A0A087YN62_POEFO Loading...

Kinesin-like protein

AlphaFold DB , UniProt , Accession A0A087YN62, Species POEFO (Poecilia formosa, Amazon molly), Gene n/a, Length 902 aa.

						>A0A087YN62_POEFO|A0A087YN62
MALSLSSPYGCHSDEEEDLAVFESTAAEHGGMTRPRLPEISVISPGLETRPTIKQLKVAAKPGSSDEGTSERVKVFLRIRPLTDSEKGQEQGCVAIQDEETLLLKAPYESQNMRTAERGITQSIHKFSFSKIFGPDTTQQQIYEGTLKKMVNDVLKGENRLLYTYGVTNSGKTYTIQGNGREAGLLPRALVSLFRKLQGRLYGAMDLKPIMYQDVRQLDNSEMKTEEIRRNSLLKEDENQTSRRAGTTTAWDSGIGGLSSTTHTATQLEDTDSVCLDPDSLSLSAGCDLEEGVQFSIWVSFYEIYNEFLYDLLDASPSQQPRKRVTLRLSDDKQGNPYVKDLTWIQIRSAEEAWRILKAGRRNQSFASTHLNQNSSRSHSIFSIRVLHVHPEASSGQAMHISELTVCDLAGSERCKEQRNGERMKEANNINTSLLTLGRCIAALRHNQNNKSRPPQVVPFRDSKLTRVLQGFFCGRGTSCMVVNINPCASIYDETLQALKFSAIATQLVHGPSTKTRVAYILSLLRDPAAHGSESTVIEEEEDESDVEDGDITLLNTESLLQAIDVLKREVRRQREEKDVLEANVREQVVSEMMEVITGMQEGFTETLEAERALIEERYEDKICNLQKHLKKFYSQELKERDQEIEALAAALDKKQKEDGVSMTAPPVEPEGPRRSHRLSSQTELNRLRAELDQCRAELLTKTQDLVKLRMKLDVPGSAGALTTAADRKLQEGQRNLRQLRLDLQKLGVDLQSGERACCRNTGGERLRHTLAAADDTVAKQNQILMELQNDLTLVKADLRRKAETLAGRANPPTTTFAAPTTPGSCKKRGCMATTPSECENRPPQKRSFFQSVFPTRTPSRKYNAHAAAESSLTPSSRILRSRQPSPPPNPLLTPRSLRGKY
					

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(Predicted Aligned Error values between residue pairs)

Download Structure PDB PAE Table

Site	Residue	pLDDT	pLDDT confidence	pLDDT₁₀	pLDDT10 confidence	SASA	SASA [Å²]	SASA₁₀	SASA10 [Å²]	RSA	RSA unformatted	RSA₁₀	RSA10 unformatted	Surface	Surface10 (not used)	Disorder (not used)	Disorder	Sec. str.	Secondary structure	Isomer	Phi (φ)	Psi (ψ)	Omega (ω)	Chi 1 (χ₁)	Chi 2 (χ₂)	Chi 3 (χ₃)	Chi 4 (χ₄)	Chi 5 (χ₅)	Tau (τ)	Contacts (colored by PAE)	Contact details
1	M	33.2	Very low	30.3	Very low	237 Å²	237	136.5 Å²	136.5	100%	1.167	82%	0.817	S	S	*	*				0	100.6	0	-52.3	175.5	-168.6	0	0	104.5
2	A	28.7	Very low	30	Very low	93 Å²	93	140.1 Å²	140.1	77%	0.769	82%	0.818	S	S	*	*				61.9	123.7	68.7	0	0	0	0	0	109.9
3	L	31.2	Very low	29.8	Very low	161 Å²	161	136.8 Å²	136.8	84%	0.843	81%	0.807	S	S	*	*			cis	-128.5	154.9	16.5	-61.4	137.1	0	0	0	108.9
4	S	31.1	Very low	29.7	Very low	94 Å²	94	138 Å²	138	66%	0.657	81%	0.808	S	S	*	*			cis	69.6	100.5	31.6	78.3	0	0	0	0	116.3
5	L	29.2	Very low	29.7	Very low	182 Å²	182	140.5 Å²	140.5	95%	0.953	81%	0.809	S	S	*	*			trans	-159.6	156.8	147.4	-109.9	172.7	0	0	0	110.3
6	S	27.9	Very low	29.7	Very low	108 Å²	108	143.1 Å²	143.1	76%	0.755	81%	0.811	S	S	*	*			trans	-131.2	169.7	-168.5	54.8	0	0	0	0	113
7	S	32	Very low	29.7	Very low	96 Å²	96	145.2 Å²	145.2	67%	0.671	81%	0.813	S	S	*	*			trans	-56.1	159.3	174.4	174.6	0	0	0	0	113.4
8	P	40.1	Very low	29.6	Very low	123 Å²	123	146.3 Å²	146.3	80%	0.799	82%	0.817	S	S	*	*				-133.1	175.7	115.8	39.2	-31.2	0	0	0	115.2
9	Y	27.5	Very low	29.5	Very low	227 Å²	227	147.6 Å²	147.6	89%	0.89	82%	0.821	S	S	*	*			trans	-71.3	164.5	-178.7	-82.6	-117.4	0	0	0	115
10	G	26.2	Very low	29.4	Very low	72 Å²	72	144.4 Å²	144.4	74%	0.742	81%	0.814	S	S	*	*			trans	-163.7	137.6	156.1	0	0	0	0	0	111.7
11	C	26.2	Very low	29.4	Very low	109 Å²	109	143.6 Å²	143.6	74%	0.736	81%	0.812	S	S	*	*			trans	-143.6	152.8	178	-66.1	0	0	0	0	111.9
12	H	26.9	Very low	29.1	Very low	179 Å²	179	141.6 Å²	141.6	83%	0.829	80%	0.797	S	S	*	*			trans	122.7	153	158	-73.9	-74.1	0	0	0	117.6
13	S	27.4	Very low	29	Very low	98 Å²	98	144.9 Å²	144.9	69%	0.685	80%	0.797	S	S	*	*			trans	61.2	118.3	-169.1	41.4	0	0	0	0	114.8
14	D	28.3	Very low	28.9	Very low	153 Å²	153	143.3 Å²	143.3	82%	0.818	80%	0.8	S	S	*	*				71.6	137.4	59.3	-51.8	-38.4	0	0	0	110.2
15	E	30.1	Very low	28.9	Very low	176 Å²	176	145 Å²	145	82%	0.822	81%	0.806	S	S	*	*			cis	-136.1	166.7	22.6	-62.3	163.8	139.3	0	0	112.4
16	E	29.1	Very low	28.9	Very low	181 Å²	181	140.9 Å²	140.9	85%	0.846	80%	0.798	S	S	*	*			trans	38.6	154.2	148	-63.6	176.9	159.9	0	0	121.7
17	E	30	Very low	29	Very low	179 Å²	179	140.2 Å²	140.2	84%	0.836	80%	0.799	S	S	*	*			cis	-152.8	148.9	25.7	-161.1	175.2	-149.8	0	0	110.7
18	D	27.7	Very low	28.8	Very low	165 Å²	165	144.2 Å²	144.2	88%	0.882	81%	0.807	S	S	*	*			trans	-76.7	149.1	176.8	-89.5	-51.3	0	0	0	112.7
19	L	27.4	Very low	28.2	Very low	172 Å²	172	148.1 Å²	148.1	90%	0.901	81%	0.814	S	S	*	*			trans	-115.3	134.1	169.8	-136.4	84.8	0	0	0	112.8
20	A	28.6	Very low	28.2	Very low	82 Å²	82	141.3 Å²	141.3	68%	0.678	81%	0.814	S	S	*	*			trans	-79.5	150	-156	0	0	0	0	0	116.7
21	V	28	Very low	28.1	Very low	128 Å²	128	141.2 Å²	141.2	78%	0.776	81%	0.812	S	S	*	*			trans	-63.1	141.1	156.8	175.1	0	0	0	0	109.7
22	F	26.9	Very low	28.4	Very low	195 Å²	195	145.5 Å²	145.5	86%	0.855	82%	0.824	S	S	*	*			trans	-128	118.7	158.7	-97	-80.9	0	0	0	110.9
23	E	28.3	Very low	28.4	Very low	163 Å²	163	143.3 Å²	143.3	76%	0.762	82%	0.823	S	S	*	*			trans	-71.1	161.9	165.1	-59.3	177.2	114.7	0	0	110.5
24	S	29	Very low	28.3	Very low	128 Å²	128	150 Å²	150	90%	0.895	83%	0.834	S	S	*	*			trans	-146.9	121.4	162.6	-149.3	0	0	0	0	110.7
25	T	30.8	Very low	28.2	Very low	128 Å²	128	148.6 Å²	148.6	79%	0.785	83%	0.833	S	S	*	*			trans	-136.8	93.3	-165.7	-46.2	0	0	0	0	111.1
26	A	28.3	Very low	28.1	Very low	96 Å²	96	151.9 Å²	151.9	79%	0.793	84%	0.837	S	S	*	*			trans	-157.7	110.5	161.6	0	0	0	0	0	107.8
27	A	30.1	Very low	28	Very low	94 Å²	94	150.7 Å²	150.7	78%	0.777	84%	0.836	S	S	*	*				89.7	92.9	59.8	0	0	0	0	0	113
28	E	28	Very low	27.9	Very low	181 Å²	181	147.7 Å²	147.7	85%	0.846	83%	0.832	S	S	*	*			trans	45.6	121.4	147.2	-54.6	-170.9	141.1	0	0	121.1
29	H	28.2	Very low	27.9	Very low	204 Å²	204	148.9 Å²	148.9	94%	0.944	83%	0.832	S	S	*	*				-145.9	143.5	116.5	-106.8	63.2	0	0	0	109.5
30	G	27.2	Very low	28.3	Very low	85 Å²	85	147.4 Å²	147.4	88%	0.876	82%	0.824	S	S	*	*			trans	-90.4	148.3	-163.8	0	0	0	0	0	116.1
31	G	24.6	Very low	28.6	Very low	69 Å²	69	146.3 Å²	146.3	71%	0.711	81%	0.811	S	S	*	*			trans	-150.5	125.3	168.6	0	0	0	0	0	111.3	T33	G31-T33 PolarHBondContact O-N 3.01Å
32	M	31.7	Very low	28.8	Very low	200 Å²	200	143.8 Å²	143.8	99%	0.985	80%	0.796	S	S	*	*			trans	-82.8	99.8	-175.8	-70.2	179.5	68.1	0	0	112.4
33	T	26.3	Very low	29.4	Very low	133 Å²	133	138 Å²	138	82%	0.816	77%	0.773	S	S	*	*			trans	-126.2	127.2	164.5	45.6	0	0	0	0	110.9	G31	G31-T33 PolarHBondContact O-N 3.01Å
34	R	26.3	Very low	29.5	Very low	238 Å²	238	132.9 Å²	132.9	90%	0.898	76%	0.755	S	S	*	*	P	Polyproline II helix	trans	-68.8	137.2	174	-69.8	175.6	172.7	171.2	-3.9	109.4	R36	R34-R36 PolarHBondContact O-N 2.96Å
35	P	25.9	Very low	29.7	Very low	123 Å²	123	129.8 Å²	129.8	80%	0.799	73%	0.733	S	S	*	*	P	Polyproline II helix	trans	-63	119.2	163.6	27.4	-32.4	0	0	0	108.7
36	R	26.9	Very low	29.7	Very low	245 Å²	245	127.8 Å²	127.8	93%	0.925	74%	0.737	S	S	*	*	P	Polyproline II helix	trans	-73.2	125.1	166.2	-76	-175.8	173.2	-177.6	-2.4	107.8	R34	R34-R36 PolarHBondContact O-N 2.96Å
37	L	27.3	Very low	29.6	Very low	157 Å²	157	131.3 Å²	131.3	82%	0.822	74%	0.742	S	S	*	*	P	Polyproline II helix	trans	-62.6	140.2	168.4	-67.4	167	0	0	0	109	E39	L37-E39 PolarHBondContact O-N 2.84Å
38	P	28.4	Very low	29.5	Very low	115 Å²	115	135.8 Å²	135.8	75%	0.747	75%	0.746	S	S	*	*	P	Polyproline II helix	trans	-58.8	136.7	167.2	-21.5	33.1	0	0	0	110.2	I40	P38-I40 PolarHBondContact O-N 3.42Å
39	E	28.6	Very low	29.4	Very low	190 Å²	190	134 Å²	134	89%	0.888	75%	0.748	S	S	*	*	P	Polyproline II helix	trans	-69.5	117.4	-176.6	-66.8	-173.1	141.2	0	0	111	L37 S41	L37-E39 PolarHBondContact O-N 2.84Å; E39-S41 PolarHBondContact O-N 2.83Å; E39-S41 VanDerWaalsContact O-N 3.09Å
40	I	33.9	Very low	29.2	Very low	141 Å²	141	135.6 Å²	135.6	72%	0.723	75%	0.746	S	S	*	*			trans	-76.6	98.1	-178.5	-57	171.4	0	0	0	108.6	P38 V42	P38-I40 PolarHBondContact O-N 3.42Å; I40-V42 PolarHBondContact O-N 3.4Å
41	S	36.5	Very low	29.2	Very low	59 Å²	59	137.3 Å²	137.3	41%	0.413	74%	0.741	S	S	.	*			trans	-70.3	118.8	169.1	-170.5	0	0	0	0	109.8	E39	E39-S41 PolarHBondContact O-N 2.83Å; E39-S41 VanDerWaalsContact O-N 3.09Å
42	V	31.8	Very low	29.2	Very low	76 Å²	76	140.7 Å²	140.7	46%	0.461	75%	0.749	S	S	.	*			trans	-89.9	112.4	178.6	-174	0	0	0	0	108.5	I40 S44 K126	I40-V42 PolarHBondContact O-N 3.4Å; V42-S44 WeakPolarHBondContact CG1-OG 3.39Å; V42-S44 PolarHBondContact O-N 3.29Å; V42-K126 HydrophobicContact CG1-CD 4.07Å; V42-K126 HydrophobicContact CG1-CG 4.39Å
43	I	39.8	Very low	29	Very low	72 Å²	72	139.1 Å²	139.1	37%	0.369	74%	0.742	S	S	.	*			trans	-79	58.4	172.4	-43.3	178.8	0	0	0	109.6	H125	I43-H125 HydrophobicContact CD1-CB 4.45Å
44	S	30.4	Very low	29	Very low	56 Å²	56	142.1 Å²	142.1	39%	0.392	74%	0.744	S	S	.	*	P	Polyproline II helix	trans	-94.7	156.6	171	-77.1	0	0	0	0	110.6	V42	V42-S44 WeakPolarHBondContact CG1-OG 3.39Å; V42-S44 PolarHBondContact O-N 3.29Å
45	P	33	Very low	29.1	Very low	64 Å²	64	139.9 Å²	139.9	42%	0.416	74%	0.744	S	S	.	*	P	Polyproline II helix	trans	-59.4	147.2	169.6	-18.4	31.9	0	0	0	110.8	L47 Q507	P45-L47 PolarHBondContact O-N 2.77Å; P45-Q507 HydrophobicContact CB-CG 4.5Å; P45-Q507 HydrophobicContact CG-CG 4.24Å
46	G	29.5	Very low	29.1	Very low	85 Å²	85	142.4 Å²	142.4	88%	0.876	75%	0.75	S	S	*	*	P	Polyproline II helix	trans	-58.2	135.1	-178.6	0	0	0	0	0	112.7
47	L	28	Very low	29.1	Very low	171 Å²	171	140.1 Å²	140.1	90%	0.895	75%	0.747	S	S	*	*	P	Polyproline II helix	trans	-100.3	128.6	173.3	-160.5	80.3	0	0	0	109.1	P45	P45-L47 PolarHBondContact O-N 2.77Å
48	E	26.8	Very low	29	Very low	187 Å²	187	139.2 Å²	139.2	87%	0.874	75%	0.747	S	S	*	*	P	Polyproline II helix	trans	-71.2	145.5	173.7	-63.8	-176.6	152.9	0	0	111.2	R50	E48-R50 PolarHBondContact O-N 3.49Å
49	T	25.8	Very low	28.8	Very low	143 Å²	143	138.5 Å²	138.5	88%	0.877	75%	0.751	S	S	*	*			trans	-79.9	107.2	179.2	45.5	0	0	0	0	111.9
50	R	25.1	Very low	28.7	Very low	238 Å²	238	134.2 Å²	134.2	90%	0.898	75%	0.748	S	S	*	*			trans	-128.8	143	159	-92.1	-173.6	168	-176.9	-2.7	111.7	E48	E48-R50 PolarHBondContact O-N 3.49Å
51	P	26.3	Very low	28.3	Very low	121 Å²	121	137.3 Å²	137.3	79%	0.786	76%	0.756	S	S	*	*			trans	-81.5	156.3	-170.1	33	-36.5	0	0	0	113.8
52	T	24.1	Very low	28.2	Very low	141 Å²	141	140.7 Å²	140.7	87%	0.865	78%	0.777	S	S	*	*			trans	-76.6	123.7	-174.6	-39.3	0	0	0	0	113.3
53	I	27.9	Very low	27.7	Very low	166 Å²	166	140.4 Å²	140.4	85%	0.851	79%	0.789	S	S	*	*			trans	-121.8	149.9	160	-69.2	170.1	0	0	0	108.8
54	K	27.7	Very low	27	Very low	197 Å²	197	142.6 Å²	142.6	86%	0.857	81%	0.811	S	S	*	*			trans	-78.9	155.1	-162.3	-63.1	175.3	-179.1	174.6	0	113.7
55	Q	28.1	Very low	26.8	Very low	191 Å²	191	145.2 Å²	145.2	89%	0.893	83%	0.829	S	S	*	*			trans	-58.3	144.6	171.4	-66.5	177.3	-17.1	0	0	112.9
56	L	25.1	Very low	26.6	Very low	175 Å²	175	149.5 Å²	149.5	92%	0.916	85%	0.848	S	S	*	*			trans	-143.5	140.2	148.1	-103	165	0	0	0	108.5
57	K	27.1	Very low	26.7	Very low	198 Å²	198	153.5 Å²	153.5	86%	0.861	84%	0.844	S	S	*	*			trans	-89	149.7	173.8	-63.2	177.4	177.9	179.2	0	109.6
58	V	25.2	Very low	27.2	Very low	138 Å²	138	148.8 Å²	148.8	84%	0.836	84%	0.837	S	S	*	*			trans	-176.1	139.5	135	135.7	0	0	0	0	111.8
59	A	24.3	Very low	27.6	Very low	99 Å²	99	145.9 Å²	145.9	82%	0.818	83%	0.833	S	S	*	*			trans	48.9	156.5	158.8	0	0	0	0	0	121.7
60	A	27.3	Very low	29.1	Very low	100 Å²	100	142 Å²	142	83%	0.826	81%	0.811	S	S	*	*			trans	-126.9	147	175	0	0	0	0	0	111.3
61	K	24.2	Very low	31.3	Very low	207 Å²	207	134.3 Å²	134.3	90%	0.9	79%	0.785	S	S	*	*			trans	-156.3	156.1	149.7	-108.7	-171.1	177	-173.9	0	109.7
62	P	33.9	Very low	34	Very low	130 Å²	130	135.7 Å²	135.7	84%	0.844	78%	0.775	S	S	*	*			trans	-96.7	155.7	-168.9	37.2	-34.8	0	0	0	113.9
63	G	23	Very low	36.9	Very low	69 Å²	69	129 Å²	129	71%	0.711	73%	0.734	S	S	*	*			trans	169.4	115.7	168	0	0	0	0	0	113.9
64	S	24.6	Very low	40	Very low	119 Å²	119	124.1 Å²	124.1	83%	0.832	71%	0.706	S	S	*	*			trans	23.8	110.6	156.2	58.2	0	0	0	0	120.7
65	S	25.1	Very low	43.2	Very low	111 Å²	111	114.7 Å²	114.7	78%	0.776	67%	0.666	S	S	*	*				-179.6	113.3	107.9	57.2	0	0	0	0	109.7	E67	S65-E67 PolarHBondContact O-N 2.91Å
66	D	30.3	Very low	46.4	Very low	154 Å²	154	106.4 Å²	106.4	82%	0.824	63%	0.627	S	S	*	*			trans	-89.2	77.8	-177.4	-164	30.5	0	0	0	111	G68	D66-G68 PolarHBondContact O-N 3.24Å; D66-G68 VanDerWaalsContact O-N 3.17Å
67	E	29.8	Very low	49.8	Very low	168 Å²	168	98.1 Å²	98.1	79%	0.785	58%	0.583	S	S	*	*			trans	-62.8	113	166.1	-77	-165.3	131.6	0	0	108.8	S65 T69	S65-E67 PolarHBondContact O-N 2.91Å; E67-T69 PolarHBondContact O-N 3.31Å
68	G	38.5	Very low	53.1	Low	73 Å²	73	88.9 Å²	88.9	75%	0.753	54%	0.543	S	S	*	.			trans	-56.4	91.2	-165.8	0	0	0	0	0	115.3	D66 S70	D66-G68 PolarHBondContact O-N 3.24Å; D66-G68 VanDerWaalsContact O-N 3.17Å; G68-S70 PolarHBondContact O-N 3.48Å
69	T	36.1	Very low	56.5	Low	126 Å²	126	82.7 Å²	82.7	77%	0.773	51%	0.505	S	S	*	.			trans	-70	95.9	177.1	58.7	0	0	0	0	110.3	E67 E71	E67-T69 PolarHBondContact O-N 3.31Å; T69-E71 PolarHBondContact O-N 2.86Å
70	S	57.5	Low	59.7	Low	61 Å²	61	78.8 Å²	78.8	43%	0.427	47%	0.469	S	S	.	.			trans	-58.1	108.7	-177.5	-177.2	0	0	0	0	112.1	G68 R72 V509 H510	G68-S70 PolarHBondContact O-N 3.48Å; S70-R72 PolarHBondContact O-N 3.09Å; S70-V509 WeakPolarHBondContact OG-CG1 3.45Å; S70-H510 PolarHBondContact OG-O 3.3Å
71	E	72.1	Confident	62.6	Low	76 Å²	76	77.3 Å²	77.3	36%	0.355	45%	0.451	S	S	.	.	P	Polyproline II helix	trans	-65.2	130.1	-173.4	-173.4	168.4	-112.2	0	0	111	T69 K74 R160 H510	T69-E71 PolarHBondContact O-N 2.86Å; E71-K74 VanDerWaalsContact OE1-CE 3.32Å; E71-K74 WeakPolarHBondContact OE1-CE 3.39Å; E71-K74 IonicContact OE1-NZ 3.22Å; E71-K74 PolarHBondContact OE1-NZ 2.85Å; E71-K74 IonicContact OE2-NZ 3.62Å; E71-K74 PolarHBondContact OE2-NZ 3.01Å; E71-R160 IonicContact OE2-NH1 2.79Å; E71-H510 PolarHBondContact O-N 3.37Å; E71-H510 PolarHBondContact O-ND1 2.82Å
72	R	82.1	Confident	65.6	Low	150 Å²	150	68.5 Å²	68.5	57%	0.566	41%	0.413	S	S	*	.	B	Isolated β-bridge	trans	-67.2	155.4	175.1	-69.2	-175.7	-176	-177.3	2.4	111.6	S70 K74 V509	S70-R72 PolarHBondContact O-N 3.09Å; R72-K74 PolarHBondContact O-N 2.88Å; R72-V509 HydrophobicContact CG-CG2 4.15Å
73	V	85.8	Confident	68	Low	2 Å²	2	65.7 Å²	65.7	1%	0.012	39%	0.394	C	S	.	.	P	Polyproline II helix	trans	-58.2	121.7	170.1	176.5	0	0	0	0	109.1	V75 L508	V73-V75 HydrophobicContact CG1-CG2 4.08Å; V73-L508 HydrophobicContact CB-CB 4.41Å; V73-L508 HydrophobicContact CG2-CB 3.83Å; V73-L508 HydrophobicContact CG2-CD2 3.95Å; V73-L508 HydrophobicContact CG2-CG 3.8Å; V73-L508 WeakPolarHBondContact CG2-O 3.21Å; V73-L508 PolarHBondContact N-O 3.37Å
74	K	91.4	Very high	70.8	Confident	62 Å²	62	68.5 Å²	68.5	27%	0.27	39%	0.393	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-78	125.2	176.8	-73.6	173.4	-179.6	157.1	0	109	E71 R72 F76 C480 M481	E71-K74 VanDerWaalsContact OE1-CE 3.32Å; E71-K74 WeakPolarHBondContact OE1-CE 3.39Å; E71-K74 IonicContact OE1-NZ 3.22Å; E71-K74 PolarHBondContact OE1-NZ 2.85Å; E71-K74 IonicContact OE2-NZ 3.62Å; E71-K74 PolarHBondContact OE2-NZ 3.01Å; R72-K74 PolarHBondContact O-N 2.88Å; K74-F76 HydrophobicContact CB-CE2 3.98Å; K74-F76 HydrophobicContact CB-CZ 4.25Å; K74-F76 HydrophobicContact CD-CZ 4.46Å; K74-C480 WeakPolarHBondContact O-CA 3.15Å; K74-M481 PolarHBondContact O-N 3.14Å
75	V	94.8	Very high	73.3	Confident	0 Å²	0	68 Å²	68	0%	0	39%	0.389	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-125.2	103.6	-177.8	-172.9	0	0	0	0	107.7	V73 F129 S130 M481 V483 A505 T506	V73-V75 HydrophobicContact CG1-CG2 4.08Å; V75-F129 HydrophobicContact CB-CD1 4.42Å; V75-F129 HydrophobicContact CG1-CD1 3.84Å; V75-F129 HydrophobicContact CG1-CE1 4.03Å; V75-F129 WeakPolarHBondContact O-CB 3.41Å; V75-S130 PolarHBondContact N-OG 3.26Å; V75-S130 VanDerWaalsContact N-OG 3.08Å; V75-S130 PolarHBondContact O-N 3.11Å; V75-M481 WeakPolarHBondContact CA-O 3.48Å; V75-M481 HydrophobicContact CG1-CB 4.25Å; V75-M481 HydrophobicContact CG1-CG 4.29Å; V75-M481 HydrophobicContact CG1-SD 4.14Å; V75-M481 HydrophobicContact CG2-CB 4.2Å; V75-V483 HydrophobicContact CG1-CG2 3.52Å; V75-A505 HydrophobicContact CG2-CB 4.21Å; V75-T506 HydrophobicContact CG2-CG2 4.49Å; V75-T506 WeakPolarHBondContact CG2-OG1 3.21Å
76	F	96.3	Very high	76	Confident	17 Å²	17	64 Å²	64	8%	0.075	36%	0.359	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-95.4	140.2	178.7	-63	-67.3	0	0	0	110.1	K74 K131 F133 T146 C480 M481 V482 V483	K74-F76 HydrophobicContact CB-CE2 3.98Å; K74-F76 HydrophobicContact CB-CZ 4.25Å; K74-F76 HydrophobicContact CD-CZ 4.46Å; F76-K131 WeakPolarHBondContact CA-O 3.36Å; F76-K131 HydrophobicContact CD1-CB 3.7Å; F76-K131 HydrophobicContact CE1-CB 3.89Å; F76-F133 HydrophobicContact CB-CD2 4.47Å; F76-F133 HydrophobicContact CB-CE2 4Å; F76-F133 HydrophobicContact CD1-CE2 4.18Å; F76-F133 HydrophobicContact CG-CE2 4.2Å; F76-T146 HydrophobicContact CB-CG2 4.45Å; F76-T146 HydrophobicContact CD1-CG2 4.4Å; F76-T146 HydrophobicContact CD2-CG2 3.46Å; F76-T146 VanDerWaalsContact CD2-CG2 3.46Å; F76-T146 HydrophobicContact CE2-CG2 3.64Å; F76-T146 HydrophobicContact CG-CG2 3.85Å; F76-T146 HydrophobicContact CZ-CG2 4.2Å; F76-C480 WeakPolarHBondContact CD2-SG 3.3Å; F76-C480 WeakPolarHBondContact CE2-SG 3.43Å; F76-M481 PolarHBondContact N-O 3.37Å; F76-V482 CarbonylContact O-C 3.4Å; F76-V482 WeakPolarHBondContact O-CA 3.43Å; F76-V483 PolarHBondContact O-N 3.23Å
77	L	97.1	Very high	78.2	Confident	0 Å²	0	62 Å²	62	0%	0	34%	0.342	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-101.6	136.8	173.2	-176.9	70.4	0	0	0	109.8	L102 F129 K131 I132 F133 V483 I485 L499	L77-L102 HydrophobicContact CD2-CB 4.1Å; L77-L102 HydrophobicContact CD2-CD1 3.59Å; L77-L102 HydrophobicContact CD2-CD2 3.67Å; L77-L102 HydrophobicContact CD2-CG 3.98Å; L77-F129 HydrophobicContact CB-CB 4.37Å; L77-F129 HydrophobicContact CB-CD1 4.16Å; L77-F129 HydrophobicContact CB-CD2 3.91Å; L77-F129 HydrophobicContact CB-CE2 4.27Å; L77-F129 HydrophobicContact CB-CG 3.86Å; L77-F129 HydrophobicContact CD1-CE2 4.38Å; L77-F129 HydrophobicContact CD1-CZ 4.29Å; L77-F129 HydrophobicContact CD2-CD2 3.93Å; L77-F129 HydrophobicContact CD2-CE2 3.82Å; L77-F129 HydrophobicContact CG-CD2 4.44Å; L77-F129 HydrophobicContact CG-CE2 4.39Å; L77-K131 PolarHBondContact N-O 3.03Å; L77-I132 HydrophobicContact CB-CG1 4.12Å; L77-I132 HydrophobicContact CB-CG2 4.47Å; L77-I132 HydrophobicContact CD2-CD1 4.22Å; L77-I132 HydrophobicContact CD2-CG1 4.13Å; L77-I132 HydrophobicContact CD2-CG2 4.04Å; L77-F133 WeakPolarHBondContact O-CD2 3.38Å; L77-F133 PolarHBondContact O-N 3.34Å; L77-V483 CarbonylContact C-O 3.51Å; L77-V483 HydrophobicContact CD1-CB 3.85Å; L77-V483 HydrophobicContact CD1-CG1 3.86Å; L77-I485 HydrophobicContact CD1-CD1 4.07Å; L77-I485 HydrophobicContact CD1-CG1 3.99Å; L77-I485 HydrophobicContact CD1-CG2 3.84Å; L77-I485 HydrophobicContact CD2-CD1 4.25Å; L77-L499 HydrophobicContact CD1-CD2 3.8Å
78	R	96.3	Very high	80	Confident	5 Å²	5	57.8 Å²	57.8	2%	0.019	34%	0.344	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-122.4	122.5	165.8	-168	-162.9	-172.3	160.2	14.5	110.3	F133 T137 Q139 I142 T175 V483 I485	R78-F133 WeakPolarHBondContact CA-O 3.42Å; R78-F133 HydrophobicContact CB-CB 4.44Å; R78-F133 HydrophobicContact CG-CB 4.21Å; R78-T137 PolarHBondContact NH2-O 2.89Å; R78-Q139 VanDerWaalsContact CZ-OE1 3.28Å; R78-I142 HydrophobicContact CG-CD1 3.91Å; R78-T175 PolarHBondContact NH1-OG1 2.89Å; R78-V483 PolarHBondContact N-O 3.44Å; R78-I485 PolarHBondContact O-N 2.72Å
79	I	95.3	Very high	81.4	Confident	8 Å²	8	58.6 Å²	58.6	4%	0.041	33%	0.329	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-88.8	129	167.5	-50.6	173	0	0	0	107	V94 I96 L102 I132 F133 I485 P487	I79-V94 HydrophobicContact CD1-CG1 3.74Å; I79-V94 HydrophobicContact CG1-CG1 4.35Å; I79-I96 HydrophobicContact CD1-CD1 3.92Å; I79-I96 HydrophobicContact CD1-CG1 3.81Å; I79-L102 HydrophobicContact CD1-CD1 3.99Å; I79-I132 HydrophobicContact CD1-CG2 4.28Å; I79-F133 PolarHBondContact N-O 3.33Å; I79-I485 HydrophobicContact CB-CG1 4.49Å; I79-I485 HydrophobicContact CG1-CD1 4.13Å; I79-I485 HydrophobicContact CG1-CG1 4.09Å; I79-P487 HydrophobicContact CG2-CB 4.35Å; I79-P487 HydrophobicContact CG2-CG 4.09Å
80	R	91.9	Very high	83	Confident	17 Å²	17	58.5 Å²	58.5	6%	0.064	32%	0.319	C	S	.	.	P	Polyproline II helix	trans	-84.2	151.7	169.8	72.7	157.1	179.9	97.8	-9.8	111.4	E86 N169 I485 N486	R80-E86 IonicContact CZ-OE1 3.94Å; R80-E86 IonicContact CZ-OE2 3.04Å; R80-E86 IonicContact NH1-OE1 2.61Å; R80-E86 IonicContact NH1-OE2 2.7Å; R80-E86 PolarHBondContact NH1-OE2 3.18Å; R80-E86 VanDerWaalsContact NH2-CD 3.26Å; R80-E86 IonicContact NH2-OE1 2.68Å; R80-E86 PolarHBondContact NH2-OE1 3.5Å; R80-E86 IonicContact NH2-OE2 3.25Å; R80-E86 PolarHBondContact NH2-OE2 3.48Å; R80-E86 VanDerWaalsContact NH2-OE2 3.09Å; R80-N169 PolarHBondContact NE-O 2.61Å; R80-N169 PolarHBondContact NH2-ND2 3.28Å; R80-N169 PolarHBondContact NH2-O 2.9Å; R80-I485 PolarHBondContact N-O 3.36Å; R80-N486 VanDerWaalsContact NH2-CG 3.34Å; R80-N486 PolarHBondContact NH2-ND2 2.99Å; R80-N486 PolarHBondContact NH2-OD1 3.04Å
81	P	89.6	Confident	83.9	Confident	68 Å²	68	59.4 Å²	59.4	44%	0.442	32%	0.317	S	S	.	.	P	Polyproline II helix	trans	-62.4	150.2	165.6	27.2	-34.3	0	0	0	111.3	P135	P81-P135 HydrophobicContact CB-CB 4.11Å
82	L	86	Confident	84.3	Confident	22 Å²	22	57.5 Å²	57.5	12%	0.115	32%	0.318	C	S	.	.	P	Polyproline II helix	trans	-74.8	139.1	169.2	-69.5	171.4	0	0	0	110	E86 K87 E90 P487 C488	L82-E86 HydrophobicContact CB-CB 4.37Å; L82-E86 HydrophobicContact CD2-CB 3.96Å; L82-K87 HydrophobicContact CB-CG 4.15Å; L82-E90 HydrophobicContact CD1-CB 3.77Å; L82-E90 VanDerWaalsContact CD1-CD 3.41Å; L82-E90 HydrophobicContact CD1-CG 3.79Å; L82-P487 HydrophobicContact CD2-CG 3.84Å; L82-P487 HydrophobicContact CG-CG 3.91Å; L82-C488 HydrophobicContact CD2-CB 4.05Å
83	T	84.8	Confident	84.4	Confident	71 Å²	71	50.6 Å²	50.6	44%	0.436	29%	0.292	S	S	.	.	P	Polyproline II helix	trans	-75.1	160.4	168.5	63.1	0	0	0	0	110.1	S85 E86 K87	T83-S85 PolarHBondContact O-N 3.38Å; T83-E86 WeakPolarHBondContact CB-OE2 3.3Å; T83-E86 PolarHBondContact N-OE2 3.33Å; T83-E86 WeakPolarHBondContact O-CA 3.38Å; T83-E86 PolarHBondContact O-N 3.38Å; T83-E86 VanDerWaalsContact OG1-CG 3.3Å; T83-E86 WeakPolarHBondContact OG1-CG 3.14Å; T83-E86 PolarHBondContact OG1-OE2 3.1Å; T83-K87 PolarHBondContact O-N 3.28Å; T83-K87 VanDerWaalsContact O-N 3.12Å
84	D	81.7	Confident	84.6	Confident	128 Å²	128	51.9 Å²	51.9	68%	0.684	30%	0.3	S	S	*	.	H	α-helix	trans	-59.1	-33.9	-175.8	-59.6	-64.6	0	0	0	113.3	E86 K87	D84-E86 PolarHBondContact O-N 2.78Å; D84-K87 WeakPolarHBondContact OD1-CE 3.27Å; D84-K87 IonicContact OD1-NZ 3.93Å; D84-K87 PolarHBondContact OD1-NZ 2.79Å
85	S	77.4	Confident	84.5	Confident	109 Å²	109	50.3 Å²	50.3	76%	0.762	30%	0.299	S	S	*	.	H	α-helix	trans	-66.7	-19.7	172.7	-50.4	0	0	0	0	114.3	T83	T83-S85 PolarHBondContact O-N 3.38Å
86	E	80.5	Confident	84.4	Confident	28 Å²	28	54.3 Å²	54.3	13%	0.131	32%	0.319	C	S	.	.	H	α-helix	trans	-102.7	-16.1	-176.9	-63.5	170.1	129.2	0	0	113	R80 L82 T83 D84 G88 Q89 N169	R80-E86 IonicContact CZ-OE1 3.94Å; R80-E86 IonicContact CZ-OE2 3.04Å; R80-E86 IonicContact NH1-OE1 2.61Å; R80-E86 IonicContact NH1-OE2 2.7Å; R80-E86 PolarHBondContact NH1-OE2 3.18Å; R80-E86 VanDerWaalsContact NH2-CD 3.26Å; R80-E86 IonicContact NH2-OE1 2.68Å; R80-E86 PolarHBondContact NH2-OE1 3.5Å; R80-E86 IonicContact NH2-OE2 3.25Å; R80-E86 PolarHBondContact NH2-OE2 3.48Å; R80-E86 VanDerWaalsContact NH2-OE2 3.09Å; L82-E86 HydrophobicContact CB-CB 4.37Å; L82-E86 HydrophobicContact CD2-CB 3.96Å; T83-E86 WeakPolarHBondContact CB-OE2 3.3Å; T83-E86 PolarHBondContact N-OE2 3.33Å; T83-E86 WeakPolarHBondContact O-CA 3.38Å; T83-E86 PolarHBondContact O-N 3.38Å; T83-E86 VanDerWaalsContact OG1-CG 3.3Å; T83-E86 WeakPolarHBondContact OG1-CG 3.14Å; T83-E86 PolarHBondContact OG1-OE2 3.1Å; D84-E86 PolarHBondContact O-N 2.78Å; E86-G88 PolarHBondContact O-N 2.75Å; E86-Q89 WeakPolarHBondContact O-CA 3.32Å; E86-Q89 PolarHBondContact O-N 2.97Å; E86-N169 PolarHBondContact OE1-ND2 3.4Å
87	K	76.9	Confident	84.1	Confident	110 Å²	110	58.6 Å²	58.6	48%	0.478	34%	0.34	S	S	.	.	H	α-helix	trans	-58.3	-31.9	173.5	-69.8	174.4	-175	168	0	112.1	L82 T83 D84 Q89 E90	L82-K87 HydrophobicContact CB-CG 4.15Å; T83-K87 PolarHBondContact O-N 3.28Å; T83-K87 VanDerWaalsContact O-N 3.12Å; D84-K87 WeakPolarHBondContact OD1-CE 3.27Å; D84-K87 IonicContact OD1-NZ 3.93Å; D84-K87 PolarHBondContact OD1-NZ 2.79Å; K87-Q89 PolarHBondContact O-N 2.75Å; K87-Q89 VanDerWaalsContact O-N 3.13Å; K87-E90 WeakPolarHBondContact O-CB 3.47Å; K87-E90 PolarHBondContact O-N 3.5Å
88	G	68.4	Low	83.8	Confident	80 Å²	80	61.9 Å²	61.9	83%	0.825	36%	0.357	S	S	*	.	T	Hydrogen-bonded Turn	trans	-66.9	-3.5	171	0	0	0	0	0	115.5	E86	E86-G88 PolarHBondContact O-N 2.75Å
89	Q	67.3	Low	83.5	Confident	91 Å²	91	67.7 Å²	67.7	43%	0.425	39%	0.385	S	S	.	.	T	Hydrogen-bonded Turn	trans	-117.2	13.9	175.9	-58.1	-173.9	9.9	0	0	112.3	E86 K87 Q91 C488 S490	E86-Q89 WeakPolarHBondContact O-CA 3.32Å; E86-Q89 PolarHBondContact O-N 2.97Å; K87-Q89 PolarHBondContact O-N 2.75Å; K87-Q89 VanDerWaalsContact O-N 3.13Å; Q89-Q91 PolarHBondContact O-N 2.89Å; Q89-C488 VanDerWaalsContact CB-SG 3.58Å; Q89-C488 PolarHBondContact OE1-SG 3.48Å; Q89-S490 PolarHBondContact OE1-OG 3.06Å
90	E	70.6	Confident	83.4	Confident	123 Å²	123	72.9 Å²	72.9	58%	0.575	41%	0.408	S	S	*	.			trans	-80	103.5	-178.7	-172.5	161	-153.9	0	0	111.8	L82 K87	L82-E90 HydrophobicContact CD1-CB 3.77Å; L82-E90 VanDerWaalsContact CD1-CD 3.41Å; L82-E90 HydrophobicContact CD1-CG 3.79Å; K87-E90 WeakPolarHBondContact O-CB 3.47Å; K87-E90 PolarHBondContact O-N 3.5Å
91	Q	76.3	Confident	83.5	Confident	80 Å²	80	72.5 Å²	72.5	37%	0.374	41%	0.408	S	S	.	.			trans	-104	18.9	175.6	-58.4	-170.6	12.4	0	0	113.2	Q89 C93 P107 Y108 A489	Q89-Q91 PolarHBondContact O-N 2.89Å; Q91-C93 VanDerWaalsContact C-N 3.25Å; Q91-C93 PolarHBondContact O-N 3.07Å; Q91-P107 VanDerWaalsContact OE1-CB 3.32Å; Q91-Y108 VanDerWaalsContact OE1-N 3.09Å; Q91-A489 HydrophobicContact CB-CB 4.4Å; Q91-A489 HydrophobicContact CG-CB 4.12Å
92	G	79.9	Confident	83.7	Confident	37 Å²	37	69.2 Å²	69.2	38%	0.381	39%	0.387	S	S	.	.			trans	64.2	27.4	-178.7	0	0	0	0	0	114.3	V94	G92-V94 PolarHBondContact O-N 2.96Å; G92-V94 VanDerWaalsContact O-N 3.14Å
93	C	84.5	Confident	84	Confident	5 Å²	5	70.1 Å²	70.1	3%	0.034	39%	0.392	C	S	.	.			trans	-61	-20.9	-174.3	-50.1	0	0	0	0	114.1	Q91 L104 K105	Q91-C93 VanDerWaalsContact C-N 3.25Å; Q91-C93 PolarHBondContact O-N 3.07Å; C93-L104 CarbonylContact O-C 3.56Å; C93-L104 WeakPolarHBondContact O-CA 3.43Å; C93-L104 WeakPolarHBondContact O-CD1 3.42Å; C93-K105 WeakPolarHBondContact CA-O 3.32Å; C93-K105 PolarHBondContact O-N 3.17Å
94	V	90.3	Very high	84.3	Confident	28 Å²	28	66.9 Å²	66.9	17%	0.17	37%	0.372	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-125.7	123.8	-178.5	-174.8	0	0	0	0	108.6	I79 G92 L102 L104 I485 P487	I79-V94 HydrophobicContact CD1-CG1 3.74Å; I79-V94 HydrophobicContact CG1-CG1 4.35Å; G92-V94 PolarHBondContact O-N 2.96Å; G92-V94 VanDerWaalsContact O-N 3.14Å; V94-L102 HydrophobicContact CG1-CD1 3.6Å; V94-L102 HydrophobicContact CG1-CD2 4.28Å; V94-L102 HydrophobicContact CG1-CG 4.21Å; V94-L104 HydrophobicContact CG2-CD1 3.86Å; V94-I485 HydrophobicContact CG1-CD1 4.06Å; V94-I485 HydrophobicContact CG2-CD1 4.23Å; V94-P487 HydrophobicContact CB-CB 3.99Å; V94-P487 HydrophobicContact CG2-CB 3.6Å
95	A	89.2	Confident	84.7	Confident	30 Å²	30	65 Å²	65	25%	0.248	36%	0.358	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-131.1	135.5	172.7	0	0	0	0	0	110.1	L103	A95-L103 HydrophobicContact CB-CB 4.41Å; A95-L103 PolarHBondContact N-O 3.34Å; A95-L103 PolarHBondContact O-N 3.5Å
96	I	91.5	Very high	85	Confident	84 Å²	84	60.3 Å²	60.3	43%	0.431	33%	0.325	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-85.2	129.3	172.2	-54.3	176.1	0	0	0	107.3	I79 D98 I132	I79-I96 HydrophobicContact CD1-CD1 3.92Å; I79-I96 HydrophobicContact CD1-CG1 3.81Å; I96-D98 WeakPolarHBondContact CG2-O 3.47Å; I96-I132 HydrophobicContact CD1-CG2 4.07Å; I96-I132 HydrophobicContact CG1-CG2 4.19Å
97	Q	90.1	Very high	85.2	Confident	107 Å²	107	59.3 Å²	59.3	50%	0.5	32%	0.321	S	S	.	.	S	Bend	trans	-92.2	-40.3	173.2	175.7	171.2	24.4	0	0	111.4	T101 L103	Q97-T101 HydrophobicContact CB-CG2 3.83Å; Q97-T101 HydrophobicContact CG-CG2 4.46Å; Q97-T101 PolarHBondContact N-O 3.09Å; Q97-L103 HydrophobicContact CB-CD1 4.22Å; Q97-L103 HydrophobicContact CB-CG 4.2Å
98	D	91	Very high	84.9	Confident	68 Å²	68	62.6 Å²	62.6	36%	0.364	33%	0.332	S	S	.	.	S	Bend	trans	-158.1	179.2	179.6	52.9	66.9	0	0	0	108.6	I96 E100 T101	I96-D98 WeakPolarHBondContact CG2-O 3.47Å; D98-E100 PolarHBondContact O-N 2.86Å; D98-E100 VanDerWaalsContact O-N 3.08Å; D98-E100 PolarHBondContact OD1-N 3.49Å; D98-T101 VanDerWaalsContact CG-CB 3.47Å; D98-T101 PolarHBondContact O-N 3.07Å; D98-T101 WeakPolarHBondContact OD1-CB 3.31Å; D98-T101 PolarHBondContact OD1-N 3.4Å; D98-T101 PolarHBondContact OD1-OG1 2.77Å; D98-T101 VanDerWaalsContact OD2-CB 3.24Å; D98-T101 WeakPolarHBondContact OD2-CB 3.49Å; D98-T101 PolarHBondContact OD2-OG1 2.98Å
99	E	91.1	Very high	85	Confident	128 Å²	128	65.7 Å²	65.7	60%	0.598	33%	0.325	S	S	*	.	S	Bend	trans	-63.2	-14.4	-176.7	-69.7	-160.3	-177.4	0	0	114.8	K131 I132	E99-K131 CarbonylContact O-C 3.54Å; E99-K131 WeakPolarHBondContact O-CA 3.34Å; E99-K131 IonicContact OE1-NZ 3.24Å; E99-K131 IonicContact OE2-NZ 3.24Å; E99-K131 PolarHBondContact OE2-NZ 2.64Å; E99-I132 PolarHBondContact O-N 2.95Å
100	E	93.1	Very high	85.3	Confident	116 Å²	116	62.3 Å²	62.3	54%	0.542	31%	0.311	S	S	.	.	S	Bend	trans	-111.8	-23.9	179.7	-65.4	-175.2	-174.7	0	0	112.5	D98 S128 F129	D98-E100 PolarHBondContact O-N 2.86Å; D98-E100 VanDerWaalsContact O-N 3.08Å; D98-E100 PolarHBondContact OD1-N 3.49Å; E100-S128 CarbonylContact O-C 3.59Å; E100-S128 WeakPolarHBondContact O-CA 3.48Å; E100-F129 WeakPolarHBondContact CB-O 3.48Å; E100-F129 WeakPolarHBondContact CG-O 3.26Å; E100-F129 PolarHBondContact O-N 3Å
101	T	93.3	Very high	85.3	Confident	9 Å²	9	63.6 Å²	63.6	6%	0.055	32%	0.317	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-105.8	125.4	-170.6	-58.9	0	0	0	0	114.4	Q97 D98 K126 F127 I132	Q97-T101 HydrophobicContact CB-CG2 3.83Å; Q97-T101 HydrophobicContact CG-CG2 4.46Å; Q97-T101 PolarHBondContact N-O 3.09Å; D98-T101 VanDerWaalsContact CG-CB 3.47Å; D98-T101 PolarHBondContact O-N 3.07Å; D98-T101 WeakPolarHBondContact OD1-CB 3.31Å; D98-T101 PolarHBondContact OD1-N 3.4Å; D98-T101 PolarHBondContact OD1-OG1 2.77Å; D98-T101 VanDerWaalsContact OD2-CB 3.24Å; D98-T101 WeakPolarHBondContact OD2-CB 3.49Å; D98-T101 PolarHBondContact OD2-OG1 2.98Å; T101-K126 HydrophobicContact CG2-CD 3.71Å; T101-K126 HydrophobicContact CG2-CG 3.76Å; T101-F127 WeakPolarHBondContact CA-O 3.31Å; T101-I132 WeakPolarHBondContact O-CD1 3.08Å
102	L	94.5	Very high	85.1	Confident	0 Å²	0	61.5 Å²	61.5	0%	0	31%	0.308	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-100.5	139	166.4	-159.9	76.6	0	0	0	111.3	L77 I79 V94 K126 F127 F129 I132 I485 L499	L77-L102 HydrophobicContact CD2-CB 4.1Å; L77-L102 HydrophobicContact CD2-CD1 3.59Å; L77-L102 HydrophobicContact CD2-CD2 3.67Å; L77-L102 HydrophobicContact CD2-CG 3.98Å; I79-L102 HydrophobicContact CD1-CD1 3.99Å; V94-L102 HydrophobicContact CG1-CD1 3.6Å; V94-L102 HydrophobicContact CG1-CD2 4.28Å; V94-L102 HydrophobicContact CG1-CG 4.21Å; L102-K126 WeakPolarHBondContact O-CA 3.19Å; L102-F127 HydrophobicContact CB-CB 4.37Å; L102-F127 PolarHBondContact N-O 3.36Å; L102-F127 PolarHBondContact O-N 2.83Å; L102-F129 HydrophobicContact CB-CE2 4.24Å; L102-I132 HydrophobicContact CB-CD1 3.98Å; L102-I132 HydrophobicContact CD1-CD1 4.3Å; L102-I485 HydrophobicContact CD2-CD1 3.9Å; L102-L499 HydrophobicContact CD2-CD1 3.83Å; L102-L499 HydrophobicContact CD2-CD2 3.94Å
103	L	92.3	Very high	85	Confident	41 Å²	41	60.9 Å²	60.9	22%	0.215	30%	0.296	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-108.6	119.6	161.8	-59.7	178.2	0	0	0	108.8	A95 Q97 K126	A95-L103 HydrophobicContact CB-CB 4.41Å; A95-L103 PolarHBondContact N-O 3.34Å; A95-L103 PolarHBondContact O-N 3.5Å; Q97-L103 HydrophobicContact CB-CD1 4.22Å; Q97-L103 HydrophobicContact CB-CG 4.2Å; L103-K126 HydrophobicContact CD2-CB 3.83Å; L103-K126 HydrophobicContact CD2-CD 4.1Å; L103-K126 HydrophobicContact CD2-CG 4.07Å
104	L	91.4	Very high	84.5	Confident	2 Å²	2	67.3 Å²	67.3	1%	0.01	32%	0.319	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-103.1	122.4	173.8	-164.5	83.5	0	0	0	109.1	C93 V94 I124 H125 F127 Y492 T495 L496 L499	C93-L104 CarbonylContact O-C 3.56Å; C93-L104 WeakPolarHBondContact O-CA 3.43Å; C93-L104 WeakPolarHBondContact O-CD1 3.42Å; V94-L104 HydrophobicContact CG2-CD1 3.86Å; L104-I124 CarbonylContact O-C 3.55Å; L104-I124 WeakPolarHBondContact O-CA 3.04Å; L104-H125 PolarHBondContact N-O 3.4Å; L104-H125 PolarHBondContact O-N 3.42Å; L104-F127 HydrophobicContact CB-CD2 4.39Å; L104-F127 HydrophobicContact CB-CE2 4.04Å; L104-F127 HydrophobicContact CD2-CE2 4.42Å; L104-Y492 HydrophobicContact CD2-CD2 4.02Å; L104-Y492 HydrophobicContact CD2-CE2 3.45Å; L104-Y492 VanDerWaalsContact CD2-CE2 3.45Å; L104-Y492 HydrophobicContact CG-CD2 4.22Å; L104-Y492 HydrophobicContact CG-CE2 3.67Å; L104-T495 HydrophobicContact CD1-CG2 4.35Å; L104-L496 HydrophobicContact CD2-CB 3.85Å; L104-L496 HydrophobicContact CD2-CD1 3.87Å; L104-L496 HydrophobicContact CD2-CG 4.39Å; L104-L499 HydrophobicContact CB-CD1 4.43Å; L104-L499 HydrophobicContact CD1-CD1 3.77Å; L104-L499 HydrophobicContact CD2-CD1 3.92Å; L104-L499 HydrophobicContact CG-CD1 4.24Å
105	K	88.5	Confident	83.7	Confident	90 Å²	90	67.9 Å²	67.9	39%	0.391	32%	0.323	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-108.3	138	-179.4	-57.5	179.5	-174.8	172	0	110.4	C93 S123 I124 Y492	C93-K105 WeakPolarHBondContact CA-O 3.32Å; C93-K105 PolarHBondContact O-N 3.17Å; K105-S123 WeakPolarHBondContact CA-O 3.43Å; K105-I124 HydrophobicContact CG-CG1 4.26Å; K105-I124 HydrophobicContact CG-CG2 4.4Å; K105-Y492 WeakPolarHBondContact O-CE2 3.48Å
106	A	84.8	Confident	82.9	Confident	9 Å²	9	67.4 Å²	67.4	7%	0.074	32%	0.319	C	S	.	.			trans	-64.1	136.9	174.6	0	0	0	0	0	111.2	N112 M113 S123 Y492	A106-N112 HydrophobicContact CB-CB 4.45Å; A106-M113 HydrophobicContact CB-CB 4.19Å; A106-M113 HydrophobicContact CB-CE 4.04Å; A106-M113 HydrophobicContact CB-SD 4.44Å; A106-M113 WeakPolarHBondContact O-CE 3.47Å; A106-S123 PolarHBondContact N-O 3.13Å; A106-Y492 HydrophobicContact CB-CE1 4.38Å
107	P	83.5	Confident	81.8	Confident	8 Å²	8	70 Å²	70	5%	0.052	33%	0.329	C	S	.	.			trans	-63.5	145.5	166.8	-18.5	29	0	0	0	110.7	Q91 E109 S110 M113 A489 Y492	Q91-P107 VanDerWaalsContact OE1-CB 3.32Å; P107-E109 VanDerWaalsContact C-N 3.29Å; P107-E109 PolarHBondContact O-N 3.23Å; P107-S110 VanDerWaalsContact O-CB 3.26Å; P107-S110 WeakPolarHBondContact O-CB 3.43Å; P107-S110 PolarHBondContact O-N 3.36Å; P107-S110 PolarHBondContact O-OG 3.02Å; P107-M113 WeakPolarHBondContact O-CB 3.18Å; P107-A489 HydrophobicContact CB-CB 3.96Å; P107-A489 HydrophobicContact CG-CB 3.86Å; P107-Y492 VanDerWaalsContact CD-CG 3.4Å; P107-Y492 HydrophobicContact CG-CD1 4.43Å; P107-Y492 HydrophobicContact CG-CD2 4.22Å; P107-Y492 HydrophobicContact CG-CG 3.88Å
108	Y	71.9	Confident	80.8	Confident	178 Å²	178	74.3 Å²	74.3	70%	0.698	34%	0.341	S	S	*	.	T	Hydrogen-bonded Turn	trans	-56.4	-40.4	-175	-70.7	-80.2	0	0	0	113.3	Q91 S110 M113	Q91-Y108 VanDerWaalsContact OE1-N 3.09Å; Y108-S110 VanDerWaalsContact C-N 3.32Å; Y108-S110 PolarHBondContact O-N 3.13Å; Y108-M113 HydrophobicContact CD1-CE 4.29Å
109	E	69.7	Low	79	Confident	146 Å²	146	74.3 Å²	74.3	68%	0.682	36%	0.357	S	S	*	.	T	Hydrogen-bonded Turn	trans	-81.2	-9.6	-178.3	-59.1	-169.4	143.2	0	0	114.1	P107 R114	P107-E109 VanDerWaalsContact C-N 3.29Å; P107-E109 PolarHBondContact O-N 3.23Å; E109-R114 PolarHBondContact O-NE 3.47Å; E109-R114 PolarHBondContact O-NH2 3.32Å
110	S	74.6	Confident	77.4	Confident	19 Å²	19	74 Å²	74	13%	0.133	36%	0.358	C	S	.	.	S	Bend	trans	-67.2	154.5	-170.9	70.9	0	0	0	0	113.3	P107 Y108 N112 M113 R114	P107-S110 VanDerWaalsContact O-CB 3.26Å; P107-S110 WeakPolarHBondContact O-CB 3.43Å; P107-S110 PolarHBondContact O-N 3.36Å; P107-S110 PolarHBondContact O-OG 3.02Å; Y108-S110 VanDerWaalsContact C-N 3.32Å; Y108-S110 PolarHBondContact O-N 3.13Å; S110-N112 VanDerWaalsContact C-N 3.26Å; S110-N112 PolarHBondContact O-N 2.83Å; S110-M113 PolarHBondContact O-N 3.36Å; S110-M113 PolarHBondContact OG-N 3.36Å; S110-M113 VanDerWaalsContact OG-N 3.16Å; S110-R114 WeakPolarHBondContact O-CG 3.37Å; S110-R114 PolarHBondContact O-N 2.56Å
111	Q	70.2	Confident	75.9	Confident	151 Å²	151	71 Å²	71	71%	0.706	35%	0.348	S	S	*	.	H	α-helix	trans	-59	-40.8	174.6	-67.3	-173.5	-9.1	0	0	111.2	M113 R114 T115	Q111-M113 VanDerWaalsContact C-N 3.31Å; Q111-M113 PolarHBondContact O-N 3.33Å; Q111-R114 PolarHBondContact O-N 2.79Å; Q111-T115 PolarHBondContact O-N 2.78Å; Q111-T115 PolarHBondContact O-OG1 3.2Å; Q111-T115 VanDerWaalsContact O-OG1 3.04Å
112	N	72.6	Confident	74.7	Confident	35 Å²	35	74.2 Å²	74.2	19%	0.187	36%	0.362	C	S	.	.	H	α-helix	trans	-64.6	-29.2	178.4	-72.7	18	0	0	0	113.8	A106 S110 T115 A116 T121 Y492 L496	A106-N112 HydrophobicContact CB-CB 4.45Å; S110-N112 VanDerWaalsContact C-N 3.26Å; S110-N112 PolarHBondContact O-N 2.83Å; N112-T115 WeakPolarHBondContact CA-OG1 3.41Å; N112-T115 PolarHBondContact O-OG1 2.9Å; N112-A116 WeakPolarHBondContact O-CB 3.17Å; N112-A116 PolarHBondContact O-N 3.17Å; N112-A116 VanDerWaalsContact O-N 3.09Å; N112-T121 PolarHBondContact O-OG1 2.97Å; N112-T121 VanDerWaalsContact O-OG1 3.09Å; N112-Y492 HydrophobicContact CB-CE1 4.15Å; N112-L496 WeakPolarHBondContact ND2-CD2 3.49Å
113	M	76.5	Confident	73.9	Confident	25 Å²	25	76.4 Å²	76.4	12%	0.123	38%	0.378	C	S	.	.	H	α-helix	trans	-70.1	-49.9	171.1	-171.3	68	83.9	0	0	110.3	A106 P107 Y108 S110 Q111 T115 A116 E117	A106-M113 HydrophobicContact CB-CB 4.19Å; A106-M113 HydrophobicContact CB-CE 4.04Å; A106-M113 HydrophobicContact CB-SD 4.44Å; A106-M113 WeakPolarHBondContact O-CE 3.47Å; P107-M113 WeakPolarHBondContact O-CB 3.18Å; Y108-M113 HydrophobicContact CD1-CE 4.29Å; S110-M113 PolarHBondContact O-N 3.36Å; S110-M113 PolarHBondContact OG-N 3.36Å; S110-M113 VanDerWaalsContact OG-N 3.16Å; Q111-M113 VanDerWaalsContact C-N 3.31Å; Q111-M113 PolarHBondContact O-N 3.33Å; M113-T115 PolarHBondContact O-N 2.79Å; M113-A116 CarbonylContact O-C 3.54Å; M113-A116 WeakPolarHBondContact O-CA 3.5Å; M113-A116 WeakPolarHBondContact O-CB 3.45Å; M113-A116 PolarHBondContact O-N 3.24Å; M113-E117 HydrophobicContact CG-CG 4.36Å; M113-E117 WeakPolarHBondContact O-CG 3.45Å; M113-E117 PolarHBondContact O-N 3.36Å
114	R	74.3	Confident	73.6	Confident	139 Å²	139	78.2 Å²	78.2	53%	0.525	39%	0.387	S	S	.	.	H	α-helix	trans	-62	-28.5	-179.5	-60.2	177.5	-158.4	-155.1	1.2	113.4	E109 S110 Q111 R118	E109-R114 PolarHBondContact O-NE 3.47Å; E109-R114 PolarHBondContact O-NH2 3.32Å; S110-R114 WeakPolarHBondContact O-CG 3.37Å; S110-R114 PolarHBondContact O-N 2.56Å; Q111-R114 PolarHBondContact O-N 2.79Å; R114-R118 VanDerWaalsContact O-CD 3.28Å; R114-R118 WeakPolarHBondContact O-CD 3.46Å; R114-R118 VanDerWaalsContact O-CG 3.26Å; R114-R118 WeakPolarHBondContact O-CG 3.31Å
115	T	73.6	Confident	73.4	Confident	41 Å²	41	78.8 Å²	78.8	25%	0.252	39%	0.39	S	S	.	.	H	α-helix	trans	-83.1	-24.3	171	51.3	0	0	0	0	112.9	Q111 N112 M113 R118 G119 I120 T121	Q111-T115 PolarHBondContact O-N 2.78Å; Q111-T115 PolarHBondContact O-OG1 3.2Å; Q111-T115 VanDerWaalsContact O-OG1 3.04Å; N112-T115 WeakPolarHBondContact CA-OG1 3.41Å; N112-T115 PolarHBondContact O-OG1 2.9Å; M113-T115 PolarHBondContact O-N 2.79Å; T115-R118 PolarHBondContact O-N 3.06Å; T115-G119 PolarHBondContact O-N 3.34Å; T115-I120 WeakPolarHBondContact O-CA 3.48Å; T115-I120 WeakPolarHBondContact O-CB 3.41Å; T115-I120 PolarHBondContact O-N 3.03Å; T115-T121 VanDerWaalsContact C-OG1 3.3Å; T115-T121 WeakPolarHBondContact CB-OG1 3.4Å; T115-T121 PolarHBondContact O-N 3.27Å; T115-T121 PolarHBondContact OG1-OG1 2.84Å
116	A	72.3	Confident	73.5	Confident	19 Å²	19	76.2 Å²	76.2	16%	0.157	38%	0.378	C	S	.	.	H	α-helix	trans	-77.2	-36.6	173.5	0	0	0	0	0	113.2	N112 M113 R118 G119 T121	N112-A116 WeakPolarHBondContact O-CB 3.17Å; N112-A116 PolarHBondContact O-N 3.17Å; N112-A116 VanDerWaalsContact O-N 3.09Å; M113-A116 CarbonylContact O-C 3.54Å; M113-A116 WeakPolarHBondContact O-CA 3.5Å; M113-A116 WeakPolarHBondContact O-CB 3.45Å; M113-A116 PolarHBondContact O-N 3.24Å; A116-R118 PolarHBondContact O-N 3.06Å; A116-G119 PolarHBondContact O-N 2.98Å; A116-T121 WeakPolarHBondContact CA-O 3.39Å; A116-T121 WeakPolarHBondContact CB-O 3.46Å; A116-T121 PolarHBondContact N-OG1 3.24Å; A116-T121 VanDerWaalsContact N-OG1 3.15Å
117	E	69.7	Low	73.9	Confident	140 Å²	140	75.9 Å²	75.9	65%	0.654	38%	0.375	S	S	*	.	T	Hydrogen-bonded Turn	trans	-59.5	-27.6	169.2	-69.4	167.5	162.2	0	0	111.9	M113	M113-E117 HydrophobicContact CG-CG 4.36Å; M113-E117 WeakPolarHBondContact O-CG 3.45Å; M113-E117 PolarHBondContact O-N 3.36Å
118	R	67.2	Low	74.3	Confident	196 Å²	196	77.3 Å²	77.3	74%	0.74	39%	0.385	S	S	*	.	T	Hydrogen-bonded Turn	trans	-89.5	4.1	173.4	-63.7	171.3	-173.7	-154.2	-4.6	113.8	R114 T115 A116 I120	R114-R118 VanDerWaalsContact O-CD 3.28Å; R114-R118 WeakPolarHBondContact O-CD 3.46Å; R114-R118 VanDerWaalsContact O-CG 3.26Å; R114-R118 WeakPolarHBondContact O-CG 3.31Å; T115-R118 PolarHBondContact O-N 3.06Å; A116-R118 PolarHBondContact O-N 3.06Å; R118-I120 HydrophobicContact CB-CD1 3.94Å; R118-I120 HydrophobicContact CB-CG1 4.08Å; R118-I120 PolarHBondContact O-N 3.36Å
119	G	53.8	Low	75.4	Confident	68 Å²	68	69.1 Å²	69.1	70%	0.701	35%	0.353	S	S	*	.	T	Hydrogen-bonded Turn	trans	74	0	-178.9	0	0	0	0	0	116.3	T115 A116	T115-G119 PolarHBondContact O-N 3.34Å; A116-G119 PolarHBondContact O-N 2.98Å
120	I	56.9	Low	76.5	Confident	123 Å²	123	64.5 Å²	64.5	63%	0.631	34%	0.337	S	S	*	.	S	Bend	trans	-78.1	-30.2	-174.1	-53.4	168.9	0	0	0	111.6	T115 R118	T115-I120 WeakPolarHBondContact O-CA 3.48Å; T115-I120 WeakPolarHBondContact O-CB 3.41Å; T115-I120 PolarHBondContact O-N 3.03Å; R118-I120 HydrophobicContact CB-CD1 3.94Å; R118-I120 HydrophobicContact CB-CG1 4.08Å; R118-I120 PolarHBondContact O-N 3.36Å
121	T	62.4	Low	77.4	Confident	53 Å²	53	66.8 Å²	66.8	33%	0.325	34%	0.344	S	S	.	.	S	Bend	trans	-135.3	169.5	-179.2	56.9	0	0	0	0	112	N112 T115 A116	N112-T121 PolarHBondContact O-OG1 2.97Å; N112-T121 VanDerWaalsContact O-OG1 3.09Å; T115-T121 VanDerWaalsContact C-OG1 3.3Å; T115-T121 WeakPolarHBondContact CB-OG1 3.4Å; T115-T121 PolarHBondContact O-N 3.27Å; T115-T121 PolarHBondContact OG1-OG1 2.84Å; A116-T121 WeakPolarHBondContact CA-O 3.39Å; A116-T121 WeakPolarHBondContact CB-O 3.46Å; A116-T121 PolarHBondContact N-OG1 3.24Å; A116-T121 VanDerWaalsContact N-OG1 3.15Å
122	Q	68.3	Low	78.7	Confident	75 Å²	75	60.1 Å²	60.1	35%	0.35	31%	0.314	S	S	.	.			trans	-92.1	136.1	171.6	-73.3	153.4	8.5	0	0	110.9	I124	Q122-I124 VanDerWaalsContact C-N 3.3Å
123	S	78.1	Confident	79.8	Confident	47 Å²	47	58.8 Å²	58.8	33%	0.329	31%	0.306	S	S	.	.	S	Bend	trans	-79.6	-10.6	173.6	52.8	0	0	0	0	113.3	K105 A106	K105-S123 WeakPolarHBondContact CA-O 3.43Å; A106-S123 PolarHBondContact N-O 3.13Å
124	I	85.5	Confident	80.6	Confident	79 Å²	79	58.1 Å²	58.1	41%	0.405	31%	0.306	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-134.6	133.8	177.8	-50.4	-178	0	0	0	109.3	L104 K105 Q122	L104-I124 CarbonylContact O-C 3.55Å; L104-I124 WeakPolarHBondContact O-CA 3.04Å; K105-I124 HydrophobicContact CG-CG1 4.26Å; K105-I124 HydrophobicContact CG-CG2 4.4Å; Q122-I124 VanDerWaalsContact C-N 3.3Å
125	H	87.3	Confident	81.5	Confident	14 Å²	14	53.9 Å²	53.9	7%	0.065	30%	0.297	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-121.1	132	174.2	-61.2	-53.5	0	0	0	110.5	I43 L104 F127 L496	I43-H125 HydrophobicContact CD1-CB 4.45Å; L104-H125 PolarHBondContact N-O 3.4Å; L104-H125 PolarHBondContact O-N 3.42Å; H125-F127 HydrophobicContact CB-CD2 4.46Å; H125-F127 HydrophobicContact CB-CE2 3.63Å; H125-F127 HydrophobicContact CB-CZ 3.96Å; H125-L496 WeakPolarHBondContact CD2-CD1 3.21Å
126	K	91.1	Very high	82.3	Confident	36 Å²	36	59 Å²	59	16%	0.157	32%	0.322	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-97.6	135.9	173.7	175.3	157.7	168.9	147.9	0	110.6	V42 T101 L102 L103	V42-K126 HydrophobicContact CG1-CD 4.07Å; V42-K126 HydrophobicContact CG1-CG 4.39Å; T101-K126 HydrophobicContact CG2-CD 3.71Å; T101-K126 HydrophobicContact CG2-CG 3.76Å; L102-K126 WeakPolarHBondContact O-CA 3.19Å; L103-K126 HydrophobicContact CD2-CB 3.83Å; L103-K126 HydrophobicContact CD2-CD 4.1Å; L103-K126 HydrophobicContact CD2-CG 4.07Å
127	F	92.4	Very high	83.3	Confident	2 Å²	2	59.1 Å²	59.1	1%	0.009	32%	0.321	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-131.9	150.2	176.5	-61.8	-81	0	0	0	110.7	T101 L102 L104 H125 F129 L496 L499 K500 A503	T101-F127 WeakPolarHBondContact CA-O 3.31Å; L102-F127 HydrophobicContact CB-CB 4.37Å; L102-F127 PolarHBondContact N-O 3.36Å; L102-F127 PolarHBondContact O-N 2.83Å; L104-F127 HydrophobicContact CB-CD2 4.39Å; L104-F127 HydrophobicContact CB-CE2 4.04Å; L104-F127 HydrophobicContact CD2-CE2 4.42Å; H125-F127 HydrophobicContact CB-CD2 4.46Å; H125-F127 HydrophobicContact CB-CE2 3.63Å; H125-F127 HydrophobicContact CB-CZ 3.96Å; F127-F129 HydrophobicContact CB-CD2 4.47Å; F127-F129 HydrophobicContact CB-CE2 3.6Å; F127-F129 HydrophobicContact CB-CZ 4.08Å; F127-L496 HydrophobicContact CE2-CD1 4.22Å; F127-L496 HydrophobicContact CZ-CD1 3.77Å; F127-L499 HydrophobicContact CD1-CB 4.11Å; F127-L499 HydrophobicContact CD2-CB 4.1Å; F127-L499 HydrophobicContact CD2-CD1 4.12Å; F127-L499 HydrophobicContact CE1-CB 3.87Å; F127-L499 HydrophobicContact CE2-CB 3.86Å; F127-L499 HydrophobicContact CE2-CD1 3.99Å; F127-L499 HydrophobicContact CG-CB 4.22Å; F127-L499 HydrophobicContact CZ-CB 3.75Å; F127-K500 HydrophobicContact CE1-CG 4.18Å; F127-K500 HydrophobicContact CZ-CG 4.29Å; F127-A503 HydrophobicContact CD1-CB 4.21Å
128	S	92.2	Very high	84.4	Confident	38 Å²	38	55.2 Å²	55.2	27%	0.266	31%	0.307	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-124.9	140	178.5	-59.8	0	0	0	0	112.1	E100	E100-S128 CarbonylContact O-C 3.59Å; E100-S128 WeakPolarHBondContact O-CA 3.48Å
129	F	93.9	Very high	85.6	Confident	6 Å²	6	46 Å²	46	3%	0.026	27%	0.272	C	S	.	.			trans	-137.5	161.3	-171.7	-66.9	-74.1	0	0	0	111.2	V75 L77 E100 L102 F127 K131 I132 V483 L499	V75-F129 HydrophobicContact CB-CD1 4.42Å; V75-F129 HydrophobicContact CG1-CD1 3.84Å; V75-F129 HydrophobicContact CG1-CE1 4.03Å; V75-F129 WeakPolarHBondContact O-CB 3.41Å; L77-F129 HydrophobicContact CB-CB 4.37Å; L77-F129 HydrophobicContact CB-CD1 4.16Å; L77-F129 HydrophobicContact CB-CD2 3.91Å; L77-F129 HydrophobicContact CB-CE2 4.27Å; L77-F129 HydrophobicContact CB-CG 3.86Å; L77-F129 HydrophobicContact CD1-CE2 4.38Å; L77-F129 HydrophobicContact CD1-CZ 4.29Å; L77-F129 HydrophobicContact CD2-CD2 3.93Å; L77-F129 HydrophobicContact CD2-CE2 3.82Å; L77-F129 HydrophobicContact CG-CD2 4.44Å; L77-F129 HydrophobicContact CG-CE2 4.39Å; E100-F129 WeakPolarHBondContact CB-O 3.48Å; E100-F129 WeakPolarHBondContact CG-O 3.26Å; E100-F129 PolarHBondContact O-N 3Å; L102-F129 HydrophobicContact CB-CE2 4.24Å; F127-F129 HydrophobicContact CB-CD2 4.47Å; F127-F129 HydrophobicContact CB-CE2 3.6Å; F127-F129 HydrophobicContact CB-CZ 4.08Å; F129-K131 VanDerWaalsContact C-N 3.27Å; F129-K131 PolarHBondContact O-N 3.45Å; F129-I132 HydrophobicContact CB-CG1 4.17Å; F129-I132 HydrophobicContact CD2-CD1 4.24Å; F129-I132 HydrophobicContact CD2-CG1 4.21Å; F129-V483 HydrophobicContact CE1-CG2 4.16Å; F129-L499 HydrophobicContact CE2-CD2 3.95Å; F129-L499 HydrophobicContact CZ-CD2 3.53Å
130	S	93.2	Very high	87.4	Confident	48 Å²	48	44.7 Å²	44.7	34%	0.336	25%	0.248	S	C	.	.	S	Bend	trans	-69.6	-23.6	178.3	-52.2	0	0	0	0	113.8	V75	V75-S130 PolarHBondContact N-OG 3.26Å; V75-S130 VanDerWaalsContact N-OG 3.08Å; V75-S130 PolarHBondContact O-N 3.11Å
131	K	94.8	Very high	89.1	Confident	67 Å²	67	43.7 Å²	43.7	29%	0.291	24%	0.241	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-170.4	149.1	162.2	-166.4	176.8	173.9	90.7	0	108.5	F76 L77 E99 F129 F133	F76-K131 WeakPolarHBondContact CA-O 3.36Å; F76-K131 HydrophobicContact CD1-CB 3.7Å; F76-K131 HydrophobicContact CE1-CB 3.89Å; L77-K131 PolarHBondContact N-O 3.03Å; E99-K131 CarbonylContact O-C 3.54Å; E99-K131 WeakPolarHBondContact O-CA 3.34Å; E99-K131 IonicContact OE1-NZ 3.24Å; E99-K131 IonicContact OE2-NZ 3.24Å; E99-K131 PolarHBondContact OE2-NZ 2.64Å; F129-K131 VanDerWaalsContact C-N 3.27Å; F129-K131 PolarHBondContact O-N 3.45Å; K131-F133 HydrophobicContact CD-CD1 4.45Å; K131-F133 HydrophobicContact CD-CE1 3.76Å; K131-F133 HydrophobicContact CD-CZ 4.03Å; K131-F133 HydrophobicContact CG-CE1 4.4Å
132	I	96.5	Very high	90.6	Very high	12 Å²	12	41.1 Å²	41.1	6%	0.062	23%	0.225	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-107.2	127.5	172.6	-58.5	179.6	0	0	0	109.5	L77 I79 I96 E99 T101 L102 F129	L77-I132 HydrophobicContact CB-CG1 4.12Å; L77-I132 HydrophobicContact CB-CG2 4.47Å; L77-I132 HydrophobicContact CD2-CD1 4.22Å; L77-I132 HydrophobicContact CD2-CG1 4.13Å; L77-I132 HydrophobicContact CD2-CG2 4.04Å; I79-I132 HydrophobicContact CD1-CG2 4.28Å; I96-I132 HydrophobicContact CD1-CG2 4.07Å; I96-I132 HydrophobicContact CG1-CG2 4.19Å; E99-I132 PolarHBondContact O-N 2.95Å; T101-I132 WeakPolarHBondContact O-CD1 3.08Å; L102-I132 HydrophobicContact CB-CD1 3.98Å; L102-I132 HydrophobicContact CD1-CD1 4.3Å; F129-I132 HydrophobicContact CB-CG1 4.17Å; F129-I132 HydrophobicContact CD2-CD1 4.24Å; F129-I132 HydrophobicContact CD2-CG1 4.21Å
133	F	96.2	Very high	91.9	Very high	6 Å²	6	37.6 Å²	37.6	3%	0.026	21%	0.209	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-102.6	110.5	171.6	-59.4	-65.7	0	0	0	108.7	F76 L77 R78 I79 K131 T137 I142 T146	F76-F133 HydrophobicContact CB-CD2 4.47Å; F76-F133 HydrophobicContact CB-CE2 4Å; F76-F133 HydrophobicContact CD1-CE2 4.18Å; F76-F133 HydrophobicContact CG-CE2 4.2Å; L77-F133 WeakPolarHBondContact O-CD2 3.38Å; L77-F133 PolarHBondContact O-N 3.34Å; R78-F133 WeakPolarHBondContact CA-O 3.42Å; R78-F133 HydrophobicContact CB-CB 4.44Å; R78-F133 HydrophobicContact CG-CB 4.21Å; I79-F133 PolarHBondContact N-O 3.33Å; K131-F133 HydrophobicContact CD-CD1 4.45Å; K131-F133 HydrophobicContact CD-CE1 3.76Å; K131-F133 HydrophobicContact CD-CZ 4.03Å; K131-F133 HydrophobicContact CG-CE1 4.4Å; F133-T137 WeakPolarHBondContact CA-OG1 3.47Å; F133-T137 HydrophobicContact CB-CG2 3.99Å; F133-T137 HydrophobicContact CD1-CG2 3.69Å; F133-T137 HydrophobicContact CG-CG2 4.19Å; F133-I142 HydrophobicContact CB-CD1 4.37Å; F133-I142 HydrophobicContact CB-CG1 4.21Å; F133-I142 HydrophobicContact CD1-CG1 4.05Å; F133-I142 HydrophobicContact CD2-CG1 4.15Å; F133-I142 HydrophobicContact CD2-CG2 4.07Å; F133-I142 HydrophobicContact CE1-CG1 4.41Å; F133-I142 HydrophobicContact CE2-CG2 3.91Å; F133-I142 HydrophobicContact CG-CD1 4.49Å; F133-I142 HydrophobicContact CG-CG1 3.88Å; F133-I142 HydrophobicContact CZ-CG2 4.33Å; F133-T146 HydrophobicContact CE2-CG2 3.83Å; F133-T146 HydrophobicContact CZ-CG2 4.02Å
134	G	93.9	Very high	92.5	Very high	12 Å²	12	38.8 Å²	38.8	12%	0.124	21%	0.209	C	C	.	.			trans	-69.1	173.3	176.3	0	0	0	0	0	113.6	D136 T137	G134-D136 PolarHBondContact O-N 2.9Å; G134-T137 PolarHBondContact N-OG1 2.97Å; G134-T137 VanDerWaalsContact O-CB 3.29Å; G134-T137 WeakPolarHBondContact O-CB 3.23Å; G134-T137 PolarHBondContact O-N 3.02Å; G134-T137 PolarHBondContact O-OG1 3.43Å
135	P	91.5	Very high	92.8	Very high	50 Å²	50	36.7 Å²	36.7	33%	0.325	21%	0.207	S	C	.	.	T	Hydrogen-bonded Turn	trans	-59.8	-31.2	-173.7	24.8	-33.9	0	0	0	113.7	P81 T137	P81-P135 HydrophobicContact CB-CB 4.11Å; P135-T137 VanDerWaalsContact C-N 3.25Å; P135-T137 PolarHBondContact O-N 2.85Å
136	D	91.4	Very high	93	Very high	147 Å²	147	36.4 Å²	36.4	79%	0.786	21%	0.206	S	C	*	.	T	Hydrogen-bonded Turn	trans	-80.3	0.2	179.8	-43.8	-77	0	0	0	113.8	G134 T138	G134-D136 PolarHBondContact O-N 2.9Å; D136-T138 PolarHBondContact O-N 3.5Å
137	T	93.1	Very high	93	Very high	23 Å²	23	34.7 Å²	34.7	14%	0.141	20%	0.199	C	C	.	.			trans	-74.2	119.7	-177	-44.7	0	0	0	0	111.6	R78 F133 G134 P135 Q141 I142	R78-T137 PolarHBondContact NH2-O 2.89Å; F133-T137 WeakPolarHBondContact CA-OG1 3.47Å; F133-T137 HydrophobicContact CB-CG2 3.99Å; F133-T137 HydrophobicContact CD1-CG2 3.69Å; F133-T137 HydrophobicContact CG-CG2 4.19Å; G134-T137 PolarHBondContact N-OG1 2.97Å; G134-T137 VanDerWaalsContact O-CB 3.29Å; G134-T137 WeakPolarHBondContact O-CB 3.23Å; G134-T137 PolarHBondContact O-N 3.02Å; G134-T137 PolarHBondContact O-OG1 3.43Å; P135-T137 VanDerWaalsContact C-N 3.25Å; P135-T137 PolarHBondContact O-N 2.85Å; T137-Q141 HydrophobicContact CG2-CB 3.65Å; T137-I142 HydrophobicContact CG2-CD1 4.25Å; T137-I142 HydrophobicContact CG2-CG1 3.61Å
138	T	92.6	Very high	93	Very high	58 Å²	58	36.6 Å²	36.6	36%	0.356	21%	0.207	S	C	.	.			trans	-69.3	156.3	177.2	70.8	0	0	0	0	112	D136 Q140 Q141 I142	D136-T138 PolarHBondContact O-N 3.5Å; T138-Q140 PolarHBondContact O-N 3.3Å; T138-Q141 PolarHBondContact O-N 3.07Å; T138-Q141 VanDerWaalsContact O-N 3.15Å; T138-Q141 WeakPolarHBondContact OG1-CG 3.31Å; T138-Q141 PolarHBondContact OG1-N 3.45Å; T138-Q141 PolarHBondContact OG1-OE1 2.74Å; T138-I142 WeakPolarHBondContact O-CG1 3.3Å; T138-I142 PolarHBondContact O-N 3.24Å
139	Q	92.6	Very high	93	Very high	1 Å²	1	39.3 Å²	39.3	1%	0.005	21%	0.214	C	C	.	.	H	α-helix	trans	-60.3	-26.6	176.2	-57.4	-89.4	83.5	0	0	111.9	R78 Y143 Y174 G178 E182 A183 G184	R78-Q139 VanDerWaalsContact CZ-OE1 3.28Å; Q139-Y143 WeakPolarHBondContact O-CB 3.5Å; Q139-Y143 PolarHBondContact O-N 3.31Å; Q139-Y174 HydrophobicContact CG-CE2 4.33Å; Q139-Y174 PolarHBondContact NE2-O 2.85Å; Q139-G178 VanDerWaalsContact NE2-CA 3.3Å; Q139-E182 HydrophobicContact CB-CG 4.02Å; Q139-E182 VanDerWaalsContact CB-OE1 3.25Å; Q139-E182 WeakPolarHBondContact CB-OE1 3.41Å; Q139-E182 HydrophobicContact CG-CB 4.3Å; Q139-E182 HydrophobicContact CG-CG 3.64Å; Q139-E182 WeakPolarHBondContact CG-OE1 3.43Å; Q139-E182 WeakPolarHBondContact CG-OE2 3.38Å; Q139-E182 PolarHBondContact N-OE1 3.37Å; Q139-A183 WeakPolarHBondContact CB-O 3.16Å; Q139-G184 VanDerWaalsContact NE2-CA 3.31Å
140	Q	91.4	Very high	92.9	Very high	42 Å²	42	39.5 Å²	39.5	20%	0.196	22%	0.215	C	C	.	.	H	α-helix	trans	-68.8	-49	173.7	177.6	159.7	-19.7	0	0	112.1	T138 I142 Y143 E144 S280	T138-Q140 PolarHBondContact O-N 3.3Å; Q140-I142 VanDerWaalsContact C-N 3.26Å; Q140-I142 PolarHBondContact O-N 3.12Å; Q140-Y143 WeakPolarHBondContact O-CA 3.38Å; Q140-Y143 WeakPolarHBondContact O-CB 3.42Å; Q140-Y143 PolarHBondContact O-N 2.94Å; Q140-E144 HydrophobicContact CG-CG 4.21Å; Q140-E144 PolarHBondContact NE2-OE1 2.96Å; Q140-E144 WeakPolarHBondContact O-CG 3.29Å; Q140-E144 PolarHBondContact O-N 3.17Å; Q140-S280 PolarHBondContact NE2-O 2.91Å
141	Q	92.7	Very high	92.9	Very high	101 Å²	101	37.2 Å²	37.2	47%	0.472	20%	0.199	S	C	.	.	H	α-helix	trans	-61.1	-37.6	-178.9	-72.4	163.6	-38.8	0	0	111.4	T137 T138 G145	T137-Q141 HydrophobicContact CG2-CB 3.65Å; T138-Q141 PolarHBondContact O-N 3.07Å; T138-Q141 VanDerWaalsContact O-N 3.15Å; T138-Q141 WeakPolarHBondContact OG1-CG 3.31Å; T138-Q141 PolarHBondContact OG1-N 3.45Å; T138-Q141 PolarHBondContact OG1-OE1 2.74Å; Q141-G145 PolarHBondContact O-N 3.02Å
142	I	94.2	Very high	92.8	Very high	0 Å²	0	35.9 Å²	35.9	0%	0	20%	0.195	C	C	.	.	H	α-helix	trans	-68.8	-40.7	173.9	-52.3	173.8	0	0	0	110.5	R78 F133 T137 T138 Q140 G145 T146 L185	R78-I142 HydrophobicContact CG-CD1 3.91Å; F133-I142 HydrophobicContact CB-CD1 4.37Å; F133-I142 HydrophobicContact CB-CG1 4.21Å; F133-I142 HydrophobicContact CD1-CG1 4.05Å; F133-I142 HydrophobicContact CD2-CG1 4.15Å; F133-I142 HydrophobicContact CD2-CG2 4.07Å; F133-I142 HydrophobicContact CE1-CG1 4.41Å; F133-I142 HydrophobicContact CE2-CG2 3.91Å; F133-I142 HydrophobicContact CG-CD1 4.49Å; F133-I142 HydrophobicContact CG-CG1 3.88Å; F133-I142 HydrophobicContact CZ-CG2 4.33Å; T137-I142 HydrophobicContact CG2-CD1 4.25Å; T137-I142 HydrophobicContact CG2-CG1 3.61Å; T138-I142 WeakPolarHBondContact O-CG1 3.3Å; T138-I142 PolarHBondContact O-N 3.24Å; Q140-I142 VanDerWaalsContact C-N 3.26Å; Q140-I142 PolarHBondContact O-N 3.12Å; I142-G145 PolarHBondContact O-N 3.38Å; I142-T146 HydrophobicContact CG2-CG2 4.27Å; I142-T146 WeakPolarHBondContact O-CB 3.46Å; I142-T146 WeakPolarHBondContact O-CG2 3.38Å; I142-T146 PolarHBondContact O-N 3.18Å; I142-T146 PolarHBondContact O-OG1 2.9Å; I142-L185 HydrophobicContact CB-CD2 4.27Å; I142-L185 HydrophobicContact CG2-CD1 4.38Å; I142-L185 HydrophobicContact CG2-CD2 3.99Å
143	Y	94.4	Very high	92.5	Very high	1 Å²	1	36 Å²	36	0%	0.004	20%	0.196	C	C	.	.	H	α-helix	trans	-59.8	-47.9	174.9	173.4	-99.4	0	0	0	112.3	Q139 Q140 T146 L147 K148 L185 R188 A189 S192 L281	Q139-Y143 WeakPolarHBondContact O-CB 3.5Å; Q139-Y143 PolarHBondContact O-N 3.31Å; Q140-Y143 WeakPolarHBondContact O-CA 3.38Å; Q140-Y143 WeakPolarHBondContact O-CB 3.42Å; Q140-Y143 PolarHBondContact O-N 2.94Å; Y143-T146 PolarHBondContact O-N 3.15Å; Y143-L147 HydrophobicContact CD2-CB 3.92Å; Y143-L147 HydrophobicContact CE2-CB 3.95Å; Y143-L147 PolarHBondContact O-N 3.04Å; Y143-L147 VanDerWaalsContact O-N 3.12Å; Y143-K148 HydrophobicContact CD1-CB 4.31Å; Y143-K148 HydrophobicContact CE1-CB 3.79Å; Y143-K148 HydrophobicContact CE1-CD 4.46Å; Y143-K148 HydrophobicContact CE1-CG 4.17Å; Y143-K148 WeakPolarHBondContact O-CB 3.15Å; Y143-K148 PolarHBondContact O-N 3.33Å; Y143-L185 HydrophobicContact CD2-CD2 4.43Å; Y143-R188 HydrophobicContact CD1-CB 4.23Å; Y143-R188 HydrophobicContact CD2-CB 3.65Å; Y143-R188 HydrophobicContact CE2-CB 4.1Å; Y143-R188 HydrophobicContact CG-CB 3.76Å; Y143-A189 HydrophobicContact CE2-CB 4Å; Y143-S192 WeakPolarHBondContact OH-CB 3.29Å; Y143-S192 PolarHBondContact OH-OG 3.26Å; Y143-L281 HydrophobicContact CD1-CD2 4.01Å; Y143-L281 HydrophobicContact CE1-CD2 3.99Å
144	E	92.6	Very high	92.4	Very high	71 Å²	71	35.8 Å²	35.8	33%	0.332	20%	0.195	S	C	.	.	H	α-helix	trans	-65.4	-38.6	179.4	-68.1	-176.2	160.7	0	0	112.1	Q140 T146 K148 S282	Q140-E144 HydrophobicContact CG-CG 4.21Å; Q140-E144 PolarHBondContact NE2-OE1 2.96Å; Q140-E144 WeakPolarHBondContact O-CG 3.29Å; Q140-E144 PolarHBondContact O-N 3.17Å; E144-T146 VanDerWaalsContact C-N 3.35Å; E144-T146 PolarHBondContact O-N 3.1Å; E144-K148 HydrophobicContact CB-CD 4.33Å; E144-K148 HydrophobicContact CG-CD 4.07Å; E144-S282 PolarHBondContact OE1-OG 3.39Å
145	G	90	Very high	92.3	Very high	36 Å²	36	35.4 Å²	35.4	37%	0.371	19%	0.19	S	C	.	.	H	α-helix	trans	-77.9	-8.6	176.5	0	0	0	0	0	115.9	Q141 I142	Q141-G145 PolarHBondContact O-N 3.02Å; I142-G145 PolarHBondContact O-N 3.38Å
146	T	92.4	Very high	92.2	Very high	8 Å²	8	38.4 Å²	38.4	5%	0.049	20%	0.198	C	C	.	.	T	Hydrogen-bonded Turn	trans	-132	-82.8	-176.3	65.3	0	0	0	0	112.6	F76 F133 I142 Y143 E144 K148	F76-T146 HydrophobicContact CB-CG2 4.45Å; F76-T146 HydrophobicContact CD1-CG2 4.4Å; F76-T146 HydrophobicContact CD2-CG2 3.46Å; F76-T146 VanDerWaalsContact CD2-CG2 3.46Å; F76-T146 HydrophobicContact CE2-CG2 3.64Å; F76-T146 HydrophobicContact CG-CG2 3.85Å; F76-T146 HydrophobicContact CZ-CG2 4.2Å; F133-T146 HydrophobicContact CE2-CG2 3.83Å; F133-T146 HydrophobicContact CZ-CG2 4.02Å; I142-T146 HydrophobicContact CG2-CG2 4.27Å; I142-T146 WeakPolarHBondContact O-CB 3.46Å; I142-T146 WeakPolarHBondContact O-CG2 3.38Å; I142-T146 PolarHBondContact O-N 3.18Å; I142-T146 PolarHBondContact O-OG1 2.9Å; Y143-T146 PolarHBondContact O-N 3.15Å; E144-T146 VanDerWaalsContact C-N 3.35Å; E144-T146 PolarHBondContact O-N 3.1Å; T146-K148 VanDerWaalsContact C-N 3.33Å; T146-K148 PolarHBondContact O-N 2.88Å
147	L	91.8	Very high	92.1	Very high	0 Å²	0	32.2 Å²	32.2	0%	0	17%	0.169	C	C	.	.	H	α-helix	trans	-77.4	-16.8	-165.1	-152.6	61.4	0	0	0	113	Y143 K149 M150 V151 L162 L185 A189 L404 V406	Y143-L147 HydrophobicContact CD2-CB 3.92Å; Y143-L147 HydrophobicContact CE2-CB 3.95Å; Y143-L147 PolarHBondContact O-N 3.04Å; Y143-L147 VanDerWaalsContact O-N 3.12Å; L147-K149 VanDerWaalsContact C-N 3.33Å; L147-K149 PolarHBondContact O-N 2.98Å; L147-M150 HydrophobicContact CD1-CB 4.05Å; L147-M150 HydrophobicContact CD1-CG 4.37Å; L147-M150 HydrophobicContact CD1-SD 3.76Å; L147-M150 PolarHBondContact O-N 2.81Å; L147-V151 WeakPolarHBondContact O-CG2 3.3Å; L147-V151 PolarHBondContact O-N 3.17Å; L147-L162 HydrophobicContact CD1-CB 3.94Å; L147-L162 HydrophobicContact CD1-CD1 4.27Å; L147-L162 HydrophobicContact CD1-CD2 4.08Å; L147-L162 HydrophobicContact CD1-CG 4.31Å; L147-L162 HydrophobicContact CD2-CD2 4.37Å; L147-L185 HydrophobicContact CD2-CB 3.86Å; L147-A189 HydrophobicContact CD2-CB 3.64Å; L147-A189 HydrophobicContact CG-CB 4.13Å; L147-L404 HydrophobicContact CD1-CD1 4.15Å; L147-V406 HydrophobicContact CD2-CG2 4.4Å
148	K	91.5	Very high	92	Very high	42 Å²	42	35 Å²	35	18%	0.183	18%	0.18	C	C	.	.	H	α-helix	trans	-59.7	-37.5	174.2	-175	173.7	-179.5	179.5	0	112.9	Y143 E144 T146 S282	Y143-K148 HydrophobicContact CD1-CB 4.31Å; Y143-K148 HydrophobicContact CE1-CB 3.79Å; Y143-K148 HydrophobicContact CE1-CD 4.46Å; Y143-K148 HydrophobicContact CE1-CG 4.17Å; Y143-K148 WeakPolarHBondContact O-CB 3.15Å; Y143-K148 PolarHBondContact O-N 3.33Å; E144-K148 HydrophobicContact CB-CD 4.33Å; E144-K148 HydrophobicContact CG-CD 4.07Å; T146-K148 VanDerWaalsContact C-N 3.33Å; T146-K148 PolarHBondContact O-N 2.88Å; K148-S282 PolarHBondContact NZ-O 2.93Å; K148-S282 PolarHBondContact NZ-OG 2.74Å
149	K	91.3	Very high	92	Very high	95 Å²	95	33.1 Å²	33.1	41%	0.413	17%	0.168	S	C	.	.	H	α-helix	trans	-68.4	-51.3	173.1	-161.9	-151.6	170.6	-161.8	0	110.4	L147 V151 N152 D153	L147-K149 VanDerWaalsContact C-N 3.33Å; L147-K149 PolarHBondContact O-N 2.98Å; K149-V151 PolarHBondContact O-N 3.03Å; K149-V151 VanDerWaalsContact O-N 3.13Å; K149-N152 WeakPolarHBondContact O-CA 3.23Å; K149-N152 VanDerWaalsContact O-CB 3.3Å; K149-N152 WeakPolarHBondContact O-CB 3.01Å; K149-N152 PolarHBondContact O-N 2.86Å; K149-D153 WeakPolarHBondContact CD-OD2 3.24Å; K149-D153 WeakPolarHBondContact CE-OD1 3.43Å; K149-D153 WeakPolarHBondContact CE-OD2 3.42Å; K149-D153 WeakPolarHBondContact CG-OD2 3.46Å; K149-D153 IonicContact NZ-OD1 3.87Å; K149-D153 IonicContact NZ-OD2 2.81Å; K149-D153 PolarHBondContact O-N 3.28Å
150	M	93	Very high	92.1	Very high	9 Å²	9	33.8 Å²	33.8	4%	0.044	17%	0.171	C	C	.	.	H	α-helix	trans	-58.3	-32	-175.5	-59.4	-173.5	119.3	0	0	113.7	L147 D153 V154 R160 L162 L404 C480	L147-M150 HydrophobicContact CD1-CB 4.05Å; L147-M150 HydrophobicContact CD1-CG 4.37Å; L147-M150 HydrophobicContact CD1-SD 3.76Å; L147-M150 PolarHBondContact O-N 2.81Å; M150-D153 WeakPolarHBondContact CA-OD2 3.31Å; M150-D153 PolarHBondContact O-N 3.36Å; M150-V154 WeakPolarHBondContact O-CB 3.2Å; M150-V154 WeakPolarHBondContact O-CG2 3.32Å; M150-V154 PolarHBondContact O-N 3.23Å; M150-R160 HydrophobicContact CB-CB 4.04Å; M150-R160 HydrophobicContact CB-CG 4.15Å; M150-R160 HydrophobicContact CE-CB 4.03Å; M150-R160 HydrophobicContact CG-CB 4.36Å; M150-R160 HydrophobicContact CG-CG 4.44Å; M150-L162 HydrophobicContact SD-CB 4.46Å; M150-L162 HydrophobicContact SD-CD1 4.24Å; M150-L404 HydrophobicContact CB-CD1 4.3Å; M150-C480 HydrophobicContact CE-CB 3.36Å; M150-C480 HydrophobicContact SD-CB 3.98Å
151	V	93.3	Very high	92.3	Very high	0 Å²	0	31.8 Å²	31.8	0%	0	16%	0.161	C	C	.	.	H	α-helix	trans	-65.7	-38.6	172.2	170.2	0	0	0	0	112	L147 K149 L155 A189 L193 K196 L404	L147-V151 WeakPolarHBondContact O-CG2 3.3Å; L147-V151 PolarHBondContact O-N 3.17Å; K149-V151 PolarHBondContact O-N 3.03Å; K149-V151 VanDerWaalsContact O-N 3.13Å; V151-L155 HydrophobicContact CG1-CD1 4.41Å; V151-L155 VanDerWaalsContact O-CG 3.27Å; V151-L155 WeakPolarHBondContact O-CG 3.29Å; V151-L155 PolarHBondContact O-N 3.36Å; V151-A189 HydrophobicContact CG2-CB 3.76Å; V151-L193 HydrophobicContact CG1-CB 4.2Å; V151-L193 HydrophobicContact CG1-CD1 4.13Å; V151-K196 HydrophobicContact CG1-CD 4.09Å; V151-L404 HydrophobicContact CG2-CD2 4.02Å
152	N	91.8	Very high	92.4	Very high	40 Å²	40	27 Å²	27	21%	0.214	14%	0.139	C	C	.	.	H	α-helix	trans	-67.7	-45.5	173.5	-58.7	-26	0	0	0	110.8	K149 V154 L155 K156 K196 C287	K149-N152 WeakPolarHBondContact O-CA 3.23Å; K149-N152 VanDerWaalsContact O-CB 3.3Å; K149-N152 WeakPolarHBondContact O-CB 3.01Å; K149-N152 PolarHBondContact O-N 2.86Å; N152-V154 VanDerWaalsContact C-N 3.32Å; N152-V154 PolarHBondContact O-N 3.27Å; N152-L155 CarbonylContact O-C 3.58Å; N152-L155 WeakPolarHBondContact O-CA 3.42Å; N152-L155 WeakPolarHBondContact O-CB 3.48Å; N152-L155 PolarHBondContact O-N 3.22Å; N152-L155 VanDerWaalsContact O-N 3.11Å; N152-K156 PolarHBondContact O-N 2.9Å; N152-K196 WeakPolarHBondContact OD1-CE 3.44Å; N152-K196 PolarHBondContact OD1-NZ 2.88Å; N152-C287 PolarHBondContact OD1-SG 3.44Å
153	D	91.7	Very high	92.5	Very high	13 Å²	13	27 Å²	27	7%	0.07	14%	0.139	C	C	.	.	H	α-helix	trans	-60.1	-42.4	-176.8	-55.6	-26.9	0	0	0	110.9	K149 M150 K156 G157 E158 R160	K149-D153 WeakPolarHBondContact CD-OD2 3.24Å; K149-D153 WeakPolarHBondContact CE-OD1 3.43Å; K149-D153 WeakPolarHBondContact CE-OD2 3.42Å; K149-D153 WeakPolarHBondContact CG-OD2 3.46Å; K149-D153 IonicContact NZ-OD1 3.87Å; K149-D153 IonicContact NZ-OD2 2.81Å; K149-D153 PolarHBondContact O-N 3.28Å; M150-D153 WeakPolarHBondContact CA-OD2 3.31Å; M150-D153 PolarHBondContact O-N 3.36Å; D153-K156 CarbonylContact O-C 3.53Å; D153-K156 WeakPolarHBondContact O-CA 3.48Å; D153-K156 PolarHBondContact O-N 3.3Å; D153-G157 PolarHBondContact O-N 3.1Å; D153-E158 HydrophobicContact CB-CB 4.3Å; D153-E158 WeakPolarHBondContact O-CB 3.41Å; D153-E158 PolarHBondContact O-N 3.49Å; D153-R160 HydrophobicContact CB-CG 3.86Å; D153-R160 VanDerWaalsContact CB-NE 3.3Å; D153-R160 IonicContact OD2-CZ 3.18Å; D153-R160 IonicContact OD2-NE 2.69Å; D153-R160 PolarHBondContact OD2-NE 3.41Å; D153-R160 IonicContact OD2-NH1 2.89Å; D153-R160 IonicContact OD2-NH2 2.92Å; D153-R160 PolarHBondContact OD2-NH2 2.87Å
154	V	93	Very high	92.5	Very high	2 Å²	2	27 Å²	27	1%	0.012	14%	0.139	C	C	.	.	H	α-helix	trans	-66.8	-36.6	175.6	171.9	0	0	0	0	112	M150 N152 K156 G157 E158 R160 V386 S402 L404	M150-V154 WeakPolarHBondContact O-CB 3.2Å; M150-V154 WeakPolarHBondContact O-CG2 3.32Å; M150-V154 PolarHBondContact O-N 3.23Å; N152-V154 VanDerWaalsContact C-N 3.32Å; N152-V154 PolarHBondContact O-N 3.27Å; V154-K156 PolarHBondContact O-N 2.89Å; V154-G157 PolarHBondContact O-N 2.7Å; V154-E158 VanDerWaalsContact CA-O 3.31Å; V154-E158 WeakPolarHBondContact CA-O 3.4Å; V154-E158 VanDerWaalsContact CG2-O 3.24Å; V154-E158 WeakPolarHBondContact CG2-O 3.34Å; V154-R160 HydrophobicContact CG2-CB 3.65Å; V154-R160 HydrophobicContact CG2-CG 3.72Å; V154-V386 HydrophobicContact CG1-CB 4.34Å; V154-V386 HydrophobicContact CG1-CG2 3.75Å; V154-S402 WeakPolarHBondContact O-CB 3.37Å; V154-S402 PolarHBondContact O-OG 3.36Å; V154-L404 HydrophobicContact CB-CB 4.49Å; V154-L404 HydrophobicContact CG1-CB 4.19Å; V154-L404 HydrophobicContact CG2-CB 3.85Å; V154-L404 HydrophobicContact CG2-CD1 4.29Å
155	L	91.4	Very high	92.6	Very high	4 Å²	4	24.3 Å²	24.3	2%	0.021	13%	0.126	C	C	.	.	H	α-helix	trans	-69.3	-15.2	172.3	-70.7	174.6	0	0	0	113.4	V151 N152 L193 K196 L197 L289 F295 V386 H388	V151-L155 HydrophobicContact CG1-CD1 4.41Å; V151-L155 VanDerWaalsContact O-CG 3.27Å; V151-L155 WeakPolarHBondContact O-CG 3.29Å; V151-L155 PolarHBondContact O-N 3.36Å; N152-L155 CarbonylContact O-C 3.58Å; N152-L155 WeakPolarHBondContact O-CA 3.42Å; N152-L155 WeakPolarHBondContact O-CB 3.48Å; N152-L155 PolarHBondContact O-N 3.22Å; N152-L155 VanDerWaalsContact O-N 3.11Å; L155-L193 HydrophobicContact CD1-CD1 4.13Å; L155-L193 HydrophobicContact CD2-CD1 3.68Å; L155-L193 HydrophobicContact CG-CD1 3.86Å; L155-K196 HydrophobicContact CD1-CB 3.62Å; L155-K196 HydrophobicContact CD1-CD 3.95Å; L155-K196 HydrophobicContact CD1-CG 4.4Å; L155-L197 HydrophobicContact CD2-CD1 4.08Å; L155-L197 HydrophobicContact CD2-CD2 3.54Å; L155-L197 HydrophobicContact CD2-CG 3.87Å; L155-L289 HydrophobicContact CB-CD2 3.71Å; L155-F295 HydrophobicContact CD2-CD1 4.45Å; L155-V386 HydrophobicContact CD2-CG1 4.39Å; L155-H388 PolarHBondContact O-CE1 3.44Å
156	K	90	Very high	92.7	Very high	114 Å²	114	22.6 Å²	22.6	50%	0.496	11%	0.108	S	C	.	.	T	Hydrogen-bonded Turn	trans	-94	8.4	168.8	-66.4	-166.6	175.1	-162.1	0	113.7	N152 D153 V154 D288	N152-K156 PolarHBondContact O-N 2.9Å; D153-K156 CarbonylContact O-C 3.53Å; D153-K156 WeakPolarHBondContact O-CA 3.48Å; D153-K156 PolarHBondContact O-N 3.3Å; V154-K156 PolarHBondContact O-N 2.89Å; K156-D288 WeakPolarHBondContact CE-O 3.48Å; K156-D288 IonicContact NZ-OD2 3.1Å; K156-D288 PolarHBondContact NZ-OD2 2.84Å
157	G	89.3	Confident	92.5	Very high	16 Å²	16	22.3 Å²	22.3	17%	0.165	11%	0.106	C	C	.	.	T	Hydrogen-bonded Turn	trans	95.2	1.9	177.8	0	0	0	0	0	115.3	D153 V154 H400 S402	D153-G157 PolarHBondContact O-N 3.1Å; V154-G157 PolarHBondContact O-N 2.7Å; G157-H400 PolarHBondContact O-CE1 3.09Å; G157-S402 VanDerWaalsContact C-CB 3.45Å; G157-S402 WeakPolarHBondContact O-CB 3.34Å
158	E	90.3	Very high	92.2	Very high	81 Å²	81	23.8 Å²	23.8	38%	0.379	12%	0.115	S	C	.	.			trans	-86.4	139.7	-177.5	-58.1	-178.8	-164.3	0	0	113.9	D153 V154 R160	D153-E158 HydrophobicContact CB-CB 4.3Å; D153-E158 WeakPolarHBondContact O-CB 3.41Å; D153-E158 PolarHBondContact O-N 3.49Å; V154-E158 VanDerWaalsContact CA-O 3.31Å; V154-E158 WeakPolarHBondContact CA-O 3.4Å; V154-E158 VanDerWaalsContact CG2-O 3.24Å; V154-E158 WeakPolarHBondContact CG2-O 3.34Å; E158-R160 IonicContact OE2-CZ 3.79Å; E158-R160 IonicContact OE2-NE 3.13Å; E158-R160 PolarHBondContact OE2-NE 3.2Å; E158-R160 IonicContact OE2-NH2 3.77Å; E158-R160 PolarHBondContact OE2-NH2 3.23Å
159	N	92.6	Very high	91.8	Very high	20 Å²	20	26.4 Å²	26.4	11%	0.107	13%	0.131	C	C	.	.			trans	-78.2	125.1	170.8	-68.3	-40.9	0	0	0	111	S402 E403 F472 R476 G477 T478	N159-S402 WeakPolarHBondContact OD1-CA 3.43Å; N159-E403 PolarHBondContact OD1-N 2.89Å; N159-F472 HydrophobicContact CB-CD1 4.47Å; N159-F472 HydrophobicContact CB-CE1 4.04Å; N159-R476 WeakPolarHBondContact CB-O 3.46Å; N159-R476 PolarHBondContact ND2-O 3.27Å; N159-G477 CarbonylContact O-C 3.55Å; N159-G477 WeakPolarHBondContact O-CA 3.49Å; N159-T478 PolarHBondContact O-N 3.34Å
160	R	94.9	Very high	91.7	Very high	15 Å²	15	21.9 Å²	21.9	6%	0.057	11%	0.112	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-130.2	127	-176	-66.2	-62.5	-175.4	154.2	1.1	111	E71 M150 D153 V154 E158 E403 L404 T405 T478	E71-R160 IonicContact OE2-NH1 2.79Å; M150-R160 HydrophobicContact CB-CB 4.04Å; M150-R160 HydrophobicContact CB-CG 4.15Å; M150-R160 HydrophobicContact CE-CB 4.03Å; M150-R160 HydrophobicContact CG-CB 4.36Å; M150-R160 HydrophobicContact CG-CG 4.44Å; D153-R160 HydrophobicContact CB-CG 3.86Å; D153-R160 VanDerWaalsContact CB-NE 3.3Å; D153-R160 IonicContact OD2-CZ 3.18Å; D153-R160 IonicContact OD2-NE 2.69Å; D153-R160 PolarHBondContact OD2-NE 3.41Å; D153-R160 IonicContact OD2-NH1 2.89Å; D153-R160 IonicContact OD2-NH2 2.92Å; D153-R160 PolarHBondContact OD2-NH2 2.87Å; V154-R160 HydrophobicContact CG2-CB 3.65Å; V154-R160 HydrophobicContact CG2-CG 3.72Å; E158-R160 IonicContact OE2-CZ 3.79Å; E158-R160 IonicContact OE2-NE 3.13Å; E158-R160 PolarHBondContact OE2-NE 3.2Å; E158-R160 IonicContact OE2-NH2 3.77Å; E158-R160 PolarHBondContact OE2-NH2 3.23Å; R160-E403 PolarHBondContact N-O 3.33Å; R160-L404 HydrophobicContact CB-CD1 4.09Å; R160-L404 WeakPolarHBondContact O-CA 3.39Å; R160-T405 PolarHBondContact O-N 3.4Å; R160-T478 WeakPolarHBondContact CD-OG1 3.34Å; R160-T478 PolarHBondContact NE-OG1 2.78Å; R160-T478 PolarHBondContact NH1-OG1 3.1Å
161	L	95.3	Very high	91.6	Very high	0 Å²	0	22.3 Å²	22.3	0%	0	12%	0.118	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-113.4	124.5	177.2	166.2	69.4	0	0	0	110.7	Y163 T405 L469 F472 T478 S479 C480	L161-Y163 HydrophobicContact CD2-CD1 4.03Å; L161-Y163 HydrophobicContact CD2-CE1 4.43Å; L161-Y163 HydrophobicContact CG-CD1 4.09Å; L161-T405 WeakPolarHBondContact CA-O 3.36Å; L161-T405 HydrophobicContact CD1-CG2 3.77Å; L161-L469 HydrophobicContact CD1-CD2 3.85Å; L161-L469 HydrophobicContact CD2-CD2 3.86Å; L161-F472 HydrophobicContact CB-CB 3.99Å; L161-F472 HydrophobicContact CB-CD1 3.48Å; L161-F472 VanDerWaalsContact CB-CD1 3.48Å; L161-F472 HydrophobicContact CB-CD2 4Å; L161-F472 HydrophobicContact CB-CE1 3.85Å; L161-F472 HydrophobicContact CB-CE2 4.34Å; L161-F472 HydrophobicContact CB-CG 3.55Å; L161-F472 HydrophobicContact CB-CZ 4.28Å; L161-F472 HydrophobicContact CD2-CB 3.73Å; L161-F472 HydrophobicContact CD2-CD2 3.83Å; L161-F472 HydrophobicContact CD2-CG 3.82Å; L161-F472 HydrophobicContact CG-CD2 4.36Å; L161-F472 HydrophobicContact CG-CG 4.27Å; L161-T478 PolarHBondContact N-O 2.83Å; L161-S479 CarbonylContact O-C 3.41Å; L161-S479 WeakPolarHBondContact O-CA 3.28Å; L161-C480 PolarHBondContact O-N 2.67Å
162	L	96.3	Very high	91.5	Very high	0 Å²	0	22.7 Å²	22.7	0%	0	12%	0.12	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-106.1	131.7	163.2	-168.5	86.4	0	0	0	109.8	L147 M150 I176 L185 T405 V406 C407 C480 V482	L147-L162 HydrophobicContact CD1-CB 3.94Å; L147-L162 HydrophobicContact CD1-CD1 4.27Å; L147-L162 HydrophobicContact CD1-CD2 4.08Å; L147-L162 HydrophobicContact CD1-CG 4.31Å; L147-L162 HydrophobicContact CD2-CD2 4.37Å; M150-L162 HydrophobicContact SD-CB 4.46Å; M150-L162 HydrophobicContact SD-CD1 4.24Å; L162-I176 HydrophobicContact CD2-CD1 3.97Å; L162-L185 HydrophobicContact CD2-CD1 3.68Å; L162-T405 PolarHBondContact N-O 3.29Å; L162-V406 HydrophobicContact CB-CG2 4.49Å; L162-V406 HydrophobicContact CD2-CG1 4.37Å; L162-V406 WeakPolarHBondContact O-CA 3.4Å; L162-C407 PolarHBondContact O-N 3.5Å; L162-C480 WeakPolarHBondContact CA-O 3.15Å; L162-C480 HydrophobicContact CD1-CB 4.01Å; L162-V482 HydrophobicContact CD1-CG2 3.82Å; L162-V482 HydrophobicContact CG-CG2 4.36Å
163	Y	95.7	Very high	91.4	Very high	1 Å²	1	22.3 Å²	22.3	0%	0.004	12%	0.119	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-132.3	133.7	168.6	62.6	-82.8	0	0	0	112.5	L161 C407 L409 F473 C480 M481 V482	L161-Y163 HydrophobicContact CD2-CD1 4.03Å; L161-Y163 HydrophobicContact CD2-CE1 4.43Å; L161-Y163 HydrophobicContact CG-CD1 4.09Å; Y163-C407 WeakPolarHBondContact CA-O 3.46Å; Y163-L409 HydrophobicContact CD2-CD1 3.84Å; Y163-F473 HydrophobicContact CE1-CZ 4.13Å; Y163-C480 WeakPolarHBondContact CD1-O 3.41Å; Y163-C480 PolarHBondContact N-O 3.11Å; Y163-M481 HydrophobicContact CD2-CB 4.47Å; Y163-M481 HydrophobicContact CD2-CG 4.08Å; Y163-M481 HydrophobicContact CE1-CB 4.17Å; Y163-M481 HydrophobicContact CE2-CB 3.85Å; Y163-M481 HydrophobicContact CE2-CE 4.28Å; Y163-M481 HydrophobicContact CE2-CG 3.48Å; Y163-M481 VanDerWaalsContact CE2-CG 3.48Å; Y163-M481 HydrophobicContact CE2-SD 3.79Å; Y163-M481 WeakPolarHBondContact O-CA 3.33Å; Y163-V482 PolarHBondContact O-N 2.77Å
164	T	95.4	Very high	91.4	Very high	0 Å²	0	25.1 Å²	25.1	0%	0	13%	0.129	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-88.6	142.3	170.4	40.8	0	0	0	0	110.8	T175 I176 C407 D408 L409 V482 N484	T164-T175 HydrophobicContact CG2-CG2 4.33Å; T164-I176 HydrophobicContact CG2-CD1 3.52Å; T164-I176 HydrophobicContact CG2-CG1 3.81Å; T164-I176 WeakPolarHBondContact OG1-CG1 3.31Å; T164-C407 PolarHBondContact N-O 2.92Å; T164-C407 PolarHBondContact OG1-O 2.96Å; T164-D408 WeakPolarHBondContact OG1-CA 3.14Å; T164-D408 PolarHBondContact OG1-OD1 3.11Å; T164-L409 VanDerWaalsContact O-CB 3.23Å; T164-L409 WeakPolarHBondContact O-CB 3.35Å; T164-L409 WeakPolarHBondContact O-CD1 3.33Å; T164-L409 VanDerWaalsContact O-CG 3.27Å; T164-L409 WeakPolarHBondContact O-CG 3.41Å; T164-L409 PolarHBondContact O-N 2.78Å; T164-V482 CarbonylContact C-O 3.58Å; T164-V482 VanDerWaalsContact CA-O 3.26Å; T164-V482 WeakPolarHBondContact CA-O 3.37Å; T164-V482 HydrophobicContact CG2-CB 3.88Å; T164-V482 HydrophobicContact CG2-CG1 4.14Å; T164-N484 WeakPolarHBondContact CG2-OD1 3.03Å
165	Y	94.1	Very high	91.5	Very high	15 Å²	15	25 Å²	25	6%	0.059	13%	0.128	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-141.8	154.9	-177.9	176.7	-100.5	0	0	0	111.4	L409 L434 M481 V482 N484 A498 F501	Y165-L409 HydrophobicContact CD2-CD1 4.08Å; Y165-L434 HydrophobicContact CD2-CD2 4.29Å; Y165-L434 HydrophobicContact CE2-CD1 4.31Å; Y165-L434 HydrophobicContact CE2-CD2 4.17Å; Y165-M481 VanDerWaalsContact CB-CE 3.49Å; Y165-M481 HydrophobicContact CD1-CE 3.28Å; Y165-M481 HydrophobicContact CE1-CE 4.14Å; Y165-M481 HydrophobicContact CG-CE 3.52Å; Y165-V482 PolarHBondContact N-O 3.46Å; Y165-N484 PolarHBondContact O-N 2.96Å; Y165-A498 HydrophobicContact CE1-CB 3.92Å; Y165-F501 HydrophobicContact CD1-CD1 4.02Å; Y165-F501 HydrophobicContact CD1-CE1 4.31Å; Y165-F501 HydrophobicContact CD2-CE1 4.49Å; Y165-F501 HydrophobicContact CE1-CB 4.12Å; Y165-F501 AromaticContact CE1-CD1 3.53Å; Y165-F501 HydrophobicContact CE1-CD1 3.53Å; Y165-F501 HydrophobicContact CE1-CE1 4.1Å; Y165-F501 AromaticContact CE1-CG 3.89Å; Y165-F501 HydrophobicContact CE1-CG 3.89Å; Y165-F501 HydrophobicContact CE2-CD1 4.41Å; Y165-F501 HydrophobicContact CE2-CE1 4.3Å; Y165-F501 HydrophobicContact CE2-CZ 4.42Å; Y165-F501 HydrophobicContact CG-CE1 4.49Å; Y165-F501 AromaticContact CZ-CD1 3.75Å; Y165-F501 AromaticContact CZ-CG 3.83Å
166	G	92.1	Very high	91.5	Very high	0 Å²	0	25.3 Å²	25.3	0%	0	13%	0.13	C	C	.	.	S	Bend	trans	132.5	-175.4	179.4	0	0	0	0	0	113	K172 S412	G166-K172 PolarHBondContact O-NZ 2.95Å; G166-S412 PolarHBondContact O-N 3.02Å; G166-S412 PolarHBondContact O-OG 2.61Å
167	V	88.6	Confident	91.5	Very high	2 Å²	2	21.9 Å²	21.9	1%	0.012	12%	0.116	C	C	.	.			trans	-69.6	161.9	-174	-62.3	0	0	0	0	113.1	S170 K172 S412 E413 I491 E494	V167-S170 WeakPolarHBondContact O-CB 3.41Å; V167-S170 PolarHBondContact O-N 3.09Å; V167-S170 PolarHBondContact O-OG 3.35Å; V167-K172 PolarHBondContact O-NZ 2.83Å; V167-S412 PolarHBondContact N-OG 3.04Å; V167-E413 WeakPolarHBondContact CA-OE2 3.25Å; V167-I491 HydrophobicContact CB-CD1 3.86Å; V167-I491 HydrophobicContact CB-CG1 4.4Å; V167-I491 HydrophobicContact CG1-CD1 4.34Å; V167-I491 HydrophobicContact CG1-CG1 4.37Å; V167-I491 HydrophobicContact CG2-CD1 3.64Å; V167-I491 HydrophobicContact CG2-CG1 4.14Å; V167-E494 HydrophobicContact CG1-CB 3.63Å
168	T	85.4	Confident	91.4	Very high	31 Å²	31	21.8 Å²	21.8	19%	0.19	12%	0.115	C	C	.	.	T	Hydrogen-bonded Turn	trans	-55.9	145.7	162.4	-73.3	0	0	0	0	110.2	S170 S376 E413	T168-S170 VanDerWaalsContact C-N 3.27Å; T168-S170 PolarHBondContact O-N 2.58Å; T168-S376 WeakPolarHBondContact OG1-CB 3.21Å; T168-S376 PolarHBondContact OG1-OG 2.74Å; T168-E413 WeakPolarHBondContact CB-OE1 3.5Å; T168-E413 PolarHBondContact N-OE2 3.38Å; T168-E413 VanDerWaalsContact OG1-CD 3.29Å; T168-E413 PolarHBondContact OG1-OE1 3.33Å; T168-E413 PolarHBondContact OG1-OE2 3.05Å
169	N	83.1	Confident	90.9	Very high	96 Å²	96	21.5 Å²	21.5	51%	0.513	12%	0.116	S	C	.	.	T	Hydrogen-bonded Turn	trans	57.5	30.2	-174.4	-161.5	27.5	0	0	0	115.2	R80 E86	R80-N169 PolarHBondContact NE-O 2.61Å; R80-N169 PolarHBondContact NH2-ND2 3.28Å; R80-N169 PolarHBondContact NH2-O 2.9Å; E86-N169 PolarHBondContact OE1-ND2 3.4Å
170	S	89.3	Confident	89.8	Confident	1 Å²	1	22.7 Å²	22.7	1%	0.007	13%	0.133	C	C	.	.	S	Bend	trans	-97.5	-6.8	167.5	61.8	0	0	0	0	114.4	V167 T168 N484	V167-S170 WeakPolarHBondContact O-CB 3.41Å; V167-S170 PolarHBondContact O-N 3.09Å; V167-S170 PolarHBondContact O-OG 3.35Å; T168-S170 VanDerWaalsContact C-N 3.27Å; T168-S170 PolarHBondContact O-N 2.58Å; S170-N484 WeakPolarHBondContact CB-O 3.18Å; S170-N484 WeakPolarHBondContact OG-CB 3.38Å; S170-N484 PolarHBondContact OG-O 3.49Å
171	G	89.3	Confident	88.9	Confident	17 Å²	17	31.6 Å²	31.6	18%	0.175	17%	0.167	C	C	.	.	S	Bend	trans	91.6	18.8	178.6	0	0	0	0	0	116.4	Y174 T175	G171-Y174 PolarHBondContact O-N 2.91Å; G171-T175 PolarHBondContact O-N 3.03Å; G171-T175 PolarHBondContact O-OG1 2.78Å
172	K	92.3	Very high	88.3	Confident	9 Å²	9	33.9 Å²	33.9	4%	0.039	18%	0.177	C	C	.	.	H	α-helix	trans	-49.6	-61.9	173.8	-60.9	-169.5	-63.9	-76.3	0	113	G166 V167 Y174 T175 I176 D408 L409 A410 N484	G166-K172 PolarHBondContact O-NZ 2.95Å; V167-K172 PolarHBondContact O-NZ 2.83Å; K172-Y174 VanDerWaalsContact C-N 3.31Å; K172-Y174 PolarHBondContact O-N 2.85Å; K172-T175 WeakPolarHBondContact O-CA 3.39Å; K172-T175 VanDerWaalsContact O-CB 3.3Å; K172-T175 WeakPolarHBondContact O-CB 3.5Å; K172-T175 PolarHBondContact O-N 2.83Å; K172-I176 PolarHBondContact O-N 2.72Å; K172-D408 WeakPolarHBondContact CB-OD1 3.39Å; K172-L409 WeakPolarHBondContact CE-O 2.87Å; K172-A410 WeakPolarHBondContact CE-O 3.49Å; K172-N484 WeakPolarHBondContact CA-OD1 3.43Å; K172-N484 HydrophobicContact CG-CB 3.84Å
173	T	89.7	Confident	88	Confident	31 Å²	31	34 Å²	34	19%	0.19	18%	0.178	C	C	.	.	H	α-helix	trans	-55.4	-41	175.8	-62.1	0	0	0	0	113.4	T175 I176 Q177 S375 D408	T173-T175 VanDerWaalsContact C-N 3.28Å; T173-T175 PolarHBondContact O-N 2.89Å; T173-I176 PolarHBondContact O-N 3.06Å; T173-Q177 WeakPolarHBondContact O-CB 3.38Å; T173-Q177 PolarHBondContact O-N 3.04Å; T173-S375 PolarHBondContact OG1-OG 2.82Å; T173-D408 VanDerWaalsContact CA-OD2 3.25Å; T173-D408 WeakPolarHBondContact CA-OD2 3.21Å; T173-D408 WeakPolarHBondContact CB-OD2 3.39Å; T173-D408 PolarHBondContact N-OD1 3.4Å; T173-D408 PolarHBondContact OG1-OD2 3.03Å
174	Y	91.3	Very high	87.8	Confident	72 Å²	72	34 Å²	34	28%	0.282	18%	0.178	S	C	.	.	H	α-helix	trans	-64.2	-34.4	174.9	168.4	-119.9	0	0	0	111.5	Q139 G171 K172 G178 E182	Q139-Y174 HydrophobicContact CG-CE2 4.33Å; Q139-Y174 PolarHBondContact NE2-O 2.85Å; G171-Y174 PolarHBondContact O-N 2.91Å; K172-Y174 VanDerWaalsContact C-N 3.31Å; K172-Y174 PolarHBondContact O-N 2.85Å; Y174-G178 WeakPolarHBondContact O-CA 3.48Å; Y174-G178 PolarHBondContact O-N 2.63Å; Y174-E182 PolarHBondContact OH-OE2 3.5Å
175	T	94.6	Very high	87.8	Confident	0 Å²	0	34 Å²	34	0%	0	18%	0.178	C	C	.	.	H	α-helix	trans	-69.8	-45.9	175.6	-51.5	0	0	0	0	111.2	R78 T164 G171 K172 T173 L185 V482 N484	R78-T175 PolarHBondContact NH1-OG1 2.89Å; T164-T175 HydrophobicContact CG2-CG2 4.33Å; G171-T175 PolarHBondContact O-N 3.03Å; G171-T175 PolarHBondContact O-OG1 2.78Å; K172-T175 WeakPolarHBondContact O-CA 3.39Å; K172-T175 VanDerWaalsContact O-CB 3.3Å; K172-T175 WeakPolarHBondContact O-CB 3.5Å; K172-T175 PolarHBondContact O-N 2.83Å; T173-T175 VanDerWaalsContact C-N 3.28Å; T173-T175 PolarHBondContact O-N 2.89Å; T175-L185 HydrophobicContact CG2-CD1 3.79Å; T175-L185 HydrophobicContact CG2-CG 4.23Å; T175-L185 WeakPolarHBondContact O-CG 3.45Å; T175-L185 PolarHBondContact O-N 3.19Å; T175-V482 HydrophobicContact CG2-CG1 4.15Å; T175-N484 PolarHBondContact OG1-ND2 2.92Å
176	I	93	Very high	87.7	Confident	11 Å²	11	33.5 Å²	33.5	6%	0.056	18%	0.177	C	C	.	.	H	α-helix	trans	-69.2	-55.3	179.1	-61.2	-52.7	0	0	0	112.6	L162 T164 K172 T173 G184 L185 L186 V406 D408	L162-I176 HydrophobicContact CD2-CD1 3.97Å; T164-I176 HydrophobicContact CG2-CD1 3.52Å; T164-I176 HydrophobicContact CG2-CG1 3.81Å; T164-I176 WeakPolarHBondContact OG1-CG1 3.31Å; K172-I176 PolarHBondContact O-N 2.72Å; T173-I176 PolarHBondContact O-N 3.06Å; I176-G184 CarbonylContact O-C 3.55Å; I176-L185 PolarHBondContact O-N 3.38Å; I176-L186 HydrophobicContact CG2-CB 4.18Å; I176-L186 HydrophobicContact CG2-CD2 4.4Å; I176-L186 WeakPolarHBondContact O-CB 3.29Å; I176-L186 PolarHBondContact O-N 2.88Å; I176-V406 HydrophobicContact CD1-CG1 3.78Å; I176-V406 HydrophobicContact CG2-CG1 3.84Å; I176-D408 HydrophobicContact CG1-CB 4.06Å
177	Q	88.9	Confident	87.7	Confident	41 Å²	41	33.7 Å²	33.7	19%	0.192	18%	0.178	C	C	.	.	T	Hydrogen-bonded Turn	trans	-96.7	-34.9	-171.2	-171.6	-179.8	1	0	0	113.1	T173 G184 R361	T173-Q177 WeakPolarHBondContact O-CB 3.38Å; T173-Q177 PolarHBondContact O-N 3.04Å; Q177-G184 PolarHBondContact O-N 2.96Å; Q177-R361 VanDerWaalsContact OE1-CZ 3.29Å
178	G	87.9	Confident	87.9	Confident	14 Å²	14	34.7 Å²	34.7	14%	0.144	18%	0.181	C	C	.	.	B	Isolated β-bridge	trans	84.3	-159.9	-170	0	0	0	0	0	113.6	Q139 Y174 E182	Q139-G178 VanDerWaalsContact NE2-CA 3.3Å; Y174-G178 WeakPolarHBondContact O-CA 3.48Å; Y174-G178 PolarHBondContact O-N 2.63Å; G178-E182 VanDerWaalsContact CA-O 3.24Å; G178-E182 WeakPolarHBondContact CA-O 3.41Å
179	N	79.8	Confident	88.3	Confident	76 Å²	76	33.3 Å²	33.3	41%	0.406	17%	0.173	S	C	.	.			trans	-124.9	174.8	166.8	68.2	54	0	0	0	108.8	R181 E182	N179-R181 PolarHBondContact O-N 3.37Å; N179-R181 VanDerWaalsContact O-N 3.14Å; N179-R181 WeakPolarHBondContact OD1-CA 3.43Å; N179-R181 WeakPolarHBondContact OD1-CB 3.44Å; N179-R181 PolarHBondContact OD1-N 3.23Å; N179-E182 PolarHBondContact N-O 2.94Å; N179-E182 CarbonylContact O-C 3.51Å; N179-E182 PolarHBondContact O-N 3.35Å; N179-E182 PolarHBondContact OD1-N 3.05Å
180	G	69.1	Low	88.7	Confident	45 Å²	45	28.8 Å²	28.8	46%	0.464	15%	0.149	S	C	.	.	S	Bend	trans	-60.7	-22.8	-176.8	0	0	0	0	0	115.2
181	R	75.8	Confident	88.8	Confident	202 Å²	202	30.2 Å²	30.2	76%	0.762	16%	0.157	S	C	*	.	S	Bend	trans	-90.5	-31.9	176.8	-59.1	-178.2	177.4	-170.2	-2.4	112.9	N179	N179-R181 PolarHBondContact O-N 3.37Å; N179-R181 VanDerWaalsContact O-N 3.14Å; N179-R181 WeakPolarHBondContact OD1-CA 3.43Å; N179-R181 WeakPolarHBondContact OD1-CB 3.44Å; N179-R181 PolarHBondContact OD1-N 3.23Å
182	E	82.7	Confident	88.8	Confident	48 Å²	48	29.9 Å²	29.9	22%	0.224	15%	0.152	C	C	.	.	S	Bend	trans	-134.5	100	-176.4	-154.3	-165.2	173.7	0	0	111.8	Q139 Y174 G178 N179	Q139-E182 HydrophobicContact CB-CG 4.02Å; Q139-E182 VanDerWaalsContact CB-OE1 3.25Å; Q139-E182 WeakPolarHBondContact CB-OE1 3.41Å; Q139-E182 HydrophobicContact CG-CB 4.3Å; Q139-E182 HydrophobicContact CG-CG 3.64Å; Q139-E182 WeakPolarHBondContact CG-OE1 3.43Å; Q139-E182 WeakPolarHBondContact CG-OE2 3.38Å; Q139-E182 PolarHBondContact N-OE1 3.37Å; Y174-E182 PolarHBondContact OH-OE2 3.5Å; G178-E182 VanDerWaalsContact CA-O 3.24Å; G178-E182 WeakPolarHBondContact CA-O 3.41Å; N179-E182 PolarHBondContact N-O 2.94Å; N179-E182 CarbonylContact O-C 3.51Å; N179-E182 PolarHBondContact O-N 3.35Å; N179-E182 PolarHBondContact OD1-N 3.05Å
183	A	89.4	Confident	88.8	Confident	3 Å²	3	29.6 Å²	29.6	3%	0.025	15%	0.151	C	C	.	.	B	Isolated β-bridge	trans	-58.6	138.2	-179.7	0	0	0	0	0	112.7	Q139 P187 R188 V274 L276	Q139-A183 WeakPolarHBondContact CB-O 3.16Å; A183-P187 HydrophobicContact CB-CB 4.31Å; A183-P187 HydrophobicContact CB-CG 3.94Å; A183-R188 HydrophobicContact CB-CG 4.32Å; A183-R188 PolarHBondContact O-NE 2.77Å; A183-V274 HydrophobicContact CB-CG1 3.96Å; A183-L276 HydrophobicContact CB-CD1 4.22Å; A183-L276 HydrophobicContact CB-CD2 3.74Å; A183-L276 HydrophobicContact CB-CG 4.03Å
184	G	92.4	Very high	88.9	Confident	0 Å²	0	29 Å²	29	0%	0	15%	0.146	C	C	.	.			trans	-81.4	-173	177.4	0	0	0	0	0	114.9	Q139 I176 Q177 L186 P187 R188	Q139-G184 VanDerWaalsContact NE2-CA 3.31Å; I176-G184 CarbonylContact O-C 3.55Å; Q177-G184 PolarHBondContact O-N 2.96Å; G184-L186 VanDerWaalsContact C-N 3.34Å; G184-L186 PolarHBondContact O-N 2.8Å; G184-P187 WeakPolarHBondContact O-CD 3.35Å; G184-P187 WeakPolarHBondContact O-CG 3.24Å; G184-R188 WeakPolarHBondContact O-CB 3.18Å; G184-R188 VanDerWaalsContact O-CG 3.3Å; G184-R188 WeakPolarHBondContact O-CG 3.5Å; G184-R188 PolarHBondContact O-N 2.89Å
185	L	94.4	Very high	88.7	Confident	1 Å²	1	29 Å²	29	1%	0.005	15%	0.146	C	C	.	.	H	α-helix	trans	-57	-44.2	-177.9	-65	-178.5	0	0	0	112.6	I142 Y143 L147 L162 T175 I176 R188 A189	I142-L185 HydrophobicContact CB-CD2 4.27Å; I142-L185 HydrophobicContact CG2-CD1 4.38Å; I142-L185 HydrophobicContact CG2-CD2 3.99Å; Y143-L185 HydrophobicContact CD2-CD2 4.43Å; L147-L185 HydrophobicContact CD2-CB 3.86Å; L162-L185 HydrophobicContact CD2-CD1 3.68Å; T175-L185 HydrophobicContact CG2-CD1 3.79Å; T175-L185 HydrophobicContact CG2-CG 4.23Å; T175-L185 WeakPolarHBondContact O-CG 3.45Å; T175-L185 PolarHBondContact O-N 3.19Å; I176-L185 PolarHBondContact O-N 3.38Å; L185-R188 PolarHBondContact O-N 2.85Å; L185-A189 WeakPolarHBondContact O-CB 3.4Å; L185-A189 PolarHBondContact O-N 3.38Å
186	L	93.4	Very high	88.4	Confident	4 Å²	4	30.9 Å²	30.9	2%	0.021	15%	0.154	C	C	.	.	H	α-helix	trans	-66.6	-53.4	-176.6	-179.7	57.3	0	0	0	113.3	I176 G184 R188 A189 L190 L357 F382 I384 V406	I176-L186 HydrophobicContact CG2-CB 4.18Å; I176-L186 HydrophobicContact CG2-CD2 4.4Å; I176-L186 WeakPolarHBondContact O-CB 3.29Å; I176-L186 PolarHBondContact O-N 2.88Å; G184-L186 VanDerWaalsContact C-N 3.34Å; G184-L186 PolarHBondContact O-N 2.8Å; L186-R188 VanDerWaalsContact C-N 3.31Å; L186-R188 PolarHBondContact O-N 2.75Å; L186-A189 WeakPolarHBondContact O-CB 3.34Å; L186-A189 PolarHBondContact O-N 2.77Å; L186-L190 HydrophobicContact CD1-CD1 4.44Å; L186-L190 HydrophobicContact CD1-CG 4.42Å; L186-L190 HydrophobicContact CG-CD1 4.42Å; L186-L190 WeakPolarHBondContact O-CG 2.99Å; L186-L190 PolarHBondContact O-N 2.96Å; L186-L357 HydrophobicContact CD2-CD1 3.89Å; L186-L357 HydrophobicContact CD2-CD2 3.7Å; L186-L357 HydrophobicContact CD2-CG 4.48Å; L186-L357 HydrophobicContact CG-CD2 4.07Å; L186-F382 HydrophobicContact CD1-CD1 3.76Å; L186-F382 HydrophobicContact CD1-CE1 4.06Å; L186-F382 HydrophobicContact CD1-CG 4.44Å; L186-F382 HydrophobicContact CD2-CB 3.95Å; L186-F382 HydrophobicContact CD2-CD1 3.92Å; L186-F382 HydrophobicContact CD2-CD2 4.2Å; L186-F382 HydrophobicContact CD2-CE1 4.46Å; L186-F382 HydrophobicContact CD2-CG 3.77Å; L186-F382 HydrophobicContact CG-CD1 4.42Å; L186-I384 HydrophobicContact CD1-CD1 4.23Å; L186-V406 HydrophobicContact CD1-CB 4.32Å; L186-V406 HydrophobicContact CD1-CG2 4.13Å
187	P	92.4	Very high	88.2	Confident	4 Å²	4	30.4 Å²	30.4	3%	0.026	15%	0.151	C	C	.	.	H	α-helix	trans	-61.7	-34.6	174.7	21	-31.5	0	0	0	113.6	A183 G184 L190 V191 W354	A183-P187 HydrophobicContact CB-CB 4.31Å; A183-P187 HydrophobicContact CB-CG 3.94Å; G184-P187 WeakPolarHBondContact O-CD 3.35Å; G184-P187 WeakPolarHBondContact O-CG 3.24Å; P187-L190 PolarHBondContact O-N 3.44Å; P187-V191 PolarHBondContact O-N 2.94Å; P187-V191 VanDerWaalsContact O-N 3.1Å; P187-W354 HydrophobicContact CB-CE3 3.8Å; P187-W354 HydrophobicContact CB-CZ3 3.68Å; P187-W354 HydrophobicContact CG-CE3 4.4Å; P187-W354 HydrophobicContact CG-CH2 4.45Å; P187-W354 HydrophobicContact CG-CZ3 3.79Å
188	R	92.5	Very high	87.9	Confident	23 Å²	23	35.9 Å²	35.9	9%	0.087	18%	0.177	C	C	.	.	H	α-helix	trans	-65.4	-39.7	173.3	-71.2	176.5	-173.3	-90.8	5	112	Y143 A183 G184 L185 L186 S192 L276	Y143-R188 HydrophobicContact CD1-CB 4.23Å; Y143-R188 HydrophobicContact CD2-CB 3.65Å; Y143-R188 HydrophobicContact CE2-CB 4.1Å; Y143-R188 HydrophobicContact CG-CB 3.76Å; A183-R188 HydrophobicContact CB-CG 4.32Å; A183-R188 PolarHBondContact O-NE 2.77Å; G184-R188 WeakPolarHBondContact O-CB 3.18Å; G184-R188 VanDerWaalsContact O-CG 3.3Å; G184-R188 WeakPolarHBondContact O-CG 3.5Å; G184-R188 PolarHBondContact O-N 2.89Å; L185-R188 PolarHBondContact O-N 2.85Å; L186-R188 VanDerWaalsContact C-N 3.31Å; L186-R188 PolarHBondContact O-N 2.75Å; R188-S192 VanDerWaalsContact O-CB 3.31Å; R188-S192 WeakPolarHBondContact O-CB 3.32Å; R188-S192 PolarHBondContact O-N 3.42Å; R188-L276 HydrophobicContact CG-CD2 3.81Å
189	A	92.9	Very high	87.6	Confident	1 Å²	1	39.2 Å²	39.2	1%	0.008	21%	0.211	C	C	.	.	H	α-helix	trans	-64	-42.5	173.7	0	0	0	0	0	112.3	Y143 L147 V151 L185 L186 S192 L193	Y143-A189 HydrophobicContact CE2-CB 4Å; L147-A189 HydrophobicContact CD2-CB 3.64Å; L147-A189 HydrophobicContact CG-CB 4.13Å; V151-A189 HydrophobicContact CG2-CB 3.76Å; L185-A189 WeakPolarHBondContact O-CB 3.4Å; L185-A189 PolarHBondContact O-N 3.38Å; L186-A189 WeakPolarHBondContact O-CB 3.34Å; L186-A189 PolarHBondContact O-N 2.77Å; A189-S192 PolarHBondContact O-N 2.84Å; A189-L193 VanDerWaalsContact O-CB 3.23Å; A189-L193 WeakPolarHBondContact O-CB 3.43Å; A189-L193 PolarHBondContact O-N 2.86Å
190	L	92.3	Very high	88	Confident	2 Å²	2	39.1 Å²	39.1	1%	0.01	21%	0.205	C	C	.	.	H	α-helix	trans	-60.4	-48.3	177.2	-70.9	168.8	0	0	0	111.9	L186 P187 S192 L193 F194 A353 F382 I384	L186-L190 HydrophobicContact CD1-CD1 4.44Å; L186-L190 HydrophobicContact CD1-CG 4.42Å; L186-L190 HydrophobicContact CG-CD1 4.42Å; L186-L190 WeakPolarHBondContact O-CG 2.99Å; L186-L190 PolarHBondContact O-N 2.96Å; P187-L190 PolarHBondContact O-N 3.44Å; L190-S192 PolarHBondContact O-N 2.87Å; L190-L193 PolarHBondContact O-N 2.86Å; L190-F194 WeakPolarHBondContact O-CD2 3.2Å; L190-F194 PolarHBondContact O-N 2.91Å; L190-F194 VanDerWaalsContact O-N 3.13Å; L190-A353 HydrophobicContact CD1-CB 3.81Å; L190-A353 HydrophobicContact CD2-CB 3.79Å; L190-A353 HydrophobicContact CG-CB 4.26Å; L190-F382 HydrophobicContact CD2-CE1 4.5Å; L190-I384 HydrophobicContact CD2-CD1 3.69Å; L190-I384 HydrophobicContact CD2-CG1 4.18Å; L190-I384 HydrophobicContact CG-CD1 4.48Å
191	V	90.6	Very high	89	Confident	31 Å²	31	40 Å²	40	19%	0.188	20%	0.199	C	C	.	.	H	α-helix	trans	-64.3	-41	176.8	168.5	0	0	0	0	112.2	P187 R195 L276 L281 A350	P187-V191 PolarHBondContact O-N 2.94Å; P187-V191 VanDerWaalsContact O-N 3.1Å; V191-R195 WeakPolarHBondContact O-CB 3.3Å; V191-R195 PolarHBondContact O-N 3.15Å; V191-R195 VanDerWaalsContact O-N 3.09Å; V191-L276 HydrophobicContact CB-CD1 4.32Å; V191-L276 HydrophobicContact CG2-CD1 3.64Å; V191-L281 HydrophobicContact CG1-CD1 4.02Å; V191-A350 HydrophobicContact CB-CB 4.46Å; V191-A350 HydrophobicContact CG2-CB 3.75Å
192	S	90.5	Very high	89.5	Confident	10 Å²	10	32.5 Å²	32.5	7%	0.07	17%	0.17	C	C	.	.	H	α-helix	trans	-65.6	-37.4	176.9	-173.8	0	0	0	0	112.9	Y143 R188 A189 L190 K196	Y143-S192 WeakPolarHBondContact OH-CB 3.29Å; Y143-S192 PolarHBondContact OH-OG 3.26Å; R188-S192 VanDerWaalsContact O-CB 3.31Å; R188-S192 WeakPolarHBondContact O-CB 3.32Å; R188-S192 PolarHBondContact O-N 3.42Å; A189-S192 PolarHBondContact O-N 2.84Å; L190-S192 PolarHBondContact O-N 2.87Å; S192-K196 WeakPolarHBondContact O-CB 3.12Å; S192-K196 WeakPolarHBondContact O-CD 3.45Å; S192-K196 VanDerWaalsContact O-CG 3.31Å; S192-K196 WeakPolarHBondContact O-CG 3.39Å; S192-K196 PolarHBondContact O-N 3.19Å; S192-K196 VanDerWaalsContact O-N 3.07Å
193	L	92.1	Very high	89.4	Confident	2 Å²	2	32.2 Å²	32.2	1%	0.01	18%	0.181	C	C	.	.	H	α-helix	trans	-62.3	-55.5	176.5	-177.4	74.1	0	0	0	110.8	V151 L155 A189 L190 R195 K196 L197 I297 I384 V386	V151-L193 HydrophobicContact CG1-CB 4.2Å; V151-L193 HydrophobicContact CG1-CD1 4.13Å; L155-L193 HydrophobicContact CD1-CD1 4.13Å; L155-L193 HydrophobicContact CD2-CD1 3.68Å; L155-L193 HydrophobicContact CG-CD1 3.86Å; A189-L193 VanDerWaalsContact O-CB 3.23Å; A189-L193 WeakPolarHBondContact O-CB 3.43Å; A189-L193 PolarHBondContact O-N 2.86Å; L190-L193 PolarHBondContact O-N 2.86Å; L193-R195 VanDerWaalsContact C-N 3.3Å; L193-R195 PolarHBondContact O-N 3Å; L193-K196 PolarHBondContact O-N 2.88Å; L193-K196 VanDerWaalsContact O-N 3.17Å; L193-L197 HydrophobicContact CD1-CD1 4.25Å; L193-L197 HydrophobicContact CG-CD1 4.03Å; L193-L197 WeakPolarHBondContact O-CG 3.44Å; L193-L197 PolarHBondContact O-N 3.14Å; L193-L197 VanDerWaalsContact O-N 3.09Å; L193-I297 HydrophobicContact CD2-CG2 4.05Å; L193-I384 HydrophobicContact CD2-CG2 3.9Å; L193-V386 HydrophobicContact CD1-CG2 4.49Å
194	F	90.9	Very high	89.1	Confident	20 Å²	20	34.2 Å²	34.2	9%	0.088	20%	0.197	C	C	.	.	H	α-helix	trans	-63.9	-33.3	-179.5	-82.7	-79.2	0	0	0	113.1	L190 L197 Q198 L201 I297 I347 A350	L190-F194 WeakPolarHBondContact O-CD2 3.2Å; L190-F194 PolarHBondContact O-N 2.91Å; L190-F194 VanDerWaalsContact O-N 3.13Å; F194-L197 CarbonylContact O-C 3.56Å; F194-L197 PolarHBondContact O-N 3.49Å; F194-Q198 PolarHBondContact O-N 3.28Å; F194-L201 HydrophobicContact CD1-CD1 3.97Å; F194-L201 HydrophobicContact CD1-CD2 4.16Å; F194-L201 HydrophobicContact CE1-CD1 4.18Å; F194-L201 HydrophobicContact CE1-CD2 4Å; F194-I297 HydrophobicContact CE1-CG1 4.46Å; F194-I297 HydrophobicContact CZ-CB 4.23Å; F194-I297 HydrophobicContact CZ-CG1 4.38Å; F194-I297 HydrophobicContact CZ-CG2 4.25Å; F194-I347 HydrophobicContact CE2-CD1 3.8Å; F194-I347 HydrophobicContact CE2-CG1 4.44Å; F194-I347 HydrophobicContact CZ-CB 4.24Å; F194-I347 HydrophobicContact CZ-CD1 3.81Å; F194-I347 HydrophobicContact CZ-CG1 3.94Å; F194-A350 HydrophobicContact CB-CB 4.31Å; F194-A350 HydrophobicContact CD2-CB 3.9Å; F194-A350 HydrophobicContact CG-CB 4.35Å
195	R	88.1	Confident	88.7	Confident	71 Å²	71	34.7 Å²	34.7	27%	0.268	20%	0.199	S	C	.	.	H	α-helix	trans	-64.9	-42.2	173.6	-168.4	-173.8	-57	-170.6	-1.5	112.5	V191 L193 L197 Q198 P278 L281	V191-R195 WeakPolarHBondContact O-CB 3.3Å; V191-R195 PolarHBondContact O-N 3.15Å; V191-R195 VanDerWaalsContact O-N 3.09Å; L193-R195 VanDerWaalsContact C-N 3.3Å; L193-R195 PolarHBondContact O-N 3Å; R195-L197 PolarHBondContact O-N 3.31Å; R195-Q198 WeakPolarHBondContact O-CB 3.42Å; R195-Q198 PolarHBondContact O-N 3.02Å; R195-P278 PolarHBondContact NH1-O 2.95Å; R195-P278 VanDerWaalsContact NH2-CA 3.35Å; R195-P278 PolarHBondContact NH2-O 2.58Å; R195-L281 PolarHBondContact NH1-O 3.4Å
196	K	87.5	Confident	88.3	Confident	40 Å²	40	35.8 Å²	35.8	17%	0.174	21%	0.205	C	C	.	.	H	α-helix	trans	-68.4	-21.9	176.5	-73.4	165.9	-179.5	-75.4	0	113	V151 N152 L155 S192 L193 C287	V151-K196 HydrophobicContact CG1-CD 4.09Å; N152-K196 WeakPolarHBondContact OD1-CE 3.44Å; N152-K196 PolarHBondContact OD1-NZ 2.88Å; L155-K196 HydrophobicContact CD1-CB 3.62Å; L155-K196 HydrophobicContact CD1-CD 3.95Å; L155-K196 HydrophobicContact CD1-CG 4.4Å; S192-K196 WeakPolarHBondContact O-CB 3.12Å; S192-K196 WeakPolarHBondContact O-CD 3.45Å; S192-K196 VanDerWaalsContact O-CG 3.31Å; S192-K196 WeakPolarHBondContact O-CG 3.39Å; S192-K196 PolarHBondContact O-N 3.19Å; S192-K196 VanDerWaalsContact O-N 3.07Å; L193-K196 PolarHBondContact O-N 2.88Å; L193-K196 VanDerWaalsContact O-N 3.17Å; K196-C287 PolarHBondContact NZ-SG 2.91Å
197	L	88.1	Confident	88.1	Confident	0 Å²	0	36 Å²	36	0%	0	21%	0.207	C	C	.	.	T	Hydrogen-bonded Turn	trans	-96.4	2.9	178.5	-69	175.6	0	0	0	114.4	L155 L193 F194 R195 G199 R200 L201 F295 I297	L155-L197 HydrophobicContact CD2-CD1 4.08Å; L155-L197 HydrophobicContact CD2-CD2 3.54Å; L155-L197 HydrophobicContact CD2-CG 3.87Å; L193-L197 HydrophobicContact CD1-CD1 4.25Å; L193-L197 HydrophobicContact CG-CD1 4.03Å; L193-L197 WeakPolarHBondContact O-CG 3.44Å; L193-L197 PolarHBondContact O-N 3.14Å; L193-L197 VanDerWaalsContact O-N 3.09Å; F194-L197 CarbonylContact O-C 3.56Å; F194-L197 PolarHBondContact O-N 3.49Å; R195-L197 PolarHBondContact O-N 3.31Å; L197-G199 PolarHBondContact O-N 2.87Å; L197-G199 VanDerWaalsContact O-N 3.14Å; L197-R200 PolarHBondContact O-N 3.28Å; L197-L201 HydrophobicContact CB-CD2 3.83Å; L197-L201 HydrophobicContact CB-CG 4.22Å; L197-L201 HydrophobicContact CD1-CD2 3.94Å; L197-L201 HydrophobicContact CG-CD2 4.5Å; L197-F295 HydrophobicContact CD1-CB 4.33Å; L197-F295 HydrophobicContact CD2-CB 3.62Å; L197-F295 HydrophobicContact CD2-CD1 3.98Å; L197-F295 HydrophobicContact CD2-CD2 3.41Å; L197-F295 VanDerWaalsContact CD2-CD2 3.41Å; L197-F295 HydrophobicContact CD2-CE1 4.49Å; L197-F295 HydrophobicContact CD2-CE2 4.03Å; L197-F295 HydrophobicContact CD2-CG 3.38Å; L197-I297 HydrophobicContact CD1-CD1 3.4Å; L197-I297 HydrophobicContact CD1-CG1 3.75Å
198	Q	83.3	Confident	87.9	Confident	157 Å²	157	37.1 Å²	37.1	73%	0.734	21%	0.211	S	C	*	.	T	Hydrogen-bonded Turn	trans	-58.5	120.1	-175.4	-172.5	171.9	-3.7	0	0	111	F194 R195	F194-Q198 PolarHBondContact O-N 3.28Å; R195-Q198 WeakPolarHBondContact O-CB 3.42Å; R195-Q198 PolarHBondContact O-N 3.02Å
199	G	82.6	Confident	87.8	Confident	83 Å²	83	36 Å²	36	86%	0.856	21%	0.207	S	C	*	.	T	Hydrogen-bonded Turn	trans	85	-5.8	-175.5	0	0	0	0	0	116	L197	L197-G199 PolarHBondContact O-N 2.87Å; L197-G199 VanDerWaalsContact O-N 3.14Å
200	R	87	Confident	87.4	Confident	75 Å²	75	37.6 Å²	37.6	28%	0.283	22%	0.215	S	C	.	.			trans	-114.7	13.5	177.6	-56.3	-166.8	-175.6	-163.7	6.6	114.2	L197 L289 E290 Q294 F295	L197-R200 PolarHBondContact O-N 3.28Å; R200-L289 PolarHBondContact NH1-O 3.31Å; R200-L289 PolarHBondContact NH2-O 2.97Å; R200-E290 PolarHBondContact NH1-O 3.5Å; R200-Q294 CarbonylContact O-C 3.58Å; R200-Q294 VanDerWaalsContact O-CA 3.3Å; R200-Q294 WeakPolarHBondContact O-CA 3.15Å; R200-F295 HydrophobicContact CB-CD2 3.9Å; R200-F295 HydrophobicContact CB-CE2 4.17Å; R200-F295 PolarHBondContact O-N 2.86Å
201	L	89.6	Confident	87.1	Confident	63 Å²	63	40 Å²	40	33%	0.33	23%	0.227	S	C	.	.	B	Isolated β-bridge	trans	-78.1	129.2	-178.7	-69.7	169.1	0	0	0	112.4	F194 L197 G203 I297	F194-L201 HydrophobicContact CD1-CD1 3.97Å; F194-L201 HydrophobicContact CD1-CD2 4.16Å; F194-L201 HydrophobicContact CE1-CD1 4.18Å; F194-L201 HydrophobicContact CE1-CD2 4Å; L197-L201 HydrophobicContact CB-CD2 3.83Å; L197-L201 HydrophobicContact CB-CG 4.22Å; L197-L201 HydrophobicContact CD1-CD2 3.94Å; L197-L201 HydrophobicContact CG-CD2 4.5Å; L201-G203 PolarHBondContact O-N 2.97Å; L201-I297 HydrophobicContact CD2-CG1 4.1Å
202	Y	87.6	Confident	86.6	Confident	44 Å²	44	39.4 Å²	39.4	17%	0.173	22%	0.221	C	C	.	.			trans	-79.7	104.9	171.7	-171.2	-93.3	0	0	0	110	A204 D206 L207 Q294 F295 Q346 V389	Y202-A204 HydrophobicContact CD1-CB 4.4Å; Y202-A204 HydrophobicContact CE1-CB 3.73Å; Y202-D206 WeakPolarHBondContact CE1-OD1 3.5Å; Y202-D206 PolarHBondContact OH-OD1 3.43Å; Y202-D206 VanDerWaalsContact OH-OD1 3.07Å; Y202-L207 HydrophobicContact CE1-CB 4.45Å; Y202-L207 HydrophobicContact CE1-CD1 3.9Å; Y202-L207 HydrophobicContact CE1-CG 4.18Å; Y202-L207 HydrophobicContact CE2-CD1 4.45Å; Y202-Q294 HydrophobicContact CD2-CB 4.28Å; Y202-F295 PolarHBondContact N-O 3.03Å; Y202-Q346 PolarHBondContact O-NE2 3.47Å; Y202-V389 HydrophobicContact CD2-CB 4.25Å; Y202-V389 HydrophobicContact CD2-CG1 4.01Å; Y202-V389 HydrophobicContact CD2-CG2 4.32Å; Y202-V389 HydrophobicContact CE2-CG1 3.91Å; Y202-V389 HydrophobicContact CG-CG2 4.33Å
203	G	79.8	Confident	86.3	Confident	43 Å²	43	42.4 Å²	42.4	44%	0.443	23%	0.234	S	C	.	.			trans	-81.9	-18.2	-169.5	0	0	0	0	0	116.3	L201 R348	L201-G203 PolarHBondContact O-N 2.97Å; G203-R348 PolarHBondContact O-NE 3.25Å; G203-R348 PolarHBondContact O-NH2 3.47Å
204	A	82.9	Confident	85.9	Confident	44 Å²	44	45 Å²	45	36%	0.364	25%	0.248	S	C	.	.			trans	-77.5	152.3	-178.4	0	0	0	0	0	111.9	Y202 D206 Q346	Y202-A204 HydrophobicContact CD1-CB 4.4Å; Y202-A204 HydrophobicContact CE1-CB 3.73Å; A204-D206 VanDerWaalsContact CB-OD1 3.26Å; A204-D206 WeakPolarHBondContact CB-OD1 3.45Å; A204-Q346 PolarHBondContact O-NE2 3.43Å; A204-Q346 PolarHBondContact O-OE1 3.24Å
205	M	83.6	Confident	85.7	Confident	10 Å²	10	46.1 Å²	46.1	5%	0.049	26%	0.256	C	S	.	.	S	Bend	trans	-103.4	10.3	-176.4	-55.1	-154.5	56.1	0	0	113.5	M223 E226 E227 Q346	M205-M223 HydrophobicContact CB-CG 4.29Å; M205-M223 HydrophobicContact CB-SD 4.4Å; M205-E226 HydrophobicContact CE-CB 3.98Å; M205-E227 HydrophobicContact SD-CB 3.8Å; M205-E227 HydrophobicContact SD-CG 4.28Å; M205-Q346 VanDerWaalsContact CA-OE1 3.29Å; M205-Q346 HydrophobicContact CE-CB 4.02Å; M205-Q346 VanDerWaalsContact CG-OE1 3.24Å
206	D	86.6	Confident	85.7	Confident	24 Å²	24	48.5 Å²	48.5	13%	0.128	27%	0.265	C	S	.	.	S	Bend	trans	-77.1	-23.6	-175.8	64.8	-46.6	0	0	0	112.9	Y202 A204 Q217 L218 M223	Y202-D206 WeakPolarHBondContact CE1-OD1 3.5Å; Y202-D206 PolarHBondContact OH-OD1 3.43Å; Y202-D206 VanDerWaalsContact OH-OD1 3.07Å; A204-D206 VanDerWaalsContact CB-OD1 3.26Å; A204-D206 WeakPolarHBondContact CB-OD1 3.45Å; D206-Q217 HydrophobicContact CB-CG 4.49Å; D206-Q217 CarbonylContact O-C 3.57Å; D206-Q217 WeakPolarHBondContact O-CA 3.14Å; D206-Q217 PolarHBondContact OD2-NE2 3.06Å; D206-L218 PolarHBondContact O-N 3.28Å; D206-M223 HydrophobicContact CB-CE 3.88Å; D206-M223 HydrophobicContact CB-SD 3.69Å
207	L	88.3	Confident	85.7	Confident	10 Å²	10	53.3 Å²	53.3	5%	0.052	29%	0.288	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-102.8	104.4	179	-59.3	177.6	0	0	0	112	Y202 V215 Q217 W298 L387 V389 M399	Y202-L207 HydrophobicContact CE1-CB 4.45Å; Y202-L207 HydrophobicContact CE1-CD1 3.9Å; Y202-L207 HydrophobicContact CE1-CG 4.18Å; Y202-L207 HydrophobicContact CE2-CD1 4.45Å; L207-V215 HydrophobicContact CB-CG1 4.33Å; L207-V215 HydrophobicContact CD2-CG1 4.46Å; L207-Q217 HydrophobicContact CD2-CG 4.47Å; L207-W298 WeakPolarHBondContact O-CZ2 3.42Å; L207-W298 PolarHBondContact O-NE1 2.96Å; L207-L387 HydrophobicContact CB-CD2 3.79Å; L207-V389 HydrophobicContact CD1-CG1 4.1Å; L207-V389 HydrophobicContact CD1-CG2 3.96Å; L207-M399 HydrophobicContact CD1-CE 3.47Å; L207-M399 VanDerWaalsContact CD1-CE 3.47Å; L207-M399 HydrophobicContact CD1-SD 4.05Å; L207-M399 HydrophobicContact CD2-CE 3.85Å; L207-M399 HydrophobicContact CD2-SD 4.17Å; L207-M399 HydrophobicContact CG-CE 4.32Å
208	K	89.5	Confident	85.7	Confident	26 Å²	26	53.8 Å²	53.8	11%	0.113	29%	0.291	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-109.2	126.5	-179.4	-178.4	160.6	-179.4	165.7	0	112.4	R216 L218 E226 W298	K208-R216 PolarHBondContact N-O 3.24Å; K208-R216 PolarHBondContact O-N 3.29Å; K208-L218 HydrophobicContact CB-CD1 3.83Å; K208-L218 HydrophobicContact CB-CD2 3.98Å; K208-L218 HydrophobicContact CB-CG 3.85Å; K208-L218 HydrophobicContact CD-CD1 3.95Å; K208-L218 HydrophobicContact CD-CD2 4.38Å; K208-E226 HydrophobicContact CD-CG 4.48Å; K208-E226 IonicContact NZ-OE1 2.76Å; K208-E226 PolarHBondContact NZ-OE1 3.35Å; K208-E226 IonicContact NZ-OE2 3.63Å; K208-E226 PolarHBondContact NZ-OE2 2.9Å; K208-W298 HydrophobicContact CB-CH2 3.83Å; K208-W298 HydrophobicContact CB-CZ2 4.04Å; K208-W298 HydrophobicContact CB-CZ3 4.43Å; K208-W298 HydrophobicContact CD-CH2 3.88Å; K208-W298 HydrophobicContact CD-CZ3 3.82Å; K208-W298 HydrophobicContact CG-CE3 4.43Å; K208-W298 HydrophobicContact CG-CH2 3.74Å; K208-W298 HydrophobicContact CG-CZ2 4.28Å; K208-W298 HydrophobicContact CG-CZ3 3.83Å
209	P	89.6	Confident	86	Confident	0 Å²	0	51.6 Å²	51.6	0%	0	28%	0.284	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-69.8	140	172.9	30.4	-35.4	0	0	0	110.9	W298 I401	P209-W298 VanDerWaalsContact CD-CD2 3.47Å; P209-W298 VanDerWaalsContact CD-CE2 3.45Å; P209-W298 HydrophobicContact CG-CB 3.93Å; P209-W298 HydrophobicContact CG-CD2 3.92Å; P209-W298 HydrophobicContact CG-CE3 4.49Å; P209-W298 HydrophobicContact CG-CG 3.62Å; P209-I401 HydrophobicContact CB-CD1 3.73Å
210	I	85.2	Confident	86.2	Confident	35 Å²	35	53.4 Å²	53.4	18%	0.179	27%	0.274	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-139	167.1	-179.4	53.7	155.5	0	0	0	110.1	Y212 D214 R216	I210-Y212 PolarHBondContact O-N 2.73Å; I210-D214 HydrophobicContact CD1-CB 3.84Å; I210-D214 HydrophobicContact CG1-CB 3.64Å; I210-D214 VanDerWaalsContact CG1-O 3.31Å; I210-D214 WeakPolarHBondContact CG1-O 3.48Å; I210-D214 PolarHBondContact N-O 2.69Å; I210-D214 PolarHBondContact O-N 2.7Å; I210-R216 HydrophobicContact CD1-CB 3.97Å; I210-R216 HydrophobicContact CG1-CB 4.25Å; I210-R216 HydrophobicContact CG2-CB 4.42Å
211	M	85.1	Confident	86.2	Confident	53 Å²	53	53.4 Å²	53.4	26%	0.261	29%	0.286	S	S	.	.	T	Hydrogen-bonded Turn	trans	52.2	-136.7	179.7	-50.2	-67.3	-73.8	0	0	111.6	D214 D332 Y338 R385	M211-D214 HydrophobicContact CB-CB 4.13Å; M211-D214 HydrophobicContact CG-CB 4.1Å; M211-D214 WeakPolarHBondContact CG-OD2 3.43Å; M211-D332 HydrophobicContact CB-CB 4.44Å; M211-D332 HydrophobicContact CE-CB 3.77Å; M211-Y338 HydrophobicContact CE-CD1 4.42Å; M211-Y338 HydrophobicContact CE-CE1 3.54Å; M211-Y338 HydrophobicContact CE-CE2 4.5Å; M211-Y338 WeakPolarHBondContact CE-OH 3.37Å; M211-Y338 HydrophobicContact SD-CE1 4.03Å; M211-Y338 HydrophobicContact SD-CE2 3.9Å; M211-Y338 VanDerWaalsContact SD-CZ 3.53Å; M211-Y338 PolarHBondContact SD-OH 2.91Å; M211-R385 PolarHBondContact O-NH1 2.93Å; M211-R385 PolarHBondContact O-NH2 3.49Å
212	Y	81.1	Confident	86.2	Confident	18 Å²	18	53.9 Å²	53.9	7%	0.071	29%	0.286	C	S	.	.	T	Hydrogen-bonded Turn	trans	-88.7	-56.5	170.2	-169.4	-116.4	0	0	0	112.1	I210 D332 N336 R385 R476	I210-Y212 PolarHBondContact O-N 2.73Å; Y212-D332 WeakPolarHBondContact CB-OD2 3.37Å; Y212-N336 HydrophobicContact CD1-CB 3.67Å; Y212-N336 VanDerWaalsContact CD1-ND2 3.3Å; Y212-N336 WeakPolarHBondContact CD1-ND2 3.26Å; Y212-N336 HydrophobicContact CD2-CB 4.25Å; Y212-N336 HydrophobicContact CE1-CB 4.27Å; Y212-N336 HydrophobicContact CG-CB 3.66Å; Y212-R385 PolarHBondContact O-NH1 3.47Å; Y212-R385 PolarHBondContact O-NH2 3.17Å; Y212-R476 VanDerWaalsContact CE1-NH1 3.32Å; Y212-R476 PolarHBondContact OH-NH1 2.66Å; Y212-R476 VanDerWaalsContact OH-NH1 3.08Å
213	Q	82.9	Confident	86.2	Confident	73 Å²	73	53.9 Å²	53.9	34%	0.341	29%	0.288	S	S	.	.	T	Hydrogen-bonded Turn	trans	-123.5	-4.7	-176.1	-79.7	175.4	-25.5	0	0	115	I401	Q213-I401 WeakPolarHBondContact O-CD1 3.48Å
214	D	84.7	Confident	86.6	Confident	55 Å²	55	58.6 Å²	58.6	29%	0.294	30%	0.297	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-70.2	145.6	-178.4	-76.8	-23.7	0	0	0	111.1	I210 M211 K333	I210-D214 HydrophobicContact CD1-CB 3.84Å; I210-D214 HydrophobicContact CG1-CB 3.64Å; I210-D214 VanDerWaalsContact CG1-O 3.31Å; I210-D214 WeakPolarHBondContact CG1-O 3.48Å; I210-D214 PolarHBondContact N-O 2.69Å; I210-D214 PolarHBondContact O-N 2.7Å; M211-D214 HydrophobicContact CB-CB 4.13Å; M211-D214 HydrophobicContact CG-CB 4.1Å; M211-D214 WeakPolarHBondContact CG-OD2 3.43Å; D214-K333 IonicContact OD2-NZ 2.8Å
215	V	86.8	Confident	86.8	Confident	44 Å²	44	60.1 Å²	60.1	27%	0.267	30%	0.302	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-115.1	141.9	170	-177.4	0	0	0	0	109.1	L207 L387 M399 I401	L207-V215 HydrophobicContact CB-CG1 4.33Å; L207-V215 HydrophobicContact CD2-CG1 4.46Å; V215-L387 HydrophobicContact CG1-CD2 4.22Å; V215-L387 HydrophobicContact CG2-CD1 3.65Å; V215-M399 HydrophobicContact CB-SD 4.42Å; V215-M399 HydrophobicContact CG1-SD 3.98Å; V215-M399 HydrophobicContact CG2-CB 4.28Å; V215-I401 HydrophobicContact CG2-CD1 3.86Å; V215-I401 HydrophobicContact CG2-CG1 4.18Å
216	R	88.8	Confident	87	Confident	121 Å²	121	60.9 Å²	60.9	46%	0.457	31%	0.305	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-121.8	135.7	172.7	-164.6	-167.4	-60.6	147.2	4.8	110.7	K208 I210	K208-R216 PolarHBondContact N-O 3.24Å; K208-R216 PolarHBondContact O-N 3.29Å; I210-R216 HydrophobicContact CD1-CB 3.97Å; I210-R216 HydrophobicContact CG1-CB 4.25Å; I210-R216 HydrophobicContact CG2-CB 4.42Å
217	Q	87.2	Confident	87.1	Confident	141 Å²	141	62.8 Å²	62.8	66%	0.659	31%	0.313	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-77.7	133	165.3	-162.1	167.4	33.3	0	0	110.3	D206 L207	D206-Q217 HydrophobicContact CB-CG 4.49Å; D206-Q217 CarbonylContact O-C 3.57Å; D206-Q217 WeakPolarHBondContact O-CA 3.14Å; D206-Q217 PolarHBondContact OD2-NE2 3.06Å; L207-Q217 HydrophobicContact CD2-CG 4.47Å
218	L	87.1	Confident	87.1	Confident	10 Å²	10	68 Å²	68	5%	0.052	34%	0.34	C	S	.	.	P	Polyproline II helix	trans	-99.6	143.5	-176.3	-63.6	-168.3	0	0	0	112.3	D206 K208 E222 M223 E226	D206-L218 PolarHBondContact O-N 3.28Å; K208-L218 HydrophobicContact CB-CD1 3.83Å; K208-L218 HydrophobicContact CB-CD2 3.98Å; K208-L218 HydrophobicContact CB-CG 3.85Å; K208-L218 HydrophobicContact CD-CD1 3.95Å; K208-L218 HydrophobicContact CD-CD2 4.38Å; L218-E222 HydrophobicContact CB-CB 4.05Å; L218-E222 HydrophobicContact CD1-CB 4.4Å; L218-E222 HydrophobicContact CD2-CB 4.38Å; L218-E222 WeakPolarHBondContact CD2-OE2 3.17Å; L218-M223 HydrophobicContact CB-CG 3.96Å; L218-E226 HydrophobicContact CD1-CG 3.83Å
219	D	89.4	Confident	86.9	Confident	112 Å²	112	71 Å²	71	60%	0.599	35%	0.351	S	S	*	.	P	Polyproline II helix	trans	-69.9	159.1	172.4	-87.4	-32.6	0	0	0	112.8	S221 E222 M223	D219-S221 PolarHBondContact O-N 3.11Å; D219-E222 HydrophobicContact CB-CG 4.34Å; D219-E222 PolarHBondContact N-OE2 3.32Å; D219-E222 PolarHBondContact O-N 3.26Å; D219-M223 PolarHBondContact O-N 3.47Å
220	N	87.1	Confident	86.9	Confident	121 Å²	121	71.8 Å²	71.8	65%	0.647	35%	0.353	S	S	*	.	H	α-helix	trans	-57.5	-18.5	173.9	-80.9	-56.7	0	0	0	114.7	K224	N220-K224 VanDerWaalsContact O-CD 3.29Å; N220-K224 WeakPolarHBondContact O-CD 3.3Å; N220-K224 VanDerWaalsContact O-CG 3.29Å; N220-K224 WeakPolarHBondContact O-CG 3.08Å
221	S	88.3	Confident	86.9	Confident	75 Å²	75	72.8 Å²	72.8	52%	0.524	36%	0.359	S	S	.	.	H	α-helix	trans	-84.4	-42.3	171.9	47	0	0	0	0	112.2	D219 T225	D219-S221 PolarHBondContact O-N 3.11Å; S221-T225 PolarHBondContact O-N 3.37Å; S221-T225 VanDerWaalsContact O-N 3.15Å; S221-T225 PolarHBondContact O-OG1 3.24Å
222	E	88.3	Confident	87	Confident	73 Å²	73	73.1 Å²	73.1	34%	0.341	37%	0.367	S	S	.	.	H	α-helix	trans	-67.3	-47.2	176.9	-66.8	-170.8	121.8	0	0	111.1	L218 D219 K224 T225 E226	L218-E222 HydrophobicContact CB-CB 4.05Å; L218-E222 HydrophobicContact CD1-CB 4.4Å; L218-E222 HydrophobicContact CD2-CB 4.38Å; L218-E222 WeakPolarHBondContact CD2-OE2 3.17Å; D219-E222 HydrophobicContact CB-CG 4.34Å; D219-E222 PolarHBondContact N-OE2 3.32Å; D219-E222 PolarHBondContact O-N 3.26Å; E222-K224 VanDerWaalsContact C-N 3.29Å; E222-K224 PolarHBondContact O-N 2.85Å; E222-T225 CarbonylContact O-C 3.56Å; E222-T225 WeakPolarHBondContact O-CA 3.5Å; E222-T225 VanDerWaalsContact O-CB 3.31Å; E222-T225 WeakPolarHBondContact O-CB 3.3Å; E222-T225 PolarHBondContact O-N 3.31Å; E222-E226 WeakPolarHBondContact O-CG 3.49Å; E222-E226 PolarHBondContact O-N 3.24Å
223	M	88.1	Confident	87.1	Confident	43 Å²	43	72.5 Å²	72.5	21%	0.212	37%	0.365	C	S	.	.	H	α-helix	trans	-52.7	-44.8	175.1	-76.6	-163.9	-99.2	0	0	112.5	M205 D206 L218 D219 T225 E226 E227	M205-M223 HydrophobicContact CB-CG 4.29Å; M205-M223 HydrophobicContact CB-SD 4.4Å; D206-M223 HydrophobicContact CB-CE 3.88Å; D206-M223 HydrophobicContact CB-SD 3.69Å; L218-M223 HydrophobicContact CB-CG 3.96Å; D219-M223 PolarHBondContact O-N 3.47Å; M223-T225 VanDerWaalsContact C-N 3.3Å; M223-T225 PolarHBondContact O-N 3.03Å; M223-E226 PolarHBondContact O-N 3.42Å; M223-E227 PolarHBondContact O-N 3.35Å
224	K	87.6	Confident	87	Confident	142 Å²	142	69.5 Å²	69.5	62%	0.617	35%	0.351	S	S	*	.	H	α-helix	trans	-64.3	-35.8	175.8	-71.9	174	-173	175.5	0	112	N220 E222 I228	N220-K224 VanDerWaalsContact O-CD 3.29Å; N220-K224 WeakPolarHBondContact O-CD 3.3Å; N220-K224 VanDerWaalsContact O-CG 3.29Å; N220-K224 WeakPolarHBondContact O-CG 3.08Å; E222-K224 VanDerWaalsContact C-N 3.29Å; E222-K224 PolarHBondContact O-N 2.85Å; K224-I228 WeakPolarHBondContact O-CB 3.43Å; K224-I228 WeakPolarHBondContact O-CD1 3.24Å; K224-I228 WeakPolarHBondContact O-CG1 3.09Å; K224-I228 PolarHBondContact O-N 2.78Å
225	T	88.1	Confident	86.5	Confident	77 Å²	77	72.5 Å²	72.5	47%	0.472	36%	0.362	S	S	.	.	H	α-helix	trans	-69	-41.5	177.3	-55	0	0	0	0	111.4	S221 E222 M223 R229	S221-T225 PolarHBondContact O-N 3.37Å; S221-T225 VanDerWaalsContact O-N 3.15Å; S221-T225 PolarHBondContact O-OG1 3.24Å; E222-T225 CarbonylContact O-C 3.56Å; E222-T225 WeakPolarHBondContact O-CA 3.5Å; E222-T225 VanDerWaalsContact O-CB 3.31Å; E222-T225 WeakPolarHBondContact O-CB 3.3Å; E222-T225 PolarHBondContact O-N 3.31Å; M223-T225 VanDerWaalsContact C-N 3.3Å; M223-T225 PolarHBondContact O-N 3.03Å; T225-R229 WeakPolarHBondContact O-CB 3.39Å; T225-R229 PolarHBondContact O-N 3.39Å
226	E	88.1	Confident	85.4	Confident	25 Å²	25	73.8 Å²	73.8	12%	0.117	36%	0.364	C	S	.	.	H	α-helix	trans	-64.7	-43.8	173.4	-64	-59.9	145.5	0	0	112	M205 K208 L218 E222 M223 R229 R230	M205-E226 HydrophobicContact CE-CB 3.98Å; K208-E226 HydrophobicContact CD-CG 4.48Å; K208-E226 IonicContact NZ-OE1 2.76Å; K208-E226 PolarHBondContact NZ-OE1 3.35Å; K208-E226 IonicContact NZ-OE2 3.63Å; K208-E226 PolarHBondContact NZ-OE2 2.9Å; L218-E226 HydrophobicContact CD1-CG 3.83Å; E222-E226 WeakPolarHBondContact O-CG 3.49Å; E222-E226 PolarHBondContact O-N 3.24Å; M223-E226 PolarHBondContact O-N 3.42Å; E226-R229 PolarHBondContact O-N 3.25Å; E226-R229 IonicContact OE1-CZ 2.78Å; E226-R229 IonicContact OE1-NH1 3.23Å; E226-R229 PolarHBondContact OE1-NH1 2.92Å; E226-R229 IonicContact OE2-NH1 3.8Å; E226-R229 PolarHBondContact OE2-NH1 2.86Å; E226-R230 WeakPolarHBondContact O-CB 3.13Å; E226-R230 PolarHBondContact O-N 3.13Å
227	E	87.8	Confident	83.7	Confident	65 Å²	65	69.4 Å²	69.4	30%	0.304	35%	0.35	S	S	.	.	H	α-helix	trans	-68.8	-35.5	177.5	-175	144.4	-117.9	0	0	112.5	M205 M223 R230 N231 R348	M205-E227 HydrophobicContact SD-CB 3.8Å; M205-E227 HydrophobicContact SD-CG 4.28Å; M223-E227 PolarHBondContact O-N 3.35Å; E227-R230 PolarHBondContact O-N 2.8Å; E227-R230 IonicContact OE1-CZ 3.25Å; E227-R230 IonicContact OE1-NE 2.79Å; E227-R230 IonicContact OE1-NH2 2.73Å; E227-R230 PolarHBondContact OE1-NH2 3.47Å; E227-N231 VanDerWaalsContact CG-ND2 3.3Å; E227-N231 WeakPolarHBondContact CG-ND2 3.46Å; E227-N231 VanDerWaalsContact O-CB 3.23Å; E227-N231 WeakPolarHBondContact O-CB 3.48Å; E227-N231 PolarHBondContact O-N 2.8Å; E227-N231 PolarHBondContact O-ND2 3.05Å; E227-N231 VanDerWaalsContact O-ND2 3.09Å; E227-R348 IonicContact OE1-CZ 2.96Å; E227-R348 IonicContact OE1-NH1 3.76Å; E227-R348 PolarHBondContact OE1-NH1 2.95Å; E227-R348 IonicContact OE1-NH2 3.5Å
228	I	87.9	Confident	82.1	Confident	120 Å²	120	68.6 Å²	68.6	62%	0.615	35%	0.346	S	S	*	.	H	α-helix	trans	-61.9	-44.6	170.6	-72.9	164.5	0	0	0	110.5	K224 N231 S232	K224-I228 WeakPolarHBondContact O-CB 3.43Å; K224-I228 WeakPolarHBondContact O-CD1 3.24Å; K224-I228 WeakPolarHBondContact O-CG1 3.09Å; K224-I228 PolarHBondContact O-N 2.78Å; I228-N231 PolarHBondContact O-N 2.98Å; I228-S232 WeakPolarHBondContact O-CB 3.39Å; I228-S232 PolarHBondContact O-N 3.23Å
229	R	86.7	Confident	80.2	Confident	89 Å²	89	72.7 Å²	72.7	34%	0.336	37%	0.368	S	S	.	.	H	α-helix	trans	-61	-49.4	176.6	-173.1	-176.1	-64.8	112.2	-1	111.6	T225 E226 N231 S232 L233	T225-R229 WeakPolarHBondContact O-CB 3.39Å; T225-R229 PolarHBondContact O-N 3.39Å; E226-R229 PolarHBondContact O-N 3.25Å; E226-R229 IonicContact OE1-CZ 2.78Å; E226-R229 IonicContact OE1-NH1 3.23Å; E226-R229 PolarHBondContact OE1-NH1 2.92Å; E226-R229 IonicContact OE2-NH1 3.8Å; E226-R229 PolarHBondContact OE2-NH1 2.86Å; R229-N231 PolarHBondContact O-N 2.74Å; R229-S232 PolarHBondContact O-N 3.37Å; R229-L233 HydrophobicContact CG-CD1 4.38Å; R229-L233 PolarHBondContact O-N 3.11Å
230	R	87.6	Confident	78.2	Confident	15 Å²	15	72.6 Å²	72.6	6%	0.057	36%	0.364	C	S	.	.	H	α-helix	trans	-54.3	-51.4	175.6	-173.5	-178.8	77.4	78.2	6	111.1	E226 E227 S232 L233 L234 I345 Q346 E352	E226-R230 WeakPolarHBondContact O-CB 3.13Å; E226-R230 PolarHBondContact O-N 3.13Å; E227-R230 PolarHBondContact O-N 2.8Å; E227-R230 IonicContact OE1-CZ 3.25Å; E227-R230 IonicContact OE1-NE 2.79Å; E227-R230 IonicContact OE1-NH2 2.73Å; E227-R230 PolarHBondContact OE1-NH2 3.47Å; R230-S232 VanDerWaalsContact C-N 3.34Å; R230-S232 PolarHBondContact O-N 3.35Å; R230-L233 PolarHBondContact O-N 2.82Å; R230-L234 HydrophobicContact CG-CD1 4.31Å; R230-L234 WeakPolarHBondContact O-CG 3.11Å; R230-L234 PolarHBondContact O-N 2.99Å; R230-I345 HydrophobicContact CB-CG2 4.01Å; R230-I345 HydrophobicContact CG-CG2 3.77Å; R230-Q346 WeakPolarHBondContact CD-O 3.45Å; R230-E352 IonicContact CZ-OE1 2.7Å; R230-E352 VanDerWaalsContact NH1-CD 3.26Å; R230-E352 IonicContact NH1-OE1 3.98Å; R230-E352 PolarHBondContact NH1-OE1 2.92Å; R230-E352 IonicContact NH1-OE2 3.7Å; R230-E352 PolarHBondContact NH1-OE2 3.06Å
231	N	86.9	Confident	76.2	Confident	56 Å²	56	71.7 Å²	71.7	30%	0.299	36%	0.363	S	S	.	.	H	α-helix	trans	-68.9	-28	-179	-71.9	-31.6	0	0	0	113.4	E227 I228 R229 K235	E227-N231 VanDerWaalsContact CG-ND2 3.3Å; E227-N231 WeakPolarHBondContact CG-ND2 3.46Å; E227-N231 VanDerWaalsContact O-CB 3.23Å; E227-N231 WeakPolarHBondContact O-CB 3.48Å; E227-N231 PolarHBondContact O-N 2.8Å; E227-N231 PolarHBondContact O-ND2 3.05Å; E227-N231 VanDerWaalsContact O-ND2 3.09Å; I228-N231 PolarHBondContact O-N 2.98Å; R229-N231 PolarHBondContact O-N 2.74Å; N231-K235 WeakPolarHBondContact O-CB 3.19Å; N231-K235 WeakPolarHBondContact O-CD 3.4Å; N231-K235 WeakPolarHBondContact O-CG 3.43Å; N231-K235 PolarHBondContact O-N 2.84Å
232	S	86.3	Confident	73.8	Confident	60 Å²	60	72.2 Å²	72.2	42%	0.42	37%	0.367	S	S	.	.	H	α-helix	trans	-65.7	-52	175.1	-164.1	0	0	0	0	110.9	I228 R229 R230 L234 K235 E236	I228-S232 WeakPolarHBondContact O-CB 3.39Å; I228-S232 PolarHBondContact O-N 3.23Å; R229-S232 PolarHBondContact O-N 3.37Å; R230-S232 VanDerWaalsContact C-N 3.34Å; R230-S232 PolarHBondContact O-N 3.35Å; S232-L234 VanDerWaalsContact C-N 3.29Å; S232-L234 PolarHBondContact O-N 3.08Å; S232-K235 PolarHBondContact O-N 3.4Å; S232-E236 PolarHBondContact O-N 3.2Å
233	L	82.6	Confident	71.6	Confident	5 Å²	5	78 Å²	78	3%	0.026	39%	0.386	C	S	.	.	H	α-helix	trans	-62.7	-33.6	-178.6	-76.5	159.6	0	0	0	113.2	R229 R230 L313 A315 I345	R229-L233 HydrophobicContact CG-CD1 4.38Å; R229-L233 PolarHBondContact O-N 3.11Å; R230-L233 PolarHBondContact O-N 2.82Å; L233-L313 WeakPolarHBondContact CD1-O 3.46Å; L233-A315 HydrophobicContact CD2-CB 3.71Å; L233-A315 HydrophobicContact CG-CB 4.41Å; L233-I345 HydrophobicContact CD1-CD1 3.34Å
234	L	82.6	Confident	69.3	Low	11 Å²	11	85.2 Å²	85.2	6%	0.058	41%	0.41	C	S	.	.	H	α-helix	trans	-74.2	-25.4	175.6	-64.5	174.8	0	0	0	113.1	R230 S232 E352 R355 I356	R230-L234 HydrophobicContact CG-CD1 4.31Å; R230-L234 WeakPolarHBondContact O-CG 3.11Å; R230-L234 PolarHBondContact O-N 2.99Å; S232-L234 VanDerWaalsContact C-N 3.29Å; S232-L234 PolarHBondContact O-N 3.08Å; L234-E352 HydrophobicContact CD1-CB 4.43Å; L234-E352 HydrophobicContact CD1-CG 4.04Å; L234-E352 HydrophobicContact CD2-CB 4.28Å; L234-R355 HydrophobicContact CD2-CB 3.72Å; L234-I356 HydrophobicContact CD2-CD1 4.49Å; L234-I356 HydrophobicContact CD2-CG1 4.11Å
235	K	73.9	Confident	66.8	Low	118 Å²	118	82.8 Å²	82.8	51%	0.513	42%	0.417	S	S	.	.	H	α-helix	trans	-86.8	-15.3	-179	-77.1	175.9	-178.9	-174.6	0	114.8	N231 S232 D237 N239	N231-K235 WeakPolarHBondContact O-CB 3.19Å; N231-K235 WeakPolarHBondContact O-CD 3.4Å; N231-K235 WeakPolarHBondContact O-CG 3.43Å; N231-K235 PolarHBondContact O-N 2.84Å; S232-K235 PolarHBondContact O-N 3.4Å; K235-D237 PolarHBondContact O-N 3.42Å; K235-N239 PolarHBondContact O-N 2.94Å; K235-N239 PolarHBondContact O-ND2 3.08Å
236	E	62	Low	64.3	Low	70 Å²	70	81.9 Å²	81.9	33%	0.327	42%	0.423	S	S	.	.	H	α-helix	trans	-67.7	-21.1	175.9	-73.1	-176.9	175.9	0	0	112.8	S232 Q240	S232-E236 PolarHBondContact O-N 3.2Å; E236-Q240 WeakPolarHBondContact O-CG 3.41Å; E236-Q240 PolarHBondContact O-NE2 2.98Å
237	D	54.7	Low	61.6	Low	29 Å²	29	86.2 Å²	86.2	16%	0.155	45%	0.452	C	S	.	.	H	α-helix	trans	-77.5	-55.2	177.5	-145.4	17.4	0	0	0	111.4	K235 N239 Q240 T241 R362	K235-D237 PolarHBondContact O-N 3.42Å; D237-N239 VanDerWaalsContact C-N 3.3Å; D237-N239 PolarHBondContact O-N 2.9Å; D237-Q240 PolarHBondContact O-N 3.11Å; D237-T241 PolarHBondContact O-N 2.86Å; D237-R362 IonicContact OD1-CZ 3.53Å; D237-R362 IonicContact OD1-NH1 2.97Å; D237-R362 PolarHBondContact OD1-NH1 3.46Å; D237-R362 IonicContact OD1-NH2 3.62Å; D237-R362 PolarHBondContact OD1-NH2 2.87Å
238	E	52.1	Low	59.3	Low	124 Å²	124	90.3 Å²	90.3	58%	0.579	48%	0.481	S	S	*	.	H	α-helix	trans	-59	-37.1	-177.3	-61.2	-178.2	147.8	0	0	113.3	Q240 T241 S242	E238-Q240 PolarHBondContact O-N 3.38Å; E238-T241 PolarHBondContact O-OG1 2.8Å; E238-T241 VanDerWaalsContact O-OG1 3.11Å; E238-S242 PolarHBondContact O-N 2.96Å
239	N	47.4	Very low	56.5	Low	97 Å²	97	89.4 Å²	89.4	52%	0.519	48%	0.481	S	S	.	.	H	α-helix	trans	-69.3	-15.1	179.4	-79.5	-72	0	0	0	113.6	K235 D237 R243	K235-N239 PolarHBondContact O-N 2.94Å; K235-N239 PolarHBondContact O-ND2 3.08Å; D237-N239 VanDerWaalsContact C-N 3.3Å; D237-N239 PolarHBondContact O-N 2.9Å; N239-R243 WeakPolarHBondContact O-CD 3.43Å; N239-R243 VanDerWaalsContact O-CG 3.29Å; N239-R243 WeakPolarHBondContact O-CG 3.47Å
240	Q	48.3	Very low	53.9	Low	109 Å²	109	90 Å²	90	51%	0.509	51%	0.505	S	S	.	.	H	α-helix	trans	-97.9	-34.5	-179.2	-66.3	-173.2	41.3	0	0	113	E236 D237 E238 S242 R243 R244	E236-Q240 WeakPolarHBondContact O-CG 3.41Å; E236-Q240 PolarHBondContact O-NE2 2.98Å; D237-Q240 PolarHBondContact O-N 3.11Å; E238-Q240 PolarHBondContact O-N 3.38Å; Q240-S242 VanDerWaalsContact C-N 3.32Å; Q240-R243 PolarHBondContact O-N 3.08Å; Q240-R244 PolarHBondContact O-N 2.74Å
241	T	44.6	Very low	51.1	Low	102 Å²	102	101.1 Å²	101.1	63%	0.626	55%	0.547	S	S	*	.	H	α-helix	trans	-58.9	-44.9	167.8	28	0	0	0	0	111	D237 E238 R243 R244	D237-T241 PolarHBondContact O-N 2.86Å; E238-T241 PolarHBondContact O-OG1 2.8Å; E238-T241 VanDerWaalsContact O-OG1 3.11Å; T241-R243 VanDerWaalsContact C-N 3.35Å; T241-R243 PolarHBondContact O-N 2.88Å; T241-R244 PolarHBondContact O-N 2.86Å
242	S	38.3	Very low	48.4	Very low	86 Å²	86	105.1 Å²	105.1	60%	0.601	57%	0.569	S	S	*	*	H	α-helix	trans	-57.6	-42.8	173.9	180	0	0	0	0	113	E238 Q240 R244 A245	E238-S242 PolarHBondContact O-N 2.96Å; Q240-S242 VanDerWaalsContact C-N 3.32Å; S242-R244 VanDerWaalsContact C-N 3.33Å; S242-R244 PolarHBondContact O-N 2.86Å; S242-A245 PolarHBondContact O-N 2.75Å; S242-A245 VanDerWaalsContact O-N 3.13Å
243	R	41.9	Very low	46	Very low	196 Å²	196	108.1 Å²	108.1	74%	0.74	59%	0.59	S	S	*	*	H	α-helix	trans	-70.2	-20.8	-178.5	-78.2	177	177.5	-164.1	-0.8	115	N239 Q240 T241 A245	N239-R243 WeakPolarHBondContact O-CD 3.43Å; N239-R243 VanDerWaalsContact O-CG 3.29Å; N239-R243 WeakPolarHBondContact O-CG 3.47Å; Q240-R243 PolarHBondContact O-N 3.08Å; T241-R243 VanDerWaalsContact C-N 3.35Å; T241-R243 PolarHBondContact O-N 2.88Å; R243-A245 VanDerWaalsContact C-N 3.33Å
244	R	39.7	Very low	43.5	Very low	193 Å²	193	110.6 Å²	110.6	73%	0.728	62%	0.616	S	S	*	*	H	α-helix	trans	-75.9	-20.6	171.6	-93.2	179.1	156.8	-152.7	-8.1	113.1	Q240 T241 S242 E269	Q240-R244 PolarHBondContact O-N 2.74Å; T241-R244 PolarHBondContact O-N 2.86Å; S242-R244 VanDerWaalsContact C-N 3.33Å; S242-R244 PolarHBondContact O-N 2.86Å; R244-E269 IonicContact CZ-OE2 2.79Å; R244-E269 VanDerWaalsContact CZ-OE2 3.26Å; R244-E269 IonicContact NH1-OE2 2.8Å; R244-E269 PolarHBondContact NH1-OE2 3.43Å; R244-E269 IonicContact NH2-OE2 3.93Å; R244-E269 PolarHBondContact NH2-OE2 3.33Å
245	A	34.8	Very low	41.2	Very low	92 Å²	92	118.5 Å²	118.5	76%	0.76	66%	0.656	S	S	*	*	T	Hydrogen-bonded Turn	trans	-88.1	-2.6	-176.1	0	0	0	0	0	114.9	S242 R243	S242-A245 PolarHBondContact O-N 2.75Å; S242-A245 VanDerWaalsContact O-N 3.13Å; R243-A245 VanDerWaalsContact C-N 3.33Å
246	G	36.6	Very low	39.2	Very low	58 Å²	58	116.7 Å²	116.7	60%	0.598	67%	0.671	S	S	*	*	S	Bend	trans	-161.4	64.6	-167.6	0	0	0	0	0	118.2
247	T	31.7	Very low	37.6	Very low	116 Å²	116	116.9 Å²	116.9	71%	0.712	69%	0.692	S	S	*	*			trans	-153.3	65.3	159	12.2	0	0	0	0	113.2	T249	T247-T249 VanDerWaalsContact C-N 3.31Å; T247-T249 PolarHBondContact O-N 3.43Å; T247-T249 VanDerWaalsContact O-N 3.14Å
248	T	37.9	Very low	36.4	Very low	150 Å²	150	123.5 Å²	123.5	92%	0.92	73%	0.727	S	S	*	*			trans	-84	70.9	167	53.2	0	0	0	0	111.4
249	T	30.1	Very low	35.4	Very low	102 Å²	102	123.7 Å²	123.7	63%	0.626	74%	0.742	S	S	*	*			trans	-127.7	97.7	171.1	46.6	0	0	0	0	109.8	T247 W251	T247-T249 VanDerWaalsContact C-N 3.31Å; T247-T249 PolarHBondContact O-N 3.43Å; T247-T249 VanDerWaalsContact O-N 3.14Å; T249-W251 PolarHBondContact O-N 3.48Å
250	A	32.2	Very low	34.4	Very low	100 Å²	100	124.2 Å²	124.2	83%	0.826	75%	0.753	S	S	*	*			trans	-65.4	130.4	177	0	0	0	0	0	110.9
251	W	29.2	Very low	33.5	Very low	250 Å²	250	125.4 Å²	125.4	95%	0.947	77%	0.768	S	S	*	*			trans	-112.9	87.5	165	-80.4	58.5	0	0	0	107.3	T249	T249-W251 PolarHBondContact O-N 3.48Å
252	D	30.3	Very low	32.7	Very low	140 Å²	140	126.8 Å²	126.8	75%	0.749	78%	0.776	S	S	*	*			trans	-74.1	132.3	173.4	177.4	23	0	0	0	110.4	G254	D252-G254 PolarHBondContact OD1-N 3.26Å
253	S	34.5	Very low	32.3	Very low	123 Å²	123	131.2 Å²	131.2	86%	0.86	79%	0.787	S	S	*	*			trans	-165.6	75.2	162.2	-80	0	0	0	0	108.1
254	G	31.1	Very low	31.6	Very low	57 Å²	57	128.6 Å²	128.6	59%	0.588	79%	0.793	S	S	*	*			trans	-58.8	161.1	-166.7	0	0	0	0	0	118.5	D252	D252-G254 PolarHBondContact OD1-N 3.26Å
255	I	34.3	Very low	31.2	Very low	176 Å²	176	123 Å²	123	90%	0.903	79%	0.789	S	S	*	*				-148.3	127	121.7	-95	150.7	0	0	0	106.4
256	G	31.6	Very low	31	Very low	80 Å²	80	124.6 Å²	124.6	83%	0.825	79%	0.789	S	S	*	*			trans	-90.2	156.3	-172.6	0	0	0	0	0	114.3
257	G	28.2	Very low	30.5	Very low	74 Å²	74	130.7 Å²	130.7	76%	0.763	80%	0.802	S	S	*	*			trans	-171.6	52.9	-174.7	0	0	0	0	0	117.2
258	L	30.2	Very low	30.5	Very low	169 Å²	169	131.8 Å²	131.8	89%	0.885	80%	0.802	S	S	*	*			trans	51.1	105.8	156.9	-67.7	162.5	0	0	0	119.4
259	S	30	Very low	30.4	Very low	127 Å²	127	130.6 Å²	130.6	89%	0.888	79%	0.786	S	S	*	*			trans	-168.3	99.7	139.9	-83.7	0	0	0	0	110.8
260	S	27.9	Very low	30.6	Very low	108 Å²	108	134 Å²	134	76%	0.755	80%	0.801	S	S	*	*			trans	-120.5	97	-178.5	-62.2	0	0	0	0	111.9
261	T	29	Very low	30.6	Very low	135 Å²	135	134.2 Å²	134.2	83%	0.828	79%	0.792	S	S	*	*			trans	-174.4	87.1	150.1	39.9	0	0	0	0	112.1
262	T	28.2	Very low	31.2	Very low	130 Å²	130	126.7 Å²	126.7	80%	0.798	77%	0.77	S	S	*	*			trans	-163.8	45.1	158.5	20.7	0	0	0	0	112.5	T264	T262-T264 PolarHBondContact O-N 2.89Å
263	H	28.4	Very low	31.7	Very low	180 Å²	180	124.8 Å²	124.8	83%	0.833	77%	0.768	S	S	*	*	T	Hydrogen-bonded Turn	trans	-92.9	68.4	179.4	-77.2	-65.6	0	0	0	113.6
264	T	27.6	Very low	32.3	Very low	140 Å²	140	120.6 Å²	120.6	86%	0.859	74%	0.737	S	S	*	*	T	Hydrogen-bonded Turn	trans	-141.9	1.9	172.2	48.1	0	0	0	0	114.7	T262	T262-T264 PolarHBondContact O-N 2.89Å
265	A	31.8	Very low	32.8	Very low	77 Å²	77	123 Å²	123	64%	0.636	74%	0.744	S	S	*	*			trans	-114.1	19.5	-162.3	0	0	0	0	0	116.2
266	T	30.2	Very low	33.8	Very low	125 Å²	125	116.1 Å²	116.1	77%	0.767	71%	0.709	S	S	*	*	S	Bend	trans	-123.6	37.3	-168.4	56.3	0	0	0	0	115.1
267	Q	26.2	Very low	34.5	Very low	186 Å²	186	117.5 Å²	117.5	87%	0.869	70%	0.697	S	S	*	*	S	Bend	trans	-139.3	28.6	173.8	-73.1	-165.7	-25	0	0	114
268	L	31.3	Very low	35.4	Very low	138 Å²	138	117.6 Å²	117.6	72%	0.723	68%	0.684	S	S	*	*			trans	-139.9	20.1	-176.8	-73.9	176.7	0	0	0	115.1
269	E	36.8	Very low	36.1	Very low	125 Å²	125	116.1 Å²	116.1	58%	0.584	68%	0.677	S	S	*	*			trans	-90.3	-9.3	-179.7	-65.2	-158.7	156.9	0	0	114.9	R244 T271	R244-E269 IonicContact CZ-OE2 2.79Å; R244-E269 VanDerWaalsContact CZ-OE2 3.26Å; R244-E269 IonicContact NH1-OE2 2.8Å; R244-E269 PolarHBondContact NH1-OE2 3.43Å; R244-E269 IonicContact NH2-OE2 3.93Å; R244-E269 PolarHBondContact NH2-OE2 3.33Å; E269-T271 VanDerWaalsContact C-N 3.28Å; E269-T271 PolarHBondContact O-N 2.79Å
270	D	33.1	Very low	37	Very low	174 Å²	174	112.9 Å²	112.9	93%	0.93	65%	0.654	S	S	*	*	S	Bend	trans	-83.5	18.2	-174.6	-78	-35.5	0	0	0	115.7
271	T	32.5	Very low	38.2	Very low	104 Å²	104	108.4 Å²	108.4	64%	0.638	62%	0.622	S	S	*	*			trans	-119.8	54.3	173	58.5	0	0	0	0	111.9	E269	E269-T271 VanDerWaalsContact C-N 3.28Å; E269-T271 PolarHBondContact O-N 2.79Å
272	D	42	Very low	38.9	Very low	93 Å²	93	104.4 Å²	104.4	50%	0.497	60%	0.599	S	S	.	*			trans	-93.8	9.1	175.6	-166.4	30.1	0	0	0	113.4	K358	D272-K358 PolarHBondContact O-NZ 2.84Å; D272-K358 IonicContact OD1-NZ 3.82Å; D272-K358 PolarHBondContact OD1-NZ 2.75Å; D272-K358 IonicContact OD2-NZ 3.23Å; D272-K358 PolarHBondContact OD2-NZ 3.41Å
273	S	41.7	Very low	39.6	Very low	99 Å²	99	105.1 Å²	105.1	69%	0.692	60%	0.598	S	S	*	*	S	Bend	trans	-75.5	130.9	158.5	-173.7	0	0	0	0	109	C275	S273-C275 PolarHBondContact O-N 2.87Å
274	V	45.7	Very low	40.3	Very low	35 Å²	35	99.4 Å²	99.4	21%	0.212	58%	0.578	C	S	.	*			trans	-78.4	114.6	-177.2	-162.7	0	0	0	0	109.3	A183 L276 W354	A183-V274 HydrophobicContact CB-CG1 3.96Å; V274-L276 HydrophobicContact CG1-CD1 4.04Å; V274-L276 HydrophobicContact CG1-CG 3.83Å; V274-L276 PolarHBondContact O-N 3.11Å; V274-W354 HydrophobicContact CG2-CD2 4.31Å; V274-W354 VanDerWaalsContact CG2-CE2 3.46Å; V274-W354 HydrophobicContact CG2-CZ2 3.7Å
275	C	43.1	Very low	40.9	Very low	108 Å²	108	97.5 Å²	97.5	73%	0.73	58%	0.577	S	S	*	*			trans	-71.1	69.8	167.8	-67.4	0	0	0	0	111	S273 D277	S273-C275 PolarHBondContact O-N 2.87Å; C275-D277 PolarHBondContact O-N 3.33Å
276	L	53.6	Low	41.6	Very low	32 Å²	32	96.9 Å²	96.9	17%	0.168	58%	0.577	C	S	.	*			trans	-89.2	83.3	159.6	-78.8	169.4	0	0	0	107.3	A183 R188 V191 V274 P278	A183-L276 HydrophobicContact CB-CD1 4.22Å; A183-L276 HydrophobicContact CB-CD2 3.74Å; A183-L276 HydrophobicContact CB-CG 4.03Å; R188-L276 HydrophobicContact CG-CD2 3.81Å; V191-L276 HydrophobicContact CB-CD1 4.32Å; V191-L276 HydrophobicContact CG2-CD1 3.64Å; V274-L276 HydrophobicContact CG1-CD1 4.04Å; V274-L276 HydrophobicContact CG1-CG 3.83Å; V274-L276 PolarHBondContact O-N 3.11Å; L276-P278 VanDerWaalsContact O-CD 3.32Å; L276-P278 WeakPolarHBondContact O-CD 3.49Å; L276-P278 VanDerWaalsContact O-N 3.1Å
277	D	46.8	Very low	42.5	Very low	109 Å²	109	92.6 Å²	92.6	58%	0.583	55%	0.552	S	S	*	*			trans	-48.4	118.5	172.5	-88.6	-44.3	0	0	0	109.3	C275 D279 S280	C275-D277 PolarHBondContact O-N 3.33Å; D277-D279 VanDerWaalsContact C-N 3.26Å; D277-D279 PolarHBondContact O-N 3.2Å; D277-S280 PolarHBondContact O-N 2.92Å
278	P	47.3	Very low	44.2	Very low	75 Å²	75	89.7 Å²	89.7	49%	0.487	54%	0.543	S	S	.	.	T	Hydrogen-bonded Turn	trans	-57.2	-44.5	-174.9	-28.5	36.3	0	0	0	111.3	R195 L276 S280 L281	R195-P278 PolarHBondContact NH1-O 2.95Å; R195-P278 VanDerWaalsContact NH2-CA 3.35Å; R195-P278 PolarHBondContact NH2-O 2.58Å; L276-P278 VanDerWaalsContact O-CD 3.32Å; L276-P278 WeakPolarHBondContact O-CD 3.49Å; L276-P278 VanDerWaalsContact O-N 3.1Å; P278-S280 VanDerWaalsContact C-N 3.34Å; P278-S280 PolarHBondContact O-N 2.79Å; P278-L281 PolarHBondContact O-N 2.98Å
279	D	45.3	Very low	46.1	Very low	138 Å²	138	83.9 Å²	83.9	74%	0.738	51%	0.512	S	S	*	.	T	Hydrogen-bonded Turn	trans	-75.5	-20.3	-170.2	-56.6	-37.2	0	0	0	113.8	D277 L281	D277-D279 VanDerWaalsContact C-N 3.26Å; D277-D279 PolarHBondContact O-N 3.2Å; D279-L281 VanDerWaalsContact C-N 3.28Å; D279-L281 PolarHBondContact O-N 2.93Å
280	S	47.8	Very low	47.8	Very low	59 Å²	59	84.3 Å²	84.3	41%	0.413	51%	0.514	S	S	.	.	T	Hydrogen-bonded Turn	trans	-68.1	-24.8	176.4	-64.9	0	0	0	0	113.4	Q140 D277 P278 S282	Q140-S280 PolarHBondContact NE2-O 2.91Å; D277-S280 PolarHBondContact O-N 2.92Å; P278-S280 VanDerWaalsContact C-N 3.34Å; P278-S280 PolarHBondContact O-N 2.79Å; S280-S282 PolarHBondContact O-N 2.95Å
281	L	54.5	Low	49.7	Very low	14 Å²	14	84.7 Å²	84.7	7%	0.073	51%	0.51	C	S	.	.	S	Bend	trans	-78.1	89.1	173.1	-73.9	177.4	0	0	0	110.2	Y143 V191 R195 P278 D279 L283	Y143-L281 HydrophobicContact CD1-CD2 4.01Å; Y143-L281 HydrophobicContact CE1-CD2 3.99Å; V191-L281 HydrophobicContact CG1-CD1 4.02Å; R195-L281 PolarHBondContact NH1-O 3.4Å; P278-L281 PolarHBondContact O-N 2.98Å; D279-L281 VanDerWaalsContact C-N 3.28Å; D279-L281 PolarHBondContact O-N 2.93Å; L281-L283 PolarHBondContact O-N 2.85Å
282	S	44.2	Very low	51.9	Low	51 Å²	51	82.5 Å²	82.5	36%	0.357	51%	0.509	S	S	.	.			trans	-35.5	115	-174.4	42.1	0	0	0	0	115.5	E144 K148 S280 S284	E144-S282 PolarHBondContact OE1-OG 3.39Å; K148-S282 PolarHBondContact NZ-O 2.93Å; K148-S282 PolarHBondContact NZ-OG 2.74Å; S280-S282 PolarHBondContact O-N 2.95Å; S282-S284 VanDerWaalsContact C-N 3.34Å; S282-S284 PolarHBondContact O-N 2.99Å
283	L	41.6	Very low	54	Low	145 Å²	145	78.3 Å²	78.3	76%	0.759	49%	0.487	S	S	*	.			trans	-65.7	77.2	-178.3	-71.4	169.6	0	0	0	113.2	L281 A285	L281-L283 PolarHBondContact O-N 2.85Å; L283-A285 VanDerWaalsContact C-N 3.28Å; L283-A285 PolarHBondContact O-N 2.9Å
284	S	44	Very low	56.4	Low	60 Å²	60	77.3 Å²	77.3	42%	0.42	47%	0.471	S	S	.	.			trans	-71.3	87.7	157.7	62.4	0	0	0	0	108.6	S282	S282-S284 VanDerWaalsContact C-N 3.34Å; S282-S284 PolarHBondContact O-N 2.99Å
285	A	39.3	Very low	58.6	Low	101 Å²	101	75.8 Å²	75.8	84%	0.835	46%	0.462	S	S	*	.			trans	-59.9	137.9	169.8	0	0	0	0	0	109.6	L283	L283-A285 VanDerWaalsContact C-N 3.28Å; L283-A285 PolarHBondContact O-N 2.9Å
286	G	46	Very low	60.9	Low	63 Å²	63	70.7 Å²	70.7	65%	0.649	43%	0.427	S	S	*	.			trans	78.1	96.5	-170.1	0	0	0	0	0	112.7
287	C	50.5	Low	62.9	Low	35 Å²	35	69.3 Å²	69.3	24%	0.236	42%	0.42	C	S	.	.			trans	-90.1	132.6	134.7	-75.4	0	0	0	0	106	N152 K196 L289	N152-C287 PolarHBondContact OD1-SG 3.44Å; K196-C287 PolarHBondContact NZ-SG 2.91Å; C287-L289 HydrophobicContact CB-CD1 4.27Å; C287-L289 HydrophobicContact CB-CD2 3.93Å; C287-L289 HydrophobicContact CB-CG 3.67Å; C287-L289 PolarHBondContact O-N 2.96Å
288	D	61.1	Low	65.2	Low	126 Å²	126	64.1 Å²	64.1	67%	0.674	39%	0.392	S	S	*	.			trans	-73.1	79.7	168.3	-21.5	-76.8	0	0	0	107.9	K156	K156-D288 WeakPolarHBondContact CE-O 3.48Å; K156-D288 IonicContact NZ-OD2 3.1Å; K156-D288 PolarHBondContact NZ-OD2 2.84Å
289	L	72.4	Confident	67.5	Low	15 Å²	15	60.5 Å²	60.5	8%	0.079	37%	0.369	C	S	.	.			trans	-97.7	124.5	171	-56.7	-175.8	0	0	0	107.5	L155 R200 C287 E291 F295	L155-L289 HydrophobicContact CB-CD2 3.71Å; R200-L289 PolarHBondContact NH1-O 3.31Å; R200-L289 PolarHBondContact NH2-O 2.97Å; C287-L289 HydrophobicContact CB-CD1 4.27Å; C287-L289 HydrophobicContact CB-CD2 3.93Å; C287-L289 HydrophobicContact CB-CG 3.67Å; C287-L289 PolarHBondContact O-N 2.96Å; L289-E291 PolarHBondContact O-N 3.1Å; L289-F295 HydrophobicContact CD1-CZ 4.48Å
290	E	71.1	Confident	69.9	Low	135 Å²	135	54 Å²	54	63%	0.631	33%	0.334	S	S	*	.			trans	-45.4	132.2	-179.7	-66.4	-177.6	172.7	0	0	112.3	R200 V293 H390	R200-E290 PolarHBondContact NH1-O 3.5Å; E290-V293 HydrophobicContact CB-CG2 3.6Å; E290-H390 IonicContact OE2-CE1 3.93Å; E290-H390 PolarHBondContact OE2-CE1 3.38Å
291	E	74.3	Confident	72.2	Confident	181 Å²	181	51.4 Å²	51.4	85%	0.846	32%	0.315	S	S	*	.	T	Hydrogen-bonded Turn	trans	-70.3	146.6	-179	-58.8	-165.8	145	0	0	110.5	L289 V293	L289-E291 PolarHBondContact O-N 3.1Å; E291-V293 VanDerWaalsContact C-N 3.26Å; E291-V293 PolarHBondContact O-N 3.36Å
292	G	78.2	Confident	74.1	Confident	59 Å²	59	51.1 Å²	51.1	61%	0.608	31%	0.313	S	S	*	.	T	Hydrogen-bonded Turn	trans	81.8	-20.7	-173.9	0	0	0	0	0	115.9	P391	G292-P391 WeakPolarHBondContact O-CD 3.43Å
293	V	86.7	Confident	76.4	Confident	5 Å²	5	48.8 Å²	48.8	3%	0.03	30%	0.297	C	S	.	.			trans	-71.6	131.9	-178.2	-172.7	0	0	0	0	112.2	E290 E291 F295 H388 H390	E290-V293 HydrophobicContact CB-CG2 3.6Å; E291-V293 VanDerWaalsContact C-N 3.26Å; E291-V293 PolarHBondContact O-N 3.36Å; V293-F295 HydrophobicContact CB-CE2 4.15Å; V293-F295 HydrophobicContact CB-CZ 4.09Å; V293-F295 HydrophobicContact CG1-CE1 4.04Å; V293-F295 HydrophobicContact CG1-CE2 3.97Å; V293-F295 HydrophobicContact CG1-CZ 3.71Å; V293-F295 WeakPolarHBondContact O-CE2 3.2Å; V293-H388 HydrophobicContact CG1-CB 4.2Å; V293-H390 VanDerWaalsContact CG2-CE1 3.45Å; V293-H390 WeakPolarHBondContact CG2-CE1 3.47Å
294	Q	90.1	Very high	78.7	Confident	77 Å²	77	42.1 Å²	42.1	36%	0.36	26%	0.261	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-109.3	150.9	172	-60.5	-173.4	3.6	0	0	110.8	R200 Y202 V389 P391	R200-Q294 CarbonylContact O-C 3.58Å; R200-Q294 VanDerWaalsContact O-CA 3.3Å; R200-Q294 WeakPolarHBondContact O-CA 3.15Å; Y202-Q294 HydrophobicContact CD2-CB 4.28Å; Q294-V389 PolarHBondContact N-O 3.03Å; Q294-V389 PolarHBondContact O-N 3.41Å; Q294-P391 HydrophobicContact CG-CG 4.16Å
295	F	91.9	Very high	80.8	Confident	4 Å²	4	42.2 Å²	42.2	2%	0.018	25%	0.253	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-126.1	122.6	-169.2	-58.4	-96.3	0	0	0	111.8	L155 L197 R200 Y202 L289 V293 I297 V386 L387 H388	L155-F295 HydrophobicContact CD2-CD1 4.45Å; L197-F295 HydrophobicContact CD1-CB 4.33Å; L197-F295 HydrophobicContact CD2-CB 3.62Å; L197-F295 HydrophobicContact CD2-CD1 3.98Å; L197-F295 HydrophobicContact CD2-CD2 3.41Å; L197-F295 VanDerWaalsContact CD2-CD2 3.41Å; L197-F295 HydrophobicContact CD2-CE1 4.49Å; L197-F295 HydrophobicContact CD2-CE2 4.03Å; L197-F295 HydrophobicContact CD2-CG 3.38Å; R200-F295 HydrophobicContact CB-CD2 3.9Å; R200-F295 HydrophobicContact CB-CE2 4.17Å; R200-F295 PolarHBondContact O-N 2.86Å; Y202-F295 PolarHBondContact N-O 3.03Å; L289-F295 HydrophobicContact CD1-CZ 4.48Å; V293-F295 HydrophobicContact CB-CE2 4.15Å; V293-F295 HydrophobicContact CB-CZ 4.09Å; V293-F295 HydrophobicContact CG1-CE1 4.04Å; V293-F295 HydrophobicContact CG1-CE2 3.97Å; V293-F295 HydrophobicContact CG1-CZ 3.71Å; V293-F295 WeakPolarHBondContact O-CE2 3.2Å; F295-I297 HydrophobicContact CB-CD1 4.26Å; F295-V386 HydrophobicContact CB-CG1 4.42Å; F295-V386 HydrophobicContact CD1-CG1 3.71Å; F295-L387 WeakPolarHBondContact CA-O 3.4Å; F295-H388 AromaticContact CD1-ND1 3.96Å; F295-H388 AromaticContact CE1-CE1 3.78Å; F295-H388 AromaticContact CE1-ND1 3.42Å; F295-H388 WeakPolarHBondContact CE1-ND1 3.42Å
296	S	93	Very high	82.9	Confident	1 Å²	1	39.6 Å²	39.6	1%	0.007	23%	0.225	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-103.3	123.5	172.9	-169.9	0	0	0	0	109.9	W298 Q346 L387	S296-W298 PolarHBondContact OG-NE1 2.66Å; S296-W298 VanDerWaalsContact OG-NE1 3.07Å; S296-Q346 PolarHBondContact OG-NE2 3.03Å; S296-L387 PolarHBondContact N-O 3.03Å; S296-L387 PolarHBondContact O-N 3.02Å
297	I	94.9	Very high	84.9	Confident	2 Å²	2	38.9 Å²	38.9	1%	0.01	21%	0.205	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-107.6	121.8	-170.8	-47.1	-60.2	0	0	0	110.2	L193 F194 L197 L201 F295 Q346 I347 I384 V386	L193-I297 HydrophobicContact CD2-CG2 4.05Å; F194-I297 HydrophobicContact CE1-CG1 4.46Å; F194-I297 HydrophobicContact CZ-CB 4.23Å; F194-I297 HydrophobicContact CZ-CG1 4.38Å; F194-I297 HydrophobicContact CZ-CG2 4.25Å; L197-I297 HydrophobicContact CD1-CD1 3.4Å; L197-I297 HydrophobicContact CD1-CG1 3.75Å; L201-I297 HydrophobicContact CD2-CG1 4.1Å; F295-I297 HydrophobicContact CB-CD1 4.26Å; I297-Q346 CarbonylContact O-C 3.58Å; I297-Q346 VanDerWaalsContact O-CA 3.31Å; I297-Q346 WeakPolarHBondContact O-CA 3.43Å; I297-I347 HydrophobicContact CB-CG1 4.11Å; I297-I347 HydrophobicContact CG2-CD1 3.8Å; I297-I347 HydrophobicContact CG2-CG1 3.85Å; I297-I347 WeakPolarHBondContact O-CG1 3.47Å; I297-I347 PolarHBondContact O-N 3.28Å; I297-I384 HydrophobicContact CG2-CG2 3.77Å; I297-V386 HydrophobicContact CD1-CB 4.19Å; I297-V386 HydrophobicContact CD1-CG1 3.85Å; I297-V386 HydrophobicContact CD1-CG2 3.84Å
298	W	95.3	Very high	86.8	Confident	0 Å²	0	41.8 Å²	41.8	0%	0	21%	0.214	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-122.8	134.4	-177.2	-68.1	78.1	0	0	0	110.7	L207 K208 P209 S296 W344 I345 Q346 I384 R385	L207-W298 WeakPolarHBondContact O-CZ2 3.42Å; L207-W298 PolarHBondContact O-NE1 2.96Å; K208-W298 HydrophobicContact CB-CH2 3.83Å; K208-W298 HydrophobicContact CB-CZ2 4.04Å; K208-W298 HydrophobicContact CB-CZ3 4.43Å; K208-W298 HydrophobicContact CD-CH2 3.88Å; K208-W298 HydrophobicContact CD-CZ3 3.82Å; K208-W298 HydrophobicContact CG-CE3 4.43Å; K208-W298 HydrophobicContact CG-CH2 3.74Å; K208-W298 HydrophobicContact CG-CZ2 4.28Å; K208-W298 HydrophobicContact CG-CZ3 3.83Å; P209-W298 VanDerWaalsContact CD-CD2 3.47Å; P209-W298 VanDerWaalsContact CD-CE2 3.45Å; P209-W298 HydrophobicContact CG-CB 3.93Å; P209-W298 HydrophobicContact CG-CD2 3.92Å; P209-W298 HydrophobicContact CG-CE3 4.49Å; P209-W298 HydrophobicContact CG-CG 3.62Å; S296-W298 PolarHBondContact OG-NE1 2.66Å; S296-W298 VanDerWaalsContact OG-NE1 3.07Å; W298-W344 HydrophobicContact CB-CE3 4.24Å; W298-W344 HydrophobicContact CE3-CB 3.98Å; W298-I345 CarbonylContact C-O 3.48Å; W298-I345 WeakPolarHBondContact CA-O 3.49Å; W298-Q346 HydrophobicContact CD2-CB 3.85Å; W298-Q346 HydrophobicContact CD2-CG 4.31Å; W298-Q346 HydrophobicContact CE3-CB 4Å; W298-Q346 VanDerWaalsContact CE3-N 3.29Å; W298-Q346 HydrophobicContact CH2-CB 3.94Å; W298-Q346 HydrophobicContact CZ2-CB 3.78Å; W298-Q346 HydrophobicContact CZ2-CG 4.1Å; W298-Q346 HydrophobicContact CZ3-CB 4.04Å; W298-I384 CarbonylContact O-C 3.59Å; W298-I384 WeakPolarHBondContact O-CA 3.35Å; W298-R385 HydrophobicContact CB-CB 4.4Å; W298-R385 PolarHBondContact N-O 2.9Å; W298-R385 PolarHBondContact O-N 2.81Å
299	V	96.1	Very high	88.2	Confident	0 Å²	0	36 Å²	36	0%	0	18%	0.182	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-117.8	145.2	176.6	-72.4	0	0	0	0	112.4	W344 I345 I347 I356 F382 S383 I384	V299-W344 WeakPolarHBondContact O-CA 3.4Å; V299-I345 HydrophobicContact CG2-CB 4.47Å; V299-I345 PolarHBondContact N-O 3.28Å; V299-I345 PolarHBondContact O-N 2.88Å; V299-I347 HydrophobicContact CB-CD1 4.4Å; V299-I347 HydrophobicContact CG1-CD1 3.48Å; V299-I347 VanDerWaalsContact CG1-CD1 3.48Å; V299-I347 HydrophobicContact CG1-CG1 4.24Å; V299-I347 HydrophobicContact CG2-CD1 4.06Å; V299-I347 HydrophobicContact CG2-CG1 4.21Å; V299-I347 HydrophobicContact CG2-CG2 3.81Å; V299-I356 HydrophobicContact CG2-CD1 4.2Å; V299-I356 HydrophobicContact CG2-CG2 4.13Å; V299-F382 HydrophobicContact CB-CE1 4.26Å; V299-F382 HydrophobicContact CB-CZ 4Å; V299-F382 HydrophobicContact CG1-CE1 3.75Å; V299-F382 HydrophobicContact CG1-CZ 3.81Å; V299-S383 WeakPolarHBondContact CA-O 3.48Å; V299-I384 HydrophobicContact CG1-CB 4.34Å; V299-I384 HydrophobicContact CG1-CG1 3.85Å; V299-I384 HydrophobicContact CG1-CG2 4.35Å
300	S	95.6	Very high	89.1	Confident	0 Å²	0	36.9 Å²	36.9	0%	0	19%	0.185	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-133.5	151.2	165.3	61.5	0	0	0	0	109.8	T343 W344 S383	S300-T343 WeakPolarHBondContact CA-O 3.35Å; S300-T343 WeakPolarHBondContact CB-O 3.49Å; S300-W344 WeakPolarHBondContact OG-CH2 3.44Å; S300-W344 VanDerWaalsContact OG-CZ2 3.3Å; S300-W344 WeakPolarHBondContact OG-CZ2 3.39Å; S300-W344 WeakPolarHBondContact OG-CZ3 3.47Å; S300-S383 PolarHBondContact N-O 2.7Å; S300-S383 PolarHBondContact O-N 3.17Å
301	F	95.3	Very high	90.1	Very high	5 Å²	5	31.5 Å²	31.5	2%	0.022	16%	0.161	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-144.7	124.1	-179.6	-173.2	-157.4	0	0	0	109.6	L312 L313 L357 R361 I381 F382	F301-L312 HydrophobicContact CD1-CB 4.16Å; F301-L312 HydrophobicContact CD1-CD1 4.01Å; F301-L312 HydrophobicContact CD2-CD1 3.91Å; F301-L312 HydrophobicContact CE1-CD1 3.8Å; F301-L312 HydrophobicContact CE2-CD1 3.71Å; F301-L312 HydrophobicContact CG-CB 4.29Å; F301-L312 HydrophobicContact CG-CD1 4.04Å; F301-L312 HydrophobicContact CZ-CD1 3.64Å; F301-L312 WeakPolarHBondContact O-CB 3.41Å; F301-L312 PolarHBondContact O-N 3.05Å; F301-L313 HydrophobicContact CB-CD1 4.08Å; F301-L313 HydrophobicContact CB-CD2 3.95Å; F301-L313 HydrophobicContact CB-CG 3.94Å; F301-L313 HydrophobicContact CD1-CD2 4.44Å; F301-L357 HydrophobicContact CD1-CD1 4.25Å; F301-L357 HydrophobicContact CE1-CD1 3.8Å; F301-L357 HydrophobicContact CZ-CD1 4.11Å; F301-R361 HydrophobicContact CE1-CG 3.94Å; F301-R361 HydrophobicContact CZ-CG 4.17Å; F301-I381 WeakPolarHBondContact CD2-O 3.23Å; F301-F382 HydrophobicContact CB-CD2 3.69Å; F301-F382 HydrophobicContact CB-CE2 4.17Å; F301-F382 AromaticContact CD1-CD2 3.96Å; F301-F382 HydrophobicContact CD1-CD2 3.96Å; F301-F382 HydrophobicContact CD1-CE2 4.44Å; F301-F382 HydrophobicContact CD2-CB 3.87Å; F301-F382 AromaticContact CD2-CD2 3.81Å; F301-F382 HydrophobicContact CD2-CD2 3.81Å; F301-F382 HydrophobicContact CD2-CG 4.32Å; F301-F382 HydrophobicContact CE2-CB 4.26Å; F301-F382 HydrophobicContact CE2-CD2 4.43Å; F301-F382 HydrophobicContact CG-CB 4.48Å; F301-F382 AromaticContact CG-CD2 3.57Å; F301-F382 HydrophobicContact CG-CD2 3.57Å; F301-F382 HydrophobicContact CG-CE2 4.31Å; F301-F382 HydrophobicContact CG-CG 4.46Å
302	Y	94.1	Very high	90.9	Very high	8 Å²	8	22.9 Å²	22.9	3%	0.031	12%	0.121	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-145.1	161.5	-176.3	60.8	-81	0	0	0	111.2	I304 L309 Y310 V339 L342 I381 V468	Y302-I304 HydrophobicContact CE2-CG1 4.44Å; Y302-L309 HydrophobicContact CD2-CD2 4.18Å; Y302-L309 HydrophobicContact CE2-CD2 3.98Å; Y302-Y310 CarbonylContact C-O 3.56Å; Y302-Y310 VanDerWaalsContact CA-O 3.28Å; Y302-Y310 WeakPolarHBondContact CA-O 3.33Å; Y302-Y310 VanDerWaalsContact CB-O 3.23Å; Y302-Y310 WeakPolarHBondContact CB-O 3.35Å; Y302-V339 HydrophobicContact CE1-CG2 4.48Å; Y302-V339 HydrophobicContact CE2-CG2 4.02Å; Y302-L342 HydrophobicContact CD1-CD1 3.82Å; Y302-L342 HydrophobicContact CD1-CD2 3.71Å; Y302-L342 HydrophobicContact CD1-CG 4.46Å; Y302-L342 HydrophobicContact CE1-CD2 3.78Å; Y302-L342 HydrophobicContact CG-CD1 4.1Å; Y302-I381 HydrophobicContact CD1-CB 4.41Å; Y302-I381 HydrophobicContact CD2-CB 4.37Å; Y302-I381 HydrophobicContact CE1-CB 3.99Å; Y302-I381 HydrophobicContact CE1-CG2 3.83Å; Y302-I381 HydrophobicContact CE2-CB 3.96Å; Y302-I381 HydrophobicContact CE2-CD1 3.82Å; Y302-I381 HydrophobicContact CE2-CG1 4.33Å; Y302-I381 HydrophobicContact CE2-CG2 4.35Å; Y302-I381 PolarHBondContact N-O 3.16Å; Y302-I381 PolarHBondContact O-N 3.25Å; Y302-V468 WeakPolarHBondContact OH-CG1 3.4Å
303	E	92.1	Very high	91.5	Very high	3 Å²	3	20.2 Å²	20.2	1%	0.014	9%	0.092	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-116.8	143.7	172.5	65.6	179.4	150	0	0	112	L309 Y310 L312 R324 A367 S378 H379	E303-L309 WeakPolarHBondContact O-CA 3.42Å; E303-Y310 HydrophobicContact CG-CD2 4.32Å; E303-Y310 PolarHBondContact N-O 3.14Å; E303-Y310 PolarHBondContact O-N 3.31Å; E303-L312 HydrophobicContact CB-CD1 4.23Å; E303-L312 HydrophobicContact CB-CD2 4.45Å; E303-L312 HydrophobicContact CB-CG 4.44Å; E303-L312 HydrophobicContact CG-CD2 3.96Å; E303-L312 HydrophobicContact CG-CG 4.36Å; E303-R324 IonicContact OE1-CZ 3.15Å; E303-R324 IonicContact OE1-NH1 3.82Å; E303-R324 PolarHBondContact OE1-NH1 3.35Å; E303-A367 WeakPolarHBondContact OE1-CB 3.21Å; E303-S378 WeakPolarHBondContact OE2-CB 3.4Å; E303-S378 PolarHBondContact OE2-OG 3.04Å; E303-H379 CarbonylContact C-O 3.5Å; E303-H379 WeakPolarHBondContact CA-O 3.44Å
304	I	91.7	Very high	91.3	Very high	4 Å²	4	24.1 Å²	24.1	2%	0.021	11%	0.113	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-100.9	105.5	165.5	-49.6	-175.1	0	0	0	107.4	Y302 F308 L309 S378 H379 I381 K464 L465 V468	Y302-I304 HydrophobicContact CE2-CG1 4.44Å; I304-F308 CarbonylContact C-O 3.6Å; I304-F308 WeakPolarHBondContact CA-O 3.38Å; I304-L309 HydrophobicContact CG1-CD2 4.47Å; I304-L309 HydrophobicContact CG1-CG 4.26Å; I304-S378 WeakPolarHBondContact O-CA 3.47Å; I304-H379 HydrophobicContact CB-CB 4.28Å; I304-H379 PolarHBondContact N-O 3.29Å; I304-H379 PolarHBondContact O-N 3.14Å; I304-I381 HydrophobicContact CD1-CD1 3.73Å; I304-I381 HydrophobicContact CG1-CD1 4.13Å; I304-K464 HydrophobicContact CD1-CB 4.46Å; I304-K464 HydrophobicContact CG2-CB 4.16Å; I304-L465 HydrophobicContact CD1-CB 4.28Å; I304-L465 HydrophobicContact CD1-CD1 4.25Å; I304-V468 HydrophobicContact CD1-CG2 4.45Å
305	Y	86.8	Confident	89.9	Confident	62 Å²	62	21.3 Å²	21.3	24%	0.243	10%	0.103	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-122.8	127.9	179.9	177.1	-111	0	0	0	109.5	E307 F308 Y310 R377 E426	Y305-E307 PolarHBondContact O-N 3Å; Y305-F308 PolarHBondContact N-O 2.65Å; Y305-F308 PolarHBondContact O-N 2.79Å; Y305-F308 VanDerWaalsContact O-O 3.14Å; Y305-Y310 HydrophobicContact CD1-CE2 4.13Å; Y305-R377 WeakPolarHBondContact CD2-O 3.42Å; Y305-E426 HydrophobicContact CE2-CG 3.79Å; Y305-E426 PolarHBondContact OH-OE2 2.9Å; Y305-E426 VanDerWaalsContact OH-OE2 3.11Å
306	N	83.6	Confident	88.3	Confident	47 Å²	47	25.2 Å²	25.2	25%	0.251	13%	0.131	S	C	.	.	T	Hydrogen-bonded Turn	trans	55.1	35.9	176.2	-168.2	29	0	0	0	113.8	F308 N429	N306-F308 HydrophobicContact CB-CD2 4.41Å; N306-F308 WeakPolarHBondContact O-CD2 3.46Å; N306-F308 PolarHBondContact O-N 2.76Å; N306-N429 PolarHBondContact OD1-ND2 3.08Å
307	E	88.6	Confident	86	Confident	47 Å²	47	31.4 Å²	31.4	22%	0.22	17%	0.171	C	C	.	.	T	Hydrogen-bonded Turn	trans	61.9	16.3	-173.1	-71.2	-72	136.7	0	0	115.8	Y305 S433 S463 K464	Y305-E307 PolarHBondContact O-N 3Å; E307-S433 WeakPolarHBondContact OE1-CB 3.33Å; E307-S463 WeakPolarHBondContact OE1-CB 3.48Å; E307-S463 PolarHBondContact OE1-OG 3.42Å; E307-S463 WeakPolarHBondContact OE2-CA 3.14Å; E307-K464 VanDerWaalsContact O-CG 3.3Å; E307-K464 WeakPolarHBondContact O-CG 3.38Å; E307-K464 WeakPolarHBondContact OE2-CG 3.47Å; E307-K464 PolarHBondContact OE2-N 2.82Å
308	F	89.2	Confident	83.7	Confident	97 Å²	97	34 Å²	34	43%	0.425	19%	0.189	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-108	148.5	166.8	-60.8	-80.8	0	0	0	110.9	I304 Y305 N306 Y310 T326	I304-F308 CarbonylContact C-O 3.6Å; I304-F308 WeakPolarHBondContact CA-O 3.38Å; Y305-F308 PolarHBondContact N-O 2.65Å; Y305-F308 PolarHBondContact O-N 2.79Å; Y305-F308 VanDerWaalsContact O-O 3.14Å; N306-F308 HydrophobicContact CB-CD2 4.41Å; N306-F308 WeakPolarHBondContact O-CD2 3.46Å; N306-F308 PolarHBondContact O-N 2.76Å; F308-Y310 HydrophobicContact CB-CD2 4.5Å; F308-Y310 HydrophobicContact CB-CE2 3.67Å; F308-T326 HydrophobicContact CB-CG2 4.02Å; F308-T326 HydrophobicContact CD1-CG2 3.73Å; F308-T326 HydrophobicContact CG-CG2 4.06Å
309	L	91.8	Very high	81.4	Confident	3 Å²	3	44 Å²	44	2%	0.016	24%	0.236	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-99	134.2	173.8	-64.2	92.3	0	0	0	109.6	Y302 E303 I304 T326 L327 L329 V339 K464 V468	Y302-L309 HydrophobicContact CD2-CD2 4.18Å; Y302-L309 HydrophobicContact CE2-CD2 3.98Å; E303-L309 WeakPolarHBondContact O-CA 3.42Å; I304-L309 HydrophobicContact CG1-CD2 4.47Å; I304-L309 HydrophobicContact CG1-CG 4.26Å; L309-T326 CarbonylContact O-C 3.56Å; L309-T326 WeakPolarHBondContact O-CA 3.46Å; L309-L327 HydrophobicContact CB-CB 3.96Å; L309-L327 PolarHBondContact O-N 2.99Å; L309-L329 HydrophobicContact CD1-CD2 4.37Å; L309-L329 HydrophobicContact CD1-CG 4.13Å; L309-L329 HydrophobicContact CD2-CD2 3.74Å; L309-L329 HydrophobicContact CD2-CG 4.38Å; L309-V339 HydrophobicContact CD2-CG1 4.01Å; L309-V339 HydrophobicContact CD2-CG2 3.84Å; L309-K464 HydrophobicContact CD1-CB 4.02Å; L309-K464 HydrophobicContact CD1-CD 4.2Å; L309-K464 HydrophobicContact CD1-CG 3.83Å; L309-V468 HydrophobicContact CD2-CG2 4.44Å
310	Y	90.8	Very high	79	Confident	34 Å²	34	49.8 Å²	49.8	13%	0.133	26%	0.263	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-128.9	128.7	177.1	-60.2	-76.2	0	0	0	110.1	Y302 E303 Y305 F308 R324 V325 T326	Y302-Y310 CarbonylContact C-O 3.56Å; Y302-Y310 VanDerWaalsContact CA-O 3.28Å; Y302-Y310 WeakPolarHBondContact CA-O 3.33Å; Y302-Y310 VanDerWaalsContact CB-O 3.23Å; Y302-Y310 WeakPolarHBondContact CB-O 3.35Å; E303-Y310 HydrophobicContact CG-CD2 4.32Å; E303-Y310 PolarHBondContact N-O 3.14Å; E303-Y310 PolarHBondContact O-N 3.31Å; Y305-Y310 HydrophobicContact CD1-CE2 4.13Å; F308-Y310 HydrophobicContact CB-CD2 4.5Å; F308-Y310 HydrophobicContact CB-CE2 3.67Å; Y310-R324 HydrophobicContact CD1-CB 3.67Å; Y310-R324 HydrophobicContact CE1-CB 3.69Å; Y310-V325 WeakPolarHBondContact CD1-O 3.43Å; Y310-T326 HydrophobicContact CD1-CG2 4.47Å; Y310-T326 HydrophobicContact CE1-CG2 3.63Å
311	D	92.5	Very high	76.8	Confident	23 Å²	23	56.4 Å²	56.4	12%	0.123	31%	0.306	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-64.8	134.7	169.7	-154.9	-38.3	0	0	0	109.6	L313 D314 L327 T343	D311-L313 WeakPolarHBondContact OD1-CA 3.22Å; D311-L313 WeakPolarHBondContact OD1-CB 3.49Å; D311-L313 PolarHBondContact OD1-N 3.37Å; D311-D314 HydrophobicContact CB-CB 3.99Å; D311-D314 PolarHBondContact OD1-N 2.89Å; D311-L327 HydrophobicContact CB-CD1 4.08Å; D311-T343 WeakPolarHBondContact OD2-CB 3.25Å; D311-T343 PolarHBondContact OD2-N 2.77Å; D311-T343 PolarHBondContact OD2-OG1 2.82Å
312	L	90.9	Very high	75.1	Confident	0 Å²	0	64.9 Å²	64.9	0%	0	34%	0.338	C	S	.	.	S	Bend	trans	-97.4	-8.3	173.3	-65	176.3	0	0	0	112.1	F301 E303 G360 N363 Q364	F301-L312 HydrophobicContact CD1-CB 4.16Å; F301-L312 HydrophobicContact CD1-CD1 4.01Å; F301-L312 HydrophobicContact CD2-CD1 3.91Å; F301-L312 HydrophobicContact CE1-CD1 3.8Å; F301-L312 HydrophobicContact CE2-CD1 3.71Å; F301-L312 HydrophobicContact CG-CB 4.29Å; F301-L312 HydrophobicContact CG-CD1 4.04Å; F301-L312 HydrophobicContact CZ-CD1 3.64Å; F301-L312 WeakPolarHBondContact O-CB 3.41Å; F301-L312 PolarHBondContact O-N 3.05Å; E303-L312 HydrophobicContact CB-CD1 4.23Å; E303-L312 HydrophobicContact CB-CD2 4.45Å; E303-L312 HydrophobicContact CB-CG 4.44Å; E303-L312 HydrophobicContact CG-CD2 3.96Å; E303-L312 HydrophobicContact CG-CG 4.36Å; L312-G360 WeakPolarHBondContact O-CA 3.34Å; L312-N363 HydrophobicContact CD2-CB 4.44Å; L312-N363 WeakPolarHBondContact O-CB 3.46Å; L312-N363 PolarHBondContact O-ND2 3.4Å; L312-Q364 HydrophobicContact CD1-CB 4.21Å; L312-Q364 HydrophobicContact CD2-CB 3.93Å
313	L	89.9	Confident	73.6	Confident	2 Å²	2	74 Å²	74	1%	0.01	38%	0.378	C	S	.	.	S	Bend	trans	-104.2	-5.6	-179.5	-52.4	-174.7	0	0	0	113.2	L233 F301 D311 A315 T343 I345 I356	L233-L313 WeakPolarHBondContact CD1-O 3.46Å; F301-L313 HydrophobicContact CB-CD1 4.08Å; F301-L313 HydrophobicContact CB-CD2 3.95Å; F301-L313 HydrophobicContact CB-CG 3.94Å; F301-L313 HydrophobicContact CD1-CD2 4.44Å; D311-L313 WeakPolarHBondContact OD1-CA 3.22Å; D311-L313 WeakPolarHBondContact OD1-CB 3.49Å; D311-L313 PolarHBondContact OD1-N 3.37Å; L313-A315 PolarHBondContact O-N 3.12Å; L313-T343 HydrophobicContact CB-CG2 4.24Å; L313-I345 HydrophobicContact CB-CD1 4.21Å; L313-I345 HydrophobicContact CD1-CD1 3.84Å; L313-I345 HydrophobicContact CD1-CG1 4.27Å; L313-I356 HydrophobicContact CD1-CG2 3.97Å; L313-I356 HydrophobicContact CD2-CG2 3.67Å; L313-I356 HydrophobicContact CG-CG2 4.49Å
314	D	83	Confident	72.7	Confident	88 Å²	88	78.1 Å²	78.1	47%	0.471	39%	0.393	S	S	.	.			trans	-75.9	86.3	170.8	-174.8	30.8	0	0	0	111	D311 S316	D311-D314 HydrophobicContact CB-CB 3.99Å; D311-D314 PolarHBondContact OD1-N 2.89Å; D314-S316 PolarHBondContact O-N 3.24Å
315	A	61.4	Low	72.3	Confident	18 Å²	18	82.8 Å²	82.8	15%	0.149	42%	0.422	C	S	.	.			trans	-65	98.3	175.7	0	0	0	0	0	111.1	L233 L313 P317	L233-A315 HydrophobicContact CD2-CB 3.71Å; L233-A315 HydrophobicContact CG-CB 4.41Å; L313-A315 PolarHBondContact O-N 3.12Å; A315-P317 WeakPolarHBondContact O-CD 3.41Å; A315-P317 VanDerWaalsContact O-CG 3.3Å; A315-P317 WeakPolarHBondContact O-CG 3.26Å
316	S	56.8	Low	72.4	Confident	86 Å²	86	82.7 Å²	82.7	60%	0.601	43%	0.427	S	S	*	.			trans	-63.9	106.4	174.3	-73.5	0	0	0	0	111	D314 S318	D314-S316 PolarHBondContact O-N 3.24Å; S316-S318 PolarHBondContact O-N 2.9Å
317	P	46.3	Very low	72.8	Confident	131 Å²	131	81.4 Å²	81.4	85%	0.851	42%	0.42	S	S	*	.			trans	-76.8	24	-162.6	-18.3	33.9	0	0	0	116.2	A315	A315-P317 WeakPolarHBondContact O-CD 3.41Å; A315-P317 VanDerWaalsContact O-CG 3.3Å; A315-P317 WeakPolarHBondContact O-CG 3.26Å
318	S	45.6	Very low	73	Confident	55 Å²	55	88 Å²	88	39%	0.385	44%	0.443	S	S	.	.	S	Bend	trans	-154.9	142.3	-174.2	67	0	0	0	0	112.5	S316 Q320	S316-S318 PolarHBondContact O-N 2.9Å; S318-Q320 PolarHBondContact O-N 2.82Å
319	Q	47.9	Very low	73.1	Confident	211 Å²	211	85 Å²	85	99%	0.986	43%	0.431	S	S	*	.	S	Bend	trans	-71.3	21.4	175.9	-61.8	172	-48.4	0	0	113.8
320	Q	46.1	Very low	73	Confident	121 Å²	121	86.6 Å²	86.6	57%	0.565	44%	0.443	S	S	*	.	S	Bend	trans	-85.7	137.7	174	-69.5	-171.4	-15.9	0	0	110.1	S318 R322	S318-Q320 PolarHBondContact O-N 2.82Å; Q320-R322 HydrophobicContact CB-CG 4.38Å; Q320-R322 PolarHBondContact O-N 3.04Å
321	P	49.4	Very low	72.8	Confident	140 Å²	140	88 Å²	88	91%	0.909	45%	0.453	S	S	*	.			trans	-74.6	68.7	177.5	32.2	-36.2	0	0	0	111.4
322	R	57.8	Low	72.3	Confident	182 Å²	182	88 Å²	88	69%	0.687	45%	0.453	S	S	*	.	P	Polyproline II helix	trans	-75.4	137.4	172	-68.2	-172.2	178.1	-162.2	-0.7	109.7	Q320 R324	Q320-R322 HydrophobicContact CB-CG 4.38Å; Q320-R322 PolarHBondContact O-N 3.04Å; R322-R324 PolarHBondContact O-N 3.17Å
323	K	64.2	Low	71.8	Confident	200 Å²	200	96.2 Å²	96.2	87%	0.87	49%	0.488	S	S	*	.	P	Polyproline II helix	trans	-65.5	123.8	175	-175.7	179.3	-179.1	-179.9	0	109.2	V325	K323-V325 PolarHBondContact O-N 3.39Å
324	R	73.4	Confident	71	Confident	90 Å²	90	102.1 Å²	102.1	34%	0.34	52%	0.516	S	S	.	.	P	Polyproline II helix	trans	-50.1	136	177.7	-70	-178.5	163.9	-147.4	-8.3	112.1	E303 Y310 R322 N363 A367	E303-R324 IonicContact OE1-CZ 3.15Å; E303-R324 IonicContact OE1-NH1 3.82Å; E303-R324 PolarHBondContact OE1-NH1 3.35Å; Y310-R324 HydrophobicContact CD1-CB 3.67Å; Y310-R324 HydrophobicContact CE1-CB 3.69Å; R322-R324 PolarHBondContact O-N 3.17Å; R324-N363 PolarHBondContact NH2-O 3.48Å; R324-A367 VanDerWaalsContact NH1-CB 3.26Å; R324-A367 VanDerWaalsContact NH2-CA 3.35Å; R324-A367 VanDerWaalsContact NH2-CB 3.31Å
325	V	83.3	Confident	70.7	Confident	102 Å²	102	99.7 Å²	99.7	62%	0.618	51%	0.512	S	S	*	.	P	Polyproline II helix	trans	-71.9	130.8	174.4	-177.4	0	0	0	0	108.8	Y310 K323	Y310-V325 WeakPolarHBondContact CD1-O 3.43Å; K323-V325 PolarHBondContact O-N 3.39Å
326	T	88.6	Confident	71.7	Confident	59 Å²	59	99.1 Å²	99.1	36%	0.362	51%	0.507	S	S	.	.			trans	-94.1	115.9	175.9	55.4	0	0	0	0	109.6	F308 L309 Y310	F308-T326 HydrophobicContact CB-CG2 4.02Å; F308-T326 HydrophobicContact CD1-CG2 3.73Å; F308-T326 HydrophobicContact CG-CG2 4.06Å; L309-T326 CarbonylContact O-C 3.56Å; L309-T326 WeakPolarHBondContact O-CA 3.46Å; Y310-T326 HydrophobicContact CD1-CG2 4.47Å; Y310-T326 HydrophobicContact CE1-CG2 3.63Å
327	L	91.7	Very high	73.1	Confident	20 Å²	20	95.5 Å²	95.5	11%	0.105	48%	0.481	C	S	.	.	B	Isolated β-bridge	trans	-66.8	160.2	174.4	-56.7	-176.9	0	0	0	111.1	L309 D311 V339 D341 L342	L309-L327 HydrophobicContact CB-CB 3.96Å; L309-L327 PolarHBondContact O-N 2.99Å; D311-L327 HydrophobicContact CB-CD1 4.08Å; L327-V339 HydrophobicContact CB-CG1 3.84Å; L327-V339 HydrophobicContact CD1-CG1 3.66Å; L327-V339 HydrophobicContact CG-CG1 4.41Å; L327-D341 HydrophobicContact CD2-CB 4.37Å; L327-D341 WeakPolarHBondContact CD2-O 3.34Å; L327-L342 HydrophobicContact CD1-CB 4.08Å; L327-L342 HydrophobicContact CD1-CD1 3.78Å
328	R	91.9	Very high	75.3	Confident	185 Å²	185	91 Å²	91	70%	0.698	45%	0.447	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-118.6	139.3	-179.6	-64.8	-175	-179.7	-170.7	1.1	110.6	K340	R328-K340 WeakPolarHBondContact O-CB 3.5Å; R328-K340 PolarHBondContact O-N 2.88Å
329	L	91.5	Very high	77.5	Confident	34 Å²	34	89.1 Å²	89.1	18%	0.178	43%	0.434	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-73.6	143.4	162.3	-61.4	-177	0	0	0	109.4	L309 Y338 V339 K464 R467 V468	L309-L329 HydrophobicContact CD1-CD2 4.37Å; L309-L329 HydrophobicContact CD1-CG 4.13Å; L309-L329 HydrophobicContact CD2-CD2 3.74Å; L309-L329 HydrophobicContact CD2-CG 4.38Å; L329-Y338 WeakPolarHBondContact CA-O 3.28Å; L329-V339 HydrophobicContact CD2-CB 4.45Å; L329-V339 HydrophobicContact CD2-CG2 3.83Å; L329-K464 HydrophobicContact CD1-CB 4.28Å; L329-K464 HydrophobicContact CD1-CD 3.84Å; L329-K464 HydrophobicContact CG-CD 4.39Å; L329-R467 HydrophobicContact CD1-CB 3.73Å; L329-R467 HydrophobicContact CD1-CG 3.73Å; L329-V468 HydrophobicContact CD1-CG2 4.14Å; L329-V468 HydrophobicContact CD2-CG2 3.66Å
330	S	89.7	Confident	79.5	Confident	37 Å²	37	83 Å²	83	26%	0.259	40%	0.404	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-141.3	158.5	172.5	-67.9	0	0	0	0	108.6	P337 Y338	S330-P337 WeakPolarHBondContact O-CA 3.42Å; S330-Y338 PolarHBondContact N-O 3.44Å; S330-Y338 VanDerWaalsContact O-CD1 3.22Å; S330-Y338 WeakPolarHBondContact O-CD1 3.49Å; S330-Y338 PolarHBondContact O-N 2.97Å
331	D	86.9	Confident	81.6	Confident	65 Å²	65	82.5 Å²	82.5	35%	0.348	41%	0.405	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-100.9	141.6	175	-58.8	-26.7	0	0	0	107.8	N336 R461 R467	D331-N336 CarbonylContact C-O 3.53Å; D331-N336 WeakPolarHBondContact CA-O 3.27Å; D331-R461 IonicContact OD2-NH2 2.9Å; D331-R461 PolarHBondContact OD2-NH2 2.99Å; D331-R461 VanDerWaalsContact OD2-NH2 3.1Å; D331-R467 IonicContact OD1-CZ 3.14Å; D331-R467 IonicContact OD1-NE 2.65Å; D331-R467 PolarHBondContact OD1-NE 3.22Å; D331-R467 IonicContact OD1-NH2 2.67Å; D331-R467 PolarHBondContact OD1-NH2 3.33Å; D331-R467 IonicContact OD2-CZ 3.09Å; D331-R467 IonicContact OD2-NH2 2.61Å; D331-R467 PolarHBondContact OD2-NH2 3.02Å
332	D	82.8	Confident	83.7	Confident	21 Å²	21	76.7 Å²	76.7	11%	0.112	37%	0.366	C	S	.	.			trans	-83	-172.3	175.8	74.9	3.8	0	0	0	112.5	M211 Y212 Q334 G335 N336 Y338	M211-D332 HydrophobicContact CB-CB 4.44Å; M211-D332 HydrophobicContact CE-CB 3.77Å; Y212-D332 WeakPolarHBondContact CB-OD2 3.37Å; D332-Q334 PolarHBondContact O-N 3.15Å; D332-Q334 WeakPolarHBondContact OD1-CA 3.42Å; D332-Q334 WeakPolarHBondContact OD1-CB 3.43Å; D332-Q334 PolarHBondContact OD1-N 3.01Å; D332-G335 PolarHBondContact O-N 2.88Å; D332-G335 PolarHBondContact OD1-N 3.32Å; D332-N336 PolarHBondContact N-O 2.8Å; D332-N336 WeakPolarHBondContact OD1-CB 3.22Å; D332-N336 PolarHBondContact OD1-N 2.91Å; D332-N336 PolarHBondContact OD1-ND2 2.89Å; D332-N336 WeakPolarHBondContact OD2-CB 3.48Å; D332-N336 PolarHBondContact OD2-ND2 2.95Å; D332-Y338 HydrophobicContact CB-CD1 4.16Å; D332-Y338 HydrophobicContact CB-CE1 4.24Å
333	K	78.6	Confident	85.3	Confident	173 Å²	173	69 Å²	69	75%	0.752	34%	0.339	S	S	*	.	T	Hydrogen-bonded Turn	trans	-58.8	-30.4	179.2	-60.8	174.3	-170.6	155	0	113.3	D214	D214-K333 IonicContact OD2-NZ 2.8Å
334	Q	74.6	Confident	86.7	Confident	126 Å²	126	60.5 Å²	60.5	59%	0.589	30%	0.302	S	S	*	.	T	Hydrogen-bonded Turn	trans	-93.1	1.3	-179.5	-60.9	167.4	-5.7	0	0	111.8	D332 N336	D332-Q334 PolarHBondContact O-N 3.15Å; D332-Q334 WeakPolarHBondContact OD1-CA 3.42Å; D332-Q334 WeakPolarHBondContact OD1-CB 3.43Å; D332-Q334 PolarHBondContact OD1-N 3.01Å; Q334-N336 WeakPolarHBondContact CB-ND2 3.38Å; Q334-N336 PolarHBondContact OE1-ND2 3.26Å
335	G	75.6	Confident	87.6	Confident	38 Å²	38	56.4 Å²	56.4	39%	0.392	29%	0.287	S	S	.	.	S	Bend	trans	80.5	11.8	-177.1	0	0	0	0	0	114.8	D332	D332-G335 PolarHBondContact O-N 2.88Å; D332-G335 PolarHBondContact OD1-N 3.32Å
336	N	82.3	Confident	88.1	Confident	6 Å²	6	51.7 Å²	51.7	3%	0.032	26%	0.258	C	S	.	.			trans	-75.1	130.2	177.2	-51.8	-51.6	0	0	0	110.6	Y212 D331 D332 Q334 R476	Y212-N336 HydrophobicContact CD1-CB 3.67Å; Y212-N336 VanDerWaalsContact CD1-ND2 3.3Å; Y212-N336 WeakPolarHBondContact CD1-ND2 3.26Å; Y212-N336 HydrophobicContact CD2-CB 4.25Å; Y212-N336 HydrophobicContact CE1-CB 4.27Å; Y212-N336 HydrophobicContact CG-CB 3.66Å; D331-N336 CarbonylContact C-O 3.53Å; D331-N336 WeakPolarHBondContact CA-O 3.27Å; D332-N336 PolarHBondContact N-O 2.8Å; D332-N336 WeakPolarHBondContact OD1-CB 3.22Å; D332-N336 PolarHBondContact OD1-N 2.91Å; D332-N336 PolarHBondContact OD1-ND2 2.89Å; D332-N336 WeakPolarHBondContact OD2-CB 3.48Å; D332-N336 PolarHBondContact OD2-ND2 2.95Å; Q334-N336 WeakPolarHBondContact CB-ND2 3.38Å; Q334-N336 PolarHBondContact OE1-ND2 3.26Å; N336-R476 PolarHBondContact OD1-NE 3.49Å; N336-R476 VanDerWaalsContact OD1-NE 3.12Å; N336-R476 PolarHBondContact OD1-NH1 2.95Å; N336-R476 PolarHBondContact OD1-NH2 3.32Å
337	P	88	Confident	88.3	Confident	9 Å²	9	49.1 Å²	49.1	6%	0.058	24%	0.242	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-73.4	130.5	175.7	28.4	-31.1	0	0	0	111	S330 R467 Q470	S330-P337 WeakPolarHBondContact O-CA 3.42Å; P337-R467 HydrophobicContact CB-CG 4.01Å; P337-R467 WeakPolarHBondContact CB-O 3.48Å; P337-R467 WeakPolarHBondContact CG-O 3.23Å; P337-Q470 HydrophobicContact CG-CB 4.32Å
338	Y	90.8	Very high	88.2	Confident	36 Å²	36	52.5 Å²	52.5	14%	0.141	25%	0.253	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-133.7	160.3	172.6	74.6	-79.9	0	0	0	110.9	M211 L329 S330 D332 K340	M211-Y338 HydrophobicContact CE-CD1 4.42Å; M211-Y338 HydrophobicContact CE-CE1 3.54Å; M211-Y338 HydrophobicContact CE-CE2 4.5Å; M211-Y338 WeakPolarHBondContact CE-OH 3.37Å; M211-Y338 HydrophobicContact SD-CE1 4.03Å; M211-Y338 HydrophobicContact SD-CE2 3.9Å; M211-Y338 VanDerWaalsContact SD-CZ 3.53Å; M211-Y338 PolarHBondContact SD-OH 2.91Å; L329-Y338 WeakPolarHBondContact CA-O 3.28Å; S330-Y338 PolarHBondContact N-O 3.44Å; S330-Y338 VanDerWaalsContact O-CD1 3.22Å; S330-Y338 WeakPolarHBondContact O-CD1 3.49Å; S330-Y338 PolarHBondContact O-N 2.97Å; D332-Y338 HydrophobicContact CB-CD1 4.16Å; D332-Y338 HydrophobicContact CB-CE1 4.24Å; Y338-K340 HydrophobicContact CE2-CB 4.02Å; Y338-K340 HydrophobicContact CE2-CG 4.14Å
339	V	92.9	Very high	88.2	Confident	17 Å²	17	45.1 Å²	45.1	10%	0.103	23%	0.23	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-86.1	114.3	172.8	-170.2	0	0	0	0	108.6	Y302 L309 L327 L329 L342 V468	Y302-V339 HydrophobicContact CE1-CG2 4.48Å; Y302-V339 HydrophobicContact CE2-CG2 4.02Å; L309-V339 HydrophobicContact CD2-CG1 4.01Å; L309-V339 HydrophobicContact CD2-CG2 3.84Å; L327-V339 HydrophobicContact CB-CG1 3.84Å; L327-V339 HydrophobicContact CD1-CG1 3.66Å; L327-V339 HydrophobicContact CG-CG1 4.41Å; L329-V339 HydrophobicContact CD2-CB 4.45Å; L329-V339 HydrophobicContact CD2-CG2 3.83Å; V339-L342 HydrophobicContact CB-CB 4.06Å; V339-L342 HydrophobicContact CB-CD2 3.99Å; V339-L342 HydrophobicContact CG1-CB 3.93Å; V339-L342 HydrophobicContact CG1-CD2 4.39Å; V339-L342 HydrophobicContact CG2-CD2 4.36Å; V339-V468 HydrophobicContact CG2-CG2 4.5Å
340	K	90.6	Very high	88.1	Confident	82 Å²	82	43.9 Å²	43.9	36%	0.357	23%	0.225	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-75.1	142.6	175.7	-160.1	-167.7	172.8	-89.9	0	110.2	R328 Y338 L342	R328-K340 WeakPolarHBondContact O-CB 3.5Å; R328-K340 PolarHBondContact O-N 2.88Å; Y338-K340 HydrophobicContact CE2-CB 4.02Å; Y338-K340 HydrophobicContact CE2-CG 4.14Å; K340-L342 PolarHBondContact O-N 2.77Å
341	D	89.5	Confident	88	Confident	110 Å²	110	47.2 Å²	47.2	59%	0.588	24%	0.236	S	C	*	.	T	Hydrogen-bonded Turn	trans	63.9	21.1	175.2	-46.6	-46.9	0	0	0	114	L327	L327-D341 HydrophobicContact CD2-CB 4.37Å; L327-D341 WeakPolarHBondContact CD2-O 3.34Å
342	L	92.4	Very high	88.2	Confident	19 Å²	19	45.4 Å²	45.4	10%	0.099	23%	0.225	C	C	.	.			trans	-74.9	136.8	172.6	178.7	62.9	0	0	0	111.8	Y302 L327 V339 K340 W344	Y302-L342 HydrophobicContact CD1-CD1 3.82Å; Y302-L342 HydrophobicContact CD1-CD2 3.71Å; Y302-L342 HydrophobicContact CD1-CG 4.46Å; Y302-L342 HydrophobicContact CE1-CD2 3.78Å; Y302-L342 HydrophobicContact CG-CD1 4.1Å; L327-L342 HydrophobicContact CD1-CB 4.08Å; L327-L342 HydrophobicContact CD1-CD1 3.78Å; V339-L342 HydrophobicContact CB-CB 4.06Å; V339-L342 HydrophobicContact CB-CD2 3.99Å; V339-L342 HydrophobicContact CG1-CB 3.93Å; V339-L342 HydrophobicContact CG1-CD2 4.39Å; V339-L342 HydrophobicContact CG2-CD2 4.36Å; K340-L342 PolarHBondContact O-N 2.77Å; L342-W344 HydrophobicContact CD2-CZ2 4.22Å; L342-W344 PolarHBondContact O-N 2.88Å
343	T	91.9	Very high	88.5	Confident	20 Å²	20	44.4 Å²	44.4	12%	0.123	22%	0.22	C	C	.	.			trans	-74.4	117.6	177.9	-55.2	0	0	0	0	111.4	S300 D311 L313 I345	S300-T343 WeakPolarHBondContact CA-O 3.35Å; S300-T343 WeakPolarHBondContact CB-O 3.49Å; D311-T343 WeakPolarHBondContact OD2-CB 3.25Å; D311-T343 PolarHBondContact OD2-N 2.77Å; D311-T343 PolarHBondContact OD2-OG1 2.82Å; L313-T343 HydrophobicContact CB-CG2 4.24Å; T343-I345 HydrophobicContact CG2-CD1 4.31Å; T343-I345 HydrophobicContact CG2-CG1 3.9Å
344	W	93.2	Very high	88.9	Confident	21 Å²	21	38 Å²	38	8%	0.08	19%	0.191	C	C	.	.			trans	-107.4	129.6	168.5	-67.5	92	0	0	0	110	W298 V299 S300 L342 R385	W298-W344 HydrophobicContact CB-CE3 4.24Å; W298-W344 HydrophobicContact CE3-CB 3.98Å; V299-W344 WeakPolarHBondContact O-CA 3.4Å; S300-W344 WeakPolarHBondContact OG-CH2 3.44Å; S300-W344 VanDerWaalsContact OG-CZ2 3.3Å; S300-W344 WeakPolarHBondContact OG-CZ2 3.39Å; S300-W344 WeakPolarHBondContact OG-CZ3 3.47Å; L342-W344 HydrophobicContact CD2-CZ2 4.22Å; L342-W344 PolarHBondContact O-N 2.88Å; W344-R385 HydrophobicContact CE3-CG 4.44Å; W344-R385 VanDerWaalsContact CH2-CD 3.45Å; W344-R385 HydrophobicContact CH2-CG 3.64Å; W344-R385 HydrophobicContact CZ3-CB 3.98Å; W344-R385 HydrophobicContact CZ3-CG 3.61Å
345	I	93	Very high	89.6	Confident	5 Å²	5	35.3 Å²	35.3	3%	0.026	18%	0.176	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-121.9	124.7	-177.4	-49.5	-179.8	0	0	0	109.2	R230 L233 W298 V299 L313 T343 I356	R230-I345 HydrophobicContact CB-CG2 4.01Å; R230-I345 HydrophobicContact CG-CG2 3.77Å; L233-I345 HydrophobicContact CD1-CD1 3.34Å; W298-I345 CarbonylContact C-O 3.48Å; W298-I345 WeakPolarHBondContact CA-O 3.49Å; V299-I345 HydrophobicContact CG2-CB 4.47Å; V299-I345 PolarHBondContact N-O 3.28Å; V299-I345 PolarHBondContact O-N 2.88Å; L313-I345 HydrophobicContact CB-CD1 4.21Å; L313-I345 HydrophobicContact CD1-CD1 3.84Å; L313-I345 HydrophobicContact CD1-CG1 4.27Å; T343-I345 HydrophobicContact CG2-CD1 4.31Å; T343-I345 HydrophobicContact CG2-CG1 3.9Å; I345-I356 HydrophobicContact CB-CD1 4.38Å; I345-I356 HydrophobicContact CD1-CD1 4.32Å; I345-I356 HydrophobicContact CG2-CD1 3.95Å
346	Q	93.6	Very high	90.4	Very high	3 Å²	3	33.6 Å²	33.6	1%	0.014	16%	0.158	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-71.4	136.9	171.1	-163.1	-178.3	0.4	0	0	110.4	Y202 A204 M205 R230 S296 I297 W298	Y202-Q346 PolarHBondContact O-NE2 3.47Å; A204-Q346 PolarHBondContact O-NE2 3.43Å; A204-Q346 PolarHBondContact O-OE1 3.24Å; M205-Q346 VanDerWaalsContact CA-OE1 3.29Å; M205-Q346 HydrophobicContact CE-CB 4.02Å; M205-Q346 VanDerWaalsContact CG-OE1 3.24Å; R230-Q346 WeakPolarHBondContact CD-O 3.45Å; S296-Q346 PolarHBondContact OG-NE2 3.03Å; I297-Q346 CarbonylContact O-C 3.58Å; I297-Q346 VanDerWaalsContact O-CA 3.31Å; I297-Q346 WeakPolarHBondContact O-CA 3.43Å; W298-Q346 HydrophobicContact CD2-CB 3.85Å; W298-Q346 HydrophobicContact CD2-CG 4.31Å; W298-Q346 HydrophobicContact CE3-CB 4Å; W298-Q346 VanDerWaalsContact CE3-N 3.29Å; W298-Q346 HydrophobicContact CH2-CB 3.94Å; W298-Q346 HydrophobicContact CZ2-CB 3.78Å; W298-Q346 HydrophobicContact CZ2-CG 4.1Å; W298-Q346 HydrophobicContact CZ3-CB 4.04Å
347	I	93	Very high	90.7	Very high	4 Å²	4	33.6 Å²	33.6	2%	0.021	16%	0.157	C	C	.	.			trans	-123.3	133.5	-178.2	41.6	165.1	0	0	0	110.8	F194 I297 V299 E352 A353 I356	F194-I347 HydrophobicContact CE2-CD1 3.8Å; F194-I347 HydrophobicContact CE2-CG1 4.44Å; F194-I347 HydrophobicContact CZ-CB 4.24Å; F194-I347 HydrophobicContact CZ-CD1 3.81Å; F194-I347 HydrophobicContact CZ-CG1 3.94Å; I297-I347 HydrophobicContact CB-CG1 4.11Å; I297-I347 HydrophobicContact CG2-CD1 3.8Å; I297-I347 HydrophobicContact CG2-CG1 3.85Å; I297-I347 WeakPolarHBondContact O-CG1 3.47Å; I297-I347 PolarHBondContact O-N 3.28Å; V299-I347 HydrophobicContact CB-CD1 4.4Å; V299-I347 HydrophobicContact CG1-CD1 3.48Å; V299-I347 VanDerWaalsContact CG1-CD1 3.48Å; V299-I347 HydrophobicContact CG1-CG1 4.24Å; V299-I347 HydrophobicContact CG2-CD1 4.06Å; V299-I347 HydrophobicContact CG2-CG1 4.21Å; V299-I347 HydrophobicContact CG2-CG2 3.81Å; I347-E352 HydrophobicContact CG2-CB 4.24Å; I347-A353 HydrophobicContact CD1-CB 3.59Å; I347-I356 HydrophobicContact CG2-CD1 3.43Å; I347-I356 VanDerWaalsContact CG2-CD1 3.43Å
348	R	90.3	Very high	90.7	Very high	91 Å²	91	34.6 Å²	34.6	34%	0.343	16%	0.161	S	C	.	.	S	Bend	trans	-100	-13.4	-176.9	-66.7	178.5	172.3	137	-0.8	113.3	G203 E227 E352	G203-R348 PolarHBondContact O-NE 3.25Å; G203-R348 PolarHBondContact O-NH2 3.47Å; E227-R348 IonicContact OE1-CZ 2.96Å; E227-R348 IonicContact OE1-NH1 3.76Å; E227-R348 PolarHBondContact OE1-NH1 2.95Å; E227-R348 IonicContact OE1-NH2 3.5Å; R348-E352 PolarHBondContact N-OE2 2.88Å
349	S	90.6	Very high	90.5	Very high	31 Å²	31	33.2 Å²	33.2	22%	0.217	16%	0.157	C	C	.	.	S	Bend	trans	-152	167.2	175.8	87.7	0	0	0	0	113.4	E351 E352 A353	S349-E351 VanDerWaalsContact C-N 3.27Å; S349-E351 WeakPolarHBondContact CB-OE2 3.19Å; S349-E351 PolarHBondContact O-N 3.37Å; S349-E351 PolarHBondContact OG-N 3.23Å; S349-E351 PolarHBondContact OG-OE2 2.95Å; S349-E352 PolarHBondContact O-N 2.85Å; S349-E352 PolarHBondContact OG-N 3.35Å; S349-A353 PolarHBondContact O-N 2.8Å
350	A	88.9	Confident	90.3	Very high	8 Å²	8	32.4 Å²	32.4	7%	0.066	15%	0.152	C	C	.	.	H	α-helix	trans	-66.7	-29.1	177.1	0	0	0	0	0	112.4	V191 F194 A353 W354	V191-A350 HydrophobicContact CB-CB 4.46Å; V191-A350 HydrophobicContact CG2-CB 3.75Å; F194-A350 HydrophobicContact CB-CB 4.31Å; F194-A350 HydrophobicContact CD2-CB 3.9Å; F194-A350 HydrophobicContact CG-CB 4.35Å; A350-A353 WeakPolarHBondContact O-CB 3.3Å; A350-A353 PolarHBondContact O-N 3.29Å; A350-W354 WeakPolarHBondContact O-CB 3.48Å; A350-W354 PolarHBondContact O-N 3.23Å
351	E	88.1	Confident	89.9	Confident	107 Å²	107	30.6 Å²	30.6	50%	0.5	14%	0.143	S	C	.	.	H	α-helix	trans	-73.9	-33	178.9	-52.8	67.6	-136.5	0	0	111.3	S349 R355	S349-E351 VanDerWaalsContact C-N 3.27Å; S349-E351 WeakPolarHBondContact CB-OE2 3.19Å; S349-E351 PolarHBondContact O-N 3.37Å; S349-E351 PolarHBondContact OG-N 3.23Å; S349-E351 PolarHBondContact OG-OE2 2.95Å; E351-R355 WeakPolarHBondContact O-CG 3.04Å; E351-R355 PolarHBondContact O-N 3.19Å; E351-R355 VanDerWaalsContact O-N 3.1Å; E351-R355 PolarHBondContact O-NE 2.7Å
352	E	90.8	Very high	89.5	Confident	26 Å²	26	28.9 Å²	28.9	12%	0.121	13%	0.128	C	C	.	.	H	α-helix	trans	-65.3	-44.9	169.4	-67.2	-167.8	155.4	0	0	110.5	R230 L234 I347 R348 S349 W354 R355 I356	R230-E352 IonicContact CZ-OE1 2.7Å; R230-E352 VanDerWaalsContact NH1-CD 3.26Å; R230-E352 IonicContact NH1-OE1 3.98Å; R230-E352 PolarHBondContact NH1-OE1 2.92Å; R230-E352 IonicContact NH1-OE2 3.7Å; R230-E352 PolarHBondContact NH1-OE2 3.06Å; L234-E352 HydrophobicContact CD1-CB 4.43Å; L234-E352 HydrophobicContact CD1-CG 4.04Å; L234-E352 HydrophobicContact CD2-CB 4.28Å; I347-E352 HydrophobicContact CG2-CB 4.24Å; R348-E352 PolarHBondContact N-OE2 2.88Å; S349-E352 PolarHBondContact O-N 2.85Å; S349-E352 PolarHBondContact OG-N 3.35Å; E352-W354 VanDerWaalsContact C-N 3.35Å; E352-W354 PolarHBondContact O-N 2.61Å; E352-R355 PolarHBondContact O-N 2.88Å; E352-I356 WeakPolarHBondContact O-CG1 3.34Å; E352-I356 PolarHBondContact O-N 3.43Å
353	A	90.8	Very high	88.9	Confident	0 Å²	0	29.7 Å²	29.7	0%	0	13%	0.133	C	C	.	.	H	α-helix	trans	-62.1	-40	177.6	0	0	0	0	0	112.7	L190 I347 S349 A350 I356 L357	L190-A353 HydrophobicContact CD1-CB 3.81Å; L190-A353 HydrophobicContact CD2-CB 3.79Å; L190-A353 HydrophobicContact CG-CB 4.26Å; I347-A353 HydrophobicContact CD1-CB 3.59Å; S349-A353 PolarHBondContact O-N 2.8Å; A350-A353 WeakPolarHBondContact O-CB 3.3Å; A350-A353 PolarHBondContact O-N 3.29Å; A353-I356 PolarHBondContact O-N 3.26Å; A353-L357 WeakPolarHBondContact O-CB 3.48Å; A353-L357 PolarHBondContact O-N 3.28Å
354	W	87.1	Confident	88.4	Confident	40 Å²	40	29.4 Å²	29.4	15%	0.152	13%	0.13	C	C	.	.	H	α-helix	trans	-66.3	-40.4	175.4	179.5	-121.4	0	0	0	112.6	P187 V274 A350 E352 L357 K358	P187-W354 HydrophobicContact CB-CE3 3.8Å; P187-W354 HydrophobicContact CB-CZ3 3.68Å; P187-W354 HydrophobicContact CG-CE3 4.4Å; P187-W354 HydrophobicContact CG-CH2 4.45Å; P187-W354 HydrophobicContact CG-CZ3 3.79Å; V274-W354 HydrophobicContact CG2-CD2 4.31Å; V274-W354 VanDerWaalsContact CG2-CE2 3.46Å; V274-W354 HydrophobicContact CG2-CZ2 3.7Å; A350-W354 WeakPolarHBondContact O-CB 3.48Å; A350-W354 PolarHBondContact O-N 3.23Å; E352-W354 VanDerWaalsContact C-N 3.35Å; E352-W354 PolarHBondContact O-N 2.61Å; W354-L357 HydrophobicContact CE3-CD2 3.9Å; W354-L357 HydrophobicContact CZ3-CD2 3.85Å; W354-L357 PolarHBondContact O-N 2.68Å; W354-K358 PolarHBondContact O-N 2.86Å
355	R	88.8	Confident	86.9	Confident	69 Å²	69	31.4 Å²	31.4	26%	0.26	15%	0.147	S	C	.	.	H	α-helix	trans	-62.7	-42.8	173.2	-81.8	172.5	-81.7	151.6	-5.8	112	L234 E351 E352 L357 K358 A359	L234-R355 HydrophobicContact CD2-CB 3.72Å; E351-R355 WeakPolarHBondContact O-CG 3.04Å; E351-R355 PolarHBondContact O-N 3.19Å; E351-R355 VanDerWaalsContact O-N 3.1Å; E351-R355 PolarHBondContact O-NE 2.7Å; E352-R355 PolarHBondContact O-N 2.88Å; R355-L357 PolarHBondContact O-N 3.12Å; R355-K358 PolarHBondContact O-N 2.79Å; R355-A359 WeakPolarHBondContact O-CB 3.47Å; R355-A359 PolarHBondContact O-N 2.94Å
356	I	90.9	Very high	85.2	Confident	2 Å²	2	38.8 Å²	38.8	1%	0.01	18%	0.18	C	C	.	.	H	α-helix	trans	-62.4	-41.5	174.4	-72	165.2	0	0	0	111.4	L234 V299 L313 I345 I347 E352 A353 A359 G360	L234-I356 HydrophobicContact CD2-CD1 4.49Å; L234-I356 HydrophobicContact CD2-CG1 4.11Å; V299-I356 HydrophobicContact CG2-CD1 4.2Å; V299-I356 HydrophobicContact CG2-CG2 4.13Å; L313-I356 HydrophobicContact CD1-CG2 3.97Å; L313-I356 HydrophobicContact CD2-CG2 3.67Å; L313-I356 HydrophobicContact CG-CG2 4.49Å; I345-I356 HydrophobicContact CB-CD1 4.38Å; I345-I356 HydrophobicContact CD1-CD1 4.32Å; I345-I356 HydrophobicContact CG2-CD1 3.95Å; I347-I356 HydrophobicContact CG2-CD1 3.43Å; I347-I356 VanDerWaalsContact CG2-CD1 3.43Å; E352-I356 WeakPolarHBondContact O-CG1 3.34Å; E352-I356 PolarHBondContact O-N 3.43Å; A353-I356 PolarHBondContact O-N 3.26Å; I356-A359 PolarHBondContact O-N 2.87Å; I356-G360 PolarHBondContact O-N 2.98Å
357	L	89.5	Confident	83.4	Confident	5 Å²	5	40.3 Å²	40.3	3%	0.026	19%	0.193	C	C	.	.	H	α-helix	trans	-64	-44.4	174.1	-178.1	60.8	0	0	0	111.8	L186 F301 A353 W354 R355 A359 R361 F382	L186-L357 HydrophobicContact CD2-CD1 3.89Å; L186-L357 HydrophobicContact CD2-CD2 3.7Å; L186-L357 HydrophobicContact CD2-CG 4.48Å; L186-L357 HydrophobicContact CG-CD2 4.07Å; F301-L357 HydrophobicContact CD1-CD1 4.25Å; F301-L357 HydrophobicContact CE1-CD1 3.8Å; F301-L357 HydrophobicContact CZ-CD1 4.11Å; A353-L357 WeakPolarHBondContact O-CB 3.48Å; A353-L357 PolarHBondContact O-N 3.28Å; W354-L357 HydrophobicContact CE3-CD2 3.9Å; W354-L357 HydrophobicContact CZ3-CD2 3.85Å; W354-L357 PolarHBondContact O-N 2.68Å; R355-L357 PolarHBondContact O-N 3.12Å; L357-A359 PolarHBondContact O-N 3.33Å; L357-R361 HydrophobicContact CD1-CG 4.23Å; L357-R361 WeakPolarHBondContact O-CB 3.44Å; L357-R361 WeakPolarHBondContact O-CG 3.47Å; L357-R361 PolarHBondContact O-N 2.84Å; L357-F382 HydrophobicContact CB-CE2 4.12Å; L357-F382 HydrophobicContact CD1-CD2 3.74Å; L357-F382 HydrophobicContact CD1-CE2 3.91Å
358	K	87.1	Confident	81.6	Confident	30 Å²	30	41.9 Å²	41.9	13%	0.13	20%	0.204	C	C	.	.	H	α-helix	trans	-57.8	-46.8	173.1	-83.5	-173.5	168.5	-179.2	0	111.4	D272 W354 R355 R361 R362	D272-K358 PolarHBondContact O-NZ 2.84Å; D272-K358 IonicContact OD1-NZ 3.82Å; D272-K358 PolarHBondContact OD1-NZ 2.75Å; D272-K358 IonicContact OD2-NZ 3.23Å; D272-K358 PolarHBondContact OD2-NZ 3.41Å; W354-K358 PolarHBondContact O-N 2.86Å; R355-K358 PolarHBondContact O-N 2.79Å; K358-R361 PolarHBondContact O-N 3.2Å; K358-R362 WeakPolarHBondContact O-CG 3.33Å; K358-R362 PolarHBondContact O-N 3.05Å
359	A	87.5	Confident	79.5	Confident	7 Å²	7	41.8 Å²	41.8	6%	0.058	21%	0.214	C	C	.	.	H	α-helix	trans	-60.5	-51.3	178.6	0	0	0	0	0	112.3	R355 I356 L357 R361 R362 N363	R355-A359 WeakPolarHBondContact O-CB 3.47Å; R355-A359 PolarHBondContact O-N 2.94Å; I356-A359 PolarHBondContact O-N 2.87Å; L357-A359 PolarHBondContact O-N 3.33Å; A359-R361 VanDerWaalsContact C-N 3.29Å; A359-R361 PolarHBondContact O-N 2.98Å; A359-R362 WeakPolarHBondContact O-CB 3.2Å; A359-R362 PolarHBondContact O-N 3.29Å; A359-R362 VanDerWaalsContact O-N 3.1Å; A359-N363 PolarHBondContact O-N 2.83Å
360	G	88.1	Confident	76.9	Confident	0 Å²	0	50.1 Å²	50.1	0%	0	25%	0.249	C	C	.	.	H	α-helix	trans	-63.5	-32.3	178.6	0	0	0	0	0	113.6	L312 I356 N363 Q364	L312-G360 WeakPolarHBondContact O-CA 3.34Å; I356-G360 PolarHBondContact O-N 2.98Å; G360-N363 PolarHBondContact O-N 2.7Å; G360-Q364 PolarHBondContact O-N 3.28Å
361	R	82.7	Confident	74.4	Confident	44 Å²	44	56 Å²	56	17%	0.166	28%	0.278	C	S	.	.	H	α-helix	trans	-70.1	-34.2	173.6	-68.6	-68.3	-74.6	-175.8	-14	112.6	Q177 F301 L357 K358 A359 Q364 S365	Q177-R361 VanDerWaalsContact OE1-CZ 3.29Å; F301-R361 HydrophobicContact CE1-CG 3.94Å; F301-R361 HydrophobicContact CZ-CG 4.17Å; L357-R361 HydrophobicContact CD1-CG 4.23Å; L357-R361 WeakPolarHBondContact O-CB 3.44Å; L357-R361 WeakPolarHBondContact O-CG 3.47Å; L357-R361 PolarHBondContact O-N 2.84Å; K358-R361 PolarHBondContact O-N 3.2Å; A359-R361 VanDerWaalsContact C-N 3.29Å; A359-R361 PolarHBondContact O-N 2.98Å; R361-Q364 PolarHBondContact O-N 3.13Å; R361-S365 PolarHBondContact O-N 2.89Å
362	R	80.4	Confident	72.6	Confident	74 Å²	74	52.4 Å²	52.4	28%	0.279	26%	0.263	S	S	.	.	H	α-helix	trans	-62.5	-47	168	-68.8	177	-173.2	129.3	-3.5	110.5	D237 K358 A359 Q364 S365 F366	D237-R362 IonicContact OD1-CZ 3.53Å; D237-R362 IonicContact OD1-NH1 2.97Å; D237-R362 PolarHBondContact OD1-NH1 3.46Å; D237-R362 IonicContact OD1-NH2 3.62Å; D237-R362 PolarHBondContact OD1-NH2 2.87Å; K358-R362 WeakPolarHBondContact O-CG 3.33Å; K358-R362 PolarHBondContact O-N 3.05Å; A359-R362 WeakPolarHBondContact O-CB 3.2Å; A359-R362 PolarHBondContact O-N 3.29Å; A359-R362 VanDerWaalsContact O-N 3.1Å; R362-Q364 VanDerWaalsContact C-N 3.28Å; R362-Q364 PolarHBondContact O-N 3.42Å; R362-S365 WeakPolarHBondContact O-CA 3.28Å; R362-S365 PolarHBondContact O-N 2.97Å; R362-S365 PolarHBondContact O-OG 3.47Å; R362-F366 HydrophobicContact CB-CD2 4.44Å; R362-F366 HydrophobicContact CB-CE2 4.34Å; R362-F366 WeakPolarHBondContact O-CD2 3.46Å; R362-F366 PolarHBondContact O-N 2.81Å
363	N	80.9	Confident	70.4	Confident	36 Å²	36	59.6 Å²	59.6	19%	0.193	30%	0.296	C	S	.	.	H	α-helix	trans	-61.3	-34.8	177.4	-69	-18.8	0	0	0	112.5	L312 R324 A359 G360 A367	L312-N363 HydrophobicContact CD2-CB 4.44Å; L312-N363 WeakPolarHBondContact O-CB 3.46Å; L312-N363 PolarHBondContact O-ND2 3.4Å; R324-N363 PolarHBondContact NH2-O 3.48Å; A359-N363 PolarHBondContact O-N 2.83Å; G360-N363 PolarHBondContact O-N 2.7Å; N363-A367 PolarHBondContact O-N 2.91Å
364	Q	80.4	Confident	68.8	Low	14 Å²	14	63.9 Å²	63.9	7%	0.065	32%	0.319	C	S	.	.	H	α-helix	trans	-65.4	-43.5	170.1	-169.1	176.6	18.6	0	0	111.7	L312 G360 R361 R362 F366 A367 S378 S380	L312-Q364 HydrophobicContact CD1-CB 4.21Å; L312-Q364 HydrophobicContact CD2-CB 3.93Å; G360-Q364 PolarHBondContact O-N 3.28Å; R361-Q364 PolarHBondContact O-N 3.13Å; R362-Q364 VanDerWaalsContact C-N 3.28Å; R362-Q364 PolarHBondContact O-N 3.42Å; Q364-F366 PolarHBondContact O-N 2.9Å; Q364-A367 WeakPolarHBondContact O-CB 3.42Å; Q364-A367 PolarHBondContact O-N 2.76Å; Q364-S378 PolarHBondContact NE2-OG 3.47Å; Q364-S380 PolarHBondContact NE2-OG 3Å
365	S	62.5	Low	67.7	Low	64 Å²	64	63.4 Å²	63.4	45%	0.448	32%	0.322	S	S	.	.	H	α-helix	trans	-64.2	-38.4	177.2	74.2	0	0	0	0	112.9	R361 R362 A367 S368	R361-S365 PolarHBondContact O-N 2.89Å; R362-S365 WeakPolarHBondContact O-CA 3.28Å; R362-S365 PolarHBondContact O-N 2.97Å; R362-S365 PolarHBondContact O-OG 3.47Å; S365-A367 PolarHBondContact O-N 3.03Å; S365-S368 WeakPolarHBondContact O-CB 3.39Å; S365-S368 PolarHBondContact O-N 3.46Å; S365-S368 PolarHBondContact O-OG 3.26Å
366	F	57.7	Low	66.9	Low	160 Å²	160	60.8 Å²	60.8	70%	0.702	31%	0.314	S	S	*	.	H	α-helix	trans	-70.2	-11.1	171.8	-71.3	-63.8	0	0	0	113.9	R362 Q364 S368	R362-F366 HydrophobicContact CB-CD2 4.44Å; R362-F366 HydrophobicContact CB-CE2 4.34Å; R362-F366 WeakPolarHBondContact O-CD2 3.46Å; R362-F366 PolarHBondContact O-N 2.81Å; Q364-F366 PolarHBondContact O-N 2.9Å; F366-S368 VanDerWaalsContact C-N 3.31Å
367	A	54.4	Low	66.3	Low	35 Å²	35	62.5 Å²	62.5	29%	0.289	32%	0.321	S	S	.	.	H	α-helix	trans	-67.5	-36.7	166.1	0	0	0	0	0	111	E303 R324 N363 Q364 S365 T369	E303-A367 WeakPolarHBondContact OE1-CB 3.21Å; R324-A367 VanDerWaalsContact NH1-CB 3.26Å; R324-A367 VanDerWaalsContact NH2-CA 3.35Å; R324-A367 VanDerWaalsContact NH2-CB 3.31Å; N363-A367 PolarHBondContact O-N 2.91Å; Q364-A367 WeakPolarHBondContact O-CB 3.42Å; Q364-A367 PolarHBondContact O-N 2.76Å; S365-A367 PolarHBondContact O-N 3.03Å; A367-T369 PolarHBondContact O-N 2.98Å; A367-T369 VanDerWaalsContact O-N 3.11Å
368	S	55.2	Low	66.1	Low	36 Å²	36	62.6 Å²	62.6	25%	0.252	32%	0.321	S	S	.	.	S	Bend	trans	-74.5	102.4	176.5	73.5	0	0	0	0	109.8	S365 F366 N372	S365-S368 WeakPolarHBondContact O-CB 3.39Å; S365-S368 PolarHBondContact O-N 3.46Å; S365-S368 PolarHBondContact O-OG 3.26Å; F366-S368 VanDerWaalsContact C-N 3.31Å; S368-N372 WeakPolarHBondContact CB-O 3.07Å
369	T	46	Very low	66.3	Low	90 Å²	90	61.4 Å²	61.4	55%	0.552	32%	0.316	S	S	*	.			trans	-52.6	156.8	162.9	52.7	0	0	0	0	109.9	A367 L371 N372	A367-T369 PolarHBondContact O-N 2.98Å; A367-T369 VanDerWaalsContact O-N 3.11Å; T369-L371 PolarHBondContact O-N 3.5Å; T369-N372 PolarHBondContact O-N 3.34Å; T369-N372 PolarHBondContact OG1-ND2 3.44Å
370	H	36.3	Very low	66.6	Low	205 Å²	205	61.3 Å²	61.3	95%	0.949	32%	0.315	S	S	*	.	T	Hydrogen-bonded Turn	trans	-51.8	-3.9	-171.1	-96.6	-88.3	0	0	0	117.7
371	L	37.6	Very low	66.9	Low	132 Å²	132	61.3 Å²	61.3	69%	0.691	32%	0.315	S	S	*	.	T	Hydrogen-bonded Turn	trans	-106.6	1.6	175.8	-78.1	141.1	0	0	0	113.9	T369 R423	T369-L371 PolarHBondContact O-N 3.5Å; L371-R423 PolarHBondContact O-NH2 3.43Å
372	N	49.2	Very low	67.6	Low	32 Å²	32	59.4 Å²	59.4	17%	0.171	31%	0.308	C	S	.	.			trans	-130.7	15.4	-158.8	-78.3	-35.4	0	0	0	117.2	S368 T369 N374 R377 R423	S368-N372 WeakPolarHBondContact CB-O 3.07Å; T369-N372 PolarHBondContact O-N 3.34Å; T369-N372 PolarHBondContact OG1-ND2 3.44Å; N372-N374 PolarHBondContact O-N 3Å; N372-R377 VanDerWaalsContact CA-NH1 3.35Å; N372-R377 PolarHBondContact O-NH1 3.22Å; N372-R377 PolarHBondContact OD1-NH1 3.37Å; N372-R377 PolarHBondContact OD1-NH2 3Å; N372-R377 VanDerWaalsContact OD1-NH2 3.09Å; N372-R423 PolarHBondContact OD1-NE 3.09Å
373	Q	44.6	Very low	68.4	Low	176 Å²	176	55.9 Å²	55.9	82%	0.822	30%	0.295	S	S	*	.			trans	-54.8	103.4	179	-71.5	-179.3	-17.3	0	0	113.6
374	N	58.2	Low	69.1	Low	90 Å²	90	54.2 Å²	54.2	48%	0.481	29%	0.286	S	S	.	.			trans	-169.1	149	142.3	-139.6	-6.4	0	0	0	111.8	N372 S376 R377	N372-N374 PolarHBondContact O-N 3Å; N374-S376 PolarHBondContact ND2-OG 3.06Å; N374-S376 PolarHBondContact O-N 2.97Å; N374-R377 HydrophobicContact CB-CG 4.49Å
375	S	64.8	Low	69.8	Low	30 Å²	30	54 Å²	54	21%	0.21	29%	0.285	C	S	.	.	G	3₁₀ helix	trans	-70	-17.6	171.1	56.5	0	0	0	0	113.2	T173 R377	T173-S375 PolarHBondContact OG1-OG 2.82Å; S375-R377 PolarHBondContact O-N 2.87Å
376	S	71.9	Confident	71.3	Confident	15 Å²	15	51 Å²	51	11%	0.105	26%	0.264	C	S	.	.	G	3₁₀ helix	trans	-73.5	10.1	-176.8	66.3	0	0	0	0	115.5	T168 N374 A410 G411	T168-S376 WeakPolarHBondContact OG1-CB 3.21Å; T168-S376 PolarHBondContact OG1-OG 2.74Å; N374-S376 PolarHBondContact ND2-OG 3.06Å; N374-S376 PolarHBondContact O-N 2.97Å; S376-A410 WeakPolarHBondContact O-CA 3.35Å; S376-A410 WeakPolarHBondContact O-CB 3.3Å; S376-G411 PolarHBondContact O-N 3.41Å
377	R	77	Confident	73	Confident	38 Å²	38	43.4 Å²	43.4	14%	0.143	23%	0.23	C	C	.	.	G	3₁₀ helix	trans	-115.1	-11.4	-170.4	-61.7	178.1	69.1	-177.6	-3.4	114.3	Y305 N372 N374 S375 E426 I430	Y305-R377 WeakPolarHBondContact CD2-O 3.42Å; N372-R377 VanDerWaalsContact CA-NH1 3.35Å; N372-R377 PolarHBondContact O-NH1 3.22Å; N372-R377 PolarHBondContact OD1-NH1 3.37Å; N372-R377 PolarHBondContact OD1-NH2 3Å; N372-R377 VanDerWaalsContact OD1-NH2 3.09Å; N374-R377 HydrophobicContact CB-CG 4.49Å; S375-R377 PolarHBondContact O-N 2.87Å; R377-E426 IonicContact CZ-OE1 2.67Å; R377-E426 IonicContact CZ-OE2 2.72Å; R377-E426 IonicContact NE-OE1 3.64Å; R377-E426 PolarHBondContact NE-OE1 3.05Å; R377-E426 IonicContact NE-OE2 2.78Å; R377-E426 IonicContact NH2-OE1 3.8Å; R377-E426 PolarHBondContact NH2-OE1 2.69Å; R377-E426 IonicContact NH2-OE2 2.67Å; R377-E426 PolarHBondContact NH2-OE2 3.32Å; R377-I430 HydrophobicContact CB-CD1 4.35Å; R377-I430 WeakPolarHBondContact O-CD1 3.41Å
378	S	85.9	Confident	74.8	Confident	6 Å²	6	42.4 Å²	42.4	4%	0.042	22%	0.22	C	C	.	.	S	Bend	trans	-131.3	148.7	168.5	59.6	0	0	0	0	110.3	E303 I304 Q364 S380	E303-S378 WeakPolarHBondContact OE2-CB 3.4Å; E303-S378 PolarHBondContact OE2-OG 3.04Å; I304-S378 WeakPolarHBondContact O-CA 3.47Å; Q364-S378 PolarHBondContact NE2-OG 3.47Å; S378-S380 PolarHBondContact O-N 2.99Å
379	H	91.4	Very high	76.3	Confident	5 Å²	5	41.1 Å²	41.1	2%	0.023	21%	0.21	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-81.3	118.7	171.7	-51.7	-72.7	0	0	0	107.9	E303 I304 L409 A410 S433 L465	E303-H379 CarbonylContact C-O 3.5Å; E303-H379 WeakPolarHBondContact CA-O 3.44Å; I304-H379 HydrophobicContact CB-CB 4.28Å; I304-H379 PolarHBondContact N-O 3.29Å; I304-H379 PolarHBondContact O-N 3.14Å; H379-L409 HydrophobicContact CB-CD2 4.26Å; H379-L409 WeakPolarHBondContact ND1-CD2 3.44Å; H379-A410 PolarHBondContact ND1-N 3.3Å; H379-S433 PolarHBondContact NE2-OG 3.1Å; H379-L465 HydrophobicContact CB-CD1 4.29Å
380	S	92.9	Very high	78.2	Confident	5 Å²	5	39.6 Å²	39.6	4%	0.035	20%	0.197	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-93.4	128.9	-179.2	-39.7	0	0	0	0	108.7	Q364 S378 C407 D408	Q364-S380 PolarHBondContact NE2-OG 3Å; S378-S380 PolarHBondContact O-N 2.99Å; S380-C407 CarbonylContact O-C 3.6Å; S380-C407 VanDerWaalsContact O-CA 3.27Å; S380-C407 WeakPolarHBondContact O-CA 3.42Å; S380-C407 PolarHBondContact O-SG 2.84Å; S380-C407 VanDerWaalsContact O-SG 3.37Å; S380-D408 PolarHBondContact N-O 3.3Å; S380-D408 PolarHBondContact O-N 2.92Å
381	I	95.9	Very high	79.8	Confident	0 Å²	0	33.5 Å²	33.5	0%	0	18%	0.176	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-128.6	110.6	-178.3	-55.3	179.4	0	0	0	109.5	F301 Y302 I304 T405 C407 L465 V468	F301-I381 WeakPolarHBondContact CD2-O 3.23Å; Y302-I381 HydrophobicContact CD1-CB 4.41Å; Y302-I381 HydrophobicContact CD2-CB 4.37Å; Y302-I381 HydrophobicContact CE1-CB 3.99Å; Y302-I381 HydrophobicContact CE1-CG2 3.83Å; Y302-I381 HydrophobicContact CE2-CB 3.96Å; Y302-I381 HydrophobicContact CE2-CD1 3.82Å; Y302-I381 HydrophobicContact CE2-CG1 4.33Å; Y302-I381 HydrophobicContact CE2-CG2 4.35Å; Y302-I381 PolarHBondContact N-O 3.16Å; Y302-I381 PolarHBondContact O-N 3.25Å; I304-I381 HydrophobicContact CD1-CD1 3.73Å; I304-I381 HydrophobicContact CG1-CD1 4.13Å; I381-T405 HydrophobicContact CG2-CG2 3.6Å; I381-C407 HydrophobicContact CG1-CB 4.38Å; I381-L465 HydrophobicContact CD1-CD1 4.38Å; I381-V468 HydrophobicContact CD1-CG1 4.25Å
382	F	96.5	Very high	81.2	Confident	4 Å²	4	36.7 Å²	36.7	2%	0.018	19%	0.187	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-105.2	119.3	174	-168.7	-81.9	0	0	0	108.6	L186 L190 V299 F301 L357 I384 V406	L186-F382 HydrophobicContact CD1-CD1 3.76Å; L186-F382 HydrophobicContact CD1-CE1 4.06Å; L186-F382 HydrophobicContact CD1-CG 4.44Å; L186-F382 HydrophobicContact CD2-CB 3.95Å; L186-F382 HydrophobicContact CD2-CD1 3.92Å; L186-F382 HydrophobicContact CD2-CD2 4.2Å; L186-F382 HydrophobicContact CD2-CE1 4.46Å; L186-F382 HydrophobicContact CD2-CG 3.77Å; L186-F382 HydrophobicContact CG-CD1 4.42Å; L190-F382 HydrophobicContact CD2-CE1 4.5Å; V299-F382 HydrophobicContact CB-CE1 4.26Å; V299-F382 HydrophobicContact CB-CZ 4Å; V299-F382 HydrophobicContact CG1-CE1 3.75Å; V299-F382 HydrophobicContact CG1-CZ 3.81Å; F301-F382 HydrophobicContact CB-CD2 3.69Å; F301-F382 HydrophobicContact CB-CE2 4.17Å; F301-F382 AromaticContact CD1-CD2 3.96Å; F301-F382 HydrophobicContact CD1-CD2 3.96Å; F301-F382 HydrophobicContact CD1-CE2 4.44Å; F301-F382 HydrophobicContact CD2-CB 3.87Å; F301-F382 AromaticContact CD2-CD2 3.81Å; F301-F382 HydrophobicContact CD2-CD2 3.81Å; F301-F382 HydrophobicContact CD2-CG 4.32Å; F301-F382 HydrophobicContact CE2-CB 4.26Å; F301-F382 HydrophobicContact CE2-CD2 4.43Å; F301-F382 HydrophobicContact CG-CB 4.48Å; F301-F382 AromaticContact CG-CD2 3.57Å; F301-F382 HydrophobicContact CG-CD2 3.57Å; F301-F382 HydrophobicContact CG-CE2 4.31Å; F301-F382 HydrophobicContact CG-CG 4.46Å; L357-F382 HydrophobicContact CB-CE2 4.12Å; L357-F382 HydrophobicContact CD1-CD2 3.74Å; L357-F382 HydrophobicContact CD1-CE2 3.91Å; F382-I384 HydrophobicContact CD1-CD1 4.49Å; F382-I384 HydrophobicContact CD1-CG1 4.02Å; F382-I384 HydrophobicContact CE1-CD1 4.19Å; F382-I384 HydrophobicContact CE1-CG1 3.65Å; F382-V406 PolarHBondContact N-O 2.85Å; F382-V406 PolarHBondContact O-N 2.98Å
383	S	96.4	Very high	81.7	Confident	1 Å²	1	37.4 Å²	37.4	1%	0.007	20%	0.197	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-113.9	130.7	179.5	-80.3	0	0	0	0	110.9	V299 S300 E403 T405	V299-S383 WeakPolarHBondContact CA-O 3.48Å; S300-S383 PolarHBondContact N-O 2.7Å; S300-S383 PolarHBondContact O-N 3.17Å; S383-E403 WeakPolarHBondContact CB-OE1 3.23Å; S383-E403 PolarHBondContact OG-OE1 3.46Å; S383-T405 PolarHBondContact OG-OG1 3.37Å
384	I	96.4	Very high	81.9	Confident	1 Å²	1	33.7 Å²	33.7	1%	0.005	19%	0.191	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-108.2	114.6	170.6	-54.8	154	0	0	0	107.2	L186 L190 L193 I297 W298 V299 F382 E403 L404	L186-I384 HydrophobicContact CD1-CD1 4.23Å; L190-I384 HydrophobicContact CD2-CD1 3.69Å; L190-I384 HydrophobicContact CD2-CG1 4.18Å; L190-I384 HydrophobicContact CG-CD1 4.48Å; L193-I384 HydrophobicContact CD2-CG2 3.9Å; I297-I384 HydrophobicContact CG2-CG2 3.77Å; W298-I384 CarbonylContact O-C 3.59Å; W298-I384 WeakPolarHBondContact O-CA 3.35Å; V299-I384 HydrophobicContact CG1-CB 4.34Å; V299-I384 HydrophobicContact CG1-CG1 3.85Å; V299-I384 HydrophobicContact CG1-CG2 4.35Å; F382-I384 HydrophobicContact CD1-CD1 4.49Å; F382-I384 HydrophobicContact CD1-CG1 4.02Å; F382-I384 HydrophobicContact CE1-CD1 4.19Å; F382-I384 HydrophobicContact CE1-CG1 3.65Å; I384-E403 WeakPolarHBondContact O-CA 3.27Å; I384-L404 HydrophobicContact CB-CB 4.31Å; I384-L404 HydrophobicContact CD1-CD2 4.11Å; I384-L404 HydrophobicContact CD1-CG 4.45Å; I384-L404 PolarHBondContact N-O 2.84Å; I384-L404 PolarHBondContact O-N 2.64Å
385	R	95.5	Very high	81.7	Confident	10 Å²	10	35.7 Å²	35.7	4%	0.038	21%	0.212	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-94.1	131.8	168.2	-79.5	-178.6	178.9	-176	1.6	110	M211 Y212 W298 W344 I401 S402 E403	M211-R385 PolarHBondContact O-NH1 2.93Å; M211-R385 PolarHBondContact O-NH2 3.49Å; Y212-R385 PolarHBondContact O-NH1 3.47Å; Y212-R385 PolarHBondContact O-NH2 3.17Å; W298-R385 HydrophobicContact CB-CB 4.4Å; W298-R385 PolarHBondContact N-O 2.9Å; W298-R385 PolarHBondContact O-N 2.81Å; W344-R385 HydrophobicContact CE3-CG 4.44Å; W344-R385 VanDerWaalsContact CH2-CD 3.45Å; W344-R385 HydrophobicContact CH2-CG 3.64Å; W344-R385 HydrophobicContact CZ3-CB 3.98Å; W344-R385 HydrophobicContact CZ3-CG 3.61Å; R385-I401 HydrophobicContact CB-CG2 4.22Å; R385-I401 HydrophobicContact CG-CG2 4.01Å; R385-S402 WeakPolarHBondContact CA-O 3.38Å; R385-E403 HydrophobicContact CG-CB 4.16Å; R385-E403 HydrophobicContact CG-CG 3.87Å; R385-E403 IonicContact CZ-OE2 3.67Å; R385-E403 VanDerWaalsContact CZ-OE2 3.26Å; R385-E403 IonicContact NE-OE2 2.75Å; R385-E403 PolarHBondContact NE-OE2 2.75Å; R385-E403 IonicContact NH2-OE2 3.44Å; R385-E403 PolarHBondContact NH2-OE2 2.95Å
386	V	94.6	Very high	81.1	Confident	0 Å²	0	37.9 Å²	37.9	0%	0	24%	0.239	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-107.6	111.1	171.7	-178.8	0	0	0	0	106.8	V154 L155 L193 F295 I297 H388 I401 S402	V154-V386 HydrophobicContact CG1-CB 4.34Å; V154-V386 HydrophobicContact CG1-CG2 3.75Å; L155-V386 HydrophobicContact CD2-CG1 4.39Å; L193-V386 HydrophobicContact CD1-CG2 4.49Å; F295-V386 HydrophobicContact CB-CG1 4.42Å; F295-V386 HydrophobicContact CD1-CG1 3.71Å; I297-V386 HydrophobicContact CD1-CB 4.19Å; I297-V386 HydrophobicContact CD1-CG1 3.85Å; I297-V386 HydrophobicContact CD1-CG2 3.84Å; V386-H388 PolarHBondContact O-CD2 3.28Å; V386-I401 WeakPolarHBondContact O-CA 3.39Å; V386-S402 PolarHBondContact N-O 3.31Å; V386-S402 PolarHBondContact O-N 2.68Å
387	L	93	Very high	80.1	Confident	1 Å²	1	46.2 Å²	46.2	1%	0.005	28%	0.276	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-90.3	119.2	171.2	169.5	63	0	0	0	108.3	L207 V215 F295 S296 V389 M399 H400 I401	L207-L387 HydrophobicContact CB-CD2 3.79Å; V215-L387 HydrophobicContact CG1-CD2 4.22Å; V215-L387 HydrophobicContact CG2-CD1 3.65Å; F295-L387 WeakPolarHBondContact CA-O 3.4Å; S296-L387 PolarHBondContact N-O 3.03Å; S296-L387 PolarHBondContact O-N 3.02Å; L387-V389 HydrophobicContact CD2-CG2 4.21Å; L387-V389 HydrophobicContact CG-CG2 3.89Å; L387-M399 HydrophobicContact CD1-CB 4.07Å; L387-H400 WeakPolarHBondContact CA-O 3.32Å; L387-I401 HydrophobicContact CD1-CG1 4.04Å
388	H	90.8	Very high	79.1	Confident	13 Å²	13	45.7 Å²	45.7	6%	0.06	28%	0.281	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-88.5	124.1	176.4	-56.6	-116.4	0	0	0	107.9	L155 V293 F295 V386 M399 H400 S402	L155-H388 PolarHBondContact O-CE1 3.44Å; V293-H388 HydrophobicContact CG1-CB 4.2Å; F295-H388 AromaticContact CD1-ND1 3.96Å; F295-H388 AromaticContact CE1-CE1 3.78Å; F295-H388 AromaticContact CE1-ND1 3.42Å; F295-H388 WeakPolarHBondContact CE1-ND1 3.42Å; V386-H388 PolarHBondContact O-CD2 3.28Å; H388-M399 WeakPolarHBondContact O-CA 3.48Å; H388-H400 HydrophobicContact CB-CB 4.17Å; H388-H400 AromaticContact CD2-ND1 3.81Å; H388-H400 PolarHBondContact CD2-O 3.03Å; H388-H400 PolarHBondContact N-O 3.14Å; H388-H400 PolarHBondContact O-N 2.82Å; H388-S402 PolarHBondContact NE2-OG 3.31Å
389	V	88	Confident	78.7	Confident	9 Å²	9	49.7 Å²	49.7	6%	0.055	30%	0.3	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-122.4	115.4	-174.9	-176.4	0	0	0	0	108.4	Y202 L207 Q294 L387 P391	Y202-V389 HydrophobicContact CD2-CB 4.25Å; Y202-V389 HydrophobicContact CD2-CG1 4.01Å; Y202-V389 HydrophobicContact CD2-CG2 4.32Å; Y202-V389 HydrophobicContact CE2-CG1 3.91Å; Y202-V389 HydrophobicContact CG-CG2 4.33Å; L207-V389 HydrophobicContact CD1-CG1 4.1Å; L207-V389 HydrophobicContact CD1-CG2 3.96Å; Q294-V389 PolarHBondContact N-O 3.03Å; Q294-V389 PolarHBondContact O-N 3.41Å; L387-V389 HydrophobicContact CD2-CG2 4.21Å; L387-V389 HydrophobicContact CG-CG2 3.89Å; V389-P391 WeakPolarHBondContact O-CD 3.39Å
390	H	85.4	Confident	78.4	Confident	58 Å²	58	53 Å²	53	27%	0.269	32%	0.315	S	S	.	.			trans	-98.2	108.2	178.3	-59.6	-109.2	0	0	0	108.6	E290 V293 E392 A393 A398	E290-H390 IonicContact OE2-CE1 3.93Å; E290-H390 PolarHBondContact OE2-CE1 3.38Å; V293-H390 VanDerWaalsContact CG2-CE1 3.45Å; V293-H390 WeakPolarHBondContact CG2-CE1 3.47Å; H390-E392 VanDerWaalsContact C-N 3.28Å; H390-E392 PolarHBondContact O-N 2.86Å; H390-A393 HydrophobicContact CB-CB 4.22Å; H390-A393 PolarHBondContact O-N 2.82Å; H390-A398 HydrophobicContact CB-CB 4.03Å; H390-A398 PolarHBondContact CD2-O 2.98Å
391	P	70.6	Confident	78.3	Confident	78 Å²	78	53 Å²	53	51%	0.506	31%	0.314	S	S	.	.	T	Hydrogen-bonded Turn	trans	-67.3	-22.5	-169.1	-23.5	35.4	0	0	0	115.4	G292 Q294 V389	G292-P391 WeakPolarHBondContact O-CD 3.43Å; Q294-P391 HydrophobicContact CG-CG 4.16Å; V389-P391 WeakPolarHBondContact O-CD 3.39Å
392	E	66.1	Low	78.2	Confident	198 Å²	198	53 Å²	53	93%	0.925	31%	0.314	S	S	*	.	T	Hydrogen-bonded Turn	trans	-94.6	-6.6	-172.7	-56.8	-169.3	151.8	0	0	113.7	H390	H390-E392 VanDerWaalsContact C-N 3.28Å; H390-E392 PolarHBondContact O-N 2.86Å
393	A	60.9	Low	78.1	Confident	48 Å²	48	53.7 Å²	53.7	40%	0.397	32%	0.318	S	S	.	.	S	Bend	trans	-92.3	138.7	-172.1	0	0	0	0	0	112.8	H390 A398	H390-A393 HydrophobicContact CB-CB 4.22Å; H390-A393 PolarHBondContact O-N 2.82Å; A393-A398 HydrophobicContact CB-CB 3.23Å
394	S	47.7	Very low	78.1	Confident	98 Å²	98	53.8 Å²	53.8	69%	0.685	32%	0.318	S	S	*	.			trans	-60.8	139.2	-179.2	48.6	0	0	0	0	112.7	G396	S394-G396 PolarHBondContact O-N 3.48Å
395	S	54.9	Low	78.1	Confident	131 Å²	131	53.8 Å²	53.8	92%	0.916	32%	0.318	S	S	*	.	T	Hydrogen-bonded Turn	trans	-55.6	101.4	-169	56.6	0	0	0	0	114
396	G	52.3	Low	78.2	Confident	77 Å²	77	53.4 Å²	53.4	79%	0.794	32%	0.317	S	S	*	.	T	Hydrogen-bonded Turn	trans	149	-30.9	167.9	0	0	0	0	0	116	S394	S394-G396 PolarHBondContact O-N 3.48Å
397	Q	49.8	Very low	78.2	Confident	189 Å²	189	53.4 Å²	53.4	88%	0.883	32%	0.317	S	S	*	.	S	Bend	trans	-112.9	1	-167.7	-74	-175.8	-62.6	0	0	116.1
398	A	56.1	Low	78.2	Confident	28 Å²	28	53.7 Å²	53.7	23%	0.231	32%	0.319	C	S	.	.			trans	-130.8	53	-173.8	0	0	0	0	0	113.1	H390 A393	H390-A398 HydrophobicContact CB-CB 4.03Å; H390-A398 PolarHBondContact CD2-O 2.98Å; A393-A398 HydrophobicContact CB-CB 3.23Å
399	M	76.7	Confident	78.3	Confident	89 Å²	89	53.1 Å²	53.1	44%	0.438	32%	0.316	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-133.8	114.8	168.6	-72.1	-174.7	-173	0	0	109.2	L207 V215 L387 H388	L207-M399 HydrophobicContact CD1-CE 3.47Å; L207-M399 VanDerWaalsContact CD1-CE 3.47Å; L207-M399 HydrophobicContact CD1-SD 4.05Å; L207-M399 HydrophobicContact CD2-CE 3.85Å; L207-M399 HydrophobicContact CD2-SD 4.17Å; L207-M399 HydrophobicContact CG-CE 4.32Å; V215-M399 HydrophobicContact CB-SD 4.42Å; V215-M399 HydrophobicContact CG1-SD 3.98Å; V215-M399 HydrophobicContact CG2-CB 4.28Å; L387-M399 HydrophobicContact CD1-CB 4.07Å; H388-M399 WeakPolarHBondContact O-CA 3.48Å
400	H	85.5	Confident	78.4	Confident	74 Å²	74	52.7 Å²	52.7	34%	0.343	31%	0.314	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-110.8	146.1	-179.7	-177.3	-89.3	0	0	0	110.5	G157 L387 H388	G157-H400 PolarHBondContact O-CE1 3.09Å; L387-H400 WeakPolarHBondContact CA-O 3.32Å; H388-H400 HydrophobicContact CB-CB 4.17Å; H388-H400 AromaticContact CD2-ND1 3.81Å; H388-H400 PolarHBondContact CD2-O 3.03Å; H388-H400 PolarHBondContact N-O 3.14Å; H388-H400 PolarHBondContact O-N 2.82Å
401	I	91.1	Very high	78.5	Confident	5 Å²	5	50 Å²	50	3%	0.026	30%	0.301	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-120.5	120.9	175.6	-59	-179.3	0	0	0	109.7	P209 Q213 V215 R385 V386 L387	P209-I401 HydrophobicContact CB-CD1 3.73Å; Q213-I401 WeakPolarHBondContact O-CD1 3.48Å; V215-I401 HydrophobicContact CG2-CD1 3.86Å; V215-I401 HydrophobicContact CG2-CG1 4.18Å; R385-I401 HydrophobicContact CB-CG2 4.22Å; R385-I401 HydrophobicContact CG-CG2 4.01Å; V386-I401 WeakPolarHBondContact O-CA 3.39Å; L387-I401 HydrophobicContact CD1-CG1 4.04Å
402	S	93.9	Very high	79.1	Confident	0 Å²	0	47 Å²	47	0%	0	28%	0.282	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-110.1	144	165.7	53.6	0	0	0	0	111.5	V154 G157 N159 R385 V386 H388	V154-S402 WeakPolarHBondContact O-CB 3.37Å; V154-S402 PolarHBondContact O-OG 3.36Å; G157-S402 VanDerWaalsContact C-CB 3.45Å; G157-S402 WeakPolarHBondContact O-CB 3.34Å; N159-S402 WeakPolarHBondContact OD1-CA 3.43Å; R385-S402 WeakPolarHBondContact CA-O 3.38Å; V386-S402 PolarHBondContact N-O 3.31Å; V386-S402 PolarHBondContact O-N 2.68Å; H388-S402 PolarHBondContact NE2-OG 3.31Å
403	E	94.4	Very high	79.6	Confident	19 Å²	19	39.4 Å²	39.4	9%	0.089	25%	0.247	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-120.3	124.3	-177.9	-164.7	172.5	147	0	0	111.8	N159 R160 S383 I384 R385 T405	N159-E403 PolarHBondContact OD1-N 2.89Å; R160-E403 PolarHBondContact N-O 3.33Å; S383-E403 WeakPolarHBondContact CB-OE1 3.23Å; S383-E403 PolarHBondContact OG-OE1 3.46Å; I384-E403 WeakPolarHBondContact O-CA 3.27Å; R385-E403 HydrophobicContact CG-CB 4.16Å; R385-E403 HydrophobicContact CG-CG 3.87Å; R385-E403 IonicContact CZ-OE2 3.67Å; R385-E403 VanDerWaalsContact CZ-OE2 3.26Å; R385-E403 IonicContact NE-OE2 2.75Å; R385-E403 PolarHBondContact NE-OE2 2.75Å; R385-E403 IonicContact NH2-OE2 3.44Å; R385-E403 PolarHBondContact NH2-OE2 2.95Å; E403-T405 PolarHBondContact OE1-OG1 3.19Å; E403-T405 VanDerWaalsContact OE1-OG1 3.11Å
404	L	96.3	Very high	79.5	Confident	3 Å²	3	43.9 Å²	43.9	2%	0.016	25%	0.253	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-96.4	103.1	163.8	-178.6	55.2	0	0	0	108.8	L147 M150 V151 V154 R160 I384 V406	L147-L404 HydrophobicContact CD1-CD1 4.15Å; M150-L404 HydrophobicContact CB-CD1 4.3Å; V151-L404 HydrophobicContact CG2-CD2 4.02Å; V154-L404 HydrophobicContact CB-CB 4.49Å; V154-L404 HydrophobicContact CG1-CB 4.19Å; V154-L404 HydrophobicContact CG2-CB 3.85Å; V154-L404 HydrophobicContact CG2-CD1 4.29Å; R160-L404 HydrophobicContact CB-CD1 4.09Å; R160-L404 WeakPolarHBondContact O-CA 3.39Å; I384-L404 HydrophobicContact CB-CB 4.31Å; I384-L404 HydrophobicContact CD1-CD2 4.11Å; I384-L404 HydrophobicContact CD1-CG 4.45Å; I384-L404 PolarHBondContact N-O 2.84Å; I384-L404 PolarHBondContact O-N 2.64Å; L404-V406 HydrophobicContact CG-CG2 4.38Å
405	T	96.5	Very high	80	Confident	2 Å²	2	41.5 Å²	41.5	1%	0.012	24%	0.236	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-97.1	128.7	175.6	-53	0	0	0	0	110	R160 L161 L162 I381 S383 E403 F472	R160-T405 PolarHBondContact O-N 3.4Å; L161-T405 WeakPolarHBondContact CA-O 3.36Å; L161-T405 HydrophobicContact CD1-CG2 3.77Å; L162-T405 PolarHBondContact N-O 3.29Å; I381-T405 HydrophobicContact CG2-CG2 3.6Å; S383-T405 PolarHBondContact OG-OG1 3.37Å; E403-T405 PolarHBondContact OE1-OG1 3.19Å; E403-T405 VanDerWaalsContact OE1-OG1 3.11Å; T405-F472 VanDerWaalsContact OG1-CZ 3.26Å; T405-F472 WeakPolarHBondContact OG1-CZ 3.43Å
406	V	96.6	Very high	80	Confident	2 Å²	2	42.6 Å²	42.6	1%	0.012	22%	0.224	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-120.8	120.9	175	-178.8	0	0	0	0	109.5	L147 L162 I176 L186 F382 L404	L147-V406 HydrophobicContact CD2-CG2 4.4Å; L162-V406 HydrophobicContact CB-CG2 4.49Å; L162-V406 HydrophobicContact CD2-CG1 4.37Å; L162-V406 WeakPolarHBondContact O-CA 3.4Å; I176-V406 HydrophobicContact CD1-CG1 3.78Å; I176-V406 HydrophobicContact CG2-CG1 3.84Å; L186-V406 HydrophobicContact CD1-CB 4.32Å; L186-V406 HydrophobicContact CD1-CG2 4.13Å; F382-V406 PolarHBondContact N-O 2.85Å; F382-V406 PolarHBondContact O-N 2.98Å; L404-V406 HydrophobicContact CG-CG2 4.38Å
407	C	95.4	Very high	80	Confident	0 Å²	0	47.6 Å²	47.6	0%	0	23%	0.227	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-118.3	127.2	-175.8	-174	0	0	0	0	113	L162 Y163 T164 S380 I381 L409	L162-C407 PolarHBondContact O-N 3.5Å; Y163-C407 WeakPolarHBondContact CA-O 3.46Å; T164-C407 PolarHBondContact N-O 2.92Å; T164-C407 PolarHBondContact OG1-O 2.96Å; S380-C407 CarbonylContact O-C 3.6Å; S380-C407 VanDerWaalsContact O-CA 3.27Å; S380-C407 WeakPolarHBondContact O-CA 3.42Å; S380-C407 PolarHBondContact O-SG 2.84Å; S380-C407 VanDerWaalsContact O-SG 3.37Å; I381-C407 HydrophobicContact CG1-CB 4.38Å; C407-L409 WeakPolarHBondContact SG-CD2 3.43Å
408	D	94.1	Very high	80.4	Confident	7 Å²	7	41.8 Å²	41.8	4%	0.037	20%	0.2	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-99.9	97.7	167	-167.2	21	0	0	0	107.4	T164 K172 T173 I176 S380	T164-D408 WeakPolarHBondContact OG1-CA 3.14Å; T164-D408 PolarHBondContact OG1-OD1 3.11Å; K172-D408 WeakPolarHBondContact CB-OD1 3.39Å; T173-D408 VanDerWaalsContact CA-OD2 3.25Å; T173-D408 WeakPolarHBondContact CA-OD2 3.21Å; T173-D408 WeakPolarHBondContact CB-OD2 3.39Å; T173-D408 PolarHBondContact N-OD1 3.4Å; T173-D408 PolarHBondContact OG1-OD2 3.03Å; I176-D408 HydrophobicContact CG1-CB 4.06Å; S380-D408 PolarHBondContact N-O 3.3Å; S380-D408 PolarHBondContact O-N 2.92Å
409	L	92.9	Very high	80.4	Confident	1 Å²	1	52.6 Å²	52.6	1%	0.005	24%	0.235	C	C	.	.	P	Polyproline II helix	trans	-70.5	157.9	-179.4	-63.8	174.7	0	0	0	111	Y163 T164 Y165 K172 H379 C407 L434 L437 L465	Y163-L409 HydrophobicContact CD2-CD1 3.84Å; T164-L409 VanDerWaalsContact O-CB 3.23Å; T164-L409 WeakPolarHBondContact O-CB 3.35Å; T164-L409 WeakPolarHBondContact O-CD1 3.33Å; T164-L409 VanDerWaalsContact O-CG 3.27Å; T164-L409 WeakPolarHBondContact O-CG 3.41Å; T164-L409 PolarHBondContact O-N 2.78Å; Y165-L409 HydrophobicContact CD2-CD1 4.08Å; K172-L409 WeakPolarHBondContact CE-O 2.87Å; H379-L409 HydrophobicContact CB-CD2 4.26Å; H379-L409 WeakPolarHBondContact ND1-CD2 3.44Å; C407-L409 WeakPolarHBondContact SG-CD2 3.43Å; L409-L434 HydrophobicContact CB-CD2 4.39Å; L409-L434 HydrophobicContact CD1-CD2 4.03Å; L409-L434 HydrophobicContact CD2-CD2 4.5Å; L409-L437 HydrophobicContact CD1-CD2 4.31Å; L409-L465 HydrophobicContact CD2-CD1 3.83Å; L409-L465 HydrophobicContact CD2-CD2 3.75Å; L409-L465 HydrophobicContact CD2-CG 4.41Å
410	A	89.1	Confident	79.8	Confident	0 Å²	0	51.9 Å²	51.9	0%	0	23%	0.233	C	C	.	.	P	Polyproline II helix	trans	-63.4	171.9	170.9	0	0	0	0	0	112.8	K172 S376 H379 I430	K172-A410 WeakPolarHBondContact CE-O 3.49Å; S376-A410 WeakPolarHBondContact O-CA 3.35Å; S376-A410 WeakPolarHBondContact O-CB 3.3Å; H379-A410 PolarHBondContact ND1-N 3.3Å; A410-I430 HydrophobicContact CB-CG1 4.24Å; A410-I430 HydrophobicContact CB-CG2 3.59Å
411	G	87	Confident	79	Confident	1 Å²	1	50.7 Å²	50.7	1%	0.01	24%	0.24	C	C	.	.	P	Polyproline II helix	trans	-61.1	136.2	174	0	0	0	0	0	112.8	S376 E413 I430 L434	S376-G411 PolarHBondContact O-N 3.41Å; G411-E413 VanDerWaalsContact C-N 3.31Å; G411-E413 VanDerWaalsContact C-OE2 3.26Å; G411-E413 WeakPolarHBondContact CA-OE2 3.2Å; G411-I430 VanDerWaalsContact O-CG2 3.28Å; G411-I430 WeakPolarHBondContact O-CG2 3.32Å; G411-L434 WeakPolarHBondContact O-CD1 3.16Å
412	S	84.2	Confident	77.9	Confident	14 Å²	14	57.9 Å²	57.9	10%	0.098	27%	0.274	C	S	.	.			trans	-84.6	-0.7	176.3	66.1	0	0	0	0	114.3	G166 V167	G166-S412 PolarHBondContact O-N 3.02Å; G166-S412 PolarHBondContact O-OG 2.61Å; V167-S412 PolarHBondContact N-OG 3.04Å
413	E	75.7	Confident	76.7	Confident	40 Å²	40	61.7 Å²	61.7	19%	0.187	29%	0.288	C	S	.	.			trans	-80.1	151	-172.3	68.6	-74.7	173.1	0	0	114.8	V167 T168 G411 N431 E494	V167-E413 WeakPolarHBondContact CA-OE2 3.25Å; T168-E413 WeakPolarHBondContact CB-OE1 3.5Å; T168-E413 PolarHBondContact N-OE2 3.38Å; T168-E413 VanDerWaalsContact OG1-CD 3.29Å; T168-E413 PolarHBondContact OG1-OE1 3.33Å; T168-E413 PolarHBondContact OG1-OE2 3.05Å; G411-E413 VanDerWaalsContact C-N 3.31Å; G411-E413 VanDerWaalsContact C-OE2 3.26Å; G411-E413 WeakPolarHBondContact CA-OE2 3.2Å; E413-N431 PolarHBondContact O-ND2 2.78Å; E413-N431 VanDerWaalsContact O-ND2 3.07Å; E413-E494 WeakPolarHBondContact CA-OE2 3.45Å; E413-E494 HydrophobicContact CB-CB 4.48Å; E413-E494 HydrophobicContact CB-CG 4.28Å
414	R	60.3	Low	75.6	Confident	141 Å²	141	66.5 Å²	66.5	53%	0.532	31%	0.312	S	S	.	.			trans	-86.4	111.4	178.3	-60	176.4	-172.6	-165.8	3.3	110.8	K416 E494	R414-K416 VanDerWaalsContact C-N 3.27Å; R414-K416 PolarHBondContact O-N 3.01Å; R414-E494 PolarHBondContact N-OE2 3.47Å; R414-E494 VanDerWaalsContact N-OE2 3.09Å
415	C	57.9	Low	74.5	Confident	49 Å²	49	72.6 Å²	72.6	33%	0.331	34%	0.338	S	S	.	.			trans	-71.3	73	179	-73.7	0	0	0	0	113.3	E417 Q418 A427	C415-E417 VanDerWaalsContact C-N 3.31Å; C415-E417 PolarHBondContact O-N 2.7Å; C415-Q418 HydrophobicContact CB-CG 3.97Å; C415-Q418 PolarHBondContact SG-NE2 2.59Å; C415-A427 HydrophobicContact CB-CB 3.69Å
416	K	54.1	Low	73.4	Confident	153 Å²	153	73.1 Å²	73.1	67%	0.665	34%	0.341	S	S	*	.	T	Hydrogen-bonded Turn	trans	-66.8	-24.1	-178.6	-67.5	160.8	-178.6	151.7	0	114	R414 E494	R414-K416 VanDerWaalsContact C-N 3.27Å; R414-K416 PolarHBondContact O-N 3.01Å; K416-E494 IonicContact NZ-OE1 3.11Å; K416-E494 PolarHBondContact NZ-OE1 2.74Å
417	E	53.3	Low	72.3	Confident	182 Å²	182	73.4 Å²	73.4	85%	0.85	34%	0.343	S	S	*	.	T	Hydrogen-bonded Turn	trans	-111.2	1.8	-166.6	-56.7	-169.4	143.6	0	0	115.5	C415 R419	C415-E417 VanDerWaalsContact C-N 3.31Å; C415-E417 PolarHBondContact O-N 2.7Å; E417-R419 PolarHBondContact O-N 2.93Å
418	Q	56.8	Low	71.5	Confident	67 Å²	67	78 Å²	78	31%	0.313	37%	0.368	S	S	.	.			trans	-77.7	99.3	-171.1	-71.9	-170.5	-4.6	0	0	113.6	C415 N420 R423	C415-Q418 HydrophobicContact CB-CG 3.97Å; C415-Q418 PolarHBondContact SG-NE2 2.59Å; Q418-N420 PolarHBondContact O-N 3.13Å; Q418-R423 VanDerWaalsContact OE1-C 3.24Å; Q418-R423 VanDerWaalsContact OE1-CB 3.24Å; Q418-R423 PolarHBondContact OE1-O 2.7Å
419	R	56.1	Low	70.8	Confident	256 Å²	256	79.3 Å²	79.3	97%	0.966	38%	0.375	S	S	*	.			trans	-68.7	11.9	178.6	-60.6	-175.1	177.7	-171.3	-0.8	116.5	E417	E417-R419 PolarHBondContact O-N 2.93Å
420	N	63.7	Low	70.2	Confident	74 Å²	74	80.1 Å²	80.1	40%	0.396	38%	0.379	S	S	.	.			trans	-124.7	123.3	-179.6	-178.7	-4.9	0	0	0	110.9	Q418 E422 R423 M424	Q418-N420 PolarHBondContact O-N 3.13Å; N420-E422 VanDerWaalsContact C-N 3.34Å; N420-E422 PolarHBondContact O-N 3.2Å; N420-E422 PolarHBondContact OD1-N 3.26Å; N420-R423 HydrophobicContact CB-CG 4.38Å; N420-R423 PolarHBondContact O-N 2.87Å; N420-M424 WeakPolarHBondContact O-CB 3.47Å; N420-M424 PolarHBondContact O-N 2.68Å
421	G	69.9	Low	69.8	Low	48 Å²	48	82.1 Å²	82.1	50%	0.495	39%	0.39	S	S	.	.	H	α-helix	trans	-61	-32.1	-175.3	0	0	0	0	0	115.4	K425	G421-K425 WeakPolarHBondContact O-CB 3.46Å; G421-K425 PolarHBondContact O-N 3Å
422	E	67.5	Low	69.8	Low	157 Å²	157	84.6 Å²	84.6	73%	0.734	41%	0.405	S	S	*	.	H	α-helix	trans	-69	-47.1	175.7	-68.2	-165.6	136.4	0	0	111.5	N420 M424 K425 E426	N420-E422 VanDerWaalsContact C-N 3.34Å; N420-E422 PolarHBondContact O-N 3.2Å; N420-E422 PolarHBondContact OD1-N 3.26Å; E422-M424 VanDerWaalsContact C-N 3.32Å; E422-M424 PolarHBondContact O-N 3.08Å; E422-K425 PolarHBondContact O-N 3.02Å; E422-E426 WeakPolarHBondContact O-CB 3.3Å; E422-E426 PolarHBondContact O-N 3.17Å
423	R	69.1	Low	70.1	Confident	79 Å²	79	84 Å²	84	30%	0.298	40%	0.401	S	S	.	.	H	α-helix	trans	-63.2	-39	176	-61.7	-171	177.3	155.3	-4.8	111.4	L371 N372 Q418 N420 K425 E426 A427	L371-R423 PolarHBondContact O-NH2 3.43Å; N372-R423 PolarHBondContact OD1-NE 3.09Å; Q418-R423 VanDerWaalsContact OE1-C 3.24Å; Q418-R423 VanDerWaalsContact OE1-CB 3.24Å; Q418-R423 PolarHBondContact OE1-O 2.7Å; N420-R423 HydrophobicContact CB-CG 4.38Å; N420-R423 PolarHBondContact O-N 2.87Å; R423-K425 PolarHBondContact O-N 3.45Å; R423-E426 WeakPolarHBondContact O-CB 3.04Å; R423-E426 PolarHBondContact O-N 2.71Å; R423-A427 VanDerWaalsContact O-CB 3.3Å; R423-A427 WeakPolarHBondContact O-CB 3.49Å; R423-A427 PolarHBondContact O-N 3.44Å
424	M	71.6	Confident	70.7	Confident	120 Å²	120	82.4 Å²	82.4	59%	0.591	39%	0.393	S	S	*	.	H	α-helix	trans	-61.2	-42.3	174.7	-174.6	178.6	70.6	0	0	112.2	N420 E422 N428	N420-M424 WeakPolarHBondContact O-CB 3.47Å; N420-M424 PolarHBondContact O-N 2.68Å; E422-M424 VanDerWaalsContact C-N 3.32Å; E422-M424 PolarHBondContact O-N 3.08Å; M424-N428 VanDerWaalsContact O-CB 3.28Å; M424-N428 WeakPolarHBondContact O-CB 3.14Å; M424-N428 PolarHBondContact O-N 3.29Å
425	K	73.6	Confident	72	Confident	131 Å²	131	81.3 Å²	81.3	57%	0.57	40%	0.397	S	S	*	.	H	α-helix	trans	-64.4	-42.1	175.2	178.1	177.5	176.6	178.6	0	112	G421 E422 R423 N428 N429	G421-K425 WeakPolarHBondContact O-CB 3.46Å; G421-K425 PolarHBondContact O-N 3Å; E422-K425 PolarHBondContact O-N 3.02Å; R423-K425 PolarHBondContact O-N 3.45Å; K425-N428 PolarHBondContact O-N 3.03Å; K425-N429 PolarHBondContact O-N 3.36Å
426	E	72.3	Confident	73.7	Confident	14 Å²	14	79.1 Å²	79.1	7%	0.065	38%	0.383	C	S	.	.	H	α-helix	trans	-65.6	-48	178.4	-174.2	-155.9	125.3	0	0	111.7	Y305 R377 E422 R423 N428 N429 I430	Y305-E426 HydrophobicContact CE2-CG 3.79Å; Y305-E426 PolarHBondContact OH-OE2 2.9Å; Y305-E426 VanDerWaalsContact OH-OE2 3.11Å; R377-E426 IonicContact CZ-OE1 2.67Å; R377-E426 IonicContact CZ-OE2 2.72Å; R377-E426 IonicContact NE-OE1 3.64Å; R377-E426 PolarHBondContact NE-OE1 3.05Å; R377-E426 IonicContact NE-OE2 2.78Å; R377-E426 IonicContact NH2-OE1 3.8Å; R377-E426 PolarHBondContact NH2-OE1 2.69Å; R377-E426 IonicContact NH2-OE2 2.67Å; R377-E426 PolarHBondContact NH2-OE2 3.32Å; E422-E426 WeakPolarHBondContact O-CB 3.3Å; E422-E426 PolarHBondContact O-N 3.17Å; R423-E426 WeakPolarHBondContact O-CB 3.04Å; R423-E426 PolarHBondContact O-N 2.71Å; E426-N428 VanDerWaalsContact C-N 3.28Å; E426-N428 PolarHBondContact O-N 3.32Å; E426-N429 PolarHBondContact O-N 3.3Å; E426-I430 WeakPolarHBondContact O-CG1 3.42Å; E426-I430 PolarHBondContact O-N 3.07Å
427	A	73.6	Confident	75.4	Confident	8 Å²	8	71.9 Å²	71.9	7%	0.066	35%	0.351	C	S	.	.	H	α-helix	trans	-60.3	-36.6	173.6	0	0	0	0	0	112.5	C415 R423 N431	C415-A427 HydrophobicContact CB-CB 3.69Å; R423-A427 VanDerWaalsContact O-CB 3.3Å; R423-A427 WeakPolarHBondContact O-CB 3.49Å; R423-A427 PolarHBondContact O-N 3.44Å; A427-N431 WeakPolarHBondContact O-CB 3.44Å; A427-N431 PolarHBondContact O-N 3.03Å; A427-N431 PolarHBondContact O-ND2 2.99Å
428	N	77.8	Confident	77.2	Confident	95 Å²	95	64 Å²	64	51%	0.508	32%	0.319	S	S	.	.	H	α-helix	trans	-65.2	-39.2	171.7	-177.8	78.5	0	0	0	112	M424 K425 E426 N431 T432	M424-N428 VanDerWaalsContact O-CB 3.28Å; M424-N428 WeakPolarHBondContact O-CB 3.14Å; M424-N428 PolarHBondContact O-N 3.29Å; K425-N428 PolarHBondContact O-N 3.03Å; E426-N428 VanDerWaalsContact C-N 3.28Å; E426-N428 PolarHBondContact O-N 3.32Å; N428-N431 PolarHBondContact O-N 2.92Å; N428-T432 VanDerWaalsContact O-CB 3.26Å; N428-T432 WeakPolarHBondContact O-CB 3.47Å; N428-T432 PolarHBondContact O-N 3.45Å; N428-T432 PolarHBondContact O-OG1 2.77Å
429	N	81	Confident	78.7	Confident	35 Å²	35	66.1 Å²	66.1	19%	0.187	32%	0.324	C	S	.	.	H	α-helix	trans	-70.7	-39.2	177.9	-74.8	-5.8	0	0	0	112	N306 K425 E426 T432 S433	N306-N429 PolarHBondContact OD1-ND2 3.08Å; K425-N429 PolarHBondContact O-N 3.36Å; E426-N429 PolarHBondContact O-N 3.3Å; N429-T432 PolarHBondContact O-N 3.3Å; N429-S433 PolarHBondContact O-N 3.01Å; N429-S433 PolarHBondContact O-OG 3.49Å
430	I	79.2	Confident	80.4	Confident	18 Å²	18	54 Å²	54	9%	0.092	28%	0.278	C	S	.	.	H	α-helix	trans	-55.6	-55.5	169.2	-68.3	162.7	0	0	0	110	R377 A410 G411 E426 T432 S433 L434	R377-I430 HydrophobicContact CB-CD1 4.35Å; R377-I430 WeakPolarHBondContact O-CD1 3.41Å; A410-I430 HydrophobicContact CB-CG1 4.24Å; A410-I430 HydrophobicContact CB-CG2 3.59Å; G411-I430 VanDerWaalsContact O-CG2 3.28Å; G411-I430 WeakPolarHBondContact O-CG2 3.32Å; E426-I430 WeakPolarHBondContact O-CG1 3.42Å; E426-I430 PolarHBondContact O-N 3.07Å; I430-T432 VanDerWaalsContact C-N 3.3Å; I430-T432 PolarHBondContact O-N 3.33Å; I430-S433 PolarHBondContact O-N 2.94Å; I430-S433 PolarHBondContact O-OG 2.98Å; I430-L434 HydrophobicContact CG2-CD1 4.23Å; I430-L434 PolarHBondContact O-N 2.97Å; I430-L434 VanDerWaalsContact O-N 3.13Å
431	N	81.8	Confident	81.5	Confident	42 Å²	42	50.5 Å²	50.5	23%	0.225	26%	0.26	C	S	.	.	H	α-helix	trans	-61.6	-36.8	179.5	-85	-88	0	0	0	112.3	E413 A427 N428 L434 L435	E413-N431 PolarHBondContact O-ND2 2.78Å; E413-N431 VanDerWaalsContact O-ND2 3.07Å; A427-N431 WeakPolarHBondContact O-CB 3.44Å; A427-N431 PolarHBondContact O-N 3.03Å; A427-N431 PolarHBondContact O-ND2 2.99Å; N428-N431 PolarHBondContact O-N 2.92Å; N431-L434 PolarHBondContact O-N 3.28Å; N431-L435 WeakPolarHBondContact O-CB 3.38Å; N431-L435 PolarHBondContact O-N 2.78Å
432	T	86.8	Confident	82.3	Confident	53 Å²	53	50 Å²	50	33%	0.325	25%	0.25	S	S	.	.	H	α-helix	trans	-63.3	-44	175.8	-62.1	0	0	0	0	111.7	N428 N429 I430 T436	N428-T432 VanDerWaalsContact O-CB 3.26Å; N428-T432 WeakPolarHBondContact O-CB 3.47Å; N428-T432 PolarHBondContact O-N 3.45Å; N428-T432 PolarHBondContact O-OG1 2.77Å; N429-T432 PolarHBondContact O-N 3.3Å; I430-T432 VanDerWaalsContact C-N 3.3Å; I430-T432 PolarHBondContact O-N 3.33Å; T432-T436 WeakPolarHBondContact O-CB 3.4Å; T432-T436 PolarHBondContact O-N 3.37Å; T432-T436 PolarHBondContact O-OG1 3Å
433	S	89.6	Confident	83.2	Confident	2 Å²	2	42.7 Å²	42.7	1%	0.014	22%	0.217	C	C	.	.	H	α-helix	trans	-65	-42	178.5	67.3	0	0	0	0	112.6	E307 H379 N429 I430 T436 L437 S463	E307-S433 WeakPolarHBondContact OE1-CB 3.33Å; H379-S433 PolarHBondContact NE2-OG 3.1Å; N429-S433 PolarHBondContact O-N 3.01Å; N429-S433 PolarHBondContact O-OG 3.49Å; I430-S433 PolarHBondContact O-N 2.94Å; I430-S433 PolarHBondContact O-OG 2.98Å; S433-T436 PolarHBondContact O-N 3.29Å; S433-L437 PolarHBondContact O-N 3.27Å; S433-S463 WeakPolarHBondContact CB-OG 3.46Å
434	L	88.9	Confident	83.9	Confident	7 Å²	7	39.4 Å²	39.4	4%	0.037	21%	0.205	C	C	.	.	H	α-helix	trans	-73	-39	178.2	-65.5	176.6	0	0	0	112.6	Y165 L409 G411 I430 N431 T436 L437 G438 L465	Y165-L434 HydrophobicContact CD2-CD2 4.29Å; Y165-L434 HydrophobicContact CE2-CD1 4.31Å; Y165-L434 HydrophobicContact CE2-CD2 4.17Å; L409-L434 HydrophobicContact CB-CD2 4.39Å; L409-L434 HydrophobicContact CD1-CD2 4.03Å; L409-L434 HydrophobicContact CD2-CD2 4.5Å; G411-L434 WeakPolarHBondContact O-CD1 3.16Å; I430-L434 HydrophobicContact CG2-CD1 4.23Å; I430-L434 PolarHBondContact O-N 2.97Å; I430-L434 VanDerWaalsContact O-N 3.13Å; N431-L434 PolarHBondContact O-N 3.28Å; L434-T436 VanDerWaalsContact C-N 3.27Å; L434-T436 PolarHBondContact O-N 2.88Å; L434-L437 WeakPolarHBondContact O-CB 3.3Å; L434-L437 PolarHBondContact O-N 3.04Å; L434-G438 PolarHBondContact O-N 2.92Å; L434-L465 HydrophobicContact CD2-CD2 4.36Å
435	L	88.3	Confident	84.4	Confident	117 Å²	117	36.8 Å²	36.8	61%	0.613	19%	0.189	S	C	*	.	H	α-helix	trans	-61.7	-37.6	170.7	178.6	62	0	0	0	111.3	N431 G438 R439	N431-L435 WeakPolarHBondContact O-CB 3.38Å; N431-L435 PolarHBondContact O-N 2.78Å; L435-G438 PolarHBondContact O-N 2.85Å; L435-R439 WeakPolarHBondContact O-CG 3.49Å; L435-R439 PolarHBondContact O-N 3.5Å
436	T	91.7	Very high	84.8	Confident	4 Å²	4	34.6 Å²	34.6	3%	0.025	18%	0.181	C	C	.	.	H	α-helix	trans	-68.6	-37.7	176.5	-62.7	0	0	0	0	111.9	T432 S433 L434 G438 R439 C440 D462 T466	T432-T436 WeakPolarHBondContact O-CB 3.4Å; T432-T436 PolarHBondContact O-N 3.37Å; T432-T436 PolarHBondContact O-OG1 3Å; S433-T436 PolarHBondContact O-N 3.29Å; L434-T436 VanDerWaalsContact C-N 3.27Å; L434-T436 PolarHBondContact O-N 2.88Å; T436-G438 VanDerWaalsContact C-N 3.34Å; T436-R439 PolarHBondContact O-N 3.22Å; T436-C440 PolarHBondContact O-N 2.92Å; T436-C440 PolarHBondContact O-SG 3.41Å; T436-D462 HydrophobicContact CG2-CB 3.56Å; T436-T466 HydrophobicContact CG2-CG2 3.95Å
437	L	91.7	Very high	85.3	Confident	1 Å²	1	35.7 Å²	35.7	1%	0.005	19%	0.187	C	C	.	.	H	α-helix	trans	-59.6	-44.5	169.9	-178	63.1	0	0	0	111.1	L409 S433 L434 R439 C440 I441 T466 L469 F473 F501	L409-L437 HydrophobicContact CD1-CD2 4.31Å; S433-L437 PolarHBondContact O-N 3.27Å; L434-L437 WeakPolarHBondContact O-CB 3.3Å; L434-L437 PolarHBondContact O-N 3.04Å; L437-R439 PolarHBondContact O-N 3.07Å; L437-C440 WeakPolarHBondContact O-CB 3.44Å; L437-C440 PolarHBondContact O-N 3.41Å; L437-C440 VanDerWaalsContact O-N 3.15Å; L437-I441 HydrophobicContact CD1-CD1 4.35Å; L437-I441 HydrophobicContact CG-CD1 4.16Å; L437-I441 WeakPolarHBondContact O-CG1 3.29Å; L437-I441 PolarHBondContact O-N 3.42Å; L437-T466 HydrophobicContact CB-CG2 3.93Å; L437-T466 HydrophobicContact CD1-CG2 4.14Å; L437-L469 HydrophobicContact CD1-CD1 4.5Å; L437-F473 HydrophobicContact CD1-CE2 3.77Å; L437-F473 HydrophobicContact CD1-CZ 4.02Å; L437-F501 HydrophobicContact CD2-CZ 4.23Å; L437-F501 HydrophobicContact CG-CZ 4.22Å
438	G	89.6	Confident	85.5	Confident	17 Å²	17	37.2 Å²	37.2	18%	0.175	19%	0.193	C	C	.	.	H	α-helix	trans	-60.5	-43.3	174	0	0	0	0	0	113.4	L434 L435 T436 C440 I441 A442 F501	L434-G438 PolarHBondContact O-N 2.92Å; L435-G438 PolarHBondContact O-N 2.85Å; T436-G438 VanDerWaalsContact C-N 3.34Å; G438-C440 VanDerWaalsContact C-N 3.31Å; G438-C440 PolarHBondContact O-N 3.17Å; G438-I441 PolarHBondContact O-N 2.97Å; G438-A442 VanDerWaalsContact O-CB 3.3Å; G438-A442 WeakPolarHBondContact O-CB 3.48Å; G438-A442 PolarHBondContact O-N 3.49Å; G438-F501 VanDerWaalsContact CA-CE2 3.44Å
439	R	89.8	Confident	85.5	Confident	110 Å²	110	38.2 Å²	38.2	42%	0.415	20%	0.198	S	C	.	.	H	α-helix	trans	-61.8	-36.5	173.1	-73.3	169.2	60.5	-129.2	-3	112.3	L435 T436 L437 A443 P459 D462	L435-R439 WeakPolarHBondContact O-CG 3.49Å; L435-R439 PolarHBondContact O-N 3.5Å; T436-R439 PolarHBondContact O-N 3.22Å; L437-R439 PolarHBondContact O-N 3.07Å; R439-A443 WeakPolarHBondContact O-CB 3.33Å; R439-A443 PolarHBondContact O-N 3.15Å; R439-A443 VanDerWaalsContact O-N 3.07Å; R439-P459 HydrophobicContact CB-CG 3.93Å; R439-D462 IonicContact CZ-OD2 3.75Å; R439-D462 VanDerWaalsContact CZ-OD2 3.25Å; R439-D462 IonicContact NH1-OD2 2.8Å; R439-D462 PolarHBondContact NH1-OD2 3.09Å; R439-D462 IonicContact NH2-OD2 3.28Å; R439-D462 PolarHBondContact NH2-OD2 3.13Å
440	C	90.3	Very high	85.3	Confident	1 Å²	1	39 Å²	39	1%	0.007	20%	0.202	C	C	.	.	H	α-helix	trans	-66.3	-51.2	175.5	-66	0	0	0	0	111.6	T436 L437 G438 A442 A443 L444 V458 P459 F460	T436-C440 PolarHBondContact O-N 2.92Å; T436-C440 PolarHBondContact O-SG 3.41Å; L437-C440 WeakPolarHBondContact O-CB 3.44Å; L437-C440 PolarHBondContact O-N 3.41Å; L437-C440 VanDerWaalsContact O-N 3.15Å; G438-C440 VanDerWaalsContact C-N 3.31Å; G438-C440 PolarHBondContact O-N 3.17Å; C440-A442 VanDerWaalsContact C-N 3.33Å; C440-A442 PolarHBondContact O-N 3.15Å; C440-A443 PolarHBondContact O-N 2.89Å; C440-L444 WeakPolarHBondContact O-CD1 3.3Å; C440-L444 VanDerWaalsContact O-CG 3.28Å; C440-L444 WeakPolarHBondContact O-CG 3.42Å; C440-L444 PolarHBondContact O-N 3.05Å; C440-V458 HydrophobicContact CB-CG1 3.8Å; C440-P459 VanDerWaalsContact SG-C 3.56Å; C440-F460 HydrophobicContact CB-CD1 4.31Å; C440-F460 HydrophobicContact CB-CE1 4.2Å
441	I	88.3	Confident	84.8	Confident	2 Å²	2	47.2 Å²	47.2	1%	0.01	24%	0.237	C	C	.	.	H	α-helix	trans	-59	-44.1	178.2	-66.7	170.4	0	0	0	110.8	L437 G438 L444 R445 F501 I504 A505 L508	L437-I441 HydrophobicContact CD1-CD1 4.35Å; L437-I441 HydrophobicContact CG-CD1 4.16Å; L437-I441 WeakPolarHBondContact O-CG1 3.29Å; L437-I441 PolarHBondContact O-N 3.42Å; G438-I441 PolarHBondContact O-N 2.97Å; I441-L444 PolarHBondContact O-N 3.44Å; I441-R445 WeakPolarHBondContact O-CB 3.45Å; I441-R445 PolarHBondContact O-N 2.83Å; I441-F501 HydrophobicContact CD1-CE1 4.39Å; I441-F501 HydrophobicContact CD1-CZ 4.12Å; I441-I504 HydrophobicContact CG2-CG2 4.11Å; I441-A505 HydrophobicContact CD1-CB 4.29Å; I441-A505 HydrophobicContact CG2-CB 4.38Å; I441-L508 HydrophobicContact CG1-CD2 4.27Å; I441-L508 HydrophobicContact CG2-CB 4.43Å; I441-L508 HydrophobicContact CG2-CD2 4.19Å
442	A	86.3	Confident	83.8	Confident	36 Å²	36	50.9 Å²	50.9	30%	0.298	27%	0.266	S	S	.	.	H	α-helix	trans	-63.7	-41.3	178.3	0	0	0	0	0	113.1	G438 C440 H446	G438-A442 VanDerWaalsContact O-CB 3.3Å; G438-A442 WeakPolarHBondContact O-CB 3.48Å; G438-A442 PolarHBondContact O-N 3.49Å; C440-A442 VanDerWaalsContact C-N 3.33Å; C440-A442 PolarHBondContact O-N 3.15Å; A442-H446 WeakPolarHBondContact O-CB 3.38Å; A442-H446 PolarHBondContact O-N 2.94Å
443	A	85.9	Confident	82.6	Confident	4 Å²	4	55.3 Å²	55.3	3%	0.033	28%	0.277	C	S	.	.	H	α-helix	trans	-69.2	-39.8	176.5	0	0	0	0	0	112.3	R439 C440 H446 N447 V458	R439-A443 WeakPolarHBondContact O-CB 3.33Å; R439-A443 PolarHBondContact O-N 3.15Å; R439-A443 VanDerWaalsContact O-N 3.07Å; C440-A443 PolarHBondContact O-N 2.89Å; A443-H446 WeakPolarHBondContact O-CB 3.35Å; A443-H446 PolarHBondContact O-N 3.37Å; A443-N447 PolarHBondContact O-N 2.96Å; A443-N447 PolarHBondContact O-OD1 3.03Å; A443-V458 HydrophobicContact CB-CG1 4.4Å; A443-V458 HydrophobicContact CB-CG2 4.2Å
444	L	84.4	Confident	81.2	Confident	10 Å²	10	57 Å²	57	5%	0.052	29%	0.288	C	S	.	.	H	α-helix	trans	-59.8	-48.6	173.8	-71.6	160.6	0	0	0	111.4	C440 I441 H446 N447 Q448 V458 F460 F473 L508	C440-L444 WeakPolarHBondContact O-CD1 3.3Å; C440-L444 VanDerWaalsContact O-CG 3.28Å; C440-L444 WeakPolarHBondContact O-CG 3.42Å; C440-L444 PolarHBondContact O-N 3.05Å; I441-L444 PolarHBondContact O-N 3.44Å; L444-H446 VanDerWaalsContact C-N 3.33Å; L444-H446 PolarHBondContact O-N 2.76Å; L444-N447 PolarHBondContact O-N 3.1Å; L444-Q448 WeakPolarHBondContact O-CG 3.31Å; L444-Q448 PolarHBondContact O-N 3.44Å; L444-V458 HydrophobicContact CD1-CG1 4.44Å; L444-V458 HydrophobicContact CD2-CG1 4.39Å; L444-V458 HydrophobicContact CD2-CG2 3.88Å; L444-V458 HydrophobicContact CG-CG1 3.99Å; L444-V458 HydrophobicContact CG-CG2 4.03Å; L444-F460 HydrophobicContact CD1-CE1 4.48Å; L444-F460 HydrophobicContact CD1-CZ 3.99Å; L444-F460 HydrophobicContact CD2-CZ 4.21Å; L444-F460 HydrophobicContact CG-CZ 4.43Å; L444-F473 HydrophobicContact CD1-CB 3.83Å; L444-F473 HydrophobicContact CD1-CG 4.33Å; L444-L508 HydrophobicContact CB-CD1 3.58Å; L444-L508 HydrophobicContact CD1-CD1 4.43Å; L444-L508 HydrophobicContact CD1-CD2 4.17Å
445	R	82.1	Confident	80.2	Confident	66 Å²	66	59.9 Å²	59.9	25%	0.249	31%	0.307	C	S	.	.	H	α-helix	trans	-61.3	-39.4	175.5	-171.3	-167.6	64.4	178	-4.7	111.9	I441 N447 Q448 N449	I441-R445 WeakPolarHBondContact O-CB 3.45Å; I441-R445 PolarHBondContact O-N 2.83Å; R445-N447 PolarHBondContact O-N 3.49Å; R445-Q448 PolarHBondContact O-N 3.28Å; R445-N449 PolarHBondContact O-N 3.11Å; R445-N449 PolarHBondContact O-OD1 3.36Å
446	H	81.8	Confident	79.5	Confident	85 Å²	85	59 Å²	59	39%	0.394	30%	0.3	S	S	.	.	H	α-helix	trans	-60.2	-45	175.1	-174.9	97.2	0	0	0	111.6	A442 A443 L444 Q448 N449 N450	A442-H446 WeakPolarHBondContact O-CB 3.38Å; A442-H446 PolarHBondContact O-N 2.94Å; A443-H446 WeakPolarHBondContact O-CB 3.35Å; A443-H446 PolarHBondContact O-N 3.37Å; L444-H446 VanDerWaalsContact C-N 3.33Å; L444-H446 PolarHBondContact O-N 2.76Å; H446-Q448 PolarHBondContact O-N 2.98Å; H446-N449 PolarHBondContact O-N 2.98Å; H446-N450 PolarHBondContact CE1-ND2 3.14Å; H446-N450 PolarHBondContact NE2-ND2 3.47Å; H446-N450 WeakPolarHBondContact O-CB 3.4Å; H446-N450 PolarHBondContact O-N 3.16Å
447	N	81.5	Confident	79	Confident	36 Å²	36	63 Å²	63	19%	0.193	32%	0.324	C	S	.	.	H	α-helix	trans	-66.7	-35.1	178.3	-65.5	-8.7	0	0	0	112.7	A443 L444 R445 P455 Q456	A443-N447 PolarHBondContact O-N 2.96Å; A443-N447 PolarHBondContact O-OD1 3.03Å; L444-N447 PolarHBondContact O-N 3.1Å; R445-N447 PolarHBondContact O-N 3.49Å; N447-P455 HydrophobicContact CB-CB 4.39Å; N447-Q456 PolarHBondContact ND2-O 3.29Å; N447-Q456 VanDerWaalsContact OD1-CB 3.29Å; N447-Q456 WeakPolarHBondContact OD1-CB 3.33Å; N447-Q456 PolarHBondContact OD1-N 3.29Å
448	Q	78.1	Confident	78.7	Confident	41 Å²	41	64.1 Å²	64.1	19%	0.192	33%	0.331	C	S	.	.	H	α-helix	trans	-70	-40	177.6	-73.3	171	-1.4	0	0	112.6	L444 R445 H446 V509	L444-Q448 WeakPolarHBondContact O-CG 3.31Å; L444-Q448 PolarHBondContact O-N 3.44Å; R445-Q448 PolarHBondContact O-N 3.28Å; H446-Q448 PolarHBondContact O-N 2.98Å; Q448-V509 PolarHBondContact NE2-O 3.2Å
449	N	79.1	Confident	78.7	Confident	116 Å²	116	64.1 Å²	64.1	62%	0.62	33%	0.328	S	S	*	.	H	α-helix	trans	-74.1	-35.2	178.3	-68.7	16.5	0	0	0	111.9	R445 H446	R445-N449 PolarHBondContact O-N 3.11Å; R445-N449 PolarHBondContact O-OD1 3.36Å; H446-N449 PolarHBondContact O-N 2.98Å
450	N	76.1	Confident	78.6	Confident	51 Å²	51	59.4 Å²	59.4	27%	0.273	31%	0.31	S	S	.	.			trans	-103.9	53.4	-174.1	-64.1	-31.3	0	0	0	112.6	H446 S452 R453	H446-N450 PolarHBondContact CE1-ND2 3.14Å; H446-N450 PolarHBondContact NE2-ND2 3.47Å; H446-N450 WeakPolarHBondContact O-CB 3.4Å; H446-N450 PolarHBondContact O-N 3.16Å; N450-S452 PolarHBondContact O-N 3.45Å; N450-R453 HydrophobicContact CB-CB 4.2Å; N450-R453 HydrophobicContact CB-CG 4.32Å; N450-R453 PolarHBondContact O-N 2.84Å
451	K	69.2	Low	78.6	Confident	191 Å²	191	67.8 Å²	67.8	83%	0.83	34%	0.342	S	S	*	.	T	Hydrogen-bonded Turn	trans	-53.4	-27	-179.6	-64.1	-173.4	-180	-178.8	0	114.5	R453	K451-R453 VanDerWaalsContact C-N 3.31Å
452	S	59.7	Low	78.7	Confident	119 Å²	119	71.9 Å²	71.9	83%	0.832	36%	0.364	S	S	*	.	T	Hydrogen-bonded Turn	trans	-83.9	4.5	178	54.9	0	0	0	0	114.7	N450	N450-S452 PolarHBondContact O-N 3.45Å
453	R	62.2	Low	79	Confident	145 Å²	145	70.3 Å²	70.3	55%	0.547	35%	0.35	S	S	.	.	S	Bend	trans	-118.8	151.9	178.3	-65.7	-169.1	-177.9	-147.1	2.3	111	N450 K451 E577	N450-R453 HydrophobicContact CB-CB 4.2Å; N450-R453 HydrophobicContact CB-CG 4.32Å; N450-R453 PolarHBondContact O-N 2.84Å; K451-R453 VanDerWaalsContact C-N 3.31Å; R453-E577 IonicContact NH1-OE1 2.58Å
454	P	59.8	Low	79.3	Confident	38 Å²	38	74.2 Å²	74.2	25%	0.247	37%	0.367	C	S	.	.	P	Polyproline II helix	trans	-60.1	130.9	175	26	-35.1	0	0	0	110.4	Q456 Y520 E570 R573	P454-Q456 PolarHBondContact O-N 2.79Å; P454-Y520 HydrophobicContact CB-CE2 4.27Å; P454-Y520 WeakPolarHBondContact CB-OH 3.26Å; P454-E570 WeakPolarHBondContact CG-OE1 3.5Å; P454-R573 VanDerWaalsContact CG-NH2 3.32Å
455	P	67.3	Low	79.8	Confident	68 Å²	68	73.8 Å²	73.8	44%	0.442	36%	0.364	S	S	.	.	P	Polyproline II helix	trans	-67.2	128.1	-170	24.7	-33.7	0	0	0	111.7	N447 V457	N447-P455 HydrophobicContact CB-CB 4.39Å; P455-V457 PolarHBondContact O-N 3.2Å
456	Q	74.1	Confident	80.3	Confident	99 Å²	99	70.7 Å²	70.7	46%	0.463	35%	0.353	S	S	.	.	P	Polyproline II helix	trans	-58.9	135.5	174.5	-169.9	-177.7	30.2	0	0	110.1	N447 P454 V458	N447-Q456 PolarHBondContact ND2-O 3.29Å; N447-Q456 VanDerWaalsContact OD1-CB 3.29Å; N447-Q456 WeakPolarHBondContact OD1-CB 3.33Å; N447-Q456 PolarHBondContact OD1-N 3.29Å; P454-Q456 PolarHBondContact O-N 2.79Å; Q456-V458 PolarHBondContact O-N 2.9Å
457	V	80.8	Confident	80.8	Confident	87 Å²	87	68 Å²	68	53%	0.527	34%	0.339	S	S	.	.			trans	-65.7	108.9	176.6	179.8	0	0	0	0	109.9	P455 R517	P455-V457 PolarHBondContact O-N 3.2Å; V457-R517 VanDerWaalsContact CG1-NH2 3.35Å
458	V	85.3	Confident	81.4	Confident	25 Å²	25	67.3 Å²	67.3	15%	0.152	34%	0.336	C	S	.	.			trans	-67.9	126	177.6	-172	0	0	0	0	109.7	C440 A443 L444 Q456 F460	C440-V458 HydrophobicContact CB-CG1 3.8Å; A443-V458 HydrophobicContact CB-CG1 4.4Å; A443-V458 HydrophobicContact CB-CG2 4.2Å; L444-V458 HydrophobicContact CD1-CG1 4.44Å; L444-V458 HydrophobicContact CD2-CG1 4.39Å; L444-V458 HydrophobicContact CD2-CG2 3.88Å; L444-V458 HydrophobicContact CG-CG1 3.99Å; L444-V458 HydrophobicContact CG-CG2 4.03Å; Q456-V458 PolarHBondContact O-N 2.9Å; V458-F460 HydrophobicContact CB-CD2 3.77Å; V458-F460 HydrophobicContact CB-CE2 3.6Å; V458-F460 HydrophobicContact CB-CZ 4.35Å; V458-F460 HydrophobicContact CG1-CD1 4.33Å; V458-F460 HydrophobicContact CG1-CD2 3.64Å; V458-F460 HydrophobicContact CG1-CE1 4.09Å; V458-F460 HydrophobicContact CG1-CE2 3.36Å; V458-F460 HydrophobicContact CG1-CG 4.14Å; V458-F460 HydrophobicContact CG1-CZ 3.63Å; V458-F460 HydrophobicContact CG2-CE2 4.31Å; V458-F460 PolarHBondContact O-N 3.01Å
459	P	89.6	Confident	82	Confident	16 Å²	16	65.4 Å²	65.4	10%	0.104	33%	0.327	C	S	.	.			trans	-78	42.6	-170.1	30.5	-35.7	0	0	0	114.8	R439 C440 R461 D462	R439-P459 HydrophobicContact CB-CG 3.93Å; C440-P459 VanDerWaalsContact SG-C 3.56Å; P459-R461 PolarHBondContact O-N 3.46Å; P459-D462 HydrophobicContact CB-CB 4.33Å; P459-D462 WeakPolarHBondContact CB-OD2 3.48Å; P459-D462 WeakPolarHBondContact O-CB 3.47Å; P459-D462 PolarHBondContact O-N 3.48Å; P459-D462 VanDerWaalsContact O-N 3.08Å
460	F	89.6	Confident	82.5	Confident	11 Å²	11	61.3 Å²	61.3	5%	0.048	30%	0.304	C	S	.	.	T	Hydrogen-bonded Turn	trans	-58.7	-21.1	179.4	-67.2	-67.1	0	0	0	114	C440 L444 V458 T466 R467 Q470 F473 C474	C440-F460 HydrophobicContact CB-CD1 4.31Å; C440-F460 HydrophobicContact CB-CE1 4.2Å; L444-F460 HydrophobicContact CD1-CE1 4.48Å; L444-F460 HydrophobicContact CD1-CZ 3.99Å; L444-F460 HydrophobicContact CD2-CZ 4.21Å; L444-F460 HydrophobicContact CG-CZ 4.43Å; V458-F460 HydrophobicContact CB-CD2 3.77Å; V458-F460 HydrophobicContact CB-CE2 3.6Å; V458-F460 HydrophobicContact CB-CZ 4.35Å; V458-F460 HydrophobicContact CG1-CD1 4.33Å; V458-F460 HydrophobicContact CG1-CD2 3.64Å; V458-F460 HydrophobicContact CG1-CE1 4.09Å; V458-F460 HydrophobicContact CG1-CE2 3.36Å; V458-F460 HydrophobicContact CG1-CG 4.14Å; V458-F460 HydrophobicContact CG1-CZ 3.63Å; V458-F460 HydrophobicContact CG2-CE2 4.31Å; V458-F460 PolarHBondContact O-N 3.01Å; F460-T466 WeakPolarHBondContact CD1-O 3.34Å; F460-T466 CarbonylContact O-C 3.56Å; F460-T466 PolarHBondContact O-OG1 2.82Å; F460-T466 VanDerWaalsContact O-OG1 3.14Å; F460-R467 VanDerWaalsContact O-CA 3.26Å; F460-R467 WeakPolarHBondContact O-CA 3.44Å; F460-R467 WeakPolarHBondContact O-CB 3.26Å; F460-R467 PolarHBondContact O-N 3.22Å; F460-Q470 HydrophobicContact CB-CB 4.34Å; F460-Q470 HydrophobicContact CB-CG 4.29Å; F460-Q470 HydrophobicContact CD1-CB 3.86Å; F460-Q470 HydrophobicContact CD1-CG 4Å; F460-Q470 HydrophobicContact CD2-CB 4.44Å; F460-Q470 HydrophobicContact CD2-CG 3.71Å; F460-Q470 HydrophobicContact CE1-CB 4.17Å; F460-Q470 HydrophobicContact CE1-CG 4.15Å; F460-Q470 HydrophobicContact CE2-CG 3.85Å; F460-Q470 HydrophobicContact CG-CB 4Å; F460-Q470 HydrophobicContact CG-CG 3.77Å; F460-Q470 HydrophobicContact CZ-CG 4.06Å; F460-F473 HydrophobicContact CE1-CB 4.07Å; F460-F473 HydrophobicContact CE1-CD2 4.17Å; F460-F473 HydrophobicContact CZ-CB 3.99Å; F460-C474 WeakPolarHBondContact CE2-SG 3.28Å
461	R	89.8	Confident	82.9	Confident	178 Å²	178	59 Å²	59	67%	0.672	29%	0.293	S	S	*	.	T	Hydrogen-bonded Turn	trans	-87.2	-7.6	179.5	-74.1	-175.9	165.8	-172.4	-7	114.2	D331 P459 S463 R467	D331-R461 IonicContact OD2-NH2 2.9Å; D331-R461 PolarHBondContact OD2-NH2 2.99Å; D331-R461 VanDerWaalsContact OD2-NH2 3.1Å; P459-R461 PolarHBondContact O-N 3.46Å; R461-S463 VanDerWaalsContact C-N 3.32Å; R461-S463 PolarHBondContact O-N 3.49Å; R461-R467 VanDerWaalsContact NH2-NH2 3.17Å
462	D	89.9	Confident	83.8	Confident	88 Å²	88	50.4 Å²	50.4	47%	0.471	26%	0.255	S	S	.	.	S	Bend	trans	-75	-18.2	-177.1	-70.4	19.2	0	0	0	113	T436 R439 P459	T436-D462 HydrophobicContact CG2-CB 3.56Å; R439-D462 IonicContact CZ-OD2 3.75Å; R439-D462 VanDerWaalsContact CZ-OD2 3.25Å; R439-D462 IonicContact NH1-OD2 2.8Å; R439-D462 PolarHBondContact NH1-OD2 3.09Å; R439-D462 IonicContact NH2-OD2 3.28Å; R439-D462 PolarHBondContact NH2-OD2 3.13Å; P459-D462 HydrophobicContact CB-CB 4.33Å; P459-D462 WeakPolarHBondContact CB-OD2 3.48Å; P459-D462 WeakPolarHBondContact O-CB 3.47Å; P459-D462 PolarHBondContact O-N 3.48Å; P459-D462 VanDerWaalsContact O-N 3.08Å
463	S	92.9	Very high	85	Confident	3 Å²	3	45 Å²	45	2%	0.021	22%	0.217	C	C	.	.	S	Bend	trans	-143	150.8	173.7	167.7	0	0	0	0	111.3	E307 S433 R461 L465 T466 R467	E307-S463 WeakPolarHBondContact OE1-CB 3.48Å; E307-S463 PolarHBondContact OE1-OG 3.42Å; E307-S463 WeakPolarHBondContact OE2-CA 3.14Å; S433-S463 WeakPolarHBondContact CB-OG 3.46Å; R461-S463 VanDerWaalsContact C-N 3.32Å; R461-S463 PolarHBondContact O-N 3.49Å; S463-L465 VanDerWaalsContact C-N 3.29Å; S463-L465 PolarHBondContact O-N 2.7Å; S463-L465 PolarHBondContact OG-N 3.22Å; S463-T466 PolarHBondContact O-N 2.61Å; S463-T466 PolarHBondContact O-OG1 3.45Å; S463-R467 PolarHBondContact O-N 3.18Å; S463-R467 VanDerWaalsContact O-N 3.11Å
464	K	93	Very high	85.8	Confident	86 Å²	86	38.4 Å²	38.4	37%	0.374	19%	0.193	S	C	.	.	H	α-helix	trans	-60.7	-37.8	172.5	-60.7	-47.3	175.4	-165.6	0	112.4	I304 E307 L309 L329 R467 V468	I304-K464 HydrophobicContact CD1-CB 4.46Å; I304-K464 HydrophobicContact CG2-CB 4.16Å; E307-K464 VanDerWaalsContact O-CG 3.3Å; E307-K464 WeakPolarHBondContact O-CG 3.38Å; E307-K464 WeakPolarHBondContact OE2-CG 3.47Å; E307-K464 PolarHBondContact OE2-N 2.82Å; L309-K464 HydrophobicContact CD1-CB 4.02Å; L309-K464 HydrophobicContact CD1-CD 4.2Å; L309-K464 HydrophobicContact CD1-CG 3.83Å; L329-K464 HydrophobicContact CD1-CB 4.28Å; L329-K464 HydrophobicContact CD1-CD 3.84Å; L329-K464 HydrophobicContact CG-CD 4.39Å; K464-R467 PolarHBondContact O-N 3.43Å; K464-V468 WeakPolarHBondContact O-CG2 3.35Å; K464-V468 PolarHBondContact O-N 2.86Å
465	L	93.9	Very high	86.5	Confident	0 Å²	0	38.2 Å²	38.2	0%	0	20%	0.198	C	C	.	.	H	α-helix	trans	-60.1	-51.7	179	177.9	67.6	0	0	0	110.6	I304 H379 I381 L409 L434 S463 R467 V468 L469	I304-L465 HydrophobicContact CD1-CB 4.28Å; I304-L465 HydrophobicContact CD1-CD1 4.25Å; H379-L465 HydrophobicContact CB-CD1 4.29Å; I381-L465 HydrophobicContact CD1-CD1 4.38Å; L409-L465 HydrophobicContact CD2-CD1 3.83Å; L409-L465 HydrophobicContact CD2-CD2 3.75Å; L409-L465 HydrophobicContact CD2-CG 4.41Å; L434-L465 HydrophobicContact CD2-CD2 4.36Å; S463-L465 VanDerWaalsContact C-N 3.29Å; S463-L465 PolarHBondContact O-N 2.7Å; S463-L465 PolarHBondContact OG-N 3.22Å; L465-R467 VanDerWaalsContact C-N 3.31Å; L465-R467 PolarHBondContact O-N 2.78Å; L465-V468 PolarHBondContact O-N 2.92Å; L465-L469 HydrophobicContact CD1-CD1 3.93Å; L465-L469 HydrophobicContact CD1-CG 4.31Å; L465-L469 HydrophobicContact CG-CD1 4.16Å; L465-L469 WeakPolarHBondContact O-CG 3.41Å; L465-L469 PolarHBondContact O-N 2.87Å
466	T	93.3	Very high	87	Confident	1 Å²	1	37.9 Å²	37.9	1%	0.006	19%	0.188	C	C	.	.	H	α-helix	trans	-69	-29	-179.2	51.4	0	0	0	0	112.8	T436 L437 F460 S463 Q470	T436-T466 HydrophobicContact CG2-CG2 3.95Å; L437-T466 HydrophobicContact CB-CG2 3.93Å; L437-T466 HydrophobicContact CD1-CG2 4.14Å; F460-T466 WeakPolarHBondContact CD1-O 3.34Å; F460-T466 CarbonylContact O-C 3.56Å; F460-T466 PolarHBondContact O-OG1 2.82Å; F460-T466 VanDerWaalsContact O-OG1 3.14Å; S463-T466 PolarHBondContact O-N 2.61Å; S463-T466 PolarHBondContact O-OG1 3.45Å; T466-Q470 PolarHBondContact O-N 3.3Å; T466-Q470 VanDerWaalsContact O-N 3.16Å
467	R	92.6	Very high	87.5	Confident	29 Å²	29	33.8 Å²	33.8	11%	0.109	17%	0.172	C	C	.	.	H	α-helix	trans	-69.8	-37.1	173.7	-172.8	55.5	170.7	-175.4	2.5	112.5	L329 D331 P337 F460 R461 S463 K464 L465	L329-R467 HydrophobicContact CD1-CB 3.73Å; L329-R467 HydrophobicContact CD1-CG 3.73Å; D331-R467 IonicContact OD1-CZ 3.14Å; D331-R467 IonicContact OD1-NE 2.65Å; D331-R467 PolarHBondContact OD1-NE 3.22Å; D331-R467 IonicContact OD1-NH2 2.67Å; D331-R467 PolarHBondContact OD1-NH2 3.33Å; D331-R467 IonicContact OD2-CZ 3.09Å; D331-R467 IonicContact OD2-NH2 2.61Å; D331-R467 PolarHBondContact OD2-NH2 3.02Å; P337-R467 HydrophobicContact CB-CG 4.01Å; P337-R467 WeakPolarHBondContact CB-O 3.48Å; P337-R467 WeakPolarHBondContact CG-O 3.23Å; F460-R467 VanDerWaalsContact O-CA 3.26Å; F460-R467 WeakPolarHBondContact O-CA 3.44Å; F460-R467 WeakPolarHBondContact O-CB 3.26Å; F460-R467 PolarHBondContact O-N 3.22Å; R461-R467 VanDerWaalsContact NH2-NH2 3.17Å; S463-R467 PolarHBondContact O-N 3.18Å; S463-R467 VanDerWaalsContact O-N 3.11Å; K464-R467 PolarHBondContact O-N 3.43Å; L465-R467 VanDerWaalsContact C-N 3.31Å; L465-R467 PolarHBondContact O-N 2.78Å
468	V	92.7	Very high	87.9	Confident	22 Å²	22	30.9 Å²	30.9	13%	0.133	15%	0.154	C	C	.	.	H	α-helix	trans	-65.9	-51	173.3	168.7	0	0	0	0	110.7	Y302 I304 L309 L329 V339 I381 K464 L465 Q470	Y302-V468 WeakPolarHBondContact OH-CG1 3.4Å; I304-V468 HydrophobicContact CD1-CG2 4.45Å; L309-V468 HydrophobicContact CD2-CG2 4.44Å; L329-V468 HydrophobicContact CD1-CG2 4.14Å; L329-V468 HydrophobicContact CD2-CG2 3.66Å; V339-V468 HydrophobicContact CG2-CG2 4.5Å; I381-V468 HydrophobicContact CD1-CG1 4.25Å; K464-V468 WeakPolarHBondContact O-CG2 3.35Å; K464-V468 PolarHBondContact O-N 2.86Å; L465-V468 PolarHBondContact O-N 2.92Å; V468-Q470 PolarHBondContact O-N 2.93Å
469	L	91.7	Very high	88.2	Confident	0 Å²	0	29.8 Å²	29.8	0%	0	15%	0.148	C	C	.	.	H	α-helix	trans	-73.6	-6.8	-174.3	-58.2	-178.3	0	0	0	114.1	L161 L437 L465 G471 F472 F473	L161-L469 HydrophobicContact CD1-CD2 3.85Å; L161-L469 HydrophobicContact CD2-CD2 3.86Å; L437-L469 HydrophobicContact CD1-CD1 4.5Å; L465-L469 HydrophobicContact CD1-CD1 3.93Å; L465-L469 HydrophobicContact CD1-CG 4.31Å; L465-L469 HydrophobicContact CG-CD1 4.16Å; L465-L469 WeakPolarHBondContact O-CG 3.41Å; L465-L469 PolarHBondContact O-N 2.87Å; L469-G471 VanDerWaalsContact C-N 3.28Å; L469-G471 PolarHBondContact O-N 3.15Å; L469-G471 VanDerWaalsContact O-N 3.15Å; L469-F472 PolarHBondContact O-N 3.28Å; L469-F473 HydrophobicContact CB-CD2 4.15Å; L469-F473 HydrophobicContact CB-CE2 3.77Å; L469-F473 HydrophobicContact CD1-CE2 4.38Å; L469-F473 WeakPolarHBondContact O-CD2 3.3Å
470	Q	89.4	Confident	88.4	Confident	30 Å²	30	29.2 Å²	29.2	14%	0.14	14%	0.144	C	C	.	.	H	α-helix	trans	-51.1	-41	-175.2	178.8	177.7	-18.7	0	0	113.8	P337 F460 T466 V468 F472 F473 C474	P337-Q470 HydrophobicContact CG-CB 4.32Å; F460-Q470 HydrophobicContact CB-CB 4.34Å; F460-Q470 HydrophobicContact CB-CG 4.29Å; F460-Q470 HydrophobicContact CD1-CB 3.86Å; F460-Q470 HydrophobicContact CD1-CG 4Å; F460-Q470 HydrophobicContact CD2-CB 4.44Å; F460-Q470 HydrophobicContact CD2-CG 3.71Å; F460-Q470 HydrophobicContact CE1-CB 4.17Å; F460-Q470 HydrophobicContact CE1-CG 4.15Å; F460-Q470 HydrophobicContact CE2-CG 3.85Å; F460-Q470 HydrophobicContact CG-CB 4Å; F460-Q470 HydrophobicContact CG-CG 3.77Å; F460-Q470 HydrophobicContact CZ-CG 4.06Å; T466-Q470 PolarHBondContact O-N 3.3Å; T466-Q470 VanDerWaalsContact O-N 3.16Å; V468-Q470 PolarHBondContact O-N 2.93Å; Q470-F472 VanDerWaalsContact C-N 3.32Å; Q470-F472 PolarHBondContact O-N 3.24Å; Q470-F473 PolarHBondContact O-N 3.14Å; Q470-F473 VanDerWaalsContact O-N 3.17Å; Q470-C474 WeakPolarHBondContact O-CB 3.31Å; Q470-C474 PolarHBondContact O-N 3.21Å
471	G	85	Confident	88.7	Confident	3 Å²	3	28.7 Å²	28.7	3%	0.031	14%	0.142	C	C	.	.	H	α-helix	trans	-57.7	-42.6	-176.7	0	0	0	0	0	113.4	L469 F473 C474 R476	L469-G471 VanDerWaalsContact C-N 3.28Å; L469-G471 PolarHBondContact O-N 3.15Å; L469-G471 VanDerWaalsContact O-N 3.15Å; G471-F473 VanDerWaalsContact C-N 3.28Å; G471-F473 PolarHBondContact O-N 3.27Å; G471-C474 PolarHBondContact O-N 3.39Å; G471-R476 PolarHBondContact O-N 2.56Å; G471-R476 VanDerWaalsContact O-N 3.11Å
472	F	87.5	Confident	89	Confident	10 Å²	10	20.2 Å²	20.2	4%	0.044	11%	0.11	C	C	.	.	H	α-helix	trans	-74.5	-15.3	-178.3	-53.7	-83.4	0	0	0	113.9	N159 L161 T405 L469 Q470	N159-F472 HydrophobicContact CB-CD1 4.47Å; N159-F472 HydrophobicContact CB-CE1 4.04Å; L161-F472 HydrophobicContact CB-CB 3.99Å; L161-F472 HydrophobicContact CB-CD1 3.48Å; L161-F472 VanDerWaalsContact CB-CD1 3.48Å; L161-F472 HydrophobicContact CB-CD2 4Å; L161-F472 HydrophobicContact CB-CE1 3.85Å; L161-F472 HydrophobicContact CB-CE2 4.34Å; L161-F472 HydrophobicContact CB-CG 3.55Å; L161-F472 HydrophobicContact CB-CZ 4.28Å; L161-F472 HydrophobicContact CD2-CB 3.73Å; L161-F472 HydrophobicContact CD2-CD2 3.83Å; L161-F472 HydrophobicContact CD2-CG 3.82Å; L161-F472 HydrophobicContact CG-CD2 4.36Å; L161-F472 HydrophobicContact CG-CG 4.27Å; T405-F472 VanDerWaalsContact OG1-CZ 3.26Å; T405-F472 WeakPolarHBondContact OG1-CZ 3.43Å; L469-F472 PolarHBondContact O-N 3.28Å; Q470-F472 VanDerWaalsContact C-N 3.32Å; Q470-F472 PolarHBondContact O-N 3.24Å
473	F	84.6	Confident	89.3	Confident	6 Å²	6	16 Å²	16	3%	0.026	9%	0.088	C	C	.	.	H	α-helix	trans	-100.6	-14.4	175.3	-65.7	-58.7	0	0	0	113.4	Y163 L437 L444 F460 L469 Q470 G471 L508	Y163-F473 HydrophobicContact CE1-CZ 4.13Å; L437-F473 HydrophobicContact CD1-CE2 3.77Å; L437-F473 HydrophobicContact CD1-CZ 4.02Å; L444-F473 HydrophobicContact CD1-CB 3.83Å; L444-F473 HydrophobicContact CD1-CG 4.33Å; F460-F473 HydrophobicContact CE1-CB 4.07Å; F460-F473 HydrophobicContact CE1-CD2 4.17Å; F460-F473 HydrophobicContact CZ-CB 3.99Å; L469-F473 HydrophobicContact CB-CD2 4.15Å; L469-F473 HydrophobicContact CB-CE2 3.77Å; L469-F473 HydrophobicContact CD1-CE2 4.38Å; L469-F473 WeakPolarHBondContact O-CD2 3.3Å; Q470-F473 PolarHBondContact O-N 3.14Å; Q470-F473 VanDerWaalsContact O-N 3.17Å; G471-F473 VanDerWaalsContact C-N 3.28Å; G471-F473 PolarHBondContact O-N 3.27Å; F473-L508 HydrophobicContact CD1-CD2 3.95Å; F473-L508 HydrophobicContact CE1-CD2 4.3Å
474	C	79.9	Confident	89.4	Confident	7 Å²	7	16 Å²	16	5%	0.047	9%	0.087	C	C	.	.	T	Hydrogen-bonded Turn	trans	-108.9	30.8	179.9	-71.8	0	0	0	0	113	F460 Q470 G471 R476	F460-C474 WeakPolarHBondContact CE2-SG 3.28Å; Q470-C474 WeakPolarHBondContact O-CB 3.31Å; Q470-C474 PolarHBondContact O-N 3.21Å; G471-C474 PolarHBondContact O-N 3.39Å; C474-R476 PolarHBondContact O-N 2.89Å
475	G	73.2	Confident	89.5	Confident	33 Å²	33	11.9 Å²	11.9	34%	0.34	7%	0.069	S	C	.	.	T	Hydrogen-bonded Turn	trans	81.6	-0.8	170.2	0	0	0	0	0	116.9	G477 G511	G475-G477 PolarHBondContact O-N 2.74Å; G475-G511 WeakPolarHBondContact CA-O 3.38Å
476	R	78.6	Confident	89.4	Confident	62 Å²	62	12.2 Å²	12.2	23%	0.234	7%	0.071	C	C	.	.	S	Bend	trans	-87.1	16.5	176.5	-73.3	-174	-79.2	113.1	-18.9	114	N159 Y212 N336 G471 C474	N159-R476 WeakPolarHBondContact CB-O 3.46Å; N159-R476 PolarHBondContact ND2-O 3.27Å; Y212-R476 VanDerWaalsContact CE1-NH1 3.32Å; Y212-R476 PolarHBondContact OH-NH1 2.66Å; Y212-R476 VanDerWaalsContact OH-NH1 3.08Å; N336-R476 PolarHBondContact OD1-NE 3.49Å; N336-R476 VanDerWaalsContact OD1-NE 3.12Å; N336-R476 PolarHBondContact OD1-NH1 2.95Å; N336-R476 PolarHBondContact OD1-NH2 3.32Å; G471-R476 PolarHBondContact O-N 2.56Å; G471-R476 VanDerWaalsContact O-N 3.11Å; C474-R476 PolarHBondContact O-N 2.89Å
477	G	84.9	Confident	89.2	Confident	13 Å²	13	13 Å²	13	13%	0.134	8%	0.076	C	C	.	.	S	Bend	trans	165.5	177.5	-176.9	0	0	0	0	0	109.7	N159 G475	N159-G477 CarbonylContact O-C 3.55Å; N159-G477 WeakPolarHBondContact O-CA 3.49Å; G475-G477 PolarHBondContact O-N 2.74Å
478	T	89.1	Confident	89	Confident	25 Å²	25	11.7 Å²	11.7	15%	0.153	7%	0.072	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-121.1	156.5	175.2	61.1	0	0	0	0	111.9	N159 R160 L161	N159-T478 PolarHBondContact O-N 3.34Å; R160-T478 WeakPolarHBondContact CD-OG1 3.34Å; R160-T478 PolarHBondContact NE-OG1 2.78Å; R160-T478 PolarHBondContact NH1-OG1 3.1Å; L161-T478 PolarHBondContact N-O 2.83Å
479	S	91.3	Very high	88.6	Confident	3 Å²	3	11.4 Å²	11.4	2%	0.021	7%	0.072	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-121.5	144.5	-172.9	70.3	0	0	0	0	111.3	L161 H510	L161-S479 CarbonylContact O-C 3.41Å; L161-S479 WeakPolarHBondContact O-CA 3.28Å; S479-H510 PolarHBondContact N-NE2 2.69Å; S479-H510 PolarHBondContact O-CE1 2.92Å; S479-H510 PolarHBondContact O-NE2 2.7Å; S479-H510 PolarHBondContact OG-NE2 3.11Å; S479-H510 VanDerWaalsContact OG-NE2 3.11Å
480	C	93.2	Very high	88.3	Confident	4 Å²	4	15.9 Å²	15.9	3%	0.027	10%	0.103	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-136.6	131.6	177.4	-179.6	0	0	0	0	109.2	K74 F76 M150 L161 L162 Y163	K74-C480 WeakPolarHBondContact O-CA 3.15Å; F76-C480 WeakPolarHBondContact CD2-SG 3.3Å; F76-C480 WeakPolarHBondContact CE2-SG 3.43Å; M150-C480 HydrophobicContact CE-CB 3.36Å; M150-C480 HydrophobicContact SD-CB 3.98Å; L161-C480 PolarHBondContact O-N 2.67Å; L162-C480 WeakPolarHBondContact CA-O 3.15Å; L162-C480 HydrophobicContact CD1-CB 4.01Å; Y163-C480 WeakPolarHBondContact CD1-O 3.41Å; Y163-C480 PolarHBondContact N-O 3.11Å
481	M	95.1	Very high	88	Confident	0 Å²	0	16 Å²	16	0%	0	10%	0.104	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-109.2	133.4	-176.6	-175	175.1	179.6	0	0	109.9	K74 V75 F76 Y163 Y165 V483 F501 S502 A505	K74-M481 PolarHBondContact O-N 3.14Å; V75-M481 WeakPolarHBondContact CA-O 3.48Å; V75-M481 HydrophobicContact CG1-CB 4.25Å; V75-M481 HydrophobicContact CG1-CG 4.29Å; V75-M481 HydrophobicContact CG1-SD 4.14Å; V75-M481 HydrophobicContact CG2-CB 4.2Å; F76-M481 PolarHBondContact N-O 3.37Å; Y163-M481 HydrophobicContact CD2-CB 4.47Å; Y163-M481 HydrophobicContact CD2-CG 4.08Å; Y163-M481 HydrophobicContact CE1-CB 4.17Å; Y163-M481 HydrophobicContact CE2-CB 3.85Å; Y163-M481 HydrophobicContact CE2-CE 4.28Å; Y163-M481 HydrophobicContact CE2-CG 3.48Å; Y163-M481 VanDerWaalsContact CE2-CG 3.48Å; Y163-M481 HydrophobicContact CE2-SD 3.79Å; Y163-M481 WeakPolarHBondContact O-CA 3.33Å; Y165-M481 VanDerWaalsContact CB-CE 3.49Å; Y165-M481 HydrophobicContact CD1-CE 3.28Å; Y165-M481 HydrophobicContact CE1-CE 4.14Å; Y165-M481 HydrophobicContact CG-CE 3.52Å; M481-V483 HydrophobicContact CE-CG2 4.06Å; M481-V483 HydrophobicContact CG-CG2 4.25Å; M481-V483 HydrophobicContact SD-CG2 4.42Å; M481-F501 HydrophobicContact CE-CD1 3.72Å; M481-F501 HydrophobicContact CE-CE1 3.59Å; M481-F501 HydrophobicContact SD-CE1 4.34Å; M481-S502 WeakPolarHBondContact CE-OG 3.4Å; M481-A505 HydrophobicContact SD-CB 3.78Å
482	V	96.5	Very high	88.1	Confident	0 Å²	0	16.2 Å²	16.2	0%	0	10%	0.104	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-115.1	108.9	171.2	-178.6	0	0	0	0	108.8	F76 L162 Y163 T164 Y165 T175	F76-V482 CarbonylContact O-C 3.4Å; F76-V482 WeakPolarHBondContact O-CA 3.43Å; L162-V482 HydrophobicContact CD1-CG2 3.82Å; L162-V482 HydrophobicContact CG-CG2 4.36Å; Y163-V482 PolarHBondContact O-N 2.77Å; T164-V482 CarbonylContact C-O 3.58Å; T164-V482 VanDerWaalsContact CA-O 3.26Å; T164-V482 WeakPolarHBondContact CA-O 3.37Å; T164-V482 HydrophobicContact CG2-CB 3.88Å; T164-V482 HydrophobicContact CG2-CG1 4.14Å; Y165-V482 PolarHBondContact N-O 3.46Å; T175-V482 HydrophobicContact CG2-CG1 4.15Å
483	V	96.8	Very high	88.1	Confident	0 Å²	0	18.8 Å²	18.8	0%	0	12%	0.118	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-86.4	111.5	-178.7	-168.3	0	0	0	0	108.1	V75 F76 L77 R78 F129 M481 I485 S502	V75-V483 HydrophobicContact CG1-CG2 3.52Å; F76-V483 PolarHBondContact O-N 3.23Å; L77-V483 CarbonylContact C-O 3.51Å; L77-V483 HydrophobicContact CD1-CB 3.85Å; L77-V483 HydrophobicContact CD1-CG1 3.86Å; R78-V483 PolarHBondContact N-O 3.44Å; F129-V483 HydrophobicContact CE1-CG2 4.16Å; M481-V483 HydrophobicContact CE-CG2 4.06Å; M481-V483 HydrophobicContact CG-CG2 4.25Å; M481-V483 HydrophobicContact SD-CG2 4.42Å; V483-I485 HydrophobicContact CG1-CG2 4.18Å; V483-S502 WeakPolarHBondContact CG1-OG 3.47Å; V483-S502 VanDerWaalsContact CG2-OG 3.23Å; V483-S502 WeakPolarHBondContact CG2-OG 3.44Å
484	N	95.9	Very high	88.2	Confident	1 Å²	1	19.6 Å²	19.6	1%	0.005	12%	0.122	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-94.4	124.2	174.7	-78.2	101.3	0	0	0	109.9	T164 Y165 S170 K172 T175	T164-N484 WeakPolarHBondContact CG2-OD1 3.03Å; Y165-N484 PolarHBondContact O-N 2.96Å; S170-N484 WeakPolarHBondContact CB-O 3.18Å; S170-N484 WeakPolarHBondContact OG-CB 3.38Å; S170-N484 PolarHBondContact OG-O 3.49Å; K172-N484 WeakPolarHBondContact CA-OD1 3.43Å; K172-N484 HydrophobicContact CG-CB 3.84Å; T175-N484 PolarHBondContact OG1-ND2 2.92Å
485	I	94.6	Very high	88.7	Confident	1 Å²	1	19.4 Å²	19.4	1%	0.005	12%	0.12	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-121.4	149.9	175.1	67.6	167	0	0	0	113	L77 R78 I79 R80 V94 L102 V483 T495 L499	L77-I485 HydrophobicContact CD1-CD1 4.07Å; L77-I485 HydrophobicContact CD1-CG1 3.99Å; L77-I485 HydrophobicContact CD1-CG2 3.84Å; L77-I485 HydrophobicContact CD2-CD1 4.25Å; R78-I485 PolarHBondContact O-N 2.72Å; I79-I485 HydrophobicContact CB-CG1 4.49Å; I79-I485 HydrophobicContact CG1-CD1 4.13Å; I79-I485 HydrophobicContact CG1-CG1 4.09Å; R80-I485 PolarHBondContact N-O 3.36Å; V94-I485 HydrophobicContact CG1-CD1 4.06Å; V94-I485 HydrophobicContact CG2-CD1 4.23Å; L102-I485 HydrophobicContact CD2-CD1 3.9Å; V483-I485 HydrophobicContact CG1-CG2 4.18Å; I485-T495 HydrophobicContact CB-CG2 3.85Å; I485-T495 HydrophobicContact CD1-CG2 4.4Å; I485-T495 HydrophobicContact CG2-CG2 3.86Å; I485-L499 HydrophobicContact CG2-CD2 4.11Å; I485-L499 HydrophobicContact CG2-CG 4.29Å
486	N	90.8	Very high	89.6	Confident	7 Å²	7	17.9 Å²	17.9	4%	0.037	11%	0.105	C	C	.	.			trans	-105.1	122.1	171.8	176.6	0.1	0	0	0	107.7	R80 C488 I491	R80-N486 VanDerWaalsContact NH2-CG 3.34Å; R80-N486 PolarHBondContact NH2-ND2 2.99Å; R80-N486 PolarHBondContact NH2-OD1 3.04Å; N486-C488 PolarHBondContact O-N 2.93Å; N486-C488 VanDerWaalsContact OD1-CB 3.3Å; N486-C488 WeakPolarHBondContact OD1-CB 3.43Å; N486-C488 PolarHBondContact OD1-N 3.33Å; N486-C488 VanDerWaalsContact OD1-N 3.11Å; N486-I491 HydrophobicContact CB-CG2 3.82Å
487	P	90.4	Very high	90	Very high	17 Å²	17	19 Å²	19	11%	0.11	11%	0.112	C	C	.	.			trans	-76.5	-3.4	-176.7	29.9	-33.9	0	0	0	114.9	I79 L82 V94	I79-P487 HydrophobicContact CG2-CB 4.35Å; I79-P487 HydrophobicContact CG2-CG 4.09Å; L82-P487 HydrophobicContact CD2-CG 3.84Å; L82-P487 HydrophobicContact CG-CG 3.91Å; V94-P487 HydrophobicContact CB-CB 3.99Å; V94-P487 HydrophobicContact CG2-CB 3.6Å
488	C	87	Confident	90.3	Very high	2 Å²	2	18.4 Å²	18.4	1%	0.014	11%	0.107	C	C	.	.			trans	-63.6	137.4	-178.8	-173.3	0	0	0	0	113.4	L82 Q89 N486 S490 I491	L82-C488 HydrophobicContact CD2-CB 4.05Å; Q89-C488 VanDerWaalsContact CB-SG 3.58Å; Q89-C488 PolarHBondContact OE1-SG 3.48Å; N486-C488 PolarHBondContact O-N 2.93Å; N486-C488 VanDerWaalsContact OD1-CB 3.3Å; N486-C488 WeakPolarHBondContact OD1-CB 3.43Å; N486-C488 PolarHBondContact OD1-N 3.33Å; N486-C488 VanDerWaalsContact OD1-N 3.11Å; C488-S490 VanDerWaalsContact C-N 3.3Å; C488-S490 PolarHBondContact O-N 3.07Å; C488-S490 PolarHBondContact SG-OG 2.97Å; C488-I491 HydrophobicContact CB-CG2 4.45Å; C488-I491 PolarHBondContact O-N 3.34Å
489	A	85.7	Confident	90.5	Very high	16 Å²	16	17.2 Å²	17.2	13%	0.132	10%	0.099	C	C	.	.	G	3₁₀ helix	trans	-57.9	-36.4	-178	0	0	0	0	0	114.1	Q91 P107 I491 Y492	Q91-A489 HydrophobicContact CB-CB 4.4Å; Q91-A489 HydrophobicContact CG-CB 4.12Å; P107-A489 HydrophobicContact CB-CB 3.96Å; P107-A489 HydrophobicContact CG-CB 3.86Å; A489-I491 PolarHBondContact O-N 2.91Å; A489-I491 VanDerWaalsContact O-N 3.15Å; A489-Y492 VanDerWaalsContact O-CB 3.28Å; A489-Y492 WeakPolarHBondContact O-CB 3.42Å; A489-Y492 PolarHBondContact O-N 3.06Å
490	S	83.8	Confident	90.4	Very high	94 Å²	94	20.8 Å²	20.8	66%	0.657	11%	0.114	S	C	*	.	G	3₁₀ helix	trans	-66.7	-14.4	-176.6	53.4	0	0	0	0	114.5	Q89 C488	Q89-S490 PolarHBondContact OE1-OG 3.06Å; C488-S490 VanDerWaalsContact C-N 3.3Å; C488-S490 PolarHBondContact O-N 3.07Å; C488-S490 PolarHBondContact SG-OG 2.97Å
491	I	84.4	Confident	90.2	Very high	33 Å²	33	22 Å²	22	17%	0.169	12%	0.119	C	C	.	.	G	3₁₀ helix	trans	-119	18.4	178	-158.5	158.2	0	0	0	112.8	V167 N486 C488 A489 D493 E494 T495	V167-I491 HydrophobicContact CB-CD1 3.86Å; V167-I491 HydrophobicContact CB-CG1 4.4Å; V167-I491 HydrophobicContact CG1-CD1 4.34Å; V167-I491 HydrophobicContact CG1-CG1 4.37Å; V167-I491 HydrophobicContact CG2-CD1 3.64Å; V167-I491 HydrophobicContact CG2-CG1 4.14Å; N486-I491 HydrophobicContact CB-CG2 3.82Å; C488-I491 HydrophobicContact CB-CG2 4.45Å; C488-I491 PolarHBondContact O-N 3.34Å; A489-I491 PolarHBondContact O-N 2.91Å; A489-I491 VanDerWaalsContact O-N 3.15Å; I491-D493 PolarHBondContact O-N 2.95Å; I491-E494 HydrophobicContact CG1-CB 4.25Å; I491-T495 VanDerWaalsContact O-CB 3.31Å; I491-T495 WeakPolarHBondContact O-CB 3.33Å; I491-T495 PolarHBondContact O-N 3.01Å; I491-T495 PolarHBondContact O-OG1 3.28Å
492	Y	87.7	Confident	90	Very high	7 Å²	7	22 Å²	22	3%	0.027	12%	0.119	C	C	.	.	H	α-helix	trans	-53.6	-50.2	179.6	171.6	-98	0	0	0	113.1	L104 K105 A106 P107 N112 A489 E494 T495 L496	L104-Y492 HydrophobicContact CD2-CD2 4.02Å; L104-Y492 HydrophobicContact CD2-CE2 3.45Å; L104-Y492 VanDerWaalsContact CD2-CE2 3.45Å; L104-Y492 HydrophobicContact CG-CD2 4.22Å; L104-Y492 HydrophobicContact CG-CE2 3.67Å; K105-Y492 WeakPolarHBondContact O-CE2 3.48Å; A106-Y492 HydrophobicContact CB-CE1 4.38Å; P107-Y492 VanDerWaalsContact CD-CG 3.4Å; P107-Y492 HydrophobicContact CG-CD1 4.43Å; P107-Y492 HydrophobicContact CG-CD2 4.22Å; P107-Y492 HydrophobicContact CG-CG 3.88Å; N112-Y492 HydrophobicContact CB-CE1 4.15Å; A489-Y492 VanDerWaalsContact O-CB 3.28Å; A489-Y492 WeakPolarHBondContact O-CB 3.42Å; A489-Y492 PolarHBondContact O-N 3.06Å; Y492-E494 PolarHBondContact O-N 3.08Å; Y492-T495 CarbonylContact O-C 3.59Å; Y492-T495 WeakPolarHBondContact O-CB 3.21Å; Y492-T495 PolarHBondContact O-N 3.1Å; Y492-L496 HydrophobicContact CE1-CD2 4Å; Y492-L496 WeakPolarHBondContact O-CB 3.37Å; Y492-L496 PolarHBondContact O-N 2.88Å
493	D	86.3	Confident	89.5	Confident	63 Å²	63	23 Å²	23	34%	0.337	13%	0.127	S	C	.	.	H	α-helix	trans	-63.2	-45.8	-174.4	-69.2	-32.1	0	0	0	112.3	I491 T495 L496 Q497	I491-D493 PolarHBondContact O-N 2.95Å; D493-T495 VanDerWaalsContact C-N 3.31Å; D493-T495 PolarHBondContact O-N 3.35Å; D493-L496 WeakPolarHBondContact O-CB 3.43Å; D493-L496 PolarHBondContact O-N 3.29Å; D493-Q497 WeakPolarHBondContact O-CG 3.46Å; D493-Q497 PolarHBondContact O-N 2.73Å
494	E	87.8	Confident	88.9	Confident	24 Å²	24	26 Å²	26	11%	0.112	14%	0.142	C	C	.	.	H	α-helix	trans	-70.7	-30.8	179.9	-52.3	-70.7	151.6	0	0	110.6	V167 E413 R414 K416 I491 Y492 Q497 A498	V167-E494 HydrophobicContact CG1-CB 3.63Å; E413-E494 WeakPolarHBondContact CA-OE2 3.45Å; E413-E494 HydrophobicContact CB-CB 4.48Å; E413-E494 HydrophobicContact CB-CG 4.28Å; R414-E494 PolarHBondContact N-OE2 3.47Å; R414-E494 VanDerWaalsContact N-OE2 3.09Å; K416-E494 IonicContact NZ-OE1 3.11Å; K416-E494 PolarHBondContact NZ-OE1 2.74Å; I491-E494 HydrophobicContact CG1-CB 4.25Å; Y492-E494 PolarHBondContact O-N 3.08Å; E494-Q497 PolarHBondContact O-N 2.81Å; E494-A498 PolarHBondContact O-N 2.9Å
495	T	90.5	Very high	88.3	Confident	2 Å²	2	25.9 Å²	25.9	1%	0.012	14%	0.142	C	C	.	.	H	α-helix	trans	-66.5	-42.5	170.7	-61.5	0	0	0	0	111.9	L104 I485 I491 Y492 D493 Q497 A498 L499	L104-T495 HydrophobicContact CD1-CG2 4.35Å; I485-T495 HydrophobicContact CB-CG2 3.85Å; I485-T495 HydrophobicContact CD1-CG2 4.4Å; I485-T495 HydrophobicContact CG2-CG2 3.86Å; I491-T495 VanDerWaalsContact O-CB 3.31Å; I491-T495 WeakPolarHBondContact O-CB 3.33Å; I491-T495 PolarHBondContact O-N 3.01Å; I491-T495 PolarHBondContact O-OG1 3.28Å; Y492-T495 CarbonylContact O-C 3.59Å; Y492-T495 WeakPolarHBondContact O-CB 3.21Å; Y492-T495 PolarHBondContact O-N 3.1Å; D493-T495 VanDerWaalsContact C-N 3.31Å; D493-T495 PolarHBondContact O-N 3.35Å; T495-Q497 VanDerWaalsContact C-N 3.35Å; T495-Q497 PolarHBondContact O-N 3.08Å; T495-A498 PolarHBondContact O-N 3.35Å; T495-L499 HydrophobicContact CG2-CD1 3.97Å; T495-L499 HydrophobicContact CG2-CG 4.49Å; T495-L499 WeakPolarHBondContact O-CG 3.48Å; T495-L499 PolarHBondContact O-N 2.86Å
496	L	90.3	Very high	87.8	Confident	2 Å²	2	27.1 Å²	27.1	1%	0.01	15%	0.15	C	C	.	.	H	α-helix	trans	-62.2	-40.2	174.6	174.5	56	0	0	0	111.7	L104 N112 H125 F127 Y492 D493 K500	L104-L496 HydrophobicContact CD2-CB 3.85Å; L104-L496 HydrophobicContact CD2-CD1 3.87Å; L104-L496 HydrophobicContact CD2-CG 4.39Å; N112-L496 WeakPolarHBondContact ND2-CD2 3.49Å; H125-L496 WeakPolarHBondContact CD2-CD1 3.21Å; F127-L496 HydrophobicContact CE2-CD1 4.22Å; F127-L496 HydrophobicContact CZ-CD1 3.77Å; Y492-L496 HydrophobicContact CE1-CD2 4Å; Y492-L496 WeakPolarHBondContact O-CB 3.37Å; Y492-L496 PolarHBondContact O-N 2.88Å; D493-L496 WeakPolarHBondContact O-CB 3.43Å; D493-L496 PolarHBondContact O-N 3.29Å; L496-K500 HydrophobicContact CD1-CD 4.15Å; L496-K500 HydrophobicContact CD1-CG 4.27Å; L496-K500 HydrophobicContact CG-CD 4.27Å; L496-K500 WeakPolarHBondContact O-CB 3.3Å; L496-K500 VanDerWaalsContact O-CG 3.31Å; L496-K500 WeakPolarHBondContact O-CG 3.17Å; L496-K500 PolarHBondContact O-N 3.33Å
497	Q	88.8	Confident	87.2	Confident	85 Å²	85	29.7 Å²	29.7	40%	0.397	16%	0.161	S	C	.	.	H	α-helix	trans	-65.2	-41.4	173.2	-62.6	-60	-25.4	0	0	111.7	D493 E494 T495 L499 K500 F501	D493-Q497 WeakPolarHBondContact O-CG 3.46Å; D493-Q497 PolarHBondContact O-N 2.73Å; E494-Q497 PolarHBondContact O-N 2.81Å; T495-Q497 VanDerWaalsContact C-N 3.35Å; T495-Q497 PolarHBondContact O-N 3.08Å; Q497-L499 PolarHBondContact O-N 2.71Å; Q497-K500 PolarHBondContact O-N 2.79Å; Q497-F501 WeakPolarHBondContact O-CB 3.22Å; Q497-F501 PolarHBondContact O-N 3.32Å
498	A	90.8	Very high	86.7	Confident	1 Å²	1	29 Å²	29	1%	0.008	16%	0.157	C	C	.	.	H	α-helix	trans	-64.3	-39.3	177.4	0	0	0	0	0	112.6	Y165 E494 T495 S502	Y165-A498 HydrophobicContact CE1-CB 3.92Å; E494-A498 PolarHBondContact O-N 2.9Å; T495-A498 PolarHBondContact O-N 3.35Å; A498-S502 WeakPolarHBondContact O-CB 3.18Å; A498-S502 PolarHBondContact O-N 3.46Å; A498-S502 PolarHBondContact O-OG 3.48Å
499	L	92.6	Very high	86.2	Confident	0 Å²	0	31.1 Å²	31.1	0%	0	17%	0.169	C	C	.	.	H	α-helix	trans	-68.1	-42	175	-69.5	166.2	0	0	0	111.9	L77 L102 L104 F127 F129 I485 T495 Q497 F501 S502 A503	L77-L499 HydrophobicContact CD1-CD2 3.8Å; L102-L499 HydrophobicContact CD2-CD1 3.83Å; L102-L499 HydrophobicContact CD2-CD2 3.94Å; L104-L499 HydrophobicContact CB-CD1 4.43Å; L104-L499 HydrophobicContact CD1-CD1 3.77Å; L104-L499 HydrophobicContact CD2-CD1 3.92Å; L104-L499 HydrophobicContact CG-CD1 4.24Å; F127-L499 HydrophobicContact CD1-CB 4.11Å; F127-L499 HydrophobicContact CD2-CB 4.1Å; F127-L499 HydrophobicContact CD2-CD1 4.12Å; F127-L499 HydrophobicContact CE1-CB 3.87Å; F127-L499 HydrophobicContact CE2-CB 3.86Å; F127-L499 HydrophobicContact CE2-CD1 3.99Å; F127-L499 HydrophobicContact CG-CB 4.22Å; F127-L499 HydrophobicContact CZ-CB 3.75Å; F129-L499 HydrophobicContact CE2-CD2 3.95Å; F129-L499 HydrophobicContact CZ-CD2 3.53Å; I485-L499 HydrophobicContact CG2-CD2 4.11Å; I485-L499 HydrophobicContact CG2-CG 4.29Å; T495-L499 HydrophobicContact CG2-CD1 3.97Å; T495-L499 HydrophobicContact CG2-CG 4.49Å; T495-L499 WeakPolarHBondContact O-CG 3.48Å; T495-L499 PolarHBondContact O-N 2.86Å; Q497-L499 PolarHBondContact O-N 2.71Å; L499-F501 PolarHBondContact O-N 3.2Å; L499-S502 PolarHBondContact O-N 2.95Å; L499-S502 VanDerWaalsContact O-N 3.17Å; L499-A503 PolarHBondContact O-N 3.22Å
500	K	89.4	Confident	85.5	Confident	78 Å²	78	31.3 Å²	31.3	34%	0.339	17%	0.168	S	C	.	.	H	α-helix	trans	-60.1	-43.3	173.5	-78.3	173.2	174.4	173.2	0	112.6	F127 L496 Q497 S502 I504	F127-K500 HydrophobicContact CE1-CG 4.18Å; F127-K500 HydrophobicContact CZ-CG 4.29Å; L496-K500 HydrophobicContact CD1-CD 4.15Å; L496-K500 HydrophobicContact CD1-CG 4.27Å; L496-K500 HydrophobicContact CG-CD 4.27Å; L496-K500 WeakPolarHBondContact O-CB 3.3Å; L496-K500 VanDerWaalsContact O-CG 3.31Å; L496-K500 WeakPolarHBondContact O-CG 3.17Å; L496-K500 PolarHBondContact O-N 3.33Å; Q497-K500 PolarHBondContact O-N 2.79Å; K500-S502 VanDerWaalsContact C-N 3.34Å; K500-I504 PolarHBondContact O-N 3.02Å
501	F	88.9	Confident	84.2	Confident	30 Å²	30	27.4 Å²	27.4	13%	0.132	14%	0.142	C	C	.	.	H	α-helix	trans	-59.4	-45.9	172.4	175.9	-77.8	0	0	0	111.2	Y165 L437 G438 I441 M481 Q497 L499 A503 I504 A505	Y165-F501 HydrophobicContact CD1-CD1 4.02Å; Y165-F501 HydrophobicContact CD1-CE1 4.31Å; Y165-F501 HydrophobicContact CD2-CE1 4.49Å; Y165-F501 HydrophobicContact CE1-CB 4.12Å; Y165-F501 AromaticContact CE1-CD1 3.53Å; Y165-F501 HydrophobicContact CE1-CD1 3.53Å; Y165-F501 HydrophobicContact CE1-CE1 4.1Å; Y165-F501 AromaticContact CE1-CG 3.89Å; Y165-F501 HydrophobicContact CE1-CG 3.89Å; Y165-F501 HydrophobicContact CE2-CD1 4.41Å; Y165-F501 HydrophobicContact CE2-CE1 4.3Å; Y165-F501 HydrophobicContact CE2-CZ 4.42Å; Y165-F501 HydrophobicContact CG-CE1 4.49Å; Y165-F501 AromaticContact CZ-CD1 3.75Å; Y165-F501 AromaticContact CZ-CG 3.83Å; L437-F501 HydrophobicContact CD2-CZ 4.23Å; L437-F501 HydrophobicContact CG-CZ 4.22Å; G438-F501 VanDerWaalsContact CA-CE2 3.44Å; I441-F501 HydrophobicContact CD1-CE1 4.39Å; I441-F501 HydrophobicContact CD1-CZ 4.12Å; M481-F501 HydrophobicContact CE-CD1 3.72Å; M481-F501 HydrophobicContact CE-CE1 3.59Å; M481-F501 HydrophobicContact SD-CE1 4.34Å; Q497-F501 WeakPolarHBondContact O-CB 3.22Å; Q497-F501 PolarHBondContact O-N 3.32Å; L499-F501 PolarHBondContact O-N 3.2Å; F501-A503 PolarHBondContact O-N 3.44Å; F501-I504 WeakPolarHBondContact O-CB 3.16Å; F501-I504 PolarHBondContact O-N 2.68Å; F501-I504 VanDerWaalsContact O-N 3.14Å; F501-A505 PolarHBondContact O-N 2.89Å
502	S	90.4	Very high	82.7	Confident	0 Å²	0	31.1 Å²	31.1	0%	0	17%	0.168	C	C	.	.	H	α-helix	trans	-67	-37.8	-175.6	-55.2	0	0	0	0	112.4	M481 V483 A498 L499 K500 I504 A505 T506	M481-S502 WeakPolarHBondContact CE-OG 3.4Å; V483-S502 WeakPolarHBondContact CG1-OG 3.47Å; V483-S502 VanDerWaalsContact CG2-OG 3.23Å; V483-S502 WeakPolarHBondContact CG2-OG 3.44Å; A498-S502 WeakPolarHBondContact O-CB 3.18Å; A498-S502 PolarHBondContact O-N 3.46Å; A498-S502 PolarHBondContact O-OG 3.48Å; L499-S502 PolarHBondContact O-N 2.95Å; L499-S502 VanDerWaalsContact O-N 3.17Å; K500-S502 VanDerWaalsContact C-N 3.34Å; S502-I504 PolarHBondContact O-N 3.09Å; S502-A505 WeakPolarHBondContact O-CA 3.15Å; S502-A505 WeakPolarHBondContact O-CB 3.44Å; S502-A505 PolarHBondContact O-N 3.07Å; S502-T506 PolarHBondContact O-N 2.93Å; S502-T506 PolarHBondContact O-OG1 2.99Å
503	A	86.4	Confident	80.9	Confident	19 Å²	19	34.7 Å²	34.7	16%	0.157	19%	0.194	C	C	.	.	H	α-helix	trans	-62.2	-27.3	173.6	0	0	0	0	0	113.7	F127 L499 F501	F127-A503 HydrophobicContact CD1-CB 4.21Å; L499-A503 PolarHBondContact O-N 3.22Å; F501-A503 PolarHBondContact O-N 3.44Å
504	I	83.8	Confident	79.1	Confident	63 Å²	63	35.4 Å²	35.4	32%	0.323	20%	0.201	S	C	.	.	H	α-helix	trans	-72.9	-38	171.3	-62.7	166.5	0	0	0	110.3	I441 K500 F501 S502 Q507	I441-I504 HydrophobicContact CG2-CG2 4.11Å; K500-I504 PolarHBondContact O-N 3.02Å; F501-I504 WeakPolarHBondContact O-CB 3.16Å; F501-I504 PolarHBondContact O-N 2.68Å; F501-I504 VanDerWaalsContact O-N 3.14Å; S502-I504 PolarHBondContact O-N 3.09Å; I504-Q507 PolarHBondContact O-N 3.46Å
505	A	84.5	Confident	77.1	Confident	0 Å²	0	42.7 Å²	42.7	0%	0	23%	0.232	C	C	.	.	H	α-helix	trans	-67.4	-37.8	177.4	0	0	0	0	0	113.1	V75 I441 M481 F501 S502 Q507 L508	V75-A505 HydrophobicContact CG2-CB 4.21Å; I441-A505 HydrophobicContact CD1-CB 4.29Å; I441-A505 HydrophobicContact CG2-CB 4.38Å; M481-A505 HydrophobicContact SD-CB 3.78Å; F501-A505 PolarHBondContact O-N 2.89Å; S502-A505 WeakPolarHBondContact O-CA 3.15Å; S502-A505 WeakPolarHBondContact O-CB 3.44Å; S502-A505 PolarHBondContact O-N 3.07Å; A505-Q507 PolarHBondContact O-N 2.89Å; A505-L508 WeakPolarHBondContact O-CB 3.14Å; A505-L508 PolarHBondContact O-N 3.03Å
506	T	83.3	Confident	75.3	Confident	27 Å²	27	46.9 Å²	46.9	17%	0.166	26%	0.258	C	S	.	.	T	Hydrogen-bonded Turn	trans	-61.5	-17	176.9	-42.3	0	0	0	0	113.4	V75 S502	V75-T506 HydrophobicContact CG2-CG2 4.49Å; V75-T506 WeakPolarHBondContact CG2-OG1 3.21Å; S502-T506 PolarHBondContact O-N 2.93Å; S502-T506 PolarHBondContact O-OG1 2.99Å
507	Q	78.1	Confident	73.4	Confident	60 Å²	60	55.1 Å²	55.1	28%	0.28	29%	0.289	S	S	.	.	T	Hydrogen-bonded Turn	trans	-92.2	-7	177.4	-62.8	174.3	6	0	0	113.3	P45 I504 A505	P45-Q507 HydrophobicContact CB-CG 4.5Å; P45-Q507 HydrophobicContact CG-CG 4.24Å; I504-Q507 PolarHBondContact O-N 3.46Å; A505-Q507 PolarHBondContact O-N 2.89Å
508	L	80.4	Confident	71.6	Confident	4 Å²	4	54.3 Å²	54.3	2%	0.021	29%	0.289	C	S	.	.			trans	-76.6	127.8	177.6	-178.3	58.8	0	0	0	109.9	V73 I441 L444 F473 A505	V73-L508 HydrophobicContact CB-CB 4.41Å; V73-L508 HydrophobicContact CG2-CB 3.83Å; V73-L508 HydrophobicContact CG2-CD2 3.95Å; V73-L508 HydrophobicContact CG2-CG 3.8Å; V73-L508 WeakPolarHBondContact CG2-O 3.21Å; V73-L508 PolarHBondContact N-O 3.37Å; I441-L508 HydrophobicContact CG1-CD2 4.27Å; I441-L508 HydrophobicContact CG2-CB 4.43Å; I441-L508 HydrophobicContact CG2-CD2 4.19Å; L444-L508 HydrophobicContact CB-CD1 3.58Å; L444-L508 HydrophobicContact CD1-CD1 4.43Å; L444-L508 HydrophobicContact CD1-CD2 4.17Å; F473-L508 HydrophobicContact CD1-CD2 3.95Å; F473-L508 HydrophobicContact CE1-CD2 4.3Å; A505-L508 WeakPolarHBondContact O-CB 3.14Å; A505-L508 PolarHBondContact O-N 3.03Å
509	V	76.3	Confident	69.6	Low	45 Å²	45	56 Å²	56	27%	0.273	30%	0.304	S	S	.	.	B	Isolated β-bridge	trans	-88.9	148.5	169.4	175.8	0	0	0	0	108.5	S70 R72 Q448 G511	S70-V509 WeakPolarHBondContact OG-CG1 3.45Å; R72-V509 HydrophobicContact CG-CG2 4.15Å; Q448-V509 PolarHBondContact NE2-O 3.2Å; V509-G511 PolarHBondContact O-N 3.35Å
510	H	70.4	Confident	67.8	Low	21 Å²	21	59 Å²	59	10%	0.097	32%	0.315	C	S	.	.			trans	-73	95.7	169	-70.3	103.9	0	0	0	109.5	S70 E71 S479	S70-H510 PolarHBondContact OG-O 3.3Å; E71-H510 PolarHBondContact O-N 3.37Å; E71-H510 PolarHBondContact O-ND1 2.82Å; S479-H510 PolarHBondContact N-NE2 2.69Å; S479-H510 PolarHBondContact O-CE1 2.92Å; S479-H510 PolarHBondContact O-NE2 2.7Å; S479-H510 PolarHBondContact OG-NE2 3.11Å; S479-H510 VanDerWaalsContact OG-NE2 3.11Å
511	G	57.2	Low	66.2	Low	11 Å²	11	56.8 Å²	56.8	11%	0.113	31%	0.307	C	S	.	.			trans	-58.6	147.1	-177	0	0	0	0	0	112	G475 V509	G475-G511 WeakPolarHBondContact CA-O 3.38Å; V509-G511 PolarHBondContact O-N 3.35Å
512	P	53	Low	64.6	Low	111 Å²	111	59 Å²	59	72%	0.721	32%	0.32	S	S	*	.			trans	-56.4	160.2	166	28.5	-35.7	0	0	0	109.6	T514	P512-T514 PolarHBondContact O-N 2.83Å
513	S	49.1	Very low	63	Low	82 Å²	82	62.7 Å²	62.7	57%	0.573	35%	0.346	S	S	*	.			trans	-44.6	117.5	176.9	-176.3	0	0	0	0	109.8	K515	S513-K515 VanDerWaalsContact C-N 3.35Å; S513-K515 PolarHBondContact O-N 3.09Å
514	T	48.9	Very low	61.7	Low	79 Å²	79	64.1 Å²	64.1	49%	0.485	35%	0.35	S	S	.	.			trans	-67.3	96.9	-174.2	47.2	0	0	0	0	108.6	P512 T516	P512-T514 PolarHBondContact O-N 2.83Å; T514-T516 PolarHBondContact O-N 2.7Å
515	K	47.1	Very low	60.5	Low	176 Å²	176	63 Å²	63	77%	0.765	35%	0.345	S	S	*	.			trans	-35.4	113.5	176.3	-79.6	-170.9	177	-177.7	0	108.1	S513 A519	S513-K515 VanDerWaalsContact C-N 3.35Å; S513-K515 PolarHBondContact O-N 3.09Å; K515-A519 HydrophobicContact CB-CB 3.9Å
516	T	51.1	Low	59.4	Low	90 Å²	90	73.7 Å²	73.7	55%	0.552	39%	0.385	S	S	*	.			trans	-51.4	156.8	-164.7	-59.2	0	0	0	0	110.9	T514 V518 A519 Y520	T514-T516 PolarHBondContact O-N 2.7Å; T516-V518 HydrophobicContact CG2-CB 4.37Å; T516-V518 HydrophobicContact CG2-CG2 4.21Å; T516-V518 CarbonylContact O-C 3.57Å; T516-V518 PolarHBondContact O-N 3.49Å; T516-A519 WeakPolarHBondContact O-CA 3.36Å; T516-A519 WeakPolarHBondContact O-CB 3.26Å; T516-A519 PolarHBondContact O-N 3.06Å; T516-Y520 PolarHBondContact O-N 2.97Å; T516-Y520 VanDerWaalsContact O-N 3.13Å
517	R	51.9	Low	57.8	Low	175 Å²	175	78.5 Å²	78.5	66%	0.66	41%	0.41	S	S	*	.	H	α-helix	trans	-46.9	-33.5	175.7	-79.9	-174.4	170.9	-165.3	-3.4	112.9	V457 I521	V457-R517 VanDerWaalsContact CG1-NH2 3.35Å; R517-I521 WeakPolarHBondContact O-CB 3.13Å; R517-I521 VanDerWaalsContact O-CD1 3.3Å; R517-I521 WeakPolarHBondContact O-CD1 3.36Å; R517-I521 WeakPolarHBondContact O-CG1 3.35Å; R517-I521 PolarHBondContact O-N 3.44Å
518	V	49.6	Very low	56.4	Low	68 Å²	68	81.1 Å²	81.1	41%	0.412	43%	0.432	S	S	.	.	H	α-helix	trans	-56.8	-53.5	170.4	-178.1	0	0	0	0	112.1	T516 Y520 I521 L522	T516-V518 HydrophobicContact CG2-CB 4.37Å; T516-V518 HydrophobicContact CG2-CG2 4.21Å; T516-V518 CarbonylContact O-C 3.57Å; T516-V518 PolarHBondContact O-N 3.49Å; V518-Y520 PolarHBondContact O-N 2.8Å; V518-I521 CarbonylContact O-C 3.57Å; V518-I521 WeakPolarHBondContact O-CA 3.44Å; V518-I521 WeakPolarHBondContact O-CB 3.39Å; V518-I521 PolarHBondContact O-N 2.75Å; V518-I521 VanDerWaalsContact O-N 3.1Å; V518-L522 HydrophobicContact CG1-CD1 3.98Å; V518-L522 HydrophobicContact CG1-CG 4.37Å; V518-L522 WeakPolarHBondContact O-CG 3.19Å; V518-L522 PolarHBondContact O-N 2.86Å
519	A	48.4	Very low	54.5	Low	37 Å²	37	85.2 Å²	85.2	31%	0.306	47%	0.466	S	S	.	.	H	α-helix	trans	-63.5	-35.3	178.4	0	0	0	0	0	113.6	K515 T516 L522 S523	K515-A519 HydrophobicContact CB-CB 3.9Å; T516-A519 WeakPolarHBondContact O-CA 3.36Å; T516-A519 WeakPolarHBondContact O-CB 3.26Å; T516-A519 PolarHBondContact O-N 3.06Å; A519-L522 PolarHBondContact O-N 2.76Å; A519-S523 PolarHBondContact O-N 2.78Å
520	Y	56	Low	52.7	Low	63 Å²	63	87.1 Å²	87.1	25%	0.247	49%	0.487	C	S	.	.	H	α-helix	trans	-65.3	-41.6	169.7	172	-106.8	0	0	0	111.9	P454 T516 V518 L522 S523 L524	P454-Y520 HydrophobicContact CB-CE2 4.27Å; P454-Y520 WeakPolarHBondContact CB-OH 3.26Å; T516-Y520 PolarHBondContact O-N 2.97Å; T516-Y520 VanDerWaalsContact O-N 3.13Å; V518-Y520 PolarHBondContact O-N 2.8Å; Y520-L522 VanDerWaalsContact C-N 3.35Å; Y520-S523 WeakPolarHBondContact O-CB 3.5Å; Y520-S523 PolarHBondContact O-N 3.14Å; Y520-L524 HydrophobicContact CD1-CD1 3.98Å; Y520-L524 HydrophobicContact CE1-CD1 3.37Å; Y520-L524 HydrophobicContact CE1-CG 4.22Å; Y520-L524 HydrophobicContact CE2-CD1 4.23Å; Y520-L524 HydrophobicContact CE2-CG 4.21Å; Y520-L524 WeakPolarHBondContact O-CG 3.43Å; Y520-L524 PolarHBondContact O-N 2.91Å
521	I	56.2	Low	51.3	Low	31 Å²	31	95.6 Å²	95.6	16%	0.159	53%	0.526	C	S	.	.	H	α-helix	trans	-64	-38.4	174	-72.5	162.1	0	0	0	111.4	R517 V518 L524 L525 A563 L567	R517-I521 WeakPolarHBondContact O-CB 3.13Å; R517-I521 VanDerWaalsContact O-CD1 3.3Å; R517-I521 WeakPolarHBondContact O-CD1 3.36Å; R517-I521 WeakPolarHBondContact O-CG1 3.35Å; R517-I521 PolarHBondContact O-N 3.44Å; V518-I521 CarbonylContact O-C 3.57Å; V518-I521 WeakPolarHBondContact O-CA 3.44Å; V518-I521 WeakPolarHBondContact O-CB 3.39Å; V518-I521 PolarHBondContact O-N 2.75Å; V518-I521 VanDerWaalsContact O-N 3.1Å; I521-L524 WeakPolarHBondContact O-CB 3.44Å; I521-L524 PolarHBondContact O-N 3.37Å; I521-L525 HydrophobicContact CG2-CD1 4.21Å; I521-L525 WeakPolarHBondContact O-CG 3.46Å; I521-L525 PolarHBondContact O-N 3.03Å; I521-A563 HydrophobicContact CG2-CB 3.46Å; I521-A563 VanDerWaalsContact CG2-CB 3.46Å; I521-L567 HydrophobicContact CD1-CD1 3.9Å; I521-L567 HydrophobicContact CG1-CD1 4.19Å; I521-L567 HydrophobicContact CG1-CD2 4.28Å; I521-L567 HydrophobicContact CG1-CG 4.46Å
522	L	55.3	Low	50.1	Low	77 Å²	77	98.2 Å²	98.2	40%	0.403	55%	0.554	S	S	.	*	H	α-helix	trans	-67.5	-39.2	175.2	-70.6	170.3	0	0	0	111.6	V518 A519 Y520 L524 L525 R526 L555	V518-L522 HydrophobicContact CG1-CD1 3.98Å; V518-L522 HydrophobicContact CG1-CG 4.37Å; V518-L522 WeakPolarHBondContact O-CG 3.19Å; V518-L522 PolarHBondContact O-N 2.86Å; A519-L522 PolarHBondContact O-N 2.76Å; Y520-L522 VanDerWaalsContact C-N 3.35Å; L522-L524 VanDerWaalsContact C-N 3.31Å; L522-L524 PolarHBondContact O-N 3.41Å; L522-L525 HydrophobicContact CD2-CD1 4.45Å; L522-L525 PolarHBondContact O-N 3.07Å; L522-L525 VanDerWaalsContact O-N 3.08Å; L522-R526 PolarHBondContact O-N 2.79Å; L522-L555 HydrophobicContact CD2-CD2 4.24Å
523	S	57.2	Low	49	Very low	78 Å²	78	98.6 Å²	98.6	55%	0.545	56%	0.559	S	S	.	*	H	α-helix	trans	-60.2	-41.4	171.4	-166	0	0	0	0	111.7	A519 Y520 L525 R526	A519-S523 PolarHBondContact O-N 2.78Å; Y520-S523 WeakPolarHBondContact O-CB 3.5Å; Y520-S523 PolarHBondContact O-N 3.14Å; S523-L525 PolarHBondContact O-N 3.32Å; S523-R526 PolarHBondContact O-N 2.8Å
524	L	57.1	Low	48.2	Very low	48 Å²	48	104 Å²	104	25%	0.251	58%	0.575	S	S	.	*	H	α-helix	trans	-68.5	-16.3	174.3	-76.7	175.6	0	0	0	114.4	Y520 I521 L522 V566	Y520-L524 HydrophobicContact CD1-CD1 3.98Å; Y520-L524 HydrophobicContact CE1-CD1 3.37Å; Y520-L524 HydrophobicContact CE1-CG 4.22Å; Y520-L524 HydrophobicContact CE2-CD1 4.23Å; Y520-L524 HydrophobicContact CE2-CG 4.21Å; Y520-L524 WeakPolarHBondContact O-CG 3.43Å; Y520-L524 PolarHBondContact O-N 2.91Å; I521-L524 WeakPolarHBondContact O-CB 3.44Å; I521-L524 PolarHBondContact O-N 3.37Å; L522-L524 VanDerWaalsContact C-N 3.31Å; L522-L524 PolarHBondContact O-N 3.41Å; L524-V566 HydrophobicContact CB-CG1 4.01Å; L524-V566 HydrophobicContact CD1-CG1 3.91Å; L524-V566 HydrophobicContact CD2-CG1 3.95Å; L524-V566 HydrophobicContact CG-CG1 4.19Å
525	L	60	Low	47.2	Very low	41 Å²	41	104.9 Å²	104.9	22%	0.215	59%	0.585	C	S	.	*	H	α-helix	trans	-94	-20.4	174.5	-71.9	169.3	0	0	0	112.6	I521 L522 S523 D527 Q562 A563	I521-L525 HydrophobicContact CG2-CD1 4.21Å; I521-L525 WeakPolarHBondContact O-CG 3.46Å; I521-L525 PolarHBondContact O-N 3.03Å; L522-L525 HydrophobicContact CD2-CD1 4.45Å; L522-L525 PolarHBondContact O-N 3.07Å; L522-L525 VanDerWaalsContact O-N 3.08Å; S523-L525 PolarHBondContact O-N 3.32Å; L525-D527 VanDerWaalsContact C-N 3.32Å; L525-Q562 HydrophobicContact CD2-CB 3.61Å; L525-A563 HydrophobicContact CD1-CB 4.36Å
526	R	60.1	Low	46.2	Very low	223 Å²	223	102.5 Å²	102.5	84%	0.842	59%	0.585	S	S	*	*	S	Bend	trans	-78.1	-9.6	176.7	-77.9	-173.6	178.2	-168.1	-0.2	114.4	L522 S523 P528	L522-R526 PolarHBondContact O-N 2.79Å; S523-R526 PolarHBondContact O-N 2.8Å; R526-P528 WeakPolarHBondContact O-CD 3.48Å
527	D	50.8	Low	45.7	Very low	128 Å²	128	104.3 Å²	104.3	68%	0.684	60%	0.595	S	S	*	*			trans	-107.8	75.3	-177.1	-171.7	13.5	0	0	0	114.8	L525	L525-D527 VanDerWaalsContact C-N 3.32Å
528	P	47.6	Very low	44.8	Very low	115 Å²	115	102.3 Å²	102.3	75%	0.747	60%	0.597	S	S	*	*			trans	-125.8	39.3	170.2	43.8	-34.2	0	0	0	114.4	R526	R526-P528 WeakPolarHBondContact O-CD 3.48Å
529	A	41.4	Very low	44.2	Very low	90 Å²	90	108 Å²	108	74%	0.744	62%	0.618	S	S	*	*			trans	-137.4	17.6	-172.9	0	0	0	0	0	117.3	H531	A529-H531 PolarHBondContact O-N 2.88Å
530	A	38.4	Very low	43.4	Very low	86 Å²	86	114 Å²	114	71%	0.711	64%	0.641	S	S	*	*	S	Bend	trans	-84.5	1.5	-175.8	0	0	0	0	0	116.5
531	H	41.1	Very low	42.4	Very low	198 Å²	198	120 Å²	120	92%	0.917	67%	0.671	S	S	*	*	S	Bend	trans	-138	78.5	-177.8	-77.1	-12.3	0	0	0	112.4	A529	A529-H531 PolarHBondContact O-N 2.88Å
532	G	32.8	Very low	41.4	Very low	67 Å²	67	127.9 Å²	127.9	69%	0.691	71%	0.707	S	S	*	*	S	Bend	trans	173.1	96.6	171.6	0	0	0	0	0	114.9
533	S	28.8	Very low	40.2	Very low	118 Å²	118	131.2 Å²	131.2	83%	0.825	73%	0.725	S	S	*	*			trans	53.1	97.9	160.6	-55.5	0	0	0	0	119.8
534	E	33	Very low	39.3	Very low	196 Å²	196	136.6 Å²	136.6	92%	0.916	74%	0.742	S	S	*	*				26.6	104.7	122.3	-174.2	174.9	-137.9	0	0	118.8
535	S	27	Very low	38.1	Very low	98 Å²	98	138.7 Å²	138.7	69%	0.685	76%	0.76	S	S	*	*				-179.4	149.1	127.5	-178.7	0	0	0	0	112.8
536	T	26.5	Very low	37.1	Very low	125 Å²	125	144.7 Å²	144.7	77%	0.767	79%	0.792	S	S	*	*			trans	57.5	111	155.7	35	0	0	0	0	119.7
537	V	41.5	Very low	36	Very low	128 Å²	128	140.5 Å²	140.5	78%	0.776	79%	0.791	S	S	*	*			trans	-61.5	131.6	160.1	176.9	0	0	0	0	110.8	E539	V537-E539 HydrophobicContact CG1-CG 4.3Å
538	I	31.3	Very low	35.4	Very low	134 Å²	134	142.8 Å²	142.8	69%	0.687	80%	0.798	S	S	*	*			trans	-131.6	131.9	144.1	-56.1	-177.3	0	0	0	106.2	E540	I538-E540 HydrophobicContact CG2-CG 3.67Å
539	E	38.4	Very low	35.2	Very low	186 Å²	186	145.2 Å²	145.2	87%	0.869	81%	0.805	S	S	*	*			trans	-86.3	105.7	167.6	-64.7	171.5	143	0	0	106.5	V537	V537-E539 HydrophobicContact CG1-CG 4.3Å
540	E	31.5	Very low	34.9	Very low	165 Å²	165	143.9 Å²	143.9	77%	0.771	80%	0.8	S	S	*	*			trans	-107.8	130.7	169.5	-63.1	-165.7	156.5	0	0	108.7	I538	I538-E540 HydrophobicContact CG2-CG 3.67Å
541	E	34.4	Very low	34.7	Very low	189 Å²	189	145.4 Å²	145.4	88%	0.883	80%	0.796	S	S	*	*			trans	-75.3	122.6	-176.2	-61.9	173.7	125.7	0	0	109.2	D543	E541-D543 VanDerWaalsContact C-N 3.33Å; E541-D543 PolarHBondContact O-N 3.28Å
542	E	34.1	Very low	34.7	Very low	195 Å²	195	143.3 Å²	143.3	91%	0.911	79%	0.79	S	S	*	*			trans	-73.3	86.3	175.2	-74.7	-163.7	137.9	0	0	110.4	E544	E542-E544 PolarHBondContact O-N 3.29Å; E542-E544 VanDerWaalsContact O-N 3.1Å
543	D	30.1	Very low	35.5	Very low	148 Å²	148	144.8 Å²	144.8	79%	0.791	79%	0.786	S	S	*	*			trans	-56.5	109.2	165.4	-94.2	-34.6	0	0	0	109.9	E541 S545	E541-D543 VanDerWaalsContact C-N 3.33Å; E541-D543 PolarHBondContact O-N 3.28Å; D543-S545 PolarHBondContact O-N 3.33Å
544	E	40.3	Very low	36.5	Very low	191 Å²	191	146 Å²	146	89%	0.893	78%	0.782	S	S	*	*			trans	-69.3	73.4	167.9	-77.4	-157.9	127.4	0	0	110.3	E542	E542-E544 PolarHBondContact O-N 3.29Å; E542-E544 VanDerWaalsContact O-N 3.1Å
545	S	31.2	Very low	37.5	Very low	92 Å²	92	140.4 Å²	140.4	64%	0.643	76%	0.758	S	S	*	*			trans	-74.4	131.1	164.5	53.5	0	0	0	0	110.3	D543 V547	D543-S545 PolarHBondContact O-N 3.33Å; S545-V547 PolarHBondContact O-N 2.9Å
546	D	39.7	Very low	39.4	Very low	166 Å²	166	140.8 Å²	140.8	89%	0.888	75%	0.753	S	S	*	*			trans	-62.6	93.2	179.9	-78.4	-59.9	0	0	0	111.7	E548	D546-E548 PolarHBondContact O-N 3.02Å
547	V	36	Very low	41.5	Very low	135 Å²	135	140.3 Å²	140.3	82%	0.818	75%	0.75	S	S	*	*			trans	-76.5	104.9	167	-177.5	0	0	0	0	108.2	S545	S545-V547 PolarHBondContact O-N 2.9Å
548	E	39	Very low	42.9	Very low	177 Å²	177	140.8 Å²	140.8	83%	0.827	74%	0.744	S	S	*	*			trans	-48.6	152.5	177.8	-63.7	-175.4	116.6	0	0	113	D546 G550	D546-E548 PolarHBondContact O-N 3.02Å; E548-G550 PolarHBondContact O-N 3.26Å
549	D	41.5	Very low	44.7	Very low	165 Å²	165	136.1 Å²	136.1	88%	0.882	72%	0.723	S	S	*	*			trans	-61.3	93	-172.2	-161.4	16.9	0	0	0	111.7	D551	D549-D551 PolarHBondContact O-N 3.46Å
550	G	35.3	Very low	46.2	Very low	63 Å²	63	131.2 Å²	131.2	65%	0.649	70%	0.702	S	S	*	*			trans	-61.9	123.4	-162.8	0	0	0	0	0	114	E548	E548-G550 PolarHBondContact O-N 3.26Å
551	D	34.6	Very low	48.4	Very low	118 Å²	118	128.8 Å²	128.8	63%	0.631	69%	0.694	S	S	*	*			trans	-52.2	139.5	-169.8	-173.7	25.2	0	0	0	114.1	D549 T553	D549-D551 PolarHBondContact O-N 3.46Å; D551-T553 PolarHBondContact O-N 2.84Å; D551-T553 WeakPolarHBondContact OD2-CB 3.42Å; D551-T553 WeakPolarHBondContact OD2-CG2 3.48Å; D551-T553 PolarHBondContact OD2-OG1 2.92Å
552	I	42.3	Very low	50.4	Low	153 Å²	153	124.6 Å²	124.6	79%	0.785	67%	0.674	S	S	*	*	T	Hydrogen-bonded Turn	trans	-67.1	-5.2	-172.1	-77.7	172.4	0	0	0	112.8
553	T	49.8	Very low	52.1	Low	98 Å²	98	115.6 Å²	115.6	60%	0.601	63%	0.633	S	S	*	*	T	Hydrogen-bonded Turn	trans	-87	-14.4	-167.5	58	0	0	0	0	115.9	D551	D551-T553 PolarHBondContact O-N 2.84Å; D551-T553 WeakPolarHBondContact OD2-CB 3.42Å; D551-T553 WeakPolarHBondContact OD2-CG2 3.48Å; D551-T553 PolarHBondContact OD2-OG1 2.92Å
554	L	49.3	Very low	54.3	Low	144 Å²	144	111.9 Å²	111.9	75%	0.754	61%	0.613	S	S	*	*			trans	-124.9	36.2	-166.2	-77	172.3	0	0	0	116.8	N556	L554-N556 PolarHBondContact O-N 3.3Å
555	L	52.8	Low	56.1	Low	78 Å²	78	105.9 Å²	105.9	41%	0.408	59%	0.587	S	S	.	*			trans	-78.9	100.8	157.6	-81.3	175.2	0	0	0	110.3	L522	L522-L555 HydrophobicContact CD2-CD2 4.24Å
556	N	66.8	Low	58.3	Low	107 Å²	107	102.4 Å²	102.4	57%	0.572	56%	0.561	S	S	*	*			trans	-52.4	145.6	173.8	-74.7	-29.7	0	0	0	111.8	L554 E558 S559 L560	L554-N556 PolarHBondContact O-N 3.3Å; N556-E558 PolarHBondContact O-N 2.87Å; N556-S559 WeakPolarHBondContact O-CB 3.43Å; N556-S559 PolarHBondContact O-N 3.26Å; N556-L560 PolarHBondContact O-N 3.37Å
557	T	72.5	Confident	59.9	Low	114 Å²	114	97.5 Å²	97.5	70%	0.699	54%	0.535	S	S	*	.	H	α-helix	trans	-53.2	-35	-176.2	-41.5	0	0	0	0	113.1	L561	T557-L561 VanDerWaalsContact O-CG 3.3Å; T557-L561 WeakPolarHBondContact O-CG 3.48Å; T557-L561 PolarHBondContact O-N 3.15Å
558	E	70.9	Confident	61.9	Low	139 Å²	139	96.8 Å²	96.8	65%	0.65	52%	0.521	S	S	*	.	H	α-helix	trans	-71.3	-46.3	177.2	-174.2	165.6	-159.3	0	0	112.7	N556 L560 L561 Q562	N556-E558 PolarHBondContact O-N 2.87Å; E558-L560 VanDerWaalsContact C-N 3.25Å; E558-L560 PolarHBondContact O-N 2.88Å; E558-L561 WeakPolarHBondContact O-CB 3.21Å; E558-L561 PolarHBondContact O-N 2.68Å; E558-L561 VanDerWaalsContact O-N 3.07Å; E558-Q562 WeakPolarHBondContact O-CG 3.2Å; E558-Q562 PolarHBondContact O-N 3.09Å
559	S	67.6	Low	63.7	Low	36 Å²	36	94.3 Å²	94.3	25%	0.252	50%	0.504	S	S	.	.	H	α-helix	trans	-59.9	-36.9	173.5	-47.4	0	0	0	0	111.7	N556 Q562 A563	N556-S559 WeakPolarHBondContact O-CB 3.43Å; N556-S559 PolarHBondContact O-N 3.26Å; S559-Q562 PolarHBondContact O-N 3.21Å; S559-A563 WeakPolarHBondContact O-CB 3.47Å; S559-A563 PolarHBondContact O-N 3.19Å
560	L	70.9	Confident	65.1	Low	83 Å²	83	87.5 Å²	87.5	44%	0.435	47%	0.467	S	S	.	.	H	α-helix	trans	-67.3	-38.2	173.8	-176.1	62.4	0	0	0	112.2	N556 E558 A563 I564	N556-L560 PolarHBondContact O-N 3.37Å; E558-L560 VanDerWaalsContact C-N 3.25Å; E558-L560 PolarHBondContact O-N 2.88Å; L560-A563 PolarHBondContact O-N 3.16Å; L560-I564 HydrophobicContact CG-CD1 4.18Å; L560-I564 WeakPolarHBondContact O-CB 3.21Å; L560-I564 WeakPolarHBondContact O-CD1 3.46Å; L560-I564 WeakPolarHBondContact O-CG1 3.28Å; L560-I564 PolarHBondContact O-N 3.09Å
561	L	77	Confident	67	Low	113 Å²	113	88 Å²	88	59%	0.592	46%	0.457	S	S	*	.	H	α-helix	trans	-67.5	-40.4	174.6	-75.2	167.9	0	0	0	112.2	T557 E558 I564 D565	T557-L561 VanDerWaalsContact O-CG 3.3Å; T557-L561 WeakPolarHBondContact O-CG 3.48Å; T557-L561 PolarHBondContact O-N 3.15Å; E558-L561 WeakPolarHBondContact O-CB 3.21Å; E558-L561 PolarHBondContact O-N 2.68Å; E558-L561 VanDerWaalsContact O-N 3.07Å; L561-I564 PolarHBondContact O-N 3.36Å; L561-D565 PolarHBondContact O-N 2.7Å; L561-D565 VanDerWaalsContact O-N 3.07Å
562	Q	75.8	Confident	69.1	Low	101 Å²	101	88.9 Å²	88.9	47%	0.472	45%	0.451	S	S	.	.	H	α-helix	trans	-61.8	-47.4	172.9	-69.4	175.5	-1.5	0	0	111.1	L525 E558 S559 I564 D565 V566	L525-Q562 HydrophobicContact CD2-CB 3.61Å; E558-Q562 WeakPolarHBondContact O-CG 3.2Å; E558-Q562 PolarHBondContact O-N 3.09Å; S559-Q562 PolarHBondContact O-N 3.21Å; Q562-I564 VanDerWaalsContact C-N 3.29Å; Q562-I564 PolarHBondContact O-N 2.93Å; Q562-D565 PolarHBondContact O-N 3.19Å; Q562-V566 PolarHBondContact O-N 3.19Å
563	A	70.6	Confident	70.8	Confident	7 Å²	7	85.4 Å²	85.4	6%	0.058	43%	0.429	C	S	.	.	H	α-helix	trans	-56.2	-42.6	174.4	0	0	0	0	0	112.3	I521 L525 S559 L560 D565 V566 L567	I521-A563 HydrophobicContact CG2-CB 3.46Å; I521-A563 VanDerWaalsContact CG2-CB 3.46Å; L525-A563 HydrophobicContact CD1-CB 4.36Å; S559-A563 WeakPolarHBondContact O-CB 3.47Å; S559-A563 PolarHBondContact O-N 3.19Å; L560-A563 PolarHBondContact O-N 3.16Å; A563-D565 VanDerWaalsContact C-N 3.32Å; A563-D565 PolarHBondContact O-N 3.36Å; A563-V566 PolarHBondContact O-N 3.33Å; A563-L567 WeakPolarHBondContact O-CB 3.5Å; A563-L567 WeakPolarHBondContact O-CG 3.4Å; A563-L567 PolarHBondContact O-N 3.04Å
564	I	76	Confident	71.8	Confident	69 Å²	69	84.3 Å²	84.3	35%	0.354	42%	0.417	S	S	.	.	H	α-helix	trans	-62.7	-36.5	176.2	-74.3	164.7	0	0	0	111.7	L560 L561 Q562 K568	L560-I564 HydrophobicContact CG-CD1 4.18Å; L560-I564 WeakPolarHBondContact O-CB 3.21Å; L560-I564 WeakPolarHBondContact O-CD1 3.46Å; L560-I564 WeakPolarHBondContact O-CG1 3.28Å; L560-I564 PolarHBondContact O-N 3.09Å; L561-I564 PolarHBondContact O-N 3.36Å; Q562-I564 VanDerWaalsContact C-N 3.29Å; Q562-I564 PolarHBondContact O-N 2.93Å; I564-K568 HydrophobicContact CG2-CD 4.15Å; I564-K568 WeakPolarHBondContact O-CB 3.4Å; I564-K568 WeakPolarHBondContact O-CD 3.41Å; I564-K568 WeakPolarHBondContact O-CG 3.37Å; I564-K568 PolarHBondContact O-N 3.41Å
565	D	78.4	Confident	73	Confident	65 Å²	65	85.2 Å²	85.2	35%	0.348	41%	0.41	S	S	.	.	H	α-helix	trans	-72.8	-44	175.9	-174.1	69.7	0	0	0	113.2	L561 Q562 A563 L567 K568 R569	L561-D565 PolarHBondContact O-N 2.7Å; L561-D565 VanDerWaalsContact O-N 3.07Å; Q562-D565 PolarHBondContact O-N 3.19Å; A563-D565 VanDerWaalsContact C-N 3.32Å; A563-D565 PolarHBondContact O-N 3.36Å; D565-L567 VanDerWaalsContact C-N 3.28Å; D565-L567 PolarHBondContact O-N 2.97Å; D565-K568 CarbonylContact O-C 3.35Å; D565-K568 WeakPolarHBondContact O-CA 3.38Å; D565-K568 WeakPolarHBondContact O-CB 3.48Å; D565-K568 PolarHBondContact O-N 3.03Å; D565-R569 PolarHBondContact O-N 2.94Å; D565-R569 IonicContact OD2-CZ 3.89Å; D565-R569 VanDerWaalsContact OD2-CZ 3.22Å; D565-R569 IonicContact OD2-NE 2.84Å; D565-R569 PolarHBondContact OD2-NE 3Å; D565-R569 IonicContact OD2-NH2 2.75Å; D565-R569 PolarHBondContact OD2-NH2 3.47Å
566	V	76.6	Confident	74.4	Confident	19 Å²	19	87.1 Å²	87.1	12%	0.115	42%	0.417	C	S	.	.	H	α-helix	trans	-60.7	-42	175.9	-170.9	0	0	0	0	110.2	L524 Q562 A563 K568 R569 E570	L524-V566 HydrophobicContact CB-CG1 4.01Å; L524-V566 HydrophobicContact CD1-CG1 3.91Å; L524-V566 HydrophobicContact CD2-CG1 3.95Å; L524-V566 HydrophobicContact CG-CG1 4.19Å; Q562-V566 PolarHBondContact O-N 3.19Å; A563-V566 PolarHBondContact O-N 3.33Å; V566-K568 VanDerWaalsContact C-N 3.34Å; V566-K568 PolarHBondContact O-N 2.9Å; V566-R569 WeakPolarHBondContact O-CB 3.28Å; V566-R569 PolarHBondContact O-N 2.81Å; V566-R569 VanDerWaalsContact O-N 3.14Å; V566-E570 PolarHBondContact O-N 3.23Å
567	L	74.1	Confident	74.8	Confident	63 Å²	63	85.7 Å²	85.7	33%	0.33	41%	0.407	S	S	.	.	H	α-helix	trans	-63.6	-34	173.5	-70.3	170.5	0	0	0	112.9	I521 A563 D565 V571	I521-L567 HydrophobicContact CD1-CD1 3.9Å; I521-L567 HydrophobicContact CG1-CD1 4.19Å; I521-L567 HydrophobicContact CG1-CD2 4.28Å; I521-L567 HydrophobicContact CG1-CG 4.46Å; A563-L567 WeakPolarHBondContact O-CB 3.5Å; A563-L567 WeakPolarHBondContact O-CG 3.4Å; A563-L567 PolarHBondContact O-N 3.04Å; D565-L567 VanDerWaalsContact C-N 3.28Å; D565-L567 PolarHBondContact O-N 2.97Å; L567-V571 VanDerWaalsContact O-CB 3.28Å; L567-V571 WeakPolarHBondContact O-CB 3.49Å; L567-V571 WeakPolarHBondContact O-CG2 3.38Å; L567-V571 PolarHBondContact O-N 2.93Å
568	K	77.6	Confident	74.7	Confident	120 Å²	120	84.9 Å²	84.9	52%	0.522	39%	0.393	S	S	.	.	H	α-helix	trans	-70.2	-28.7	172.4	-77.3	165.6	-178.6	170.3	0	113.2	I564 D565 V566 R572	I564-K568 HydrophobicContact CG2-CD 4.15Å; I564-K568 WeakPolarHBondContact O-CB 3.4Å; I564-K568 WeakPolarHBondContact O-CD 3.41Å; I564-K568 WeakPolarHBondContact O-CG 3.37Å; I564-K568 PolarHBondContact O-N 3.41Å; D565-K568 CarbonylContact O-C 3.35Å; D565-K568 WeakPolarHBondContact O-CA 3.38Å; D565-K568 WeakPolarHBondContact O-CB 3.48Å; D565-K568 PolarHBondContact O-N 3.03Å; V566-K568 VanDerWaalsContact C-N 3.34Å; V566-K568 PolarHBondContact O-N 2.9Å; K568-R572 WeakPolarHBondContact O-CG 3.4Å; K568-R572 PolarHBondContact O-N 3.22Å; K568-R572 PolarHBondContact O-NE 3.06Å; K568-R572 VanDerWaalsContact O-NE 3.11Å
569	R	77	Confident	75.2	Confident	126 Å²	126	82.6 Å²	82.6	48%	0.475	39%	0.386	S	S	.	.	H	α-helix	trans	-72.5	-49	170.4	-81.1	179.1	-85.5	132.3	-8.5	110.6	D565 V566 V571 R572 R573	D565-R569 PolarHBondContact O-N 2.94Å; D565-R569 IonicContact OD2-CZ 3.89Å; D565-R569 VanDerWaalsContact OD2-CZ 3.22Å; D565-R569 IonicContact OD2-NE 2.84Å; D565-R569 PolarHBondContact OD2-NE 3Å; D565-R569 IonicContact OD2-NH2 2.75Å; D565-R569 PolarHBondContact OD2-NH2 3.47Å; V566-R569 WeakPolarHBondContact O-CB 3.28Å; V566-R569 PolarHBondContact O-N 2.81Å; V566-R569 VanDerWaalsContact O-N 3.14Å; R569-V571 PolarHBondContact O-N 3.38Å; R569-R572 WeakPolarHBondContact O-CB 3.3Å; R569-R572 PolarHBondContact O-N 2.8Å; R569-R573 PolarHBondContact O-N 3.28Å
570	E	70.8	Confident	76.1	Confident	22 Å²	22	85.1 Å²	85.1	10%	0.103	40%	0.399	C	S	.	.	H	α-helix	trans	-62.4	-39.9	179.1	-178.6	52.8	-154.8	0	0	112.6	P454 V566 R572 R573 Q574	P454-E570 WeakPolarHBondContact CG-OE1 3.5Å; V566-E570 PolarHBondContact O-N 3.23Å; E570-R572 VanDerWaalsContact C-N 3.26Å; E570-R572 PolarHBondContact O-N 3.02Å; E570-R573 PolarHBondContact O-N 3.45Å; E570-R573 IonicContact OE1-CZ 3.14Å; E570-R573 IonicContact OE1-NE 2.86Å; E570-R573 PolarHBondContact OE1-NE 2.96Å; E570-R573 IonicContact OE1-NH2 3.26Å; E570-R573 PolarHBondContact OE1-NH2 2.91Å; E570-R573 IonicContact OE2-CZ 2.7Å; E570-R573 IonicContact OE2-NE 2.75Å; E570-R573 PolarHBondContact OE2-NE 3.02Å; E570-R573 IonicContact OE2-NH2 3.18Å; E570-Q574 WeakPolarHBondContact O-CG 3.46Å; E570-Q574 PolarHBondContact O-N 2.93Å; E570-Q574 WeakPolarHBondContact OE1-CG 3.38Å; E570-Q574 PolarHBondContact OE1-NE2 3.42Å
571	V	76.1	Confident	76.3	Confident	74 Å²	74	86.3 Å²	86.3	45%	0.448	41%	0.406	S	S	.	.	H	α-helix	trans	-66.7	-23.7	174.5	167.4	0	0	0	0	112.9	L567 R569 R575	L567-V571 VanDerWaalsContact O-CB 3.28Å; L567-V571 WeakPolarHBondContact O-CB 3.49Å; L567-V571 WeakPolarHBondContact O-CG2 3.38Å; L567-V571 PolarHBondContact O-N 2.93Å; R569-V571 PolarHBondContact O-N 3.38Å; V571-R575 WeakPolarHBondContact O-CD 3.37Å; V571-R575 WeakPolarHBondContact O-CG 3.42Å; V571-R575 PolarHBondContact O-N 2.96Å
572	R	77.6	Confident	76.5	Confident	135 Å²	135	84.4 Å²	84.4	51%	0.509	39%	0.394	S	S	.	.	H	α-helix	trans	-76.6	-50.4	169.7	-79.2	-179.3	-76.8	167	-5	110.8	K568 R569 E570 Q574 R575 E576	K568-R572 WeakPolarHBondContact O-CG 3.4Å; K568-R572 PolarHBondContact O-N 3.22Å; K568-R572 PolarHBondContact O-NE 3.06Å; K568-R572 VanDerWaalsContact O-NE 3.11Å; R569-R572 WeakPolarHBondContact O-CB 3.3Å; R569-R572 PolarHBondContact O-N 2.8Å; E570-R572 VanDerWaalsContact C-N 3.26Å; E570-R572 PolarHBondContact O-N 3.02Å; R572-Q574 VanDerWaalsContact C-N 3.32Å; R572-Q574 PolarHBondContact O-N 3.3Å; R572-R575 WeakPolarHBondContact O-CA 3.22Å; R572-R575 WeakPolarHBondContact O-CB 3.18Å; R572-R575 PolarHBondContact O-N 3.38Å; R572-E576 PolarHBondContact O-N 3.19Å
573	R	79.5	Confident	76.9	Confident	81 Å²	81	82 Å²	82	31%	0.306	39%	0.391	S	S	.	.	H	α-helix	trans	-51.1	-47.6	176.3	-158.5	-166	68.5	62.9	26.1	112.2	P454 R569 E570 R575 E576 E577	P454-R573 VanDerWaalsContact CG-NH2 3.32Å; R569-R573 PolarHBondContact O-N 3.28Å; E570-R573 PolarHBondContact O-N 3.45Å; E570-R573 IonicContact OE1-CZ 3.14Å; E570-R573 IonicContact OE1-NE 2.86Å; E570-R573 PolarHBondContact OE1-NE 2.96Å; E570-R573 IonicContact OE1-NH2 3.26Å; E570-R573 PolarHBondContact OE1-NH2 2.91Å; E570-R573 IonicContact OE2-CZ 2.7Å; E570-R573 IonicContact OE2-NE 2.75Å; E570-R573 PolarHBondContact OE2-NE 3.02Å; E570-R573 IonicContact OE2-NH2 3.18Å; R573-R575 VanDerWaalsContact C-N 3.35Å; R573-R575 PolarHBondContact O-N 3.25Å; R573-E576 PolarHBondContact O-N 3.43Å; R573-E577 IonicContact CZ-OE1 2.66Å; R573-E577 IonicContact CZ-OE2 2.73Å; R573-E577 VanDerWaalsContact CZ-OE2 3.23Å; R573-E577 IonicContact NH1-OE1 4Å; R573-E577 PolarHBondContact NH1-OE1 3.4Å; R573-E577 IonicContact NH1-OE2 2.69Å; R573-E577 PolarHBondContact NH1-OE2 3.11Å; R573-E577 IonicContact NH2-OE1 2.72Å; R573-E577 IonicContact NH2-OE2 3.86Å; R573-E577 PolarHBondContact NH2-OE2 3.44Å; R573-E577 WeakPolarHBondContact O-CG 3.42Å; R573-E577 PolarHBondContact O-N 2.98Å
574	Q	69.4	Low	77.6	Confident	74 Å²	74	85.5 Å²	85.5	35%	0.346	41%	0.409	S	S	.	.	H	α-helix	trans	-68.1	-27.7	176.7	-69.8	-174.3	14.1	0	0	114.1	E570 R572 K578	E570-Q574 WeakPolarHBondContact O-CG 3.46Å; E570-Q574 PolarHBondContact O-N 2.93Å; E570-Q574 WeakPolarHBondContact OE1-CG 3.38Å; E570-Q574 PolarHBondContact OE1-NE2 3.42Å; R572-Q574 VanDerWaalsContact C-N 3.32Å; R572-Q574 PolarHBondContact O-N 3.3Å; Q574-K578 WeakPolarHBondContact O-CB 3.3Å; Q574-K578 PolarHBondContact O-N 3.49Å
575	R	74.4	Confident	77.8	Confident	164 Å²	164	85.5 Å²	85.5	62%	0.619	41%	0.412	S	S	*	.	H	α-helix	trans	-71.9	-45.4	173.9	-76.3	166.7	-179.6	-84.1	-1.7	110.7	V571 R572 R573 K578 D579	V571-R575 WeakPolarHBondContact O-CD 3.37Å; V571-R575 WeakPolarHBondContact O-CG 3.42Å; V571-R575 PolarHBondContact O-N 2.96Å; R572-R575 WeakPolarHBondContact O-CA 3.22Å; R572-R575 WeakPolarHBondContact O-CB 3.18Å; R572-R575 PolarHBondContact O-N 3.38Å; R573-R575 VanDerWaalsContact C-N 3.35Å; R573-R575 PolarHBondContact O-N 3.25Å; R575-K578 PolarHBondContact O-N 2.97Å; R575-D579 WeakPolarHBondContact O-CB 3.49Å; R575-D579 PolarHBondContact O-N 2.81Å
576	E	83.9	Confident	78.1	Confident	118 Å²	118	89.7 Å²	89.7	55%	0.551	42%	0.423	S	S	*	.	H	α-helix	trans	-60.1	-47.8	176.2	-69.4	152.3	-154.3	0	0	110.8	R572 R573 K578 D579 V580	R572-E576 PolarHBondContact O-N 3.19Å; R573-E576 PolarHBondContact O-N 3.43Å; E576-K578 PolarHBondContact O-N 2.91Å; E576-D579 PolarHBondContact O-N 3.47Å; E576-V580 WeakPolarHBondContact O-CG2 3.45Å; E576-V580 PolarHBondContact O-N 3.49Å
577	E	74.8	Confident	78.7	Confident	76 Å²	76	95.6 Å²	95.6	36%	0.355	45%	0.449	S	S	.	.	H	α-helix	trans	-57.7	-44.3	171.7	-76.6	-175.9	137.4	0	0	112.9	R453 R573 L581	R453-E577 IonicContact NH1-OE1 2.58Å; R573-E577 IonicContact CZ-OE1 2.66Å; R573-E577 IonicContact CZ-OE2 2.73Å; R573-E577 VanDerWaalsContact CZ-OE2 3.23Å; R573-E577 IonicContact NH1-OE1 4Å; R573-E577 PolarHBondContact NH1-OE1 3.4Å; R573-E577 IonicContact NH1-OE2 2.69Å; R573-E577 PolarHBondContact NH1-OE2 3.11Å; R573-E577 IonicContact NH2-OE1 2.72Å; R573-E577 IonicContact NH2-OE2 3.86Å; R573-E577 PolarHBondContact NH2-OE2 3.44Å; R573-E577 WeakPolarHBondContact O-CG 3.42Å; R573-E577 PolarHBondContact O-N 2.98Å; E577-L581 WeakPolarHBondContact O-CB 3.29Å; E577-L581 PolarHBondContact O-N 3.34Å
578	K	69.8	Low	79	Confident	97 Å²	97	99 Å²	99	42%	0.422	46%	0.463	S	S	.	.	H	α-helix	trans	-67	-38.8	-179.9	-170.1	-108.9	58.6	174	0	111.2	Q574 R575 E576 L581 E582	Q574-K578 WeakPolarHBondContact O-CB 3.3Å; Q574-K578 PolarHBondContact O-N 3.49Å; R575-K578 PolarHBondContact O-N 2.97Å; E576-K578 PolarHBondContact O-N 2.91Å; K578-L581 PolarHBondContact O-N 3.46Å; K578-E582 WeakPolarHBondContact CE-OE2 3.18Å; K578-E582 IonicContact NZ-OE2 2.74Å; K578-E582 PolarHBondContact NZ-OE2 2.86Å; K578-E582 VanDerWaalsContact O-CB 3.3Å; K578-E582 WeakPolarHBondContact O-CB 3.42Å; K578-E582 PolarHBondContact O-N 3.02Å
579	D	81.2	Confident	79.4	Confident	91 Å²	91	97.4 Å²	97.4	49%	0.487	46%	0.464	S	S	.	.	H	α-helix	trans	-71.9	-36.3	180	-73.3	-27	0	0	0	111.4	R575 E576 E582 A583	R575-D579 WeakPolarHBondContact O-CB 3.49Å; R575-D579 PolarHBondContact O-N 2.81Å; E576-D579 PolarHBondContact O-N 3.47Å; D579-E582 PolarHBondContact O-N 2.99Å; D579-A583 PolarHBondContact O-N 3Å
580	V	87	Confident	79.8	Confident	89 Å²	89	96 Å²	96	54%	0.539	47%	0.469	S	S	.	.	H	α-helix	trans	-64	-46.5	168.9	171.1	0	0	0	0	111.1	E576 E582 A583 N584	E576-V580 WeakPolarHBondContact O-CG2 3.45Å; E576-V580 PolarHBondContact O-N 3.49Å; V580-E582 VanDerWaalsContact C-N 3.31Å; V580-E582 PolarHBondContact O-N 3.22Å; V580-A583 WeakPolarHBondContact O-CB 3.42Å; V580-A583 PolarHBondContact O-N 3.2Å; V580-A583 VanDerWaalsContact O-N 3.13Å; V580-N584 PolarHBondContact O-N 2.93Å; V580-N584 PolarHBondContact O-OD1 3.34Å; V580-N584 VanDerWaalsContact O-OD1 3.11Å
581	L	75.4	Confident	80.6	Confident	109 Å²	109	97.9 Å²	97.9	57%	0.571	48%	0.484	S	S	*	.	H	α-helix	trans	-63.6	-37.2	177.3	-177.4	67.8	0	0	0	112	E577 K578 A583 N584 V585	E577-L581 WeakPolarHBondContact O-CB 3.29Å; E577-L581 PolarHBondContact O-N 3.34Å; K578-L581 PolarHBondContact O-N 3.46Å; L581-A583 VanDerWaalsContact C-N 3.31Å; L581-A583 PolarHBondContact O-N 3.4Å; L581-N584 PolarHBondContact O-N 3.46Å; L581-V585 HydrophobicContact CD1-CG2 4.32Å; L581-V585 HydrophobicContact CG-CG2 4.47Å; L581-V585 WeakPolarHBondContact O-CB 3.28Å; L581-V585 VanDerWaalsContact O-CG2 3.29Å; L581-V585 WeakPolarHBondContact O-CG2 3.26Å; L581-V585 PolarHBondContact O-N 2.94Å
582	E	81.3	Confident	80.9	Confident	73 Å²	73	100.5 Å²	100.5	34%	0.341	49%	0.492	S	S	.	.	H	α-helix	trans	-65.9	-32.3	174.2	-172	177.7	130.5	0	0	112.2	K578 D579 V580 R586	K578-E582 WeakPolarHBondContact CE-OE2 3.18Å; K578-E582 IonicContact NZ-OE2 2.74Å; K578-E582 PolarHBondContact NZ-OE2 2.86Å; K578-E582 VanDerWaalsContact O-CB 3.3Å; K578-E582 WeakPolarHBondContact O-CB 3.42Å; K578-E582 PolarHBondContact O-N 3.02Å; D579-E582 PolarHBondContact O-N 2.99Å; V580-E582 VanDerWaalsContact C-N 3.31Å; V580-E582 PolarHBondContact O-N 3.22Å; E582-R586 WeakPolarHBondContact O-CB 3.28Å; E582-R586 WeakPolarHBondContact O-CD 3.4Å; E582-R586 VanDerWaalsContact O-CG 3.24Å; E582-R586 WeakPolarHBondContact O-CG 3.5Å; E582-R586 PolarHBondContact O-N 3.32Å; E582-R586 IonicContact OE1-CZ 2.81Å; E582-R586 IonicContact OE1-NH1 2.69Å; E582-R586 PolarHBondContact OE1-NH1 3.11Å; E582-R586 VanDerWaalsContact OE1-NH1 3.15Å; E582-R586 IonicContact OE1-NH2 2.84Å; E582-R586 PolarHBondContact OE1-NH2 3.13Å
583	A	84.3	Confident	81.1	Confident	50 Å²	50	99.3 Å²	99.3	41%	0.413	49%	0.493	S	S	.	.	H	α-helix	trans	-68.2	-52	171.6	0	0	0	0	0	111.5	D579 V580 L581 V585 R586 E587	D579-A583 PolarHBondContact O-N 3Å; V580-A583 WeakPolarHBondContact O-CB 3.42Å; V580-A583 PolarHBondContact O-N 3.2Å; V580-A583 VanDerWaalsContact O-N 3.13Å; L581-A583 VanDerWaalsContact C-N 3.31Å; L581-A583 PolarHBondContact O-N 3.4Å; A583-V585 VanDerWaalsContact C-N 3.32Å; A583-V585 PolarHBondContact O-N 2.97Å; A583-R586 WeakPolarHBondContact O-CB 3.49Å; A583-R586 PolarHBondContact O-N 3.48Å; A583-E587 PolarHBondContact O-N 3.07Å
584	N	83.7	Confident	81.5	Confident	80 Å²	80	101.6 Å²	101.6	43%	0.428	51%	0.509	S	S	.	.	H	α-helix	trans	-59.9	-40.8	-179.2	-63.7	11	0	0	0	112.1	V580 L581 E587 Q588	V580-N584 PolarHBondContact O-N 2.93Å; V580-N584 PolarHBondContact O-OD1 3.34Å; V580-N584 VanDerWaalsContact O-OD1 3.11Å; L581-N584 PolarHBondContact O-N 3.46Å; N584-E587 PolarHBondContact O-N 3.13Å; N584-Q588 WeakPolarHBondContact O-CG 3.45Å; N584-Q588 PolarHBondContact O-N 2.98Å
585	V	81.4	Confident	82.3	Confident	70 Å²	70	103.9 Å²	103.9	42%	0.424	52%	0.519	S	S	.	.	H	α-helix	trans	-67.5	-35.2	176.6	169.9	0	0	0	0	111.7	L581 A583 V589	L581-V585 HydrophobicContact CD1-CG2 4.32Å; L581-V585 HydrophobicContact CG-CG2 4.47Å; L581-V585 WeakPolarHBondContact O-CB 3.28Å; L581-V585 VanDerWaalsContact O-CG2 3.29Å; L581-V585 WeakPolarHBondContact O-CG2 3.26Å; L581-V585 PolarHBondContact O-N 2.94Å; A583-V585 VanDerWaalsContact C-N 3.32Å; A583-V585 PolarHBondContact O-N 2.97Å; V585-V589 HydrophobicContact CG1-CG2 4.49Å; V585-V589 WeakPolarHBondContact O-CB 3.48Å; V585-V589 VanDerWaalsContact O-CG2 3.25Å; V585-V589 WeakPolarHBondContact O-CG2 3.16Å; V585-V589 PolarHBondContact O-N 3.32Å
586	R	84.7	Confident	82.8	Confident	152 Å²	152	100.7 Å²	100.7	57%	0.574	52%	0.518	S	S	*	.	H	α-helix	trans	-66	-42.3	172.8	-79.5	172.1	173.3	145.9	9.1	111.9	E582 A583 V589 V590	E582-R586 WeakPolarHBondContact O-CB 3.28Å; E582-R586 WeakPolarHBondContact O-CD 3.4Å; E582-R586 VanDerWaalsContact O-CG 3.24Å; E582-R586 WeakPolarHBondContact O-CG 3.5Å; E582-R586 PolarHBondContact O-N 3.32Å; E582-R586 IonicContact OE1-CZ 2.81Å; E582-R586 IonicContact OE1-NH1 2.69Å; E582-R586 PolarHBondContact OE1-NH1 3.11Å; E582-R586 VanDerWaalsContact OE1-NH1 3.15Å; E582-R586 IonicContact OE1-NH2 2.84Å; E582-R586 PolarHBondContact OE1-NH2 3.13Å; A583-R586 WeakPolarHBondContact O-CB 3.49Å; A583-R586 PolarHBondContact O-N 3.48Å; R586-V589 PolarHBondContact O-N 2.87Å; R586-V590 WeakPolarHBondContact O-CB 3.24Å; R586-V590 VanDerWaalsContact O-CG2 3.28Å; R586-V590 WeakPolarHBondContact O-CG2 3.48Å; R586-V590 PolarHBondContact O-N 3.32Å
587	E	87.8	Confident	82.8	Confident	144 Å²	144	98.9 Å²	98.9	67%	0.673	51%	0.511	S	S	*	.	H	α-helix	trans	-61.5	-47.9	177.9	-174.2	169.6	-148.1	0	0	111.2	A583 N584 V589 V590 S591	A583-E587 PolarHBondContact O-N 3.07Å; N584-E587 PolarHBondContact O-N 3.13Å; E587-V589 PolarHBondContact O-N 3.01Å; E587-V590 PolarHBondContact O-N 3.22Å; E587-S591 PolarHBondContact O-N 2.67Å
588	Q	81.6	Confident	83.4	Confident	133 Å²	133	97.7 Å²	97.7	62%	0.621	51%	0.509	S	S	*	.	H	α-helix	trans	-57.6	-49	173.6	-73.5	-178.1	-32.7	0	0	112.5	N584 V590 S591 E592	N584-Q588 WeakPolarHBondContact O-CG 3.45Å; N584-Q588 PolarHBondContact O-N 2.98Å; Q588-V590 VanDerWaalsContact C-N 3.26Å; Q588-V590 PolarHBondContact O-N 3Å; Q588-S591 PolarHBondContact O-N 2.92Å; Q588-E592 VanDerWaalsContact O-CG 3.28Å; Q588-E592 WeakPolarHBondContact O-CG 3.44Å; Q588-E592 PolarHBondContact O-N 3.15Å
589	V	84.8	Confident	84.2	Confident	88 Å²	88	94.9 Å²	94.9	53%	0.533	51%	0.508	S	S	.	.	H	α-helix	trans	-63.6	-31.2	179	169	0	0	0	0	112.2	V585 R586 E587 M593	V585-V589 HydrophobicContact CG1-CG2 4.49Å; V585-V589 WeakPolarHBondContact O-CB 3.48Å; V585-V589 VanDerWaalsContact O-CG2 3.25Å; V585-V589 WeakPolarHBondContact O-CG2 3.16Å; V585-V589 PolarHBondContact O-N 3.32Å; R586-V589 PolarHBondContact O-N 2.87Å; E587-V589 PolarHBondContact O-N 3.01Å; V589-M593 WeakPolarHBondContact O-CB 3.25Å; V589-M593 PolarHBondContact O-N 3.19Å; V589-M593 VanDerWaalsContact O-N 3.14Å
590	V	85.4	Confident	84.2	Confident	97 Å²	97	96.1 Å²	96.1	59%	0.588	51%	0.512	S	S	*	.	H	α-helix	trans	-73.4	-40.1	174.3	168.3	0	0	0	0	111.5	R586 E587 Q588 M594	R586-V590 WeakPolarHBondContact O-CB 3.24Å; R586-V590 VanDerWaalsContact O-CG2 3.28Å; R586-V590 WeakPolarHBondContact O-CG2 3.48Å; R586-V590 PolarHBondContact O-N 3.32Å; E587-V590 PolarHBondContact O-N 3.22Å; Q588-V590 VanDerWaalsContact C-N 3.26Å; Q588-V590 PolarHBondContact O-N 3Å; V590-M594 VanDerWaalsContact O-CB 3.27Å; V590-M594 WeakPolarHBondContact O-CB 3.32Å; V590-M594 PolarHBondContact O-N 3.48Å
591	S	87.8	Confident	83.9	Confident	60 Å²	60	97.5 Å²	97.5	42%	0.42	51%	0.513	S	S	.	.	H	α-helix	trans	-62	-53.7	175.6	-160.7	0	0	0	0	111.4	E587 Q588 M593 M594 E595	E587-S591 PolarHBondContact O-N 2.67Å; Q588-S591 PolarHBondContact O-N 2.92Å; S591-M593 VanDerWaalsContact C-N 3.31Å; S591-M593 PolarHBondContact O-N 3.14Å; S591-M594 WeakPolarHBondContact O-CA 3.42Å; S591-M594 WeakPolarHBondContact O-CB 3.28Å; S591-M594 PolarHBondContact O-N 3.39Å; S591-E595 PolarHBondContact O-N 3.04Å; S591-E595 PolarHBondContact OG-OE1 2.65Å; S591-E595 VanDerWaalsContact OG-OE1 3.13Å
592	E	82.8	Confident	84.5	Confident	130 Å²	130	98.3 Å²	98.3	61%	0.607	51%	0.514	S	S	*	.	H	α-helix	trans	-57.3	-42.9	178.6	-66.6	-94.4	168.3	0	0	111.7	Q588 M594 V596	Q588-E592 VanDerWaalsContact O-CG 3.28Å; Q588-E592 WeakPolarHBondContact O-CG 3.44Å; Q588-E592 PolarHBondContact O-N 3.15Å; E592-M594 VanDerWaalsContact C-N 3.34Å; E592-V596 WeakPolarHBondContact O-CG2 3.27Å; E592-V596 PolarHBondContact O-N 3.06Å
593	M	83.1	Confident	84.8	Confident	110 Å²	110	96.1 Å²	96.1	54%	0.542	51%	0.511	S	S	.	.	H	α-helix	trans	-65.8	-37	175.8	-174.6	66	62	0	0	112.1	V589 S591 I597	V589-M593 WeakPolarHBondContact O-CB 3.25Å; V589-M593 PolarHBondContact O-N 3.19Å; V589-M593 VanDerWaalsContact O-N 3.14Å; S591-M593 VanDerWaalsContact C-N 3.31Å; S591-M593 PolarHBondContact O-N 3.14Å; M593-I597 HydrophobicContact CG-CD1 3.96Å; M593-I597 WeakPolarHBondContact O-CB 3.42Å; M593-I597 WeakPolarHBondContact O-CD1 3.21Å; M593-I597 WeakPolarHBondContact O-CG1 3.48Å; M593-I597 PolarHBondContact O-N 2.92Å; M593-I597 HydrophobicContact SD-CD1 4.37Å
594	M	86.8	Confident	84.8	Confident	128 Å²	128	99.8 Å²	99.8	63%	0.631	52%	0.518	S	S	*	.	H	α-helix	trans	-69.4	-43.6	178.1	-173.4	162.8	176.8	0	0	111.3	V590 S591 E592 V596 I597 T598	V590-M594 VanDerWaalsContact O-CB 3.27Å; V590-M594 WeakPolarHBondContact O-CB 3.32Å; V590-M594 PolarHBondContact O-N 3.48Å; S591-M594 WeakPolarHBondContact O-CA 3.42Å; S591-M594 WeakPolarHBondContact O-CB 3.28Å; S591-M594 PolarHBondContact O-N 3.39Å; E592-M594 VanDerWaalsContact C-N 3.34Å; M594-V596 PolarHBondContact O-N 3.16Å; M594-I597 PolarHBondContact O-N 3.25Å; M594-T598 WeakPolarHBondContact O-CB 3.35Å; M594-T598 PolarHBondContact O-N 3.04Å; M594-T598 PolarHBondContact O-OG1 3.31Å
595	E	86.4	Confident	85	Confident	122 Å²	122	99.4 Å²	99.4	57%	0.57	52%	0.518	S	S	*	.	H	α-helix	trans	-59.7	-44.7	174.6	-71.9	169.7	-133.8	0	0	111.8	S591 I597 T598 G599	S591-E595 PolarHBondContact O-N 3.04Å; S591-E595 PolarHBondContact OG-OE1 2.65Å; S591-E595 VanDerWaalsContact OG-OE1 3.13Å; E595-I597 VanDerWaalsContact C-N 3.35Å; E595-I597 PolarHBondContact O-N 3.41Å; E595-T598 PolarHBondContact O-N 2.92Å; E595-G599 PolarHBondContact O-N 2.83Å
596	V	85.6	Confident	85.4	Confident	97 Å²	97	102.7 Å²	102.7	59%	0.588	53%	0.529	S	S	*	.	H	α-helix	trans	-62.8	-39	175	170.1	0	0	0	0	112.1	E592 M594 M600	E592-V596 WeakPolarHBondContact O-CG2 3.27Å; E592-V596 PolarHBondContact O-N 3.06Å; M594-V596 PolarHBondContact O-N 3.16Å; V596-M600 VanDerWaalsContact O-CB 3.24Å; V596-M600 WeakPolarHBondContact O-CB 3.48Å; V596-M600 PolarHBondContact O-N 3.45Å; V596-M600 VanDerWaalsContact O-N 3.13Å
597	I	83.1	Confident	85.6	Confident	80 Å²	80	99.4 Å²	99.4	41%	0.41	53%	0.526	S	S	.	.	H	α-helix	trans	-68.6	-41.7	176.2	-72.2	166.7	0	0	0	111	M593 M594 E595 M600 Q601	M593-I597 HydrophobicContact CG-CD1 3.96Å; M593-I597 WeakPolarHBondContact O-CB 3.42Å; M593-I597 WeakPolarHBondContact O-CD1 3.21Å; M593-I597 WeakPolarHBondContact O-CG1 3.48Å; M593-I597 PolarHBondContact O-N 2.92Å; M593-I597 HydrophobicContact SD-CD1 4.37Å; M594-I597 PolarHBondContact O-N 3.25Å; E595-I597 VanDerWaalsContact C-N 3.35Å; E595-I597 PolarHBondContact O-N 3.41Å; I597-M600 PolarHBondContact O-N 3.2Å; I597-Q601 WeakPolarHBondContact O-CG 3.44Å; I597-Q601 PolarHBondContact O-N 3.13Å
598	T	87.3	Confident	85.6	Confident	51 Å²	51	97.9 Å²	97.9	31%	0.313	52%	0.522	S	S	.	.	H	α-helix	trans	-64.8	-51	178.5	-66.5	0	0	0	0	111.3	M594 E595 M600 Q601 E602	M594-T598 WeakPolarHBondContact O-CB 3.35Å; M594-T598 PolarHBondContact O-N 3.04Å; M594-T598 PolarHBondContact O-OG1 3.31Å; E595-T598 PolarHBondContact O-N 2.92Å; T598-M600 PolarHBondContact O-N 3.03Å; T598-Q601 WeakPolarHBondContact O-CA 3.45Å; T598-Q601 WeakPolarHBondContact O-CB 3.24Å; T598-Q601 PolarHBondContact O-N 2.87Å; T598-E602 HydrophobicContact CG2-CG 4.41Å; T598-E602 WeakPolarHBondContact O-CG 3.41Å; T598-E602 PolarHBondContact O-N 2.99Å
599	G	86.8	Confident	86	Confident	38 Å²	38	97.6 Å²	97.6	39%	0.392	52%	0.521	S	S	.	.	H	α-helix	trans	-61.9	-31	177	0	0	0	0	0	113.3	E595 G603	E595-G599 PolarHBondContact O-N 2.83Å; G599-G603 PolarHBondContact O-N 2.95Å
600	M	81.7	Confident	86.3	Confident	118 Å²	118	95.9 Å²	95.9	58%	0.581	52%	0.516	S	S	*	.	H	α-helix	trans	-68.3	-39.9	171.2	179.5	175.9	165.8	0	0	112.2	V596 I597 T598 F604	V596-M600 VanDerWaalsContact O-CB 3.24Å; V596-M600 WeakPolarHBondContact O-CB 3.48Å; V596-M600 PolarHBondContact O-N 3.45Å; V596-M600 VanDerWaalsContact O-N 3.13Å; I597-M600 PolarHBondContact O-N 3.2Å; T598-M600 PolarHBondContact O-N 3.03Å; M600-F604 HydrophobicContact CE-CE2 3.75Å; M600-F604 HydrophobicContact CG-CD2 4.07Å; M600-F604 HydrophobicContact CG-CE2 3.93Å; M600-F604 WeakPolarHBondContact O-CD2 3.43Å; M600-F604 PolarHBondContact O-N 2.73Å; M600-F604 VanDerWaalsContact O-N 3.15Å
601	Q	80.6	Confident	86.3	Confident	118 Å²	118	96.8 Å²	96.8	55%	0.551	51%	0.513	S	S	*	.	H	α-helix	trans	-67.5	-40.5	175	-74.8	175.7	-19.7	0	0	112.3	I597 T598 F604 T605	I597-Q601 WeakPolarHBondContact O-CG 3.44Å; I597-Q601 PolarHBondContact O-N 3.13Å; T598-Q601 WeakPolarHBondContact O-CA 3.45Å; T598-Q601 WeakPolarHBondContact O-CB 3.24Å; T598-Q601 PolarHBondContact O-N 2.87Å; Q601-F604 PolarHBondContact O-N 3.43Å; Q601-T605 PolarHBondContact O-N 3.45Å; Q601-T605 PolarHBondContact O-OG1 3.31Å
602	E	88.3	Confident	86.3	Confident	125 Å²	125	100.6 Å²	100.6	58%	0.584	52%	0.519	S	S	*	.	H	α-helix	trans	-62.1	-50.7	176.3	-71.6	170.9	168.7	0	0	110.8	T598 F604 T605 E606	T598-E602 HydrophobicContact CG2-CG 4.41Å; T598-E602 WeakPolarHBondContact O-CG 3.41Å; T598-E602 PolarHBondContact O-N 2.99Å; E602-F604 VanDerWaalsContact C-N 3.32Å; E602-F604 PolarHBondContact O-N 3.03Å; E602-T605 WeakPolarHBondContact O-CA 3.48Å; E602-T605 WeakPolarHBondContact O-CB 3.47Å; E602-T605 PolarHBondContact O-N 3.17Å; E602-E606 PolarHBondContact O-N 2.79Å
603	G	87	Confident	86.7	Confident	28 Å²	28	96.8 Å²	96.8	29%	0.289	51%	0.509	S	S	.	.	H	α-helix	trans	-62.2	-33.1	177.2	0	0	0	0	0	114.3	G599 T607	G599-G603 PolarHBondContact O-N 2.95Å; G603-T607 WeakPolarHBondContact O-CB 3.17Å; G603-T607 PolarHBondContact O-N 3.1Å; G603-T607 VanDerWaalsContact O-N 3.1Å; G603-T607 PolarHBondContact O-OG1 3.15Å
604	F	84.6	Confident	87.1	Confident	126 Å²	126	96 Å²	96	55%	0.553	51%	0.507	S	S	*	.	H	α-helix	trans	-68.6	-35.7	171	-87.7	-61.4	0	0	0	112.4	M600 Q601 E602 L608	M600-F604 HydrophobicContact CE-CE2 3.75Å; M600-F604 HydrophobicContact CG-CD2 4.07Å; M600-F604 HydrophobicContact CG-CE2 3.93Å; M600-F604 WeakPolarHBondContact O-CD2 3.43Å; M600-F604 PolarHBondContact O-N 2.73Å; M600-F604 VanDerWaalsContact O-N 3.15Å; Q601-F604 PolarHBondContact O-N 3.43Å; E602-F604 VanDerWaalsContact C-N 3.32Å; E602-F604 PolarHBondContact O-N 3.03Å; F604-L608 VanDerWaalsContact O-CG 3.29Å; F604-L608 WeakPolarHBondContact O-CG 3.41Å; F604-L608 PolarHBondContact O-N 3.39Å; F604-L608 VanDerWaalsContact O-N 3.12Å
605	T	87.9	Confident	87.3	Confident	72 Å²	72	93.8 Å²	93.8	44%	0.442	50%	0.497	S	S	.	.	H	α-helix	trans	-69.3	-48.6	178.5	-54.8	0	0	0	0	110.5	Q601 E602 T607 L608 E609	Q601-T605 PolarHBondContact O-N 3.45Å; Q601-T605 PolarHBondContact O-OG1 3.31Å; E602-T605 WeakPolarHBondContact O-CA 3.48Å; E602-T605 WeakPolarHBondContact O-CB 3.47Å; E602-T605 PolarHBondContact O-N 3.17Å; T605-T607 VanDerWaalsContact C-N 3.32Å; T605-T607 PolarHBondContact O-N 3.05Å; T605-L608 PolarHBondContact O-N 3.39Å; T605-L608 VanDerWaalsContact O-N 3.11Å; T605-E609 WeakPolarHBondContact O-CG 3.4Å; T605-E609 PolarHBondContact O-N 3.45Å
606	E	90.3	Very high	87.5	Confident	140 Å²	140	92 Å²	92	65%	0.654	49%	0.489	S	S	*	.	H	α-helix	trans	-57.2	-42.8	175.3	-175.3	178.4	-148.1	0	0	111.9	E602 L608 E609 A610	E602-E606 PolarHBondContact O-N 2.79Å; E606-L608 PolarHBondContact O-N 2.69Å; E606-E609 PolarHBondContact O-N 2.91Å; E606-A610 WeakPolarHBondContact O-CB 3.46Å; E606-A610 PolarHBondContact O-N 3.33Å
607	T	87.6	Confident	87.9	Confident	83 Å²	83	93 Å²	93	51%	0.509	49%	0.487	S	S	.	.	H	α-helix	trans	-60.9	-43.9	175.3	-56.8	0	0	0	0	112.1	G603 T605 A610 E611	G603-T607 WeakPolarHBondContact O-CB 3.17Å; G603-T607 PolarHBondContact O-N 3.1Å; G603-T607 VanDerWaalsContact O-N 3.1Å; G603-T607 PolarHBondContact O-OG1 3.15Å; T605-T607 VanDerWaalsContact C-N 3.32Å; T605-T607 PolarHBondContact O-N 3.05Å; T607-A610 PolarHBondContact O-N 2.88Å; T607-E611 PolarHBondContact O-N 2.88Å
608	L	88.3	Confident	88.3	Confident	111 Å²	111	97 Å²	97	58%	0.581	50%	0.497	S	S	*	.	H	α-helix	trans	-69.5	-34.3	178.8	-73.2	168	0	0	0	112.5	F604 T605 E606 R612	F604-L608 VanDerWaalsContact O-CG 3.29Å; F604-L608 WeakPolarHBondContact O-CG 3.41Å; F604-L608 PolarHBondContact O-N 3.39Å; F604-L608 VanDerWaalsContact O-N 3.12Å; T605-L608 PolarHBondContact O-N 3.39Å; T605-L608 VanDerWaalsContact O-N 3.11Å; E606-L608 PolarHBondContact O-N 2.69Å; L608-R612 VanDerWaalsContact O-CB 3.28Å; L608-R612 WeakPolarHBondContact O-CB 3.31Å; L608-R612 PolarHBondContact O-N 3.11Å
609	E	90.3	Very high	88.4	Confident	127 Å²	127	101.8 Å²	101.8	59%	0.593	51%	0.51	S	S	*	.	H	α-helix	trans	-70.4	-37.9	175	-72.3	-175.9	175.1	0	0	111.7	T605 E606 R612 A613	T605-E609 WeakPolarHBondContact O-CG 3.4Å; T605-E609 PolarHBondContact O-N 3.45Å; E606-E609 PolarHBondContact O-N 2.91Å; E609-R612 WeakPolarHBondContact O-CB 3.47Å; E609-R612 PolarHBondContact O-N 2.9Å; E609-A613 WeakPolarHBondContact O-CB 3.44Å; E609-A613 PolarHBondContact O-N 3.34Å
610	A	90.3	Very high	88.7	Confident	52 Å²	52	106 Å²	106	43%	0.43	52%	0.519	S	S	.	.	H	α-helix	trans	-64.8	-45	172.2	0	0	0	0	0	112.4	E606 T607 R612 A613 L614	E606-A610 WeakPolarHBondContact O-CB 3.46Å; E606-A610 PolarHBondContact O-N 3.33Å; T607-A610 PolarHBondContact O-N 2.88Å; A610-R612 VanDerWaalsContact C-N 3.32Å; A610-R612 PolarHBondContact O-N 3.36Å; A610-A613 PolarHBondContact O-N 3.46Å; A610-L614 WeakPolarHBondContact O-CG 3.42Å; A610-L614 PolarHBondContact O-N 3Å
611	E	85.5	Confident	89.2	Confident	116 Å²	116	104.7 Å²	104.7	54%	0.542	52%	0.515	S	S	.	.	H	α-helix	trans	-61.2	-41.1	172.6	-76.6	-162	153.1	0	0	111.8	T607 L614 I615	T607-E611 PolarHBondContact O-N 2.88Å; E611-L614 PolarHBondContact O-N 3.12Å; E611-I615 WeakPolarHBondContact O-CB 3.48Å; E611-I615 WeakPolarHBondContact O-CD1 3.39Å; E611-I615 VanDerWaalsContact O-CG1 3.24Å; E611-I615 WeakPolarHBondContact O-CG1 3.29Å; E611-I615 PolarHBondContact O-N 3.42Å
612	R	89.2	Confident	89.8	Confident	140 Å²	140	105.5 Å²	105.5	53%	0.528	52%	0.517	S	S	.	.	H	α-helix	trans	-59.7	-46.7	175.6	-175.6	-168.9	167.2	-67.5	-19	111.2	L608 E609 A610 I615 E616	L608-R612 VanDerWaalsContact O-CB 3.28Å; L608-R612 WeakPolarHBondContact O-CB 3.31Å; L608-R612 PolarHBondContact O-N 3.11Å; E609-R612 WeakPolarHBondContact O-CB 3.47Å; E609-R612 PolarHBondContact O-N 2.9Å; A610-R612 VanDerWaalsContact C-N 3.32Å; A610-R612 PolarHBondContact O-N 3.36Å; R612-I615 PolarHBondContact O-N 3Å; R612-E616 IonicContact CZ-OE1 3.16Å; R612-E616 IonicContact CZ-OE2 3.24Å; R612-E616 VanDerWaalsContact CZ-OE2 3.28Å; R612-E616 IonicContact NH1-OE1 2.68Å; R612-E616 IonicContact NH1-OE2 2.73Å; R612-E616 PolarHBondContact NH1-OE2 2.96Å; R612-E616 VanDerWaalsContact NH2-CD 3.27Å; R612-E616 IonicContact NH2-OE1 2.68Å; R612-E616 PolarHBondContact NH2-OE1 3.34Å; R612-E616 IonicContact NH2-OE2 3.41Å; R612-E616 PolarHBondContact NH2-OE2 3.31Å; R612-E616 VanDerWaalsContact NH2-OE2 3.11Å; R612-E616 WeakPolarHBondContact O-CB 3.28Å; R612-E616 PolarHBondContact O-N 3.32Å
613	A	91.1	Very high	90	Very high	50 Å²	50	103.9 Å²	103.9	41%	0.413	51%	0.511	S	S	.	.	H	α-helix	trans	-62.2	-46.3	178.3	0	0	0	0	0	112.1	E609 A610 I615 E616 E617	E609-A613 WeakPolarHBondContact O-CB 3.44Å; E609-A613 PolarHBondContact O-N 3.34Å; A610-A613 PolarHBondContact O-N 3.46Å; A613-I615 PolarHBondContact O-N 2.98Å; A613-E616 PolarHBondContact O-N 3.46Å; A613-E616 VanDerWaalsContact O-N 3.13Å; A613-E617 WeakPolarHBondContact O-CB 3.35Å; A613-E617 PolarHBondContact O-N 2.98Å
614	L	91.4	Very high	90.3	Very high	94 Å²	94	105.2 Å²	105.2	49%	0.492	52%	0.515	S	S	.	.	H	α-helix	trans	-65.4	-16.9	176	-71.1	170.5	0	0	0	113.7	A610 E611 R618	A610-L614 WeakPolarHBondContact O-CG 3.42Å; A610-L614 PolarHBondContact O-N 3Å; E611-L614 PolarHBondContact O-N 3.12Å; L614-R618 PolarHBondContact O-NE 2.68Å; L614-R618 PolarHBondContact O-NH2 3.32Å
615	I	89.6	Confident	90.6	Very high	81 Å²	81	102.1 Å²	102.1	42%	0.415	51%	0.505	S	S	.	.	H	α-helix	trans	-87.7	-42.3	171.6	-71.9	167	0	0	0	110.2	E611 R612 A613 R618 Y619	E611-I615 WeakPolarHBondContact O-CB 3.48Å; E611-I615 WeakPolarHBondContact O-CD1 3.39Å; E611-I615 VanDerWaalsContact O-CG1 3.24Å; E611-I615 WeakPolarHBondContact O-CG1 3.29Å; E611-I615 PolarHBondContact O-N 3.42Å; R612-I615 PolarHBondContact O-N 3Å; A613-I615 PolarHBondContact O-N 2.98Å; I615-R618 PolarHBondContact O-N 3.43Å; I615-Y619 HydrophobicContact CG2-CD2 3.76Å; I615-Y619 HydrophobicContact CG2-CE2 3.53Å; I615-Y619 WeakPolarHBondContact O-CD2 3.44Å; I615-Y619 PolarHBondContact O-N 2.98Å; I615-Y619 VanDerWaalsContact O-N 3.11Å
616	E	92.3	Very high	90.7	Very high	86 Å²	86	104 Å²	104	40%	0.402	51%	0.511	S	S	.	.	H	α-helix	trans	-61.2	-51	178.1	-165.5	154.2	-122.5	0	0	111.3	R612 A613 R618 Y619 E620	R612-E616 IonicContact CZ-OE1 3.16Å; R612-E616 IonicContact CZ-OE2 3.24Å; R612-E616 VanDerWaalsContact CZ-OE2 3.28Å; R612-E616 IonicContact NH1-OE1 2.68Å; R612-E616 IonicContact NH1-OE2 2.73Å; R612-E616 PolarHBondContact NH1-OE2 2.96Å; R612-E616 VanDerWaalsContact NH2-CD 3.27Å; R612-E616 IonicContact NH2-OE1 2.68Å; R612-E616 PolarHBondContact NH2-OE1 3.34Å; R612-E616 IonicContact NH2-OE2 3.41Å; R612-E616 PolarHBondContact NH2-OE2 3.31Å; R612-E616 VanDerWaalsContact NH2-OE2 3.11Å; R612-E616 WeakPolarHBondContact O-CB 3.28Å; R612-E616 PolarHBondContact O-N 3.32Å; A613-E616 PolarHBondContact O-N 3.46Å; A613-E616 VanDerWaalsContact O-N 3.13Å; E616-R618 PolarHBondContact O-N 3.2Å; E616-Y619 WeakPolarHBondContact O-CA 3.46Å; E616-Y619 PolarHBondContact O-N 2.99Å; E616-E620 PolarHBondContact O-N 2.96Å
617	E	92.9	Very high	90.8	Very high	117 Å²	117	103.1 Å²	103.1	55%	0.547	51%	0.507	S	S	.	.	H	α-helix	trans	-52.8	-49.3	174.1	-179	-178.6	-142.1	0	0	111.8	A613 Y619 E620 D621	A613-E617 WeakPolarHBondContact O-CB 3.35Å; A613-E617 PolarHBondContact O-N 2.98Å; E617-Y619 PolarHBondContact O-N 3.25Å; E617-E620 PolarHBondContact O-N 2.87Å; E617-E620 VanDerWaalsContact O-N 3.16Å; E617-D621 WeakPolarHBondContact O-CB 3.45Å; E617-D621 PolarHBondContact O-N 2.67Å
618	R	91.2	Very high	91	Very high	165 Å²	165	105.2 Å²	105.2	62%	0.623	51%	0.509	S	S	*	.	H	α-helix	trans	-65	-23.3	178.3	-80.8	-175	-72.2	-177.9	-5.9	113.8	L614 I615 E616 K622	L614-R618 PolarHBondContact O-NE 2.68Å; L614-R618 PolarHBondContact O-NH2 3.32Å; I615-R618 PolarHBondContact O-N 3.43Å; E616-R618 PolarHBondContact O-N 3.2Å; R618-K622 WeakPolarHBondContact O-CB 3.49Å; R618-K622 PolarHBondContact O-N 3.25Å
619	Y	89.6	Confident	91.1	Very high	150 Å²	150	106.1 Å²	106.1	59%	0.588	51%	0.51	S	S	*	.	H	α-helix	trans	-81.3	-40.7	170.8	-79.6	-61.2	0	0	0	112.2	I615 E616 E617 D621 K622 I623	I615-Y619 HydrophobicContact CG2-CD2 3.76Å; I615-Y619 HydrophobicContact CG2-CE2 3.53Å; I615-Y619 WeakPolarHBondContact O-CD2 3.44Å; I615-Y619 PolarHBondContact O-N 2.98Å; I615-Y619 VanDerWaalsContact O-N 3.11Å; E616-Y619 WeakPolarHBondContact O-CA 3.46Å; E616-Y619 PolarHBondContact O-N 2.99Å; E617-Y619 PolarHBondContact O-N 3.25Å; Y619-D621 VanDerWaalsContact C-N 3.35Å; Y619-D621 PolarHBondContact O-N 2.86Å; Y619-K622 PolarHBondContact O-N 3.21Å; Y619-I623 VanDerWaalsContact O-CG1 3.29Å; Y619-I623 WeakPolarHBondContact O-CG1 3.46Å; Y619-I623 PolarHBondContact O-N 3.01Å
620	E	93.1	Very high	91.2	Very high	126 Å²	126	104.7 Å²	104.7	59%	0.589	51%	0.506	S	S	*	.	H	α-helix	trans	-60.5	-44.4	174.3	-68.1	-166.4	150.8	0	0	111.6	E616 E617 K622 I623 C624	E616-E620 PolarHBondContact O-N 2.96Å; E617-E620 PolarHBondContact O-N 2.87Å; E617-E620 VanDerWaalsContact O-N 3.16Å; E620-K622 VanDerWaalsContact C-N 3.31Å; E620-K622 PolarHBondContact O-N 2.89Å; E620-I623 WeakPolarHBondContact O-CB 3.49Å; E620-I623 PolarHBondContact O-N 3.11Å; E620-I623 VanDerWaalsContact O-N 3.15Å; E620-C624 WeakPolarHBondContact O-CB 3.24Å; E620-C624 PolarHBondContact O-N 3.2Å; E620-C624 PolarHBondContact O-SG 3.42Å; E620-C624 VanDerWaalsContact O-SG 3.39Å
621	D	92.2	Very high	91.3	Very high	92 Å²	92	110.1 Å²	110.1	49%	0.492	52%	0.52	S	S	.	.	H	α-helix	trans	-63.4	-39	178.1	-147	10.3	0	0	0	111.4	E617 Y619 C624 N625	E617-D621 WeakPolarHBondContact O-CB 3.45Å; E617-D621 PolarHBondContact O-N 2.67Å; Y619-D621 VanDerWaalsContact C-N 3.35Å; Y619-D621 PolarHBondContact O-N 2.86Å; D621-C624 PolarHBondContact O-N 3.07Å; D621-N625 WeakPolarHBondContact O-CB 3.44Å; D621-N625 VanDerWaalsContact O-CG 3.28Å; D621-N625 PolarHBondContact O-N 3.42Å; D621-N625 PolarHBondContact O-ND2 3.5Å
622	K	92.6	Very high	91.6	Very high	135 Å²	135	111.4 Å²	111.4	59%	0.587	52%	0.524	S	S	*	.	H	α-helix	trans	-66.5	-38.1	174	-168.8	167.7	-174.2	169.4	0	112.3	R618 Y619 E620 L626	R618-K622 WeakPolarHBondContact O-CB 3.49Å; R618-K622 PolarHBondContact O-N 3.25Å; Y619-K622 PolarHBondContact O-N 3.21Å; E620-K622 VanDerWaalsContact C-N 3.31Å; E620-K622 PolarHBondContact O-N 2.89Å; K622-L626 WeakPolarHBondContact O-CG 3.16Å; K622-L626 PolarHBondContact O-N 3.16Å
623	I	92.4	Very high	91.8	Very high	91 Å²	91	110.7 Å²	110.7	47%	0.467	53%	0.525	S	S	.	.	H	α-helix	trans	-65.8	-48.2	173.5	-70.4	162.9	0	0	0	110.3	Y619 E620 N625 L626 Q627	Y619-I623 VanDerWaalsContact O-CG1 3.29Å; Y619-I623 WeakPolarHBondContact O-CG1 3.46Å; Y619-I623 PolarHBondContact O-N 3.01Å; E620-I623 WeakPolarHBondContact O-CB 3.49Å; E620-I623 PolarHBondContact O-N 3.11Å; E620-I623 VanDerWaalsContact O-N 3.15Å; I623-N625 VanDerWaalsContact C-N 3.31Å; I623-N625 PolarHBondContact O-N 3.32Å; I623-L626 PolarHBondContact O-N 3.24Å; I623-Q627 HydrophobicContact CG2-CG 4.41Å; I623-Q627 WeakPolarHBondContact O-CG 3.39Å; I623-Q627 PolarHBondContact O-N 3.49Å
624	C	93.2	Very high	91.8	Very high	55 Å²	55	114.3 Å²	114.3	37%	0.372	53%	0.528	S	S	.	.	H	α-helix	trans	-57.1	-42.8	176.5	-76.9	0	0	0	0	112	E620 D621 Q627 K628	E620-C624 WeakPolarHBondContact O-CB 3.24Å; E620-C624 PolarHBondContact O-N 3.2Å; E620-C624 PolarHBondContact O-SG 3.42Å; E620-C624 VanDerWaalsContact O-SG 3.39Å; D621-C624 PolarHBondContact O-N 3.07Å; C624-Q627 PolarHBondContact O-N 3.38Å; C624-K628 VanDerWaalsContact O-CG 3.27Å; C624-K628 WeakPolarHBondContact O-CG 3.49Å; C624-K628 PolarHBondContact O-N 2.9Å
625	N	92.3	Very high	91.7	Very high	62 Å²	62	112.4 Å²	112.4	33%	0.332	52%	0.523	S	S	.	.	H	α-helix	trans	-71.3	-34	178	-69.7	-42.9	0	0	0	112.7	D621 I623 K628 H629	D621-N625 WeakPolarHBondContact O-CB 3.44Å; D621-N625 VanDerWaalsContact O-CG 3.28Å; D621-N625 PolarHBondContact O-N 3.42Å; D621-N625 PolarHBondContact O-ND2 3.5Å; I623-N625 VanDerWaalsContact C-N 3.31Å; I623-N625 PolarHBondContact O-N 3.32Å; N625-K628 PolarHBondContact OD1-NZ 3.35Å; N625-K628 VanDerWaalsContact OD1-NZ 3.07Å; N625-H629 PolarHBondContact O-N 2.92Å; N625-H629 VanDerWaalsContact O-N 3.16Å; N625-H629 PolarHBondContact O-ND1 2.87Å
626	L	90.5	Very high	91.7	Very high	111 Å²	111	113.4 Å²	113.4	58%	0.581	53%	0.526	S	S	*	.	H	α-helix	trans	-65.5	-42.5	169.7	-73.8	168	0	0	0	112.1	K622 I623 H629 L630	K622-L626 WeakPolarHBondContact O-CG 3.16Å; K622-L626 PolarHBondContact O-N 3.16Å; I623-L626 PolarHBondContact O-N 3.24Å; L626-H629 PolarHBondContact O-N 3.13Å; L626-L630 WeakPolarHBondContact O-CB 3.37Å; L626-L630 PolarHBondContact O-N 2.9Å
627	Q	91	Very high	91.6	Very high	121 Å²	121	112.8 Å²	112.8	57%	0.565	52%	0.523	S	S	*	.	H	α-helix	trans	-62	-42.8	175.7	-71.8	177.8	6.9	0	0	112.3	I623 C624 L630 K631	I623-Q627 HydrophobicContact CG2-CG 4.41Å; I623-Q627 WeakPolarHBondContact O-CG 3.39Å; I623-Q627 PolarHBondContact O-N 3.49Å; C624-Q627 PolarHBondContact O-N 3.38Å; Q627-L630 PolarHBondContact O-N 3.11Å; Q627-K631 VanDerWaalsContact O-CB 3.29Å; Q627-K631 WeakPolarHBondContact O-CB 3.4Å; Q627-K631 PolarHBondContact O-N 3.2Å
628	K	93	Very high	91.4	Very high	127 Å²	127	112.2 Å²	112.2	55%	0.552	52%	0.523	S	S	*	.	H	α-helix	trans	-58.2	-47.2	174.5	-72.8	168	-165.1	164.8	0	111.4	C624 N625 K632	C624-K628 VanDerWaalsContact O-CG 3.27Å; C624-K628 WeakPolarHBondContact O-CG 3.49Å; C624-K628 PolarHBondContact O-N 2.9Å; N625-K628 PolarHBondContact OD1-NZ 3.35Å; N625-K628 VanDerWaalsContact OD1-NZ 3.07Å; K628-K632 WeakPolarHBondContact O-CB 3.36Å; K628-K632 PolarHBondContact O-N 2.99Å
629	H	90.6	Very high	91.3	Very high	131 Å²	131	110.7 Å²	110.7	61%	0.606	52%	0.521	S	S	*	.	H	α-helix	trans	-65.4	-44.3	178	-72.2	111.5	0	0	0	112.7	N625 L626 K631 K632 F633	N625-H629 PolarHBondContact O-N 2.92Å; N625-H629 VanDerWaalsContact O-N 3.16Å; N625-H629 PolarHBondContact O-ND1 2.87Å; L626-H629 PolarHBondContact O-N 3.13Å; H629-K631 PolarHBondContact O-N 3.05Å; H629-K632 WeakPolarHBondContact O-CB 3.38Å; H629-K632 PolarHBondContact O-N 2.93Å; H629-F633 PolarHBondContact O-N 3.07Å
630	L	91.7	Very high	91.3	Very high	96 Å²	96	108 Å²	108	50%	0.503	51%	0.514	S	S	.	.	H	α-helix	trans	-63.7	-41.9	178.7	-170.6	67.2	0	0	0	111.8	L626 Q627 F633 Y634	L626-L630 WeakPolarHBondContact O-CB 3.37Å; L626-L630 PolarHBondContact O-N 2.9Å; Q627-L630 PolarHBondContact O-N 3.11Å; L630-F633 PolarHBondContact O-N 3.4Å; L630-Y634 HydrophobicContact CD1-CD2 4.12Å; L630-Y634 HydrophobicContact CD1-CE2 3.53Å; L630-Y634 HydrophobicContact CD2-CE2 4.29Å; L630-Y634 HydrophobicContact CG-CD2 3.99Å; L630-Y634 HydrophobicContact CG-CE2 3.71Å; L630-Y634 WeakPolarHBondContact O-CD2 3.48Å; L630-Y634 PolarHBondContact O-N 3.19Å; L630-Y634 VanDerWaalsContact O-N 3.09Å
631	K	92.8	Very high	91	Very high	167 Å²	167	107.3 Å²	107.3	73%	0.726	51%	0.506	S	S	*	.	H	α-helix	trans	-63.5	-40.7	174.1	-172.5	175.6	-177.3	178.1	0	111.5	Q627 H629 S635	Q627-K631 VanDerWaalsContact O-CB 3.29Å; Q627-K631 WeakPolarHBondContact O-CB 3.4Å; Q627-K631 PolarHBondContact O-N 3.2Å; H629-K631 PolarHBondContact O-N 3.05Å; K631-S635 VanDerWaalsContact O-CB 3.23Å; K631-S635 WeakPolarHBondContact O-CB 3.29Å; K631-S635 PolarHBondContact O-N 3.4Å; K631-S635 PolarHBondContact O-OG 2.71Å
632	K	91.3	Very high	90.8	Very high	143 Å²	143	107.5 Å²	107.5	62%	0.622	51%	0.507	S	S	*	.	H	α-helix	trans	-61.9	-48.6	175.2	-170.6	-177.7	-176.5	-172.6	0	111.1	K628 H629 S635 Q636	K628-K632 WeakPolarHBondContact O-CB 3.36Å; K628-K632 PolarHBondContact O-N 2.99Å; H629-K632 WeakPolarHBondContact O-CB 3.38Å; H629-K632 PolarHBondContact O-N 2.93Å; K632-S635 WeakPolarHBondContact CA-OG 3.34Å; K632-S635 PolarHBondContact O-N 2.77Å; K632-S635 PolarHBondContact O-OG 3.06Å; K632-Q636 PolarHBondContact O-N 3.43Å
633	F	92.6	Very high	90.6	Very high	124 Å²	124	107 Å²	107	54%	0.544	51%	0.507	S	S	.	.	H	α-helix	trans	-54.4	-58.3	178.4	179.8	-90.9	0	0	0	111.7	H629 L630 S635 Q636 E637	H629-F633 PolarHBondContact O-N 3.07Å; L630-F633 PolarHBondContact O-N 3.4Å; F633-S635 VanDerWaalsContact C-N 3.29Å; F633-S635 PolarHBondContact O-N 3.26Å; F633-Q636 PolarHBondContact O-N 3.17Å; F633-E637 WeakPolarHBondContact CE1-OE2 3.42Å; F633-E637 PolarHBondContact O-N 3.31Å
634	Y	91.3	Very high	90.3	Very high	126 Å²	126	107.2 Å²	107.2	49%	0.494	51%	0.506	S	S	.	.	H	α-helix	trans	-64.2	-31.9	179.6	-70.3	-53.9	0	0	0	113.2	L630 Q636 E637 L638	L630-Y634 HydrophobicContact CD1-CD2 4.12Å; L630-Y634 HydrophobicContact CD1-CE2 3.53Å; L630-Y634 HydrophobicContact CD2-CE2 4.29Å; L630-Y634 HydrophobicContact CG-CD2 3.99Å; L630-Y634 HydrophobicContact CG-CE2 3.71Å; L630-Y634 WeakPolarHBondContact O-CD2 3.48Å; L630-Y634 PolarHBondContact O-N 3.19Å; L630-Y634 VanDerWaalsContact O-N 3.09Å; Y634-Q636 PolarHBondContact O-N 2.89Å; Y634-E637 WeakPolarHBondContact CD1-OE2 3.49Å; Y634-L638 VanDerWaalsContact O-CB 3.32Å; Y634-L638 WeakPolarHBondContact O-CB 3.31Å; Y634-L638 WeakPolarHBondContact O-CD1 3.27Å; Y634-L638 VanDerWaalsContact O-CG 3.29Å; Y634-L638 WeakPolarHBondContact O-CG 3.44Å; Y634-L638 PolarHBondContact O-N 2.91Å
635	S	90.8	Very high	89.9	Confident	54 Å²	54	109.7 Å²	109.7	38%	0.378	51%	0.514	S	S	.	.	H	α-helix	trans	-70.3	-18.3	174.5	76.1	0	0	0	0	114.2	K631 K632 F633 K639	K631-S635 VanDerWaalsContact O-CB 3.23Å; K631-S635 WeakPolarHBondContact O-CB 3.29Å; K631-S635 PolarHBondContact O-N 3.4Å; K631-S635 PolarHBondContact O-OG 2.71Å; K632-S635 WeakPolarHBondContact CA-OG 3.34Å; K632-S635 PolarHBondContact O-N 2.77Å; K632-S635 PolarHBondContact O-OG 3.06Å; F633-S635 VanDerWaalsContact C-N 3.29Å; F633-S635 PolarHBondContact O-N 3.26Å; S635-K639 WeakPolarHBondContact O-CD 3.3Å; S635-K639 WeakPolarHBondContact O-CG 3.49Å
636	Q	89.1	Confident	89.6	Confident	102 Å²	102	113.6 Å²	113.6	48%	0.477	53%	0.53	S	S	.	.	H	α-helix	trans	-89.4	-46.1	173.5	178.1	170.9	-19.4	0	0	110.3	K632 F633 Y634 L638 K639 E640	K632-Q636 PolarHBondContact O-N 3.43Å; F633-Q636 PolarHBondContact O-N 3.17Å; Y634-Q636 PolarHBondContact O-N 2.89Å; Q636-L638 VanDerWaalsContact C-N 3.26Å; Q636-L638 PolarHBondContact O-N 3.13Å; Q636-K639 PolarHBondContact O-N 3.44Å; Q636-E640 HydrophobicContact CG-CG 4.48Å; Q636-E640 WeakPolarHBondContact CG-OE1 3.43Å; Q636-E640 PolarHBondContact NE2-OE1 2.89Å; Q636-E640 WeakPolarHBondContact O-CG 3.43Å; Q636-E640 PolarHBondContact O-N 3.45Å
637	E	90.4	Very high	89.2	Confident	73 Å²	73	111.3 Å²	111.3	34%	0.341	53%	0.528	S	S	.	.	H	α-helix	trans	-56.9	-39.2	174.2	-174.6	176	-158.9	0	0	111.9	F633 Y634 E640 R641	F633-E637 WeakPolarHBondContact CE1-OE2 3.42Å; F633-E637 PolarHBondContact O-N 3.31Å; Y634-E637 WeakPolarHBondContact CD1-OE2 3.49Å; E637-E640 PolarHBondContact O-N 2.89Å; E637-R641 WeakPolarHBondContact O-CB 3.44Å; E637-R641 VanDerWaalsContact O-CG 3.24Å; E637-R641 WeakPolarHBondContact O-CG 3.47Å; E637-R641 PolarHBondContact O-N 3.36Å
638	L	88.8	Confident	88.7	Confident	106 Å²	106	111 Å²	111	56%	0.555	53%	0.529	S	S	*	.	H	α-helix	trans	-61.6	-44.7	171.9	-80.1	165.4	0	0	0	112.5	Y634 Q636 E640 R641 D642	Y634-L638 VanDerWaalsContact O-CB 3.32Å; Y634-L638 WeakPolarHBondContact O-CB 3.31Å; Y634-L638 WeakPolarHBondContact O-CD1 3.27Å; Y634-L638 VanDerWaalsContact O-CG 3.29Å; Y634-L638 WeakPolarHBondContact O-CG 3.44Å; Y634-L638 PolarHBondContact O-N 2.91Å; Q636-L638 VanDerWaalsContact C-N 3.26Å; Q636-L638 PolarHBondContact O-N 3.13Å; L638-E640 VanDerWaalsContact C-N 3.34Å; L638-E640 PolarHBondContact O-N 2.93Å; L638-R641 WeakPolarHBondContact O-CB 3.35Å; L638-R641 PolarHBondContact O-N 2.72Å; L638-D642 WeakPolarHBondContact O-CB 3.38Å; L638-D642 PolarHBondContact O-N 3.26Å
639	K	88.5	Confident	88.1	Confident	133 Å²	133	107.5 Å²	107.5	58%	0.578	52%	0.524	S	S	*	.	H	α-helix	trans	-66.6	-36.2	178.3	-74.2	174.8	179.3	-175	0	112.7	S635 Q636 D642 Q643	S635-K639 WeakPolarHBondContact O-CD 3.3Å; S635-K639 WeakPolarHBondContact O-CG 3.49Å; Q636-K639 PolarHBondContact O-N 3.44Å; K639-D642 PolarHBondContact O-N 2.91Å; K639-Q643 WeakPolarHBondContact O-CB 3.32Å; K639-Q643 VanDerWaalsContact O-CG 3.24Å; K639-Q643 WeakPolarHBondContact O-CG 3.43Å; K639-Q643 PolarHBondContact O-N 3.36Å
640	E	89.6	Confident	87.7	Confident	92 Å²	92	103.8 Å²	103.8	43%	0.43	52%	0.516	S	S	.	.	H	α-helix	trans	-67.8	-41.8	175.9	-70.5	167.6	-171.6	0	0	110.2	Q636 E637 L638 Q643 E644	Q636-E640 HydrophobicContact CG-CG 4.48Å; Q636-E640 WeakPolarHBondContact CG-OE1 3.43Å; Q636-E640 PolarHBondContact NE2-OE1 2.89Å; Q636-E640 WeakPolarHBondContact O-CG 3.43Å; Q636-E640 PolarHBondContact O-N 3.45Å; E637-E640 PolarHBondContact O-N 2.89Å; L638-E640 VanDerWaalsContact C-N 3.34Å; L638-E640 PolarHBondContact O-N 2.93Å; E640-Q643 PolarHBondContact O-N 3.31Å; E640-E644 WeakPolarHBondContact O-CG 3.39Å; E640-E644 PolarHBondContact O-N 3.34Å
641	R	86.3	Confident	87	Confident	112 Å²	112	102 Å²	102	42%	0.423	52%	0.515	S	S	.	.	H	α-helix	trans	-60.5	-45.1	169.3	-71.7	-79.3	96.1	78.8	0.5	112.8	E637 L638 Q643 E644 I645	E637-R641 WeakPolarHBondContact O-CB 3.44Å; E637-R641 VanDerWaalsContact O-CG 3.24Å; E637-R641 WeakPolarHBondContact O-CG 3.47Å; E637-R641 PolarHBondContact O-N 3.36Å; L638-R641 WeakPolarHBondContact O-CB 3.35Å; L638-R641 PolarHBondContact O-N 2.72Å; R641-Q643 VanDerWaalsContact C-N 3.33Å; R641-Q643 PolarHBondContact O-N 2.88Å; R641-E644 IonicContact CZ-OE1 3.45Å; R641-E644 IonicContact CZ-OE2 2.7Å; R641-E644 IonicContact NE-OE2 3.46Å; R641-E644 PolarHBondContact NE-OE2 3.46Å; R641-E644 IonicContact NH2-OE1 2.75Å; R641-E644 PolarHBondContact NH2-OE1 3.39Å; R641-E644 IonicContact NH2-OE2 3.42Å; R641-E644 PolarHBondContact NH2-OE2 2.81Å; R641-E644 WeakPolarHBondContact O-CB 3.47Å; R641-E644 PolarHBondContact O-N 3.32Å; R641-I645 WeakPolarHBondContact O-CD1 3.47Å; R641-I645 VanDerWaalsContact O-CG1 3.26Å; R641-I645 WeakPolarHBondContact O-CG1 3.34Å; R641-I645 PolarHBondContact O-N 3.42Å
642	D	87.3	Confident	86	Confident	96 Å²	96	99.4 Å²	99.4	51%	0.513	51%	0.508	S	S	.	.	H	α-helix	trans	-63.3	-39.7	179.8	-69.1	-28.8	0	0	0	111.1	L638 K639 I645 E646	L638-D642 WeakPolarHBondContact O-CB 3.38Å; L638-D642 PolarHBondContact O-N 3.26Å; K639-D642 PolarHBondContact O-N 2.91Å; D642-I645 PolarHBondContact O-N 3.47Å; D642-E646 WeakPolarHBondContact O-CB 3.37Å; D642-E646 PolarHBondContact O-N 2.94Å
643	Q	88.7	Confident	85.1	Confident	126 Å²	126	96 Å²	96	59%	0.589	50%	0.497	S	S	*	.	H	α-helix	trans	-68.1	-38.4	174.6	-73.9	172.6	4.1	0	0	112.9	K639 E640 R641 I645 E646 A647	K639-Q643 WeakPolarHBondContact O-CB 3.32Å; K639-Q643 VanDerWaalsContact O-CG 3.24Å; K639-Q643 WeakPolarHBondContact O-CG 3.43Å; K639-Q643 PolarHBondContact O-N 3.36Å; E640-Q643 PolarHBondContact O-N 3.31Å; R641-Q643 VanDerWaalsContact C-N 3.33Å; R641-Q643 PolarHBondContact O-N 2.88Å; Q643-I645 VanDerWaalsContact C-N 3.33Å; Q643-E646 PolarHBondContact O-N 3.4Å; Q643-A647 VanDerWaalsContact O-CB 3.31Å; Q643-A647 WeakPolarHBondContact O-CB 3.41Å; Q643-A647 PolarHBondContact O-N 2.88Å
644	E	86.4	Confident	84.1	Confident	94 Å²	94	97 Å²	97	44%	0.439	50%	0.501	S	S	.	.	H	α-helix	trans	-59.8	-44.1	170.1	-75.6	174.6	169.9	0	0	111.3	E640 R641 A647 L648	E640-E644 WeakPolarHBondContact O-CG 3.39Å; E640-E644 PolarHBondContact O-N 3.34Å; R641-E644 IonicContact CZ-OE1 3.45Å; R641-E644 IonicContact CZ-OE2 2.7Å; R641-E644 IonicContact NE-OE2 3.46Å; R641-E644 PolarHBondContact NE-OE2 3.46Å; R641-E644 IonicContact NH2-OE1 2.75Å; R641-E644 PolarHBondContact NH2-OE1 3.39Å; R641-E644 IonicContact NH2-OE2 3.42Å; R641-E644 PolarHBondContact NH2-OE2 2.81Å; R641-E644 WeakPolarHBondContact O-CB 3.47Å; R641-E644 PolarHBondContact O-N 3.32Å; E644-A647 PolarHBondContact O-N 3.44Å; E644-L648 WeakPolarHBondContact O-CB 3.45Å; E644-L648 WeakPolarHBondContact O-CD1 3.24Å; E644-L648 WeakPolarHBondContact O-CG 3.36Å; E644-L648 PolarHBondContact O-N 3.44Å
645	I	85.3	Confident	82.9	Confident	108 Å²	108	97 Å²	97	55%	0.554	50%	0.504	S	S	*	.	H	α-helix	trans	-64.4	-45.1	178.5	-69.6	163.6	0	0	0	111.1	R641 D642 Q643 L648 A649	R641-I645 WeakPolarHBondContact O-CD1 3.47Å; R641-I645 VanDerWaalsContact O-CG1 3.26Å; R641-I645 WeakPolarHBondContact O-CG1 3.34Å; R641-I645 PolarHBondContact O-N 3.42Å; D642-I645 PolarHBondContact O-N 3.47Å; Q643-I645 VanDerWaalsContact C-N 3.33Å; I645-L648 PolarHBondContact O-N 3.15Å; I645-A649 WeakPolarHBondContact O-CB 3.43Å; I645-A649 PolarHBondContact O-N 3Å
646	E	84.9	Confident	81.4	Confident	143 Å²	143	101.4 Å²	101.4	67%	0.668	52%	0.519	S	S	*	.	H	α-helix	trans	-64.3	-41.8	178.3	-171.9	171.1	-146.9	0	0	111.8	D642 Q643 A649 A650	D642-E646 WeakPolarHBondContact O-CB 3.37Å; D642-E646 PolarHBondContact O-N 2.94Å; Q643-E646 PolarHBondContact O-N 3.4Å; E646-A649 PolarHBondContact O-N 2.98Å; E646-A650 WeakPolarHBondContact O-CB 3.29Å; E646-A650 PolarHBondContact O-N 2.78Å
647	A	82.8	Confident	80	Confident	63 Å²	63	103.1 Å²	103.1	52%	0.521	52%	0.524	S	S	.	.	H	α-helix	trans	-64	-40.7	174.9	0	0	0	0	0	112.6	Q643 E644 A650 A651	Q643-A647 VanDerWaalsContact O-CB 3.31Å; Q643-A647 WeakPolarHBondContact O-CB 3.41Å; Q643-A647 PolarHBondContact O-N 2.88Å; E644-A647 PolarHBondContact O-N 3.44Å; A647-A650 PolarHBondContact O-N 3.38Å; A647-A651 WeakPolarHBondContact O-CB 3.39Å; A647-A651 PolarHBondContact O-N 3.17Å
648	L	81.8	Confident	78.2	Confident	114 Å²	114	107.1 Å²	107.1	60%	0.597	54%	0.543	S	S	*	.	H	α-helix	trans	-67.7	-38.2	175.4	-73.1	168.2	0	0	0	112.1	E644 I645 A651 L652	E644-L648 WeakPolarHBondContact O-CB 3.45Å; E644-L648 WeakPolarHBondContact O-CD1 3.24Å; E644-L648 WeakPolarHBondContact O-CG 3.36Å; E644-L648 PolarHBondContact O-N 3.44Å; I645-L648 PolarHBondContact O-N 3.15Å; L648-A651 PolarHBondContact O-N 2.84Å; L648-L652 WeakPolarHBondContact O-CG 3.49Å; L648-L652 PolarHBondContact O-N 2.88Å
649	A	80.3	Confident	76.5	Confident	54 Å²	54	108.6 Å²	108.6	45%	0.446	55%	0.551	S	S	.	*	H	α-helix	trans	-64.2	-43.9	174.4	0	0	0	0	0	111.8	I645 E646 A651 L652 D653	I645-A649 WeakPolarHBondContact O-CB 3.43Å; I645-A649 PolarHBondContact O-N 3Å; E646-A649 PolarHBondContact O-N 2.98Å; A649-A651 VanDerWaalsContact C-N 3.31Å; A649-A651 PolarHBondContact O-N 3.16Å; A649-L652 PolarHBondContact O-N 3.33Å; A649-D653 PolarHBondContact O-N 2.93Å
650	A	80.9	Confident	74.3	Confident	54 Å²	54	104.8 Å²	104.8	45%	0.446	55%	0.55	S	S	.	.	H	α-helix	trans	-64.4	-33	175.1	0	0	0	0	0	112.9	E646 A647 K654	E646-A650 WeakPolarHBondContact O-CB 3.29Å; E646-A650 PolarHBondContact O-N 2.78Å; A647-A650 PolarHBondContact O-N 3.38Å; A650-K654 WeakPolarHBondContact O-CG 3.31Å; A650-K654 PolarHBondContact O-N 2.91Å; A650-K654 VanDerWaalsContact O-N 3.14Å
651	A	78.2	Confident	72	Confident	57 Å²	57	107 Å²	107	47%	0.471	57%	0.57	S	S	.	*	H	α-helix	trans	-68.9	-37.4	172.8	0	0	0	0	0	112.5	A647 L648 A649 K655	A647-A651 WeakPolarHBondContact O-CB 3.39Å; A647-A651 PolarHBondContact O-N 3.17Å; L648-A651 PolarHBondContact O-N 2.84Å; A649-A651 VanDerWaalsContact C-N 3.31Å; A649-A651 PolarHBondContact O-N 3.16Å; A651-K655 PolarHBondContact O-N 3.28Å; A651-K655 VanDerWaalsContact O-N 3.12Å
652	L	71.9	Confident	69.6	Low	113 Å²	113	107.5 Å²	107.5	59%	0.592	59%	0.59	S	S	*	*	H	α-helix	trans	-68.3	-43.1	175.3	-74.3	167.3	0	0	0	112.5	L648 A649 K655 Q656	L648-L652 WeakPolarHBondContact O-CG 3.49Å; L648-L652 PolarHBondContact O-N 2.88Å; A649-L652 PolarHBondContact O-N 3.33Å; L652-K655 PolarHBondContact O-N 3.02Å; L652-Q656 WeakPolarHBondContact O-CG 3.48Å; L652-Q656 PolarHBondContact O-N 3.26Å
653	D	71.1	Confident	67.2	Low	71 Å²	71	110.8 Å²	110.8	38%	0.38	60%	0.604	S	S	.	*	H	α-helix	trans	-63	-40	176	169.4	72.7	0	0	0	112.3	A649 K655 Q656 K657	A649-D653 PolarHBondContact O-N 2.93Å; D653-K655 PolarHBondContact O-N 3.36Å; D653-Q656 PolarHBondContact O-N 3.5Å; D653-K657 WeakPolarHBondContact O-CD 3.38Å; D653-K657 WeakPolarHBondContact O-CG 3.38Å; D653-K657 PolarHBondContact O-N 2.86Å; D653-K657 WeakPolarHBondContact OD1-CE 3.44Å; D653-K657 IonicContact OD1-NZ 3.85Å; D653-K657 PolarHBondContact OD1-NZ 3.41Å; D653-K657 IonicContact OD2-NZ 2.75Å; D653-K657 PolarHBondContact OD2-NZ 2.99Å
654	K	71.2	Confident	64.5	Low	145 Å²	145	111.7 Å²	111.7	63%	0.63	62%	0.618	S	S	*	*	H	α-helix	trans	-58.8	-46.2	169.9	-80.6	-176.6	175.7	-178	0	112	A650 Q656 K657 E658	A650-K654 WeakPolarHBondContact O-CG 3.31Å; A650-K654 PolarHBondContact O-N 2.91Å; A650-K654 VanDerWaalsContact O-N 3.14Å; K654-Q656 PolarHBondContact O-N 2.94Å; K654-K657 WeakPolarHBondContact O-CA 3.23Å; K654-K657 WeakPolarHBondContact O-CB 3.29Å; K654-K657 PolarHBondContact O-N 3.43Å; K654-E658 PolarHBondContact O-N 3.41Å
655	K	67	Low	62.1	Low	127 Å²	127	111.5 Å²	111.5	55%	0.552	63%	0.633	S	S	*	*	H	α-helix	trans	-65.1	-38.6	-178.9	-161.8	172.6	-175.7	179.6	0	112.6	A651 L652 D653 K657 E658 D659	A651-K655 PolarHBondContact O-N 3.28Å; A651-K655 VanDerWaalsContact O-N 3.12Å; L652-K655 PolarHBondContact O-N 3.02Å; D653-K655 PolarHBondContact O-N 3.36Å; K655-K657 PolarHBondContact O-N 3.36Å; K655-E658 PolarHBondContact O-N 2.79Å; K655-E658 VanDerWaalsContact O-N 3.14Å; K655-D659 PolarHBondContact O-N 3.06Å; K655-D659 VanDerWaalsContact O-N 3.09Å
656	Q	59.8	Low	60.6	Low	147 Å²	147	111.9 Å²	111.9	69%	0.687	64%	0.643	S	S	*	*	H	α-helix	trans	-63.7	-24.2	172.3	-72.7	-177.9	-4.9	0	0	113.4	L652 D653 K654	L652-Q656 WeakPolarHBondContact O-CG 3.48Å; L652-Q656 PolarHBondContact O-N 3.26Å; D653-Q656 PolarHBondContact O-N 3.5Å; K654-Q656 PolarHBondContact O-N 2.94Å
657	K	59	Low	59.4	Low	137 Å²	137	110.4 Å²	110.4	60%	0.596	65%	0.645	S	S	*	*	H	α-helix	trans	-85	-23.1	174.1	-71.3	163.4	-176.1	165.4	0	113	D653 K654 K655	D653-K657 WeakPolarHBondContact O-CD 3.38Å; D653-K657 WeakPolarHBondContact O-CG 3.38Å; D653-K657 PolarHBondContact O-N 2.86Å; D653-K657 WeakPolarHBondContact OD1-CE 3.44Å; D653-K657 IonicContact OD1-NZ 3.85Å; D653-K657 PolarHBondContact OD1-NZ 3.41Å; D653-K657 IonicContact OD2-NZ 2.75Å; D653-K657 PolarHBondContact OD2-NZ 2.99Å; K654-K657 WeakPolarHBondContact O-CA 3.23Å; K654-K657 WeakPolarHBondContact O-CB 3.29Å; K654-K657 PolarHBondContact O-N 3.43Å; K655-K657 PolarHBondContact O-N 3.36Å
658	E	52.9	Low	57	Low	157 Å²	157	114.1 Å²	114.1	73%	0.734	66%	0.661	S	S	*	*	H	α-helix	trans	-77.8	-37.5	173.3	-71.5	173.4	170.8	0	0	112.2	K654 K655 G660	K654-E658 PolarHBondContact O-N 3.41Å; K655-E658 PolarHBondContact O-N 2.79Å; K655-E658 VanDerWaalsContact O-N 3.14Å; E658-G660 PolarHBondContact O-N 2.86Å; E658-G660 VanDerWaalsContact O-N 3.14Å
659	D	52.5	Low	54.7	Low	137 Å²	137	117 Å²	117	73%	0.733	67%	0.671	S	S	*	*	S	Bend	trans	-75	9.3	174	-72.6	-40.9	0	0	0	113.7	K655	K655-D659 PolarHBondContact O-N 3.06Å; K655-D659 VanDerWaalsContact O-N 3.09Å
660	G	43.3	Very low	53.6	Low	53 Å²	53	119.5 Å²	119.5	55%	0.546	68%	0.683	S	S	.	*			trans	-95.3	19.8	-158.5	0	0	0	0	0	119.2	E658	E658-G660 PolarHBondContact O-N 2.86Å; E658-G660 VanDerWaalsContact O-N 3.14Å
661	V	40.8	Very low	51.2	Low	140 Å²	140	126.5 Å²	126.5	85%	0.848	71%	0.707	S	S	*	*			trans	-137.2	88.7	-176.4	-170.4	0	0	0	0	114.6
662	S	36.2	Very low	49.4	Very low	121 Å²	121	127 Å²	127	85%	0.846	72%	0.718	S	S	*	*				-173.3	165.3	129.1	-162.5	0	0	0	0	110.8
663	M	36.5	Very low	48.6	Very low	166 Å²	166	127.2 Å²	127.2	82%	0.818	73%	0.726	S	S	*	*			trans	-129.5	168.8	-169.7	-81.9	-87.4	-104.9	0	0	113.2
664	T	32.5	Very low	47.3	Very low	144 Å²	144	135.1 Å²	135.1	88%	0.883	75%	0.751	S	S	*	*			trans	88.4	140.8	161.5	73	0	0	0	0	120.2
665	A	34.7	Very low	45.8	Very low	90 Å²	90	140.1 Å²	140.1	74%	0.744	77%	0.765	S	S	*	*			trans	-129.9	-172.6	164	0	0	0	0	0	105.8
666	P	54.3	Low	44.7	Very low	117 Å²	117	138.8 Å²	138.8	76%	0.76	77%	0.772	S	S	*	*			cis	-136.6	-131.3	5.3	39.4	-15.5	0	0	0	111
667	P	59.4	Low	44.1	Very low	111 Å²	111	140.7 Å²	140.7	72%	0.721	78%	0.781	S	S	*	*				-115.5	176.7	-65.8	32.6	-16.1	0	0	0	113.5
668	V	32.2	Very low	43.5	Very low	141 Å²	141	143.7 Å²	143.7	86%	0.855	79%	0.788	S	S	*	*			trans	171.1	145.2	134.7	149.1	0	0	0	0	110.2
669	E	34.6	Very low	43.2	Very low	174 Å²	174	143.4 Å²	143.4	81%	0.813	79%	0.791	S	S	*	*			trans	-102.6	-171.2	175.4	-38.4	-170.9	136.3	0	0	111.5
670	P	57.5	Low	43.2	Very low	107 Å²	107	140.5 Å²	140.5	70%	0.695	78%	0.781	S	S	*	*			cis	-131.7	160.6	-16.9	37	-21.1	0	0	0	114.7
671	E	30.6	Very low	43.7	Very low	201 Å²	201	140.9 Å²	140.9	94%	0.939	78%	0.775	S	S	*	*			trans	179.6	169	137.8	-104.6	177.5	-166.9	0	0	110.9
672	G	40.2	Very low	44.4	Very low	68 Å²	68	139.2 Å²	139.2	70%	0.701	76%	0.758	S	S	*	*			trans	-134.6	-159.7	178.3	0	0	0	0	0	112.3
673	P	53.5	Low	45.4	Very low	118 Å²	118	138.2 Å²	138.2	77%	0.766	75%	0.747	S	S	*	*			cis	-136.7	165.9	-5.2	41.2	-24.8	0	0	0	115.9
674	R	45.3	Very low	46.6	Very low	237 Å²	237	136.4 Å²	136.4	89%	0.894	74%	0.737	S	S	*	*			trans	36.6	112.5	150.7	-64.4	174.3	172	169.8	-2.5	120
675	R	40.1	Very low	47.9	Very low	250 Å²	250	133.6 Å²	133.6	94%	0.943	72%	0.716	S	S	*	*				175.6	153.2	112.9	-101.5	173.5	173.1	-179.4	-1	116.2
676	S	43	Very low	49.6	Very low	98 Å²	98	133.4 Å²	133.4	69%	0.685	70%	0.702	S	S	*	*			trans	76.7	71	146	-164.4	0	0	0	0	121.7	R678	S676-R678 PolarHBondContact O-N 3.28Å
677	H	46.4	Very low	50.4	Low	188 Å²	188	135.9 Å²	135.9	87%	0.87	70%	0.697	S	S	*	*			trans	-75.2	109.5	139.2	-104.5	-92.1	0	0	0	109.1
678	R	46.8	Very low	50.8	Low	200 Å²	200	135.9 Å²	135.9	76%	0.755	69%	0.69	S	S	*	*			trans	-158.7	22.6	173.1	-138.6	-176.2	-169.4	-168.9	3	117	S676	S676-R678 PolarHBondContact O-N 3.28Å
679	L	47.9	Very low	52.7	Low	150 Å²	150	136.2 Å²	136.2	79%	0.785	68%	0.676	S	S	*	*	S	Bend	trans	-116.6	-23.3	-174.5	-75.5	166.8	0	0	0	115.4
680	S	50.7	Low	54.6	Low	77 Å²	77	130.9 Å²	130.9	54%	0.538	66%	0.662	S	S	.	*	H	α-helix	trans	-72.8	-37.6	179	50	0	0	0	0	113.8	Q682 T683	S680-Q682 PolarHBondContact O-N 2.76Å; S680-T683 PolarHBondContact O-N 2.92Å; S680-T683 PolarHBondContact O-OG1 3.37Å
681	S	54.4	Low	55.5	Low	60 Å²	60	129.4 Å²	129.4	42%	0.42	65%	0.646	S	S	.	*	H	α-helix	trans	-65.8	-20.2	-178.3	59	0	0	0	0	113.8	L685	S681-L685 VanDerWaalsContact O-CB 3.28Å; S681-L685 WeakPolarHBondContact O-CB 3.48Å; S681-L685 PolarHBondContact O-N 3.33Å
682	Q	55.3	Low	57.5	Low	106 Å²	106	124.1 Å²	124.1	50%	0.495	62%	0.623	S	S	.	*	H	α-helix	trans	-77.5	-35.3	-175.3	-153.3	71.7	19.3	0	0	112	S680 N686	S680-Q682 PolarHBondContact O-N 2.76Å; Q682-N686 WeakPolarHBondContact O-CB 3.34Å; Q682-N686 PolarHBondContact O-N 3.25Å; Q682-N686 VanDerWaalsContact O-N 3.1Å; Q682-N686 PolarHBondContact O-ND2 3.07Å
683	T	58.4	Low	59.3	Low	100 Å²	100	124.8 Å²	124.8	61%	0.613	61%	0.611	S	S	*	*	H	α-helix	trans	-72.3	-40.1	176.9	34.5	0	0	0	0	112.1	S680 N686 R687	S680-T683 PolarHBondContact O-N 2.92Å; S680-T683 PolarHBondContact O-OG1 3.37Å; T683-N686 PolarHBondContact O-N 3.4Å; T683-R687 WeakPolarHBondContact O-CB 3.44Å; T683-R687 PolarHBondContact O-N 3.05Å
684	E	59.9	Low	60.5	Low	128 Å²	128	124.7 Å²	124.7	60%	0.598	60%	0.6	S	S	*	*	H	α-helix	trans	-66	-42.8	175.5	-65.6	178.4	142.5	0	0	112	N686 R687 L688	E684-N686 VanDerWaalsContact C-N 3.31Å; E684-N686 PolarHBondContact O-N 2.93Å; E684-R687 PolarHBondContact O-N 3.04Å; E684-L688 WeakPolarHBondContact O-CB 3.45Å; E684-L688 WeakPolarHBondContact O-CG 3.29Å; E684-L688 PolarHBondContact O-N 3.2Å
685	L	61.8	Low	61.7	Low	85 Å²	85	117.1 Å²	117.1	45%	0.445	58%	0.583	S	S	.	*	H	α-helix	trans	-66.8	-33.3	177.4	-154.2	167	0	0	0	111.6	S681 R689	S681-L685 VanDerWaalsContact O-CB 3.28Å; S681-L685 WeakPolarHBondContact O-CB 3.48Å; S681-L685 PolarHBondContact O-N 3.33Å; L685-R689 HydrophobicContact CD2-CG 4.44Å; L685-R689 WeakPolarHBondContact O-CB 3.19Å; L685-R689 PolarHBondContact O-N 2.87Å
686	N	68.3	Low	63.3	Low	85 Å²	85	112.5 Å²	112.5	46%	0.455	57%	0.565	S	S	.	*	H	α-helix	trans	-69.9	-37.7	171.6	-74.6	-12.9	0	0	0	112.5	Q682 T683 E684 R689 A690	Q682-N686 WeakPolarHBondContact O-CB 3.34Å; Q682-N686 PolarHBondContact O-N 3.25Å; Q682-N686 VanDerWaalsContact O-N 3.1Å; Q682-N686 PolarHBondContact O-ND2 3.07Å; T683-N686 PolarHBondContact O-N 3.4Å; E684-N686 VanDerWaalsContact C-N 3.31Å; E684-N686 PolarHBondContact O-N 2.93Å; N686-R689 WeakPolarHBondContact O-CB 3.46Å; N686-R689 PolarHBondContact O-N 3.3Å; N686-A690 PolarHBondContact O-N 3Å
687	R	72	Confident	65	Low	170 Å²	170	110.5 Å²	110.5	64%	0.642	56%	0.555	S	S	*	*	H	α-helix	trans	-64.5	-49.6	174.1	177.8	177.3	173	162.2	3.1	111.6	T683 E684 R689 A690 E691	T683-R687 WeakPolarHBondContact O-CB 3.44Å; T683-R687 PolarHBondContact O-N 3.05Å; E684-R687 PolarHBondContact O-N 3.04Å; R687-R689 PolarHBondContact O-N 3.25Å; R687-A690 WeakPolarHBondContact O-CB 3.42Å; R687-A690 PolarHBondContact O-N 2.89Å; R687-E691 WeakPolarHBondContact CG-OE1 3.36Å; R687-E691 IonicContact CZ-OE1 2.72Å; R687-E691 IonicContact NE-OE1 3.89Å; R687-E691 PolarHBondContact NE-OE1 3.09Å; R687-E691 IonicContact NH2-OE1 2.7Å; R687-E691 PolarHBondContact NH2-OE1 2.76Å; R687-E691 VanDerWaalsContact NH2-OE1 3.16Å; R687-E691 PolarHBondContact O-N 2.87Å
688	L	68.8	Low	66.5	Low	111 Å²	111	106.3 Å²	106.3	58%	0.581	54%	0.536	S	S	*	.	H	α-helix	trans	-61.2	-29.7	175.7	-74.3	165.5	0	0	0	112.3	E684 L692	E684-L688 WeakPolarHBondContact O-CB 3.45Å; E684-L688 WeakPolarHBondContact O-CG 3.29Å; E684-L688 PolarHBondContact O-N 3.2Å; L688-L692 WeakPolarHBondContact O-CB 3.21Å; L688-L692 PolarHBondContact O-N 3.39Å
689	R	71.6	Confident	67.8	Low	147 Å²	147	102.5 Å²	102.5	56%	0.555	53%	0.529	S	S	*	.	H	α-helix	trans	-66.8	-46.6	169	-90.8	178.5	165.7	159.4	-3.7	112.7	L685 N686 R687 E691 L692 D693	L685-R689 HydrophobicContact CD2-CG 4.44Å; L685-R689 WeakPolarHBondContact O-CB 3.19Å; L685-R689 PolarHBondContact O-N 2.87Å; N686-R689 WeakPolarHBondContact O-CB 3.46Å; N686-R689 PolarHBondContact O-N 3.3Å; R687-R689 PolarHBondContact O-N 3.25Å; R689-E691 VanDerWaalsContact C-N 3.34Å; R689-E691 PolarHBondContact O-N 3.01Å; R689-L692 PolarHBondContact O-N 3.41Å; R689-D693 WeakPolarHBondContact O-CB 3.24Å; R689-D693 PolarHBondContact O-N 3.48Å
690	A	74.7	Confident	69.1	Low	63 Å²	63	100.4 Å²	100.4	52%	0.521	52%	0.519	S	S	.	.	H	α-helix	trans	-61.4	-43.5	177.5	0	0	0	0	0	111.7	N686 R687 D693 Q694	N686-A690 PolarHBondContact O-N 3Å; R687-A690 WeakPolarHBondContact O-CB 3.42Å; R687-A690 PolarHBondContact O-N 2.89Å; A690-D693 PolarHBondContact O-N 2.81Å; A690-Q694 WeakPolarHBondContact O-CB 3.29Å; A690-Q694 PolarHBondContact O-N 3.22Å
691	E	76.3	Confident	70.3	Confident	76 Å²	76	100.2 Å²	100.2	36%	0.355	51%	0.514	S	S	.	.	H	α-helix	trans	-64	-41.3	175.3	-69.1	167.4	177.4	0	0	111.3	R687 R689 Q694 C695	R687-E691 WeakPolarHBondContact CG-OE1 3.36Å; R687-E691 IonicContact CZ-OE1 2.72Å; R687-E691 IonicContact NE-OE1 3.89Å; R687-E691 PolarHBondContact NE-OE1 3.09Å; R687-E691 IonicContact NH2-OE1 2.7Å; R687-E691 PolarHBondContact NH2-OE1 2.76Å; R687-E691 VanDerWaalsContact NH2-OE1 3.16Å; R687-E691 PolarHBondContact O-N 2.87Å; R689-E691 VanDerWaalsContact C-N 3.34Å; R689-E691 PolarHBondContact O-N 3.01Å; E691-Q694 PolarHBondContact O-N 3.5Å; E691-C695 PolarHBondContact O-N 2.9Å; E691-C695 PolarHBondContact O-SG 2.79Å; E691-C695 VanDerWaalsContact O-SG 3.37Å
692	L	72.2	Confident	71.3	Confident	90 Å²	90	104.3 Å²	104.3	47%	0.471	52%	0.524	S	S	.	.	H	α-helix	trans	-70	-36.2	177.4	-175.4	147.1	0	0	0	113.4	L688 R689 C695 R696	L688-L692 WeakPolarHBondContact O-CB 3.21Å; L688-L692 PolarHBondContact O-N 3.39Å; R689-L692 PolarHBondContact O-N 3.41Å; L692-C695 PolarHBondContact O-N 2.91Å; L692-R696 WeakPolarHBondContact O-CG 3.46Å; L692-R696 PolarHBondContact O-N 2.75Å
693	D	77.3	Confident	72	Confident	81 Å²	81	102.7 Å²	102.7	43%	0.433	52%	0.522	S	S	.	.	H	α-helix	trans	-76.3	-28.5	174.9	-72.6	-34.3	0	0	0	111.9	R689 A690 R696 A697	R689-D693 WeakPolarHBondContact O-CB 3.24Å; R689-D693 PolarHBondContact O-N 3.48Å; A690-D693 PolarHBondContact O-N 2.81Å; D693-R696 WeakPolarHBondContact O-CB 3.45Å; D693-R696 PolarHBondContact O-N 2.93Å; D693-R696 VanDerWaalsContact OD1-CD 3.26Å; D693-R696 WeakPolarHBondContact OD1-CD 3.32Å; D693-R696 IonicContact OD1-CZ 2.68Å; D693-R696 IonicContact OD1-NE 2.76Å; D693-R696 IonicContact OD1-NH1 3.96Å; D693-R696 PolarHBondContact OD1-NH1 3.31Å; D693-A697 PolarHBondContact O-N 3.21Å
694	Q	79.9	Confident	72.7	Confident	116 Å²	116	102.8 Å²	102.8	54%	0.542	52%	0.515	S	S	.	.	H	α-helix	trans	-63.3	-50.2	165.3	179	178.3	-18.9	0	0	111	A690 E691 R696 A697 E698	A690-Q694 WeakPolarHBondContact O-CB 3.29Å; A690-Q694 PolarHBondContact O-N 3.22Å; E691-Q694 PolarHBondContact O-N 3.5Å; Q694-R696 PolarHBondContact O-N 3.46Å; Q694-A697 WeakPolarHBondContact O-CB 3.49Å; Q694-A697 PolarHBondContact O-N 3.04Å; Q694-E698 PolarHBondContact NE2-OE1 3.17Å; Q694-E698 VanDerWaalsContact NE2-OE1 3.1Å; Q694-E698 PolarHBondContact O-N 3.01Å
695	C	70.3	Confident	73.2	Confident	79 Å²	79	100.2 Å²	100.2	53%	0.534	51%	0.506	S	S	.	.	H	α-helix	trans	-60.1	-30.7	175.7	-70.5	0	0	0	0	112.6	E691 L692 L699	E691-C695 PolarHBondContact O-N 2.9Å; E691-C695 PolarHBondContact O-SG 2.79Å; E691-C695 VanDerWaalsContact O-SG 3.37Å; L692-C695 PolarHBondContact O-N 2.91Å; C695-L699 VanDerWaalsContact O-CB 3.24Å; C695-L699 WeakPolarHBondContact O-CB 3.24Å; C695-L699 PolarHBondContact O-N 2.89Å
696	R	74.1	Confident	73.4	Confident	152 Å²	152	101.7 Å²	101.7	57%	0.574	51%	0.513	S	S	*	.	H	α-helix	trans	-68.4	-40.8	170.7	-77.3	165.8	166.5	172.2	-3.8	112.8	L692 D693 Q694 L699 L700	L692-R696 WeakPolarHBondContact O-CG 3.46Å; L692-R696 PolarHBondContact O-N 2.75Å; D693-R696 WeakPolarHBondContact O-CB 3.45Å; D693-R696 PolarHBondContact O-N 2.93Å; D693-R696 VanDerWaalsContact OD1-CD 3.26Å; D693-R696 WeakPolarHBondContact OD1-CD 3.32Å; D693-R696 IonicContact OD1-CZ 2.68Å; D693-R696 IonicContact OD1-NE 2.76Å; D693-R696 IonicContact OD1-NH1 3.96Å; D693-R696 PolarHBondContact OD1-NH1 3.31Å; Q694-R696 PolarHBondContact O-N 3.46Å; R696-L699 PolarHBondContact O-N 3.01Å; R696-L700 VanDerWaalsContact O-CB 3.26Å; R696-L700 WeakPolarHBondContact O-CB 3.29Å; R696-L700 PolarHBondContact O-N 3Å
697	A	76.9	Confident	73.4	Confident	57 Å²	57	101.1 Å²	101.1	47%	0.471	51%	0.513	S	S	.	.	H	α-helix	trans	-65.4	-41.3	175.6	0	0	0	0	0	111.7	D693 Q694 L700 T701	D693-A697 PolarHBondContact O-N 3.21Å; Q694-A697 WeakPolarHBondContact O-CB 3.49Å; Q694-A697 PolarHBondContact O-N 3.04Å; A697-L700 PolarHBondContact O-N 3.02Å; A697-T701 WeakPolarHBondContact O-CB 3.48Å; A697-T701 WeakPolarHBondContact O-CG2 3.41Å; A697-T701 PolarHBondContact O-N 3.41Å; A697-T701 PolarHBondContact O-OG1 3.44Å
698	E	79.8	Confident	73.2	Confident	100 Å²	100	98.2 Å²	98.2	47%	0.467	51%	0.505	S	S	.	.	H	α-helix	trans	-64	-44.2	172.2	-71.7	-179.7	-162.5	0	0	111.7	Q694 L700 T701 K702	Q694-E698 PolarHBondContact NE2-OE1 3.17Å; Q694-E698 VanDerWaalsContact NE2-OE1 3.1Å; Q694-E698 PolarHBondContact O-N 3.01Å; E698-L700 VanDerWaalsContact C-N 3.34Å; E698-L700 PolarHBondContact O-N 2.81Å; E698-T701 WeakPolarHBondContact CA-OG1 3.26Å; E698-T701 PolarHBondContact O-N 3Å; E698-T701 PolarHBondContact O-OG1 2.93Å; E698-K702 VanDerWaalsContact O-CB 3.26Å; E698-K702 WeakPolarHBondContact O-CB 3.5Å; E698-K702 WeakPolarHBondContact O-CG 3.47Å; E698-K702 PolarHBondContact O-N 3.01Å
699	L	72.6	Confident	72.8	Confident	119 Å²	119	97.4 Å²	97.4	62%	0.623	50%	0.501	S	S	*	.	H	α-helix	trans	-61.8	-40.7	174.9	-173.4	69.5	0	0	0	112	C695 R696 T703	C695-L699 VanDerWaalsContact O-CB 3.24Å; C695-L699 WeakPolarHBondContact O-CB 3.24Å; C695-L699 PolarHBondContact O-N 2.89Å; R696-L699 PolarHBondContact O-N 3.01Å; L699-T703 VanDerWaalsContact O-CB 3.25Å; L699-T703 WeakPolarHBondContact O-CB 3.41Å; L699-T703 PolarHBondContact O-N 2.91Å; L699-T703 PolarHBondContact O-OG1 2.84Å
700	L	75.6	Confident	71.8	Confident	107 Å²	107	98.6 Å²	98.6	56%	0.56	51%	0.505	S	S	*	.	H	α-helix	trans	-71.5	-39.3	-178.5	-162.6	153.5	0	0	0	111.5	R696 A697 E698 T703 Q704	R696-L700 VanDerWaalsContact O-CB 3.26Å; R696-L700 WeakPolarHBondContact O-CB 3.29Å; R696-L700 PolarHBondContact O-N 3Å; A697-L700 PolarHBondContact O-N 3.02Å; E698-L700 VanDerWaalsContact C-N 3.34Å; E698-L700 PolarHBondContact O-N 2.81Å; L700-T703 PolarHBondContact O-N 2.77Å; L700-Q704 HydrophobicContact CD2-CG 4.34Å; L700-Q704 WeakPolarHBondContact O-CG 3.41Å; L700-Q704 PolarHBondContact O-N 3.47Å
701	T	75.9	Confident	70.8	Confident	72 Å²	72	102.4 Å²	102.4	44%	0.442	51%	0.514	S	S	.	.	H	α-helix	trans	-67.9	-44.9	172.3	46.4	0	0	0	0	112.2	A697 E698 T703 Q704 D705	A697-T701 WeakPolarHBondContact O-CB 3.48Å; A697-T701 WeakPolarHBondContact O-CG2 3.41Å; A697-T701 PolarHBondContact O-N 3.41Å; A697-T701 PolarHBondContact O-OG1 3.44Å; E698-T701 WeakPolarHBondContact CA-OG1 3.26Å; E698-T701 PolarHBondContact O-N 3Å; E698-T701 PolarHBondContact O-OG1 2.93Å; T701-T703 PolarHBondContact O-N 2.84Å; T701-Q704 CarbonylContact O-C 3.53Å; T701-Q704 PolarHBondContact O-N 3.22Å; T701-Q704 VanDerWaalsContact O-N 3.14Å; T701-D705 PolarHBondContact O-N 3.43Å
702	K	75.4	Confident	69.4	Low	146 Å²	146	106.2 Å²	106.2	64%	0.635	53%	0.53	S	S	*	.	H	α-helix	trans	-58.6	-35.8	170.7	-68.4	-77.7	-178.1	177.7	0	112	E698 D705 L706	E698-K702 VanDerWaalsContact O-CB 3.26Å; E698-K702 WeakPolarHBondContact O-CB 3.5Å; E698-K702 WeakPolarHBondContact O-CG 3.47Å; E698-K702 PolarHBondContact O-N 3.01Å; K702-D705 PolarHBondContact O-N 3.04Å; K702-L706 WeakPolarHBondContact O-CB 3.31Å; K702-L706 WeakPolarHBondContact O-CG 3.34Å; K702-L706 PolarHBondContact O-N 2.81Å
703	T	70.6	Confident	68.2	Low	72 Å²	72	108.7 Å²	108.7	44%	0.442	54%	0.543	S	S	.	.	H	α-helix	trans	-70.4	-41.2	175	-59.3	0	0	0	0	111.5	L699 L700 T701 D705 L706 V707	L699-T703 VanDerWaalsContact O-CB 3.25Å; L699-T703 WeakPolarHBondContact O-CB 3.41Å; L699-T703 PolarHBondContact O-N 2.91Å; L699-T703 PolarHBondContact O-OG1 2.84Å; L700-T703 PolarHBondContact O-N 2.77Å; T701-T703 PolarHBondContact O-N 2.84Å; T703-D705 VanDerWaalsContact C-N 3.32Å; T703-D705 PolarHBondContact O-N 3.39Å; T703-L706 PolarHBondContact O-N 3.44Å; T703-V707 WeakPolarHBondContact O-CG2 3.45Å; T703-V707 PolarHBondContact O-N 3.39Å
704	Q	72.4	Confident	66.4	Low	102 Å²	102	109.9 Å²	109.9	48%	0.477	55%	0.549	S	S	.	.	H	α-helix	trans	-63	-37.7	171.6	-76.5	-173.6	0.3	0	0	112.2	L700 T701 V707 K708	L700-Q704 HydrophobicContact CD2-CG 4.34Å; L700-Q704 WeakPolarHBondContact O-CG 3.41Å; L700-Q704 PolarHBondContact O-N 3.47Å; T701-Q704 CarbonylContact O-C 3.53Å; T701-Q704 PolarHBondContact O-N 3.22Å; T701-Q704 VanDerWaalsContact O-N 3.14Å; Q704-V707 CarbonylContact O-C 3.53Å; Q704-V707 PolarHBondContact O-N 2.86Å; Q704-K708 WeakPolarHBondContact O-CG 3.24Å; Q704-K708 PolarHBondContact O-N 3.47Å
705	D	71.5	Confident	64.5	Low	75 Å²	75	109 Å²	109	40%	0.401	55%	0.551	S	S	.	*	H	α-helix	trans	-73.7	-32.3	176.4	-73.2	-18.7	0	0	0	112.4	T701 K702 T703 V707 K708 L709	T701-D705 PolarHBondContact O-N 3.43Å; K702-D705 PolarHBondContact O-N 3.04Å; T703-D705 VanDerWaalsContact C-N 3.32Å; T703-D705 PolarHBondContact O-N 3.39Å; D705-V707 VanDerWaalsContact C-N 3.34Å; D705-K708 PolarHBondContact O-N 3.16Å; D705-K708 WeakPolarHBondContact OD1-CD 3.47Å; D705-K708 WeakPolarHBondContact OD1-CE 3.47Å; D705-K708 IonicContact OD1-NZ 3.09Å; D705-K708 PolarHBondContact OD1-NZ 2.82Å; D705-L709 VanDerWaalsContact O-CB 3.31Å; D705-L709 WeakPolarHBondContact O-CB 3.46Å; D705-L709 WeakPolarHBondContact O-CG 3.46Å; D705-L709 PolarHBondContact O-N 3.44Å
706	L	65.5	Low	63.5	Low	115 Å²	115	111.6 Å²	111.6	60%	0.602	57%	0.567	S	S	*	*	H	α-helix	trans	-64.8	-36.1	165.8	-80.4	171.5	0	0	0	112	K702 T703 L709 R710	K702-L706 WeakPolarHBondContact O-CB 3.31Å; K702-L706 WeakPolarHBondContact O-CG 3.34Å; K702-L706 PolarHBondContact O-N 2.81Å; T703-L706 PolarHBondContact O-N 3.44Å; L706-L709 PolarHBondContact O-N 3.19Å; L706-R710 VanDerWaalsContact O-CB 3.23Å; L706-R710 WeakPolarHBondContact O-CB 3.44Å; L706-R710 PolarHBondContact O-N 3.03Å
707	V	69.1	Low	62.2	Low	74 Å²	74	107.2 Å²	107.2	45%	0.448	57%	0.569	S	S	.	*	H	α-helix	trans	-68.8	-40.5	172.3	169.5	0	0	0	0	111.2	T703 Q704 D705 R710 M711	T703-V707 WeakPolarHBondContact O-CG2 3.45Å; T703-V707 PolarHBondContact O-N 3.39Å; Q704-V707 CarbonylContact O-C 3.53Å; Q704-V707 PolarHBondContact O-N 2.86Å; D705-V707 VanDerWaalsContact C-N 3.34Å; V707-R710 PolarHBondContact O-N 3.42Å; V707-M711 HydrophobicContact CG1-SD 4.43Å; V707-M711 WeakPolarHBondContact O-CB 3.46Å; V707-M711 WeakPolarHBondContact O-CG 3.45Å; V707-M711 PolarHBondContact O-N 3.37Å
708	K	67.5	Low	60.6	Low	108 Å²	108	108.7 Å²	108.7	47%	0.47	58%	0.576	S	S	.	*	H	α-helix	trans	-64.6	-38.8	172.5	-68.7	169.3	-155	157.3	0	112	Q704 D705 M711 K712	Q704-K708 WeakPolarHBondContact O-CG 3.24Å; Q704-K708 PolarHBondContact O-N 3.47Å; D705-K708 PolarHBondContact O-N 3.16Å; D705-K708 WeakPolarHBondContact OD1-CD 3.47Å; D705-K708 WeakPolarHBondContact OD1-CE 3.47Å; D705-K708 IonicContact OD1-NZ 3.09Å; D705-K708 PolarHBondContact OD1-NZ 2.82Å; K708-M711 PolarHBondContact O-N 2.94Å; K708-K712 WeakPolarHBondContact O-CB 3.29Å; K708-K712 VanDerWaalsContact O-CG 3.27Å; K708-K712 WeakPolarHBondContact O-CG 3.42Å; K708-K712 PolarHBondContact O-N 3.29Å
709	L	60.8	Low	58.8	Low	95 Å²	95	107.7 Å²	107.7	50%	0.497	59%	0.585	S	S	.	*	H	α-helix	trans	-67.7	-40.3	174.3	-81.1	163.5	0	0	0	111.1	D705 L706 K712 L713	D705-L709 VanDerWaalsContact O-CB 3.31Å; D705-L709 WeakPolarHBondContact O-CB 3.46Å; D705-L709 WeakPolarHBondContact O-CG 3.46Å; D705-L709 PolarHBondContact O-N 3.44Å; L706-L709 PolarHBondContact O-N 3.19Å; L709-K712 CarbonylContact O-C 3.45Å; L709-K712 WeakPolarHBondContact O-CA 3.43Å; L709-K712 WeakPolarHBondContact O-CB 3.18Å; L709-K712 PolarHBondContact O-N 3.43Å; L709-K712 VanDerWaalsContact O-N 3.1Å; L709-L713 WeakPolarHBondContact O-CB 3.47Å; L709-L713 PolarHBondContact O-N 2.98Å
710	R	50.5	Low	57.4	Low	171 Å²	171	103.7 Å²	103.7	65%	0.645	57%	0.573	S	S	*	*	H	α-helix	trans	-60.9	-46.1	172.1	-175.2	175.1	178.4	173.6	2	111.4	L706 V707 K712 L713 D714	L706-R710 VanDerWaalsContact O-CB 3.23Å; L706-R710 WeakPolarHBondContact O-CB 3.44Å; L706-R710 PolarHBondContact O-N 3.03Å; V707-R710 PolarHBondContact O-N 3.42Å; R710-K712 PolarHBondContact O-N 2.85Å; R710-L713 CarbonylContact O-C 3.58Å; R710-L713 WeakPolarHBondContact O-CA 3.35Å; R710-L713 PolarHBondContact O-N 2.86Å; R710-D714 WeakPolarHBondContact O-CB 3.49Å; R710-D714 PolarHBondContact O-N 2.96Å
711	M	52	Low	55.9	Low	143 Å²	143	101.4 Å²	101.4	70%	0.704	57%	0.569	S	S	*	*	H	α-helix	trans	-69.2	-13.1	173.8	-66.5	-173.5	81.1	0	0	114.2	V707 K708	V707-M711 HydrophobicContact CG1-SD 4.43Å; V707-M711 WeakPolarHBondContact O-CB 3.46Å; V707-M711 WeakPolarHBondContact O-CG 3.45Å; V707-M711 PolarHBondContact O-N 3.37Å; K708-M711 PolarHBondContact O-N 2.94Å
712	K	48.5	Very low	54.4	Low	157 Å²	157	104.7 Å²	104.7	68%	0.683	58%	0.583	S	S	*	*	H	α-helix	trans	-90.1	-20.2	167.7	-74.6	172.7	178.7	-175.4	0	113.1	K708 L709 R710 V715	K708-K712 WeakPolarHBondContact O-CB 3.29Å; K708-K712 VanDerWaalsContact O-CG 3.27Å; K708-K712 WeakPolarHBondContact O-CG 3.42Å; K708-K712 PolarHBondContact O-N 3.29Å; L709-K712 CarbonylContact O-C 3.45Å; L709-K712 WeakPolarHBondContact O-CA 3.43Å; L709-K712 WeakPolarHBondContact O-CB 3.18Å; L709-K712 PolarHBondContact O-N 3.43Å; L709-K712 VanDerWaalsContact O-N 3.1Å; R710-K712 PolarHBondContact O-N 2.85Å; K712-V715 WeakPolarHBondContact O-CG2 3.44Å
713	L	45.6	Very low	53.2	Low	142 Å²	142	101.4 Å²	101.4	74%	0.743	58%	0.575	S	S	*	*	H	α-helix	trans	-88.5	-32.8	173.8	-90.5	153	0	0	0	112.1	L709 R710 V715	L709-L713 WeakPolarHBondContact O-CB 3.47Å; L709-L713 PolarHBondContact O-N 2.98Å; R710-L713 CarbonylContact O-C 3.58Å; R710-L713 WeakPolarHBondContact O-CA 3.35Å; R710-L713 PolarHBondContact O-N 2.86Å; L713-V715 PolarHBondContact O-N 2.97Å
714	D	41	Very low	52.3	Low	106 Å²	106	102 Å²	102	57%	0.567	58%	0.579	S	S	*	*	S	Bend	trans	-71.8	57.4	167.6	-74.4	-43.4	0	0	0	110.6	R710 P716	R710-D714 WeakPolarHBondContact O-CB 3.49Å; R710-D714 PolarHBondContact O-N 2.96Å; D714-P716 VanDerWaalsContact O-CD 3.31Å; D714-P716 WeakPolarHBondContact O-CD 3.27Å
715	V	39.7	Very low	51.2	Low	97 Å²	97	99.7 Å²	99.7	59%	0.588	58%	0.577	S	S	*	*			trans	-66	121.2	171	175.8	0	0	0	0	108.9	K712 L713 G717	K712-V715 WeakPolarHBondContact O-CG2 3.44Å; L713-V715 PolarHBondContact O-N 2.97Å; V715-G717 PolarHBondContact O-N 3.47Å
716	P	48.7	Very low	50.3	Low	133 Å²	133	98.9 Å²	98.9	86%	0.864	58%	0.581	S	S	*	*	S	Bend	trans	-67.6	100.9	175.3	-19.1	33.2	0	0	0	111.1	D714	D714-P716 VanDerWaalsContact O-CD 3.31Å; D714-P716 WeakPolarHBondContact O-CD 3.27Å
717	G	46.3	Very low	49.8	Very low	60 Å²	60	97.5 Å²	97.5	62%	0.619	57%	0.574	S	S	*	*	S	Bend	trans	85.2	76.1	164.5	0	0	0	0	0	116.8	V715	V715-G717 PolarHBondContact O-N 3.47Å
718	S	44.3	Very low	49.6	Very low	88 Å²	88	102.6 Å²	102.6	62%	0.615	59%	0.585	S	S	*	*	S	Bend	trans	-109.5	-42.7	158.7	-176.7	0	0	0	0	112.5	G720 A721 L722	S718-G720 PolarHBondContact O-N 3.44Å; S718-A721 WeakPolarHBondContact O-CB 3.06Å; S718-A721 PolarHBondContact O-N 3.31Å; S718-L722 PolarHBondContact O-N 3.47Å
719	A	40.9	Very low	49.4	Very low	80 Å²	80	105.1 Å²	105.1	66%	0.661	60%	0.596	S	S	*	*	H	α-helix	trans	-53.3	-40.1	170.9	0	0	0	0	0	112	A721 L722 T723	A719-A721 VanDerWaalsContact C-N 3.28Å; A719-A721 PolarHBondContact O-N 2.81Å; A719-L722 PolarHBondContact O-N 3.45Å; A719-T723 WeakPolarHBondContact O-CG2 3.5Å; A719-T723 PolarHBondContact O-N 3.3Å; A719-T723 PolarHBondContact O-OG1 2.93Å
720	G	44.6	Very low	49.4	Very low	35 Å²	35	105.3 Å²	105.3	36%	0.361	60%	0.597	S	S	.	*	H	α-helix	trans	-61.7	-28.9	175	0	0	0	0	0	114.6	S718 T723 T724	S718-G720 PolarHBondContact O-N 3.44Å; G720-T723 WeakPolarHBondContact CA-OG1 3.42Å; G720-T723 PolarHBondContact O-OG1 3.01Å; G720-T724 VanDerWaalsContact O-CB 3.27Å; G720-T724 WeakPolarHBondContact O-CB 3.48Å; G720-T724 VanDerWaalsContact O-CG2 3.24Å; G720-T724 WeakPolarHBondContact O-CG2 3.34Å; G720-T724 PolarHBondContact O-N 2.89Å; G720-T724 PolarHBondContact O-OG1 3.43Å
721	A	43.9	Very low	50.1	Low	59 Å²	59	102 Å²	102	49%	0.488	59%	0.589	S	S	.	*	H	α-helix	trans	-74.1	-42.1	176.7	0	0	0	0	0	111.2	S718 A719 T724 A725	S718-A721 WeakPolarHBondContact O-CB 3.06Å; S718-A721 PolarHBondContact O-N 3.31Å; A719-A721 VanDerWaalsContact C-N 3.28Å; A719-A721 PolarHBondContact O-N 2.81Å; A721-T724 PolarHBondContact O-OG1 3.31Å; A721-A725 VanDerWaalsContact O-CB 3.27Å; A721-A725 WeakPolarHBondContact O-CB 3.13Å; A721-A725 PolarHBondContact O-N 2.94Å
722	L	43.5	Very low	50.6	Low	141 Å²	141	99.9 Å²	99.9	74%	0.738	58%	0.577	S	S	*	*	H	α-helix	trans	-69.1	-41.5	176.1	-133.1	76.3	0	0	0	111.7	S718 A719 A725 A726	S718-L722 PolarHBondContact O-N 3.47Å; A719-L722 PolarHBondContact O-N 3.45Å; L722-A725 PolarHBondContact O-N 2.91Å; L722-A726 WeakPolarHBondContact O-CB 3.47Å; L722-A726 PolarHBondContact O-N 3Å
723	T	50.3	Low	51.2	Low	76 Å²	76	94.3 Å²	94.3	47%	0.466	56%	0.564	S	S	.	*	H	α-helix	trans	-69.1	-39.6	175.9	61.8	0	0	0	0	112.1	A719 G720 A726 D727	A719-T723 WeakPolarHBondContact O-CG2 3.5Å; A719-T723 PolarHBondContact O-N 3.3Å; A719-T723 PolarHBondContact O-OG1 2.93Å; G720-T723 WeakPolarHBondContact CA-OG1 3.42Å; G720-T723 PolarHBondContact O-OG1 3.01Å; T723-A726 CarbonylContact O-C 3.6Å; T723-A726 PolarHBondContact O-N 2.93Å; T723-D727 WeakPolarHBondContact O-CB 3.22Å; T723-D727 VanDerWaalsContact O-CG 3.31Å; T723-D727 PolarHBondContact O-N 2.82Å
724	T	51.2	Low	52.1	Low	86 Å²	86	91.5 Å²	91.5	53%	0.528	55%	0.548	S	S	.	.	H	α-helix	trans	-71.3	-28.7	175.4	54.3	0	0	0	0	113.1	G720 A721 R728	G720-T724 VanDerWaalsContact O-CB 3.27Å; G720-T724 WeakPolarHBondContact O-CB 3.48Å; G720-T724 VanDerWaalsContact O-CG2 3.24Å; G720-T724 WeakPolarHBondContact O-CG2 3.34Å; G720-T724 PolarHBondContact O-N 2.89Å; G720-T724 PolarHBondContact O-OG1 3.43Å; A721-T724 PolarHBondContact O-OG1 3.31Å; T724-R728 WeakPolarHBondContact O-CB 3.39Å; T724-R728 PolarHBondContact O-N 3.44Å
725	A	50	Low	53.1	Low	52 Å²	52	93.3 Å²	93.3	43%	0.43	55%	0.547	S	S	.	.	H	α-helix	trans	-65.9	-41.8	168.7	0	0	0	0	0	111.6	A721 L722 K729	A721-A725 VanDerWaalsContact O-CB 3.27Å; A721-A725 WeakPolarHBondContact O-CB 3.13Å; A721-A725 PolarHBondContact O-N 2.94Å; L722-A725 PolarHBondContact O-N 2.91Å; A725-K729 PolarHBondContact O-N 2.86Å
726	A	51.8	Low	54.3	Low	58 Å²	58	93.7 Å²	93.7	48%	0.479	55%	0.545	S	S	.	.	H	α-helix	trans	-65.9	-48.9	174.2	0	0	0	0	0	112.1	L722 T723 R728 K729 L730	L722-A726 WeakPolarHBondContact O-CB 3.47Å; L722-A726 PolarHBondContact O-N 3Å; T723-A726 CarbonylContact O-C 3.6Å; T723-A726 PolarHBondContact O-N 2.93Å; A726-R728 VanDerWaalsContact C-N 3.3Å; A726-R728 PolarHBondContact O-N 3.19Å; A726-K729 CarbonylContact O-C 3.55Å; A726-K729 PolarHBondContact O-N 3.35Å; A726-L730 VanDerWaalsContact O-CB 3.29Å; A726-L730 WeakPolarHBondContact O-CB 3.39Å; A726-L730 PolarHBondContact O-N 2.95Å
727	D	55.6	Low	54.8	Low	86 Å²	86	91.2 Å²	91.2	46%	0.46	52%	0.524	S	S	.	.	H	α-helix	trans	-63.2	-33.9	176.9	-73.1	-36.7	0	0	0	111.8	T723 L730 Q731	T723-D727 WeakPolarHBondContact O-CB 3.22Å; T723-D727 VanDerWaalsContact O-CG 3.31Å; T723-D727 PolarHBondContact O-N 2.82Å; D727-L730 PolarHBondContact O-N 3.2Å; D727-Q731 WeakPolarHBondContact O-CB 3.49Å; D727-Q731 WeakPolarHBondContact O-CG 3.49Å; D727-Q731 PolarHBondContact O-N 3.25Å
728	R	64.9	Low	55.9	Low	182 Å²	182	96.4 Å²	96.4	69%	0.687	53%	0.525	S	S	*	.	H	α-helix	trans	-69.1	-46.1	173.7	-177.7	171.8	177.2	154.9	-0.9	111.3	T724 A726 L730 Q731 E732	T724-R728 WeakPolarHBondContact O-CB 3.39Å; T724-R728 PolarHBondContact O-N 3.44Å; A726-R728 VanDerWaalsContact C-N 3.3Å; A726-R728 PolarHBondContact O-N 3.19Å; R728-L730 VanDerWaalsContact C-N 3.27Å; R728-L730 PolarHBondContact O-N 3.32Å; R728-Q731 PolarHBondContact O-N 3.33Å; R728-E732 VanDerWaalsContact O-CB 3.26Å; R728-E732 WeakPolarHBondContact O-CB 3.5Å; R728-E732 PolarHBondContact O-N 2.82Å
729	K	62.8	Low	56.7	Low	160 Å²	160	96.8 Å²	96.8	70%	0.696	52%	0.517	S	S	*	.	H	α-helix	trans	-63.5	-32.6	172.3	-78.6	-170.2	173.4	-173.5	0	112.3	A725 A726 E732 G733	A725-K729 PolarHBondContact O-N 2.86Å; A726-K729 CarbonylContact O-C 3.55Å; A726-K729 PolarHBondContact O-N 3.35Å; K729-E732 PolarHBondContact O-N 3.3Å; K729-G733 PolarHBondContact O-N 2.99Å
730	L	61	Low	57.7	Low	99 Å²	99	98.1 Å²	98.1	52%	0.518	51%	0.513	S	S	.	.	H	α-helix	trans	-69.9	-44.1	174.6	-175.2	62.6	0	0	0	111.4	A726 D727 R728 E732 G733 Q734	A726-L730 VanDerWaalsContact O-CB 3.29Å; A726-L730 WeakPolarHBondContact O-CB 3.39Å; A726-L730 PolarHBondContact O-N 2.95Å; D727-L730 PolarHBondContact O-N 3.2Å; R728-L730 VanDerWaalsContact C-N 3.27Å; R728-L730 PolarHBondContact O-N 3.32Å; L730-E732 VanDerWaalsContact C-N 3.31Å; L730-E732 PolarHBondContact O-N 3.09Å; L730-G733 PolarHBondContact O-N 3.38Å; L730-Q734 WeakPolarHBondContact O-CB 3.26Å; L730-Q734 VanDerWaalsContact O-CG 3.24Å; L730-Q734 WeakPolarHBondContact O-CG 3.43Å; L730-Q734 PolarHBondContact O-N 3.33Å
731	Q	64.6	Low	58.6	Low	101 Å²	101	101.6 Å²	101.6	47%	0.472	52%	0.515	S	S	.	.	H	α-helix	trans	-61.9	-38.4	170.8	-80.6	-164.2	8.5	0	0	112.3	D727 R728 Q734 R735	D727-Q731 WeakPolarHBondContact O-CB 3.49Å; D727-Q731 WeakPolarHBondContact O-CG 3.49Å; D727-Q731 PolarHBondContact O-N 3.25Å; R728-Q731 PolarHBondContact O-N 3.33Å; Q731-Q734 PolarHBondContact O-N 3.36Å; Q731-R735 WeakPolarHBondContact O-CB 3.3Å; Q731-R735 WeakPolarHBondContact O-CG 3.47Å; Q731-R735 PolarHBondContact O-N 2.74Å
732	E	62.7	Low	59.7	Low	99 Å²	99	103.5 Å²	103.5	46%	0.463	52%	0.516	S	S	.	.	H	α-helix	trans	-68.2	-45.1	178.6	-168.5	157.5	-126.4	0	0	111	R728 K729 L730 Q734 R735 N736	R728-E732 VanDerWaalsContact O-CB 3.26Å; R728-E732 WeakPolarHBondContact O-CB 3.5Å; R728-E732 PolarHBondContact O-N 2.82Å; K729-E732 PolarHBondContact O-N 3.3Å; L730-E732 VanDerWaalsContact C-N 3.31Å; L730-E732 PolarHBondContact O-N 3.09Å; E732-Q734 VanDerWaalsContact C-N 3.34Å; E732-Q734 PolarHBondContact O-N 2.93Å; E732-R735 PolarHBondContact O-N 3.25Å; E732-N736 WeakPolarHBondContact O-CB 3.46Å; E732-N736 PolarHBondContact O-N 2.93Å; E732-N736 PolarHBondContact O-ND2 2.78Å; E732-N736 PolarHBondContact O-OD1 2.98Å
733	G	62	Low	60.4	Low	40 Å²	40	100.5 Å²	100.5	41%	0.412	50%	0.501	S	S	.	.	H	α-helix	trans	-58.2	-42.2	168.6	0	0	0	0	0	112.8	K729 L730 N736 L737	K729-G733 PolarHBondContact O-N 2.99Å; L730-G733 PolarHBondContact O-N 3.38Å; G733-N736 PolarHBondContact O-N 3.45Å; G733-L737 VanDerWaalsContact O-CB 3.29Å; G733-L737 WeakPolarHBondContact O-CB 3.37Å; G733-L737 PolarHBondContact O-N 3.3Å
734	Q	64.6	Low	61	Low	84 Å²	84	102.1 Å²	102.1	39%	0.393	51%	0.506	S	S	.	.	H	α-helix	trans	-67	-35.1	174.6	-74.8	176.7	8.8	0	0	113.1	L730 Q731 E732 R738	L730-Q734 WeakPolarHBondContact O-CB 3.26Å; L730-Q734 VanDerWaalsContact O-CG 3.24Å; L730-Q734 WeakPolarHBondContact O-CG 3.43Å; L730-Q734 PolarHBondContact O-N 3.33Å; Q731-Q734 PolarHBondContact O-N 3.36Å; E732-Q734 VanDerWaalsContact C-N 3.34Å; E732-Q734 PolarHBondContact O-N 2.93Å; Q734-R738 WeakPolarHBondContact O-CB 3.49Å; Q734-R738 WeakPolarHBondContact O-CG 3.43Å; Q734-R738 PolarHBondContact O-N 3.19Å
735	R	62.8	Low	61.8	Low	144 Å²	144	104.5 Å²	104.5	54%	0.543	51%	0.511	S	S	.	.	H	α-helix	trans	-66.3	-47	172	-76.8	-179.5	-171.4	101.9	10.1	110.6	Q731 E732 L737 R738 Q739	Q731-R735 WeakPolarHBondContact O-CB 3.3Å; Q731-R735 WeakPolarHBondContact O-CG 3.47Å; Q731-R735 PolarHBondContact O-N 2.74Å; E732-R735 PolarHBondContact O-N 3.25Å; R735-L737 VanDerWaalsContact C-N 3.34Å; R735-L737 PolarHBondContact O-N 3.48Å; R735-R738 PolarHBondContact O-N 3.42Å; R735-R738 VanDerWaalsContact O-N 3.16Å; R735-Q739 PolarHBondContact O-N 2.97Å
736	N	62.9	Low	62.4	Low	105 Å²	105	108.1 Å²	108.1	56%	0.561	52%	0.517	S	S	*	.	H	α-helix	trans	-63.1	-39.9	178.6	-65.5	-10.4	0	0	0	111.5	E732 G733 Q739 L740	E732-N736 WeakPolarHBondContact O-CB 3.46Å; E732-N736 PolarHBondContact O-N 2.93Å; E732-N736 PolarHBondContact O-ND2 2.78Å; E732-N736 PolarHBondContact O-OD1 2.98Å; G733-N736 PolarHBondContact O-N 3.45Å; N736-Q739 PolarHBondContact O-N 2.84Å; N736-L740 WeakPolarHBondContact O-CB 3.32Å; N736-L740 PolarHBondContact O-N 2.67Å
737	L	61.1	Low	62.8	Low	81 Å²	81	110.6 Å²	110.6	42%	0.424	52%	0.522	S	S	.	.	H	α-helix	trans	-65.8	-37.6	174.2	-171.8	68.3	0	0	0	112.4	G733 R735 R741	G733-L737 VanDerWaalsContact O-CB 3.29Å; G733-L737 WeakPolarHBondContact O-CB 3.37Å; G733-L737 PolarHBondContact O-N 3.3Å; R735-L737 VanDerWaalsContact C-N 3.34Å; R735-L737 PolarHBondContact O-N 3.48Å; L737-R741 WeakPolarHBondContact O-CB 3.46Å; L737-R741 VanDerWaalsContact O-CG 3.24Å; L737-R741 WeakPolarHBondContact O-CG 3.39Å; L737-R741 PolarHBondContact O-N 2.95Å
738	R	68.2	Low	63.1	Low	169 Å²	169	107.5 Å²	107.5	64%	0.638	51%	0.51	S	S	*	.	H	α-helix	trans	-67.8	-39.3	173.3	-73.2	170.3	-169.2	-157.8	4.5	112	Q734 R735 R741 L742	Q734-R738 WeakPolarHBondContact O-CB 3.49Å; Q734-R738 WeakPolarHBondContact O-CG 3.43Å; Q734-R738 PolarHBondContact O-N 3.19Å; R735-R738 PolarHBondContact O-N 3.42Å; R735-R738 VanDerWaalsContact O-N 3.16Å; R738-R741 PolarHBondContact O-N 3.48Å; R738-L742 WeakPolarHBondContact O-CG 3.33Å; R738-L742 PolarHBondContact O-N 2.96Å
739	Q	61.7	Low	63.2	Low	96 Å²	96	102.9 Å²	102.9	45%	0.449	50%	0.502	S	S	.	.	H	α-helix	trans	-63.1	-49.6	174.7	-176.6	56.3	48.7	0	0	110.7	R735 N736 R741 L742 D743	R735-Q739 PolarHBondContact O-N 2.97Å; N736-Q739 PolarHBondContact O-N 2.84Å; Q739-R741 VanDerWaalsContact C-N 3.25Å; Q739-R741 PolarHBondContact O-N 3.34Å; Q739-L742 WeakPolarHBondContact O-CA 3.19Å; Q739-L742 WeakPolarHBondContact O-CB 3.34Å; Q739-L742 PolarHBondContact O-N 3.34Å; Q739-D743 VanDerWaalsContact NE2-CG 3.29Å; Q739-D743 PolarHBondContact NE2-OD1 3.48Å; Q739-D743 PolarHBondContact NE2-OD2 2.95Å; Q739-D743 PolarHBondContact O-N 2.88Å
740	L	60.8	Low	62.7	Low	107 Å²	107	99.5 Å²	99.5	56%	0.56	49%	0.492	S	S	*	.	H	α-helix	trans	-60.1	-34.5	177.6	-158.9	74.9	0	0	0	112.5	N736 L744	N736-L740 WeakPolarHBondContact O-CB 3.32Å; N736-L740 PolarHBondContact O-N 2.67Å; L740-L744 WeakPolarHBondContact O-CB 3.27Å; L740-L744 WeakPolarHBondContact O-CG 3.47Å; L740-L744 PolarHBondContact O-N 2.97Å
741	R	63.4	Low	62.5	Low	109 Å²	109	99.5 Å²	99.5	41%	0.411	49%	0.492	S	S	.	.	H	α-helix	trans	-66.8	-40.8	171.9	-75.5	172	-177	-160.1	-1.1	112.7	L737 R738 Q739 Q745 N782	L737-R741 WeakPolarHBondContact O-CB 3.46Å; L737-R741 VanDerWaalsContact O-CG 3.24Å; L737-R741 WeakPolarHBondContact O-CG 3.39Å; L737-R741 PolarHBondContact O-N 2.95Å; R738-R741 PolarHBondContact O-N 3.48Å; Q739-R741 VanDerWaalsContact C-N 3.25Å; Q739-R741 PolarHBondContact O-N 3.34Å; R741-Q745 WeakPolarHBondContact O-CB 3.42Å; R741-Q745 PolarHBondContact O-N 2.81Å; R741-N782 PolarHBondContact NH1-OD1 2.67Å; R741-N782 PolarHBondContact NH2-OD1 2.82Å
742	L	67.4	Low	62	Low	99 Å²	99	99.7 Å²	99.7	52%	0.518	49%	0.493	S	S	.	.	H	α-helix	trans	-65.3	-41.2	174.2	-74	170.2	0	0	0	111.7	R738 Q739 Q745 K746	R738-L742 WeakPolarHBondContact O-CG 3.33Å; R738-L742 PolarHBondContact O-N 2.96Å; Q739-L742 WeakPolarHBondContact O-CA 3.19Å; Q739-L742 WeakPolarHBondContact O-CB 3.34Å; Q739-L742 PolarHBondContact O-N 3.34Å; L742-Q745 PolarHBondContact O-N 2.84Å; L742-K746 VanDerWaalsContact O-CB 3.31Å; L742-K746 WeakPolarHBondContact O-CB 3.24Å; L742-K746 PolarHBondContact O-N 2.69Å
743	D	58.8	Low	61.6	Low	77 Å²	77	98.6 Å²	98.6	41%	0.412	50%	0.496	S	S	.	.	H	α-helix	trans	-69.3	-37.3	178.5	-66.7	-42.6	0	0	0	111.9	Q739 L747	Q739-D743 VanDerWaalsContact NE2-CG 3.29Å; Q739-D743 PolarHBondContact NE2-OD1 3.48Å; Q739-D743 PolarHBondContact NE2-OD2 2.95Å; Q739-D743 PolarHBondContact O-N 2.88Å; D743-L747 VanDerWaalsContact O-CB 3.31Å; D743-L747 WeakPolarHBondContact O-CB 3.44Å; D743-L747 PolarHBondContact O-N 3.24Å
744	L	62.9	Low	61	Low	110 Å²	110	98.6 Å²	98.6	58%	0.576	50%	0.496	S	S	*	.	H	α-helix	trans	-63.6	-45.5	169.4	-87.8	164.8	0	0	0	112.5	L740 K746 L747 G748	L740-L744 WeakPolarHBondContact O-CB 3.27Å; L740-L744 WeakPolarHBondContact O-CG 3.47Å; L740-L744 PolarHBondContact O-N 2.97Å; L744-K746 VanDerWaalsContact C-N 3.32Å; L744-K746 PolarHBondContact O-N 2.72Å; L744-L747 PolarHBondContact O-N 3.14Å; L744-G748 PolarHBondContact O-N 3.02Å
745	Q	67.8	Low	60	Low	136 Å²	136	98.8 Å²	98.8	64%	0.636	50%	0.497	S	S	*	.	H	α-helix	trans	-62.9	-41.4	178.2	-172.1	177.6	24	0	0	111.2	R741 L742 G748 V749	R741-Q745 WeakPolarHBondContact O-CB 3.42Å; R741-Q745 PolarHBondContact O-N 2.81Å; L742-Q745 PolarHBondContact O-N 2.84Å; Q745-G748 PolarHBondContact O-N 2.92Å; Q745-V749 WeakPolarHBondContact O-CG2 3.47Å; Q745-V749 PolarHBondContact O-N 3.24Å; Q745-V749 VanDerWaalsContact O-N 3.07Å
746	K	62.7	Low	59.5	Low	128 Å²	128	101.5 Å²	101.5	56%	0.557	51%	0.507	S	S	*	.	H	α-helix	trans	-61.8	-48.2	173.1	-179.2	-173.8	169.9	-167.3	0	111.4	L742 L744 G748 V749 D750	L742-K746 VanDerWaalsContact O-CB 3.31Å; L742-K746 WeakPolarHBondContact O-CB 3.24Å; L742-K746 PolarHBondContact O-N 2.69Å; L744-K746 VanDerWaalsContact C-N 3.32Å; L744-K746 PolarHBondContact O-N 2.72Å; K746-G748 PolarHBondContact O-N 3.35Å; K746-V749 PolarHBondContact O-N 3.16Å; K746-D750 PolarHBondContact O-N 2.85Å
747	L	60.1	Low	58.9	Low	110 Å²	110	100.5 Å²	100.5	58%	0.576	51%	0.514	S	S	*	.	H	α-helix	trans	-58	-39.2	177.3	-172.8	68.1	0	0	0	111.3	D743 L744 D750 L751	D743-L747 VanDerWaalsContact O-CB 3.31Å; D743-L747 WeakPolarHBondContact O-CB 3.44Å; D743-L747 PolarHBondContact O-N 3.24Å; L744-L747 PolarHBondContact O-N 3.14Å; L747-D750 PolarHBondContact O-N 3.14Å; L747-L751 VanDerWaalsContact O-CB 3.29Å; L747-L751 WeakPolarHBondContact O-CB 3.47Å; L747-L751 PolarHBondContact O-N 2.94Å
748	G	61.8	Low	58.2	Low	21 Å²	21	101.2 Å²	101.2	22%	0.216	52%	0.524	C	S	.	.	H	α-helix	trans	-62.9	-40.3	173.3	0	0	0	0	0	113.6	L744 Q745 K746 L751 Q752	L744-G748 PolarHBondContact O-N 3.02Å; Q745-G748 PolarHBondContact O-N 2.92Å; K746-G748 PolarHBondContact O-N 3.35Å; G748-L751 PolarHBondContact O-N 3.49Å; G748-Q752 WeakPolarHBondContact O-CG 3.48Å; G748-Q752 PolarHBondContact O-N 2.89Å
749	V	67.2	Low	57.2	Low	86 Å²	86	99 Å²	99	52%	0.521	53%	0.533	S	S	.	.	H	α-helix	trans	-68.8	-42.7	174.9	172.1	0	0	0	0	111.6	Q745 K746 L751 Q752 S753	Q745-V749 WeakPolarHBondContact O-CG2 3.47Å; Q745-V749 PolarHBondContact O-N 3.24Å; Q745-V749 VanDerWaalsContact O-N 3.07Å; K746-V749 PolarHBondContact O-N 3.16Å; V749-L751 VanDerWaalsContact C-N 3.29Å; V749-L751 PolarHBondContact O-N 3.48Å; V749-Q752 PolarHBondContact O-N 3.46Å; V749-S753 WeakPolarHBondContact O-CB 3.42Å; V749-S753 PolarHBondContact O-N 2.95Å
750	D	53.5	Low	56.7	Low	89 Å²	89	105.3 Å²	105.3	48%	0.476	55%	0.553	S	S	.	*	H	α-helix	trans	-62.3	-38.1	175.5	-71.2	-27.1	0	0	0	110.7	K746 L747 S753 G754	K746-D750 PolarHBondContact O-N 2.85Å; L747-D750 PolarHBondContact O-N 3.14Å; D750-S753 WeakPolarHBondContact O-CB 3.25Å; D750-S753 PolarHBondContact O-N 3.23Å; D750-G754 PolarHBondContact O-N 3.45Å
751	L	54.8	Low	56.1	Low	98 Å²	98	107.2 Å²	107.2	51%	0.513	56%	0.563	S	S	.	*	H	α-helix	trans	-68.6	-42.8	175.3	-153.9	77.7	0	0	0	112.5	L747 G748 V749 S753 G754 E755 L767	L747-L751 VanDerWaalsContact O-CB 3.29Å; L747-L751 WeakPolarHBondContact O-CB 3.47Å; L747-L751 PolarHBondContact O-N 2.94Å; G748-L751 PolarHBondContact O-N 3.49Å; V749-L751 VanDerWaalsContact C-N 3.29Å; V749-L751 PolarHBondContact O-N 3.48Å; L751-S753 VanDerWaalsContact C-N 3.26Å; L751-S753 PolarHBondContact O-N 2.87Å; L751-G754 PolarHBondContact O-N 2.88Å; L751-E755 PolarHBondContact O-N 3.03Å; L751-L767 HydrophobicContact CD2-CD2 3.68Å
752	Q	55.3	Low	55.7	Low	106 Å²	106	107.7 Å²	107.7	50%	0.495	58%	0.579	S	S	.	*	H	α-helix	trans	-64.6	-30.4	172.8	-75	-179.9	14.5	0	0	112.5	G748 V749 R756	G748-Q752 WeakPolarHBondContact O-CG 3.48Å; G748-Q752 PolarHBondContact O-N 2.89Å; V749-Q752 PolarHBondContact O-N 3.46Å; Q752-R756 WeakPolarHBondContact O-CG 3.49Å; Q752-R756 PolarHBondContact O-N 3.38Å
753	S	53.3	Low	55.2	Low	76 Å²	76	105.3 Å²	105.3	53%	0.531	58%	0.578	S	S	.	*	H	α-helix	trans	-66.5	-45.2	172.3	-164.5	0	0	0	0	110.6	V749 D750 L751 R756	V749-S753 WeakPolarHBondContact O-CB 3.42Å; V749-S753 PolarHBondContact O-N 2.95Å; D750-S753 WeakPolarHBondContact O-CB 3.25Å; D750-S753 PolarHBondContact O-N 3.23Å; L751-S753 VanDerWaalsContact C-N 3.26Å; L751-S753 PolarHBondContact O-N 2.87Å; S753-R756 PolarHBondContact O-N 3.23Å
754	G	49.7	Very low	55	Low	39 Å²	39	102.7 Å²	102.7	40%	0.402	57%	0.569	S	S	.	*	H	α-helix	trans	-62	-40.5	172.7	0	0	0	0	0	113.9	D750 L751 R756 A757 C758	D750-G754 PolarHBondContact O-N 3.45Å; L751-G754 PolarHBondContact O-N 2.88Å; G754-R756 VanDerWaalsContact C-N 3.32Å; G754-R756 PolarHBondContact O-N 2.91Å; G754-A757 WeakPolarHBondContact O-CB 3.38Å; G754-A757 PolarHBondContact O-N 3.2Å; G754-A757 VanDerWaalsContact O-N 3.07Å; G754-C758 PolarHBondContact O-N 2.66Å
755	E	44	Very low	54.5	Low	88 Å²	88	103.2 Å²	103.2	41%	0.411	57%	0.568	S	S	.	*	H	α-helix	trans	-62.6	-37	179	-169.1	175.8	-164.5	0	0	111.8	L751 A757 C758 R768	L751-E755 PolarHBondContact O-N 3.03Å; E755-A757 PolarHBondContact O-N 3.33Å; E755-C758 CarbonylContact O-C 3.5Å; E755-C758 PolarHBondContact O-N 2.91Å; E755-R768 IonicContact OE1-CZ 3.26Å; E755-R768 IonicContact OE1-NH1 2.66Å; E755-R768 PolarHBondContact OE1-NH1 3.04Å; E755-R768 IonicContact OE2-NH1 2.96Å; E755-R768 PolarHBondContact OE2-NH1 3.09Å
756	R	52.1	Low	53.9	Low	201 Å²	201	106.4 Å²	106.4	76%	0.758	57%	0.574	S	S	*	*	H	α-helix	trans	-64.1	-21	175.4	-67.8	177.2	-153.2	178.2	7.7	113.8	Q752 S753 G754	Q752-R756 WeakPolarHBondContact O-CG 3.49Å; Q752-R756 PolarHBondContact O-N 3.38Å; S753-R756 PolarHBondContact O-N 3.23Å; G754-R756 VanDerWaalsContact C-N 3.32Å; G754-R756 PolarHBondContact O-N 2.91Å
757	A	50.8	Low	53.5	Low	85 Å²	85	104.9 Å²	104.9	70%	0.702	57%	0.572	S	S	*	*	H	α-helix	trans	-85.5	-13.1	174.2	0	0	0	0	0	113.3	G754 E755	G754-A757 WeakPolarHBondContact O-CB 3.38Å; G754-A757 PolarHBondContact O-N 3.2Å; G754-A757 VanDerWaalsContact O-N 3.07Å; E755-A757 PolarHBondContact O-N 3.33Å
758	C	45.4	Very low	53.5	Low	96 Å²	96	105.4 Å²	105.4	65%	0.649	57%	0.566	S	S	*	*	S	Bend	trans	-117.8	89.3	-177.2	-80.8	0	0	0	0	112	G754 E755 R760	G754-C758 PolarHBondContact O-N 2.66Å; E755-C758 CarbonylContact O-C 3.5Å; E755-C758 PolarHBondContact O-N 2.91Å; C758-R760 PolarHBondContact O-N 3.44Å
759	C	47.5	Very low	53.4	Low	121 Å²	121	111.3 Å²	111.3	82%	0.818	59%	0.588	S	S	*	*			trans	-61.8	109	175.8	-75.6	0	0	0	0	113.1
760	R	51.1	Low	52.9	Low	230 Å²	230	111.8 Å²	111.8	87%	0.868	59%	0.591	S	S	*	*			trans	55.2	94	153.1	-59.3	-179	178.1	-175.2	-1.8	117.1	C758	C758-R760 PolarHBondContact O-N 3.44Å
761	N	48.7	Very low	53.3	Low	147 Å²	147	111.8 Å²	111.8	79%	0.786	59%	0.591	S	S	*	*			trans	-159.7	119.1	137.4	-103.3	-33.8	0	0	0	112.1	G763	N761-G763 VanDerWaalsContact C-N 3.26Å; N761-G763 PolarHBondContact O-N 2.93Å
762	T	55.2	Low	53.9	Low	119 Å²	119	109.6 Å²	109.6	73%	0.73	59%	0.587	S	S	*	*	S	Bend	trans	35.6	-21.4	156	55.9	0	0	0	0	123.9
763	G	56.1	Low	54.1	Low	48 Å²	48	107 Å²	107	50%	0.495	58%	0.584	S	S	.	*	H	α-helix	trans	-75.7	-38.7	177.3	0	0	0	0	0	113.7	N761 E765 R766 L767	N761-G763 VanDerWaalsContact C-N 3.26Å; N761-G763 PolarHBondContact O-N 2.93Å; G763-E765 VanDerWaalsContact C-N 3.34Å; G763-E765 PolarHBondContact O-N 3.46Å; G763-R766 PolarHBondContact O-N 3.5Å; G763-L767 PolarHBondContact O-N 3.17Å
764	G	55	Low	54.3	Low	22 Å²	22	105.8 Å²	105.8	23%	0.227	58%	0.578	C	S	.	*	H	α-helix	trans	-63.7	-31.3	-172.4	0	0	0	0	0	114.8	L767 R768	G764-L767 PolarHBondContact O-N 3.02Å; G764-R768 WeakPolarHBondContact O-CB 3.42Å; G764-R768 WeakPolarHBondContact O-CG 3.5Å; G764-R768 PolarHBondContact O-N 3.14Å
765	E	53.4	Low	55.1	Low	121 Å²	121	108.9 Å²	108.9	57%	0.565	59%	0.585	S	S	*	*	H	α-helix	trans	-71.5	-44.4	179.1	-72.1	179.7	147.8	0	0	112.4	G763 L767 R768 H769	G763-E765 VanDerWaalsContact C-N 3.34Å; G763-E765 PolarHBondContact O-N 3.46Å; E765-L767 VanDerWaalsContact C-N 3.26Å; E765-L767 PolarHBondContact O-N 3.33Å; E765-R768 PolarHBondContact O-N 3.05Å; E765-H769 PolarHBondContact O-CD2 3.25Å; E765-H769 PolarHBondContact O-N 3.12Å
766	R	53.9	Low	56.2	Low	203 Å²	203	109.3 Å²	109.3	77%	0.766	59%	0.591	S	S	*	*	H	α-helix	trans	-60	-42.2	173.3	-59.9	-171.4	80.8	-169.2	7.7	110.2	G763 H769 T770	G763-R766 PolarHBondContact O-N 3.5Å; R766-H769 PolarHBondContact O-N 3.19Å; R766-T770 PolarHBondContact O-N 2.7Å; R766-T770 PolarHBondContact O-OG1 3.02Å
767	L	55.3	Low	56.7	Low	96 Å²	96	103.2 Å²	103.2	50%	0.503	58%	0.575	S	S	.	*	H	α-helix	trans	-64.6	-40.7	177.9	-149.8	77.1	0	0	0	112.6	L751 G763 G764 E765 T770 L771	L751-L767 HydrophobicContact CD2-CD2 3.68Å; G763-L767 PolarHBondContact O-N 3.17Å; G764-L767 PolarHBondContact O-N 3.02Å; E765-L767 VanDerWaalsContact C-N 3.26Å; E765-L767 PolarHBondContact O-N 3.33Å; L767-T770 PolarHBondContact O-N 3.27Å; L767-L771 WeakPolarHBondContact O-CB 3.44Å; L767-L771 PolarHBondContact O-N 3Å
768	R	58.5	Low	57.4	Low	122 Å²	122	102 Å²	102	46%	0.46	56%	0.559	S	S	.	*	H	α-helix	trans	-60.3	-44.2	172.8	-82.1	-170.5	-72.5	-82.3	7.4	112.4	E755 G764 E765 L771 A772	E755-R768 IonicContact OE1-CZ 3.26Å; E755-R768 IonicContact OE1-NH1 2.66Å; E755-R768 PolarHBondContact OE1-NH1 3.04Å; E755-R768 IonicContact OE2-NH1 2.96Å; E755-R768 PolarHBondContact OE2-NH1 3.09Å; G764-R768 WeakPolarHBondContact O-CB 3.42Å; G764-R768 WeakPolarHBondContact O-CG 3.5Å; G764-R768 PolarHBondContact O-N 3.14Å; E765-R768 PolarHBondContact O-N 3.05Å; R768-L771 PolarHBondContact O-N 3.29Å; R768-A772 WeakPolarHBondContact O-CB 3.33Å; R768-A772 PolarHBondContact O-N 3.28Å
769	H	59.8	Low	58.5	Low	145 Å²	145	100 Å²	100	67%	0.671	55%	0.549	S	S	*	.	H	α-helix	trans	-64.2	-41.3	176	-78	-68.3	0	0	0	112.3	E765 R766 A773	E765-H769 PolarHBondContact O-CD2 3.25Å; E765-H769 PolarHBondContact O-N 3.12Å; R766-H769 PolarHBondContact O-N 3.19Å; H769-A773 VanDerWaalsContact O-CB 3.31Å; H769-A773 WeakPolarHBondContact O-CB 3.5Å; H769-A773 PolarHBondContact O-N 2.73Å
770	T	57.3	Low	59.3	Low	96 Å²	96	100.6 Å²	100.6	59%	0.589	54%	0.538	S	S	*	.	H	α-helix	trans	-65.3	-38.8	175.1	-50.9	0	0	0	0	112.1	R766 L767 A774	R766-T770 PolarHBondContact O-N 2.7Å; R766-T770 PolarHBondContact O-OG1 3.02Å; L767-T770 PolarHBondContact O-N 3.27Å; T770-A774 WeakPolarHBondContact O-CB 3.45Å; T770-A774 PolarHBondContact O-N 3.45Å
771	L	62.5	Low	59.9	Low	88 Å²	88	95.3 Å²	95.3	46%	0.461	52%	0.524	S	S	.	.	H	α-helix	trans	-67	-46.3	177.9	-142.1	77.6	0	0	0	111.4	L767 R768 A773 A774 D775	L767-L771 WeakPolarHBondContact O-CB 3.44Å; L767-L771 PolarHBondContact O-N 3Å; R768-L771 PolarHBondContact O-N 3.29Å; L771-A773 VanDerWaalsContact C-N 3.35Å; L771-A773 PolarHBondContact O-N 3Å; L771-A774 WeakPolarHBondContact O-CB 3.4Å; L771-A774 PolarHBondContact O-N 2.86Å; L771-A774 VanDerWaalsContact O-N 3.13Å; L771-D775 PolarHBondContact O-N 3.07Å
772	A	67	Low	60.4	Low	52 Å²	52	91 Å²	91	43%	0.43	50%	0.5	S	S	.	.	H	α-helix	trans	-62.1	-40.6	176.1	0	0	0	0	0	112.3	R768 A774 D775 D776	R768-A772 WeakPolarHBondContact O-CB 3.33Å; R768-A772 PolarHBondContact O-N 3.28Å; A772-A774 VanDerWaalsContact C-N 3.3Å; A772-A774 PolarHBondContact O-N 2.9Å; A772-D775 PolarHBondContact O-N 2.92Å; A772-D776 WeakPolarHBondContact O-CB 3.49Å; A772-D776 PolarHBondContact O-N 3.37Å
773	A	60	Low	61.1	Low	53 Å²	53	90 Å²	90	44%	0.438	49%	0.488	S	S	.	.	H	α-helix	trans	-65.6	-32.6	174.7	0	0	0	0	0	112.7	H769 L771 T777	H769-A773 VanDerWaalsContact O-CB 3.31Å; H769-A773 WeakPolarHBondContact O-CB 3.5Å; H769-A773 PolarHBondContact O-N 2.73Å; L771-A773 VanDerWaalsContact C-N 3.35Å; L771-A773 PolarHBondContact O-N 3Å; A773-T777 WeakPolarHBondContact O-CB 3.49Å; A773-T777 PolarHBondContact O-N 2.77Å; A773-T777 PolarHBondContact O-OG1 3.26Å
774	A	56.9	Low	61.6	Low	49 Å²	49	92.3 Å²	92.3	41%	0.405	49%	0.487	S	S	.	.	H	α-helix	trans	-69.7	-44.3	172.5	0	0	0	0	0	111.6	T770 L771 A772 T777 V778	T770-A774 WeakPolarHBondContact O-CB 3.45Å; T770-A774 PolarHBondContact O-N 3.45Å; L771-A774 WeakPolarHBondContact O-CB 3.4Å; L771-A774 PolarHBondContact O-N 2.86Å; L771-A774 VanDerWaalsContact O-N 3.13Å; A772-A774 VanDerWaalsContact C-N 3.3Å; A772-A774 PolarHBondContact O-N 2.9Å; A774-T777 WeakPolarHBondContact O-CB 3.35Å; A774-T777 PolarHBondContact O-N 2.83Å; A774-V778 WeakPolarHBondContact O-CG2 3.47Å; A774-V778 PolarHBondContact O-N 3.36Å
775	D	67	Low	62.2	Low	105 Å²	105	96 Å²	96	56%	0.561	50%	0.501	S	S	*	.	H	α-helix	trans	-61.5	-43.3	175.5	-75.9	-32.3	0	0	0	111.8	L771 A772 T777 V778 A779	L771-D775 PolarHBondContact O-N 3.07Å; A772-D775 PolarHBondContact O-N 2.92Å; D775-T777 VanDerWaalsContact C-N 3.32Å; D775-T777 PolarHBondContact O-N 3.01Å; D775-V778 PolarHBondContact O-N 2.78Å; D775-A779 WeakPolarHBondContact O-CB 3.48Å; D775-A779 PolarHBondContact O-N 2.89Å
776	D	67.8	Low	62.9	Low	97 Å²	97	95.7 Å²	95.7	52%	0.519	50%	0.501	S	S	.	.	H	α-helix	trans	-60.9	-38.5	172.7	-89.7	-7.3	0	0	0	112.4	A772 A779 K780	A772-D776 WeakPolarHBondContact O-CB 3.49Å; A772-D776 PolarHBondContact O-N 3.37Å; D776-A779 PolarHBondContact O-N 3.1Å; D776-K780 VanDerWaalsContact O-CG 3.3Å; D776-K780 WeakPolarHBondContact O-CG 3.49Å; D776-K780 PolarHBondContact O-N 2.99Å
777	T	60.8	Low	63.5	Low	72 Å²	72	90.2 Å²	90.2	44%	0.442	49%	0.485	S	S	.	.	H	α-helix	trans	-68.9	-41.2	177.3	-59.5	0	0	0	0	110.8	A773 A774 D775 K780 Q781	A773-T777 WeakPolarHBondContact O-CB 3.49Å; A773-T777 PolarHBondContact O-N 2.77Å; A773-T777 PolarHBondContact O-OG1 3.26Å; A774-T777 WeakPolarHBondContact O-CB 3.35Å; A774-T777 PolarHBondContact O-N 2.83Å; D775-T777 VanDerWaalsContact C-N 3.32Å; D775-T777 PolarHBondContact O-N 3.01Å; T777-K780 PolarHBondContact O-N 2.94Å; T777-Q781 WeakPolarHBondContact O-CG 3.31Å; T777-Q781 PolarHBondContact O-N 3.19Å
778	V	66.1	Low	64	Low	59 Å²	59	90.7 Å²	90.7	36%	0.358	49%	0.487	S	S	.	.	H	α-helix	trans	-65.3	-38.3	173.2	169.4	0	0	0	0	110.9	A774 D775 Q781 N782	A774-V778 WeakPolarHBondContact O-CG2 3.47Å; A774-V778 PolarHBondContact O-N 3.36Å; D775-V778 PolarHBondContact O-N 2.78Å; V778-Q781 PolarHBondContact O-N 2.93Å; V778-N782 WeakPolarHBondContact CG1-ND2 3.47Å; V778-N782 PolarHBondContact O-N 3.37Å; V778-N782 PolarHBondContact O-ND2 3.33Å
779	A	67.9	Low	64.4	Low	54 Å²	54	90.7 Å²	90.7	45%	0.446	49%	0.492	S	S	.	.	H	α-helix	trans	-61.3	-48.5	174.5	0	0	0	0	0	111.6	D775 D776 Q781 N782 Q783	D775-A779 WeakPolarHBondContact O-CB 3.48Å; D775-A779 PolarHBondContact O-N 2.89Å; D776-A779 PolarHBondContact O-N 3.1Å; A779-Q781 VanDerWaalsContact C-N 3.35Å; A779-Q781 PolarHBondContact O-N 3.4Å; A779-N782 PolarHBondContact O-N 2.87Å; A779-N782 VanDerWaalsContact O-N 3.17Å; A779-Q783 PolarHBondContact O-N 2.85Å
780	K	66.1	Low	65	Low	134 Å²	134	88.3 Å²	88.3	58%	0.583	48%	0.484	S	S	*	.	H	α-helix	trans	-59.2	-42.5	174.5	-70.5	164.1	-173.7	169.5	0	112.2	D776 T777 N782 Q783 I784	D776-K780 VanDerWaalsContact O-CG 3.3Å; D776-K780 WeakPolarHBondContact O-CG 3.49Å; D776-K780 PolarHBondContact O-N 2.99Å; T777-K780 PolarHBondContact O-N 2.94Å; K780-N782 PolarHBondContact O-N 3.14Å; K780-Q783 WeakPolarHBondContact O-CB 3.45Å; K780-Q783 PolarHBondContact O-N 3.14Å; K780-I784 WeakPolarHBondContact O-CG1 3.25Å; K780-I784 PolarHBondContact O-N 3.13Å
781	Q	62.2	Low	65.4	Low	120 Å²	120	88.3 Å²	88.3	56%	0.561	48%	0.481	S	S	*	.	H	α-helix	trans	-64.8	-37.4	175.2	-74.7	179.4	-5.7	0	0	112.9	T777 V778 A779 L785	T777-Q781 WeakPolarHBondContact O-CG 3.31Å; T777-Q781 PolarHBondContact O-N 3.19Å; V778-Q781 PolarHBondContact O-N 2.93Å; A779-Q781 VanDerWaalsContact C-N 3.35Å; A779-Q781 PolarHBondContact O-N 3.4Å; Q781-L785 WeakPolarHBondContact O-CB 3.31Å; Q781-L785 PolarHBondContact O-N 2.8Å
782	N	60.4	Low	65.9	Low	56 Å²	56	88.5 Å²	88.5	30%	0.299	48%	0.482	S	S	.	.	H	α-helix	trans	-66.2	-36.2	174	-71.8	-66.8	0	0	0	111.9	R741 V778 A779 K780 L785 M786	R741-N782 PolarHBondContact NH1-OD1 2.67Å; R741-N782 PolarHBondContact NH2-OD1 2.82Å; V778-N782 WeakPolarHBondContact CG1-ND2 3.47Å; V778-N782 PolarHBondContact O-N 3.37Å; V778-N782 PolarHBondContact O-ND2 3.33Å; A779-N782 PolarHBondContact O-N 2.87Å; A779-N782 VanDerWaalsContact O-N 3.17Å; K780-N782 PolarHBondContact O-N 3.14Å; N782-L785 PolarHBondContact O-N 3.47Å; N782-M786 PolarHBondContact O-N 2.85Å
783	Q	69.5	Low	66.1	Low	99 Å²	99	89.7 Å²	89.7	46%	0.463	48%	0.484	S	S	.	.	H	α-helix	trans	-62.6	-51.1	175.1	-178.4	63.1	26.5	0	0	111	A779 K780 L785 M786 E787	A779-Q783 PolarHBondContact O-N 2.85Å; K780-Q783 WeakPolarHBondContact O-CB 3.45Å; K780-Q783 PolarHBondContact O-N 3.14Å; Q783-L785 VanDerWaalsContact C-N 3.27Å; Q783-L785 PolarHBondContact O-N 3.16Å; Q783-M786 WeakPolarHBondContact O-CB 3.24Å; Q783-M786 PolarHBondContact O-N 2.99Å; Q783-E787 WeakPolarHBondContact CG-OE1 3.35Å; Q783-E787 PolarHBondContact NE2-OE1 2.8Å; Q783-E787 PolarHBondContact O-N 3.35Å
784	I	66.9	Low	66.7	Low	95 Å²	95	92.6 Å²	92.6	49%	0.487	49%	0.491	S	S	.	.	H	α-helix	trans	-59.2	-38	176.6	-65.9	163.7	0	0	0	111.3	K780 E787 L788	K780-I784 WeakPolarHBondContact O-CG1 3.25Å; K780-I784 PolarHBondContact O-N 3.13Å; I784-E787 PolarHBondContact O-N 3.48Å; I784-L788 HydrophobicContact CG2-CD1 4.1Å; I784-L788 WeakPolarHBondContact O-CB 3.23Å; I784-L788 PolarHBondContact O-N 2.83Å
785	L	67.5	Low	67.3	Low	100 Å²	100	94 Å²	94	52%	0.524	50%	0.495	S	S	.	.	H	α-helix	trans	-66.3	-35.3	175	-116.8	167.8	0	0	0	112.9	Q781 N782 Q783 Q789	Q781-L785 WeakPolarHBondContact O-CB 3.31Å; Q781-L785 PolarHBondContact O-N 2.8Å; N782-L785 PolarHBondContact O-N 3.47Å; Q783-L785 VanDerWaalsContact C-N 3.27Å; Q783-L785 PolarHBondContact O-N 3.16Å; L785-Q789 VanDerWaalsContact O-CB 3.29Å; L785-Q789 WeakPolarHBondContact O-CB 3.41Å; L785-Q789 PolarHBondContact O-N 3.46Å
786	M	68.1	Low	67.4	Low	114 Å²	114	94.2 Å²	94.2	56%	0.562	49%	0.491	S	S	*	.	H	α-helix	trans	-72	-39	176.4	-170.4	174.4	-66.6	0	0	111.5	N782 Q783 Q789 N790	N782-M786 PolarHBondContact O-N 2.85Å; Q783-M786 WeakPolarHBondContact O-CB 3.24Å; Q783-M786 PolarHBondContact O-N 2.99Å; M786-Q789 PolarHBondContact O-N 3.31Å; M786-N790 VanDerWaalsContact O-CG 3.25Å; M786-N790 PolarHBondContact O-N 3.26Å; M786-N790 PolarHBondContact O-ND2 2.85Å
787	E	66.8	Low	67.5	Low	89 Å²	89	91.4 Å²	91.4	42%	0.416	48%	0.481	S	S	.	.	H	α-helix	trans	-62.1	-52.3	173	-73.2	162.2	-175.1	0	0	110.9	Q783 I784 Q789 N790 D791	Q783-E787 WeakPolarHBondContact CG-OE1 3.35Å; Q783-E787 PolarHBondContact NE2-OE1 2.8Å; Q783-E787 PolarHBondContact O-N 3.35Å; I784-E787 PolarHBondContact O-N 3.48Å; E787-Q789 PolarHBondContact O-N 3.35Å; E787-N790 WeakPolarHBondContact O-CA 3.1Å; E787-N790 WeakPolarHBondContact O-CB 3.36Å; E787-N790 PolarHBondContact O-N 2.84Å; E787-D791 PolarHBondContact O-N 3.48Å
788	L	64.9	Low	67.8	Low	106 Å²	106	90.5 Å²	90.5	56%	0.555	47%	0.474	S	S	*	.	H	α-helix	trans	-57.2	-33.5	173.6	-83.1	165	0	0	0	113.5	I784 L792	I784-L788 HydrophobicContact CG2-CD1 4.1Å; I784-L788 WeakPolarHBondContact O-CB 3.23Å; I784-L788 PolarHBondContact O-N 2.83Å; L788-L792 WeakPolarHBondContact O-CB 3.27Å; L788-L792 PolarHBondContact O-N 2.86Å
789	Q	67.9	Low	67.7	Low	121 Å²	121	93 Å²	93	57%	0.565	48%	0.484	S	S	*	.	H	α-helix	trans	-73.8	-32.7	176	-175.1	173.1	-30.8	0	0	112.3	L785 M786 E787 T793	L785-Q789 VanDerWaalsContact O-CB 3.29Å; L785-Q789 WeakPolarHBondContact O-CB 3.41Å; L785-Q789 PolarHBondContact O-N 3.46Å; M786-Q789 PolarHBondContact O-N 3.31Å; E787-Q789 PolarHBondContact O-N 3.35Å; Q789-T793 PolarHBondContact O-N 3.14Å; Q789-T793 VanDerWaalsContact O-N 3.09Å; Q789-T793 PolarHBondContact O-OG1 3.28Å
790	N	71.6	Confident	67.8	Low	95 Å²	95	98.7 Å²	98.7	51%	0.508	49%	0.494	S	S	.	.	H	α-helix	trans	-69.9	-45.9	172.4	-70.6	-25.1	0	0	0	110.6	M786 E787 L792 T793 L794	M786-N790 VanDerWaalsContact O-CG 3.25Å; M786-N790 PolarHBondContact O-N 3.26Å; M786-N790 PolarHBondContact O-ND2 2.85Å; E787-N790 WeakPolarHBondContact O-CA 3.1Å; E787-N790 WeakPolarHBondContact O-CB 3.36Å; E787-N790 PolarHBondContact O-N 2.84Å; N790-L792 PolarHBondContact O-N 2.95Å; N790-T793 WeakPolarHBondContact CA-OG1 3.26Å; N790-T793 PolarHBondContact O-N 3.43Å; N790-T793 VanDerWaalsContact O-N 3.14Å; N790-T793 PolarHBondContact O-OG1 2.81Å; N790-L794 WeakPolarHBondContact O-CB 3.36Å; N790-L794 PolarHBondContact O-N 2.99Å
791	D	66.4	Low	68	Low	96 Å²	96	98.8 Å²	98.8	51%	0.513	49%	0.491	S	S	.	.	H	α-helix	trans	-61.6	-43.5	175.8	-69.4	-25.5	0	0	0	111.5	E787 T793 L794 V795	E787-D791 PolarHBondContact O-N 3.48Å; D791-T793 VanDerWaalsContact C-N 3.29Å; D791-T793 PolarHBondContact O-N 2.83Å; D791-L794 WeakPolarHBondContact O-CB 3.32Å; D791-L794 PolarHBondContact O-N 3.1Å; D791-V795 WeakPolarHBondContact O-CB 3.44Å; D791-V795 WeakPolarHBondContact O-CG2 3.4Å; D791-V795 PolarHBondContact O-N 2.68Å
792	L	71.3	Confident	68.1	Low	92 Å²	92	98.5 Å²	98.5	48%	0.482	49%	0.488	S	S	.	.	H	α-helix	trans	-64.3	-31.8	176	-177.6	61.6	0	0	0	112.7	L788 N790 K796	L788-L792 WeakPolarHBondContact O-CB 3.27Å; L788-L792 PolarHBondContact O-N 2.86Å; N790-L792 PolarHBondContact O-N 2.95Å; L792-K796 HydrophobicContact CG-CD 4.36Å; L792-K796 WeakPolarHBondContact O-CB 3.45Å; L792-K796 WeakPolarHBondContact O-CG 3.11Å; L792-K796 PolarHBondContact O-N 2.83Å
793	T	72.7	Confident	68.2	Low	77 Å²	77	98.6 Å²	98.6	47%	0.472	50%	0.496	S	S	.	.	H	α-helix	trans	-77.6	-33	173.8	44.9	0	0	0	0	112.3	Q789 N790 D791 K796 A797	Q789-T793 PolarHBondContact O-N 3.14Å; Q789-T793 VanDerWaalsContact O-N 3.09Å; Q789-T793 PolarHBondContact O-OG1 3.28Å; N790-T793 WeakPolarHBondContact CA-OG1 3.26Å; N790-T793 PolarHBondContact O-N 3.43Å; N790-T793 VanDerWaalsContact O-N 3.14Å; N790-T793 PolarHBondContact O-OG1 2.81Å; D791-T793 VanDerWaalsContact C-N 3.29Å; D791-T793 PolarHBondContact O-N 2.83Å; T793-K796 PolarHBondContact O-N 3.46Å; T793-A797 WeakPolarHBondContact O-CB 3.35Å; T793-A797 PolarHBondContact O-N 3.4Å
794	L	71.3	Confident	67.9	Low	114 Å²	114	99.9 Å²	99.9	60%	0.597	50%	0.502	S	S	*	.	H	α-helix	trans	-63.3	-48.4	170.8	-158.6	78.4	0	0	0	111.3	N790 D791 K796 A797 D798	N790-L794 WeakPolarHBondContact O-CB 3.36Å; N790-L794 PolarHBondContact O-N 2.99Å; D791-L794 WeakPolarHBondContact O-CB 3.32Å; D791-L794 PolarHBondContact O-N 3.1Å; L794-K796 PolarHBondContact O-N 3.23Å; L794-A797 WeakPolarHBondContact O-CB 3.5Å; L794-A797 PolarHBondContact O-N 3.39Å; L794-A797 VanDerWaalsContact O-N 3.16Å; L794-D798 PolarHBondContact O-N 3.42Å
795	V	71.1	Confident	67.5	Low	79 Å²	79	100.1 Å²	100.1	48%	0.479	51%	0.508	S	S	.	.	H	α-helix	trans	-62.2	-41.1	175.7	170.4	0	0	0	0	111.3	D791 A797 D798 L799	D791-V795 WeakPolarHBondContact O-CB 3.44Å; D791-V795 WeakPolarHBondContact O-CG2 3.4Å; D791-V795 PolarHBondContact O-N 2.68Å; V795-A797 VanDerWaalsContact C-N 3.34Å; V795-A797 PolarHBondContact O-N 2.87Å; V795-D798 PolarHBondContact O-N 2.75Å; V795-L799 HydrophobicContact CG1-CD1 3.96Å; V795-L799 HydrophobicContact CG1-CG 4.39Å; V795-L799 WeakPolarHBondContact O-CB 3.5Å; V795-L799 WeakPolarHBondContact O-CG 3.46Å; V795-L799 PolarHBondContact O-N 2.87Å
796	K	67.8	Low	66.8	Low	109 Å²	109	101.3 Å²	101.3	47%	0.474	52%	0.515	S	S	.	.	H	α-helix	trans	-63.8	-35.8	173.7	-78.9	172.3	179.1	179	0	112.7	L792 T793 L794 R800	L792-K796 HydrophobicContact CG-CD 4.36Å; L792-K796 WeakPolarHBondContact O-CB 3.45Å; L792-K796 WeakPolarHBondContact O-CG 3.11Å; L792-K796 PolarHBondContact O-N 2.83Å; T793-K796 PolarHBondContact O-N 3.46Å; L794-K796 PolarHBondContact O-N 3.23Å; K796-R800 WeakPolarHBondContact O-CG 3.47Å; K796-R800 PolarHBondContact O-N 3.5Å
797	A	70.3	Confident	66.1	Low	38 Å²	38	98.8 Å²	98.8	31%	0.314	51%	0.512	S	S	.	.	H	α-helix	trans	-68.9	-39.3	173.2	0	0	0	0	0	111.7	T793 L794 V795 R800 R801	T793-A797 WeakPolarHBondContact O-CB 3.35Å; T793-A797 PolarHBondContact O-N 3.4Å; L794-A797 WeakPolarHBondContact O-CB 3.5Å; L794-A797 PolarHBondContact O-N 3.39Å; L794-A797 VanDerWaalsContact O-N 3.16Å; V795-A797 VanDerWaalsContact C-N 3.34Å; V795-A797 PolarHBondContact O-N 2.87Å; A797-R800 WeakPolarHBondContact O-CB 3.26Å; A797-R800 PolarHBondContact O-N 3.39Å; A797-R801 PolarHBondContact O-N 2.9Å
798	D	67.1	Low	65.3	Low	54 Å²	54	97.7 Å²	97.7	29%	0.289	52%	0.524	S	S	.	.	H	α-helix	trans	-72.1	-36.5	-179.4	-146.4	59.7	0	0	0	113.1	L794 V795 R800 R801 K802	L794-D798 PolarHBondContact O-N 3.42Å; V795-D798 PolarHBondContact O-N 2.75Å; D798-R800 VanDerWaalsContact C-N 3.32Å; D798-R800 PolarHBondContact O-N 3.02Å; D798-R801 PolarHBondContact O-N 2.93Å; D798-R801 IonicContact OD1-CZ 3.71Å; D798-R801 IonicContact OD1-NE 3.68Å; D798-R801 PolarHBondContact OD1-NE 3.41Å; D798-R801 IonicContact OD1-NH2 3.87Å; D798-R801 PolarHBondContact OD1-NH2 2.99Å; D798-K802 WeakPolarHBondContact O-CB 3.36Å; D798-K802 WeakPolarHBondContact O-CG 3.46Å; D798-K802 PolarHBondContact O-N 2.92Å; D798-K802 VanDerWaalsContact OD2-CE 3.3Å; D798-K802 WeakPolarHBondContact OD2-CE 3.5Å; D798-K802 IonicContact OD2-NZ 3.37Å; D798-K802 PolarHBondContact OD2-NZ 3.44Å
799	L	64.4	Low	64.7	Low	110 Å²	110	103.5 Å²	103.5	58%	0.576	54%	0.539	S	S	*	.	H	α-helix	trans	-63	-36.1	169.8	-73.5	170.1	0	0	0	112.2	V795 K802 A803	V795-L799 HydrophobicContact CG1-CD1 3.96Å; V795-L799 HydrophobicContact CG1-CG 4.39Å; V795-L799 WeakPolarHBondContact O-CB 3.5Å; V795-L799 WeakPolarHBondContact O-CG 3.46Å; V795-L799 PolarHBondContact O-N 2.87Å; L799-K802 PolarHBondContact O-N 2.93Å; L799-A803 WeakPolarHBondContact O-CB 3.5Å; L799-A803 PolarHBondContact O-N 2.96Å
800	R	68.6	Low	63.6	Low	175 Å²	175	101.3 Å²	101.3	66%	0.66	54%	0.541	S	S	*	.	H	α-helix	trans	-65.1	-48.7	172.2	-74.8	171.5	178.4	177.7	-1.5	111.6	K796 A797 D798 K802 A803 E804	K796-R800 WeakPolarHBondContact O-CG 3.47Å; K796-R800 PolarHBondContact O-N 3.5Å; A797-R800 WeakPolarHBondContact O-CB 3.26Å; A797-R800 PolarHBondContact O-N 3.39Å; D798-R800 VanDerWaalsContact C-N 3.32Å; D798-R800 PolarHBondContact O-N 3.02Å; R800-K802 PolarHBondContact O-N 3.43Å; R800-A803 WeakPolarHBondContact O-CB 3.47Å; R800-A803 PolarHBondContact O-N 3.47Å; R800-E804 WeakPolarHBondContact O-CB 3.46Å; R800-E804 WeakPolarHBondContact O-CG 3.5Å; R800-E804 PolarHBondContact O-N 3.19Å
801	R	70.4	Confident	62.1	Low	135 Å²	135	103.5 Å²	103.5	51%	0.509	55%	0.553	S	S	.	*	H	α-helix	trans	-58.3	-36.1	175.2	-69.7	-172.1	-68.8	-130.6	3.7	112.7	A797 D798 T805	A797-R801 PolarHBondContact O-N 2.9Å; D798-R801 PolarHBondContact O-N 2.93Å; D798-R801 IonicContact OD1-CZ 3.71Å; D798-R801 IonicContact OD1-NE 3.68Å; D798-R801 PolarHBondContact OD1-NE 3.41Å; D798-R801 IonicContact OD1-NH2 3.87Å; D798-R801 PolarHBondContact OD1-NH2 2.99Å; R801-T805 WeakPolarHBondContact O-CB 3.45Å; R801-T805 PolarHBondContact O-N 3Å; R801-T805 PolarHBondContact O-OG1 3.43Å
802	K	66.1	Low	60.8	Low	114 Å²	114	104.1 Å²	104.1	50%	0.496	56%	0.562	S	S	.	*	H	α-helix	trans	-70.8	-38.2	174.6	-76.5	163.8	175.7	155.9	0	112.5	D798 L799 R800 T805 L806	D798-K802 WeakPolarHBondContact O-CB 3.36Å; D798-K802 WeakPolarHBondContact O-CG 3.46Å; D798-K802 PolarHBondContact O-N 2.92Å; D798-K802 VanDerWaalsContact OD2-CE 3.3Å; D798-K802 WeakPolarHBondContact OD2-CE 3.5Å; D798-K802 IonicContact OD2-NZ 3.37Å; D798-K802 PolarHBondContact OD2-NZ 3.44Å; L799-K802 PolarHBondContact O-N 2.93Å; R800-K802 PolarHBondContact O-N 3.43Å; K802-T805 WeakPolarHBondContact CA-OG1 3.43Å; K802-T805 PolarHBondContact O-OG1 3.1Å; K802-L806 WeakPolarHBondContact O-CB 3.46Å; K802-L806 WeakPolarHBondContact O-CD1 3.4Å; K802-L806 VanDerWaalsContact O-CG 3.25Å; K802-L806 WeakPolarHBondContact O-CG 3.26Å; K802-L806 PolarHBondContact O-N 3.4Å
803	A	61	Low	59.3	Low	58 Å²	58	105.6 Å²	105.6	48%	0.479	58%	0.577	S	S	.	*	H	α-helix	trans	-66.8	-41.8	173.1	0	0	0	0	0	112.3	L799 R800 L806 A807	L799-A803 WeakPolarHBondContact O-CB 3.5Å; L799-A803 PolarHBondContact O-N 2.96Å; R800-A803 WeakPolarHBondContact O-CB 3.47Å; R800-A803 PolarHBondContact O-N 3.47Å; A803-L806 PolarHBondContact O-N 3.02Å; A803-A807 WeakPolarHBondContact O-CB 3.28Å; A803-A807 PolarHBondContact O-N 3.18Å
804	E	63.4	Low	57.5	Low	126 Å²	126	108.4 Å²	108.4	59%	0.589	60%	0.595	S	S	*	*	H	α-helix	trans	-64.5	-41.6	177	-71.6	159.1	-170.1	0	0	111.9	R800 A807 G808	R800-E804 WeakPolarHBondContact O-CB 3.46Å; R800-E804 WeakPolarHBondContact O-CG 3.5Å; R800-E804 PolarHBondContact O-N 3.19Å; E804-A807 PolarHBondContact O-N 3.18Å; E804-G808 PolarHBondContact O-N 3.49Å
805	T	58.5	Low	55.7	Low	100 Å²	100	108.8 Å²	108.8	61%	0.613	60%	0.602	S	S	*	*	H	α-helix	trans	-73.5	-28.3	176.4	44.4	0	0	0	0	113.4	R801 K802	R801-T805 WeakPolarHBondContact O-CB 3.45Å; R801-T805 PolarHBondContact O-N 3Å; R801-T805 PolarHBondContact O-OG1 3.43Å; K802-T805 WeakPolarHBondContact CA-OG1 3.43Å; K802-T805 PolarHBondContact O-OG1 3.1Å
806	L	53.2	Low	53.8	Low	126 Å²	126	111.6 Å²	111.6	66%	0.66	62%	0.619	S	S	*	*	H	α-helix	trans	-68.8	-44.3	168.1	-77.1	165.7	0	0	0	111.8	K802 A803 R809	K802-L806 WeakPolarHBondContact O-CB 3.46Å; K802-L806 WeakPolarHBondContact O-CD1 3.4Å; K802-L806 VanDerWaalsContact O-CG 3.25Å; K802-L806 WeakPolarHBondContact O-CG 3.26Å; K802-L806 PolarHBondContact O-N 3.4Å; A803-L806 PolarHBondContact O-N 3.02Å; L806-R809 PolarHBondContact O-N 3.38Å
807	A	53.2	Low	52.1	Low	61 Å²	61	116.5 Å²	116.5	50%	0.504	64%	0.641	S	S	.	*	H	α-helix	trans	-62.9	-42.2	176.7	0	0	0	0	0	112.2	A803 E804 R809 A810	A803-A807 WeakPolarHBondContact O-CB 3.28Å; A803-A807 PolarHBondContact O-N 3.18Å; E804-A807 PolarHBondContact O-N 3.18Å; A807-R809 PolarHBondContact O-N 3.27Å; A807-R809 VanDerWaalsContact O-N 3.13Å; A807-A810 PolarHBondContact O-N 2.72Å; A807-A810 VanDerWaalsContact O-N 3.14Å
808	G	50.5	Low	50.3	Low	65 Å²	65	119.3 Å²	119.3	67%	0.67	66%	0.664	S	S	*	*	T	Hydrogen-bonded Turn	trans	-62.2	-17.2	176.2	0	0	0	0	0	114.7	E804	E804-G808 PolarHBondContact O-N 3.49Å
809	R	51.2	Low	48.6	Very low	229 Å²	229	121.5 Å²	121.5	86%	0.864	69%	0.69	S	S	*	*	T	Hydrogen-bonded Turn	trans	-94	-0.6	179.1	-152	172	-175.3	177.1	0.5	113.7	L806 A807	L806-R809 PolarHBondContact O-N 3.38Å; A807-R809 PolarHBondContact O-N 3.27Å; A807-R809 VanDerWaalsContact O-N 3.13Å
810	A	44.4	Very low	47.6	Very low	75 Å²	75	121.9 Å²	121.9	62%	0.62	70%	0.699	S	S	*	*	S	Bend	trans	-105.2	1.3	-172.5	0	0	0	0	0	115.3	A807	A807-A810 PolarHBondContact O-N 2.72Å; A807-A810 VanDerWaalsContact O-N 3.14Å
811	N	40.7	Very low	45.7	Very low	141 Å²	141	120.6 Å²	120.6	75%	0.754	71%	0.711	S	S	*	*			trans	-110.7	117.1	179.5	-79.7	-21.2	0	0	0	112.1
812	P	40	Very low	44	Very low	108 Å²	108	120.6 Å²	120.6	70%	0.701	73%	0.726	S	S	*	*			trans	-78	153.1	164	33.4	-33.4	0	0	0	111.1	T814	P812-T814 PolarHBondContact O-N 3.05Å
813	P	39.9	Very low	43.1	Very low	123 Å²	123	121.3 Å²	121.3	80%	0.799	74%	0.742	S	S	*	*			trans	-78.2	118.6	178.7	30.6	-33.5	0	0	0	112	T815	P813-T815 PolarHBondContact O-N 2.94Å
814	T	34.3	Very low	41.5	Very low	137 Å²	137	122.1 Å²	122.1	84%	0.84	76%	0.756	S	S	*	*			trans	-84.7	103.4	170.2	35.6	0	0	0	0	111.3	P812 T816	P812-T814 PolarHBondContact O-N 3.05Å; T814-T816 PolarHBondContact O-N 3.47Å
815	T	32.8	Very low	39.8	Very low	121 Å²	121	121.5 Å²	121.5	74%	0.742	77%	0.765	S	S	*	*	P	Polyproline II helix	trans	-75.4	117.3	171.4	50.3	0	0	0	0	111.4	P813	P813-T815 PolarHBondContact O-N 2.94Å
816	T	32.8	Very low	38.5	Very low	139 Å²	139	121.1 Å²	121.1	85%	0.853	77%	0.766	S	S	*	*	P	Polyproline II helix	trans	-85.3	137	160.1	35.8	0	0	0	0	110.4	T814	T814-T816 PolarHBondContact O-N 3.47Å
817	F	31.9	Very low	37.5	Very low	212 Å²	212	123.7 Å²	123.7	93%	0.93	77%	0.772	S	S	*	*	P	Polyproline II helix	trans	-75.1	136.8	178.4	-91.2	-105.2	0	0	0	111.8
818	A	31.6	Very low	36.6	Very low	96 Å²	96	130.1 Å²	130.1	79%	0.793	79%	0.789	S	S	*	*			trans	-130.6	149.1	157	0	0	0	0	0	108.8
819	A	31.2	Very low	35.6	Very low	100 Å²	100	138.4 Å²	138.4	83%	0.826	80%	0.8	S	S	*	*			trans	-81.9	165.2	-168.2	0	0	0	0	0	113.6
820	P	43.3	Very low	34.5	Very low	119 Å²	119	130.8 Å²	130.8	77%	0.773	79%	0.792	S	S	*	*			trans	-105.3	158.5	-148.5	38.8	-36.6	0	0	0	116.6
821	T	29.2	Very low	33.7	Very low	148 Å²	148	133 Å²	133	91%	0.908	80%	0.802	S	S	*	*			trans	-138.4	152.6	152.6	43.9	0	0	0	0	111
822	T	34.5	Very low	33	Very low	134 Å²	134	135.2 Å²	135.2	82%	0.822	81%	0.81	S	S	*	*			trans	-118.2	176.1	-173.7	48.9	0	0	0	0	110.8
823	P	46.5	Very low	32.5	Very low	129 Å²	129	133.3 Å²	133.3	84%	0.838	80%	0.803	S	S	*	*			cis	-127.9	178	-34	33.6	-16.4	0	0	0	112.8
824	G	27.7	Very low	31.8	Very low	75 Å²	75	133.4 Å²	133.4	77%	0.773	80%	0.802	S	S	*	*			trans	-173	66.9	178.4	0	0	0	0	0	121.6
825	S	29.4	Very low	31.5	Very low	113 Å²	113	132.9 Å²	132.9	79%	0.79	80%	0.798	S	S	*	*			trans	43.6	121.7	143.8	-151	0	0	0	0	124.5
826	C	31.1	Very low	32.5	Very low	93 Å²	93	132.3 Å²	132.3	63%	0.628	80%	0.796	S	S	*	*			trans	73.3	116.6	133.8	-76.2	0	0	0	0	125.7
827	K	31.9	Very low	32.2	Very low	180 Å²	180	130.6 Å²	130.6	78%	0.783	79%	0.79	S	S	*	*				83	128.3	120.2	-71.8	173.9	-178.8	168.4	0	123.1
828	K	33.7	Very low	31.9	Very low	196 Å²	196	128.8 Å²	128.8	85%	0.852	79%	0.785	S	S	*	*			trans	70.3	166.1	147.4	-70.2	-179.3	175.6	-176.3	0	118.8
829	R	28.9	Very low	31.7	Very low	239 Å²	239	129.3 Å²	129.3	90%	0.902	78%	0.781	S	S	*	*			cis	-174.9	122.6	-42.3	-169.3	-175.8	-152.4	-166.5	8.6	109.3
830	G	28.2	Very low	31.5	Very low	68 Å²	68	132.2 Å²	132.2	70%	0.701	78%	0.778	S	S	*	*			trans	71.7	-179.4	172.3	0	0	0	0	0	115.3
831	C	27.6	Very low	30.7	Very low	122 Å²	122	131.9 Å²	131.9	82%	0.824	77%	0.769	S	S	*	*			cis	172.1	146.9	-26.4	-102.4	0	0	0	0	107.6
832	M	27.2	Very low	30.6	Very low	188 Å²	188	135.5 Å²	135.5	93%	0.926	77%	0.767	S	S	*	*			trans	65.8	158.4	171	-64.1	-173.4	74.2	0	0	116.4
833	A	28.3	Very low	31.4	Very low	67 Å²	67	134.3 Å²	134.3	55%	0.554	76%	0.761	S	S	*	*			cis	-165.9	176.6	-26.2	0	0	0	0	0	110.2
834	T	25.6	Very low	31.6	Very low	126 Å²	126	133.1 Å²	133.1	77%	0.773	75%	0.753	S	S	*	*			trans	55.5	112.1	155.4	46.9	0	0	0	0	121.3
835	T	28.5	Very low	31.7	Very low	125 Å²	125	136.7 Å²	136.7	77%	0.767	75%	0.75	S	S	*	*				5.6	158	121.2	51.8	0	0	0	0	120.7
836	P	53.6	Low	31.7	Very low	109 Å²	109	140.3 Å²	140.3	71%	0.708	75%	0.751	S	S	*	*			cis	-144.1	-174.1	-22.8	39.7	-20.2	0	0	0	115.8
837	S	26.5	Very low	31.7	Very low	103 Å²	103	145.7 Å²	145.7	72%	0.72	76%	0.758	S	S	*	*			trans	84.4	148.4	144.2	79.2	0	0	0	0	122.9
838	E	26	Very low	31.5	Very low	174 Å²	174	142.6 Å²	142.6	81%	0.813	76%	0.759	S	S	*	*			trans	73.8	114.9	153	-72.3	-169.3	-178.1	0	0	124.1
839	C	26.6	Very low	31.4	Very low	107 Å²	107	140.1 Å²	140.1	72%	0.723	75%	0.749	S	S	*	*				83.5	138.1	122	-68.9	0	0	0	0	124.5
840	E	27.4	Very low	31.8	Very low	161 Å²	161	136.6 Å²	136.6	75%	0.752	74%	0.74	S	S	*	*			trans	79.5	140.6	142.9	-86.2	-147.5	122.6	0	0	124
841	N	27.3	Very low	31.8	Very low	112 Å²	112	141 Å²	141	60%	0.599	74%	0.743	S	S	*	*			trans	64.8	141.6	148.6	-71.1	-45.1	0	0	0	119.8
842	R	25.8	Very low	31.9	Very low	225 Å²	225	139.2 Å²	139.2	85%	0.849	73%	0.732	S	S	*	*			cis	-161.9	-164.6	-18.8	-126.2	-172.5	174.5	-164.8	0.1	108.6
843	P	50.8	Low	32.1	Very low	108 Å²	108	136.3 Å²	136.3	70%	0.701	72%	0.724	S	S	*	*			trans	-107.2	-148.5	-159.5	33.9	-8.6	0	0	0	110.3
844	P	51.3	Low	32.6	Very low	104 Å²	104	142.5 Å²	142.5	68%	0.675	74%	0.739	S	S	*	*			cis	-150.1	-164.1	10.1	40.2	-14.4	0	0	0	119.1
845	Q	29.5	Very low	33.2	Very low	150 Å²	150	142.6 Å²	142.6	70%	0.701	74%	0.742	S	S	*	*			trans	87.2	143.6	169.9	-49.9	-165.9	22.4	0	0	116
846	K	29.8	Very low	33.2	Very low	190 Å²	190	143 Å²	143	83%	0.826	74%	0.744	S	S	*	*			cis	-142.4	179.3	7.5	-129.5	148.9	-176.9	152.1	0	111.7
847	R	31.8	Very low	32	Very low	206 Å²	206	149.6 Å²	149.6	78%	0.777	76%	0.755	S	S	*	*			trans	-118.1	155.7	-163.5	-63.2	177.8	176.6	167.7	-2.3	116.5	F849	R847-F849 HydrophobicContact CB-CD2 4.1Å; R847-F849 HydrophobicContact CB-CE2 4.32Å
848	S	26.9	Very low	32.5	Very low	115 Å²	115	150.8 Å²	150.8	80%	0.804	76%	0.758	S	S	*	*			trans	-150.1	114.7	132.1	36.6	0	0	0	0	108.1
849	F	32.2	Very low	32.9	Very low	143 Å²	143	148.4 Å²	148.4	63%	0.627	76%	0.758	S	S	*	*				57.6	124.4	74.2	-76.8	-81.5	0	0	0	113.3	R847	R847-F849 HydrophobicContact CB-CD2 4.1Å; R847-F849 HydrophobicContact CB-CE2 4.32Å
850	F	35.9	Very low	32.9	Very low	165 Å²	165	148.8 Å²	148.8	72%	0.724	76%	0.762	S	S	*	*			cis	-162.3	-167.9	-10	-141.9	-148.4	0	0	0	108.4
851	Q	28.8	Very low	32.8	Very low	161 Å²	161	152.9 Å²	152.9	75%	0.752	77%	0.77	S	S	*	*			cis	-155.1	-178.6	15.4	-170.2	157.1	-60.9	0	0	111.3
852	S	30.6	Very low	32.7	Very low	85 Å²	85	156.1 Å²	156.1	59%	0.594	78%	0.779	S	S	*	*			trans	-93.5	-174.1	175.3	43.9	0	0	0	0	113.1
853	V	29.8	Very low	32.7	Very low	127 Å²	127	155.4 Å²	155.4	77%	0.77	78%	0.778	S	S	*	*			cis	-159.3	161	34.9	-147	0	0	0	0	113.3
854	F	39.5	Very low	31.6	Very low	197 Å²	197	157.2 Å²	157.2	86%	0.864	78%	0.782	S	S	*	*			trans	-76.5	163.6	160.9	-69.3	-85.8	0	0	0	112.7
855	P	38.4	Very low	30.4	Very low	128 Å²	128	156.9 Å²	156.9	83%	0.831	79%	0.788	S	S	*	*				-144.9	176.4	123.5	38.6	-24.2	0	0	0	116
856	T	29.6	Very low	30.3	Very low	134 Å²	134	159 Å²	159	82%	0.822	80%	0.797	S	S	*	*			trans	-99.3	149.8	-175.8	50.9	0	0	0	0	114.2
857	R	27.8	Very low	30.2	Very low	246 Å²	246	154.7 Å²	154.7	93%	0.928	80%	0.797	S	S	*	*			trans	179.5	150.4	137.2	-109.6	176	173.5	177.9	-2.2	114.7
858	T	35.9	Very low	30	Very low	128 Å²	128	149.3 Å²	149.3	79%	0.785	80%	0.796	S	S	*	*			trans	-96.4	156.2	152.6	51.6	0	0	0	0	109.2
859	P	34.9	Very low	30.1	Very low	125 Å²	125	148 Å²	148	81%	0.812	79%	0.792	S	S	*	*				-151.2	-167.8	98	40.8	-22.2	0	0	0	114.7
860	S	26	Very low	29.9	Very low	114 Å²	114	150 Å²	150	80%	0.797	80%	0.803	S	S	*	*			trans	-85.5	159.9	-175.7	58	0	0	0	0	115.7
861	R	25.4	Very low	29.5	Very low	247 Å²	247	147.6 Å²	147.6	93%	0.932	81%	0.807	S	S	*	*				-166.7	159.9	122.3	-152.3	161.7	178.2	163.9	-1.3	112.7
862	K	26.4	Very low	29.6	Very low	181 Å²	181	145.7 Å²	145.7	79%	0.787	81%	0.812	S	S	*	*			trans	-85.9	149.4	172.2	-49.3	170	-178.4	178	0	111.1
863	Y	25.5	Very low	29.7	Very low	210 Å²	210	149.5 Å²	149.5	82%	0.824	83%	0.825	S	S	*	*				-175.9	170.6	112.9	-118.3	-95.4	0	0	0	113.3
864	N	26.6	Very low	30.3	Very low	146 Å²	146	148.9 Å²	148.9	78%	0.781	82%	0.821	S	S	*	*			trans	-91.7	157.8	-175.8	-43.7	-35.1	0	0	0	112.8
865	A	27.3	Very low	30.5	Very low	97 Å²	97	145.8 Å²	145.8	80%	0.802	82%	0.821	S	S	*	*				-176.5	156.9	125.8	0	0	0	0	0	113.3
866	H	27.7	Very low	30.3	Very low	195 Å²	195	145.2 Å²	145.2	90%	0.903	82%	0.82	S	S	*	*			trans	-80.9	168.1	163.4	-48.4	-98.6	0	0	0	109.3
867	A	27.5	Very low	30.8	Very low	99 Å²	99	143.5 Å²	143.5	82%	0.818	81%	0.813	S	S	*	*			cis	-145.3	-154.5	12.2	0	0	0	0	0	108.8
868	A	27.2	Very low	31.4	Very low	92 Å²	92	143.2 Å²	143.2	76%	0.76	81%	0.812	S	S	*	*			cis	-160.3	178.1	7.6	0	0	0	0	0	112.4
869	A	28.2	Very low	31.7	Very low	87 Å²	87	144.8 Å²	144.8	72%	0.719	81%	0.814	S	S	*	*			trans	49.9	105.4	147.2	0	0	0	0	0	122
870	E	28.8	Very low	31.8	Very low	185 Å²	185	147 Å²	147	86%	0.864	82%	0.818	S	S	*	*				38.1	121.4	122.5	-57.4	-176.9	161.3	0	0	121.4
871	S	28.4	Very low	32.4	Very low	115 Å²	115	153.5 Å²	153.5	80%	0.804	83%	0.825	S	S	*	*				171.7	150.5	97.7	49.9	0	0	0	0	113.8
872	S	30.8	Very low	33	Very low	122 Å²	122	147 Å²	147	85%	0.853	82%	0.818	S	S	*	*			trans	132	92	160.5	62.9	0	0	0	0	114.1
873	L	32.7	Very low	33.6	Very low	164 Å²	164	149.8 Å²	149.8	86%	0.859	82%	0.824	S	S	*	*			trans	-89.7	145.8	166.3	-80.6	130.2	0	0	0	110.3
874	T	41.8	Very low	34.1	Very low	114 Å²	114	148.8 Å²	148.8	70%	0.699	83%	0.826	S	S	*	*			trans	-121	150.8	167.2	52.7	0	0	0	0	111	S876	T874-S876 PolarHBondContact O-N 3.5Å
875	P	43.2	Very low	34.7	Very low	132 Å²	132	147.5 Å²	147.5	86%	0.857	83%	0.826	S	S	*	*	T	Hydrogen-bonded Turn	trans	-91.4	44.4	-146.2	36.5	-39	0	0	0	115.9
876	S	35.4	Very low	35.5	Very low	117 Å²	117	148 Å²	148	82%	0.818	82%	0.824	S	S	*	*	T	Hydrogen-bonded Turn	trans	-117	-3	-177.4	-54.2	0	0	0	0	115.5	T874	T874-S876 PolarHBondContact O-N 3.5Å
877	S	40.3	Very low	36.4	Very low	97 Å²	97	144.3 Å²	144.3	68%	0.678	82%	0.817	S	S	*	*	S	Bend	trans	-94.2	8.5	-171.3	55.5	0	0	0	0	115.6
878	R	39.4	Very low	37.4	Very low	240 Å²	240	145.1 Å²	145.1	91%	0.906	81%	0.814	S	S	*	*			trans	-100.5	-2.5	-161.6	-133.3	179.6	-163.7	177.8	6.1	117.3
879	I	43.1	Very low	38.1	Very low	161 Å²	161	146.7 Å²	146.7	83%	0.826	82%	0.816	S	S	*	*	S	Bend	trans	-130.7	83.8	179.8	-51	179.2	0	0	0	110.4
880	L	37	Very low	38.7	Very low	172 Å²	172	150 Å²	150	90%	0.901	82%	0.822	S	S	*	*	S	Bend	trans	-179.8	43.3	148.7	-100.5	169.5	0	0	0	112.4
881	R	37.3	Very low	39.3	Very low	250 Å²	250	147.1 Å²	147.1	94%	0.943	82%	0.819	S	S	*	*			trans	-139	80.6	167.9	-82.9	-163.8	177.3	-174.3	0.9	112.5
882	S	39	Very low	39.5	Very low	110 Å²	110	149.6 Å²	149.6	77%	0.769	82%	0.822	S	S	*	*			trans	-143.8	154.5	148.2	68.4	0	0	0	0	108.3
883	R	38	Very low	39.7	Very low	241 Å²	241	152.2 Å²	152.2	91%	0.909	83%	0.826	S	S	*	*			trans	69.4	64	-175.6	-51.9	178.5	179.7	-97.9	-0.4	117
884	Q	37.3	Very low	39.8	Very low	188 Å²	188	150.5 Å²	150.5	88%	0.879	82%	0.822	S	S	*	*				-133.8	145.9	127.7	-83.1	-153	-6.8	0	0	109.8
885	P	38.8	Very low	39.5	Very low	120 Å²	120	150.9 Å²	150.9	78%	0.779	83%	0.827	S	S	*	*	P	Polyproline II helix	trans	-79.2	157.5	-179.6	33	-35.2	0	0	0	112.6
886	S	43	Very low	39.2	Very low	108 Å²	108	156.5 Å²	156.5	76%	0.755	83%	0.831	S	S	*	*	P	Polyproline II helix	trans	-77.8	146.1	178.1	49.8	0	0	0	0	113.2
887	P	46.9	Very low	39.2	Very low	116 Å²	116	155.9 Å²	155.9	75%	0.753	83%	0.826	S	S	*	*	P	Polyproline II helix	trans	-69.8	158.3	170.2	31.4	-35.7	0	0	0	112.1
888	P	48.9	Very low	38.9	Very low	116 Å²	116	159.4 Å²	159.4	75%	0.753	84%	0.837	S	S	*	*	P	Polyproline II helix	trans	-72.2	159.1	176.7	31.3	-36.1	0	0	0	112.6
889	P	41.8	Very low	38.8	Very low	126 Å²	126	160 Å²	160	82%	0.818	84%	0.839	S	S	*	*	P	Polyproline II helix	trans	-73.4	145	178.3	30.6	-35.3	0	0	0	112.6
890	N	40.6	Very low	38.3	Very low	155 Å²	155	156 Å²	156	83%	0.829	84%	0.838	S	S	*	*	P	Polyproline II helix	trans	-68.2	142.4	169	-82.8	-24.5	0	0	0	111
891	P	41.6	Very low	38.3	Very low	125 Å²	125	157.2 Å²	157.2	81%	0.812	84%	0.836	S	S	*	*	P	Polyproline II helix	trans	-70.4	151.3	174.8	29.9	-34.8	0	0	0	112.3
892	L	33.4	Very low	38.3	Very low	167 Å²	167	159.7 Å²	159.7	87%	0.874	85%	0.847	S	S	*	*	P	Polyproline II helix	trans	-74.3	150.6	-179.4	-72.8	161	0	0	0	112.7
893	L	33.4	Very low	38.2	Very low	178 Å²	178	162.2 Å²	162.2	93%	0.932	85%	0.851	S	S	*	*	P	Polyproline II helix	trans	-78.2	121.8	168	-78.7	162.9	0	0	0	110.6
894	T	35.7	Very low	38.2	Very low	127 Å²	127	158.1 Å²	158.1	78%	0.779	85%	0.848	S	S	*	*			trans	-130.9	154.9	165.3	41.1	0	0	0	0	110.6
895	P	35.7	Very low	38.3	Very low	122 Å²	122	156.4 Å²	156.4	79%	0.792	85%	0.846	S	S	*	*			trans	-91.2	160.8	-150.1	34.3	-37.2	0	0	0	115.8	S897	P895-S897 PolarHBondContact O-N 3.36Å
896	R	36.6	Very low	38.3	Very low	251 Å²	251	158.5 Å²	158.5	95%	0.947	85%	0.85	S	S	*	*			trans	-55.6	128	167.4	-75.2	175.2	164.6	174.5	-5.6	111.5
897	S	34.5	Very low	38	Very low	103 Å²	103	161.7 Å²	161.7	72%	0.72	86%	0.856	S	S	*	*			trans	-153.3	154.4	146	77	0	0	0	0	112.5	P895	P895-S897 PolarHBondContact O-N 3.36Å
898	L	35.8	Very low	37.4	Very low	172 Å²	172	164.7 Å²	164.7	90%	0.901	86%	0.863	S	S	*	*			trans	70.2	136.5	162.5	-64.1	169.6	0	0	0	120.7
899	R	36	Very low	36.5	Very low	252 Å²	252	168.2 Å²	168.2	95%	0.951	87%	0.871	S	S	*	*			trans	-78.1	156.5	176.8	-57.3	162.8	167.9	178.3	-6.6	110.8
900	G	33.6	Very low	36.1	Very low	77 Å²	77	171.5 Å²	171.5	79%	0.794	88%	0.875	S	S	*	*			trans	-159.2	135.5	159.5	0	0	0	0	0	110.9
901	K	36.7	Very low	35.7	Very low	198 Å²	198	172.8 Å²	172.8	86%	0.861	88%	0.879	S	S	*	*			trans	-84.7	141.9	168.6	-62.1	176.5	178.4	-179.5	0	108.7
902	Y	36	Very low	35.2	Very low	302 Å²	302	177.2 Å²	177.2	100%	1.184	89%	0.885	S	S	*	*				-160.2	0	106.9	-100.4	-68.2	0	0	0	109.7

Retrieved 902 of 902 residues in 241.8 ms (Link to these results)

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