-Q335 PolarHBondContact OD1-N 3.48Å; K333-Q335 HydrophobicContact CB-CG 3.82Å; K333-Q335 PolarHBondContact O-N 3.25Å; Q335-H339 HydrophobicContact CB-CB 3.87Å; Q335-H339 HydrophobicContact CG-CB 4.19Å; Q335-V340 HydrophobicContact CB-CG2 4.3Å; Q335-D364 HydrophobicContact CG-CB 3.8Å
336	T	96.6	Very high	94.6	Very high	1 Å²	1	39.4 Å²	39.4	1%	0.006	21%	0.206	C	C	.	.			trans	-82.9	163.8	165.6	69.9	0	0	0	0	110.6	I329 L330 L338 H339 V340 A362	I329-T336 WeakPolarHBondContact O-CA 3.39Å; L330-T336 HydrophobicContact CD2-CG2 3.59Å; T336-L338 PolarHBondContact O-N 2.87Å; T336-L338 VanDerWaalsContact O-N 3.13Å; T336-L338 PolarHBondContact OG1-N 3.01Å; T336-H339 PolarHBondContact N-ND1 3.4Å; T336-H339 WeakPolarHBondContact O-CB 3.44Å; T336-H339 PolarHBondContact O-N 2.58Å; T336-H339 PolarHBondContact OG1-N 2.89Å; T336-H339 PolarHBondContact OG1-ND1 2.97Å; T336-V340 PolarHBondContact O-N 3.34Å; T336-A362 HydrophobicContact CG2-CB 3.69Å
337	P	97.2	Very high	94.7	Very high	0 Å²	0	38.2 Å²	38.2	0%	0	20%	0.201	C	C	.	.	H	α-helix	trans	-51.5	-33.7	169.3	-29	34.3	0	0	0	113.4	L305 V309 I327 I329 V340 A341 L353	L305-P337 HydrophobicContact CB-CG 4.31Å; L305-P337 HydrophobicContact CD2-CB 4.23Å; L305-P337 HydrophobicContact CD2-CG 3.68Å; L305-P337 HydrophobicContact CG-CB 4.04Å; L305-P337 HydrophobicContact CG-CG 3.72Å; V309-P337 HydrophobicContact CG2-CB 4.16Å; I327-P337 WeakPolarHBondContact O-CD 3.48Å; I329-P337 HydrophobicContact CG2-CG 3.96Å; I329-P337 VanDerWaalsContact O-CD 3.29Å; I329-P337 WeakPolarHBondContact O-CD 3.4Å; P337-V340 PolarHBondContact O-N 2.89Å; P337-A341 WeakPolarHBondContact O-CB 3.33Å; P337-A341 PolarHBondContact O-N 3.25Å; P337-L353 HydrophobicContact CB-CD1 4.19Å; P337-L353 HydrophobicContact CB-CD2 4.28Å
338	L	98.2	Very high	94.8	Very high	1 Å²	1	40.9 Å²	40.9	1%	0.005	21%	0.213	C	C	.	.	H	α-helix	trans	-66	-40.8	175.8	-173.6	71	0	0	0	112.3	T336 V340 A341 A342 L353 L354 L360 A370 L386	T336-L338 PolarHBondContact O-N 2.87Å; T336-L338 VanDerWaalsContact O-N 3.13Å; T336-L338 PolarHBondContact OG1-N 3.01Å; L338-V340 VanDerWaalsContact C-N 3.28Å; L338-V340 PolarHBondContact O-N 3.25Å; L338-A341 PolarHBondContact O-N 3Å; L338-A342 WeakPolarHBondContact O-CB 3.44Å; L338-A342 PolarHBondContact O-N 3.24Å; L338-L353 HydrophobicContact CD1-CB 4.13Å; L338-L353 HydrophobicContact CD1-CD1 4.47Å; L338-L354 HydrophobicContact CD1-CD2 3.97Å; L338-L354 HydrophobicContact CD1-CG 4.29Å; L338-L354 HydrophobicContact CD2-CD2 4.34Å; L338-L360 HydrophobicContact CD2-CD2 3.58Å; L338-A370 HydrophobicContact CB-CB 4.4Å; L338-A370 HydrophobicContact CD2-CB 3.66Å; L338-A370 HydrophobicContact CG-CB 3.7Å; L338-L386 HydrophobicContact CD1-CD2 4.18Å; L338-L386 HydrophobicContact CD2-CD2 3.88Å; L338-L386 HydrophobicContact CG-CD2 4.24Å
339	H	97.8	Very high	94.9	Very high	1 Å²	1	38.6 Å²	38.6	1%	0.005	20%	0.201	C	C	.	.	H	α-helix	trans	-59.1	-43.5	174.8	-71	84.6	0	0	0	111	Q335 T336 A342 D343 A362 K368 A370	Q335-H339 HydrophobicContact CB-CB 3.87Å; Q335-H339 HydrophobicContact CG-CB 4.19Å; T336-H339 PolarHBondContact N-ND1 3.4Å; T336-H339 WeakPolarHBondContact O-CB 3.44Å; T336-H339 PolarHBondContact O-N 2.58Å; T336-H339 PolarHBondContact OG1-N 2.89Å; T336-H339 PolarHBondContact OG1-ND1 2.97Å; H339-A342 PolarHBondContact O-N 2.79Å; H339-D343 PolarHBondContact O-N 3.27Å; H339-A362 PolarHBondContact CE1-O 3.32Å; H339-A362 PolarHBondContact NE2-O 2.74Å; H339-K368 PolarHBondContact CD2-O 3.15Å; H339-K368 PolarHBondContact NE2-O 3.21Å; H339-A370 PolarHBondContact CD2-N 3.16Å; H339-A370 PolarHBondContact NE2-N 3.01Å
340	V	96.6	Very high	95.2	Very high	14 Å²	14	37.2 Å²	37.2	9%	0.085	19%	0.193	C	C	.	.	H	α-helix	trans	-68.8	-44.6	179.9	-177.7	0	0	0	0	111.3	V309 I310 Q335 T336 P337 L338 A342 D343 C344	V309-V340 HydrophobicContact CG1-CB 4.09Å; V309-V340 HydrophobicContact CG1-CG1 3.95Å; I310-V340 HydrophobicContact CD1-CG1 4.44Å; I310-V340 HydrophobicContact CG1-CG1 3.56Å; Q335-V340 HydrophobicContact CB-CG2 4.3Å; T336-V340 PolarHBondContact O-N 3.34Å; P337-V340 PolarHBondContact O-N 2.89Å; L338-V340 VanDerWaalsContact C-N 3.28Å; L338-V340 PolarHBondContact O-N 3.25Å; V340-A342 VanDerWaalsContact C-N 3.26Å; V340-A342 PolarHBondContact O-N 2.68Å; V340-D343 PolarHBondContact O-N 3.28Å; V340-C344 WeakPolarHBondContact O-CB 3.49Å; V340-C344 PolarHBondContact O-N 3.33Å; V340-C344 PolarHBondContact O-SG 3.46Å; V340-C344 VanDerWaalsContact O-SG 3.33Å
341	A	97.6	Very high	95.4	Very high	0 Å²	0	33.4 Å²	33.4	0%	0	17%	0.173	C	C	.	.	H	α-helix	trans	-60.2	-38.7	175.4	0	0	0	0	0	111.8	V309 P337 L338 C344 G345 N346 L349 V350 L353	V309-A341 HydrophobicContact CG1-CB 3.78Å; P337-A341 WeakPolarHBondContact O-CB 3.33Å; P337-A341 PolarHBondContact O-N 3.25Å; L338-A341 PolarHBondContact O-N 3Å; A341-C344 PolarHBondContact O-N 3.08Å; A341-G345 PolarHBondContact O-N 3.43Å; A341-G345 VanDerWaalsContact O-N 3.09Å; A341-N346 PolarHBondContact O-N 3.05Å; A341-L349 HydrophobicContact CB-CB 4.17Å; A341-V350 HydrophobicContact CB-CG2 3.85Å; A341-L353 HydrophobicContact CB-CD1 3.76Å
342	A	97.4	Very high	95.8	Very high	0 Å²	0	34 Å²	34	0%	0	18%	0.178	C	C	.	.	H	α-helix	trans	-66.9	-41.3	177	0	0	0	0	0	113	L338 H339 V340 G345 A370 A374 H379 V382 L386	L338-A342 WeakPolarHBondContact O-CB 3.44Å; L338-A342 PolarHBondContact O-N 3.24Å; H339-A342 PolarHBondContact O-N 2.79Å; V340-A342 VanDerWaalsContact C-N 3.26Å; V340-A342 PolarHBondContact O-N 2.68Å; A342-G345 PolarHBondContact O-N 2.89Å; A342-A370 HydrophobicContact CB-CB 4.2Å; A342-A374 HydrophobicContact CB-CB 4.13Å; A342-H379 PolarHBondContact O-CD2 2.79Å; A342-V382 HydrophobicContact CB-CG1 4.19Å; A342-L386 HydrophobicContact CB-CD1 4.36Å
343	D	96.1	Very high	96.2	Very high	63 Å²	63	27.9 Å²	27.9	34%	0.337	15%	0.149	S	C	.	.	H	α-helix	trans	-67.6	-37.6	175.9	-160.7	42.1	0	0	0	111.8	H339 V340 G345 V373 R376 S377 H379	H339-D343 PolarHBondContact O-N 3.27Å; V340-D343 PolarHBondContact O-N 3.28Å; D343-G345 VanDerWaalsContact C-N 3.28Å; D343-G345 PolarHBondContact O-N 2.9Å; D343-V373 HydrophobicContact CB-CG1 3.59Å; D343-R376 IonicContact OD1-CZ 3.4Å; D343-R376 IonicContact OD1-NH2 2.82Å; D343-R376 PolarHBondContact OD1-NH2 2.93Å; D343-S377 PolarHBondContact OD1-OG 3.25Å; D343-H379 PolarHBondContact O-CD2 2.86Å; D343-H379 PolarHBondContact O-NE2 3.49Å
344	C	93.6	Very high	96.5	Very high	71 Å²	71	22.1 Å²	22.1	48%	0.48	12%	0.124	S	C	.	.	H	α-helix	trans	-71.7	-17.9	175.8	-70.3	0	0	0	0	113.7	V340 A341 N346	V340-C344 WeakPolarHBondContact O-CB 3.49Å; V340-C344 PolarHBondContact O-N 3.33Å; V340-C344 PolarHBondContact O-SG 3.46Å; V340-C344 VanDerWaalsContact O-SG 3.33Å; A341-C344 PolarHBondContact O-N 3.08Å; C344-N346 VanDerWaalsContact C-N 3.29Å; C344-N346 PolarHBondContact O-N 3.27Å
345	G	94.3	Very high	96.6	Very high	19 Å²	19	22.1 Å²	22.1	20%	0.196	12%	0.122	C	C	.	.	T	Hydrogen-bonded Turn	trans	71.8	18.6	179.8	0	0	0	0	0	114.8	A341 A342 D343 V347 H379	A341-G345 PolarHBondContact O-N 3.43Å; A341-G345 VanDerWaalsContact O-N 3.09Å; A342-G345 PolarHBondContact O-N 2.89Å; D343-G345 VanDerWaalsContact C-N 3.28Å; D343-G345 PolarHBondContact O-N 2.9Å; G345-V347 PolarHBondContact O-N 2.95Å; G345-H379 WeakPolarHBondContact CA-CD2 3.35Å; G345-H379 VanDerWaalsContact CA-CG 3.43Å; G345-H379 WeakPolarHBondContact CA-NE2 3.37Å; G345-H379 PolarHBondContact N-NE2 2.8Å
346	N	92.7	Very high	96.6	Very high	33 Å²	33	23.4 Å²	23.4	18%	0.176	14%	0.137	C	C	.	.			trans	-85	99.3	-173.6	-172.3	-28.5	0	0	0	111.5	N312 A341 C344 E348 L349 V350	N312-N346 PolarHBondContact ND2-ND2 3.42Å; N312-N346 PolarHBondContact OD1-ND2 3.46Å; A341-N346 PolarHBondContact O-N 3.05Å; C344-N346 VanDerWaalsContact C-N 3.29Å; C344-N346 PolarHBondContact O-N 3.27Å; N346-E348 VanDerWaalsContact C-N 3.28Å; N346-E348 PolarHBondContact O-N 3.4Å; N346-E348 PolarHBondContact OD1-N 3.48Å; N346-E348 VanDerWaalsContact OD1-N 3.12Å; N346-L349 HydrophobicContact CB-CB 4.14Å; N346-L349 HydrophobicContact CB-CD1 3.97Å; N346-L349 HydrophobicContact CB-CG 4.31Å; N346-L349 VanDerWaalsContact ND2-CD1 3.32Å; N346-L349 WeakPolarHBondContact ND2-CD1 3.46Å; N346-L349 PolarHBondContact O-N 3.24Å; N346-L349 PolarHBondContact OD1-N 3.05Å; N346-V350 VanDerWaalsContact O-CG2 3.31Å; N346-V350 WeakPolarHBondContact O-CG2 3.36Å; N346-V350 PolarHBondContact O-N 3.28Å
347	V	96.4	Very high	96.4	Very high	45 Å²	45	25.2 Å²	25.2	27%	0.273	16%	0.156	S	C	.	.	H	α-helix	trans	-53.4	-40.1	-179.2	168.9	0	0	0	0	113	G345 E351 L381 V382 M385 K415	G345-V347 PolarHBondContact O-N 2.95Å; V347-E351 VanDerWaalsContact O-CB 3.29Å; V347-E351 WeakPolarHBondContact O-CB 3.4Å; V347-E351 PolarHBondContact O-N 2.81Å; V347-L381 HydrophobicContact CG2-CB 4.25Å; V347-L381 HydrophobicContact CG2-CD1 4.42Å; V347-V382 HydrophobicContact CG2-CG2 4.4Å; V347-M385 HydrophobicContact CB-SD 4.29Å; V347-M385 HydrophobicContact CG1-CE 4.22Å; V347-M385 HydrophobicContact CG1-SD 3.75Å; V347-M385 HydrophobicContact CG2-SD 4.29Å; V347-M385 WeakPolarHBondContact O-CE 3.32Å; V347-K415 HydrophobicContact CG1-CD 4.29Å; V347-K415 HydrophobicContact CG1-CG 4.06Å
348	E	96.9	Very high	96.2	Very high	79 Å²	79	25.6 Å²	25.6	37%	0.369	16%	0.158	S	C	.	.	H	α-helix	trans	-71.9	-43.7	-177.4	-162.9	64.2	-130.4	0	0	111.7	I314 N346 E351 T352 K415	I314-E348 HydrophobicContact CD1-CB 3.81Å; I314-E348 HydrophobicContact CD1-CG 3.59Å; I314-E348 HydrophobicContact CG1-CG 4.33Å; N346-E348 VanDerWaalsContact C-N 3.28Å; N346-E348 PolarHBondContact O-N 3.4Å; N346-E348 PolarHBondContact OD1-N 3.48Å; N346-E348 VanDerWaalsContact OD1-N 3.12Å; E348-E351 WeakPolarHBondContact O-CB 3.3Å; E348-E351 PolarHBondContact O-N 2.66Å; E348-T352 PolarHBondContact O-N 3.1Å; E348-T352 PolarHBondContact O-OG1 3.26Å; E348-T352 VanDerWaalsContact O-OG1 3.05Å; E348-K415 IonicContact OE1-NZ 3.99Å; E348-K415 PolarHBondContact OE1-NZ 3.19Å; E348-K415 IonicContact OE2-NZ 3.84Å; E348-K415 PolarHBondContact OE2-NZ 2.83Å
349	L	97.3	Very high	96.1	Very high	0 Å²	0	29 Å²	29	0%	0	18%	0.176	C	C	.	.	H	α-helix	trans	-64.5	-42.2	176.3	-73.7	174.8	0	0	0	112.2	V309 I314 V317 A341 N346 E351 T352 L353	V309-L349 HydrophobicContact CB-CD1 4.49Å; V309-L349 HydrophobicContact CG1-CD1 4.15Å; V309-L349 WeakPolarHBondContact O-CD1 3.49Å; I314-L349 HydrophobicContact CB-CD2 4.37Å; I314-L349 HydrophobicContact CG1-CD2 3.58Å; I314-L349 HydrophobicContact CG1-CG 3.99Å; V317-L349 HydrophobicContact CB-CD2 4.41Å; V317-L349 HydrophobicContact CG2-CD2 3.78Å; A341-L349 HydrophobicContact CB-CB 4.17Å; N346-L349 HydrophobicContact CB-CB 4.14Å; N346-L349 HydrophobicContact CB-CD1 3.97Å; N346-L349 HydrophobicContact CB-CG 4.31Å; N346-L349 VanDerWaalsContact ND2-CD1 3.32Å; N346-L349 WeakPolarHBondContact ND2-CD1 3.46Å; N346-L349 PolarHBondContact O-N 3.24Å; N346-L349 PolarHBondContact OD1-N 3.05Å; L349-E351 VanDerWaalsContact C-N 3.34Å; L349-T352 PolarHBondContact O-N 3.47Å; L349-L353 WeakPolarHBondContact O-CB 3.31Å; L349-L353 WeakPolarHBondContact O-CG 3.23Å; L349-L353 PolarHBondContact O-N 3.48Å
350	V	98.3	Very high	96.1	Very high	0 Å²	0	29.8 Å²	29.8	0%	0	18%	0.181	C	C	.	.	H	α-helix	trans	-60.7	-47.3	175.6	171.1	0	0	0	0	109.6	A341 N346 T352 L353 L354 V382 M385	A341-V350 HydrophobicContact CB-CG2 3.85Å; N346-V350 VanDerWaalsContact O-CG2 3.31Å; N346-V350 WeakPolarHBondContact O-CG2 3.36Å; N346-V350 PolarHBondContact O-N 3.28Å; V350-T352 VanDerWaalsContact C-N 3.34Å; V350-T352 PolarHBondContact O-N 3.12Å; V350-L353 PolarHBondContact O-N 3.35Å; V350-L354 HydrophobicContact CG1-CD1 3.56Å; V350-L354 HydrophobicContact CG1-CG 4.02Å; V350-L354 VanDerWaalsContact O-CB 3.32Å; V350-L354 WeakPolarHBondContact O-CB 3.44Å; V350-L354 WeakPolarHBondContact O-CG 3.37Å; V350-L354 PolarHBondContact O-N 3.41Å; V350-V382 HydrophobicContact CG1-CG1 4.23Å; V350-V382 HydrophobicContact CG2-CG1 3.95Å; V350-V382 HydrophobicContact CG2-CG2 4.2Å; V350-M385 HydrophobicContact CB-CE 4.32Å; V350-M385 HydrophobicContact CG1-CB 4.31Å; V350-M385 HydrophobicContact CG1-CE 3.98Å; V350-M385 HydrophobicContact CG1-SD 4.33Å
351	E	97.8	Very high	96	Very high	2 Å²	2	35.3 Å²	35.3	1%	0.009	20%	0.204	C	C	.	.	H	α-helix	trans	-54.5	-49.7	175.4	177.8	77.1	170.7	0	0	111.9	V347 E348 L349 L354 K355 M385 T413 F414 K415	V347-E351 VanDerWaalsContact O-CB 3.29Å; V347-E351 WeakPolarHBondContact O-CB 3.4Å; V347-E351 PolarHBondContact O-N 2.81Å; E348-E351 WeakPolarHBondContact O-CB 3.3Å; E348-E351 PolarHBondContact O-N 2.66Å; L349-E351 VanDerWaalsContact C-N 3.34Å; E351-L354 PolarHBondContact O-N 2.97Å; E351-K355 HydrophobicContact CG-CD 4.05Å; E351-K355 WeakPolarHBondContact O-CB 3.28Å; E351-K355 WeakPolarHBondContact O-CG 3.45Å; E351-K355 PolarHBondContact O-N 3.47Å; E351-K355 WeakPolarHBondContact OE1-CE 3.43Å; E351-K355 IonicContact OE1-NZ 3.89Å; E351-K355 PolarHBondContact OE1-NZ 3.38Å; E351-M385 HydrophobicContact CB-CE 3.68Å; E351-M385 WeakPolarHBondContact OE2-CE 3.26Å; E351-T413 WeakPolarHBondContact OE1-CA 3.25Å; E351-T413 PolarHBondContact OE1-OG1 3.06Å; E351-F414 PolarHBondContact OE1-N 3.07Å; E351-F414 WeakPolarHBondContact OE2-CA 3.18Å; E351-F414 WeakPolarHBondContact OE2-CB 3.43Å; E351-F414 PolarHBondContact OE2-N 2.95Å; E351-K415 HydrophobicContact CG-CG 4.4Å; E351-K415 PolarHBondContact OE2-N 2.89Å
352	T	97.6	Very high	96	Very high	19 Å²	19	36.1 Å²	36.1	12%	0.117	21%	0.21	C	C	.	.	H	α-helix	trans	-59.6	-48.4	-179.6	-61.7	0	0	0	0	111.7	V317 N318 L321 E348 L349 V350 K355 A356	V317-T352 HydrophobicContact CG1-CG2 3.99Å; N318-T352 WeakPolarHBondContact OD1-CG2 3.35Å; L321-T352 HydrophobicContact CD1-CG2 4.02Å; E348-T352 PolarHBondContact O-N 3.1Å; E348-T352 PolarHBondContact O-OG1 3.26Å; E348-T352 VanDerWaalsContact O-OG1 3.05Å; L349-T352 PolarHBondContact O-N 3.47Å; V350-T352 VanDerWaalsContact C-N 3.34Å; V350-T352 PolarHBondContact O-N 3.12Å; T352-K355 PolarHBondContact O-N 3.1Å; T352-A356 WeakPolarHBondContact O-CB 3.42Å; T352-A356 PolarHBondContact O-N 2.97Å; T352-A356 VanDerWaalsContact O-N 3.14Å
353	L	97.9	Very high	96	Very high	0 Å²	0	39.7 Å²	39.7	0%	0	23%	0.232	C	C	.	.	H	α-helix	trans	-66.7	-41.7	-179.4	-68.8	170.3	0	0	0	111.9	V309 V317 L321 I327 P337 L338 A341 L349 V350 K355 A356 G357 C358	V309-L353 HydrophobicContact CG2-CD1 4.21Å; V317-L353 HydrophobicContact CG1-CD2 4.4Å; L321-L353 HydrophobicContact CD1-CD2 4.44Å; I327-L353 HydrophobicContact CD1-CD2 4.17Å; I327-L353 HydrophobicContact CG1-CD2 4.05Å; P337-L353 HydrophobicContact CB-CD1 4.19Å; P337-L353 HydrophobicContact CB-CD2 4.28Å; L338-L353 HydrophobicContact CD1-CB 4.13Å; L338-L353 HydrophobicContact CD1-CD1 4.47Å; A341-L353 HydrophobicContact CB-CD1 3.76Å; L349-L353 WeakPolarHBondContact O-CB 3.31Å; L349-L353 WeakPolarHBondContact O-CG 3.23Å; L349-L353 PolarHBondContact O-N 3.48Å; V350-L353 PolarHBondContact O-N 3.35Å; L353-K355 PolarHBondContact O-N 2.87Å; L353-A356 PolarHBondContact O-N 3.19Å; L353-G357 PolarHBondContact O-N 3.4Å; L353-C358 PolarHBondContact O-SG 3.48Å; L353-C358 VanDerWaalsContact O-SG 3.4Å
354	L	97.4	Very high	96	Very high	0 Å²	0	37.3 Å²	37.3	0%	0	22%	0.219	C	C	.	.	H	α-helix	trans	-62	-43.8	177.2	-70.1	177.5	0	0	0	111.3	L338 V350 E351 A356 G357 L360 M385 L386 A389 Y393 F414	L338-L354 HydrophobicContact CD1-CD2 3.97Å; L338-L354 HydrophobicContact CD1-CG 4.29Å; L338-L354 HydrophobicContact CD2-CD2 4.34Å; V350-L354 HydrophobicContact CG1-CD1 3.56Å; V350-L354 HydrophobicContact CG1-CG 4.02Å; V350-L354 VanDerWaalsContact O-CB 3.32Å; V350-L354 WeakPolarHBondContact O-CB 3.44Å; V350-L354 WeakPolarHBondContact O-CG 3.37Å; V350-L354 PolarHBondContact O-N 3.41Å; E351-L354 PolarHBondContact O-N 2.97Å; L354-A356 VanDerWaalsContact C-N 3.25Å; L354-A356 PolarHBondContact O-N 3.45Å; L354-G357 PolarHBondContact O-N 2.86Å; L354-G357 VanDerWaalsContact O-N 3.14Å; L354-L360 HydrophobicContact CD2-CD2 3.43Å; L354-L360 VanDerWaalsContact CD2-CD2 3.43Å; L354-M385 HydrophobicContact CD1-CB 4.07Å; L354-L386 HydrophobicContact CD2-CD2 3.99Å; L354-A389 HydrophobicContact CB-CB 4.33Å; L354-A389 HydrophobicContact CD1-CB 3.89Å; L354-A389 HydrophobicContact CD2-CB 3.7Å; L354-A389 HydrophobicContact CG-CB 4.18Å; L354-Y393 WeakPolarHBondContact O-CE2 3.29Å; L354-Y393 PolarHBondContact O-OH 3.28Å; L354-F414 HydrophobicContact CB-CD2 3.62Å; L354-F414 HydrophobicContact CB-CE2 3.71Å; L354-F414 HydrophobicContact CD1-CB 4.26Å; L354-F414 HydrophobicContact CD1-CD2 4.04Å; L354-F414 HydrophobicContact CD1-CG 4.25Å; L354-F414 HydrophobicContact CG-CD2 4.49Å
355	K	95.4	Very high	96.1	Very high	93 Å²	93	41 Å²	41	40%	0.404	23%	0.227	S	C	.	.	H	α-helix	trans	-63.1	-30.8	176	-79.4	174.7	163.5	165.1	0	113.7	E351 T352 L353 G357 L412 F414	E351-K355 HydrophobicContact CG-CD 4.05Å; E351-K355 WeakPolarHBondContact O-CB 3.28Å; E351-K355 WeakPolarHBondContact O-CG 3.45Å; E351-K355 PolarHBondContact O-N 3.47Å; E351-K355 WeakPolarHBondContact OE1-CE 3.43Å; E351-K355 IonicContact OE1-NZ 3.89Å; E351-K355 PolarHBondContact OE1-NZ 3.38Å; T352-K355 PolarHBondContact O-N 3.1Å; L353-K355 PolarHBondContact O-N 2.87Å; K355-G357 PolarHBondContact O-N 3.44Å; K355-L412 WeakPolarHBondContact CE-O 3.41Å; K355-L412 HydrophobicContact CG-CD2 4.39Å; K355-L412 PolarHBondContact NZ-O 3.44Å; K355-F414 HydrophobicContact CG-CE2 4.28Å
356	A	94.8	Very high	96.1	Very high	51 Å²	51	46.1 Å²	46.1	42%	0.421	25%	0.246	S	C	.	.	T	Hydrogen-bonded Turn	trans	-78.6	-2.3	177.6	0	0	0	0	0	113.5	L321 I327 T352 L353 L354	L321-A356 HydrophobicContact CD1-CB 3.9Å; L321-A356 HydrophobicContact CD2-CB 4.5Å; I327-A356 HydrophobicContact CD1-CB 3.45Å; I327-A356 VanDerWaalsContact CD1-CB 3.45Å; T352-A356 WeakPolarHBondContact O-CB 3.42Å; T352-A356 PolarHBondContact O-N 2.97Å; T352-A356 VanDerWaalsContact O-N 3.14Å; L353-A356 PolarHBondContact O-N 3.19Å; L354-A356 VanDerWaalsContact C-N 3.25Å; L354-A356 PolarHBondContact O-N 3.45Å
357	G	92.4	Very high	96.3	Very high	39 Å²	39	47 Å²	47	40%	0.402	26%	0.263	S	S	.	.	T	Hydrogen-bonded Turn	trans	79.2	39.1	171.9	0	0	0	0	0	114.3	L353 L354 K355	L353-G357 PolarHBondContact O-N 3.4Å; L354-G357 PolarHBondContact O-N 2.86Å; L354-G357 VanDerWaalsContact O-N 3.14Å; K355-G357 PolarHBondContact O-N 3.44Å
358	C	94.6	Very high	96.3	Very high	7 Å²	7	49.4 Å²	49.4	5%	0.047	27%	0.269	C	S	.	.			trans	-61.6	153.4	173.5	57.6	0	0	0	0	112.9	I327 L353 L360	I327-C358 HydrophobicContact CD1-CB 3.7Å; I327-C358 HydrophobicContact CG1-CB 3.85Å; I327-C358 HydrophobicContact CG2-CB 4.5Å; L353-C358 PolarHBondContact O-SG 3.48Å; L353-C358 VanDerWaalsContact O-SG 3.4Å; C358-L360 PolarHBondContact O-N 3.39Å
359	D	95.9	Very high	96.4	Very high	72 Å²	72	47.3 Å²	47.3	39%	0.385	26%	0.262	S	S	.	.			trans	-69.8	113.6	173.7	179.6	8.9	0	0	0	110.6	N328 K361 A362	N328-D359 WeakPolarHBondContact OD1-CB 3.47Å; N328-D359 PolarHBondContact OD1-N 3.37Å; D359-K361 VanDerWaalsContact C-N 3.33Å; D359-K361 WeakPolarHBondContact OD1-CA 3.28Å; D359-K361 WeakPolarHBondContact OD1-CB 3.45Å; D359-K361 PolarHBondContact OD1-N 3.49Å; D359-A362 HydrophobicContact CB-CB 4.35Å; D359-A362 PolarHBondContact OD1-N 2.99Å; D359-A362 PolarHBondContact OD2-N 2.8Å
360	L	96.7	Very high	96.4	Very high	18 Å²	18	47.4 Å²	47.4	9%	0.094	26%	0.263	C	S	.	.	S	Bend	trans	-81.9	-13.9	-180	-53.3	-178.1	0	0	0	112.9	L338 L354 C358 A389 E390 Y393	L338-L360 HydrophobicContact CD2-CD2 3.58Å; L354-L360 HydrophobicContact CD2-CD2 3.43Å; L354-L360 VanDerWaalsContact CD2-CD2 3.43Å; C358-L360 PolarHBondContact O-N 3.39Å; L360-A389 HydrophobicContact CD1-CB 4.02Å; L360-E390 HydrophobicContact CB-CG 4.12Å; L360-E390 HydrophobicContact CD1-CB 4.22Å; L360-E390 HydrophobicContact CD1-CG 3.68Å; L360-Y393 HydrophobicContact CD1-CD2 3.96Å
361	K	96.1	Very high	96.3	Very high	131 Å²	131	47.9 Å²	47.9	57%	0.57	27%	0.266	S	S	*	.	S	Bend	trans	-98.3	-10.5	-177.2	-55.3	-53.6	177.8	-170.1	0	113	D359 V363 E390	D359-K361 VanDerWaalsContact C-N 3.33Å; D359-K361 WeakPolarHBondContact OD1-CA 3.28Å; D359-K361 WeakPolarHBondContact OD1-CB 3.45Å; D359-K361 PolarHBondContact OD1-N 3.49Å; K361-V363 PolarHBondContact O-N 3.41Å; K361-E390 IonicContact NZ-OE1 2.58Å; K361-E390 PolarHBondContact NZ-OE1 3.23Å
362	A	96.9	Very high	96.3	Very high	16 Å²	16	48.9 Å²	48.9	13%	0.132	27%	0.274	C	S	.	.			trans	-51.3	139.1	169.7	0	0	0	0	0	110.9	T336 H339 D359	T336-A362 HydrophobicContact CG2-CB 3.69Å; H339-A362 PolarHBondContact CE1-O 3.32Å; H339-A362 PolarHBondContact NE2-O 2.74Å; D359-A362 HydrophobicContact CB-CB 4.35Å; D359-A362 PolarHBondContact OD1-N 2.99Å; D359-A362 PolarHBondContact OD2-N 2.8Å
363	V	96.9	Very high	96.2	Very high	76 Å²	76	48.1 Å²	48.1	46%	0.461	27%	0.269	S	S	.	.	B	Isolated β-bridge	trans	-121.8	142.9	179.7	-67.5	0	0	0	0	110.9	K361 K368 T369	K361-V363 PolarHBondContact O-N 3.41Å; V363-K368 WeakPolarHBondContact CA-O 3.29Å; V363-T369 HydrophobicContact CG1-CG2 3.8Å
364	D	95.8	Very high	96.2	Very high	12 Å²	12	48.1 Å²	48.1	6%	0.064	27%	0.269	C	S	.	.			trans	-73.3	-178.5	172.8	72.5	12.4	0	0	0	113.1	Q334 Q335 Q366 G367 K368	Q334-D364 WeakPolarHBondContact O-CA 3.26Å; Q335-D364 HydrophobicContact CG-CB 3.8Å; D364-Q366 PolarHBondContact O-N 3.32Å; D364-Q366 VanDerWaalsContact O-N 3.07Å; D364-Q366 VanDerWaalsContact OD1-CA 3.3Å; D364-Q366 WeakPolarHBondContact OD1-CA 3.29Å; D364-Q366 WeakPolarHBondContact OD1-CB 3.35Å; D364-Q366 PolarHBondContact OD1-N 3.2Å; D364-G367 PolarHBondContact O-N 3.01Å; D364-G367 PolarHBondContact OD1-N 3.06Å; D364-G367 VanDerWaalsContact OD1-N 3.16Å; D364-K368 PolarHBondContact N-O 3.08Å; D364-K368 WeakPolarHBondContact OD1-CB 3.35Å; D364-K368 PolarHBondContact OD1-N 3.44Å
365	K	95.4	Very high	96	Very high	150 Å²	150	49 Å²	49	65%	0.652	28%	0.275	S	S	*	.	T	Hydrogen-bonded Turn	trans	-61.8	-17.5	179.3	-174.2	173	-176.3	175	0	113.3	K333 Q334	K333-K365 WeakPolarHBondContact O-CB 3.48Å; K333-K365 PolarHBondContact O-N 3.18Å; Q334-K365 HydrophobicContact CB-CB 4.2Å; Q334-K365 HydrophobicContact CG-CB 4.31Å
366	Q	95.6	Very high	95.9	Very high	126 Å²	126	52.5 Å²	52.5	59%	0.589	29%	0.286	S	S	*	.	T	Hydrogen-bonded Turn	trans	-94.6	4.4	174.9	-67.4	74.1	52.8	0	0	112.4	D364 K368	D364-Q366 PolarHBondContact O-N 3.32Å; D364-Q366 VanDerWaalsContact O-N 3.07Å; D364-Q366 VanDerWaalsContact OD1-CA 3.3Å; D364-Q366 WeakPolarHBondContact OD1-CA 3.29Å; D364-Q366 WeakPolarHBondContact OD1-CB 3.35Å; D364-Q366 PolarHBondContact OD1-N 3.2Å; Q366-K368 VanDerWaalsContact C-N 3.3Å; Q366-K368 HydrophobicContact CB-CG 3.98Å
367	G	96.6	Very high	95.6	Very high	51 Å²	51	51.4 Å²	51.4	53%	0.526	28%	0.275	S	S	.	.	S	Bend	trans	72.8	22.1	-176.5	0	0	0	0	0	113	D364	D364-G367 PolarHBondContact O-N 3.01Å; D364-G367 PolarHBondContact OD1-N 3.06Å; D364-G367 VanDerWaalsContact OD1-N 3.16Å
368	K	96.6	Very high	95.4	Very high	95 Å²	95	54.3 Å²	54.3	41%	0.413	28%	0.282	S	S	.	.			trans	-99.8	132.1	-179	-55	-62.7	-69.3	173.2	0	109.7	H339 V363 D364 Q366 A372 V373	H339-K368 PolarHBondContact CD2-O 3.15Å; H339-K368 PolarHBondContact NE2-O 3.21Å; V363-K368 WeakPolarHBondContact CA-O 3.29Å; D364-K368 PolarHBondContact N-O 3.08Å; D364-K368 WeakPolarHBondContact OD1-CB 3.35Å; D364-K368 PolarHBondContact OD1-N 3.44Å; Q366-K368 VanDerWaalsContact C-N 3.3Å; Q366-K368 HydrophobicContact CB-CG 3.98Å; K368-A372 HydrophobicContact CB-CB 4.25Å; K368-A372 HydrophobicContact CD-CB 4.42Å; K368-A372 VanDerWaalsContact CE-CB 3.42Å; K368-V373 HydrophobicContact CB-CG2 4.19Å
369	T	97.7	Very high	95.3	Very high	35 Å²	35	56.6 Å²	56.6	22%	0.215	29%	0.292	C	S	.	.	B	Isolated β-bridge	trans	-76.2	166.7	168	61.5	0	0	0	0	111	V363 L371 A372 V373	V363-T369 HydrophobicContact CG1-CG2 3.8Å; T369-L371 PolarHBondContact O-N 3.28Å; T369-A372 WeakPolarHBondContact O-CB 3.49Å; T369-A372 PolarHBondContact O-N 3.35Å; T369-A372 PolarHBondContact OG1-N 3.23Å; T369-V373 PolarHBondContact O-N 2.94Å
370	A	97.6	Very high	95.2	Very high	3 Å²	3	54.6 Å²	54.6	3%	0.025	28%	0.283	C	S	.	.	H	α-helix	trans	-56.3	-35.7	173.4	0	0	0	0	0	112.9	L338 H339 A342 A372 V373 A374 L386	L338-A370 HydrophobicContact CB-CB 4.4Å; L338-A370 HydrophobicContact CD2-CB 3.66Å; L338-A370 HydrophobicContact CG-CB 3.7Å; H339-A370 PolarHBondContact CD2-N 3.16Å; H339-A370 PolarHBondContact NE2-N 3.01Å; A342-A370 HydrophobicContact CB-CB 4.2Å; A370-A372 VanDerWaalsContact C-N 3.33Å; A370-A372 PolarHBondContact O-N 2.87Å; A370-V373 PolarHBondContact O-N 3.46Å; A370-A374 WeakPolarHBondContact O-CB 3.43Å; A370-A374 PolarHBondContact O-N 3.39Å; A370-L386 HydrophobicContact CB-CD1 4.46Å; A370-L386 HydrophobicContact CB-CD2 4.28Å
371	L	97.9	Very high	95.2	Very high	10 Å²	10	57.5 Å²	57.5	5%	0.052	30%	0.299	C	S	.	.	H	α-helix	trans	-59.4	-45.3	173.4	176.7	62.6	0	0	0	111.4	T369 V373 A374 S375 V383 L386 I387 Q455 A458	T369-L371 PolarHBondContact O-N 3.28Å; L371-V373 VanDerWaalsContact C-N 3.34Å; L371-A374 PolarHBondContact O-N 2.91Å; L371-S375 VanDerWaalsContact O-CB 3.31Å; L371-S375 WeakPolarHBondContact O-CB 3.48Å; L371-S375 PolarHBondContact O-N 3.28Å; L371-V383 HydrophobicContact CD1-CB 4.46Å; L371-V383 HydrophobicContact CD1-CG1 3.94Å; L371-L386 HydrophobicContact CB-CD1 4.46Å; L371-L386 HydrophobicContact CD1-CB 4.04Å; L371-I387 HydrophobicContact CD1-CD1 4.31Å; L371-I387 HydrophobicContact CD1-CG1 3.79Å; L371-I387 HydrophobicContact CD2-CG1 4.32Å; L371-Q455 HydrophobicContact CD2-CG 4.12Å; L371-A458 HydrophobicContact CD1-CB 3.83Å; L371-A458 HydrophobicContact CD2-CB 4.23Å; L371-A458 HydrophobicContact CG-CB 3.95Å
372	A	96.4	Very high	95.3	Very high	22 Å²	22	51.4 Å²	51.4	18%	0.182	27%	0.272	C	S	.	.	H	α-helix	trans	-71.5	-30.6	-179.2	0	0	0	0	0	112.4	K368 T369 A370 R376	K368-A372 HydrophobicContact CB-CB 4.25Å; K368-A372 HydrophobicContact CD-CB 4.42Å; K368-A372 VanDerWaalsContact CE-CB 3.42Å; T369-A372 WeakPolarHBondContact O-CB 3.49Å; T369-A372 PolarHBondContact O-N 3.35Å; T369-A372 PolarHBondContact OG1-N 3.23Å; A370-A372 VanDerWaalsContact C-N 3.33Å; A370-A372 PolarHBondContact O-N 2.87Å; A372-R376 PolarHBondContact O-N 2.91Å
373	V	96.3	Very high	95.3	Very high	4 Å²	4	50.6 Å²	50.6	2%	0.024	27%	0.266	C	S	.	.	H	α-helix	trans	-67.3	-50.8	171.4	173	0	0	0	0	111.1	D343 K368 T369 A370 L371 S375 R376 S377	D343-V373 HydrophobicContact CB-CG1 3.59Å; K368-V373 HydrophobicContact CB-CG2 4.19Å; T369-V373 PolarHBondContact O-N 2.94Å; A370-V373 PolarHBondContact O-N 3.46Å; L371-V373 VanDerWaalsContact C-N 3.34Å; V373-S375 VanDerWaalsContact C-N 3.26Å; V373-S375 PolarHBondContact O-N 2.85Å; V373-R376 PolarHBondContact O-N 2.94Å; V373-S377 PolarHBondContact O-N 3.32Å; V373-S377 PolarHBondContact O-OG 3.14Å
374	A	96.7	Very high	95.3	Very high	0 Å²	0	47.7 Å²	47.7	0%	0	25%	0.248	C	C	.	.	H	α-helix	trans	-56.8	-41.8	176.9	0	0	0	0	0	112.1	A342 A370 L371 S377 N378 H379 V382 V383 L386	A342-A374 HydrophobicContact CB-CB 4.13Å; A370-A374 WeakPolarHBondContact O-CB 3.43Å; A370-A374 PolarHBondContact O-N 3.39Å; L371-A374 PolarHBondContact O-N 2.91Å; A374-S377 PolarHBondContact O-N 3.03Å; A374-N378 PolarHBondContact O-N 3.48Å; A374-H379 PolarHBondContact O-N 2.83Å; A374-V382 HydrophobicContact CB-CB 4.28Å; A374-V382 HydrophobicContact CB-CG1 3.67Å; A374-V383 HydrophobicContact CB-CG2 3.87Å; A374-L386 HydrophobicContact CB-CD1 3.83Å
375	S	94.1	Very high	95.5	Very high	17 Å²	17	47.3 Å²	47.3	12%	0.119	25%	0.245	C	C	.	.	H	α-helix	trans	-62.1	-46.4	178.5	-175.5	0	0	0	0	112	L371 V373 S377 N378 A458 A461 Q462	L371-S375 VanDerWaalsContact O-CB 3.31Å; L371-S375 WeakPolarHBondContact O-CB 3.48Å; L371-S375 PolarHBondContact O-N 3.28Å; V373-S375 VanDerWaalsContact C-N 3.26Å; V373-S375 PolarHBondContact O-N 2.85Å; S375-S377 VanDerWaalsContact C-N 3.29Å; S375-S377 PolarHBondContact O-N 2.89Å; S375-N378 PolarHBondContact O-N 3.39Å; S375-A458 PolarHBondContact OG-O 3.25Å; S375-A461 VanDerWaalsContact OG-CB 3.24Å; S375-A461 WeakPolarHBondContact OG-CB 3.35Å; S375-Q462 PolarHBondContact O-NE2 3.36Å
376	R	92.5	Very high	95.6	Very high	167 Å²	167	40.3 Å²	40.3	63%	0.63	22%	0.215	S	C	*	.	H	α-helix	trans	-62.6	-35.9	176.3	-175	-170.6	57.1	60.7	3.6	112.4	D343 A372 V373 N378	D343-R376 IonicContact OD1-CZ 3.4Å; D343-R376 IonicContact OD1-NH2 2.82Å; D343-R376 PolarHBondContact OD1-NH2 2.93Å; A372-R376 PolarHBondContact O-N 2.91Å; V373-R376 PolarHBondContact O-N 2.94Å; R376-N378 VanDerWaalsContact C-N 3.27Å; R376-N378 PolarHBondContact O-N 3.09Å
377	S	89	Confident	95.7	Very high	29 Å²	29	34.3 Å²	34.3	20%	0.203	19%	0.187	C	C	.	.	T	Hydrogen-bonded Turn	trans	-86.7	6.2	-176.7	-62.6	0	0	0	0	113.8	D343 V373 A374 S375 H379	D343-S377 PolarHBondContact OD1-OG 3.25Å; V373-S377 PolarHBondContact O-N 3.32Å; V373-S377 PolarHBondContact O-OG 3.14Å; A374-S377 PolarHBondContact O-N 3.03Å; S375-S377 VanDerWaalsContact C-N 3.29Å; S375-S377 PolarHBondContact O-N 2.89Å; S377-H379 VanDerWaalsContact C-N 3.33Å; S377-H379 PolarHBondContact O-N 3.24Å
378	N	87.8	Confident	95.7	Very high	100 Å²	100	32.5 Å²	32.5	54%	0.535	17%	0.165	S	C	.	.	T	Hydrogen-bonded Turn	trans	60.6	33.9	175.8	-157.1	43.9	0	0	0	114.7	A374 S375 R376 S380 Q462	A374-N378 PolarHBondContact O-N 3.48Å; S375-N378 PolarHBondContact O-N 3.39Å; R376-N378 VanDerWaalsContact C-N 3.27Å; R376-N378 PolarHBondContact O-N 3.09Å; N378-S380 PolarHBondContact O-N 3.35Å; N378-Q462 VanDerWaalsContact CA-OE1 3.27Å; N378-Q462 PolarHBondContact OD1-O 3.42Å
379	H	93.4	Very high	95.8	Very high	55 Å²	55	28 Å²	28	26%	0.255	15%	0.145	S	C	.	.			trans	-95.3	74.1	178	-63.1	-54.8	0	0	0	111.1	A342 D343 G345 A374 S377 L381 V382 V383	A342-H379 PolarHBondContact O-CD2 2.79Å; D343-H379 PolarHBondContact O-CD2 2.86Å; D343-H379 PolarHBondContact O-NE2 3.49Å; G345-H379 WeakPolarHBondContact CA-CD2 3.35Å; G345-H379 VanDerWaalsContact CA-CG 3.43Å; G345-H379 WeakPolarHBondContact CA-NE2 3.37Å; G345-H379 PolarHBondContact N-NE2 2.8Å; A374-H379 PolarHBondContact O-N 2.83Å; S377-H379 VanDerWaalsContact C-N 3.33Å; S377-H379 PolarHBondContact O-N 3.24Å; H379-L381 VanDerWaalsContact C-N 3.3Å; H379-L381 PolarHBondContact O-N 2.76Å; H379-V382 HydrophobicContact CB-CB 3.95Å; H379-V382 HydrophobicContact CB-CG2 4.12Å; H379-V382 WeakPolarHBondContact O-CB 3.44Å; H379-V382 PolarHBondContact O-N 3.42Å; H379-V383 PolarHBondContact O-N 3.27Å
380	S	94.1	Very high	95.7	Very high	30 Å²	30	27.3 Å²	27.3	21%	0.21	14%	0.139	C	C	.	.	H	α-helix	trans	-57.1	-36.7	-171.3	62.6	0	0	0	0	114.5	N378 V383 D384 Q462 R475	N378-S380 PolarHBondContact O-N 3.35Å; S380-V383 PolarHBondContact O-N 2.81Å; S380-D384 PolarHBondContact O-N 3.07Å; S380-Q462 VanDerWaalsContact N-OE1 3.12Å; S380-R475 PolarHBondContact O-NH2 3.26Å
381	L	95.6	Very high	95.5	Very high	79 Å²	79	29.7 Å²	29.7	41%	0.414	15%	0.148	S	C	.	.	H	α-helix	trans	-65.4	-40.8	175.3	-66.5	178.2	0	0	0	112	V347 H379 D384 M385	V347-L381 HydrophobicContact CG2-CB 4.25Å; V347-L381 HydrophobicContact CG2-CD1 4.42Å; H379-L381 VanDerWaalsContact C-N 3.3Å; H379-L381 PolarHBondContact O-N 2.76Å; L381-D384 PolarHBondContact O-N 3.16Å; L381-M385 VanDerWaalsContact O-CG 3.25Å; L381-M385 WeakPolarHBondContact O-CG 3.3Å; L381-M385 PolarHBondContact O-N 3.11Å
382	V	97.8	Very high	95.2	Very high	2 Å²	2	30.9 Å²	30.9	1%	0.012	15%	0.152	C	C	.	.	H	α-helix	trans	-67.7	-39	177.9	172.1	0	0	0	0	110.7	A342 V347 V350 A374 H379 D384 M385 L386	A342-V382 HydrophobicContact CB-CG1 4.19Å; V347-V382 HydrophobicContact CG2-CG2 4.4Å; V350-V382 HydrophobicContact CG1-CG1 4.23Å; V350-V382 HydrophobicContact CG2-CG1 3.95Å; V350-V382 HydrophobicContact CG2-CG2 4.2Å; A374-V382 HydrophobicContact CB-CB 4.28Å; A374-V382 HydrophobicContact CB-CG1 3.67Å; H379-V382 HydrophobicContact CB-CB 3.95Å; H379-V382 HydrophobicContact CB-CG2 4.12Å; H379-V382 WeakPolarHBondContact O-CB 3.44Å; H379-V382 PolarHBondContact O-N 3.42Å; V382-D384 VanDerWaalsContact C-N 3.32Å; V382-D384 PolarHBondContact O-N 2.95Å; V382-M385 PolarHBondContact O-N 3.03Å; V382-L386 HydrophobicContact CG1-CD1 3.71Å; V382-L386 HydrophobicContact CG1-CG 4.31Å; V382-L386 WeakPolarHBondContact O-CB 3.45Å; V382-L386 VanDerWaalsContact O-CG 3.3Å; V382-L386 WeakPolarHBondContact O-CG 3.43Å; V382-L386 PolarHBondContact O-N 2.82Å
383	V	97.8	Very high	95	Very high	0 Å²	0	31.2 Å²	31.2	0%	0	15%	0.149	C	C	.	.	H	α-helix	trans	-55.7	-48.5	171	171	0	0	0	0	110.3	L371 A374 H379 S380 M385 L386 I387 A458 Q462	L371-V383 HydrophobicContact CD1-CB 4.46Å; L371-V383 HydrophobicContact CD1-CG1 3.94Å; A374-V383 HydrophobicContact CB-CG2 3.87Å; H379-V383 PolarHBondContact O-N 3.27Å; S380-V383 PolarHBondContact O-N 2.81Å; V383-M385 PolarHBondContact O-N 2.81Å; V383-L386 PolarHBondContact O-N 3.11Å; V383-I387 HydrophobicContact CG1-CD1 3.85Å; V383-I387 VanDerWaalsContact O-CG1 3.27Å; V383-I387 WeakPolarHBondContact O-CG1 3.47Å; V383-I387 PolarHBondContact O-N 2.83Å; V383-A458 HydrophobicContact CG1-CB 3.99Å; V383-Q462 HydrophobicContact CG2-CG 4.47Å
384	D	97.7	Very high	94.7	Very high	15 Å²	15	33 Å²	33	8%	0.08	16%	0.164	C	C	.	.	H	α-helix	trans	-63.4	-41.1	179.4	-66.2	-22.8	0	0	0	112.1	S380 L381 V382 I387 K388 R475 I479	S380-D384 PolarHBondContact O-N 3.07Å; L381-D384 PolarHBondContact O-N 3.16Å; V382-D384 VanDerWaalsContact C-N 3.32Å; V382-D384 PolarHBondContact O-N 2.95Å; D384-I387 PolarHBondContact O-N 2.95Å; D384-K388 WeakPolarHBondContact O-CB 3.38Å; D384-K388 WeakPolarHBondContact O-CG 3.32Å; D384-K388 PolarHBondContact O-N 3.19Å; D384-R475 IonicContact OD1-CZ 3.91Å; D384-R475 IonicContact OD1-NE 3.11Å; D384-R475 PolarHBondContact OD1-NE 3.06Å; D384-R475 IonicContact OD1-NH2 2.81Å; D384-R475 PolarHBondContact OD1-NH2 3.18Å; D384-R475 IonicContact OD2-CZ 3.11Å; D384-R475 IonicContact OD2-NE 3.45Å; D384-R475 PolarHBondContact OD2-NE 3.13Å; D384-R475 IonicContact OD2-NH2 2.78Å; D384-R475 PolarHBondContact OD2-NH2 3.13Å; D384-I479 HydrophobicContact CB-CD1 4.36Å; D384-I479 HydrophobicContact CB-CG1 4.25Å; D384-I479 WeakPolarHBondContact OD1-CD1 3.46Å
385	M	98.3	Very high	94.4	Very high	3 Å²	3	35.8 Å²	35.8	2%	0.015	17%	0.174	C	C	.	.	H	α-helix	trans	-61.9	-44.2	176.4	-70	174.5	74.4	0	0	112.3	V347 V350 E351 L354 L381 V382 V383 K388 A389 F414 K415	V347-M385 HydrophobicContact CB-SD 4.29Å; V347-M385 HydrophobicContact CG1-CE 4.22Å; V347-M385 HydrophobicContact CG1-SD 3.75Å; V347-M385 HydrophobicContact CG2-SD 4.29Å; V347-M385 WeakPolarHBondContact O-CE 3.32Å; V350-M385 HydrophobicContact CB-CE 4.32Å; V350-M385 HydrophobicContact CG1-CB 4.31Å; V350-M385 HydrophobicContact CG1-CE 3.98Å; V350-M385 HydrophobicContact CG1-SD 4.33Å; E351-M385 HydrophobicContact CB-CE 3.68Å; E351-M385 WeakPolarHBondContact OE2-CE 3.26Å; L354-M385 HydrophobicContact CD1-CB 4.07Å; L381-M385 VanDerWaalsContact O-CG 3.25Å; L381-M385 WeakPolarHBondContact O-CG 3.3Å; L381-M385 PolarHBondContact O-N 3.11Å; V382-M385 PolarHBondContact O-N 3.03Å; V383-M385 PolarHBondContact O-N 2.81Å; M385-K388 PolarHBondContact O-N 3.13Å; M385-A389 WeakPolarHBondContact O-CB 3.48Å; M385-A389 PolarHBondContact O-N 3.29Å; M385-F414 HydrophobicContact CB-CB 4.15Å; M385-F414 HydrophobicContact CE-CB 4.27Å; M385-F414 HydrophobicContact CG-CB 4.28Å; M385-F414 VanDerWaalsContact CG-O 3.31Å; M385-F414 WeakPolarHBondContact CG-O 3.22Å; M385-K415 HydrophobicContact CE-CG 4.13Å
386	L	98.1	Very high	94	Very high	3 Å²	3	39.3 Å²	39.3	2%	0.016	19%	0.185	C	C	.	.	H	α-helix	trans	-64.3	-45	179.1	-74.4	163.5	0	0	0	111.1	L338 A342 L354 A370 L371 A374 V382 V383 K388 A389 E390	L338-L386 HydrophobicContact CD1-CD2 4.18Å; L338-L386 HydrophobicContact CD2-CD2 3.88Å; L338-L386 HydrophobicContact CG-CD2 4.24Å; A342-L386 HydrophobicContact CB-CD1 4.36Å; L354-L386 HydrophobicContact CD2-CD2 3.99Å; A370-L386 HydrophobicContact CB-CD1 4.46Å; A370-L386 HydrophobicContact CB-CD2 4.28Å; L371-L386 HydrophobicContact CB-CD1 4.46Å; L371-L386 HydrophobicContact CD1-CB 4.04Å; A374-L386 HydrophobicContact CB-CD1 3.83Å; V382-L386 HydrophobicContact CG1-CD1 3.71Å; V382-L386 HydrophobicContact CG1-CG 4.31Å; V382-L386 WeakPolarHBondContact O-CB 3.45Å; V382-L386 VanDerWaalsContact O-CG 3.3Å; V382-L386 WeakPolarHBondContact O-CG 3.43Å; V382-L386 PolarHBondContact O-N 2.82Å; V383-L386 PolarHBondContact O-N 3.11Å; L386-K388 PolarHBondContact O-N 3.02Å; L386-A389 PolarHBondContact O-N 3.42Å; L386-E390 WeakPolarHBondContact O-CG 3.38Å; L386-E390 PolarHBondContact O-N 3.01Å
387	I	97.9	Very high	93.7	Very high	0 Å²	0	38.7 Å²	38.7	0%	0	19%	0.189	C	C	.	.	H	α-helix	trans	-64	-42.7	177.4	-60.3	171.3	0	0	0	110.7	L371 V383 D384 A389 E390 R391 F451 Q455 I459 I479	L371-I387 HydrophobicContact CD1-CD1 4.31Å; L371-I387 HydrophobicContact CD1-CG1 3.79Å; L371-I387 HydrophobicContact CD2-CG1 4.32Å; V383-I387 HydrophobicContact CG1-CD1 3.85Å; V383-I387 VanDerWaalsContact O-CG1 3.27Å; V383-I387 WeakPolarHBondContact O-CG1 3.47Å; V383-I387 PolarHBondContact O-N 2.83Å; D384-I387 PolarHBondContact O-N 2.95Å; I387-A389 VanDerWaalsContact C-N 3.32Å; I387-A389 PolarHBondContact O-N 3.27Å; I387-E390 PolarHBondContact O-N 2.76Å; I387-R391 HydrophobicContact CG2-CG 4.43Å; I387-R391 WeakPolarHBondContact O-CB 3.42Å; I387-R391 VanDerWaalsContact O-CG 3.26Å; I387-R391 WeakPolarHBondContact O-CG 3.27Å; I387-R391 PolarHBondContact O-N 3.05Å; I387-F451 HydrophobicContact CG2-CD1 4.31Å; I387-F451 HydrophobicContact CG2-CE1 3.96Å; I387-Q455 HydrophobicContact CD1-CB 4.08Å; I387-Q455 HydrophobicContact CD1-CG 4.46Å; I387-Q455 HydrophobicContact CG1-CB 4.2Å; I387-Q455 HydrophobicContact CG1-CG 4.03Å; I387-Q455 HydrophobicContact CG2-CB 4.24Å; I387-Q455 HydrophobicContact CG2-CG 4.02Å; I387-I459 HydrophobicContact CD1-CD1 3.93Å; I387-I459 HydrophobicContact CD1-CG1 3.68Å; I387-I479 HydrophobicContact CB-CD1 4.12Å; I387-I479 HydrophobicContact CB-CG2 4.35Å; I387-I479 HydrophobicContact CD1-CD1 3.99Å; I387-I479 HydrophobicContact CG2-CD1 4.11Å; I387-I479 HydrophobicContact CG2-CG2 3.69Å
388	K	97.3	Very high	93.6	Very high	13 Å²	13	44 Å²	44	6%	0.057	21%	0.211	C	C	.	.	H	α-helix	trans	-58.7	-43.9	174.8	-74	168.8	-174.8	173.9	0	111.8	D384 M385 L386 R391 Y392 F414 K415 I479 H482	D384-K388 WeakPolarHBondContact O-CB 3.38Å; D384-K388 WeakPolarHBondContact O-CG 3.32Å; D384-K388 PolarHBondContact O-N 3.19Å; M385-K388 PolarHBondContact O-N 3.13Å; L386-K388 PolarHBondContact O-N 3.02Å; K388-R391 PolarHBondContact O-N 3.41Å; K388-Y392 VanDerWaalsContact O-CB 3.29Å; K388-Y392 WeakPolarHBondContact O-CB 3.5Å; K388-Y392 PolarHBondContact O-N 3.19Å; K388-F414 HydrophobicContact CB-CD1 3.96Å; K388-F414 WeakPolarHBondContact CD-O 3.38Å; K388-F414 PolarHBondContact NZ-O 3.43Å; K388-K415 PolarHBondContact NZ-O 2.97Å; K388-I479 HydrophobicContact CG-CB 4.41Å; K388-I479 HydrophobicContact CG-CG1 4.3Å; K388-I479 HydrophobicContact CG-CG2 4.08Å; K388-H482 HydrophobicContact CD-CB 3.98Å; K388-H482 HydrophobicContact CG-CB 3.98Å
389	A	97.1	Very high	93.3	Very high	0 Å²	0	44 Å²	44	0%	0	21%	0.208	C	C	.	.	H	α-helix	trans	-67	-44.2	178.4	0	0	0	0	0	112.5	L354 L360 M385 L386 I387 R391 Y392 Y393 F414	L354-A389 HydrophobicContact CB-CB 4.33Å; L354-A389 HydrophobicContact CD1-CB 3.89Å; L354-A389 HydrophobicContact CD2-CB 3.7Å; L354-A389 HydrophobicContact CG-CB 4.18Å; L360-A389 HydrophobicContact CD1-CB 4.02Å; M385-A389 WeakPolarHBondContact O-CB 3.48Å; M385-A389 PolarHBondContact O-N 3.29Å; L386-A389 PolarHBondContact O-N 3.42Å; I387-A389 VanDerWaalsContact C-N 3.32Å; I387-A389 PolarHBondContact O-N 3.27Å; A389-R391 VanDerWaalsContact C-N 3.27Å; A389-R391 PolarHBondContact O-N 3.5Å; A389-Y392 PolarHBondContact O-N 2.92Å; A389-Y393 HydrophobicContact CB-CD2 4.31Å; A389-Y393 HydrophobicContact CB-CE2 4.27Å; A389-Y393 WeakPolarHBondContact O-CD2 3.43Å; A389-Y393 PolarHBondContact O-N 3.39Å; A389-F414 VanDerWaalsContact CA-CE1 3.48Å; A389-F414 HydrophobicContact CB-CD1 3.92Å; A389-F414 HydrophobicContact CB-CD2 4.41Å; A389-F414 HydrophobicContact CB-CE1 3.79Å; A389-F414 HydrophobicContact CB-CE2 4.28Å; A389-F414 HydrophobicContact CB-CG 4.23Å; A389-F414 HydrophobicContact CB-CZ 3.96Å
390	E	95.9	Very high	92.1	Very high	21 Å²	21	49.4 Å²	49.4	10%	0.098	23%	0.233	C	C	.	.	H	α-helix	trans	-55.8	-44.7	174.7	-74.1	-170.3	132.7	0	0	111.7	L360 K361 L386 I387 A394 Q455	L360-E390 HydrophobicContact CB-CG 4.12Å; L360-E390 HydrophobicContact CD1-CB 4.22Å; L360-E390 HydrophobicContact CD1-CG 3.68Å; K361-E390 IonicContact NZ-OE1 2.58Å; K361-E390 PolarHBondContact NZ-OE1 3.23Å; L386-E390 WeakPolarHBondContact O-CG 3.38Å; L386-E390 PolarHBondContact O-N 3.01Å; I387-E390 PolarHBondContact O-N 2.76Å; E390-A394 VanDerWaalsContact O-CB 3.29Å; E390-A394 WeakPolarHBondContact O-CB 3.49Å; E390-A394 PolarHBondContact O-N 3.35Å; E390-Q455 PolarHBondContact OE2-NE2 2.96Å
391	R	93.3	Very high	90.6	Very high	54 Å²	54	53.5 Å²	53.5	20%	0.204	25%	0.248	C	C	.	.	H	α-helix	trans	-68.2	-43	178.8	-68.3	176.5	69.6	82.8	4.4	112.1	I387 K388 A389 W395 W449 F451	I387-R391 HydrophobicContact CG2-CG 4.43Å; I387-R391 WeakPolarHBondContact O-CB 3.42Å; I387-R391 VanDerWaalsContact O-CG 3.26Å; I387-R391 WeakPolarHBondContact O-CG 3.27Å; I387-R391 PolarHBondContact O-N 3.05Å; K388-R391 PolarHBondContact O-N 3.41Å; A389-R391 VanDerWaalsContact C-N 3.27Å; A389-R391 PolarHBondContact O-N 3.5Å; R391-W395 WeakPolarHBondContact O-CB 3.47Å; R391-W395 PolarHBondContact O-N 3.12Å; R391-W449 VanDerWaalsContact CZ-O 3.27Å; R391-W449 PolarHBondContact NH1-O 3.34Å; R391-W449 PolarHBondContact NH2-O 2.97Å; R391-F451 VanDerWaalsContact NH1-CE2 3.27Å
392	Y	92.6	Very high	88.3	Confident	34 Å²	34	54.9 Å²	54.9	13%	0.133	27%	0.265	C	S	.	.	H	α-helix	trans	-62.2	-47	178.5	173.5	-103.2	0	0	0	111.8	K388 A389 W395 R396 L412 F414 M486	K388-Y392 VanDerWaalsContact O-CB 3.29Å; K388-Y392 WeakPolarHBondContact O-CB 3.5Å; K388-Y392 PolarHBondContact O-N 3.19Å; A389-Y392 PolarHBondContact O-N 2.92Å; Y392-W395 PolarHBondContact O-N 2.84Å; Y392-R396 HydrophobicContact CE1-CG 4.19Å; Y392-R396 HydrophobicContact CE2-CG 4.26Å; Y392-R396 WeakPolarHBondContact O-CG 3.39Å; Y392-R396 PolarHBondContact O-N 3.3Å; Y392-R396 WeakPolarHBondContact OH-CD 3.48Å; Y392-R396 PolarHBondContact OH-NH1 2.98Å; Y392-L412 HydrophobicContact CD1-CD1 4.23Å; Y392-L412 HydrophobicContact CD2-CD1 4.29Å; Y392-L412 HydrophobicContact CE1-CD1 3.87Å; Y392-L412 HydrophobicContact CE1-CD2 3.85Å; Y392-L412 HydrophobicContact CE2-CD1 3.95Å; Y392-L412 HydrophobicContact CG-CD1 4.42Å; Y392-F414 HydrophobicContact CD1-CE1 4.03Å; Y392-F414 AromaticContact CD1-CZ 3.86Å; Y392-F414 HydrophobicContact CD1-CZ 3.86Å; Y392-F414 HydrophobicContact CE1-CZ 4.44Å; Y392-F414 HydrophobicContact CG-CE1 4.08Å; Y392-F414 HydrophobicContact CG-CZ 4.37Å; Y392-M486 HydrophobicContact CD2-CB 4.22Å; Y392-M486 HydrophobicContact CD2-CG 4.26Å; Y392-M486 HydrophobicContact CE2-CB 4.45Å
393	Y	91.7	Very high	85.9	Confident	30 Å²	30	63 Å²	63	12%	0.118	31%	0.306	C	S	.	.	H	α-helix	trans	-71.3	-36.8	-179.1	-71.6	-57.9	0	0	0	112.9	L354 L360 A389 W395 R396 E397 F414	L354-Y393 WeakPolarHBondContact O-CE2 3.29Å; L354-Y393 PolarHBondContact O-OH 3.28Å; L360-Y393 HydrophobicContact CD1-CD2 3.96Å; A389-Y393 HydrophobicContact CB-CD2 4.31Å; A389-Y393 HydrophobicContact CB-CE2 4.27Å; A389-Y393 WeakPolarHBondContact O-CD2 3.43Å; A389-Y393 PolarHBondContact O-N 3.39Å; Y393-W395 VanDerWaalsContact C-N 3.34Å; Y393-W395 PolarHBondContact O-N 3.06Å; Y393-R396 VanDerWaalsContact CE1-NH2 3.33Å; Y393-R396 PolarHBondContact O-N 2.67Å; Y393-E397 WeakPolarHBondContact O-CG 3.48Å; Y393-E397 PolarHBondContact O-N 3.1Å; Y393-F414 HydrophobicContact CE2-CZ 4.21Å
394	A	90.6	Very high	83.3	Confident	42 Å²	42	66.3 Å²	66.3	35%	0.347	34%	0.34	S	S	.	.	H	α-helix	trans	-59.7	-44.8	171.5	0	0	0	0	0	111.8	E390 R396 E397 E398	E390-A394 VanDerWaalsContact O-CB 3.29Å; E390-A394 WeakPolarHBondContact O-CB 3.49Å; E390-A394 PolarHBondContact O-N 3.35Å; A394-R396 PolarHBondContact O-N 3.42Å; A394-E397 PolarHBondContact O-N 3.41Å; A394-E398 WeakPolarHBondContact O-CG 3.41Å; A394-E398 PolarHBondContact O-N 3.24Å
395	W	88.8	Confident	80.3	Confident	57 Å²	57	71.7 Å²	71.7	22%	0.216	37%	0.369	C	S	.	.	H	α-helix	trans	-60.2	-43.4	175.5	174.3	82.1	0	0	0	112	R391 Y392 Y393 E397 E398 H399 T487	R391-W395 WeakPolarHBondContact O-CB 3.47Å; R391-W395 PolarHBondContact O-N 3.12Å; Y392-W395 PolarHBondContact O-N 2.84Å; Y393-W395 VanDerWaalsContact C-N 3.34Å; Y393-W395 PolarHBondContact O-N 3.06Å; W395-E397 PolarHBondContact O-N 3.39Å; W395-E398 PolarHBondContact O-N 3.43Å; W395-H399 AromaticContact CD1-CE1 3.28Å; W395-H399 AromaticContact CD1-ND1 3.44Å; W395-H399 AromaticContact CD1-NE2 3.99Å; W395-H399 AromaticContact CE2-CG 3.87Å; W395-H399 AromaticContact CE2-ND1 3.77Å; W395-H399 AromaticContact CG-ND1 3.94Å; W395-H399 HydrophobicContact CZ2-CB 4.42Å; W395-H399 AromaticContact NE1-CD2 3.77Å; W395-H399 AromaticContact NE1-CE1 3.13Å; W395-H399 PolarHBondContact NE1-CE1 3.11Å; W395-H399 AromaticContact NE1-CG 3.73Å; W395-H399 AromaticContact NE1-ND1 3.32Å; W395-H399 PolarHBondContact NE1-ND1 3.28Å; W395-H399 AromaticContact NE1-NE2 3.39Å; W395-H399 PolarHBondContact NE1-NE2 3.34Å; W395-H399 PolarHBondContact O-N 2.94Å; W395-H399 VanDerWaalsContact O-N 3.16Å; W395-H399 PolarHBondContact O-ND1 3.18Å; W395-T487 HydrophobicContact CD2-CG2 4.04Å; W395-T487 HydrophobicContact CG-CG2 4.27Å; W395-T487 HydrophobicContact CZ2-CG2 4.04Å
396	R	85.9	Confident	77.6	Confident	91 Å²	91	77.2 Å²	77.2	34%	0.343	41%	0.405	S	S	.	.	H	α-helix	trans	-62.3	-41.2	177.9	-73.8	-144.1	-56.4	-172.7	11.7	113.3	Y392 Y393 A394 E398 H399 H400	Y392-R396 HydrophobicContact CE1-CG 4.19Å; Y392-R396 HydrophobicContact CE2-CG 4.26Å; Y392-R396 WeakPolarHBondContact O-CG 3.39Å; Y392-R396 PolarHBondContact O-N 3.3Å; Y392-R396 WeakPolarHBondContact OH-CD 3.48Å; Y392-R396 PolarHBondContact OH-NH1 2.98Å; Y393-R396 VanDerWaalsContact CE1-NH2 3.33Å; Y393-R396 PolarHBondContact O-N 2.67Å; A394-R396 PolarHBondContact O-N 3.42Å; R396-E398 VanDerWaalsContact C-N 3.33Å; R396-H399 PolarHBondContact O-N 3.02Å; R396-H400 PolarHBondContact O-N 3.04Å
397	E	86.5	Confident	75	Confident	154 Å²	154	81.6 Å²	81.6	72%	0.72	44%	0.436	S	S	*	.	H	α-helix	trans	-61.7	-41.5	177.3	-73.9	178	174.8	0	0	111.6	Y393 A394 W395 H399	Y393-E397 WeakPolarHBondContact O-CG 3.48Å; Y393-E397 PolarHBondContact O-N 3.1Å; A394-E397 PolarHBondContact O-N 3.41Å; W395-E397 PolarHBondContact O-N 3.39Å; E397-H399 PolarHBondContact O-N 2.99Å
398	E	86.7	Confident	72.7	Confident	140 Å²	140	85 Å²	85	65%	0.654	46%	0.457	S	S	*	.	H	α-helix	trans	-66	-35.2	177.9	-69.7	173	178.3	0	0	112.8	A394 W395 R396 H400	A394-E398 WeakPolarHBondContact O-CG 3.41Å; A394-E398 PolarHBondContact O-N 3.24Å; W395-E398 PolarHBondContact O-N 3.43Å; R396-E398 VanDerWaalsContact C-N 3.33Å; E398-H400 PolarHBondContact O-ND1 3.17Å; E398-H400 VanDerWaalsContact O-ND1 3.11Å
399	H	81.4	Confident	70.5	Confident	101 Å²	101	88.6 Å²	88.6	47%	0.468	50%	0.497	S	S	.	.	H	α-helix	trans	-95.8	2.4	-171.4	-65.8	70.4	0	0	0	114.6	W395 R396 E397 E401	W395-H399 AromaticContact CD1-CE1 3.28Å; W395-H399 AromaticContact CD1-ND1 3.44Å; W395-H399 AromaticContact CD1-NE2 3.99Å; W395-H399 AromaticContact CE2-CG 3.87Å; W395-H399 AromaticContact CE2-ND1 3.77Å; W395-H399 AromaticContact CG-ND1 3.94Å; W395-H399 HydrophobicContact CZ2-CB 4.42Å; W395-H399 AromaticContact NE1-CD2 3.77Å; W395-H399 AromaticContact NE1-CE1 3.13Å; W395-H399 PolarHBondContact NE1-CE1 3.11Å; W395-H399 AromaticContact NE1-CG 3.73Å; W395-H399 AromaticContact NE1-ND1 3.32Å; W395-H399 PolarHBondContact NE1-ND1 3.28Å; W395-H399 AromaticContact NE1-NE2 3.39Å; W395-H399 PolarHBondContact NE1-NE2 3.34Å; W395-H399 PolarHBondContact O-N 2.94Å; W395-H399 VanDerWaalsContact O-N 3.16Å; W395-H399 PolarHBondContact O-ND1 3.18Å; R396-H399 PolarHBondContact O-N 3.02Å; E397-H399 PolarHBondContact O-N 2.99Å; H399-E401 PolarHBondContact O-N 3.18Å; H399-E401 VanDerWaalsContact O-N 3.15Å
400	H	68.6	Low	68.9	Low	169 Å²	169	92.8 Å²	92.8	78%	0.782	53%	0.527	S	S	*	.	T	Hydrogen-bonded Turn	trans	51.9	34	173.3	-60.6	72.6	0	0	0	115	R396 E398 S402	R396-H400 PolarHBondContact O-N 3.04Å; E398-H400 PolarHBondContact O-ND1 3.17Å; E398-H400 VanDerWaalsContact O-ND1 3.11Å; H400-S402 PolarHBondContact O-N 2.98Å
401	E	62.1	Low	68.1	Low	115 Å²	115	97.3 Å²	97.3	54%	0.537	56%	0.558	S	S	.	*			trans	-69.6	117.3	175.8	-73.5	-173	161.6	0	0	110.9	H399	H399-E401 PolarHBondContact O-N 3.18Å; H399-E401 VanDerWaalsContact O-N 3.15Å
402	S	47.8	Very low	68	Low	109 Å²	109	96.7 Å²	96.7	76%	0.762	56%	0.559	S	S	*	*			trans	-66.2	137.7	174.1	169.4	0	0	0	0	111.2	H400 G404	H400-S402 PolarHBondContact O-N 2.98Å; S402-G404 PolarHBondContact O-N 3.36Å
403	I	48.2	Very low	68	Low	172 Å²	172	97.5 Å²	97.5	88%	0.882	57%	0.567	S	S	*	*	S	Bend	trans	-59.9	94.5	171.4	-60.1	167.8	0	0	0	108.7
404	G	42.6	Very low	68.3	Low	69 Å²	69	96.1 Å²	96.1	71%	0.711	56%	0.562	S	S	*	*			trans	145.6	59.1	170.9	0	0	0	0	0	116	S402	S402-G404 PolarHBondContact O-N 3.36Å
405	D	34.9	Very low	68.5	Low	129 Å²	129	96.9 Å²	96.9	69%	0.69	56%	0.557	S	S	*	*			trans	-161	117.3	139.9	-145.7	-10.9	0	0	0	109.9	S407	D405-S407 PolarHBondContact O-N 3.46Å
406	P	41.9	Very low	68.7	Low	118 Å²	118	98.2 Å²	98.2	77%	0.766	57%	0.566	S	S	*	*			trans	-75.1	66.1	168.4	32.9	-32.2	0	0	0	109.1	T408	P406-T408 PolarHBondContact O-N 2.9Å
407	S	42.8	Very low	68.9	Low	95 Å²	95	96.2 Å²	96.2	66%	0.664	56%	0.562	S	S	*	*			trans	-79.2	-4.6	171.8	65.1	0	0	0	0	112.3	D405	D405-S407 PolarHBondContact O-N 3.46Å
408	T	49.9	Very low	69.1	Low	72 Å²	72	95 Å²	95	44%	0.442	56%	0.556	S	S	.	*	S	Bend	trans	-99.2	110	-179.1	63.6	0	0	0	0	110.6	P406 S410	P406-T408 PolarHBondContact O-N 2.9Å; T408-S410 PolarHBondContact O-N 3.45Å
409	G	52.1	Low	69.3	Low	88 Å²	88	90.1 Å²	90.1	91%	0.907	54%	0.537	S	S	*	.	S	Bend	trans	-66.2	24.7	-174.8	0	0	0	0	0	117.4
410	S	61.5	Low	69.7	Low	89 Å²	89	91.7 Å²	91.7	62%	0.622	55%	0.549	S	S	*	.	S	Bend	trans	-139.3	132	175.4	-67.1	0	0	0	0	111.5	T408 L412	T408-S410 PolarHBondContact O-N 3.45Å; S410-L412 PolarHBondContact O-N 2.99Å
411	P	81.1	Confident	70.6	Confident	115 Å²	115	90.5 Å²	90.5	75%	0.747	54%	0.543	S	S	*	.			trans	-67.4	130.8	179.2	26.4	-32.2	0	0	0	110.7	T413	P411-T413 PolarHBondContact O-N 3.45Å
412	L	89.9	Confident	71.9	Confident	42 Å²	42	85.5 Å²	85.5	22%	0.22	52%	0.52	C	S	.	.			trans	-50.2	133.8	173.9	179	62.7	0	0	0	109.8	K355 Y392 S410 F414 M486	K355-L412 WeakPolarHBondContact CE-O 3.41Å; K355-L412 HydrophobicContact CG-CD2 4.39Å; K355-L412 PolarHBondContact NZ-O 3.44Å; Y392-L412 HydrophobicContact CD1-CD1 4.23Å; Y392-L412 HydrophobicContact CD2-CD1 4.29Å; Y392-L412 HydrophobicContact CE1-CD1 3.87Å; Y392-L412 HydrophobicContact CE1-CD2 3.85Å; Y392-L412 HydrophobicContact CE2-CD1 3.95Å; Y392-L412 HydrophobicContact CG-CD1 4.42Å; S410-L412 PolarHBondContact O-N 2.99Å; L412-F414 HydrophobicContact CD1-CE1 4.05Å; L412-F414 HydrophobicContact CD1-CE2 4.41Å; L412-F414 HydrophobicContact CD1-CZ 3.83Å; L412-F414 HydrophobicContact CD2-CE2 4.17Å; L412-F414 HydrophobicContact CD2-CZ 4.01Å; L412-F414 HydrophobicContact CG-CE2 4.22Å; L412-F414 HydrophobicContact CG-CZ 4.08Å; L412-M486 HydrophobicContact CD1-SD 4.11Å
413	T	93.9	Very high	74	Confident	51 Å²	51	88 Å²	88	31%	0.313	51%	0.513	S	S	.	.			trans	-153.7	139.5	174.2	177.1	0	0	0	0	110.3	E351 P411 K415 H482	E351-T413 WeakPolarHBondContact OE1-CA 3.25Å; E351-T413 PolarHBondContact OE1-OG1 3.06Å; P411-T413 PolarHBondContact O-N 3.45Å; T413-K415 PolarHBondContact OG1-N 3.3Å; T413-H482 PolarHBondContact O-CD2 3.27Å; T413-H482 PolarHBondContact O-NE2 2.91Å
414	F	96.3	Very high	76	Confident	0 Å²	0	84.4 Å²	84.4	0%	0	49%	0.493	C	S	.	.			trans	-103.4	-9.4	174.2	-56.9	-69.7	0	0	0	112.2	E351 L354 K355 M385 K388 A389 Y392 Y393 L412 H482	E351-F414 PolarHBondContact OE1-N 3.07Å; E351-F414 WeakPolarHBondContact OE2-CA 3.18Å; E351-F414 WeakPolarHBondContact OE2-CB 3.43Å; E351-F414 PolarHBondContact OE2-N 2.95Å; L354-F414 HydrophobicContact CB-CD2 3.62Å; L354-F414 HydrophobicContact CB-CE2 3.71Å; L354-F414 HydrophobicContact CD1-CB 4.26Å; L354-F414 HydrophobicContact CD1-CD2 4.04Å; L354-F414 HydrophobicContact CD1-CG 4.25Å; L354-F414 HydrophobicContact CG-CD2 4.49Å; K355-F414 HydrophobicContact CG-CE2 4.28Å; M385-F414 HydrophobicContact CB-CB 4.15Å; M385-F414 HydrophobicContact CE-CB 4.27Å; M385-F414 HydrophobicContact CG-CB 4.28Å; M385-F414 VanDerWaalsContact CG-O 3.31Å; M385-F414 WeakPolarHBondContact CG-O 3.22Å; K388-F414 HydrophobicContact CB-CD1 3.96Å; K388-F414 WeakPolarHBondContact CD-O 3.38Å; K388-F414 PolarHBondContact NZ-O 3.43Å; A389-F414 VanDerWaalsContact CA-CE1 3.48Å; A389-F414 HydrophobicContact CB-CD1 3.92Å; A389-F414 HydrophobicContact CB-CD2 4.41Å; A389-F414 HydrophobicContact CB-CE1 3.79Å; A389-F414 HydrophobicContact CB-CE2 4.28Å; A389-F414 HydrophobicContact CB-CG 4.23Å; A389-F414 HydrophobicContact CB-CZ 3.96Å; Y392-F414 HydrophobicContact CD1-CE1 4.03Å; Y392-F414 AromaticContact CD1-CZ 3.86Å; Y392-F414 HydrophobicContact CD1-CZ 3.86Å; Y392-F414 HydrophobicContact CE1-CZ 4.44Å; Y392-F414 HydrophobicContact CG-CE1 4.08Å; Y392-F414 HydrophobicContact CG-CZ 4.37Å; Y393-F414 HydrophobicContact CE2-CZ 4.21Å; L412-F414 HydrophobicContact CD1-CE1 4.05Å; L412-F414 HydrophobicContact CD1-CE2 4.41Å; L412-F414 HydrophobicContact CD1-CZ 3.83Å; L412-F414 HydrophobicContact CD2-CE2 4.17Å; L412-F414 HydrophobicContact CD2-CZ 4.01Å; L412-F414 HydrophobicContact CG-CE2 4.22Å; L412-F414 HydrophobicContact CG-CZ 4.08Å; F414-H482 AromaticContact CD1-CE1 3.84Å
415	K	95.6	Very high	78.3	Confident	59 Å²	59	81.4 Å²	81.4	26%	0.257	46%	0.46	S	S	.	.	S	Bend	trans	-56.8	164.2	176.8	-63	-178.1	-173.3	166.4	0	111.9	V347 E348 E351 M385 K388 T413 D417	V347-K415 HydrophobicContact CG1-CD 4.29Å; V347-K415 HydrophobicContact CG1-CG 4.06Å; E348-K415 IonicContact OE1-NZ 3.99Å; E348-K415 PolarHBondContact OE1-NZ 3.19Å; E348-K415 IonicContact OE2-NZ 3.84Å; E348-K415 PolarHBondContact OE2-NZ 2.83Å; E351-K415 HydrophobicContact CG-CG 4.4Å; E351-K415 PolarHBondContact OE2-N 2.89Å; M385-K415 HydrophobicContact CE-CG 4.13Å; K388-K415 PolarHBondContact NZ-O 2.97Å; T413-K415 PolarHBondContact OG1-N 3.3Å; K415-D417 PolarHBondContact O-N 3.44Å
416	Q	92.6	Very high	81.1	Confident	85 Å²	85	77.7 Å²	77.7	40%	0.397	44%	0.437	S	S	.	.	P	Polyproline II helix	trans	-64.4	133.5	174.4	-169.9	170.6	19.6	0	0	110.2	H418	Q416-H418 PolarHBondContact O-CD2 3.37Å; Q416-H418 VanDerWaalsContact O-CD2 3.27Å
417	D	91.4	Very high	83.5	Confident	49 Å²	49	75.5 Å²	75.5	26%	0.262	42%	0.421	S	S	.	.	P	Polyproline II helix	trans	-82.9	121.2	-179.2	176.7	23.9	0	0	0	110.7	K415 S419 T422 R426	K415-D417 PolarHBondContact O-N 3.44Å; D417-S419 WeakPolarHBondContact OD1-CB 3.42Å; D417-S419 PolarHBondContact OD1-N 3.49Å; D417-S419 PolarHBondContact OD1-OG 3.37Å; D417-S419 PolarHBondContact OD2-OG 2.9Å; D417-T422 WeakPolarHBondContact OD2-CB 3.44Å; D417-T422 WeakPolarHBondContact OD2-CG2 3.35Å; D417-T422 PolarHBondContact OD2-OG1 3.04Å; D417-R426 WeakPolarHBondContact O-CD 3.49Å; D417-R426 PolarHBondContact O-NE 2.91Å; D417-R426 PolarHBondContact O-NH1 3.25Å; D417-R426 VanDerWaalsContact O-NH1 3.16Å
418	H	90.7	Very high	85.8	Confident	129 Å²	129	71.7 Å²	71.7	60%	0.597	39%	0.393	S	S	*	.			trans	-118.2	11	176.2	-60.4	-72	0	0	0	112.7	Q416 R426	Q416-H418 PolarHBondContact O-CD2 3.37Å; Q416-H418 VanDerWaalsContact O-CD2 3.27Å; H418-R426 PolarHBondContact O-NH2 3.26Å
419	S	90.1	Very high	87.9	Confident	37 Å²	37	68.2 Å²	68.2	26%	0.259	37%	0.372	S	S	.	.			trans	-59.7	150.7	-178.5	69.7	0	0	0	0	112.3	D417 E421 T422 R423 R426	D417-S419 WeakPolarHBondContact OD1-CB 3.42Å; D417-S419 PolarHBondContact OD1-N 3.49Å; D417-S419 PolarHBondContact OD1-OG 3.37Å; D417-S419 PolarHBondContact OD2-OG 2.9Å; S419-E421 VanDerWaalsContact C-N 3.3Å; S419-E421 VanDerWaalsContact CB-OE2 3.27Å; S419-E421 WeakPolarHBondContact CB-OE2 3.31Å; S419-T422 WeakPolarHBondContact OG-CG2 3.43Å; S419-T422 PolarHBondContact OG-OG1 3.11Å; S419-T422 VanDerWaalsContact OG-OG1 3.04Å; S419-R423 PolarHBondContact O-N 3.08Å; S419-R426 PolarHBondContact O-NH2 3.22Å
420	L	88.9	Confident	89.9	Confident	134 Å²	134	69 Å²	69	70%	0.702	35%	0.348	S	S	*	.	S	Bend	trans	-72.6	-32.3	179.6	-71.2	175.4	0	0	0	110.7	T422 R423	L420-T422 VanDerWaalsContact C-N 3.31Å; L420-T422 PolarHBondContact O-N 3.31Å; L420-R423 VanDerWaalsContact O-CB 3.27Å; L420-R423 WeakPolarHBondContact O-CB 3.26Å; L420-R423 PolarHBondContact O-N 2.89Å
421	E	87.4	Confident	91.4	Very high	143 Å²	143	65.4 Å²	65.4	67%	0.668	32%	0.324	S	S	*	.	T	Hydrogen-bonded Turn	trans	-56.8	-44.3	179.1	-64.8	71	-157.2	0	0	110.5	S419 H424	S419-E421 VanDerWaalsContact C-N 3.3Å; S419-E421 VanDerWaalsContact CB-OE2 3.27Å; S419-E421 WeakPolarHBondContact CB-OE2 3.31Å; E421-H424 PolarHBondContact O-CE1 3.32Å; E421-H424 PolarHBondContact O-ND1 3.31Å
422	T	90.4	Very high	91.9	Very high	10 Å²	10	60 Å²	60	6%	0.061	29%	0.289	C	S	.	.	T	Hydrogen-bonded Turn	trans	-93	-1.2	-178.5	70.6	0	0	0	0	113.9	D417 S419 L420 H424 I425 R426 L485	D417-T422 WeakPolarHBondContact OD2-CB 3.44Å; D417-T422 WeakPolarHBondContact OD2-CG2 3.35Å; D417-T422 PolarHBondContact OD2-OG1 3.04Å; S419-T422 WeakPolarHBondContact OG-CG2 3.43Å; S419-T422 PolarHBondContact OG-OG1 3.11Å; S419-T422 VanDerWaalsContact OG-OG1 3.04Å; L420-T422 VanDerWaalsContact C-N 3.31Å; L420-T422 PolarHBondContact O-N 3.31Å; T422-H424 PolarHBondContact O-N 3.45Å; T422-I425 WeakPolarHBondContact O-CG2 3.42Å; T422-I425 PolarHBondContact O-N 3.16Å; T422-R426 WeakPolarHBondContact O-CB 3.36Å; T422-R426 WeakPolarHBondContact O-CG 3.4Å; T422-R426 PolarHBondContact O-N 3.23Å; T422-R426 PolarHBondContact OG1-NE 3.07Å; T422-L485 HydrophobicContact CG2-CD1 3.73Å; T422-L485 HydrophobicContact CG2-CD2 4.31Å
423	R	91.9	Very high	92.1	Very high	162 Å²	162	58 Å²	58	61%	0.611	28%	0.279	S	S	*	.	H	α-helix	trans	-53.5	-42.8	-176.2	-178.6	-178	176.5	-177.4	0.4	112.7	S419 L420 T427	S419-R423 PolarHBondContact O-N 3.08Å; L420-R423 VanDerWaalsContact O-CB 3.27Å; L420-R423 WeakPolarHBondContact O-CB 3.26Å; L420-R423 PolarHBondContact O-N 2.89Å; R423-T427 WeakPolarHBondContact O-CB 3.39Å; R423-T427 PolarHBondContact O-N 3.38Å; R423-T427 PolarHBondContact O-OG1 3.38Å
424	H	90	Very high	92	Very high	97 Å²	97	58.5 Å²	58.5	45%	0.449	28%	0.275	S	S	.	.	H	α-helix	trans	-62.5	-50.5	-179	70.5	-60.2	0	0	0	111.8	E421 T422 T427 L428	E421-H424 PolarHBondContact O-CE1 3.32Å; E421-H424 PolarHBondContact O-ND1 3.31Å; T422-H424 PolarHBondContact O-N 3.45Å; H424-T427 PolarHBondContact O-N 2.76Å; H424-L428 PolarHBondContact O-N 2.99Å; H424-L428 VanDerWaalsContact O-N 3.12Å
425	I	90.8	Very high	91.7	Very high	5 Å²	5	64.8 Å²	64.8	3%	0.026	30%	0.304	C	S	.	.	H	α-helix	trans	-68.2	-39.5	178.9	-169	68.9	0	0	0	111.1	T422 T427 L428 L429 L481 P491 A492 L495	T422-I425 WeakPolarHBondContact O-CG2 3.42Å; T422-I425 PolarHBondContact O-N 3.16Å; I425-T427 VanDerWaalsContact C-N 3.29Å; I425-T427 PolarHBondContact O-N 3.02Å; I425-L428 HydrophobicContact CD1-CD1 4.39Å; I425-L428 HydrophobicContact CD1-CD2 4.32Å; I425-L428 WeakPolarHBondContact O-CB 3.45Å; I425-L428 PolarHBondContact O-N 2.91Å; I425-L428 VanDerWaalsContact O-N 3.09Å; I425-L429 HydrophobicContact CG1-CD1 4.49Å; I425-L429 HydrophobicContact CG1-CG 4.45Å; I425-L429 VanDerWaalsContact O-CG 3.29Å; I425-L429 WeakPolarHBondContact O-CG 3.37Å; I425-L429 PolarHBondContact O-N 3.35Å; I425-L481 HydrophobicContact CG1-CD1 4.11Å; I425-L481 HydrophobicContact CG2-CD1 3.93Å; I425-L481 HydrophobicContact CG2-CD2 3.8Å; I425-P491 HydrophobicContact CG1-CB 4.35Å; I425-A492 HydrophobicContact CD1-CB 4.32Å; I425-L495 HydrophobicContact CD1-CD2 4.27Å
426	R	93.6	Very high	91.4	Very high	52 Å²	52	65 Å²	65	20%	0.196	31%	0.306	C	S	.	.	H	α-helix	trans	-60	-38.9	175	-70.1	-173.4	-66.2	126.2	-1	112.5	D417 H418 S419 T422 L429 W430 L478 L481	D417-R426 WeakPolarHBondContact O-CD 3.49Å; D417-R426 PolarHBondContact O-NE 2.91Å; D417-R426 PolarHBondContact O-NH1 3.25Å; D417-R426 VanDerWaalsContact O-NH1 3.16Å; H418-R426 PolarHBondContact O-NH2 3.26Å; S419-R426 PolarHBondContact O-NH2 3.22Å; T422-R426 WeakPolarHBondContact O-CB 3.36Å; T422-R426 WeakPolarHBondContact O-CG 3.4Å; T422-R426 PolarHBondContact O-N 3.23Å; T422-R426 PolarHBondContact OG1-NE 3.07Å; R426-L429 PolarHBondContact O-N 3.46Å; R426-W430 PolarHBondContact O-N 3.18Å; R426-L478 HydrophobicContact CB-CD2 4.45Å; R426-L478 HydrophobicContact CG-CD2 3.92Å; R426-L481 HydrophobicContact CG-CD2 3.76Å
427	T	92.7	Very high	91.3	Very high	71 Å²	71	61.5 Å²	61.5	44%	0.436	29%	0.29	S	S	.	.	H	α-helix	trans	-65	-40.9	175	-53.6	0	0	0	0	111.4	R423 H424 I425 W430 G431 F514	R423-T427 WeakPolarHBondContact O-CB 3.39Å; R423-T427 PolarHBondContact O-N 3.38Å; R423-T427 PolarHBondContact O-OG1 3.38Å; H424-T427 PolarHBondContact O-N 2.76Å; I425-T427 VanDerWaalsContact C-N 3.29Å; I425-T427 PolarHBondContact O-N 3.02Å; T427-W430 PolarHBondContact O-N 3.4Å; T427-G431 PolarHBondContact O-N 3.22Å; T427-F514 HydrophobicContact CG2-CZ 4.14Å
428	L	91.6	Very high	91.2	Very high	15 Å²	15	66 Å²	66	8%	0.079	31%	0.307	C	S	.	.	H	α-helix	trans	-61.4	-47.1	174.4	-179.5	158.2	0	0	0	111.2	H424 I425 W430 G431 L432 L495 T511 F514	H424-L428 PolarHBondContact O-N 2.99Å; H424-L428 VanDerWaalsContact O-N 3.12Å; I425-L428 HydrophobicContact CD1-CD1 4.39Å; I425-L428 HydrophobicContact CD1-CD2 4.32Å; I425-L428 WeakPolarHBondContact O-CB 3.45Å; I425-L428 PolarHBondContact O-N 2.91Å; I425-L428 VanDerWaalsContact O-N 3.09Å; L428-W430 VanDerWaalsContact C-N 3.33Å; L428-W430 PolarHBondContact O-N 3.12Å; L428-G431 PolarHBondContact O-N 2.88Å; L428-L432 WeakPolarHBondContact O-CB 3.22Å; L428-L432 PolarHBondContact O-N 3.43Å; L428-L495 HydrophobicContact CD2-CD2 3.44Å; L428-L495 VanDerWaalsContact CD2-CD2 3.44Å; L428-T511 HydrophobicContact CD2-CG2 3.88Å; L428-F514 HydrophobicContact CB-CD1 3.85Å; L428-F514 HydrophobicContact CB-CE1 3.81Å; L428-F514 HydrophobicContact CB-CG 4.29Å; L428-F514 HydrophobicContact CB-CZ 4.26Å; L428-F514 HydrophobicContact CD1-CB 3.72Å; L428-F514 HydrophobicContact CD1-CD1 3.66Å; L428-F514 HydrophobicContact CD1-CE1 4.46Å; L428-F514 HydrophobicContact CD1-CG 3.83Å; L428-F514 HydrophobicContact CG-CB 4.37Å; L428-F514 HydrophobicContact CG-CD1 4.08Å; L428-F514 HydrophobicContact CG-CG 4.14Å
429	L	93.6	Very high	90.9	Very high	0 Å²	0	61.9 Å²	61.9	0%	0	30%	0.296	C	S	.	.	H	α-helix	trans	-62.8	-39.5	179	-63.6	175.6	0	0	0	111.8	I425 R426 L432 A433 L477 L478 W480 L481 L495	I425-L429 HydrophobicContact CG1-CD1 4.49Å; I425-L429 HydrophobicContact CG1-CG 4.45Å; I425-L429 VanDerWaalsContact O-CG 3.29Å; I425-L429 WeakPolarHBondContact O-CG 3.37Å; I425-L429 PolarHBondContact O-N 3.35Å; R426-L429 PolarHBondContact O-N 3.46Å; L429-L432 PolarHBondContact O-N 3.45Å; L429-A433 WeakPolarHBondContact O-CB 3.41Å; L429-A433 PolarHBondContact O-N 2.86Å; L429-L477 HydrophobicContact CB-CB 4.11Å; L429-L477 HydrophobicContact CB-CD1 4.35Å; L429-L477 HydrophobicContact CD1-CB 4.25Å; L429-L477 HydrophobicContact CD2-CB 4.11Å; L429-L477 HydrophobicContact CD2-CD2 3.88Å; L429-L477 HydrophobicContact CD2-CG 4.41Å; L429-L477 HydrophobicContact CG-CB 4.36Å; L429-L477 WeakPolarHBondContact O-CD1 3.38Å; L429-L478 HydrophobicContact CD1-CD2 4.42Å; L429-W480 HydrophobicContact CD2-CZ3 4.48Å; L429-L481 HydrophobicContact CD1-CB 3.87Å; L429-L481 HydrophobicContact CD1-CD2 3.78Å; L429-L481 HydrophobicContact CD1-CG 4.3Å; L429-L495 HydrophobicContact CD2-CD1 4.24Å; L429-L495 HydrophobicContact CD2-CD2 3.69Å
430	W	94.6	Very high	90.5	Very high	105 Å²	105	65.8 Å²	65.8	40%	0.398	31%	0.314	S	S	.	.	H	α-helix	trans	-60.1	-48.3	172.9	-176.1	87.1	0	0	0	111.5	R426 T427 L428 L432 A433 Y434 H435 H474	R426-W430 PolarHBondContact O-N 3.18Å; T427-W430 PolarHBondContact O-N 3.4Å; L428-W430 VanDerWaalsContact C-N 3.33Å; L428-W430 PolarHBondContact O-N 3.12Å; W430-L432 VanDerWaalsContact C-N 3.29Å; W430-L432 PolarHBondContact O-N 2.9Å; W430-A433 PolarHBondContact O-N 3.12Å; W430-Y434 AromaticContact CD1-CD2 3.69Å; W430-Y434 AromaticContact CD1-CE2 3.75Å; W430-Y434 HydrophobicContact CD2-CD2 4.17Å; W430-Y434 HydrophobicContact CD2-CG 4.45Å; W430-Y434 AromaticContact CE2-CD2 3.68Å; W430-Y434 AromaticContact CE2-CG 3.83Å; W430-Y434 HydrophobicContact CG-CD2 4.17Å; W430-Y434 HydrophobicContact CZ2-CD1 4.11Å; W430-Y434 HydrophobicContact CZ2-CD2 4.22Å; W430-Y434 AromaticContact CZ2-CG 3.9Å; W430-Y434 HydrophobicContact CZ2-CG 3.9Å; W430-Y434 AromaticContact NE1-CD2 3.36Å; W430-Y434 AromaticContact NE1-CE2 3.35Å; W430-Y434 AromaticContact NE1-CG 3.95Å; W430-Y434 AromaticContact NE1-CZ 3.94Å; W430-Y434 WeakPolarHBondContact O-CB 3.36Å; W430-Y434 PolarHBondContact O-N 3.37Å; W430-H435 AromaticContact CH2-NE2 3.62Å; W430-H435 AromaticContact CZ3-CD2 4Å; W430-H435 AromaticContact CZ3-NE2 3.31Å; W430-H435 VanDerWaalsContact CZ3-NE2 3.31Å; W430-H435 WeakPolarHBondContact CZ3-NE2 3.49Å; W430-H474 AromaticContact CD1-NE2 3.93Å
431	G	93	Very high	90.6	Very high	13 Å²	13	61.1 Å²	61.1	13%	0.134	29%	0.288	C	S	.	.	H	α-helix	trans	-62.8	-35.2	177.7	0	0	0	0	0	113.1	T427 L428 H435	T427-G431 PolarHBondContact O-N 3.22Å; L428-G431 PolarHBondContact O-N 2.88Å; G431-H435 WeakPolarHBondContact O-CB 3.5Å; G431-H435 PolarHBondContact O-N 2.95Å; G431-H435 VanDerWaalsContact O-N 3.13Å
432	L	91.3	Very high	90.9	Very high	1 Å²	1	54.4 Å²	54.4	1%	0.005	26%	0.257	C	S	.	.	H	α-helix	trans	-64.8	-47.2	174.7	-172.8	134.7	0	0	0	111.1	L428 L429 W430 Q436 L437 L477 L499 L507 T511	L428-L432 WeakPolarHBondContact O-CB 3.22Å; L428-L432 PolarHBondContact O-N 3.43Å; L429-L432 PolarHBondContact O-N 3.45Å; W430-L432 VanDerWaalsContact C-N 3.29Å; W430-L432 PolarHBondContact O-N 2.9Å; L432-Q436 WeakPolarHBondContact O-CB 3.33Å; L432-Q436 PolarHBondContact O-N 3.44Å; L432-Q436 VanDerWaalsContact O-N 3.16Å; L432-L437 HydrophobicContact CD2-CD1 3.74Å; L432-L437 HydrophobicContact CD2-CD2 4.26Å; L432-L437 HydrophobicContact CD2-CG 3.82Å; L432-L437 PolarHBondContact O-N 2.97Å; L432-L477 HydrophobicContact CD2-CD1 3.55Å; L432-L477 HydrophobicContact CD2-CD2 3.92Å; L432-L477 HydrophobicContact CD2-CG 4.38Å; L432-L499 HydrophobicContact CD1-CD1 3.92Å; L432-L507 HydrophobicContact CD1-CD1 3.9Å; L432-L507 HydrophobicContact CD1-CD2 3.81Å; L432-L507 HydrophobicContact CD1-CG 3.65Å; L432-L507 HydrophobicContact CD2-CD2 4.19Å; L432-L507 HydrophobicContact CG-CD1 4.08Å; L432-L507 HydrophobicContact CG-CD2 4Å; L432-L507 HydrophobicContact CG-CG 4.2Å; L432-T511 HydrophobicContact CD1-CG2 3.77Å
433	A	93.3	Very high	91.1	Very high	0 Å²	0	55.2 Å²	55.2	0%	0	26%	0.26	C	S	.	.	H	α-helix	trans	-66.9	-46.2	179.3	0	0	0	0	0	113.7	L429 W430 H474 L477	L429-A433 WeakPolarHBondContact O-CB 3.41Å; L429-A433 PolarHBondContact O-N 2.86Å; W430-A433 PolarHBondContact O-N 3.12Å; A433-H474 HydrophobicContact CB-CB 3.76Å; A433-L477 HydrophobicContact CB-CD1 3.92Å
434	Y	93.3	Very high	91.2	Very high	61 Å²	61	54.3 Å²	54.3	24%	0.239	26%	0.257	C	S	.	.	H	α-helix	trans	-85.6	-21.6	-171	-88.1	-98.7	0	0	0	114.9	W430 R470 E471 H474	W430-Y434 AromaticContact CD1-CD2 3.69Å; W430-Y434 AromaticContact CD1-CE2 3.75Å; W430-Y434 HydrophobicContact CD2-CD2 4.17Å; W430-Y434 HydrophobicContact CD2-CG 4.45Å; W430-Y434 AromaticContact CE2-CD2 3.68Å; W430-Y434 AromaticContact CE2-CG 3.83Å; W430-Y434 HydrophobicContact CG-CD2 4.17Å; W430-Y434 HydrophobicContact CZ2-CD1 4.11Å; W430-Y434 HydrophobicContact CZ2-CD2 4.22Å; W430-Y434 AromaticContact CZ2-CG 3.9Å; W430-Y434 HydrophobicContact CZ2-CG 3.9Å; W430-Y434 AromaticContact NE1-CD2 3.36Å; W430-Y434 AromaticContact NE1-CE2 3.35Å; W430-Y434 AromaticContact NE1-CG 3.95Å; W430-Y434 AromaticContact NE1-CZ 3.94Å; W430-Y434 WeakPolarHBondContact O-CB 3.36Å; W430-Y434 PolarHBondContact O-N 3.37Å; Y434-R470 HydrophobicContact CD1-CB 4.08Å; Y434-R470 HydrophobicContact CD2-CB 4.34Å; Y434-R470 HydrophobicContact CE1-CB 4.08Å; Y434-R470 HydrophobicContact CE2-CB 4.34Å; Y434-R470 HydrophobicContact CG-CB 4.21Å; Y434-R470 PolarHBondContact O-NH1 3.35Å; Y434-E471 PolarHBondContact OH-OE2 3.09Å; Y434-H474 HydrophobicContact CE2-CB 4.26Å
435	H	90.1	Very high	91.3	Very high	133 Å²	133	49.8 Å²	49.8	62%	0.616	24%	0.236	S	C	*	.	H	α-helix	trans	-124.1	-14.1	-173.1	-56.3	-51.5	0	0	0	114.6	W430 G431	W430-H435 AromaticContact CH2-NE2 3.62Å; W430-H435 AromaticContact CZ3-CD2 4Å; W430-H435 AromaticContact CZ3-NE2 3.31Å; W430-H435 VanDerWaalsContact CZ3-NE2 3.31Å; W430-H435 WeakPolarHBondContact CZ3-NE2 3.49Å; G431-H435 WeakPolarHBondContact O-CB 3.5Å; G431-H435 PolarHBondContact O-N 2.95Å; G431-H435 VanDerWaalsContact O-N 3.13Å
436	Q	89	Confident	91.5	Very high	63 Å²	63	49.6 Å²	49.6	29%	0.294	24%	0.235	S	C	.	.	T	Hydrogen-bonded Turn	trans	-125.5	-37.1	-169	-49.2	-171	35	0	0	114	L432 L507	L432-Q436 WeakPolarHBondContact O-CB 3.33Å; L432-Q436 PolarHBondContact O-N 3.44Å; L432-Q436 VanDerWaalsContact O-N 3.16Å; Q436-L507 HydrophobicContact CB-CD1 3.44Å; Q436-L507 VanDerWaalsContact CB-CD1 3.44Å; Q436-L507 HydrophobicContact CG-CD1 4.23Å
437	L	89.4	Confident	91.5	Very high	12 Å²	12	53 Å²	53	6%	0.063	25%	0.248	C	C	.	.			trans	-73.4	142.2	174.6	-71.3	179.1	0	0	0	111.6	L432 E441 W442 F469 L477 L507	L432-L437 HydrophobicContact CD2-CD1 3.74Å; L432-L437 HydrophobicContact CD2-CD2 4.26Å; L432-L437 HydrophobicContact CD2-CG 3.82Å; L432-L437 PolarHBondContact O-N 2.97Å; L437-E441 HydrophobicContact CD2-CB 3.96Å; L437-W442 HydrophobicContact CD1-CB 4.01Å; L437-F469 WeakPolarHBondContact O-CE2 3.5Å; L437-L477 HydrophobicContact CD1-CD1 4.4Å; L437-L507 HydrophobicContact CD2-CD2 3.83Å
438	K	89.3	Confident	91.6	Very high	142 Å²	142	51.4 Å²	51.4	62%	0.617	24%	0.24	S	C	*	.			trans	-95	167.2	168.1	-56	177.6	-171.3	169.3	0	111.4	N440 E441	K438-N440 VanDerWaalsContact C-N 3.28Å; K438-N440 PolarHBondContact O-N 3.46Å; K438-E441 HydrophobicContact CB-CG 3.95Å; K438-E441 WeakPolarHBondContact CD-OE1 3.46Å; K438-E441 PolarHBondContact N-OE2 3.38Å; K438-E441 PolarHBondContact O-N 3.1Å
439	A	84.8	Confident	91.6	Very high	44 Å²	44	51.1 Å²	51.1	36%	0.364	24%	0.238	S	C	.	.	T	Hydrogen-bonded Turn	trans	-46.7	-40.7	-173.1	0	0	0	0	0	116.3	Q443 F469	A439-Q443 PolarHBondContact O-OE1 3.17Å; A439-F469 VanDerWaalsContact CA-CG 3.49Å; A439-F469 HydrophobicContact CB-CD1 3.98Å; A439-F469 HydrophobicContact CB-CE1 4.29Å; A439-F469 HydrophobicContact CB-CG 4.1Å
440	N	81.8	Confident	91.5	Very high	119 Å²	119	57.7 Å²	57.7	64%	0.636	27%	0.273	S	S	*	.	T	Hydrogen-bonded Turn	trans	-103.7	1.9	-176.7	-60.1	-17.8	0	0	0	113.5	K438 Q443	K438-N440 VanDerWaalsContact C-N 3.28Å; K438-N440 PolarHBondContact O-N 3.46Å; N440-Q443 VanDerWaalsContact CA-OE1 3.28Å; N440-Q443 PolarHBondContact O-OE1 3.03Å
441	E	91.3	Very high	91.6	Very high	35 Å²	35	53.1 Å²	53.1	16%	0.164	26%	0.256	C	S	.	.	H	α-helix	trans	-82.1	-30.9	-175	-71	179	167.6	0	0	111.8	L437 K438 R444 L445 F504	L437-E441 HydrophobicContact CD2-CB 3.96Å; K438-E441 HydrophobicContact CB-CG 3.95Å; K438-E441 WeakPolarHBondContact CD-OE1 3.46Å; K438-E441 PolarHBondContact N-OE2 3.38Å; K438-E441 PolarHBondContact O-N 3.1Å; E441-R444 PolarHBondContact O-N 2.88Å; E441-L445 WeakPolarHBondContact O-CB 3.35Å; E441-L445 PolarHBondContact O-N 3.34Å; E441-F504 HydrophobicContact CB-CE1 3.92Å; E441-F504 HydrophobicContact CB-CZ 4.11Å; E441-F504 HydrophobicContact CG-CE1 3.88Å; E441-F504 HydrophobicContact CG-CZ 4.37Å
442	W	93.3	Very high	91.7	Very high	3 Å²	3	55.5 Å²	55.5	1%	0.011	27%	0.268	C	S	.	.	H	α-helix	trans	-69.5	-36.7	-179	81.5	-91.4	0	0	0	112.5	L437 R444 L445 A446 I456 I459 E460 H472 A476	L437-W442 HydrophobicContact CD1-CB 4.01Å; W442-R444 VanDerWaalsContact C-N 3.33Å; W442-R444 PolarHBondContact O-N 2.98Å; W442-L445 PolarHBondContact O-N 2.92Å; W442-A446 HydrophobicContact CE3-CB 4.41Å; W442-A446 HydrophobicContact CZ3-CB 4.48Å; W442-A446 WeakPolarHBondContact O-CB 3.44Å; W442-A446 PolarHBondContact O-N 2.84Å; W442-I456 HydrophobicContact CH2-CG2 3.69Å; W442-I456 HydrophobicContact CZ2-CG2 4.4Å; W442-I456 HydrophobicContact CZ3-CG2 4.19Å; W442-I459 HydrophobicContact CH2-CB 4.4Å; W442-I459 HydrophobicContact CH2-CG2 4.1Å; W442-I459 HydrophobicContact CZ3-CG2 4.28Å; W442-E460 HydrophobicContact CH2-CG 3.77Å; W442-E460 HydrophobicContact CZ2-CG 3.5Å; W442-E460 VanDerWaalsContact CZ2-CG 3.5Å; W442-E460 WeakPolarHBondContact CZ2-OE1 3.35Å; W442-H472 HydrophobicContact CD2-CB 3.97Å; W442-H472 HydrophobicContact CE3-CB 4.31Å; W442-H472 HydrophobicContact CH2-CB 3.83Å; W442-H472 HydrophobicContact CZ2-CB 3.44Å; W442-H472 VanDerWaalsContact CZ2-CB 3.44Å; W442-H472 AromaticContact CZ2-CG 3.96Å; W442-H472 AromaticContact CZ2-ND1 3.97Å; W442-H472 HydrophobicContact CZ3-CB 4.24Å; W442-A476 HydrophobicContact CE3-CB 4.1Å; W442-A476 HydrophobicContact CZ3-CB 4.31Å
443	Q	94.5	Very high	91.9	Very high	26 Å²	26	59.1 Å²	59.1	12%	0.121	29%	0.287	C	S	.	.	H	α-helix	trans	-68.4	-35	175.2	-58.5	92.1	-22.1	0	0	111.5	A439 N440 L445 A446 R447 I456 E460	A439-Q443 PolarHBondContact O-OE1 3.17Å; N440-Q443 VanDerWaalsContact CA-OE1 3.28Å; N440-Q443 PolarHBondContact O-OE1 3.03Å; Q443-L445 VanDerWaalsContact C-N 3.32Å; Q443-A446 PolarHBondContact O-N 2.85Å; Q443-R447 WeakPolarHBondContact O-CB 3.31Å; Q443-R447 WeakPolarHBondContact O-CG 3.48Å; Q443-R447 PolarHBondContact O-N 3.3Å; Q443-I456 HydrophobicContact CB-CG2 4.42Å; Q443-I456 HydrophobicContact CG-CG2 3.86Å; Q443-E460 PolarHBondContact NE2-OE1 3.36Å
444	R	93.3	Very high	92	Very high	143 Å²	143	63.9 Å²	63.9	54%	0.54	31%	0.313	S	S	.	.	H	α-helix	trans	-62.4	-44	174.2	-72.8	177.4	61.2	-162.4	-4.8	110.5	E441 W442 R447 S448 F504	E441-R444 PolarHBondContact O-N 2.88Å; W442-R444 VanDerWaalsContact C-N 3.33Å; W442-R444 PolarHBondContact O-N 2.98Å; R444-R447 PolarHBondContact O-N 2.92Å; R444-S448 PolarHBondContact O-N 3.25Å; R444-S448 PolarHBondContact O-OG 2.93Å; R444-F504 HydrophobicContact CB-CZ 4.39Å
445	L	93	Very high	92.2	Very high	3 Å²	3	61.3 Å²	61.3	2%	0.016	30%	0.303	C	S	.	.	H	α-helix	trans	-66.7	-41.7	177.2	-170.8	63.4	0	0	0	112.4	E441 W442 Q443 R447 S448 W449 L477 L499 A502 F504	E441-L445 WeakPolarHBondContact O-CB 3.35Å; E441-L445 PolarHBondContact O-N 3.34Å; W442-L445 PolarHBondContact O-N 2.92Å; Q443-L445 VanDerWaalsContact C-N 3.32Å; L445-R447 VanDerWaalsContact C-N 3.33Å; L445-R447 PolarHBondContact O-N 3.42Å; L445-S448 WeakPolarHBondContact CA-OG 3.41Å; L445-S448 PolarHBondContact O-N 3.32Å; L445-S448 PolarHBondContact O-OG 3.27Å; L445-W449 HydrophobicContact CD1-CD2 4.41Å; L445-W449 HydrophobicContact CD1-CH2 3.9Å; L445-W449 HydrophobicContact CD1-CZ2 3.48Å; L445-W449 VanDerWaalsContact CD1-CZ2 3.48Å; L445-W449 HydrophobicContact CD1-CZ3 4.49Å; L445-W449 HydrophobicContact CD2-CH2 3.4Å; L445-W449 VanDerWaalsContact CD2-CH2 3.4Å; L445-W449 HydrophobicContact CD2-CZ2 3.9Å; L445-W449 HydrophobicContact CD2-CZ3 3.81Å; L445-W449 HydrophobicContact CG-CD2 4.18Å; L445-W449 HydrophobicContact CG-CE3 4.04Å; L445-W449 HydrophobicContact CG-CH2 3.49Å; L445-W449 VanDerWaalsContact CG-CH2 3.49Å; L445-W449 HydrophobicContact CG-CZ2 3.61Å; L445-W449 HydrophobicContact CG-CZ3 3.7Å; L445-W449 PolarHBondContact O-N 3.05Å; L445-L477 HydrophobicContact CD2-CD2 4.13Å; L445-L499 HydrophobicContact CD1-CD2 3.8Å; L445-L499 HydrophobicContact CD2-CD2 4.11Å; L445-A502 HydrophobicContact CD1-CB 3.76Å; L445-F504 HydrophobicContact CB-CE2 4.38Å; L445-F504 HydrophobicContact CD1-CD2 4.23Å; L445-F504 HydrophobicContact CD1-CE2 4.22Å
446	A	94.5	Very high	92.5	Very high	1 Å²	1	55.1 Å²	55.1	1%	0.008	27%	0.274	C	S	.	.	H	α-helix	trans	-61.1	-42.7	175.1	0	0	0	0	0	111.3	W442 Q443 W449 N450 F451 I456	W442-A446 HydrophobicContact CE3-CB 4.41Å; W442-A446 HydrophobicContact CZ3-CB 4.48Å; W442-A446 WeakPolarHBondContact O-CB 3.44Å; W442-A446 PolarHBondContact O-N 2.84Å; Q443-A446 PolarHBondContact O-N 2.85Å; A446-W449 CarbonylContact O-C 3.38Å; A446-W449 WeakPolarHBondContact O-CA 2.97Å; A446-W449 PolarHBondContact O-N 2.87Å; A446-N450 PolarHBondContact O-N 2.83Å; A446-F451 HydrophobicContact CB-CB 3.92Å; A446-F451 HydrophobicContact CB-CD1 4.43Å; A446-F451 HydrophobicContact CB-CD2 4.09Å; A446-F451 HydrophobicContact CB-CG 3.9Å; A446-F451 WeakPolarHBondContact O-CB 3.42Å; A446-F451 VanDerWaalsContact O-CD2 3.26Å; A446-F451 WeakPolarHBondContact O-CD2 3.25Å; A446-F451 PolarHBondContact O-N 3.28Å; A446-I456 HydrophobicContact CB-CD1 4.11Å; A446-I456 HydrophobicContact CB-CG1 4.17Å
447	R	94.7	Very high	92.8	Very high	122 Å²	122	58.4 Å²	58.4	46%	0.46	28%	0.284	S	S	.	.	H	α-helix	trans	-65.6	-37.1	176.4	-73.5	-174.8	-175.4	97.1	2.2	113.3	Q443 R444 L445 W449 N450 D453 I456	Q443-R447 WeakPolarHBondContact O-CB 3.31Å; Q443-R447 WeakPolarHBondContact O-CG 3.48Å; Q443-R447 PolarHBondContact O-N 3.3Å; R444-R447 PolarHBondContact O-N 2.92Å; L445-R447 VanDerWaalsContact C-N 3.33Å; L445-R447 PolarHBondContact O-N 3.42Å; R447-W449 PolarHBondContact O-N 2.65Å; R447-N450 PolarHBondContact O-N 2.99Å; R447-N450 VanDerWaalsContact O-N 3.09Å; R447-D453 IonicContact CZ-OD1 3.9Å; R447-D453 IonicContact NE-OD1 2.91Å; R447-D453 PolarHBondContact NE-OD1 3.22Å; R447-D453 VanDerWaalsContact NE-OD1 3.11Å; R447-D453 IonicContact NH2-OD1 2.7Å; R447-D453 PolarHBondContact NH2-OD1 3.14Å; R447-I456 HydrophobicContact CG-CD1 3.68Å
448	S	93.2	Very high	93.1	Very high	38 Å²	38	58 Å²	58	27%	0.266	28%	0.283	S	S	.	.	H	α-helix	trans	-64.2	-21.5	172.7	54.7	0	0	0	0	112.7	R444 L445 A502	R444-S448 PolarHBondContact O-N 3.25Å; R444-S448 PolarHBondContact O-OG 2.93Å; L445-S448 WeakPolarHBondContact CA-OG 3.41Å; L445-S448 PolarHBondContact O-N 3.32Å; L445-S448 PolarHBondContact O-OG 3.27Å; S448-A502 VanDerWaalsContact OG-CB 3.28Å; S448-A502 WeakPolarHBondContact OG-CB 2.93Å
449	W	92	Very high	93.3	Very high	10 Å²	10	51.3 Å²	51.3	4%	0.038	25%	0.253	C	S	.	.	T	Hydrogen-bonded Turn	trans	-97.3	20.7	174.6	-59.4	-26.5	0	0	0	113.5	R391 L445 A446 R447 F451 L477 W480 L495 E498	R391-W449 VanDerWaalsContact CZ-O 3.27Å; R391-W449 PolarHBondContact NH1-O 3.34Å; R391-W449 PolarHBondContact NH2-O 2.97Å; L445-W449 HydrophobicContact CD1-CD2 4.41Å; L445-W449 HydrophobicContact CD1-CH2 3.9Å; L445-W449 HydrophobicContact CD1-CZ2 3.48Å; L445-W449 VanDerWaalsContact CD1-CZ2 3.48Å; L445-W449 HydrophobicContact CD1-CZ3 4.49Å; L445-W449 HydrophobicContact CD2-CH2 3.4Å; L445-W449 VanDerWaalsContact CD2-CH2 3.4Å; L445-W449 HydrophobicContact CD2-CZ2 3.9Å; L445-W449 HydrophobicContact CD2-CZ3 3.81Å; L445-W449 HydrophobicContact CG-CD2 4.18Å; L445-W449 HydrophobicContact CG-CE3 4.04Å; L445-W449 HydrophobicContact CG-CH2 3.49Å; L445-W449 VanDerWaalsContact CG-CH2 3.49Å; L445-W449 HydrophobicContact CG-CZ2 3.61Å; L445-W449 HydrophobicContact CG-CZ3 3.7Å; L445-W449 PolarHBondContact O-N 3.05Å; A446-W449 CarbonylContact O-C 3.38Å; A446-W449 WeakPolarHBondContact O-CA 2.97Å; A446-W449 PolarHBondContact O-N 2.87Å; R447-W449 PolarHBondContact O-N 2.65Å; W449-F451 VanDerWaalsContact C-N 3.25Å; W449-F451 HydrophobicContact CB-CD2 4.04Å; W449-F451 HydrophobicContact CB-CE2 4.17Å; W449-F451 HydrophobicContact CE3-CE2 4.49Å; W449-F451 PolarHBondContact O-N 2.97Å; W449-L477 HydrophobicContact CH2-CD2 3.41Å; W449-L477 VanDerWaalsContact CH2-CD2 3.41Å; W449-L477 HydrophobicContact CZ3-CD2 3.63Å; W449-L477 HydrophobicContact CZ3-CG 4.45Å; W449-W480 HydrophobicContact CD2-CB 4.43Å; W449-W480 AromaticContact CD2-CD1 3.35Å; W449-W480 AromaticContact CD2-CG 3.91Å; W449-W480 HydrophobicContact CD2-CG 3.91Å; W449-W480 AromaticContact CD2-NE1 3.83Å; W449-W480 AromaticContact CE2-CD1 3.72Å; W449-W480 AromaticContact CE2-NE1 3.7Å; W449-W480 HydrophobicContact CE3-CB 3.72Å; W449-W480 AromaticContact CE3-CD1 3.55Å; W449-W480 AromaticContact CE3-CG 3.63Å; W449-W480 HydrophobicContact CE3-CG 3.63Å; W449-W480 AromaticContact CG-CD1 3.63Å; W449-W480 HydrophobicContact CH2-CD2 4.13Å; W449-W480 HydrophobicContact CH2-CG 4.07Å; W449-W480 HydrophobicContact CZ2-CD2 4.32Å; W449-W480 HydrophobicContact CZ2-CG 4.34Å; W449-W480 HydrophobicContact CZ3-CB 3.78Å; W449-W480 HydrophobicContact CZ3-CD2 4.25Å; W449-W480 AromaticContact CZ3-CG 3.72Å; W449-W480 HydrophobicContact CZ3-CG 3.72Å; W449-W480 AromaticContact NE1-NE1 3.9Å; W449-L495 HydrophobicContact CH2-CD1 4.19Å; W449-L495 HydrophobicContact CZ2-CD1 4.16Å; W449-E498 HydrophobicContact CZ2-CB 4.41Å; W449-E498 PolarHBondContact NE1-OE2 3.31Å; W449-E498 VanDerWaalsContact NE1-OE2 3.09Å
450	N	92.4	Very high	93.7	Very high	138 Å²	138	52.4 Å²	52.4	74%	0.738	25%	0.251	S	S	*	.	T	Hydrogen-bonded Turn	trans	58.1	30.9	178.7	-59.3	-24.1	0	0	0	114.2	A446 R447	A446-N450 PolarHBondContact O-N 2.83Å; R447-N450 PolarHBondContact O-N 2.99Å; R447-N450 VanDerWaalsContact O-N 3.09Å
451	F	96.2	Very high	94.2	Very high	8 Å²	8	49.6 Å²	49.6	4%	0.035	25%	0.245	C	C	.	.			trans	-68	133.7	164.1	-78.2	-116.3	0	0	0	109.3	I387 R391 A446 W449 Q455 I456 I459 A476 I479	I387-F451 HydrophobicContact CG2-CD1 4.31Å; I387-F451 HydrophobicContact CG2-CE1 3.96Å; R391-F451 VanDerWaalsContact NH1-CE2 3.27Å; A446-F451 HydrophobicContact CB-CB 3.92Å; A446-F451 HydrophobicContact CB-CD1 4.43Å; A446-F451 HydrophobicContact CB-CD2 4.09Å; A446-F451 HydrophobicContact CB-CG 3.9Å; A446-F451 WeakPolarHBondContact O-CB 3.42Å; A446-F451 VanDerWaalsContact O-CD2 3.26Å; A446-F451 WeakPolarHBondContact O-CD2 3.25Å; A446-F451 PolarHBondContact O-N 3.28Å; W449-F451 VanDerWaalsContact C-N 3.25Å; W449-F451 HydrophobicContact CB-CD2 4.04Å; W449-F451 HydrophobicContact CB-CE2 4.17Å; W449-F451 HydrophobicContact CE3-CE2 4.49Å; W449-F451 PolarHBondContact O-N 2.97Å; F451-Q455 HydrophobicContact CD1-CB 4.24Å; F451-I456 HydrophobicContact CB-CD1 4.27Å; F451-I456 HydrophobicContact CB-CG1 4.01Å; F451-I459 HydrophobicContact CD1-CD1 4.3Å; F451-I459 HydrophobicContact CE1-CD1 4.07Å; F451-A476 HydrophobicContact CE1-CB 4.46Å; F451-A476 HydrophobicContact CZ-CB 4.49Å; F451-I479 HydrophobicContact CE1-CB 4.2Å; F451-I479 HydrophobicContact CE1-CD1 4.17Å; F451-I479 HydrophobicContact CE1-CG2 3.81Å; F451-I479 HydrophobicContact CZ-CB 3.89Å; F451-I479 HydrophobicContact CZ-CG2 3.55Å
452	T	95.9	Very high	93.8	Very high	64 Å²	64	48.5 Å²	48.5	39%	0.393	24%	0.24	S	C	.	.			trans	-74.5	156.9	174.7	73.9	0	0	0	0	110.6	D454 Q455 I456	T452-D454 PolarHBondContact O-N 2.9Å; T452-Q455 PolarHBondContact O-N 3.31Å; T452-Q455 VanDerWaalsContact O-N 3.11Å; T452-Q455 VanDerWaalsContact OG1-CG 3.27Å; T452-Q455 WeakPolarHBondContact OG1-CG 3.38Å; T452-Q455 PolarHBondContact OG1-N 3.31Å; T452-I456 WeakPolarHBondContact O-CG1 3.47Å; T452-I456 PolarHBondContact O-N 3.45Å
453	D	95.7	Very high	93.3	Very high	77 Å²	77	53.1 Å²	53.1	41%	0.412	26%	0.257	S	S	.	.	H	α-helix	trans	-62.1	-27.9	175.9	-75.4	-38	0	0	0	112.2	R447 R457	R447-D453 IonicContact CZ-OD1 3.9Å; R447-D453 IonicContact NE-OD1 2.91Å; R447-D453 PolarHBondContact NE-OD1 3.22Å; R447-D453 VanDerWaalsContact NE-OD1 3.11Å; R447-D453 IonicContact NH2-OD1 2.7Å; R447-D453 PolarHBondContact NH2-OD1 3.14Å; D453-R457 WeakPolarHBondContact O-CB 3.39Å; D453-R457 VanDerWaalsContact O-CG 3.29Å; D453-R457 WeakPolarHBondContact O-CG 3.24Å; D453-R457 PolarHBondContact O-N 2.9Å
454	D	94.9	Very high	92.6	Very high	100 Å²	100	57.6 Å²	57.6	54%	0.535	29%	0.291	S	S	.	.	H	α-helix	trans	-66.9	-41.7	172.9	-76.7	-44	0	0	0	112.4	T452 R457 A458	T452-D454 PolarHBondContact O-N 2.9Å; D454-R457 PolarHBondContact O-N 3.11Å; D454-R457 IonicContact OD1-CZ 3.46Å; D454-R457 IonicContact OD1-NE 3.52Å; D454-R457 IonicContact OD1-NH2 2.64Å; D454-R457 PolarHBondContact OD1-NH2 3.32Å; D454-R457 IonicContact OD2-NH2 3.9Å; D454-A458 WeakPolarHBondContact O-CB 3.42Å; D454-A458 PolarHBondContact O-N 2.86Å
455	Q	96.8	Very high	92.2	Very high	7 Å²	7	53.1 Å²	53.1	3%	0.033	29%	0.289	C	S	.	.	H	α-helix	trans	-65.1	-43.5	175.9	-67.1	170.6	-14.1	0	0	111.2	L371 I387 E390 F451 T452 A458 I459	L371-Q455 HydrophobicContact CD2-CG 4.12Å; I387-Q455 HydrophobicContact CD1-CB 4.08Å; I387-Q455 HydrophobicContact CD1-CG 4.46Å; I387-Q455 HydrophobicContact CG1-CB 4.2Å; I387-Q455 HydrophobicContact CG1-CG 4.03Å; I387-Q455 HydrophobicContact CG2-CB 4.24Å; I387-Q455 HydrophobicContact CG2-CG 4.02Å; E390-Q455 PolarHBondContact OE2-NE2 2.96Å; F451-Q455 HydrophobicContact CD1-CB 4.24Å; T452-Q455 PolarHBondContact O-N 3.31Å; T452-Q455 VanDerWaalsContact O-N 3.11Å; T452-Q455 VanDerWaalsContact OG1-CG 3.27Å; T452-Q455 WeakPolarHBondContact OG1-CG 3.38Å; T452-Q455 PolarHBondContact OG1-N 3.31Å; Q455-A458 PolarHBondContact O-N 2.85Å; Q455-I459 WeakPolarHBondContact O-CG1 3.39Å; Q455-I459 PolarHBondContact O-N 2.67Å
456	I	96	Very high	91.6	Very high	3 Å²	3	60.3 Å²	60.3	2%	0.015	33%	0.328	C	S	.	.	H	α-helix	trans	-60.5	-48.7	175.9	-66.7	173	0	0	0	110.2	W442 Q443 A446 R447 F451 T452 A458 I459 E460	W442-I456 HydrophobicContact CH2-CG2 3.69Å; W442-I456 HydrophobicContact CZ2-CG2 4.4Å; W442-I456 HydrophobicContact CZ3-CG2 4.19Å; Q443-I456 HydrophobicContact CB-CG2 4.42Å; Q443-I456 HydrophobicContact CG-CG2 3.86Å; A446-I456 HydrophobicContact CB-CD1 4.11Å; A446-I456 HydrophobicContact CB-CG1 4.17Å; R447-I456 HydrophobicContact CG-CD1 3.68Å; F451-I456 HydrophobicContact CB-CD1 4.27Å; F451-I456 HydrophobicContact CB-CG1 4.01Å; T452-I456 WeakPolarHBondContact O-CG1 3.47Å; T452-I456 PolarHBondContact O-N 3.45Å; I456-A458 VanDerWaalsContact C-N 3.3Å; I456-A458 PolarHBondContact O-N 3.44Å; I456-I459 PolarHBondContact O-N 3.46Å; I456-E460 WeakPolarHBondContact O-CG 3.47Å; I456-E460 PolarHBondContact O-N 3.47Å
457	R	95.1	Very high	91.1	Very high	131 Å²	131	65.2 Å²	65.2	49%	0.494	35%	0.351	S	S	.	.	H	α-helix	trans	-59.3	-40	175.5	-79	-172.1	-69.4	-93.7	6.7	112.4	D453 D454 I459 E460 A461	D453-R457 WeakPolarHBondContact O-CB 3.39Å; D453-R457 VanDerWaalsContact O-CG 3.29Å; D453-R457 WeakPolarHBondContact O-CG 3.24Å; D453-R457 PolarHBondContact O-N 2.9Å; D454-R457 PolarHBondContact O-N 3.11Å; D454-R457 IonicContact OD1-CZ 3.46Å; D454-R457 IonicContact OD1-NE 3.52Å; D454-R457 IonicContact OD1-NH2 2.64Å; D454-R457 PolarHBondContact OD1-NH2 3.32Å; D454-R457 IonicContact OD2-NH2 3.9Å; R457-I459 VanDerWaalsContact C-N 3.34Å; R457-E460 PolarHBondContact O-N 2.93Å; R457-A461 WeakPolarHBondContact O-CB 3.38Å; R457-A461 PolarHBondContact O-N 3.34Å
458	A	95.8	Very high	90.9	Very high	5 Å²	5	60.7 Å²	60.7	4%	0.041	34%	0.337	C	S	.	.	H	α-helix	trans	-64.7	-39.1	179.2	0	0	0	0	0	112	L371 S375 V383 D454 Q455 I456	L371-A458 HydrophobicContact CD1-CB 3.83Å; L371-A458 HydrophobicContact CD2-CB 4.23Å; L371-A458 HydrophobicContact CG-CB 3.95Å; S375-A458 PolarHBondContact OG-O 3.25Å; V383-A458 HydrophobicContact CG1-CB 3.99Å; D454-A458 WeakPolarHBondContact O-CB 3.42Å; D454-A458 PolarHBondContact O-N 2.86Å; Q455-A458 PolarHBondContact O-N 2.85Å; I456-A458 VanDerWaalsContact C-N 3.3Å; I456-A458 PolarHBondContact O-N 3.44Å
459	I	95.3	Very high	90.9	Very high	0 Å²	0	60.1 Å²	60.1	0%	0	33%	0.33	C	S	.	.	H	α-helix	trans	-64.6	-46.2	173.5	-67.5	168.6	0	0	0	110.5	I387 W442 F451 Q455 I456 R457 A461 Q462 H472 R475 A476 I479	I387-I459 HydrophobicContact CD1-CD1 3.93Å; I387-I459 HydrophobicContact CD1-CG1 3.68Å; W442-I459 HydrophobicContact CH2-CB 4.4Å; W442-I459 HydrophobicContact CH2-CG2 4.1Å; W442-I459 HydrophobicContact CZ3-CG2 4.28Å; F451-I459 HydrophobicContact CD1-CD1 4.3Å; F451-I459 HydrophobicContact CE1-CD1 4.07Å; Q455-I459 WeakPolarHBondContact O-CG1 3.39Å; Q455-I459 PolarHBondContact O-N 2.67Å; I456-I459 PolarHBondContact O-N 3.46Å; R457-I459 VanDerWaalsContact C-N 3.34Å; I459-A461 VanDerWaalsContact C-N 3.34Å; I459-A461 PolarHBondContact O-N 3.49Å; I459-Q462 PolarHBondContact O-N 3.47Å; I459-H472 HydrophobicContact CG2-CB 3.79Å; I459-H472 PolarHBondContact O-CD2 2.93Å; I459-R475 PolarHBondContact O-NH1 3.26Å; I459-A476 HydrophobicContact CD1-CB 4.3Å; I459-I479 HydrophobicContact CD1-CD1 3.93Å; I459-I479 HydrophobicContact CG1-CD1 4.47Å
460	E	93.1	Very high	91	Very high	67 Å²	67	63.7 Å²	63.7	31%	0.313	34%	0.344	S	S	.	.	H	α-helix	trans	-62	-40.4	-178.7	-76.9	178.3	160.1	0	0	112.5	W442 Q443 I456 R457 Q462 W463 H472	W442-E460 HydrophobicContact CH2-CG 3.77Å; W442-E460 HydrophobicContact CZ2-CG 3.5Å; W442-E460 VanDerWaalsContact CZ2-CG 3.5Å; W442-E460 WeakPolarHBondContact CZ2-OE1 3.35Å; Q443-E460 PolarHBondContact NE2-OE1 3.36Å; I456-E460 WeakPolarHBondContact O-CG 3.47Å; I456-E460 PolarHBondContact O-N 3.47Å; R457-E460 PolarHBondContact O-N 2.93Å; E460-Q462 PolarHBondContact O-N 3.27Å; E460-W463 PolarHBondContact O-N 3.27Å; E460-W463 VanDerWaalsContact O-O 3.08Å; E460-H472 WeakPolarHBondContact CA-NE2 3.23Å; E460-H472 PolarHBondContact O-NE2 3.3Å
461	A	90.5	Very high	91	Very high	61 Å²	61	59.1 Å²	59.1	50%	0.504	32%	0.318	S	S	.	.	T	Hydrogen-bonded Turn	trans	-61.3	-17.5	-176.3	0	0	0	0	0	114.7	S375 R457 I459	S375-A461 VanDerWaalsContact OG-CB 3.24Å; S375-A461 WeakPolarHBondContact OG-CB 3.35Å; R457-A461 WeakPolarHBondContact O-CB 3.38Å; R457-A461 PolarHBondContact O-N 3.34Å; I459-A461 VanDerWaalsContact C-N 3.34Å; I459-A461 PolarHBondContact O-N 3.49Å
462	Q	83.7	Confident	90.9	Very high	12 Å²	12	59.1 Å²	59.1	6%	0.056	32%	0.318	C	S	.	.	T	Hydrogen-bonded Turn	trans	-83.1	-20.5	-176.5	-57	-53.4	-87.2	0	0	113.9	S375 N378 S380 V383 I459 E460	S375-Q462 PolarHBondContact O-NE2 3.36Å; N378-Q462 VanDerWaalsContact CA-OE1 3.27Å; N378-Q462 PolarHBondContact OD1-O 3.42Å; S380-Q462 VanDerWaalsContact N-OE1 3.12Å; V383-Q462 HydrophobicContact CG2-CG 4.47Å; I459-Q462 PolarHBondContact O-N 3.47Å; E460-Q462 PolarHBondContact O-N 3.27Å
463	W	83.8	Confident	90.9	Very high	99 Å²	99	56.1 Å²	56.1	38%	0.375	30%	0.3	S	S	.	.			trans	-140.6	130.5	-179.5	-77.9	-88.3	0	0	0	111.7	E460 E471 H472 R475	E460-W463 PolarHBondContact O-N 3.27Å; E460-W463 VanDerWaalsContact O-O 3.08Å; W463-E471 HydrophobicContact CD2-CG 3.75Å; W463-E471 HydrophobicContact CE3-CG 3.85Å; W463-E471 HydrophobicContact CG-CG 4.34Å; W463-E471 HydrophobicContact CH2-CG 4.11Å; W463-E471 HydrophobicContact CZ2-CG 3.99Å; W463-E471 HydrophobicContact CZ3-CG 4.07Å; W463-H472 PolarHBondContact O-CE1 3.47Å; W463-H472 PolarHBondContact O-NE2 3.06Å; W463-R475 VanDerWaalsContact CZ3-NH1 3.34Å
464	S	79.8	Confident	90.9	Very high	121 Å²	121	53.7 Å²	53.7	85%	0.846	29%	0.286	S	S	*	.			trans	-110	142	174.6	59.8	0	0	0	0	111.6
465	G	84.3	Confident	90.9	Very high	48 Å²	48	49.2 Å²	49.2	50%	0.495	26%	0.262	S	S	.	.	S	Bend	trans	134.7	165.3	172.9	0	0	0	0	0	113.5	E467 S468	G465-E467 PolarHBondContact O-N 2.66Å; G465-S468 VanDerWaalsContact O-CB 3.3Å; G465-S468 WeakPolarHBondContact O-CB 3.3Å; G465-S468 PolarHBondContact O-N 3.3Å; G465-S468 VanDerWaalsContact O-N 3.12Å; G465-S468 PolarHBondContact O-OG 2.87Å
466	N	79.3	Confident	90.9	Very high	155 Å²	155	49 Å²	49	83%	0.829	26%	0.262	S	S	*	.	T	Hydrogen-bonded Turn	trans	-64.7	-23.2	-172	-67.9	-4.5	0	0	0	114.1	F469	N466-F469 WeakPolarHBondContact O-CD1 3.37Å
467	E	85.1	Confident	90.9	Very high	104 Å²	104	49 Å²	49	49%	0.486	26%	0.261	S	S	.	.	T	Hydrogen-bonded Turn	trans	-105.7	6.1	178.9	-59.4	-59.6	150.9	0	0	113.3	G465 F469 R470	G465-E467 PolarHBondContact O-N 2.66Å; E467-F469 PolarHBondContact O-N 2.87Å; E467-F469 WeakPolarHBondContact OE2-CE1 3.48Å; E467-R470 PolarHBondContact O-N 3.1Å; E467-R470 IonicContact OE1-NH2 3.8Å; E467-R470 IonicContact OE2-CZ 2.83Å; E467-R470 IonicContact OE2-NE 2.67Å; E467-R470 PolarHBondContact OE2-NE 2.87Å; E467-R470 IonicContact OE2-NH2 3.71Å; E467-R470 PolarHBondContact OE2-NH2 2.72Å
468	S	90.6	Very high	90.9	Very high	26 Å²	26	44 Å²	44	18%	0.182	25%	0.245	C	C	.	.	H	α-helix	trans	-61.4	-28.7	-178.5	58.6	0	0	0	0	113.1	G465 R470 E471 H472	G465-S468 VanDerWaalsContact O-CB 3.3Å; G465-S468 WeakPolarHBondContact O-CB 3.3Å; G465-S468 PolarHBondContact O-N 3.3Å; G465-S468 VanDerWaalsContact O-N 3.12Å; G465-S468 PolarHBondContact O-OG 2.87Å; S468-R470 PolarHBondContact O-N 2.83Å; S468-R470 VanDerWaalsContact O-N 3.09Å; S468-E471 PolarHBondContact O-N 2.92Å; S468-H472 VanDerWaalsContact CB-CE1 3.45Å; S468-H472 WeakPolarHBondContact CB-CE1 3.36Å; S468-H472 VanDerWaalsContact O-CG 3.3Å; S468-H472 PolarHBondContact O-N 2.87Å; S468-H472 PolarHBondContact O-ND1 3.2Å; S468-H472 PolarHBondContact OG-CE1 2.7Å; S468-H472 VanDerWaalsContact OG-CE1 3.27Å
469	F	91.9	Very high	91	Very high	27 Å²	27	43.9 Å²	43.9	12%	0.118	24%	0.243	C	C	.	.	H	α-helix	trans	-56.7	-27.2	178.1	76	-93.6	0	0	0	113.7	L437 A439 N466 E467 G473	L437-F469 WeakPolarHBondContact O-CE2 3.5Å; A439-F469 VanDerWaalsContact CA-CG 3.49Å; A439-F469 HydrophobicContact CB-CD1 3.98Å; A439-F469 HydrophobicContact CB-CE1 4.29Å; A439-F469 HydrophobicContact CB-CG 4.1Å; N466-F469 WeakPolarHBondContact O-CD1 3.37Å; E467-F469 PolarHBondContact O-N 2.87Å; E467-F469 WeakPolarHBondContact OE2-CE1 3.48Å; F469-G473 PolarHBondContact O-N 3.07Å
470	R	94.3	Very high	91	Very high	84 Å²	84	44.2 Å²	44.2	32%	0.317	24%	0.244	S	C	.	.	H	α-helix	trans	-68	-42.7	176.9	-60.1	-178.7	-167	-165.2	3.6	110.6	Y434 E467 S468 H474	Y434-R470 HydrophobicContact CD1-CB 4.08Å; Y434-R470 HydrophobicContact CD2-CB 4.34Å; Y434-R470 HydrophobicContact CE1-CB 4.08Å; Y434-R470 HydrophobicContact CE2-CB 4.34Å; Y434-R470 HydrophobicContact CG-CB 4.21Å; Y434-R470 PolarHBondContact O-NH1 3.35Å; E467-R470 PolarHBondContact O-N 3.1Å; E467-R470 IonicContact OE1-NH2 3.8Å; E467-R470 IonicContact OE2-CZ 2.83Å; E467-R470 IonicContact OE2-NE 2.67Å; E467-R470 PolarHBondContact OE2-NE 2.87Å; E467-R470 IonicContact OE2-NH2 3.71Å; E467-R470 PolarHBondContact OE2-NH2 2.72Å; S468-R470 PolarHBondContact O-N 2.83Å; S468-R470 VanDerWaalsContact O-N 3.09Å; R470-H474 WeakPolarHBondContact O-CB 3.4Å; R470-H474 PolarHBondContact O-N 2.99Å
471	E	93.8	Very high	91	Very high	42 Å²	42	41.2 Å²	41.2	20%	0.196	23%	0.23	C	C	.	.	H	α-helix	trans	-70.8	-43.8	176.5	-174.8	56.9	-146.1	0	0	110.9	Y434 W463 S468 G473 H474 R475	Y434-E471 PolarHBondContact OH-OE2 3.09Å; W463-E471 HydrophobicContact CD2-CG 3.75Å; W463-E471 HydrophobicContact CE3-CG 3.85Å; W463-E471 HydrophobicContact CG-CG 4.34Å; W463-E471 HydrophobicContact CH2-CG 4.11Å; W463-E471 HydrophobicContact CZ2-CG 3.99Å; W463-E471 HydrophobicContact CZ3-CG 4.07Å; S468-E471 PolarHBondContact O-N 2.92Å; E471-G473 VanDerWaalsContact C-N 3.33Å; E471-G473 PolarHBondContact O-N 3.19Å; E471-H474 PolarHBondContact O-N 2.93Å; E471-R475 WeakPolarHBondContact O-CG 3.36Å; E471-R475 PolarHBondContact O-N 3.37Å; E471-R475 WeakPolarHBondContact OE1-CG 3.22Å
472	H	94.6	Very high	91.2	Very high	8 Å²	8	39.1 Å²	39.1	4%	0.037	21%	0.21	C	C	.	.	H	α-helix	trans	-57.8	-46.9	175.4	-54.7	147.1	0	0	0	111.6	W442 I459 E460 W463 S468 R475 A476	W442-H472 HydrophobicContact CD2-CB 3.97Å; W442-H472 HydrophobicContact CE3-CB 4.31Å; W442-H472 HydrophobicContact CH2-CB 3.83Å; W442-H472 HydrophobicContact CZ2-CB 3.44Å; W442-H472 VanDerWaalsContact CZ2-CB 3.44Å; W442-H472 AromaticContact CZ2-CG 3.96Å; W442-H472 AromaticContact CZ2-ND1 3.97Å; W442-H472 HydrophobicContact CZ3-CB 4.24Å; I459-H472 HydrophobicContact CG2-CB 3.79Å; I459-H472 PolarHBondContact O-CD2 2.93Å; E460-H472 WeakPolarHBondContact CA-NE2 3.23Å; E460-H472 PolarHBondContact O-NE2 3.3Å; W463-H472 PolarHBondContact O-CE1 3.47Å; W463-H472 PolarHBondContact O-NE2 3.06Å; S468-H472 VanDerWaalsContact CB-CE1 3.45Å; S468-H472 WeakPolarHBondContact CB-CE1 3.36Å; S468-H472 VanDerWaalsContact O-CG 3.3Å; S468-H472 PolarHBondContact O-N 2.87Å; S468-H472 PolarHBondContact O-ND1 3.2Å; S468-H472 PolarHBondContact OG-CE1 2.7Å; S468-H472 VanDerWaalsContact OG-CE1 3.27Å; H472-R475 PolarHBondContact O-N 3.46Å; H472-A476 WeakPolarHBondContact O-CB 3.46Å; H472-A476 PolarHBondContact O-N 3.39Å
473	G	95.1	Very high	91.4	Very high	1 Å²	1	39.6 Å²	39.6	1%	0.01	22%	0.218	C	C	.	.	H	α-helix	trans	-62.9	-42.6	175.8	0	0	0	0	0	112.5	F469 E471 R475 A476 L477	F469-G473 PolarHBondContact O-N 3.07Å; E471-G473 VanDerWaalsContact C-N 3.33Å; E471-G473 PolarHBondContact O-N 3.19Å; G473-R475 PolarHBondContact O-N 3.36Å; G473-A476 PolarHBondContact O-N 2.94Å; G473-L477 WeakPolarHBondContact O-CB 3.42Å; G473-L477 WeakPolarHBondContact O-CD1 3.1Å; G473-L477 WeakPolarHBondContact O-CG 3.45Å; G473-L477 PolarHBondContact O-N 3.45Å
474	H	95.8	Very high	91.7	Very high	27 Å²	27	35.1 Å²	35.1	13%	0.125	20%	0.202	C	C	.	.	H	α-helix	trans	-60.8	-46.3	176.9	-175.7	45.8	0	0	0	112.1	W430 A433 Y434 R470 E471 L477 L478	W430-H474 AromaticContact CD1-NE2 3.93Å; A433-H474 HydrophobicContact CB-CB 3.76Å; Y434-H474 HydrophobicContact CE2-CB 4.26Å; R470-H474 WeakPolarHBondContact O-CB 3.4Å; R470-H474 PolarHBondContact O-N 2.99Å; E471-H474 PolarHBondContact O-N 2.93Å; H474-L477 WeakPolarHBondContact O-CB 3.47Å; H474-L477 PolarHBondContact O-N 2.97Å; H474-L478 WeakPolarHBondContact O-CG 3.24Å; H474-L478 PolarHBondContact O-N 3.41Å
475	R	95.7	Very high	92	Very high	5 Å²	5	32.2 Å²	32.2	2%	0.019	18%	0.176	C	C	.	.	H	α-helix	trans	-63.6	-45.3	177.5	-71.1	178	63.8	-136.8	3.2	112.3	S380 D384 I459 W463 E471 H472 G473 L477 L478 I479	S380-R475 PolarHBondContact O-NH2 3.26Å; D384-R475 IonicContact OD1-CZ 3.91Å; D384-R475 IonicContact OD1-NE 3.11Å; D384-R475 PolarHBondContact OD1-NE 3.06Å; D384-R475 IonicContact OD1-NH2 2.81Å; D384-R475 PolarHBondContact OD1-NH2 3.18Å; D384-R475 IonicContact OD2-CZ 3.11Å; D384-R475 IonicContact OD2-NE 3.45Å; D384-R475 PolarHBondContact OD2-NE 3.13Å; D384-R475 IonicContact OD2-NH2 2.78Å; D384-R475 PolarHBondContact OD2-NH2 3.13Å; I459-R475 PolarHBondContact O-NH1 3.26Å; W463-R475 VanDerWaalsContact CZ3-NH1 3.34Å; E471-R475 WeakPolarHBondContact O-CG 3.36Å; E471-R475 PolarHBondContact O-N 3.37Å; E471-R475 WeakPolarHBondContact OE1-CG 3.22Å; H472-R475 PolarHBondContact O-N 3.46Å; G473-R475 PolarHBondContact O-N 3.36Å; R475-L477 VanDerWaalsContact C-N 3.27Å; R475-L477 PolarHBondContact O-N 2.91Å; R475-L478 PolarHBondContact O-N 3.01Å; R475-L478 VanDerWaalsContact O-N 3.1Å; R475-I479 WeakPolarHBondContact O-CG1 3.34Å; R475-I479 PolarHBondContact O-N 3.45Å
476	A	95.9	Very high	91.9	Very high	4 Å²	4	32.3 Å²	32.3	3%	0.033	17%	0.165	C	C	.	.	H	α-helix	trans	-57.7	-40.9	175.5	0	0	0	0	0	112	W442 F451 I459 H472 G473 I479 W480	W442-A476 HydrophobicContact CE3-CB 4.1Å; W442-A476 HydrophobicContact CZ3-CB 4.31Å; F451-A476 HydrophobicContact CE1-CB 4.46Å; F451-A476 HydrophobicContact CZ-CB 4.49Å; I459-A476 HydrophobicContact CD1-CB 4.3Å; H472-A476 WeakPolarHBondContact O-CB 3.46Å; H472-A476 PolarHBondContact O-N 3.39Å; G473-A476 PolarHBondContact O-N 2.94Å; A476-I479 PolarHBondContact O-N 3.04Å; A476-W480 WeakPolarHBondContact O-CB 3.15Å; A476-W480 PolarHBondContact O-N 2.94Å
477	L	95.6	Very high	91.8	Very high	2 Å²	2	27.6 Å²	27.6	1%	0.01	14%	0.141	C	C	.	.	H	α-helix	trans	-64.9	-38.8	175.1	-71	162.1	0	0	0	112.9	L429 L432 A433 L437 L445 W449 G473 H474 R475 W480 L481	L429-L477 HydrophobicContact CB-CB 4.11Å; L429-L477 HydrophobicContact CB-CD1 4.35Å; L429-L477 HydrophobicContact CD1-CB 4.25Å; L429-L477 HydrophobicContact CD2-CB 4.11Å; L429-L477 HydrophobicContact CD2-CD2 3.88Å; L429-L477 HydrophobicContact CD2-CG 4.41Å; L429-L477 HydrophobicContact CG-CB 4.36Å; L429-L477 WeakPolarHBondContact O-CD1 3.38Å; L432-L477 HydrophobicContact CD2-CD1 3.55Å; L432-L477 HydrophobicContact CD2-CD2 3.92Å; L432-L477 HydrophobicContact CD2-CG 4.38Å; A433-L477 HydrophobicContact CB-CD1 3.92Å; L437-L477 HydrophobicContact CD1-CD1 4.4Å; L445-L477 HydrophobicContact CD2-CD2 4.13Å; W449-L477 HydrophobicContact CH2-CD2 3.41Å; W449-L477 VanDerWaalsContact CH2-CD2 3.41Å; W449-L477 HydrophobicContact CZ3-CD2 3.63Å; W449-L477 HydrophobicContact CZ3-CG 4.45Å; G473-L477 WeakPolarHBondContact O-CB 3.42Å; G473-L477 WeakPolarHBondContact O-CD1 3.1Å; G473-L477 WeakPolarHBondContact O-CG 3.45Å; G473-L477 PolarHBondContact O-N 3.45Å; H474-L477 WeakPolarHBondContact O-CB 3.47Å; H474-L477 PolarHBondContact O-N 2.97Å; R475-L477 VanDerWaalsContact C-N 3.27Å; R475-L477 PolarHBondContact O-N 2.91Å; L477-W480 PolarHBondContact O-N 2.8Å; L477-L481 WeakPolarHBondContact O-CB 3.31Å; L477-L481 PolarHBondContact O-N 2.79Å
478	L	96.2	Very high	90.9	Very high	27 Å²	27	29.4 Å²	29.4	14%	0.141	15%	0.15	C	C	.	.	H	α-helix	trans	-69.8	-37	176.4	-69.3	179.6	0	0	0	112.4	R426 L429 H474 R475 L481 H482	R426-L478 HydrophobicContact CB-CD2 4.45Å; R426-L478 HydrophobicContact CG-CD2 3.92Å; L429-L478 HydrophobicContact CD1-CD2 4.42Å; H474-L478 WeakPolarHBondContact O-CG 3.24Å; H474-L478 PolarHBondContact O-N 3.41Å; R475-L478 PolarHBondContact O-N 3.01Å; R475-L478 VanDerWaalsContact O-N 3.1Å; L478-L481 PolarHBondContact O-N 3.16Å; L478-H482 PolarHBondContact O-N 3.04Å; L478-H482 VanDerWaalsContact O-N 3.08Å
479	I	96.6	Very high	90	Very high	1 Å²	1	29.9 Å²	29.9	1%	0.005	16%	0.155	C	C	.	.	H	α-helix	trans	-64.6	-44.7	172.4	-66.7	163.9	0	0	0	110.1	D384 I387 K388 F451 I459 R475 A476 H482 G483	D384-I479 HydrophobicContact CB-CD1 4.36Å; D384-I479 HydrophobicContact CB-CG1 4.25Å; D384-I479 WeakPolarHBondContact OD1-CD1 3.46Å; I387-I479 HydrophobicContact CB-CD1 4.12Å; I387-I479 HydrophobicContact CB-CG2 4.35Å; I387-I479 HydrophobicContact CD1-CD1 3.99Å; I387-I479 HydrophobicContact CG2-CD1 4.11Å; I387-I479 HydrophobicContact CG2-CG2 3.69Å; K388-I479 HydrophobicContact CG-CB 4.41Å; K388-I479 HydrophobicContact CG-CG1 4.3Å; K388-I479 HydrophobicContact CG-CG2 4.08Å; F451-I479 HydrophobicContact CE1-CB 4.2Å; F451-I479 HydrophobicContact CE1-CD1 4.17Å; F451-I479 HydrophobicContact CE1-CG2 3.81Å; F451-I479 HydrophobicContact CZ-CB 3.89Å; F451-I479 HydrophobicContact CZ-CG2 3.55Å; I459-I479 HydrophobicContact CD1-CD1 3.93Å; I459-I479 HydrophobicContact CG1-CD1 4.47Å; R475-I479 WeakPolarHBondContact O-CG1 3.34Å; R475-I479 PolarHBondContact O-N 3.45Å; A476-I479 PolarHBondContact O-N 3.04Å; I479-H482 WeakPolarHBondContact O-CB 3.29Å; I479-H482 PolarHBondContact O-N 3Å; I479-G483 PolarHBondContact O-N 3.39Å
480	W	95	Very high	89.6	Confident	8 Å²	8	32.2 Å²	32.2	3%	0.03	17%	0.169	C	C	.	.	H	α-helix	trans	-58.5	-47.5	174.4	169.8	87	0	0	0	111.4	L429 W449 A476 L477 H482 G483 T484 H494 L495 E498	L429-W480 HydrophobicContact CD2-CZ3 4.48Å; W449-W480 HydrophobicContact CD2-CB 4.43Å; W449-W480 AromaticContact CD2-CD1 3.35Å; W449-W480 AromaticContact CD2-CG 3.91Å; W449-W480 HydrophobicContact CD2-CG 3.91Å; W449-W480 AromaticContact CD2-NE1 3.83Å; W449-W480 AromaticContact CE2-CD1 3.72Å; W449-W480 AromaticContact CE2-NE1 3.7Å; W449-W480 HydrophobicContact CE3-CB 3.72Å; W449-W480 AromaticContact CE3-CD1 3.55Å; W449-W480 AromaticContact CE3-CG 3.63Å; W449-W480 HydrophobicContact CE3-CG 3.63Å; W449-W480 AromaticContact CG-CD1 3.63Å; W449-W480 HydrophobicContact CH2-CD2 4.13Å; W449-W480 HydrophobicContact CH2-CG 4.07Å; W449-W480 HydrophobicContact CZ2-CD2 4.32Å; W449-W480 HydrophobicContact CZ2-CG 4.34Å; W449-W480 HydrophobicContact CZ3-CB 3.78Å; W449-W480 HydrophobicContact CZ3-CD2 4.25Å; W449-W480 AromaticContact CZ3-CG 3.72Å; W449-W480 HydrophobicContact CZ3-CG 3.72Å; W449-W480 AromaticContact NE1-NE1 3.9Å; A476-W480 WeakPolarHBondContact O-CB 3.15Å; A476-W480 PolarHBondContact O-N 2.94Å; L477-W480 PolarHBondContact O-N 2.8Å; W480-H482 VanDerWaalsContact C-N 3.28Å; W480-H482 PolarHBondContact O-N 3.45Å; W480-G483 PolarHBondContact O-N 3.28Å; W480-G483 VanDerWaalsContact O-N 3.09Å; W480-T484 HydrophobicContact CH2-CG2 4.3Å; W480-T484 HydrophobicContact CZ2-CG2 4.38Å; W480-T484 WeakPolarHBondContact CZ2-OG1 3.36Å; W480-T484 PolarHBondContact O-N 3.22Å; W480-T484 PolarHBondContact O-OG1 3.27Å; W480-T484 VanDerWaalsContact O-OG1 3.1Å; W480-H494 AromaticContact CZ2-CD2 3.62Å; W480-L495 HydrophobicContact CE3-CD1 4.36Å; W480-L495 HydrophobicContact CH2-CB 3.53Å; W480-L495 HydrophobicContact CH2-CD1 3.84Å; W480-L495 HydrophobicContact CH2-CG 4.23Å; W480-L495 HydrophobicContact CZ2-CB 4.23Å; W480-L495 HydrophobicContact CZ2-CD1 4.25Å; W480-L495 HydrophobicContact CZ3-CB 4.13Å; W480-L495 HydrophobicContact CZ3-CD1 3.88Å; W480-L495 HydrophobicContact CZ3-CG 4.45Å; W480-E498 HydrophobicContact CZ2-CG 4.48Å
481	L	93.9	Very high	89.1	Confident	4 Å²	4	29.3 Å²	29.3	2%	0.021	16%	0.161	C	C	.	.	H	α-helix	trans	-57.7	-41.5	179	175.8	63.4	0	0	0	111.8	I425 R426 L429 L477 L478 T484 L485 P491	I425-L481 HydrophobicContact CG1-CD1 4.11Å; I425-L481 HydrophobicContact CG2-CD1 3.93Å; I425-L481 HydrophobicContact CG2-CD2 3.8Å; R426-L481 HydrophobicContact CG-CD2 3.76Å; L429-L481 HydrophobicContact CD1-CB 3.87Å; L429-L481 HydrophobicContact CD1-CD2 3.78Å; L429-L481 HydrophobicContact CD1-CG 4.3Å; L477-L481 WeakPolarHBondContact O-CB 3.31Å; L477-L481 PolarHBondContact O-N 2.79Å; L478-L481 PolarHBondContact O-N 3.16Å; L481-T484 PolarHBondContact O-N 2.91Å; L481-L485 HydrophobicContact CD1-CD1 4.07Å; L481-L485 HydrophobicContact CD1-CG 4.07Å; L481-L485 HydrophobicContact CG-CD1 3.88Å; L481-L485 HydrophobicContact CG-CG 4.34Å; L481-L485 WeakPolarHBondContact O-CB 3.12Å; L481-L485 VanDerWaalsContact O-CG 3.27Å; L481-L485 WeakPolarHBondContact O-CG 3.31Å; L481-L485 PolarHBondContact O-N 2.93Å; L481-P491 HydrophobicContact CD1-CB 3.67Å; L481-P491 HydrophobicContact CD1-CG 4.18Å
482	H	93.8	Very high	88.7	Confident	17 Å²	17	28.3 Å²	28.3	8%	0.079	16%	0.16	C	C	.	.	H	α-helix	trans	-57.3	-48.9	175.4	171.9	-87.7	0	0	0	111.4	K388 T413 F414 L478 I479 W480 T484 L485 M486	K388-H482 HydrophobicContact CD-CB 3.98Å; K388-H482 HydrophobicContact CG-CB 3.98Å; T413-H482 PolarHBondContact O-CD2 3.27Å; T413-H482 PolarHBondContact O-NE2 2.91Å; F414-H482 AromaticContact CD1-CE1 3.84Å; L478-H482 PolarHBondContact O-N 3.04Å; L478-H482 VanDerWaalsContact O-N 3.08Å; I479-H482 WeakPolarHBondContact O-CB 3.29Å; I479-H482 PolarHBondContact O-N 3Å; W480-H482 VanDerWaalsContact C-N 3.28Å; W480-H482 PolarHBondContact O-N 3.45Å; H482-T484 PolarHBondContact O-N 3.36Å; H482-L485 PolarHBondContact O-N 3.45Å; H482-M486 VanDerWaalsContact O-CG 3.31Å; H482-M486 WeakPolarHBondContact O-CG 3.45Å; H482-M486 PolarHBondContact O-N 3.46Å; H482-M486 VanDerWaalsContact O-N 3.07Å
483	G	89.3	Confident	88.2	Confident	22 Å²	22	33.9 Å²	33.9	23%	0.227	18%	0.184	C	C	.	.	H	α-helix	trans	-57.1	-48.9	175.7	0	0	0	0	0	112.3	I479 W480 L485 M486 T487	I479-G483 PolarHBondContact O-N 3.39Å; W480-G483 PolarHBondContact O-N 3.28Å; W480-G483 VanDerWaalsContact O-N 3.09Å; G483-L485 VanDerWaalsContact C-N 3.3Å; G483-L485 PolarHBondContact O-N 3.04Å; G483-M486 PolarHBondContact O-N 3.35Å; G483-M486 VanDerWaalsContact O-N 3.11Å; G483-T487 PolarHBondContact O-N 3.19Å; G483-T487 VanDerWaalsContact O-N 3.11Å
484	T	88.9	Confident	87.9	Confident	4 Å²	4	36.3 Å²	36.3	3%	0.025	20%	0.195	C	C	.	.	H	α-helix	trans	-59.5	-38.3	179.3	-53.3	0	0	0	0	113.2	W480 L481 H482 T487 Q488 A489 P491 H494	W480-T484 HydrophobicContact CH2-CG2 4.3Å; W480-T484 HydrophobicContact CZ2-CG2 4.38Å; W480-T484 WeakPolarHBondContact CZ2-OG1 3.36Å; W480-T484 PolarHBondContact O-N 3.22Å; W480-T484 PolarHBondContact O-OG1 3.27Å; W480-T484 VanDerWaalsContact O-OG1 3.1Å; L481-T484 PolarHBondContact O-N 2.91Å; H482-T484 PolarHBondContact O-N 3.36Å; T484-T487 PolarHBondContact O-N 3.43Å; T484-T487 PolarHBondContact O-OG1 3.36Å; T484-T487 VanDerWaalsContact O-OG1 3.12Å; T484-Q488 PolarHBondContact O-N 3.39Å; T484-A489 HydrophobicContact CG2-CB 3.93Å; T484-A489 PolarHBondContact O-N 3.34Å; T484-P491 HydrophobicContact CG2-CB 4.07Å; T484-P491 HydrophobicContact CG2-CG 4.34Å; T484-H494 HydrophobicContact CG2-CB 4.12Å
485	L	87.4	Confident	87.6	Confident	60 Å²	60	35 Å²	35	31%	0.314	19%	0.189	S	C	.	.	H	α-helix	trans	-69.5	-36.6	176.9	-71.5	168.6	0	0	0	111.8	T422 L481 H482 G483 T487 Q488 P491	T422-L485 HydrophobicContact CG2-CD1 3.73Å; T422-L485 HydrophobicContact CG2-CD2 4.31Å; L481-L485 HydrophobicContact CD1-CD1 4.07Å; L481-L485 HydrophobicContact CD1-CG 4.07Å; L481-L485 HydrophobicContact CG-CD1 3.88Å; L481-L485 HydrophobicContact CG-CG 4.34Å; L481-L485 WeakPolarHBondContact O-CB 3.12Å; L481-L485 VanDerWaalsContact O-CG 3.27Å; L481-L485 WeakPolarHBondContact O-CG 3.31Å; L481-L485 PolarHBondContact O-N 2.93Å; H482-L485 PolarHBondContact O-N 3.45Å; G483-L485 VanDerWaalsContact C-N 3.3Å; G483-L485 PolarHBondContact O-N 3.04Å; L485-T487 VanDerWaalsContact C-N 3.3Å; L485-T487 PolarHBondContact O-N 2.99Å; L485-Q488 PolarHBondContact O-N 3.44Å; L485-P491 HydrophobicContact CD2-CG 3.67Å; L485-P491 HydrophobicContact CG-CG 4.38Å
486	M	81.6	Confident	87.3	Confident	51 Å²	51	38.2 Å²	38.2	25%	0.251	20%	0.202	S	C	.	.	H	α-helix	trans	-68.5	-29.8	177.2	-65.2	-64.5	129.7	0	0	112.1	Y392 L412 H482 G483 Q488	Y392-M486 HydrophobicContact CD2-CB 4.22Å; Y392-M486 HydrophobicContact CD2-CG 4.26Å; Y392-M486 HydrophobicContact CE2-CB 4.45Å; L412-M486 HydrophobicContact CD1-SD 4.11Å; H482-M486 VanDerWaalsContact O-CG 3.31Å; H482-M486 WeakPolarHBondContact O-CG 3.45Å; H482-M486 PolarHBondContact O-N 3.46Å; H482-M486 VanDerWaalsContact O-N 3.07Å; G483-M486 PolarHBondContact O-N 3.35Å; G483-M486 VanDerWaalsContact O-N 3.11Å; M486-Q488 VanDerWaalsContact C-N 3.31Å
487	T	76.2	Confident	86.9	Confident	56 Å²	56	42.3 Å²	42.3	34%	0.344	22%	0.22	S	C	.	.	T	Hydrogen-bonded Turn	trans	-88.1	9.9	175.4	66.2	0	0	0	0	114	W395 G483 T484 L485 A489	W395-T487 HydrophobicContact CD2-CG2 4.04Å; W395-T487 HydrophobicContact CG-CG2 4.27Å; W395-T487 HydrophobicContact CZ2-CG2 4.04Å; G483-T487 PolarHBondContact O-N 3.19Å; G483-T487 VanDerWaalsContact O-N 3.11Å; T484-T487 PolarHBondContact O-N 3.43Å; T484-T487 PolarHBondContact O-OG1 3.36Å; T484-T487 VanDerWaalsContact O-OG1 3.12Å; L485-T487 VanDerWaalsContact C-N 3.3Å; L485-T487 PolarHBondContact O-N 2.99Å; T487-A489 PolarHBondContact O-N 3.1Å; T487-A489 VanDerWaalsContact O-N 3.08Å
488	Q	67.3	Low	86.6	Confident	142 Å²	142	44.2 Å²	44.2	66%	0.664	23%	0.229	S	C	*	.	T	Hydrogen-bonded Turn	trans	54.7	22.5	179.5	-55.1	-173.8	16.8	0	0	116.2	T484 L485 M486	T484-Q488 PolarHBondContact O-N 3.39Å; L485-Q488 PolarHBondContact O-N 3.44Å; M486-Q488 VanDerWaalsContact C-N 3.31Å
489	A	72.1	Confident	86.3	Confident	35 Å²	35	42.9 Å²	42.9	29%	0.289	22%	0.222	S	C	.	.			trans	-77.4	148.6	175.5	0	0	0	0	0	110.9	T484 T487 P491 H494	T484-A489 HydrophobicContact CG2-CB 3.93Å; T484-A489 PolarHBondContact O-N 3.34Å; T487-A489 PolarHBondContact O-N 3.1Å; T487-A489 VanDerWaalsContact O-N 3.08Å; A489-P491 WeakPolarHBondContact O-CD 3.29Å; A489-H494 HydrophobicContact CB-CB 4.38Å
490	D	82.2	Confident	86	Confident	76 Å²	76	45.9 Å²	45.9	41%	0.406	24%	0.24	S	C	.	.			trans	-61.7	109.2	167.1	172.7	-8.5	0	0	0	107.9	A492 K493 H494 K515	D490-A492 PolarHBondContact O-N 3.27Å; D490-A492 PolarHBondContact OD1-N 2.83Å; D490-K493 HydrophobicContact CB-CB 3.95Å; D490-K493 PolarHBondContact O-N 3.36Å; D490-K493 PolarHBondContact OD1-N 3.44Å; D490-H494 WeakPolarHBondContact O-CB 3.36Å; D490-H494 PolarHBondContact O-N 3.2Å; D490-K515 IonicContact OD2-NZ 3.45Å; D490-K515 PolarHBondContact OD2-NZ 3.33Å; D490-K515 VanDerWaalsContact OD2-NZ 3.17Å
491	P	85.6	Confident	85.8	Confident	23 Å²	23	52.8 Å²	52.8	15%	0.149	27%	0.272	C	S	.	.	H	α-helix	trans	-65.6	-30.1	-170.8	-21.4	34.2	0	0	0	112.7	I425 L481 T484 L485 A489 L495	I425-P491 HydrophobicContact CG1-CB 4.35Å; L481-P491 HydrophobicContact CD1-CB 3.67Å; L481-P491 HydrophobicContact CD1-CG 4.18Å; T484-P491 HydrophobicContact CG2-CB 4.07Å; T484-P491 HydrophobicContact CG2-CG 4.34Å; L485-P491 HydrophobicContact CD2-CG 3.67Å; L485-P491 HydrophobicContact CG-CG 4.38Å; A489-P491 WeakPolarHBondContact O-CD 3.29Å; P491-L495 WeakPolarHBondContact O-CB 3.42Å; P491-L495 PolarHBondContact O-N 3.5Å
492	A	83.7	Confident	85.5	Confident	21 Å²	21	53.4 Å²	53.4	17%	0.174	28%	0.278	C	S	.	.	H	α-helix	trans	-74.6	-39.7	-179.7	0	0	0	0	0	111.5	I425 D490 Y496 K515	I425-A492 HydrophobicContact CD1-CB 4.32Å; D490-A492 PolarHBondContact O-N 3.27Å; D490-A492 PolarHBondContact OD1-N 2.83Å; A492-Y496 PolarHBondContact O-N 3.19Å; A492-K515 HydrophobicContact CB-CD 4.14Å
493	K	85.3	Confident	85.3	Confident	125 Å²	125	55 Å²	55	54%	0.543	30%	0.299	S	S	.	.	H	α-helix	trans	-67.2	-48.5	175.1	-174.9	-174.6	173.9	-164.8	0	110.5	D490 L495 Y496 E497	D490-K493 HydrophobicContact CB-CB 3.95Å; D490-K493 PolarHBondContact O-N 3.36Å; D490-K493 PolarHBondContact OD1-N 3.44Å; K493-L495 VanDerWaalsContact C-N 3.33Å; K493-L495 PolarHBondContact O-N 3.18Å; K493-Y496 WeakPolarHBondContact O-CB 3.48Å; K493-Y496 PolarHBondContact O-N 3.36Å; K493-Y496 VanDerWaalsContact O-N 3.13Å; K493-E497 WeakPolarHBondContact CE-OE1 3.4Å; K493-E497 IonicContact NZ-OE1 3.87Å; K493-E497 PolarHBondContact O-N 3.26Å
494	H	87.6	Confident	85.3	Confident	52 Å²	52	54.8 Å²	54.8	24%	0.241	29%	0.292	C	S	.	.	H	α-helix	trans	-62.3	-41	-179.2	-167.1	50.1	0	0	0	111.5	W480 T484 A489 D490 Y496 E497 E498	W480-H494 AromaticContact CZ2-CD2 3.62Å; T484-H494 HydrophobicContact CG2-CB 4.12Å; A489-H494 HydrophobicContact CB-CB 4.38Å; D490-H494 WeakPolarHBondContact O-CB 3.36Å; D490-H494 PolarHBondContact O-N 3.2Å; H494-Y496 VanDerWaalsContact C-N 3.29Å; H494-Y496 PolarHBondContact O-N 2.89Å; H494-E497 PolarHBondContact O-N 3.39Å; H494-E498 IonicContact CE1-OE1 2.79Å; H494-E498 PolarHBondContact CE1-OE1 2.68Å; H494-E498 VanDerWaalsContact O-CB 3.29Å; H494-E498 WeakPolarHBondContact O-CB 3.22Å; H494-E498 VanDerWaalsContact O-CG 3.25Å; H494-E498 WeakPolarHBondContact O-CG 3.43Å; H494-E498 PolarHBondContact O-N 3.1Å
495	L	89.9	Confident	85.3	Confident	1 Å²	1	58 Å²	58	1%	0.005	31%	0.313	C	S	.	.	H	α-helix	trans	-57.4	-40.2	174.7	-176.1	61.3	0	0	0	112.7	I425 L428 L429 W449 W480 P491 K493 L499 T511	I425-L495 HydrophobicContact CD1-CD2 4.27Å; L428-L495 HydrophobicContact CD2-CD2 3.44Å; L428-L495 VanDerWaalsContact CD2-CD2 3.44Å; L429-L495 HydrophobicContact CD2-CD1 4.24Å; L429-L495 HydrophobicContact CD2-CD2 3.69Å; W449-L495 HydrophobicContact CH2-CD1 4.19Å; W449-L495 HydrophobicContact CZ2-CD1 4.16Å; W480-L495 HydrophobicContact CE3-CD1 4.36Å; W480-L495 HydrophobicContact CH2-CB 3.53Å; W480-L495 HydrophobicContact CH2-CD1 3.84Å; W480-L495 HydrophobicContact CH2-CG 4.23Å; W480-L495 HydrophobicContact CZ2-CB 4.23Å; W480-L495 HydrophobicContact CZ2-CD1 4.25Å; W480-L495 HydrophobicContact CZ3-CB 4.13Å; W480-L495 HydrophobicContact CZ3-CD1 3.88Å; W480-L495 HydrophobicContact CZ3-CG 4.45Å; P491-L495 WeakPolarHBondContact O-CB 3.42Å; P491-L495 PolarHBondContact O-N 3.5Å; K493-L495 VanDerWaalsContact C-N 3.33Å; K493-L495 PolarHBondContact O-N 3.18Å; L495-L499 HydrophobicContact CD1-CD1 4.13Å; L495-L499 HydrophobicContact CD1-CG 4.16Å; L495-L499 HydrophobicContact CG-CD1 3.97Å; L495-L499 HydrophobicContact CG-CG 4.4Å; L495-L499 VanDerWaalsContact O-CB 3.32Å; L495-L499 WeakPolarHBondContact O-CB 3.28Å; L495-L499 WeakPolarHBondContact O-CG 3.48Å; L495-L499 PolarHBondContact O-N 3.04Å; L495-T511 HydrophobicContact CD2-CG2 4.17Å
496	Y	88.8	Confident	85.2	Confident	72 Å²	72	63.6 Å²	63.6	28%	0.282	34%	0.335	S	S	.	.	H	α-helix	trans	-63.9	-50.5	178.6	176.5	-86.6	0	0	0	111.2	A492 K493 H494 E498 L499 V500 A508 E509 R512	A492-Y496 PolarHBondContact O-N 3.19Å; K493-Y496 WeakPolarHBondContact O-CB 3.48Å; K493-Y496 PolarHBondContact O-N 3.36Å; K493-Y496 VanDerWaalsContact O-N 3.13Å; H494-Y496 VanDerWaalsContact C-N 3.29Å; H494-Y496 PolarHBondContact O-N 2.89Å; Y496-E498 VanDerWaalsContact C-N 3.35Å; Y496-E498 PolarHBondContact O-N 2.88Å; Y496-L499 PolarHBondContact O-N 3.14Å; Y496-V500 HydrophobicContact CD1-CG2 4.33Å; Y496-V500 HydrophobicContact CE1-CG2 3.92Å; Y496-V500 WeakPolarHBondContact O-CG2 3.3Å; Y496-V500 PolarHBondContact O-N 3.03Å; Y496-A508 HydrophobicContact CD2-CB 3.66Å; Y496-A508 VanDerWaalsContact CD2-O 3.28Å; Y496-A508 WeakPolarHBondContact CD2-O 3.28Å; Y496-A508 HydrophobicContact CE2-CB 3.73Å; Y496-A508 HydrophobicContact CG-CB 4.27Å; Y496-E509 WeakPolarHBondContact CE2-OE1 3.5Å; Y496-E509 PolarHBondContact OH-OE1 3.21Å; Y496-R512 HydrophobicContact CD2-CB 4.39Å; Y496-R512 HydrophobicContact CE2-CB 4.47Å
497	E	88.6	Confident	85.4	Confident	90 Å²	90	61.8 Å²	61.8	42%	0.421	33%	0.326	S	S	.	.	H	α-helix	trans	-59.9	-46.6	-178.9	-68.6	170.2	169.7	0	0	111	K493 H494 L499 V500 H501	K493-E497 WeakPolarHBondContact CE-OE1 3.4Å; K493-E497 IonicContact NZ-OE1 3.87Å; K493-E497 PolarHBondContact O-N 3.26Å; H494-E497 PolarHBondContact O-N 3.39Å; E497-L499 PolarHBondContact O-N 3.09Å; E497-V500 PolarHBondContact O-N 3.28Å; E497-H501 WeakPolarHBondContact O-CB 3.17Å; E497-H501 PolarHBondContact O-N 3.49Å
498	E	88.8	Confident	85.8	Confident	41 Å²	41	59.1 Å²	59.1	19%	0.192	31%	0.309	C	S	.	.	H	α-helix	trans	-63	-40.6	178	-75.8	-59.1	127.1	0	0	113	W449 W480 H494 Y496 H501 A502	W449-E498 HydrophobicContact CZ2-CB 4.41Å; W449-E498 PolarHBondContact NE1-OE2 3.31Å; W449-E498 VanDerWaalsContact NE1-OE2 3.09Å; W480-E498 HydrophobicContact CZ2-CG 4.48Å; H494-E498 IonicContact CE1-OE1 2.79Å; H494-E498 PolarHBondContact CE1-OE1 2.68Å; H494-E498 VanDerWaalsContact O-CB 3.29Å; H494-E498 WeakPolarHBondContact O-CB 3.22Å; H494-E498 VanDerWaalsContact O-CG 3.25Å; H494-E498 WeakPolarHBondContact O-CG 3.43Å; H494-E498 PolarHBondContact O-N 3.1Å; Y496-E498 VanDerWaalsContact C-N 3.35Å; Y496-E498 PolarHBondContact O-N 2.88Å; E498-H501 PolarHBondContact O-N 2.89Å; E498-A502 VanDerWaalsContact O-CB 3.23Å; E498-A502 WeakPolarHBondContact O-CB 3.33Å; E498-A502 PolarHBondContact O-N 3.01Å
499	L	90.6	Very high	86.7	Confident	0 Å²	0	55.7 Å²	55.7	0%	0	29%	0.293	C	S	.	.	H	α-helix	trans	-66.3	-38.3	175.9	-77.3	174.2	0	0	0	112.4	L432 L445 L495 Y496 E497 G503 F504 L507 A508 T511	L432-L499 HydrophobicContact CD1-CD1 3.92Å; L445-L499 HydrophobicContact CD1-CD2 3.8Å; L445-L499 HydrophobicContact CD2-CD2 4.11Å; L495-L499 HydrophobicContact CD1-CD1 4.13Å; L495-L499 HydrophobicContact CD1-CG 4.16Å; L495-L499 HydrophobicContact CG-CD1 3.97Å; L495-L499 HydrophobicContact CG-CG 4.4Å; L495-L499 VanDerWaalsContact O-CB 3.32Å; L495-L499 WeakPolarHBondContact O-CB 3.28Å; L495-L499 WeakPolarHBondContact O-CG 3.48Å; L495-L499 PolarHBondContact O-N 3.04Å; Y496-L499 PolarHBondContact O-N 3.14Å; E497-L499 PolarHBondContact O-N 3.09Å; L499-G503 PolarHBondContact O-N 3.43Å; L499-F504 HydrophobicContact CD2-CB 4.32Å; L499-F504 CarbonylContact O-C 3.49Å; L499-F504 WeakPolarHBondContact O-CA 3.47Å; L499-F504 WeakPolarHBondContact O-CB 3.48Å; L499-F504 PolarHBondContact O-N 3.45Å; L499-L507 HydrophobicContact CD1-CG 4.25Å; L499-L507 HydrophobicContact CD2-CD2 3.86Å; L499-L507 HydrophobicContact CD2-CG 4.34Å; L499-A508 HydrophobicContact CB-CB 3.82Å; L499-T511 HydrophobicContact CD1-CG2 3.74Å
500	V	90.4	Very high	87	Confident	63 Å²	63	59.5 Å²	59.5	38%	0.382	30%	0.303	S	S	.	.	H	α-helix	trans	-64.6	-47.2	174.5	173.2	0	0	0	0	109.9	Y496 E497 A502 G503 A508	Y496-V500 HydrophobicContact CD1-CG2 4.33Å; Y496-V500 HydrophobicContact CE1-CG2 3.92Å; Y496-V500 WeakPolarHBondContact O-CG2 3.3Å; Y496-V500 PolarHBondContact O-N 3.03Å; E497-V500 PolarHBondContact O-N 3.28Å; V500-A502 VanDerWaalsContact C-N 3.32Å; V500-A502 PolarHBondContact O-N 3.29Å; V500-G503 PolarHBondContact O-N 2.96Å; V500-A508 HydrophobicContact CG2-CB 3.62Å
501	H	89.2	Confident	86.9	Confident	154 Å²	154	56.3 Å²	56.3	71%	0.713	29%	0.287	S	S	*	.	H	α-helix	trans	-61.6	-39.8	179.6	-167.6	71.6	0	0	0	112.4	E497 E498 G503	E497-H501 WeakPolarHBondContact O-CB 3.17Å; E497-H501 PolarHBondContact O-N 3.49Å; E498-H501 PolarHBondContact O-N 2.89Å; H501-G503 PolarHBondContact O-N 3.35Å; H501-G503 VanDerWaalsContact O-N 3.13Å
502	A	88.8	Confident	86.4	Confident	17 Å²	17	62.6 Å²	62.6	14%	0.14	31%	0.307	C	S	.	.	T	Hydrogen-bonded Turn	trans	-71.7	0.3	175.9	0	0	0	0	0	114.3	L445 S448 E498 V500 F504	L445-A502 HydrophobicContact CD1-CB 3.76Å; S448-A502 VanDerWaalsContact OG-CB 3.28Å; S448-A502 WeakPolarHBondContact OG-CB 2.93Å; E498-A502 VanDerWaalsContact O-CB 3.23Å; E498-A502 WeakPolarHBondContact O-CB 3.33Å; E498-A502 PolarHBondContact O-N 3.01Å; V500-A502 VanDerWaalsContact C-N 3.32Å; V500-A502 PolarHBondContact O-N 3.29Å; A502-F504 HydrophobicContact CB-CD2 3.72Å; A502-F504 HydrophobicContact CB-CE2 4Å; A502-F504 VanDerWaalsContact O-CD2 3.31Å; A502-F504 WeakPolarHBondContact O-CD2 3.42Å; A502-F504 WeakPolarHBondContact O-CE2 3.17Å
503	G	89.6	Confident	85.5	Confident	50 Å²	50	67.1 Å²	67.1	52%	0.515	33%	0.325	S	S	.	.	T	Hydrogen-bonded Turn	trans	83.4	25.6	177.4	0	0	0	0	0	114.3	L499 V500 H501 P505	L499-G503 PolarHBondContact O-N 3.43Å; V500-G503 PolarHBondContact O-N 2.96Å; H501-G503 PolarHBondContact O-N 3.35Å; H501-G503 VanDerWaalsContact O-N 3.13Å; G503-P505 VanDerWaalsContact O-CD 3.29Å; G503-P505 WeakPolarHBondContact O-CD 3.41Å
504	F	89.3	Confident	84.4	Confident	18 Å²	18	64.6 Å²	64.6	8%	0.079	31%	0.314	C	S	.	.			trans	-116	53.5	177.8	-58.4	-86.1	0	0	0	113.3	E441 R444 L445 L499 A502 K506 L507 A508	E441-F504 HydrophobicContact CB-CE1 3.92Å; E441-F504 HydrophobicContact CB-CZ 4.11Å; E441-F504 HydrophobicContact CG-CE1 3.88Å; E441-F504 HydrophobicContact CG-CZ 4.37Å; R444-F504 HydrophobicContact CB-CZ 4.39Å; L445-F504 HydrophobicContact CB-CE2 4.38Å; L445-F504 HydrophobicContact CD1-CD2 4.23Å; L445-F504 HydrophobicContact CD1-CE2 4.22Å; L499-F504 HydrophobicContact CD2-CB 4.32Å; L499-F504 CarbonylContact O-C 3.49Å; L499-F504 WeakPolarHBondContact O-CA 3.47Å; L499-F504 WeakPolarHBondContact O-CB 3.48Å; L499-F504 PolarHBondContact O-N 3.45Å; A502-F504 HydrophobicContact CB-CD2 3.72Å; A502-F504 HydrophobicContact CB-CE2 4Å; A502-F504 VanDerWaalsContact O-CD2 3.31Å; A502-F504 WeakPolarHBondContact O-CD2 3.42Å; A502-F504 WeakPolarHBondContact O-CE2 3.17Å; F504-K506 VanDerWaalsContact C-N 3.31Å; F504-K506 PolarHBondContact O-N 3.32Å; F504-L507 HydrophobicContact CB-CB 3.82Å; F504-L507 HydrophobicContact CB-CD2 4.27Å; F504-L507 WeakPolarHBondContact O-CA 3.4Å; F504-L507 WeakPolarHBondContact O-CB 3.5Å; F504-L507 PolarHBondContact O-N 2.91Å; F504-A508 PolarHBondContact O-N 3.42Å
505	P	88.1	Confident	83.1	Confident	71 Å²	71	66.1 Å²	66.1	46%	0.461	32%	0.32	S	S	.	.	H	α-helix	trans	-62.9	-34.5	-174.9	26.1	-35.3	0	0	0	113.3	G503 L507 A508 E509	G503-P505 VanDerWaalsContact O-CD 3.29Å; G503-P505 WeakPolarHBondContact O-CD 3.41Å; P505-L507 PolarHBondContact O-N 3.39Å; P505-A508 PolarHBondContact O-N 2.79Å; P505-E509 PolarHBondContact O-N 3.43Å; P505-E509 VanDerWaalsContact O-N 3.08Å
506	K	85.6	Confident	81.6	Confident	178 Å²	178	68.7 Å²	68.7	77%	0.774	34%	0.338	S	S	*	.	H	α-helix	trans	-66	-28.2	174.7	-66.7	-176.5	-179.5	179.2	0	112.7	F504 K510	F504-K506 VanDerWaalsContact C-N 3.31Å; F504-K506 PolarHBondContact O-N 3.32Å; K506-K510 WeakPolarHBondContact O-CG 3.38Å
507	L	85.3	Confident	80	Confident	13 Å²	13	72.2 Å²	72.2	7%	0.068	36%	0.355	C	S	.	.	H	α-helix	trans	-79.5	-41.5	177.2	-167.7	60.1	0	0	0	110.2	L432 Q436 L437 L499 F504 P505 E509 K510 T511	L432-L507 HydrophobicContact CD1-CD1 3.9Å; L432-L507 HydrophobicContact CD1-CD2 3.81Å; L432-L507 HydrophobicContact CD1-CG 3.65Å; L432-L507 HydrophobicContact CD2-CD2 4.19Å; L432-L507 HydrophobicContact CG-CD1 4.08Å; L432-L507 HydrophobicContact CG-CD2 4Å; L432-L507 HydrophobicContact CG-CG 4.2Å; Q436-L507 HydrophobicContact CB-CD1 3.44Å; Q436-L507 VanDerWaalsContact CB-CD1 3.44Å; Q436-L507 HydrophobicContact CG-CD1 4.23Å; L437-L507 HydrophobicContact CD2-CD2 3.83Å; L499-L507 HydrophobicContact CD1-CG 4.25Å; L499-L507 HydrophobicContact CD2-CD2 3.86Å; L499-L507 HydrophobicContact CD2-CG 4.34Å; F504-L507 HydrophobicContact CB-CB 3.82Å; F504-L507 HydrophobicContact CB-CD2 4.27Å; F504-L507 WeakPolarHBondContact O-CA 3.4Å; F504-L507 WeakPolarHBondContact O-CB 3.5Å; F504-L507 PolarHBondContact O-N 2.91Å; P505-L507 PolarHBondContact O-N 3.39Å; L507-E509 PolarHBondContact O-N 2.94Å; L507-K510 WeakPolarHBondContact O-CB 3.41Å; L507-K510 PolarHBondContact O-N 3.23Å; L507-K510 VanDerWaalsContact O-N 3.1Å; L507-T511 PolarHBondContact O-N 3.48Å
508	A	86.3	Confident	78.4	Confident	0 Å²	0	69.9 Å²	69.9	0%	0	35%	0.346	C	S	.	.	H	α-helix	trans	-57.3	-44.5	174.7	0	0	0	0	0	112.4	Y496 L499 V500 F504 P505 K510 T511 R512	Y496-A508 HydrophobicContact CD2-CB 3.66Å; Y496-A508 VanDerWaalsContact CD2-O 3.28Å; Y496-A508 WeakPolarHBondContact CD2-O 3.28Å; Y496-A508 HydrophobicContact CE2-CB 3.73Å; Y496-A508 HydrophobicContact CG-CB 4.27Å; L499-A508 HydrophobicContact CB-CB 3.82Å; V500-A508 HydrophobicContact CG2-CB 3.62Å; F504-A508 PolarHBondContact O-N 3.42Å; P505-A508 PolarHBondContact O-N 2.79Å; A508-K510 VanDerWaalsContact C-N 3.25Å; A508-K510 PolarHBondContact O-N 3.1Å; A508-T511 PolarHBondContact O-N 3.43Å; A508-T511 VanDerWaalsContact O-N 3.11Å; A508-T511 PolarHBondContact O-OG1 3.17Å; A508-R512 PolarHBondContact O-N 2.99Å
509	E	84.4	Confident	76.8	Confident	69 Å²	69	71.6 Å²	71.6	32%	0.322	36%	0.357	S	S	.	.	H	α-helix	trans	-62.4	-32.4	176.4	-71.7	-55.5	140.5	0	0	113	Y496 P505 L507 T511 R512 H513	Y496-E509 WeakPolarHBondContact CE2-OE1 3.5Å; Y496-E509 PolarHBondContact OH-OE1 3.21Å; P505-E509 PolarHBondContact O-N 3.43Å; P505-E509 VanDerWaalsContact O-N 3.08Å; L507-E509 PolarHBondContact O-N 2.94Å; E509-T511 PolarHBondContact O-N 2.66Å; E509-R512 WeakPolarHBondContact O-CB 3.46Å; E509-R512 PolarHBondContact O-N 2.88Å; E509-R512 IonicContact OE2-NH1 3.83Å; E509-H513 PolarHBondContact O-CD2 3.22Å; E509-H513 PolarHBondContact O-N 3.02Å
510	K	79.7	Confident	74.6	Confident	115 Å²	115	76.7 Å²	76.7	50%	0.5	38%	0.383	S	S	.	.	H	α-helix	trans	-69.3	-31.5	176	-68.6	176.4	-179.3	-178.3	0	112.6	K506 L507 A508 F514	K506-K510 WeakPolarHBondContact O-CG 3.38Å; L507-K510 WeakPolarHBondContact O-CB 3.41Å; L507-K510 PolarHBondContact O-N 3.23Å; L507-K510 VanDerWaalsContact O-N 3.1Å; A508-K510 VanDerWaalsContact C-N 3.25Å; A508-K510 PolarHBondContact O-N 3.1Å; K510-F514 PolarHBondContact O-N 3.15Å
511	T	79.3	Confident	72.5	Confident	9 Å²	9	78.5 Å²	78.5	6%	0.055	39%	0.391	C	S	.	.	H	α-helix	trans	-71.9	-34.7	175.1	66	0	0	0	0	111.4	L428 L432 L495 L499 L507 A508 E509 F514 K515	L428-T511 HydrophobicContact CD2-CG2 3.88Å; L432-T511 HydrophobicContact CD1-CG2 3.77Å; L495-T511 HydrophobicContact CD2-CG2 4.17Å; L499-T511 HydrophobicContact CD1-CG2 3.74Å; L507-T511 PolarHBondContact O-N 3.48Å; A508-T511 PolarHBondContact O-N 3.43Å; A508-T511 VanDerWaalsContact O-N 3.11Å; A508-T511 PolarHBondContact O-OG1 3.17Å; E509-T511 PolarHBondContact O-N 2.66Å; T511-F514 WeakPolarHBondContact O-CB 3.43Å; T511-F514 PolarHBondContact O-N 2.91Å; T511-K515 PolarHBondContact O-N 3.26Å
512	R	74.9	Confident	70.5	Confident	155 Å²	155	74.4 Å²	74.4	59%	0.585	38%	0.38	S	S	*	.	H	α-helix	trans	-61.1	-43.9	173.7	-168.7	-179.2	-178	-177.4	3.2	112.8	Y496 A508 E509 F514 K515 S516	Y496-R512 HydrophobicContact CD2-CB 4.39Å; Y496-R512 HydrophobicContact CE2-CB 4.47Å; A508-R512 PolarHBondContact O-N 2.99Å; E509-R512 WeakPolarHBondContact O-CB 3.46Å; E509-R512 PolarHBondContact O-N 2.88Å; E509-R512 IonicContact OE2-NH1 3.83Å; R512-F514 VanDerWaalsContact C-N 3.27Å; R512-F514 PolarHBondContact O-N 3.22Å; R512-K515 PolarHBondContact O-N 2.75Å; R512-S516 PolarHBondContact O-N 3.25Å
513	H	65.3	Low	68.3	Low	117 Å²	117	81.3 Å²	81.3	54%	0.542	41%	0.407	S	S	.	.	H	α-helix	trans	-65.3	-29.2	176.6	-71.7	-58.1	0	0	0	113.1	E509 S516 K517	E509-H513 PolarHBondContact O-CD2 3.22Å; E509-H513 PolarHBondContact O-N 3.02Å; H513-S516 PolarHBondContact O-N 2.95Å; H513-S516 PolarHBondContact O-OG 3.08Å; H513-K517 PolarHBondContact O-N 2.82Å
514	F	62.7	Low	66	Low	72 Å²	72	86.5 Å²	86.5	32%	0.316	42%	0.415	S	S	.	.	H	α-helix	trans	-67.7	-44.7	176.1	-162.8	-83.3	0	0	0	111.4	T427 L428 K510 T511 R512 S516 K517 T518	T427-F514 HydrophobicContact CG2-CZ 4.14Å; L428-F514 HydrophobicContact CB-CD1 3.85Å; L428-F514 HydrophobicContact CB-CE1 3.81Å; L428-F514 HydrophobicContact CB-CG 4.29Å; L428-F514 HydrophobicContact CB-CZ 4.26Å; L428-F514 HydrophobicContact CD1-CB 3.72Å; L428-F514 HydrophobicContact CD1-CD1 3.66Å; L428-F514 HydrophobicContact CD1-CE1 4.46Å; L428-F514 HydrophobicContact CD1-CG 3.83Å; L428-F514 HydrophobicContact CG-CB 4.37Å; L428-F514 HydrophobicContact CG-CD1 4.08Å; L428-F514 HydrophobicContact CG-CG 4.14Å; K510-F514 PolarHBondContact O-N 3.15Å; T511-F514 WeakPolarHBondContact O-CB 3.43Å; T511-F514 PolarHBondContact O-N 2.91Å; R512-F514 VanDerWaalsContact C-N 3.27Å; R512-F514 PolarHBondContact O-N 3.22Å; F514-S516 VanDerWaalsContact C-N 3.32Å; F514-S516 PolarHBondContact O-N 2.79Å; F514-K517 PolarHBondContact O-N 3.44Å; F514-K517 VanDerWaalsContact O-N 3.09Å; F514-T518 HydrophobicContact CD1-CG2 4Å; F514-T518 HydrophobicContact CE1-CG2 3.75Å; F514-T518 PolarHBondContact O-N 3Å; F514-T518 PolarHBondContact O-OG1 2.85Å; F514-T518 VanDerWaalsContact O-OG1 3.06Å
515	K	59.3	Low	63.7	Low	84 Å²	84	91.1 Å²	91.1	37%	0.365	45%	0.448	S	S	.	.	H	α-helix	trans	-55.7	-44.8	174	-169.6	170.2	-177	168.1	0	111.5	D490 A492 T511 R512 K517 T518 D519	D490-K515 IonicContact OD2-NZ 3.45Å; D490-K515 PolarHBondContact OD2-NZ 3.33Å; D490-K515 VanDerWaalsContact OD2-NZ 3.17Å; A492-K515 HydrophobicContact CB-CD 4.14Å; T511-K515 PolarHBondContact O-N 3.26Å; R512-K515 PolarHBondContact O-N 2.75Å; K515-K517 VanDerWaalsContact C-N 3.34Å; K515-K517 PolarHBondContact O-N 2.96Å; K515-T518 WeakPolarHBondContact CA-OG1 3.4Å; K515-T518 PolarHBondContact O-N 2.87Å; K515-T518 PolarHBondContact O-OG1 2.99Å; K515-D519 WeakPolarHBondContact O-CB 3.3Å; K515-D519 VanDerWaalsContact O-CG 3.29Å; K515-D519 PolarHBondContact O-N 3.29Å
516	S	58.1	Low	61.2	Low	54 Å²	54	93.7 Å²	93.7	38%	0.378	46%	0.462	S	S	.	.	H	α-helix	trans	-62.1	-36.2	176.7	66.4	0	0	0	0	113.9	R512 H513 F514 L520	R512-S516 PolarHBondContact O-N 3.25Å; H513-S516 PolarHBondContact O-N 2.95Å; H513-S516 PolarHBondContact O-OG 3.08Å; F514-S516 VanDerWaalsContact C-N 3.32Å; F514-S516 PolarHBondContact O-N 2.79Å; S516-L520 WeakPolarHBondContact O-CB 3.24Å; S516-L520 VanDerWaalsContact O-CD1 3.22Å; S516-L520 WeakPolarHBondContact O-CD1 3.41Å; S516-L520 WeakPolarHBondContact O-CG 3.41Å; S516-L520 PolarHBondContact O-N 2.67Å; S516-L520 VanDerWaalsContact O-N 3.12Å
517	K	56.3	Low	58.9	Low	147 Å²	147	90.8 Å²	90.8	64%	0.639	46%	0.459	S	S	*	.	H	α-helix	trans	-74.6	-37.2	178.6	-80.1	-177.7	177.8	178.9	0	112.3	H513 F514 K515 L520 N521	H513-K517 PolarHBondContact O-N 2.82Å; F514-K517 PolarHBondContact O-N 3.44Å; F514-K517 VanDerWaalsContact O-N 3.09Å; K515-K517 VanDerWaalsContact C-N 3.34Å; K515-K517 PolarHBondContact O-N 2.96Å; K517-L520 PolarHBondContact O-N 3.24Å; K517-N521 WeakPolarHBondContact O-CB 3.34Å; K517-N521 PolarHBondContact O-N 3.24Å
518	T	55.2	Low	56.4	Low	40 Å²	40	99.5 Å²	99.5	25%	0.245	52%	0.521	C	S	.	.	H	α-helix	trans	-69.7	-38.8	175.3	43.3	0	0	0	0	112.1	F514 K515 L520 N521 S522	F514-T518 HydrophobicContact CD1-CG2 4Å; F514-T518 HydrophobicContact CE1-CG2 3.75Å; F514-T518 PolarHBondContact O-N 3Å; F514-T518 PolarHBondContact O-OG1 2.85Å; F514-T518 VanDerWaalsContact O-OG1 3.06Å; K515-T518 WeakPolarHBondContact CA-OG1 3.4Å; K515-T518 PolarHBondContact O-N 2.87Å; K515-T518 PolarHBondContact O-OG1 2.99Å; T518-L520 VanDerWaalsContact C-N 3.31Å; T518-L520 PolarHBondContact O-N 3.04Å; T518-N521 PolarHBondContact O-N 3.19Å; T518-S522 WeakPolarHBondContact O-CB 3.4Å; T518-S522 PolarHBondContact O-N 3Å; T518-S522 PolarHBondContact O-OG 3.12Å
519	D	53.8	Low	54.9	Low	78 Å²	78	104.5 Å²	104.5	42%	0.417	55%	0.547	S	S	.	.	H	α-helix	trans	-67.9	-31	175.1	-70.1	-16.9	0	0	0	112.4	K515 S522 K523	K515-D519 WeakPolarHBondContact O-CB 3.3Å; K515-D519 VanDerWaalsContact O-CG 3.29Å; K515-D519 PolarHBondContact O-N 3.29Å; D519-S522 WeakPolarHBondContact CA-OG 3.43Å; D519-S522 PolarHBondContact O-OG 3.25Å; D519-S522 VanDerWaalsContact O-OG 3.12Å; D519-K523 VanDerWaalsContact O-CG 3.26Å; D519-K523 WeakPolarHBondContact O-CG 3.36Å; D519-K523 PolarHBondContact O-N 3.02Å
520	L	46	Very low	53.4	Low	106 Å²	106	106.3 Å²	106.3	56%	0.555	56%	0.559	S	S	*	*	H	α-helix	trans	-71.7	-35.4	172.3	-79.8	161.5	0	0	0	112.4	S516 K517 T518 K524	S516-L520 WeakPolarHBondContact O-CB 3.24Å; S516-L520 VanDerWaalsContact O-CD1 3.22Å; S516-L520 WeakPolarHBondContact O-CD1 3.41Å; S516-L520 WeakPolarHBondContact O-CG 3.41Å; S516-L520 PolarHBondContact O-N 2.67Å; S516-L520 VanDerWaalsContact O-N 3.12Å; K517-L520 PolarHBondContact O-N 3.24Å; T518-L520 VanDerWaalsContact C-N 3.31Å; T518-L520 PolarHBondContact O-N 3.04Å; L520-K524 WeakPolarHBondContact O-CG 3.17Å; L520-K524 PolarHBondContact O-N 3.46Å
521	N	46	Very low	51.9	Low	101 Å²	101	105.8 Å²	105.8	54%	0.54	56%	0.562	S	S	.	*	H	α-helix	trans	-80.5	-34.6	178.4	-80.6	-9.1	0	0	0	112.8	K517 T518 K523 K524 C525	K517-N521 WeakPolarHBondContact O-CB 3.34Å; K517-N521 PolarHBondContact O-N 3.24Å; T518-N521 PolarHBondContact O-N 3.19Å; N521-K523 VanDerWaalsContact C-N 3.31Å; N521-K523 PolarHBondContact O-N 3.22Å; N521-K524 PolarHBondContact O-N 3.24Å; N521-K524 VanDerWaalsContact O-N 3.14Å; N521-C525 PolarHBondContact O-N 3.17Å
522	S	47	Very low	50.3	Low	68 Å²	68	111.5 Å²	111.5	48%	0.476	59%	0.592	S	S	.	*	H	α-helix	trans	-64.3	-37.3	173.3	64.5	0	0	0	0	111.5	T518 D519 K524 C525	T518-S522 WeakPolarHBondContact O-CB 3.4Å; T518-S522 PolarHBondContact O-N 3Å; T518-S522 PolarHBondContact O-OG 3.12Å; D519-S522 WeakPolarHBondContact CA-OG 3.43Å; D519-S522 PolarHBondContact O-OG 3.25Å; D519-S522 VanDerWaalsContact O-OG 3.12Å; S522-K524 VanDerWaalsContact C-N 3.3Å; S522-K524 PolarHBondContact O-N 2.93Å; S522-C525 PolarHBondContact O-N 3.11Å
523	K	42.6	Very low	48.8	Very low	162 Å²	162	108.8 Å²	108.8	70%	0.704	59%	0.592	S	S	*	*	H	α-helix	trans	-67	-25.3	172.1	-74.1	177.1	-177.9	-178.6	0	114.1	D519 N521	D519-K523 VanDerWaalsContact O-CG 3.26Å; D519-K523 WeakPolarHBondContact O-CG 3.36Å; D519-K523 PolarHBondContact O-N 3.02Å; N521-K523 VanDerWaalsContact C-N 3.31Å; N521-K523 PolarHBondContact O-N 3.22Å
524	K	42.1	Very low	47.7	Very low	160 Å²	160	108.3 Å²	108.3	70%	0.696	60%	0.596	S	S	*	*	H	α-helix	trans	-81.8	-20.4	176.2	-79	-177.5	178.2	-176.1	0	113.7	L520 N521 S522	L520-K524 WeakPolarHBondContact O-CG 3.17Å; L520-K524 PolarHBondContact O-N 3.46Å; N521-K524 PolarHBondContact O-N 3.24Å; N521-K524 VanDerWaalsContact O-N 3.14Å; S522-K524 VanDerWaalsContact C-N 3.3Å; S522-K524 PolarHBondContact O-N 2.93Å
525	C	39.7	Very low	46.6	Very low	115 Å²	115	110.9 Å²	110.9	78%	0.777	62%	0.616	S	S	*	*	T	Hydrogen-bonded Turn	trans	-89.7	1.1	178.6	-72.2	0	0	0	0	114.3	N521 S522	N521-C525 PolarHBondContact O-N 3.17Å; S522-C525 PolarHBondContact O-N 3.11Å
526	V	35.4	Very low	45.6	Very low	124 Å²	124	112.9 Å²	112.9	75%	0.752	64%	0.635	S	S	*	*	T	Hydrogen-bonded Turn	trans	-95	2.7	178.5	178.4	0	0	0	0	112.6
527	V	38	Very low	44.6	Very low	118 Å²	118	117.8 Å²	117.8	72%	0.715	66%	0.657	S	S	*	*			trans	-128.4	91	174.2	-173.6	0	0	0	0	109.7
528	S	32.8	Very low	43.5	Very low	195 Å²	195	115.2 Å²	115.2	100%	1.364	66%	0.658	S	S	*	*			trans	-174.7	0	138.6	-74.8	0	0	0	0	109.5

Retrieved 528 of 528 residues in 3777.2 ms (Link to these results)

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