A0A096NFG3_PAPAN Loading...

Spastin

ATP-dependent microtubule severing protein that specifically recognizes and cuts microtubules that are polyglutamylated. Preferentially recognizes and acts on microtubules decorated with short polyglutamate tails: severing activity increases as the number of glutamates per tubulin rises from one to eight, but decreases beyond this glutamylation threshold. Severing activity is not dependent on tubulin acetylation or detyrosination. Microtubule severing promotes reorganization of cellular microtubule arrays and the release of microtubules from the centrosome following nucleation. It is critical for the biogenesis and maintenance of complex microtubule arrays in axons, spindles and cilia. SPAST is involved in abscission step of cytokinesis and nuclear envelope reassembly during anaphase in cooperation with the ESCRT-III complex. Recruited at the midbody, probably by IST1, and participates in membrane fission during abscission together with the ESCRT-III complex. Recruited to the nuclear membrane by IST1 and mediates microtubule severing, promoting nuclear envelope sealing and mitotic spindle disassembly during late anaphase. Required for membrane traffic from the endoplasmic reticulum (ER) to the Golgi and endosome recycling. Recruited by IST1 to endosomes and regulates early endosomal tubulation and recycling by mediating microtubule severing. Probably plays a role in axon growth and the formation of axonal branches.

AlphaFold DB , UniProt , Accession A0A096NFG3, Species PAPAN (Papio anubis, Olive baboon), Gene SPAST, Length 614 aa.

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(Predicted Aligned Error values between residue pairs)

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Site	Residue	pLDDT	pLDDT confidence	pLDDT₁₀	pLDDT10 confidence	SASA	SASA [Å²]	SASA₁₀	SASA10 [Å²]	RSA	RSA unformatted	RSA₁₀	RSA10 unformatted	Surface	Surface10 (not used)	Disorder (not used)	Disorder	Sec. str.	Secondary structure	Isomer	Phi (φ)	Psi (ψ)	Omega (ω)	Chi 1 (χ₁)	Chi 2 (χ₂)	Chi 3 (χ₃)	Chi 4 (χ₄)	Chi 5 (χ₅)	Tau (τ)	Contacts (colored by PAE)	Contact details
1	M	36.9	Very low	38.6	Very low	236 Å²	236	161.9 Å²	161.9	100%	1.163	91%	0.905	S	S	*	*				0	145.9	0	-71.6	125.1	72.9	0	0	109.2
2	N	35.2	Very low	38.1	Very low	155 Å²	155	154.8 Å²	154.8	83%	0.829	90%	0.895	S	S	*	*			trans	20	141.6	162.9	-58.6	6.8	0	0	0	123.4
3	S	35.3	Very low	37.9	Very low	116 Å²	116	152.3 Å²	152.3	81%	0.811	89%	0.892	S	S	*	*			trans	94.3	107.8	143.8	-60.9	0	0	0	0	120.3
4	P	52.9	Low	37.5	Very low	131 Å²	131	147.5 Å²	147.5	85%	0.851	89%	0.891	S	S	*	*			trans	-105.1	165.9	161.6	39.4	-31.8	0	0	0	113.3
5	G	37.3	Very low	37.2	Very low	86 Å²	86	143 Å²	143	89%	0.887	89%	0.887	S	S	*	*			trans	101.6	136.4	151.7	0	0	0	0	0	117.3
6	G	35.9	Very low	37.3	Very low	83 Å²	83	140.6 Å²	140.6	86%	0.856	89%	0.886	S	S	*	*			trans	-164.5	83.9	176.6	0	0	0	0	0	112.3
7	R	38.8	Very low	37.3	Very low	263 Å²	263	138.8 Å²	138.8	99%	0.992	88%	0.878	S	S	*	*			trans	-84.5	121.5	175.3	-104.7	-179.2	172.3	172.6	-1	110.3
8	G	38.4	Very low	37.4	Very low	80 Å²	80	140.1 Å²	140.1	83%	0.825	88%	0.878	S	S	*	*			trans	-121.1	108.1	171.4	0	0	0	0	0	112.5
9	K	37.1	Very low	38.2	Very low	211 Å²	211	138.6 Å²	138.6	92%	0.917	87%	0.87	S	S	*	*			trans	-101.7	135.3	165.6	-87.7	-173.9	174.1	-178.8	0	109.3
10	K	39.8	Very low	38.8	Very low	213 Å²	213	138.7 Å²	138.7	93%	0.926	87%	0.869	S	S	*	*			trans	-145.6	140.1	152.2	-112.6	-179.5	-178.9	-179	0	111.5
11	K	37.4	Very low	39.8	Very low	207 Å²	207	137.3 Å²	137.3	90%	0.9	86%	0.862	S	S	*	*			trans	-78.3	162.9	160.2	-56.2	175.9	-178.5	180	0	107.7
12	G	32.7	Very low	40.7	Very low	76 Å²	76	132.1 Å²	132.1	78%	0.784	85%	0.845	S	S	*	*			cis	144.9	106.6	-2.7	0	0	0	0	0	111.4
13	S	35.6	Very low	41.4	Very low	123 Å²	123	136.2 Å²	136.2	86%	0.86	85%	0.849	S	S	*	*			trans	-164	144.3	174.6	49.6	0	0	0	0	106.5
14	G	31.7	Very low	42.4	Very low	85 Å²	85	136.2 Å²	136.2	88%	0.876	85%	0.846	S	S	*	*			cis	123.5	78.3	18	0	0	0	0	0	108.2
15	G	33.2	Very low	42.5	Very low	80 Å²	80	135.5 Å²	135.5	83%	0.825	84%	0.841	S	S	*	*			trans	-165.1	140.2	-173.4	0	0	0	0	0	111.5
16	A	38.5	Very low	43.3	Very low	105 Å²	105	137 Å²	137	87%	0.868	84%	0.836	S	S	*	*			trans	-75.1	153.3	-162.8	0	0	0	0	0	115.3
17	S	38.3	Very low	43.9	Very low	109 Å²	109	138.7 Å²	138.7	76%	0.762	83%	0.831	S	S	*	*			trans	-79.3	143.3	165.6	52.9	0	0	0	0	112.1
18	N	38.5	Very low	43.9	Very low	163 Å²	163	132.4 Å²	132.4	87%	0.872	83%	0.826	S	S	*	*			trans	-155.1	159.2	150.5	-109.3	-19.8	0	0	0	111.3
19	P	51.7	Low	44.1	Very low	112 Å²	112	136.7 Å²	136.7	73%	0.727	83%	0.83	S	S	*	*	P	Polyproline II helix	trans	-93.9	164.4	-158.5	36.4	-37.8	0	0	0	115.6
20	V	51.4	Low	44.3	Very low	140 Å²	140	131.3 Å²	131.3	85%	0.848	83%	0.825	S	S	*	*	P	Polyproline II helix	trans	-90	132.8	170.4	-178.9	0	0	0	0	109.8
21	P	59.6	Low	44.6	Very low	110 Å²	110	127 Å²	127	71%	0.714	82%	0.821	S	S	*	*	P	Polyproline II helix	trans	-80.7	156.9	-177.6	32.2	-36.1	0	0	0	114
22	P	56.1	Low	44.7	Very low	126 Å²	126	121.5 Å²	121.5	82%	0.818	81%	0.814	S	S	*	*	P	Polyproline II helix	trans	-77.4	158.5	178.6	32.8	-36.1	0	0	0	113.4
23	R	48.5	Very low	45.4	Very low	242 Å²	242	123.7 Å²	123.7	91%	0.913	82%	0.815	S	S	*	*	P	Polyproline II helix	trans	-88.8	150.3	169.6	-81.8	-171.1	173.2	-160.8	-1.3	111.9
24	P	56.1	Low	46	Very low	116 Å²	116	124 Å²	124	75%	0.753	81%	0.813	S	S	*	*	P	Polyproline II helix	trans	-80.8	161.1	-177.7	34	-37.1	0	0	0	113.6
25	P	55.4	Low	46.7	Very low	115 Å²	115	124.7 Å²	124.7	75%	0.747	81%	0.811	S	S	*	*	P	Polyproline II helix	trans	-82.4	151.5	175.6	34.1	-35.3	0	0	0	113.2
26	P	54	Low	47.3	Very low	118 Å²	118	125.9 Å²	125.9	77%	0.766	81%	0.813	S	S	*	*	P	Polyproline II helix	trans	-76.4	159.8	166.2	33.1	-34.1	0	0	0	112
27	P	49.3	Very low	48	Very low	118 Å²	118	124 Å²	124	77%	0.766	80%	0.804	S	S	*	*	P	Polyproline II helix	trans	-84.8	155.1	-165.4	33.5	-37	0	0	0	115
28	C	39.1	Very low	48.6	Very low	131 Å²	131	125.1 Å²	125.1	89%	0.885	81%	0.809	S	S	*	*	P	Polyproline II helix	trans	-72.9	135.9	168.2	-58	0	0	0	0	111.2
29	L	43	Very low	49.1	Very low	171 Å²	171	121.8 Å²	121.8	90%	0.895	80%	0.804	S	S	*	*			trans	-125.3	153.4	166.4	-86.1	168	0	0	0	110.3
30	A	39.8	Very low	49.6	Very low	98 Å²	98	122 Å²	122	81%	0.81	81%	0.805	S	S	*	*			trans	-78.2	161	-162.4	0	0	0	0	0	114.7
31	S	45.9	Very low	50	Low	123 Å²	123	120.7 Å²	120.7	86%	0.86	80%	0.8	S	S	*	*			trans	-69.3	131.9	-179.1	53.3	0	0	0	0	113.9
32	A	40.5	Very low	49.8	Very low	91 Å²	91	121.6 Å²	121.6	75%	0.752	81%	0.806	S	S	*	*			trans	-129	157.2	164.8	0	0	0	0	0	109
33	P	46.6	Very low	49.8	Very low	122 Å²	122	123 Å²	123	79%	0.792	80%	0.801	S	S	*	*	P	Polyproline II helix	trans	-74.6	155.6	-161.6	29.1	-36.1	0	0	0	114.3
34	P	49.4	Very low	50.3	Low	128 Å²	128	114.6 Å²	114.6	83%	0.831	78%	0.779	S	S	*	*	P	Polyproline II helix	trans	-70	134.8	179.9	29.1	-34.9	0	0	0	112
35	A	44.9	Very low	50.3	Low	100 Å²	100	113.5 Å²	113.5	83%	0.826	77%	0.772	S	S	*	*	P	Polyproline II helix	trans	-69.6	149.7	169.4	0	0	0	0	0	111.3	G37	A35-G37 PolarHBondContact O-N 3.26Å
36	A	47.3	Very low	50.4	Low	105 Å²	105	115.3 Å²	115.3	87%	0.868	77%	0.771	S	S	*	*	P	Polyproline II helix	trans	-67	128.5	-178.2	0	0	0	0	0	112.2
37	G	52.4	Low	50.4	Low	66 Å²	66	116.2 Å²	116.2	68%	0.68	76%	0.762	S	S	*	*	P	Polyproline II helix	trans	-74	158.9	171	0	0	0	0	0	112.6	A35	A35-G37 PolarHBondContact O-N 3.26Å
38	P	50.1	Low	50.8	Low	133 Å²	133	118.8 Å²	118.8	86%	0.864	76%	0.757	S	S	*	*	P	Polyproline II helix	trans	-66.6	147.2	179.2	28.7	-35.1	0	0	0	112
39	A	50.8	Low	51.5	Low	93 Å²	93	117.8 Å²	117.8	77%	0.769	74%	0.743	S	S	*	*	P	Polyproline II helix	trans	-68.5	146.4	-177.2	0	0	0	0	0	112.9
40	P	60.3	Low	52.2	Low	115 Å²	115	115.9 Å²	115.9	75%	0.747	73%	0.733	S	S	*	*	P	Polyproline II helix	trans	-68.5	151.7	173.4	30	-35.2	0	0	0	111.6
41	P	60.8	Low	53.2	Low	114 Å²	114	119.7 Å²	119.7	74%	0.74	73%	0.727	S	S	*	*	P	Polyproline II helix	trans	-67.4	150.9	178.4	29.1	-35.4	0	0	0	111.9	E43	P41-E43 PolarHBondContact O-N 3.44Å
42	P	54.5	Low	54	Low	129 Å²	129	122 Å²	122	84%	0.838	72%	0.718	S	S	*	*	P	Polyproline II helix	trans	-66.7	128.2	-178.3	27.1	-34.4	0	0	0	111.9
43	E	57.9	Low	55.1	Low	155 Å²	155	125.1 Å²	125.1	72%	0.724	72%	0.716	S	S	*	*	P	Polyproline II helix	trans	-66.6	139.7	174.3	-70.4	-152.3	113	0	0	112	P41	P41-E43 PolarHBondContact O-N 3.44Å
44	S	58.5	Low	56.1	Low	65 Å²	65	121.2 Å²	121.2	46%	0.455	69%	0.691	S	S	.	*	P	Polyproline II helix	trans	-70.3	135	178	60	0	0	0	0	111.7	H46 K47	S44-H46 PolarHBondContact O-N 3.41Å; S44-K47 PolarHBondContact O-N 3.49Å
45	P	56.6	Low	57.2	Low	93 Å²	93	122.6 Å²	122.6	60%	0.604	68%	0.681	S	S	*	*	H	α-helix	trans	-61.8	-23.6	-170.1	22.2	-33.6	0	0	0	113.9	K47 R48 N49	P45-K47 VanDerWaalsContact C-N 3.33Å; P45-K47 PolarHBondContact O-N 3.37Å; P45-R48 PolarHBondContact O-N 3.09Å; P45-N49 PolarHBondContact O-N 3.04Å
46	H	56.6	Low	58.6	Low	154 Å²	154	121.7 Å²	121.7	71%	0.713	67%	0.666	S	S	*	*	H	α-helix	trans	-61.7	-33.6	178.4	-68.3	-78.7	0	0	0	114	S44 L50	S44-H46 PolarHBondContact O-N 3.41Å; H46-L50 PolarHBondContact O-N 3.11Å
47	K	54.9	Low	60.1	Low	136 Å²	136	121 Å²	121	59%	0.591	65%	0.647	S	S	*	*	H	α-helix	trans	-65.5	-40.3	177.6	-78.8	-172.5	175.3	-178.1	0	112.1	S44 P45 L50	S44-K47 PolarHBondContact O-N 3.49Å; P45-K47 VanDerWaalsContact C-N 3.33Å; P45-K47 PolarHBondContact O-N 3.37Å; K47-L50 PolarHBondContact O-N 3.48Å
48	R	56.1	Low	61.3	Low	173 Å²	173	125.2 Å²	125.2	65%	0.653	65%	0.647	S	S	*	*	H	α-helix	trans	-66.2	-43.3	-176.7	-164.2	169.4	176.9	-177.9	-3.2	111.4	P45 L50 Y51 Y52	P45-R48 PolarHBondContact O-N 3.09Å; R48-L50 VanDerWaalsContact C-N 3.34Å; R48-L50 PolarHBondContact O-N 2.77Å; R48-Y51 PolarHBondContact O-N 3.32Å; R48-Y52 HydrophobicContact CG-CD2 4.43Å; R48-Y52 HydrophobicContact CG-CE2 4.22Å; R48-Y52 WeakPolarHBondContact O-CD2 3.48Å; R48-Y52 PolarHBondContact O-N 3Å
49	N	55.6	Low	62.8	Low	110 Å²	110	122.1 Å²	122.1	59%	0.588	63%	0.626	S	S	*	*	H	α-helix	trans	-65.1	-33.8	179	-71	-1.7	0	0	0	113.3	P45 Y51 Y52 F53	P45-N49 PolarHBondContact O-N 3.04Å; N49-Y51 VanDerWaalsContact C-N 3.31Å; N49-Y51 PolarHBondContact O-N 3.21Å; N49-Y52 PolarHBondContact O-N 2.65Å; N49-F53 PolarHBondContact O-N 2.8Å; N49-F53 VanDerWaalsContact O-N 3.17Å
50	L	57.6	Low	64.4	Low	131 Å²	131	119.5 Å²	119.5	69%	0.686	61%	0.608	S	S	*	*	H	α-helix	trans	-64.9	-35.3	-180	-162	73.7	0	0	0	112.3	H46 K47 R48 S54	H46-L50 PolarHBondContact O-N 3.11Å; K47-L50 PolarHBondContact O-N 3.48Å; R48-L50 VanDerWaalsContact C-N 3.34Å; R48-L50 PolarHBondContact O-N 2.77Å; L50-S54 WeakPolarHBondContact O-CB 3.36Å; L50-S54 PolarHBondContact O-N 3.28Å; L50-S54 VanDerWaalsContact O-N 3.08Å; L50-S54 PolarHBondContact O-OG 2.99Å
51	Y	59.1	Low	65.5	Low	177 Å²	177	120.5 Å²	120.5	69%	0.694	60%	0.601	S	S	*	*	H	α-helix	trans	-69.9	-44.4	177.7	-123.5	-88.2	0	0	0	112.1	R48 N49 F53 S54 Y55	R48-Y51 PolarHBondContact O-N 3.32Å; N49-Y51 VanDerWaalsContact C-N 3.31Å; N49-Y51 PolarHBondContact O-N 3.21Å; Y51-F53 VanDerWaalsContact C-N 3.29Å; Y51-F53 PolarHBondContact O-N 3.04Å; Y51-S54 PolarHBondContact O-OG 3.37Å; Y51-Y55 WeakPolarHBondContact O-CB 3.37Å; Y51-Y55 PolarHBondContact O-N 2.89Å
52	Y	63.5	Low	66.6	Low	171 Å²	171	118 Å²	118	67%	0.671	59%	0.589	S	S	*	*	H	α-helix	trans	-63.9	-31	177.4	-83.6	-78.8	0	0	0	113.3	R48 N49 P56	R48-Y52 HydrophobicContact CG-CD2 4.43Å; R48-Y52 HydrophobicContact CG-CE2 4.22Å; R48-Y52 WeakPolarHBondContact O-CD2 3.48Å; R48-Y52 PolarHBondContact O-N 3Å; N49-Y52 PolarHBondContact O-N 2.65Å; Y52-P56 WeakPolarHBondContact O-CD 3.43Å; Y52-P56 WeakPolarHBondContact O-CG 3.29Å
53	F	63.3	Low	68.1	Low	158 Å²	158	116.8 Å²	116.8	69%	0.693	58%	0.576	S	S	*	*	H	α-helix	trans	-85.1	-35.8	179.6	-156.1	-90.6	0	0	0	113.5	N49 Y51 L57	N49-F53 PolarHBondContact O-N 2.8Å; N49-F53 VanDerWaalsContact O-N 3.17Å; Y51-F53 VanDerWaalsContact C-N 3.29Å; Y51-F53 PolarHBondContact O-N 3.04Å; F53-L57 HydrophobicContact CD1-CD1 4.06Å; F53-L57 HydrophobicContact CE1-CD1 3.98Å
54	S	68.6	Low	69.5	Low	39 Å²	39	114.8 Å²	114.8	27%	0.273	57%	0.569	S	S	.	*	H	α-helix	trans	-78.2	-36.7	-177.3	55.1	0	0	0	0	113.7	L50 Y51 L57 F58	L50-S54 WeakPolarHBondContact O-CB 3.36Å; L50-S54 PolarHBondContact O-N 3.28Å; L50-S54 VanDerWaalsContact O-N 3.08Å; L50-S54 PolarHBondContact O-OG 2.99Å; Y51-S54 PolarHBondContact O-OG 3.37Å; S54-L57 WeakPolarHBondContact O-CB 3.33Å; S54-L57 PolarHBondContact O-N 3.42Å; S54-F58 VanDerWaalsContact O-CD2 3.29Å; S54-F58 WeakPolarHBondContact O-CD2 3.45Å; S54-F58 PolarHBondContact O-N 3.17Å
55	Y	72.4	Confident	70.8	Confident	158 Å²	158	121.5 Å²	121.5	62%	0.62	58%	0.584	S	S	*	*	H	α-helix	trans	-58.9	-49.4	-177.4	-157.1	-96.7	0	0	0	114.5	Y51 L57 F58 V59	Y51-Y55 WeakPolarHBondContact O-CB 3.37Å; Y51-Y55 PolarHBondContact O-N 2.89Å; Y55-L57 VanDerWaalsContact C-N 3.28Å; Y55-L57 PolarHBondContact O-N 3.29Å; Y55-F58 PolarHBondContact O-N 3.48Å; Y55-V59 HydrophobicContact CD1-CG2 4.25Å; Y55-V59 HydrophobicContact CE1-CG2 4.1Å; Y55-V59 WeakPolarHBondContact O-CG2 3.38Å; Y55-V59 PolarHBondContact O-N 3.03Å; Y55-V59 VanDerWaalsContact O-N 3.09Å
56	P	74.8	Confident	72.3	Confident	80 Å²	80	121.7 Å²	121.7	52%	0.519	58%	0.58	S	S	.	*	H	α-helix	trans	-65.3	-29.6	177.1	26.1	-34.9	0	0	0	113	Y52 V59 G60	Y52-P56 WeakPolarHBondContact O-CD 3.43Å; Y52-P56 WeakPolarHBondContact O-CG 3.29Å; P56-V59 PolarHBondContact O-N 2.92Å; P56-G60 PolarHBondContact O-N 2.95Å
57	L	77.8	Confident	74	Confident	91 Å²	91	118 Å²	118	48%	0.476	57%	0.568	S	S	.	*	H	α-helix	trans	-65	-45.6	173.2	-88	165.3	0	0	0	111.7	F53 S54 Y55 V59 G60 F61	F53-L57 HydrophobicContact CD1-CD1 4.06Å; F53-L57 HydrophobicContact CE1-CD1 3.98Å; S54-L57 WeakPolarHBondContact O-CB 3.33Å; S54-L57 PolarHBondContact O-N 3.42Å; Y55-L57 VanDerWaalsContact C-N 3.28Å; Y55-L57 PolarHBondContact O-N 3.29Å; L57-V59 PolarHBondContact O-N 3.44Å; L57-G60 PolarHBondContact O-N 3.22Å; L57-F61 WeakPolarHBondContact O-CD2 3.34Å; L57-F61 PolarHBondContact O-N 2.95Å
58	F	77.4	Confident	75.5	Confident	154 Å²	154	114.2 Å²	114.2	68%	0.675	56%	0.562	S	S	*	*	H	α-helix	trans	-62.5	-40.4	175.8	-81.8	-68.6	0	0	0	112.5	S54 Y55 F61 A62	S54-F58 VanDerWaalsContact O-CD2 3.29Å; S54-F58 WeakPolarHBondContact O-CD2 3.45Å; S54-F58 PolarHBondContact O-N 3.17Å; Y55-F58 PolarHBondContact O-N 3.48Å; F58-F61 PolarHBondContact O-N 3.18Å; F58-A62 WeakPolarHBondContact O-CB 3.49Å; F58-A62 PolarHBondContact O-N 3.36Å
59	V	81.8	Confident	77.2	Confident	68 Å²	68	112.4 Å²	112.4	41%	0.412	56%	0.559	S	S	.	*	H	α-helix	trans	-63.6	-41.7	174	174.4	0	0	0	0	111.3	Y55 P56 L57 A62 L63	Y55-V59 HydrophobicContact CD1-CG2 4.25Å; Y55-V59 HydrophobicContact CE1-CG2 4.1Å; Y55-V59 WeakPolarHBondContact O-CG2 3.38Å; Y55-V59 PolarHBondContact O-N 3.03Å; Y55-V59 VanDerWaalsContact O-N 3.09Å; P56-V59 PolarHBondContact O-N 2.92Å; L57-V59 PolarHBondContact O-N 3.44Å; V59-A62 PolarHBondContact O-N 2.89Å; V59-L63 HydrophobicContact CG1-CD1 4.24Å; V59-L63 PolarHBondContact O-N 3.28Å
60	G	84.7	Confident	78.8	Confident	38 Å²	38	112.3 Å²	112.3	39%	0.392	56%	0.555	S	S	.	*	H	α-helix	trans	-60.9	-45	174.9	0	0	0	0	0	113.3	P56 L57 L63 L64	P56-G60 PolarHBondContact O-N 2.95Å; L57-G60 PolarHBondContact O-N 3.22Å; G60-L63 PolarHBondContact O-N 2.89Å; G60-L64 WeakPolarHBondContact O-CB 3.35Å; G60-L64 PolarHBondContact O-N 2.93Å
61	F	84.2	Confident	80.3	Confident	137 Å²	137	111.2 Å²	111.2	60%	0.601	55%	0.549	S	S	*	.	H	α-helix	trans	-65.6	-35.8	175	-86.8	-71.6	0	0	0	112.9	L57 F58 R65	L57-F61 WeakPolarHBondContact O-CD2 3.34Å; L57-F61 PolarHBondContact O-N 2.95Å; F58-F61 PolarHBondContact O-N 3.18Å; F61-R65 WeakPolarHBondContact O-CB 3.37Å; F61-R65 PolarHBondContact O-N 3.27Å
62	A	82.4	Confident	81.6	Confident	60 Å²	60	104.5 Å²	104.5	50%	0.496	53%	0.534	S	S	.	.	H	α-helix	trans	-64.9	-45.4	174.4	0	0	0	0	0	111.8	F58 V59 R65 L66	F58-A62 WeakPolarHBondContact O-CB 3.49Å; F58-A62 PolarHBondContact O-N 3.36Å; V59-A62 PolarHBondContact O-N 2.89Å; A62-R65 PolarHBondContact O-N 2.94Å; A62-L66 WeakPolarHBondContact O-CB 3.45Å; A62-L66 PolarHBondContact O-N 3.31Å
63	L	86.7	Confident	82.8	Confident	105 Å²	105	100.6 Å²	100.6	55%	0.55	52%	0.524	S	S	.	.	H	α-helix	trans	-60.1	-47.7	173.9	-88.8	162.5	0	0	0	112	V59 G60 R65 L66 V67	V59-L63 HydrophobicContact CG1-CD1 4.24Å; V59-L63 PolarHBondContact O-N 3.28Å; G60-L63 PolarHBondContact O-N 2.89Å; L63-R65 VanDerWaalsContact C-N 3.31Å; L63-R65 PolarHBondContact O-N 3.4Å; L63-L66 PolarHBondContact O-N 2.88Å; L63-L66 VanDerWaalsContact O-N 3.16Å; L63-V67 WeakPolarHBondContact O-CG2 3.49Å; L63-V67 PolarHBondContact O-N 3.38Å
64	L	87.3	Confident	84	Confident	112 Å²	112	98 Å²	98	59%	0.586	52%	0.517	S	S	*	.	H	α-helix	trans	-59.6	-41.6	178.3	-175.6	65.4	0	0	0	111.8	G60 V67 A68	G60-L64 WeakPolarHBondContact O-CB 3.35Å; G60-L64 PolarHBondContact O-N 2.93Å; L64-V67 PolarHBondContact O-N 3.44Å; L64-A68 WeakPolarHBondContact O-CB 3.33Å; L64-A68 PolarHBondContact O-N 2.94Å
65	R	84.8	Confident	84.9	Confident	206 Å²	206	102.8 Å²	102.8	78%	0.777	53%	0.533	S	S	*	.	H	α-helix	trans	-65.6	-37	176.9	-168	176.1	-171.9	173.2	2.6	112.3	F61 A62 L63 F69	F61-R65 WeakPolarHBondContact O-CB 3.37Å; F61-R65 PolarHBondContact O-N 3.27Å; A62-R65 PolarHBondContact O-N 2.94Å; L63-R65 VanDerWaalsContact C-N 3.31Å; L63-R65 PolarHBondContact O-N 3.4Å; R65-F69 WeakPolarHBondContact O-CB 3.37Å; R65-F69 PolarHBondContact O-N 2.79Å
66	L	89.8	Confident	85.5	Confident	98 Å²	98	99 Å²	99	51%	0.513	53%	0.526	S	S	.	.	H	α-helix	trans	-71.4	-42.1	177	-172	138	0	0	0	111.7	A62 L63 F69 H70	A62-L66 WeakPolarHBondContact O-CB 3.45Å; A62-L66 PolarHBondContact O-N 3.31Å; L63-L66 PolarHBondContact O-N 2.88Å; L63-L66 VanDerWaalsContact O-N 3.16Å; L66-F69 PolarHBondContact O-N 3.43Å; L66-H70 PolarHBondContact O-CD2 3.31Å; L66-H70 VanDerWaalsContact O-CD2 3.23Å; L66-H70 PolarHBondContact O-N 2.67Å
67	V	90.5	Very high	86.2	Confident	75 Å²	75	101.8 Å²	101.8	46%	0.455	53%	0.526	S	S	.	.	H	α-helix	trans	-60.7	-45.8	172.2	171.2	0	0	0	0	111.1	L63 L64 F69 H70 L71	L63-V67 WeakPolarHBondContact O-CG2 3.49Å; L63-V67 PolarHBondContact O-N 3.38Å; L64-V67 PolarHBondContact O-N 3.44Å; V67-F69 VanDerWaalsContact C-N 3.3Å; V67-F69 PolarHBondContact O-N 3.24Å; V67-H70 PolarHBondContact O-N 2.95Å; V67-L71 HydrophobicContact CG1-CD1 3.92Å; V67-L71 HydrophobicContact CG1-CG 4.37Å; V67-L71 WeakPolarHBondContact O-CG 3.43Å; V67-L71 PolarHBondContact O-N 3.22Å
68	A	87.6	Confident	86.4	Confident	58 Å²	58	100.8 Å²	100.8	48%	0.479	52%	0.521	S	S	.	.	H	α-helix	trans	-60.4	-38.1	176.4	0	0	0	0	0	112.6	L64 G72	L64-A68 WeakPolarHBondContact O-CB 3.33Å; L64-A68 PolarHBondContact O-N 2.94Å; A68-G72 PolarHBondContact O-N 2.75Å
69	F	90.8	Very high	86.3	Confident	134 Å²	134	96 Å²	96	59%	0.588	51%	0.506	S	S	*	.	H	α-helix	trans	-64.9	-45.2	175	-178.5	-106.2	0	0	0	112.4	R65 L66 V67 G72 L73	R65-F69 WeakPolarHBondContact O-CB 3.37Å; R65-F69 PolarHBondContact O-N 2.79Å; L66-F69 PolarHBondContact O-N 3.43Å; V67-F69 VanDerWaalsContact C-N 3.3Å; V67-F69 PolarHBondContact O-N 3.24Å; F69-G72 PolarHBondContact O-N 2.96Å; F69-L73 HydrophobicContact CD1-CD1 4Å; F69-L73 HydrophobicContact CE1-CD1 3.55Å; F69-L73 HydrophobicContact CE1-CG 4.32Å; F69-L73 HydrophobicContact CZ-CD1 3.97Å; F69-L73 HydrophobicContact CZ-CG 4.37Å; F69-L73 PolarHBondContact O-N 3.37Å
70	H	88.9	Confident	86.1	Confident	108 Å²	108	97.6 Å²	97.6	50%	0.5	51%	0.509	S	S	.	.	H	α-helix	trans	-66.6	-37.1	176.1	-77.5	-70.7	0	0	0	113.1	L66 V67 G72 L73 L74	L66-H70 PolarHBondContact O-CD2 3.31Å; L66-H70 VanDerWaalsContact O-CD2 3.23Å; L66-H70 PolarHBondContact O-N 2.67Å; V67-H70 PolarHBondContact O-N 2.95Å; H70-G72 VanDerWaalsContact C-N 3.35Å; H70-L73 PolarHBondContact O-N 2.97Å; H70-L74 WeakPolarHBondContact O-CB 3.37Å; H70-L74 PolarHBondContact O-N 3.17Å
71	L	89	Confident	85.9	Confident	108 Å²	108	103.2 Å²	103.2	57%	0.565	52%	0.519	S	S	*	.	H	α-helix	trans	-63.3	-40	171.7	-72	171.5	0	0	0	111.7	V67 L74 F75	V67-L71 HydrophobicContact CG1-CD1 3.92Å; V67-L71 HydrophobicContact CG1-CG 4.37Å; V67-L71 WeakPolarHBondContact O-CG 3.43Å; V67-L71 PolarHBondContact O-N 3.22Å; L71-L74 PolarHBondContact O-N 3.48Å; L71-F75 WeakPolarHBondContact O-CB 3.35Å; L71-F75 PolarHBondContact O-N 2.8Å
72	G	87.2	Confident	85.2	Confident	36 Å²	36	103.4 Å²	103.4	37%	0.371	52%	0.519	S	S	.	.	H	α-helix	trans	-61.8	-44.7	173.6	0	0	0	0	0	113	A68 F69 H70 F75 V76	A68-G72 PolarHBondContact O-N 2.75Å; F69-G72 PolarHBondContact O-N 2.96Å; H70-G72 VanDerWaalsContact C-N 3.35Å; G72-F75 PolarHBondContact O-N 3.41Å; G72-V76 WeakPolarHBondContact O-CG2 3.31Å; G72-V76 PolarHBondContact O-N 3.17Å
73	L	88.9	Confident	84.5	Confident	89 Å²	89	104 Å²	104	47%	0.466	52%	0.52	S	S	.	.	H	α-helix	trans	-62	-42.9	174	-73.2	173.7	0	0	0	112.2	F69 H70 V76 W77	F69-L73 HydrophobicContact CD1-CD1 4Å; F69-L73 HydrophobicContact CE1-CD1 3.55Å; F69-L73 HydrophobicContact CE1-CG 4.32Å; F69-L73 HydrophobicContact CZ-CD1 3.97Å; F69-L73 HydrophobicContact CZ-CG 4.37Å; F69-L73 PolarHBondContact O-N 3.37Å; H70-L73 PolarHBondContact O-N 2.97Å; L73-V76 PolarHBondContact O-N 2.96Å; L73-W77 WeakPolarHBondContact O-CB 3.42Å; L73-W77 PolarHBondContact O-N 2.67Å
74	L	88.9	Confident	83.8	Confident	105 Å²	105	106.8 Å²	106.8	55%	0.55	52%	0.523	S	S	.	.	H	α-helix	trans	-65.9	-39.7	178.4	-167.9	149.5	0	0	0	111.3	H70 L71 W77 L78	H70-L74 WeakPolarHBondContact O-CB 3.37Å; H70-L74 PolarHBondContact O-N 3.17Å; L71-L74 PolarHBondContact O-N 3.48Å; L74-W77 PolarHBondContact O-N 3.37Å; L74-L78 WeakPolarHBondContact O-CB 3.27Å; L74-L78 PolarHBondContact O-N 3.41Å
75	F	86.6	Confident	82.9	Confident	139 Å²	139	104.3 Å²	104.3	61%	0.61	52%	0.519	S	S	*	.	H	α-helix	trans	-61.7	-47.9	173	-178.5	-100.1	0	0	0	112	L71 G72 W77 L78 C79	L71-F75 WeakPolarHBondContact O-CB 3.35Å; L71-F75 PolarHBondContact O-N 2.8Å; G72-F75 PolarHBondContact O-N 3.41Å; F75-W77 VanDerWaalsContact C-N 3.32Å; F75-W77 PolarHBondContact O-N 3.41Å; F75-L78 WeakPolarHBondContact O-CB 3.35Å; F75-L78 PolarHBondContact O-N 3.47Å; F75-L78 VanDerWaalsContact O-N 3.15Å; F75-C79 PolarHBondContact O-N 2.71Å; F75-C79 PolarHBondContact O-SG 3.08Å; F75-C79 VanDerWaalsContact O-SG 3.36Å
76	V	86.3	Confident	81.9	Confident	77 Å²	77	100.8 Å²	100.8	47%	0.467	52%	0.515	S	S	.	.	H	α-helix	trans	-60.2	-41.9	176.4	170.1	0	0	0	0	111.4	G72 L73 C79 Q80	G72-V76 WeakPolarHBondContact O-CG2 3.31Å; G72-V76 PolarHBondContact O-N 3.17Å; L73-V76 PolarHBondContact O-N 2.96Å; V76-C79 PolarHBondContact O-N 3.42Å; V76-Q80 WeakPolarHBondContact O-CG 3.13Å; V76-Q80 PolarHBondContact O-N 3.36Å
77	W	87.9	Confident	80.6	Confident	139 Å²	139	102.7 Å²	102.7	53%	0.527	52%	0.522	S	S	.	.	H	α-helix	trans	-62.7	-42.5	174.5	-177.7	91.5	0	0	0	112.1	L73 L74 F75 Q80 R81	L73-W77 WeakPolarHBondContact O-CB 3.42Å; L73-W77 PolarHBondContact O-N 2.67Å; L74-W77 PolarHBondContact O-N 3.37Å; F75-W77 VanDerWaalsContact C-N 3.32Å; F75-W77 PolarHBondContact O-N 3.41Å; W77-Q80 PolarHBondContact O-N 3.36Å; W77-R81 WeakPolarHBondContact O-CB 3.46Å; W77-R81 PolarHBondContact O-N 2.79Å
78	L	82.3	Confident	79.2	Confident	71 Å²	71	102.2 Å²	102.2	37%	0.372	53%	0.526	S	S	.	.	H	α-helix	trans	-63.2	-46.1	177.3	-148.3	76.3	0	0	0	111.1	L74 F75 Q80 R81 F82	L74-L78 WeakPolarHBondContact O-CB 3.27Å; L74-L78 PolarHBondContact O-N 3.41Å; F75-L78 WeakPolarHBondContact O-CB 3.35Å; F75-L78 PolarHBondContact O-N 3.47Å; F75-L78 VanDerWaalsContact O-N 3.15Å; L78-Q80 PolarHBondContact O-N 2.91Å; L78-R81 WeakPolarHBondContact O-CB 3.36Å; L78-R81 PolarHBondContact O-N 3.31Å; L78-R81 VanDerWaalsContact O-N 3.12Å; L78-F82 HydrophobicContact CD2-CE2 4.15Å; L78-F82 HydrophobicContact CG-CD2 4.08Å; L78-F82 HydrophobicContact CG-CE2 3.98Å; L78-F82 WeakPolarHBondContact O-CD2 3.32Å; L78-F82 PolarHBondContact O-N 3.46Å
79	C	75.3	Confident	77.6	Confident	53 Å²	53	102.4 Å²	102.4	36%	0.358	53%	0.528	S	S	.	.	H	α-helix	trans	-57.1	-48.9	173.5	-68.9	0	0	0	0	111.5	F75 V76 R81 F82 S83	F75-C79 PolarHBondContact O-N 2.71Å; F75-C79 PolarHBondContact O-SG 3.08Å; F75-C79 VanDerWaalsContact O-SG 3.36Å; V76-C79 PolarHBondContact O-N 3.42Å; C79-R81 PolarHBondContact O-N 3.44Å; C79-F82 PolarHBondContact O-N 3.44Å; C79-S83 WeakPolarHBondContact O-CB 3.36Å; C79-S83 PolarHBondContact O-N 3.12Å; C79-S83 PolarHBondContact O-OG 3.36Å; C79-S83 VanDerWaalsContact O-OG 3.08Å
80	Q	78.8	Confident	75.7	Confident	102 Å²	102	104 Å²	104	48%	0.477	54%	0.535	S	S	.	.	H	α-helix	trans	-63	-26.6	176.9	-72.6	-175.2	15.6	0	0	113.8	V76 W77 L78 R84	V76-Q80 WeakPolarHBondContact O-CG 3.13Å; V76-Q80 PolarHBondContact O-N 3.36Å; W77-Q80 PolarHBondContact O-N 3.36Å; L78-Q80 PolarHBondContact O-N 2.91Å; Q80-R84 WeakPolarHBondContact O-CB 3.38Å; Q80-R84 WeakPolarHBondContact O-CG 3.4Å; Q80-R84 PolarHBondContact O-N 3.3Å; Q80-R84 PolarHBondContact O-NE 3.41Å
81	R	78.6	Confident	73.8	Confident	155 Å²	155	109.7 Å²	109.7	59%	0.585	55%	0.552	S	S	*	*	H	α-helix	trans	-76.9	-45.8	175.1	-172.4	174.4	176.2	122.4	-0.2	111	W77 L78 C79 R84 A85	W77-R81 WeakPolarHBondContact O-CB 3.46Å; W77-R81 PolarHBondContact O-N 2.79Å; L78-R81 WeakPolarHBondContact O-CB 3.36Å; L78-R81 PolarHBondContact O-N 3.31Å; L78-R81 VanDerWaalsContact O-N 3.12Å; C79-R81 PolarHBondContact O-N 3.44Å; R81-R84 PolarHBondContact O-N 2.96Å; R81-A85 PolarHBondContact O-N 3.35Å
82	F	69.9	Low	71.8	Confident	141 Å²	141	109.7 Å²	109.7	62%	0.618	56%	0.561	S	S	*	*	H	α-helix	trans	-63.6	-44.2	174.7	-87	-73.9	0	0	0	112.6	L78 C79 R84 A85 L86	L78-F82 HydrophobicContact CD2-CE2 4.15Å; L78-F82 HydrophobicContact CG-CD2 4.08Å; L78-F82 HydrophobicContact CG-CE2 3.98Å; L78-F82 WeakPolarHBondContact O-CD2 3.32Å; L78-F82 PolarHBondContact O-N 3.46Å; C79-F82 PolarHBondContact O-N 3.44Å; F82-R84 VanDerWaalsContact C-N 3.29Å; F82-R84 PolarHBondContact O-N 3.47Å; F82-A85 PolarHBondContact O-N 3.3Å; F82-L86 WeakPolarHBondContact O-CB 3.44Å; F82-L86 PolarHBondContact O-N 2.88Å
83	S	68.6	Low	69.7	Low	72 Å²	72	112.3 Å²	112.3	50%	0.503	57%	0.573	S	S	.	*	H	α-helix	trans	-60.5	-37.3	175.9	-59.7	0	0	0	0	112.5	C79 M87	C79-S83 WeakPolarHBondContact O-CB 3.36Å; C79-S83 PolarHBondContact O-N 3.12Å; C79-S83 PolarHBondContact O-OG 3.36Å; C79-S83 VanDerWaalsContact O-OG 3.08Å; S83-M87 WeakPolarHBondContact O-CB 3.31Å; S83-M87 VanDerWaalsContact O-CG 3.26Å; S83-M87 WeakPolarHBondContact O-CG 3.43Å; S83-M87 PolarHBondContact O-N 2.9Å
84	R	71.8	Confident	67.2	Low	165 Å²	165	111.9 Å²	111.9	62%	0.623	59%	0.591	S	S	*	*	H	α-helix	trans	-67.9	-41.6	174.6	-83.1	-177.9	-90.9	-167.3	-11.1	112.4	Q80 R81 F82 M87 A88	Q80-R84 WeakPolarHBondContact O-CB 3.38Å; Q80-R84 WeakPolarHBondContact O-CG 3.4Å; Q80-R84 PolarHBondContact O-N 3.3Å; Q80-R84 PolarHBondContact O-NE 3.41Å; R81-R84 PolarHBondContact O-N 2.96Å; F82-R84 VanDerWaalsContact C-N 3.29Å; F82-R84 PolarHBondContact O-N 3.47Å; R84-M87 PolarHBondContact O-N 3.46Å; R84-A88 PolarHBondContact O-N 3.35Å
85	A	67.8	Low	64.7	Low	59 Å²	59	111.7 Å²	111.7	49%	0.488	61%	0.605	S	S	.	*	H	α-helix	trans	-63	-43.8	174.6	0	0	0	0	0	112.2	R81 F82 M87 A88 A89	R81-A85 PolarHBondContact O-N 3.35Å; F82-A85 PolarHBondContact O-N 3.3Å; A85-M87 PolarHBondContact O-N 3.44Å; A85-A88 PolarHBondContact O-N 2.83Å; A85-A89 PolarHBondContact O-N 2.88Å
86	L	64.6	Low	62.2	Low	133 Å²	133	109.9 Å²	109.9	70%	0.696	62%	0.615	S	S	*	*	H	α-helix	trans	-64.1	-40.4	178.8	-152.4	83.8	0	0	0	112.1	F82 A88 A89 K90	F82-L86 WeakPolarHBondContact O-CB 3.44Å; F82-L86 PolarHBondContact O-N 2.88Å; L86-A88 VanDerWaalsContact C-N 3.34Å; L86-A89 PolarHBondContact O-N 3.43Å; L86-K90 WeakPolarHBondContact O-CB 3.46Å; L86-K90 PolarHBondContact O-N 3.16Å
87	M	63.1	Low	60.1	Low	137 Å²	137	112.2 Å²	112.2	68%	0.675	63%	0.632	S	S	*	*	H	α-helix	trans	-69.4	-28.9	175.7	-74	-67	-160.3	0	0	113.3	S83 R84 A85	S83-M87 WeakPolarHBondContact O-CB 3.31Å; S83-M87 VanDerWaalsContact O-CG 3.26Å; S83-M87 WeakPolarHBondContact O-CG 3.43Å; S83-M87 PolarHBondContact O-N 2.9Å; R84-M87 PolarHBondContact O-N 3.46Å; A85-M87 PolarHBondContact O-N 3.44Å
88	A	59.1	Low	57.7	Low	65 Å²	65	110.4 Å²	110.4	54%	0.537	65%	0.647	S	S	.	*	H	α-helix	trans	-70.4	-48.5	171.7	0	0	0	0	0	111.1	R84 A85 L86 K90 R91	R84-A88 PolarHBondContact O-N 3.35Å; A85-A88 PolarHBondContact O-N 2.83Å; L86-A88 VanDerWaalsContact C-N 3.34Å; A88-K90 VanDerWaalsContact C-N 3.26Å; A88-K90 PolarHBondContact O-N 3.31Å; A88-R91 PolarHBondContact O-N 2.96Å
89	A	55.6	Low	55.6	Low	63 Å²	63	112.6 Å²	112.6	52%	0.521	67%	0.665	S	S	.	*	H	α-helix	trans	-60.3	-33.7	177.5	0	0	0	0	0	113	A85 L86 R91 S92	A85-A89 PolarHBondContact O-N 2.88Å; L86-A89 PolarHBondContact O-N 3.43Å; A89-R91 PolarHBondContact O-N 2.94Å; A89-S92 PolarHBondContact O-OG 2.89Å; A89-S92 VanDerWaalsContact O-OG 3.07Å
90	K	49.9	Very low	53.7	Low	167 Å²	167	114.9 Å²	114.9	73%	0.726	69%	0.687	S	S	*	*	T	Hydrogen-bonded Turn	trans	-75	-6.1	177.4	-161.5	167.3	-177.5	177.4	0	114.2	L86 A88	L86-K90 WeakPolarHBondContact O-CB 3.46Å; L86-K90 PolarHBondContact O-N 3.16Å; A88-K90 VanDerWaalsContact C-N 3.26Å; A88-K90 PolarHBondContact O-N 3.31Å
91	R	49.3	Very low	52	Low	228 Å²	228	115.9 Å²	115.9	86%	0.86	71%	0.706	S	S	*	*	T	Hydrogen-bonded Turn	trans	-93.1	-10.1	177	-85	-177.5	166.7	-176.7	-4.1	114.8	A88 A89	A88-R91 PolarHBondContact O-N 2.96Å; A89-R91 PolarHBondContact O-N 2.94Å
92	S	46.2	Very low	50.1	Low	107 Å²	107	113 Å²	113	75%	0.748	72%	0.715	S	S	*	*	S	Bend	trans	-95.5	2.1	-179.4	50.6	0	0	0	0	114.8	A89	A89-S92 PolarHBondContact O-OG 2.89Å; A89-S92 VanDerWaalsContact O-OG 3.07Å
93	S	44.3	Very low	48.7	Very low	91 Å²	91	112.3 Å²	112.3	64%	0.636	73%	0.725	S	S	*	*	S	Bend	trans	-128.5	93.3	-175.7	61.6	0	0	0	0	112.3
94	G	36.4	Very low	47.4	Very low	81 Å²	81	113.1 Å²	113.1	84%	0.835	74%	0.736	S	S	*	*			trans	132.1	113.5	174.1	0	0	0	0	0	112.7
95	A	36.6	Very low	46	Very low	101 Å²	101	110.2 Å²	110.2	84%	0.835	74%	0.738	S	S	*	*			trans	-140.5	155.5	-179.5	0	0	0	0	0	111.6
96	A	32.8	Very low	44.9	Very low	100 Å²	100	112.9 Å²	112.9	83%	0.826	75%	0.748	S	S	*	*			trans	67.5	154.5	179	0	0	0	0	0	117.2
97	P	42.8	Very low	44.1	Very low	127 Å²	127	112.6 Å²	112.6	83%	0.825	76%	0.755	S	S	*	*			cis	-119.7	167.5	-33.5	36	-22.8	0	0	0	112.3
98	A	38.8	Very low	43.8	Very low	101 Å²	101	108 Å²	108	84%	0.835	74%	0.742	S	S	*	*			trans	-98.1	146.7	-176	0	0	0	0	0	113.7
99	P	37.5	Very low	44.2	Very low	116 Å²	116	106.1 Å²	106.1	75%	0.753	73%	0.729	S	S	*	*			trans	-112.5	148.4	155.3	36.4	-28.2	0	0	0	112.7
100	A	35	Very low	45.3	Very low	101 Å²	101	105 Å²	105	84%	0.835	71%	0.713	S	S	*	*			trans	44.8	121.2	158.6	0	0	0	0	0	120.2	A102	A100-A102 PolarHBondContact O-N 3.03Å
101	S	44.1	Very low	46.8	Very low	124 Å²	124	97.2 Å²	97.2	87%	0.867	68%	0.68	S	S	*	*	P	Polyproline II helix	trans	-58.8	126.7	174.1	50.6	0	0	0	0	114.5
102	A	37.4	Very low	48.5	Very low	93 Å²	93	90.7 Å²	90.7	77%	0.769	66%	0.659	S	S	*	*	P	Polyproline II helix	trans	-94.5	146.3	160.6	0	0	0	0	0	110.6	A100	A100-A102 PolarHBondContact O-N 3.03Å
103	P	41.8	Very low	50.4	Low	128 Å²	128	91.2 Å²	91.2	83%	0.831	65%	0.645	S	S	*	*	P	Polyproline II helix	trans	-73.1	160.4	-176.9	30	-35.7	0	0	0	113.4
104	A	40.2	Very low	52.5	Low	88 Å²	88	86.9 Å²	86.9	73%	0.727	61%	0.614	S	S	*	*	P	Polyproline II helix	trans	-60.4	148.2	-179.9	0	0	0	0	0	113.1	V106	A104-V106 PolarHBondContact O-N 3.4Å
105	P	41.9	Very low	55	Low	104 Å²	104	87.9 Å²	87.9	68%	0.675	59%	0.593	S	S	*	*	P	Polyproline II helix	trans	-72.7	125.1	-172.3	28.5	-34.9	0	0	0	113
106	V	44.8	Very low	57.6	Low	116 Å²	116	86.6 Å²	86.6	70%	0.703	57%	0.574	S	S	*	*	P	Polyproline II helix	trans	-76.8	128.5	172.4	-176.8	0	0	0	0	110.2	A104 G108 G109	A104-V106 PolarHBondContact O-N 3.4Å; V106-G108 PolarHBondContact O-N 3.46Å; V106-G109 PolarHBondContact O-N 3.2Å
107	P	48.6	Very low	60.5	Low	127 Å²	127	84.1 Å²	84.1	83%	0.825	55%	0.545	S	S	*	.	T	Hydrogen-bonded Turn	trans	-55.3	134.6	175.6	-25.9	35	0	0	0	112.2
108	G	55.9	Low	62.9	Low	40 Å²	40	80.5 Å²	80.5	41%	0.412	52%	0.517	S	S	.	.	T	Hydrogen-bonded Turn	trans	92.3	-21.2	-178.1	0	0	0	0	0	115.3	V106 E110 A111	V106-G108 PolarHBondContact O-N 3.46Å; G108-E110 PolarHBondContact O-N 3.45Å; G108-E110 VanDerWaalsContact O-N 3.14Å; G108-A111 PolarHBondContact O-N 3.07Å; G108-A111 VanDerWaalsContact O-N 3.11Å
109	G	67.9	Low	65.5	Low	26 Å²	26	82.2 Å²	82.2	27%	0.268	51%	0.506	S	S	.	.	H	α-helix	trans	-59.2	-28.2	179	0	0	0	0	0	114.3	V106 A111 E112 R113	V106-G109 PolarHBondContact O-N 3.2Å; G109-A111 PolarHBondContact O-N 3.13Å; G109-E112 PolarHBondContact O-N 2.59Å; G109-R113 WeakPolarHBondContact O-CG 3.45Å; G109-R113 PolarHBondContact O-N 3.45Å
110	E	80	Confident	68.1	Low	39 Å²	39	80.3 Å²	80.3	18%	0.182	49%	0.487	C	S	.	.	H	α-helix	trans	-58.4	-44.3	174.7	-71.7	166.1	-171.4	0	0	112.7	G108 E112 R113 V114 V160 V162 T163	G108-E110 PolarHBondContact O-N 3.45Å; G108-E110 VanDerWaalsContact O-N 3.14Å; E110-E112 PolarHBondContact O-N 3.28Å; E110-R113 PolarHBondContact O-N 2.86Å; E110-V114 WeakPolarHBondContact O-CG2 3.43Å; E110-V114 PolarHBondContact O-N 3.29Å; E110-V114 VanDerWaalsContact O-N 3.09Å; E110-V160 HydrophobicContact CB-CG1 4.31Å; E110-V160 HydrophobicContact CG-CG1 4.49Å; E110-V162 WeakPolarHBondContact OE2-CA 3.44Å; E110-T163 PolarHBondContact OE1-OG1 3.05Å; E110-T163 PolarHBondContact OE2-N 3.16Å; E110-T163 PolarHBondContact OE2-OG1 3.45Å
111	A	80.6	Confident	70.9	Confident	3 Å²	3	75.5 Å²	75.5	3%	0.025	45%	0.447	C	S	.	.	H	α-helix	trans	-71.7	-19	-178.1	0	0	0	0	0	112.9	G108 G109 R115 A172	G108-A111 PolarHBondContact O-N 3.07Å; G108-A111 VanDerWaalsContact O-N 3.11Å; G109-A111 PolarHBondContact O-N 3.13Å; A111-R115 PolarHBondContact O-NE 2.74Å; A111-R115 PolarHBondContact O-NH2 2.75Å; A111-A172 HydrophobicContact CB-CB 3.94Å
112	E	84.4	Confident	73.3	Confident	92 Å²	92	75.4 Å²	75.4	43%	0.43	43%	0.431	S	S	.	.	H	α-helix	trans	-84.1	-42.2	170.1	-158.6	63.3	-108.1	0	0	111.2	G109 E110 V114 R115 V116	G109-E112 PolarHBondContact O-N 2.59Å; E110-E112 PolarHBondContact O-N 3.28Å; E112-V114 VanDerWaalsContact C-N 3.33Å; E112-V114 PolarHBondContact O-N 3.33Å; E112-R115 VanDerWaalsContact CD-NH2 3.3Å; E112-R115 WeakPolarHBondContact O-CA 3.3Å; E112-R115 WeakPolarHBondContact O-CB 3.4Å; E112-R115 PolarHBondContact O-N 2.78Å; E112-R115 IonicContact OE1-CZ 3.44Å; E112-R115 IonicContact OE1-NE 3.34Å; E112-R115 IonicContact OE1-NH1 2.74Å; E112-R115 PolarHBondContact OE1-NH1 3.05Å; E112-R115 IonicContact OE1-NH2 3.15Å; E112-R115 IonicContact OE2-CZ 2.73Å; E112-R115 IonicContact OE2-NH1 3.21Å; E112-R115 PolarHBondContact OE2-NH1 2.77Å; E112-R115 IonicContact OE2-NH2 2.67Å; E112-R115 PolarHBondContact OE2-NH2 3.28Å; E112-V116 PolarHBondContact O-N 2.98Å
113	R	86.3	Confident	76	Confident	117 Å²	117	75 Å²	75	44%	0.442	41%	0.414	S	S	.	.	H	α-helix	trans	-54.9	-45.4	174.7	-72.2	-169.8	-66.1	-115	8.1	112.3	G109 E110 R115 V116 F117 V160	G109-R113 WeakPolarHBondContact O-CG 3.45Å; G109-R113 PolarHBondContact O-N 3.45Å; E110-R113 PolarHBondContact O-N 2.86Å; R113-R115 VanDerWaalsContact C-N 3.28Å; R113-R115 PolarHBondContact O-N 2.73Å; R113-V116 PolarHBondContact O-N 3.41Å; R113-F117 HydrophobicContact CB-CE2 4.45Å; R113-F117 WeakPolarHBondContact O-CD2 3.25Å; R113-F117 PolarHBondContact O-N 2.87Å; R113-V160 HydrophobicContact CB-CG1 4.44Å; R113-V160 HydrophobicContact CB-CG2 4.39Å
114	V	88.2	Confident	78.5	Confident	0 Å²	0	72.1 Å²	72.1	0%	0	39%	0.386	C	S	.	.	H	α-helix	trans	-57.6	-40.4	174.1	175.7	0	0	0	0	111.8	E110 E112 H118 V160 V162 L175 Q176 M179	E110-V114 WeakPolarHBondContact O-CG2 3.43Å; E110-V114 PolarHBondContact O-N 3.29Å; E110-V114 VanDerWaalsContact O-N 3.09Å; E112-V114 VanDerWaalsContact C-N 3.33Å; E112-V114 PolarHBondContact O-N 3.33Å; V114-H118 VanDerWaalsContact O-CB 3.3Å; V114-H118 WeakPolarHBondContact O-CB 3.3Å; V114-H118 PolarHBondContact O-N 3.4Å; V114-V160 HydrophobicContact CG2-CB 3.8Å; V114-V160 HydrophobicContact CG2-CG1 3.85Å; V114-V160 HydrophobicContact CG2-CG2 4.35Å; V114-V162 HydrophobicContact CG2-CG2 3.87Å; V114-L175 HydrophobicContact CG1-CB 4.39Å; V114-L175 HydrophobicContact CG1-CD2 4.08Å; V114-L175 HydrophobicContact CG1-CG 4.34Å; V114-Q176 HydrophobicContact CG1-CG 3.66Å; V114-Q176 HydrophobicContact CG2-CG 4.2Å; V114-M179 HydrophobicContact CG1-SD 4.09Å
115	R	89.1	Confident	81.1	Confident	103 Å²	103	69.2 Å²	69.2	39%	0.389	36%	0.358	S	S	.	.	H	α-helix	trans	-71.2	-35.9	179.6	-81.8	179.3	-77.1	135.2	0.4	112.9	A111 E112 R113 K119 L175	A111-R115 PolarHBondContact O-NE 2.74Å; A111-R115 PolarHBondContact O-NH2 2.75Å; E112-R115 VanDerWaalsContact CD-NH2 3.3Å; E112-R115 WeakPolarHBondContact O-CA 3.3Å; E112-R115 WeakPolarHBondContact O-CB 3.4Å; E112-R115 PolarHBondContact O-N 2.78Å; E112-R115 IonicContact OE1-CZ 3.44Å; E112-R115 IonicContact OE1-NE 3.34Å; E112-R115 IonicContact OE1-NH1 2.74Å; E112-R115 PolarHBondContact OE1-NH1 3.05Å; E112-R115 IonicContact OE1-NH2 3.15Å; E112-R115 IonicContact OE2-CZ 2.73Å; E112-R115 IonicContact OE2-NH1 3.21Å; E112-R115 PolarHBondContact OE2-NH1 2.77Å; E112-R115 IonicContact OE2-NH2 2.67Å; E112-R115 PolarHBondContact OE2-NH2 3.28Å; R113-R115 VanDerWaalsContact C-N 3.28Å; R113-R115 PolarHBondContact O-N 2.73Å; R115-K119 WeakPolarHBondContact O-CB 3.41Å; R115-K119 PolarHBondContact O-N 3.39Å; R115-L175 HydrophobicContact CB-CD2 4.49Å; R115-L175 HydrophobicContact CG-CD2 3.56Å
116	V	91.9	Very high	83.5	Confident	73 Å²	73	65.3 Å²	65.3	44%	0.442	33%	0.334	S	S	.	.	H	α-helix	trans	-62.9	-52.1	173.3	173.6	0	0	0	0	110.7	E112 R113 H118 K119 Q120	E112-V116 PolarHBondContact O-N 2.98Å; R113-V116 PolarHBondContact O-N 3.41Å; V116-H118 PolarHBondContact O-N 2.82Å; V116-K119 PolarHBondContact O-N 2.88Å; V116-K119 VanDerWaalsContact O-N 3.11Å; V116-Q120 PolarHBondContact O-N 3.16Å
117	F	92.5	Very high	85.6	Confident	49 Å²	49	62 Å²	62	22%	0.215	31%	0.312	C	S	.	.	H	α-helix	trans	-61.5	-42	177.4	-69.9	-54	0	0	0	112.4	R113 K119 Q120 A121 E153 K156 V160 M179	R113-F117 HydrophobicContact CB-CE2 4.45Å; R113-F117 WeakPolarHBondContact O-CD2 3.25Å; R113-F117 PolarHBondContact O-N 2.87Å; F117-K119 VanDerWaalsContact C-N 3.32Å; F117-K119 PolarHBondContact O-N 2.79Å; F117-Q120 PolarHBondContact O-N 3.19Å; F117-A121 VanDerWaalsContact O-CB 3.31Å; F117-A121 WeakPolarHBondContact O-CB 3.38Å; F117-A121 PolarHBondContact O-N 3.05Å; F117-E153 VanDerWaalsContact CD1-OE2 3.29Å; F117-E153 WeakPolarHBondContact CD1-OE2 3.38Å; F117-K156 HydrophobicContact CD1-CB 3.89Å; F117-K156 HydrophobicContact CD1-CD 4.47Å; F117-K156 HydrophobicContact CD2-CB 4.49Å; F117-K156 HydrophobicContact CE1-CB 3.87Å; F117-K156 HydrophobicContact CE1-CD 4.1Å; F117-K156 HydrophobicContact CE2-CB 4.46Å; F117-K156 HydrophobicContact CG-CB 4.22Å; F117-K156 HydrophobicContact CZ-CB 4.17Å; F117-V160 HydrophobicContact CD2-CG2 3.86Å; F117-V160 HydrophobicContact CE2-CG2 3.8Å; F117-M179 HydrophobicContact CB-CE 4.35Å
118	H	94	Very high	87.6	Confident	50 Å²	50	56 Å²	56	23%	0.231	27%	0.272	C	S	.	.	H	α-helix	trans	-56.9	-43.8	172.7	176.1	-82.5	0	0	0	112.2	V114 V116 F122 L175 M179	V114-H118 VanDerWaalsContact O-CB 3.3Å; V114-H118 WeakPolarHBondContact O-CB 3.3Å; V114-H118 PolarHBondContact O-N 3.4Å; V116-H118 PolarHBondContact O-N 2.82Å; H118-F122 VanDerWaalsContact O-CB 3.31Å; H118-F122 WeakPolarHBondContact O-CB 3.3Å; H118-F122 PolarHBondContact O-N 2.95Å; H118-L175 HydrophobicContact CB-CD2 4.05Å; H118-L175 HydrophobicContact CB-CG 4.33Å; H118-L175 WeakPolarHBondContact CD2-CD1 3.47Å; H118-M179 HydrophobicContact CB-CE 4.05Å; H118-M179 HydrophobicContact CB-CG 4.46Å; H118-M179 HydrophobicContact CB-SD 3.83Å
119	K	93.3	Very high	89.2	Confident	137 Å²	137	57.7 Å²	57.7	60%	0.596	27%	0.272	S	S	*	.	H	α-helix	trans	-64.9	-45.8	179.1	-171.8	-179.6	178.6	-175.6	0	111.4	R115 V116 F117 F122 E123	R115-K119 WeakPolarHBondContact O-CB 3.41Å; R115-K119 PolarHBondContact O-N 3.39Å; V116-K119 PolarHBondContact O-N 2.88Å; V116-K119 VanDerWaalsContact O-N 3.11Å; F117-K119 VanDerWaalsContact C-N 3.32Å; F117-K119 PolarHBondContact O-N 2.79Å; K119-F122 PolarHBondContact O-N 3.46Å; K119-E123 WeakPolarHBondContact O-CG 3.39Å; K119-E123 PolarHBondContact O-N 2.91Å
120	Q	92.6	Very high	90.2	Very high	76 Å²	76	63.4 Å²	63.4	36%	0.355	29%	0.285	S	S	.	.	H	α-helix	trans	-64.1	-44	179.2	-69.9	170.8	-50.6	0	0	111.9	V116 F117 F122 E123 Y124 E153	V116-Q120 PolarHBondContact O-N 3.16Å; F117-Q120 PolarHBondContact O-N 3.19Å; Q120-F122 VanDerWaalsContact C-N 3.35Å; Q120-F122 PolarHBondContact O-N 3.2Å; Q120-E123 PolarHBondContact O-N 3.12Å; Q120-Y124 WeakPolarHBondContact O-CD2 3.5Å; Q120-Y124 PolarHBondContact O-N 3.34Å; Q120-Y124 VanDerWaalsContact O-N 3.12Å; Q120-E153 HydrophobicContact CB-CB 4.47Å; Q120-E153 HydrophobicContact CB-CG 4.17Å
121	A	93.8	Very high	90.4	Very high	0 Å²	0	62.9 Å²	62.9	0%	0	28%	0.283	C	S	.	.	H	α-helix	trans	-58	-44.5	172.3	0	0	0	0	0	112.6	F117 Y124 I125 E153 L154	F117-A121 VanDerWaalsContact O-CB 3.31Å; F117-A121 WeakPolarHBondContact O-CB 3.38Å; F117-A121 PolarHBondContact O-N 3.05Å; A121-Y124 PolarHBondContact O-N 2.7Å; A121-I125 WeakPolarHBondContact O-CB 3.43Å; A121-I125 VanDerWaalsContact O-CG1 3.27Å; A121-I125 WeakPolarHBondContact O-CG1 3.44Å; A121-I125 PolarHBondContact O-N 2.82Å; A121-E153 HydrophobicContact CB-CB 3.89Å; A121-L154 HydrophobicContact CB-CD2 3.59Å; A121-L154 HydrophobicContact CB-CG 3.75Å
122	F	94.7	Very high	90.5	Very high	123 Å²	123	63.3 Å²	63.3	54%	0.539	29%	0.285	S	S	.	.	H	α-helix	trans	-63	-44.9	178.8	-179.9	-93.7	0	0	0	112.2	H118 K119 Q120 I125 S126	H118-F122 VanDerWaalsContact O-CB 3.31Å; H118-F122 WeakPolarHBondContact O-CB 3.3Å; H118-F122 PolarHBondContact O-N 2.95Å; K119-F122 PolarHBondContact O-N 3.46Å; Q120-F122 VanDerWaalsContact C-N 3.35Å; Q120-F122 PolarHBondContact O-N 3.2Å; F122-I125 PolarHBondContact O-N 3.23Å; F122-S126 VanDerWaalsContact O-CB 3.29Å; F122-S126 WeakPolarHBondContact O-CB 3.49Å; F122-S126 PolarHBondContact O-N 3.35Å; F122-S126 PolarHBondContact O-OG 3.05Å
123	E	94.3	Very high	90.4	Very high	85 Å²	85	66.2 Å²	66.2	40%	0.397	30%	0.299	S	S	.	.	H	α-helix	trans	-57.4	-52.5	175.2	-68.7	-60.9	156.9	0	0	110.9	K119 Q120 I125 S126 I127	K119-E123 WeakPolarHBondContact O-CG 3.39Å; K119-E123 PolarHBondContact O-N 2.91Å; Q120-E123 PolarHBondContact O-N 3.12Å; E123-I125 PolarHBondContact O-N 3.29Å; E123-S126 PolarHBondContact O-N 2.84Å; E123-S126 PolarHBondContact O-OG 3.32Å; E123-I127 WeakPolarHBondContact O-CG1 3.08Å; E123-I127 PolarHBondContact O-N 3Å
124	Y	94.5	Very high	90	Very high	66 Å²	66	64 Å²	64	26%	0.259	30%	0.295	S	S	.	.	H	α-helix	trans	-62.3	-41.8	-179.1	-62	-25.8	0	0	0	113.2	Q120 A121 I127 A128 W146 K149 E153	Q120-Y124 WeakPolarHBondContact O-CD2 3.5Å; Q120-Y124 PolarHBondContact O-N 3.34Å; Q120-Y124 VanDerWaalsContact O-N 3.12Å; A121-Y124 PolarHBondContact O-N 2.7Å; Y124-I127 PolarHBondContact O-N 2.97Å; Y124-A128 WeakPolarHBondContact O-CB 3.37Å; Y124-A128 PolarHBondContact O-N 2.86Å; Y124-W146 AromaticContact CD1-CE3 3.78Å; Y124-W146 HydrophobicContact CD1-CE3 3.78Å; Y124-W146 AromaticContact CD1-CZ3 3.57Å; Y124-W146 HydrophobicContact CD1-CZ3 3.57Å; Y124-W146 HydrophobicContact CE1-CE3 4.43Å; Y124-W146 AromaticContact CE1-CZ3 3.79Å; Y124-W146 HydrophobicContact CE1-CZ3 3.79Å; Y124-W146 HydrophobicContact CG-CE3 4.25Å; Y124-W146 HydrophobicContact CG-CZ3 4.42Å; Y124-K149 HydrophobicContact CD2-CB 3.74Å; Y124-K149 HydrophobicContact CE2-CB 4.13Å; Y124-K149 HydrophobicContact CG-CB 4.17Å; Y124-E153 HydrophobicContact CD2-CG 3.96Å; Y124-E153 HydrophobicContact CE2-CG 3.71Å
125	I	93.3	Very high	88.7	Confident	27 Å²	27	72.9 Å²	72.9	14%	0.138	34%	0.337	C	S	.	.	H	α-helix	trans	-68.6	-36.2	176.9	-67.3	168.2	0	0	0	111	A121 F122 E123 I127 A128 L129 L154 A186	A121-I125 WeakPolarHBondContact O-CB 3.43Å; A121-I125 VanDerWaalsContact O-CG1 3.27Å; A121-I125 WeakPolarHBondContact O-CG1 3.44Å; A121-I125 PolarHBondContact O-N 2.82Å; F122-I125 PolarHBondContact O-N 3.23Å; E123-I125 PolarHBondContact O-N 3.29Å; I125-I127 VanDerWaalsContact C-N 3.3Å; I125-I127 PolarHBondContact O-N 3.42Å; I125-A128 PolarHBondContact O-N 3.3Å; I125-L129 HydrophobicContact CG2-CD1 3.94Å; I125-L129 HydrophobicContact CG2-CG 4.42Å; I125-L129 WeakPolarHBondContact O-CB 3.29Å; I125-L129 WeakPolarHBondContact O-CG 3.44Å; I125-L129 PolarHBondContact O-N 2.74Å; I125-L154 HydrophobicContact CD1-CD1 3.74Å; I125-L154 HydrophobicContact CD1-CG 4.26Å; I125-A186 HydrophobicContact CD1-CB 4.47Å
126	S	92.4	Very high	87.6	Confident	23 Å²	23	73.6 Å²	73.6	16%	0.161	34%	0.343	C	S	.	.	H	α-helix	trans	-66.7	-31.4	175	83	0	0	0	0	112.7	F122 E123 R130	F122-S126 VanDerWaalsContact O-CB 3.29Å; F122-S126 WeakPolarHBondContact O-CB 3.49Å; F122-S126 PolarHBondContact O-N 3.35Å; F122-S126 PolarHBondContact O-OG 3.05Å; E123-S126 PolarHBondContact O-N 2.84Å; E123-S126 PolarHBondContact O-OG 3.32Å; S126-R130 WeakPolarHBondContact O-CG 3.18Å; S126-R130 PolarHBondContact O-N 3.24Å; S126-R130 PolarHBondContact O-NE 2.85Å; S126-R130 PolarHBondContact OG-NH2 2.99Å
127	I	90.3	Very high	85.8	Confident	46 Å²	46	74.8 Å²	74.8	24%	0.236	36%	0.361	C	S	.	.	H	α-helix	trans	-73.2	-44.1	174	-66.1	164.3	0	0	0	109.4	E123 Y124 I125 R130 I131 W146	E123-I127 WeakPolarHBondContact O-CG1 3.08Å; E123-I127 PolarHBondContact O-N 3Å; Y124-I127 PolarHBondContact O-N 2.97Å; I125-I127 VanDerWaalsContact C-N 3.3Å; I125-I127 PolarHBondContact O-N 3.42Å; I127-R130 PolarHBondContact O-N 3.23Å; I127-I131 HydrophobicContact CG2-CD1 3.81Å; I127-I131 WeakPolarHBondContact O-CG1 3.44Å; I127-I131 PolarHBondContact O-N 2.86Å; I127-W146 HydrophobicContact CB-CD2 4.43Å; I127-W146 HydrophobicContact CB-CG 4.44Å; I127-W146 HydrophobicContact CG2-CD2 3.82Å; I127-W146 HydrophobicContact CG2-CG 3.8Å; I127-W146 HydrophobicContact CG2-CZ2 4.41Å
128	A	90.6	Very high	84.3	Confident	0 Å²	0	75.3 Å²	75.3	0%	0	38%	0.379	C	S	.	.	H	α-helix	trans	-57.1	-51.4	176.3	0	0	0	0	0	111.9	Y124 I125 R130 I131 D132 W146 Y147	Y124-A128 WeakPolarHBondContact O-CB 3.37Å; Y124-A128 PolarHBondContact O-N 2.86Å; I125-A128 PolarHBondContact O-N 3.3Å; A128-R130 PolarHBondContact O-N 2.8Å; A128-I131 PolarHBondContact O-N 3.11Å; A128-I131 VanDerWaalsContact O-N 3.14Å; A128-D132 WeakPolarHBondContact O-CB 3.39Å; A128-D132 PolarHBondContact O-N 2.84Å; A128-W146 HydrophobicContact CB-CB 3.7Å; A128-Y147 HydrophobicContact CB-CD1 3.7Å; A128-Y147 HydrophobicContact CB-CD2 3.75Å; A128-Y147 HydrophobicContact CB-CE1 3.75Å; A128-Y147 HydrophobicContact CB-CE2 3.8Å; A128-Y147 HydrophobicContact CB-CG 3.69Å
129	L	89.6	Confident	83	Confident	76 Å²	76	76 Å²	76	40%	0.398	38%	0.383	S	S	.	.	H	α-helix	trans	-57.2	-45.2	178.6	-77.5	163.8	0	0	0	112.6	I125 I131 D132 E133 Y147	I125-L129 HydrophobicContact CG2-CD1 3.94Å; I125-L129 HydrophobicContact CG2-CG 4.42Å; I125-L129 WeakPolarHBondContact O-CB 3.29Å; I125-L129 WeakPolarHBondContact O-CG 3.44Å; I125-L129 PolarHBondContact O-N 2.74Å; L129-I131 VanDerWaalsContact C-N 3.25Å; L129-I131 PolarHBondContact O-N 3.27Å; L129-D132 PolarHBondContact O-N 3.29Å; L129-D132 VanDerWaalsContact O-N 3.1Å; L129-E133 WeakPolarHBondContact O-CG 3.38Å; L129-E133 PolarHBondContact O-N 3.06Å; L129-Y147 WeakPolarHBondContact CD2-OH 3.29Å
130	R	87.7	Confident	82.2	Confident	146 Å²	146	72.8 Å²	72.8	55%	0.551	37%	0.369	S	S	*	.	H	α-helix	trans	-61	-31.8	178	-80	176.8	-80.6	173.2	-9.8	113.5	S126 I127 A128	S126-R130 WeakPolarHBondContact O-CG 3.18Å; S126-R130 PolarHBondContact O-N 3.24Å; S126-R130 PolarHBondContact O-NE 2.85Å; S126-R130 PolarHBondContact OG-NH2 2.99Å; I127-R130 PolarHBondContact O-N 3.23Å; A128-R130 PolarHBondContact O-N 2.8Å
131	I	84.8	Confident	81.7	Confident	29 Å²	29	75.6 Å²	75.6	15%	0.149	38%	0.382	C	S	.	.	H	α-helix	trans	-85.3	-23.8	178.1	-60.6	166.2	0	0	0	111.3	I127 A128 L129 Q139 Q142 A143	I127-I131 HydrophobicContact CG2-CD1 3.81Å; I127-I131 WeakPolarHBondContact O-CG1 3.44Å; I127-I131 PolarHBondContact O-N 2.86Å; A128-I131 PolarHBondContact O-N 3.11Å; A128-I131 VanDerWaalsContact O-N 3.14Å; L129-I131 VanDerWaalsContact C-N 3.25Å; L129-I131 PolarHBondContact O-N 3.27Å; I131-Q139 HydrophobicContact CG2-CB 3.88Å; I131-Q139 VanDerWaalsContact CG2-O 3.28Å; I131-Q139 WeakPolarHBondContact CG2-O 3.49Å; I131-Q142 HydrophobicContact CG2-CB 4.38Å; I131-A143 HydrophobicContact CB-CB 4.14Å; I131-A143 HydrophobicContact CG2-CB 3.98Å
132	D	83	Confident	81.2	Confident	11 Å²	11	80.9 Å²	80.9	6%	0.059	41%	0.407	C	S	.	.	H	α-helix	trans	-83.9	-28.2	-179.9	-170.5	12.4	0	0	0	112.6	A128 L129 A143 Y147 R189	A128-D132 WeakPolarHBondContact O-CB 3.39Å; A128-D132 PolarHBondContact O-N 2.84Å; L129-D132 PolarHBondContact O-N 3.29Å; L129-D132 VanDerWaalsContact O-N 3.1Å; D132-A143 HydrophobicContact CB-CB 4.17Å; D132-Y147 HydrophobicContact CB-CE2 4.21Å; D132-Y147 WeakPolarHBondContact OD2-CE2 3.46Å; D132-Y147 PolarHBondContact OD2-OH 2.55Å; D132-R189 VanDerWaalsContact CG-NH2 3.26Å; D132-R189 IonicContact OD1-CZ 3.73Å; D132-R189 IonicContact OD1-NE 3.96Å; D132-R189 PolarHBondContact OD1-NE 2.78Å; D132-R189 IonicContact OD1-NH2 2.68Å; D132-R189 PolarHBondContact OD1-NH2 2.95Å; D132-R189 IonicContact OD2-CZ 2.76Å; D132-R189 IonicContact OD2-NE 2.61Å; D132-R189 PolarHBondContact OD2-NE 3.1Å; D132-R189 IonicContact OD2-NH2 2.7Å; D132-R189 PolarHBondContact OD2-NH2 3.39Å
133	E	81.7	Confident	80.8	Confident	153 Å²	153	75 Å²	75	72%	0.715	38%	0.381	S	S	*	.	S	Bend	trans	-76.1	-24.2	170	-71.7	178	165.1	0	0	113.3	L129 E135	L129-E133 WeakPolarHBondContact O-CG 3.38Å; L129-E133 PolarHBondContact O-N 3.06Å; E133-E135 PolarHBondContact O-N 2.82Å
134	D	77	Confident	80.6	Confident	70 Å²	70	71.4 Å²	71.4	37%	0.374	37%	0.365	S	S	.	.	S	Bend	trans	-80	113.7	-179.5	-123.1	15.7	0	0	0	110.5	K136	D134-K136 PolarHBondContact O-N 3.39Å; D134-K136 IonicContact OD1-NZ 2.74Å; D134-K136 IonicContact OD2-NZ 3.6Å; D134-K136 PolarHBondContact OD2-NZ 3.06Å
135	E	61	Low	80.4	Confident	187 Å²	187	69.8 Å²	69.8	87%	0.874	37%	0.368	S	S	*	.			trans	-67.3	9.5	-173.2	-62.5	-167.7	133.1	0	0	115.7	E133 A137	E133-E135 PolarHBondContact O-N 2.82Å; E135-A137 PolarHBondContact O-N 3.08Å; E135-A137 VanDerWaalsContact O-N 3.08Å
136	K	66.1	Low	80.4	Confident	119 Å²	119	71.9 Å²	71.9	52%	0.517	37%	0.374	S	S	.	.			trans	-73.2	104	-178	-67.7	169.7	-166	132.7	0	110.5	D134 G138 Q139	D134-K136 PolarHBondContact O-N 3.39Å; D134-K136 IonicContact OD1-NZ 2.74Å; D134-K136 IonicContact OD2-NZ 3.6Å; D134-K136 PolarHBondContact OD2-NZ 3.06Å; K136-G138 PolarHBondContact O-N 2.77Å; K136-Q139 HydrophobicContact CB-CG 4.21Å; K136-Q139 PolarHBondContact O-N 3.01Å
137	A	55.5	Low	80.5	Confident	98 Å²	98	71 Å²	71	81%	0.81	37%	0.368	S	S	*	.	T	Hydrogen-bonded Turn	trans	-47.5	-29.9	-169.9	0	0	0	0	0	116.7	E135	E135-A137 PolarHBondContact O-N 3.08Å; E135-A137 VanDerWaalsContact O-N 3.08Å
138	G	60.8	Low	80.7	Confident	59 Å²	59	73.5 Å²	73.5	61%	0.608	38%	0.377	S	S	*	.	T	Hydrogen-bonded Turn	trans	-85.3	-2.1	179.1	0	0	0	0	0	116.6	K136	K136-G138 PolarHBondContact O-N 2.77Å
139	Q	66.8	Low	80.9	Confident	64 Å²	64	78.1 Å²	78.1	30%	0.299	40%	0.397	S	S	.	.	S	Bend	trans	-99.5	-11.8	-172.7	-63.7	-171.3	-39.6	0	0	114.4	I131 K136 E141 Q142 A143	I131-Q139 HydrophobicContact CG2-CB 3.88Å; I131-Q139 VanDerWaalsContact CG2-O 3.28Å; I131-Q139 WeakPolarHBondContact CG2-O 3.49Å; K136-Q139 HydrophobicContact CB-CG 4.21Å; K136-Q139 PolarHBondContact O-N 3.01Å; Q139-E141 VanDerWaalsContact C-N 3.29Å; Q139-E141 PolarHBondContact O-N 3.17Å; Q139-Q142 WeakPolarHBondContact O-CB 3.35Å; Q139-Q142 PolarHBondContact O-N 3.33Å; Q139-A143 PolarHBondContact O-N 3.07Å
140	K	76.4	Confident	81.2	Confident	70 Å²	70	74.5 Å²	74.5	30%	0.304	38%	0.378	S	S	.	.	H	α-helix	trans	-64.8	-27.6	-176.8	-64.9	-169.8	173.7	-172.6	0	114.1	Q142 A143 V144 L193	K140-Q142 VanDerWaalsContact C-N 3.27Å; K140-Q142 PolarHBondContact O-N 2.98Å; K140-A143 PolarHBondContact O-N 3.21Å; K140-V144 WeakPolarHBondContact O-CG2 3.2Å; K140-V144 PolarHBondContact O-N 3.49Å; K140-L193 HydrophobicContact CD-CD2 4.27Å
141	E	81.1	Confident	81.5	Confident	136 Å²	136	68.2 Å²	68.2	64%	0.636	36%	0.355	S	S	*	.	H	α-helix	trans	-59.9	-36	169.6	-74.4	166.7	-154.6	0	0	112.6	Q139 G145 Q197	Q139-E141 VanDerWaalsContact C-N 3.29Å; Q139-E141 PolarHBondContact O-N 3.17Å; E141-G145 PolarHBondContact O-N 2.98Å; E141-Q197 VanDerWaalsContact CG-NE2 3.34Å
142	Q	83.2	Confident	82.1	Confident	110 Å²	110	71.4 Å²	71.4	51%	0.514	37%	0.369	S	S	.	.	H	α-helix	trans	-73.3	-39.2	177.9	-54.3	-175.2	9.4	0	0	110.8	I131 Q139 K140 V144 G145 W146	I131-Q142 HydrophobicContact CG2-CB 4.38Å; Q139-Q142 WeakPolarHBondContact O-CB 3.35Å; Q139-Q142 PolarHBondContact O-N 3.33Å; K140-Q142 VanDerWaalsContact C-N 3.27Å; K140-Q142 PolarHBondContact O-N 2.98Å; Q142-V144 PolarHBondContact O-N 3.33Å; Q142-G145 PolarHBondContact O-N 3.39Å; Q142-W146 PolarHBondContact O-N 2.96Å
143	A	87.2	Confident	82.7	Confident	0 Å²	0	71.9 Å²	71.9	0%	0	37%	0.371	C	S	.	.	H	α-helix	trans	-58.6	-45.7	172.2	0	0	0	0	0	111.8	I131 D132 Q139 K140 G145 W146 Y147 L193	I131-A143 HydrophobicContact CB-CB 4.14Å; I131-A143 HydrophobicContact CG2-CB 3.98Å; D132-A143 HydrophobicContact CB-CB 4.17Å; Q139-A143 PolarHBondContact O-N 3.07Å; K140-A143 PolarHBondContact O-N 3.21Å; A143-G145 VanDerWaalsContact C-N 3.29Å; A143-G145 PolarHBondContact O-N 3.43Å; A143-W146 PolarHBondContact O-N 2.91Å; A143-W146 VanDerWaalsContact O-N 3.13Å; A143-Y147 HydrophobicContact CB-CD2 4.47Å; A143-Y147 HydrophobicContact CB-CE2 4.37Å; A143-Y147 WeakPolarHBondContact O-CD2 3.28Å; A143-Y147 PolarHBondContact O-N 3.08Å; A143-L193 HydrophobicContact CB-CD1 4.49Å
144	V	89.6	Confident	83.2	Confident	10 Å²	10	64.7 Å²	64.7	6%	0.061	34%	0.338	C	S	.	.	H	α-helix	trans	-54.3	-43.7	173.6	163	0	0	0	0	111.7	K140 Q142 K148 L190 L193	K140-V144 WeakPolarHBondContact O-CG2 3.2Å; K140-V144 PolarHBondContact O-N 3.49Å; Q142-V144 PolarHBondContact O-N 3.33Å; V144-K148 HydrophobicContact CG1-CD 4.34Å; V144-K148 WeakPolarHBondContact O-CG 3.07Å; V144-K148 PolarHBondContact O-N 3.38Å; V144-K148 VanDerWaalsContact O-N 3.1Å; V144-L190 HydrophobicContact CB-CD1 4.26Å; V144-L190 HydrophobicContact CG1-CD1 3.91Å; V144-L190 HydrophobicContact CG2-CD1 4.18Å; V144-L193 HydrophobicContact CG2-CB 3.73Å; V144-L193 HydrophobicContact CG2-CD1 4.32Å
145	G	90.1	Very high	84.1	Confident	32 Å²	32	65.4 Å²	65.4	33%	0.33	34%	0.339	S	S	.	.	H	α-helix	trans	-64	-39.1	176	0	0	0	0	0	114.1	E141 Q142 A143 K149	E141-G145 PolarHBondContact O-N 2.98Å; Q142-G145 PolarHBondContact O-N 3.39Å; A143-G145 VanDerWaalsContact C-N 3.29Å; A143-G145 PolarHBondContact O-N 3.43Å; G145-K149 PolarHBondContact O-N 2.85Å
146	W	93.3	Very high	85.6	Confident	71 Å²	71	60.1 Å²	60.1	27%	0.269	31%	0.313	S	S	.	.	H	α-helix	trans	-74.7	-37.4	177.1	-71.7	114.4	0	0	0	113.1	Y124 I127 A128 Q142 A143 K148 K149 G150	Y124-W146 AromaticContact CD1-CE3 3.78Å; Y124-W146 HydrophobicContact CD1-CE3 3.78Å; Y124-W146 AromaticContact CD1-CZ3 3.57Å; Y124-W146 HydrophobicContact CD1-CZ3 3.57Å; Y124-W146 HydrophobicContact CE1-CE3 4.43Å; Y124-W146 AromaticContact CE1-CZ3 3.79Å; Y124-W146 HydrophobicContact CE1-CZ3 3.79Å; Y124-W146 HydrophobicContact CG-CE3 4.25Å; Y124-W146 HydrophobicContact CG-CZ3 4.42Å; I127-W146 HydrophobicContact CB-CD2 4.43Å; I127-W146 HydrophobicContact CB-CG 4.44Å; I127-W146 HydrophobicContact CG2-CD2 3.82Å; I127-W146 HydrophobicContact CG2-CG 3.8Å; I127-W146 HydrophobicContact CG2-CZ2 4.41Å; A128-W146 HydrophobicContact CB-CB 3.7Å; Q142-W146 PolarHBondContact O-N 2.96Å; A143-W146 PolarHBondContact O-N 2.91Å; A143-W146 VanDerWaalsContact O-N 3.13Å; W146-K148 VanDerWaalsContact C-N 3.34Å; W146-K148 PolarHBondContact O-N 3.34Å; W146-K149 HydrophobicContact CE3-CD 3.86Å; W146-K149 HydrophobicContact CZ3-CD 3.94Å; W146-K149 PolarHBondContact O-N 2.98Å; W146-G150 PolarHBondContact O-N 3.03Å
147	Y	94.5	Very high	86.8	Confident	4 Å²	4	54.5 Å²	54.5	2%	0.016	29%	0.288	C	S	.	.	H	α-helix	trans	-60	-43.1	171.9	-80.6	-60.7	0	0	0	111.6	A128 L129 D132 A143 K149 G150 I151 R189 L193	A128-Y147 HydrophobicContact CB-CD1 3.7Å; A128-Y147 HydrophobicContact CB-CD2 3.75Å; A128-Y147 HydrophobicContact CB-CE1 3.75Å; A128-Y147 HydrophobicContact CB-CE2 3.8Å; A128-Y147 HydrophobicContact CB-CG 3.69Å; L129-Y147 WeakPolarHBondContact CD2-OH 3.29Å; D132-Y147 HydrophobicContact CB-CE2 4.21Å; D132-Y147 WeakPolarHBondContact OD2-CE2 3.46Å; D132-Y147 PolarHBondContact OD2-OH 2.55Å; A143-Y147 HydrophobicContact CB-CD2 4.47Å; A143-Y147 HydrophobicContact CB-CE2 4.37Å; A143-Y147 WeakPolarHBondContact O-CD2 3.28Å; A143-Y147 PolarHBondContact O-N 3.08Å; Y147-K149 PolarHBondContact O-N 2.96Å; Y147-G150 PolarHBondContact O-N 3.32Å; Y147-I151 WeakPolarHBondContact O-CB 3.28Å; Y147-I151 WeakPolarHBondContact O-CD1 3.28Å; Y147-I151 WeakPolarHBondContact O-CG1 3.44Å; Y147-I151 PolarHBondContact O-N 3.4Å; Y147-R189 HydrophobicContact CE1-CG 4.39Å; Y147-R189 HydrophobicContact CE2-CG 4.09Å; Y147-L193 HydrophobicContact CD2-CD1 3.77Å; Y147-L193 HydrophobicContact CE2-CD1 3.52Å
148	K	94.7	Very high	88.5	Confident	98 Å²	98	52.3 Å²	52.3	43%	0.426	26%	0.263	S	S	.	.	H	α-helix	trans	-59.5	-45.9	176.8	-76.6	174.7	177	173.2	0	112.4	V144 W146 I151 E152 L190 E194	V144-K148 HydrophobicContact CG1-CD 4.34Å; V144-K148 WeakPolarHBondContact O-CG 3.07Å; V144-K148 PolarHBondContact O-N 3.38Å; V144-K148 VanDerWaalsContact O-N 3.1Å; W146-K148 VanDerWaalsContact C-N 3.34Å; W146-K148 PolarHBondContact O-N 3.34Å; K148-I151 PolarHBondContact O-N 3.03Å; K148-E152 PolarHBondContact O-N 3.28Å; K148-L190 HydrophobicContact CG-CD1 4.21Å; K148-L190 HydrophobicContact CG-CD2 3.72Å; K148-E194 WeakPolarHBondContact CE-OE1 3.49Å; K148-E194 IonicContact NZ-OE1 2.71Å; K148-E194 PolarHBondContact NZ-OE1 2.9Å
149	K	94.4	Very high	90	Very high	97 Å²	97	53.1 Å²	53.1	42%	0.422	26%	0.263	S	S	.	.	H	α-helix	trans	-62.3	-42.1	173.6	-68.5	174	179.8	177.6	0	112.6	Y124 G145 W146 Y147 E152 E153	Y124-K149 HydrophobicContact CD2-CB 3.74Å; Y124-K149 HydrophobicContact CE2-CB 4.13Å; Y124-K149 HydrophobicContact CG-CB 4.17Å; G145-K149 PolarHBondContact O-N 2.85Å; W146-K149 HydrophobicContact CE3-CD 3.86Å; W146-K149 HydrophobicContact CZ3-CD 3.94Å; W146-K149 PolarHBondContact O-N 2.98Å; Y147-K149 PolarHBondContact O-N 2.96Å; K149-E152 PolarHBondContact O-N 3.1Å; K149-E153 PolarHBondContact O-N 3.35Å; K149-E153 VanDerWaalsContact O-N 3.15Å
150	G	95.6	Very high	91.1	Very high	0 Å²	0	50.9 Å²	50.9	0%	0	25%	0.254	C	S	.	.	H	α-helix	trans	-61.9	-43.1	177	0	0	0	0	0	112.9	W146 Y147 E153 L154	W146-G150 PolarHBondContact O-N 3.03Å; Y147-G150 PolarHBondContact O-N 3.32Å; G150-E153 PolarHBondContact O-N 2.84Å; G150-L154 WeakPolarHBondContact O-CG 3.32Å; G150-L154 PolarHBondContact O-N 2.9Å
151	I	95.5	Very high	91.6	Very high	15 Å²	15	54 Å²	54	8%	0.077	27%	0.272	C	S	.	.	H	α-helix	trans	-60.6	-44.9	174.2	-77	159.5	0	0	0	111.1	Y147 K148 E153 L154 E155 L183 A186 K187 L190	Y147-I151 WeakPolarHBondContact O-CB 3.28Å; Y147-I151 WeakPolarHBondContact O-CD1 3.28Å; Y147-I151 WeakPolarHBondContact O-CG1 3.44Å; Y147-I151 PolarHBondContact O-N 3.4Å; K148-I151 PolarHBondContact O-N 3.03Å; I151-E153 PolarHBondContact O-N 2.92Å; I151-L154 WeakPolarHBondContact O-CB 3.45Å; I151-L154 PolarHBondContact O-N 3Å; I151-E155 WeakPolarHBondContact O-CG 3.45Å; I151-E155 PolarHBondContact O-N 2.72Å; I151-L183 HydrophobicContact CB-CD1 4.29Å; I151-L183 HydrophobicContact CG1-CD1 4.25Å; I151-L183 HydrophobicContact CG2-CD1 3.82Å; I151-A186 HydrophobicContact CD1-CB 4.15Å; I151-A186 HydrophobicContact CG1-CB 3.8Å; I151-K187 HydrophobicContact CD1-CG 3.82Å; I151-K187 HydrophobicContact CG1-CG 4.2Å; I151-K187 HydrophobicContact CG2-CG 4.49Å; I151-L190 HydrophobicContact CD1-CB 4.28Å; I151-L190 HydrophobicContact CD1-CD2 3.64Å
152	E	96	Very high	91.8	Very high	96 Å²	96	48.3 Å²	48.3	45%	0.449	25%	0.247	S	C	.	.	H	α-helix	trans	-60.2	-43.8	179.1	-161.4	-166.9	144.2	0	0	112.3	K148 K149 E155 K156	K148-E152 PolarHBondContact O-N 3.28Å; K149-E152 PolarHBondContact O-N 3.1Å; E152-E155 PolarHBondContact O-N 3.12Å; E152-K156 WeakPolarHBondContact O-CG 3.4Å; E152-K156 PolarHBondContact O-N 2.83Å; E152-K156 WeakPolarHBondContact OE1-CE 3.46Å; E152-K156 IonicContact OE1-NZ 3.46Å; E152-K156 PolarHBondContact OE1-NZ 3.36Å
153	E	95.4	Very high	91.4	Very high	21 Å²	21	47.8 Å²	47.8	10%	0.098	25%	0.252	C	S	.	.	H	α-helix	trans	-71.8	-30.9	176.5	-61.1	-49.4	139.4	0	0	113.3	F117 Q120 A121 Y124 K149 G150 I151 K156 G157	F117-E153 VanDerWaalsContact CD1-OE2 3.29Å; F117-E153 WeakPolarHBondContact CD1-OE2 3.38Å; Q120-E153 HydrophobicContact CB-CB 4.47Å; Q120-E153 HydrophobicContact CB-CG 4.17Å; A121-E153 HydrophobicContact CB-CB 3.89Å; Y124-E153 HydrophobicContact CD2-CG 3.96Å; Y124-E153 HydrophobicContact CE2-CG 3.71Å; K149-E153 PolarHBondContact O-N 3.35Å; K149-E153 VanDerWaalsContact O-N 3.15Å; G150-E153 PolarHBondContact O-N 2.84Å; I151-E153 PolarHBondContact O-N 2.92Å; E153-K156 IonicContact OE1-NZ 2.66Å; E153-K156 PolarHBondContact OE1-NZ 2.86Å; E153-K156 VanDerWaalsContact OE2-CD 3.25Å; E153-K156 WeakPolarHBondContact OE2-CD 3.48Å; E153-K156 IonicContact OE2-NZ 2.68Å; E153-G157 PolarHBondContact O-N 2.82Å
154	L	93.6	Very high	90.6	Very high	2 Å²	2	49.5 Å²	49.5	1%	0.01	27%	0.27	C	S	.	.	H	α-helix	trans	-63	-45.8	169.4	-72.2	178.6	0	0	0	111	A121 I125 G150 I151 G157 I158 M179 N182 L183	A121-L154 HydrophobicContact CB-CD2 3.59Å; A121-L154 HydrophobicContact CB-CG 3.75Å; I125-L154 HydrophobicContact CD1-CD1 3.74Å; I125-L154 HydrophobicContact CD1-CG 4.26Å; G150-L154 WeakPolarHBondContact O-CG 3.32Å; G150-L154 PolarHBondContact O-N 2.9Å; I151-L154 WeakPolarHBondContact O-CB 3.45Å; I151-L154 PolarHBondContact O-N 3Å; L154-G157 PolarHBondContact O-N 3.11Å; L154-I158 WeakPolarHBondContact O-CB 3.38Å; L154-I158 WeakPolarHBondContact O-CD1 3.12Å; L154-I158 VanDerWaalsContact O-CG1 3.23Å; L154-I158 WeakPolarHBondContact O-CG1 3.43Å; L154-I158 PolarHBondContact O-N 3.3Å; L154-M179 HydrophobicContact CD2-CB 3.87Å; L154-M179 HydrophobicContact CD2-CE 3.98Å; L154-M179 HydrophobicContact CD2-CG 3.96Å; L154-N182 HydrophobicContact CD1-CB 4.02Å; L154-N182 HydrophobicContact CD2-CB 4.46Å; L154-L183 HydrophobicContact CB-CB 4.4Å; L154-L183 HydrophobicContact CB-CD1 4.1Å; L154-L183 HydrophobicContact CD1-CB 4Å; L154-L183 HydrophobicContact CD1-CD1 4.34Å
155	E	95.1	Very high	89.4	Confident	84 Å²	84	58.3 Å²	58.3	39%	0.393	31%	0.31	S	S	.	.	H	α-helix	trans	-64.6	-42.9	179.3	-71.9	-177.5	164.6	0	0	112	I151 E152 G157 I158 A159 L183 K187	I151-E155 WeakPolarHBondContact O-CG 3.45Å; I151-E155 PolarHBondContact O-N 2.72Å; E152-E155 PolarHBondContact O-N 3.12Å; E155-G157 PolarHBondContact O-N 3.27Å; E155-I158 PolarHBondContact O-N 2.91Å; E155-A159 VanDerWaalsContact O-CB 3.31Å; E155-A159 WeakPolarHBondContact O-CB 3.3Å; E155-A159 PolarHBondContact O-N 3.22Å; E155-L183 HydrophobicContact CG-CD1 3.82Å; E155-L183 HydrophobicContact CG-CD2 3.86Å; E155-K187 WeakPolarHBondContact OE1-CE 3.38Å; E155-K187 IonicContact OE1-NZ 3.57Å; E155-K187 PolarHBondContact OE1-NZ 3.27Å
156	K	93.5	Very high	88.9	Confident	77 Å²	77	58.8 Å²	58.8	34%	0.335	32%	0.315	S	S	.	.	H	α-helix	trans	-56.5	-47.1	171.6	-72.8	164	-175.4	168.3	0	112	F117 E152 E153 A159 V160	F117-K156 HydrophobicContact CD1-CB 3.89Å; F117-K156 HydrophobicContact CD1-CD 4.47Å; F117-K156 HydrophobicContact CD2-CB 4.49Å; F117-K156 HydrophobicContact CE1-CB 3.87Å; F117-K156 HydrophobicContact CE1-CD 4.1Å; F117-K156 HydrophobicContact CE2-CB 4.46Å; F117-K156 HydrophobicContact CG-CB 4.22Å; F117-K156 HydrophobicContact CZ-CB 4.17Å; E152-K156 WeakPolarHBondContact O-CG 3.4Å; E152-K156 PolarHBondContact O-N 2.83Å; E152-K156 WeakPolarHBondContact OE1-CE 3.46Å; E152-K156 IonicContact OE1-NZ 3.46Å; E152-K156 PolarHBondContact OE1-NZ 3.36Å; E153-K156 IonicContact OE1-NZ 2.66Å; E153-K156 PolarHBondContact OE1-NZ 2.86Å; E153-K156 VanDerWaalsContact OE2-CD 3.25Å; E153-K156 WeakPolarHBondContact OE2-CD 3.48Å; E153-K156 IonicContact OE2-NZ 2.68Å; K156-A159 PolarHBondContact O-N 3.27Å; K156-V160 PolarHBondContact O-N 2.91Å
157	G	90.6	Very high	88.1	Confident	0 Å²	0	61.1 Å²	61.1	0%	0	33%	0.329	C	S	.	.	H	α-helix	trans	-69.7	-30	180	0	0	0	0	0	114.8	E153 L154 E155 Q176	E153-G157 PolarHBondContact O-N 2.82Å; L154-G157 PolarHBondContact O-N 3.11Å; E155-G157 PolarHBondContact O-N 3.27Å; G157-Q176 PolarHBondContact O-NE2 2.86Å
158	I	92.3	Very high	87.4	Confident	53 Å²	53	66.7 Å²	66.7	27%	0.272	36%	0.355	S	S	.	.	H	α-helix	trans	-74.2	-34.5	172.3	-68	160.5	0	0	0	110.8	L154 E155 V160 M179 M180 L183	L154-I158 WeakPolarHBondContact O-CB 3.38Å; L154-I158 WeakPolarHBondContact O-CD1 3.12Å; L154-I158 VanDerWaalsContact O-CG1 3.23Å; L154-I158 WeakPolarHBondContact O-CG1 3.43Å; L154-I158 PolarHBondContact O-N 3.3Å; E155-I158 PolarHBondContact O-N 2.91Å; I158-V160 VanDerWaalsContact C-N 3.26Å; I158-V160 PolarHBondContact O-N 3.26Å; I158-M179 HydrophobicContact CD1-CB 4.11Å; I158-M179 HydrophobicContact CG1-CB 3.9Å; I158-M180 HydrophobicContact CD1-CB 4.12Å; I158-L183 HydrophobicContact CD1-CB 4.33Å; I158-L183 HydrophobicContact CD1-CD2 3.76Å
159	A	90.6	Very high	86.7	Confident	75 Å²	75	63 Å²	63	62%	0.62	34%	0.341	S	S	*	.	H	α-helix	trans	-71.8	-12.9	177.4	0	0	0	0	0	114.4	E155 K156 I161	E155-A159 VanDerWaalsContact O-CB 3.31Å; E155-A159 WeakPolarHBondContact O-CB 3.3Å; E155-A159 PolarHBondContact O-N 3.22Å; K156-A159 PolarHBondContact O-N 3.27Å; A159-I161 PolarHBondContact O-N 3.11Å; A159-I161 VanDerWaalsContact O-N 3.08Å
160	V	90.8	Very high	86.3	Confident	18 Å²	18	62.4 Å²	62.4	11%	0.109	34%	0.34	C	S	.	.	S	Bend	trans	-66.8	108	171.9	-177.9	0	0	0	0	109.4	E110 R113 V114 F117 K156 I158 V162 Q176	E110-V160 HydrophobicContact CB-CG1 4.31Å; E110-V160 HydrophobicContact CG-CG1 4.49Å; R113-V160 HydrophobicContact CB-CG1 4.44Å; R113-V160 HydrophobicContact CB-CG2 4.39Å; V114-V160 HydrophobicContact CG2-CB 3.8Å; V114-V160 HydrophobicContact CG2-CG1 3.85Å; V114-V160 HydrophobicContact CG2-CG2 4.35Å; F117-V160 HydrophobicContact CD2-CG2 3.86Å; F117-V160 HydrophobicContact CE2-CG2 3.8Å; K156-V160 PolarHBondContact O-N 2.91Å; I158-V160 VanDerWaalsContact C-N 3.26Å; I158-V160 PolarHBondContact O-N 3.26Å; V160-V162 PolarHBondContact O-N 3.16Å; V160-Q176 PolarHBondContact O-NE2 2.87Å
161	I	87	Confident	85.7	Confident	134 Å²	134	69.5 Å²	69.5	69%	0.687	37%	0.367	S	S	*	.			trans	-65.9	123.8	171.5	-48.5	179	0	0	0	108.1	A159 T163	A159-I161 PolarHBondContact O-N 3.11Å; A159-I161 VanDerWaalsContact O-N 3.08Å; I161-T163 HydrophobicContact CG2-CG2 3.72Å
162	V	84.2	Confident	85.3	Confident	17 Å²	17	69 Å²	69	10%	0.103	37%	0.365	C	S	.	.			trans	-103.3	93.4	176.6	-179.1	0	0	0	0	109.2	E110 V114 V160 C169 A172	E110-V162 WeakPolarHBondContact OE2-CA 3.44Å; V114-V162 HydrophobicContact CG2-CG2 3.87Å; V160-V162 PolarHBondContact O-N 3.16Å; V162-C169 HydrophobicContact CG1-CB 4.01Å; V162-A172 HydrophobicContact CG1-CB 4.13Å; V162-A172 HydrophobicContact CG2-CB 4.18Å
163	T	74.6	Confident	85	Confident	100 Å²	100	69 Å²	69	61%	0.613	36%	0.361	S	S	*	.			trans	-90.9	110.6	-179.2	61.4	0	0	0	0	110.9	E110 I161	E110-T163 PolarHBondContact OE1-OG1 3.05Å; E110-T163 PolarHBondContact OE2-N 3.16Å; E110-T163 PolarHBondContact OE2-OG1 3.45Å; I161-T163 HydrophobicContact CG2-CG2 3.72Å
164	G	72.3	Confident	84.7	Confident	36 Å²	36	75.8 Å²	75.8	37%	0.371	39%	0.385	S	S	.	.			trans	155.2	161.5	176.3	0	0	0	0	0	115.7	R173	G164-R173 PolarHBondContact O-NH1 2.98Å; G164-R173 PolarHBondContact O-NH2 3.43Å
165	Q	62.7	Low	84.6	Confident	194 Å²	194	77.2 Å²	77.2	91%	0.907	39%	0.393	S	S	*	.			trans	-111.4	146.7	169.3	-66	-177.8	-8.1	0	0	109
166	G	79.5	Confident	84.5	Confident	42 Å²	42	74.5 Å²	74.5	43%	0.433	38%	0.38	S	S	.	.	S	Bend	trans	124.4	161	-173.8	0	0	0	0	0	112.9	Q168 C169 E170	G166-Q168 VanDerWaalsContact C-N 3.33Å; G166-Q168 PolarHBondContact O-N 3.42Å; G166-C169 WeakPolarHBondContact O-CB 3.17Å; G166-C169 PolarHBondContact O-N 3.21Å; G166-C169 VanDerWaalsContact O-N 3.11Å; G166-E170 PolarHBondContact O-N 3.37Å; G166-E170 VanDerWaalsContact O-N 3.15Å
167	E	78.2	Confident	84.5	Confident	120 Å²	120	73.4 Å²	73.4	56%	0.561	39%	0.386	S	S	*	.	H	α-helix	trans	-61.8	-36.9	-165.9	-152.5	-149.6	164.3	0	0	113.4	C169 E170 R171	E167-C169 PolarHBondContact O-N 3.36Å; E167-E170 PolarHBondContact O-N 3Å; E167-R171 WeakPolarHBondContact O-CB 3.42Å; E167-R171 VanDerWaalsContact O-CG 3.29Å; E167-R171 WeakPolarHBondContact O-CG 3.4Å; E167-R171 PolarHBondContact O-N 2.74Å; E167-R171 IonicContact OE1-CZ 3.32Å; E167-R171 IonicContact OE1-NE 2.78Å; E167-R171 PolarHBondContact OE1-NE 3.26Å; E167-R171 IonicContact OE1-NH2 3.03Å; E167-R171 PolarHBondContact OE1-NH2 3.47Å; E167-R171 IonicContact OE2-CZ 2.86Å; E167-R171 IonicContact OE2-NE 3.8Å; E167-R171 IonicContact OE2-NH2 3.8Å; E167-R171 PolarHBondContact OE2-NH2 3.28Å
168	Q	78.4	Confident	84.7	Confident	122 Å²	122	80 Å²	80	57%	0.57	41%	0.414	S	S	*	.	H	α-helix	trans	-65.2	-38.9	178.3	-61	-173.5	11.5	0	0	112.1	G166 R171 A172	G166-Q168 VanDerWaalsContact C-N 3.33Å; G166-Q168 PolarHBondContact O-N 3.42Å; Q168-R171 PolarHBondContact O-N 3.11Å; Q168-A172 WeakPolarHBondContact O-CB 3.47Å; Q168-A172 PolarHBondContact O-N 3.47Å
169	C	81.1	Confident	84.7	Confident	21 Å²	21	77.4 Å²	77.4	14%	0.142	40%	0.401	C	S	.	.	H	α-helix	trans	-68.2	-36.1	175.8	-59.4	0	0	0	0	111.5	V162 G166 E167 R173	V162-C169 HydrophobicContact CG1-CB 4.01Å; G166-C169 WeakPolarHBondContact O-CB 3.17Å; G166-C169 PolarHBondContact O-N 3.21Å; G166-C169 VanDerWaalsContact O-N 3.11Å; E167-C169 PolarHBondContact O-N 3.36Å; C169-R173 WeakPolarHBondContact O-CG 3.26Å; C169-R173 PolarHBondContact O-N 2.76Å
170	E	84.6	Confident	84.9	Confident	83 Å²	83	79.3 Å²	79.3	39%	0.388	40%	0.398	S	S	.	.	H	α-helix	trans	-67.4	-45.8	171.9	-77.4	-167	-143.9	0	0	113	G166 E167 A172 R173 R174	G166-E170 PolarHBondContact O-N 3.37Å; G166-E170 VanDerWaalsContact O-N 3.15Å; E167-E170 PolarHBondContact O-N 3Å; E170-A172 PolarHBondContact O-N 3.15Å; E170-R173 PolarHBondContact O-N 3.01Å; E170-R174 WeakPolarHBondContact O-CB 3.31Å; E170-R174 VanDerWaalsContact O-CG 3.29Å; E170-R174 WeakPolarHBondContact O-CG 3.35Å; E170-R174 PolarHBondContact O-N 3.25Å; E170-R174 IonicContact OE2-CZ 3.81Å; E170-R174 IonicContact OE2-NE 3.4Å; E170-R174 IonicContact OE2-NH2 2.72Å; E170-R174 PolarHBondContact OE2-NH2 3.47Å
171	R	84.3	Confident	85.1	Confident	150 Å²	150	82.4 Å²	82.4	57%	0.566	42%	0.418	S	S	*	.	H	α-helix	trans	-56.6	-41.6	174.5	-71.6	172.6	-179.4	-163	7.6	110.6	E167 Q168 L175	E167-R171 WeakPolarHBondContact O-CB 3.42Å; E167-R171 VanDerWaalsContact O-CG 3.29Å; E167-R171 WeakPolarHBondContact O-CG 3.4Å; E167-R171 PolarHBondContact O-N 2.74Å; E167-R171 IonicContact OE1-CZ 3.32Å; E167-R171 IonicContact OE1-NE 2.78Å; E167-R171 PolarHBondContact OE1-NE 3.26Å; E167-R171 IonicContact OE1-NH2 3.03Å; E167-R171 PolarHBondContact OE1-NH2 3.47Å; E167-R171 IonicContact OE2-CZ 2.86Å; E167-R171 IonicContact OE2-NE 3.8Å; E167-R171 IonicContact OE2-NH2 3.8Å; E167-R171 PolarHBondContact OE2-NH2 3.28Å; Q168-R171 PolarHBondContact O-N 3.11Å; R171-L175 WeakPolarHBondContact O-CB 3.4Å; R171-L175 PolarHBondContact O-N 3.08Å
172	A	86.6	Confident	85.3	Confident	4 Å²	4	78.7 Å²	78.7	3%	0.033	40%	0.399	C	S	.	.	H	α-helix	trans	-65.3	-46	174.8	0	0	0	0	0	113	A111 V162 Q168 E170 R174 L175 Q176	A111-A172 HydrophobicContact CB-CB 3.94Å; V162-A172 HydrophobicContact CG1-CB 4.13Å; V162-A172 HydrophobicContact CG2-CB 4.18Å; Q168-A172 WeakPolarHBondContact O-CB 3.47Å; Q168-A172 PolarHBondContact O-N 3.47Å; E170-A172 PolarHBondContact O-N 3.15Å; A172-R174 PolarHBondContact O-N 3.24Å; A172-L175 WeakPolarHBondContact O-CA 3.5Å; A172-L175 WeakPolarHBondContact O-CB 3.37Å; A172-L175 PolarHBondContact O-N 2.94Å; A172-Q176 PolarHBondContact O-N 2.69Å
173	R	88.9	Confident	85.8	Confident	97 Å²	97	78.9 Å²	78.9	37%	0.366	40%	0.399	S	S	.	.	H	α-helix	trans	-62	-40.3	175.6	-74.8	-175.6	-72.7	-101.4	5.2	112.6	G164 C169 E170 L175 Q176 A177	G164-R173 PolarHBondContact O-NH1 2.98Å; G164-R173 PolarHBondContact O-NH2 3.43Å; C169-R173 WeakPolarHBondContact O-CG 3.26Å; C169-R173 PolarHBondContact O-N 2.76Å; E170-R173 PolarHBondContact O-N 3.01Å; R173-L175 VanDerWaalsContact C-N 3.27Å; R173-L175 PolarHBondContact O-N 3.09Å; R173-Q176 PolarHBondContact O-N 3.29Å; R173-A177 PolarHBondContact O-N 3.24Å
174	R	90.6	Very high	86.7	Confident	162 Å²	162	78 Å²	78	61%	0.611	39%	0.394	S	S	*	.	H	α-helix	trans	-64.8	-30.6	173.1	-66.4	175.7	-159	-166.3	8.9	112	E170 A172 K178	E170-R174 WeakPolarHBondContact O-CB 3.31Å; E170-R174 VanDerWaalsContact O-CG 3.29Å; E170-R174 WeakPolarHBondContact O-CG 3.35Å; E170-R174 PolarHBondContact O-N 3.25Å; E170-R174 IonicContact OE2-CZ 3.81Å; E170-R174 IonicContact OE2-NE 3.4Å; E170-R174 IonicContact OE2-NH2 2.72Å; E170-R174 PolarHBondContact OE2-NH2 3.47Å; A172-R174 PolarHBondContact O-N 3.24Å; R174-K178 PolarHBondContact O-N 2.87Å
175	L	90.8	Very high	87.7	Confident	32 Å²	32	81.3 Å²	81.3	17%	0.168	40%	0.401	C	S	.	.	H	α-helix	trans	-72.6	-44.6	173.9	-168	59.2	0	0	0	111.6	V114 R115 H118 R171 A172 R173 A177 K178 M179	V114-L175 HydrophobicContact CG1-CB 4.39Å; V114-L175 HydrophobicContact CG1-CD2 4.08Å; V114-L175 HydrophobicContact CG1-CG 4.34Å; R115-L175 HydrophobicContact CB-CD2 4.49Å; R115-L175 HydrophobicContact CG-CD2 3.56Å; H118-L175 HydrophobicContact CB-CD2 4.05Å; H118-L175 HydrophobicContact CB-CG 4.33Å; H118-L175 WeakPolarHBondContact CD2-CD1 3.47Å; R171-L175 WeakPolarHBondContact O-CB 3.4Å; R171-L175 PolarHBondContact O-N 3.08Å; A172-L175 WeakPolarHBondContact O-CA 3.5Å; A172-L175 WeakPolarHBondContact O-CB 3.37Å; A172-L175 PolarHBondContact O-N 2.94Å; R173-L175 VanDerWaalsContact C-N 3.27Å; R173-L175 PolarHBondContact O-N 3.09Å; L175-A177 VanDerWaalsContact C-N 3.31Å; L175-A177 PolarHBondContact O-N 2.9Å; L175-K178 WeakPolarHBondContact O-CB 3.38Å; L175-K178 PolarHBondContact O-N 3.43Å; L175-K178 VanDerWaalsContact O-N 3.11Å; L175-M179 HydrophobicContact CG-SD 4.48Å; L175-M179 WeakPolarHBondContact O-CG 3.36Å; L175-M179 PolarHBondContact O-N 3.49Å
176	Q	93.1	Very high	89.1	Confident	28 Å²	28	72.4 Å²	72.4	13%	0.131	36%	0.36	C	S	.	.	H	α-helix	trans	-61	-37.5	175.4	-70.3	178.9	-52.2	0	0	112.5	V114 G157 V160 A172 R173 K178 M179 M180	V114-Q176 HydrophobicContact CG1-CG 3.66Å; V114-Q176 HydrophobicContact CG2-CG 4.2Å; G157-Q176 PolarHBondContact O-NE2 2.86Å; V160-Q176 PolarHBondContact O-NE2 2.87Å; A172-Q176 PolarHBondContact O-N 2.69Å; R173-Q176 PolarHBondContact O-N 3.29Å; Q176-K178 PolarHBondContact O-N 2.93Å; Q176-M179 WeakPolarHBondContact O-CB 3.49Å; Q176-M179 PolarHBondContact O-N 2.99Å; Q176-M180 PolarHBondContact O-N 2.76Å
177	A	93.6	Very high	89.8	Confident	54 Å²	54	74.6 Å²	74.6	45%	0.446	36%	0.358	S	S	.	.	H	α-helix	trans	-58.5	-45	172.6	0	0	0	0	0	112	R173 L175 M180 T181	R173-A177 PolarHBondContact O-N 3.24Å; L175-A177 VanDerWaalsContact C-N 3.31Å; L175-A177 PolarHBondContact O-N 2.9Å; A177-M180 PolarHBondContact O-N 2.9Å; A177-T181 PolarHBondContact O-N 2.87Å; A177-T181 VanDerWaalsContact O-N 3.14Å; A177-T181 PolarHBondContact O-OG1 3.19Å
178	K	93.4	Very high	90.5	Very high	137 Å²	137	73.7 Å²	73.7	60%	0.596	36%	0.357	S	S	*	.	H	α-helix	trans	-65	-39.8	174.2	-67.6	-178.9	178.8	-171.2	0	112.4	R174 L175 Q176 M180 T181 N182	R174-K178 PolarHBondContact O-N 2.87Å; L175-K178 WeakPolarHBondContact O-CB 3.38Å; L175-K178 PolarHBondContact O-N 3.43Å; L175-K178 VanDerWaalsContact O-N 3.11Å; Q176-K178 PolarHBondContact O-N 2.93Å; K178-M180 VanDerWaalsContact C-N 3.27Å; K178-M180 PolarHBondContact O-N 2.81Å; K178-T181 PolarHBondContact O-N 3.14Å; K178-N182 WeakPolarHBondContact O-CB 3.29Å; K178-N182 VanDerWaalsContact O-CG 3.27Å; K178-N182 PolarHBondContact O-N 2.62Å; K178-N182 PolarHBondContact O-OD1 2.85Å
179	M	94.1	Very high	91.1	Very high	0 Å²	0	72.3 Å²	72.3	0%	0	35%	0.346	C	S	.	.	H	α-helix	trans	-59.9	-38.9	174.6	-67.9	174	79.3	0	0	111.4	V114 F117 H118 L154 I158 L175 Q176 N182 L183	V114-M179 HydrophobicContact CG1-SD 4.09Å; F117-M179 HydrophobicContact CB-CE 4.35Å; H118-M179 HydrophobicContact CB-CE 4.05Å; H118-M179 HydrophobicContact CB-CG 4.46Å; H118-M179 HydrophobicContact CB-SD 3.83Å; L154-M179 HydrophobicContact CD2-CB 3.87Å; L154-M179 HydrophobicContact CD2-CE 3.98Å; L154-M179 HydrophobicContact CD2-CG 3.96Å; I158-M179 HydrophobicContact CD1-CB 4.11Å; I158-M179 HydrophobicContact CG1-CB 3.9Å; L175-M179 HydrophobicContact CG-SD 4.48Å; L175-M179 WeakPolarHBondContact O-CG 3.36Å; L175-M179 PolarHBondContact O-N 3.49Å; Q176-M179 WeakPolarHBondContact O-CB 3.49Å; Q176-M179 PolarHBondContact O-N 2.99Å; M179-N182 PolarHBondContact O-N 2.84Å; M179-L183 VanDerWaalsContact O-CB 3.32Å; M179-L183 WeakPolarHBondContact O-CB 3.25Å; M179-L183 PolarHBondContact O-N 3.14Å
180	M	93.9	Very high	91.6	Very high	114 Å²	114	72.1 Å²	72.1	56%	0.562	34%	0.344	S	S	*	.	H	α-helix	trans	-69.1	-37.7	177.7	-164.8	169.6	70.2	0	0	112.5	I158 Q176 A177 K178 L183 V184	I158-M180 HydrophobicContact CD1-CB 4.12Å; Q176-M180 PolarHBondContact O-N 2.76Å; A177-M180 PolarHBondContact O-N 2.9Å; K178-M180 VanDerWaalsContact C-N 3.27Å; K178-M180 PolarHBondContact O-N 2.81Å; M180-L183 PolarHBondContact O-N 3.12Å; M180-V184 PolarHBondContact O-N 2.99Å
181	T	94.1	Very high	92	Very high	84 Å²	84	73.1 Å²	73.1	52%	0.515	35%	0.349	S	S	.	.	H	α-helix	trans	-63.7	-45.3	170.4	-49.1	0	0	0	0	111.5	A177 K178 L183 V184 M185	A177-T181 PolarHBondContact O-N 2.87Å; A177-T181 VanDerWaalsContact O-N 3.14Å; A177-T181 PolarHBondContact O-OG1 3.19Å; K178-T181 PolarHBondContact O-N 3.14Å; T181-L183 VanDerWaalsContact C-N 3.27Å; T181-L183 PolarHBondContact O-N 2.77Å; T181-V184 PolarHBondContact O-N 2.9Å; T181-M185 HydrophobicContact CG2-CE 4.24Å; T181-M185 PolarHBondContact O-N 2.98Å
182	N	92	Very high	92.2	Very high	56 Å²	56	69.8 Å²	69.8	30%	0.299	34%	0.342	S	S	.	.	H	α-helix	trans	-63	-33.8	177.2	-68.8	-1.6	0	0	0	112.2	L154 K178 M179 M185 A186	L154-N182 HydrophobicContact CD1-CB 4.02Å; L154-N182 HydrophobicContact CD2-CB 4.46Å; K178-N182 WeakPolarHBondContact O-CB 3.29Å; K178-N182 VanDerWaalsContact O-CG 3.27Å; K178-N182 PolarHBondContact O-N 2.62Å; K178-N182 PolarHBondContact O-OD1 2.85Å; M179-N182 PolarHBondContact O-N 2.84Å; N182-M185 PolarHBondContact O-N 2.97Å; N182-M185 WeakPolarHBondContact OD1-CE 3.32Å; N182-A186 VanDerWaalsContact O-CB 3.25Å; N182-A186 WeakPolarHBondContact O-CB 3.38Å; N182-A186 PolarHBondContact O-N 2.87Å
183	L	94.3	Very high	92.1	Very high	21 Å²	21	69.8 Å²	69.8	11%	0.11	34%	0.341	C	S	.	.	H	α-helix	trans	-64.7	-40.5	178.3	179.1	63.5	0	0	0	111.9	I151 L154 E155 I158 M179 M180 T181 K187	I151-L183 HydrophobicContact CB-CD1 4.29Å; I151-L183 HydrophobicContact CG1-CD1 4.25Å; I151-L183 HydrophobicContact CG2-CD1 3.82Å; L154-L183 HydrophobicContact CB-CB 4.4Å; L154-L183 HydrophobicContact CB-CD1 4.1Å; L154-L183 HydrophobicContact CD1-CB 4Å; L154-L183 HydrophobicContact CD1-CD1 4.34Å; E155-L183 HydrophobicContact CG-CD1 3.82Å; E155-L183 HydrophobicContact CG-CD2 3.86Å; I158-L183 HydrophobicContact CD1-CB 4.33Å; I158-L183 HydrophobicContact CD1-CD2 3.76Å; M179-L183 VanDerWaalsContact O-CB 3.32Å; M179-L183 WeakPolarHBondContact O-CB 3.25Å; M179-L183 PolarHBondContact O-N 3.14Å; M180-L183 PolarHBondContact O-N 3.12Å; T181-L183 VanDerWaalsContact C-N 3.27Å; T181-L183 PolarHBondContact O-N 2.77Å; L183-K187 HydrophobicContact CD1-CD 4.23Å; L183-K187 HydrophobicContact CG-CD 4.35Å; L183-K187 WeakPolarHBondContact O-CB 3.44Å; L183-K187 VanDerWaalsContact O-CG 3.31Å; L183-K187 WeakPolarHBondContact O-CG 3.46Å; L183-K187 PolarHBondContact O-N 2.76Å; L183-K187 VanDerWaalsContact O-N 3.09Å
184	V	94.9	Very high	91.9	Very high	82 Å²	82	69 Å²	69	50%	0.497	34%	0.341	S	S	.	.	H	α-helix	trans	-64.2	-54.2	174.5	176.1	0	0	0	0	109.9	M180 T181 A186 K187 D188	M180-V184 PolarHBondContact O-N 2.99Å; T181-V184 PolarHBondContact O-N 2.9Å; V184-A186 VanDerWaalsContact C-N 3.3Å; V184-A186 PolarHBondContact O-N 3.01Å; V184-K187 PolarHBondContact O-N 3.36Å; V184-D188 PolarHBondContact O-N 3.37Å
185	M	92.6	Very high	91.5	Very high	105 Å²	105	68.4 Å²	68.4	52%	0.517	34%	0.343	S	S	.	.	H	α-helix	trans	-58.8	-39.5	-178.9	-63.4	-173.9	-62.9	0	0	112.9	T181 N182 R189	T181-M185 HydrophobicContact CG2-CE 4.24Å; T181-M185 PolarHBondContact O-N 2.98Å; N182-M185 PolarHBondContact O-N 2.97Å; N182-M185 WeakPolarHBondContact OD1-CE 3.32Å; M185-R189 WeakPolarHBondContact O-CB 3.34Å; M185-R189 PolarHBondContact O-N 2.68Å
186	A	91.7	Very high	90.5	Very high	6 Å²	6	73 Å²	73	5%	0.05	37%	0.366	C	S	.	.	H	α-helix	trans	-67.3	-38.5	176.4	0	0	0	0	0	112.4	I125 I151 N182 V184 L190	I125-A186 HydrophobicContact CD1-CB 4.47Å; I151-A186 HydrophobicContact CD1-CB 4.15Å; I151-A186 HydrophobicContact CG1-CB 3.8Å; N182-A186 VanDerWaalsContact O-CB 3.25Å; N182-A186 WeakPolarHBondContact O-CB 3.38Å; N182-A186 PolarHBondContact O-N 2.87Å; V184-A186 VanDerWaalsContact C-N 3.3Å; V184-A186 PolarHBondContact O-N 3.01Å; A186-L190 VanDerWaalsContact O-CB 3.23Å; A186-L190 WeakPolarHBondContact O-CB 3.49Å; A186-L190 PolarHBondContact O-N 3.2Å
187	K	94.1	Very high	89.1	Confident	88 Å²	88	75.3 Å²	75.3	38%	0.383	38%	0.376	S	S	.	.	H	α-helix	trans	-69.2	-40.9	176	-78.1	178.3	174.5	-179.6	0	112.4	I151 E155 L183 V184 L190 Q191	I151-K187 HydrophobicContact CD1-CG 3.82Å; I151-K187 HydrophobicContact CG1-CG 4.2Å; I151-K187 HydrophobicContact CG2-CG 4.49Å; E155-K187 WeakPolarHBondContact OE1-CE 3.38Å; E155-K187 IonicContact OE1-NZ 3.57Å; E155-K187 PolarHBondContact OE1-NZ 3.27Å; L183-K187 HydrophobicContact CD1-CD 4.23Å; L183-K187 HydrophobicContact CG-CD 4.35Å; L183-K187 WeakPolarHBondContact O-CB 3.44Å; L183-K187 VanDerWaalsContact O-CG 3.31Å; L183-K187 WeakPolarHBondContact O-CG 3.46Å; L183-K187 PolarHBondContact O-N 2.76Å; L183-K187 VanDerWaalsContact O-N 3.09Å; V184-K187 PolarHBondContact O-N 3.36Å; K187-L190 PolarHBondContact O-N 3.02Å; K187-Q191 WeakPolarHBondContact O-CB 3.12Å; K187-Q191 PolarHBondContact O-N 3.37Å
188	D	93.1	Very high	87	Confident	101 Å²	101	78.3 Å²	78.3	54%	0.54	39%	0.391	S	S	.	.	H	α-helix	trans	-63	-44	176.3	-66.2	-24.1	0	0	0	111	V184 Q191 L192	V184-D188 PolarHBondContact O-N 3.37Å; D188-Q191 PolarHBondContact O-N 3.15Å; D188-L192 PolarHBondContact O-N 3.46Å; D188-L192 VanDerWaalsContact O-N 3.09Å
189	R	91.8	Very high	84.4	Confident	94 Å²	94	78.2 Å²	78.2	36%	0.355	40%	0.402	S	S	.	.	H	α-helix	trans	-67.1	-40.6	176.1	-173.9	56.3	176.6	-162.3	2.3	112.4	D132 Y147 M185 L192 L193	D132-R189 VanDerWaalsContact CG-NH2 3.26Å; D132-R189 IonicContact OD1-CZ 3.73Å; D132-R189 IonicContact OD1-NE 3.96Å; D132-R189 PolarHBondContact OD1-NE 2.78Å; D132-R189 IonicContact OD1-NH2 2.68Å; D132-R189 PolarHBondContact OD1-NH2 2.95Å; D132-R189 IonicContact OD2-CZ 2.76Å; D132-R189 IonicContact OD2-NE 2.61Å; D132-R189 PolarHBondContact OD2-NE 3.1Å; D132-R189 IonicContact OD2-NH2 2.7Å; D132-R189 PolarHBondContact OD2-NH2 3.39Å; Y147-R189 HydrophobicContact CE1-CG 4.39Å; Y147-R189 HydrophobicContact CE2-CG 4.09Å; M185-R189 WeakPolarHBondContact O-CB 3.34Å; M185-R189 PolarHBondContact O-N 2.68Å; R189-L192 PolarHBondContact O-N 2.92Å; R189-L193 HydrophobicContact CG-CD1 4.47Å; R189-L193 PolarHBondContact O-N 2.85Å
190	L	91.6	Very high	81.6	Confident	17 Å²	17	86 Å²	86	9%	0.089	44%	0.442	C	S	.	.	H	α-helix	trans	-59.4	-47.5	174.4	177.5	61.9	0	0	0	111.3	V144 K148 I151 A186 K187 L192 L193 E194	V144-L190 HydrophobicContact CB-CD1 4.26Å; V144-L190 HydrophobicContact CG1-CD1 3.91Å; V144-L190 HydrophobicContact CG2-CD1 4.18Å; K148-L190 HydrophobicContact CG-CD1 4.21Å; K148-L190 HydrophobicContact CG-CD2 3.72Å; I151-L190 HydrophobicContact CD1-CB 4.28Å; I151-L190 HydrophobicContact CD1-CD2 3.64Å; A186-L190 VanDerWaalsContact O-CB 3.23Å; A186-L190 WeakPolarHBondContact O-CB 3.49Å; A186-L190 PolarHBondContact O-N 3.2Å; K187-L190 PolarHBondContact O-N 3.02Å; L190-L192 VanDerWaalsContact C-N 3.28Å; L190-L192 PolarHBondContact O-N 3.02Å; L190-L193 PolarHBondContact O-N 2.99Å; L190-L193 VanDerWaalsContact O-N 3.12Å; L190-E194 HydrophobicContact CD1-CG 4.17Å; L190-E194 HydrophobicContact CG-CG 4.47Å; L190-E194 WeakPolarHBondContact O-CG 3.4Å; L190-E194 PolarHBondContact O-N 3.09Å
191	Q	91.5	Very high	79	Confident	104 Å²	104	86 Å²	86	49%	0.486	45%	0.451	S	S	.	.	H	α-helix	trans	-62.9	-34.9	179.1	-162.9	-161.7	71.8	0	0	112	K187 D188 K195	K187-Q191 WeakPolarHBondContact O-CB 3.12Å; K187-Q191 PolarHBondContact O-N 3.37Å; D188-Q191 PolarHBondContact O-N 3.15Å; Q191-K195 HydrophobicContact CG-CD 4.45Å; Q191-K195 WeakPolarHBondContact O-CB 3.21Å; Q191-K195 WeakPolarHBondContact O-CD 3.39Å; Q191-K195 VanDerWaalsContact O-CG 3.23Å; Q191-K195 WeakPolarHBondContact O-CG 3.28Å; Q191-K195 PolarHBondContact O-N 3.29Å; Q191-K195 VanDerWaalsContact O-N 3.1Å
192	L	88.4	Confident	76	Confident	80 Å²	80	91.8 Å²	91.8	42%	0.419	47%	0.469	S	S	.	.	H	α-helix	trans	-65.1	-43.5	173.5	-173.7	151.5	0	0	0	111.4	D188 R189 L190 K195 M196	D188-L192 PolarHBondContact O-N 3.46Å; D188-L192 VanDerWaalsContact O-N 3.09Å; R189-L192 PolarHBondContact O-N 2.92Å; L190-L192 VanDerWaalsContact C-N 3.28Å; L190-L192 PolarHBondContact O-N 3.02Å; L192-K195 PolarHBondContact O-N 2.89Å; L192-M196 HydrophobicContact CD2-SD 4Å; L192-M196 WeakPolarHBondContact O-CG 3.49Å; L192-M196 PolarHBondContact O-N 3.25Å
193	L	85.3	Confident	73	Confident	4 Å²	4	93.8 Å²	93.8	2%	0.021	49%	0.487	C	S	.	.	H	α-helix	trans	-67.3	-41	178.1	-72.3	172.1	0	0	0	112.9	K140 A143 V144 Y147 R189 L190 K195 M196 Q197	K140-L193 HydrophobicContact CD-CD2 4.27Å; A143-L193 HydrophobicContact CB-CD1 4.49Å; V144-L193 HydrophobicContact CG2-CB 3.73Å; V144-L193 HydrophobicContact CG2-CD1 4.32Å; Y147-L193 HydrophobicContact CD2-CD1 3.77Å; Y147-L193 HydrophobicContact CE2-CD1 3.52Å; R189-L193 HydrophobicContact CG-CD1 4.47Å; R189-L193 PolarHBondContact O-N 2.85Å; L190-L193 PolarHBondContact O-N 2.99Å; L190-L193 VanDerWaalsContact O-N 3.12Å; L193-K195 VanDerWaalsContact C-N 3.3Å; L193-K195 PolarHBondContact O-N 3.18Å; L193-M196 PolarHBondContact O-N 3.32Å; L193-Q197 PolarHBondContact O-N 3.11Å
194	E	84.2	Confident	70	Confident	79 Å²	79	102.8 Å²	102.8	37%	0.369	53%	0.526	S	S	.	.	H	α-helix	trans	-63.8	-35.4	175.1	-69.6	-178.5	146.3	0	0	111.8	K148 L190 M196 Q197	K148-E194 WeakPolarHBondContact CE-OE1 3.49Å; K148-E194 IonicContact NZ-OE1 2.71Å; K148-E194 PolarHBondContact NZ-OE1 2.9Å; L190-E194 HydrophobicContact CD1-CG 4.17Å; L190-E194 HydrophobicContact CG-CG 4.47Å; L190-E194 WeakPolarHBondContact O-CG 3.4Å; L190-E194 PolarHBondContact O-N 3.09Å; E194-M196 PolarHBondContact O-N 2.98Å; E194-Q197 PolarHBondContact O-N 3.49Å
195	K	83.1	Confident	66.9	Low	151 Å²	151	104.4 Å²	104.4	66%	0.657	54%	0.541	S	S	*	.	T	Hydrogen-bonded Turn	trans	-68.2	-16.2	171.7	-75.5	167.2	176	171.6	0	114.3	Q191 L192 L193	Q191-K195 HydrophobicContact CG-CD 4.45Å; Q191-K195 WeakPolarHBondContact O-CB 3.21Å; Q191-K195 WeakPolarHBondContact O-CD 3.39Å; Q191-K195 VanDerWaalsContact O-CG 3.23Å; Q191-K195 WeakPolarHBondContact O-CG 3.28Å; Q191-K195 PolarHBondContact O-N 3.29Å; Q191-K195 VanDerWaalsContact O-N 3.1Å; L192-K195 PolarHBondContact O-N 2.89Å; L193-K195 VanDerWaalsContact C-N 3.3Å; L193-K195 PolarHBondContact O-N 3.18Å
196	M	70.4	Confident	63.9	Low	129 Å²	129	108 Å²	108	64%	0.635	56%	0.557	S	S	*	*	T	Hydrogen-bonded Turn	trans	-97.4	-2.9	177.4	-67.8	-166.8	83.4	0	0	113.7	L192 L193 E194	L192-M196 HydrophobicContact CD2-SD 4Å; L192-M196 WeakPolarHBondContact O-CG 3.49Å; L192-M196 PolarHBondContact O-N 3.25Å; L193-M196 PolarHBondContact O-N 3.32Å; E194-M196 PolarHBondContact O-N 2.98Å
197	Q	63.5	Low	60.8	Low	75 Å²	75	113.7 Å²	113.7	35%	0.35	59%	0.59	S	S	.	*	S	Bend	trans	-82	133.6	174.2	-72.8	-177.6	-19.7	0	0	111	E141 L193 E194 V199	E141-Q197 VanDerWaalsContact CG-NE2 3.34Å; L193-Q197 PolarHBondContact O-N 3.11Å; E194-Q197 PolarHBondContact O-N 3.49Å; Q197-V199 PolarHBondContact O-N 3.1Å
198	P	47.9	Very low	57.6	Low	118 Å²	118	116.1 Å²	116.1	77%	0.766	61%	0.608	S	S	*	*			trans	-72.1	126.4	176.6	29.4	-33.3	0	0	0	110.6	L200	P198-L200 PolarHBondContact O-N 3.02Å
199	V	40.1	Very low	54.6	Low	135 Å²	135	117.4 Å²	117.4	82%	0.818	62%	0.619	S	S	*	*			trans	-69.9	111.9	178.6	178.8	0	0	0	0	110.3	Q197	Q197-V199 PolarHBondContact O-N 3.1Å
200	L	34.6	Very low	51.5	Low	163 Å²	163	121.6 Å²	121.6	85%	0.853	64%	0.636	S	S	*	*			trans	-83.9	130.1	159.4	-71.1	176.7	0	0	0	109.2	P198	P198-L200 PolarHBondContact O-N 3.02Å
201	P	40.7	Very low	48.5	Very low	114 Å²	114	128.1 Å²	128.1	74%	0.74	67%	0.671	S	S	*	*			trans	-80.1	134.6	-177.8	31.5	-33.9	0	0	0	111.6
202	F	29.7	Very low	45.5	Very low	206 Å²	206	128.6 Å²	128.6	90%	0.904	68%	0.677	S	S	*	*			trans	-135.5	159.6	157.2	-142	-98	0	0	0	111.5
203	S	30	Very low	42.8	Very low	97 Å²	97	128.4 Å²	128.4	68%	0.678	68%	0.682	S	S	*	*	P	Polyproline II helix	trans	-69.8	137.6	-156.3	54.4	0	0	0	0	115.4
204	K	30.4	Very low	40.2	Very low	210 Å²	210	133.8 Å²	133.8	91%	0.913	72%	0.716	S	S	*	*	P	Polyproline II helix	trans	-86.4	123.5	146.3	-79.5	-171.5	172.4	-174.1	0	109.3
205	S	30.3	Very low	37.7	Very low	116 Å²	116	136.4 Å²	136.4	81%	0.811	73%	0.732	S	S	*	*	P	Polyproline II helix	trans	-72.5	156.8	152.5	44.1	0	0	0	0	109.7
206	Q	28.8	Very low	35.1	Very low	182 Å²	182	135.3 Å²	135.3	85%	0.85	74%	0.738	S	S	*	*			trans	-107.2	121.3	-167.4	177.6	-177	18.2	0	0	111.2
207	T	28	Very low	33.1	Very low	124 Å²	124	133 Å²	133	76%	0.761	74%	0.739	S	S	*	*			trans	174.1	145.5	156.4	20.7	0	0	0	0	107.3
208	D	27.3	Very low	31.4	Very low	140 Å²	140	135.1 Å²	135.1	75%	0.749	76%	0.761	S	S	*	*			cis	-156.7	172.1	-5.5	-138.2	-25.1	0	0	0	113.6
209	V	29.9	Very low	30.3	Very low	128 Å²	128	140.8 Å²	140.8	78%	0.776	77%	0.767	S	S	*	*			trans	69.7	136.6	156	172.9	0	0	0	0	120.2
210	Y	26.3	Very low	29.9	Very low	181 Å²	181	142.1 Å²	142.1	71%	0.71	77%	0.77	S	S	*	*			trans	-88	153.7	-178.6	-129.7	-122	0	0	0	112.8	D212	Y210-D212 HydrophobicContact CD1-CB 3.66Å; Y210-D212 HydrophobicContact CE1-CB 3.97Å
211	N	28.8	Very low	29.5	Very low	154 Å²	154	137.7 Å²	137.7	82%	0.824	76%	0.763	S	S	*	*				179.2	116.6	129.6	-87.7	-14.4	0	0	0	106.9
212	D	27.5	Very low	28.9	Very low	114 Å²	114	140.5 Å²	140.5	61%	0.61	77%	0.766	S	S	*	*			cis	71	129.5	39.1	-147.8	46.2	0	0	0	111.6	Y210	Y210-D212 HydrophobicContact CD1-CB 3.66Å; Y210-D212 HydrophobicContact CE1-CB 3.97Å
213	S	33.1	Very low	28.8	Very low	76 Å²	76	136.7 Å²	136.7	53%	0.531	75%	0.754	S	S	.	*			cis	-153.8	-169	6.9	-149.1	0	0	0	0	113.9
214	T	30.3	Very low	28.6	Very low	118 Å²	118	139.3 Å²	139.3	72%	0.724	76%	0.756	S	S	*	*			trans	80	140.6	162.2	75.3	0	0	0	0	119.5
215	N	30.1	Very low	28.3	Very low	133 Å²	133	134.3 Å²	134.3	71%	0.711	75%	0.747	S	S	*	*			cis	-165.8	150.4	-32.1	-115.5	-26.2	0	0	0	111.4
216	V	30.4	Very low	28.2	Very low	129 Å²	129	137.7 Å²	137.7	78%	0.782	75%	0.75	S	S	*	*			trans	45.5	130.9	137.6	173.1	0	0	0	0	119
217	A	26.9	Very low	28.1	Very low	80 Å²	80	134.9 Å²	134.9	66%	0.661	75%	0.751	S	S	*	*			cis	-152.1	150.4	36.9	0	0	0	0	0	116
218	C	28.4	Very low	28.1	Very low	120 Å²	120	132.6 Å²	132.6	81%	0.811	75%	0.751	S	S	*	*				38.9	149.6	125.2	-52.1	0	0	0	0	121.7
219	R	25.2	Very low	28.1	Very low	237 Å²	237	130.5 Å²	130.5	89%	0.894	75%	0.754	S	S	*	*			cis	-158.6	149.9	18.2	-154.4	175	-177.7	162.4	0.3	112.3
220	N	31.7	Very low	28	Very low	163 Å²	163	130.5 Å²	130.5	87%	0.872	75%	0.754	S	S	*	*			trans	-110	169	169.1	-83.6	-9.9	0	0	0	112.1
221	G	26.6	Very low	28.5	Very low	69 Å²	69	127.3 Å²	127.3	71%	0.711	76%	0.755	S	S	*	*			trans	-136.3	136	148.7	0	0	0	0	0	109.9
222	H	26.3	Very low	28.3	Very low	174 Å²	174	129 Å²	129	81%	0.806	76%	0.755	S	S	*	*			cis	82.7	115.6	24.5	-163.9	89.9	0	0	0	112
223	L	29.2	Very low	28.3	Very low	126 Å²	126	135.2 Å²	135.2	66%	0.66	77%	0.77	S	S	*	*			cis	-118.9	-150.6	2.7	-64.9	154.6	0	0	0	109.6
224	Q	25	Very low	28	Very low	152 Å²	152	141.1 Å²	141.1	71%	0.71	79%	0.786	S	S	*	*			cis	-163.4	153.6	-9.8	-145	161.5	-32.6	0	0	107.3
225	S	24.9	Very low	27.9	Very low	104 Å²	104	142.8 Å²	142.8	73%	0.727	79%	0.791	S	S	*	*			cis	109	70.9	-5.1	-168.7	0	0	0	0	119.2
226	E	26.7	Very low	28.4	Very low	188 Å²	188	141.5 Å²	141.5	88%	0.879	79%	0.789	S	S	*	*			trans	-178	155	152.4	-99.9	-178.3	-167.1	0	0	110.6
227	S	27.7	Very low	28.3	Very low	123 Å²	123	142.3 Å²	142.3	86%	0.86	79%	0.789	S	S	*	*			cis	-163.9	151.3	-29.8	-165.9	0	0	0	0	110.7
228	G	26.9	Very low	28.5	Very low	75 Å²	75	143.7 Å²	143.7	77%	0.773	79%	0.789	S	S	*	*			trans	162	129.5	172.2	0	0	0	0	0	116.8
229	A	27.9	Very low	28.5	Very low	97 Å²	97	146.7 Å²	146.7	80%	0.802	79%	0.791	S	S	*	*			trans	-101.7	131.2	-178.7	0	0	0	0	0	111.6
230	V	28.6	Very low	28.6	Very low	128 Å²	128	141.9 Å²	141.9	78%	0.776	79%	0.788	S	S	*	*				71.2	114.5	68.4	172.7	0	0	0	0	112.2
231	P	35.8	Very low	28.5	Very low	113 Å²	113	139.2 Å²	139.2	73%	0.734	78%	0.782	S	S	*	*				-147.4	133.6	93.8	36.8	-18.7	0	0	0	119
232	K	26.3	Very low	28.8	Very low	191 Å²	191	144.4 Å²	144.4	83%	0.83	79%	0.794	S	S	*	*			trans	52.1	108.6	138.9	-59.1	174.8	178.9	173.2	0	120.4
233	R	27.3	Very low	28.9	Very low	243 Å²	243	141.3 Å²	141.3	92%	0.917	79%	0.791	S	S	*	*				179.2	127.5	101.1	-97.4	175.3	-178.9	-165.6	1.8	114.6
234	K	26.6	Very low	28.9	Very low	201 Å²	201	143.5 Å²	143.5	87%	0.874	80%	0.803	S	S	*	*			trans	49.9	104.9	148.4	-68.1	-167.7	173.3	-169.3	0	121.3
235	D	26.8	Very low	29.4	Very low	152 Å²	152	142 Å²	142	81%	0.813	81%	0.807	S	S	*	*			trans	-59.3	171.6	134.3	-79.9	-58.3	0	0	0	112.4
236	P	40.4	Very low	29.6	Very low	106 Å²	106	148.7 Å²	148.7	69%	0.688	82%	0.816	S	S	*	*			cis	-142.5	166.1	21.1	44	-25.8	0	0	0	119.6
237	L	29.3	Very low	29.7	Very low	146 Å²	146	145 Å²	145	76%	0.764	81%	0.811	S	S	*	*			trans	46.5	135	136.6	-65.1	170.3	0	0	0	123
238	T	30.7	Very low	29.9	Very low	109 Å²	109	148.9 Å²	148.9	67%	0.669	81%	0.812	S	S	*	*			trans	37.2	132.4	141.3	61.5	0	0	0	0	120.9
239	H	28	Very low	29.9	Very low	183 Å²	183	151.8 Å²	151.8	85%	0.847	82%	0.815	S	S	*	*				-158.3	135.9	116	-105.6	-71.7	0	0	0	112
240	T	28.9	Very low	30	Very low	137 Å²	137	154.6 Å²	154.6	84%	0.84	82%	0.815	S	S	*	*			trans	-84.7	142.6	160.3	45.1	0	0	0	0	109.2
241	S	29.3	Very low	30	Very low	107 Å²	107	157.1 Å²	157.1	75%	0.748	82%	0.82	S	S	*	*			trans	-147.3	103.1	172	48	0	0	0	0	111.9
242	N	31.5	Very low	29.6	Very low	178 Å²	178	161.6 Å²	161.6	95%	0.952	83%	0.828	S	S	*	*			trans	-80.3	127.6	156.7	-80	-34.4	0	0	0	107.8
243	S	28.9	Very low	29.8	Very low	108 Å²	108	159 Å²	159	76%	0.755	83%	0.829	S	S	*	*			trans	-149.2	131	165.2	64	0	0	0	0	111.9
244	L	29.7	Very low	29.7	Very low	172 Å²	172	151.3 Å²	151.3	90%	0.901	83%	0.825	S	S	*	*			trans	-140	155.6	162.9	-80.5	-177.2	0	0	0	108.5
245	P	36.3	Very low	29.9	Very low	122 Å²	122	147.9 Å²	147.9	79%	0.792	83%	0.826	S	S	*	*			trans	-104.9	162.2	-134.9	37.6	-37.3	0	0	0	115.5
246	R	27.5	Very low	30	Very low	243 Å²	243	145.5 Å²	145.5	92%	0.917	83%	0.828	S	S	*	*	P	Polyproline II helix	trans	-101.5	146.2	163	-164	169.3	-175.8	164.8	1.8	110.6
247	S	29.7	Very low	29.3	Very low	110 Å²	110	146.3 Å²	146.3	77%	0.769	84%	0.836	S	S	*	*	P	Polyproline II helix	trans	-74.1	157.3	-171.8	42.3	0	0	0	0	114.7
248	K	31	Very low	29.4	Very low	206 Å²	206	147.9 Å²	147.9	90%	0.896	84%	0.844	S	S	*	*	P	Polyproline II helix	trans	-80.3	136.8	-179.8	-64.9	178.7	178.7	178.2	0	112.1
249	T	27.2	Very low	29.3	Very low	135 Å²	135	148 Å²	148	83%	0.828	85%	0.849	S	S	*	*	P	Polyproline II helix	trans	-85.7	143.7	164	-51.4	0	0	0	0	110.1
250	I	30.1	Very low	29.2	Very low	157 Å²	157	142.4 Å²	142.4	81%	0.805	84%	0.841	S	S	*	*			trans	-121	135	169.6	-66.6	175.4	0	0	0	108.4
251	M	28.6	Very low	29.3	Very low	180 Å²	180	144.6 Å²	144.6	89%	0.887	84%	0.841	S	S	*	*			trans	-101.5	144.8	171.6	-75.9	-177.9	154.7	0	0	111
252	K	28	Very low	29.2	Very low	208 Å²	208	148.4 Å²	148.4	90%	0.904	85%	0.847	S	S	*	*			trans	-150.9	165.1	153.6	-135.6	176.3	-177.6	-177.9	0	110.3
253	T	29.5	Very low	29.1	Very low	137 Å²	137	152 Å²	152	84%	0.84	85%	0.847	S	S	*	*			trans	-125.6	154.4	-155	40.5	0	0	0	0	114.2
254	G	26.8	Very low	29.1	Very low	81 Å²	81	150.7 Å²	150.7	84%	0.835	84%	0.843	S	S	*	*			trans	84.3	149.8	171.6	0	0	0	0	0	114.6
255	S	28.9	Very low	29.3	Very low	129 Å²	129	148.6 Å²	148.6	90%	0.902	84%	0.84	S	S	*	*			cis	-150.8	173.9	-7.5	58.4	0	0	0	0	110
256	A	29.6	Very low	29	Very low	102 Å²	102	148.6 Å²	148.6	84%	0.843	84%	0.842	S	S	*	*			trans	-101.4	150	-170.1	0	0	0	0	0	114.2
257	S	26.1	Very low	29.1	Very low	122 Å²	122	148 Å²	148	85%	0.853	84%	0.842	S	S	*	*			trans	-154.6	155.2	153.6	55.3	0	0	0	0	110.2
258	L	31.5	Very low	29.3	Very low	179 Å²	179	148.8 Å²	148.8	94%	0.937	85%	0.847	S	S	*	*			trans	-102.5	144.9	-178.5	-59.1	104.9	0	0	0	111.6
259	S	28.8	Very low	29.1	Very low	112 Å²	112	141.9 Å²	141.9	78%	0.783	84%	0.835	S	S	*	*			trans	-167.7	151.6	138.6	-171.8	0	0	0	0	110
260	G	26.2	Very low	29.3	Very low	65 Å²	65	144.1 Å²	144.1	67%	0.67	84%	0.84	S	S	*	*			trans	-150.9	138.2	172.6	0	0	0	0	0	110.9
261	H	30.3	Very low	29.3	Very low	183 Å²	183	141.1 Å²	141.1	85%	0.847	83%	0.833	S	S	*	*			trans	-144.7	141.1	175.2	-83.6	-65.6	0	0	0	111.9
262	H	27.7	Very low	29.3	Very low	187 Å²	187	140.2 Å²	140.2	87%	0.866	83%	0.829	S	S	*	*			trans	-89.5	137.9	165.2	-58.3	-107.3	0	0	0	109.8
263	R	28.6	Very low	29.4	Very low	255 Å²	255	135.7 Å²	135.7	96%	0.962	82%	0.818	S	S	*	*			trans	-167.4	163.3	130.1	-116.6	176.1	171	145.5	-1.7	115.4
264	A	30.2	Very low	29.6	Very low	80 Å²	80	134.9 Å²	134.9	66%	0.661	82%	0.819	S	S	*	*	P	Polyproline II helix	trans	-54.7	162.1	-172.6	0	0	0	0	0	117.7
265	P	33.6	Very low	29.8	Very low	128 Å²	128	134.6 Å²	134.6	83%	0.831	82%	0.815	S	S	*	*	P	Polyproline II helix	trans	-75.6	144.1	159.6	33.9	-33.5	0	0	0	111.2
266	S	29.9	Very low	29.9	Very low	121 Å²	121	134.4 Å²	134.4	85%	0.846	81%	0.809	S	S	*	*	P	Polyproline II helix	trans	-90.2	150.9	-179.7	-63.4	0	0	0	0	113.3
267	Y	29.1	Very low	30	Very low	231 Å²	231	138 Å²	138	91%	0.906	81%	0.805	S	S	*	*	P	Polyproline II helix	trans	-71	138.6	173.4	-119.7	-111.1	0	0	0	112.1
268	S	33.2	Very low	30.2	Very low	126 Å²	126	140.6 Å²	140.6	88%	0.881	80%	0.804	S	S	*	*			trans	-147.9	128	155.7	-75.3	0	0	0	0	108.6
269	G	26.8	Very low	30	Very low	62 Å²	62	135.6 Å²	135.6	64%	0.639	80%	0.796	S	S	*	*			trans	-160.5	-173.8	179.3	0	0	0	0	0	111.5
270	L	31.8	Very low	30.9	Very low	181 Å²	181	137 Å²	137	95%	0.948	80%	0.802	S	S	*	*			trans	73.3	148.1	-167.2	-47.8	172.8	0	0	0	113.2
271	S	29.8	Very low	31.1	Very low	94 Å²	94	137.2 Å²	137.2	66%	0.657	80%	0.804	S	S	*	*			cis	-169.8	152.2	-28.6	-159.7	0	0	0	0	106
272	M	30	Very low	32.2	Very low	161 Å²	161	134.9 Å²	134.9	79%	0.793	81%	0.805	S	S	*	*				-176.3	150.9	61.5	-82.6	-70.7	-102.2	0	0	111.7
273	V	30	Very low	32.4	Very low	113 Å²	113	130.3 Å²	130.3	69%	0.685	80%	0.8	S	S	*	*			trans	42.1	105.2	133.1	-171.6	0	0	0	0	122.5
274	S	33.4	Very low	33.5	Very low	121 Å²	121	123.8 Å²	123.8	85%	0.846	79%	0.79	S	S	*	*				44.5	128.8	120	-44.6	0	0	0	0	125.4
275	G	29.8	Very low	33.6	Very low	74 Å²	74	126.3 Å²	126.3	76%	0.763	80%	0.798	S	S	*	*			trans	161.4	141.9	154.6	0	0	0	0	0	113.1
276	V	31.4	Very low	33.5	Very low	126 Å²	126	125.4 Å²	125.4	76%	0.764	79%	0.79	S	S	*	*			cis	170.4	140.2	-27.6	142.2	0	0	0	0	105.4
277	K	31.5	Very low	33.7	Very low	177 Å²	177	127.9 Å²	127.9	77%	0.77	79%	0.788	S	S	*	*			trans	71.4	124.4	175	-72.7	176.1	178.8	178.2	0	116.8
278	Q	31.2	Very low	33.8	Very low	177 Å²	177	127 Å²	127	83%	0.827	79%	0.789	S	S	*	*				90.3	130.5	68.4	-77.1	175.3	-19.2	0	0	113.6
279	G	27.5	Very low	33.5	Very low	74 Å²	74	124.4 Å²	124.4	76%	0.763	78%	0.782	S	S	*	*			trans	-95.1	-145.9	176.9	0	0	0	0	0	113
280	P	46.9	Very low	33.6	Very low	140 Å²	140	128 Å²	128	91%	0.909	79%	0.792	S	S	*	*			cis	-136.4	-172.2	-1.1	44	-27.1	0	0	0	114.7
281	G	29.6	Very low	34.4	Very low	70 Å²	70	124.8 Å²	124.8	72%	0.722	78%	0.782	S	S	*	*			trans	121.1	161.6	150.3	0	0	0	0	0	118.6
282	P	54	Low	34.3	Very low	134 Å²	134	130.5 Å²	130.5	87%	0.87	79%	0.794	S	S	*	*			trans	-134	-163.9	-161.1	43.3	-24.7	0	0	0	116.3
283	A	33	Very low	34.3	Very low	91 Å²	91	128.6 Å²	128.6	75%	0.752	79%	0.792	S	S	*	*			trans	121.4	170.7	153.1	0	0	0	0	0	116.4
284	P	51.4	Low	34.3	Very low	118 Å²	118	131.1 Å²	131.1	77%	0.766	80%	0.802	S	S	*	*				-142	174.7	-122.2	38.4	-14.9	0	0	0	119.1
285	T	31.1	Very low	34.2	Very low	134 Å²	134	136.4 Å²	136.4	82%	0.822	80%	0.803	S	S	*	*			trans	-153.8	-176.4	166	41.9	0	0	0	0	111.5
286	T	31.5	Very low	34.4	Very low	109 Å²	109	139.8 Å²	139.8	67%	0.669	81%	0.809	S	S	*	*				-161.1	-178.2	-96	28.9	0	0	0	0	111.4
287	H	34	Very low	34.3	Very low	173 Å²	173	141.1 Å²	141.1	80%	0.801	81%	0.812	S	S	*	*			trans	78	123.6	173.3	-51.8	-84.2	0	0	0	116.5
288	K	31.9	Very low	34.3	Very low	213 Å²	213	142.2 Å²	142.2	93%	0.926	82%	0.817	S	S	*	*			cis	105.9	108	9.8	-165.1	-175.5	-174.7	-176.8	0	114.7
289	G	27.8	Very low	34.3	Very low	70 Å²	70	139.3 Å²	139.3	72%	0.722	81%	0.813	S	S	*	*			trans	178.6	136.8	169.3	0	0	0	0	0	114.1
290	T	29.1	Very low	34.4	Very low	139 Å²	139	141.3 Å²	141.3	85%	0.853	82%	0.815	S	S	*	*			trans	-155.3	-179.5	-178.9	52.5	0	0	0	0	109.3
291	P	47.7	Very low	33.6	Very low	113 Å²	113	140.3 Å²	140.3	73%	0.734	81%	0.807	S	S	*	*				-125.1	179.8	-55.5	37.9	-24.4	0	0	0	111.7
292	K	28	Very low	33.7	Very low	213 Å²	213	142.8 Å²	142.8	93%	0.926	81%	0.81	S	S	*	*			trans	-156.2	162	156.3	-118.3	168.7	-171.8	177.9	0	113.1
293	T	30.3	Very low	32.7	Very low	121 Å²	121	142.6 Å²	142.6	74%	0.742	81%	0.807	S	S	*	*			trans	-114.8	148.7	-163.3	50.3	0	0	0	0	113.8
294	N	29.7	Very low	32.7	Very low	166 Å²	166	144.6 Å²	144.6	89%	0.888	81%	0.81	S	S	*	*				-171.5	162	120	-96.1	-9.2	0	0	0	113.5
295	R	31.4	Very low	31.9	Very low	233 Å²	233	143.2 Å²	143.2	88%	0.879	81%	0.808	S	S	*	*			trans	-97.4	148.1	178.2	-77.8	168.3	147.3	172.1	-7.4	111.6
296	T	32.9	Very low	32	Very low	144 Å²	144	141.4 Å²	141.4	88%	0.883	81%	0.807	S	S	*	*			trans	-155.8	154.4	133.2	15	0	0	0	0	110.8
297	N	30.2	Very low	32.4	Very low	154 Å²	154	146.7 Å²	146.7	82%	0.824	82%	0.815	S	S	*	*			trans	-83.8	171.4	178.4	-49.8	-48.5	0	0	0	109.8
298	K	31.9	Very low	32.4	Very low	200 Å²	200	147.9 Å²	147.9	87%	0.87	82%	0.818	S	S	*	*			cis	-149.4	-169.7	30.9	-124.3	-158.2	169.8	175.8	0	109.9
299	P	31	Very low	32.7	Very low	116 Å²	116	147 Å²	147	75%	0.753	81%	0.813	S	S	*	*			trans	-99.7	154.8	-146.6	40.2	-36.2	0	0	0	115.5
300	S	28.5	Very low	33.5	Very low	116 Å²	116	151.6 Å²	151.6	81%	0.811	81%	0.814	S	S	*	*			trans	-117.2	151	159.5	53.3	0	0	0	0	110.7
301	T	30.5	Very low	34.1	Very low	120 Å²	120	151.5 Å²	151.5	74%	0.736	81%	0.808	S	S	*	*			trans	-62	137.5	-173.5	-41.1	0	0	0	0	112	T303	T301-T303 VanDerWaalsContact C-N 3.31Å; T301-T303 PolarHBondContact O-N 3.29Å
302	P	32.6	Very low	34.4	Very low	121 Å²	121	150.9 Å²	150.9	79%	0.786	80%	0.798	S	S	*	*			trans	-73.6	84.3	173.1	31	-34.8	0	0	0	110.6	T304	P302-T304 PolarHBondContact O-N 3.04Å
303	T	31.6	Very low	35.4	Very low	130 Å²	130	149.1 Å²	149.1	80%	0.798	79%	0.791	S	S	*	*			trans	-55.2	125	168.9	-59.4	0	0	0	0	109.4	T301 A305	T301-T303 VanDerWaalsContact C-N 3.31Å; T301-T303 PolarHBondContact O-N 3.29Å; T303-A305 PolarHBondContact O-N 3.26Å
304	T	33.7	Very low	36.6	Very low	133 Å²	133	150.3 Å²	150.3	82%	0.816	79%	0.792	S	S	*	*			trans	-52.3	113.6	-173.6	-43.3	0	0	0	0	111.3	P302 A306	P302-T304 PolarHBondContact O-N 3.04Å; T304-A306 PolarHBondContact O-N 3.16Å
305	A	33.8	Very low	38.3	Very low	89 Å²	89	144.5 Å²	144.5	74%	0.736	76%	0.759	S	S	*	*			trans	-61.8	111.8	-179.6	0	0	0	0	0	109.9	T303 R307	T303-A305 PolarHBondContact O-N 3.26Å; A305-R307 PolarHBondContact O-N 3.31Å
306	A	34.4	Very low	39.6	Very low	96 Å²	96	143 Å²	143	79%	0.793	75%	0.754	S	S	*	*			trans	-62.2	104.8	-177	0	0	0	0	0	110.4	T304 K308	T304-A306 PolarHBondContact O-N 3.16Å; A306-K308 PolarHBondContact O-N 3.43Å; A306-K308 VanDerWaalsContact O-N 3.16Å
307	R	39.1	Very low	41.2	Very low	220 Å²	220	144.6 Å²	144.6	83%	0.83	76%	0.756	S	S	*	*			trans	-54.7	122.4	170.7	-75.2	-177.6	170.7	-174.3	-4.5	107.6	A305 K309	A305-R307 PolarHBondContact O-N 3.31Å; R307-K309 PolarHBondContact O-N 2.63Å
308	K	34.5	Very low	43.3	Very low	199 Å²	199	138.4 Å²	138.4	87%	0.865	72%	0.724	S	S	*	*			trans	-53.3	128.9	-175.2	-66.3	-178.8	177.5	-179.8	0	110	A306 K310	A306-K308 PolarHBondContact O-N 3.43Å; A306-K308 VanDerWaalsContact O-N 3.16Å; K308-K310 PolarHBondContact O-N 3Å
309	K	38.6	Very low	45.7	Very low	193 Å²	193	133.3 Å²	133.3	84%	0.839	71%	0.706	S	S	*	*			trans	-59.6	104.3	161.5	-82.9	-175	172.5	-178.7	0	107.6	R307	R307-K309 PolarHBondContact O-N 2.63Å
310	K	43.6	Very low	48.2	Very low	167 Å²	167	131.3 Å²	131.3	73%	0.726	70%	0.696	S	S	*	*			trans	-73.2	123.2	164.1	-167.2	-175.2	179.6	-165.2	0	105.7	K308 L312	K308-K310 PolarHBondContact O-N 3Å; K310-L312 PolarHBondContact O-N 3.39Å
311	D	43.3	Very low	50.9	Low	138 Å²	138	132.7 Å²	132.7	74%	0.738	69%	0.694	S	S	*	*			trans	-57.6	125.6	-170.8	-78.8	-77.1	0	0	0	112.7	K313	D311-K313 PolarHBondContact O-N 2.95Å
312	L	52.7	Low	53.5	Low	99 Å²	99	128.5 Å²	128.5	52%	0.518	67%	0.667	S	S	.	*			trans	-74.5	33.3	-175.4	-73.2	85.4	0	0	0	113.5	K310	K310-L312 PolarHBondContact O-N 3.39Å
313	K	49.8	Very low	56	Low	177 Å²	177	122.8 Å²	122.8	77%	0.77	63%	0.63	S	S	*	*			trans	-105	107.7	-172.5	-70.9	-176.6	178.3	175.5	0	111.6	D311	D311-K313 PolarHBondContact O-N 2.95Å
314	N	55.3	Low	58.6	Low	146 Å²	146	119.3 Å²	119.3	78%	0.781	61%	0.606	S	S	*	*			trans	74.7	70.8	168.1	-52	-1.4	0	0	0	115.4	R316	N314-R316 PolarHBondContact O-N 3.14Å
315	F	64.8	Low	61.2	Low	44 Å²	44	116 Å²	116	19%	0.193	58%	0.583	C	S	.	*			trans	-50.6	125	146.8	-66.8	-80.4	0	0	0	108.3	N317 V318 A323 V427 E430	F315-N317 PolarHBondContact O-N 3.16Å; F315-V318 HydrophobicContact CB-CB 4.04Å; F315-V318 HydrophobicContact CB-CG2 4.27Å; F315-A323 HydrophobicContact CD2-CB 3.59Å; F315-A323 HydrophobicContact CE2-CB 3.83Å; F315-A323 HydrophobicContact CG-CB 4.41Å; F315-V427 HydrophobicContact CD1-CG2 3.98Å; F315-V427 HydrophobicContact CD2-CG2 4.49Å; F315-V427 HydrophobicContact CE1-CB 4.28Å; F315-V427 HydrophobicContact CE1-CG1 3.98Å; F315-V427 HydrophobicContact CE1-CG2 3.97Å; F315-V427 HydrophobicContact CE2-CG2 4.48Å; F315-V427 HydrophobicContact CG-CG2 4.25Å; F315-V427 HydrophobicContact CZ-CG1 4.13Å; F315-V427 HydrophobicContact CZ-CG2 4.23Å; F315-E430 HydrophobicContact CD1-CB 3.91Å; F315-E430 HydrophobicContact CD1-CG 4.05Å; F315-E430 HydrophobicContact CE1-CB 3.99Å
316	R	60	Low	63.8	Low	202 Å²	202	111.8 Å²	111.8	76%	0.762	55%	0.548	S	S	*	.	T	Hydrogen-bonded Turn	trans	-66.9	128.3	-174.9	-71	179.4	172.4	-176	-1.9	110.3	N314 V318	N314-R316 PolarHBondContact O-N 3.14Å; R316-V318 VanDerWaalsContact C-N 3.29Å; R316-V318 PolarHBondContact O-N 3.34Å
317	N	66.4	Low	66.3	Low	176 Å²	176	109.6 Å²	109.6	94%	0.941	52%	0.522	S	S	*	.	T	Hydrogen-bonded Turn	trans	63.4	20.9	176.4	-48.5	-25.5	0	0	0	116	F315	F315-N317 PolarHBondContact O-N 3.16Å
318	V	74.4	Confident	68.4	Low	25 Å²	25	105.3 Å²	105.3	15%	0.152	52%	0.516	C	S	.	.	S	Bend	trans	-116.7	134.9	177.1	-175.4	0	0	0	0	111.3	F315 R316 S320 A323 A423 A426	F315-V318 HydrophobicContact CB-CB 4.04Å; F315-V318 HydrophobicContact CB-CG2 4.27Å; R316-V318 VanDerWaalsContact C-N 3.29Å; R316-V318 PolarHBondContact O-N 3.34Å; V318-S320 PolarHBondContact O-N 3.35Å; V318-A323 HydrophobicContact CG1-CB 3.98Å; V318-A423 HydrophobicContact CG1-CB 3.59Å; V318-A426 HydrophobicContact CG2-CB 3.48Å; V318-A426 VanDerWaalsContact CG2-CB 3.48Å
319	D	82.4	Confident	70.6	Confident	92 Å²	92	103 Å²	103	49%	0.492	51%	0.508	S	S	.	.			trans	-59	119.9	171.9	-77.5	-41.4	0	0	0	110.4	N321 L322 A323 K419	D319-N321 VanDerWaalsContact C-N 3.25Å; D319-N321 PolarHBondContact O-N 3.32Å; D319-N321 VanDerWaalsContact O-N 3.16Å; D319-L322 HydrophobicContact CB-CB 3.94Å; D319-L322 WeakPolarHBondContact O-CA 3.49Å; D319-L322 WeakPolarHBondContact O-CB 3.49Å; D319-L322 PolarHBondContact O-N 2.92Å; D319-A323 PolarHBondContact O-N 3.05Å; D319-K419 IonicContact OD2-NZ 3.58Å
320	S	83.1	Confident	72.7	Confident	75 Å²	75	94.3 Å²	94.3	52%	0.524	47%	0.471	S	S	.	.	H	α-helix	trans	-54.6	-39.4	-175.9	-177.4	0	0	0	0	113	V318 L322 A323 N324	V318-S320 PolarHBondContact O-N 3.35Å; S320-L322 VanDerWaalsContact C-N 3.3Å; S320-L322 PolarHBondContact O-N 3.19Å; S320-A323 PolarHBondContact O-N 3.15Å; S320-N324 WeakPolarHBondContact O-CB 3.33Å; S320-N324 PolarHBondContact O-N 3.28Å; S320-N324 PolarHBondContact O-ND2 2.89Å; S320-N324 PolarHBondContact OG-ND2 3.33Å
321	N	85.6	Confident	74.7	Confident	144 Å²	144	87.1 Å²	87.1	77%	0.77	44%	0.441	S	S	*	.	H	α-helix	trans	-61.8	-39	176.8	-63.3	-14.3	0	0	0	112.1	D319 N324 L325	D319-N321 VanDerWaalsContact C-N 3.25Å; D319-N321 PolarHBondContact O-N 3.32Å; D319-N321 VanDerWaalsContact O-N 3.16Å; N321-N324 PolarHBondContact O-N 3.43Å; N321-L325 PolarHBondContact O-N 3.23Å
322	L	84.8	Confident	76.5	Confident	32 Å²	32	83 Å²	83	17%	0.168	42%	0.419	C	S	.	.	H	α-helix	trans	-74.4	-40.1	-178.7	-170.7	58.1	0	0	0	111.2	D319 S320 L325 I326 K419 L420 A423	D319-L322 HydrophobicContact CB-CB 3.94Å; D319-L322 WeakPolarHBondContact O-CA 3.49Å; D319-L322 WeakPolarHBondContact O-CB 3.49Å; D319-L322 PolarHBondContact O-N 2.92Å; S320-L322 VanDerWaalsContact C-N 3.3Å; S320-L322 PolarHBondContact O-N 3.19Å; L322-L325 WeakPolarHBondContact O-CB 3.5Å; L322-L325 PolarHBondContact O-N 2.85Å; L322-I326 HydrophobicContact CG-CD1 4.47Å; L322-I326 WeakPolarHBondContact O-CD1 3.44Å; L322-I326 WeakPolarHBondContact O-CG1 3.43Å; L322-I326 PolarHBondContact O-N 2.99Å; L322-K419 HydrophobicContact CD2-CB 3.97Å; L322-L420 HydrophobicContact CD1-CB 4.24Å; L322-L420 HydrophobicContact CD1-CD1 3.72Å; L322-L420 HydrophobicContact CG-CD1 4.47Å; L322-A423 HydrophobicContact CD2-CB 3.52Å; L322-A423 HydrophobicContact CG-CB 3.75Å
323	A	84.8	Confident	77.7	Confident	2 Å²	2	85.1 Å²	85.1	2%	0.017	43%	0.431	C	S	.	.	H	α-helix	trans	-60.5	-43.4	170.9	0	0	0	0	0	111.9	F315 V318 D319 S320 L325 I326 M327 V427	F315-A323 HydrophobicContact CD2-CB 3.59Å; F315-A323 HydrophobicContact CE2-CB 3.83Å; F315-A323 HydrophobicContact CG-CB 4.41Å; V318-A323 HydrophobicContact CG1-CB 3.98Å; D319-A323 PolarHBondContact O-N 3.05Å; S320-A323 PolarHBondContact O-N 3.15Å; A323-L325 VanDerWaalsContact C-N 3.34Å; A323-L325 PolarHBondContact O-N 3.18Å; A323-I326 PolarHBondContact O-N 2.96Å; A323-M327 WeakPolarHBondContact O-CB 3.29Å; A323-M327 VanDerWaalsContact O-CG 3.25Å; A323-M327 WeakPolarHBondContact O-CG 3.47Å; A323-M327 PolarHBondContact O-N 2.8Å; A323-V427 HydrophobicContact CB-CG2 4.11Å
324	N	86.3	Confident	78.5	Confident	57 Å²	57	79.2 Å²	79.2	31%	0.305	42%	0.42	S	S	.	.	H	α-helix	trans	-64.8	-35.3	176	-75	-60.1	0	0	0	112.6	S320 N321 N328	S320-N324 WeakPolarHBondContact O-CB 3.33Å; S320-N324 PolarHBondContact O-N 3.28Å; S320-N324 PolarHBondContact O-ND2 2.89Å; S320-N324 PolarHBondContact OG-ND2 3.33Å; N321-N324 PolarHBondContact O-N 3.43Å; N324-N328 WeakPolarHBondContact O-CB 3.23Å; N324-N328 PolarHBondContact O-N 3.03Å; N324-N328 VanDerWaalsContact O-N 3.16Å; N324-N328 PolarHBondContact O-ND2 3.3Å
325	L	87.5	Confident	79	Confident	63 Å²	63	78.8 Å²	78.8	33%	0.33	42%	0.423	S	S	.	.	H	α-helix	trans	-62	-51.3	172.4	-175.1	153.1	0	0	0	110.9	N321 L322 A323 M327 N328 E329 L420	N321-L325 PolarHBondContact O-N 3.23Å; L322-L325 WeakPolarHBondContact O-CB 3.5Å; L322-L325 PolarHBondContact O-N 2.85Å; A323-L325 VanDerWaalsContact C-N 3.34Å; A323-L325 PolarHBondContact O-N 3.18Å; L325-M327 VanDerWaalsContact C-N 3.31Å; L325-M327 PolarHBondContact O-N 2.81Å; L325-N328 PolarHBondContact O-N 3.32Å; L325-N328 VanDerWaalsContact O-N 3.15Å; L325-E329 WeakPolarHBondContact O-CB 3.38Å; L325-E329 PolarHBondContact O-N 3.48Å; L325-L420 HydrophobicContact CD2-CD1 4.32Å
326	I	88.3	Confident	79.5	Confident	0 Å²	0	80.4 Å²	80.4	0%	0	45%	0.445	C	S	.	.	I	π-helix	trans	-55.9	-46.2	177.3	-65.2	156.3	0	0	0	111	L322 A323 N328 I330 V331 F402 L420 A423 L424 V427	L322-I326 HydrophobicContact CG-CD1 4.47Å; L322-I326 WeakPolarHBondContact O-CD1 3.44Å; L322-I326 WeakPolarHBondContact O-CG1 3.43Å; L322-I326 PolarHBondContact O-N 2.99Å; A323-I326 PolarHBondContact O-N 2.96Å; I326-N328 VanDerWaalsContact C-N 3.28Å; I326-N328 PolarHBondContact O-N 3.37Å; I326-I330 HydrophobicContact CG1-CD1 4.17Å; I326-I330 HydrophobicContact CG2-CB 4.31Å; I326-I330 WeakPolarHBondContact O-CA 3.36Å; I326-I330 WeakPolarHBondContact O-CB 3.47Å; I326-I330 PolarHBondContact O-N 2.61Å; I326-V331 PolarHBondContact O-N 2.76Å; I326-V331 VanDerWaalsContact O-N 3.12Å; I326-F402 HydrophobicContact CG2-CD1 3.98Å; I326-F402 HydrophobicContact CG2-CE1 3.85Å; I326-L420 HydrophobicContact CD1-CD1 4.12Å; I326-L420 HydrophobicContact CG1-CD1 3.77Å; I326-A423 HydrophobicContact CD1-CB 3.61Å; I326-L424 HydrophobicContact CD1-CB 4.49Å; I326-L424 HydrophobicContact CG2-CD1 4.29Å; I326-V427 HydrophobicContact CD1-CG2 4.36Å; I326-V427 HydrophobicContact CG2-CB 4.46Å; I326-V427 HydrophobicContact CG2-CG1 4.21Å
327	M	86.4	Confident	80.8	Confident	50 Å²	50	72 Å²	72	25%	0.246	42%	0.416	C	S	.	.	I	π-helix	trans	-66.7	-23.9	-178.8	-71	-57	-57.3	0	0	114.5	A323 L325 V331 V427 L431	A323-M327 WeakPolarHBondContact O-CB 3.29Å; A323-M327 VanDerWaalsContact O-CG 3.25Å; A323-M327 WeakPolarHBondContact O-CG 3.47Å; A323-M327 PolarHBondContact O-N 2.8Å; L325-M327 VanDerWaalsContact C-N 3.31Å; L325-M327 PolarHBondContact O-N 2.81Å; M327-V331 HydrophobicContact CE-CG2 4.3Å; M327-V331 HydrophobicContact SD-CG2 3.94Å; M327-V427 HydrophobicContact SD-CG1 3.79Å; M327-L431 HydrophobicContact CE-CD1 3.84Å; M327-L431 HydrophobicContact SD-CD1 3.48Å; M327-L431 WeakPolarHBondContact SD-CD1 3.47Å
328	N	84.6	Confident	81.8	Confident	131 Å²	131	69.2 Å²	69.2	70%	0.701	40%	0.395	S	S	*	.	I	π-helix	trans	-99.7	-35	-177.7	-69	-28.6	0	0	0	113.4	N324 L325 I326	N324-N328 WeakPolarHBondContact O-CB 3.23Å; N324-N328 PolarHBondContact O-N 3.03Å; N324-N328 VanDerWaalsContact O-N 3.16Å; N324-N328 PolarHBondContact O-ND2 3.3Å; L325-N328 PolarHBondContact O-N 3.32Å; L325-N328 VanDerWaalsContact O-N 3.15Å; I326-N328 VanDerWaalsContact C-N 3.28Å; I326-N328 PolarHBondContact O-N 3.37Å
329	E	81.1	Confident	82.5	Confident	149 Å²	149	69 Å²	69	70%	0.696	39%	0.392	S	S	*	.	I	π-helix	trans	-105	-29.8	-172.1	-62.1	-176.6	178	0	0	113.5	L325	L325-E329 WeakPolarHBondContact O-CB 3.38Å; L325-E329 PolarHBondContact O-N 3.48Å
330	I	82.8	Confident	82.7	Confident	11 Å²	11	71.1 Å²	71.1	6%	0.056	40%	0.404	C	S	.	.	I	π-helix	trans	-105	-34.9	-172.5	-63.2	176.4	0	0	0	112.1	I326 D332 F402 N403 I404 L420 L424	I326-I330 HydrophobicContact CG1-CD1 4.17Å; I326-I330 HydrophobicContact CG2-CB 4.31Å; I326-I330 WeakPolarHBondContact O-CA 3.36Å; I326-I330 WeakPolarHBondContact O-CB 3.47Å; I326-I330 PolarHBondContact O-N 2.61Å; I330-D332 PolarHBondContact O-N 2.95Å; I330-F402 HydrophobicContact CG2-CB 3.79Å; I330-F402 HydrophobicContact CG2-CD1 4.02Å; I330-F402 HydrophobicContact CG2-CG 4.42Å; I330-F402 CarbonylContact O-C 3.58Å; I330-F402 WeakPolarHBondContact O-CA 2.94Å; I330-N403 PolarHBondContact O-N 2.72Å; I330-I404 HydrophobicContact CD1-CD1 4.42Å; I330-I404 HydrophobicContact CD1-CG1 4.34Å; I330-I404 HydrophobicContact CG1-CG1 4.45Å; I330-I404 HydrophobicContact CG2-CD1 3.88Å; I330-I404 HydrophobicContact CG2-CG1 3.44Å; I330-I404 VanDerWaalsContact CG2-CG1 3.44Å; I330-L420 HydrophobicContact CD1-CD1 4.34Å; I330-L424 HydrophobicContact CG2-CD1 4.26Å
331	V	83.6	Confident	82.9	Confident	16 Å²	16	72 Å²	72	10%	0.097	40%	0.403	C	S	.	.	B	Isolated β-bridge	trans	-73.8	111	177.7	180	0	0	0	0	110.2	I326 M327 N333 T400 F402	I326-V331 PolarHBondContact O-N 2.76Å; I326-V331 VanDerWaalsContact O-N 3.12Å; M327-V331 HydrophobicContact CE-CG2 4.3Å; M327-V331 HydrophobicContact SD-CG2 3.94Å; V331-N333 PolarHBondContact O-N 3.05Å; V331-N333 PolarHBondContact O-ND2 3.46Å; V331-T400 HydrophobicContact CG1-CG2 3.92Å; V331-F402 HydrophobicContact CG2-CD1 3.74Å; V331-F402 HydrophobicContact CG2-CE1 3.51Å; V331-F402 HydrophobicContact CG2-CZ 4.14Å
332	D	83	Confident	83.2	Confident	53 Å²	53	66.1 Å²	66.1	28%	0.283	37%	0.371	S	S	.	.			trans	-77.4	114.6	-178.5	-166	-5.7	0	0	0	110.9	I330 G334 K391 F401 N403	I330-D332 PolarHBondContact O-N 2.95Å; D332-G334 WeakPolarHBondContact OD1-CA 3.27Å; D332-G334 PolarHBondContact OD1-N 2.95Å; D332-K391 IonicContact OD2-NZ 3.52Å; D332-K391 PolarHBondContact OD2-NZ 3.1Å; D332-F401 HydrophobicContact CB-CB 4.49Å; D332-F401 HydrophobicContact CB-CD1 3.81Å; D332-F401 PolarHBondContact N-O 3.21Å; D332-N403 HydrophobicContact CB-CB 4.24Å
333	N	76.9	Confident	83.5	Confident	143 Å²	143	65.1 Å²	65.1	77%	0.765	37%	0.367	S	S	*	.			trans	-105.9	16.4	175	-67.3	-93	0	0	0	111.7	V331	V331-N333 PolarHBondContact O-N 3.05Å; V331-N333 PolarHBondContact O-ND2 3.46Å
334	G	66.6	Low	83.7	Confident	53 Å²	53	65.4 Å²	65.4	55%	0.546	37%	0.37	S	S	.	.	S	Bend	trans	-70.6	-179.1	-175.4	0	0	0	0	0	115.1	D332 A336	D332-G334 WeakPolarHBondContact OD1-CA 3.27Å; D332-G334 PolarHBondContact OD1-N 2.95Å; G334-A336 PolarHBondContact O-N 2.93Å; G334-A336 VanDerWaalsContact O-N 3.14Å
335	T	65.8	Low	84	Confident	137 Å²	137	63.9 Å²	63.9	84%	0.84	36%	0.361	S	S	*	.			trans	-62.7	115.1	179.1	51	0	0	0	0	110.7	V337	T335-V337 PolarHBondContact O-N 2.57Å; T335-V337 VanDerWaalsContact O-N 3.15Å
336	A	75.3	Confident	84.1	Confident	78 Å²	78	65.9 Å²	65.9	65%	0.645	37%	0.372	S	S	*	.			trans	-58.9	115	176.5	0	0	0	0	0	111.2	G334 A395	G334-A336 PolarHBondContact O-N 2.93Å; G334-A336 VanDerWaalsContact O-N 3.14Å; A336-A395 HydrophobicContact CB-CB 3.95Å
337	V	86.9	Confident	84.3	Confident	26 Å²	26	70.6 Å²	70.6	16%	0.158	40%	0.397	C	S	.	.			trans	-80	139	167.2	-178.3	0	0	0	0	107.7	T335 D341 I342 M388 A392 A395	T335-V337 PolarHBondContact O-N 2.57Å; T335-V337 VanDerWaalsContact O-N 3.15Å; V337-D341 HydrophobicContact CG1-CB 3.9Å; V337-I342 HydrophobicContact CG1-CG1 4.41Å; V337-M388 HydrophobicContact CG1-CE 4.22Å; V337-A392 HydrophobicContact CB-CB 4.46Å; V337-A392 HydrophobicContact CG1-CB 4.32Å; V337-A392 VanDerWaalsContact O-CA 3.3Å; V337-A392 WeakPolarHBondContact O-CA 3.3Å; V337-A395 WeakPolarHBondContact O-CB 3.39Å
338	K	88.3	Confident	84.5	Confident	116 Å²	116	68.3 Å²	68.3	50%	0.504	39%	0.386	S	S	.	.			trans	-96.6	165	176.9	-66.3	-172.2	174.1	-169.3	0	112.8	D340 D341 E396	K338-D340 PolarHBondContact O-N 2.7Å; K338-D341 PolarHBondContact N-OD2 3.06Å; K338-D341 PolarHBondContact O-N 3.16Å; K338-E396 WeakPolarHBondContact CA-OE1 3.32Å; K338-E396 WeakPolarHBondContact CB-OE1 3.11Å
339	F	87.7	Confident	84.9	Confident	20 Å²	20	63.5 Å²	63.5	9%	0.088	36%	0.359	C	S	.	.	G	3₁₀ helix	trans	-60.6	-28.4	169.6	-103.1	44.9	0	0	0	113.1	K349 L352 I357 L389 A392 V393 E396	F339-K349 HydrophobicContact CD2-CB 4.21Å; F339-K349 HydrophobicContact CD2-CD 4.34Å; F339-K349 HydrophobicContact CD2-CG 4.2Å; F339-K349 HydrophobicContact CE2-CB 3.82Å; F339-K349 HydrophobicContact CE2-CG 4.05Å; F339-K349 VanDerWaalsContact O-CE 3.3Å; F339-K349 WeakPolarHBondContact O-CE 3.44Å; F339-K349 PolarHBondContact O-NZ 2.76Å; F339-L352 HydrophobicContact CZ-CB 4.22Å; F339-I357 HydrophobicContact CD1-CD1 4.39Å; F339-I357 HydrophobicContact CD2-CD1 4.4Å; F339-I357 HydrophobicContact CE1-CD1 3.89Å; F339-I357 HydrophobicContact CE2-CD1 3.87Å; F339-I357 HydrophobicContact CZ-CD1 3.61Å; F339-L389 HydrophobicContact CE1-CD1 4.35Å; F339-L389 HydrophobicContact CZ-CD1 4.35Å; F339-A392 HydrophobicContact CD1-CB 3.81Å; F339-A392 HydrophobicContact CE1-CB 4.12Å; F339-V393 HydrophobicContact CE1-CB 4.37Å; F339-V393 HydrophobicContact CE1-CG2 3.59Å; F339-V393 HydrophobicContact CZ-CG2 3.72Å; F339-E396 HydrophobicContact CB-CG 4.16Å; F339-E396 HydrophobicContact CD1-CG 3.7Å; F339-E396 HydrophobicContact CE1-CG 4.47Å; F339-E396 HydrophobicContact CG-CG 4.08Å; F339-E396 PolarHBondContact N-OE1 3.38Å
340	D	87.1	Confident	85.5	Confident	138 Å²	138	61.3 Å²	61.3	74%	0.738	35%	0.348	S	S	*	.	G	3₁₀ helix	trans	-75	-27.2	177.7	-59.6	-33.4	0	0	0	113.5	K338 I342	K338-D340 PolarHBondContact O-N 2.7Å; D340-I342 PolarHBondContact O-N 2.68Å
341	D	87.8	Confident	85.9	Confident	94 Å²	94	61.6 Å²	61.6	50%	0.503	35%	0.353	S	S	.	.	G	3₁₀ helix	trans	-72	-17.3	-179.1	-65.2	-43.3	0	0	0	112.5	V337 K338	V337-D341 HydrophobicContact CG1-CB 3.9Å; K338-D341 PolarHBondContact N-OD2 3.06Å; K338-D341 PolarHBondContact O-N 3.16Å
342	I	91.3	Very high	86.3	Confident	20 Å²	20	60.9 Å²	60.9	10%	0.103	35%	0.348	C	S	.	.	S	Bend	trans	-92.4	121.3	-178.2	-59.8	175.7	0	0	0	109	V337 D340 K349 L389 A392	V337-I342 HydrophobicContact CG1-CG1 4.41Å; D340-I342 PolarHBondContact O-N 2.68Å; I342-K349 WeakPolarHBondContact O-CE 3.27Å; I342-K349 PolarHBondContact O-NZ 3.27Å; I342-L389 HydrophobicContact CD1-CB 4.14Å; I342-L389 HydrophobicContact CD1-CD1 3.81Å; I342-A392 HydrophobicContact CD1-CB 3.77Å
343	A	91.2	Very high	86.7	Confident	11 Å²	11	62.8 Å²	62.8	9%	0.091	36%	0.355	C	S	.	.			trans	-79.6	127.3	177.3	0	0	0	0	0	112	T511 L514 L515	A343-T511 HydrophobicContact CB-CG2 4.04Å; A343-T511 WeakPolarHBondContact O-CG2 3.43Å; A343-L514 HydrophobicContact CB-CB 4.35Å; A343-L514 HydrophobicContact CB-CD2 3.84Å; A343-L514 HydrophobicContact CB-CG 3.98Å; A343-L515 HydrophobicContact CB-CD2 3.69Å; A343-L515 HydrophobicContact CB-CG 3.73Å
344	G	90.6	Very high	87.4	Confident	8 Å²	8	60.7 Å²	60.7	8%	0.082	34%	0.341	C	S	.	.	S	Bend	trans	62.2	-142.8	177.9	0	0	0	0	0	113.5	D346 K349	G344-D346 VanDerWaalsContact C-N 3.25Å; G344-D346 VanDerWaalsContact CA-OD2 3.27Å; G344-D346 WeakPolarHBondContact CA-OD2 3.43Å; G344-D346 PolarHBondContact O-N 2.93Å; G344-K349 WeakPolarHBondContact O-CE 3.36Å
345	Q	90.9	Very high	88.4	Confident	24 Å²	24	59.5 Å²	59.5	11%	0.112	32%	0.322	C	S	.	.			trans	59.7	33.8	-174.3	-58.5	-67.9	-18.9	0	0	112.7	L347 A348 K349 V504 S505	Q345-L347 PolarHBondContact O-N 3.47Å; Q345-A348 HydrophobicContact CB-CB 4.35Å; Q345-A348 CarbonylContact O-C 3.59Å; Q345-A348 WeakPolarHBondContact O-CA 3.34Å; Q345-A348 WeakPolarHBondContact O-CB 3.4Å; Q345-A348 PolarHBondContact O-N 2.9Å; Q345-K349 PolarHBondContact O-N 3.25Å; Q345-V504 HydrophobicContact CG-CG1 4.34Å; Q345-S505 PolarHBondContact NE2-O 3.37Å; Q345-S505 VanDerWaalsContact OE1-N 3.16Å
346	D	91.2	Very high	89.6	Confident	105 Å²	105	53.6 Å²	53.6	56%	0.561	29%	0.286	S	S	*	.	H	α-helix	trans	-66.2	-35.4	-163	-49.5	-82.1	0	0	0	113	G344 K349 Q350	G344-D346 VanDerWaalsContact C-N 3.25Å; G344-D346 VanDerWaalsContact CA-OD2 3.27Å; G344-D346 WeakPolarHBondContact CA-OD2 3.43Å; G344-D346 PolarHBondContact O-N 2.93Å; D346-K349 PolarHBondContact O-N 3.02Å; D346-Q350 WeakPolarHBondContact O-CB 3.5Å; D346-Q350 PolarHBondContact O-N 3.01Å
347	L	90.6	Very high	90.3	Very high	100 Å²	100	50.4 Å²	50.4	52%	0.524	26%	0.258	S	S	.	.	H	α-helix	trans	-61.7	-42.1	170.3	-62.9	175.1	0	0	0	112.3	Q345 A351	Q345-L347 PolarHBondContact O-N 3.47Å; L347-A351 WeakPolarHBondContact O-CB 3.49Å; L347-A351 PolarHBondContact O-N 2.66Å
348	A	92.4	Very high	90.5	Very high	1 Å²	1	52.5 Å²	52.5	1%	0.008	27%	0.267	C	S	.	.	H	α-helix	trans	-71.9	-38.7	178.5	0	0	0	0	0	111.6	Q345 L352 L389 V502	Q345-A348 HydrophobicContact CB-CB 4.35Å; Q345-A348 CarbonylContact O-C 3.59Å; Q345-A348 WeakPolarHBondContact O-CA 3.34Å; Q345-A348 WeakPolarHBondContact O-CB 3.4Å; Q345-A348 PolarHBondContact O-N 2.9Å; A348-L352 WeakPolarHBondContact O-CB 3.26Å; A348-L352 WeakPolarHBondContact O-CD1 3.39Å; A348-L352 VanDerWaalsContact O-CG 3.25Å; A348-L352 WeakPolarHBondContact O-CG 3.4Å; A348-L352 PolarHBondContact O-N 3.46Å; A348-L389 HydrophobicContact CB-CD2 4.3Å; A348-V502 HydrophobicContact CB-CG1 3.44Å; A348-V502 VanDerWaalsContact CB-CG1 3.44Å
349	K	92.8	Very high	90.6	Very high	30 Å²	30	47.5 Å²	47.5	13%	0.13	25%	0.247	C	C	.	.	H	α-helix	trans	-59.8	-49.6	171.3	-73.5	-177.6	177.5	-176.8	0	111.3	F339 I342 G344 Q345 D346 L352 Q353 L389	F339-K349 HydrophobicContact CD2-CB 4.21Å; F339-K349 HydrophobicContact CD2-CD 4.34Å; F339-K349 HydrophobicContact CD2-CG 4.2Å; F339-K349 HydrophobicContact CE2-CB 3.82Å; F339-K349 HydrophobicContact CE2-CG 4.05Å; F339-K349 VanDerWaalsContact O-CE 3.3Å; F339-K349 WeakPolarHBondContact O-CE 3.44Å; F339-K349 PolarHBondContact O-NZ 2.76Å; I342-K349 WeakPolarHBondContact O-CE 3.27Å; I342-K349 PolarHBondContact O-NZ 3.27Å; G344-K349 WeakPolarHBondContact O-CE 3.36Å; Q345-K349 PolarHBondContact O-N 3.25Å; D346-K349 PolarHBondContact O-N 3.02Å; K349-L352 PolarHBondContact O-N 3.23Å; K349-Q353 VanDerWaalsContact O-CB 3.32Å; K349-Q353 WeakPolarHBondContact O-CB 3.13Å; K349-Q353 PolarHBondContact O-N 2.88Å; K349-L389 HydrophobicContact CG-CD1 4.27Å
350	Q	92.2	Very high	90.6	Very high	103 Å²	103	48.7 Å²	48.7	48%	0.481	26%	0.258	S	S	.	.	H	α-helix	trans	-59	-49.9	178.2	-178.5	-178.2	-14.1	0	0	110.9	D346 L352 Q353 E354	D346-Q350 WeakPolarHBondContact O-CB 3.5Å; D346-Q350 PolarHBondContact O-N 3.01Å; Q350-L352 VanDerWaalsContact C-N 3.32Å; Q350-L352 PolarHBondContact O-N 3.29Å; Q350-Q353 WeakPolarHBondContact O-CB 3.27Å; Q350-Q353 PolarHBondContact O-N 3.06Å; Q350-Q353 VanDerWaalsContact O-N 3.12Å; Q350-E354 VanDerWaalsContact CG-OE1 3.28Å; Q350-E354 WeakPolarHBondContact CG-OE1 3.24Å; Q350-E354 PolarHBondContact NE2-OE1 3.34Å; Q350-E354 WeakPolarHBondContact O-CG 3.49Å; Q350-E354 PolarHBondContact O-N 3.08Å
351	A	91.1	Very high	90.6	Very high	18 Å²	18	47.3 Å²	47.3	15%	0.149	25%	0.25	C	C	.	.	H	α-helix	trans	-57.2	-44.2	177.9	0	0	0	0	0	112	L347 E354 I355 V502	L347-A351 WeakPolarHBondContact O-CB 3.49Å; L347-A351 PolarHBondContact O-N 2.66Å; A351-E354 PolarHBondContact O-N 3.04Å; A351-I355 HydrophobicContact CB-CD1 4.31Å; A351-I355 VanDerWaalsContact O-CB 3.27Å; A351-I355 WeakPolarHBondContact O-CB 3.4Å; A351-I355 VanDerWaalsContact O-CD1 3.27Å; A351-I355 WeakPolarHBondContact O-CD1 3.2Å; A351-I355 WeakPolarHBondContact O-CG1 3.35Å; A351-I355 PolarHBondContact O-N 2.92Å; A351-V502 HydrophobicContact CB-CG2 4.04Å
352	L	92.6	Very high	90.7	Very high	0 Å²	0	51.2 Å²	51.2	0%	0	26%	0.258	C	S	.	.	H	α-helix	trans	-69.2	-33.5	176.9	-71.2	165.4	0	0	0	113.3	F339 A348 K349 Q350 V356 I357 L376 L378 L389 V393 M481	F339-L352 HydrophobicContact CZ-CB 4.22Å; A348-L352 WeakPolarHBondContact O-CB 3.26Å; A348-L352 WeakPolarHBondContact O-CD1 3.39Å; A348-L352 VanDerWaalsContact O-CG 3.25Å; A348-L352 WeakPolarHBondContact O-CG 3.4Å; A348-L352 PolarHBondContact O-N 3.46Å; K349-L352 PolarHBondContact O-N 3.23Å; Q350-L352 VanDerWaalsContact C-N 3.32Å; Q350-L352 PolarHBondContact O-N 3.29Å; L352-V356 HydrophobicContact CD2-CG2 4.35Å; L352-V356 WeakPolarHBondContact O-CA 3.25Å; L352-V356 WeakPolarHBondContact O-CB 3.4Å; L352-V356 PolarHBondContact O-N 3.3Å; L352-I357 PolarHBondContact O-N 2.94Å; L352-L376 HydrophobicContact CD2-CD1 3.54Å; L352-L376 HydrophobicContact CD2-CD2 3.76Å; L352-L376 HydrophobicContact CD2-CG 4.33Å; L352-L378 HydrophobicContact CD1-CD2 4.19Å; L352-L378 HydrophobicContact CD2-CD2 4.33Å; L352-L389 HydrophobicContact CD1-CD1 3.84Å; L352-L389 HydrophobicContact CD1-CD2 3.49Å; L352-L389 VanDerWaalsContact CD1-CD2 3.49Å; L352-L389 HydrophobicContact CD1-CG 3.43Å; L352-L389 VanDerWaalsContact CD1-CG 3.43Å; L352-V393 HydrophobicContact CB-CG2 3.84Å; L352-V393 HydrophobicContact CD1-CG2 3.9Å; L352-V393 HydrophobicContact CD2-CG2 4.18Å; L352-V393 HydrophobicContact CG-CG2 4.21Å; L352-M481 HydrophobicContact CD2-CE 4.06Å
353	Q	92.4	Very high	90.5	Very high	93 Å²	93	53.2 Å²	53.2	44%	0.435	27%	0.272	S	S	.	.	I	π-helix	trans	-64.2	-45.4	174.4	-172.8	174.6	4.6	0	0	110.7	K349 Q350 I357 L358	K349-Q353 VanDerWaalsContact O-CB 3.32Å; K349-Q353 WeakPolarHBondContact O-CB 3.13Å; K349-Q353 PolarHBondContact O-N 2.88Å; Q350-Q353 WeakPolarHBondContact O-CB 3.27Å; Q350-Q353 PolarHBondContact O-N 3.06Å; Q350-Q353 VanDerWaalsContact O-N 3.12Å; Q353-I357 HydrophobicContact CB-CD1 4.42Å; Q353-I357 HydrophobicContact CG-CB 4.41Å; Q353-I357 PolarHBondContact O-N 3.14Å; Q353-L358 HydrophobicContact CG-CG 4.39Å; Q353-L358 WeakPolarHBondContact O-CG 3.29Å; Q353-L358 PolarHBondContact O-N 2.81Å
354	E	90.1	Very high	90.5	Very high	100 Å²	100	60.9 Å²	60.9	47%	0.467	31%	0.306	S	S	.	.	I	π-helix	trans	-69.5	-42	177.3	-69.3	176.7	-160	0	0	113.3	Q350 A351 P359	Q350-E354 VanDerWaalsContact CG-OE1 3.28Å; Q350-E354 WeakPolarHBondContact CG-OE1 3.24Å; Q350-E354 PolarHBondContact NE2-OE1 3.34Å; Q350-E354 WeakPolarHBondContact O-CG 3.49Å; Q350-E354 PolarHBondContact O-N 3.08Å; A351-E354 PolarHBondContact O-N 3.04Å; E354-P359 WeakPolarHBondContact O-CD 3.42Å
355	I	88.3	Confident	90.5	Very high	27 Å²	27	64.8 Å²	64.8	14%	0.138	32%	0.324	C	S	.	.	I	π-helix	trans	-82.2	-29.4	-174.3	-62.6	160.3	0	0	0	112.8	A351 A373 L376 K500	A351-I355 HydrophobicContact CB-CD1 4.31Å; A351-I355 VanDerWaalsContact O-CB 3.27Å; A351-I355 WeakPolarHBondContact O-CB 3.4Å; A351-I355 VanDerWaalsContact O-CD1 3.27Å; A351-I355 WeakPolarHBondContact O-CD1 3.2Å; A351-I355 WeakPolarHBondContact O-CG1 3.35Å; A351-I355 PolarHBondContact O-N 2.92Å; I355-A373 HydrophobicContact CG2-CB 4.15Å; I355-L376 HydrophobicContact CB-CD1 4.35Å; I355-L376 HydrophobicContact CD1-CD1 4.16Å; I355-L376 HydrophobicContact CG2-CD1 3.93Å; I355-K500 HydrophobicContact CD1-CB 3.98Å; I355-K500 HydrophobicContact CD1-CD 3.99Å; I355-K500 HydrophobicContact CD1-CG 3.78Å; I355-K500 HydrophobicContact CG1-CG 4.35Å; I355-K500 HydrophobicContact CG2-CG 4.36Å
356	V	90.2	Very high	90.4	Very high	13 Å²	13	66.2 Å²	66.2	8%	0.079	33%	0.33	C	S	.	.	I	π-helix	trans	-124.6	-49.6	-170.4	-168.8	0	0	0	0	113.5	L352 S360 L376 V393 I435 L479	L352-V356 HydrophobicContact CD2-CG2 4.35Å; L352-V356 WeakPolarHBondContact O-CA 3.25Å; L352-V356 WeakPolarHBondContact O-CB 3.4Å; L352-V356 PolarHBondContact O-N 3.3Å; V356-S360 PolarHBondContact O-N 3.17Å; V356-L376 HydrophobicContact CG2-CD1 4.39Å; V356-V393 HydrophobicContact CB-CG1 3.74Å; V356-V393 HydrophobicContact CG1-CG1 3.43Å; V356-V393 VanDerWaalsContact CG1-CG1 3.43Å; V356-V393 HydrophobicContact CG2-CG1 4.22Å; V356-I435 HydrophobicContact CG1-CD1 4.01Å; V356-L479 HydrophobicContact CB-CD2 4.17Å; V356-L479 HydrophobicContact CG1-CD2 3.51Å; V356-L479 HydrophobicContact CG2-CD2 3.54Å
357	I	90.8	Very high	90.2	Very high	11 Å²	11	65.5 Å²	65.5	6%	0.056	33%	0.33	C	S	.	.	I	π-helix	trans	-75	-50.6	-170.6	-56	175.8	0	0	0	111	F339 L352 Q353 S360 L361 V393 E396	F339-I357 HydrophobicContact CD1-CD1 4.39Å; F339-I357 HydrophobicContact CD2-CD1 4.4Å; F339-I357 HydrophobicContact CE1-CD1 3.89Å; F339-I357 HydrophobicContact CE2-CD1 3.87Å; F339-I357 HydrophobicContact CZ-CD1 3.61Å; L352-I357 PolarHBondContact O-N 2.94Å; Q353-I357 HydrophobicContact CB-CD1 4.42Å; Q353-I357 HydrophobicContact CG-CB 4.41Å; Q353-I357 PolarHBondContact O-N 3.14Å; I357-S360 PolarHBondContact O-N 3.45Å; I357-S360 VanDerWaalsContact O-N 3.16Å; I357-L361 HydrophobicContact CG2-CD1 3.76Å; I357-L361 HydrophobicContact CG2-CG 4.23Å; I357-L361 WeakPolarHBondContact O-CG 2.93Å; I357-L361 PolarHBondContact O-N 3.45Å; I357-V393 HydrophobicContact CG1-CG1 4.38Å; I357-E396 HydrophobicContact CD1-CB 3.87Å; I357-E396 HydrophobicContact CD1-CG 4.41Å; I357-E396 HydrophobicContact CG1-CB 4.48Å; I357-E396 HydrophobicContact CG2-CB 4.49Å
358	L	91.6	Very high	90	Very high	70 Å²	70	64 Å²	64	37%	0.366	34%	0.338	S	S	.	.	H	α-helix	trans	-61.4	-40.8	179.6	-64	179.5	0	0	0	113.3	Q353 S360 L361 R362 F366	Q353-L358 HydrophobicContact CG-CG 4.39Å; Q353-L358 WeakPolarHBondContact O-CG 3.29Å; Q353-L358 PolarHBondContact O-N 2.81Å; L358-S360 PolarHBondContact O-N 2.61Å; L358-L361 PolarHBondContact O-N 2.87Å; L358-R362 PolarHBondContact O-N 2.93Å; L358-F366 HydrophobicContact CB-CE2 3.72Å; L358-F366 HydrophobicContact CB-CZ 3.57Å; L358-F366 HydrophobicContact CD1-CZ 4.49Å
359	P	89.9	Confident	89.7	Confident	12 Å²	12	73 Å²	73	8%	0.078	39%	0.385	C	S	.	.	H	α-helix	trans	-63.1	-34.6	171.8	-25.4	35.3	0	0	0	114.4	E354 P363 F366 P372	E354-P359 WeakPolarHBondContact O-CD 3.42Å; P359-P363 WeakPolarHBondContact O-CA 3.17Å; P359-P363 WeakPolarHBondContact O-CD 3.3Å; P359-F366 HydrophobicContact CB-CB 4.17Å; P359-F366 HydrophobicContact CB-CD1 4.4Å; P359-F366 HydrophobicContact CB-CD2 4.14Å; P359-F366 HydrophobicContact CB-CG 3.99Å; P359-F366 HydrophobicContact CG-CB 4.39Å; P359-F366 HydrophobicContact CG-CD1 3.72Å; P359-F366 HydrophobicContact CG-CD2 4.06Å; P359-F366 HydrophobicContact CG-CE1 3.91Å; P359-F366 HydrophobicContact CG-CE2 4.25Å; P359-F366 HydrophobicContact CG-CG 3.79Å; P359-F366 HydrophobicContact CG-CZ 4.18Å; P359-P372 HydrophobicContact CB-CB 3.8Å; P359-P372 HydrophobicContact CB-CG 4.03Å; P359-P372 HydrophobicContact CG-CB 3.92Å
360	S	87.8	Confident	89.5	Confident	44 Å²	44	80 Å²	80	31%	0.308	41%	0.411	S	S	.	.	H	α-helix	trans	-68.2	-41.1	174	-164.7	0	0	0	0	111.6	V356 I357 L358 S397	V356-S360 PolarHBondContact O-N 3.17Å; I357-S360 PolarHBondContact O-N 3.45Å; I357-S360 VanDerWaalsContact O-N 3.16Å; L358-S360 PolarHBondContact O-N 2.61Å; S360-S397 PolarHBondContact OG-O 3.02Å
361	L	87.8	Confident	89.3	Confident	110 Å²	110	78 Å²	78	58%	0.576	41%	0.411	S	S	*	.	H	α-helix	trans	-76.5	-33.6	-177.3	-67.6	176.7	0	0	0	114.1	I357 L358	I357-L361 HydrophobicContact CG2-CD1 3.76Å; I357-L361 HydrophobicContact CG2-CG 4.23Å; I357-L361 WeakPolarHBondContact O-CG 2.93Å; I357-L361 PolarHBondContact O-N 3.45Å; L358-L361 PolarHBondContact O-N 2.87Å
362	R	89.2	Confident	89.1	Confident	176 Å²	176	79 Å²	79	66%	0.664	42%	0.416	S	S	*	.			trans	-143	67.7	-178.5	-69.9	-168.7	178.6	162.1	1.2	112.6	L358 E364 L365 F366	L358-R362 PolarHBondContact O-N 2.93Å; R362-E364 PolarHBondContact O-N 3.23Å; R362-E364 VanDerWaalsContact O-N 3.09Å; R362-L365 HydrophobicContact CB-CD1 3.98Å; R362-L365 HydrophobicContact CB-CG 4.28Å; R362-L365 PolarHBondContact O-N 2.94Å; R362-L365 VanDerWaalsContact O-N 3.11Å; R362-F366 WeakPolarHBondContact O-CD2 3.43Å
363	P	87.9	Confident	88.9	Confident	62 Å²	62	79.9 Å²	79.9	40%	0.403	42%	0.424	S	S	.	.	G	3₁₀ helix	trans	-57.4	-28.5	-175	21.6	-33.9	0	0	0	114.4	P359 L365 F366	P359-P363 WeakPolarHBondContact O-CA 3.17Å; P359-P363 WeakPolarHBondContact O-CD 3.3Å; P363-L365 PolarHBondContact O-N 3.36Å; P363-F366 CarbonylContact O-C 3.44Å; P363-F366 PolarHBondContact O-N 3.05Å
364	E	90.3	Very high	88.8	Confident	171 Å²	171	77.4 Å²	77.4	80%	0.799	41%	0.411	S	S	*	.	G	3₁₀ helix	trans	-56.9	-31.1	177.6	-64.2	178.2	-161.1	0	0	113.7	R362 F366 T367	R362-E364 PolarHBondContact O-N 3.23Å; R362-E364 VanDerWaalsContact O-N 3.09Å; E364-F366 VanDerWaalsContact C-N 3.33Å; E364-T367 PolarHBondContact O-OG1 3.32Å
365	L	91	Very high	89	Confident	91 Å²	91	72.7 Å²	72.7	48%	0.476	39%	0.389	S	S	.	.	G	3₁₀ helix	trans	-78.5	-18.2	178.6	-59.8	178.4	0	0	0	113.2	R362 P363 R370	R362-L365 HydrophobicContact CB-CD1 3.98Å; R362-L365 HydrophobicContact CB-CG 4.28Å; R362-L365 PolarHBondContact O-N 2.94Å; R362-L365 VanDerWaalsContact O-N 3.11Å; P363-L365 PolarHBondContact O-N 3.36Å; L365-R370 VanDerWaalsContact O-CD 3.27Å; L365-R370 WeakPolarHBondContact O-CD 3.42Å
366	F	89.1	Confident	89.3	Confident	53 Å²	53	71.4 Å²	71.4	23%	0.232	38%	0.382	C	S	.	.	S	Bend	trans	-111.9	52.9	-171.8	-67.2	-86.4	0	0	0	110.8	L358 P359 R362 P363 E364 R370 A371	L358-F366 HydrophobicContact CB-CE2 3.72Å; L358-F366 HydrophobicContact CB-CZ 3.57Å; L358-F366 HydrophobicContact CD1-CZ 4.49Å; P359-F366 HydrophobicContact CB-CB 4.17Å; P359-F366 HydrophobicContact CB-CD1 4.4Å; P359-F366 HydrophobicContact CB-CD2 4.14Å; P359-F366 HydrophobicContact CB-CG 3.99Å; P359-F366 HydrophobicContact CG-CB 4.39Å; P359-F366 HydrophobicContact CG-CD1 3.72Å; P359-F366 HydrophobicContact CG-CD2 4.06Å; P359-F366 HydrophobicContact CG-CE1 3.91Å; P359-F366 HydrophobicContact CG-CE2 4.25Å; P359-F366 HydrophobicContact CG-CG 3.79Å; P359-F366 HydrophobicContact CG-CZ 4.18Å; R362-F366 WeakPolarHBondContact O-CD2 3.43Å; P363-F366 CarbonylContact O-C 3.44Å; P363-F366 PolarHBondContact O-N 3.05Å; E364-F366 VanDerWaalsContact C-N 3.33Å; F366-R370 CarbonylContact C-O 3.56Å; F366-R370 VanDerWaalsContact CA-O 3.27Å; F366-R370 WeakPolarHBondContact CA-O 3.43Å; F366-R370 VanDerWaalsContact CB-O 3.31Å; F366-R370 WeakPolarHBondContact CB-O 3.47Å; F366-R370 WeakPolarHBondContact CD1-O 3.36Å; F366-A371 WeakPolarHBondContact O-CA 3.48Å
367	T	86.1	Confident	89.6	Confident	91 Å²	91	70.8 Å²	70.8	56%	0.558	38%	0.378	S	S	*	.			trans	-110.1	156.1	-178	48.8	0	0	0	0	111.8	E364 L369 R370	E364-T367 PolarHBondContact O-OG1 3.32Å; T367-L369 PolarHBondContact O-N 2.76Å; T367-R370 PolarHBondContact O-N 2.98Å
368	G	86.9	Confident	89.9	Confident	67 Å²	67	70.2 Å²	70.2	69%	0.691	38%	0.376	S	S	*	.	G	3₁₀ helix	trans	58.3	-123.9	-179.8	0	0	0	0	0	112.5	R370 A371	G368-R370 PolarHBondContact O-N 3.12Å; G368-R370 VanDerWaalsContact O-N 3.1Å; G368-A371 VanDerWaalsContact O-CB 3.3Å; G368-A371 WeakPolarHBondContact O-CB 3.45Å; G368-A371 PolarHBondContact O-N 2.83Å
369	L	86.6	Confident	90.1	Very high	191 Å²	191	66.9 Å²	66.9	100%	1	36%	0.358	S	S	*	.	G	3₁₀ helix	trans	-63.8	-10.9	177.1	-63.3	178.2	0	0	0	114.3	T367	T367-L369 PolarHBondContact O-N 2.76Å
370	R	88.1	Confident	90.4	Very high	177 Å²	177	66.3 Å²	66.3	67%	0.668	35%	0.354	S	S	*	.	G	3₁₀ helix	trans	-99	10.3	174.4	-59.5	180	-177.6	162.5	1	113.2	L365 F366 T367 G368	L365-R370 VanDerWaalsContact O-CD 3.27Å; L365-R370 WeakPolarHBondContact O-CD 3.42Å; F366-R370 CarbonylContact C-O 3.56Å; F366-R370 VanDerWaalsContact CA-O 3.27Å; F366-R370 WeakPolarHBondContact CA-O 3.43Å; F366-R370 VanDerWaalsContact CB-O 3.31Å; F366-R370 WeakPolarHBondContact CB-O 3.47Å; F366-R370 WeakPolarHBondContact CD1-O 3.36Å; T367-R370 PolarHBondContact O-N 2.98Å; G368-R370 PolarHBondContact O-N 3.12Å; G368-R370 VanDerWaalsContact O-N 3.1Å
371	A	87.1	Confident	90.7	Very high	60 Å²	60	64.2 Å²	64.2	50%	0.496	34%	0.34	S	S	.	.	P	Polyproline II helix	trans	-56.1	138.4	176.8	0	0	0	0	0	111.5	F366 G368	F366-A371 WeakPolarHBondContact O-CA 3.48Å; G368-A371 VanDerWaalsContact O-CB 3.3Å; G368-A371 WeakPolarHBondContact O-CB 3.45Å; G368-A371 PolarHBondContact O-N 2.83Å
372	P	88.2	Confident	91	Very high	39 Å²	39	61.5 Å²	61.5	25%	0.253	33%	0.329	S	S	.	.	P	Polyproline II helix	trans	-65.8	143.1	-178.8	26.8	-34.4	0	0	0	111.7	P359 R374	P359-P372 HydrophobicContact CB-CB 3.8Å; P359-P372 HydrophobicContact CB-CG 4.03Å; P359-P372 HydrophobicContact CG-CB 3.92Å; P372-R374 PolarHBondContact O-N 2.82Å
373	A	87.8	Confident	91.2	Very high	20 Å²	20	54.4 Å²	54.4	17%	0.165	31%	0.31	C	S	.	.	P	Polyproline II helix	trans	-64	126.8	175.1	0	0	0	0	0	110.4	I355 G375 L479 I499 K500	I355-A373 HydrophobicContact CG2-CB 4.15Å; A373-G375 VanDerWaalsContact C-N 3.29Å; A373-G375 PolarHBondContact O-N 3.34Å; A373-L479 WeakPolarHBondContact O-CD1 3.42Å; A373-I499 HydrophobicContact CB-CB 4.46Å; A373-K500 HydrophobicContact CB-CB 4.41Å; A373-K500 HydrophobicContact CB-CG 3.74Å
374	R	90.1	Very high	91.5	Very high	41 Å²	41	52.2 Å²	52.2	16%	0.155	30%	0.295	C	S	.	.	S	Bend	trans	-78.8	-11.7	-178.6	-53.8	-50.1	-168	155.6	10.3	114.2	P372 V470 Q471 G474 D476 V480	P372-R374 PolarHBondContact O-N 2.82Å; R374-V470 HydrophobicContact CB-CG1 4.48Å; R374-Q471 HydrophobicContact CB-CG 4.09Å; R374-G474 PolarHBondContact NH2-O 3.41Å; R374-D476 PolarHBondContact NH1-O 2.86Å; R374-D476 PolarHBondContact NH2-O 3.45Å; R374-D476 VanDerWaalsContact NH2-O 3.09Å; R374-V480 PolarHBondContact O-N 3.13Å
375	G	93.5	Very high	91.6	Very high	0 Å²	0	45.4 Å²	45.4	0%	0	27%	0.271	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-133.9	120.5	-178.9	0	0	0	0	0	111.7	A373 V480 I499 K500	A373-G375 VanDerWaalsContact C-N 3.29Å; A373-G375 PolarHBondContact O-N 3.34Å; G375-V480 WeakPolarHBondContact CA-O 3.34Å; G375-I499 PolarHBondContact O-N 3.18Å; G375-K500 PolarHBondContact O-N 3.06Å
376	L	95	Very high	91.7	Very high	0 Å²	0	41.5 Å²	41.5	0%	0	25%	0.25	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-124.9	137.8	175.5	-169.8	145.5	0	0	0	111.6	L352 I355 V356 L378 L479 V480 M481 G482 F498 K500 V502	L352-L376 HydrophobicContact CD2-CD1 3.54Å; L352-L376 HydrophobicContact CD2-CD2 3.76Å; L352-L376 HydrophobicContact CD2-CG 4.33Å; I355-L376 HydrophobicContact CB-CD1 4.35Å; I355-L376 HydrophobicContact CD1-CD1 4.16Å; I355-L376 HydrophobicContact CG2-CD1 3.93Å; V356-L376 HydrophobicContact CG2-CD1 4.39Å; L376-L378 HydrophobicContact CD2-CD2 3.65Å; L376-L378 HydrophobicContact CD2-CG 3.94Å; L376-L479 HydrophobicContact CB-CD1 4.32Å; L376-V480 PolarHBondContact N-O 2.7Å; L376-M481 HydrophobicContact CD2-CE 4.36Å; L376-M481 HydrophobicContact CD2-CG 4Å; L376-M481 HydrophobicContact CD2-SD 4.45Å; L376-M481 CarbonylContact O-C 3.59Å; L376-M481 VanDerWaalsContact O-CA 3.26Å; L376-M481 WeakPolarHBondContact O-CA 3.43Å; L376-G482 PolarHBondContact O-N 3.09Å; L376-F498 VanDerWaalsContact C-CD1 3.47Å; L376-F498 VanDerWaalsContact O-CD1 3.27Å; L376-F498 WeakPolarHBondContact O-CD1 3.44Å; L376-F498 WeakPolarHBondContact O-CE1 3.25Å; L376-K500 CarbonylContact C-O 3.58Å; L376-K500 VanDerWaalsContact CA-O 3.26Å; L376-K500 WeakPolarHBondContact CA-O 3.46Å; L376-K500 HydrophobicContact CD1-CB 4.29Å; L376-K500 HydrophobicContact CG-CB 4.32Å; L376-V502 HydrophobicContact CD1-CG2 4.34Å
377	L	96.3	Very high	91.9	Very high	0 Å²	0	41.3 Å²	41.3	0%	0	25%	0.253	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-116.3	122.1	175.5	-176.3	68.2	0	0	0	110.6	V441 T484 L490 L495 F498 K500 R501 V502 W605	L377-V441 HydrophobicContact CD1-CG1 3.89Å; L377-T484 HydrophobicContact CD1-CG2 3.86Å; L377-T484 HydrophobicContact CD2-CG2 4.25Å; L377-T484 HydrophobicContact CG-CG2 4.2Å; L377-L490 HydrophobicContact CD1-CD1 4.3Å; L377-L490 HydrophobicContact CD2-CD1 3.79Å; L377-L495 HydrophobicContact CD2-CD2 4.29Å; L377-F498 HydrophobicContact CB-CB 3.87Å; L377-F498 HydrophobicContact CB-CD1 4.17Å; L377-F498 HydrophobicContact CB-CD2 4.42Å; L377-F498 HydrophobicContact CB-CG 3.91Å; L377-F498 HydrophobicContact CD1-CD2 4.33Å; L377-F498 HydrophobicContact CD1-CE2 4.41Å; L377-K500 PolarHBondContact N-O 2.96Å; L377-R501 HydrophobicContact CB-CG 4.19Å; L377-R501 HydrophobicContact CD2-CG 4.45Å; L377-R501 CarbonylContact O-C 3.51Å; L377-R501 WeakPolarHBondContact O-CA 3.47Å; L377-V502 PolarHBondContact O-N 2.85Å; L377-W605 HydrophobicContact CD2-CH2 4.24Å
378	L	96.8	Very high	92.2	Very high	0 Å²	0	41.4 Å²	41.4	0%	0	25%	0.248	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-91.1	118.1	166.2	-60.3	-179.1	0	0	0	108.7	L352 L376 K386 L389 A390 M481 G482 A483 T484 V502 V504	L352-L378 HydrophobicContact CD1-CD2 4.19Å; L352-L378 HydrophobicContact CD2-CD2 4.33Å; L376-L378 HydrophobicContact CD2-CD2 3.65Å; L376-L378 HydrophobicContact CD2-CG 3.94Å; L378-K386 HydrophobicContact CB-CB 4.33Å; L378-K386 HydrophobicContact CB-CD 4.15Å; L378-K386 HydrophobicContact CB-CG 4.31Å; L378-K386 HydrophobicContact CD1-CB 4.4Å; L378-K386 WeakPolarHBondContact CD1-O 3.27Å; L378-L389 HydrophobicContact CD2-CD2 4.47Å; L378-A390 HydrophobicContact CD1-CB 4.3Å; L378-M481 HydrophobicContact CD1-CG 4.45Å; L378-M481 HydrophobicContact CD1-SD 3.89Å; L378-M481 HydrophobicContact CG-CG 4.4Å; L378-M481 HydrophobicContact CG-SD 4.33Å; L378-G482 PolarHBondContact N-O 3.37Å; L378-A483 HydrophobicContact CB-CB 4.44Å; L378-A483 VanDerWaalsContact O-CA 3.32Å; L378-A483 WeakPolarHBondContact O-CA 3.43Å; L378-T484 PolarHBondContact O-N 2.85Å; L378-V502 HydrophobicContact CD2-CB 4.09Å; L378-V502 HydrophobicContact CD2-CG1 4.4Å; L378-V504 HydrophobicContact CD2-CG2 4.35Å
379	F	96.5	Very high	92.6	Very high	0 Å²	0	38.3 Å²	38.3	0%	0	22%	0.216	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-132.7	165.3	-180	75.1	-83.4	0	0	0	112	T484 P487 R501 V502 Y503 V504 W605 N606	F379-T484 HydrophobicContact CB-CG2 3.53Å; F379-P487 HydrophobicContact CB-CB 4.04Å; F379-P487 HydrophobicContact CB-CG 4.18Å; F379-P487 HydrophobicContact CD2-CB 4.33Å; F379-P487 HydrophobicContact CD2-CG 3.91Å; F379-P487 HydrophobicContact CG-CB 4.33Å; F379-P487 HydrophobicContact CG-CG 4.35Å; F379-R501 HydrophobicContact CD1-CB 4.39Å; F379-R501 HydrophobicContact CE1-CB 4.07Å; F379-V502 WeakPolarHBondContact CD1-O 3.4Å; F379-V502 PolarHBondContact N-O 3.19Å; F379-V502 VanDerWaalsContact N-O 3.14Å; F379-Y503 AromaticContact CD2-CD2 3.93Å; F379-Y503 HydrophobicContact CD2-CD2 3.93Å; F379-Y503 AromaticContact CE2-CD2 3.56Å; F379-Y503 HydrophobicContact CE2-CD2 3.56Å; F379-Y503 HydrophobicContact CE2-CE2 4.46Å; F379-Y503 HydrophobicContact CE2-CG 4.19Å; F379-Y503 HydrophobicContact CZ-CD2 4.1Å; F379-Y503 HydrophobicContact CZ-CG 4.29Å; F379-V504 PolarHBondContact O-N 3.48Å; F379-W605 HydrophobicContact CD1-CE3 4.44Å; F379-W605 AromaticContact CD1-CZ3 3.81Å; F379-W605 HydrophobicContact CD1-CZ3 3.81Å; F379-W605 AromaticContact CD2-CE3 3.78Å; F379-W605 HydrophobicContact CD2-CE3 3.78Å; F379-W605 AromaticContact CD2-CZ3 3.95Å; F379-W605 HydrophobicContact CD2-CZ3 3.95Å; F379-W605 HydrophobicContact CE1-CE3 4.15Å; F379-W605 AromaticContact CE1-CZ3 3.64Å; F379-W605 HydrophobicContact CE1-CZ3 3.64Å; F379-W605 AromaticContact CE2-CE3 3.43Å; F379-W605 HydrophobicContact CE2-CE3 3.43Å; F379-W605 VanDerWaalsContact CE2-CE3 3.43Å; F379-W605 AromaticContact CE2-CZ3 3.78Å; F379-W605 HydrophobicContact CE2-CZ3 3.78Å; F379-W605 HydrophobicContact CG-CE3 4.26Å; F379-W605 AromaticContact CG-CZ3 3.96Å; F379-W605 HydrophobicContact CG-CZ3 3.96Å; F379-W605 AromaticContact CZ-CE3 3.62Å; F379-W605 HydrophobicContact CZ-CE3 3.62Å; F379-W605 AromaticContact CZ-CZ3 3.6Å; F379-W605 HydrophobicContact CZ-CZ3 3.6Å; F379-N606 HydrophobicContact CE2-CB 3.94Å; F379-N606 HydrophobicContact CZ-CB 3.74Å; F379-N606 WeakPolarHBondContact CZ-OD1 3.46Å
380	G	95.7	Very high	92.9	Very high	0 Å²	0	29.2 Å²	29.2	0%	0	17%	0.168	C	C	.	.	S	Bend	trans	127.7	-174.1	-179.3	0	0	0	0	0	112.2	K386	G380-K386 PolarHBondContact O-NZ 3.25Å
381	P	95.6	Very high	93.1	Very high	0 Å²	0	23.5 Å²	23.5	0%	0	15%	0.148	C	C	.	.	S	Bend	trans	-58.6	152.1	-173.7	13.1	-22.9	0	0	0	114.2	N384 K386 V504 L506 V594 L599 Y602	P381-N384 WeakPolarHBondContact CB-ND2 3.45Å; P381-N384 WeakPolarHBondContact CG-ND2 3.36Å; P381-N384 PolarHBondContact O-ND2 3.37Å; P381-N384 VanDerWaalsContact O-ND2 3.08Å; P381-K386 PolarHBondContact O-NZ 2.87Å; P381-K386 VanDerWaalsContact O-NZ 3.14Å; P381-V504 WeakPolarHBondContact CD-O 3.3Å; P381-L506 HydrophobicContact CB-CD2 4.27Å; P381-L506 HydrophobicContact CG-CD2 4.04Å; P381-L506 HydrophobicContact CG-CG 3.94Å; P381-V594 HydrophobicContact CB-CG1 4.21Å; P381-V594 HydrophobicContact CB-CG2 3.82Å; P381-L599 HydrophobicContact CG-CD1 4.44Å; P381-Y602 HydrophobicContact CB-CD2 4.39Å; P381-Y602 HydrophobicContact CB-CE2 3.83Å; P381-Y602 HydrophobicContact CG-CD2 4.27Å; P381-Y602 HydrophobicContact CG-CE2 4.2Å
382	P	94.1	Very high	93.4	Very high	53 Å²	53	20.6 Å²	20.6	34%	0.344	13%	0.125	S	C	.	.	T	Hydrogen-bonded Turn	trans	-64.7	157.4	175.8	28.8	-35.8	0	0	0	111.6	N384 N485 S543 V594	P382-N384 VanDerWaalsContact C-N 3.33Å; P382-N384 PolarHBondContact O-N 2.94Å; P382-N384 PolarHBondContact O-ND2 3.27Å; P382-N485 WeakPolarHBondContact CA-OD1 3.46Å; P382-S543 WeakPolarHBondContact O-CB 3.4Å; P382-V594 HydrophobicContact CG-CG2 4.37Å
383	G	91.9	Very high	93.6	Very high	27 Å²	27	18.8 Å²	18.8	28%	0.278	11%	0.112	S	C	.	.	T	Hydrogen-bonded Turn	trans	77.2	6.1	173.3	0	0	0	0	0	116.9	G544 S545	G383-G544 CarbonylContact O-C 3.59Å; G383-G544 VanDerWaalsContact O-CA 3.29Å; G383-G544 WeakPolarHBondContact O-CA 3.33Å; G383-G544 PolarHBondContact O-N 3.21Å; G383-S545 WeakPolarHBondContact CA-OG 3.35Å; G383-S545 PolarHBondContact O-N 3.43Å
384	N	93.8	Very high	93.8	Very high	16 Å²	16	18 Å²	18	9%	0.086	11%	0.107	C	C	.	.	S	Bend	trans	-100.9	24	179.6	-54.4	-60	0	0	0	113.7	P381 P382 V504 S505 S543 G544	P381-N384 WeakPolarHBondContact CB-ND2 3.45Å; P381-N384 WeakPolarHBondContact CG-ND2 3.36Å; P381-N384 PolarHBondContact O-ND2 3.37Å; P381-N384 VanDerWaalsContact O-ND2 3.08Å; P382-N384 VanDerWaalsContact C-N 3.33Å; P382-N384 PolarHBondContact O-N 2.94Å; P382-N384 PolarHBondContact O-ND2 3.27Å; N384-V504 HydrophobicContact CB-CG1 4.01Å; N384-V504 VanDerWaalsContact O-CG1 3.29Å; N384-V504 WeakPolarHBondContact O-CG1 3.45Å; N384-S505 WeakPolarHBondContact CB-O 3.44Å; N384-S543 WeakPolarHBondContact OD1-CA 3.3Å; N384-S543 WeakPolarHBondContact OD1-CB 3.4Å; N384-G544 PolarHBondContact OD1-N 2.95Å
385	G	92.3	Very high	93.9	Very high	27 Å²	27	17.9 Å²	17.9	28%	0.278	11%	0.114	S	C	.	.			trans	82	13.5	166.6	0	0	0	0	0	117.2	T387 M388 L389	G385-T387 VanDerWaalsContact C-N 3.3Å; G385-T387 PolarHBondContact O-N 2.92Å; G385-M388 CarbonylContact O-C 3.54Å; G385-M388 WeakPolarHBondContact O-CA 3.35Å; G385-M388 WeakPolarHBondContact O-CB 3.31Å; G385-M388 PolarHBondContact O-N 3.38Å; G385-L389 WeakPolarHBondContact O-CB 3.49Å; G385-L389 PolarHBondContact O-N 3.02Å
386	K	94.8	Very high	93.7	Very high	10 Å²	10	21.3 Å²	21.3	4%	0.043	13%	0.13	C	C	.	.	H	α-helix	trans	-44.3	-51	177.7	-64.5	-168.8	-71	-95.1	0	113.3	L378 G380 P381 M388 L389 A390 A483 T484 N485 V504	L378-K386 HydrophobicContact CB-CB 4.33Å; L378-K386 HydrophobicContact CB-CD 4.15Å; L378-K386 HydrophobicContact CB-CG 4.31Å; L378-K386 HydrophobicContact CD1-CB 4.4Å; L378-K386 WeakPolarHBondContact CD1-O 3.27Å; G380-K386 PolarHBondContact O-NZ 3.25Å; P381-K386 PolarHBondContact O-NZ 2.87Å; P381-K386 VanDerWaalsContact O-NZ 3.14Å; K386-M388 PolarHBondContact O-N 2.97Å; K386-L389 PolarHBondContact O-N 3.11Å; K386-A390 PolarHBondContact O-N 2.9Å; K386-A483 HydrophobicContact CB-CB 4.26Å; K386-T484 WeakPolarHBondContact CE-O 3.34Å; K386-T484 PolarHBondContact NZ-O 3.35Å; K386-T484 VanDerWaalsContact NZ-O 3.12Å; K386-N485 PolarHBondContact NZ-OD1 2.94Å; K386-V504 HydrophobicContact CG-CB 4Å; K386-V504 HydrophobicContact CG-CG1 4.14Å; K386-V504 HydrophobicContact CG-CG2 4.04Å
387	T	92.9	Very high	93.4	Very high	48 Å²	48	21.6 Å²	21.6	29%	0.294	13%	0.132	S	C	.	.	H	α-helix	trans	-64.7	-34.8	177.6	-34.9	0	0	0	0	113.5	G385 K391 F437 D439	G385-T387 VanDerWaalsContact C-N 3.3Å; G385-T387 PolarHBondContact O-N 2.92Å; T387-K391 WeakPolarHBondContact O-CG 3.39Å; T387-K391 PolarHBondContact O-N 3.09Å; T387-F437 HydrophobicContact CG2-CE1 3.83Å; T387-F437 HydrophobicContact CG2-CZ 4.23Å; T387-D439 WeakPolarHBondContact CB-OD2 3.36Å; T387-D439 VanDerWaalsContact CG2-OD2 3.23Å; T387-D439 WeakPolarHBondContact CG2-OD2 3.25Å; T387-D439 PolarHBondContact OG1-OD2 3.06Å
388	M	92.4	Very high	93	Very high	93 Å²	93	27.2 Å²	27.2	46%	0.458	16%	0.162	S	C	.	.	H	α-helix	trans	-72.1	-39.9	175.5	-70.3	179.3	62	0	0	111.3	V337 G385 K386 K391 A392	V337-M388 HydrophobicContact CG1-CE 4.22Å; G385-M388 CarbonylContact O-C 3.54Å; G385-M388 WeakPolarHBondContact O-CA 3.35Å; G385-M388 WeakPolarHBondContact O-CB 3.31Å; G385-M388 PolarHBondContact O-N 3.38Å; K386-M388 PolarHBondContact O-N 2.97Å; M388-K391 PolarHBondContact O-N 3.16Å; M388-A392 WeakPolarHBondContact O-CB 3.44Å; M388-A392 PolarHBondContact O-N 2.92Å
389	L	94.3	Very high	92.7	Very high	3 Å²	3	28 Å²	28	2%	0.016	17%	0.168	C	C	.	.	H	α-helix	trans	-62.9	-43.2	177.5	-173.2	60.6	0	0	0	110.9	F339 I342 A348 K349 L352 L378 G385 K386 A392 V393 V504	F339-L389 HydrophobicContact CE1-CD1 4.35Å; F339-L389 HydrophobicContact CZ-CD1 4.35Å; I342-L389 HydrophobicContact CD1-CB 4.14Å; I342-L389 HydrophobicContact CD1-CD1 3.81Å; A348-L389 HydrophobicContact CB-CD2 4.3Å; K349-L389 HydrophobicContact CG-CD1 4.27Å; L352-L389 HydrophobicContact CD1-CD1 3.84Å; L352-L389 HydrophobicContact CD1-CD2 3.49Å; L352-L389 VanDerWaalsContact CD1-CD2 3.49Å; L352-L389 HydrophobicContact CD1-CG 3.43Å; L352-L389 VanDerWaalsContact CD1-CG 3.43Å; L378-L389 HydrophobicContact CD2-CD2 4.47Å; G385-L389 WeakPolarHBondContact O-CB 3.49Å; G385-L389 PolarHBondContact O-N 3.02Å; K386-L389 PolarHBondContact O-N 3.11Å; L389-A392 PolarHBondContact O-N 3.15Å; L389-V393 WeakPolarHBondContact O-CG2 3.26Å; L389-V393 PolarHBondContact O-N 2.97Å; L389-V504 HydrophobicContact CD2-CG2 4.21Å
390	A	93.6	Very high	92.5	Very high	0 Å²	0	30.1 Å²	30.1	0%	0	18%	0.182	C	C	.	.	H	α-helix	trans	-60.3	-47.1	172.8	0	0	0	0	0	113.3	L378 K386 A392 V393 A394 F401 F437 M481	L378-A390 HydrophobicContact CD1-CB 4.3Å; K386-A390 PolarHBondContact O-N 2.9Å; A390-A392 VanDerWaalsContact C-N 3.31Å; A390-A392 PolarHBondContact O-N 3.2Å; A390-V393 PolarHBondContact O-N 2.96Å; A390-A394 PolarHBondContact O-N 2.72Å; A390-A394 VanDerWaalsContact O-N 3.14Å; A390-F401 HydrophobicContact CB-CE2 4.07Å; A390-F401 HydrophobicContact CB-CZ 3.93Å; A390-F437 HydrophobicContact CB-CD2 3.27Å; A390-F437 HydrophobicContact CB-CE2 3.34Å; A390-F437 HydrophobicContact CB-CG 3.94Å; A390-F437 HydrophobicContact CB-CZ 4.06Å; A390-M481 HydrophobicContact CB-SD 3.52Å; A390-M481 VanDerWaalsContact CB-SD 3.52Å
391	K	92.7	Very high	92.4	Very high	56 Å²	56	30.7 Å²	30.7	24%	0.243	18%	0.184	C	C	.	.	H	α-helix	trans	-60.2	-40.4	175.2	-73.5	169.4	-173.7	-104.2	0	111.9	D332 T387 M388 A394 A395 F401	D332-K391 IonicContact OD2-NZ 3.52Å; D332-K391 PolarHBondContact OD2-NZ 3.1Å; T387-K391 WeakPolarHBondContact O-CG 3.39Å; T387-K391 PolarHBondContact O-N 3.09Å; M388-K391 PolarHBondContact O-N 3.16Å; K391-A394 PolarHBondContact O-N 2.9Å; K391-A395 PolarHBondContact O-N 3.31Å; K391-F401 HydrophobicContact CB-CE1 4.45Å; K391-F401 HydrophobicContact CG-CD1 4.12Å; K391-F401 HydrophobicContact CG-CE1 3.43Å; K391-F401 VanDerWaalsContact CG-CE1 3.43Å; K391-F401 HydrophobicContact CG-CZ 3.8Å
392	A	93.1	Very high	92.4	Very high	0 Å²	0	30.7 Å²	30.7	0%	0	18%	0.184	C	C	.	.	H	α-helix	trans	-68.1	-40.8	178	0	0	0	0	0	112.3	V337 F339 I342 M388 L389 A390 A394 A395 E396	V337-A392 HydrophobicContact CB-CB 4.46Å; V337-A392 HydrophobicContact CG1-CB 4.32Å; V337-A392 VanDerWaalsContact O-CA 3.3Å; V337-A392 WeakPolarHBondContact O-CA 3.3Å; F339-A392 HydrophobicContact CD1-CB 3.81Å; F339-A392 HydrophobicContact CE1-CB 4.12Å; I342-A392 HydrophobicContact CD1-CB 3.77Å; M388-A392 WeakPolarHBondContact O-CB 3.44Å; M388-A392 PolarHBondContact O-N 2.92Å; L389-A392 PolarHBondContact O-N 3.15Å; A390-A392 VanDerWaalsContact C-N 3.31Å; A390-A392 PolarHBondContact O-N 3.2Å; A392-A394 VanDerWaalsContact C-N 3.28Å; A392-A394 PolarHBondContact O-N 2.84Å; A392-A395 PolarHBondContact O-N 3.1Å; A392-E396 WeakPolarHBondContact O-CG 3.43Å; A392-E396 PolarHBondContact O-N 3.01Å
393	V	93.1	Very high	92.4	Very high	0 Å²	0	30.8 Å²	30.8	0%	0	18%	0.181	C	C	.	.	H	α-helix	trans	-57.4	-42.5	173	171.7	0	0	0	0	111.1	F339 L352 V356 I357 L389 A390 S397 I435 M481	F339-V393 HydrophobicContact CE1-CB 4.37Å; F339-V393 HydrophobicContact CE1-CG2 3.59Å; F339-V393 HydrophobicContact CZ-CG2 3.72Å; L352-V393 HydrophobicContact CB-CG2 3.84Å; L352-V393 HydrophobicContact CD1-CG2 3.9Å; L352-V393 HydrophobicContact CD2-CG2 4.18Å; L352-V393 HydrophobicContact CG-CG2 4.21Å; V356-V393 HydrophobicContact CB-CG1 3.74Å; V356-V393 HydrophobicContact CG1-CG1 3.43Å; V356-V393 VanDerWaalsContact CG1-CG1 3.43Å; V356-V393 HydrophobicContact CG2-CG1 4.22Å; I357-V393 HydrophobicContact CG1-CG1 4.38Å; L389-V393 WeakPolarHBondContact O-CG2 3.26Å; L389-V393 PolarHBondContact O-N 2.97Å; A390-V393 PolarHBondContact O-N 2.96Å; V393-S397 VanDerWaalsContact O-CB 3.25Å; V393-S397 WeakPolarHBondContact O-CB 3.33Å; V393-S397 PolarHBondContact O-N 3.24Å; V393-S397 PolarHBondContact O-OG 3.29Å; V393-I435 HydrophobicContact CG1-CD1 3.95Å; V393-M481 HydrophobicContact CB-CE 4.45Å; V393-M481 HydrophobicContact CG1-CE 4.17Å
394	A	91.9	Very high	92.4	Very high	5 Å²	5	29.5 Å²	29.5	4%	0.041	17%	0.168	C	C	.	.	H	α-helix	trans	-66.8	-37.6	178.3	0	0	0	0	0	113.2	A390 K391 A392 S397 N398 A399 F401 I435	A390-A394 PolarHBondContact O-N 2.72Å; A390-A394 VanDerWaalsContact O-N 3.14Å; K391-A394 PolarHBondContact O-N 2.9Å; A392-A394 VanDerWaalsContact C-N 3.28Å; A392-A394 PolarHBondContact O-N 2.84Å; A394-S397 PolarHBondContact O-OG 2.83Å; A394-N398 PolarHBondContact O-N 2.81Å; A394-N398 VanDerWaalsContact O-N 3.08Å; A394-A399 PolarHBondContact O-N 2.88Å; A394-F401 HydrophobicContact CB-CB 3.8Å; A394-F401 HydrophobicContact CB-CD2 3.39Å; A394-F401 HydrophobicContact CB-CE2 4.15Å; A394-F401 HydrophobicContact CB-CG 3.85Å; A394-I435 HydrophobicContact CB-CD1 4.08Å
395	A	90.5	Very high	92.1	Very high	37 Å²	37	31 Å²	31	31%	0.306	18%	0.18	S	C	.	.	H	α-helix	trans	-64.3	-52.9	174.6	0	0	0	0	0	112.2	A336 V337 K391 A392 S397 N398	A336-A395 HydrophobicContact CB-CB 3.95Å; V337-A395 WeakPolarHBondContact O-CB 3.39Å; K391-A395 PolarHBondContact O-N 3.31Å; A392-A395 PolarHBondContact O-N 3.1Å; A395-S397 VanDerWaalsContact C-N 3.31Å; A395-S397 PolarHBondContact O-N 3.08Å; A395-N398 PolarHBondContact O-N 2.97Å; A395-N398 VanDerWaalsContact O-N 3.16Å
396	E	90.1	Very high	91.6	Very high	72 Å²	72	29.8 Å²	29.8	34%	0.336	17%	0.168	S	C	.	.	H	α-helix	trans	-66.8	-30.8	-178.7	-58.1	-59.1	167.6	0	0	112.5	K338 F339 I357 A392	K338-E396 WeakPolarHBondContact CA-OE1 3.32Å; K338-E396 WeakPolarHBondContact CB-OE1 3.11Å; F339-E396 HydrophobicContact CB-CG 4.16Å; F339-E396 HydrophobicContact CD1-CG 3.7Å; F339-E396 HydrophobicContact CE1-CG 4.47Å; F339-E396 HydrophobicContact CG-CG 4.08Å; F339-E396 PolarHBondContact N-OE1 3.38Å; I357-E396 HydrophobicContact CD1-CB 3.87Å; I357-E396 HydrophobicContact CD1-CG 4.41Å; I357-E396 HydrophobicContact CG1-CB 4.48Å; I357-E396 HydrophobicContact CG2-CB 4.49Å; A392-E396 WeakPolarHBondContact O-CG 3.43Å; A392-E396 PolarHBondContact O-N 3.01Å
397	S	88.8	Confident	90.8	Very high	7 Å²	7	32.4 Å²	32.4	5%	0.049	19%	0.191	C	C	.	.	T	Hydrogen-bonded Turn	trans	-85.6	-4.3	175.8	63.6	0	0	0	0	114.3	S360 V393 A394 A395 A399	S360-S397 PolarHBondContact OG-O 3.02Å; V393-S397 VanDerWaalsContact O-CB 3.25Å; V393-S397 WeakPolarHBondContact O-CB 3.33Å; V393-S397 PolarHBondContact O-N 3.24Å; V393-S397 PolarHBondContact O-OG 3.29Å; A394-S397 PolarHBondContact O-OG 2.83Å; A395-S397 VanDerWaalsContact C-N 3.31Å; A395-S397 PolarHBondContact O-N 3.08Å; S397-A399 PolarHBondContact O-N 2.83Å
398	N	88.4	Confident	90.4	Very high	118 Å²	118	33.7 Å²	33.7	63%	0.631	20%	0.202	S	C	*	.	T	Hydrogen-bonded Turn	trans	48.1	42.1	-173.8	-179.3	76.7	0	0	0	112.8	A394 A395	A394-N398 PolarHBondContact O-N 2.81Å; A394-N398 VanDerWaalsContact O-N 3.08Å; A395-N398 PolarHBondContact O-N 2.97Å; A395-N398 VanDerWaalsContact O-N 3.16Å
399	A	90.2	Very high	90	Very high	16 Å²	16	29.3 Å²	29.3	13%	0.132	18%	0.18	C	C	.	.	P	Polyproline II helix	trans	-97.2	151.9	178.8	0	0	0	0	0	111.8	A394 S397 F401 P433 I435	A394-A399 PolarHBondContact O-N 2.88Å; S397-A399 PolarHBondContact O-N 2.83Å; A399-F401 PolarHBondContact O-N 2.96Å; A399-P433 CarbonylContact C-O 3.53Å; A399-P433 VanDerWaalsContact CA-O 3.3Å; A399-P433 WeakPolarHBondContact CA-O 3.24Å; A399-P433 HydrophobicContact CB-CB 4.42Å; A399-P433 WeakPolarHBondContact CB-O 3.47Å; A399-I435 HydrophobicContact CB-CD1 4.15Å; A399-I435 HydrophobicContact CB-CG1 3.94Å
400	T	92.4	Very high	89.5	Confident	45 Å²	45	33.8 Å²	33.8	28%	0.276	21%	0.208	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-71.2	117.7	172.4	-62.7	0	0	0	0	110	V331 F402 L431 P433 S434 I435	V331-T400 HydrophobicContact CG1-CG2 3.92Å; T400-F402 HydrophobicContact CG2-CD2 4.18Å; T400-F402 HydrophobicContact CG2-CE2 3.56Å; T400-F402 HydrophobicContact CG2-CZ 3.92Å; T400-L431 HydrophobicContact CG2-CD1 4.49Å; T400-P433 PolarHBondContact N-O 3.09Å; T400-S434 WeakPolarHBondContact O-CA 3.37Å; T400-I435 PolarHBondContact O-N 3.12Å
401	F	94.4	Very high	88.8	Confident	12 Å²	12	36 Å²	36	5%	0.053	22%	0.224	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-92	116.7	-178.7	-164.3	-115.9	0	0	0	111.1	D332 A390 K391 A394 A399 N403 I435 F437	D332-F401 HydrophobicContact CB-CB 4.49Å; D332-F401 HydrophobicContact CB-CD1 3.81Å; D332-F401 PolarHBondContact N-O 3.21Å; A390-F401 HydrophobicContact CB-CE2 4.07Å; A390-F401 HydrophobicContact CB-CZ 3.93Å; K391-F401 HydrophobicContact CB-CE1 4.45Å; K391-F401 HydrophobicContact CG-CD1 4.12Å; K391-F401 HydrophobicContact CG-CE1 3.43Å; K391-F401 VanDerWaalsContact CG-CE1 3.43Å; K391-F401 HydrophobicContact CG-CZ 3.8Å; A394-F401 HydrophobicContact CB-CB 3.8Å; A394-F401 HydrophobicContact CB-CD2 3.39Å; A394-F401 HydrophobicContact CB-CE2 4.15Å; A394-F401 HydrophobicContact CB-CG 3.85Å; A399-F401 PolarHBondContact O-N 2.96Å; F401-N403 HydrophobicContact CD1-CB 3.93Å; F401-N403 HydrophobicContact CE1-CB 3.73Å; F401-I435 HydrophobicContact CD2-CB 4.19Å; F401-I435 HydrophobicContact CD2-CG2 4.16Å; F401-I435 HydrophobicContact CE2-CG2 4.2Å; F401-F437 HydrophobicContact CD2-CB 4.32Å; F401-F437 HydrophobicContact CE1-CB 4.19Å; F401-F437 HydrophobicContact CE1-CD1 4.47Å; F401-F437 HydrophobicContact CE2-CB 3.42Å; F401-F437 VanDerWaalsContact CE2-CB 3.42Å; F401-F437 HydrophobicContact CE2-CG 4.04Å; F401-F437 HydrophobicContact CZ-CB 3.34Å; F401-F437 AromaticContact CZ-CD1 3.89Å; F401-F437 HydrophobicContact CZ-CD1 3.89Å; F401-F437 HydrophobicContact CZ-CD2 4.35Å; F401-F437 AromaticContact CZ-CG 3.59Å; F401-F437 HydrophobicContact CZ-CG 3.59Å
402	F	94.6	Very high	88.3	Confident	0 Å²	0	43 Å²	43	0%	0	25%	0.254	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-98.7	110	170.3	-63.5	-99.5	0	0	0	107.4	I326 I330 V331 T400 L424 V427 A428 L431 I435 I436 F437	I326-F402 HydrophobicContact CG2-CD1 3.98Å; I326-F402 HydrophobicContact CG2-CE1 3.85Å; I330-F402 HydrophobicContact CG2-CB 3.79Å; I330-F402 HydrophobicContact CG2-CD1 4.02Å; I330-F402 HydrophobicContact CG2-CG 4.42Å; I330-F402 CarbonylContact O-C 3.58Å; I330-F402 WeakPolarHBondContact O-CA 2.94Å; V331-F402 HydrophobicContact CG2-CD1 3.74Å; V331-F402 HydrophobicContact CG2-CE1 3.51Å; V331-F402 HydrophobicContact CG2-CZ 4.14Å; T400-F402 HydrophobicContact CG2-CD2 4.18Å; T400-F402 HydrophobicContact CG2-CE2 3.56Å; T400-F402 HydrophobicContact CG2-CZ 3.92Å; F402-L424 HydrophobicContact CB-CD1 4.13Å; F402-L424 HydrophobicContact CD1-CD1 3.68Å; F402-L424 HydrophobicContact CE1-CD1 4.4Å; F402-L424 HydrophobicContact CG-CD1 4.11Å; F402-V427 HydrophobicContact CE1-CG1 3.88Å; F402-V427 HydrophobicContact CZ-CG1 4.08Å; F402-A428 HydrophobicContact CD2-CB 4.23Å; F402-A428 HydrophobicContact CE2-CB 3.79Å; F402-A428 HydrophobicContact CZ-CB 3.98Å; F402-L431 HydrophobicContact CZ-CB 4.43Å; F402-L431 HydrophobicContact CZ-CD1 4.15Å; F402-I435 PolarHBondContact N-O 3.04Å; F402-I436 HydrophobicContact CB-CG1 4.45Å; F402-I436 HydrophobicContact CD2-CG1 4.45Å; F402-F437 PolarHBondContact O-N 3.32Å
403	N	93.4	Very high	87.8	Confident	54 Å²	54	50.5 Å²	50.5	29%	0.289	28%	0.283	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-102.1	111.9	-175.5	-179.3	42.1	0	0	0	110.3	I330 D332 F401 F437	I330-N403 PolarHBondContact O-N 2.72Å; D332-N403 HydrophobicContact CB-CB 4.24Å; F401-N403 HydrophobicContact CD1-CB 3.93Å; F401-N403 HydrophobicContact CE1-CB 3.73Å; N403-F437 WeakPolarHBondContact OD1-CD1 3.4Å
404	I	92.2	Very high	87.3	Confident	1 Å²	1	55.6 Å²	55.6	1%	0.005	31%	0.314	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-124.9	129.4	-171.9	-60.5	176.9	0	0	0	110.3	I330 L409 L424 I436 F437 I438 D439	I330-I404 HydrophobicContact CD1-CD1 4.42Å; I330-I404 HydrophobicContact CD1-CG1 4.34Å; I330-I404 HydrophobicContact CG1-CG1 4.45Å; I330-I404 HydrophobicContact CG2-CD1 3.88Å; I330-I404 HydrophobicContact CG2-CG1 3.44Å; I330-I404 VanDerWaalsContact CG2-CG1 3.44Å; I404-L409 HydrophobicContact CG2-CD1 3.93Å; I404-L409 HydrophobicContact CG2-CD2 4.13Å; I404-L409 HydrophobicContact CG2-CG 3.75Å; I404-L424 HydrophobicContact CD1-CD1 3.7Å; I404-L424 HydrophobicContact CD1-CD2 3.23Å; I404-L424 HydrophobicContact CD1-CG 4.06Å; I404-I436 HydrophobicContact CD1-CG2 4.23Å; I404-F437 PolarHBondContact N-O 2.89Å; I404-I438 CarbonylContact O-C 3.6Å; I404-I438 WeakPolarHBondContact O-CA 3.47Å; I404-D439 PolarHBondContact O-N 3.4Å
405	S	88.3	Confident	86.9	Confident	46 Å²	46	56.2 Å²	56.2	32%	0.322	32%	0.321	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-86.8	141	156.7	174.8	0	0	0	0	108.7	A407 S408	S405-A407 PolarHBondContact O-N 2.91Å; S405-A407 VanDerWaalsContact O-N 3.08Å; S405-A407 PolarHBondContact OG-N 3.41Å; S405-S408 VanDerWaalsContact O-CB 3.31Å; S405-S408 WeakPolarHBondContact O-CB 3.42Å; S405-S408 PolarHBondContact O-N 2.87Å
406	A	80.5	Confident	86.8	Confident	3 Å²	3	59.1 Å²	59.1	3%	0.025	33%	0.328	C	S	.	.	G	3₁₀ helix	trans	-46.8	-36.9	171.6	0	0	0	0	0	113.7	S408 L409 S443 L444	A406-S408 VanDerWaalsContact C-N 3.29Å; A406-S408 PolarHBondContact O-N 2.86Å; A406-L409 PolarHBondContact O-N 3.21Å; A406-L409 VanDerWaalsContact O-N 3.16Å; A406-S443 WeakPolarHBondContact CB-OG 2.96Å; A406-L444 HydrophobicContact CB-CB 3.78Å
407	A	79.8	Confident	86.8	Confident	64 Å²	64	55.9 Å²	55.9	53%	0.529	31%	0.314	S	S	.	.	G	3₁₀ helix	trans	-59.4	-37.6	177.5	0	0	0	0	0	112.9	S405 L409 T410	S405-A407 PolarHBondContact O-N 2.91Å; S405-A407 VanDerWaalsContact O-N 3.08Å; S405-A407 PolarHBondContact OG-N 3.41Å; A407-L409 PolarHBondContact O-N 3.36Å; A407-T410 PolarHBondContact O-N 3.32Å; A407-T410 PolarHBondContact O-OG1 2.77Å
408	S	84.8	Confident	86.9	Confident	75 Å²	75	57.1 Å²	57.1	52%	0.524	32%	0.319	S	S	.	.	G	3₁₀ helix	trans	-65.6	-18.5	179.3	-54.4	0	0	0	0	113.7	S405 A406 L420	S405-S408 VanDerWaalsContact O-CB 3.31Å; S405-S408 WeakPolarHBondContact O-CB 3.42Å; S405-S408 PolarHBondContact O-N 2.87Å; A406-S408 VanDerWaalsContact C-N 3.29Å; A406-S408 PolarHBondContact O-N 2.86Å; S408-L420 WeakPolarHBondContact O-CD2 3.36Å
409	L	83.3	Confident	87	Confident	2 Å²	2	56.6 Å²	56.6	1%	0.01	31%	0.311	C	S	.	.	G	3₁₀ helix	trans	-88.5	-8.6	175.2	-62.3	176.4	0	0	0	113.1	I404 A406 A407 G417 L420 V421 L444 L459	I404-L409 HydrophobicContact CG2-CD1 3.93Å; I404-L409 HydrophobicContact CG2-CD2 4.13Å; I404-L409 HydrophobicContact CG2-CG 3.75Å; A406-L409 PolarHBondContact O-N 3.21Å; A406-L409 VanDerWaalsContact O-N 3.16Å; A407-L409 PolarHBondContact O-N 3.36Å; L409-G417 WeakPolarHBondContact O-CA 3.3Å; L409-L420 HydrophobicContact CD2-CD2 3.94Å; L409-L420 HydrophobicContact CD2-CG 4.04Å; L409-V421 HydrophobicContact CD1-CG2 4.37Å; L409-V421 HydrophobicContact CD2-CG2 4.18Å; L409-L444 HydrophobicContact CB-CD1 4.45Å; L409-L444 HydrophobicContact CD1-CD1 4.24Å; L409-L444 HydrophobicContact CD1-CD2 3.71Å; L409-L459 HydrophobicContact CB-CD2 4.14Å; L409-L459 WeakPolarHBondContact O-CD2 3.48Å
410	T	83.1	Confident	87	Confident	97 Å²	97	56.7 Å²	56.7	60%	0.595	31%	0.309	S	S	*	.			trans	-96.7	119.3	-177.2	64.3	0	0	0	0	112	A407 L459	A407-T410 PolarHBondContact O-N 3.32Å; A407-T410 PolarHBondContact O-OG1 2.77Å; T410-L459 HydrophobicContact CG2-CD2 4.16Å
411	S	79.8	Confident	87.1	Confident	47 Å²	47	54.5 Å²	54.5	33%	0.329	30%	0.296	S	S	.	.			trans	-111.8	145.4	-177.3	56.7	0	0	0	0	111.8	Y413 E416 G417	S411-Y413 PolarHBondContact O-N 3.03Å; S411-Y413 PolarHBondContact OG-O 2.78Å; S411-E416 WeakPolarHBondContact OG-CB 3.36Å; S411-G417 PolarHBondContact OG-N 3.2Å
412	K	81.7	Confident	87	Confident	202 Å²	202	58.7 Å²	58.7	88%	0.878	31%	0.312	S	S	*	.	S	Bend	trans	-67	-27.8	170.7	-177.8	173.7	177.5	178	0	112.2
413	Y	81.9	Confident	86.8	Confident	158 Å²	158	59 Å²	59	62%	0.62	31%	0.314	S	S	*	.	S	Bend	trans	-88.6	135.1	177.8	-56.1	-81.6	0	0	0	110.6	S411 E416	S411-Y413 PolarHBondContact O-N 3.03Å; S411-Y413 PolarHBondContact OG-O 2.78Å; Y413-E416 WeakPolarHBondContact CB-OE2 3.38Å; Y413-E416 VanDerWaalsContact CD2-OE2 3.28Å; Y413-E416 WeakPolarHBondContact CD2-OE2 3.47Å
414	V	82.3	Confident	86.8	Confident	107 Å²	107	56.4 Å²	56.4	65%	0.648	30%	0.3	S	S	*	.	T	Hydrogen-bonded Turn	trans	-69	130.3	-178.2	-178	0	0	0	0	109.9
415	G	84.7	Confident	86.8	Confident	17 Å²	17	56.3 Å²	56.3	18%	0.175	30%	0.3	C	S	.	.	T	Hydrogen-bonded Turn	trans	84.2	-5.4	178.2	0	0	0	0	0	115.9	K419	G415-K419 WeakPolarHBondContact O-CG 3.42Å; G415-K419 PolarHBondContact O-N 2.93Å
416	E	87.6	Confident	86.9	Confident	98 Å²	98	55 Å²	55	46%	0.458	29%	0.291	S	S	.	.	H	α-helix	trans	-72	-47.7	175.3	-80.8	-176.5	176.4	0	0	112.3	S411 Y413 E418 K419 L420	S411-E416 WeakPolarHBondContact OG-CB 3.36Å; Y413-E416 WeakPolarHBondContact CB-OE2 3.38Å; Y413-E416 VanDerWaalsContact CD2-OE2 3.28Å; Y413-E416 WeakPolarHBondContact CD2-OE2 3.47Å; E416-E418 VanDerWaalsContact C-N 3.28Å; E416-E418 PolarHBondContact O-N 3.33Å; E416-K419 WeakPolarHBondContact O-CB 3.4Å; E416-K419 PolarHBondContact O-N 3.38Å; E416-K419 VanDerWaalsContact O-N 3.13Å; E416-L420 WeakPolarHBondContact O-CB 3.41Å; E416-L420 PolarHBondContact O-N 3.15Å
417	G	89.9	Confident	87.5	Confident	5 Å²	5	54.9 Å²	54.9	5%	0.052	29%	0.29	C	S	.	.	H	α-helix	trans	-57.6	-39.1	173.7	0	0	0	0	0	113.3	L409 S411 K419 L420 V421 L459	L409-G417 WeakPolarHBondContact O-CA 3.3Å; S411-G417 PolarHBondContact OG-N 3.2Å; G417-K419 PolarHBondContact O-N 2.98Å; G417-L420 PolarHBondContact O-N 3.4Å; G417-V421 WeakPolarHBondContact O-CG2 3.37Å; G417-V421 PolarHBondContact O-N 3.36Å; G417-L459 VanDerWaalsContact C-CD1 3.43Å; G417-L459 WeakPolarHBondContact O-CD1 3.48Å
418	E	91.1	Very high	88.1	Confident	33 Å²	33	51.8 Å²	51.8	15%	0.154	27%	0.265	C	S	.	.	H	α-helix	trans	-60.4	-44.4	175.1	-61.2	162.9	-157.2	0	0	111.2	E416 R422 R458 E462	E416-E418 VanDerWaalsContact C-N 3.28Å; E416-E418 PolarHBondContact O-N 3.33Å; E418-R422 PolarHBondContact O-N 3.39Å; E418-R458 HydrophobicContact CG-CB 4.26Å; E418-R458 VanDerWaalsContact OE1-CB 3.27Å; E418-R458 WeakPolarHBondContact OE1-CB 3Å; E418-R458 WeakPolarHBondContact OE1-CD 3.04Å; E418-E462 HydrophobicContact CB-CG 4.45Å
419	K	90.9	Very high	88.3	Confident	106 Å²	106	51.3 Å²	51.3	46%	0.461	25%	0.252	S	S	.	.	H	α-helix	trans	-65.7	-42	173.3	-72.2	176.8	174.1	-163.1	0	112.5	D319 L322 G415 E416 G417 V421 R422 A423	D319-K419 IonicContact OD2-NZ 3.58Å; L322-K419 HydrophobicContact CD2-CB 3.97Å; G415-K419 WeakPolarHBondContact O-CG 3.42Å; G415-K419 PolarHBondContact O-N 2.93Å; E416-K419 WeakPolarHBondContact O-CB 3.4Å; E416-K419 PolarHBondContact O-N 3.38Å; E416-K419 VanDerWaalsContact O-N 3.13Å; G417-K419 PolarHBondContact O-N 2.98Å; K419-V421 VanDerWaalsContact C-N 3.3Å; K419-V421 PolarHBondContact O-N 2.87Å; K419-R422 PolarHBondContact O-N 2.88Å; K419-A423 VanDerWaalsContact O-CB 3.24Å; K419-A423 WeakPolarHBondContact O-CB 3.27Å; K419-A423 PolarHBondContact O-N 3.4Å
420	L	91.3	Very high	88.6	Confident	18 Å²	18	55.6 Å²	55.6	9%	0.094	27%	0.272	C	S	.	.	H	α-helix	trans	-60.8	-39.4	180	176.8	59.6	0	0	0	111.3	L322 L325 I326 I330 S408 L409 E416 G417 L424	L322-L420 HydrophobicContact CD1-CB 4.24Å; L322-L420 HydrophobicContact CD1-CD1 3.72Å; L322-L420 HydrophobicContact CG-CD1 4.47Å; L325-L420 HydrophobicContact CD2-CD1 4.32Å; I326-L420 HydrophobicContact CD1-CD1 4.12Å; I326-L420 HydrophobicContact CG1-CD1 3.77Å; I330-L420 HydrophobicContact CD1-CD1 4.34Å; S408-L420 WeakPolarHBondContact O-CD2 3.36Å; L409-L420 HydrophobicContact CD2-CD2 3.94Å; L409-L420 HydrophobicContact CD2-CG 4.04Å; E416-L420 WeakPolarHBondContact O-CB 3.41Å; E416-L420 PolarHBondContact O-N 3.15Å; G417-L420 PolarHBondContact O-N 3.4Å; L420-L424 VanDerWaalsContact O-CB 3.23Å; L420-L424 WeakPolarHBondContact O-CB 3.35Å; L420-L424 PolarHBondContact O-N 3.29Å
421	V	93.1	Very high	88.9	Confident	0 Å²	0	53.1 Å²	53.1	0%	0	26%	0.255	C	S	.	.	H	α-helix	trans	-63	-51.4	173.5	168	0	0	0	0	111.7	L409 G417 K419 A423 L424 F425 L459 E462 F463 E466	L409-V421 HydrophobicContact CD1-CG2 4.37Å; L409-V421 HydrophobicContact CD2-CG2 4.18Å; G417-V421 WeakPolarHBondContact O-CG2 3.37Å; G417-V421 PolarHBondContact O-N 3.36Å; K419-V421 VanDerWaalsContact C-N 3.3Å; K419-V421 PolarHBondContact O-N 2.87Å; V421-A423 VanDerWaalsContact C-N 3.32Å; V421-A423 PolarHBondContact O-N 3.16Å; V421-L424 WeakPolarHBondContact O-CB 3.27Å; V421-L424 PolarHBondContact O-N 2.74Å; V421-F425 HydrophobicContact CG1-CD2 4.06Å; V421-F425 HydrophobicContact CG1-CE2 4.15Å; V421-F425 WeakPolarHBondContact O-CD2 3.26Å; V421-F425 PolarHBondContact O-N 3.46Å; V421-F425 VanDerWaalsContact O-N 3.09Å; V421-L459 HydrophobicContact CG2-CD1 3.64Å; V421-E462 HydrophobicContact CG1-CG 4.24Å; V421-F463 HydrophobicContact CG1-CB 4.26Å; V421-F463 HydrophobicContact CG1-CD2 4.2Å; V421-E466 HydrophobicContact CG1-CB 4.49Å; V421-E466 HydrophobicContact CG1-CG 4.43Å
422	R	92	Very high	89.3	Confident	100 Å²	100	53.2 Å²	53.2	38%	0.377	25%	0.25	S	C	.	.	H	α-helix	trans	-58	-44.7	176.4	-64.2	179.2	-164.8	122.5	10.8	112.1	E418 K419 F425 A426 E462 E466	E418-R422 PolarHBondContact O-N 3.39Å; K419-R422 PolarHBondContact O-N 2.88Å; R422-F425 PolarHBondContact O-N 3.5Å; R422-A426 WeakPolarHBondContact O-CB 3.45Å; R422-A426 PolarHBondContact O-N 3.09Å; R422-E462 HydrophobicContact CG-CG 4.17Å; R422-E462 VanDerWaalsContact CG-OE1 3.3Å; R422-E462 WeakPolarHBondContact CG-OE1 3.28Å; R422-E462 IonicContact CZ-OE1 3.14Å; R422-E462 IonicContact CZ-OE2 2.62Å; R422-E462 IonicContact NE-OE1 2.69Å; R422-E462 PolarHBondContact NE-OE1 2.89Å; R422-E462 IonicContact NE-OE2 3.65Å; R422-E462 IonicContact NH2-OE1 2.81Å; R422-E462 PolarHBondContact NH2-OE1 3.12Å; R422-E462 IonicContact NH2-OE2 3.03Å; R422-E462 PolarHBondContact NH2-OE2 3.28Å; R422-E466 WeakPolarHBondContact CA-OE1 3.43Å; R422-E466 HydrophobicContact CG-CG 4.38Å
423	A	91.6	Very high	89.8	Confident	5 Å²	5	45.4 Å²	45.4	4%	0.041	22%	0.22	C	C	.	.	H	α-helix	trans	-63.6	-42.1	179.1	0	0	0	0	0	112.3	V318 L322 I326 K419 V421 A426 V427	V318-A423 HydrophobicContact CG1-CB 3.59Å; L322-A423 HydrophobicContact CD2-CB 3.52Å; L322-A423 HydrophobicContact CG-CB 3.75Å; I326-A423 HydrophobicContact CD1-CB 3.61Å; K419-A423 VanDerWaalsContact O-CB 3.24Å; K419-A423 WeakPolarHBondContact O-CB 3.27Å; K419-A423 PolarHBondContact O-N 3.4Å; V421-A423 VanDerWaalsContact C-N 3.32Å; V421-A423 PolarHBondContact O-N 3.16Å; A423-A426 PolarHBondContact O-N 3.09Å; A423-V427 WeakPolarHBondContact O-CB 3.23Å; A423-V427 VanDerWaalsContact O-CG2 3.27Å; A423-V427 WeakPolarHBondContact O-CG2 3.47Å; A423-V427 PolarHBondContact O-N 3.28Å
424	L	92.9	Very high	90.3	Very high	0 Å²	0	38 Å²	38	0%	0	19%	0.191	C	C	.	.	H	α-helix	trans	-57	-54.8	174.3	167.5	70.9	0	0	0	111.2	I326 I330 F402 I404 L420 V421 A426 V427 A428 I436	I326-L424 HydrophobicContact CD1-CB 4.49Å; I326-L424 HydrophobicContact CG2-CD1 4.29Å; I330-L424 HydrophobicContact CG2-CD1 4.26Å; F402-L424 HydrophobicContact CB-CD1 4.13Å; F402-L424 HydrophobicContact CD1-CD1 3.68Å; F402-L424 HydrophobicContact CE1-CD1 4.4Å; F402-L424 HydrophobicContact CG-CD1 4.11Å; I404-L424 HydrophobicContact CD1-CD1 3.7Å; I404-L424 HydrophobicContact CD1-CD2 3.23Å; I404-L424 HydrophobicContact CD1-CG 4.06Å; L420-L424 VanDerWaalsContact O-CB 3.23Å; L420-L424 WeakPolarHBondContact O-CB 3.35Å; L420-L424 PolarHBondContact O-N 3.29Å; V421-L424 WeakPolarHBondContact O-CB 3.27Å; V421-L424 PolarHBondContact O-N 2.74Å; L424-A426 VanDerWaalsContact C-N 3.31Å; L424-A426 PolarHBondContact O-N 3.17Å; L424-V427 PolarHBondContact O-N 3.03Å; L424-A428 VanDerWaalsContact O-CB 3.32Å; L424-A428 WeakPolarHBondContact O-CB 3.43Å; L424-A428 PolarHBondContact O-N 2.95Å; L424-I436 HydrophobicContact CD2-CG2 4.02Å; L424-I436 HydrophobicContact CG-CD1 4.37Å
425	F	92.8	Very high	90.9	Very high	0 Å²	0	33.1 Å²	33.1	0%	0	16%	0.161	C	C	.	.	H	α-helix	trans	-65	-36	-177.9	-83.2	-82.6	0	0	0	111.7	V421 R422 R429 I436 F463 E466 F467 V470 V480	V421-F425 HydrophobicContact CG1-CD2 4.06Å; V421-F425 HydrophobicContact CG1-CE2 4.15Å; V421-F425 WeakPolarHBondContact O-CD2 3.26Å; V421-F425 PolarHBondContact O-N 3.46Å; V421-F425 VanDerWaalsContact O-N 3.09Å; R422-F425 PolarHBondContact O-N 3.5Å; F425-R429 WeakPolarHBondContact O-CB 3.32Å; F425-R429 VanDerWaalsContact O-CG 3.28Å; F425-R429 WeakPolarHBondContact O-CG 3.46Å; F425-R429 PolarHBondContact O-N 3.3Å; F425-R429 PolarHBondContact O-NE 3.42Å; F425-I436 HydrophobicContact CD1-CD1 3.54Å; F425-I436 HydrophobicContact CE1-CD1 3.53Å; F425-I436 HydrophobicContact CG-CD1 4.13Å; F425-I436 HydrophobicContact CZ-CD1 4.09Å; F425-F463 AromaticContact CE2-CD2 3.83Å; F425-F463 HydrophobicContact CE2-CD2 3.83Å; F425-F463 AromaticContact CE2-CE2 3.58Å; F425-F463 HydrophobicContact CE2-CE2 3.58Å; F425-F463 HydrophobicContact CE2-CZ 4.34Å; F425-F463 HydrophobicContact CZ-CD2 4.33Å; F425-F463 AromaticContact CZ-CE2 3.71Å; F425-F463 HydrophobicContact CZ-CE2 3.71Å; F425-F463 HydrophobicContact CZ-CZ 4.03Å; F425-E466 HydrophobicContact CB-CB 4.09Å; F425-E466 HydrophobicContact CB-CG 4.25Å; F425-E466 HydrophobicContact CD1-CB 4.31Å; F425-E466 HydrophobicContact CD2-CB 3.42Å; F425-E466 VanDerWaalsContact CD2-CB 3.42Å; F425-E466 HydrophobicContact CD2-CG 4.1Å; F425-E466 HydrophobicContact CE2-CB 3.8Å; F425-E466 HydrophobicContact CG-CB 3.7Å; F425-E466 HydrophobicContact CG-CG 4.35Å; F425-E466 HydrophobicContact CZ-CB 4.39Å; F425-F467 HydrophobicContact CZ-CB 4.4Å; F425-V470 HydrophobicContact CD1-CG2 3.66Å; F425-V470 HydrophobicContact CE1-CG2 3.96Å; F425-V480 HydrophobicContact CE1-CG2 3.76Å; F425-V480 HydrophobicContact CZ-CG2 4.05Å
426	A	90.8	Very high	91.4	Very high	18 Å²	18	32.3 Å²	32.3	15%	0.149	15%	0.153	C	C	.	.	H	α-helix	trans	-63.7	-46.4	172	0	0	0	0	0	113.2	V318 R422 A423 L424 R429 E430	V318-A426 HydrophobicContact CG2-CB 3.48Å; V318-A426 VanDerWaalsContact CG2-CB 3.48Å; R422-A426 WeakPolarHBondContact O-CB 3.45Å; R422-A426 PolarHBondContact O-N 3.09Å; A423-A426 PolarHBondContact O-N 3.09Å; L424-A426 VanDerWaalsContact C-N 3.31Å; L424-A426 PolarHBondContact O-N 3.17Å; A426-R429 PolarHBondContact O-N 2.83Å; A426-E430 WeakPolarHBondContact O-CG 3.18Å; A426-E430 PolarHBondContact O-N 2.93Å; A426-E430 VanDerWaalsContact O-N 3.09Å
427	V	91.6	Very high	91.8	Very high	0 Å²	0	27.6 Å²	27.6	0%	0	13%	0.131	C	C	.	.	H	α-helix	trans	-65.8	-38.6	176.8	172.6	0	0	0	0	111.2	F315 A323 I326 M327 F402 A423 L424 E430 L431	F315-V427 HydrophobicContact CD1-CG2 3.98Å; F315-V427 HydrophobicContact CD2-CG2 4.49Å; F315-V427 HydrophobicContact CE1-CB 4.28Å; F315-V427 HydrophobicContact CE1-CG1 3.98Å; F315-V427 HydrophobicContact CE1-CG2 3.97Å; F315-V427 HydrophobicContact CE2-CG2 4.48Å; F315-V427 HydrophobicContact CG-CG2 4.25Å; F315-V427 HydrophobicContact CZ-CG1 4.13Å; F315-V427 HydrophobicContact CZ-CG2 4.23Å; A323-V427 HydrophobicContact CB-CG2 4.11Å; I326-V427 HydrophobicContact CD1-CG2 4.36Å; I326-V427 HydrophobicContact CG2-CB 4.46Å; I326-V427 HydrophobicContact CG2-CG1 4.21Å; M327-V427 HydrophobicContact SD-CG1 3.79Å; F402-V427 HydrophobicContact CE1-CG1 3.88Å; F402-V427 HydrophobicContact CZ-CG1 4.08Å; A423-V427 WeakPolarHBondContact O-CB 3.23Å; A423-V427 VanDerWaalsContact O-CG2 3.27Å; A423-V427 WeakPolarHBondContact O-CG2 3.47Å; A423-V427 PolarHBondContact O-N 3.28Å; L424-V427 PolarHBondContact O-N 3.03Å; V427-E430 PolarHBondContact O-N 2.75Å; V427-L431 HydrophobicContact CG1-CD1 3.96Å; V427-L431 WeakPolarHBondContact O-CB 3.48Å; V427-L431 WeakPolarHBondContact O-CG 3.47Å; V427-L431 PolarHBondContact O-N 3.01Å; V427-L431 VanDerWaalsContact O-N 3.09Å
428	A	92.5	Very high	92.1	Very high	0 Å²	0	27.4 Å²	27.4	0%	0	13%	0.129	C	C	.	.	H	α-helix	trans	-65.4	-35.8	175	0	0	0	0	0	112.8	F402 L424 L431 Q432 S434 I436 V478	F402-A428 HydrophobicContact CD2-CB 4.23Å; F402-A428 HydrophobicContact CE2-CB 3.79Å; F402-A428 HydrophobicContact CZ-CB 3.98Å; L424-A428 VanDerWaalsContact O-CB 3.32Å; L424-A428 WeakPolarHBondContact O-CB 3.43Å; L424-A428 PolarHBondContact O-N 2.95Å; A428-L431 CarbonylContact O-C 3.59Å; A428-L431 PolarHBondContact O-N 2.91Å; A428-Q432 PolarHBondContact O-N 2.73Å; A428-S434 PolarHBondContact O-OG 3.41Å; A428-I436 HydrophobicContact CB-CD1 3.76Å; A428-I436 HydrophobicContact CB-CG1 3.97Å; A428-V478 HydrophobicContact CB-CG1 4.41Å
429	R	90.1	Very high	92.2	Very high	64 Å²	64	27.3 Å²	27.3	24%	0.242	13%	0.129	C	C	.	.	H	α-helix	trans	-67.2	-36.1	172.9	-76.2	178.9	-71.1	-118.9	0.3	112.5	F425 A426 L431 Q432 E466 D476 V478	F425-R429 WeakPolarHBondContact O-CB 3.32Å; F425-R429 VanDerWaalsContact O-CG 3.28Å; F425-R429 WeakPolarHBondContact O-CG 3.46Å; F425-R429 PolarHBondContact O-N 3.3Å; F425-R429 PolarHBondContact O-NE 3.42Å; A426-R429 PolarHBondContact O-N 2.83Å; R429-L431 VanDerWaalsContact C-N 3.32Å; R429-L431 PolarHBondContact O-N 3.3Å; R429-Q432 VanDerWaalsContact O-CG 3.28Å; R429-Q432 WeakPolarHBondContact O-CG 3.19Å; R429-Q432 PolarHBondContact O-NE2 3.44Å; R429-E466 IonicContact CZ-OE2 3.29Å; R429-E466 IonicContact NH1-OE2 2.69Å; R429-E466 PolarHBondContact NH1-OE2 3.27Å; R429-E466 IonicContact NH2-OE1 3.51Å; R429-E466 PolarHBondContact NH2-OE1 3.27Å; R429-E466 IonicContact NH2-OE2 2.96Å; R429-E466 PolarHBondContact NH2-OE2 2.85Å; R429-D476 WeakPolarHBondContact CD-OD2 3.33Å; R429-D476 WeakPolarHBondContact CG-OD2 3.48Å; R429-V478 HydrophobicContact CG-CG2 3.9Å
430	E	89	Confident	92.2	Very high	92 Å²	92	26.8 Å²	26.8	43%	0.43	13%	0.129	S	C	.	.	H	α-helix	trans	-77.9	-13.9	177.2	-69.9	-87.5	-163	0	0	113.7	F315 A426 V427	F315-E430 HydrophobicContact CD1-CB 3.91Å; F315-E430 HydrophobicContact CD1-CG 4.05Å; F315-E430 HydrophobicContact CE1-CB 3.99Å; A426-E430 WeakPolarHBondContact O-CG 3.18Å; A426-E430 PolarHBondContact O-N 2.93Å; A426-E430 VanDerWaalsContact O-N 3.09Å; V427-E430 PolarHBondContact O-N 2.75Å
431	L	89.8	Confident	92.3	Very high	46 Å²	46	26 Å²	26	24%	0.241	12%	0.124	C	C	.	.	T	Hydrogen-bonded Turn	trans	-115.9	30.3	179.6	-63.3	-178.6	0	0	0	113.7	M327 T400 F402 V427 A428 R429	M327-L431 HydrophobicContact CE-CD1 3.84Å; M327-L431 HydrophobicContact SD-CD1 3.48Å; M327-L431 WeakPolarHBondContact SD-CD1 3.47Å; T400-L431 HydrophobicContact CG2-CD1 4.49Å; F402-L431 HydrophobicContact CZ-CB 4.43Å; F402-L431 HydrophobicContact CZ-CD1 4.15Å; V427-L431 HydrophobicContact CG1-CD1 3.96Å; V427-L431 WeakPolarHBondContact O-CB 3.48Å; V427-L431 WeakPolarHBondContact O-CG 3.47Å; V427-L431 PolarHBondContact O-N 3.01Å; V427-L431 VanDerWaalsContact O-N 3.09Å; A428-L431 CarbonylContact O-C 3.59Å; A428-L431 PolarHBondContact O-N 2.91Å; R429-L431 VanDerWaalsContact C-N 3.32Å; R429-L431 PolarHBondContact O-N 3.3Å
432	Q	88.9	Confident	92.3	Very high	48 Å²	48	26.7 Å²	26.7	22%	0.224	13%	0.128	C	C	.	.			trans	-64.6	145.2	176.9	-71.9	173.7	28.6	0	0	113.6	A428 R429 D476 R477 V478	A428-Q432 PolarHBondContact O-N 2.73Å; R429-Q432 VanDerWaalsContact O-CG 3.28Å; R429-Q432 WeakPolarHBondContact O-CG 3.19Å; R429-Q432 PolarHBondContact O-NE2 3.44Å; Q432-D476 VanDerWaalsContact NE2-CG 3.34Å; Q432-D476 PolarHBondContact NE2-OD1 2.92Å; Q432-R477 HydrophobicContact CB-CB 4.28Å; Q432-R477 HydrophobicContact CG-CB 4.38Å; Q432-V478 HydrophobicContact CG-CG2 3.94Å
433	P	90.8	Very high	92.1	Very high	39 Å²	39	25.2 Å²	25.2	25%	0.253	13%	0.133	S	C	.	.	S	Bend	cis	-74.5	138.9	-1.1	30.9	-34.7	0	0	0	112.3	A399 T400 R477	A399-P433 CarbonylContact C-O 3.53Å; A399-P433 VanDerWaalsContact CA-O 3.3Å; A399-P433 WeakPolarHBondContact CA-O 3.24Å; A399-P433 HydrophobicContact CB-CB 4.42Å; A399-P433 WeakPolarHBondContact CB-O 3.47Å; T400-P433 PolarHBondContact N-O 3.09Å; P433-R477 WeakPolarHBondContact CA-O 3.31Å; P433-R477 HydrophobicContact CB-CB 4.39Å
434	S	92.9	Very high	91.9	Very high	2 Å²	2	25.3 Å²	25.3	1%	0.014	13%	0.133	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-138.9	145.7	-172.2	52.6	0	0	0	0	113	T400 A428 R477 V478 L479	T400-S434 WeakPolarHBondContact O-CA 3.37Å; A428-S434 PolarHBondContact O-OG 3.41Å; S434-R477 PolarHBondContact N-O 3.3Å; S434-R477 VanDerWaalsContact N-O 3.1Å; S434-V478 WeakPolarHBondContact O-CA 3.12Å; S434-L479 PolarHBondContact O-N 3.46Å
435	I	94.4	Very high	91.7	Very high	4 Å²	4	25.4 Å²	25.4	2%	0.021	13%	0.133	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-120.8	117.9	175.9	-57.9	-178.1	0	0	0	108	V356 V393 A394 A399 T400 F401 F402 L479 M481	V356-I435 HydrophobicContact CG1-CD1 4.01Å; V393-I435 HydrophobicContact CG1-CD1 3.95Å; A394-I435 HydrophobicContact CB-CD1 4.08Å; A399-I435 HydrophobicContact CB-CD1 4.15Å; A399-I435 HydrophobicContact CB-CG1 3.94Å; T400-I435 PolarHBondContact O-N 3.12Å; F401-I435 HydrophobicContact CD2-CB 4.19Å; F401-I435 HydrophobicContact CD2-CG2 4.16Å; F401-I435 HydrophobicContact CE2-CG2 4.2Å; F402-I435 PolarHBondContact N-O 3.04Å; I435-L479 CarbonylContact C-O 3.39Å; I435-L479 WeakPolarHBondContact CA-O 3.39Å; I435-L479 HydrophobicContact CD1-CD2 4.27Å; I435-L479 HydrophobicContact CG1-CB 4.35Å; I435-L479 HydrophobicContact CG1-CD2 4.24Å; I435-L479 HydrophobicContact CG2-CD2 4.39Å; I435-M481 HydrophobicContact CG2-CB 4.16Å; I435-M481 HydrophobicContact CG2-CE 4.44Å
436	I	95.6	Very high	91.5	Very high	0 Å²	0	26.8 Å²	26.8	0%	0	14%	0.143	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-92.1	104.3	171.3	-57.9	172.9	0	0	0	107.4	F402 I404 L424 F425 A428 I438 V478 L479 M481	F402-I436 HydrophobicContact CB-CG1 4.45Å; F402-I436 HydrophobicContact CD2-CG1 4.45Å; I404-I436 HydrophobicContact CD1-CG2 4.23Å; L424-I436 HydrophobicContact CD2-CG2 4.02Å; L424-I436 HydrophobicContact CG-CD1 4.37Å; F425-I436 HydrophobicContact CD1-CD1 3.54Å; F425-I436 HydrophobicContact CE1-CD1 3.53Å; F425-I436 HydrophobicContact CG-CD1 4.13Å; F425-I436 HydrophobicContact CZ-CD1 4.09Å; A428-I436 HydrophobicContact CB-CD1 3.76Å; A428-I436 HydrophobicContact CB-CG1 3.97Å; I436-I438 HydrophobicContact CG2-CD1 4.42Å; I436-I438 HydrophobicContact CG2-CG1 4.23Å; I436-V478 HydrophobicContact CD1-CG1 3.91Å; I436-V478 HydrophobicContact CG1-CG1 4.25Å; I436-L479 PolarHBondContact N-O 2.95Å; I436-M481 PolarHBondContact O-N 3.13Å
437	F	96.1	Very high	91.2	Very high	0 Å²	0	31.5 Å²	31.5	0%	0	16%	0.162	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-96.9	131.5	176.5	179	-99.2	0	0	0	111.3	T387 A390 F401 F402 N403 I404 D439 M481 A483	T387-F437 HydrophobicContact CG2-CE1 3.83Å; T387-F437 HydrophobicContact CG2-CZ 4.23Å; A390-F437 HydrophobicContact CB-CD2 3.27Å; A390-F437 HydrophobicContact CB-CE2 3.34Å; A390-F437 HydrophobicContact CB-CG 3.94Å; A390-F437 HydrophobicContact CB-CZ 4.06Å; F401-F437 HydrophobicContact CD2-CB 4.32Å; F401-F437 HydrophobicContact CE1-CB 4.19Å; F401-F437 HydrophobicContact CE1-CD1 4.47Å; F401-F437 HydrophobicContact CE2-CB 3.42Å; F401-F437 VanDerWaalsContact CE2-CB 3.42Å; F401-F437 HydrophobicContact CE2-CG 4.04Å; F401-F437 HydrophobicContact CZ-CB 3.34Å; F401-F437 AromaticContact CZ-CD1 3.89Å; F401-F437 HydrophobicContact CZ-CD1 3.89Å; F401-F437 HydrophobicContact CZ-CD2 4.35Å; F401-F437 AromaticContact CZ-CG 3.59Å; F401-F437 HydrophobicContact CZ-CG 3.59Å; F402-F437 PolarHBondContact O-N 3.32Å; N403-F437 WeakPolarHBondContact OD1-CD1 3.4Å; I404-F437 PolarHBondContact N-O 2.89Å; F437-D439 HydrophobicContact CE1-CB 3.68Å; F437-D439 HydrophobicContact CZ-CB 4.17Å; F437-M481 CarbonylContact C-O 3.49Å; F437-M481 VanDerWaalsContact CA-O 3.27Å; F437-M481 WeakPolarHBondContact CA-O 3.48Å; F437-M481 HydrophobicContact CD2-CB 4.15Å; F437-M481 HydrophobicContact CD2-CG 3.98Å; F437-M481 WeakPolarHBondContact CD2-O 3.37Å; F437-M481 HydrophobicContact CD2-SD 4.13Å; F437-M481 HydrophobicContact CE2-CG 4.46Å; F437-A483 HydrophobicContact CE2-CB 3.63Å; F437-A483 HydrophobicContact CZ-CB 3.45Å; F437-A483 VanDerWaalsContact CZ-CB 3.45Å
438	I	95.1	Very high	90.7	Very high	0 Å²	0	37.8 Å²	37.8	0%	0	19%	0.185	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-125.3	106	-178.2	-54	174.9	0	0	0	108.6	I404 I436 V441 F463 V480 M481 G482 A483	I404-I438 CarbonylContact O-C 3.6Å; I404-I438 WeakPolarHBondContact O-CA 3.47Å; I436-I438 HydrophobicContact CG2-CD1 4.42Å; I436-I438 HydrophobicContact CG2-CG1 4.23Å; I438-V441 HydrophobicContact CB-CB 4.46Å; I438-V441 HydrophobicContact CB-CG2 4.39Å; I438-V441 HydrophobicContact CG2-CB 4.01Å; I438-V441 HydrophobicContact CG2-CG2 3.95Å; I438-F463 HydrophobicContact CD1-CD2 4.43Å; I438-F463 HydrophobicContact CD1-CE1 4.27Å; I438-F463 HydrophobicContact CD1-CE2 3.32Å; I438-F463 HydrophobicContact CD1-CZ 3.23Å; I438-V480 HydrophobicContact CD1-CG1 4.37Å; I438-M481 PolarHBondContact N-O 3.44Å; I438-G482 CarbonylContact O-C 3.59Å; I438-A483 PolarHBondContact O-N 3.28Å
439	D	93.4	Very high	90.2	Very high	31 Å²	31	44.2 Å²	44.2	17%	0.166	21%	0.21	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-81.6	149.3	173.8	-134.9	-32.9	0	0	0	111.5	T387 I404 F437 V441	T387-D439 WeakPolarHBondContact CB-OD2 3.36Å; T387-D439 VanDerWaalsContact CG2-OD2 3.23Å; T387-D439 WeakPolarHBondContact CG2-OD2 3.25Å; T387-D439 PolarHBondContact OG1-OD2 3.06Å; I404-D439 PolarHBondContact O-N 3.4Å; F437-D439 HydrophobicContact CE1-CB 3.68Å; F437-D439 HydrophobicContact CZ-CB 4.17Å; D439-V441 VanDerWaalsContact C-N 3.26Å; D439-V441 PolarHBondContact O-N 2.94Å
440	E	92.1	Very high	89.6	Confident	96 Å²	96	49.7 Å²	49.7	45%	0.449	24%	0.238	S	C	.	.	T	Hydrogen-bonded Turn	trans	49.5	44.4	-173.5	-53.9	-165.9	129.8	0	0	113	D442 S443 A483	E440-D442 PolarHBondContact O-N 3.5Å; E440-S443 WeakPolarHBondContact O-CB 3.37Å; E440-S443 PolarHBondContact O-N 2.67Å; E440-S443 PolarHBondContact O-OG 3.41Å; E440-A483 PolarHBondContact N-O 3.34Å; E440-A483 VanDerWaalsContact N-O 3.12Å
441	V	93.3	Very high	89.1	Confident	0 Å²	0	49 Å²	49	0%	0	26%	0.256	C	S	.	.	H	α-helix	trans	-59.1	-22.4	-175.4	72.4	0	0	0	0	113.2	L377 I438 D439 S443 L444 L445 A483 L490 F498	L377-V441 HydrophobicContact CD1-CG1 3.89Å; I438-V441 HydrophobicContact CB-CB 4.46Å; I438-V441 HydrophobicContact CB-CG2 4.39Å; I438-V441 HydrophobicContact CG2-CB 4.01Å; I438-V441 HydrophobicContact CG2-CG2 3.95Å; D439-V441 VanDerWaalsContact C-N 3.26Å; D439-V441 PolarHBondContact O-N 2.94Å; V441-S443 VanDerWaalsContact C-N 3.25Å; V441-S443 PolarHBondContact O-N 3.5Å; V441-L444 PolarHBondContact O-N 3.18Å; V441-L445 HydrophobicContact CG2-CB 4.33Å; V441-L445 HydrophobicContact CG2-CD1 3.63Å; V441-L445 HydrophobicContact CG2-CG 3.99Å; V441-L445 WeakPolarHBondContact O-CB 3.35Å; V441-L445 PolarHBondContact O-N 2.98Å; V441-A483 WeakPolarHBondContact CG1-O 3.41Å; V441-A483 PolarHBondContact N-O 3.29Å; V441-L490 HydrophobicContact CG1-CD2 4.36Å; V441-F498 HydrophobicContact CG2-CE2 4.44Å; V441-F498 HydrophobicContact CG2-CZ 4.44Å
442	D	91.8	Very high	88.8	Confident	16 Å²	16	48.4 Å²	48.4	9%	0.086	25%	0.252	C	S	.	.	H	α-helix	trans	-58.3	-31.9	169.2	41.5	-61	0	0	0	113.4	E440 C446 T484 R486 L490	E440-D442 PolarHBondContact O-N 3.5Å; D442-C446 WeakPolarHBondContact O-CB 3.36Å; D442-C446 PolarHBondContact O-N 3.04Å; D442-T484 WeakPolarHBondContact OD1-CA 3.42Å; D442-T484 VanDerWaalsContact OD1-CB 3.24Å; D442-T484 WeakPolarHBondContact OD1-CB 3.26Å; D442-T484 PolarHBondContact OD1-OG1 3.34Å; D442-R486 HydrophobicContact CB-CB 4.3Å; D442-R486 WeakPolarHBondContact OD2-CB 3.48Å; D442-R486 WeakPolarHBondContact OD2-CG 3.48Å; D442-L490 HydrophobicContact CB-CD2 4.22Å
443	S	88.9	Confident	88.7	Confident	69 Å²	69	52.6 Å²	52.6	48%	0.483	27%	0.271	S	S	.	.	H	α-helix	trans	-75.7	-26.2	176.7	67	0	0	0	0	113.7	A406 E440 V441	A406-S443 WeakPolarHBondContact CB-OG 2.96Å; E440-S443 WeakPolarHBondContact O-CB 3.37Å; E440-S443 PolarHBondContact O-N 2.67Å; E440-S443 PolarHBondContact O-OG 3.41Å; V441-S443 VanDerWaalsContact C-N 3.25Å; V441-S443 PolarHBondContact O-N 3.5Å
444	L	87.8	Confident	88.5	Confident	6 Å²	6	54.9 Å²	54.9	3%	0.031	28%	0.281	C	S	.	.	H	α-helix	trans	-85.4	-43.1	174.3	-175.3	70.2	0	0	0	112	A406 L409 V441 L459 K460 F463	A406-L444 HydrophobicContact CB-CB 3.78Å; L409-L444 HydrophobicContact CB-CD1 4.45Å; L409-L444 HydrophobicContact CD1-CD1 4.24Å; L409-L444 HydrophobicContact CD1-CD2 3.71Å; V441-L444 PolarHBondContact O-N 3.18Å; L444-L459 HydrophobicContact CD1-CD2 3.64Å; L444-L459 HydrophobicContact CD1-CG 4.06Å; L444-K460 WeakPolarHBondContact O-CE 3.25Å; L444-K460 WeakPolarHBondContact O-CG 3.24Å; L444-F463 HydrophobicContact CD2-CD2 4.41Å; L444-F463 HydrophobicContact CD2-CG 4.46Å
445	L	88.9	Confident	88.2	Confident	2 Å²	2	56.1 Å²	56.1	1%	0.01	29%	0.291	C	S	.	.	H	α-helix	trans	-118.2	27.8	-163.4	-60.4	-174.4	0	0	0	113.4	V441 K460 F463 L490 D491 V494	V441-L445 HydrophobicContact CG2-CB 4.33Å; V441-L445 HydrophobicContact CG2-CD1 3.63Å; V441-L445 HydrophobicContact CG2-CG 3.99Å; V441-L445 WeakPolarHBondContact O-CB 3.35Å; V441-L445 PolarHBondContact O-N 2.98Å; L445-K460 HydrophobicContact CD2-CG 4.23Å; L445-F463 HydrophobicContact CD1-CD1 3.72Å; L445-F463 HydrophobicContact CD1-CE1 3.65Å; L445-F463 HydrophobicContact CD2-CD1 3.86Å; L445-F463 HydrophobicContact CD2-CG 4.37Å; L445-F463 HydrophobicContact CG-CD1 4.39Å; L445-L490 HydrophobicContact CB-CD2 4.3Å; L445-D491 PolarHBondContact O-N 3.35Å; L445-V494 HydrophobicContact CB-CB 4.43Å; L445-V494 HydrophobicContact CB-CG1 3.9Å; L445-V494 HydrophobicContact CB-CG2 3.77Å; L445-V494 HydrophobicContact CD1-CG1 3.65Å; L445-V494 HydrophobicContact CD1-CG2 4.2Å; L445-V494 HydrophobicContact CG-CG1 4.42Å; L445-V494 HydrophobicContact CG-CG2 4.39Å
446	C	86.9	Confident	87.9	Confident	30 Å²	30	57.8 Å²	57.8	20%	0.203	30%	0.303	C	S	.	.	B	Isolated β-bridge	trans	-62.3	156.7	172.8	52.2	0	0	0	0	113.5	D442 K460 E489	D442-C446 WeakPolarHBondContact O-CB 3.36Å; D442-C446 PolarHBondContact O-N 3.04Å; C446-K460 WeakPolarHBondContact O-CE 3.45Å; C446-K460 PolarHBondContact O-NZ 3.05Å; C446-K460 PolarHBondContact SG-NZ 3.36Å; C446-E489 CarbonylContact C-O 3.6Å; C446-E489 WeakPolarHBondContact CA-O 3.29Å
447	E	85.1	Confident	87.6	Confident	116 Å²	116	61.2 Å²	61.2	54%	0.542	32%	0.316	S	S	.	.			trans	-46.4	139.5	169.9	-171.8	-173.6	-146.1	0	0	112.3	R449 E489	E447-R449 PolarHBondContact O-N 3.02Å; E447-E489 PolarHBondContact N-O 3.39Å
448	R	81.8	Confident	87.3	Confident	133 Å²	133	67.1 Å²	67.1	50%	0.502	34%	0.339	S	S	.	.			trans	-74.3	115	-175	-56.8	173	-169.1	-138.1	-8	110.2	D491	R448-D491 IonicContact NE-OD2 2.74Å; R448-D491 PolarHBondContact NE-OD2 3.08Å
449	R	82.4	Confident	87.1	Confident	135 Å²	135	67.6 Å²	67.6	51%	0.509	34%	0.341	S	S	.	.			trans	-104	151.9	-179.9	-63.3	-176.4	-175.7	160	9.8	111.8	E447 E452 R457 E489	E447-R449 PolarHBondContact O-N 3.02Å; R449-E452 VanDerWaalsContact O-CB 3.29Å; R449-E452 WeakPolarHBondContact O-CB 3.35Å; R449-E452 PolarHBondContact O-N 3.44Å; R449-R457 PolarHBondContact O-NH2 3.08Å; R449-E489 IonicContact NH2-OE2 3.89Å
450	E	75.8	Confident	87	Confident	179 Å²	179	66.4 Å²	66.4	84%	0.836	33%	0.334	S	S	*	.	T	Hydrogen-bonded Turn	trans	-69.7	134.1	169.9	-72.1	-56.1	165.7	0	0	111.1	R457	E450-R457 IonicContact OE2-NH2 2.76Å; E450-R457 PolarHBondContact OE2-NH2 2.93Å; E450-R457 VanDerWaalsContact OE2-NH2 3.15Å
451	G	78.8	Confident	87	Confident	78 Å²	78	64.5 Å²	64.5	80%	0.804	33%	0.329	S	S	*	.	T	Hydrogen-bonded Turn	trans	85.1	0.4	-168.6	0	0	0	0	0	115.5
452	E	84.1	Confident	87	Confident	33 Å²	33	65.9 Å²	65.9	15%	0.154	34%	0.336	C	S	.	.			trans	-62.8	138.1	169	-176.8	-176.6	174.1	0	0	111.1	R449 S456 R457 K460	R449-E452 VanDerWaalsContact O-CB 3.29Å; R449-E452 WeakPolarHBondContact O-CB 3.35Å; R449-E452 PolarHBondContact O-N 3.44Å; E452-S456 VanDerWaalsContact OE1-CB 3.26Å; E452-S456 WeakPolarHBondContact OE1-CB 3.17Å; E452-S456 PolarHBondContact OE1-OG 3.33Å; E452-R457 HydrophobicContact CB-CG 4.31Å; E452-R457 HydrophobicContact CG-CG 4Å; E452-R457 PolarHBondContact O-NE 3.22Å; E452-K460 WeakPolarHBondContact OE1-CD 3.28Å; E452-K460 WeakPolarHBondContact OE1-CE 3.46Å; E452-K460 IonicContact OE1-NZ 3.7Å; E452-K460 PolarHBondContact OE1-NZ 2.6Å; E452-K460 IonicContact OE2-NZ 3.43Å; E452-K460 PolarHBondContact OE2-NZ 3.15Å
453	H	86	Confident	87.1	Confident	136 Å²	136	65.1 Å²	65.1	63%	0.63	33%	0.332	S	S	*	.			trans	-67.6	134.2	-178.1	-173.9	60.1	0	0	0	112.7	A455 S456 R457	H453-A455 VanDerWaalsContact C-N 3.27Å; H453-A455 PolarHBondContact O-N 2.94Å; H453-A455 VanDerWaalsContact O-N 3.13Å; H453-S456 WeakPolarHBondContact O-CB 3.47Å; H453-S456 PolarHBondContact O-N 3.44Å; H453-R457 PolarHBondContact O-N 3.44Å
454	D	87.3	Confident	87.2	Confident	86 Å²	86	62.4 Å²	62.4	46%	0.46	31%	0.312	S	S	.	.	H	α-helix	trans	-58.3	-32	-172.5	-70.5	-35.4	0	0	0	114.6	S456 R457 R458	D454-S456 VanDerWaalsContact C-N 3.31Å; D454-S456 PolarHBondContact O-N 3.15Å; D454-R457 PolarHBondContact O-N 3.16Å; D454-R457 IonicContact OD1-NH1 3.21Å; D454-R458 VanDerWaalsContact O-CG 3.31Å; D454-R458 WeakPolarHBondContact O-CG 3.1Å; D454-R458 PolarHBondContact O-N 3.35Å
455	A	87	Confident	87.5	Confident	28 Å²	28	66.7 Å²	66.7	23%	0.231	33%	0.334	C	S	.	.	H	α-helix	trans	-65.2	-34.7	176.1	0	0	0	0	0	112.3	H453 L459	H453-A455 VanDerWaalsContact C-N 3.27Å; H453-A455 PolarHBondContact O-N 2.94Å; H453-A455 VanDerWaalsContact O-N 3.13Å; A455-L459 VanDerWaalsContact O-CB 3.26Å; A455-L459 WeakPolarHBondContact O-CB 3.44Å; A455-L459 PolarHBondContact O-N 3.21Å
456	S	87.4	Confident	87.6	Confident	39 Å²	39	68 Å²	68	27%	0.273	34%	0.34	S	S	.	.	H	α-helix	trans	-67.2	-46.2	172.6	179.5	0	0	0	0	110.7	E452 H453 D454 R458 L459 K460	E452-S456 VanDerWaalsContact OE1-CB 3.26Å; E452-S456 WeakPolarHBondContact OE1-CB 3.17Å; E452-S456 PolarHBondContact OE1-OG 3.33Å; H453-S456 WeakPolarHBondContact O-CB 3.47Å; H453-S456 PolarHBondContact O-N 3.44Å; D454-S456 VanDerWaalsContact C-N 3.31Å; D454-S456 PolarHBondContact O-N 3.15Å; S456-R458 VanDerWaalsContact C-N 3.28Å; S456-R458 PolarHBondContact O-N 3.02Å; S456-L459 PolarHBondContact O-N 3.24Å; S456-K460 WeakPolarHBondContact O-CB 3.38Å; S456-K460 WeakPolarHBondContact O-CG 3.39Å; S456-K460 PolarHBondContact O-N 2.79Å
457	R	88.6	Confident	87.9	Confident	72 Å²	72	66.7 Å²	66.7	27%	0.272	33%	0.331	S	S	.	.	H	α-helix	trans	-58.1	-38.3	176.5	-66.5	173.2	163	-173.8	-6.9	112.3	R449 E450 E452 H453 D454 T461	R449-R457 PolarHBondContact O-NH2 3.08Å; E450-R457 IonicContact OE2-NH2 2.76Å; E450-R457 PolarHBondContact OE2-NH2 2.93Å; E450-R457 VanDerWaalsContact OE2-NH2 3.15Å; E452-R457 HydrophobicContact CB-CG 4.31Å; E452-R457 HydrophobicContact CG-CG 4Å; E452-R457 PolarHBondContact O-NE 3.22Å; H453-R457 PolarHBondContact O-N 3.44Å; D454-R457 PolarHBondContact O-N 3.16Å; D454-R457 IonicContact OD1-NH1 3.21Å; R457-T461 WeakPolarHBondContact O-CB 3.03Å; R457-T461 PolarHBondContact O-N 2.86Å; R457-T461 PolarHBondContact O-OG1 3.34Å
458	R	90.4	Very high	88.1	Confident	125 Å²	125	63.5 Å²	63.5	47%	0.472	32%	0.317	S	S	.	.	H	α-helix	trans	-71	-47.6	174	-68.9	171.9	-160.6	179.2	5.9	112.2	E418 D454 S456 K460 T461 E462	E418-R458 HydrophobicContact CG-CB 4.26Å; E418-R458 VanDerWaalsContact OE1-CB 3.27Å; E418-R458 WeakPolarHBondContact OE1-CB 3Å; E418-R458 WeakPolarHBondContact OE1-CD 3.04Å; D454-R458 VanDerWaalsContact O-CG 3.31Å; D454-R458 WeakPolarHBondContact O-CG 3.1Å; D454-R458 PolarHBondContact O-N 3.35Å; S456-R458 VanDerWaalsContact C-N 3.28Å; S456-R458 PolarHBondContact O-N 3.02Å; R458-K460 VanDerWaalsContact C-N 3.35Å; R458-K460 PolarHBondContact O-N 2.87Å; R458-T461 WeakPolarHBondContact O-CA 3.37Å; R458-T461 WeakPolarHBondContact O-CB 3.39Å; R458-T461 PolarHBondContact O-N 3.19Å; R458-E462 PolarHBondContact O-N 3.48Å
459	L	91.2	Very high	88.2	Confident	9 Å²	9	58.6 Å²	58.6	5%	0.047	31%	0.308	C	S	.	.	H	α-helix	trans	-57.5	-45.1	178	-174.2	65.6	0	0	0	112	L409 T410 G417 V421 L444 A455 S456 T461 E462 F463	L409-L459 HydrophobicContact CB-CD2 4.14Å; L409-L459 WeakPolarHBondContact O-CD2 3.48Å; T410-L459 HydrophobicContact CG2-CD2 4.16Å; G417-L459 VanDerWaalsContact C-CD1 3.43Å; G417-L459 WeakPolarHBondContact O-CD1 3.48Å; V421-L459 HydrophobicContact CG2-CD1 3.64Å; L444-L459 HydrophobicContact CD1-CD2 3.64Å; L444-L459 HydrophobicContact CD1-CG 4.06Å; A455-L459 VanDerWaalsContact O-CB 3.26Å; A455-L459 WeakPolarHBondContact O-CB 3.44Å; A455-L459 PolarHBondContact O-N 3.21Å; S456-L459 PolarHBondContact O-N 3.24Å; L459-T461 VanDerWaalsContact C-N 3.32Å; L459-T461 PolarHBondContact O-N 2.97Å; L459-E462 PolarHBondContact O-N 3.3Å; L459-F463 WeakPolarHBondContact O-CB 3.43Å; L459-F463 PolarHBondContact O-N 2.95Å
460	K	91	Very high	88.1	Confident	7 Å²	7	52.2 Å²	52.2	3%	0.03	28%	0.284	C	S	.	.	H	α-helix	trans	-55.1	-45.3	170.7	-77.4	175.4	178.1	-178.1	0	112.5	L444 L445 C446 E452 S456 R458 L464	L444-K460 WeakPolarHBondContact O-CE 3.25Å; L444-K460 WeakPolarHBondContact O-CG 3.24Å; L445-K460 HydrophobicContact CD2-CG 4.23Å; C446-K460 WeakPolarHBondContact O-CE 3.45Å; C446-K460 PolarHBondContact O-NZ 3.05Å; C446-K460 PolarHBondContact SG-NZ 3.36Å; E452-K460 WeakPolarHBondContact OE1-CD 3.28Å; E452-K460 WeakPolarHBondContact OE1-CE 3.46Å; E452-K460 IonicContact OE1-NZ 3.7Å; E452-K460 PolarHBondContact OE1-NZ 2.6Å; E452-K460 IonicContact OE2-NZ 3.43Å; E452-K460 PolarHBondContact OE2-NZ 3.15Å; S456-K460 WeakPolarHBondContact O-CB 3.38Å; S456-K460 WeakPolarHBondContact O-CG 3.39Å; S456-K460 PolarHBondContact O-N 2.79Å; R458-K460 VanDerWaalsContact C-N 3.35Å; R458-K460 PolarHBondContact O-N 2.87Å; K460-L464 WeakPolarHBondContact O-CG 3.32Å; K460-L464 PolarHBondContact O-N 2.88Å; K460-L464 VanDerWaalsContact O-N 3.15Å
461	T	91.8	Very high	88.1	Confident	56 Å²	56	46.7 Å²	46.7	34%	0.344	26%	0.258	S	S	.	.	H	α-helix	trans	-69.2	-44.7	-177.8	-58.6	0	0	0	0	111.2	R457 R458 L459 L464 I465	R457-T461 WeakPolarHBondContact O-CB 3.03Å; R457-T461 PolarHBondContact O-N 2.86Å; R457-T461 PolarHBondContact O-OG1 3.34Å; R458-T461 WeakPolarHBondContact O-CA 3.37Å; R458-T461 WeakPolarHBondContact O-CB 3.39Å; R458-T461 PolarHBondContact O-N 3.19Å; L459-T461 VanDerWaalsContact C-N 3.32Å; L459-T461 PolarHBondContact O-N 2.97Å; T461-L464 PolarHBondContact O-N 3.46Å; T461-I465 HydrophobicContact CG2-CD1 4.01Å; T461-I465 VanDerWaalsContact O-CG1 3.31Å; T461-I465 WeakPolarHBondContact O-CG1 3.48Å; T461-I465 PolarHBondContact O-N 3.27Å
462	E	93.3	Very high	87.9	Confident	28 Å²	28	47.8 Å²	47.8	13%	0.131	25%	0.254	C	S	.	.	H	α-helix	trans	-62	-44.1	176.9	-165.3	63.8	-141.3	0	0	112	E418 V421 R422 R458 L459 L464 I465 E466	E418-E462 HydrophobicContact CB-CG 4.45Å; V421-E462 HydrophobicContact CG1-CG 4.24Å; R422-E462 HydrophobicContact CG-CG 4.17Å; R422-E462 VanDerWaalsContact CG-OE1 3.3Å; R422-E462 WeakPolarHBondContact CG-OE1 3.28Å; R422-E462 IonicContact CZ-OE1 3.14Å; R422-E462 IonicContact CZ-OE2 2.62Å; R422-E462 IonicContact NE-OE1 2.69Å; R422-E462 PolarHBondContact NE-OE1 2.89Å; R422-E462 IonicContact NE-OE2 3.65Å; R422-E462 IonicContact NH2-OE1 2.81Å; R422-E462 PolarHBondContact NH2-OE1 3.12Å; R422-E462 IonicContact NH2-OE2 3.03Å; R422-E462 PolarHBondContact NH2-OE2 3.28Å; R458-E462 PolarHBondContact O-N 3.48Å; L459-E462 PolarHBondContact O-N 3.3Å; E462-L464 VanDerWaalsContact C-N 3.34Å; E462-L464 PolarHBondContact O-N 2.95Å; E462-I465 PolarHBondContact O-N 2.74Å; E462-E466 PolarHBondContact O-N 2.97Å
463	F	93.7	Very high	87.3	Confident	0 Å²	0	47.9 Å²	47.9	0%	0	26%	0.26	C	S	.	.	H	α-helix	trans	-60	-43.4	176.7	-176.3	-90.3	0	0	0	112.2	V421 F425 I438 L444 L445 L459 I465 F467 V480	V421-F463 HydrophobicContact CG1-CB 4.26Å; V421-F463 HydrophobicContact CG1-CD2 4.2Å; F425-F463 AromaticContact CE2-CD2 3.83Å; F425-F463 HydrophobicContact CE2-CD2 3.83Å; F425-F463 AromaticContact CE2-CE2 3.58Å; F425-F463 HydrophobicContact CE2-CE2 3.58Å; F425-F463 HydrophobicContact CE2-CZ 4.34Å; F425-F463 HydrophobicContact CZ-CD2 4.33Å; F425-F463 AromaticContact CZ-CE2 3.71Å; F425-F463 HydrophobicContact CZ-CE2 3.71Å; F425-F463 HydrophobicContact CZ-CZ 4.03Å; I438-F463 HydrophobicContact CD1-CD2 4.43Å; I438-F463 HydrophobicContact CD1-CE1 4.27Å; I438-F463 HydrophobicContact CD1-CE2 3.32Å; I438-F463 HydrophobicContact CD1-CZ 3.23Å; L444-F463 HydrophobicContact CD2-CD2 4.41Å; L444-F463 HydrophobicContact CD2-CG 4.46Å; L445-F463 HydrophobicContact CD1-CD1 3.72Å; L445-F463 HydrophobicContact CD1-CE1 3.65Å; L445-F463 HydrophobicContact CD2-CD1 3.86Å; L445-F463 HydrophobicContact CD2-CG 4.37Å; L445-F463 HydrophobicContact CG-CD1 4.39Å; L459-F463 WeakPolarHBondContact O-CB 3.43Å; L459-F463 PolarHBondContact O-N 2.95Å; F463-I465 VanDerWaalsContact C-N 3.34Å; F463-I465 PolarHBondContact O-N 3.34Å; F463-F467 HydrophobicContact CE1-CB 4.43Å; F463-F467 AromaticContact CE1-CD1 3.76Å; F463-F467 HydrophobicContact CE1-CD1 3.76Å; F463-F467 HydrophobicContact CE1-CE1 4.43Å; F463-F467 HydrophobicContact CE1-CG 4.48Å; F463-F467 HydrophobicContact CZ-CD1 4.36Å; F463-F467 VanDerWaalsContact O-CB 3.25Å; F463-F467 WeakPolarHBondContact O-CB 3.39Å; F463-F467 PolarHBondContact O-N 2.87Å; F463-V480 HydrophobicContact CZ-CG1 4.02Å
464	L	92.5	Very high	86.4	Confident	12 Å²	12	44.3 Å²	44.3	6%	0.063	26%	0.26	C	S	.	.	H	α-helix	trans	-67.1	-33.1	176.7	-72.4	170.8	0	0	0	112.6	K460 T461 E462 D468 V494	K460-L464 WeakPolarHBondContact O-CG 3.32Å; K460-L464 PolarHBondContact O-N 2.88Å; K460-L464 VanDerWaalsContact O-N 3.15Å; T461-L464 PolarHBondContact O-N 3.46Å; E462-L464 VanDerWaalsContact C-N 3.34Å; E462-L464 PolarHBondContact O-N 2.95Å; L464-D468 WeakPolarHBondContact O-CB 3.44Å; L464-D468 VanDerWaalsContact O-CG 3.23Å; L464-D468 PolarHBondContact O-N 2.95Å; L464-V494 HydrophobicContact CD1-CG2 4.42Å; L464-V494 HydrophobicContact CD2-CG2 4.09Å
465	I	93.1	Very high	85.7	Confident	97 Å²	97	47.6 Å²	47.6	50%	0.497	28%	0.278	S	S	.	.	H	α-helix	trans	-67.3	-48.8	176	-71	164.4	0	0	0	111.1	T461 E462 F463 F467 D468 G469	T461-I465 HydrophobicContact CG2-CD1 4.01Å; T461-I465 VanDerWaalsContact O-CG1 3.31Å; T461-I465 WeakPolarHBondContact O-CG1 3.48Å; T461-I465 PolarHBondContact O-N 3.27Å; E462-I465 PolarHBondContact O-N 2.74Å; F463-I465 VanDerWaalsContact C-N 3.34Å; F463-I465 PolarHBondContact O-N 3.34Å; I465-F467 VanDerWaalsContact C-N 3.35Å; I465-F467 PolarHBondContact O-N 3.43Å; I465-D468 PolarHBondContact O-N 3.34Å; I465-G469 PolarHBondContact O-N 3.15Å
466	E	92.5	Very high	85.5	Confident	30 Å²	30	47.8 Å²	47.8	14%	0.14	28%	0.275	C	S	.	.	H	α-helix	trans	-67.2	-35.4	178.3	-79.3	-75.5	-169	0	0	112.3	V421 R422 F425 R429 E462 G469 V470	V421-E466 HydrophobicContact CG1-CB 4.49Å; V421-E466 HydrophobicContact CG1-CG 4.43Å; R422-E466 WeakPolarHBondContact CA-OE1 3.43Å; R422-E466 HydrophobicContact CG-CG 4.38Å; F425-E466 HydrophobicContact CB-CB 4.09Å; F425-E466 HydrophobicContact CB-CG 4.25Å; F425-E466 HydrophobicContact CD1-CB 4.31Å; F425-E466 HydrophobicContact CD2-CB 3.42Å; F425-E466 VanDerWaalsContact CD2-CB 3.42Å; F425-E466 HydrophobicContact CD2-CG 4.1Å; F425-E466 HydrophobicContact CE2-CB 3.8Å; F425-E466 HydrophobicContact CG-CB 3.7Å; F425-E466 HydrophobicContact CG-CG 4.35Å; F425-E466 HydrophobicContact CZ-CB 4.39Å; R429-E466 IonicContact CZ-OE2 3.29Å; R429-E466 IonicContact NH1-OE2 2.69Å; R429-E466 PolarHBondContact NH1-OE2 3.27Å; R429-E466 IonicContact NH2-OE1 3.51Å; R429-E466 PolarHBondContact NH2-OE1 3.27Å; R429-E466 IonicContact NH2-OE2 2.96Å; R429-E466 PolarHBondContact NH2-OE2 2.85Å; E462-E466 PolarHBondContact O-N 2.97Å; E466-G469 PolarHBondContact O-N 3.03Å; E466-V470 PolarHBondContact O-N 3.16Å
467	F	91.9	Very high	85.4	Confident	1 Å²	1	52.2 Å²	52.2	0%	0.004	29%	0.286	C	S	.	.	H	α-helix	trans	-64.1	-49.4	173.3	-166.4	177.1	0	0	0	111	F425 F463 I465 G469 V470 Q471 V480 R497 F498	F425-F467 HydrophobicContact CZ-CB 4.4Å; F463-F467 HydrophobicContact CE1-CB 4.43Å; F463-F467 AromaticContact CE1-CD1 3.76Å; F463-F467 HydrophobicContact CE1-CD1 3.76Å; F463-F467 HydrophobicContact CE1-CE1 4.43Å; F463-F467 HydrophobicContact CE1-CG 4.48Å; F463-F467 HydrophobicContact CZ-CD1 4.36Å; F463-F467 VanDerWaalsContact O-CB 3.25Å; F463-F467 WeakPolarHBondContact O-CB 3.39Å; F463-F467 PolarHBondContact O-N 2.87Å; I465-F467 VanDerWaalsContact C-N 3.35Å; I465-F467 PolarHBondContact O-N 3.43Å; F467-G469 PolarHBondContact O-N 3.37Å; F467-V470 WeakPolarHBondContact O-CB 3.23Å; F467-V470 PolarHBondContact O-N 3.34Å; F467-V470 VanDerWaalsContact O-N 3.08Å; F467-Q471 HydrophobicContact CD2-CG 4.21Å; F467-Q471 HydrophobicContact CE2-CG 4.4Å; F467-Q471 VanDerWaalsContact CE2-NE2 3.34Å; F467-Q471 WeakPolarHBondContact O-CG 3.38Å; F467-Q471 PolarHBondContact O-N 3.47Å; F467-V480 HydrophobicContact CD1-CG1 4.41Å; F467-V480 HydrophobicContact CD2-CB 4.11Å; F467-V480 HydrophobicContact CD2-CG2 3.67Å; F467-V480 HydrophobicContact CE1-CB 4.24Å; F467-V480 HydrophobicContact CE1-CG1 3.99Å; F467-V480 HydrophobicContact CE2-CB 3.59Å; F467-V480 HydrophobicContact CE2-CG1 4.24Å; F467-V480 HydrophobicContact CE2-CG2 3.66Å; F467-V480 HydrophobicContact CG-CG2 4.24Å; F467-V480 HydrophobicContact CZ-CB 3.66Å; F467-V480 HydrophobicContact CZ-CG1 3.9Å; F467-V480 HydrophobicContact CZ-CG2 4.19Å; F467-R497 HydrophobicContact CD1-CB 3.73Å; F467-R497 HydrophobicContact CD1-CG 4.12Å; F467-R497 HydrophobicContact CE1-CB 3.45Å; F467-R497 VanDerWaalsContact CE1-CB 3.45Å; F467-R497 HydrophobicContact CE1-CG 4.33Å; F467-R497 HydrophobicContact CE2-CB 4.33Å; F467-R497 HydrophobicContact CG-CB 4.31Å; F467-R497 HydrophobicContact CG-CG 4.37Å; F467-R497 HydrophobicContact CZ-CB 3.77Å; F467-F498 HydrophobicContact CE1-CD1 4.24Å; F467-F498 AromaticContact CE1-CE1 3.89Å; F467-F498 HydrophobicContact CE1-CE1 3.89Å; F467-F498 HydrophobicContact CE1-CE2 4.37Å; F467-F498 AromaticContact CE1-CZ 3.96Å; F467-F498 HydrophobicContact CE1-CZ 3.96Å; F467-F498 HydrophobicContact CZ-CD1 4.08Å; F467-F498 AromaticContact CZ-CE1 3.93Å; F467-F498 HydrophobicContact CZ-CE1 3.93Å; F467-F498 HydrophobicContact CZ-CZ 4.47Å
468	D	88.9	Confident	85.6	Confident	50 Å²	50	48.9 Å²	48.9	27%	0.267	27%	0.273	S	S	.	.	H	α-helix	trans	-60.4	-32.3	174.6	-73.7	-11.1	0	0	0	112.1	L464 I465 Q471 S472 R497	L464-D468 WeakPolarHBondContact O-CB 3.44Å; L464-D468 VanDerWaalsContact O-CG 3.23Å; L464-D468 PolarHBondContact O-N 2.95Å; I465-D468 PolarHBondContact O-N 3.34Å; D468-Q471 PolarHBondContact O-N 2.7Å; D468-S472 WeakPolarHBondContact O-CB 3.5Å; D468-S472 PolarHBondContact O-N 3.3Å; D468-S472 PolarHBondContact O-OG 2.97Å; D468-R497 VanDerWaalsContact OD1-CG 3.24Å; D468-R497 WeakPolarHBondContact OD1-CG 3.34Å; D468-R497 IonicContact OD1-CZ 3.97Å; D468-R497 IonicContact OD1-NE 2.7Å; D468-R497 PolarHBondContact OD1-NE 2.97Å; D468-R497 IonicContact OD1-NH2 2.64Å; D468-R497 IonicContact OD2-CZ 3.94Å; D468-R497 IonicContact OD2-NE 3.68Å; D468-R497 PolarHBondContact OD2-NE 3.43Å; D468-R497 IonicContact OD2-NH2 3.42Å; D468-R497 PolarHBondContact OD2-NH2 3.02Å
469	G	84.9	Confident	85.7	Confident	30 Å²	30	43.6 Å²	43.6	31%	0.309	25%	0.254	S	S	.	.	H	α-helix	trans	-60	-48.2	170.5	0	0	0	0	0	112.8	I465 E466 F467 Q471 S472 A473	I465-G469 PolarHBondContact O-N 3.15Å; E466-G469 PolarHBondContact O-N 3.03Å; F467-G469 PolarHBondContact O-N 3.37Å; G469-Q471 VanDerWaalsContact C-N 3.26Å; G469-Q471 PolarHBondContact O-N 3.43Å; G469-S472 PolarHBondContact O-N 3.44Å; G469-S472 VanDerWaalsContact O-N 3.1Å; G469-A473 PolarHBondContact O-N 2.68Å
470	V	80.7	Confident	85.9	Confident	0 Å²	0	43.2 Å²	43.2	0%	0	25%	0.252	C	S	.	.	H	α-helix	trans	-62.5	-30.5	173.2	167.1	0	0	0	0	112.5	R374 F425 E466 F467 V478	R374-V470 HydrophobicContact CB-CG1 4.48Å; F425-V470 HydrophobicContact CD1-CG2 3.66Å; F425-V470 HydrophobicContact CE1-CG2 3.96Å; E466-V470 PolarHBondContact O-N 3.16Å; F467-V470 WeakPolarHBondContact O-CB 3.23Å; F467-V470 PolarHBondContact O-N 3.34Å; F467-V470 VanDerWaalsContact O-N 3.08Å; V470-V478 HydrophobicContact CG1-CB 3.83Å; V470-V478 HydrophobicContact CG1-CG1 4.23Å; V470-V478 HydrophobicContact CG2-CB 4.32Å; V470-V478 HydrophobicContact CG2-CG1 4.36Å
471	Q	75.3	Confident	86.2	Confident	63 Å²	63	42.9 Å²	42.9	29%	0.294	25%	0.251	S	S	.	.	H	α-helix	trans	-74.2	-28.8	173.7	-54.6	-156.4	-1.6	0	0	112.8	R374 F467 D468 G469 R497	R374-Q471 HydrophobicContact CB-CG 4.09Å; F467-Q471 HydrophobicContact CD2-CG 4.21Å; F467-Q471 HydrophobicContact CE2-CG 4.4Å; F467-Q471 VanDerWaalsContact CE2-NE2 3.34Å; F467-Q471 WeakPolarHBondContact O-CG 3.38Å; F467-Q471 PolarHBondContact O-N 3.47Å; D468-Q471 PolarHBondContact O-N 2.7Å; G469-Q471 VanDerWaalsContact C-N 3.26Å; G469-Q471 PolarHBondContact O-N 3.43Å; Q471-R497 PolarHBondContact NE2-O 3.3Å
472	S	74.1	Confident	86.4	Confident	101 Å²	101	40.2 Å²	40.2	71%	0.706	23%	0.234	S	C	*	.	H	α-helix	trans	-85.2	-29	-176.7	-56.3	0	0	0	0	113.4	D468 G469 G474	D468-S472 WeakPolarHBondContact O-CB 3.5Å; D468-S472 PolarHBondContact O-N 3.3Å; D468-S472 PolarHBondContact O-OG 2.97Å; G469-S472 PolarHBondContact O-N 3.44Å; G469-S472 VanDerWaalsContact O-N 3.1Å; S472-G474 PolarHBondContact O-N 2.83Å
473	A	71.5	Confident	86.5	Confident	35 Å²	35	38.9 Å²	38.9	29%	0.289	23%	0.228	S	C	.	.			trans	-79.3	95.6	176.8	0	0	0	0	0	111	G469 D475 D476	G469-A473 PolarHBondContact O-N 2.68Å; A473-D475 VanDerWaalsContact C-N 3.26Å; A473-D475 PolarHBondContact O-N 3.34Å; A473-D475 VanDerWaalsContact O-N 3.15Å; A473-D476 HydrophobicContact CB-CB 3.86Å; A473-D476 WeakPolarHBondContact CB-OD2 3.35Å; A473-D476 PolarHBondContact O-N 2.75Å; A473-D476 VanDerWaalsContact O-N 3.11Å
474	G	67	Low	86.6	Confident	62 Å²	62	38.9 Å²	38.9	64%	0.639	23%	0.228	S	C	*	.	T	Hydrogen-bonded Turn	trans	-52.5	-38.8	-175.1	0	0	0	0	0	114.8	R374 S472	R374-G474 PolarHBondContact NH2-O 3.41Å; S472-G474 PolarHBondContact O-N 2.83Å
475	D	73.1	Confident	86.7	Confident	155 Å²	155	39.8 Å²	39.8	83%	0.829	23%	0.233	S	C	*	.	T	Hydrogen-bonded Turn	trans	-83	-16	-176.8	-62.5	-32.2	0	0	0	114.2	A473 R477	A473-D475 VanDerWaalsContact C-N 3.26Å; A473-D475 PolarHBondContact O-N 3.34Å; A473-D475 VanDerWaalsContact O-N 3.15Å; D475-R477 PolarHBondContact O-N 2.92Å; D475-R477 VanDerWaalsContact O-N 3.16Å
476	D	81.8	Confident	86.8	Confident	31 Å²	31	41.2 Å²	41.2	17%	0.166	23%	0.232	C	C	.	.			trans	-71.1	110.4	-171.3	-93	-9.5	0	0	0	111.7	R374 R429 Q432 A473 V478	R374-D476 PolarHBondContact NH1-O 2.86Å; R374-D476 PolarHBondContact NH2-O 3.45Å; R374-D476 VanDerWaalsContact NH2-O 3.09Å; R429-D476 WeakPolarHBondContact CD-OD2 3.33Å; R429-D476 WeakPolarHBondContact CG-OD2 3.48Å; Q432-D476 VanDerWaalsContact NE2-CG 3.34Å; Q432-D476 PolarHBondContact NE2-OD1 2.92Å; A473-D476 HydrophobicContact CB-CB 3.86Å; A473-D476 WeakPolarHBondContact CB-OD2 3.35Å; A473-D476 PolarHBondContact O-N 2.75Å; A473-D476 VanDerWaalsContact O-N 3.11Å; D476-V478 PolarHBondContact O-N 3.24Å
477	R	86.9	Confident	86.9	Confident	133 Å²	133	39.9 Å²	39.9	50%	0.502	23%	0.226	S	C	.	.			trans	-83.7	53.5	177.5	-63.8	179.2	-62.8	162.9	5.3	112.6	Q432 P433 S434 D475	Q432-R477 HydrophobicContact CB-CB 4.28Å; Q432-R477 HydrophobicContact CG-CB 4.38Å; P433-R477 WeakPolarHBondContact CA-O 3.31Å; P433-R477 HydrophobicContact CB-CB 4.39Å; S434-R477 PolarHBondContact N-O 3.3Å; S434-R477 VanDerWaalsContact N-O 3.1Å; D475-R477 PolarHBondContact O-N 2.92Å; D475-R477 VanDerWaalsContact O-N 3.16Å
478	V	92.3	Very high	86.9	Confident	1 Å²	1	45.3 Å²	45.3	1%	0.006	25%	0.252	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-105.1	139.7	171.5	-171.7	0	0	0	0	109.3	A428 R429 Q432 S434 I436 V470 D476	A428-V478 HydrophobicContact CB-CG1 4.41Å; R429-V478 HydrophobicContact CG-CG2 3.9Å; Q432-V478 HydrophobicContact CG-CG2 3.94Å; S434-V478 WeakPolarHBondContact O-CA 3.12Å; I436-V478 HydrophobicContact CD1-CG1 3.91Å; I436-V478 HydrophobicContact CG1-CG1 4.25Å; V470-V478 HydrophobicContact CG1-CB 3.83Å; V470-V478 HydrophobicContact CG1-CG1 4.23Å; V470-V478 HydrophobicContact CG2-CB 4.32Å; V470-V478 HydrophobicContact CG2-CG1 4.36Å; D476-V478 PolarHBondContact O-N 3.24Å
479	L	93.1	Very high	87.1	Confident	15 Å²	15	45.3 Å²	45.3	8%	0.079	25%	0.25	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-121.8	132.2	170.4	168.3	65	0	0	0	109.5	V356 A373 L376 S434 I435 I436 M481	V356-L479 HydrophobicContact CB-CD2 4.17Å; V356-L479 HydrophobicContact CG1-CD2 3.51Å; V356-L479 HydrophobicContact CG2-CD2 3.54Å; A373-L479 WeakPolarHBondContact O-CD1 3.42Å; L376-L479 HydrophobicContact CB-CD1 4.32Å; S434-L479 PolarHBondContact O-N 3.46Å; I435-L479 CarbonylContact C-O 3.39Å; I435-L479 WeakPolarHBondContact CA-O 3.39Å; I435-L479 HydrophobicContact CD1-CD2 4.27Å; I435-L479 HydrophobicContact CG1-CB 4.35Å; I435-L479 HydrophobicContact CG1-CD2 4.24Å; I435-L479 HydrophobicContact CG2-CD2 4.39Å; I436-L479 PolarHBondContact N-O 2.95Å; L479-M481 HydrophobicContact CD2-CE 4.01Å
480	V	95.2	Very high	87.5	Confident	0 Å²	0	44.5 Å²	44.5	0%	0	24%	0.239	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-98.2	122.9	168.4	-176.2	0	0	0	0	109.1	R374 G375 L376 F425 I438 F463 F467 F498	R374-V480 PolarHBondContact O-N 3.13Å; G375-V480 WeakPolarHBondContact CA-O 3.34Å; L376-V480 PolarHBondContact N-O 2.7Å; F425-V480 HydrophobicContact CE1-CG2 3.76Å; F425-V480 HydrophobicContact CZ-CG2 4.05Å; I438-V480 HydrophobicContact CD1-CG1 4.37Å; F463-V480 HydrophobicContact CZ-CG1 4.02Å; F467-V480 HydrophobicContact CD1-CG1 4.41Å; F467-V480 HydrophobicContact CD2-CB 4.11Å; F467-V480 HydrophobicContact CD2-CG2 3.67Å; F467-V480 HydrophobicContact CE1-CB 4.24Å; F467-V480 HydrophobicContact CE1-CG1 3.99Å; F467-V480 HydrophobicContact CE2-CB 3.59Å; F467-V480 HydrophobicContact CE2-CG1 4.24Å; F467-V480 HydrophobicContact CE2-CG2 3.66Å; F467-V480 HydrophobicContact CG-CG2 4.24Å; F467-V480 HydrophobicContact CZ-CB 3.66Å; F467-V480 HydrophobicContact CZ-CG1 3.9Å; F467-V480 HydrophobicContact CZ-CG2 4.19Å; V480-F498 HydrophobicContact CG1-CE1 4.1Å; V480-F498 HydrophobicContact CG1-CZ 4.38Å
481	M	95.7	Very high	87.8	Confident	0 Å²	0	46 Å²	46	0%	0	25%	0.247	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-120	106.2	179.5	-171	179.9	-64.2	0	0	110.5	L352 L376 L378 A390 V393 I435 I436 F437 I438 L479	L352-M481 HydrophobicContact CD2-CE 4.06Å; L376-M481 HydrophobicContact CD2-CE 4.36Å; L376-M481 HydrophobicContact CD2-CG 4Å; L376-M481 HydrophobicContact CD2-SD 4.45Å; L376-M481 CarbonylContact O-C 3.59Å; L376-M481 VanDerWaalsContact O-CA 3.26Å; L376-M481 WeakPolarHBondContact O-CA 3.43Å; L378-M481 HydrophobicContact CD1-CG 4.45Å; L378-M481 HydrophobicContact CD1-SD 3.89Å; L378-M481 HydrophobicContact CG-CG 4.4Å; L378-M481 HydrophobicContact CG-SD 4.33Å; A390-M481 HydrophobicContact CB-SD 3.52Å; A390-M481 VanDerWaalsContact CB-SD 3.52Å; V393-M481 HydrophobicContact CB-CE 4.45Å; V393-M481 HydrophobicContact CG1-CE 4.17Å; I435-M481 HydrophobicContact CG2-CB 4.16Å; I435-M481 HydrophobicContact CG2-CE 4.44Å; I436-M481 PolarHBondContact O-N 3.13Å; F437-M481 CarbonylContact C-O 3.49Å; F437-M481 VanDerWaalsContact CA-O 3.27Å; F437-M481 WeakPolarHBondContact CA-O 3.48Å; F437-M481 HydrophobicContact CD2-CB 4.15Å; F437-M481 HydrophobicContact CD2-CG 3.98Å; F437-M481 WeakPolarHBondContact CD2-O 3.37Å; F437-M481 HydrophobicContact CD2-SD 4.13Å; F437-M481 HydrophobicContact CE2-CG 4.46Å; I438-M481 PolarHBondContact N-O 3.44Å; L479-M481 HydrophobicContact CD2-CE 4.01Å
482	G	95.9	Very high	88.4	Confident	0 Å²	0	51 Å²	51	0%	0	27%	0.27	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-85.2	146.8	172.9	0	0	0	0	0	111.7	L376 L378 I438	L376-G482 PolarHBondContact O-N 3.09Å; L378-G482 PolarHBondContact N-O 3.37Å; I438-G482 CarbonylContact O-C 3.59Å
483	A	96.3	Very high	89.2	Confident	0 Å²	0	47.4 Å²	47.4	0%	0	25%	0.246	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-120.1	135	161.9	0	0	0	0	0	110.7	L378 K386 F437 I438 E440 V441	L378-A483 HydrophobicContact CB-CB 4.44Å; L378-A483 VanDerWaalsContact O-CA 3.32Å; L378-A483 WeakPolarHBondContact O-CA 3.43Å; K386-A483 HydrophobicContact CB-CB 4.26Å; F437-A483 HydrophobicContact CE2-CB 3.63Å; F437-A483 HydrophobicContact CZ-CB 3.45Å; F437-A483 VanDerWaalsContact CZ-CB 3.45Å; I438-A483 PolarHBondContact O-N 3.28Å; E440-A483 PolarHBondContact N-O 3.34Å; E440-A483 VanDerWaalsContact N-O 3.12Å; V441-A483 WeakPolarHBondContact CG1-O 3.41Å; V441-A483 PolarHBondContact N-O 3.29Å
484	T	95.6	Very high	90.1	Very high	0 Å²	0	45.9 Å²	45.9	0%	0	23%	0.233	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-136.2	148.4	-179.6	-176.7	0	0	0	0	112.8	L377 L378 F379 K386 D442 R486 P487 L490	L377-T484 HydrophobicContact CD1-CG2 3.86Å; L377-T484 HydrophobicContact CD2-CG2 4.25Å; L377-T484 HydrophobicContact CG-CG2 4.2Å; L378-T484 PolarHBondContact O-N 2.85Å; F379-T484 HydrophobicContact CB-CG2 3.53Å; K386-T484 WeakPolarHBondContact CE-O 3.34Å; K386-T484 PolarHBondContact NZ-O 3.35Å; K386-T484 VanDerWaalsContact NZ-O 3.12Å; D442-T484 WeakPolarHBondContact OD1-CA 3.42Å; D442-T484 VanDerWaalsContact OD1-CB 3.24Å; D442-T484 WeakPolarHBondContact OD1-CB 3.26Å; D442-T484 PolarHBondContact OD1-OG1 3.34Å; T484-R486 PolarHBondContact OG1-N 3.04Å; T484-P487 HydrophobicContact CG2-CB 3.91Å; T484-L490 HydrophobicContact CG2-CD1 4.35Å
485	N	95.3	Very high	91.3	Very high	32 Å²	32	43.7 Å²	43.7	17%	0.171	21%	0.207	C	C	.	.	S	Bend	trans	-99.2	-8.3	166.7	-61.4	-56.2	0	0	0	112	P382 K386 Y602	P382-N485 WeakPolarHBondContact CA-OD1 3.46Å; K386-N485 PolarHBondContact NZ-OD1 2.94Å; N485-Y602 WeakPolarHBondContact O-CE1 3.45Å; N485-Y602 PolarHBondContact O-OH 3.28Å
486	R	94	Very high	92.2	Very high	127 Å²	127	44.4 Å²	44.4	48%	0.479	20%	0.198	S	C	.	.			trans	-141.3	65	-172.3	-50.7	-166.7	-166.6	-179	6	111.7	D442 T484 Q488 E489	D442-R486 HydrophobicContact CB-CB 4.3Å; D442-R486 WeakPolarHBondContact OD2-CB 3.48Å; D442-R486 WeakPolarHBondContact OD2-CG 3.48Å; T484-R486 PolarHBondContact OG1-N 3.04Å; R486-Q488 VanDerWaalsContact C-OE1 3.29Å; R486-Q488 PolarHBondContact O-N 3.25Å; R486-E489 HydrophobicContact CB-CB 4.34Å; R486-E489 HydrophobicContact CB-CG 4.17Å; R486-E489 WeakPolarHBondContact CD-OE1 3.38Å; R486-E489 IonicContact CZ-OE1 3.43Å; R486-E489 IonicContact NE-OE1 2.73Å; R486-E489 IonicContact NH1-OE1 3.69Å; R486-E489 PolarHBondContact NH1-OE1 3.34Å; R486-E489 IonicContact NH1-OE2 2.62Å; R486-E489 PolarHBondContact O-N 3.1Å
487	P	94.5	Very high	92.7	Very high	1 Å²	1	44.1 Å²	44.1	1%	0.006	19%	0.194	C	C	.	.	G	3₁₀ helix	trans	-60.1	-22	-176.4	29.6	-38.7	0	0	0	113.4	F379 T484 E489 Y602 W605	F379-P487 HydrophobicContact CB-CB 4.04Å; F379-P487 HydrophobicContact CB-CG 4.18Å; F379-P487 HydrophobicContact CD2-CB 4.33Å; F379-P487 HydrophobicContact CD2-CG 3.91Å; F379-P487 HydrophobicContact CG-CB 4.33Å; F379-P487 HydrophobicContact CG-CG 4.35Å; T484-P487 HydrophobicContact CG2-CB 3.91Å; P487-E489 VanDerWaalsContact C-N 3.31Å; P487-E489 PolarHBondContact O-N 3.01Å; P487-Y602 HydrophobicContact CG-CD1 4.32Å; P487-Y602 HydrophobicContact CG-CE1 4.48Å; P487-W605 HydrophobicContact CB-CD2 3.81Å; P487-W605 HydrophobicContact CB-CE3 3.97Å; P487-W605 HydrophobicContact CB-CG 4.49Å; P487-W605 HydrophobicContact CB-CH2 3.91Å; P487-W605 HydrophobicContact CB-CZ2 3.73Å; P487-W605 HydrophobicContact CB-CZ3 4.02Å; P487-W605 HydrophobicContact CG-CD2 3.89Å; P487-W605 HydrophobicContact CG-CE3 4.1Å; P487-W605 HydrophobicContact CG-CG 4.17Å
488	Q	93.3	Very high	93	Very high	116 Å²	116	37.8 Å²	37.8	54%	0.542	17%	0.17	S	C	.	.	G	3₁₀ helix	trans	-75.1	-7.2	174.2	77.5	-71.4	-11.8	0	0	115.4	R486	R486-Q488 VanDerWaalsContact C-OE1 3.29Å; R486-Q488 PolarHBondContact O-N 3.25Å
489	E	92.8	Very high	93	Very high	50 Å²	50	41.9 Å²	41.9	23%	0.234	19%	0.192	C	C	.	.	G	3₁₀ helix	trans	-95.4	-4.3	174.2	-67.7	-167.4	-144.6	0	0	113	C446 E447 R449 R486 P487	C446-E489 CarbonylContact C-O 3.6Å; C446-E489 WeakPolarHBondContact CA-O 3.29Å; E447-E489 PolarHBondContact N-O 3.39Å; R449-E489 IonicContact NH2-OE2 3.89Å; R486-E489 HydrophobicContact CB-CB 4.34Å; R486-E489 HydrophobicContact CB-CG 4.17Å; R486-E489 WeakPolarHBondContact CD-OE1 3.38Å; R486-E489 IonicContact CZ-OE1 3.43Å; R486-E489 IonicContact NE-OE1 2.73Å; R486-E489 IonicContact NH1-OE1 3.69Å; R486-E489 PolarHBondContact NH1-OE1 3.34Å; R486-E489 IonicContact NH1-OE2 2.62Å; R486-E489 PolarHBondContact O-N 3.1Å; P487-E489 VanDerWaalsContact C-N 3.31Å; P487-E489 PolarHBondContact O-N 3.01Å
490	L	92.2	Very high	92.9	Very high	13 Å²	13	44.4 Å²	44.4	7%	0.068	20%	0.202	C	C	.	.	B	Isolated β-bridge	trans	-79.1	137.4	-178.8	-64.5	173	0	0	0	112.5	L377 V441 D442 L445 T484 V494 L495	L377-L490 HydrophobicContact CD1-CD1 4.3Å; L377-L490 HydrophobicContact CD2-CD1 3.79Å; V441-L490 HydrophobicContact CG1-CD2 4.36Å; D442-L490 HydrophobicContact CB-CD2 4.22Å; L445-L490 HydrophobicContact CB-CD2 4.3Å; T484-L490 HydrophobicContact CG2-CD1 4.35Å; L490-V494 HydrophobicContact CD2-CG1 4.34Å; L490-L495 HydrophobicContact CB-CD2 3.92Å; L490-L495 HydrophobicContact CB-CG 4.15Å; L490-L495 HydrophobicContact CD1-CD2 3.81Å
491	D	87.6	Confident	92.9	Very high	31 Å²	31	46.6 Å²	46.6	17%	0.166	21%	0.21	C	C	.	.			trans	-59	138	172.2	-175.8	-24.7	0	0	0	110.6	L445 R448 A493 V494 L495	L445-D491 PolarHBondContact O-N 3.35Å; R448-D491 IonicContact NE-OD2 2.74Å; R448-D491 PolarHBondContact NE-OD2 3.08Å; D491-A493 PolarHBondContact O-N 2.84Å; D491-A493 VanDerWaalsContact O-N 3.13Å; D491-A493 WeakPolarHBondContact OD1-CB 3.44Å; D491-A493 PolarHBondContact OD1-N 3.19Å; D491-V494 HydrophobicContact CB-CB 4.44Å; D491-V494 HydrophobicContact CB-CG2 3.91Å; D491-V494 WeakPolarHBondContact O-CA 3.39Å; D491-V494 VanDerWaalsContact O-CB 3.32Å; D491-V494 WeakPolarHBondContact O-CB 3.47Å; D491-V494 PolarHBondContact O-N 3.27Å; D491-L495 PolarHBondContact O-N 2.85Å
492	E	88.9	Confident	92.9	Very high	169 Å²	169	46.6 Å²	46.6	79%	0.79	21%	0.21	S	C	*	.	H	α-helix	trans	-52.4	-34.9	173.9	-66.6	-170.2	162.9	0	0	112	V494 L495 R496	E492-V494 PolarHBondContact O-N 3.03Å; E492-L495 PolarHBondContact O-N 3.29Å; E492-R496 PolarHBondContact O-N 3.32Å
493	A	89.6	Confident	92.9	Very high	25 Å²	25	47.2 Å²	47.2	21%	0.207	21%	0.213	C	C	.	.	H	α-helix	trans	-56.6	-40.1	174.1	0	0	0	0	0	111.5	D491 R497	D491-A493 PolarHBondContact O-N 2.84Å; D491-A493 VanDerWaalsContact O-N 3.13Å; D491-A493 WeakPolarHBondContact OD1-CB 3.44Å; D491-A493 PolarHBondContact OD1-N 3.19Å; A493-R497 WeakPolarHBondContact O-CD 3.27Å; A493-R497 PolarHBondContact O-NH1 2.88Å
494	V	91.2	Very high	92.9	Very high	3 Å²	3	47.2 Å²	47.2	2%	0.018	21%	0.213	C	C	.	.	H	α-helix	trans	-76	-44.6	-178.4	176	0	0	0	0	109.9	L445 L464 L490 D491 E492 R496 R497 F498	L445-V494 HydrophobicContact CB-CB 4.43Å; L445-V494 HydrophobicContact CB-CG1 3.9Å; L445-V494 HydrophobicContact CB-CG2 3.77Å; L445-V494 HydrophobicContact CD1-CG1 3.65Å; L445-V494 HydrophobicContact CD1-CG2 4.2Å; L445-V494 HydrophobicContact CG-CG1 4.42Å; L445-V494 HydrophobicContact CG-CG2 4.39Å; L464-V494 HydrophobicContact CD1-CG2 4.42Å; L464-V494 HydrophobicContact CD2-CG2 4.09Å; L490-V494 HydrophobicContact CD2-CG1 4.34Å; D491-V494 HydrophobicContact CB-CB 4.44Å; D491-V494 HydrophobicContact CB-CG2 3.91Å; D491-V494 WeakPolarHBondContact O-CA 3.39Å; D491-V494 VanDerWaalsContact O-CB 3.32Å; D491-V494 WeakPolarHBondContact O-CB 3.47Å; D491-V494 PolarHBondContact O-N 3.27Å; E492-V494 PolarHBondContact O-N 3.03Å; V494-R496 PolarHBondContact O-N 3.32Å; V494-R497 PolarHBondContact O-N 3.43Å; V494-F498 HydrophobicContact CG1-CD2 3.77Å; V494-F498 HydrophobicContact CG1-CE2 3.61Å; V494-F498 WeakPolarHBondContact O-CD2 3.45Å; V494-F498 PolarHBondContact O-N 3.16Å; V494-F498 VanDerWaalsContact O-N 3.17Å
495	L	92.1	Very high	92.8	Very high	15 Å²	15	48.7 Å²	48.7	8%	0.079	22%	0.223	C	C	.	.	H	α-helix	trans	-56.8	-34.3	174	-63.8	-179.7	0	0	0	112	L377 L490 D491 E492 R497 F498 R501 W605	L377-L495 HydrophobicContact CD2-CD2 4.29Å; L490-L495 HydrophobicContact CB-CD2 3.92Å; L490-L495 HydrophobicContact CB-CG 4.15Å; L490-L495 HydrophobicContact CD1-CD2 3.81Å; D491-L495 PolarHBondContact O-N 2.85Å; E492-L495 PolarHBondContact O-N 3.29Å; L495-R497 VanDerWaalsContact C-N 3.34Å; L495-R497 PolarHBondContact O-N 2.78Å; L495-F498 CarbonylContact O-C 3.57Å; L495-F498 PolarHBondContact O-N 2.92Å; L495-F498 VanDerWaalsContact O-O 3.08Å; L495-R501 PolarHBondContact O-NH2 3.23Å; L495-W605 HydrophobicContact CD1-CZ2 4.1Å; L495-W605 HydrophobicContact CD2-CH2 4.07Å; L495-W605 HydrophobicContact CD2-CZ2 3.71Å
496	R	91.4	Very high	92.8	Very high	170 Å²	170	48.2 Å²	48.2	64%	0.642	22%	0.22	S	C	*	.	H	α-helix	trans	-65.5	-30.3	175.8	-165.3	178.5	74.2	-169.2	5.2	113.9	E492 V494	E492-R496 PolarHBondContact O-N 3.32Å; V494-R496 PolarHBondContact O-N 3.32Å
497	R	92.6	Very high	92.8	Very high	25 Å²	25	42.5 Å²	42.5	9%	0.094	20%	0.2	C	C	.	.	H	α-helix	trans	-83.2	-31.7	177.4	-77.8	76.3	176.9	-174.6	-5	111.9	F467 D468 Q471 A493 V494 L495 I499	F467-R497 HydrophobicContact CD1-CB 3.73Å; F467-R497 HydrophobicContact CD1-CG 4.12Å; F467-R497 HydrophobicContact CE1-CB 3.45Å; F467-R497 VanDerWaalsContact CE1-CB 3.45Å; F467-R497 HydrophobicContact CE1-CG 4.33Å; F467-R497 HydrophobicContact CE2-CB 4.33Å; F467-R497 HydrophobicContact CG-CB 4.31Å; F467-R497 HydrophobicContact CG-CG 4.37Å; F467-R497 HydrophobicContact CZ-CB 3.77Å; D468-R497 VanDerWaalsContact OD1-CG 3.24Å; D468-R497 WeakPolarHBondContact OD1-CG 3.34Å; D468-R497 IonicContact OD1-CZ 3.97Å; D468-R497 IonicContact OD1-NE 2.7Å; D468-R497 PolarHBondContact OD1-NE 2.97Å; D468-R497 IonicContact OD1-NH2 2.64Å; D468-R497 IonicContact OD2-CZ 3.94Å; D468-R497 IonicContact OD2-NE 3.68Å; D468-R497 PolarHBondContact OD2-NE 3.43Å; D468-R497 IonicContact OD2-NH2 3.42Å; D468-R497 PolarHBondContact OD2-NH2 3.02Å; Q471-R497 PolarHBondContact NE2-O 3.3Å; A493-R497 WeakPolarHBondContact O-CD 3.27Å; A493-R497 PolarHBondContact O-NH1 2.88Å; V494-R497 PolarHBondContact O-N 3.43Å; L495-R497 VanDerWaalsContact C-N 3.34Å; L495-R497 PolarHBondContact O-N 2.78Å; R497-I499 PolarHBondContact O-N 3.48Å
498	F	93.9	Very high	92.8	Very high	0 Å²	0	47.7 Å²	47.7	0%	0	23%	0.228	C	C	.	.			trans	-78.3	76	168.2	-67	-59.9	0	0	0	110.6	L376 L377 V441 F467 V480 V494 L495 K500 R501	L376-F498 VanDerWaalsContact C-CD1 3.47Å; L376-F498 VanDerWaalsContact O-CD1 3.27Å; L376-F498 WeakPolarHBondContact O-CD1 3.44Å; L376-F498 WeakPolarHBondContact O-CE1 3.25Å; L377-F498 HydrophobicContact CB-CB 3.87Å; L377-F498 HydrophobicContact CB-CD1 4.17Å; L377-F498 HydrophobicContact CB-CD2 4.42Å; L377-F498 HydrophobicContact CB-CG 3.91Å; L377-F498 HydrophobicContact CD1-CD2 4.33Å; L377-F498 HydrophobicContact CD1-CE2 4.41Å; V441-F498 HydrophobicContact CG2-CE2 4.44Å; V441-F498 HydrophobicContact CG2-CZ 4.44Å; F467-F498 HydrophobicContact CE1-CD1 4.24Å; F467-F498 AromaticContact CE1-CE1 3.89Å; F467-F498 HydrophobicContact CE1-CE1 3.89Å; F467-F498 HydrophobicContact CE1-CE2 4.37Å; F467-F498 AromaticContact CE1-CZ 3.96Å; F467-F498 HydrophobicContact CE1-CZ 3.96Å; F467-F498 HydrophobicContact CZ-CD1 4.08Å; F467-F498 AromaticContact CZ-CE1 3.93Å; F467-F498 HydrophobicContact CZ-CE1 3.93Å; F467-F498 HydrophobicContact CZ-CZ 4.47Å; V480-F498 HydrophobicContact CG1-CE1 4.1Å; V480-F498 HydrophobicContact CG1-CZ 4.38Å; V494-F498 HydrophobicContact CG1-CD2 3.77Å; V494-F498 HydrophobicContact CG1-CE2 3.61Å; V494-F498 WeakPolarHBondContact O-CD2 3.45Å; V494-F498 PolarHBondContact O-N 3.16Å; V494-F498 VanDerWaalsContact O-N 3.17Å; L495-F498 CarbonylContact O-C 3.57Å; L495-F498 PolarHBondContact O-N 2.92Å; L495-F498 VanDerWaalsContact O-O 3.08Å; F498-K500 PolarHBondContact O-N 3.27Å; F498-R501 PolarHBondContact O-NE 3.04Å
499	I	91.2	Very high	93	Very high	88 Å²	88	45.7 Å²	45.7	45%	0.451	22%	0.218	S	C	.	.			trans	-58.1	-38.3	179.9	-60.1	170	0	0	0	110.9	A373 G375 R497	A373-I499 HydrophobicContact CB-CB 4.46Å; G375-I499 PolarHBondContact O-N 3.18Å; R497-I499 PolarHBondContact O-N 3.48Å
500	K	92.8	Very high	93.1	Very high	68 Å²	68	51.3 Å²	51.3	30%	0.296	25%	0.245	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-109.2	133.2	177.6	-70.7	-62.3	-173.5	-178.7	0	112.1	I355 A373 G375 L376 L377 F498 D611	I355-K500 HydrophobicContact CD1-CB 3.98Å; I355-K500 HydrophobicContact CD1-CD 3.99Å; I355-K500 HydrophobicContact CD1-CG 3.78Å; I355-K500 HydrophobicContact CG1-CG 4.35Å; I355-K500 HydrophobicContact CG2-CG 4.36Å; A373-K500 HydrophobicContact CB-CB 4.41Å; A373-K500 HydrophobicContact CB-CG 3.74Å; G375-K500 PolarHBondContact O-N 3.06Å; L376-K500 CarbonylContact C-O 3.58Å; L376-K500 VanDerWaalsContact CA-O 3.26Å; L376-K500 WeakPolarHBondContact CA-O 3.46Å; L376-K500 HydrophobicContact CD1-CB 4.29Å; L376-K500 HydrophobicContact CG-CB 4.32Å; L377-K500 PolarHBondContact N-O 2.96Å; F498-K500 PolarHBondContact O-N 3.27Å; K500-D611 VanDerWaalsContact CA-OD2 3.24Å; K500-D611 WeakPolarHBondContact CA-OD2 3.25Å; K500-D611 VanDerWaalsContact CD-CG 3.43Å; K500-D611 WeakPolarHBondContact CD-OD1 3.46Å; K500-D611 VanDerWaalsContact CD-OD2 3.26Å; K500-D611 WeakPolarHBondContact CD-OD2 3.4Å; K500-D611 WeakPolarHBondContact CE-OD1 3.32Å; K500-D611 IonicContact NZ-OD1 2.77Å; K500-D611 PolarHBondContact NZ-OD1 3.4Å
501	R	95.1	Very high	93.2	Very high	45 Å²	45	51.6 Å²	51.6	17%	0.17	25%	0.247	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-136.6	106.7	-172.5	-61.1	151.1	-169.5	173.8	2.8	108.9	L377 F379 L495 F498 F609 D611	L377-R501 HydrophobicContact CB-CG 4.19Å; L377-R501 HydrophobicContact CD2-CG 4.45Å; L377-R501 CarbonylContact O-C 3.51Å; L377-R501 WeakPolarHBondContact O-CA 3.47Å; F379-R501 HydrophobicContact CD1-CB 4.39Å; F379-R501 HydrophobicContact CE1-CB 4.07Å; L495-R501 PolarHBondContact O-NH2 3.23Å; F498-R501 PolarHBondContact O-NE 3.04Å; R501-F609 WeakPolarHBondContact CD-O 3.29Å; R501-F609 PolarHBondContact NH1-O 3.06Å; R501-D611 PolarHBondContact N-OD2 3.43Å; R501-D611 PolarHBondContact O-N 2.68Å
502	V	95.1	Very high	93.6	Very high	1 Å²	1	50.7 Å²	50.7	1%	0.006	24%	0.241	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-105.5	122.3	-173.9	178.2	0	0	0	0	109.1	A348 A351 L376 L377 L378 F379 T612	A348-V502 HydrophobicContact CB-CG1 3.44Å; A348-V502 VanDerWaalsContact CB-CG1 3.44Å; A351-V502 HydrophobicContact CB-CG2 4.04Å; L376-V502 HydrophobicContact CD1-CG2 4.34Å; L377-V502 PolarHBondContact O-N 2.85Å; L378-V502 HydrophobicContact CD2-CB 4.09Å; L378-V502 HydrophobicContact CD2-CG1 4.4Å; F379-V502 WeakPolarHBondContact CD1-O 3.4Å; F379-V502 PolarHBondContact N-O 3.19Å; F379-V502 VanDerWaalsContact N-O 3.14Å; V502-T612 HydrophobicContact CG1-CG2 4.09Å
503	Y	95.6	Very high	93.9	Very high	12 Å²	12	44 Å²	44	5%	0.047	21%	0.21	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-78.7	131.1	174.2	179.5	-121	0	0	0	110.8	F379 S505 L599 Y602 N606 T612 V614	F379-Y503 AromaticContact CD2-CD2 3.93Å; F379-Y503 HydrophobicContact CD2-CD2 3.93Å; F379-Y503 AromaticContact CE2-CD2 3.56Å; F379-Y503 HydrophobicContact CE2-CD2 3.56Å; F379-Y503 HydrophobicContact CE2-CE2 4.46Å; F379-Y503 HydrophobicContact CE2-CG 4.19Å; F379-Y503 HydrophobicContact CZ-CD2 4.1Å; F379-Y503 HydrophobicContact CZ-CG 4.29Å; Y503-S505 VanDerWaalsContact CE1-CB 3.49Å; Y503-L599 WeakPolarHBondContact OH-CD1 3.31Å; Y503-Y602 HydrophobicContact CE2-CG 4.32Å; Y503-N606 WeakPolarHBondContact CB-OD1 3.41Å; Y503-T612 WeakPolarHBondContact CB-OG1 3.17Å; Y503-T612 PolarHBondContact N-OG1 3.42Å; Y503-V614 HydrophobicContact CD1-CG2 3.58Å; Y503-V614 HydrophobicContact CE1-CG2 4.11Å
504	V	95.6	Very high	94.2	Very high	0 Å²	0	46.1 Å²	46.1	0%	0	22%	0.218	C	C	.	.			trans	-110.4	103.2	174.5	-177.4	0	0	0	0	107.6	Q345 L378 F379 P381 N384 K386 L389	Q345-V504 HydrophobicContact CG-CG1 4.34Å; L378-V504 HydrophobicContact CD2-CG2 4.35Å; F379-V504 PolarHBondContact O-N 3.48Å; P381-V504 WeakPolarHBondContact CD-O 3.3Å; N384-V504 HydrophobicContact CB-CG1 4.01Å; N384-V504 VanDerWaalsContact O-CG1 3.29Å; N384-V504 WeakPolarHBondContact O-CG1 3.45Å; K386-V504 HydrophobicContact CG-CB 4Å; K386-V504 HydrophobicContact CG-CG1 4.14Å; K386-V504 HydrophobicContact CG-CG2 4.04Å; L389-V504 HydrophobicContact CD2-CG2 4.21Å
505	S	93.9	Very high	94.3	Very high	32 Å²	32	47.9 Å²	47.9	22%	0.224	23%	0.227	C	C	.	.			trans	-78.9	178.2	-168.2	65.5	0	0	0	0	113.4	Q345 N384 Y503	Q345-S505 PolarHBondContact NE2-O 3.37Å; Q345-S505 VanDerWaalsContact OE1-N 3.16Å; N384-S505 WeakPolarHBondContact CB-O 3.44Å; Y503-S505 VanDerWaalsContact CE1-CB 3.49Å
506	L	95.1	Very high	94.5	Very high	21 Å²	21	47.2 Å²	47.2	11%	0.11	22%	0.223	C	C	.	.	P	Polyproline II helix	trans	-74.6	150.3	161.7	-70.2	173.2	0	0	0	110.6	P381 L599	P381-L506 HydrophobicContact CB-CD2 4.27Å; P381-L506 HydrophobicContact CG-CD2 4.04Å; P381-L506 HydrophobicContact CG-CG 3.94Å; L506-L599 HydrophobicContact CD1-CD1 3.85Å; L506-L599 HydrophobicContact CD1-CD2 4.02Å; L506-L599 HydrophobicContact CG-CD1 4.19Å
507	P	95.3	Very high	94.6	Very high	7 Å²	7	43.4 Å²	43.4	5%	0.045	21%	0.212	C	C	.	.	P	Polyproline II helix	trans	-70.7	133	-179.1	27.7	-35.3	0	0	0	113.9	T511 R512 L515 Y542 L547	P507-T511 HydrophobicContact CB-CG2 3.69Å; P507-R512 HydrophobicContact CB-CG 3.8Å; P507-R512 HydrophobicContact CG-CG 3.79Å; P507-R512 WeakPolarHBondContact O-CG 3.48Å; P507-R512 PolarHBondContact O-NH1 2.74Å; P507-L515 HydrophobicContact CB-CD1 4.12Å; P507-L515 HydrophobicContact CG-CD1 4.29Å; P507-Y542 WeakPolarHBondContact CD-O 3.46Å; P507-Y542 VanDerWaalsContact CG-O 3.3Å; P507-Y542 WeakPolarHBondContact CG-O 3.46Å; P507-L547 HydrophobicContact CG-CD1 4.46Å
508	N	94.6	Very high	94.6	Very high	111 Å²	111	45.5 Å²	45.5	59%	0.594	23%	0.225	S	C	*	.	P	Polyproline II helix	trans	-68.2	164.2	171.8	-65.1	-5.8	0	0	0	111.6	E510 T511 R512	N508-E510 VanDerWaalsContact C-N 3.29Å; N508-E510 PolarHBondContact O-N 3.05Å; N508-T511 CarbonylContact O-C 3.46Å; N508-T511 WeakPolarHBondContact O-CA 3.46Å; N508-T511 WeakPolarHBondContact O-CB 3.27Å; N508-T511 PolarHBondContact O-N 3.43Å; N508-R512 WeakPolarHBondContact O-CG 3.41Å; N508-R512 PolarHBondContact O-N 3.3Å
509	E	95.8	Very high	94.5	Very high	73 Å²	73	47.9 Å²	47.9	34%	0.341	24%	0.237	S	C	.	.	H	α-helix	trans	-49	-46.8	-178.3	-176.1	174	144.2	0	0	112.8	T511 R512 L513 A536 R537	E509-T511 PolarHBondContact O-N 3.4Å; E509-R512 PolarHBondContact O-N 3.13Å; E509-L513 PolarHBondContact O-N 2.65Å; E509-A536 HydrophobicContact CG-CB 3.83Å; E509-A536 WeakPolarHBondContact O-CB 3.37Å; E509-R537 VanDerWaalsContact CD-CG 3.44Å; E509-R537 HydrophobicContact CG-CG 4.34Å; E509-R537 WeakPolarHBondContact OE1-CG 3.29Å; E509-R537 IonicContact OE1-CZ 3.48Å; E509-R537 IonicContact OE1-NE 2.77Å; E509-R537 PolarHBondContact OE1-NE 2.9Å; E509-R537 IonicContact OE1-NH2 3.26Å; E509-R537 PolarHBondContact OE1-NH2 2.83Å; E509-R537 WeakPolarHBondContact OE2-CG 3.49Å; E509-R537 IonicContact OE2-NE 3.74Å
510	E	94.9	Very high	94.6	Very high	169 Å²	169	44 Å²	44	79%	0.79	22%	0.217	S	C	*	.	H	α-helix	trans	-62.8	-42.2	177.4	-58.4	-176.7	165.7	0	0	112.5	N508 L513 L514	N508-E510 VanDerWaalsContact C-N 3.29Å; N508-E510 PolarHBondContact O-N 3.05Å; E510-L513 WeakPolarHBondContact O-CB 3.23Å; E510-L513 PolarHBondContact O-N 2.73Å; E510-L514 PolarHBondContact O-N 2.78Å
511	T	95.6	Very high	94.5	Very high	18 Å²	18	43.9 Å²	43.9	11%	0.11	22%	0.224	C	C	.	.	H	α-helix	trans	-65.1	-40.1	175.6	-42.6	0	0	0	0	111.5	A343 P507 N508 E509 L514 L515	A343-T511 HydrophobicContact CB-CG2 4.04Å; A343-T511 WeakPolarHBondContact O-CG2 3.43Å; P507-T511 HydrophobicContact CB-CG2 3.69Å; N508-T511 CarbonylContact O-C 3.46Å; N508-T511 WeakPolarHBondContact O-CA 3.46Å; N508-T511 WeakPolarHBondContact O-CB 3.27Å; N508-T511 PolarHBondContact O-N 3.43Å; E509-T511 PolarHBondContact O-N 3.4Å; T511-L514 PolarHBondContact O-N 3.11Å; T511-L515 HydrophobicContact CG2-CD1 4.37Å; T511-L515 WeakPolarHBondContact O-CB 3.42Å; T511-L515 VanDerWaalsContact O-CG 3.31Å; T511-L515 WeakPolarHBondContact O-CG 3.26Å; T511-L515 PolarHBondContact O-N 3.46Å
512	R	96.3	Very high	94	Very high	13 Å²	13	50.3 Å²	50.3	5%	0.049	25%	0.254	C	S	.	.	H	α-helix	trans	-64.9	-41	175.8	-62.9	-166.9	-65	-110.3	15.4	111.3	P507 N508 E509 L515 L516 A536 T539 D540 L547	P507-R512 HydrophobicContact CB-CG 3.8Å; P507-R512 HydrophobicContact CG-CG 3.79Å; P507-R512 WeakPolarHBondContact O-CG 3.48Å; P507-R512 PolarHBondContact O-NH1 2.74Å; N508-R512 WeakPolarHBondContact O-CG 3.41Å; N508-R512 PolarHBondContact O-N 3.3Å; E509-R512 PolarHBondContact O-N 3.13Å; R512-L515 PolarHBondContact O-N 3.28Å; R512-L516 WeakPolarHBondContact O-CB 3.46Å; R512-L516 VanDerWaalsContact O-CG 3.3Å; R512-L516 WeakPolarHBondContact O-CG 3.45Å; R512-L516 PolarHBondContact O-N 3.4Å; R512-A536 HydrophobicContact CB-CB 4.22Å; R512-A536 PolarHBondContact NE-O 3.03Å; R512-A536 PolarHBondContact NH2-O 3.25Å; R512-T539 VanDerWaalsContact CD-O 3.3Å; R512-T539 WeakPolarHBondContact CD-O 3.4Å; R512-T539 PolarHBondContact NE-O 2.71Å; R512-D540 IonicContact CZ-OD1 3.3Å; R512-D540 VanDerWaalsContact CZ-OD1 3.3Å; R512-D540 IonicContact NH1-OD1 2.94Å; R512-D540 PolarHBondContact NH1-OD1 3.43Å; R512-D540 IonicContact NH2-OD1 2.7Å; R512-D540 PolarHBondContact NH2-OD1 2.94Å; R512-L547 HydrophobicContact CB-CD1 3.99Å; R512-L547 HydrophobicContact CG-CD1 3.92Å
513	L	95.6	Very high	93.6	Very high	27 Å²	27	56.1 Å²	56.1	14%	0.141	28%	0.28	C	S	.	.	H	α-helix	trans	-59.8	-49.7	173.2	-164.6	164.3	0	0	0	110.7	E509 E510 L515 L516 K517 L532 A533 A536	E509-L513 PolarHBondContact O-N 2.65Å; E510-L513 WeakPolarHBondContact O-CB 3.23Å; E510-L513 PolarHBondContact O-N 2.73Å; L513-L515 PolarHBondContact O-N 3.29Å; L513-L516 PolarHBondContact O-N 2.93Å; L513-K517 WeakPolarHBondContact O-CB 3.24Å; L513-K517 PolarHBondContact O-N 3.46Å; L513-L532 HydrophobicContact CD2-CB 4.32Å; L513-L532 HydrophobicContact CG-CB 4.15Å; L513-A533 HydrophobicContact CD1-CB 3.94Å; L513-A536 HydrophobicContact CB-CB 3.98Å
514	L	94.6	Very high	93	Very high	71 Å²	71	58.7 Å²	58.7	37%	0.372	31%	0.311	S	S	.	.	H	α-helix	trans	-61.7	-41.5	179	-176.9	58.6	0	0	0	112.4	A343 E510 T511 K517 N518	A343-L514 HydrophobicContact CB-CB 4.35Å; A343-L514 HydrophobicContact CB-CD2 3.84Å; A343-L514 HydrophobicContact CB-CG 3.98Å; E510-L514 PolarHBondContact O-N 2.78Å; T511-L514 PolarHBondContact O-N 3.11Å; L514-K517 PolarHBondContact O-N 3.43Å; L514-N518 WeakPolarHBondContact O-CB 3.43Å; L514-N518 PolarHBondContact O-N 3.4Å; L514-N518 PolarHBondContact O-OD1 3.36Å
515	L	94.3	Very high	92.6	Very high	40 Å²	40	61.3 Å²	61.3	21%	0.209	33%	0.329	C	S	.	.	H	α-helix	trans	-61.2	-49.7	174	-75.3	168.7	0	0	0	111.9	A343 P507 T511 R512 L513 K517 N518 L519 L547	A343-L515 HydrophobicContact CB-CD2 3.69Å; A343-L515 HydrophobicContact CB-CG 3.73Å; P507-L515 HydrophobicContact CB-CD1 4.12Å; P507-L515 HydrophobicContact CG-CD1 4.29Å; T511-L515 HydrophobicContact CG2-CD1 4.37Å; T511-L515 WeakPolarHBondContact O-CB 3.42Å; T511-L515 VanDerWaalsContact O-CG 3.31Å; T511-L515 WeakPolarHBondContact O-CG 3.26Å; T511-L515 PolarHBondContact O-N 3.46Å; R512-L515 PolarHBondContact O-N 3.28Å; L513-L515 PolarHBondContact O-N 3.29Å; L515-K517 VanDerWaalsContact C-N 3.32Å; L515-K517 PolarHBondContact O-N 3.21Å; L515-N518 PolarHBondContact O-N 2.9Å; L515-L519 WeakPolarHBondContact O-CB 3.49Å; L515-L519 VanDerWaalsContact O-CG 3.25Å; L515-L519 WeakPolarHBondContact O-CG 3.48Å; L515-L519 PolarHBondContact O-N 3.14Å; L515-L547 HydrophobicContact CB-CD1 4.11Å; L515-L547 HydrophobicContact CD1-CD1 3.82Å
516	L	94.9	Very high	92.3	Very high	0 Å²	0	61.6 Å²	61.6	0%	0	33%	0.33	C	S	.	.	H	α-helix	trans	-60.6	-41.7	178.1	-73	168.6	0	0	0	111.8	R512 L513 L520 L532 L535 L547 F583	R512-L516 WeakPolarHBondContact O-CB 3.46Å; R512-L516 VanDerWaalsContact O-CG 3.3Å; R512-L516 WeakPolarHBondContact O-CG 3.45Å; R512-L516 PolarHBondContact O-N 3.4Å; L513-L516 PolarHBondContact O-N 2.93Å; L516-L520 WeakPolarHBondContact O-CB 3.37Å; L516-L520 WeakPolarHBondContact O-CG 3.48Å; L516-L520 PolarHBondContact O-N 3.27Å; L516-L532 HydrophobicContact CB-CD2 4.2Å; L516-L535 HydrophobicContact CD1-CB 3.74Å; L516-L547 HydrophobicContact CD2-CD2 4.27Å; L516-L547 HydrophobicContact CG-CD2 4.38Å; L516-F583 HydrophobicContact CD2-CE1 4.06Å
517	K	94.2	Very high	92.2	Very high	91 Å²	91	61.2 Å²	61.2	40%	0.396	33%	0.328	S	S	.	.	H	α-helix	trans	-59.6	-52.6	174.1	-174.6	178.7	178.4	180	0	111.4	L513 L514 L515 L519 L520 C521 L532	L513-K517 WeakPolarHBondContact O-CB 3.24Å; L513-K517 PolarHBondContact O-N 3.46Å; L514-K517 PolarHBondContact O-N 3.43Å; L515-K517 VanDerWaalsContact C-N 3.32Å; L515-K517 PolarHBondContact O-N 3.21Å; K517-L519 VanDerWaalsContact C-N 3.31Å; K517-L519 PolarHBondContact O-N 3.37Å; K517-L520 CarbonylContact O-C 3.6Å; K517-L520 PolarHBondContact O-N 2.85Å; K517-L520 VanDerWaalsContact O-N 3.12Å; K517-C521 PolarHBondContact O-N 2.92Å; K517-C521 PolarHBondContact O-SG 3.26Å; K517-L532 HydrophobicContact CB-CD1 4.16Å; K517-L532 HydrophobicContact CG-CD1 4.38Å
518	N	92.4	Very high	92.2	Very high	68 Å²	68	64.7 Å²	64.7	36%	0.364	35%	0.35	S	S	.	.	H	α-helix	trans	-65	-33.2	-177.4	-69.9	0.4	0	0	0	112.7	L514 L515	L514-N518 WeakPolarHBondContact O-CB 3.43Å; L514-N518 PolarHBondContact O-N 3.4Å; L514-N518 PolarHBondContact O-OD1 3.36Å; L515-N518 PolarHBondContact O-N 2.9Å
519	L	92.4	Very high	92.1	Very high	50 Å²	50	64.6 Å²	64.6	26%	0.262	35%	0.346	S	S	.	.	H	α-helix	trans	-65.5	-44.6	171.5	-72.6	166.2	0	0	0	111.6	L515 K517 T548 A551	L515-L519 WeakPolarHBondContact O-CB 3.49Å; L515-L519 VanDerWaalsContact O-CG 3.25Å; L515-L519 WeakPolarHBondContact O-CG 3.48Å; L515-L519 PolarHBondContact O-N 3.14Å; K517-L519 VanDerWaalsContact C-N 3.31Å; K517-L519 PolarHBondContact O-N 3.37Å; L519-T548 HydrophobicContact CD2-CG2 4.24Å; L519-A551 HydrophobicContact CB-CB 4.37Å; L519-A551 HydrophobicContact CD1-CB 4.03Å
520	L	92.6	Very high	92.1	Very high	6 Å²	6	69.9 Å²	69.9	3%	0.031	37%	0.367	C	S	.	.	H	α-helix	trans	-78.9	-20	-177.2	-74	167.6	0	0	0	114.4	L516 K517 K522 Q523 G524 S525 P526 L527 L532 I578 F583	L516-L520 WeakPolarHBondContact O-CB 3.37Å; L516-L520 WeakPolarHBondContact O-CG 3.48Å; L516-L520 PolarHBondContact O-N 3.27Å; K517-L520 CarbonylContact O-C 3.6Å; K517-L520 PolarHBondContact O-N 2.85Å; K517-L520 VanDerWaalsContact O-N 3.12Å; L520-K522 PolarHBondContact O-N 3.31Å; L520-K522 VanDerWaalsContact O-N 3.16Å; L520-Q523 CarbonylContact O-C 3.5Å; L520-Q523 WeakPolarHBondContact O-CA 3.47Å; L520-Q523 PolarHBondContact O-N 2.9Å; L520-G524 PolarHBondContact O-N 3.05Å; L520-S525 PolarHBondContact O-N 3.03Å; L520-P526 HydrophobicContact CD2-CG 4.33Å; L520-L527 HydrophobicContact CD1-CB 4.44Å; L520-L527 HydrophobicContact CD1-CD1 3.82Å; L520-L527 HydrophobicContact CD1-CG 4.11Å; L520-L532 HydrophobicContact CD1-CD2 3.71Å; L520-I578 HydrophobicContact CD2-CD1 4Å; L520-F583 HydrophobicContact CD1-CE2 4.24Å; L520-F583 HydrophobicContact CD1-CZ 4Å; L520-F583 HydrophobicContact CD2-CE2 4.28Å; L520-F583 HydrophobicContact CD2-CZ 4.13Å; L520-F583 HydrophobicContact CG-CZ 4.39Å
521	C	90.7	Very high	92.1	Very high	66 Å²	66	64.1 Å²	64.1	45%	0.446	34%	0.34	S	S	.	.	G	3₁₀ helix	trans	-54.7	-31.2	170.8	-76.3	0	0	0	0	112.7	K517 Q523 G524 S525	K517-C521 PolarHBondContact O-N 2.92Å; K517-C521 PolarHBondContact O-SG 3.26Å; C521-Q523 PolarHBondContact O-N 3.06Å; C521-G524 PolarHBondContact O-N 3.38Å; C521-S525 WeakPolarHBondContact CA-OG 3.5Å; C521-S525 PolarHBondContact SG-OG 3.39Å
522	K	85.3	Confident	92.1	Very high	181 Å²	181	63.6 Å²	63.6	79%	0.787	34%	0.337	S	S	*	.	G	3₁₀ helix	trans	-71.6	-9.3	176	-59.9	-174.2	-179.1	-177.6	0	114	L520	L520-K522 PolarHBondContact O-N 3.31Å; L520-K522 VanDerWaalsContact O-N 3.16Å
523	Q	85.4	Confident	92.1	Very high	122 Å²	122	64.1 Å²	64.1	57%	0.57	34%	0.344	S	S	*	.	G	3₁₀ helix	trans	-120.9	23.1	178.8	-60	-62.6	-20.5	0	0	111.4	L520 C521 S525 I578	L520-Q523 CarbonylContact O-C 3.5Å; L520-Q523 WeakPolarHBondContact O-CA 3.47Å; L520-Q523 PolarHBondContact O-N 2.9Å; C521-Q523 PolarHBondContact O-N 3.06Å; Q523-S525 PolarHBondContact O-N 2.91Å; Q523-I578 HydrophobicContact CB-CD1 4.35Å; Q523-I578 HydrophobicContact CG-CD1 4.25Å
524	G	84.1	Confident	92.1	Very high	67 Å²	67	67.3 Å²	67.3	69%	0.691	36%	0.358	S	S	*	.	T	Hydrogen-bonded Turn	trans	77.2	13.5	178.5	0	0	0	0	0	115.6	L520 C521	L520-G524 PolarHBondContact O-N 3.05Å; C521-G524 PolarHBondContact O-N 3.38Å
525	S	86.9	Confident	92.2	Very high	55 Å²	55	64 Å²	64	39%	0.385	34%	0.341	S	S	.	.			trans	52.5	60.9	-179.5	-63.6	0	0	0	0	114.3	L520 C521 Q523 L527	L520-S525 PolarHBondContact O-N 3.03Å; C521-S525 WeakPolarHBondContact CA-OG 3.5Å; C521-S525 PolarHBondContact SG-OG 3.39Å; Q523-S525 PolarHBondContact O-N 2.91Å; S525-L527 VanDerWaalsContact C-N 3.26Å; S525-L527 PolarHBondContact O-N 3.44Å
526	P	87.9	Confident	92.3	Very high	38 Å²	38	62 Å²	62	25%	0.247	33%	0.331	C	S	.	.			trans	-74.7	-7.8	-171.1	32.1	-37.5	0	0	0	114.9	L520 N577 I578	L520-P526 HydrophobicContact CD2-CG 4.33Å; P526-N577 HydrophobicContact CB-CB 4.08Å; P526-I578 HydrophobicContact CG-CB 4.06Å
527	L	92.4	Very high	92.3	Very high	13 Å²	13	70 Å²	70	7%	0.068	36%	0.361	C	S	.	.	S	Bend	trans	-104.5	142.7	178.5	-59.9	-172.1	0	0	0	111.6	L520 S525 E531 L532 L535 F583	L520-L527 HydrophobicContact CD1-CB 4.44Å; L520-L527 HydrophobicContact CD1-CD1 3.82Å; L520-L527 HydrophobicContact CD1-CG 4.11Å; S525-L527 VanDerWaalsContact C-N 3.26Å; S525-L527 PolarHBondContact O-N 3.44Å; L527-E531 HydrophobicContact CB-CB 4.32Å; L527-L532 HydrophobicContact CB-CD2 4.1Å; L527-L532 HydrophobicContact CB-CG 4.29Å; L527-L532 HydrophobicContact CD1-CD2 4.22Å; L527-L535 HydrophobicContact CD1-CD1 3.65Å; L527-F583 HydrophobicContact CD1-CD2 3.9Å; L527-F583 HydrophobicContact CD1-CE2 3.72Å
528	T	94.4	Very high	92.4	Very high	80 Å²	80	69.6 Å²	69.6	49%	0.491	36%	0.361	S	S	.	.			trans	-72.9	157.5	174.9	67.7	0	0	0	0	112.2	K530 E531 L532	T528-K530 PolarHBondContact O-N 3.31Å; T528-K530 VanDerWaalsContact O-N 3.09Å; T528-E531 VanDerWaalsContact CB-OE2 3.29Å; T528-E531 WeakPolarHBondContact CB-OE2 3.28Å; T528-E531 WeakPolarHBondContact CG2-OE2 3.45Å; T528-E531 PolarHBondContact N-OE2 3.09Å; T528-E531 PolarHBondContact O-N 3.12Å; T528-E531 WeakPolarHBondContact OG1-CG 3.46Å; T528-E531 PolarHBondContact OG1-N 3.02Å; T528-E531 PolarHBondContact OG1-OE2 2.9Å; T528-L532 WeakPolarHBondContact O-CG 3.37Å; T528-L532 PolarHBondContact O-N 3.36Å
529	Q	93.3	Very high	92.6	Very high	109 Å²	109	66.4 Å²	66.4	51%	0.509	34%	0.344	S	S	.	.	H	α-helix	trans	-55.1	-29.5	176.1	-174.8	66.5	18.1	0	0	113.3	A533	Q529-A533 PolarHBondContact O-N 3.18Å; Q529-A533 VanDerWaalsContact O-N 3.11Å
530	K	94.9	Very high	92.7	Very high	183 Å²	183	67.9 Å²	67.9	80%	0.796	35%	0.353	S	S	*	.	H	α-helix	trans	-70.6	-43.2	176.3	-67.7	-175.4	178.9	-179.1	0	111.8	T528 A533 Q534	T528-K530 PolarHBondContact O-N 3.31Å; T528-K530 VanDerWaalsContact O-N 3.09Å; K530-A533 PolarHBondContact O-N 3.45Å; K530-Q534 PolarHBondContact O-N 3.48Å
531	E	95.2	Very high	92.8	Very high	48 Å²	48	68.1 Å²	68.1	22%	0.224	36%	0.356	C	S	.	.	H	α-helix	trans	-67.1	-38.9	176.5	-65.4	164.5	102.9	0	0	111.3	L527 T528 A533 Q534 L535 L580	L527-E531 HydrophobicContact CB-CB 4.32Å; T528-E531 VanDerWaalsContact CB-OE2 3.29Å; T528-E531 WeakPolarHBondContact CB-OE2 3.28Å; T528-E531 WeakPolarHBondContact CG2-OE2 3.45Å; T528-E531 PolarHBondContact N-OE2 3.09Å; T528-E531 PolarHBondContact O-N 3.12Å; T528-E531 WeakPolarHBondContact OG1-CG 3.46Å; T528-E531 PolarHBondContact OG1-N 3.02Å; T528-E531 PolarHBondContact OG1-OE2 2.9Å; E531-A533 PolarHBondContact O-N 2.62Å; E531-Q534 PolarHBondContact O-N 3.23Å; E531-L535 WeakPolarHBondContact O-CG 3.5Å; E531-L535 PolarHBondContact O-N 2.9Å; E531-L580 HydrophobicContact CB-CD1 4.41Å; E531-L580 HydrophobicContact CG-CB 4.45Å; E531-L580 HydrophobicContact CG-CD2 4.19Å
532	L	95.6	Very high	93.1	Very high	8 Å²	8	65.7 Å²	65.7	4%	0.042	34%	0.338	C	S	.	.	H	α-helix	trans	-62	-41.1	173.8	-65.1	176.2	0	0	0	112.2	L513 L516 K517 L520 L527 T528 L535 A536	L513-L532 HydrophobicContact CD2-CB 4.32Å; L513-L532 HydrophobicContact CG-CB 4.15Å; L516-L532 HydrophobicContact CB-CD2 4.2Å; K517-L532 HydrophobicContact CB-CD1 4.16Å; K517-L532 HydrophobicContact CG-CD1 4.38Å; L520-L532 HydrophobicContact CD1-CD2 3.71Å; L527-L532 HydrophobicContact CB-CD2 4.1Å; L527-L532 HydrophobicContact CB-CG 4.29Å; L527-L532 HydrophobicContact CD1-CD2 4.22Å; T528-L532 WeakPolarHBondContact O-CG 3.37Å; T528-L532 PolarHBondContact O-N 3.36Å; L532-L535 PolarHBondContact O-N 3Å; L532-A536 WeakPolarHBondContact O-CB 3.33Å; L532-A536 PolarHBondContact O-N 3.46Å
533	A	96	Very high	93.6	Very high	24 Å²	24	57 Å²	57	20%	0.198	30%	0.3	C	S	.	.	H	α-helix	trans	-66.6	-39.7	174.4	0	0	0	0	0	112.4	L513 Q529 K530 E531 A536 R537	L513-A533 HydrophobicContact CD1-CB 3.94Å; Q529-A533 PolarHBondContact O-N 3.18Å; Q529-A533 VanDerWaalsContact O-N 3.11Å; K530-A533 PolarHBondContact O-N 3.45Å; E531-A533 PolarHBondContact O-N 2.62Å; A533-A536 PolarHBondContact O-N 3.04Å; A533-R537 PolarHBondContact O-N 3.48Å
534	Q	96.2	Very high	94	Very high	94 Å²	94	51.9 Å²	51.9	44%	0.439	28%	0.28	S	S	.	.	H	α-helix	trans	-60.7	-44.8	173.1	-179.9	176.4	-15.4	0	0	111.5	K530 E531 R537 M538	K530-Q534 PolarHBondContact O-N 3.48Å; E531-Q534 PolarHBondContact O-N 3.23Å; Q534-R537 PolarHBondContact O-N 3.28Å; Q534-M538 HydrophobicContact CG-SD 3.88Å; Q534-M538 WeakPolarHBondContact O-CG 3.25Å; Q534-M538 PolarHBondContact O-N 3.06Å
535	L	96.3	Very high	94.5	Very high	0 Å²	0	51.9 Å²	51.9	0%	0	27%	0.269	C	S	.	.	H	α-helix	trans	-64.2	-39.2	176	-71.8	174.4	0	0	0	112.5	L516 L527 E531 L532 R537 M538 T539 L580 F583 L587	L516-L535 HydrophobicContact CD1-CB 3.74Å; L527-L535 HydrophobicContact CD1-CD1 3.65Å; E531-L535 WeakPolarHBondContact O-CG 3.5Å; E531-L535 PolarHBondContact O-N 2.9Å; L532-L535 PolarHBondContact O-N 3Å; L535-R537 PolarHBondContact O-N 3.1Å; L535-M538 PolarHBondContact O-N 2.94Å; L535-T539 WeakPolarHBondContact O-CB 3.21Å; L535-T539 WeakPolarHBondContact O-CG2 3.31Å; L535-T539 PolarHBondContact O-N 2.89Å; L535-T539 PolarHBondContact O-OG1 2.91Å; L535-L580 HydrophobicContact CD1-CD1 4.03Å; L535-L580 HydrophobicContact CD2-CD1 3.68Å; L535-L580 HydrophobicContact CG-CD1 3.67Å; L535-F583 HydrophobicContact CD1-CB 4.02Å; L535-F583 HydrophobicContact CD1-CD1 3.86Å; L535-F583 HydrophobicContact CD1-CD2 4.01Å; L535-F583 HydrophobicContact CD1-CE1 4.31Å; L535-F583 HydrophobicContact CD1-CE2 4.45Å; L535-F583 HydrophobicContact CD1-CG 3.7Å; L535-F583 HydrophobicContact CD2-CB 3.58Å; L535-F583 HydrophobicContact CD2-CD1 4.3Å; L535-F583 HydrophobicContact CD2-CG 4.12Å; L535-F583 HydrophobicContact CG-CB 4.47Å; L535-L587 HydrophobicContact CD2-CD1 4.35Å
536	A	96.4	Very high	95	Very high	0 Å²	0	50 Å²	50	0%	0	26%	0.255	C	S	.	.	H	α-helix	trans	-60.9	-31.9	176.5	0	0	0	0	0	113.1	E509 R512 L513 L532 A533 T539	E509-A536 HydrophobicContact CG-CB 3.83Å; E509-A536 WeakPolarHBondContact O-CB 3.37Å; R512-A536 HydrophobicContact CB-CB 4.22Å; R512-A536 PolarHBondContact NE-O 3.03Å; R512-A536 PolarHBondContact NH2-O 3.25Å; L513-A536 HydrophobicContact CB-CB 3.98Å; L532-A536 WeakPolarHBondContact O-CB 3.33Å; L532-A536 PolarHBondContact O-N 3.46Å; A533-A536 PolarHBondContact O-N 3.04Å; A536-T539 WeakPolarHBondContact CA-OG1 3.32Å; A536-T539 PolarHBondContact O-OG1 3.46Å
537	R	96.2	Very high	95.4	Very high	166 Å²	166	48.1 Å²	48.1	63%	0.626	24%	0.243	S	C	*	.	H	α-helix	trans	-74.7	-44.8	172.3	-69.1	170.2	-173.5	-174.5	-0.2	112.7	E509 A533 Q534 L535 T539	E509-R537 VanDerWaalsContact CD-CG 3.44Å; E509-R537 HydrophobicContact CG-CG 4.34Å; E509-R537 WeakPolarHBondContact OE1-CG 3.29Å; E509-R537 IonicContact OE1-CZ 3.48Å; E509-R537 IonicContact OE1-NE 2.77Å; E509-R537 PolarHBondContact OE1-NE 2.9Å; E509-R537 IonicContact OE1-NH2 3.26Å; E509-R537 PolarHBondContact OE1-NH2 2.83Å; E509-R537 WeakPolarHBondContact OE2-CG 3.49Å; E509-R537 IonicContact OE2-NE 3.74Å; A533-R537 PolarHBondContact O-N 3.48Å; Q534-R537 PolarHBondContact O-N 3.28Å; L535-R537 PolarHBondContact O-N 3.1Å; R537-T539 PolarHBondContact O-N 3.08Å
538	M	95.5	Very high	95.6	Very high	84 Å²	84	49.7 Å²	49.7	41%	0.414	25%	0.253	S	S	.	.	H	α-helix	trans	-68.3	-21	179.9	-66.5	173.8	76.1	0	0	113.3	Q534 L535 L587	Q534-M538 HydrophobicContact CG-SD 3.88Å; Q534-M538 WeakPolarHBondContact O-CG 3.25Å; Q534-M538 PolarHBondContact O-N 3.06Å; L535-M538 PolarHBondContact O-N 2.94Å; M538-L587 HydrophobicContact CB-CD1 3.94Å; M538-L587 HydrophobicContact CE-CD1 3.83Å; M538-L587 HydrophobicContact SD-CD1 4.48Å
539	T	96.4	Very high	95.7	Very high	0 Å²	0	47.8 Å²	47.8	0%	0	25%	0.245	C	C	.	.	T	Hydrogen-bonded Turn	trans	-96.3	29.4	-179.6	51.8	0	0	0	0	113.7	R512 L535 A536 R537 G541 Y542 L547 L550 L587	R512-T539 VanDerWaalsContact CD-O 3.3Å; R512-T539 WeakPolarHBondContact CD-O 3.4Å; R512-T539 PolarHBondContact NE-O 2.71Å; L535-T539 WeakPolarHBondContact O-CB 3.21Å; L535-T539 WeakPolarHBondContact O-CG2 3.31Å; L535-T539 PolarHBondContact O-N 2.89Å; L535-T539 PolarHBondContact O-OG1 2.91Å; A536-T539 WeakPolarHBondContact CA-OG1 3.32Å; A536-T539 PolarHBondContact O-OG1 3.46Å; R537-T539 PolarHBondContact O-N 3.08Å; T539-G541 PolarHBondContact O-N 3.44Å; T539-Y542 HydrophobicContact CG2-CD2 4.34Å; T539-Y542 HydrophobicContact CG2-CG 4.42Å; T539-Y542 VanDerWaalsContact O-CB 3.29Å; T539-Y542 WeakPolarHBondContact O-CB 3.47Å; T539-Y542 WeakPolarHBondContact O-CD1 3.44Å; T539-Y542 PolarHBondContact O-N 2.86Å; T539-L547 HydrophobicContact CG2-CD2 3.69Å; T539-L550 HydrophobicContact CG2-CD2 3.5Å; T539-L587 HydrophobicContact CG2-CD2 3.97Å
540	D	95.3	Very high	95.9	Very high	82 Å²	82	42.6 Å²	42.6	44%	0.439	22%	0.221	S	C	.	.	T	Hydrogen-bonded Turn	trans	-63.4	137.8	178.7	-168.8	64.2	0	0	0	113.5	R512 Y542 R592	R512-D540 IonicContact CZ-OD1 3.3Å; R512-D540 VanDerWaalsContact CZ-OD1 3.3Å; R512-D540 IonicContact NH1-OD1 2.94Å; R512-D540 PolarHBondContact NH1-OD1 3.43Å; R512-D540 IonicContact NH2-OD1 2.7Å; R512-D540 PolarHBondContact NH2-OD1 2.94Å; D540-Y542 VanDerWaalsContact C-N 3.29Å; D540-Y542 WeakPolarHBondContact O-CD1 3.31Å; D540-Y542 PolarHBondContact O-N 2.86Å; D540-R592 PolarHBondContact O-NE 3.15Å; D540-R592 PolarHBondContact O-NH2 3.33Å
541	G	93.9	Very high	95.9	Very high	11 Å²	11	34.4 Å²	34.4	11%	0.113	19%	0.187	C	C	.	.	T	Hydrogen-bonded Turn	trans	73	8.8	-173.9	0	0	0	0	0	115.9	T539 R592	T539-G541 PolarHBondContact O-N 3.44Å; G541-R592 WeakPolarHBondContact O-CB 3.23Å
542	Y	96.6	Very high	95.9	Very high	14 Å²	14	38.9 Å²	38.9	6%	0.055	21%	0.206	C	C	.	.			trans	-81.6	137.8	176.5	-77.3	55.6	0	0	0	110.9	P507 T539 D540 D546 L587 I590 R592	P507-Y542 WeakPolarHBondContact CD-O 3.46Å; P507-Y542 VanDerWaalsContact CG-O 3.3Å; P507-Y542 WeakPolarHBondContact CG-O 3.46Å; T539-Y542 HydrophobicContact CG2-CD2 4.34Å; T539-Y542 HydrophobicContact CG2-CG 4.42Å; T539-Y542 VanDerWaalsContact O-CB 3.29Å; T539-Y542 WeakPolarHBondContact O-CB 3.47Å; T539-Y542 WeakPolarHBondContact O-CD1 3.44Å; T539-Y542 PolarHBondContact O-N 2.86Å; D540-Y542 VanDerWaalsContact C-N 3.29Å; D540-Y542 WeakPolarHBondContact O-CD1 3.31Å; D540-Y542 PolarHBondContact O-N 2.86Å; Y542-D546 HydrophobicContact CD2-CB 3.55Å; Y542-D546 HydrophobicContact CE2-CB 4.42Å; Y542-D546 HydrophobicContact CG-CB 4.08Å; Y542-L587 HydrophobicContact CE2-CD2 4.13Å; Y542-L587 WeakPolarHBondContact OH-CD2 3.36Å; Y542-I590 HydrophobicContact CE2-CG2 4.31Å; Y542-I590 PolarHBondContact OH-O 3.03Å; Y542-R592 HydrophobicContact CD1-CB 4.08Å; Y542-R592 HydrophobicContact CE1-CB 4.24Å
543	S	96.3	Very high	95.9	Very high	0 Å²	0	39.6 Å²	39.6	0%	0	21%	0.21	C	C	.	.			trans	-75.9	167.7	169.1	67.6	0	0	0	0	112.2	P382 N384 S545 D546 L547	P382-S543 WeakPolarHBondContact O-CB 3.4Å; N384-S543 WeakPolarHBondContact OD1-CA 3.3Å; N384-S543 WeakPolarHBondContact OD1-CB 3.4Å; S543-S545 PolarHBondContact O-N 3.45Å; S543-D546 WeakPolarHBondContact CB-OD2 3.32Å; S543-D546 PolarHBondContact N-OD2 3.13Å; S543-D546 PolarHBondContact O-N 3Å; S543-D546 VanDerWaalsContact O-N 3.07Å; S543-D546 PolarHBondContact OG-N 3.07Å; S543-D546 VanDerWaalsContact OG-N 3.12Å; S543-D546 PolarHBondContact OG-OD1 3.22Å; S543-D546 PolarHBondContact OG-OD2 3.34Å; S543-L547 WeakPolarHBondContact O-CG 3.47Å; S543-L547 PolarHBondContact O-N 3.35Å
544	G	94.8	Very high	95.9	Very high	14 Å²	14	38.5 Å²	38.5	14%	0.144	20%	0.201	C	C	.	.	H	α-helix	trans	-57.8	-35.6	171.8	0	0	0	0	0	113.4	G383 N384 T548	G383-G544 CarbonylContact O-C 3.59Å; G383-G544 VanDerWaalsContact O-CA 3.29Å; G383-G544 WeakPolarHBondContact O-CA 3.33Å; G383-G544 PolarHBondContact O-N 3.21Å; N384-G544 PolarHBondContact OD1-N 2.95Å; G544-T548 WeakPolarHBondContact O-CB 3.26Å; G544-T548 PolarHBondContact O-N 3.39Å; G544-T548 PolarHBondContact O-OG1 2.91Å
545	S	95.1	Very high	95.8	Very high	66 Å²	66	35.5 Å²	35.5	46%	0.462	19%	0.192	S	C	.	.	H	α-helix	trans	-64.9	-43.3	170.7	-74.7	0	0	0	0	112.7	G383 S543 T548 A549	G383-S545 WeakPolarHBondContact CA-OG 3.35Å; G383-S545 PolarHBondContact O-N 3.43Å; S543-S545 PolarHBondContact O-N 3.45Å; S545-T548 PolarHBondContact O-N 3.22Å; S545-A549 WeakPolarHBondContact O-CB 3.41Å; S545-A549 PolarHBondContact O-N 3.15Å
546	D	96.8	Very high	95.7	Very high	15 Å²	15	39.4 Å²	39.4	8%	0.08	21%	0.213	C	C	.	.	H	α-helix	trans	-65.8	-40.1	179.9	-54.4	-34.1	0	0	0	111.1	Y542 S543 T548 A549 L550 S593	Y542-D546 HydrophobicContact CD2-CB 3.55Å; Y542-D546 HydrophobicContact CE2-CB 4.42Å; Y542-D546 HydrophobicContact CG-CB 4.08Å; S543-D546 WeakPolarHBondContact CB-OD2 3.32Å; S543-D546 PolarHBondContact N-OD2 3.13Å; S543-D546 PolarHBondContact O-N 3Å; S543-D546 VanDerWaalsContact O-N 3.07Å; S543-D546 PolarHBondContact OG-N 3.07Å; S543-D546 VanDerWaalsContact OG-N 3.12Å; S543-D546 PolarHBondContact OG-OD1 3.22Å; S543-D546 PolarHBondContact OG-OD2 3.34Å; D546-T548 VanDerWaalsContact C-N 3.35Å; D546-A549 PolarHBondContact O-N 3.35Å; D546-L550 VanDerWaalsContact O-CB 3.28Å; D546-L550 WeakPolarHBondContact O-CB 3.4Å; D546-L550 PolarHBondContact O-N 2.96Å; D546-S593 WeakPolarHBondContact OD1-CB 3.41Å; D546-S593 PolarHBondContact OD1-OG 2.86Å; D546-S593 PolarHBondContact OD2-N 3.03Å; D546-S593 VanDerWaalsContact OD2-N 3.11Å; D546-S593 PolarHBondContact OD2-OG 3.49Å
547	L	96.4	Very high	95.6	Very high	0 Å²	0	39.9 Å²	39.9	0%	0	22%	0.218	C	C	.	.	H	α-helix	trans	-64	-39.1	173	-67.8	176.1	0	0	0	112.1	P507 R512 L515 L516 T539 S543 L550 A551	P507-L547 HydrophobicContact CG-CD1 4.46Å; R512-L547 HydrophobicContact CB-CD1 3.99Å; R512-L547 HydrophobicContact CG-CD1 3.92Å; L515-L547 HydrophobicContact CB-CD1 4.11Å; L515-L547 HydrophobicContact CD1-CD1 3.82Å; L516-L547 HydrophobicContact CD2-CD2 4.27Å; L516-L547 HydrophobicContact CG-CD2 4.38Å; T539-L547 HydrophobicContact CG2-CD2 3.69Å; S543-L547 WeakPolarHBondContact O-CG 3.47Å; S543-L547 PolarHBondContact O-N 3.35Å; L547-L550 PolarHBondContact O-N 3.31Å; L547-A551 WeakPolarHBondContact O-CB 3.46Å; L547-A551 PolarHBondContact O-N 3.41Å
548	T	95.4	Very high	95.4	Very high	45 Å²	45	32.2 Å²	32.2	28%	0.276	19%	0.19	S	C	.	.	H	α-helix	trans	-67.3	-38.9	175.8	-59.2	0	0	0	0	111.5	L519 G544 S545 D546 K552	L519-T548 HydrophobicContact CD2-CG2 4.24Å; G544-T548 WeakPolarHBondContact O-CB 3.26Å; G544-T548 PolarHBondContact O-N 3.39Å; G544-T548 PolarHBondContact O-OG1 2.91Å; S545-T548 PolarHBondContact O-N 3.22Å; D546-T548 VanDerWaalsContact C-N 3.35Å; T548-K552 HydrophobicContact CG2-CD 4.34Å; T548-K552 WeakPolarHBondContact O-CB 3.43Å; T548-K552 VanDerWaalsContact O-CG 3.25Å; T548-K552 WeakPolarHBondContact O-CG 3.34Å; T548-K552 PolarHBondContact O-N 2.93Å; T548-K552 VanDerWaalsContact O-N 3.08Å
549	A	96.6	Very high	95.2	Very high	40 Å²	40	31 Å²	31	33%	0.331	18%	0.184	S	C	.	.	H	α-helix	trans	-66.7	-43.4	173.8	0	0	0	0	0	111.4	S545 D546 K552 D553 I590	S545-A549 WeakPolarHBondContact O-CB 3.41Å; S545-A549 PolarHBondContact O-N 3.15Å; D546-A549 PolarHBondContact O-N 3.35Å; A549-K552 PolarHBondContact O-N 2.94Å; A549-D553 WeakPolarHBondContact O-CB 3.44Å; A549-D553 PolarHBondContact O-N 3.23Å; A549-I590 HydrophobicContact CB-CG2 4.44Å
550	L	97.1	Very high	95	Very high	0 Å²	0	36.7 Å²	36.7	0%	0	21%	0.206	C	C	.	.	H	α-helix	trans	-60.5	-47	176.1	-177.2	71.1	0	0	0	112	T539 D546 L547 K552 D553 A554 F583 L587 I590	T539-L550 HydrophobicContact CG2-CD2 3.5Å; D546-L550 VanDerWaalsContact O-CB 3.28Å; D546-L550 WeakPolarHBondContact O-CB 3.4Å; D546-L550 PolarHBondContact O-N 2.96Å; L547-L550 PolarHBondContact O-N 3.31Å; L550-K552 PolarHBondContact O-N 3.36Å; L550-D553 PolarHBondContact O-N 3.45Å; L550-A554 WeakPolarHBondContact O-CB 3.46Å; L550-A554 PolarHBondContact O-N 2.89Å; L550-F583 HydrophobicContact CD2-CD1 4.11Å; L550-F583 HydrophobicContact CG-CD1 3.98Å; L550-F583 HydrophobicContact CG-CE1 4.4Å; L550-L587 HydrophobicContact CD1-CD2 3.86Å; L550-L587 HydrophobicContact CD1-CG 3.87Å; L550-L587 HydrophobicContact CD2-CD2 3.75Å; L550-L587 HydrophobicContact CD2-CG 4.19Å; L550-L587 HydrophobicContact CG-CD2 4.49Å; L550-I590 HydrophobicContact CB-CG2 4.33Å; L550-I590 HydrophobicContact CD1-CB 4.12Å; L550-I590 HydrophobicContact CD1-CG1 4.38Å
551	A	96.1	Very high	94.7	Very high	11 Å²	11	38.5 Å²	38.5	9%	0.091	21%	0.212	C	C	.	.	H	α-helix	trans	-65.4	-36.7	177.8	0	0	0	0	0	112.5	L519 L547 A555 F583	L519-A551 HydrophobicContact CB-CB 4.37Å; L519-A551 HydrophobicContact CD1-CB 4.03Å; L547-A551 WeakPolarHBondContact O-CB 3.46Å; L547-A551 PolarHBondContact O-N 3.41Å; A551-A555 WeakPolarHBondContact O-CB 3.21Å; A551-A555 PolarHBondContact O-N 3.29Å; A551-F583 HydrophobicContact CB-CE1 4.15Å; A551-F583 HydrophobicContact CB-CZ 4.25Å
552	K	95.6	Very high	94.5	Very high	143 Å²	143	40 Å²	40	62%	0.622	22%	0.217	S	C	*	.	H	α-helix	trans	-66	-42.1	172.1	-75.5	172.3	178.8	179.9	0	112.1	T548 A549 L550 A555 L556	T548-K552 HydrophobicContact CG2-CD 4.34Å; T548-K552 WeakPolarHBondContact O-CB 3.43Å; T548-K552 VanDerWaalsContact O-CG 3.25Å; T548-K552 WeakPolarHBondContact O-CG 3.34Å; T548-K552 PolarHBondContact O-N 2.93Å; T548-K552 VanDerWaalsContact O-N 3.08Å; A549-K552 PolarHBondContact O-N 2.94Å; L550-K552 PolarHBondContact O-N 3.36Å; K552-A555 PolarHBondContact O-N 3.21Å; K552-L556 WeakPolarHBondContact O-CG 3.47Å; K552-L556 PolarHBondContact O-N 3.48Å
553	D	96.1	Very high	94.2	Very high	23 Å²	23	46.5 Å²	46.5	12%	0.123	25%	0.245	C	C	.	.	H	α-helix	trans	-67.1	-38.9	179.1	-166	82.9	0	0	0	111.9	A549 L550 L556 R560 S586 I590	A549-D553 WeakPolarHBondContact O-CB 3.44Å; A549-D553 PolarHBondContact O-N 3.23Å; L550-D553 PolarHBondContact O-N 3.45Å; D553-L556 WeakPolarHBondContact O-CB 3.36Å; D553-L556 PolarHBondContact O-N 3.1Å; D553-R560 PolarHBondContact O-NH1 2.87Å; D553-R560 VanDerWaalsContact O-NH1 3.11Å; D553-R560 IonicContact OD1-CZ 3.64Å; D553-R560 IonicContact OD1-NH1 3.71Å; D553-R560 PolarHBondContact OD1-NH1 3.06Å; D553-R560 IonicContact OD1-NH2 2.74Å; D553-R560 PolarHBondContact OD1-NH2 3.07Å; D553-R560 IonicContact OD2-CZ 3.57Å; D553-R560 IonicContact OD2-NH1 3.05Å; D553-R560 PolarHBondContact OD2-NH1 3.3Å; D553-R560 IonicContact OD2-NH2 3.34Å; D553-S586 VanDerWaalsContact C-OG 3.26Å; D553-S586 WeakPolarHBondContact OD2-CB 3.35Å; D553-S586 PolarHBondContact OD2-OG 2.91Å; D553-I590 HydrophobicContact CB-CD1 4.3Å; D553-I590 HydrophobicContact CB-CG1 4.02Å
554	A	95.6	Very high	94	Very high	0 Å²	0	50.9 Å²	50.9	0%	0	27%	0.274	C	S	.	.	H	α-helix	trans	-68.6	-37	174.9	0	0	0	0	0	112.2	L550 L556 G557 I578 D582 F583 S586	L550-A554 WeakPolarHBondContact O-CB 3.46Å; L550-A554 PolarHBondContact O-N 2.89Å; A554-L556 PolarHBondContact O-N 2.64Å; A554-G557 WeakPolarHBondContact O-CA 3.4Å; A554-G557 PolarHBondContact O-N 3.4Å; A554-I578 HydrophobicContact CB-CG2 4.3Å; A554-D582 HydrophobicContact CB-CB 4.16Å; A554-F583 HydrophobicContact CB-CB 4.41Å; A554-F583 HydrophobicContact CB-CD1 3.87Å; A554-F583 HydrophobicContact CB-CD2 3.63Å; A554-F583 HydrophobicContact CB-CE1 3.98Å; A554-F583 HydrophobicContact CB-CE2 3.74Å; A554-F583 HydrophobicContact CB-CG 3.7Å; A554-F583 HydrophobicContact CB-CZ 3.91Å; A554-S586 WeakPolarHBondContact CA-OG 3.28Å; A554-S586 PolarHBondContact N-OG 3.04Å; A554-S586 VanDerWaalsContact N-OG 3.13Å
555	A	94.3	Very high	93.8	Very high	32 Å²	32	55.4 Å²	55.4	26%	0.264	29%	0.291	S	S	.	.	H	α-helix	trans	-63.1	-22.2	172.2	0	0	0	0	0	113.5	A551 K552 G557 I578	A551-A555 WeakPolarHBondContact O-CB 3.21Å; A551-A555 PolarHBondContact O-N 3.29Å; K552-A555 PolarHBondContact O-N 3.21Å; A555-G557 VanDerWaalsContact C-N 3.35Å; A555-I578 HydrophobicContact CB-CD1 3.75Å
556	L	93.7	Very high	93.4	Very high	81 Å²	81	56.6 Å²	56.6	42%	0.424	29%	0.29	S	S	.	.	T	Hydrogen-bonded Turn	trans	-83.5	-7.5	170.4	-62.7	177.2	0	0	0	113.3	K552 D553 A554 I559 R560	K552-L556 WeakPolarHBondContact O-CG 3.47Å; K552-L556 PolarHBondContact O-N 3.48Å; D553-L556 WeakPolarHBondContact O-CB 3.36Å; D553-L556 PolarHBondContact O-N 3.1Å; A554-L556 PolarHBondContact O-N 2.64Å; L556-I559 HydrophobicContact CD2-CD1 4.07Å; L556-I559 PolarHBondContact O-N 2.9Å; L556-I559 VanDerWaalsContact O-N 3.16Å; L556-R560 WeakPolarHBondContact O-CD 3.47Å; L556-R560 VanDerWaalsContact O-CG 3.23Å; L556-R560 WeakPolarHBondContact O-CG 3.35Å; L556-R560 PolarHBondContact O-N 2.85Å
557	G	93.2	Very high	93	Very high	11 Å²	11	59 Å²	59	11%	0.113	31%	0.305	C	S	.	.	H	α-helix	trans	-51.7	-58.1	177.2	0	0	0	0	0	113.3	A554 A555 I559 R560 E561	A554-G557 WeakPolarHBondContact O-CA 3.4Å; A554-G557 PolarHBondContact O-N 3.4Å; A555-G557 VanDerWaalsContact C-N 3.35Å; G557-I559 PolarHBondContact O-N 3.29Å; G557-I559 VanDerWaalsContact O-N 3.16Å; G557-R560 PolarHBondContact O-N 2.78Å; G557-E561 PolarHBondContact O-N 3.36Å
558	P	92.4	Very high	92.7	Very high	5 Å²	5	65.7 Å²	65.7	3%	0.032	33%	0.334	C	S	.	.	H	α-helix	trans	-53.1	-33.6	174.8	-29.3	35.9	0	0	0	114.8	M575 R576	P558-M575 HydrophobicContact CB-CG 4.03Å; P558-M575 HydrophobicContact CB-SD 4.47Å; P558-R576 HydrophobicContact CB-CB 4.24Å; P558-R576 WeakPolarHBondContact CB-O 3.46Å; P558-R576 WeakPolarHBondContact CG-O 3.35Å
559	I	92.5	Very high	92.3	Very high	59 Å²	59	70 Å²	70	30%	0.303	36%	0.355	S	S	.	.	H	α-helix	trans	-77.2	-33.3	-179.6	-60	176.1	0	0	0	111.1	L556 G557 E561 L562 V567 M575	L556-I559 HydrophobicContact CD2-CD1 4.07Å; L556-I559 PolarHBondContact O-N 2.9Å; L556-I559 VanDerWaalsContact O-N 3.16Å; G557-I559 PolarHBondContact O-N 3.29Å; G557-I559 VanDerWaalsContact O-N 3.16Å; I559-E561 VanDerWaalsContact C-N 3.28Å; I559-E561 PolarHBondContact O-N 3.33Å; I559-L562 PolarHBondContact O-N 3.32Å; I559-V567 HydrophobicContact CG2-CG1 4.42Å; I559-V567 HydrophobicContact CG2-CG2 4.27Å; I559-M575 HydrophobicContact CD1-CE 4.05Å; I559-M575 HydrophobicContact CD1-SD 4.22Å; I559-M575 HydrophobicContact CG1-CE 3.71Å; I559-M575 HydrophobicContact CG1-SD 3.85Å
560	R	91.4	Very high	91.8	Very high	118 Å²	118	71.1 Å²	71.1	45%	0.445	35%	0.354	S	S	.	.	H	α-helix	trans	-72.3	-18.6	179	-70	158.4	175.2	-180	-6.8	113.7	D553 L556 G557 L562	D553-R560 PolarHBondContact O-NH1 2.87Å; D553-R560 VanDerWaalsContact O-NH1 3.11Å; D553-R560 IonicContact OD1-CZ 3.64Å; D553-R560 IonicContact OD1-NH1 3.71Å; D553-R560 PolarHBondContact OD1-NH1 3.06Å; D553-R560 IonicContact OD1-NH2 2.74Å; D553-R560 PolarHBondContact OD1-NH2 3.07Å; D553-R560 IonicContact OD2-CZ 3.57Å; D553-R560 IonicContact OD2-NH1 3.05Å; D553-R560 PolarHBondContact OD2-NH1 3.3Å; D553-R560 IonicContact OD2-NH2 3.34Å; L556-R560 WeakPolarHBondContact O-CD 3.47Å; L556-R560 VanDerWaalsContact O-CG 3.23Å; L556-R560 WeakPolarHBondContact O-CG 3.35Å; L556-R560 PolarHBondContact O-N 2.85Å; G557-R560 PolarHBondContact O-N 2.78Å; R560-L562 VanDerWaalsContact C-N 3.29Å
561	E	89.7	Confident	91.4	Very high	121 Å²	121	73.1 Å²	73.1	57%	0.565	37%	0.368	S	S	*	.	T	Hydrogen-bonded Turn	trans	-77.5	-15.7	174.2	-68.5	172.8	168.3	0	0	112.8	G557 I559 R576	G557-E561 PolarHBondContact O-N 3.36Å; I559-E561 VanDerWaalsContact C-N 3.28Å; I559-E561 PolarHBondContact O-N 3.33Å; E561-R576 IonicContact OE1-CZ 2.67Å; E561-R576 IonicContact OE1-NE 3.48Å; E561-R576 IonicContact OE1-NH2 3.33Å; E561-R576 PolarHBondContact OE1-NH2 3.31Å; E561-R576 IonicContact OE2-CZ 3.52Å; E561-R576 IonicContact OE2-NE 3.62Å; E561-R576 PolarHBondContact OE2-NE 3.21Å; E561-R576 IonicContact OE2-NH2 2.78Å; E561-R576 PolarHBondContact OE2-NH2 3.44Å
562	L	89.8	Confident	90.9	Very high	42 Å²	42	77.2 Å²	77.2	22%	0.22	40%	0.402	C	S	.	.	S	Bend	trans	-98.4	145.4	-173.6	-61.8	170.1	0	0	0	112.2	I559 R560 Q566 V567 M570	I559-L562 PolarHBondContact O-N 3.32Å; R560-L562 VanDerWaalsContact C-N 3.29Å; L562-Q566 HydrophobicContact CB-CB 4.34Å; L562-Q566 HydrophobicContact CD2-CB 4.37Å; L562-V567 HydrophobicContact CB-CG2 3.6Å; L562-V567 HydrophobicContact CD1-CG2 4.1Å; L562-M570 HydrophobicContact CD1-CE 4.49Å; L562-M570 HydrophobicContact CD1-SD 3.46Å; L562-M570 WeakPolarHBondContact CD1-SD 3.23Å; L562-M570 HydrophobicContact CD2-CE 4.45Å; L562-M570 HydrophobicContact CD2-SD 4.17Å; L562-M570 HydrophobicContact CG-SD 4.48Å
563	K	90.4	Very high	90.4	Very high	150 Å²	150	75.7 Å²	75.7	65%	0.652	41%	0.41	S	S	*	.			trans	-71.7	150.9	168.6	-61.5	176.2	-177.2	178.2	0	109.9	E565 Q566 V567	K563-E565 PolarHBondContact O-N 2.74Å; K563-E565 VanDerWaalsContact O-N 3.1Å; K563-Q566 HydrophobicContact CB-CG 4.31Å; K563-Q566 VanDerWaalsContact CB-OE1 3.32Å; K563-Q566 WeakPolarHBondContact O-CA 3.27Å; K563-Q566 WeakPolarHBondContact O-CB 3.2Å; K563-Q566 PolarHBondContact O-N 2.82Å; K563-V567 PolarHBondContact O-N 3.25Å; K563-V567 VanDerWaalsContact O-N 3.15Å
564	P	91.2	Very high	89.9	Confident	93 Å²	93	80 Å²	80	60%	0.604	43%	0.429	S	S	*	.	H	α-helix	trans	-52.7	-36.7	-179.5	-29.5	36.1	0	0	0	114.6	Q566 V567 K568	P564-Q566 VanDerWaalsContact C-N 3.31Å; P564-Q566 PolarHBondContact O-N 3.35Å; P564-V567 PolarHBondContact O-N 3.14Å; P564-K568 WeakPolarHBondContact O-CG 3.46Å; P564-K568 PolarHBondContact O-N 3.38Å
565	E	89.6	Confident	89.5	Confident	108 Å²	108	83.5 Å²	83.5	51%	0.505	45%	0.446	S	S	.	.	H	α-helix	trans	-74.3	-18.2	177.8	-52.2	-48.5	130.6	0	0	113.8	K563 K568 N569	K563-E565 PolarHBondContact O-N 2.74Å; K563-E565 VanDerWaalsContact O-N 3.1Å; E565-K568 IonicContact OE1-NZ 2.75Å; E565-K568 PolarHBondContact OE1-NZ 2.96Å; E565-K568 WeakPolarHBondContact OE2-CE 3.39Å; E565-K568 IonicContact OE2-NZ 3.57Å; E565-K568 PolarHBondContact OE2-NZ 2.69Å; E565-N569 PolarHBondContact O-ND2 3.39Å
566	Q	86.8	Confident	89.3	Confident	92 Å²	92	84.4 Å²	84.4	43%	0.43	44%	0.443	S	S	.	.	H	α-helix	trans	-79.5	-43.6	169.7	-63.2	173	-80.3	0	0	109.9	L562 K563 P564 K568 N569 M570	L562-Q566 HydrophobicContact CB-CB 4.34Å; L562-Q566 HydrophobicContact CD2-CB 4.37Å; K563-Q566 HydrophobicContact CB-CG 4.31Å; K563-Q566 VanDerWaalsContact CB-OE1 3.32Å; K563-Q566 WeakPolarHBondContact O-CA 3.27Å; K563-Q566 WeakPolarHBondContact O-CB 3.2Å; K563-Q566 PolarHBondContact O-N 2.82Å; P564-Q566 VanDerWaalsContact C-N 3.31Å; P564-Q566 PolarHBondContact O-N 3.35Å; Q566-K568 PolarHBondContact O-N 3.4Å; Q566-N569 PolarHBondContact O-N 2.81Å; Q566-M570 VanDerWaalsContact O-CB 3.3Å; Q566-M570 WeakPolarHBondContact O-CB 3.48Å; Q566-M570 PolarHBondContact O-N 3Å
567	V	88.8	Confident	89.2	Confident	66 Å²	66	86.1 Å²	86.1	40%	0.4	45%	0.452	S	S	.	.	H	α-helix	trans	-58.8	-31.5	179	-178.9	0	0	0	0	112.7	I559 L562 K563 P564	I559-V567 HydrophobicContact CG2-CG1 4.42Å; I559-V567 HydrophobicContact CG2-CG2 4.27Å; L562-V567 HydrophobicContact CB-CG2 3.6Å; L562-V567 HydrophobicContact CD1-CG2 4.1Å; K563-V567 PolarHBondContact O-N 3.25Å; K563-V567 VanDerWaalsContact O-N 3.15Å; P564-V567 PolarHBondContact O-N 3.14Å
568	K	89.6	Confident	89.3	Confident	140 Å²	140	86.3 Å²	86.3	61%	0.609	45%	0.451	S	S	*	.	T	Hydrogen-bonded Turn	trans	-70.6	-29.2	174.9	-67.1	174.9	-159.1	167.4	0	114.5	P564 E565 Q566	P564-K568 WeakPolarHBondContact O-CG 3.46Å; P564-K568 PolarHBondContact O-N 3.38Å; E565-K568 IonicContact OE1-NZ 2.75Å; E565-K568 PolarHBondContact OE1-NZ 2.96Å; E565-K568 WeakPolarHBondContact OE2-CE 3.39Å; E565-K568 IonicContact OE2-NZ 3.57Å; E565-K568 PolarHBondContact OE2-NZ 2.69Å; Q566-K568 PolarHBondContact O-N 3.4Å
569	N	88.7	Confident	89.3	Confident	135 Å²	135	93.1 Å²	93.1	72%	0.722	48%	0.476	S	S	*	.	T	Hydrogen-bonded Turn	trans	-112.9	-12.5	-164.9	-67.8	-45.7	0	0	0	113.8	E565 Q566	E565-N569 PolarHBondContact O-ND2 3.39Å; Q566-N569 PolarHBondContact O-N 2.81Å
570	M	86.4	Confident	89.5	Confident	63 Å²	63	91.8 Å²	91.8	31%	0.31	47%	0.469	S	S	.	.			trans	-80.1	138.1	-179.3	-170.9	177.6	-150.9	0	0	111.5	L562 Q566 E574	L562-M570 HydrophobicContact CD1-CE 4.49Å; L562-M570 HydrophobicContact CD1-SD 3.46Å; L562-M570 WeakPolarHBondContact CD1-SD 3.23Å; L562-M570 HydrophobicContact CD2-CE 4.45Å; L562-M570 HydrophobicContact CD2-SD 4.17Å; L562-M570 HydrophobicContact CG-SD 4.48Å; Q566-M570 VanDerWaalsContact O-CB 3.3Å; Q566-M570 WeakPolarHBondContact O-CB 3.48Å; Q566-M570 PolarHBondContact O-N 3Å; M570-E574 WeakPolarHBondContact CA-OE2 3.44Å; M570-E574 HydrophobicContact CE-CB 3.74Å; M570-E574 WeakPolarHBondContact CE-O 3.48Å; M570-E574 HydrophobicContact CG-CB 3.8Å; M570-E574 WeakPolarHBondContact CG-OE2 3.36Å
571	S	87.3	Confident	89.6	Confident	42 Å²	42	89.2 Å²	89.2	29%	0.294	47%	0.469	S	S	.	.			trans	-77.5	151.4	173.2	81.7	0	0	0	0	111.6	S573 E574	S571-S573 PolarHBondContact O-N 2.87Å; S571-S573 VanDerWaalsContact O-N 3.11Å; S571-S573 PolarHBondContact OG-OG 3.47Å; S571-E574 WeakPolarHBondContact CB-OE1 3.5Å; S571-E574 PolarHBondContact N-OE2 3.31Å; S571-E574 PolarHBondContact O-N 3.44Å; S571-E574 WeakPolarHBondContact OG-CG 3.36Å; S571-E574 PolarHBondContact OG-OE1 3.49Å
572	A	85.4	Confident	89.9	Confident	97 Å²	97	83.9 Å²	83.9	80%	0.802	45%	0.445	S	S	*	.	G	3₁₀ helix	trans	-59.1	-26.4	179.1	0	0	0	0	0	113.1
573	S	85	Confident	90.3	Very high	112 Å²	112	81.9 Å²	81.9	78%	0.783	43%	0.434	S	S	*	.	G	3₁₀ helix	trans	-74.9	-19.8	175.6	27.8	0	0	0	0	114.9	S571	S571-S573 PolarHBondContact O-N 2.87Å; S571-S573 VanDerWaalsContact O-N 3.11Å; S571-S573 PolarHBondContact OG-OG 3.47Å
574	E	86.1	Confident	90.5	Very high	114 Å²	114	77.4 Å²	77.4	53%	0.533	42%	0.419	S	S	.	.	G	3₁₀ helix	trans	-83.7	-14.3	176.7	-70.9	143.3	-140.2	0	0	112.5	M570 S571 R576	M570-E574 WeakPolarHBondContact CA-OE2 3.44Å; M570-E574 HydrophobicContact CE-CB 3.74Å; M570-E574 WeakPolarHBondContact CE-O 3.48Å; M570-E574 HydrophobicContact CG-CB 3.8Å; M570-E574 WeakPolarHBondContact CG-OE2 3.36Å; S571-E574 WeakPolarHBondContact CB-OE1 3.5Å; S571-E574 PolarHBondContact N-OE2 3.31Å; S571-E574 PolarHBondContact O-N 3.44Å; S571-E574 WeakPolarHBondContact OG-CG 3.36Å; S571-E574 PolarHBondContact OG-OE1 3.49Å; E574-R576 PolarHBondContact O-N 2.76Å
575	M	86.8	Confident	90.7	Very high	72 Å²	72	76.3 Å²	76.3	36%	0.355	41%	0.406	S	S	.	.	S	Bend	trans	-66.1	132	-172.5	-169.4	171.6	-67.2	0	0	112.1	P558 I559 N577	P558-M575 HydrophobicContact CB-CG 4.03Å; P558-M575 HydrophobicContact CB-SD 4.47Å; I559-M575 HydrophobicContact CD1-CE 4.05Å; I559-M575 HydrophobicContact CD1-SD 4.22Å; I559-M575 HydrophobicContact CG1-CE 3.71Å; I559-M575 HydrophobicContact CG1-SD 3.85Å; M575-N577 PolarHBondContact O-N 3.01Å
576	R	90.4	Very high	91.1	Very high	51 Å²	51	71.2 Å²	71.2	19%	0.192	38%	0.382	C	S	.	.	P	Polyproline II helix	trans	-60.5	128.8	178.4	-179.1	-176.8	67.9	74.6	-24.5	111.4	P558 E561 E574 D582	P558-R576 HydrophobicContact CB-CB 4.24Å; P558-R576 WeakPolarHBondContact CB-O 3.46Å; P558-R576 WeakPolarHBondContact CG-O 3.35Å; E561-R576 IonicContact OE1-CZ 2.67Å; E561-R576 IonicContact OE1-NE 3.48Å; E561-R576 IonicContact OE1-NH2 3.33Å; E561-R576 PolarHBondContact OE1-NH2 3.31Å; E561-R576 IonicContact OE2-CZ 3.52Å; E561-R576 IonicContact OE2-NE 3.62Å; E561-R576 PolarHBondContact OE2-NE 3.21Å; E561-R576 IonicContact OE2-NH2 2.78Å; E561-R576 PolarHBondContact OE2-NH2 3.44Å; E574-R576 PolarHBondContact O-N 2.76Å; R576-D582 IonicContact CZ-OD1 3.48Å; R576-D582 IonicContact CZ-OD2 3.43Å; R576-D582 IonicContact NH1-OD1 3.41Å; R576-D582 IonicContact NH1-OD2 3.9Å; R576-D582 PolarHBondContact NH1-OD2 3.28Å; R576-D582 IonicContact NH2-OD1 3.55Å; R576-D582 PolarHBondContact NH2-OD1 3.48Å; R576-D582 IonicContact NH2-OD2 2.68Å; R576-D582 PolarHBondContact NH2-OD2 2.95Å
577	N	91.9	Very high	91.6	Very high	118 Å²	118	67.8 Å²	67.8	63%	0.631	37%	0.367	S	S	*	.	P	Polyproline II helix	trans	-55.4	146.5	169.7	-75.3	-4.2	0	0	0	112.7	P526 M575	P526-N577 HydrophobicContact CB-CB 4.08Å; M575-N577 PolarHBondContact O-N 3.01Å
578	I	94.2	Very high	91.9	Very high	15 Å²	15	70.9 Å²	70.9	8%	0.077	38%	0.375	C	S	.	.	P	Polyproline II helix	trans	-63.4	135.5	178.8	-47	171.1	0	0	0	110.2	L520 Q523 P526 A554 A555 D582 F583	L520-I578 HydrophobicContact CD2-CD1 4Å; Q523-I578 HydrophobicContact CB-CD1 4.35Å; Q523-I578 HydrophobicContact CG-CD1 4.25Å; P526-I578 HydrophobicContact CG-CB 4.06Å; A554-I578 HydrophobicContact CB-CG2 4.3Å; A555-I578 HydrophobicContact CB-CD1 3.75Å; I578-D582 WeakPolarHBondContact CA-OD2 3.43Å; I578-D582 HydrophobicContact CG2-CB 4.15Å; I578-F583 HydrophobicContact CG2-CD2 4.11Å; I578-F583 HydrophobicContact CG2-CE2 3.71Å
579	R	94.3	Very high	92.1	Very high	147 Å²	147	69.5 Å²	69.5	56%	0.555	37%	0.369	S	S	*	.			trans	-119.8	161.6	-177.8	-70	174.7	176.9	176.3	-2	111.6	S581 D582	R579-S581 WeakPolarHBondContact CB-OG 3.41Å; R579-S581 PolarHBondContact O-N 3.33Å; R579-S581 VanDerWaalsContact O-N 3.17Å; R579-D582 PolarHBondContact N-OD2 2.94Å; R579-D582 WeakPolarHBondContact O-CB 3.03Å; R579-D582 PolarHBondContact O-N 2.95Å
580	L	95.1	Very high	92.5	Very high	31 Å²	31	64.9 Å²	64.9	16%	0.162	34%	0.344	C	S	.	.	H	α-helix	trans	-56.5	-29.5	173.1	-178.6	65.7	0	0	0	113.1	E531 L535 D582 F583 T584	E531-L580 HydrophobicContact CB-CD1 4.41Å; E531-L580 HydrophobicContact CG-CB 4.45Å; E531-L580 HydrophobicContact CG-CD2 4.19Å; L535-L580 HydrophobicContact CD1-CD1 4.03Å; L535-L580 HydrophobicContact CD2-CD1 3.68Å; L535-L580 HydrophobicContact CG-CD1 3.67Å; L580-D582 VanDerWaalsContact C-N 3.26Å; L580-D582 PolarHBondContact O-N 3.26Å; L580-F583 PolarHBondContact O-N 2.93Å; L580-T584 WeakPolarHBondContact O-CB 3.31Å; L580-T584 PolarHBondContact O-N 3.33Å; L580-T584 PolarHBondContact O-OG1 3.27Å
581	S	95.4	Very high	92.9	Very high	65 Å²	65	67.8 Å²	67.8	46%	0.455	36%	0.355	S	S	.	.	H	α-helix	trans	-56.8	-39.2	172.8	52.5	0	0	0	0	112.7	R579 T584 E585	R579-S581 WeakPolarHBondContact CB-OG 3.41Å; R579-S581 PolarHBondContact O-N 3.33Å; R579-S581 VanDerWaalsContact O-N 3.17Å; S581-T584 PolarHBondContact O-N 2.91Å; S581-E585 PolarHBondContact O-N 3.44Å
582	D	95.9	Very high	93.2	Very high	9 Å²	9	71.1 Å²	71.1	5%	0.048	36%	0.361	C	S	.	.	H	α-helix	trans	-69.3	-46.7	-174.9	-52.2	-30.1	0	0	0	109.7	A554 R576 I578 R579 L580 T584 E585 S586	A554-D582 HydrophobicContact CB-CB 4.16Å; R576-D582 IonicContact CZ-OD1 3.48Å; R576-D582 IonicContact CZ-OD2 3.43Å; R576-D582 IonicContact NH1-OD1 3.41Å; R576-D582 IonicContact NH1-OD2 3.9Å; R576-D582 PolarHBondContact NH1-OD2 3.28Å; R576-D582 IonicContact NH2-OD1 3.55Å; R576-D582 PolarHBondContact NH2-OD1 3.48Å; R576-D582 IonicContact NH2-OD2 2.68Å; R576-D582 PolarHBondContact NH2-OD2 2.95Å; I578-D582 WeakPolarHBondContact CA-OD2 3.43Å; I578-D582 HydrophobicContact CG2-CB 4.15Å; R579-D582 PolarHBondContact N-OD2 2.94Å; R579-D582 WeakPolarHBondContact O-CB 3.03Å; R579-D582 PolarHBondContact O-N 2.95Å; L580-D582 VanDerWaalsContact C-N 3.26Å; L580-D582 PolarHBondContact O-N 3.26Å; D582-T584 VanDerWaalsContact C-N 3.32Å; D582-T584 PolarHBondContact O-N 3.46Å; D582-E585 PolarHBondContact O-N 2.95Å; D582-S586 WeakPolarHBondContact O-CB 3.39Å; D582-S586 PolarHBondContact O-N 3.26Å; D582-S586 PolarHBondContact O-OG 3.19Å; D582-S586 VanDerWaalsContact O-OG 3.07Å
583	F	96.4	Very high	93.6	Very high	0 Å²	0	70 Å²	70	0%	0	35%	0.347	C	S	.	.	H	α-helix	trans	-60.8	-39	171.5	-78.1	-91.4	0	0	0	112.7	L516 L520 L527 L535 L550 A551 A554 I578 L580 E585 S586 L587	L516-F583 HydrophobicContact CD2-CE1 4.06Å; L520-F583 HydrophobicContact CD1-CE2 4.24Å; L520-F583 HydrophobicContact CD1-CZ 4Å; L520-F583 HydrophobicContact CD2-CE2 4.28Å; L520-F583 HydrophobicContact CD2-CZ 4.13Å; L520-F583 HydrophobicContact CG-CZ 4.39Å; L527-F583 HydrophobicContact CD1-CD2 3.9Å; L527-F583 HydrophobicContact CD1-CE2 3.72Å; L535-F583 HydrophobicContact CD1-CB 4.02Å; L535-F583 HydrophobicContact CD1-CD1 3.86Å; L535-F583 HydrophobicContact CD1-CD2 4.01Å; L535-F583 HydrophobicContact CD1-CE1 4.31Å; L535-F583 HydrophobicContact CD1-CE2 4.45Å; L535-F583 HydrophobicContact CD1-CG 3.7Å; L535-F583 HydrophobicContact CD2-CB 3.58Å; L535-F583 HydrophobicContact CD2-CD1 4.3Å; L535-F583 HydrophobicContact CD2-CG 4.12Å; L535-F583 HydrophobicContact CG-CB 4.47Å; L550-F583 HydrophobicContact CD2-CD1 4.11Å; L550-F583 HydrophobicContact CG-CD1 3.98Å; L550-F583 HydrophobicContact CG-CE1 4.4Å; A551-F583 HydrophobicContact CB-CE1 4.15Å; A551-F583 HydrophobicContact CB-CZ 4.25Å; A554-F583 HydrophobicContact CB-CB 4.41Å; A554-F583 HydrophobicContact CB-CD1 3.87Å; A554-F583 HydrophobicContact CB-CD2 3.63Å; A554-F583 HydrophobicContact CB-CE1 3.98Å; A554-F583 HydrophobicContact CB-CE2 3.74Å; A554-F583 HydrophobicContact CB-CG 3.7Å; A554-F583 HydrophobicContact CB-CZ 3.91Å; I578-F583 HydrophobicContact CG2-CD2 4.11Å; I578-F583 HydrophobicContact CG2-CE2 3.71Å; L580-F583 PolarHBondContact O-N 2.93Å; F583-E585 VanDerWaalsContact C-N 3.31Å; F583-E585 PolarHBondContact O-N 3.44Å; F583-S586 PolarHBondContact O-N 2.94Å; F583-L587 WeakPolarHBondContact O-CB 3.29Å; F583-L587 VanDerWaalsContact O-CG 3.29Å; F583-L587 WeakPolarHBondContact O-CG 3.31Å; F583-L587 PolarHBondContact O-N 3.39Å
584	T	95.9	Very high	94.1	Very high	56 Å²	56	65.1 Å²	65.1	34%	0.344	31%	0.313	S	S	.	.	H	α-helix	trans	-65.5	-35.4	178.9	-56.7	0	0	0	0	111.7	L580 S581 D582	L580-T584 WeakPolarHBondContact O-CB 3.31Å; L580-T584 PolarHBondContact O-N 3.33Å; L580-T584 PolarHBondContact O-OG1 3.27Å; S581-T584 PolarHBondContact O-N 2.91Å; D582-T584 VanDerWaalsContact C-N 3.32Å; D582-T584 PolarHBondContact O-N 3.46Å
585	E	95.9	Very high	94.5	Very high	69 Å²	69	62 Å²	62	32%	0.322	30%	0.303	S	S	.	.	H	α-helix	trans	-73.2	-42.6	172.1	179.5	53.2	-143.4	0	0	111.9	S581 D582 F583 L587 K588 K589	S581-E585 PolarHBondContact O-N 3.44Å; D582-E585 PolarHBondContact O-N 2.95Å; F583-E585 VanDerWaalsContact C-N 3.31Å; F583-E585 PolarHBondContact O-N 3.44Å; E585-L587 VanDerWaalsContact C-N 3.33Å; E585-L587 PolarHBondContact O-N 3.18Å; E585-K588 VanDerWaalsContact O-CB 3.28Å; E585-K588 WeakPolarHBondContact O-CB 3.49Å; E585-K588 PolarHBondContact O-N 2.91Å; E585-K588 WeakPolarHBondContact OE2-CD 3.29Å; E585-K588 VanDerWaalsContact OE2-CE 3.31Å; E585-K588 WeakPolarHBondContact OE2-CE 3.41Å; E585-K588 IonicContact OE2-NZ 2.88Å; E585-K588 PolarHBondContact OE2-NZ 3.04Å; E585-K589 VanDerWaalsContact OE1-CE 3.28Å; E585-K589 WeakPolarHBondContact OE1-CE 3.33Å; E585-K589 IonicContact OE1-NZ 2.74Å; E585-K589 PolarHBondContact OE1-NZ 3.12Å
586	S	96.9	Very high	94.8	Very high	1 Å²	1	62.8 Å²	62.8	1%	0.007	31%	0.314	C	S	.	.	H	α-helix	trans	-62.4	-35.4	176.1	-64.4	0	0	0	0	113.1	D553 A554 D582 F583 K588 K589 I590	D553-S586 VanDerWaalsContact C-OG 3.26Å; D553-S586 WeakPolarHBondContact OD2-CB 3.35Å; D553-S586 PolarHBondContact OD2-OG 2.91Å; A554-S586 WeakPolarHBondContact CA-OG 3.28Å; A554-S586 PolarHBondContact N-OG 3.04Å; A554-S586 VanDerWaalsContact N-OG 3.13Å; D582-S586 WeakPolarHBondContact O-CB 3.39Å; D582-S586 PolarHBondContact O-N 3.26Å; D582-S586 PolarHBondContact O-OG 3.19Å; D582-S586 VanDerWaalsContact O-OG 3.07Å; F583-S586 PolarHBondContact O-N 2.94Å; S586-K588 PolarHBondContact O-N 3.45Å; S586-K589 PolarHBondContact O-N 3.36Å; S586-I590 PolarHBondContact O-N 3.47Å
587	L	96.5	Very high	95	Very high	20 Å²	20	68.2 Å²	68.2	11%	0.105	34%	0.342	C	S	.	.	H	α-helix	trans	-63.2	-16.8	173.2	-77.6	170.8	0	0	0	113.7	L535 M538 T539 Y542 L550 F583 E585 K591	L535-L587 HydrophobicContact CD2-CD1 4.35Å; M538-L587 HydrophobicContact CB-CD1 3.94Å; M538-L587 HydrophobicContact CE-CD1 3.83Å; M538-L587 HydrophobicContact SD-CD1 4.48Å; T539-L587 HydrophobicContact CG2-CD2 3.97Å; Y542-L587 HydrophobicContact CE2-CD2 4.13Å; Y542-L587 WeakPolarHBondContact OH-CD2 3.36Å; L550-L587 HydrophobicContact CD1-CD2 3.86Å; L550-L587 HydrophobicContact CD1-CG 3.87Å; L550-L587 HydrophobicContact CD2-CD2 3.75Å; L550-L587 HydrophobicContact CD2-CG 4.19Å; L550-L587 HydrophobicContact CG-CD2 4.49Å; F583-L587 WeakPolarHBondContact O-CB 3.29Å; F583-L587 VanDerWaalsContact O-CG 3.29Å; F583-L587 WeakPolarHBondContact O-CG 3.31Å; F583-L587 PolarHBondContact O-N 3.39Å; E585-L587 VanDerWaalsContact C-N 3.33Å; E585-L587 PolarHBondContact O-N 3.18Å; L587-K591 PolarHBondContact O-NZ 3.11Å
588	K	95.6	Very high	95.1	Very high	131 Å²	131	65.5 Å²	65.5	57%	0.57	33%	0.329	S	S	*	.	H	α-helix	trans	-73.2	-31.6	170.6	-57.6	178.5	-168.4	164.5	0	111.4	E585 S586 K591	E585-K588 VanDerWaalsContact O-CB 3.28Å; E585-K588 WeakPolarHBondContact O-CB 3.49Å; E585-K588 PolarHBondContact O-N 2.91Å; E585-K588 WeakPolarHBondContact OE2-CD 3.29Å; E585-K588 VanDerWaalsContact OE2-CE 3.31Å; E585-K588 WeakPolarHBondContact OE2-CE 3.41Å; E585-K588 IonicContact OE2-NZ 2.88Å; E585-K588 PolarHBondContact OE2-NZ 3.04Å; S586-K588 PolarHBondContact O-N 3.45Å; K588-K591 WeakPolarHBondContact O-CE 3.48Å; K588-K591 PolarHBondContact O-NZ 3.46Å
589	K	94.8	Very high	95.1	Very high	111 Å²	111	67 Å²	67	48%	0.483	34%	0.337	S	S	.	.	H	α-helix	trans	-98.4	-56	-172.4	-65.3	156.5	177.5	150.1	0	112.1	E585 S586	E585-K589 VanDerWaalsContact OE1-CE 3.28Å; E585-K589 WeakPolarHBondContact OE1-CE 3.33Å; E585-K589 IonicContact OE1-NZ 2.74Å; E585-K589 PolarHBondContact OE1-NZ 3.12Å; S586-K589 PolarHBondContact O-N 3.36Å
590	I	96.4	Very high	95.1	Very high	39 Å²	39	64.2 Å²	64.2	20%	0.2	33%	0.33	C	S	.	.			trans	-75.2	131.1	175.7	-50.2	-55.4	0	0	0	108.4	Y542 A549 L550 D553 S586	Y542-I590 HydrophobicContact CE2-CG2 4.31Å; Y542-I590 PolarHBondContact OH-O 3.03Å; A549-I590 HydrophobicContact CB-CG2 4.44Å; L550-I590 HydrophobicContact CB-CG2 4.33Å; L550-I590 HydrophobicContact CD1-CB 4.12Å; L550-I590 HydrophobicContact CD1-CG1 4.38Å; D553-I590 HydrophobicContact CB-CD1 4.3Å; D553-I590 HydrophobicContact CB-CG1 4.02Å; S586-I590 PolarHBondContact O-N 3.47Å
591	K	94.4	Very high	95.1	Very high	123 Å²	123	65.4 Å²	65.4	54%	0.535	35%	0.345	S	S	.	.			trans	-125.6	163.1	176.5	-56.4	-60.9	172.5	-165.4	0	109.5	L587 K588 S593	L587-K591 PolarHBondContact O-NZ 3.11Å; K588-K591 WeakPolarHBondContact O-CE 3.48Å; K588-K591 PolarHBondContact O-NZ 3.46Å; K591-S593 PolarHBondContact O-N 3.04Å
592	R	95.1	Very high	95.1	Very high	113 Å²	113	63.1 Å²	63.1	43%	0.426	33%	0.326	S	S	.	.			trans	-55.6	134.2	170.9	65.9	-178.2	74.8	-172.7	1	110.4	D540 G541 Y542	D540-R592 PolarHBondContact O-NE 3.15Å; D540-R592 PolarHBondContact O-NH2 3.33Å; G541-R592 WeakPolarHBondContact O-CB 3.23Å; Y542-R592 HydrophobicContact CD1-CB 4.08Å; Y542-R592 HydrophobicContact CE1-CB 4.24Å
593	S	93.8	Very high	95	Very high	73 Å²	73	66 Å²	66	51%	0.51	34%	0.341	S	S	.	.	S	Bend	trans	-83.3	-15.9	178.8	50.5	0	0	0	0	114	D546 K591	D546-S593 WeakPolarHBondContact OD1-CB 3.41Å; D546-S593 PolarHBondContact OD1-OG 2.86Å; D546-S593 PolarHBondContact OD2-N 3.03Å; D546-S593 VanDerWaalsContact OD2-N 3.11Å; D546-S593 PolarHBondContact OD2-OG 3.49Å; K591-S593 PolarHBondContact O-N 3.04Å
594	V	94.2	Very high	94.9	Very high	10 Å²	10	72.8 Å²	72.8	6%	0.061	37%	0.367	C	S	.	.	S	Bend	trans	-111.3	134.2	-175.1	-175.2	0	0	0	0	110.8	P381 P382	P381-V594 HydrophobicContact CB-CG1 4.21Å; P381-V594 HydrophobicContact CB-CG2 3.82Å; P382-V594 HydrophobicContact CG-CG2 4.37Å
595	S	94.5	Very high	94.9	Very high	47 Å²	47	71.1 Å²	71.1	33%	0.329	35%	0.354	S	S	.	.			trans	-84.7	151	175.6	90.8	0	0	0	0	111.8	Q597 T598 L599	S595-Q597 PolarHBondContact O-N 3.32Å; S595-Q597 PolarHBondContact OG-N 3.18Å; S595-T598 WeakPolarHBondContact O-CB 3.3Å; S595-T598 PolarHBondContact O-N 3.08Å; S595-T598 VanDerWaalsContact O-N 3.11Å; S595-T598 PolarHBondContact OG-N 3.33Å; S595-T598 VanDerWaalsContact OG-N 3.08Å; S595-T598 PolarHBondContact OG-OG1 2.97Å; S595-L599 PolarHBondContact O-N 3.45Å
596	P	93.9	Very high	94.8	Very high	89 Å²	89	68.4 Å²	68.4	58%	0.578	34%	0.342	S	S	*	.	H	α-helix	trans	-58.9	-31.8	174	-25.2	35.2	0	0	0	113.7	L599 E600	P596-L599 WeakPolarHBondContact O-CB 3.31Å; P596-L599 PolarHBondContact O-N 2.76Å; P596-E600 PolarHBondContact O-N 3.29Å
597	Q	94.3	Very high	94.7	Very high	166 Å²	166	76.9 Å²	76.9	78%	0.776	38%	0.378	S	S	*	.	H	α-helix	trans	-68	-37.7	176.6	-63.3	176.5	-2.5	0	0	111.5	S595 L599 A601	S595-Q597 PolarHBondContact O-N 3.32Å; S595-Q597 PolarHBondContact OG-N 3.18Å; Q597-L599 VanDerWaalsContact C-N 3.34Å; Q597-A601 PolarHBondContact O-N 2.74Å; Q597-A601 VanDerWaalsContact O-N 3.15Å
598	T	94.3	Very high	94.5	Very high	60 Å²	60	80.7 Å²	80.7	37%	0.368	40%	0.399	S	S	.	.	H	α-helix	trans	-67.8	-36.7	173.1	-41.5	0	0	0	0	111	S595 A601 Y602	S595-T598 WeakPolarHBondContact O-CB 3.3Å; S595-T598 PolarHBondContact O-N 3.08Å; S595-T598 VanDerWaalsContact O-N 3.11Å; S595-T598 PolarHBondContact OG-N 3.33Å; S595-T598 VanDerWaalsContact OG-N 3.08Å; S595-T598 PolarHBondContact OG-OG1 2.97Å; T598-A601 PolarHBondContact O-N 2.86Å; T598-Y602 HydrophobicContact CG2-CD2 4.49Å; T598-Y602 HydrophobicContact CG2-CE2 3.82Å; T598-Y602 WeakPolarHBondContact O-CD2 3.48Å; T598-Y602 PolarHBondContact O-N 2.84Å
599	L	94.2	Very high	94.3	Very high	48 Å²	48	78.9 Å²	78.9	25%	0.251	39%	0.391	S	S	.	.	H	α-helix	trans	-64.9	-47.9	176.9	-170.7	64.8	0	0	0	112	P381 Y503 L506 S595 P596 Q597 A601 Y602 I603	P381-L599 HydrophobicContact CG-CD1 4.44Å; Y503-L599 WeakPolarHBondContact OH-CD1 3.31Å; L506-L599 HydrophobicContact CD1-CD1 3.85Å; L506-L599 HydrophobicContact CD1-CD2 4.02Å; L506-L599 HydrophobicContact CG-CD1 4.19Å; S595-L599 PolarHBondContact O-N 3.45Å; P596-L599 WeakPolarHBondContact O-CB 3.31Å; P596-L599 PolarHBondContact O-N 2.76Å; Q597-L599 VanDerWaalsContact C-N 3.34Å; L599-A601 VanDerWaalsContact C-N 3.27Å; L599-A601 PolarHBondContact O-N 2.86Å; L599-Y602 PolarHBondContact O-N 2.71Å; L599-Y602 VanDerWaalsContact O-N 3.1Å; L599-I603 HydrophobicContact CG-CD1 4.14Å; L599-I603 WeakPolarHBondContact O-CG1 3.46Å; L599-I603 PolarHBondContact O-N 2.92Å
600	E	94.3	Very high	94	Very high	88 Å²	88	74.9 Å²	74.9	41%	0.411	38%	0.382	S	S	.	.	H	α-helix	trans	-56.1	-39.4	173.3	169.3	57.5	-157.1	0	0	112.1	P596 Y602 I603 R604	P596-E600 PolarHBondContact O-N 3.29Å; E600-Y602 PolarHBondContact O-N 3.25Å; E600-I603 PolarHBondContact O-N 3.35Å; E600-R604 WeakPolarHBondContact O-CB 3.32Å; E600-R604 PolarHBondContact O-N 2.96Å; E600-R604 IonicContact OE1-CZ 3.3Å; E600-R604 IonicContact OE1-NE 2.71Å; E600-R604 IonicContact OE1-NH2 2.73Å; E600-R604 PolarHBondContact OE1-NH2 3.11Å
601	A	95.1	Very high	93.2	Very high	56 Å²	56	76.3 Å²	76.3	46%	0.463	39%	0.389	S	S	.	.	H	α-helix	trans	-62.6	-39.8	175.4	0	0	0	0	0	112.7	Q597 T598 L599 W605	Q597-A601 PolarHBondContact O-N 2.74Å; Q597-A601 VanDerWaalsContact O-N 3.15Å; T598-A601 PolarHBondContact O-N 2.86Å; L599-A601 VanDerWaalsContact C-N 3.27Å; L599-A601 PolarHBondContact O-N 2.86Å; A601-W605 WeakPolarHBondContact O-CB 3.45Å; A601-W605 PolarHBondContact O-N 2.99Å
602	Y	95.3	Very high	92.1	Very high	16 Å²	16	71.2 Å²	71.2	6%	0.063	37%	0.369	C	S	.	.	H	α-helix	trans	-68.1	-39.8	173.4	-65.3	-62.1	0	0	0	112.7	P381 N485 P487 Y503 T598 L599 E600 R604 W605 N606	P381-Y602 HydrophobicContact CB-CD2 4.39Å; P381-Y602 HydrophobicContact CB-CE2 3.83Å; P381-Y602 HydrophobicContact CG-CD2 4.27Å; P381-Y602 HydrophobicContact CG-CE2 4.2Å; N485-Y602 WeakPolarHBondContact O-CE1 3.45Å; N485-Y602 PolarHBondContact O-OH 3.28Å; P487-Y602 HydrophobicContact CG-CD1 4.32Å; P487-Y602 HydrophobicContact CG-CE1 4.48Å; Y503-Y602 HydrophobicContact CE2-CG 4.32Å; T598-Y602 HydrophobicContact CG2-CD2 4.49Å; T598-Y602 HydrophobicContact CG2-CE2 3.82Å; T598-Y602 WeakPolarHBondContact O-CD2 3.48Å; T598-Y602 PolarHBondContact O-N 2.84Å; L599-Y602 PolarHBondContact O-N 2.71Å; L599-Y602 VanDerWaalsContact O-N 3.1Å; E600-Y602 PolarHBondContact O-N 3.25Å; Y602-R604 VanDerWaalsContact C-N 3.35Å; Y602-W605 PolarHBondContact O-N 3Å; Y602-N606 VanDerWaalsContact O-CB 3.31Å; Y602-N606 WeakPolarHBondContact O-CB 3.47Å; Y602-N606 PolarHBondContact O-N 3.33Å
603	I	93.6	Very high	90.5	Very high	69 Å²	69	71.7 Å²	71.7	35%	0.354	38%	0.384	S	S	.	.	H	α-helix	trans	-63.3	-43.7	179	-68.2	166.2	0	0	0	110.2	L599 E600 N606 K607	L599-I603 HydrophobicContact CG-CD1 4.14Å; L599-I603 WeakPolarHBondContact O-CG1 3.46Å; L599-I603 PolarHBondContact O-N 2.92Å; E600-I603 PolarHBondContact O-N 3.35Å; I603-N606 PolarHBondContact O-N 3.28Å; I603-K607 PolarHBondContact O-N 3.09Å
604	R	94.9	Very high	88.5	Confident	144 Å²	144	74.8 Å²	74.8	54%	0.543	40%	0.4	S	S	.	.	H	α-helix	trans	-62.1	-49.9	174.3	-169.4	174.5	-54.5	171.8	6.8	112.1	E600 Y602 N606 K607 D608	E600-R604 WeakPolarHBondContact O-CB 3.32Å; E600-R604 PolarHBondContact O-N 2.96Å; E600-R604 IonicContact OE1-CZ 3.3Å; E600-R604 IonicContact OE1-NE 2.71Å; E600-R604 IonicContact OE1-NH2 2.73Å; E600-R604 PolarHBondContact OE1-NH2 3.11Å; Y602-R604 VanDerWaalsContact C-N 3.35Å; R604-N606 VanDerWaalsContact C-N 3.28Å; R604-N606 PolarHBondContact O-N 3.47Å; R604-K607 WeakPolarHBondContact O-CB 3.47Å; R604-K607 PolarHBondContact O-N 3.27Å; R604-D608 VanDerWaalsContact O-CG 3.29Å; R604-D608 PolarHBondContact O-N 3.01Å
605	W	95.1	Very high	88.2	Confident	21 Å²	21	78 Å²	78	8%	0.08	42%	0.417	C	S	.	.	H	α-helix	trans	-60.5	-37.9	177.5	-165.7	96.7	0	0	0	112	L377 F379 P487 L495 A601 Y602 D608 F609	L377-W605 HydrophobicContact CD2-CH2 4.24Å; F379-W605 HydrophobicContact CD1-CE3 4.44Å; F379-W605 AromaticContact CD1-CZ3 3.81Å; F379-W605 HydrophobicContact CD1-CZ3 3.81Å; F379-W605 AromaticContact CD2-CE3 3.78Å; F379-W605 HydrophobicContact CD2-CE3 3.78Å; F379-W605 AromaticContact CD2-CZ3 3.95Å; F379-W605 HydrophobicContact CD2-CZ3 3.95Å; F379-W605 HydrophobicContact CE1-CE3 4.15Å; F379-W605 AromaticContact CE1-CZ3 3.64Å; F379-W605 HydrophobicContact CE1-CZ3 3.64Å; F379-W605 AromaticContact CE2-CE3 3.43Å; F379-W605 HydrophobicContact CE2-CE3 3.43Å; F379-W605 VanDerWaalsContact CE2-CE3 3.43Å; F379-W605 AromaticContact CE2-CZ3 3.78Å; F379-W605 HydrophobicContact CE2-CZ3 3.78Å; F379-W605 HydrophobicContact CG-CE3 4.26Å; F379-W605 AromaticContact CG-CZ3 3.96Å; F379-W605 HydrophobicContact CG-CZ3 3.96Å; F379-W605 AromaticContact CZ-CE3 3.62Å; F379-W605 HydrophobicContact CZ-CE3 3.62Å; F379-W605 AromaticContact CZ-CZ3 3.6Å; F379-W605 HydrophobicContact CZ-CZ3 3.6Å; P487-W605 HydrophobicContact CB-CD2 3.81Å; P487-W605 HydrophobicContact CB-CE3 3.97Å; P487-W605 HydrophobicContact CB-CG 4.49Å; P487-W605 HydrophobicContact CB-CH2 3.91Å; P487-W605 HydrophobicContact CB-CZ2 3.73Å; P487-W605 HydrophobicContact CB-CZ3 4.02Å; P487-W605 HydrophobicContact CG-CD2 3.89Å; P487-W605 HydrophobicContact CG-CE3 4.1Å; P487-W605 HydrophobicContact CG-CG 4.17Å; L495-W605 HydrophobicContact CD1-CZ2 4.1Å; L495-W605 HydrophobicContact CD2-CH2 4.07Å; L495-W605 HydrophobicContact CD2-CZ2 3.71Å; A601-W605 WeakPolarHBondContact O-CB 3.45Å; A601-W605 PolarHBondContact O-N 2.99Å; Y602-W605 PolarHBondContact O-N 3Å; W605-D608 PolarHBondContact O-N 3.14Å; W605-F609 AromaticContact CD1-CD2 3.76Å; W605-F609 HydrophobicContact CD2-CB 4.08Å; W605-F609 AromaticContact CD2-CD2 3.93Å; W605-F609 HydrophobicContact CD2-CD2 3.93Å; W605-F609 HydrophobicContact CD2-CG 4.42Å; W605-F609 AromaticContact CE2-CD2 3.6Å; W605-F609 AromaticContact CE2-CG 3.99Å; W605-F609 HydrophobicContact CE3-CB 4.03Å; W605-F609 HydrophobicContact CG-CD2 4.02Å; W605-F609 HydrophobicContact CH2-CB 3.75Å; W605-F609 HydrophobicContact CH2-CG 4.5Å; W605-F609 HydrophobicContact CZ2-CB 3.77Å; W605-F609 HydrophobicContact CZ2-CD2 4.11Å; W605-F609 HydrophobicContact CZ2-CG 4.04Å; W605-F609 HydrophobicContact CZ3-CB 3.87Å; W605-F609 AromaticContact NE1-CD2 3.51Å; W605-F609 AromaticContact NE1-CE2 3.9Å; W605-F609 WeakPolarHBondContact O-CB 3.13Å; W605-F609 PolarHBondContact O-N 3.33Å
606	N	94.6	Very high	87.8	Confident	12 Å²	12	79.6 Å²	79.6	6%	0.064	42%	0.421	C	S	.	.	H	α-helix	trans	-64	-38.3	173.2	179.4	72.4	0	0	0	112.6	F379 Y503 Y602 I603 R604 G610 T612	F379-N606 HydrophobicContact CE2-CB 3.94Å; F379-N606 HydrophobicContact CZ-CB 3.74Å; F379-N606 WeakPolarHBondContact CZ-OD1 3.46Å; Y503-N606 WeakPolarHBondContact CB-OD1 3.41Å; Y602-N606 VanDerWaalsContact O-CB 3.31Å; Y602-N606 WeakPolarHBondContact O-CB 3.47Å; Y602-N606 PolarHBondContact O-N 3.33Å; I603-N606 PolarHBondContact O-N 3.28Å; R604-N606 VanDerWaalsContact C-N 3.28Å; R604-N606 PolarHBondContact O-N 3.47Å; N606-G610 VanDerWaalsContact O-CA 3.26Å; N606-G610 WeakPolarHBondContact O-CA 3.46Å; N606-G610 PolarHBondContact O-N 3.11Å; N606-T612 PolarHBondContact ND2-O 3.23Å; N606-T612 PolarHBondContact OD1-O 2.66Å; N606-T612 PolarHBondContact OD1-OG1 3.45Å
607	K	93.6	Very high	87.5	Confident	178 Å²	178	79.1 Å²	79.1	77%	0.774	41%	0.413	S	S	*	.	H	α-helix	trans	-65.9	-37.8	175	-175.7	-175.4	176.4	-175.5	0	112.5	I603 R604	I603-K607 PolarHBondContact O-N 3.09Å; R604-K607 WeakPolarHBondContact O-CB 3.47Å; R604-K607 PolarHBondContact O-N 3.27Å
608	D	92.3	Very high	87.1	Confident	101 Å²	101	74 Å²	74	54%	0.54	39%	0.391	S	S	.	.	H	α-helix	trans	-83.6	-28.4	-176.1	-59.6	-26.5	0	0	0	112.5	R604 W605	R604-D608 VanDerWaalsContact O-CG 3.29Å; R604-D608 PolarHBondContact O-N 3.01Å; W605-D608 PolarHBondContact O-N 3.14Å
609	F	91.9	Very high	86.7	Confident	93 Å²	93	74.9 Å²	74.9	41%	0.408	39%	0.393	S	S	.	.	H	α-helix	trans	-136.6	-10.3	-170	-62.4	-73.7	0	0	0	116.8	R501 W605	R501-F609 WeakPolarHBondContact CD-O 3.29Å; R501-F609 PolarHBondContact NH1-O 3.06Å; W605-F609 AromaticContact CD1-CD2 3.76Å; W605-F609 HydrophobicContact CD2-CB 4.08Å; W605-F609 AromaticContact CD2-CD2 3.93Å; W605-F609 HydrophobicContact CD2-CD2 3.93Å; W605-F609 HydrophobicContact CD2-CG 4.42Å; W605-F609 AromaticContact CE2-CD2 3.6Å; W605-F609 AromaticContact CE2-CG 3.99Å; W605-F609 HydrophobicContact CE3-CB 4.03Å; W605-F609 HydrophobicContact CG-CD2 4.02Å; W605-F609 HydrophobicContact CH2-CB 3.75Å; W605-F609 HydrophobicContact CH2-CG 4.5Å; W605-F609 HydrophobicContact CZ2-CB 3.77Å; W605-F609 HydrophobicContact CZ2-CD2 4.11Å; W605-F609 HydrophobicContact CZ2-CG 4.04Å; W605-F609 HydrophobicContact CZ3-CB 3.87Å; W605-F609 AromaticContact NE1-CD2 3.51Å; W605-F609 AromaticContact NE1-CE2 3.9Å; W605-F609 WeakPolarHBondContact O-CB 3.13Å; W605-F609 PolarHBondContact O-N 3.33Å
610	G	87.6	Confident	86.2	Confident	27 Å²	27	76.7 Å²	76.7	28%	0.278	40%	0.402	S	S	.	.			trans	-91.3	160.5	-172.6	0	0	0	0	0	115.2	N606	N606-G610 VanDerWaalsContact O-CA 3.26Å; N606-G610 WeakPolarHBondContact O-CA 3.46Å; N606-G610 PolarHBondContact O-N 3.11Å
611	D	80.5	Confident	85.6	Confident	68 Å²	68	75.9 Å²	75.9	36%	0.364	40%	0.401	S	S	.	.	S	Bend	trans	-89.4	-27.7	172.6	-72.2	-87.9	0	0	0	113.4	K500 R501	K500-D611 VanDerWaalsContact CA-OD2 3.24Å; K500-D611 WeakPolarHBondContact CA-OD2 3.25Å; K500-D611 VanDerWaalsContact CD-CG 3.43Å; K500-D611 WeakPolarHBondContact CD-OD1 3.46Å; K500-D611 VanDerWaalsContact CD-OD2 3.26Å; K500-D611 WeakPolarHBondContact CD-OD2 3.4Å; K500-D611 WeakPolarHBondContact CE-OD1 3.32Å; K500-D611 IonicContact NZ-OD1 2.77Å; K500-D611 PolarHBondContact NZ-OD1 3.4Å; R501-D611 PolarHBondContact N-OD2 3.43Å; R501-D611 PolarHBondContact O-N 2.68Å
612	T	70.8	Confident	84.8	Confident	17 Å²	17	77.4 Å²	77.4	10%	0.104	40%	0.397	C	S	.	.	S	Bend	trans	-88.1	110.3	-173.9	39.3	0	0	0	0	111.2	V502 Y503 N606	V502-T612 HydrophobicContact CG1-CG2 4.09Å; Y503-T612 WeakPolarHBondContact CB-OG1 3.17Å; Y503-T612 PolarHBondContact N-OG1 3.42Å; N606-T612 PolarHBondContact ND2-O 3.23Å; N606-T612 PolarHBondContact OD1-O 2.66Å; N606-T612 PolarHBondContact OD1-OG1 3.45Å
613	T	61.5	Low	84	Confident	123 Å²	123	82.5 Å²	82.5	76%	0.755	43%	0.425	S	S	*	.			trans	-65.2	132.4	164.9	51.9	0	0	0	0	110.2
614	V	51.3	Low	83.1	Confident	137 Å²	137	83.7 Å²	83.7	83%	0.83	43%	0.431	S	S	*	.			trans	-114.8	0	178.8	-176.9	0	0	0	0	108.8	Y503	Y503-V614 HydrophobicContact CD1-CG2 3.58Å; Y503-V614 HydrophobicContact CE1-CG2 4.11Å

Retrieved 614 of 614 residues in 218.5 ms (Link to these results)

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