A0A077ZB82_TRITR Loading...

non-specific serine/threonine protein kinase

AlphaFold DB , UniProt , Accession A0A077ZB82, Species TRITR (Trichuris trichiura, Whipworm), Gene n/a, Length 527 aa.

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(Predicted Aligned Error values between residue pairs)

Download Structure PDB PAE Table

Site	Residue	pLDDT	pLDDT confidence	pLDDT₁₀	pLDDT10 confidence	SASA	SASA [Å²]	SASA₁₀	SASA10 [Å²]	RSA	RSA unformatted	RSA₁₀	RSA10 unformatted	Surface	Surface10 (not used)	Disorder (not used)	Disorder	Sec. str.	Secondary structure	Isomer	Phi (φ)	Psi (ψ)	Omega (ω)	Chi 1 (χ₁)	Chi 2 (χ₂)	Chi 3 (χ₃)	Chi 4 (χ₄)	Chi 5 (χ₅)	Tau (τ)	Contacts (colored by PAE)	Contact details
1	M	38.9	Very low	43.6	Very low	234 Å²	234	160.3 Å²	160.3	100%	1.153	81%	0.813	S	S	*	*				0	104	0	-66.4	171.4	174.2	0	0	105
2	V	42	Very low	44.5	Very low	130 Å²	130	156.5 Å²	156.5	79%	0.788	81%	0.807	S	S	*	*				61.7	126.1	96.7	-169.8	0	0	0	0	111.3
3	D	40.9	Very low	44.2	Very low	152 Å²	152	158.9 Å²	158.9	81%	0.813	81%	0.813	S	S	*	*			cis	-160.7	170.1	-28.5	-102.6	-38.8	0	0	0	107
4	E	39	Very low	44.7	Very low	159 Å²	159	155.7 Å²	155.7	74%	0.743	81%	0.808	S	S	*	*			trans	-79.2	176.5	179.1	-61.2	-176.9	138.6	0	0	114.8
5	N	43.2	Very low	45.2	Very low	137 Å²	137	153.7 Å²	153.7	73%	0.733	81%	0.808	S	S	*	*			trans	77.3	148	152.2	-63.2	-47.4	0	0	0	117.3
6	N	41.3	Very low	44.8	Very low	123 Å²	123	152.3 Å²	152.3	66%	0.658	81%	0.807	S	S	*	*			cis	-168.8	-175.3	-15.4	-177.9	18.9	0	0	0	106.4
7	Y	45.2	Very low	44.8	Very low	203 Å²	203	157.9 Å²	157.9	80%	0.796	82%	0.815	S	S	*	*			trans	125.8	123.1	153.1	-73.1	-74.6	0	0	0	117.8
8	D	42.1	Very low	44.5	Very low	137 Å²	137	158 Å²	158	73%	0.733	82%	0.816	S	S	*	*			trans	-32.8	147.5	169.4	-70.9	-86.2	0	0	0	118.2
9	D	48.5	Very low	44	Very low	163 Å²	163	154.5 Å²	154.5	87%	0.872	81%	0.813	S	S	*	*			trans	-146.2	149	133.2	-144	-19	0	0	0	112.6
10	K	47.2	Very low	43.7	Very low	185 Å²	185	152.6 Å²	152.6	80%	0.804	81%	0.813	S	S	*	*	P	Polyproline II helix	trans	-95.4	143.2	-169.8	-81.4	176.5	176.3	171	0	113.5
11	V	51	Low	43.4	Very low	140 Å²	140	156.5 Å²	156.5	85%	0.848	82%	0.816	S	S	*	*	P	Polyproline II helix	trans	-77.7	140.2	176.1	-170.7	0	0	0	0	111.6
12	P	54.3	Low	43.3	Very low	115 Å²	115	152.4 Å²	152.4	75%	0.747	80%	0.799	S	S	*	*	P	Polyproline II helix	trans	-78.8	158.8	-177.6	-11.1	27.9	0	0	0	114.8
13	Q	40.5	Very low	43.1	Very low	188 Å²	188	151.8 Å²	151.8	88%	0.879	80%	0.798	S	S	*	*	P	Polyproline II helix	trans	-78.4	146.5	170.7	-82.8	-175.7	-36	0	0	113.1
14	P	52.2	Low	42.9	Very low	114 Å²	114	148.8 Å²	148.8	74%	0.74	79%	0.794	S	S	*	*	P	Polyproline II helix	trans	-78	156.6	172	32.6	-34.8	0	0	0	113
15	P	51.4	Low	42.7	Very low	126 Å²	126	150.1 Å²	150.1	82%	0.818	80%	0.8	S	S	*	*	P	Polyproline II helix	trans	-85.1	151.2	-168	33.1	-36.5	0	0	0	115.4
16	V	38.8	Very low	42.4	Very low	130 Å²	130	149.4 Å²	149.4	79%	0.788	80%	0.801	S	S	*	*	P	Polyproline II helix	trans	-80.8	137.5	175	-177.1	0	0	0	0	111
17	R	45.5	Very low	42	Very low	248 Å²	248	152.3 Å²	152.3	94%	0.936	81%	0.808	S	S	*	*			trans	-108.5	129.3	169.3	-82.2	-175.6	171.2	154	-1.4	111.5
18	L	39.4	Very low	41.7	Very low	160 Å²	160	150.3 Å²	150.3	84%	0.838	81%	0.81	S	S	*	*			trans	-97.3	132.7	174.2	-87.6	103	0	0	0	113.2
19	A	34.9	Very low	41.6	Very low	92 Å²	92	151 Å²	151	76%	0.76	81%	0.814	S	S	*	*			trans	22.1	136.8	146.1	0	0	0	0	0	123.7
20	S	36.7	Very low	41.1	Very low	116 Å²	116	150.6 Å²	150.6	81%	0.811	81%	0.811	S	S	*	*			trans	-157.5	112.2	133.7	-73.9	0	0	0	0	107.1
21	R	37.4	Very low	40.8	Very low	235 Å²	235	151.3 Å²	151.3	89%	0.887	81%	0.814	S	S	*	*				55.2	127.2	98.4	-78.3	-172.2	175.8	175.9	-2.1	113.2
22	D	38.4	Very low	40.9	Very low	148 Å²	148	150.3 Å²	150.3	79%	0.791	81%	0.811	S	S	*	*			cis	-144.5	176	44.3	-96.4	-32.2	0	0	0	116
23	P	36.9	Very low	40.1	Very low	117 Å²	117	152.7 Å²	152.7	76%	0.76	82%	0.816	S	S	*	*			trans	-120.1	157.2	-156.8	41.7	-31.8	0	0	0	117.5
24	A	36.2	Very low	40.9	Very low	89 Å²	89	149.5 Å²	149.5	74%	0.736	81%	0.812	S	S	*	*			trans	-162.8	129	150.8	0	0	0	0	0	112.7
25	Q	36	Very low	41.3	Very low	186 Å²	186	155.7 Å²	155.7	87%	0.869	82%	0.82	S	S	*	*			trans	59.9	135.3	155.7	-62	178.2	6.6	0	0	120
26	T	35.9	Very low	41.1	Very low	123 Å²	123	158 Å²	158	76%	0.755	82%	0.82	S	S	*	*			cis	-164.4	140.9	-29.5	0.2	0	0	0	0	108.5
27	F	34.2	Very low	42.1	Very low	184 Å²	184	157.8 Å²	157.8	81%	0.807	82%	0.821	S	S	*	*			trans	55.9	105.9	162.2	-102.6	-97.5	0	0	0	120.7
28	L	39	Very low	42.6	Very low	160 Å²	160	153.7 Å²	153.7	84%	0.838	82%	0.818	S	S	*	*			trans	-121.4	123.5	154	-80.7	168.4	0	0	0	108.5	L30	L28-L30 PolarHBondContact O-N 3.35Å
29	D	38.9	Very low	42.6	Very low	153 Å²	153	149.3 Å²	149.3	82%	0.818	81%	0.812	S	S	*	*			trans	-80.2	100.5	171.3	-104.9	-29.3	0	0	0	110.2
30	L	38.3	Very low	43	Very low	153 Å²	153	152.6 Å²	152.6	80%	0.801	82%	0.816	S	S	*	*			trans	-102.2	109.1	170.4	-74.7	175.1	0	0	0	110.2	L28	L28-L30 PolarHBondContact O-N 3.35Å
31	K	41.3	Very low	43.2	Very low	201 Å²	201	154.3 Å²	154.3	87%	0.874	82%	0.816	S	S	*	*	P	Polyproline II helix	trans	-71.1	129.4	176.8	-152.3	166.1	-169.9	168.1	0	109.8
32	P	52.5	Low	43.1	Very low	119 Å²	119	148.7 Å²	148.7	77%	0.773	81%	0.812	S	S	*	*	P	Polyproline II helix	trans	-67	148	-177.3	-18.1	30.3	0	0	0	112.6
33	L	38.3	Very low	43.2	Very low	164 Å²	164	146.8 Å²	146.8	86%	0.859	81%	0.81	S	S	*	*	P	Polyproline II helix	trans	-75.5	148.9	167.2	-73.6	167.5	0	0	0	110.6
34	P	56.8	Low	43.3	Very low	121 Å²	121	146.7 Å²	146.7	79%	0.786	81%	0.813	S	S	*	*	P	Polyproline II helix	trans	-63.2	151.1	175.4	-20.4	33.1	0	0	0	112.8
35	R	60	Low	43.5	Very low	244 Å²	244	146.5 Å²	146.5	92%	0.921	81%	0.811	S	S	*	*	P	Polyproline II helix	trans	-68	144.1	169.5	-110.9	179.8	174.6	178.4	-4.6	110.9
36	E	48	Very low	43.9	Very low	174 Å²	174	147.4 Å²	147.4	81%	0.813	82%	0.815	S	S	*	*	P	Polyproline II helix	trans	-69.3	147.3	165.2	-64.2	-175.6	146.8	0	0	110.1
37	P	59.5	Low	44.1	Very low	126 Å²	126	145.4 Å²	145.4	82%	0.818	82%	0.819	S	S	*	*			trans	-84.9	115.6	177	32	-30.7	0	0	0	111
38	D	56	Low	44.4	Very low	162 Å²	162	147.6 Å²	147.6	87%	0.866	82%	0.822	S	S	*	*			trans	-64.7	146.5	166.3	-66.2	-56	0	0	0	110.8
39	G	40.3	Very low	44.8	Very low	68 Å²	68	147.8 Å²	147.8	70%	0.701	82%	0.819	S	S	*	*			trans	-90.8	177.8	-178.8	0	0	0	0	0	115
40	D	43.2	Very low	44.9	Very low	161 Å²	161	151 Å²	151	86%	0.861	82%	0.819	S	S	*	*			trans	86.5	147.5	163.7	-58.2	-28.1	0	0	0	120.9
41	D	40	Very low	45.3	Very low	152 Å²	152	152.8 Å²	152.8	81%	0.813	82%	0.815	S	S	*	*			trans	71.9	89.4	167.2	-64.9	-25.1	0	0	0	122.8
42	C	35.5	Very low	45.7	Very low	117 Å²	117	148.3 Å²	148.3	79%	0.791	80%	0.801	S	S	*	*				19.7	124	124.2	-65.9	0	0	0	0	120.1
43	S	39.5	Very low	45.3	Very low	108 Å²	108	150.9 Å²	150.9	76%	0.755	80%	0.8	S	S	*	*				167.5	136.8	94	53.1	0	0	0	0	116.9
44	S	39.3	Very low	45.5	Very low	116 Å²	116	150.6 Å²	150.6	81%	0.811	79%	0.792	S	S	*	*			trans	75.3	161	143.9	81	0	0	0	0	122.9
45	A	41.4	Very low	44.9	Very low	85 Å²	85	150.8 Å²	150.8	70%	0.702	78%	0.782	S	S	*	*			trans	72.7	88.8	171.8	0	0	0	0	0	118.6
46	Q	43.8	Very low	44.2	Very low	204 Å²	204	147.9 Å²	147.9	95%	0.953	78%	0.776	S	S	*	*				77.8	114.3	81.6	-74.2	-177.1	14	0	0	115.9
47	G	39.3	Very low	43.9	Very low	81 Å²	81	150 Å²	150	84%	0.835	78%	0.782	S	S	*	*			trans	179.3	58.4	177.4	0	0	0	0	0	118.8
48	R	41.8	Very low	43	Very low	231 Å²	231	147.9 Å²	147.9	87%	0.872	78%	0.784	S	S	*	*			trans	-4.9	118.6	165.3	-73	170.9	174.4	167.6	-1.3	118.9
49	Q	46.1	Very low	42.2	Very low	164 Å²	164	149.4 Å²	149.4	77%	0.766	78%	0.783	S	S	*	*				72.1	122.2	82.7	-76.5	-173.6	1.6	0	0	118.4
50	R	42.7	Very low	42.5	Very low	221 Å²	221	158.1 Å²	158.1	83%	0.834	80%	0.795	S	S	*	*				-171.3	116.3	124.8	-100.7	165.8	-177.9	-149.2	0	109.3
51	R	46.1	Very low	42.6	Very low	190 Å²	190	159.5 Å²	159.5	72%	0.717	79%	0.793	S	S	*	*				81.4	138.1	83.8	-79.8	-169.3	-174.8	-175.6	-0.3	112.4
52	D	49.3	Very low	42.6	Very low	107 Å²	107	157.3 Å²	157.3	57%	0.572	80%	0.797	S	S	*	*			cis	-167.7	164.3	10.5	-126.6	-14.5	0	0	0	114.4
53	K	44.1	Very low	43.2	Very low	173 Å²	173	161.2 Å²	161.2	75%	0.752	80%	0.8	S	S	*	*			trans	69.2	144	156	-65	160.2	-172.3	174.7	0	117.3
54	K	43.4	Very low	43.6	Very low	158 Å²	158	162.9 Å²	162.9	69%	0.687	80%	0.8	S	S	*	*			cis	-167	163.4	5.2	-115.2	-174.2	169.8	-127.5	0	107.8
55	E	42.9	Very low	44.3	Very low	124 Å²	124	167.1 Å²	167.1	58%	0.579	80%	0.799	S	S	*	*			cis	-159.3	127.7	-11.5	-160.4	148.3	-120.6	0	0	113.8
56	K	45.3	Very low	44.7	Very low	183 Å²	183	171.4 Å²	171.4	80%	0.796	80%	0.804	S	S	*	*			trans	30.8	123.2	144.7	-61.2	174.7	172.1	176	0	122.8
57	K	41.9	Very low	45.3	Very low	218 Å²	218	165.2 Å²	165.2	95%	0.948	80%	0.795	S	S	*	*				170.9	140	125.5	-93.5	165	-174.5	-179.8	0	107.6
58	G	41.1	Very low	46.2	Very low	83 Å²	83	168.4 Å²	168.4	86%	0.856	79%	0.788	S	S	*	*			cis	-160.6	160.7	-6.4	0	0	0	0	0	109.5
59	F	39.1	Very low	47.3	Very low	193 Å²	193	166.1 Å²	166.1	85%	0.846	78%	0.784	S	S	*	*			trans	-103.3	128	-159.4	-172.9	-90.7	0	0	0	113.5
60	R	45.5	Very low	48.4	Very low	251 Å²	251	164 Å²	164	95%	0.947	79%	0.785	S	S	*	*			trans	-141	116.1	158	-79.6	-162.2	167.6	-177.7	-3.9	112.6
61	K	45.5	Very low	50	Low	190 Å²	190	160.3 Å²	160.3	83%	0.826	79%	0.787	S	S	*	*			trans	-10.5	132.7	172.5	-69.5	177.8	171	-177.6	0	118.9
62	A	41.1	Very low	51.4	Low	107 Å²	107	158.7 Å²	158.7	88%	0.884	79%	0.79	S	S	*	*			trans	-64.4	156	162.7	0	0	0	0	0	112.4
63	K	48.7	Very low	52.8	Low	199 Å²	199	157.6 Å²	157.6	87%	0.865	79%	0.792	S	S	*	*			trans	-126.1	134.2	168.4	-171.2	179.5	-176.4	-176.3	0	107	R65	K63-R65 PolarHBondContact O-N 3.41Å
64	D	47.4	Very low	54.3	Low	142 Å²	142	154.6 Å²	154.6	76%	0.759	79%	0.79	S	S	*	*			trans	-55.9	128	-172.9	-64.7	-65.3	0	0	0	112.9	Q66	D64-Q66 HydrophobicContact CB-CG 4.21Å; D64-Q66 PolarHBondContact O-N 2.78Å
65	R	52.7	Low	55.5	Low	205 Å²	205	152.6 Å²	152.6	77%	0.774	79%	0.793	S	S	*	*			trans	-89.5	83.1	158.3	-78.2	-166	177.3	-153.4	3.5	108.7	K63 E68	K63-R65 PolarHBondContact O-N 3.41Å; R65-E68 IonicContact CZ-OE2 3.43Å; R65-E68 IonicContact NH1-OE1 2.91Å; R65-E68 PolarHBondContact NH1-OE1 2.94Å; R65-E68 IonicContact NH1-OE2 3.78Å; R65-E68 PolarHBondContact NH1-OE2 3.43Å
66	Q	51.5	Low	56.8	Low	176 Å²	176	151.7 Å²	151.7	82%	0.822	80%	0.8	S	S	*	*			trans	-72	127.6	166.2	-71.6	174.5	-13.8	0	0	109.6	D64	D64-Q66 HydrophobicContact CB-CG 4.21Å; D64-Q66 PolarHBondContact O-N 2.78Å
67	G	54.8	Low	57.2	Low	73 Å²	73	149.3 Å²	149.3	75%	0.753	80%	0.796	S	S	*	*			trans	83.7	19.3	149	0	0	0	0	0	119.6	K69	G67-K69 PolarHBondContact O-N 3.08Å
68	E	59.4	Low	57.5	Low	148 Å²	148	146.4 Å²	146.4	69%	0.692	78%	0.784	S	S	*	*			trans	-65	99.7	164.3	-82.6	179.2	135.3	0	0	109.2	R65	R65-E68 IonicContact CZ-OE2 3.43Å; R65-E68 IonicContact NH1-OE1 2.91Å; R65-E68 PolarHBondContact NH1-OE1 2.94Å; R65-E68 IonicContact NH1-OE2 3.78Å; R65-E68 PolarHBondContact NH1-OE2 3.43Å
69	K	64.6	Low	57.8	Low	183 Å²	183	148 Å²	148	80%	0.796	77%	0.769	S	S	*	*			trans	-53.3	140.2	172.3	-79.1	-180	173.8	178.6	0	109.6	G67 V71	G67-K69 PolarHBondContact O-N 3.08Å; K69-V71 PolarHBondContact O-N 3.11Å; K69-V71 VanDerWaalsContact O-N 3.08Å
70	P	69.1	Low	58.4	Low	119 Å²	119	145.1 Å²	145.1	77%	0.773	76%	0.758	S	S	*	*			trans	-59.3	118	175.3	24.9	-33.2	0	0	0	109.8	I72	P70-I72 PolarHBondContact O-N 3.24Å; P70-I72 VanDerWaalsContact O-N 3.11Å
71	V	77.4	Confident	58.8	Low	144 Å²	144	137.5 Å²	137.5	87%	0.873	74%	0.739	S	S	*	*			trans	-76.2	100.4	177.1	-179.6	0	0	0	0	107.8	K69 S73	K69-V71 PolarHBondContact O-N 3.11Å; K69-V71 VanDerWaalsContact O-N 3.08Å; V71-S73 PolarHBondContact O-N 2.78Å
72	I	74.7	Confident	59.5	Low	156 Å²	156	130.6 Å²	130.6	80%	0.8	71%	0.713	S	S	*	*	P	Polyproline II helix	trans	-66.7	117.1	173.9	-57.1	175.3	0	0	0	107.6	P70	P70-I72 PolarHBondContact O-N 3.24Å; P70-I72 VanDerWaalsContact O-N 3.11Å
73	S	78.9	Confident	60.8	Low	85 Å²	85	132.6 Å²	132.6	59%	0.594	70%	0.704	S	S	*	*	P	Polyproline II helix	trans	-63.9	148	173.2	54.8	0	0	0	0	110.7	V71	V71-S73 PolarHBondContact O-N 2.78Å
74	P	75.4	Confident	62.1	Low	110 Å²	110	124.6 Å²	124.6	71%	0.714	67%	0.672	S	S	*	*	P	Polyproline II helix	trans	-55.7	150.2	168.9	26.5	-35.2	0	0	0	110.5	S76	P74-S76 PolarHBondContact O-N 2.7Å
75	P	68.1	Low	63.5	Low	116 Å²	116	119.1 Å²	119.1	75%	0.753	65%	0.649	S	S	*	*			trans	-60.6	110.3	-174.3	23.4	-33.7	0	0	0	111.7
76	S	70.6	Confident	64.8	Low	105 Å²	105	112.5 Å²	112.5	73%	0.734	62%	0.624	S	S	*	*	T	Hydrogen-bonded Turn	trans	-77.8	141.6	169	58.3	0	0	0	0	110.4	P74	P74-S76 PolarHBondContact O-N 2.7Å
77	N	54.3	Low	66.2	Low	132 Å²	132	106.8 Å²	106.8	71%	0.706	60%	0.599	S	S	*	*	T	Hydrogen-bonded Turn	trans	60.6	46	176.9	-158.3	84	0	0	0	114.3	E79	N77-E79 PolarHBondContact ND2-OE1 3.06Å; N77-E79 PolarHBondContact O-N 3Å
78	F	48	Very low	67.3	Low	158 Å²	158	107.5 Å²	107.5	69%	0.693	60%	0.598	S	S	*	*			trans	-65	117.6	167.5	-178.6	-97.5	0	0	0	110.6	H80	F78-H80 HydrophobicContact CE1-CB 4.05Å; F78-H80 AromaticContact CE1-CD2 3.84Å; F78-H80 AromaticContact CZ-CD2 3.95Å
79	E	47	Very low	68.2	Low	116 Å²	116	105 Å²	105	54%	0.542	60%	0.603	S	S	.	*			trans	-106.7	120.3	175.4	-71.1	-178.3	-157.8	0	0	109.9	N77 T81	N77-E79 PolarHBondContact ND2-OE1 3.06Å; N77-E79 PolarHBondContact O-N 3Å; E79-T81 PolarHBondContact O-N 3Å
80	H	51.3	Low	69	Low	132 Å²	132	100.2 Å²	100.2	61%	0.611	59%	0.589	S	S	*	*			trans	-90.5	85.1	177.3	-159.3	-105.5	0	0	0	110	F78 V82	F78-H80 HydrophobicContact CE1-CB 4.05Å; F78-H80 AromaticContact CE1-CD2 3.84Å; F78-H80 AromaticContact CZ-CD2 3.95Å; H80-V82 VanDerWaalsContact ND1-CG2 3.35Å; H80-V82 WeakPolarHBondContact ND1-CG2 3.43Å; H80-V82 PolarHBondContact O-N 2.69Å
81	T	53.9	Low	69.3	Low	92 Å²	92	95 Å²	95	56%	0.564	56%	0.557	S	S	*	*			trans	-79.2	82.1	-176	-41	0	0	0	0	111.5	E79 H83	E79-T81 PolarHBondContact O-N 3Å; T81-H83 WeakPolarHBondContact CG2-CE1 3.31Å; T81-H83 PolarHBondContact O-N 3.38Å; T81-H83 VanDerWaalsContact O-N 3.17Å; T81-H83 PolarHBondContact O-ND1 2.96Å
82	V	60.4	Low	69.5	Low	44 Å²	44	93 Å²	93	27%	0.267	54%	0.538	S	S	.	.			trans	-72.5	106.1	173.5	-173.3	0	0	0	0	109.3	H80 G95 P97 M215	H80-V82 VanDerWaalsContact ND1-CG2 3.35Å; H80-V82 WeakPolarHBondContact ND1-CG2 3.43Å; H80-V82 PolarHBondContact O-N 2.69Å; V82-G95 WeakPolarHBondContact CG1-O 3.35Å; V82-P97 HydrophobicContact CB-CG 4.43Å; V82-P97 HydrophobicContact CG1-CG 3.9Å; V82-M215 HydrophobicContact CB-SD 4.41Å
83	H	67.9	Low	69.8	Low	149 Å²	149	86.6 Å²	86.6	69%	0.69	51%	0.505	S	S	*	.			trans	-85.3	112.9	175.6	-69.6	79.6	0	0	0	109.2	T81	T81-H83 WeakPolarHBondContact CG2-CE1 3.31Å; T81-H83 PolarHBondContact O-N 3.38Å; T81-H83 VanDerWaalsContact O-N 3.17Å; T81-H83 PolarHBondContact O-ND1 2.96Å
84	V	76.4	Confident	70	Confident	32 Å²	32	86 Å²	86	19%	0.194	50%	0.498	C	S	.	.			trans	-89.3	110.4	171.8	-170.2	0	0	0	0	108.3	F93 T94 M96 W100 L122	V84-F93 HydrophobicContact CG1-CB 4.36Å; V84-F93 HydrophobicContact CG1-CD1 4.16Å; V84-T94 CarbonylContact C-O 3.5Å; V84-T94 WeakPolarHBondContact CA-O 3.27Å; V84-M96 HydrophobicContact CG1-CB 4.11Å; V84-W100 HydrophobicContact CB-CZ3 4.29Å; V84-W100 HydrophobicContact CG1-CZ3 4.5Å; V84-W100 HydrophobicContact CG2-CE3 3.94Å; V84-W100 HydrophobicContact CG2-CZ3 3.77Å; V84-L122 HydrophobicContact CB-CD2 4.24Å; V84-L122 HydrophobicContact CG1-CD2 3.76Å
85	G	76.1	Confident	70.2	Confident	27 Å²	27	83.1 Å²	83.1	28%	0.278	49%	0.488	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-92.8	161.5	170.4	0	0	0	0	0	111.1	F93 T94	G85-F93 CarbonylContact O-C 3.39Å; G85-F93 VanDerWaalsContact O-CA 3.29Å; G85-F93 WeakPolarHBondContact O-CA 3.27Å; G85-T94 PolarHBondContact N-O 2.76Å; G85-T94 PolarHBondContact O-N 3.08Å
86	Y	81.1	Confident	70.7	Confident	65 Å²	65	79.4 Å²	79.4	26%	0.255	46%	0.46	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-118.1	116.6	163.1	175.1	-98.9	0	0	0	107.5	A88 G91 F93 Q115 P118	Y86-A88 HydrophobicContact CE1-CB 4.23Å; Y86-A88 PolarHBondContact O-N 3.19Å; Y86-G91 WeakPolarHBondContact OH-CA 3.48Å; Y86-F93 AromaticContact CD2-CD1 3.96Å; Y86-F93 HydrophobicContact CD2-CD1 3.96Å; Y86-F93 HydrophobicContact CD2-CD2 4.47Å; Y86-F93 AromaticContact CD2-CE1 3.77Å; Y86-F93 HydrophobicContact CD2-CE1 3.77Å; Y86-F93 HydrophobicContact CD2-CE2 4.31Å; Y86-F93 HydrophobicContact CD2-CG 4.31Å; Y86-F93 AromaticContact CD2-CZ 3.96Å; Y86-F93 HydrophobicContact CD2-CZ 3.96Å; Y86-F93 HydrophobicContact CG-CD1 4.47Å; Y86-F93 HydrophobicContact CG-CE1 4.24Å; Y86-Q115 VanDerWaalsContact OH-CA 3.32Å; Y86-Q115 WeakPolarHBondContact OH-CA 3.5Å; Y86-Q115 WeakPolarHBondContact OH-CG 3.5Å; Y86-P118 HydrophobicContact CD1-CB 3.85Å; Y86-P118 HydrophobicContact CD1-CG 3.85Å; Y86-P118 HydrophobicContact CD2-CB 3.66Å; Y86-P118 HydrophobicContact CD2-CG 4.49Å; Y86-P118 HydrophobicContact CE1-CB 4.12Å; Y86-P118 HydrophobicContact CE1-CG 3.91Å; Y86-P118 HydrophobicContact CE2-CB 3.96Å; Y86-P118 HydrophobicContact CG-CB 3.6Å; Y86-P118 HydrophobicContact CG-CG 4.15Å
87	D	80.9	Confident	71.2	Confident	57 Å²	57	76 Å²	76	31%	0.305	44%	0.436	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-86.4	108.7	176.3	173.3	14.2	0	0	0	109.1	A89 T90 G91 E92 T94	D87-A89 PolarHBondContact O-N 3.14Å; D87-A89 WeakPolarHBondContact OD1-CB 3.47Å; D87-A89 PolarHBondContact OD1-N 3.2Å; D87-T90 WeakPolarHBondContact CB-OG1 3.42Å; D87-T90 WeakPolarHBondContact OD2-CB 3.46Å; D87-T90 VanDerWaalsContact OD2-CG2 3.24Å; D87-T90 WeakPolarHBondContact OD2-CG2 3.23Å; D87-T90 PolarHBondContact OD2-OG1 2.99Å; D87-G91 VanDerWaalsContact O-CA 3.31Å; D87-G91 WeakPolarHBondContact O-CA 3.5Å; D87-G91 PolarHBondContact O-N 3.06Å; D87-E92 PolarHBondContact N-O 2.8Å; D87-E92 PolarHBondContact O-N 3.14Å; D87-T94 HydrophobicContact CB-CG2 4.15Å
88	A	78.5	Confident	72.5	Confident	87 Å²	87	75.9 Å²	75.9	72%	0.719	43%	0.431	S	S	*	.	T	Hydrogen-bonded Turn	trans	-68	-15.6	-179.4	0	0	0	0	0	114	Y86	Y86-A88 HydrophobicContact CE1-CB 4.23Å; Y86-A88 PolarHBondContact O-N 3.19Å
89	A	77.8	Confident	74.1	Confident	97 Å²	97	72 Å²	72	80%	0.802	41%	0.414	S	S	*	.	T	Hydrogen-bonded Turn	trans	-84.3	-40	178.1	0	0	0	0	0	112.5	D87	D87-A89 PolarHBondContact O-N 3.14Å; D87-A89 WeakPolarHBondContact OD1-CB 3.47Å; D87-A89 PolarHBondContact OD1-N 3.2Å
90	T	80.4	Confident	75.9	Confident	82 Å²	82	67 Å²	67	50%	0.503	39%	0.39	S	S	.	.	T	Hydrogen-bonded Turn	trans	-88.5	-22.9	174.9	53.6	0	0	0	0	113	D87 E92	D87-T90 WeakPolarHBondContact CB-OG1 3.42Å; D87-T90 WeakPolarHBondContact OD2-CB 3.46Å; D87-T90 VanDerWaalsContact OD2-CG2 3.24Å; D87-T90 WeakPolarHBondContact OD2-CG2 3.23Å; D87-T90 PolarHBondContact OD2-OG1 2.99Å; T90-E92 VanDerWaalsContact C-N 3.29Å
91	G	76.6	Confident	77.4	Confident	10 Å²	10	63 Å²	63	10%	0.103	38%	0.375	C	S	.	.	T	Hydrogen-bonded Turn	trans	71.5	24.3	-172.5	0	0	0	0	0	113.2	Y86 D87	Y86-G91 WeakPolarHBondContact OH-CA 3.48Å; D87-G91 VanDerWaalsContact O-CA 3.31Å; D87-G91 WeakPolarHBondContact O-CA 3.5Å; D87-G91 PolarHBondContact O-N 3.06Å
92	E	80.7	Confident	78.8	Confident	101 Å²	101	64.2 Å²	64.2	47%	0.472	37%	0.369	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-119.2	149.8	-176.5	-57	-154.1	135.3	0	0	112.5	D87 T90 K111	D87-E92 PolarHBondContact N-O 2.8Å; D87-E92 PolarHBondContact O-N 3.14Å; T90-E92 VanDerWaalsContact C-N 3.29Å; E92-K111 IonicContact OE1-NZ 3.61Å; E92-K111 PolarHBondContact OE1-NZ 2.8Å
93	F	82.2	Confident	79.9	Confident	22 Å²	22	63.3 Å²	63.3	10%	0.096	36%	0.362	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-81.5	118.7	174.3	-71.3	-77.4	0	0	0	110.7	V84 G85 Y86 M96 L104 Q114 P118 V121 L122	V84-F93 HydrophobicContact CG1-CB 4.36Å; V84-F93 HydrophobicContact CG1-CD1 4.16Å; G85-F93 CarbonylContact O-C 3.39Å; G85-F93 VanDerWaalsContact O-CA 3.29Å; G85-F93 WeakPolarHBondContact O-CA 3.27Å; Y86-F93 AromaticContact CD2-CD1 3.96Å; Y86-F93 HydrophobicContact CD2-CD1 3.96Å; Y86-F93 HydrophobicContact CD2-CD2 4.47Å; Y86-F93 AromaticContact CD2-CE1 3.77Å; Y86-F93 HydrophobicContact CD2-CE1 3.77Å; Y86-F93 HydrophobicContact CD2-CE2 4.31Å; Y86-F93 HydrophobicContact CD2-CG 4.31Å; Y86-F93 AromaticContact CD2-CZ 3.96Å; Y86-F93 HydrophobicContact CD2-CZ 3.96Å; Y86-F93 HydrophobicContact CG-CD1 4.47Å; Y86-F93 HydrophobicContact CG-CE1 4.24Å; F93-M96 HydrophobicContact CB-CB 4.27Å; F93-M96 HydrophobicContact CB-CE 3.92Å; F93-M96 HydrophobicContact CB-SD 4.21Å; F93-L104 HydrophobicContact CD2-CD2 4.28Å; F93-L104 HydrophobicContact CE2-CD2 4.36Å; F93-Q114 HydrophobicContact CE2-CB 4.18Å; F93-Q114 HydrophobicContact CE2-CG 4.39Å; F93-P118 HydrophobicContact CE1-CB 4.14Å; F93-P118 HydrophobicContact CZ-CB 3.94Å; F93-V121 HydrophobicContact CE2-CB 4.41Å; F93-V121 HydrophobicContact CE2-CG1 3.94Å; F93-V121 HydrophobicContact CZ-CB 4.05Å; F93-V121 HydrophobicContact CZ-CG1 3.98Å; F93-L122 HydrophobicContact CD1-CD2 4.05Å; F93-L122 HydrophobicContact CD1-CG 4.46Å; F93-L122 HydrophobicContact CE1-CD1 4.14Å; F93-L122 HydrophobicContact CE1-CD2 3.79Å; F93-L122 HydrophobicContact CE1-CG 3.74Å; F93-L122 HydrophobicContact CZ-CG 4.45Å
94	T	81.4	Confident	80.8	Confident	73 Å²	73	56.6 Å²	56.6	45%	0.448	33%	0.332	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-91.9	144.7	177.2	54.9	0	0	0	0	110.6	V84 G85 D87 M96	V84-T94 CarbonylContact C-O 3.5Å; V84-T94 WeakPolarHBondContact CA-O 3.27Å; G85-T94 PolarHBondContact N-O 2.76Å; G85-T94 PolarHBondContact O-N 3.08Å; D87-T94 HydrophobicContact CB-CG2 4.15Å; T94-M96 PolarHBondContact O-N 3.34Å
95	G	80	Confident	81.1	Confident	49 Å²	49	61.9 Å²	61.9	51%	0.505	35%	0.354	S	S	.	.	S	Bend	trans	68.1	10	179.5	0	0	0	0	0	115.6	V82	V82-G95 WeakPolarHBondContact CG1-O 3.35Å
96	M	79.8	Confident	81.5	Confident	37 Å²	37	67 Å²	67	18%	0.182	37%	0.371	C	S	.	.			trans	-62.9	126.7	179.9	-176.4	160.7	51.2	0	0	111.9	V84 F93 T94 W100 T101 L104 L125	V84-M96 HydrophobicContact CG1-CB 4.11Å; F93-M96 HydrophobicContact CB-CB 4.27Å; F93-M96 HydrophobicContact CB-CE 3.92Å; F93-M96 HydrophobicContact CB-SD 4.21Å; T94-M96 PolarHBondContact O-N 3.34Å; M96-W100 HydrophobicContact CG-CB 3.47Å; M96-W100 VanDerWaalsContact CG-CB 3.47Å; M96-W100 HydrophobicContact CG-CE3 4.47Å; M96-W100 HydrophobicContact CG-CG 4.48Å; M96-W100 HydrophobicContact SD-CB 3.89Å; M96-T101 HydrophobicContact CE-CG2 4.2Å; M96-L104 HydrophobicContact CE-CD2 4.11Å; M96-L104 HydrophobicContact SD-CD2 4.17Å; M96-L125 HydrophobicContact SD-CD1 4.18Å
97	P	81.1	Confident	81.6	Confident	33 Å²	33	63.9 Å²	63.9	21%	0.214	36%	0.359	C	S	.	.			trans	-57.4	141.7	174.3	-19	25.2	0	0	0	111.3	V82 K99 W100 T101	V82-P97 HydrophobicContact CB-CG 4.43Å; V82-P97 HydrophobicContact CG1-CG 3.9Å; P97-K99 PolarHBondContact O-N 3.25Å; P97-W100 HydrophobicContact CB-CG 4.38Å; P97-W100 HydrophobicContact CG-CD2 4.27Å; P97-W100 HydrophobicContact CG-CG 4.12Å; P97-W100 WeakPolarHBondContact O-CA 3.45Å; P97-W100 WeakPolarHBondContact O-CB 3.4Å; P97-W100 PolarHBondContact O-N 3.4Å; P97-T101 PolarHBondContact O-N 3.32Å; P97-T101 VanDerWaalsContact O-N 3.1Å; P97-T101 PolarHBondContact O-OG1 2.96Å
98	E	81.3	Confident	81.8	Confident	130 Å²	130	67.9 Å²	67.9	61%	0.607	38%	0.377	S	S	*	.	H	α-helix	trans	-50.1	-37	178.9	-69.9	-174.9	-148.2	0	0	113.7	W100 T101 R102	E98-W100 VanDerWaalsContact C-N 3.3Å; E98-W100 PolarHBondContact O-N 3.07Å; E98-T101 WeakPolarHBondContact O-CB 3.3Å; E98-T101 PolarHBondContact O-N 3.39Å; E98-R102 WeakPolarHBondContact O-CG 3.43Å; E98-R102 PolarHBondContact O-N 2.84Å; E98-R102 IonicContact OE2-CZ 3.59Å; E98-R102 IonicContact OE2-NH2 2.7Å; E98-R102 PolarHBondContact OE2-NH2 3.09Å
99	K	80.9	Confident	82.2	Confident	76 Å²	76	64.1 Å²	64.1	33%	0.33	35%	0.345	S	S	.	.	H	α-helix	trans	-59.9	-41.2	176.4	-167.6	-169	-170.4	174.7	0	111.9	P97 L103 T129 L211	P97-K99 PolarHBondContact O-N 3.25Å; K99-L103 HydrophobicContact CG-CD1 4.29Å; K99-L103 WeakPolarHBondContact O-CB 3.46Å; K99-L103 VanDerWaalsContact O-CG 3.26Å; K99-L103 WeakPolarHBondContact O-CG 3.12Å; K99-L103 PolarHBondContact O-N 3.25Å; K99-T129 HydrophobicContact CD-CG2 4.34Å; K99-L211 HydrophobicContact CD-CD1 4.03Å; K99-L211 HydrophobicContact CG-CD1 4.47Å
100	W	84.3	Confident	82.7	Confident	13 Å²	13	63 Å²	63	5%	0.049	33%	0.328	C	S	.	.	H	α-helix	trans	-69.4	-42.5	177.8	-73.7	26.3	0	0	0	110.2	V84 M96 P97 E98 R102 L103 L104 L122 L125 N126 T129 M215	V84-W100 HydrophobicContact CB-CZ3 4.29Å; V84-W100 HydrophobicContact CG1-CZ3 4.5Å; V84-W100 HydrophobicContact CG2-CE3 3.94Å; V84-W100 HydrophobicContact CG2-CZ3 3.77Å; M96-W100 HydrophobicContact CG-CB 3.47Å; M96-W100 VanDerWaalsContact CG-CB 3.47Å; M96-W100 HydrophobicContact CG-CE3 4.47Å; M96-W100 HydrophobicContact CG-CG 4.48Å; M96-W100 HydrophobicContact SD-CB 3.89Å; P97-W100 HydrophobicContact CB-CG 4.38Å; P97-W100 HydrophobicContact CG-CD2 4.27Å; P97-W100 HydrophobicContact CG-CG 4.12Å; P97-W100 WeakPolarHBondContact O-CA 3.45Å; P97-W100 WeakPolarHBondContact O-CB 3.4Å; P97-W100 PolarHBondContact O-N 3.4Å; E98-W100 VanDerWaalsContact C-N 3.3Å; E98-W100 PolarHBondContact O-N 3.07Å; W100-R102 PolarHBondContact O-N 3.15Å; W100-L103 PolarHBondContact O-N 3.07Å; W100-L104 VanDerWaalsContact O-CB 3.32Å; W100-L104 WeakPolarHBondContact O-CB 3.32Å; W100-L104 PolarHBondContact O-N 2.85Å; W100-L122 HydrophobicContact CZ3-CD2 3.99Å; W100-L125 HydrophobicContact CB-CD1 4.41Å; W100-L125 HydrophobicContact CB-CD2 3.98Å; W100-L125 HydrophobicContact CD2-CB 4.05Å; W100-L125 HydrophobicContact CD2-CD1 4.43Å; W100-L125 HydrophobicContact CE3-CB 3.92Å; W100-L125 HydrophobicContact CE3-CD1 3.91Å; W100-L125 HydrophobicContact CE3-CG 4.44Å; W100-L125 HydrophobicContact CG-CD2 4.23Å; W100-L125 HydrophobicContact CZ3-CB 4.21Å; W100-N126 WeakPolarHBondContact CH2-OD1 3.43Å; W100-T129 VanDerWaalsContact CD1-CG2 3.43Å; W100-T129 PolarHBondContact NE1-OG1 3.24Å; W100-T129 VanDerWaalsContact NE1-OG1 3.17Å; W100-M215 HydrophobicContact CH2-CE 3.93Å; W100-M215 HydrophobicContact CZ2-CE 3.53Å
101	T	83.3	Confident	82.9	Confident	46 Å²	46	65.1 Å²	65.1	28%	0.282	33%	0.331	S	S	.	.	H	α-helix	trans	-56.4	-47.2	174.3	-45.7	0	0	0	0	111.9	M96 P97 E98 L104 Q105	M96-T101 HydrophobicContact CE-CG2 4.2Å; P97-T101 PolarHBondContact O-N 3.32Å; P97-T101 VanDerWaalsContact O-N 3.1Å; P97-T101 PolarHBondContact O-OG1 2.96Å; E98-T101 WeakPolarHBondContact O-CB 3.3Å; E98-T101 PolarHBondContact O-N 3.39Å; T101-L104 PolarHBondContact O-N 3.21Å; T101-Q105 VanDerWaalsContact O-CG 3.27Å; T101-Q105 WeakPolarHBondContact O-CG 3.42Å; T101-Q105 PolarHBondContact O-N 3.41Å
102	R	84.3	Confident	83.4	Confident	119 Å²	119	68.9 Å²	68.9	45%	0.449	36%	0.355	S	S	.	.	H	α-helix	trans	-65.8	-43	177.4	-66.1	177.4	-155.2	-175.8	6.6	112.3	E98 W100 L104 Q105 Q106	E98-R102 WeakPolarHBondContact O-CG 3.43Å; E98-R102 PolarHBondContact O-N 2.84Å; E98-R102 IonicContact OE2-CZ 3.59Å; E98-R102 IonicContact OE2-NH2 2.7Å; E98-R102 PolarHBondContact OE2-NH2 3.09Å; W100-R102 PolarHBondContact O-N 3.15Å; R102-L104 VanDerWaalsContact C-N 3.32Å; R102-L104 PolarHBondContact O-N 3.44Å; R102-Q105 PolarHBondContact O-N 2.95Å; R102-Q106 WeakPolarHBondContact O-CB 3.48Å; R102-Q106 VanDerWaalsContact O-CG 3.32Å; R102-Q106 WeakPolarHBondContact O-CG 3.38Å; R102-Q106 PolarHBondContact O-N 3.13Å
103	L	83.7	Confident	83.8	Confident	24 Å²	24	66 Å²	66	13%	0.126	34%	0.341	C	S	.	.	H	α-helix	trans	-61.2	-41.1	175.4	-77.3	170.2	0	0	0	111.8	K99 W100 Q106 S107 L125 F128 T129 L448	K99-L103 HydrophobicContact CG-CD1 4.29Å; K99-L103 WeakPolarHBondContact O-CB 3.46Å; K99-L103 VanDerWaalsContact O-CG 3.26Å; K99-L103 WeakPolarHBondContact O-CG 3.12Å; K99-L103 PolarHBondContact O-N 3.25Å; W100-L103 PolarHBondContact O-N 3.07Å; L103-Q106 CarbonylContact O-C 3.53Å; L103-Q106 PolarHBondContact O-N 3.49Å; L103-S107 VanDerWaalsContact O-CB 3.29Å; L103-S107 WeakPolarHBondContact O-CB 3.49Å; L103-S107 PolarHBondContact O-N 2.89Å; L103-L125 HydrophobicContact CB-CD2 4.08Å; L103-F128 HydrophobicContact CD1-CD1 4.36Å; L103-F128 HydrophobicContact CD2-CD1 3.81Å; L103-F128 HydrophobicContact CD2-CE1 4.13Å; L103-T129 HydrophobicContact CD1-CG2 3.6Å; L103-L448 HydrophobicContact CB-CD1 4.02Å
104	L	85.3	Confident	84.1	Confident	8 Å²	8	66.2 Å²	66.2	4%	0.042	34%	0.343	C	S	.	.	H	α-helix	trans	-67.5	-42.9	179.3	-170.2	57.6	0	0	0	111.4	F93 M96 W100 T101 R102 Q106 S107 I109 Q114 V121 L125	F93-L104 HydrophobicContact CD2-CD2 4.28Å; F93-L104 HydrophobicContact CE2-CD2 4.36Å; M96-L104 HydrophobicContact CE-CD2 4.11Å; M96-L104 HydrophobicContact SD-CD2 4.17Å; W100-L104 VanDerWaalsContact O-CB 3.32Å; W100-L104 WeakPolarHBondContact O-CB 3.32Å; W100-L104 PolarHBondContact O-N 2.85Å; T101-L104 PolarHBondContact O-N 3.21Å; R102-L104 VanDerWaalsContact C-N 3.32Å; R102-L104 PolarHBondContact O-N 3.44Å; L104-Q106 VanDerWaalsContact C-N 3.31Å; L104-Q106 PolarHBondContact O-N 3.26Å; L104-S107 WeakPolarHBondContact CA-OG 3.44Å; L104-S107 PolarHBondContact O-N 2.85Å; L104-S107 VanDerWaalsContact O-N 3.13Å; L104-S107 PolarHBondContact O-OG 3.23Å; L104-I109 HydrophobicContact CD1-CB 4.17Å; L104-I109 HydrophobicContact CD1-CD1 4.29Å; L104-Q114 HydrophobicContact CD1-CG 4.33Å; L104-Q114 HydrophobicContact CD2-CG 4.37Å; L104-V121 HydrophobicContact CD1-CG1 3.53Å; L104-V121 HydrophobicContact CD2-CG1 4.15Å; L104-L125 HydrophobicContact CB-CD2 4.38Å; L104-L125 HydrophobicContact CD2-CD1 4.49Å
105	Q	84.2	Confident	84.3	Confident	143 Å²	143	67.2 Å²	67.2	67%	0.668	34%	0.343	S	S	*	.	H	α-helix	trans	-58.5	-40.4	171.9	-73.5	167.9	-13.6	0	0	112.4	T101 R102 S107	T101-Q105 VanDerWaalsContact O-CG 3.27Å; T101-Q105 WeakPolarHBondContact O-CG 3.42Å; T101-Q105 PolarHBondContact O-N 3.41Å; R102-Q105 PolarHBondContact O-N 2.95Å; Q105-S107 VanDerWaalsContact C-N 3.31Å
106	Q	84.2	Confident	84.7	Confident	134 Å²	134	72.7 Å²	72.7	63%	0.626	35%	0.353	S	S	*	.	H	α-helix	trans	-79.2	-9.6	177.6	-70.5	175.6	-23.7	0	0	114	R102 L103 L104 N446	R102-Q106 WeakPolarHBondContact O-CB 3.48Å; R102-Q106 VanDerWaalsContact O-CG 3.32Å; R102-Q106 WeakPolarHBondContact O-CG 3.38Å; R102-Q106 PolarHBondContact O-N 3.13Å; L103-Q106 CarbonylContact O-C 3.53Å; L103-Q106 PolarHBondContact O-N 3.49Å; L104-Q106 VanDerWaalsContact C-N 3.31Å; L104-Q106 PolarHBondContact O-N 3.26Å; Q106-N446 PolarHBondContact O-ND2 3.15Å; Q106-N446 VanDerWaalsContact O-ND2 3.16Å
107	S	82.9	Confident	85.1	Confident	0 Å²	0	73.4 Å²	73.4	0%	0	36%	0.357	C	S	.	.	T	Hydrogen-bonded Turn	trans	-89.6	-0.2	-175.3	71.3	0	0	0	0	115.1	L103 L104 Q105 I109 N446 R449	L103-S107 VanDerWaalsContact O-CB 3.29Å; L103-S107 WeakPolarHBondContact O-CB 3.49Å; L103-S107 PolarHBondContact O-N 2.89Å; L104-S107 WeakPolarHBondContact CA-OG 3.44Å; L104-S107 PolarHBondContact O-N 2.85Å; L104-S107 VanDerWaalsContact O-N 3.13Å; L104-S107 PolarHBondContact O-OG 3.23Å; Q105-S107 VanDerWaalsContact C-N 3.31Å; S107-I109 PolarHBondContact O-N 3.16Å; S107-I109 WeakPolarHBondContact OG-CG1 3.49Å; S107-N446 WeakPolarHBondContact CA-ND2 3.34Å; S107-R449 WeakPolarHBondContact O-CB 3.44Å; S107-R449 WeakPolarHBondContact O-CD 3.36Å
108	M	85.4	Confident	85.4	Confident	142 Å²	142	73.4 Å²	73.4	70%	0.7	36%	0.357	S	S	*	.	T	Hydrogen-bonded Turn	trans	55.4	17.3	-177.6	-53.9	-70.1	-85.4	0	0	113.9	T110 R449	M108-T110 PolarHBondContact O-N 3.31Å; M108-R449 PolarHBondContact O-NH1 3.24Å
109	I	86	Confident	85.6	Confident	7 Å²	7	72.6 Å²	72.6	4%	0.036	35%	0.353	C	S	.	.			trans	-82.8	108.5	172.2	-56.8	174.3	0	0	0	107.4	L104 S107 E113 Q114 V121 L448 R449 Y452	L104-I109 HydrophobicContact CD1-CB 4.17Å; L104-I109 HydrophobicContact CD1-CD1 4.29Å; S107-I109 PolarHBondContact O-N 3.16Å; S107-I109 WeakPolarHBondContact OG-CG1 3.49Å; I109-E113 HydrophobicContact CG2-CB 3.74Å; I109-Q114 HydrophobicContact CG2-CG 3.93Å; I109-Q114 PolarHBondContact O-NE2 2.82Å; I109-V121 HydrophobicContact CG2-CG2 4.07Å; I109-L448 HydrophobicContact CD1-CD2 3.63Å; I109-R449 HydrophobicContact CG1-CB 4.47Å; I109-R449 HydrophobicContact CG1-CG 4.38Å; I109-Y452 HydrophobicContact CD1-CD1 4.29Å; I109-Y452 HydrophobicContact CD1-CD2 4.25Å; I109-Y452 HydrophobicContact CD1-CG 3.81Å; I109-Y452 HydrophobicContact CG1-CD1 4.34Å; I109-Y452 HydrophobicContact CG1-CG 4.35Å; I109-Y452 HydrophobicContact CG2-CD1 4.43Å; I109-Y452 HydrophobicContact CG2-CD2 4.49Å; I109-Y452 HydrophobicContact CG2-CE1 4.39Å; I109-Y452 HydrophobicContact CG2-CE2 4.42Å
110	T	88.2	Confident	85.9	Confident	74 Å²	74	69.6 Å²	69.6	45%	0.454	34%	0.342	S	S	.	.			trans	-63.6	157	-176.3	63.6	0	0	0	0	112.3	M108 S112 E113 Q114	M108-T110 PolarHBondContact O-N 3.31Å; T110-S112 PolarHBondContact O-N 2.88Å; T110-E113 VanDerWaalsContact CB-OE2 3.31Å; T110-E113 WeakPolarHBondContact CB-OE2 3.08Å; T110-E113 WeakPolarHBondContact CG2-OE2 3.42Å; T110-E113 PolarHBondContact N-OE2 2.87Å; T110-E113 PolarHBondContact O-N 2.69Å; T110-E113 VanDerWaalsContact O-N 3.15Å; T110-E113 WeakPolarHBondContact OG1-CB 3.32Å; T110-E113 WeakPolarHBondContact OG1-CG 3.41Å; T110-E113 PolarHBondContact OG1-N 3.26Å; T110-E113 PolarHBondContact OG1-OE2 3.06Å; T110-Q114 WeakPolarHBondContact O-CG 3.48Å; T110-Q114 PolarHBondContact O-N 2.9Å
111	K	85.5	Confident	86.1	Confident	127 Å²	127	69 Å²	69	55%	0.552	34%	0.34	S	S	*	.	H	α-helix	trans	-56.5	-33.8	174	-76.8	-164	167.8	-158.9	0	112.4	E92 Q114 Q115	E92-K111 IonicContact OE1-NZ 3.61Å; E92-K111 PolarHBondContact OE1-NZ 2.8Å; K111-Q114 PolarHBondContact O-N 2.91Å; K111-Q115 VanDerWaalsContact O-CG 3.25Å; K111-Q115 WeakPolarHBondContact O-CG 3.42Å; K111-Q115 PolarHBondContact O-N 2.92Å
112	S	87.5	Confident	86.2	Confident	88 Å²	88	67.8 Å²	67.8	62%	0.615	33%	0.332	S	S	*	.	H	α-helix	trans	-66.6	-44.4	176.2	-174.1	0	0	0	0	112.4	T110 Q115 K116	T110-S112 PolarHBondContact O-N 2.88Å; S112-Q115 PolarHBondContact O-N 3.44Å; S112-K116 WeakPolarHBondContact O-CB 3.47Å; S112-K116 PolarHBondContact O-N 2.91Å
113	E	88.6	Confident	86.2	Confident	40 Å²	40	62.9 Å²	62.9	19%	0.187	32%	0.315	C	S	.	.	H	α-helix	trans	-60.9	-43.9	172.8	-78.1	162.8	130.3	0	0	111.9	I109 T110 Q115 K116 N117 R449 Y452	I109-E113 HydrophobicContact CG2-CB 3.74Å; T110-E113 VanDerWaalsContact CB-OE2 3.31Å; T110-E113 WeakPolarHBondContact CB-OE2 3.08Å; T110-E113 WeakPolarHBondContact CG2-OE2 3.42Å; T110-E113 PolarHBondContact N-OE2 2.87Å; T110-E113 PolarHBondContact O-N 2.69Å; T110-E113 VanDerWaalsContact O-N 3.15Å; T110-E113 WeakPolarHBondContact OG1-CB 3.32Å; T110-E113 WeakPolarHBondContact OG1-CG 3.41Å; T110-E113 PolarHBondContact OG1-N 3.26Å; T110-E113 PolarHBondContact OG1-OE2 3.06Å; E113-Q115 VanDerWaalsContact C-N 3.34Å; E113-Q115 PolarHBondContact O-N 2.92Å; E113-K116 PolarHBondContact O-N 2.94Å; E113-N117 PolarHBondContact O-N 2.85Å; E113-R449 IonicContact OE1-CZ 3.71Å; E113-R449 IonicContact OE1-NH1 3.67Å; E113-R449 PolarHBondContact OE1-NH1 2.93Å; E113-R449 IonicContact OE1-NH2 2.69Å; E113-R449 IonicContact OE2-NH1 2.69Å; E113-R449 PolarHBondContact OE2-NH1 3.3Å; E113-Y452 HydrophobicContact CB-CE1 4.1Å; E113-Y452 WeakPolarHBondContact CB-OH 3.17Å; E113-Y452 HydrophobicContact CG-CE1 4.16Å; E113-Y452 PolarHBondContact O-OH 3.22Å
114	Q	87.4	Confident	86.2	Confident	27 Å²	27	61.8 Å²	61.8	13%	0.126	31%	0.309	C	S	.	.	H	α-helix	trans	-58.4	-44.4	175.9	-67.2	170	41.2	0	0	112.2	F93 L104 I109 T110 K111 N117 P118 V121	F93-Q114 HydrophobicContact CE2-CB 4.18Å; F93-Q114 HydrophobicContact CE2-CG 4.39Å; L104-Q114 HydrophobicContact CD1-CG 4.33Å; L104-Q114 HydrophobicContact CD2-CG 4.37Å; I109-Q114 HydrophobicContact CG2-CG 3.93Å; I109-Q114 PolarHBondContact O-NE2 2.82Å; T110-Q114 WeakPolarHBondContact O-CG 3.48Å; T110-Q114 PolarHBondContact O-N 2.9Å; K111-Q114 PolarHBondContact O-N 2.91Å; Q114-N117 CarbonylContact O-C 3.57Å; Q114-P118 VanDerWaalsContact O-CA 3.29Å; Q114-P118 WeakPolarHBondContact O-CA 3.35Å; Q114-P118 WeakPolarHBondContact O-CD 3.18Å; Q114-V121 HydrophobicContact CB-CG2 4.46Å; Q114-V121 HydrophobicContact CG-CG1 4.49Å; Q114-V121 HydrophobicContact CG-CG2 4.15Å
115	Q	86.2	Confident	86.2	Confident	95 Å²	95	61.4 Å²	61.4	44%	0.444	31%	0.307	S	S	.	.	H	α-helix	trans	-69.9	-34.2	179.1	-71.4	172.8	-2.5	0	0	112.8	Y86 K111 S112 E113	Y86-Q115 VanDerWaalsContact OH-CA 3.32Å; Y86-Q115 WeakPolarHBondContact OH-CA 3.5Å; Y86-Q115 WeakPolarHBondContact OH-CG 3.5Å; K111-Q115 VanDerWaalsContact O-CG 3.25Å; K111-Q115 WeakPolarHBondContact O-CG 3.42Å; K111-Q115 PolarHBondContact O-N 2.92Å; S112-Q115 PolarHBondContact O-N 3.44Å; E113-Q115 VanDerWaalsContact C-N 3.34Å; E113-Q115 PolarHBondContact O-N 2.92Å
116	K	89.3	Confident	85.9	Confident	164 Å²	164	56.3 Å²	56.3	71%	0.713	28%	0.284	S	S	*	.	H	α-helix	trans	-70.3	-39.3	179.2	-169.3	-179.4	-179.8	-176.7	0	112.6	S112 E113	S112-K116 WeakPolarHBondContact O-CB 3.47Å; S112-K116 PolarHBondContact O-N 2.91Å; E113-K116 PolarHBondContact O-N 2.94Å
117	N	87.4	Confident	85.3	Confident	52 Å²	52	50.6 Å²	50.6	28%	0.278	26%	0.257	S	S	.	.			trans	-138.2	64.6	-175.5	-60.6	-70	0	0	0	112.6	E113 Q114 Q119 A120 V121 Y452 T456	E113-N117 PolarHBondContact O-N 2.85Å; Q114-N117 CarbonylContact O-C 3.57Å; N117-Q119 VanDerWaalsContact C-N 3.28Å; N117-Q119 PolarHBondContact O-N 3.02Å; N117-A120 HydrophobicContact CB-CB 3.97Å; N117-A120 PolarHBondContact O-N 2.86Å; N117-A120 VanDerWaalsContact O-N 3.09Å; N117-V121 PolarHBondContact O-N 2.91Å; N117-Y452 HydrophobicContact CB-CE2 4.02Å; N117-Y452 PolarHBondContact ND2-OH 3.23Å; N117-T456 HydrophobicContact CB-CG2 3.75Å; N117-T456 WeakPolarHBondContact ND2-CG2 3.37Å
118	P	87.7	Confident	84.6	Confident	32 Å²	32	52.5 Å²	52.5	21%	0.208	27%	0.265	C	S	.	.	H	α-helix	trans	-61.6	-34.3	-173.4	23.1	-34	0	0	0	113.1	Y86 F93 Q114 V121 L122	Y86-P118 HydrophobicContact CD1-CB 3.85Å; Y86-P118 HydrophobicContact CD1-CG 3.85Å; Y86-P118 HydrophobicContact CD2-CB 3.66Å; Y86-P118 HydrophobicContact CD2-CG 4.49Å; Y86-P118 HydrophobicContact CE1-CB 4.12Å; Y86-P118 HydrophobicContact CE1-CG 3.91Å; Y86-P118 HydrophobicContact CE2-CB 3.96Å; Y86-P118 HydrophobicContact CG-CB 3.6Å; Y86-P118 HydrophobicContact CG-CG 4.15Å; F93-P118 HydrophobicContact CE1-CB 4.14Å; F93-P118 HydrophobicContact CZ-CB 3.94Å; Q114-P118 VanDerWaalsContact O-CA 3.29Å; Q114-P118 WeakPolarHBondContact O-CA 3.35Å; Q114-P118 WeakPolarHBondContact O-CD 3.18Å; P118-V121 PolarHBondContact O-N 3.24Å; P118-L122 WeakPolarHBondContact O-CG 3.45Å; P118-L122 PolarHBondContact O-N 3.19Å
119	Q	86.3	Confident	83.9	Confident	114 Å²	114	46.8 Å²	46.8	53%	0.533	24%	0.238	S	C	.	.	H	α-helix	trans	-65.8	-39	176.1	-173.7	59.1	47.1	0	0	112.7	N117 V121 L122 D123	N117-Q119 VanDerWaalsContact C-N 3.28Å; N117-Q119 PolarHBondContact O-N 3.02Å; Q119-V121 VanDerWaalsContact C-N 3.29Å; Q119-V121 PolarHBondContact O-N 3.07Å; Q119-L122 PolarHBondContact O-N 3.44Å; Q119-D123 PolarHBondContact NE2-OD1 3.06Å; Q119-D123 VanDerWaalsContact O-CG 3.31Å; Q119-D123 PolarHBondContact O-N 3.27Å
120	A	87.3	Confident	82.9	Confident	12 Å²	12	49.8 Å²	49.8	10%	0.099	26%	0.257	C	S	.	.	H	α-helix	trans	-65.4	-35.7	178.3	0	0	0	0	0	111.6	N117 D123 A124 Y452 A455 T456	N117-A120 HydrophobicContact CB-CB 3.97Å; N117-A120 PolarHBondContact O-N 2.86Å; N117-A120 VanDerWaalsContact O-N 3.09Å; A120-D123 PolarHBondContact O-N 3.31Å; A120-A124 WeakPolarHBondContact O-CB 3.43Å; A120-A124 PolarHBondContact O-N 3.13Å; A120-Y452 HydrophobicContact CB-CD2 3.88Å; A120-Y452 HydrophobicContact CB-CE2 4.04Å; A120-A455 HydrophobicContact CB-CB 4.16Å; A120-T456 HydrophobicContact CB-CG2 3.73Å
121	V	88.3	Confident	81.2	Confident	0 Å²	0	46.6 Å²	46.6	0%	0	24%	0.238	C	C	.	.	H	α-helix	trans	-65.6	-44	172.8	176.7	0	0	0	0	111.3	F93 L104 I109 Q114 N117 P118 Q119 D123 A124 L125 Y452	F93-V121 HydrophobicContact CE2-CB 4.41Å; F93-V121 HydrophobicContact CE2-CG1 3.94Å; F93-V121 HydrophobicContact CZ-CB 4.05Å; F93-V121 HydrophobicContact CZ-CG1 3.98Å; L104-V121 HydrophobicContact CD1-CG1 3.53Å; L104-V121 HydrophobicContact CD2-CG1 4.15Å; I109-V121 HydrophobicContact CG2-CG2 4.07Å; Q114-V121 HydrophobicContact CB-CG2 4.46Å; Q114-V121 HydrophobicContact CG-CG1 4.49Å; Q114-V121 HydrophobicContact CG-CG2 4.15Å; N117-V121 PolarHBondContact O-N 2.91Å; P118-V121 PolarHBondContact O-N 3.24Å; Q119-V121 VanDerWaalsContact C-N 3.29Å; Q119-V121 PolarHBondContact O-N 3.07Å; V121-D123 PolarHBondContact O-N 3.25Å; V121-A124 PolarHBondContact O-N 3Å; V121-L125 HydrophobicContact CG1-CD1 3.89Å; V121-L125 HydrophobicContact CG1-CG 4.47Å; V121-L125 WeakPolarHBondContact O-CB 3.44Å; V121-L125 WeakPolarHBondContact O-CG 3.41Å; V121-L125 PolarHBondContact O-N 3.28Å; V121-Y452 HydrophobicContact CG2-CD2 3.7Å; V121-Y452 HydrophobicContact CG2-CE2 3.7Å
122	L	85.2	Confident	79.5	Confident	22 Å²	22	42.8 Å²	42.8	12%	0.115	22%	0.223	C	C	.	.	H	α-helix	trans	-61.6	-42	174.6	-69.7	172.8	0	0	0	111.8	V84 F93 W100 P118 Q119 N126	V84-L122 HydrophobicContact CB-CD2 4.24Å; V84-L122 HydrophobicContact CG1-CD2 3.76Å; F93-L122 HydrophobicContact CD1-CD2 4.05Å; F93-L122 HydrophobicContact CD1-CG 4.46Å; F93-L122 HydrophobicContact CE1-CD1 4.14Å; F93-L122 HydrophobicContact CE1-CD2 3.79Å; F93-L122 HydrophobicContact CE1-CG 3.74Å; F93-L122 HydrophobicContact CZ-CG 4.45Å; W100-L122 HydrophobicContact CZ3-CD2 3.99Å; P118-L122 WeakPolarHBondContact O-CG 3.45Å; P118-L122 PolarHBondContact O-N 3.19Å; Q119-L122 PolarHBondContact O-N 3.44Å; L122-N126 WeakPolarHBondContact O-CB 3.34Å; L122-N126 VanDerWaalsContact O-CG 3.31Å; L122-N126 PolarHBondContact O-N 3.25Å; L122-N126 PolarHBondContact O-ND2 3.41Å
123	D	83.8	Confident	77.5	Confident	16 Å²	16	44.3 Å²	44.3	9%	0.086	22%	0.218	C	C	.	.	H	α-helix	trans	-64.5	-41.7	178.5	-71.3	-16.9	0	0	0	111.7	Q119 A120 V121 N126 Y127	Q119-D123 PolarHBondContact NE2-OD1 3.06Å; Q119-D123 VanDerWaalsContact O-CG 3.31Å; Q119-D123 PolarHBondContact O-N 3.27Å; A120-D123 PolarHBondContact O-N 3.31Å; V121-D123 PolarHBondContact O-N 3.25Å; D123-N126 WeakPolarHBondContact O-CB 3.4Å; D123-N126 PolarHBondContact O-N 3.38Å; D123-Y127 PolarHBondContact O-N 2.7Å
124	A	84.1	Confident	75.1	Confident	0 Å²	0	43.4 Å²	43.4	0%	0	22%	0.218	C	C	.	.	H	α-helix	trans	-66.4	-45.8	175.9	0	0	0	0	0	113.1	A120 V121 N126 Y127 F128 L448 I451	A120-A124 WeakPolarHBondContact O-CB 3.43Å; A120-A124 PolarHBondContact O-N 3.13Å; V121-A124 PolarHBondContact O-N 3Å; A124-N126 VanDerWaalsContact C-N 3.28Å; A124-N126 PolarHBondContact O-N 2.99Å; A124-Y127 WeakPolarHBondContact O-CB 3.45Å; A124-Y127 PolarHBondContact O-N 3.03Å; A124-F128 PolarHBondContact O-N 3.32Å; A124-F128 VanDerWaalsContact O-N 3.08Å; A124-L448 HydrophobicContact CB-CD2 3.73Å; A124-L448 HydrophobicContact CB-CG 4.25Å; A124-I451 HydrophobicContact CB-CB 4.37Å; A124-I451 HydrophobicContact CB-CG2 3.79Å
125	L	84.8	Confident	72.7	Confident	0 Å²	0	42.8 Å²	42.8	0%	0	22%	0.217	C	C	.	.	H	α-helix	trans	-60	-40.1	172.9	-77.9	166.7	0	0	0	111.7	M96 W100 L103 L104 V121 F128 T129 L448	M96-L125 HydrophobicContact SD-CD1 4.18Å; W100-L125 HydrophobicContact CB-CD1 4.41Å; W100-L125 HydrophobicContact CB-CD2 3.98Å; W100-L125 HydrophobicContact CD2-CB 4.05Å; W100-L125 HydrophobicContact CD2-CD1 4.43Å; W100-L125 HydrophobicContact CE3-CB 3.92Å; W100-L125 HydrophobicContact CE3-CD1 3.91Å; W100-L125 HydrophobicContact CE3-CG 4.44Å; W100-L125 HydrophobicContact CG-CD2 4.23Å; W100-L125 HydrophobicContact CZ3-CB 4.21Å; L103-L125 HydrophobicContact CB-CD2 4.08Å; L104-L125 HydrophobicContact CB-CD2 4.38Å; L104-L125 HydrophobicContact CD2-CD1 4.49Å; V121-L125 HydrophobicContact CG1-CD1 3.89Å; V121-L125 HydrophobicContact CG1-CG 4.47Å; V121-L125 WeakPolarHBondContact O-CB 3.44Å; V121-L125 WeakPolarHBondContact O-CG 3.41Å; V121-L125 PolarHBondContact O-N 3.28Å; L125-F128 PolarHBondContact O-N 3.29Å; L125-T129 WeakPolarHBondContact O-CB 3.45Å; L125-T129 WeakPolarHBondContact O-CG2 3.22Å; L125-T129 PolarHBondContact O-N 2.91Å; L125-T129 PolarHBondContact O-OG1 3Å; L125-L448 HydrophobicContact CD2-CD1 4.07Å
126	N	78.1	Confident	70.3	Confident	37 Å²	37	45.6 Å²	45.6	20%	0.198	23%	0.227	C	C	.	.	H	α-helix	trans	-64.8	-40	176.1	-91.5	-62.5	0	0	0	112.3	W100 L122 D123 A124 T130 R416	W100-N126 WeakPolarHBondContact CH2-OD1 3.43Å; L122-N126 WeakPolarHBondContact O-CB 3.34Å; L122-N126 VanDerWaalsContact O-CG 3.31Å; L122-N126 PolarHBondContact O-N 3.25Å; L122-N126 PolarHBondContact O-ND2 3.41Å; D123-N126 WeakPolarHBondContact O-CB 3.4Å; D123-N126 PolarHBondContact O-N 3.38Å; A124-N126 VanDerWaalsContact C-N 3.28Å; A124-N126 PolarHBondContact O-N 2.99Å; N126-T130 WeakPolarHBondContact O-CB 3.34Å; N126-T130 PolarHBondContact O-N 2.73Å; N126-T130 PolarHBondContact O-OG1 2.78Å; N126-R416 PolarHBondContact O-NH2 3.43Å
127	Y	71.8	Confident	67.7	Low	13 Å²	13	43.8 Å²	43.8	5%	0.051	22%	0.221	C	C	.	.	H	α-helix	trans	-56	-59.2	169.6	174.6	-106.2	0	0	0	110.6	D123 A124 T129 T130 D131 M402 G404 P406 M409 I451	D123-Y127 PolarHBondContact O-N 2.7Å; A124-Y127 WeakPolarHBondContact O-CB 3.45Å; A124-Y127 PolarHBondContact O-N 3.03Å; Y127-T129 PolarHBondContact O-N 2.99Å; Y127-T130 PolarHBondContact O-N 2.88Å; Y127-T130 VanDerWaalsContact O-N 3.14Å; Y127-D131 PolarHBondContact O-N 2.8Å; Y127-M402 VanDerWaalsContact CB-SD 3.5Å; Y127-M402 HydrophobicContact CD2-CB 4.46Å; Y127-M402 HydrophobicContact CD2-CG 3.76Å; Y127-M402 HydrophobicContact CD2-SD 3.27Å; Y127-M402 WeakPolarHBondContact CD2-SD 3.5Å; Y127-M402 HydrophobicContact CE2-CG 4.28Å; Y127-M402 HydrophobicContact CE2-SD 4.25Å; Y127-M402 HydrophobicContact CG-SD 3.75Å; Y127-G404 PolarHBondContact OH-O 3.34Å; Y127-P406 HydrophobicContact CE1-CG 3.98Å; Y127-P406 WeakPolarHBondContact OH-CD 3.39Å; Y127-P406 WeakPolarHBondContact OH-CG 3.47Å; Y127-M409 HydrophobicContact CD2-CE 4.46Å; Y127-M409 HydrophobicContact CE2-CE 4.16Å; Y127-M409 HydrophobicContact CE2-SD 4.15Å; Y127-I451 HydrophobicContact CD1-CD1 3.07Å; Y127-I451 HydrophobicContact CD2-CD1 4.15Å; Y127-I451 HydrophobicContact CE1-CD1 3.32Å; Y127-I451 HydrophobicContact CE2-CD1 4.3Å; Y127-I451 HydrophobicContact CG-CD1 3.5Å; Y127-I451 VanDerWaalsContact CG-CD1 3.5Å
128	F	68.7	Low	65.4	Low	40 Å²	40	44 Å²	44	18%	0.175	22%	0.22	C	C	.	.	H	α-helix	trans	-61.8	-27.6	-168.6	-132.8	-91.9	0	0	0	112.2	L103 A124 L125 N132 P447 L448	L103-F128 HydrophobicContact CD1-CD1 4.36Å; L103-F128 HydrophobicContact CD2-CD1 3.81Å; L103-F128 HydrophobicContact CD2-CE1 4.13Å; A124-F128 PolarHBondContact O-N 3.32Å; A124-F128 VanDerWaalsContact O-N 3.08Å; L125-F128 PolarHBondContact O-N 3.29Å; F128-N132 WeakPolarHBondContact CD1-ND2 3.35Å; F128-N132 WeakPolarHBondContact O-CB 3.2Å; F128-N132 PolarHBondContact O-N 3.01Å; F128-N132 PolarHBondContact O-ND2 3.42Å; F128-P447 HydrophobicContact CE2-CB 3.94Å; F128-P447 HydrophobicContact CE2-CG 3.82Å; F128-P447 HydrophobicContact CZ-CG 4.06Å; F128-L448 HydrophobicContact CB-CD1 3.91Å; F128-L448 HydrophobicContact CB-CG 4.32Å; F128-L448 HydrophobicContact CD2-CB 3.65Å; F128-L448 HydrophobicContact CD2-CD1 4.19Å; F128-L448 HydrophobicContact CD2-CG 4.05Å; F128-L448 HydrophobicContact CE2-CB 3.91Å; F128-L448 HydrophobicContact CG-CB 4.28Å; F128-L448 HydrophobicContact CG-CD1 3.96Å; F128-L448 HydrophobicContact CG-CG 4.3Å
129	T	70.5	Confident	62.9	Low	22 Å²	22	47.6 Å²	47.6	14%	0.135	23%	0.232	C	C	.	.	H	α-helix	trans	-96.8	-25	178.3	59.2	0	0	0	0	115.3	K99 W100 L103 L125 Y127	K99-T129 HydrophobicContact CD-CG2 4.34Å; W100-T129 VanDerWaalsContact CD1-CG2 3.43Å; W100-T129 PolarHBondContact NE1-OG1 3.24Å; W100-T129 VanDerWaalsContact NE1-OG1 3.17Å; L103-T129 HydrophobicContact CD1-CG2 3.6Å; L125-T129 WeakPolarHBondContact O-CB 3.45Å; L125-T129 WeakPolarHBondContact O-CG2 3.22Å; L125-T129 PolarHBondContact O-N 2.91Å; L125-T129 PolarHBondContact O-OG1 3Å; Y127-T129 PolarHBondContact O-N 2.99Å
130	T	63.2	Low	60.2	Low	70 Å²	70	46.2 Å²	46.2	43%	0.429	23%	0.228	S	C	.	.	H	α-helix	trans	-69.9	-46.1	171.2	-53.8	0	0	0	0	110.4	N126 Y127 R416	N126-T130 WeakPolarHBondContact O-CB 3.34Å; N126-T130 PolarHBondContact O-N 2.73Å; N126-T130 PolarHBondContact O-OG1 2.78Å; Y127-T130 PolarHBondContact O-N 2.88Å; Y127-T130 VanDerWaalsContact O-N 3.14Å; T130-R416 PolarHBondContact OG1-NH2 2.96Å
131	D	54.3	Low	57.3	Low	8 Å²	8	50.4 Å²	50.4	4%	0.043	25%	0.254	C	S	.	.	H	α-helix	trans	-87	-21.8	-174.5	-137.5	34.8	0	0	0	113.3	Y127 K133 A134 S135 K138 K286	Y127-D131 PolarHBondContact O-N 2.8Å; D131-K133 PolarHBondContact O-N 2.98Å; D131-A134 CarbonylContact O-C 3.58Å; D131-A134 WeakPolarHBondContact O-CA 3.44Å; D131-A134 PolarHBondContact O-N 2.83Å; D131-S135 VanDerWaalsContact O-CB 3.26Å; D131-S135 WeakPolarHBondContact O-CB 3.49Å; D131-S135 PolarHBondContact O-N 2.58Å; D131-S135 PolarHBondContact O-OG 2.92Å; D131-S135 VanDerWaalsContact OD2-CB 3.31Å; D131-S135 WeakPolarHBondContact OD2-CB 3.19Å; D131-K138 IonicContact OD2-NZ 2.69Å; D131-K138 PolarHBondContact OD2-NZ 3.28Å; D131-K286 IonicContact OD1-NZ 3.43Å
132	N	49.9	Very low	54.6	Low	46 Å²	46	56.1 Å²	56.1	25%	0.246	29%	0.285	C	S	.	.	T	Hydrogen-bonded Turn	trans	-58.1	-12.4	173.1	-111	-76.4	0	0	0	114.9	F128 A134	F128-N132 WeakPolarHBondContact CD1-ND2 3.35Å; F128-N132 WeakPolarHBondContact O-CB 3.2Å; F128-N132 PolarHBondContact O-N 3.01Å; F128-N132 PolarHBondContact O-ND2 3.42Å; N132-A134 VanDerWaalsContact C-N 3.31Å
133	K	44.4	Very low	51.9	Low	120 Å²	120	62.7 Å²	62.7	52%	0.522	31%	0.312	S	S	.	.	T	Hydrogen-bonded Turn	trans	-83.4	-3.1	170	-68.2	-165.4	168	-162.2	0	114	D131 G213	D131-K133 PolarHBondContact O-N 2.98Å; K133-G213 VanDerWaalsContact NZ-C 3.33Å; K133-G213 PolarHBondContact NZ-O 3.17Å
134	A	38.5	Very low	49.2	Very low	21 Å²	21	64.9 Å²	64.9	17%	0.174	33%	0.327	C	S	.	.	T	Hydrogen-bonded Turn	trans	-148.4	-4.5	-175.1	0	0	0	0	0	114.9	D131 N132 P285	D131-A134 CarbonylContact O-C 3.58Å; D131-A134 WeakPolarHBondContact O-CA 3.44Å; D131-A134 PolarHBondContact O-N 2.83Å; N132-A134 VanDerWaalsContact C-N 3.31Å; A134-P285 HydrophobicContact CB-CB 4.25Å; A134-P285 WeakPolarHBondContact O-CG 3.26Å
135	S	37.9	Very low	46.7	Very low	15 Å²	15	72.6 Å²	72.6	11%	0.105	36%	0.361	C	S	.	.			trans	-123.9	9.6	-166.8	73	0	0	0	0	116.7	D131 Q137 K138	D131-S135 VanDerWaalsContact O-CB 3.26Å; D131-S135 WeakPolarHBondContact O-CB 3.49Å; D131-S135 PolarHBondContact O-N 2.58Å; D131-S135 PolarHBondContact O-OG 2.92Å; D131-S135 VanDerWaalsContact OD2-CB 3.31Å; D131-S135 WeakPolarHBondContact OD2-CB 3.19Å; S135-Q137 PolarHBondContact O-N 2.92Å; S135-K138 PolarHBondContact O-N 3Å
136	K	35.9	Very low	44	Very low	153 Å²	153	78.3 Å²	78.3	67%	0.665	39%	0.389	S	S	*	.	T	Hydrogen-bonded Turn	trans	-57.5	-1.7	179.7	-90.6	-165.3	173.4	-167.7	0	116.2
137	Q	33.9	Very low	41.8	Very low	126 Å²	126	82.6 Å²	82.6	59%	0.589	41%	0.412	S	S	*	.	T	Hydrogen-bonded Turn	trans	-136.2	9.9	-174.3	-69.3	176.9	-37.6	0	0	114.3	S135 A258	S135-Q137 PolarHBondContact O-N 2.92Å; Q137-A258 WeakPolarHBondContact O-CB 3.01Å
138	K	39.1	Very low	40.2	Very low	56 Å²	56	89.5 Å²	89.5	24%	0.243	45%	0.445	C	S	.	.			trans	-84	-5.9	-178.8	-70.1	-171.9	-170.5	173.3	0	115.6	D131 S135 A258 F388	D131-K138 IonicContact OD2-NZ 2.69Å; D131-K138 PolarHBondContact OD2-NZ 3.28Å; S135-K138 PolarHBondContact O-N 3Å; K138-A258 HydrophobicContact CB-CB 4.48Å; K138-A258 HydrophobicContact CG-CB 4.19Å; K138-F388 HydrophobicContact CD-CE1 4.34Å; K138-F388 HydrophobicContact CD-CZ 3.75Å; K138-F388 VanDerWaalsContact CE-CZ 3.41Å
139	F	35.3	Very low	38.2	Very low	108 Å²	108	93.2 Å²	93.2	47%	0.474	47%	0.472	S	S	.	.			trans	-106.5	111.6	178.2	-57.6	-77	0	0	0	108.3	P406	F139-P406 HydrophobicContact CE1-CG 4.35Å; F139-P406 HydrophobicContact CZ-CG 4.14Å
140	L	29.4	Very low	36.2	Very low	85 Å²	85	100.5 Å²	100.5	45%	0.445	51%	0.507	S	S	.	.			trans	-101.1	120	175	-78.5	146.4	0	0	0	109	L142 S256	L140-L142 PolarHBondContact O-N 3.11Å; L140-S256 WeakPolarHBondContact CD1-O 3.22Å; L140-S256 WeakPolarHBondContact CD2-O 3.26Å
141	P	25.5	Very low	34.9	Very low	100 Å²	100	102.2 Å²	102.2	65%	0.649	52%	0.519	S	S	*	.			trans	-68.9	114.4	144.4	29.8	-27.8	0	0	0	107	K143	P141-K143 PolarHBondContact O-N 3.09Å
142	L	32.7	Very low	33.6	Very low	121 Å²	121	107.5 Å²	107.5	63%	0.634	56%	0.557	S	S	*	*			trans	-65.4	98.1	168.6	-87	154.2	0	0	0	108.3	L140 P144	L140-L142 PolarHBondContact O-N 3.11Å; L142-P144 WeakPolarHBondContact O-CD 3.34Å
143	K	27.2	Very low	32.9	Very low	160 Å²	160	110.4 Å²	110.4	70%	0.696	58%	0.581	S	S	*	*			trans	-80.3	115.9	163.7	-75.5	-166.6	174.8	-166.4	0	108.3	P141 F145	P141-K143 PolarHBondContact O-N 3.09Å; K143-F145 HydrophobicContact CB-CD2 4.33Å; K143-F145 HydrophobicContact CB-CE2 4.05Å
144	P	28.1	Very low	32.4	Very low	61 Å²	61	113.9 Å²	113.9	40%	0.396	60%	0.599	S	S	.	*			trans	-75.3	141.5	174.2	32.3	-34.4	0	0	0	110.5	L142 Q523	L142-P144 WeakPolarHBondContact O-CD 3.34Å; P144-Q523 HydrophobicContact CB-CG 3.52Å; P144-Q523 HydrophobicContact CG-CG 3.67Å
145	F	32.2	Very low	32	Very low	163 Å²	163	118 Å²	118	72%	0.715	63%	0.627	S	S	*	*			trans	-132.1	110.5	179.3	-90.2	-83	0	0	0	111.5	K143	K143-F145 HydrophobicContact CB-CD2 4.33Å; K143-F145 HydrophobicContact CB-CE2 4.05Å
146	M	27.7	Very low	31.9	Very low	120 Å²	120	124 Å²	124	59%	0.591	66%	0.663	S	S	*	*			trans	43.4	129.9	133.5	-74.7	179.8	165.9	0	0	121.4	A527	M146-A527 HydrophobicContact CE-CB 3.85Å
147	N	32.3	Very low	31.7	Very low	127 Å²	127	126.8 Å²	126.8	68%	0.679	67%	0.671	S	S	*	*			trans	95.4	145.1	155.9	-56.7	-5.9	0	0	0	116.8
148	H	36.8	Very low	31.5	Very low	158 Å²	158	127 Å²	127	73%	0.731	68%	0.684	S	S	*	*			cis	-164.2	171.5	-22.7	-104	-26.1	0	0	0	107.8
149	P	27.3	Very low	31.3	Very low	117 Å²	117	129.6 Å²	129.6	76%	0.76	71%	0.707	S	S	*	*			trans	-71.1	149.8	-159.7	27.7	-36.2	0	0	0	115.6
150	M	29	Very low	31.4	Very low	176 Å²	176	129.2 Å²	129.2	87%	0.867	72%	0.718	S	S	*	*			trans	-51.1	132.5	171.6	-80.6	-82.4	-72.5	0	0	112	S152	M150-S152 PolarHBondContact O-N 2.78Å
151	P	34.5	Very low	31.8	Very low	105 Å²	105	133.5 Å²	133.5	68%	0.682	74%	0.736	S	S	*	*			trans	-73.1	115.9	172.4	29.4	-32	0	0	0	110.1
152	S	27.1	Very low	32.4	Very low	119 Å²	119	135 Å²	135	83%	0.832	74%	0.743	S	S	*	*			trans	-66.7	128.9	156.2	48.7	0	0	0	0	108.1	M150	M150-S152 PolarHBondContact O-N 2.78Å
153	S	36.6	Very low	32.4	Very low	108 Å²	108	137.8 Å²	137.8	76%	0.755	75%	0.746	S	S	*	*			trans	-142.6	112.3	177.2	-73.4	0	0	0	0	109.6
154	Q	32.4	Very low	32.9	Very low	193 Å²	193	135.4 Å²	135.4	90%	0.902	75%	0.747	S	S	*	*			trans	-69.9	151.8	177.4	-70.8	174.2	-15.1	0	0	110.7
155	S	30.4	Very low	33.5	Very low	108 Å²	108	138.5 Å²	138.5	76%	0.755	77%	0.768	S	S	*	*			trans	-53.1	139	180	51.5	0	0	0	0	115
156	T	35.7	Very low	33.7	Very low	141 Å²	141	136.8 Å²	136.8	87%	0.865	76%	0.762	S	S	*	*			trans	-147.1	135.2	141.5	-38.1	0	0	0	0	110.5
157	Y	31.3	Very low	34.2	Very low	211 Å²	211	142.4 Å²	142.4	83%	0.827	78%	0.778	S	S	*	*			trans	-73.3	147.4	-177.6	-100.6	-114.3	0	0	0	113.3
158	C	31	Very low	34.5	Very low	129 Å²	129	139.9 Å²	139.9	87%	0.872	77%	0.77	S	S	*	*				-172.9	140.2	126.1	-104.8	0	0	0	0	111.9
159	P	35.2	Very low	34.9	Very low	111 Å²	111	137.7 Å²	137.7	72%	0.721	77%	0.77	S	S	*	*			trans	-111.2	152.8	-171.5	39.4	-32.5	0	0	0	115.4
160	S	37.3	Very low	36	Very low	101 Å²	101	137.7 Å²	137.7	71%	0.706	77%	0.77	S	S	*	*			trans	174.4	133.1	134.6	34	0	0	0	0	114.1
161	H	37	Very low	36.7	Very low	175 Å²	175	134.5 Å²	134.5	81%	0.81	76%	0.762	S	S	*	*			trans	38.7	136.9	151.4	-45.4	-56.8	0	0	0	120.6
162	T	37.4	Very low	37.4	Very low	132 Å²	132	134.7 Å²	134.7	81%	0.81	76%	0.764	S	S	*	*			cis	-163.7	150.4	30	-22.5	0	0	0	0	110.6
163	Y	34.4	Very low	38.8	Very low	178 Å²	178	135 Å²	135	70%	0.698	76%	0.763	S	S	*	*			trans	-99.2	153.7	-176.3	-78.8	-77.6	0	0	0	115.3	Q166	Y163-Q166 HydrophobicContact CD1-CG 4.25Å; Y163-Q166 HydrophobicContact CE1-CG 3.93Å
164	P	37.9	Very low	39	Very low	110 Å²	110	139.4 Å²	139.4	71%	0.714	77%	0.772	S	S	*	*				-119.4	175.6	127.1	38	-30.5	0	0	0	111.2
165	P	39.9	Very low	39.4	Very low	127 Å²	127	132.9 Å²	132.9	83%	0.825	76%	0.756	S	S	*	*			trans	-77.5	135.6	-140.9	30.4	-36.4	0	0	0	115.7
166	Q	36.6	Very low	39.9	Very low	126 Å²	126	137.6 Å²	137.6	59%	0.589	77%	0.766	S	S	*	*			trans	-83.6	131.8	175.1	-67.1	176	-52.6	0	0	112.4	Y163 S168	Y163-Q166 HydrophobicContact CD1-CG 4.25Å; Y163-Q166 HydrophobicContact CE1-CG 3.93Å; Q166-S168 VanDerWaalsContact C-N 3.28Å; Q166-S168 WeakPolarHBondContact CB-OG 3.47Å; Q166-S168 PolarHBondContact O-N 2.8Å
167	Y	37.9	Very low	40.3	Very low	239 Å²	239	139.7 Å²	139.7	94%	0.937	77%	0.766	S	S	*	*			trans	-79.9	80.8	149.2	-100.2	-92.4	0	0	0	108.3
168	S	38.7	Very low	40.8	Very low	73 Å²	73	138.5 Å²	138.5	51%	0.51	77%	0.768	S	S	.	*	P	Polyproline II helix	trans	-81.4	129.6	169.2	-60.5	0	0	0	0	109	Q166	Q166-S168 VanDerWaalsContact C-N 3.28Å; Q166-S168 WeakPolarHBondContact CB-OG 3.47Å; Q166-S168 PolarHBondContact O-N 2.8Å
169	P	45.8	Very low	41.3	Very low	112 Å²	112	140.7 Å²	140.7	73%	0.727	77%	0.771	S	S	*	*	P	Polyproline II helix	trans	-63.4	152	167.2	29.1	-33.4	0	0	0	109.4
170	P	49.7	Very low	41.6	Very low	117 Å²	117	144 Å²	144	76%	0.76	78%	0.777	S	S	*	*	P	Polyproline II helix	trans	-61.9	147.1	175.8	27.9	-34.6	0	0	0	110.2
171	P	43.2	Very low	41.9	Very low	110 Å²	110	144.9 Å²	144.9	71%	0.714	78%	0.78	S	S	*	*	P	Polyproline II helix	trans	-61.2	151.2	170.5	28.7	-34.5	0	0	0	109.9
172	P	50.3	Low	42.4	Very low	109 Å²	109	139.9 Å²	139.9	71%	0.708	77%	0.769	S	S	*	*	P	Polyproline II helix	trans	-59.9	152	168.2	29	-34.4	0	0	0	109.6	E174	P172-E174 PolarHBondContact O-N 2.93Å
173	P	55.6	Low	42.9	Very low	125 Å²	125	139.1 Å²	139.1	81%	0.812	77%	0.766	S	S	*	*	P	Polyproline II helix	trans	-62.3	124.7	177.9	26.4	-33.4	0	0	0	110.1	G175	P173-G175 PolarHBondContact O-N 2.86Å
174	E	40.4	Very low	43.7	Very low	201 Å²	201	137.3 Å²	137.3	94%	0.939	77%	0.773	S	S	*	*			trans	-71.8	83.9	167.5	-68.2	178.9	168.6	0	0	108.3	P172	P172-E174 PolarHBondContact O-N 2.93Å
175	G	41.1	Very low	44.4	Very low	55 Å²	55	134.9 Å²	134.9	57%	0.567	75%	0.754	S	S	*	*			trans	-98.6	123.7	169.1	0	0	0	0	0	110	P173 E177	P173-G175 PolarHBondContact O-N 2.86Å; G175-E177 PolarHBondContact O-N 2.77Å
176	E	40.8	Very low	44.8	Very low	207 Å²	207	133 Å²	133	97%	0.967	74%	0.742	S	S	*	*			trans	-73.1	76.8	168	-63.6	176.8	164.5	0	0	109.1
177	E	44.8	Very low	45.7	Very low	185 Å²	185	134.5 Å²	134.5	86%	0.864	75%	0.754	S	S	*	*			trans	-107.9	131.1	170.4	-70.1	-173.2	166.7	0	0	109.7	G175	G175-E177 PolarHBondContact O-N 2.77Å
178	E	42.2	Very low	46.3	Very low	186 Å²	186	124.8 Å²	124.8	87%	0.869	72%	0.715	S	S	*	*			trans	-64.4	151.9	-170.2	-58.3	175.7	138.4	0	0	112.1	E180	E178-E180 VanDerWaalsContact C-N 3.28Å; E178-E180 PolarHBondContact O-N 2.89Å
179	D	41.6	Very low	46.8	Very low	176 Å²	176	123.5 Å²	123.5	94%	0.941	71%	0.705	S	S	*	*			trans	-61.5	75	-179.5	-85.5	-56.4	0	0	0	113.2
180	E	42.1	Very low	47.1	Very low	180 Å²	180	123.8 Å²	123.8	84%	0.841	71%	0.705	S	S	*	*	P	Polyproline II helix	trans	-78.3	130.2	160.2	-81.7	-143.7	137.8	0	0	110.2	E178 A182	E178-E180 VanDerWaalsContact C-N 3.28Å; E178-E180 PolarHBondContact O-N 2.89Å; E180-A182 PolarHBondContact O-N 2.62Å
181	P	41.9	Very low	46.9	Very low	119 Å²	119	124.6 Å²	124.6	77%	0.773	69%	0.693	S	S	*	*	P	Polyproline II helix	trans	-65.4	129.2	178.2	27.2	-33.6	0	0	0	110.3
182	A	48.7	Very low	47.2	Very low	70 Å²	70	119.8 Å²	119.8	58%	0.579	66%	0.662	S	S	*	*	P	Polyproline II helix	trans	-49.9	134.8	178.6	0	0	0	0	0	111.3	E180 V184	E180-A182 PolarHBondContact O-N 2.62Å; A182-V184 PolarHBondContact O-N 2.96Å
183	P	46.6	Very low	47	Very low	117 Å²	117	119.5 Å²	119.5	76%	0.76	65%	0.652	S	S	*	*	P	Polyproline II helix	trans	-59	132.4	-172.1	22.6	-33.5	0	0	0	110.9	I185	P183-I185 PolarHBondContact O-N 3.06Å
184	V	52.6	Low	46.6	Very low	139 Å²	139	113.6 Å²	113.6	84%	0.842	61%	0.614	S	S	*	*			trans	-62.2	109.7	177.3	-179.2	0	0	0	0	108.4	A182 P186	A182-V184 PolarHBondContact O-N 2.96Å; V184-P186 WeakPolarHBondContact O-CD 2.94Å
185	I	51.3	Low	46.7	Very low	60 Å²	60	107.2 Å²	107.2	31%	0.308	59%	0.589	S	S	.	*	P	Polyproline II helix	trans	-64.3	122.5	173.6	-58.2	170.2	0	0	0	106.6	P183 D187 H510 A514	P183-I185 PolarHBondContact O-N 3.06Å; I185-D187 PolarHBondContact O-N 2.91Å; I185-H510 HydrophobicContact CD1-CB 4.23Å; I185-A514 HydrophobicContact CD1-CB 3.81Å
186	P	49.6	Very low	46.4	Very low	87 Å²	87	109.7 Å²	109.7	57%	0.565	58%	0.582	S	S	*	*	P	Polyproline II helix	trans	-66	132.2	-178.4	26.1	-33.4	0	0	0	110.4	V184	V184-P186 WeakPolarHBondContact O-CD 2.94Å
187	D	55.8	Low	46.7	Very low	157 Å²	157	101.4 Å²	101.4	84%	0.84	55%	0.545	S	S	*	.	P	Polyproline II helix	trans	-59	141.9	174.3	-76.4	-38.9	0	0	0	111	I185	I185-D187 PolarHBondContact O-N 2.91Å
188	R	49.9	Very low	46.5	Very low	35 Å²	35	98.7 Å²	98.7	13%	0.132	53%	0.53	C	S	.	.	P	Polyproline II helix	trans	-64	128.7	-177.1	-176.7	170.3	-166.8	168.9	15.1	111.6	T190 T192 V334 T335 Q338 E437 G438	R188-T190 PolarHBondContact O-N 3.19Å; R188-T192 WeakPolarHBondContact CG-OG1 3.48Å; R188-T192 PolarHBondContact NE-O 3.31Å; R188-T192 PolarHBondContact NE-OG1 2.96Å; R188-T192 PolarHBondContact NH1-O 2.9Å; R188-T192 PolarHBondContact NH2-O 2.85Å; R188-T192 VanDerWaalsContact NH2-O 3.17Å; R188-V334 PolarHBondContact NH1-O 3.48Å; R188-T335 PolarHBondContact NH1-O 2.82Å; R188-Q338 HydrophobicContact CB-CG 4.29Å; R188-Q338 HydrophobicContact CG-CG 4.18Å; R188-E437 PolarHBondContact NH2-O 3.11Å; R188-G438 VanDerWaalsContact NH2-N 3.12Å
189	P	49	Very low	46	Very low	46 Å²	46	95.2 Å²	95.2	30%	0.299	52%	0.524	S	S	.	.	P	Polyproline II helix	trans	-56.8	129.3	175.4	-26	34.8	0	0	0	111.7	R191 T192 Q338	P189-R191 HydrophobicContact CB-CG 4.14Å; P189-R191 PolarHBondContact O-N 2.87Å; P189-T192 PolarHBondContact O-N 3.31Å; P189-T192 PolarHBondContact O-OG1 2.86Å; P189-Q338 VanDerWaalsContact CD-CD 3.43Å
190	T	51.2	Low	45.8	Very low	119 Å²	119	93.1 Å²	93.1	73%	0.73	52%	0.517	S	S	*	.	G	3₁₀ helix	trans	-51.2	-33.1	-174.6	52	0	0	0	0	114.2	R188 T192 M193	R188-T190 PolarHBondContact O-N 3.19Å; T190-T192 PolarHBondContact O-N 3.41Å; T190-T192 VanDerWaalsContact O-N 3.08Å; T190-M193 PolarHBondContact O-N 2.86Å; T190-M193 VanDerWaalsContact O-N 3.15Å
191	R	45.3	Very low	45.4	Very low	134 Å²	134	93 Å²	93	51%	0.506	52%	0.516	S	S	.	.	G	3₁₀ helix	trans	-58.4	-16	174	69.1	174.5	174.9	88	-0.3	115	P189	P189-R191 HydrophobicContact CB-CG 4.14Å; P189-R191 PolarHBondContact O-N 2.87Å
192	T	49.9	Very low	44.8	Very low	9 Å²	9	96.4 Å²	96.4	6%	0.055	52%	0.522	C	S	.	.	G	3₁₀ helix	trans	-112.1	8.7	-178.9	62.4	0	0	0	0	113.2	R188 P189 T190 S194	R188-T192 WeakPolarHBondContact CG-OG1 3.48Å; R188-T192 PolarHBondContact NE-O 3.31Å; R188-T192 PolarHBondContact NE-OG1 2.96Å; R188-T192 PolarHBondContact NH1-O 2.9Å; R188-T192 PolarHBondContact NH2-O 2.85Å; R188-T192 VanDerWaalsContact NH2-O 3.17Å; P189-T192 PolarHBondContact O-N 3.31Å; P189-T192 PolarHBondContact O-OG1 2.86Å; T190-T192 PolarHBondContact O-N 3.41Å; T190-T192 VanDerWaalsContact O-N 3.08Å; T192-S194 PolarHBondContact O-N 3.13Å; T192-S194 VanDerWaalsContact O-N 3.14Å
193	M	46.3	Very low	44	Very low	102 Å²	102	99.7 Å²	99.7	50%	0.502	54%	0.535	S	S	.	.			trans	-64.9	114.8	172.5	-68.6	-178.4	76	0	0	110.1	T190	T190-M193 PolarHBondContact O-N 2.86Å; T190-M193 VanDerWaalsContact O-N 3.15Å
194	S	46.4	Very low	43.2	Very low	1 Å²	1	101.9 Å²	101.9	1%	0.007	54%	0.539	C	S	.	.			trans	-60.4	158.7	-177.4	76.7	0	0	0	0	112.6	T192 Y196 T197 E439	T192-S194 PolarHBondContact O-N 3.13Å; T192-S194 VanDerWaalsContact O-N 3.14Å; S194-Y196 PolarHBondContact O-N 3.15Å; S194-Y196 VanDerWaalsContact O-N 3.17Å; S194-Y196 PolarHBondContact OG-N 3.24Å; S194-T197 PolarHBondContact O-N 3.22Å; S194-T197 PolarHBondContact O-OG1 3.18Å; S194-E439 WeakPolarHBondContact CA-OE2 3.24Å
195	V	43.3	Very low	42.1	Very low	68 Å²	68	100.5 Å²	100.5	41%	0.412	54%	0.535	S	S	.	.	G	3₁₀ helix	trans	-59.3	-24.7	172.9	-179.5	0	0	0	0	112.4	T197 K198 E439 L443	V195-T197 VanDerWaalsContact C-N 3.31Å; V195-T197 PolarHBondContact O-N 3.24Å; V195-K198 PolarHBondContact O-N 3.3Å; V195-E439 PolarHBondContact N-OE2 3.44Å; V195-L443 HydrophobicContact CB-CD2 4.41Å
196	Y	35.7	Very low	41.4	Very low	107 Å²	107	103.4 Å²	103.4	42%	0.42	56%	0.559	S	S	.	*	G	3₁₀ helix	trans	-66.8	-24.1	-177.7	-57	-66.8	0	0	0	114.9	S194 T335 L443	S194-Y196 PolarHBondContact O-N 3.15Å; S194-Y196 VanDerWaalsContact O-N 3.17Å; S194-Y196 PolarHBondContact OG-N 3.24Å; Y196-T335 HydrophobicContact CD2-CG2 4.04Å; Y196-L443 HydrophobicContact CD2-CD2 4.17Å; Y196-L443 HydrophobicContact CE1-CD2 4.25Å; Y196-L443 HydrophobicContact CE2-CD2 3.49Å; Y196-L443 VanDerWaalsContact CE2-CD2 3.49Å; Y196-L443 WeakPolarHBondContact OH-CD1 3.39Å
197	T	47.3	Very low	40.5	Very low	32 Å²	32	105 Å²	105	20%	0.196	57%	0.566	C	S	.	*	G	3₁₀ helix	trans	-95.8	3.2	-177.7	57.8	0	0	0	0	113.8	S194 V195 E336	S194-T197 PolarHBondContact O-N 3.22Å; S194-T197 PolarHBondContact O-OG1 3.18Å; V195-T197 VanDerWaalsContact C-N 3.31Å; V195-T197 PolarHBondContact O-N 3.24Å; T197-E336 WeakPolarHBondContact CG2-OE1 3.42Å
198	K	40.2	Very low	39.3	Very low	129 Å²	129	102.7 Å²	102.7	56%	0.561	56%	0.56	S	S	*	*	S	Bend	trans	-86.4	138.5	176.2	-68.6	178	-177.7	170.4	0	111.2	V195 V200	V195-K198 PolarHBondContact O-N 3.3Å; K198-V200 PolarHBondContact O-N 3.44Å
199	P	32.2	Very low	38.4	Very low	113 Å²	113	105.8 Å²	105.8	73%	0.734	58%	0.578	S	S	*	*			trans	-55	131.7	167.7	-23.7	33.9	0	0	0	110.6	E201	P199-E201 PolarHBondContact O-N 3.24Å; P199-E201 VanDerWaalsContact O-N 3.13Å
200	V	37.1	Very low	37.4	Very low	131 Å²	131	112.7 Å²	112.7	79%	0.794	61%	0.606	S	S	*	*			trans	-72.7	105.2	-179.4	179	0	0	0	0	109.4	K198	K198-V200 PolarHBondContact O-N 3.44Å
201	E	33.4	Very low	36.3	Very low	177 Å²	177	111.4 Å²	111.4	83%	0.827	60%	0.595	S	S	*	*			trans	-65.6	136.5	161.2	-74.2	-172.7	144.5	0	0	109.7	P199 V203	P199-E201 PolarHBondContact O-N 3.24Å; P199-E201 VanDerWaalsContact O-N 3.13Å; E201-V203 PolarHBondContact O-N 3.28Å
202	E	28.1	Very low	35.5	Very low	192 Å²	192	113.2 Å²	113.2	90%	0.897	61%	0.614	S	S	*	*			trans	-69.5	87.3	-173.9	-68.4	-169.6	132.4	0	0	112.6	L204	E202-L204 PolarHBondContact O-N 2.96Å
203	V	32.2	Very low	34.6	Very low	139 Å²	139	115.3 Å²	115.3	84%	0.842	64%	0.637	S	S	*	*			trans	-71.6	118	165.8	-177.1	0	0	0	0	109.2	E201	E201-V203 PolarHBondContact O-N 3.28Å
204	L	31.3	Very low	34	Very low	162 Å²	162	116 Å²	116	85%	0.848	65%	0.648	S	S	*	*			trans	-44.8	132	-173.2	-67.8	164.1	0	0	0	114.2	E202	E202-L204 PolarHBondContact O-N 2.96Å
205	S	29.3	Very low	33.4	Very low	110 Å²	110	120.3 Å²	120.3	77%	0.769	67%	0.669	S	S	*	*	P	Polyproline II helix	trans	-66.7	129.3	-175.5	48.1	0	0	0	0	113.3
206	P	36.5	Very low	33	Very low	122 Å²	122	120.5 Å²	120.5	79%	0.792	68%	0.684	S	S	*	*	P	Polyproline II helix	trans	-75.9	127.9	175.7	-13.6	28.3	0	0	0	112.3
207	V	29.8	Very low	33.2	Very low	120 Å²	120	120.3 Å²	120.3	73%	0.727	69%	0.69	S	S	*	*	P	Polyproline II helix	trans	-55.8	134.3	-179.1	-175.7	0	0	0	0	112.5	I209	V207-I209 PolarHBondContact O-N 3.21Å
208	P	31.4	Very low	32.8	Very low	109 Å²	109	126.1 Å²	126.1	71%	0.708	72%	0.72	S	S	*	*			trans	-75.1	97.4	179.8	29.8	-35	0	0	0	112.6
209	I	30.9	Very low	32.5	Very low	100 Å²	100	130.1 Å²	130.1	51%	0.513	74%	0.737	S	S	.	*			trans	-88.4	121.5	172.2	-54.9	177.2	0	0	0	110.4	V207 L211	V207-I209 PolarHBondContact O-N 3.21Å; I209-L211 HydrophobicContact CG2-CD1 3.91Å; I209-L211 HydrophobicContact CG2-CG 4.3Å
210	Q	27.5	Very low	32.9	Very low	191 Å²	191	132.7 Å²	132.7	89%	0.893	74%	0.739	S	S	*	*			trans	-73.4	133.9	170.2	-66.5	-179.2	-5.9	0	0	110.4
211	L	29.3	Very low	32.8	Very low	92 Å²	92	137.4 Å²	137.4	48%	0.482	74%	0.744	S	S	.	*			trans	-142.5	98.5	-175.7	-98.4	148.4	0	0	0	112.9	K99 I209	K99-L211 HydrophobicContact CD-CD1 4.03Å; K99-L211 HydrophobicContact CG-CD1 4.47Å; I209-L211 HydrophobicContact CG2-CD1 3.91Å; I209-L211 HydrophobicContact CG2-CG 4.3Å
212	N	27.5	Very low	33.2	Very low	172 Å²	172	137 Å²	137	92%	0.92	74%	0.735	S	S	*	*			trans	-68.3	147.2	159.4	-77	-18.6	0	0	0	109.9
213	G	31.4	Very low	34.5	Very low	52 Å²	52	137.4 Å²	137.4	54%	0.536	73%	0.734	S	S	.	*			trans	139	91.7	-179.2	0	0	0	0	0	112.6	K133	K133-G213 VanDerWaalsContact NZ-C 3.33Å; K133-G213 PolarHBondContact NZ-O 3.17Å
214	T	32.7	Very low	35.8	Very low	118 Å²	118	139 Å²	139	72%	0.724	73%	0.729	S	S	*	*			trans	-88.9	111.6	174.8	38.3	0	0	0	0	110
215	M	35.3	Very low	37.6	Very low	91 Å²	91	139.1 Å²	139.1	45%	0.448	72%	0.719	S	S	.	*			trans	-81.5	141.7	169	-64.4	-127.3	-71	0	0	110.4	V82 W100	V82-M215 HydrophobicContact CB-SD 4.41Å; W100-M215 HydrophobicContact CH2-CE 3.93Å; W100-M215 HydrophobicContact CZ2-CE 3.53Å
216	G	34	Very low	39.9	Very low	71 Å²	71	137.3 Å²	137.3	73%	0.732	70%	0.699	S	S	*	*			trans	-66.9	143.2	-172.6	0	0	0	0	0	113.9
217	L	39.5	Very low	42.3	Very low	104 Å²	104	134.9 Å²	134.9	55%	0.545	68%	0.682	S	S	.	*			trans	-110.6	138.8	161.8	-86.1	164.5	0	0	0	107.9
218	N	39.7	Very low	44.9	Very low	153 Å²	153	133.3 Å²	133.3	82%	0.818	67%	0.669	S	S	*	*			trans	-46.7	137.4	-176.6	-84.1	-27.9	0	0	0	113.5	Q220	N218-Q220 VanDerWaalsContact C-N 3.31Å; N218-Q220 PolarHBondContact O-N 2.98Å
219	K	33.3	Very low	47.6	Very low	214 Å²	214	133.3 Å²	133.3	93%	0.93	66%	0.66	S	S	*	*			trans	-69.2	79.9	177.9	-77	174.1	171	168	0	111.5
220	Q	40	Very low	50.4	Low	166 Å²	166	132.6 Å²	132.6	78%	0.776	66%	0.655	S	S	*	*	S	Bend	trans	-130.2	109.5	160.3	-72.5	-174.1	-12.9	0	0	109.2	N218 R222	N218-Q220 VanDerWaalsContact C-N 3.31Å; N218-Q220 PolarHBondContact O-N 2.98Å; Q220-R222 PolarHBondContact O-N 3.44Å
221	Y	36.3	Very low	53.2	Low	231 Å²	231	123.7 Å²	123.7	91%	0.906	61%	0.613	S	S	*	*			trans	28.5	61.7	170.2	-72.4	-88.7	0	0	0	116.6	K223	Y221-K223 PolarHBondContact O-N 3.42Å
222	R	41.6	Very low	56	Low	167 Å²	167	121.3 Å²	121.3	63%	0.63	60%	0.601	S	S	*	*			trans	-66.1	103.9	163.7	-64.8	-173.3	87.7	167.9	8.9	107.8	Q220 K224	Q220-R222 PolarHBondContact O-N 3.44Å; R222-K224 PolarHBondContact O-N 2.95Å
223	K	54.1	Low	59.1	Low	201 Å²	201	117.1 Å²	117.1	87%	0.874	58%	0.576	S	S	*	*			trans	-45.9	127	162	-80.1	-179	174.7	176.4	0	107.2	Y221 R225	Y221-K223 PolarHBondContact O-N 3.42Å; K223-R225 PolarHBondContact O-N 3.06Å
224	K	60.1	Low	61.9	Low	172 Å²	172	119 Å²	119	75%	0.748	57%	0.569	S	S	*	*	P	Polyproline II helix	trans	-50.8	127.9	178.7	-170.3	-172.7	177	-165.8	0	107.8	R222 M226	R222-K224 PolarHBondContact O-N 2.95Å; K224-M226 PolarHBondContact O-N 3.05Å
225	R	70.3	Confident	64.7	Low	165 Å²	165	113.4 Å²	113.4	62%	0.623	54%	0.535	S	S	*	.	P	Polyproline II helix	trans	-57.7	134.9	172.9	-78.2	-174.9	171.5	180	-4.2	108	K223	K223-R225 PolarHBondContact O-N 3.06Å
226	M	76.8	Confident	67.4	Low	73 Å²	73	114.5 Å²	114.5	36%	0.36	53%	0.534	S	S	.	.	P	Polyproline II helix	trans	-66.9	139.5	173.6	-64.8	177.7	-160	0	0	108.1	K224 E230 V231 K234	K224-M226 PolarHBondContact O-N 3.05Å; M226-E230 HydrophobicContact CB-CB 4.11Å; M226-V231 HydrophobicContact CB-CG2 3.72Å; M226-K234 HydrophobicContact SD-CD 3.88Å; M226-K234 PolarHBondContact SD-NZ 3.1Å; M226-K234 VanDerWaalsContact SD-NZ 3.41Å
227	T	86.2	Confident	70.2	Confident	70 Å²	70	116.7 Å²	116.7	43%	0.429	53%	0.529	S	S	.	.	P	Polyproline II helix	trans	-70	159.3	168.2	59.9	0	0	0	0	109.9	E229 E230 V231	T227-E229 PolarHBondContact O-N 2.79Å; T227-E230 WeakPolarHBondContact CB-OE2 3.35Å; T227-E230 WeakPolarHBondContact CG2-OE2 3.41Å; T227-E230 PolarHBondContact N-OE2 3.05Å; T227-E230 WeakPolarHBondContact O-CB 3.21Å; T227-E230 PolarHBondContact O-N 3.07Å; T227-E230 VanDerWaalsContact O-N 3.07Å; T227-E230 WeakPolarHBondContact OG1-CB 3.45Å; T227-E230 VanDerWaalsContact OG1-CD 3.32Å; T227-E230 VanDerWaalsContact OG1-CG 3.23Å; T227-E230 WeakPolarHBondContact OG1-CG 3.32Å; T227-E230 PolarHBondContact OG1-N 2.79Å; T227-E230 PolarHBondContact OG1-OE2 2.89Å; T227-V231 PolarHBondContact O-N 2.77Å
228	D	84.9	Confident	72.7	Confident	87 Å²	87	113.1 Å²	113.1	47%	0.465	51%	0.51	S	S	.	.	H	α-helix	trans	-57.6	-36.8	179.7	-76	3.8	0	0	0	112.6	V231 L232 K287	D228-V231 PolarHBondContact O-N 3Å; D228-L232 WeakPolarHBondContact O-CB 3.13Å; D228-L232 WeakPolarHBondContact O-CG 3.45Å; D228-L232 PolarHBondContact O-N 3.35Å; D228-K287 VanDerWaalsContact CG-NZ 3.27Å; D228-K287 IonicContact OD1-NZ 2.78Å; D228-K287 IonicContact OD2-NZ 2.91Å; D228-K287 PolarHBondContact OD2-NZ 3.17Å
229	E	87.9	Confident	75.3	Confident	109 Å²	109	106.7 Å²	106.7	51%	0.509	48%	0.476	S	S	.	.	H	α-helix	trans	-69.7	-38.8	175.7	-167	60.3	-143	0	0	112.1	T227 V231 L232 Q233 R236	T227-E229 PolarHBondContact O-N 2.79Å; E229-V231 VanDerWaalsContact C-N 3.27Å; E229-V231 PolarHBondContact O-N 2.93Å; E229-L232 PolarHBondContact O-N 3.14Å; E229-Q233 VanDerWaalsContact O-CB 3.27Å; E229-Q233 WeakPolarHBondContact O-CB 3.39Å; E229-Q233 PolarHBondContact O-N 2.97Å; E229-R236 IonicContact OE1-CZ 2.78Å; E229-R236 IonicContact OE1-NH1 3.14Å; E229-R236 PolarHBondContact OE1-NH1 3Å
230	E	90	Very high	78.2	Confident	86 Å²	86	98.7 Å²	98.7	40%	0.402	45%	0.447	S	S	.	.	H	α-helix	trans	-63.5	-33.8	173.1	-73.7	167.5	133.4	0	0	111.8	M226 T227 K234	M226-E230 HydrophobicContact CB-CB 4.11Å; T227-E230 WeakPolarHBondContact CB-OE2 3.35Å; T227-E230 WeakPolarHBondContact CG2-OE2 3.41Å; T227-E230 PolarHBondContact N-OE2 3.05Å; T227-E230 WeakPolarHBondContact O-CB 3.21Å; T227-E230 PolarHBondContact O-N 3.07Å; T227-E230 VanDerWaalsContact O-N 3.07Å; T227-E230 WeakPolarHBondContact OG1-CB 3.45Å; T227-E230 VanDerWaalsContact OG1-CD 3.32Å; T227-E230 VanDerWaalsContact OG1-CG 3.23Å; T227-E230 WeakPolarHBondContact OG1-CG 3.32Å; T227-E230 PolarHBondContact OG1-N 2.79Å; T227-E230 PolarHBondContact OG1-OE2 2.89Å; E230-K234 WeakPolarHBondContact O-CB 3.08Å; E230-K234 VanDerWaalsContact O-CG 3.3Å; E230-K234 WeakPolarHBondContact O-CG 3.43Å; E230-K234 PolarHBondContact O-N 2.91Å
231	V	86.6	Confident	80.8	Confident	3 Å²	3	99.1 Å²	99.1	2%	0.018	45%	0.453	C	S	.	.	H	α-helix	trans	-71.8	-49	174.2	173.7	0	0	0	0	111	M226 T227 D228 E229 Q233 K234 L235 K287 E288 I291	M226-V231 HydrophobicContact CB-CG2 3.72Å; T227-V231 PolarHBondContact O-N 2.77Å; D228-V231 PolarHBondContact O-N 3Å; E229-V231 VanDerWaalsContact C-N 3.27Å; E229-V231 PolarHBondContact O-N 2.93Å; V231-Q233 VanDerWaalsContact C-N 3.34Å; V231-Q233 PolarHBondContact O-N 3.29Å; V231-K234 PolarHBondContact O-N 3.45Å; V231-K234 VanDerWaalsContact O-N 3.15Å; V231-L235 HydrophobicContact CG1-CD1 3.98Å; V231-L235 HydrophobicContact CG1-CG 4.36Å; V231-L235 WeakPolarHBondContact O-CG 3.47Å; V231-L235 PolarHBondContact O-N 3.49Å; V231-K287 HydrophobicContact CB-CB 4.42Å; V231-K287 HydrophobicContact CG1-CB 3.71Å; V231-K287 HydrophobicContact CG2-CB 4.42Å; V231-E288 HydrophobicContact CG2-CB 4.41Å; V231-I291 HydrophobicContact CB-CD1 4.39Å; V231-I291 HydrophobicContact CG1-CD1 3.87Å; V231-I291 HydrophobicContact CG1-CG1 4.5Å
232	L	88.8	Confident	83.3	Confident	42 Å²	42	90.2 Å²	90.2	22%	0.22	43%	0.432	C	S	.	.	H	α-helix	trans	-60.1	-43.2	177.9	-75.3	171.1	0	0	0	111.7	D228 E229 K234 L235 R236 L281	D228-L232 WeakPolarHBondContact O-CB 3.13Å; D228-L232 WeakPolarHBondContact O-CG 3.45Å; D228-L232 PolarHBondContact O-N 3.35Å; E229-L232 PolarHBondContact O-N 3.14Å; L232-K234 VanDerWaalsContact C-N 3.3Å; L232-K234 PolarHBondContact O-N 3.26Å; L232-L235 PolarHBondContact O-N 3.49Å; L232-R236 WeakPolarHBondContact O-CG 3.42Å; L232-R236 PolarHBondContact O-N 3.08Å; L232-L281 HydrophobicContact CD2-CD1 3.66Å
233	Q	91.3	Very high	85.7	Confident	85 Å²	85	87.3 Å²	87.3	40%	0.397	43%	0.425	S	S	.	.	H	α-helix	trans	-64.6	-35.3	176.7	-171.7	55.6	54.7	0	0	112.2	E229 V231 N237	E229-Q233 VanDerWaalsContact O-CB 3.27Å; E229-Q233 WeakPolarHBondContact O-CB 3.39Å; E229-Q233 PolarHBondContact O-N 2.97Å; V231-Q233 VanDerWaalsContact C-N 3.34Å; V231-Q233 PolarHBondContact O-N 3.29Å; Q233-N237 PolarHBondContact NE2-OD1 2.82Å; Q233-N237 PolarHBondContact O-N 3.41Å; Q233-N237 PolarHBondContact O-ND2 3.12Å; Q233-N237 PolarHBondContact O-OD1 2.84Å; Q233-N237 VanDerWaalsContact O-OD1 3.09Å
234	K	90.8	Very high	87.6	Confident	91 Å²	91	77.8 Å²	77.8	40%	0.396	38%	0.384	S	S	.	.	H	α-helix	trans	-70	-40.9	172.8	-78.6	-177.7	178.4	-165.3	0	112.8	M226 E230 V231 L232 N237 I238 I291	M226-K234 HydrophobicContact SD-CD 3.88Å; M226-K234 PolarHBondContact SD-NZ 3.1Å; M226-K234 VanDerWaalsContact SD-NZ 3.41Å; E230-K234 WeakPolarHBondContact O-CB 3.08Å; E230-K234 VanDerWaalsContact O-CG 3.3Å; E230-K234 WeakPolarHBondContact O-CG 3.43Å; E230-K234 PolarHBondContact O-N 2.91Å; V231-K234 PolarHBondContact O-N 3.45Å; V231-K234 VanDerWaalsContact O-N 3.15Å; L232-K234 VanDerWaalsContact C-N 3.3Å; L232-K234 PolarHBondContact O-N 3.26Å; K234-N237 PolarHBondContact O-N 2.98Å; K234-N237 VanDerWaalsContact O-N 3.13Å; K234-I238 PolarHBondContact O-N 3.44Å; K234-I291 HydrophobicContact CB-CD1 3.6Å; K234-I291 HydrophobicContact CB-CG1 4.45Å; K234-I291 HydrophobicContact CD-CD1 4.09Å
235	L	91.2	Very high	89.1	Confident	0 Å²	0	75.9 Å²	75.9	0%	0	38%	0.378	C	S	.	.	H	α-helix	trans	-58.4	-51	174.1	-72.6	171	0	0	0	110.2	V231 L232 N237 I238 V239 L281 I290 I291 I294 L318	V231-L235 HydrophobicContact CG1-CD1 3.98Å; V231-L235 HydrophobicContact CG1-CG 4.36Å; V231-L235 WeakPolarHBondContact O-CG 3.47Å; V231-L235 PolarHBondContact O-N 3.49Å; L232-L235 PolarHBondContact O-N 3.49Å; L235-N237 PolarHBondContact O-N 3.38Å; L235-I238 HydrophobicContact CD2-CD1 4.33Å; L235-I238 WeakPolarHBondContact O-CG1 3.37Å; L235-I238 PolarHBondContact O-N 3.26Å; L235-V239 WeakPolarHBondContact O-CG1 3.36Å; L235-V239 WeakPolarHBondContact O-CG2 3.44Å; L235-V239 PolarHBondContact O-N 3.46Å; L235-L281 HydrophobicContact CD1-CD1 3.73Å; L235-L281 HydrophobicContact CD1-CD2 3.93Å; L235-I290 HydrophobicContact CD2-CG2 4.49Å; L235-I291 HydrophobicContact CD2-CG1 3.73Å; L235-I291 HydrophobicContact CG-CG1 4Å; L235-I294 HydrophobicContact CD2-CD1 3.92Å; L235-L318 HydrophobicContact CD2-CD2 4.37Å
236	R	92	Very high	90.2	Very high	115 Å²	115	76.8 Å²	76.8	43%	0.434	38%	0.381	S	S	.	.	H	α-helix	trans	-52.6	-29.9	174.2	-72.1	175	-171.8	140	4.8	113.8	E229 L232 L313	E229-R236 IonicContact OE1-CZ 2.78Å; E229-R236 IonicContact OE1-NH1 3.14Å; E229-R236 PolarHBondContact OE1-NH1 3Å; L232-R236 WeakPolarHBondContact O-CG 3.42Å; L232-R236 PolarHBondContact O-N 3.08Å; R236-L313 HydrophobicContact CG-CD2 3.73Å
237	N	92.7	Very high	91	Very high	117 Å²	117	76 Å²	76	63%	0.626	38%	0.376	S	S	*	.	H	α-helix	trans	-85.4	-16.7	180	-66.8	-0.7	0	0	0	114.2	Q233 K234 L235	Q233-N237 PolarHBondContact NE2-OD1 2.82Å; Q233-N237 PolarHBondContact O-N 3.41Å; Q233-N237 PolarHBondContact O-ND2 3.12Å; Q233-N237 PolarHBondContact O-OD1 2.84Å; Q233-N237 VanDerWaalsContact O-OD1 3.09Å; K234-N237 PolarHBondContact O-N 2.98Å; K234-N237 VanDerWaalsContact O-N 3.13Å; L235-N237 PolarHBondContact O-N 3.38Å
238	I	92.2	Very high	91.5	Very high	29 Å²	29	72.9 Å²	72.9	15%	0.149	36%	0.356	C	S	.	.	H	α-helix	trans	-110.4	-25.7	-177.2	67.8	176.3	0	0	0	114.1	K234 L235 I291 I294 L295 R298	K234-I238 PolarHBondContact O-N 3.44Å; L235-I238 HydrophobicContact CD2-CD1 4.33Å; L235-I238 WeakPolarHBondContact O-CG1 3.37Å; L235-I238 PolarHBondContact O-N 3.26Å; I238-I291 HydrophobicContact CD1-CG1 4.48Å; I238-I291 HydrophobicContact CD1-CG2 4.16Å; I238-I294 HydrophobicContact CD1-CB 4.1Å; I238-I294 HydrophobicContact CD1-CD1 3.98Å; I238-I294 HydrophobicContact CD1-CG2 4.02Å; I238-L295 HydrophobicContact CD1-CG 4.48Å; I238-L295 HydrophobicContact CG2-CD2 4.27Å; I238-R298 PolarHBondContact O-NH1 2.81Å
239	V	94.4	Very high	92	Very high	18 Å²	18	72 Å²	72	11%	0.109	35%	0.354	C	S	.	.	S	Bend	trans	-77.3	159.5	175.4	-57.4	0	0	0	0	111.5	L235 S311 L313 L318	L235-V239 WeakPolarHBondContact O-CG1 3.36Å; L235-V239 WeakPolarHBondContact O-CG2 3.44Å; L235-V239 PolarHBondContact O-N 3.46Å; V239-S311 WeakPolarHBondContact CB-O 3.44Å; V239-L313 HydrophobicContact CG2-CB 4.06Å; V239-L318 HydrophobicContact CG1-CD1 3.63Å
240	S	95	Very high	92.2	Very high	45 Å²	45	73.3 Å²	73.3	32%	0.315	36%	0.358	S	S	.	.	B	Isolated β-bridge	trans	-74.3	145.2	171.3	-70	0	0	0	0	111.7	D310 S311 Y312	S240-D310 VanDerWaalsContact CB-OD1 3.22Å; S240-D310 WeakPolarHBondContact CB-OD1 3.2Å; S240-D310 PolarHBondContact OG-OD1 3.25Å; S240-S311 PolarHBondContact N-O 3.03Å; S240-Y312 WeakPolarHBondContact O-CD1 3.23Å
241	I	93.1	Very high	92.4	Very high	175 Å²	175	72.3 Å²	72.3	90%	0.897	36%	0.355	S	S	*	.	S	Bend	trans	-83.4	121.6	175	-55.3	176.5	0	0	0	108.5
242	G	90.5	Very high	92.8	Very high	45 Å²	45	78 Å²	78	46%	0.464	38%	0.382	S	S	.	.	S	Bend	trans	154.6	175	174	0	0	0	0	0	113.7	P244 Y312	G242-P244 WeakPolarHBondContact O-CD 3.33Å; G242-Y312 WeakPolarHBondContact O-CD1 2.97Å
243	E	90.8	Very high	93	Very high	106 Å²	106	81.3 Å²	81.3	50%	0.495	39%	0.394	S	S	.	.			trans	-97.9	107.7	173.8	-72	169.6	-157.5	0	0	109.5	Q245 R246	E243-Q245 PolarHBondContact O-N 2.72Å; E243-Q245 VanDerWaalsContact O-N 3.14Å; E243-R246 HydrophobicContact CB-CG 4.18Å; E243-R246 PolarHBondContact O-N 2.68Å; E243-R246 IonicContact OE1-CZ 3.92Å; E243-R246 IonicContact OE1-NH2 3.71Å; E243-R246 PolarHBondContact OE1-NH2 3.24Å; E243-R246 IonicContact OE2-CZ 1.9Å; E243-R246 IonicContact OE2-NE 3.8Å; E243-R246 PolarHBondContact OE2-NE 2.87Å; E243-R246 IonicContact OE2-NH2 3.93Å; E243-R246 PolarHBondContact OE2-NH2 3.48Å
244	P	93.7	Very high	92.9	Very high	1 Å²	1	81.4 Å²	81.4	1%	0.006	40%	0.396	C	S	.	.	G	3₁₀ helix	trans	-62.5	-24.3	-177.6	24	-33.5	0	0	0	112.8	G242 R246 K247 Y248 Y312 V314 W319 M321	G242-P244 WeakPolarHBondContact O-CD 3.33Å; P244-R246 PolarHBondContact O-N 3.32Å; P244-R246 VanDerWaalsContact O-N 3.14Å; P244-K247 PolarHBondContact O-N 2.99Å; P244-Y248 HydrophobicContact CB-CD2 4.12Å; P244-Y248 WeakPolarHBondContact O-CD2 3.35Å; P244-Y248 PolarHBondContact O-N 3.42Å; P244-Y312 HydrophobicContact CB-CD2 3.81Å; P244-Y312 HydrophobicContact CB-CE2 4.19Å; P244-Y312 HydrophobicContact CB-CG 4Å; P244-Y312 HydrophobicContact CG-CD2 4.3Å; P244-Y312 HydrophobicContact CG-CG 4.06Å; P244-V314 HydrophobicContact CG-CG2 3.47Å; P244-V314 VanDerWaalsContact CG-CG2 3.47Å; P244-W319 HydrophobicContact CB-CE3 4Å; P244-W319 HydrophobicContact CB-CZ3 4.33Å; P244-W319 HydrophobicContact CG-CD2 4.15Å; P244-W319 HydrophobicContact CG-CE3 3.65Å; P244-W319 HydrophobicContact CG-CZ3 4.04Å; P244-M321 HydrophobicContact CB-CE 3.43Å; P244-M321 VanDerWaalsContact CB-CE 3.43Å; P244-M321 HydrophobicContact CG-CE 4.2Å
245	Q	92.2	Very high	92.6	Very high	132 Å²	132	78.1 Å²	78.1	62%	0.617	39%	0.388	S	S	*	.	G	3₁₀ helix	trans	-59.7	-19.4	174.7	-63.8	176.5	-8.1	0	0	113.9	E243 W319	E243-Q245 PolarHBondContact O-N 2.72Å; E243-Q245 VanDerWaalsContact O-N 3.14Å; Q245-W319 HydrophobicContact CG-CH2 4.18Å
246	R	92.8	Very high	92.1	Very high	184 Å²	184	80.2 Å²	80.2	69%	0.694	40%	0.403	S	S	*	.	G	3₁₀ helix	trans	-86.5	-19.7	173.2	-57.6	-171.8	-167.2	-169.7	6.9	113.4	E243 P244	E243-R246 HydrophobicContact CB-CG 4.18Å; E243-R246 PolarHBondContact O-N 2.68Å; E243-R246 IonicContact OE1-CZ 3.92Å; E243-R246 IonicContact OE1-NH2 3.71Å; E243-R246 PolarHBondContact OE1-NH2 3.24Å; E243-R246 IonicContact OE2-CZ 1.9Å; E243-R246 IonicContact OE2-NE 3.8Å; E243-R246 PolarHBondContact OE2-NE 2.87Å; E243-R246 IonicContact OE2-NH2 3.93Å; E243-R246 PolarHBondContact OE2-NH2 3.48Å; P244-R246 PolarHBondContact O-N 3.32Å; P244-R246 VanDerWaalsContact O-N 3.14Å
247	K	94.5	Very high	91.2	Very high	56 Å²	56	76.1 Å²	76.1	24%	0.243	40%	0.397	C	S	.	.	T	Hydrogen-bonded Turn	trans	-101	-28.5	-175.3	-172.2	178.4	176.7	-157.9	0	112.1	P244 E267 V268 D310 Y312	P244-K247 PolarHBondContact O-N 2.99Å; K247-E267 WeakPolarHBondContact CE-OE1 3.47Å; K247-E267 HydrophobicContact CG-CG 4.38Å; K247-E267 IonicContact NZ-OE1 3.96Å; K247-E267 WeakPolarHBondContact O-CA 3.36Å; K247-V268 WeakPolarHBondContact O-CG2 3.27Å; K247-V268 PolarHBondContact O-N 3.41Å; K247-D310 IonicContact NZ-OD2 3.48Å; K247-D310 PolarHBondContact NZ-OD2 2.81Å; K247-Y312 WeakPolarHBondContact CD-OH 3.06Å; K247-Y312 PolarHBondContact NZ-OH 3.17Å
248	Y	96.2	Very high	90.1	Very high	5 Å²	5	72.6 Å²	72.6	2%	0.02	38%	0.384	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-124.3	136.6	-176.3	-57.6	-73.5	0	0	0	111.7	P244 I266 E267 V274 I276 Y312 M321	P244-Y248 HydrophobicContact CB-CD2 4.12Å; P244-Y248 WeakPolarHBondContact O-CD2 3.35Å; P244-Y248 PolarHBondContact O-N 3.42Å; Y248-I266 WeakPolarHBondContact CA-O 3.45Å; Y248-E267 HydrophobicContact CD1-CB 4.01Å; Y248-E267 HydrophobicContact CD1-CG 4.47Å; Y248-E267 HydrophobicContact CE1-CB 3.78Å; Y248-E267 HydrophobicContact CE1-CG 4Å; Y248-V274 HydrophobicContact CD1-CG2 3.57Å; Y248-V274 HydrophobicContact CE1-CB 4.49Å; Y248-V274 HydrophobicContact CE1-CG1 4.18Å; Y248-V274 HydrophobicContact CE1-CG2 3.64Å; Y248-I276 HydrophobicContact CD2-CD1 4.39Å; Y248-I276 HydrophobicContact CG-CD1 4.09Å; Y248-Y312 HydrophobicContact CE2-CE2 4.27Å; Y248-M321 HydrophobicContact CD2-CE 3.84Å; Y248-M321 HydrophobicContact CD2-CG 4.33Å; Y248-M321 HydrophobicContact CE2-CE 3.79Å; Y248-M321 HydrophobicContact CE2-CG 3.65Å; Y248-M321 HydrophobicContact CE2-SD 4.4Å
249	T	95.6	Very high	89.3	Confident	69 Å²	69	72 Å²	72	42%	0.423	38%	0.382	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-129.4	171.9	179.7	-171.6	0	0	0	0	111.3	A265 I266 V268	T249-A265 WeakPolarHBondContact O-CA 3.42Å; T249-A265 WeakPolarHBondContact O-CB 3.41Å; T249-I266 HydrophobicContact CG2-CB 4.22Å; T249-I266 PolarHBondContact N-O 3.47Å; T249-I266 PolarHBondContact O-N 3.06Å; T249-V268 HydrophobicContact CG2-CG2 3.88Å
250	K	92.6	Very high	88.8	Confident	135 Å²	135	72 Å²	72	59%	0.587	39%	0.385	S	S	*	.	E	Extended strand (participates in β ladder)	trans	50.1	61.1	-177.2	-55	-171.7	-165.9	174	0	113.2	E252 I266	K250-E252 PolarHBondContact O-N 2.9Å; K250-I266 HydrophobicContact CD-CD1 3.81Å
251	L	93.5	Very high	88.6	Confident	65 Å²	65	73.7 Å²	73.7	34%	0.34	39%	0.388	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-73.6	110.7	176.2	-85.6	69.7	0	0	0	110.3	F263 T264 A265 I276 W319	L251-F263 HydrophobicContact CB-CD1 4.34Å; L251-T264 VanDerWaalsContact CA-O 3.32Å; L251-T264 WeakPolarHBondContact CA-O 3.26Å; L251-A265 HydrophobicContact CD1-CB 3.89Å; L251-A265 HydrophobicContact CG-CB 4.2Å; L251-I276 HydrophobicContact CG-CD1 4.44Å; L251-W319 HydrophobicContact CD2-CH2 3.79Å; L251-W319 HydrophobicContact CD2-CZ3 3.84Å
252	E	94.6	Very high	88.6	Confident	124 Å²	124	67 Å²	67	58%	0.579	36%	0.355	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-117.3	128.7	178	-67.7	174.3	-173.2	0	0	109.4	K250 I254 F263 T264	K250-E252 PolarHBondContact O-N 2.9Å; E252-I254 PolarHBondContact O-N 3.39Å; E252-F263 CarbonylContact O-C 3.49Å; E252-F263 WeakPolarHBondContact O-CA 3.27Å; E252-F263 WeakPolarHBondContact O-CB 3.32Å; E252-T264 PolarHBondContact N-O 3.17Å; E252-T264 PolarHBondContact O-N 2.88Å; E252-T264 PolarHBondContact O-OG1 3.35Å
253	K	93.3	Very high	88.8	Confident	110 Å²	110	66.3 Å²	66.3	48%	0.478	34%	0.34	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-79.7	112.8	-173	-173.8	177.3	171.8	177.4	0	110.6	G255 S256 H261 F263	K253-G255 WeakPolarHBondContact CE-O 3.49Å; K253-S256 WeakPolarHBondContact CE-OG 3.49Å; K253-S256 PolarHBondContact NZ-OG 3.49Å; K253-H261 PolarHBondContact NZ-CE1 2.95Å; K253-H261 PolarHBondContact NZ-ND1 2.98Å; K253-H261 VanDerWaalsContact NZ-ND1 3.19Å; K253-F263 HydrophobicContact CB-CD1 3.74Å; K253-F263 HydrophobicContact CB-CE1 3.65Å; K253-F263 HydrophobicContact CB-CZ 4.43Å; K253-F263 HydrophobicContact CD-CE1 4.41Å; K253-F263 HydrophobicContact CD-CZ 4.45Å; K253-F263 HydrophobicContact CG-CD1 4.31Å; K253-F263 HydrophobicContact CG-CE1 4.05Å; K253-F263 HydrophobicContact CG-CZ 4.35Å
254	I	90.3	Very high	89.1	Confident	87 Å²	87	62 Å²	62	45%	0.446	32%	0.321	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-98.9	-17.8	179.1	59.2	160.5	0	0	0	114.1	E252 V262 T264 Y324	E252-I254 PolarHBondContact O-N 3.39Å; I254-V262 HydrophobicContact CD1-CG1 3.92Å; I254-V262 HydrophobicContact CG1-CB 4.23Å; I254-V262 HydrophobicContact CG1-CG1 3.94Å; I254-V262 WeakPolarHBondContact CG1-O 3.16Å; I254-V262 PolarHBondContact N-O 2.86Å; I254-T264 HydrophobicContact CD1-CG2 4.15Å; I254-T264 HydrophobicContact CG2-CG2 3.74Å; I254-Y324 HydrophobicContact CD1-CD2 4.36Å; I254-Y324 HydrophobicContact CD1-CE2 3.94Å
255	G	82.6	Confident	89.3	Confident	22 Å²	22	62.1 Å²	62.1	23%	0.227	32%	0.322	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-163.6	168.4	-175.6	0	0	0	0	0	115.3	K253 V262	K253-G255 WeakPolarHBondContact CE-O 3.49Å; G255-V262 PolarHBondContact N-O 3.04Å; G255-V262 PolarHBondContact O-N 3.06Å
256	S	82.2	Confident	89.5	Confident	45 Å²	45	57.8 Å²	57.8	32%	0.315	30%	0.302	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-136.6	121	168.1	-58.8	0	0	0	0	108.7	L140 K253 G260 H261	L140-S256 WeakPolarHBondContact CD1-O 3.22Å; L140-S256 WeakPolarHBondContact CD2-O 3.26Å; K253-S256 WeakPolarHBondContact CE-OG 3.49Å; K253-S256 PolarHBondContact NZ-OG 3.49Å; S256-G260 CarbonylContact C-O 3.51Å; S256-G260 WeakPolarHBondContact CA-O 3.38Å; S256-H261 PolarHBondContact OG-ND1 3.49Å
257	G	72.8	Confident	89.7	Confident	29 Å²	29	50.5 Å²	50.5	30%	0.299	28%	0.276	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-103.1	170.6	175.4	0	0	0	0	0	111.6	S259 G260	G257-S259 PolarHBondContact O-N 3.36Å; G257-S259 VanDerWaalsContact O-N 3.11Å; G257-G260 PolarHBondContact N-O 3.46Å; G257-G260 PolarHBondContact O-N 3.46Å; G257-G260 VanDerWaalsContact O-N 3.09Å
258	A	68.7	Low	89.7	Confident	43 Å²	43	52.3 Å²	52.3	36%	0.355	29%	0.292	S	S	.	.	T	Hydrogen-bonded Turn	trans	-60.6	-21.3	175	0	0	0	0	0	113.3	Q137 K138	Q137-A258 WeakPolarHBondContact O-CB 3.01Å; K138-A258 HydrophobicContact CB-CB 4.48Å; K138-A258 HydrophobicContact CG-CB 4.19Å
259	S	75.5	Confident	89.7	Confident	17 Å²	17	56.7 Å²	56.7	12%	0.119	32%	0.323	C	S	.	.	T	Hydrogen-bonded Turn	trans	-89.5	-16.1	178	61.1	0	0	0	0	114.3	G257 K277 M279 Q284	G257-S259 PolarHBondContact O-N 3.36Å; G257-S259 VanDerWaalsContact O-N 3.11Å; S259-K277 WeakPolarHBondContact OG-CE 3.5Å; S259-M279 WeakPolarHBondContact O-CA 3.43Å; S259-M279 WeakPolarHBondContact O-CB 3.37Å; S259-M279 WeakPolarHBondContact O-CG 3.29Å; S259-Q284 PolarHBondContact O-NE2 2.84Å
260	G	83.7	Confident	89.6	Confident	16 Å²	16	57.7 Å²	57.7	17%	0.165	33%	0.329	C	S	.	.	E	Extended strand (participates in β ladder)	trans	147.4	-149.1	-173.1	0	0	0	0	0	114.3	S256 G257 Q278	S256-G260 CarbonylContact C-O 3.51Å; S256-G260 WeakPolarHBondContact CA-O 3.38Å; G257-G260 PolarHBondContact N-O 3.46Å; G257-G260 PolarHBondContact O-N 3.46Å; G257-G260 VanDerWaalsContact O-N 3.09Å; G260-Q278 CarbonylContact C-O 3.54Å; G260-Q278 WeakPolarHBondContact CA-O 3.24Å
261	H	90.8	Very high	89.7	Confident	82 Å²	82	53.7 Å²	53.7	38%	0.38	33%	0.326	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-110.3	149.4	-174.8	-63.3	-36.5	0	0	0	112	K253 S256 F263 K277 Q278	K253-H261 PolarHBondContact NZ-CE1 2.95Å; K253-H261 PolarHBondContact NZ-ND1 2.98Å; K253-H261 VanDerWaalsContact NZ-ND1 3.19Å; S256-H261 PolarHBondContact OG-ND1 3.49Å; H261-F263 HydrophobicContact CB-CD2 4.32Å; H261-F263 HydrophobicContact CB-CE2 3.5Å; H261-F263 VanDerWaalsContact CB-CE2 3.5Å; H261-F263 HydrophobicContact CB-CZ 4.02Å; H261-K277 CarbonylContact O-C 3.46Å; H261-K277 WeakPolarHBondContact O-CA 3.45Å; H261-Q278 PolarHBondContact N-O 3.24Å; H261-Q278 PolarHBondContact O-N 2.75Å
262	V	93.1	Very high	89.8	Confident	34 Å²	34	52.8 Å²	52.8	21%	0.206	33%	0.328	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-117.6	130.1	176.3	-170.6	0	0	0	0	108.9	I254 G255 A275 I276 K277	I254-V262 HydrophobicContact CD1-CG1 3.92Å; I254-V262 HydrophobicContact CG1-CB 4.23Å; I254-V262 HydrophobicContact CG1-CG1 3.94Å; I254-V262 WeakPolarHBondContact CG1-O 3.16Å; I254-V262 PolarHBondContact N-O 2.86Å; G255-V262 PolarHBondContact N-O 3.04Å; G255-V262 PolarHBondContact O-N 3.06Å; V262-A275 HydrophobicContact CG1-CB 4.42Å; V262-I276 WeakPolarHBondContact CA-O 3.39Å; V262-K277 HydrophobicContact CG2-CG 4.41Å
263	F	96	Very high	89.8	Confident	31 Å²	31	52.4 Å²	52.4	14%	0.136	33%	0.326	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-122.2	146.1	179.5	-59.1	-103	0	0	0	110.3	L251 E252 K253 H261 A275 I276 Q278	L251-F263 HydrophobicContact CB-CD1 4.34Å; E252-F263 CarbonylContact O-C 3.49Å; E252-F263 WeakPolarHBondContact O-CA 3.27Å; E252-F263 WeakPolarHBondContact O-CB 3.32Å; K253-F263 HydrophobicContact CB-CD1 3.74Å; K253-F263 HydrophobicContact CB-CE1 3.65Å; K253-F263 HydrophobicContact CB-CZ 4.43Å; K253-F263 HydrophobicContact CD-CE1 4.41Å; K253-F263 HydrophobicContact CD-CZ 4.45Å; K253-F263 HydrophobicContact CG-CD1 4.31Å; K253-F263 HydrophobicContact CG-CE1 4.05Å; K253-F263 HydrophobicContact CG-CZ 4.35Å; H261-F263 HydrophobicContact CB-CD2 4.32Å; H261-F263 HydrophobicContact CB-CE2 3.5Å; H261-F263 VanDerWaalsContact CB-CE2 3.5Å; H261-F263 HydrophobicContact CB-CZ 4.02Å; F263-A275 CarbonylContact O-C 3.53Å; F263-A275 VanDerWaalsContact O-CA 3.32Å; F263-A275 WeakPolarHBondContact O-CA 3.31Å; F263-I276 PolarHBondContact N-O 3.24Å; F263-I276 PolarHBondContact O-N 2.94Å; F263-Q278 HydrophobicContact CD2-CG 3.96Å; F263-Q278 HydrophobicContact CE2-CB 4.22Å; F263-Q278 HydrophobicContact CE2-CG 3.91Å
264	T	96.6	Very high	90	Very high	16 Å²	16	47.3 Å²	47.3	10%	0.098	30%	0.304	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-76.9	153.8	154.7	40.6	0	0	0	0	109.5	L251 E252 I254 V274 Y324	L251-T264 VanDerWaalsContact CA-O 3.32Å; L251-T264 WeakPolarHBondContact CA-O 3.26Å; E252-T264 PolarHBondContact N-O 3.17Å; E252-T264 PolarHBondContact O-N 2.88Å; E252-T264 PolarHBondContact O-OG1 3.35Å; I254-T264 HydrophobicContact CD1-CG2 4.15Å; I254-T264 HydrophobicContact CG2-CG2 3.74Å; T264-V274 CarbonylContact C-O 3.55Å; T264-V274 WeakPolarHBondContact CA-O 3.43Å; T264-Y324 HydrophobicContact CG2-CD1 3.98Å; T264-Y324 HydrophobicContact CG2-CD2 3.73Å; T264-Y324 HydrophobicContact CG2-CE1 3.72Å; T264-Y324 HydrophobicContact CG2-CE2 3.49Å; T264-Y324 VanDerWaalsContact CG2-CE2 3.49Å; T264-Y324 HydrophobicContact CG2-CG 3.99Å; T264-Y324 VanDerWaalsContact CG2-CZ 3.47Å
265	A	97.5	Very high	90.3	Very high	3 Å²	3	43.5 Å²	43.5	3%	0.025	29%	0.286	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-154.4	164.1	168.8	0	0	0	0	0	110.2	T249 L251 E273 V274 I276	T249-A265 WeakPolarHBondContact O-CA 3.42Å; T249-A265 WeakPolarHBondContact O-CB 3.41Å; L251-A265 HydrophobicContact CD1-CB 3.89Å; L251-A265 HydrophobicContact CG-CB 4.2Å; A265-E273 WeakPolarHBondContact O-CA 3.43Å; A265-V274 HydrophobicContact CB-CG2 4.06Å; A265-V274 PolarHBondContact N-O 3.19Å; A265-V274 PolarHBondContact O-N 3.01Å; A265-I276 HydrophobicContact CB-CD1 3.55Å; A265-I276 HydrophobicContact CB-CG1 4.16Å
266	I	97.1	Very high	90.9	Very high	40 Å²	40	42.5 Å²	42.5	21%	0.205	28%	0.275	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-106.9	128.5	173.2	-56.5	-175.4	0	0	0	109.4	Y248 T249 K250 V268 A272 E273	Y248-I266 WeakPolarHBondContact CA-O 3.45Å; T249-I266 HydrophobicContact CG2-CB 4.22Å; T249-I266 PolarHBondContact N-O 3.47Å; T249-I266 PolarHBondContact O-N 3.06Å; K250-I266 HydrophobicContact CD-CD1 3.81Å; I266-V268 PolarHBondContact O-N 3.35Å; I266-A272 WeakPolarHBondContact CA-O 3.31Å; I266-E273 HydrophobicContact CG1-CG 4.46Å
267	E	96.3	Very high	91.4	Very high	32 Å²	32	41.1 Å²	41.1	15%	0.15	26%	0.264	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-71.8	119.7	170.4	-176.6	174.9	-121.7	0	0	110.6	K247 Y248 S269 T270 G271 A272	K247-E267 WeakPolarHBondContact CE-OE1 3.47Å; K247-E267 HydrophobicContact CG-CG 4.38Å; K247-E267 IonicContact NZ-OE1 3.96Å; K247-E267 WeakPolarHBondContact O-CA 3.36Å; Y248-E267 HydrophobicContact CD1-CB 4.01Å; Y248-E267 HydrophobicContact CD1-CG 4.47Å; Y248-E267 HydrophobicContact CE1-CB 3.78Å; Y248-E267 HydrophobicContact CE1-CG 4Å; E267-S269 VanDerWaalsContact C-N 3.28Å; E267-S269 PolarHBondContact O-N 2.9Å; E267-T270 WeakPolarHBondContact CB-OG1 3.45Å; E267-T270 PolarHBondContact O-N 2.8Å; E267-T270 WeakPolarHBondContact OE2-CB 3.45Å; E267-T270 WeakPolarHBondContact OE2-CG2 3.37Å; E267-T270 PolarHBondContact OE2-OG1 2.96Å; E267-G271 WeakPolarHBondContact O-CA 3.32Å; E267-G271 PolarHBondContact O-N 3.32Å; E267-A272 PolarHBondContact N-O 3.39Å
268	V	95.3	Very high	92.4	Very high	94 Å²	94	40.9 Å²	40.9	57%	0.57	25%	0.254	S	S	*	.	T	Hydrogen-bonded Turn	trans	-62.4	-32.3	-171.1	175.7	0	0	0	0	112.8	K247 T249 I266	K247-V268 WeakPolarHBondContact O-CG2 3.27Å; K247-V268 PolarHBondContact O-N 3.41Å; T249-V268 HydrophobicContact CG2-CG2 3.88Å; I266-V268 PolarHBondContact O-N 3.35Å
269	S	94.6	Very high	93.5	Very high	96 Å²	96	38.9 Å²	38.9	67%	0.671	24%	0.238	S	C	*	.	T	Hydrogen-bonded Turn	trans	-82.4	-20.9	-176.9	47.8	0	0	0	0	115	E267	E267-S269 VanDerWaalsContact C-N 3.28Å; E267-S269 PolarHBondContact O-N 2.9Å
270	T	94.9	Very high	94.1	Very high	90 Å²	90	40 Å²	40	55%	0.552	24%	0.243	S	C	*	.	T	Hydrogen-bonded Turn	trans	-123	-19.9	-172.9	59.2	0	0	0	0	113.4	E267 A272	E267-T270 WeakPolarHBondContact CB-OG1 3.45Å; E267-T270 PolarHBondContact O-N 2.8Å; E267-T270 WeakPolarHBondContact OE2-CB 3.45Å; E267-T270 WeakPolarHBondContact OE2-CG2 3.37Å; E267-T270 PolarHBondContact OE2-OG1 2.96Å; T270-A272 PolarHBondContact O-N 3.37Å; T270-A272 WeakPolarHBondContact OG1-CB 3.42Å; T270-A272 PolarHBondContact OG1-N 3.4Å
271	G	94.4	Very high	94.4	Very high	52 Å²	52	39.5 Å²	39.5	54%	0.536	24%	0.236	S	C	.	.			trans	73.4	5	-168.9	0	0	0	0	0	113.9	E267	E267-G271 WeakPolarHBondContact O-CA 3.32Å; E267-G271 PolarHBondContact O-N 3.32Å
272	A	94.7	Very high	94.1	Very high	45 Å²	45	38.5 Å²	38.5	37%	0.372	24%	0.242	S	C	.	.			trans	-73.4	137.2	-177.9	0	0	0	0	0	112	I266 E267 T270	I266-A272 WeakPolarHBondContact CA-O 3.31Å; E267-A272 PolarHBondContact N-O 3.39Å; T270-A272 PolarHBondContact O-N 3.37Å; T270-A272 WeakPolarHBondContact OG1-CB 3.42Å; T270-A272 PolarHBondContact OG1-N 3.4Å
273	E	96.3	Very high	93.7	Very high	117 Å²	117	42.7 Å²	42.7	55%	0.547	26%	0.259	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-76.5	134.5	169.9	-67.4	-177.2	-179.8	0	0	110.9	A265 I266 Y324	A265-E273 WeakPolarHBondContact O-CA 3.43Å; I266-E273 HydrophobicContact CG1-CG 4.46Å; E273-Y324 HydrophobicContact CB-CD1 3.99Å; E273-Y324 VanDerWaalsContact OE2-CD1 3.31Å; E273-Y324 WeakPolarHBondContact OE2-CD1 3.33Å; E273-Y324 WeakPolarHBondContact OE2-CE1 3.37Å
274	V	97.1	Very high	93	Very high	3 Å²	3	42.7 Å²	42.7	2%	0.018	26%	0.26	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-132.5	156	-179.8	-57.3	0	0	0	0	110.6	Y248 T264 A265 I276 L309	Y248-V274 HydrophobicContact CD1-CG2 3.57Å; Y248-V274 HydrophobicContact CE1-CB 4.49Å; Y248-V274 HydrophobicContact CE1-CG1 4.18Å; Y248-V274 HydrophobicContact CE1-CG2 3.64Å; T264-V274 CarbonylContact C-O 3.55Å; T264-V274 WeakPolarHBondContact CA-O 3.43Å; A265-V274 HydrophobicContact CB-CG2 4.06Å; A265-V274 PolarHBondContact N-O 3.19Å; A265-V274 PolarHBondContact O-N 3.01Å; V274-I276 HydrophobicContact CG2-CG1 4.2Å; V274-L309 HydrophobicContact CB-CD1 4.09Å; V274-L309 HydrophobicContact CG1-CD1 3.48Å; V274-L309 VanDerWaalsContact CG1-CD1 3.48Å
275	A	96.6	Very high	91.9	Very high	7 Å²	7	45.7 Å²	45.7	6%	0.058	28%	0.28	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-99.9	137.5	167.2	0	0	0	0	0	110.2	V262 F263 M321 M322 Y324	V262-A275 HydrophobicContact CG1-CB 4.42Å; F263-A275 CarbonylContact O-C 3.53Å; F263-A275 VanDerWaalsContact O-CA 3.32Å; F263-A275 WeakPolarHBondContact O-CA 3.31Å; A275-M321 WeakPolarHBondContact O-CA 3.35Å; A275-M322 HydrophobicContact CB-CG 3.73Å; A275-M322 HydrophobicContact CB-SD 4.48Å; A275-M322 PolarHBondContact N-O 2.89Å; A275-M322 PolarHBondContact O-N 2.62Å; A275-Y324 HydrophobicContact CB-CD2 4.47Å
276	I	95.5	Very high	90.9	Very high	0 Å²	0	48.2 Å²	48.2	0%	0	29%	0.29	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-119.6	110.1	179	-52.9	-177.2	0	0	0	108.7	Y248 L251 V262 F263 A265 V274 Q278 W319 V320 M321	Y248-I276 HydrophobicContact CD2-CD1 4.39Å; Y248-I276 HydrophobicContact CG-CD1 4.09Å; L251-I276 HydrophobicContact CG-CD1 4.44Å; V262-I276 WeakPolarHBondContact CA-O 3.39Å; F263-I276 PolarHBondContact N-O 3.24Å; F263-I276 PolarHBondContact O-N 2.94Å; A265-I276 HydrophobicContact CB-CD1 3.55Å; A265-I276 HydrophobicContact CB-CG1 4.16Å; V274-I276 HydrophobicContact CG2-CG1 4.2Å; I276-Q278 HydrophobicContact CG2-CG 4.01Å; I276-W319 HydrophobicContact CG2-CB 4.17Å; I276-W319 HydrophobicContact CG2-CD2 4.22Å; I276-W319 HydrophobicContact CG2-CE3 3.84Å; I276-W319 HydrophobicContact CG2-CG 4.38Å; I276-V320 WeakPolarHBondContact CA-O 3.39Å; I276-M321 HydrophobicContact CD1-CE 4.17Å; I276-M321 HydrophobicContact CG1-CE 4.43Å; I276-M321 HydrophobicContact CG1-CG 4.25Å; I276-M321 HydrophobicContact CG2-CE 3.99Å; I276-M321 HydrophobicContact CG2-SD 4.45Å
277	K	92.7	Very high	90.2	Very high	17 Å²	17	48 Å²	48	7%	0.074	29%	0.287	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-88.1	104.1	172.1	-173.8	176.8	-179.3	-177.4	0	108.3	S259 H261 V262 M279 E293 V320 M322 D385	S259-K277 WeakPolarHBondContact OG-CE 3.5Å; H261-K277 CarbonylContact O-C 3.46Å; H261-K277 WeakPolarHBondContact O-CA 3.45Å; V262-K277 HydrophobicContact CG2-CG 4.41Å; K277-M279 HydrophobicContact CD-CE 4.32Å; K277-M279 HydrophobicContact CD-SD 4.26Å; K277-M279 HydrophobicContact CG-CE 4.24Å; K277-M279 HydrophobicContact CG-CG 4.11Å; K277-M279 HydrophobicContact CG-SD 4.25Å; K277-E293 IonicContact NZ-OE1 3.06Å; K277-E293 PolarHBondContact NZ-OE1 2.74Å; K277-E293 IonicContact NZ-OE2 2.79Å; K277-V320 HydrophobicContact CB-CB 4.45Å; K277-V320 PolarHBondContact N-O 3.21Å; K277-V320 PolarHBondContact O-N 2.9Å; K277-M322 HydrophobicContact CB-CE 3.67Å; K277-M322 HydrophobicContact CD-CE 4.26Å; K277-D385 IonicContact NZ-OD1 3.8Å; K277-D385 PolarHBondContact NZ-OD1 3.5Å
278	Q	93.4	Very high	89.4	Confident	23 Å²	23	49.3 Å²	49.3	11%	0.107	29%	0.294	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-91.6	123.5	176.3	-63.3	-177.2	-6.7	0	0	109.8	G260 H261 F263 I276 W319	G260-Q278 CarbonylContact C-O 3.54Å; G260-Q278 WeakPolarHBondContact CA-O 3.24Å; H261-Q278 PolarHBondContact N-O 3.24Å; H261-Q278 PolarHBondContact O-N 2.75Å; F263-Q278 HydrophobicContact CD2-CG 3.96Å; F263-Q278 HydrophobicContact CE2-CB 4.22Å; F263-Q278 HydrophobicContact CE2-CG 3.91Å; I276-Q278 HydrophobicContact CG2-CG 4.01Å; Q278-W319 HydrophobicContact CG-CD2 3.92Å; Q278-W319 HydrophobicContact CG-CG 3.98Å; Q278-W319 HydrophobicContact CG-CZ2 4.4Å; Q278-W319 VanDerWaalsContact NE2-CH2 3.3Å
279	M	90.6	Very high	88.7	Confident	1 Å²	1	47.5 Å²	47.5	1%	0.005	28%	0.28	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-127	112.2	-174.9	-61.9	179.4	-87	0	0	110.2	S259 K277 L281 I290 E317 L318 V320	S259-M279 WeakPolarHBondContact O-CA 3.43Å; S259-M279 WeakPolarHBondContact O-CB 3.37Å; S259-M279 WeakPolarHBondContact O-CG 3.29Å; K277-M279 HydrophobicContact CD-CE 4.32Å; K277-M279 HydrophobicContact CD-SD 4.26Å; K277-M279 HydrophobicContact CG-CE 4.24Å; K277-M279 HydrophobicContact CG-CG 4.11Å; K277-M279 HydrophobicContact CG-SD 4.25Å; M279-L281 PolarHBondContact O-N 3.48Å; M279-I290 HydrophobicContact CE-CG2 4.39Å; M279-E317 WeakPolarHBondContact O-CA 3.49Å; M279-L318 HydrophobicContact CE-CD2 3.66Å; M279-L318 HydrophobicContact CE-CG 4.2Å; M279-L318 PolarHBondContact N-O 2.73Å; M279-L318 PolarHBondContact O-N 2.93Å; M279-V320 HydrophobicContact CE-CB 4.27Å; M279-V320 HydrophobicContact CE-CG2 3.47Å; M279-V320 VanDerWaalsContact CE-CG2 3.47Å
280	N	90.1	Very high	88.2	Confident	41 Å²	41	43.2 Å²	43.2	22%	0.219	25%	0.25	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-69.4	112.8	172.8	-178.9	-63	0	0	0	109.4	A282 Q283 Q284	N280-A282 VanDerWaalsContact C-N 3.33Å; N280-A282 PolarHBondContact O-N 2.97Å; N280-A282 WeakPolarHBondContact OD1-CB 3.46Å; N280-A282 PolarHBondContact OD1-N 3.47Å; N280-A282 VanDerWaalsContact OD1-N 3.08Å; N280-Q283 HydrophobicContact CB-CB 4.46Å; N280-Q283 HydrophobicContact CB-CG 4.28Å; N280-Q283 PolarHBondContact O-N 2.9Å; N280-Q283 PolarHBondContact OD1-N 3.49Å; N280-Q284 WeakPolarHBondContact O-CG 3.36Å
281	L	88.6	Confident	87.7	Confident	5 Å²	5	39.8 Å²	39.8	3%	0.026	23%	0.228	C	C	.	.	G	3₁₀ helix	trans	-66.5	-33.7	-172.7	-65.3	177.2	0	0	0	112.6	L232 L235 M279 Q283 Q284 K287 I290 L313 E316 L318	L232-L281 HydrophobicContact CD2-CD1 3.66Å; L235-L281 HydrophobicContact CD1-CD1 3.73Å; L235-L281 HydrophobicContact CD1-CD2 3.93Å; M279-L281 PolarHBondContact O-N 3.48Å; L281-Q283 PolarHBondContact O-N 3.14Å; L281-Q284 PolarHBondContact O-N 3.32Å; L281-Q284 VanDerWaalsContact O-N 3.16Å; L281-K287 WeakPolarHBondContact O-CE 3.23Å; L281-I290 HydrophobicContact CD2-CD1 3.49Å; L281-I290 VanDerWaalsContact CD2-CD1 3.49Å; L281-L313 HydrophobicContact CD1-CD1 3.54Å; L281-E316 VanDerWaalsContact CB-O 3.27Å; L281-E316 WeakPolarHBondContact CB-O 3.35Å; L281-E316 VanDerWaalsContact CG-O 3.31Å; L281-E316 WeakPolarHBondContact CG-O 3.19Å; L281-E316 PolarHBondContact N-O 2.61Å; L281-L318 HydrophobicContact CD2-CB 3.93Å; L281-L318 HydrophobicContact CG-CB 4.35Å
282	A	85.8	Confident	87	Confident	61 Å²	61	39 Å²	39	50%	0.504	21%	0.212	S	C	.	.	G	3₁₀ helix	trans	-63.9	-28	179.5	0	0	0	0	0	112.7	N280	N280-A282 VanDerWaalsContact C-N 3.33Å; N280-A282 PolarHBondContact O-N 2.97Å; N280-A282 WeakPolarHBondContact OD1-CB 3.46Å; N280-A282 PolarHBondContact OD1-N 3.47Å; N280-A282 VanDerWaalsContact OD1-N 3.08Å
283	Q	83.6	Confident	86.5	Confident	122 Å²	122	37.5 Å²	37.5	57%	0.57	20%	0.197	S	C	*	.	G	3₁₀ helix	trans	-82.7	-11.8	177.7	-64.1	176.4	16.3	0	0	113.5	N280 L281 P285	N280-Q283 HydrophobicContact CB-CB 4.46Å; N280-Q283 HydrophobicContact CB-CG 4.28Å; N280-Q283 PolarHBondContact O-N 2.9Å; N280-Q283 PolarHBondContact OD1-N 3.49Å; L281-Q283 PolarHBondContact O-N 3.14Å; Q283-P285 WeakPolarHBondContact O-CD 3.32Å
284	Q	81.1	Confident	86.1	Confident	31 Å²	31	32 Å²	32	15%	0.145	17%	0.171	C	C	.	.			trans	-82	119	-174.9	-63.3	-53	-51.8	0	0	112.5	S259 N280 L281 K286 K287 I290	S259-Q284 PolarHBondContact O-NE2 2.84Å; N280-Q284 WeakPolarHBondContact O-CG 3.36Å; L281-Q284 PolarHBondContact O-N 3.32Å; L281-Q284 VanDerWaalsContact O-N 3.16Å; Q284-K286 VanDerWaalsContact C-N 3.26Å; Q284-K286 PolarHBondContact O-N 3.35Å; Q284-K287 HydrophobicContact CB-CG 4.24Å; Q284-K287 WeakPolarHBondContact O-CG 3.23Å; Q284-I290 HydrophobicContact CB-CD1 3.8Å; Q284-I290 HydrophobicContact CG-CD1 3.67Å
285	P	73.6	Confident	85.7	Confident	80 Å²	80	34.3 Å²	34.3	52%	0.519	18%	0.183	S	C	.	.	T	Hydrogen-bonded Turn	trans	-74	-13.8	-171.6	29.4	-36.2	0	0	0	114.3	A134 Q283	A134-P285 HydrophobicContact CB-CB 4.25Å; A134-P285 WeakPolarHBondContact O-CG 3.26Å; Q283-P285 WeakPolarHBondContact O-CD 3.32Å
286	K	76.7	Confident	85.2	Confident	55 Å²	55	34 Å²	34	24%	0.239	18%	0.181	C	C	.	.	T	Hydrogen-bonded Turn	trans	-144.6	71.7	178.4	-65.4	174.3	-172.9	157.7	0	108.7	D131 Q284 E288 L289	D131-K286 IonicContact OD1-NZ 3.43Å; Q284-K286 VanDerWaalsContact C-N 3.26Å; Q284-K286 PolarHBondContact O-N 3.35Å; K286-E288 WeakPolarHBondContact CA-OE2 3.2Å; K286-E288 PolarHBondContact O-N 2.93Å; K286-L289 HydrophobicContact CB-CD1 3.81Å; K286-L289 HydrophobicContact CB-CG 3.89Å; K286-L289 HydrophobicContact CD-CD1 3.84Å; K286-L289 HydrophobicContact CG-CD1 4.48Å; K286-L289 WeakPolarHBondContact O-CB 3.41Å; K286-L289 PolarHBondContact O-N 3.08Å
287	K	81.6	Confident	84.9	Confident	35 Å²	35	34.2 Å²	34.2	15%	0.152	18%	0.182	C	C	.	.	H	α-helix	trans	-55	-24.7	-175.4	-52	-179.5	-174.7	-176.6	0	112.6	D228 V231 L281 Q284 L289 I290	D228-K287 VanDerWaalsContact CG-NZ 3.27Å; D228-K287 IonicContact OD1-NZ 2.78Å; D228-K287 IonicContact OD2-NZ 2.91Å; D228-K287 PolarHBondContact OD2-NZ 3.17Å; V231-K287 HydrophobicContact CB-CB 4.42Å; V231-K287 HydrophobicContact CG1-CB 3.71Å; V231-K287 HydrophobicContact CG2-CB 4.42Å; L281-K287 WeakPolarHBondContact O-CE 3.23Å; Q284-K287 HydrophobicContact CB-CG 4.24Å; Q284-K287 WeakPolarHBondContact O-CG 3.23Å; K287-L289 VanDerWaalsContact C-N 3.27Å; K287-L289 PolarHBondContact O-N 2.95Å; K287-I290 HydrophobicContact CB-CD1 4.35Å; K287-I290 WeakPolarHBondContact O-CB 3.45Å; K287-I290 WeakPolarHBondContact O-CG1 3.13Å; K287-I290 PolarHBondContact O-N 2.73Å
288	E	80.5	Confident	84.8	Confident	61 Å²	61	39.6 Å²	39.6	29%	0.285	20%	0.201	S	C	.	.	H	α-helix	trans	-65.3	-22.1	175.4	72.2	-88.2	-146.9	0	0	114.7	V231 K286	V231-E288 HydrophobicContact CG2-CB 4.41Å; K286-E288 WeakPolarHBondContact CA-OE2 3.2Å; K286-E288 PolarHBondContact O-N 2.93Å
289	L	80.3	Confident	84.6	Confident	55 Å²	55	44 Å²	44	29%	0.288	22%	0.222	S	C	.	.	H	α-helix	trans	-72.9	-29.9	177	-64.6	-178.9	0	0	0	112.3	K286 K287 I291 N292 E293	K286-L289 HydrophobicContact CB-CD1 3.81Å; K286-L289 HydrophobicContact CB-CG 3.89Å; K286-L289 HydrophobicContact CD-CD1 3.84Å; K286-L289 HydrophobicContact CG-CD1 4.48Å; K286-L289 WeakPolarHBondContact O-CB 3.41Å; K286-L289 PolarHBondContact O-N 3.08Å; K287-L289 VanDerWaalsContact C-N 3.27Å; K287-L289 PolarHBondContact O-N 2.95Å; L289-I291 VanDerWaalsContact C-N 3.32Å; L289-I291 PolarHBondContact O-N 3Å; L289-N292 WeakPolarHBondContact O-CA 3.38Å; L289-N292 WeakPolarHBondContact O-CB 3.19Å; L289-N292 PolarHBondContact O-N 3.19Å; L289-E293 PolarHBondContact O-N 3.4Å
290	I	84.1	Confident	84.6	Confident	6 Å²	6	44.2 Å²	44.2	3%	0.031	22%	0.223	C	C	.	.	H	α-helix	trans	-64.4	-39.4	-178.8	-49.6	170.8	0	0	0	110.9	L235 M279 L281 Q284 K287 N292 E293 I294 L318	L235-I290 HydrophobicContact CD2-CG2 4.49Å; M279-I290 HydrophobicContact CE-CG2 4.39Å; L281-I290 HydrophobicContact CD2-CD1 3.49Å; L281-I290 VanDerWaalsContact CD2-CD1 3.49Å; Q284-I290 HydrophobicContact CB-CD1 3.8Å; Q284-I290 HydrophobicContact CG-CD1 3.67Å; K287-I290 HydrophobicContact CB-CD1 4.35Å; K287-I290 WeakPolarHBondContact O-CB 3.45Å; K287-I290 WeakPolarHBondContact O-CG1 3.13Å; K287-I290 PolarHBondContact O-N 2.73Å; I290-N292 VanDerWaalsContact C-N 3.27Å; I290-N292 PolarHBondContact O-N 3.33Å; I290-E293 WeakPolarHBondContact O-CB 3.38Å; I290-E293 PolarHBondContact O-N 2.73Å; I290-I294 PolarHBondContact O-N 3.13Å; I290-I294 VanDerWaalsContact O-N 3.08Å; I290-L318 HydrophobicContact CG2-CD2 3.16Å
291	I	85	Confident	84.8	Confident	19 Å²	19	48 Å²	48	10%	0.097	24%	0.238	C	C	.	.	H	α-helix	trans	-58.8	-43.3	172.9	-68.8	166.6	0	0	0	110.2	V231 K234 L235 I238 L289 L295	V231-I291 HydrophobicContact CB-CD1 4.39Å; V231-I291 HydrophobicContact CG1-CD1 3.87Å; V231-I291 HydrophobicContact CG1-CG1 4.5Å; K234-I291 HydrophobicContact CB-CD1 3.6Å; K234-I291 HydrophobicContact CB-CG1 4.45Å; K234-I291 HydrophobicContact CD-CD1 4.09Å; L235-I291 HydrophobicContact CD2-CG1 3.73Å; L235-I291 HydrophobicContact CG-CG1 4Å; I238-I291 HydrophobicContact CD1-CG1 4.48Å; I238-I291 HydrophobicContact CD1-CG2 4.16Å; L289-I291 VanDerWaalsContact C-N 3.32Å; L289-I291 PolarHBondContact O-N 3Å; I291-L295 HydrophobicContact CG2-CD1 3.81Å; I291-L295 HydrophobicContact CG2-CG 4.44Å; I291-L295 WeakPolarHBondContact O-CB 3.29Å; I291-L295 VanDerWaalsContact O-CG 3.27Å; I291-L295 WeakPolarHBondContact O-CG 3.36Å; I291-L295 PolarHBondContact O-N 3.5Å
292	N	79.9	Confident	85.2	Confident	36 Å²	36	50 Å²	50	19%	0.193	25%	0.247	C	C	.	.	H	α-helix	trans	-68.2	-38.2	179.5	-174.8	78.3	0	0	0	111.7	L289 I290 L295 V296 C389	L289-N292 WeakPolarHBondContact O-CA 3.38Å; L289-N292 WeakPolarHBondContact O-CB 3.19Å; L289-N292 PolarHBondContact O-N 3.19Å; I290-N292 VanDerWaalsContact C-N 3.27Å; I290-N292 PolarHBondContact O-N 3.33Å; N292-L295 PolarHBondContact O-N 3.08Å; N292-V296 VanDerWaalsContact O-CB 3.29Å; N292-V296 WeakPolarHBondContact O-CB 3.45Å; N292-V296 WeakPolarHBondContact O-CG2 3.29Å; N292-V296 PolarHBondContact O-N 2.67Å; N292-C389 PolarHBondContact ND2-O 3.22Å
293	E	83.5	Confident	85.7	Confident	12 Å²	12	51.5 Å²	51.5	6%	0.056	25%	0.252	C	S	.	.	H	α-helix	trans	-59	-51.5	174.4	-170.6	-179.6	157.1	0	0	111.7	K277 L289 I290 L295 V296 M297 F386	K277-E293 IonicContact NZ-OE1 3.06Å; K277-E293 PolarHBondContact NZ-OE1 2.74Å; K277-E293 IonicContact NZ-OE2 2.79Å; L289-E293 PolarHBondContact O-N 3.4Å; I290-E293 WeakPolarHBondContact O-CB 3.38Å; I290-E293 PolarHBondContact O-N 2.73Å; E293-L295 PolarHBondContact O-N 3.03Å; E293-V296 PolarHBondContact O-N 2.83Å; E293-M297 HydrophobicContact CG-SD 4.28Å; E293-M297 WeakPolarHBondContact O-CG 3.44Å; E293-M297 PolarHBondContact O-N 2.76Å; E293-F386 HydrophobicContact CG-CB 4.26Å
294	I	87.5	Confident	86.4	Confident	2 Å²	2	46.3 Å²	46.3	1%	0.01	23%	0.228	C	C	.	.	H	α-helix	trans	-59.6	-49.6	177.3	-66	163.3	0	0	0	111.2	L235 I238 I290 M297 R298 Y308 L318 V320	L235-I294 HydrophobicContact CD2-CD1 3.92Å; I238-I294 HydrophobicContact CD1-CB 4.1Å; I238-I294 HydrophobicContact CD1-CD1 3.98Å; I238-I294 HydrophobicContact CD1-CG2 4.02Å; I290-I294 PolarHBondContact O-N 3.13Å; I290-I294 VanDerWaalsContact O-N 3.08Å; I294-M297 PolarHBondContact O-N 2.97Å; I294-R298 WeakPolarHBondContact O-CB 3.47Å; I294-R298 PolarHBondContact O-N 2.96Å; I294-Y308 HydrophobicContact CG2-CE2 4.11Å; I294-L318 HydrophobicContact CD1-CD1 4Å; I294-L318 HydrophobicContact CD1-CD2 3.53Å; I294-L318 HydrophobicContact CD1-CG 4.37Å; I294-L318 HydrophobicContact CG1-CD2 4.3Å; I294-V320 HydrophobicContact CG1-CG2 4.26Å
295	L	88.7	Confident	87.2	Confident	52 Å²	52	45 Å²	45	27%	0.272	22%	0.222	S	C	.	.	H	α-helix	trans	-62.8	-45.7	-177.3	-70.9	174.1	0	0	0	111.3	I238 I291 N292 E293 R298 E299	I238-L295 HydrophobicContact CD1-CG 4.48Å; I238-L295 HydrophobicContact CG2-CD2 4.27Å; I291-L295 HydrophobicContact CG2-CD1 3.81Å; I291-L295 HydrophobicContact CG2-CG 4.44Å; I291-L295 WeakPolarHBondContact O-CB 3.29Å; I291-L295 VanDerWaalsContact O-CG 3.27Å; I291-L295 WeakPolarHBondContact O-CG 3.36Å; I291-L295 PolarHBondContact O-N 3.5Å; N292-L295 PolarHBondContact O-N 3.08Å; E293-L295 PolarHBondContact O-N 3.03Å; L295-R298 PolarHBondContact O-N 3.34Å; L295-E299 VanDerWaalsContact O-CB 3.32Å; L295-E299 WeakPolarHBondContact O-CB 3.41Å; L295-E299 VanDerWaalsContact O-CG 3.26Å; L295-E299 WeakPolarHBondContact O-CG 3.48Å; L295-E299 PolarHBondContact O-N 3.42Å
296	V	86.8	Confident	88.2	Confident	0 Å²	0	41.2 Å²	41.2	0%	0	20%	0.197	C	C	.	.	H	α-helix	trans	-60.8	-51.4	177.4	171.2	0	0	0	0	110.5	N292 E293 R298 E299 N300 V363 F386 C389	N292-V296 VanDerWaalsContact O-CB 3.29Å; N292-V296 WeakPolarHBondContact O-CB 3.45Å; N292-V296 WeakPolarHBondContact O-CG2 3.29Å; N292-V296 PolarHBondContact O-N 2.67Å; E293-V296 PolarHBondContact O-N 2.83Å; V296-R298 VanDerWaalsContact C-N 3.31Å; V296-R298 PolarHBondContact O-N 3.14Å; V296-E299 PolarHBondContact O-N 2.79Å; V296-N300 WeakPolarHBondContact O-CB 3.41Å; V296-N300 PolarHBondContact O-N 3.11Å; V296-N300 PolarHBondContact O-ND2 2.81Å; V296-V363 HydrophobicContact CG1-CG1 4.09Å; V296-F386 HydrophobicContact CG1-CB 4.19Å; V296-F386 HydrophobicContact CG1-CD1 3.48Å; V296-F386 VanDerWaalsContact CG1-CD1 3.48Å; V296-F386 HydrophobicContact CG1-CE1 4.23Å; V296-F386 HydrophobicContact CG1-CG 4.08Å; V296-C389 HydrophobicContact CG2-CB 4.48Å
297	M	87.7	Confident	89.1	Confident	5 Å²	5	41.1 Å²	41.1	3%	0.025	20%	0.2	C	C	.	.	H	α-helix	trans	-63.6	-34.4	-179.9	-67.4	-177.2	70.3	0	0	113.2	E293 I294 Y308 F386	E293-M297 HydrophobicContact CG-SD 4.28Å; E293-M297 WeakPolarHBondContact O-CG 3.44Å; E293-M297 PolarHBondContact O-N 2.76Å; I294-M297 PolarHBondContact O-N 2.97Å; M297-Y308 HydrophobicContact CB-CD2 4.42Å; M297-Y308 HydrophobicContact CB-CG 4.49Å; M297-F386 HydrophobicContact CG-CB 4.07Å; M297-F386 HydrophobicContact CG-CD2 3.54Å; M297-F386 HydrophobicContact CG-CE2 4.29Å; M297-F386 HydrophobicContact CG-CG 3.92Å; M297-F386 HydrophobicContact SD-CD2 4.12Å
298	R	90.9	Very high	89.7	Confident	129 Å²	129	40 Å²	40	49%	0.487	19%	0.194	S	C	.	.	H	α-helix	trans	-70.3	-38.7	177.9	-177.7	177.2	179.3	162.7	1.2	112.8	I238 I294 L295 V296 Y308	I238-R298 PolarHBondContact O-NH1 2.81Å; I294-R298 WeakPolarHBondContact O-CB 3.47Å; I294-R298 PolarHBondContact O-N 2.96Å; L295-R298 PolarHBondContact O-N 3.34Å; V296-R298 VanDerWaalsContact C-N 3.31Å; V296-R298 PolarHBondContact O-N 3.14Å; R298-Y308 HydrophobicContact CB-CD1 4.13Å; R298-Y308 HydrophobicContact CB-CE1 4.2Å; R298-Y308 HydrophobicContact CG-CD1 4.34Å; R298-Y308 HydrophobicContact CG-CE1 4.15Å
299	E	90.2	Very high	90.3	Very high	116 Å²	116	40.5 Å²	40.5	54%	0.542	20%	0.198	S	C	.	.	H	α-helix	trans	-85.1	-26.1	-177	-69.1	169.9	-177	0	0	113.3	L295 V296	L295-E299 VanDerWaalsContact O-CB 3.32Å; L295-E299 WeakPolarHBondContact O-CB 3.41Å; L295-E299 VanDerWaalsContact O-CG 3.26Å; L295-E299 WeakPolarHBondContact O-CG 3.48Å; L295-E299 PolarHBondContact O-N 3.42Å; V296-E299 PolarHBondContact O-N 2.79Å
300	N	89.7	Confident	91	Very high	6 Å²	6	38.9 Å²	38.9	3%	0.032	19%	0.19	C	C	.	.			trans	-108.5	56.3	-168.2	-66.4	-84.6	0	0	0	113	V296 H302 F357 L358 R361	V296-N300 WeakPolarHBondContact O-CB 3.41Å; V296-N300 PolarHBondContact O-N 3.11Å; V296-N300 PolarHBondContact O-ND2 2.81Å; N300-H302 PolarHBondContact O-N 2.71Å; N300-F357 HydrophobicContact CB-CE1 3.87Å; N300-L358 HydrophobicContact CB-CD2 4.08Å; N300-R361 WeakPolarHBondContact OD1-CD 3.5Å
301	K	93.8	Very high	91.5	Very high	120 Å²	120	38.6 Å²	38.6	52%	0.522	19%	0.189	S	C	.	.			trans	-71.5	123.5	176.1	-62	-163.3	173.9	-145.3	0	111.8	N307 Y308 F357	K301-N307 PolarHBondContact NZ-OD1 3.2Å; K301-Y308 PolarHBondContact NZ-O 3.32Å; K301-F357 WeakPolarHBondContact O-CZ 3.46Å
302	H	97.1	Very high	92	Very high	46 Å²	46	38.6 Å²	38.6	21%	0.213	19%	0.188	C	C	.	.			trans	-150.2	148.3	-179.5	-172.1	-105.3	0	0	0	110.2	N300 N304 I305 F357	N300-H302 PolarHBondContact O-N 2.71Å; H302-N304 PolarHBondContact CE1-OD1 3.12Å; H302-N304 PolarHBondContact ND1-N 2.79Å; H302-N304 PolarHBondContact O-N 3.16Å; H302-N304 VanDerWaalsContact O-N 3.16Å; H302-I305 HydrophobicContact CB-CB 4.05Å; H302-I305 HydrophobicContact CB-CD1 3.81Å; H302-I305 HydrophobicContact CB-CG1 3.93Å; H302-I305 PolarHBondContact O-N 2.98Å; H302-I305 VanDerWaalsContact O-O 3.09Å; H302-F357 HydrophobicContact CB-CD1 3.99Å; H302-F357 HydrophobicContact CB-CD2 4.17Å; H302-F357 HydrophobicContact CB-CE1 4.03Å; H302-F357 HydrophobicContact CB-CE2 4.16Å; H302-F357 HydrophobicContact CB-CG 4.07Å; H302-F357 HydrophobicContact CB-CZ 4.1Å; H302-F357 AromaticContact CD2-CD2 3.23Å; H302-F357 WeakPolarHBondContact CD2-CD2 3.46Å; H302-F357 AromaticContact CD2-CE2 3.78Å; H302-F357 AromaticContact CD2-CG 3.56Å; H302-F357 AromaticContact CG-CD2 3.89Å; H302-F357 AromaticContact CG-CG 3.83Å
303	P	97.4	Very high	92.7	Very high	94 Å²	94	38.9 Å²	38.9	61%	0.61	19%	0.189	S	C	*	.	T	Hydrogen-bonded Turn	trans	-55.3	-33.5	179.4	-28.9	37.4	0	0	0	114.6	K382	P303-K382 WeakPolarHBondContact O-CD 3.25Å; P303-K382 WeakPolarHBondContact O-CE 3.33Å
304	N	98.2	Very high	93.2	Very high	12 Å²	12	40.2 Å²	40.2	6%	0.064	20%	0.198	C	C	.	.	T	Hydrogen-bonded Turn	trans	-98.7	21	179.2	-46.5	94.4	0	0	0	113.5	H302 E350 Q353 A354 V381 K382 L383	H302-N304 PolarHBondContact CE1-OD1 3.12Å; H302-N304 PolarHBondContact ND1-N 2.79Å; H302-N304 PolarHBondContact O-N 3.16Å; H302-N304 VanDerWaalsContact O-N 3.16Å; N304-E350 WeakPolarHBondContact CB-O 3.33Å; N304-E350 WeakPolarHBondContact ND2-CB 3.31Å; N304-E350 PolarHBondContact ND2-OE2 3.07Å; N304-Q353 PolarHBondContact OD1-OE1 3.38Å; N304-A354 HydrophobicContact CB-CB 4.05Å; N304-A354 WeakPolarHBondContact O-CB 3.4Å; N304-V381 PolarHBondContact ND2-O 3.25Å; N304-K382 WeakPolarHBondContact O-CA 3.27Å; N304-L383 PolarHBondContact O-N 3.02Å
305	I	97.1	Very high	93.2	Very high	3 Å²	3	43.4 Å²	43.4	2%	0.015	23%	0.232	C	C	.	.	B	Isolated β-bridge	trans	-123.3	138.4	171.2	-68.6	176.9	0	0	0	107.7	H302 N307 A354 F357 L358 F386	H302-I305 HydrophobicContact CB-CB 4.05Å; H302-I305 HydrophobicContact CB-CD1 3.81Å; H302-I305 HydrophobicContact CB-CG1 3.93Å; H302-I305 PolarHBondContact O-N 2.98Å; H302-I305 VanDerWaalsContact O-O 3.09Å; I305-N307 PolarHBondContact O-N 2.63Å; I305-N307 VanDerWaalsContact O-N 3.14Å; I305-A354 HydrophobicContact CG1-CB 4.02Å; I305-F357 HydrophobicContact CD1-CD1 4.02Å; I305-F357 HydrophobicContact CD1-CE1 4.33Å; I305-L358 HydrophobicContact CD1-CD1 4.05Å; I305-L358 HydrophobicContact CD1-CD2 3.87Å; I305-L358 HydrophobicContact CD1-CG 3.89Å; I305-F386 HydrophobicContact CB-CZ 4.39Å; I305-F386 HydrophobicContact CD1-CE1 4.46Å; I305-F386 HydrophobicContact CD1-CZ 4.14Å; I305-F386 HydrophobicContact CG1-CZ 4.12Å; I305-F386 HydrophobicContact CG2-CE2 3.76Å; I305-F386 HydrophobicContact CG2-CZ 3.51Å
306	V	95.9	Very high	93.2	Very high	1 Å²	1	47.4 Å²	47.4	1%	0.006	25%	0.249	C	C	.	.			trans	-59.8	117.6	177.7	174.1	0	0	0	0	110.3	Y308 M322 E323 L325 L374 K382 L383	V306-Y308 PolarHBondContact O-N 3.38Å; V306-M322 HydrophobicContact CG1-CB 3.85Å; V306-M322 HydrophobicContact CG1-CG 4.01Å; V306-M322 HydrophobicContact CG1-SD 3.96Å; V306-E323 HydrophobicContact CG1-CG 4.06Å; V306-L325 HydrophobicContact CG2-CD1 3.73Å; V306-L374 HydrophobicContact CG2-CD1 4.19Å; V306-K382 HydrophobicContact CG2-CB 3.9Å; V306-L383 WeakPolarHBondContact CG2-O 3.31Å; V306-L383 PolarHBondContact N-O 3.26Å
307	N	94.7	Very high	93.4	Very high	54 Å²	54	50.4 Å²	50.4	29%	0.289	26%	0.263	S	S	.	.			trans	-68.7	112.3	-176	178.2	47.4	0	0	0	111.2	K301 I305 L309 M322 E323	K301-N307 PolarHBondContact NZ-OD1 3.2Å; I305-N307 PolarHBondContact O-N 2.63Å; I305-N307 VanDerWaalsContact O-N 3.14Å; N307-L309 WeakPolarHBondContact ND2-CD2 3.5Å; N307-L309 PolarHBondContact O-N 3.47Å; N307-M322 WeakPolarHBondContact O-CA 3.03Å; N307-E323 HydrophobicContact CB-CB 4.45Å; N307-E323 HydrophobicContact CB-CG 4.12Å; N307-E323 WeakPolarHBondContact CB-OE1 3.48Å; N307-E323 PolarHBondContact N-OE1 2.88Å; N307-E323 PolarHBondContact O-N 3.35Å
308	Y	94.4	Very high	93.7	Very high	12 Å²	12	50.1 Å²	50.1	5%	0.047	26%	0.261	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-62.8	128	165.1	170.9	-84.2	0	0	0	110.8	I294 M297 R298 K301 V306 D310 S311 V320	I294-Y308 HydrophobicContact CG2-CE2 4.11Å; M297-Y308 HydrophobicContact CB-CD2 4.42Å; M297-Y308 HydrophobicContact CB-CG 4.49Å; R298-Y308 HydrophobicContact CB-CD1 4.13Å; R298-Y308 HydrophobicContact CB-CE1 4.2Å; R298-Y308 HydrophobicContact CG-CD1 4.34Å; R298-Y308 HydrophobicContact CG-CE1 4.15Å; K301-Y308 PolarHBondContact NZ-O 3.32Å; V306-Y308 PolarHBondContact O-N 3.38Å; Y308-D310 WeakPolarHBondContact CE2-O 3.48Å; Y308-D310 VanDerWaalsContact CZ-C 3.42Å; Y308-D310 VanDerWaalsContact OH-C 3.23Å; Y308-S311 PolarHBondContact OH-N 2.88Å; Y308-S311 VanDerWaalsContact OH-N 3.12Å; Y308-S311 PolarHBondContact OH-OG 3.41Å; Y308-V320 HydrophobicContact CD2-CG1 4.01Å; Y308-V320 HydrophobicContact CE2-CG1 4.1Å
309	L	94	Very high	93.9	Very high	70 Å²	70	44.6 Å²	44.6	37%	0.366	24%	0.241	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-97.7	-56.9	175.6	-57.8	177.7	0	0	0	110.6	V274 N307 M321	V274-L309 HydrophobicContact CB-CD1 4.09Å; V274-L309 HydrophobicContact CG1-CD1 3.48Å; V274-L309 VanDerWaalsContact CG1-CD1 3.48Å; N307-L309 WeakPolarHBondContact ND2-CD2 3.5Å; N307-L309 PolarHBondContact O-N 3.47Å; L309-M321 HydrophobicContact CB-CB 4.16Å; L309-M321 WeakPolarHBondContact CB-O 3.45Å; L309-M321 PolarHBondContact N-O 2.88Å
310	D	94.5	Very high	94	Very high	22 Å²	22	39.2 Å²	39.2	12%	0.118	22%	0.216	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-162.2	171.4	-169.9	-142.5	-23.8	0	0	0	112	S240 K247 Y308 Y312 M321	S240-D310 VanDerWaalsContact CB-OD1 3.22Å; S240-D310 WeakPolarHBondContact CB-OD1 3.2Å; S240-D310 PolarHBondContact OG-OD1 3.25Å; K247-D310 IonicContact NZ-OD2 3.48Å; K247-D310 PolarHBondContact NZ-OD2 2.81Å; Y308-D310 WeakPolarHBondContact CE2-O 3.48Å; Y308-D310 VanDerWaalsContact CZ-C 3.42Å; Y308-D310 VanDerWaalsContact OH-C 3.23Å; D310-Y312 HydrophobicContact CB-CE2 3.94Å; D310-Y312 PolarHBondContact OD2-OH 3.33Å; D310-M321 HydrophobicContact CB-CB 4.16Å; D310-M321 PolarHBondContact N-O 3.19Å; D310-M321 PolarHBondContact O-N 3.07Å
311	S	95.3	Very high	94.3	Very high	0 Å²	0	39 Å²	39	0%	0	21%	0.214	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-152.3	150.4	167.9	55.5	0	0	0	0	111.8	V239 S240 Y308 W319	V239-S311 WeakPolarHBondContact CB-O 3.44Å; S240-S311 PolarHBondContact N-O 3.03Å; Y308-S311 PolarHBondContact OH-N 2.88Å; Y308-S311 VanDerWaalsContact OH-N 3.12Å; Y308-S311 PolarHBondContact OH-OG 3.41Å; S311-W319 CarbonylContact C-O 3.5Å; S311-W319 WeakPolarHBondContact CA-O 3.43Å; S311-W319 WeakPolarHBondContact CB-O 3.33Å
312	Y	95.6	Very high	94.4	Very high	19 Å²	19	33.9 Å²	33.9	8%	0.075	19%	0.192	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-140.3	144.3	-175.6	-62.9	-92.9	0	0	0	110.8	S240 G242 P244 K247 Y248 D310 W319 M321	S240-Y312 WeakPolarHBondContact O-CD1 3.23Å; G242-Y312 WeakPolarHBondContact O-CD1 2.97Å; P244-Y312 HydrophobicContact CB-CD2 3.81Å; P244-Y312 HydrophobicContact CB-CE2 4.19Å; P244-Y312 HydrophobicContact CB-CG 4Å; P244-Y312 HydrophobicContact CG-CD2 4.3Å; P244-Y312 HydrophobicContact CG-CG 4.06Å; K247-Y312 WeakPolarHBondContact CD-OH 3.06Å; K247-Y312 PolarHBondContact NZ-OH 3.17Å; Y248-Y312 HydrophobicContact CE2-CE2 4.27Å; D310-Y312 HydrophobicContact CB-CE2 3.94Å; D310-Y312 PolarHBondContact OD2-OH 3.33Å; Y312-W319 PolarHBondContact N-O 3.33Å; Y312-W319 PolarHBondContact O-N 3.38Å; Y312-M321 HydrophobicContact CD2-CE 3.68Å; Y312-M321 HydrophobicContact CD2-SD 3.68Å; Y312-M321 HydrophobicContact CE2-CE 4.14Å; Y312-M321 HydrophobicContact CE2-SD 4.08Å
313	L	94.1	Very high	94.3	Very high	41 Å²	41	33.7 Å²	33.7	22%	0.215	19%	0.192	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-98.5	111.1	171.1	-174.9	70.2	0	0	0	109.3	R236 V239 L281	R236-L313 HydrophobicContact CG-CD2 3.73Å; V239-L313 HydrophobicContact CG2-CB 4.06Å; L281-L313 HydrophobicContact CD1-CD1 3.54Å
314	V	92.7	Very high	94.2	Very high	40 Å²	40	32.4 Å²	32.4	24%	0.242	18%	0.175	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-112.4	93	-176.4	-173.4	0	0	0	0	108.6	P244 E316 E317 W319	P244-V314 HydrophobicContact CG-CG2 3.47Å; P244-V314 VanDerWaalsContact CG-CG2 3.47Å; V314-E316 PolarHBondContact O-N 3.33Å; V314-E317 PolarHBondContact N-O 3.29Å; V314-E317 PolarHBondContact O-N 3.07Å; V314-W319 HydrophobicContact CG2-CD2 4.13Å; V314-W319 HydrophobicContact CG2-CG 4.08Å
315	G	89.1	Confident	94.2	Very high	70 Å²	70	32.7 Å²	32.7	72%	0.722	18%	0.176	S	C	*	.	T	Hydrogen-bonded Turn	trans	63.6	-116.2	-172.8	0	0	0	0	0	111.4
316	E	87.6	Confident	94.1	Very high	136 Å²	136	33.8 Å²	33.8	64%	0.636	19%	0.186	S	C	*	.	T	Hydrogen-bonded Turn	trans	-96.8	4.7	174.7	-60.5	-166.9	167.9	0	0	113.6	L281 V314	L281-E316 VanDerWaalsContact CB-O 3.27Å; L281-E316 WeakPolarHBondContact CB-O 3.35Å; L281-E316 VanDerWaalsContact CG-O 3.31Å; L281-E316 WeakPolarHBondContact CG-O 3.19Å; L281-E316 PolarHBondContact N-O 2.61Å; V314-E316 PolarHBondContact O-N 3.33Å
317	E	91.7	Very high	94.1	Very high	62 Å²	62	33.9 Å²	33.9	29%	0.29	19%	0.187	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-103	137.5	178.4	-58.6	-168.9	152.2	0	0	111.7	M279 V314 W319	M279-E317 WeakPolarHBondContact O-CA 3.49Å; V314-E317 PolarHBondContact N-O 3.29Å; V314-E317 PolarHBondContact O-N 3.07Å; E317-W319 PolarHBondContact OE2-NE1 2.57Å
318	L	93	Very high	94.2	Very high	0 Å²	0	32.5 Å²	32.5	0%	0	19%	0.185	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-95.1	126.1	163.5	175.8	72.5	0	0	0	109	L235 V239 M279 L281 I290 I294 V320	L235-L318 HydrophobicContact CD2-CD2 4.37Å; V239-L318 HydrophobicContact CG1-CD1 3.63Å; M279-L318 HydrophobicContact CE-CD2 3.66Å; M279-L318 HydrophobicContact CE-CG 4.2Å; M279-L318 PolarHBondContact N-O 2.73Å; M279-L318 PolarHBondContact O-N 2.93Å; L281-L318 HydrophobicContact CD2-CB 3.93Å; L281-L318 HydrophobicContact CG-CB 4.35Å; I290-L318 HydrophobicContact CG2-CD2 3.16Å; I294-L318 HydrophobicContact CD1-CD1 4Å; I294-L318 HydrophobicContact CD1-CD2 3.53Å; I294-L318 HydrophobicContact CD1-CG 4.37Å; I294-L318 HydrophobicContact CG1-CD2 4.3Å; L318-V320 HydrophobicContact CD2-CG2 3.93Å; L318-V320 HydrophobicContact CG-CG2 4.01Å
319	W	94.9	Very high	94.3	Very high	13 Å²	13	32.6 Å²	32.6	5%	0.049	19%	0.188	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-105.6	126.3	172.1	-68.4	27.8	0	0	0	108.4	P244 Q245 L251 I276 Q278 S311 Y312 V314 E317 M321	P244-W319 HydrophobicContact CB-CE3 4Å; P244-W319 HydrophobicContact CB-CZ3 4.33Å; P244-W319 HydrophobicContact CG-CD2 4.15Å; P244-W319 HydrophobicContact CG-CE3 3.65Å; P244-W319 HydrophobicContact CG-CZ3 4.04Å; Q245-W319 HydrophobicContact CG-CH2 4.18Å; L251-W319 HydrophobicContact CD2-CH2 3.79Å; L251-W319 HydrophobicContact CD2-CZ3 3.84Å; I276-W319 HydrophobicContact CG2-CB 4.17Å; I276-W319 HydrophobicContact CG2-CD2 4.22Å; I276-W319 HydrophobicContact CG2-CE3 3.84Å; I276-W319 HydrophobicContact CG2-CG 4.38Å; Q278-W319 HydrophobicContact CG-CD2 3.92Å; Q278-W319 HydrophobicContact CG-CG 3.98Å; Q278-W319 HydrophobicContact CG-CZ2 4.4Å; Q278-W319 VanDerWaalsContact NE2-CH2 3.3Å; S311-W319 CarbonylContact C-O 3.5Å; S311-W319 WeakPolarHBondContact CA-O 3.43Å; S311-W319 WeakPolarHBondContact CB-O 3.33Å; Y312-W319 PolarHBondContact N-O 3.33Å; Y312-W319 PolarHBondContact O-N 3.38Å; V314-W319 HydrophobicContact CG2-CD2 4.13Å; V314-W319 HydrophobicContact CG2-CG 4.08Å; E317-W319 PolarHBondContact OE2-NE1 2.57Å; W319-M321 HydrophobicContact CB-CE 3.85Å; W319-M321 HydrophobicContact CB-SD 4.22Å; W319-M321 HydrophobicContact CE3-CE 3.82Å
320	V	93.7	Very high	94.4	Very high	3 Å²	3	29.3 Å²	29.3	2%	0.018	17%	0.171	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-117	123.1	176.1	179.9	0	0	0	0	109.4	I276 K277 M279 I294 Y308 L318 M322	I276-V320 WeakPolarHBondContact CA-O 3.39Å; K277-V320 HydrophobicContact CB-CB 4.45Å; K277-V320 PolarHBondContact N-O 3.21Å; K277-V320 PolarHBondContact O-N 2.9Å; M279-V320 HydrophobicContact CE-CB 4.27Å; M279-V320 HydrophobicContact CE-CG2 3.47Å; M279-V320 VanDerWaalsContact CE-CG2 3.47Å; I294-V320 HydrophobicContact CG1-CG2 4.26Å; Y308-V320 HydrophobicContact CD2-CG1 4.01Å; Y308-V320 HydrophobicContact CE2-CG1 4.1Å; L318-V320 HydrophobicContact CD2-CG2 3.93Å; L318-V320 HydrophobicContact CG-CG2 4.01Å; V320-M322 HydrophobicContact CG1-CE 4.19Å
321	M	95.3	Very high	94.5	Very high	0 Å²	0	28.7 Å²	28.7	0%	0	17%	0.168	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-99.8	130.1	-177	-70	65.8	-177.6	0	0	109.4	P244 Y248 A275 I276 L309 D310 Y312 W319	P244-M321 HydrophobicContact CB-CE 3.43Å; P244-M321 VanDerWaalsContact CB-CE 3.43Å; P244-M321 HydrophobicContact CG-CE 4.2Å; Y248-M321 HydrophobicContact CD2-CE 3.84Å; Y248-M321 HydrophobicContact CD2-CG 4.33Å; Y248-M321 HydrophobicContact CE2-CE 3.79Å; Y248-M321 HydrophobicContact CE2-CG 3.65Å; Y248-M321 HydrophobicContact CE2-SD 4.4Å; A275-M321 WeakPolarHBondContact O-CA 3.35Å; I276-M321 HydrophobicContact CD1-CE 4.17Å; I276-M321 HydrophobicContact CG1-CE 4.43Å; I276-M321 HydrophobicContact CG1-CG 4.25Å; I276-M321 HydrophobicContact CG2-CE 3.99Å; I276-M321 HydrophobicContact CG2-SD 4.45Å; L309-M321 HydrophobicContact CB-CB 4.16Å; L309-M321 WeakPolarHBondContact CB-O 3.45Å; L309-M321 PolarHBondContact N-O 2.88Å; D310-M321 HydrophobicContact CB-CB 4.16Å; D310-M321 PolarHBondContact N-O 3.19Å; D310-M321 PolarHBondContact O-N 3.07Å; Y312-M321 HydrophobicContact CD2-CE 3.68Å; Y312-M321 HydrophobicContact CD2-SD 3.68Å; Y312-M321 HydrophobicContact CE2-CE 4.14Å; Y312-M321 HydrophobicContact CE2-SD 4.08Å; W319-M321 HydrophobicContact CB-CE 3.85Å; W319-M321 HydrophobicContact CB-SD 4.22Å; W319-M321 HydrophobicContact CE3-CE 3.82Å
322	M	95.3	Very high	94.5	Very high	13 Å²	13	30.9 Å²	30.9	6%	0.064	18%	0.18	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-140.1	165.4	-179.5	66.4	-163.7	75.1	0	0	110.8	A275 K277 V306 N307 V320	A275-M322 HydrophobicContact CB-CG 3.73Å; A275-M322 HydrophobicContact CB-SD 4.48Å; A275-M322 PolarHBondContact N-O 2.89Å; A275-M322 PolarHBondContact O-N 2.62Å; K277-M322 HydrophobicContact CB-CE 3.67Å; K277-M322 HydrophobicContact CD-CE 4.26Å; V306-M322 HydrophobicContact CG1-CB 3.85Å; V306-M322 HydrophobicContact CG1-CG 4.01Å; V306-M322 HydrophobicContact CG1-SD 3.96Å; N307-M322 WeakPolarHBondContact O-CA 3.03Å; V320-M322 HydrophobicContact CG1-CE 4.19Å
323	E	95.7	Very high	94.6	Very high	43 Å²	43	30.1 Å²	30.1	20%	0.201	18%	0.177	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-56.9	141.9	170.9	66.3	178.7	129.1	0	0	111.3	V306 N307 K382	V306-E323 HydrophobicContact CG1-CG 4.06Å; N307-E323 HydrophobicContact CB-CB 4.45Å; N307-E323 HydrophobicContact CB-CG 4.12Å; N307-E323 WeakPolarHBondContact CB-OE1 3.48Å; N307-E323 PolarHBondContact N-OE1 2.88Å; N307-E323 PolarHBondContact O-N 3.35Å; E323-K382 WeakPolarHBondContact OE1-CD 3.2Å; E323-K382 IonicContact OE1-NZ 2.62Å; E323-K382 PolarHBondContact OE1-NZ 3.1Å; E323-K382 IonicContact OE2-NZ 3Å; E323-K382 PolarHBondContact OE2-NZ 3.41Å
324	Y	96.6	Very high	94.7	Very high	67 Å²	67	28.3 Å²	28.3	26%	0.263	17%	0.168	S	C	.	.			trans	-86.5	123.7	173.6	177.3	-135	0	0	0	110.7	I254 T264 E273 A275 A326	I254-Y324 HydrophobicContact CD1-CD2 4.36Å; I254-Y324 HydrophobicContact CD1-CE2 3.94Å; T264-Y324 HydrophobicContact CG2-CD1 3.98Å; T264-Y324 HydrophobicContact CG2-CD2 3.73Å; T264-Y324 HydrophobicContact CG2-CE1 3.72Å; T264-Y324 HydrophobicContact CG2-CE2 3.49Å; T264-Y324 VanDerWaalsContact CG2-CE2 3.49Å; T264-Y324 HydrophobicContact CG2-CG 3.99Å; T264-Y324 VanDerWaalsContact CG2-CZ 3.47Å; E273-Y324 HydrophobicContact CB-CD1 3.99Å; E273-Y324 VanDerWaalsContact OE2-CD1 3.31Å; E273-Y324 WeakPolarHBondContact OE2-CD1 3.33Å; E273-Y324 WeakPolarHBondContact OE2-CE1 3.37Å; A275-Y324 HydrophobicContact CB-CD2 4.47Å; Y324-A326 HydrophobicContact CD1-CB 4.13Å; Y324-A326 HydrophobicContact CE1-CB 3.58Å
325	L	96.8	Very high	94.7	Very high	17 Å²	17	27.1 Å²	27.1	9%	0.089	16%	0.161	C	C	.	.			trans	-104.1	88.7	174.9	-74	170.6	0	0	0	109.3	V306 G327 G328 L374 L375 K382	V306-L325 HydrophobicContact CG2-CD1 3.73Å; L325-G327 PolarHBondContact O-N 3.41Å; L325-G328 PolarHBondContact O-N 3.08Å; L325-L374 HydrophobicContact CB-CB 4.04Å; L325-L374 HydrophobicContact CD1-CB 3.44Å; L325-L374 VanDerWaalsContact CD1-CB 3.44Å; L325-L374 HydrophobicContact CD1-CD1 4.23Å; L325-L374 HydrophobicContact CD1-CG 4.48Å; L325-L374 HydrophobicContact CG-CB 4.41Å; L325-L375 CarbonylContact C-O 3.4Å; L325-L375 WeakPolarHBondContact CB-O 3.29Å; L325-K382 HydrophobicContact CD1-CB 3.79Å; L325-K382 HydrophobicContact CD1-CD 4.03Å; L325-K382 HydrophobicContact CD1-CG 4.04Å; L325-K382 HydrophobicContact CD2-CD 4.28Å
326	A	95.8	Very high	94.9	Very high	27 Å²	27	25.2 Å²	25.2	22%	0.223	13%	0.133	C	C	.	.	T	Hydrogen-bonded Turn	trans	-63.5	-10.6	-172.4	0	0	0	0	0	114.8	Y324 G328 M377 K516	Y324-A326 HydrophobicContact CD1-CB 4.13Å; Y324-A326 HydrophobicContact CE1-CB 3.58Å; A326-G328 VanDerWaalsContact C-N 3.29Å; A326-G328 PolarHBondContact O-N 3.12Å; A326-M377 HydrophobicContact CB-CG 3.93Å; A326-K516 WeakPolarHBondContact O-CE 3.37Å; A326-K516 PolarHBondContact O-NZ 2.75Å
327	G	96.4	Very high	95.3	Very high	3 Å²	3	19.2 Å²	19.2	3%	0.031	11%	0.106	C	C	.	.	T	Hydrogen-bonded Turn	trans	-73.5	-16	176.3	0	0	0	0	0	114.3	L325 L375	L325-G327 PolarHBondContact O-N 3.41Å; G327-L375 CarbonylContact C-O 3.58Å; G327-L375 WeakPolarHBondContact CA-O 3.38Å; G327-L375 PolarHBondContact N-O 3.28Å
328	G	95.2	Very high	95.4	Very high	24 Å²	24	19.9 Å²	19.9	25%	0.247	11%	0.109	C	C	.	.	E	Extended strand (participates in β ladder)	trans	89.5	-157.1	-179.1	0	0	0	0	0	112.9	L325 A326 L374 L375	L325-G328 PolarHBondContact O-N 3.08Å; A326-G328 VanDerWaalsContact C-N 3.29Å; A326-G328 PolarHBondContact O-N 3.12Å; G328-L374 WeakPolarHBondContact O-CA 3.38Å; G328-L375 PolarHBondContact O-N 2.69Å
329	S	96.1	Very high	95.6	Very high	15 Å²	15	20.9 Å²	20.9	11%	0.105	11%	0.114	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-88	161.8	178.2	71	0	0	0	0	111.7	T331 D332 I373	S329-T331 PolarHBondContact O-N 3.47Å; S329-T331 WeakPolarHBondContact OG-CB 3.43Å; S329-T331 PolarHBondContact OG-N 2.67Å; S329-D332 WeakPolarHBondContact CB-OD2 3.25Å; S329-D332 PolarHBondContact N-OD2 2.99Å; S329-D332 PolarHBondContact OG-N 3.34Å; S329-D332 PolarHBondContact OG-OD2 2.74Å; S329-I373 CarbonylContact C-O 3.57Å; S329-I373 WeakPolarHBondContact CA-O 3.48Å
330	L	97.9	Very high	95.7	Very high	1 Å²	1	25.2 Å²	25.2	1%	0.005	14%	0.135	C	C	.	.	H	α-helix	trans	-67.6	-26.8	166.8	-177.1	63.8	0	0	0	111	D332 V333 V334 M339 V347 I373 L375 M431 M435	L330-D332 VanDerWaalsContact C-N 3.3Å; L330-D332 PolarHBondContact O-N 2.9Å; L330-V333 HydrophobicContact CD1-CB 4.45Å; L330-V333 PolarHBondContact O-N 2.91Å; L330-V334 HydrophobicContact CD1-CG1 4.19Å; L330-V334 HydrophobicContact CG-CG1 4.05Å; L330-V334 PolarHBondContact O-N 2.95Å; L330-M339 HydrophobicContact CD1-CE 4.47Å; L330-M339 HydrophobicContact CD1-SD 4.31Å; L330-V347 HydrophobicContact CD1-CG1 4.49Å; L330-V347 HydrophobicContact CD1-CG2 4.46Å; L330-V347 HydrophobicContact CD2-CG1 3.78Å; L330-I373 HydrophobicContact CB-CB 3.87Å; L330-I373 HydrophobicContact CB-CG2 4.1Å; L330-I373 HydrophobicContact CD2-CB 4.12Å; L330-I373 HydrophobicContact CD2-CG1 4.31Å; L330-I373 HydrophobicContact CD2-CG2 4.17Å; L330-I373 PolarHBondContact N-O 2.97Å; L330-L375 HydrophobicContact CD1-CD1 4.37Å; L330-M431 HydrophobicContact CD2-CE 4.49Å; L330-M431 HydrophobicContact CD2-CG 4.41Å; L330-M431 HydrophobicContact CD2-SD 4.04Å; L330-M435 HydrophobicContact CD2-CG 4.35Å; L330-M435 HydrophobicContact CD2-SD 4.09Å
331	T	96.5	Very high	95.9	Very high	8 Å²	8	27.5 Å²	27.5	5%	0.049	15%	0.145	C	C	.	.	H	α-helix	trans	-53.5	-48.6	175.7	-43.6	0	0	0	0	110.7	S329 V333 V334 T335 S370 D371	S329-T331 PolarHBondContact O-N 3.47Å; S329-T331 WeakPolarHBondContact OG-CB 3.43Å; S329-T331 PolarHBondContact OG-N 2.67Å; T331-V333 PolarHBondContact O-N 2.89Å; T331-V334 WeakPolarHBondContact O-CG2 3.45Å; T331-V334 PolarHBondContact O-N 3.34Å; T331-V334 VanDerWaalsContact O-N 3.17Å; T331-T335 HydrophobicContact CG2-CG2 4.3Å; T331-T335 WeakPolarHBondContact O-CG2 3.41Å; T331-T335 PolarHBondContact O-N 3.38Å; T331-T335 PolarHBondContact O-OG1 3.05Å; T331-S370 VanDerWaalsContact OG1-C 3.27Å; T331-S370 WeakPolarHBondContact OG1-CB 3.48Å; T331-S370 PolarHBondContact OG1-OG 3.15Å; T331-S370 VanDerWaalsContact OG1-OG 3.11Å; T331-D371 WeakPolarHBondContact OG1-CA 3.24Å; T331-D371 PolarHBondContact OG1-N 3.02Å; T331-D371 PolarHBondContact OG1-OD1 2.99Å
332	D	95.3	Very high	96.1	Very high	47 Å²	47	27.9 Å²	27.9	25%	0.251	15%	0.149	S	C	.	.	H	α-helix	trans	-55.8	-35.8	178	-57.1	-56.3	0	0	0	112.2	S329 L330 E336 A515 I519	S329-D332 WeakPolarHBondContact CB-OD2 3.25Å; S329-D332 PolarHBondContact N-OD2 2.99Å; S329-D332 PolarHBondContact OG-N 3.34Å; S329-D332 PolarHBondContact OG-OD2 2.74Å; L330-D332 VanDerWaalsContact C-N 3.3Å; L330-D332 PolarHBondContact O-N 2.9Å; D332-E336 WeakPolarHBondContact O-CB 3.5Å; D332-E336 WeakPolarHBondContact O-CG 3.39Å; D332-A515 VanDerWaalsContact O-CB 3.25Å; D332-A515 WeakPolarHBondContact O-CB 3.32Å; D332-I519 HydrophobicContact CB-CD1 3.66Å; D332-I519 WeakPolarHBondContact OD1-CD1 3.46Å
333	V	97.3	Very high	96.2	Very high	3 Å²	3	27.9 Å²	27.9	2%	0.018	15%	0.149	C	C	.	.	H	α-helix	trans	-79.2	-41.1	178.9	174.8	0	0	0	0	112	L330 T331 C337 M339 L375 L511 I512 A515	L330-V333 HydrophobicContact CD1-CB 4.45Å; L330-V333 PolarHBondContact O-N 2.91Å; T331-V333 PolarHBondContact O-N 2.89Å; V333-C337 HydrophobicContact CG1-CB 4.5Å; V333-C337 WeakPolarHBondContact O-CB 3.48Å; V333-C337 PolarHBondContact O-N 2.93Å; V333-M339 HydrophobicContact CG1-CG 4.24Å; V333-M339 HydrophobicContact CG1-SD 4.08Å; V333-L375 HydrophobicContact CG2-CD1 3.69Å; V333-L511 HydrophobicContact CG1-CB 3.89Å; V333-L511 HydrophobicContact CG1-CD1 4.04Å; V333-I512 HydrophobicContact CG2-CG1 4.22Å; V333-A515 HydrophobicContact CG2-CB 4.2Å
334	V	95.9	Very high	96.4	Very high	3 Å²	3	26 Å²	26	2%	0.018	14%	0.14	C	C	.	.	H	α-helix	trans	-78.4	-19.7	-176.2	-58.4	0	0	0	0	113.8	R188 L330 T331 M339 E434 M435 G438	R188-V334 PolarHBondContact NH1-O 3.48Å; L330-V334 HydrophobicContact CD1-CG1 4.19Å; L330-V334 HydrophobicContact CG-CG1 4.05Å; L330-V334 PolarHBondContact O-N 2.95Å; T331-V334 WeakPolarHBondContact O-CG2 3.45Å; T331-V334 PolarHBondContact O-N 3.34Å; T331-V334 VanDerWaalsContact O-N 3.17Å; V334-M339 HydrophobicContact CG1-SD 3.92Å; V334-E434 HydrophobicContact CG2-CG 4.11Å; V334-M435 HydrophobicContact CG1-CB 4.26Å; V334-M435 HydrophobicContact CG1-CG 3.63Å; V334-G438 VanDerWaalsContact O-CA 3.27Å; V334-G438 WeakPolarHBondContact O-CA 3.24Å
335	T	93.3	Very high	96.5	Very high	15 Å²	15	22.8 Å²	22.8	9%	0.092	13%	0.127	C	C	.	.	H	α-helix	trans	-79.5	-43.6	170.6	61.5	0	0	0	0	111.4	R188 Y196 T331	R188-T335 PolarHBondContact NH1-O 2.82Å; Y196-T335 HydrophobicContact CD2-CG2 4.04Å; T331-T335 HydrophobicContact CG2-CG2 4.3Å; T331-T335 WeakPolarHBondContact O-CG2 3.41Å; T331-T335 PolarHBondContact O-N 3.38Å; T331-T335 PolarHBondContact O-OG1 3.05Å
336	E	93.5	Very high	96.6	Very high	29 Å²	29	22 Å²	22	14%	0.136	12%	0.123	C	C	.	.	H	α-helix	trans	-90.5	-27.8	-169.4	-57.4	-47.8	113.1	0	0	115.1	T197 D332 A515 S518 I519 Q522	T197-E336 WeakPolarHBondContact CG2-OE1 3.42Å; D332-E336 WeakPolarHBondContact O-CB 3.5Å; D332-E336 WeakPolarHBondContact O-CG 3.39Å; E336-A515 HydrophobicContact CB-CB 4.05Å; E336-A515 HydrophobicContact CG-CB 4.31Å; E336-S518 VanDerWaalsContact OE2-CB 3.29Å; E336-S518 WeakPolarHBondContact OE2-CB 3.36Å; E336-S518 PolarHBondContact OE2-OG 3.01Å; E336-I519 HydrophobicContact CG-CD1 3.94Å; E336-I519 HydrophobicContact CG-CG1 3.83Å; E336-Q522 PolarHBondContact OE2-NE2 3.2Å
337	C	94.7	Very high	96.7	Very high	11 Å²	11	20.7 Å²	20.7	7%	0.074	11%	0.113	C	C	.	.			trans	-125	157	-171.3	-64.6	0	0	0	0	112.3	V333 L511	V333-C337 HydrophobicContact CG1-CB 4.5Å; V333-C337 WeakPolarHBondContact O-CB 3.48Å; V333-C337 PolarHBondContact O-N 2.93Å; C337-L511 HydrophobicContact CB-CD2 4.07Å
338	Q	94.4	Very high	96.8	Very high	75 Å²	75	20.5 Å²	20.5	35%	0.35	11%	0.111	S	C	.	.	P	Polyproline II helix	trans	-89.1	135.7	163.1	-58.3	-156.3	-73.6	0	0	109.6	R188 P189	R188-Q338 HydrophobicContact CB-CG 4.29Å; R188-Q338 HydrophobicContact CG-CG 4.18Å; P189-Q338 VanDerWaalsContact CD-CD 3.43Å
339	M	97.4	Very high	97	Very high	21 Å²	21	22.3 Å²	22.3	10%	0.103	11%	0.11	C	C	.	.	P	Polyproline II helix	trans	-102.7	133.6	176.4	-60.8	-173.8	67.4	0	0	110.4	L330 V333 V334 Q343 I344 V347 M435 L508 L511	L330-M339 HydrophobicContact CD1-CE 4.47Å; L330-M339 HydrophobicContact CD1-SD 4.31Å; V333-M339 HydrophobicContact CG1-CG 4.24Å; V333-M339 HydrophobicContact CG1-SD 4.08Å; V334-M339 HydrophobicContact CG1-SD 3.92Å; M339-Q343 HydrophobicContact CE-CB 4.07Å; M339-I344 HydrophobicContact CB-CD1 4.07Å; M339-I344 HydrophobicContact CB-CG1 3.64Å; M339-I344 HydrophobicContact CE-CG1 4.4Å; M339-V347 HydrophobicContact CE-CG2 4.04Å; M339-M435 HydrophobicContact CE-SD 4.04Å; M339-M435 HydrophobicContact SD-CB 4.08Å; M339-M435 HydrophobicContact SD-CG 3.77Å; M339-M435 HydrophobicContact SD-SD 3.99Å; M339-L508 HydrophobicContact CE-CD2 4.11Å; M339-L511 HydrophobicContact CE-CD1 4.35Å; M339-L511 HydrophobicContact CG-CD1 3.98Å
340	E	97	Very high	97.1	Very high	105 Å²	105	22.4 Å²	22.4	49%	0.491	11%	0.109	S	C	.	.	P	Polyproline II helix	trans	-72.7	152	169.2	-66.8	-179.6	-134.4	0	0	111.2	G342 Q343 I344 K503	E340-G342 PolarHBondContact O-N 2.86Å; E340-Q343 WeakPolarHBondContact O-CA 3.29Å; E340-Q343 WeakPolarHBondContact O-CB 3.32Å; E340-Q343 PolarHBondContact O-N 3.49Å; E340-I344 WeakPolarHBondContact O-CG1 3.03Å; E340-I344 PolarHBondContact O-N 3.21Å; E340-K503 IonicContact OE1-NZ 2.76Å; E340-K503 PolarHBondContact OE1-NZ 3.33Å; E340-K503 WeakPolarHBondContact OE2-CE 3.2Å; E340-K503 IonicContact OE2-NZ 2.73Å; E340-K503 PolarHBondContact OE2-NZ 2.92Å
341	E	98.3	Very high	97.2	Very high	50 Å²	50	22.5 Å²	22.5	23%	0.234	11%	0.11	C	C	.	.	H	α-helix	trans	-50.6	-36.1	177.1	-71.7	-160.8	-175.3	0	0	113.7	I344 A345 L468 S469 F472 F498	E341-I344 PolarHBondContact O-N 3.26Å; E341-A345 WeakPolarHBondContact O-CB 3.42Å; E341-A345 PolarHBondContact O-N 2.93Å; E341-L468 WeakPolarHBondContact OE1-CA 3.36Å; E341-S469 PolarHBondContact OE1-N 2.99Å; E341-S469 PolarHBondContact OE1-OG 2.92Å; E341-S469 WeakPolarHBondContact OE2-CB 3.35Å; E341-S469 PolarHBondContact OE2-OG 3.04Å; E341-F472 HydrophobicContact CG-CD1 3.72Å; E341-F472 HydrophobicContact CG-CE1 4.31Å; E341-F498 HydrophobicContact CB-CE2 4.19Å
342	G	98.4	Very high	97.3	Very high	8 Å²	8	22.1 Å²	22.1	8%	0.082	11%	0.107	C	C	.	.	H	α-helix	trans	-69.7	-29.3	177	0	0	0	0	0	114.2	E340 A346 C501 A502 K503	E340-G342 PolarHBondContact O-N 2.86Å; G342-A346 PolarHBondContact O-N 2.84Å; G342-C501 WeakPolarHBondContact CA-O 3.45Å; G342-A502 CarbonylContact O-C 3.47Å; G342-A502 WeakPolarHBondContact O-CA 3.06Å; G342-K503 PolarHBondContact O-N 3.19Å
343	Q	98.5	Very high	97.4	Very high	14 Å²	14	22.9 Å²	22.9	7%	0.065	11%	0.109	C	C	.	.	H	α-helix	trans	-75.8	-42.3	172.3	-71.8	160.4	-37.4	0	0	110.3	M339 E340 A345 A346 V347 K503 S507 L508 L511	M339-Q343 HydrophobicContact CE-CB 4.07Å; E340-Q343 WeakPolarHBondContact O-CA 3.29Å; E340-Q343 WeakPolarHBondContact O-CB 3.32Å; E340-Q343 PolarHBondContact O-N 3.49Å; Q343-A345 PolarHBondContact O-N 3.43Å; Q343-A346 WeakPolarHBondContact O-CB 3.44Å; Q343-A346 PolarHBondContact O-N 3.43Å; Q343-A346 VanDerWaalsContact O-N 3.17Å; Q343-V347 PolarHBondContact O-N 3.4Å; Q343-K503 HydrophobicContact CG-CD 4.36Å; Q343-S507 PolarHBondContact NE2-O 2.97Å; Q343-L508 HydrophobicContact CB-CD2 3.81Å; Q343-L508 HydrophobicContact CG-CD2 4.02Å; Q343-L511 HydrophobicContact CG-CD1 4.43Å
344	I	98.7	Very high	97.5	Very high	2 Å²	2	22.7 Å²	22.7	1%	0.01	11%	0.108	C	C	.	.	H	α-helix	trans	-59.8	-46.9	174.8	-59	179.2	0	0	0	110.7	M339 E340 E341 A346 V347 C348 M435 V436 F472 F498	M339-I344 HydrophobicContact CB-CD1 4.07Å; M339-I344 HydrophobicContact CB-CG1 3.64Å; M339-I344 HydrophobicContact CE-CG1 4.4Å; E340-I344 WeakPolarHBondContact O-CG1 3.03Å; E340-I344 PolarHBondContact O-N 3.21Å; E341-I344 PolarHBondContact O-N 3.26Å; I344-A346 VanDerWaalsContact C-N 3.26Å; I344-A346 PolarHBondContact O-N 3.25Å; I344-V347 PolarHBondContact O-N 2.63Å; I344-C348 WeakPolarHBondContact O-CB 3.31Å; I344-C348 PolarHBondContact O-N 3Å; I344-C348 PolarHBondContact O-SG 3.38Å; I344-M435 HydrophobicContact CB-SD 4.41Å; I344-M435 HydrophobicContact CD1-CB 3.99Å; I344-M435 HydrophobicContact CG1-CB 3.96Å; I344-M435 HydrophobicContact CG1-SD 4.39Å; I344-M435 HydrophobicContact CG2-CB 4.19Å; I344-M435 HydrophobicContact CG2-CE 3.87Å; I344-M435 HydrophobicContact CG2-SD 4Å; I344-V436 HydrophobicContact CD1-CG2 3.91Å; I344-F472 HydrophobicContact CD1-CE1 3.97Å; I344-F472 HydrophobicContact CD1-CZ 4.13Å; I344-F472 HydrophobicContact CG2-CE1 4.36Å; I344-F472 HydrophobicContact CG2-CE2 4.07Å; I344-F472 HydrophobicContact CG2-CZ 3.66Å; I344-F498 HydrophobicContact CB-CZ 4.33Å; I344-F498 HydrophobicContact CG2-CE1 4.48Å; I344-F498 HydrophobicContact CG2-CZ 4.09Å
345	A	98.8	Very high	97.6	Very high	0 Å²	0	22.6 Å²	22.6	0%	0	11%	0.108	C	C	.	.	H	α-helix	trans	-61.1	-33.7	176.6	0	0	0	0	0	112.5	E341 Q343 R349 F498 A502	E341-A345 WeakPolarHBondContact O-CB 3.42Å; E341-A345 PolarHBondContact O-N 2.93Å; Q343-A345 PolarHBondContact O-N 3.43Å; A345-R349 WeakPolarHBondContact O-CB 3.41Å; A345-R349 PolarHBondContact O-N 2.76Å; A345-F498 HydrophobicContact CB-CD1 4.17Å; A345-F498 HydrophobicContact CB-CD2 4.39Å; A345-F498 HydrophobicContact CB-CE1 3.72Å; A345-F498 HydrophobicContact CB-CE2 3.95Å; A345-F498 HydrophobicContact CB-CG 4.49Å; A345-F498 HydrophobicContact CB-CZ 3.6Å; A345-A502 HydrophobicContact CB-CB 3.8Å
346	A	98.7	Very high	97.8	Very high	0 Å²	0	24.5 Å²	24.5	0%	0	12%	0.116	C	C	.	.	H	α-helix	trans	-66.3	-52.1	173.7	0	0	0	0	0	111.3	G342 Q343 I344 C348 R349 E350 A502 K503 L505	G342-A346 PolarHBondContact O-N 2.84Å; Q343-A346 WeakPolarHBondContact O-CB 3.44Å; Q343-A346 PolarHBondContact O-N 3.43Å; Q343-A346 VanDerWaalsContact O-N 3.17Å; I344-A346 VanDerWaalsContact C-N 3.26Å; I344-A346 PolarHBondContact O-N 3.25Å; A346-C348 PolarHBondContact O-N 3.3Å; A346-R349 WeakPolarHBondContact O-CB 3.34Å; A346-R349 PolarHBondContact O-N 3.18Å; A346-R349 VanDerWaalsContact O-N 3.16Å; A346-E350 WeakPolarHBondContact O-CG 3.27Å; A346-E350 PolarHBondContact O-N 3.45Å; A346-E350 VanDerWaalsContact O-N 3.15Å; A346-A502 HydrophobicContact CB-CB 4.25Å; A346-K503 WeakPolarHBondContact CB-O 3.49Å; A346-L505 HydrophobicContact CB-CD2 4.05Å
347	V	98.8	Very high	98	Very high	0 Å²	0	24.7 Å²	24.7	0%	0	12%	0.116	C	C	.	.	H	α-helix	trans	-57.2	-48.1	176.3	174.8	0	0	0	0	111.5	L330 M339 Q343 I344 R349 E350 V351 V381 M435 L508	L330-V347 HydrophobicContact CD1-CG1 4.49Å; L330-V347 HydrophobicContact CD1-CG2 4.46Å; L330-V347 HydrophobicContact CD2-CG1 3.78Å; M339-V347 HydrophobicContact CE-CG2 4.04Å; Q343-V347 PolarHBondContact O-N 3.4Å; I344-V347 PolarHBondContact O-N 2.63Å; V347-R349 VanDerWaalsContact C-N 3.3Å; V347-R349 PolarHBondContact O-N 3.29Å; V347-E350 PolarHBondContact O-N 3.23Å; V347-V351 HydrophobicContact CG1-CG2 4.41Å; V347-V351 WeakPolarHBondContact O-CG2 3.22Å; V347-V351 PolarHBondContact O-N 3.03Å; V347-V381 HydrophobicContact CG1-CG1 4.21Å; V347-V381 HydrophobicContact CG2-CG2 4.18Å; V347-M435 HydrophobicContact CB-CE 4.41Å; V347-M435 HydrophobicContact CB-SD 3.94Å; V347-M435 HydrophobicContact CG1-CE 4.06Å; V347-M435 HydrophobicContact CG1-SD 3.83Å; V347-M435 HydrophobicContact CG2-SD 4.4Å; V347-L508 HydrophobicContact CG2-CD1 3.94Å; V347-L508 HydrophobicContact CG2-CD2 4.31Å
348	C	98.8	Very high	98.1	Very high	0 Å²	0	24.1 Å²	24.1	0%	0	11%	0.112	C	C	.	.	H	α-helix	trans	-57.4	-40.2	177	-77.5	0	0	0	0	112.7	I344 A346 L352 F475 L499	I344-C348 WeakPolarHBondContact O-CB 3.31Å; I344-C348 PolarHBondContact O-N 3Å; I344-C348 PolarHBondContact O-SG 3.38Å; A346-C348 PolarHBondContact O-N 3.3Å; C348-L352 VanDerWaalsContact O-CB 3.23Å; C348-L352 WeakPolarHBondContact O-CB 3.47Å; C348-L352 WeakPolarHBondContact O-CD1 3.37Å; C348-L352 WeakPolarHBondContact O-CG 3.44Å; C348-L352 PolarHBondContact O-N 3.15Å; C348-F475 HydrophobicContact CB-CE1 4.17Å; C348-F475 HydrophobicContact CB-CZ 3.95Å; C348-L499 HydrophobicContact CB-CD2 4.01Å
349	R	98.8	Very high	98.2	Very high	61 Å²	61	21.7 Å²	21.7	23%	0.23	10%	0.101	C	C	.	.	H	α-helix	trans	-63.3	-49.7	177.5	-179	-174.7	65.3	-138.5	-12.2	111.8	A345 A346 V347 V351 L352 Q353 L499	A345-R349 WeakPolarHBondContact O-CB 3.41Å; A345-R349 PolarHBondContact O-N 2.76Å; A346-R349 WeakPolarHBondContact O-CB 3.34Å; A346-R349 PolarHBondContact O-N 3.18Å; A346-R349 VanDerWaalsContact O-N 3.16Å; V347-R349 VanDerWaalsContact C-N 3.3Å; V347-R349 PolarHBondContact O-N 3.29Å; R349-V351 PolarHBondContact O-N 3.45Å; R349-L352 PolarHBondContact O-N 3.21Å; R349-Q353 WeakPolarHBondContact O-CG 3.4Å; R349-Q353 PolarHBondContact O-N 2.75Å; R349-L499 HydrophobicContact CB-CD1 4.39Å; R349-L499 HydrophobicContact CB-CD2 4.35Å
350	E	98.7	Very high	98.1	Very high	18 Å²	18	26.2 Å²	26.2	8%	0.084	13%	0.125	C	C	.	.	H	α-helix	trans	-63.7	-40.9	-178.7	-57.7	-43.9	116.7	0	0	111.8	N304 A346 V347 Q353 A354 V381 L505	N304-E350 WeakPolarHBondContact CB-O 3.33Å; N304-E350 WeakPolarHBondContact ND2-CB 3.31Å; N304-E350 PolarHBondContact ND2-OE2 3.07Å; A346-E350 WeakPolarHBondContact O-CG 3.27Å; A346-E350 PolarHBondContact O-N 3.45Å; A346-E350 VanDerWaalsContact O-N 3.15Å; V347-E350 PolarHBondContact O-N 3.23Å; E350-Q353 PolarHBondContact O-N 3.16Å; E350-Q353 PolarHBondContact OE2-OE1 3.4Å; E350-A354 PolarHBondContact O-N 2.96Å; E350-A354 VanDerWaalsContact O-N 3.17Å; E350-V381 HydrophobicContact CB-CB 3.71Å; E350-V381 HydrophobicContact CB-CG1 4.01Å; E350-V381 HydrophobicContact CB-CG2 4.4Å; E350-V381 HydrophobicContact CG-CB 3.91Å; E350-V381 HydrophobicContact CG-CG2 4.15Å; E350-L505 HydrophobicContact CG-CD1 4.1Å; E350-L505 HydrophobicContact CG-CD2 3.81Å
351	V	98.8	Very high	97.9	Very high	2 Å²	2	27.5 Å²	27.5	1%	0.012	13%	0.126	C	C	.	.	H	α-helix	trans	-67.4	-39	175.7	176.1	0	0	0	0	111.3	V347 R349 Q353 A354 L355 I373 V381 L428 M431	V347-V351 HydrophobicContact CG1-CG2 4.41Å; V347-V351 WeakPolarHBondContact O-CG2 3.22Å; V347-V351 PolarHBondContact O-N 3.03Å; R349-V351 PolarHBondContact O-N 3.45Å; V351-Q353 VanDerWaalsContact C-N 3.32Å; V351-Q353 PolarHBondContact O-N 2.85Å; V351-A354 PolarHBondContact O-N 2.86Å; V351-L355 HydrophobicContact CG1-CD1 4.2Å; V351-L355 HydrophobicContact CG1-CG 4.38Å; V351-L355 WeakPolarHBondContact O-CG 3.48Å; V351-L355 PolarHBondContact O-N 3.37Å; V351-I373 HydrophobicContact CG1-CD1 4.28Å; V351-I373 HydrophobicContact CG2-CD1 3.59Å; V351-I373 HydrophobicContact CG2-CG1 4.13Å; V351-I373 HydrophobicContact CG2-CG2 4.41Å; V351-V381 HydrophobicContact CG2-CG1 4.1Å; V351-L428 HydrophobicContact CB-CD1 4.43Å; V351-L428 HydrophobicContact CG1-CD1 4.1Å; V351-M431 HydrophobicContact CG1-CE 4.32Å; V351-M431 HydrophobicContact CG2-CE 4.2Å
352	L	98.8	Very high	97.6	Very high	0 Å²	0	25.7 Å²	25.7	0%	0	12%	0.12	C	C	.	.	H	α-helix	trans	-64.4	-33.9	174.7	-80.3	168	0	0	0	113.2	C348 R349 L355 E356 L428 F475 L493 L494 L499	C348-L352 VanDerWaalsContact O-CB 3.23Å; C348-L352 WeakPolarHBondContact O-CB 3.47Å; C348-L352 WeakPolarHBondContact O-CD1 3.37Å; C348-L352 WeakPolarHBondContact O-CG 3.44Å; C348-L352 PolarHBondContact O-N 3.15Å; R349-L352 PolarHBondContact O-N 3.21Å; L352-L355 PolarHBondContact O-N 3Å; L352-E356 WeakPolarHBondContact O-CB 3.23Å; L352-E356 PolarHBondContact O-N 3.03Å; L352-L428 HydrophobicContact CD1-CD2 4.19Å; L352-L428 HydrophobicContact CD2-CD2 3.44Å; L352-L428 VanDerWaalsContact CD2-CD2 3.44Å; L352-L428 HydrophobicContact CG-CD2 3.56Å; L352-F475 HydrophobicContact CD1-CE2 3.93Å; L352-F475 HydrophobicContact CD1-CZ 3.91Å; L352-L493 HydrophobicContact CD1-CB 3.73Å; L352-L493 HydrophobicContact CD2-CB 3.73Å; L352-L493 HydrophobicContact CD2-CD1 4.04Å; L352-L493 HydrophobicContact CG-CB 4.42Å; L352-L494 HydrophobicContact CB-CD2 3.5Å; L352-L494 HydrophobicContact CB-CG 3.85Å; L352-L499 HydrophobicContact CD1-CD1 3.78Å
353	Q	98.7	Very high	97.3	Very high	63 Å²	63	25.4 Å²	25.4	29%	0.294	12%	0.117	S	C	.	.	H	α-helix	trans	-65.8	-43.9	173.6	-70.4	168.6	-8.5	0	0	111.1	N304 R349 E350 V351 E356 F357 L494	N304-Q353 PolarHBondContact OD1-OE1 3.38Å; R349-Q353 WeakPolarHBondContact O-CG 3.4Å; R349-Q353 PolarHBondContact O-N 2.75Å; E350-Q353 PolarHBondContact O-N 3.16Å; E350-Q353 PolarHBondContact OE2-OE1 3.4Å; V351-Q353 VanDerWaalsContact C-N 3.32Å; V351-Q353 PolarHBondContact O-N 2.85Å; Q353-E356 PolarHBondContact O-N 3.34Å; Q353-F357 WeakPolarHBondContact O-CB 3.46Å; Q353-F357 PolarHBondContact O-N 2.91Å; Q353-L494 HydrophobicContact CG-CD2 3.83Å
354	A	98.2	Very high	97.1	Very high	0 Å²	0	24.7 Å²	24.7	0%	0	11%	0.114	C	C	.	.	H	α-helix	trans	-60.2	-45.1	172.3	0	0	0	0	0	112.2	N304 I305 E350 V351 F357 L358 L383	N304-A354 HydrophobicContact CB-CB 4.05Å; N304-A354 WeakPolarHBondContact O-CB 3.4Å; I305-A354 HydrophobicContact CG1-CB 4.02Å; E350-A354 PolarHBondContact O-N 2.96Å; E350-A354 VanDerWaalsContact O-N 3.17Å; V351-A354 PolarHBondContact O-N 2.86Å; A354-F357 PolarHBondContact O-N 3.19Å; A354-L358 VanDerWaalsContact O-CG 3.28Å; A354-L358 WeakPolarHBondContact O-CG 3.29Å; A354-L358 PolarHBondContact O-N 3.31Å; A354-L383 HydrophobicContact CB-CB 4.27Å; A354-L383 HydrophobicContact CB-CD2 4.23Å
355	L	98.4	Very high	96.9	Very high	0 Å²	0	24.6 Å²	24.6	0%	0	11%	0.113	C	C	.	.	H	α-helix	trans	-66	-42.2	178.7	-71.3	179.8	0	0	0	112.6	V351 L352 F357 L358 H359 I368 D424	V351-L355 HydrophobicContact CG1-CD1 4.2Å; V351-L355 HydrophobicContact CG1-CG 4.38Å; V351-L355 WeakPolarHBondContact O-CG 3.48Å; V351-L355 PolarHBondContact O-N 3.37Å; L352-L355 PolarHBondContact O-N 3Å; L355-F357 VanDerWaalsContact C-N 3.34Å; L355-F357 PolarHBondContact O-N 3.06Å; L355-L358 PolarHBondContact O-N 3.1Å; L355-H359 WeakPolarHBondContact O-CB 3.32Å; L355-H359 PolarHBondContact O-CD2 2.95Å; L355-H359 PolarHBondContact O-N 2.87Å; L355-I368 HydrophobicContact CD2-CD1 3.85Å; L355-I368 HydrophobicContact CD2-CG1 4.12Å; L355-D424 HydrophobicContact CD1-CB 4.09Å; L355-D424 HydrophobicContact CD2-CB 3.7Å
356	E	98.3	Very high	96.7	Very high	56 Å²	56	25.9 Å²	25.9	26%	0.262	12%	0.118	S	C	.	.	H	α-helix	trans	-58.5	-46.6	173.2	174.8	170.9	-111.8	0	0	111.1	L352 Q353 L358 H359 N360 S491 L494	L352-E356 WeakPolarHBondContact O-CB 3.23Å; L352-E356 PolarHBondContact O-N 3.03Å; Q353-E356 PolarHBondContact O-N 3.34Å; E356-L358 VanDerWaalsContact C-N 3.32Å; E356-L358 PolarHBondContact O-N 2.88Å; E356-H359 PolarHBondContact O-N 2.68Å; E356-N360 WeakPolarHBondContact CG-ND2 3.4Å; E356-N360 VanDerWaalsContact O-CB 3.29Å; E356-N360 WeakPolarHBondContact O-CB 3.45Å; E356-N360 PolarHBondContact O-N 2.79Å; E356-N360 PolarHBondContact O-ND2 2.91Å; E356-N360 VanDerWaalsContact O-ND2 3.15Å; E356-S491 VanDerWaalsContact OE1-CA 3.22Å; E356-S491 WeakPolarHBondContact OE1-CA 3.44Å; E356-S491 WeakPolarHBondContact OE1-CB 3.48Å; E356-S491 PolarHBondContact OE1-OG 2.94Å; E356-L494 HydrophobicContact CB-CD1 3.89Å; E356-L494 HydrophobicContact CG-CD1 4.33Å; E356-L494 VanDerWaalsContact OE2-CD1 3.26Å; E356-L494 WeakPolarHBondContact OE2-CD1 3.5Å
357	F	97.7	Very high	96.4	Very high	32 Å²	32	26.2 Å²	26.2	14%	0.14	12%	0.12	C	C	.	.	H	α-helix	trans	-58.9	-41.2	178.7	176.4	-84.5	0	0	0	113	N300 K301 H302 I305 Q353 A354 L355 R361	N300-F357 HydrophobicContact CB-CE1 3.87Å; K301-F357 WeakPolarHBondContact O-CZ 3.46Å; H302-F357 HydrophobicContact CB-CD1 3.99Å; H302-F357 HydrophobicContact CB-CD2 4.17Å; H302-F357 HydrophobicContact CB-CE1 4.03Å; H302-F357 HydrophobicContact CB-CE2 4.16Å; H302-F357 HydrophobicContact CB-CG 4.07Å; H302-F357 HydrophobicContact CB-CZ 4.1Å; H302-F357 AromaticContact CD2-CD2 3.23Å; H302-F357 WeakPolarHBondContact CD2-CD2 3.46Å; H302-F357 AromaticContact CD2-CE2 3.78Å; H302-F357 AromaticContact CD2-CG 3.56Å; H302-F357 AromaticContact CG-CD2 3.89Å; H302-F357 AromaticContact CG-CG 3.83Å; I305-F357 HydrophobicContact CD1-CD1 4.02Å; I305-F357 HydrophobicContact CD1-CE1 4.33Å; Q353-F357 WeakPolarHBondContact O-CB 3.46Å; Q353-F357 PolarHBondContact O-N 2.91Å; A354-F357 PolarHBondContact O-N 3.19Å; L355-F357 VanDerWaalsContact C-N 3.34Å; L355-F357 PolarHBondContact O-N 3.06Å; F357-R361 VanDerWaalsContact CE2-NH2 3.28Å; F357-R361 PolarHBondContact O-NH1 3.18Å
358	L	96.4	Very high	96.4	Very high	0 Å²	0	26.2 Å²	26.2	0%	0	12%	0.12	C	C	.	.	H	α-helix	trans	-74.2	-47.6	178.6	-70.1	168	0	0	0	111.9	N300 I305 A354 L355 E356 N360 R361 G362 V363 L383 F386	N300-L358 HydrophobicContact CB-CD2 4.08Å; I305-L358 HydrophobicContact CD1-CD1 4.05Å; I305-L358 HydrophobicContact CD1-CD2 3.87Å; I305-L358 HydrophobicContact CD1-CG 3.89Å; A354-L358 VanDerWaalsContact O-CG 3.28Å; A354-L358 WeakPolarHBondContact O-CG 3.29Å; A354-L358 PolarHBondContact O-N 3.31Å; L355-L358 PolarHBondContact O-N 3.1Å; E356-L358 VanDerWaalsContact C-N 3.32Å; E356-L358 PolarHBondContact O-N 2.88Å; L358-N360 VanDerWaalsContact C-N 3.3Å; L358-N360 PolarHBondContact O-N 2.97Å; L358-R361 CarbonylContact O-C 3.59Å; L358-R361 WeakPolarHBondContact O-CA 3.38Å; L358-R361 PolarHBondContact O-N 2.89Å; L358-G362 PolarHBondContact O-N 3.05Å; L358-V363 CarbonylContact C-O 3.55Å; L358-V363 HydrophobicContact CB-CB 4.09Å; L358-V363 HydrophobicContact CD2-CB 3.99Å; L358-V363 HydrophobicContact CD2-CG1 3.96Å; L358-V363 HydrophobicContact CD2-CG2 4.49Å; L358-V363 PolarHBondContact O-N 3Å; L358-L383 HydrophobicContact CD1-CD2 3.77Å; L358-F386 HydrophobicContact CD1-CE1 3.82Å; L358-F386 HydrophobicContact CD1-CZ 4.44Å; L358-F386 HydrophobicContact CD2-CE1 3.95Å
359	H	96	Very high	96.3	Very high	24 Å²	24	27.2 Å²	27.2	11%	0.111	12%	0.124	C	C	.	.	H	α-helix	trans	-61.9	-38.4	-178	-66.9	-177.1	0	0	0	111.4	L355 E356 R361 G362 V363 P421 D424 S490	L355-H359 WeakPolarHBondContact O-CB 3.32Å; L355-H359 PolarHBondContact O-CD2 2.95Å; L355-H359 PolarHBondContact O-N 2.87Å; E356-H359 PolarHBondContact O-N 2.68Å; H359-R361 PolarHBondContact O-N 3.19Å; H359-G362 PolarHBondContact O-N 3.38Å; H359-V363 PolarHBondContact CD2-O 2.54Å; H359-P421 HydrophobicContact CB-CB 4.11Å; H359-P421 PolarHBondContact CE1-O 3.05Å; H359-P421 PolarHBondContact NE2-O 2.92Å; H359-D424 IonicContact CD2-OD2 2.72Å; H359-D424 VanDerWaalsContact CE1-CB 3.45Å; H359-D424 WeakPolarHBondContact CE1-CB 3.46Å; H359-D424 WeakPolarHBondContact NE2-CB 3.37Å; H359-D424 IonicContact NE2-OD1 3.46Å; H359-D424 IonicContact NE2-OD2 3.78Å; H359-D424 PolarHBondContact NE2-OD2 2.91Å; H359-S490 PolarHBondContact ND1-OG 3.32Å; H359-S490 VanDerWaalsContact ND1-OG 3.13Å
360	N	95.1	Very high	96.2	Very high	115 Å²	115	24.4 Å²	24.4	62%	0.615	11%	0.114	S	C	*	.	T	Hydrogen-bonded Turn	trans	-66	-17.4	174.8	-73.2	-24.7	0	0	0	113.9	E356 L358	E356-N360 WeakPolarHBondContact CG-ND2 3.4Å; E356-N360 VanDerWaalsContact O-CB 3.29Å; E356-N360 WeakPolarHBondContact O-CB 3.45Å; E356-N360 PolarHBondContact O-N 2.79Å; E356-N360 PolarHBondContact O-ND2 2.91Å; E356-N360 VanDerWaalsContact O-ND2 3.15Å; L358-N360 VanDerWaalsContact C-N 3.3Å; L358-N360 PolarHBondContact O-N 2.97Å
361	R	93.4	Very high	95.9	Very high	132 Å²	132	25.9 Å²	25.9	50%	0.498	12%	0.122	S	C	.	.	T	Hydrogen-bonded Turn	trans	-99.6	6.6	171.6	-70.8	175	178	72.9	-0.2	113.1	N300 F357 L358 H359 V363	N300-R361 WeakPolarHBondContact OD1-CD 3.5Å; F357-R361 VanDerWaalsContact CE2-NH2 3.28Å; F357-R361 PolarHBondContact O-NH1 3.18Å; L358-R361 CarbonylContact O-C 3.59Å; L358-R361 WeakPolarHBondContact O-CA 3.38Å; L358-R361 PolarHBondContact O-N 2.89Å; H359-R361 PolarHBondContact O-N 3.19Å; R361-V363 VanDerWaalsContact C-N 3.27Å; R361-V363 HydrophobicContact CB-CG2 4.3Å; R361-V363 PolarHBondContact O-N 3.26Å
362	G	91.8	Very high	95.8	Very high	12 Å²	12	26.2 Å²	26.2	12%	0.124	12%	0.124	C	C	.	.	T	Hydrogen-bonded Turn	trans	67.7	24.3	-174.3	0	0	0	0	0	113.4	L358 H359 Q391 I392	L358-G362 PolarHBondContact O-N 3.05Å; H359-G362 PolarHBondContact O-N 3.38Å; G362-Q391 CarbonylContact O-C 3.51Å; G362-Q391 VanDerWaalsContact O-CA 3.32Å; G362-Q391 WeakPolarHBondContact O-CA 3.32Å; G362-I392 WeakPolarHBondContact O-CG1 3.22Å; G362-I392 PolarHBondContact O-N 2.86Å
363	V	93.1	Very high	95.7	Very high	2 Å²	2	26.2 Å²	26.2	1%	0.012	12%	0.124	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-95.4	124.7	172.5	-174.4	0	0	0	0	109	V296 L358 H359 R361 C389 Q391	V296-V363 HydrophobicContact CG1-CG1 4.09Å; L358-V363 CarbonylContact C-O 3.55Å; L358-V363 HydrophobicContact CB-CB 4.09Å; L358-V363 HydrophobicContact CD2-CB 3.99Å; L358-V363 HydrophobicContact CD2-CG1 3.96Å; L358-V363 HydrophobicContact CD2-CG2 4.49Å; L358-V363 PolarHBondContact O-N 3Å; H359-V363 PolarHBondContact CD2-O 2.54Å; R361-V363 VanDerWaalsContact C-N 3.27Å; R361-V363 HydrophobicContact CB-CG2 4.3Å; R361-V363 PolarHBondContact O-N 3.26Å; V363-C389 HydrophobicContact CG1-CB 4.22Å; V363-Q391 HydrophobicContact CG2-CG 4.33Å
364	I	94.3	Very high	95.7	Very high	0 Å²	0	25.1 Å²	25.1	0%	0	12%	0.12	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-105.8	130.4	171.4	-46.5	175.8	0	0	0	107.9	R366 C389 A390 I392 P421 V423 D424	I364-R366 HydrophobicContact CB-CG 4.01Å; I364-R366 HydrophobicContact CG2-CG 3.47Å; I364-R366 VanDerWaalsContact CG2-CG 3.47Å; I364-C389 CarbonylContact O-C 3.01Å; I364-C389 VanDerWaalsContact O-CA 3.23Å; I364-C389 WeakPolarHBondContact O-CA 3.39Å; I364-A390 PolarHBondContact N-O 2.83Å; I364-A390 PolarHBondContact O-N 2.94Å; I364-I392 HydrophobicContact CD1-CD1 4.46Å; I364-I392 HydrophobicContact CD1-CG2 3.76Å; I364-I392 HydrophobicContact CG1-CG2 4.4Å; I364-P421 HydrophobicContact CD1-CG 4.31Å; I364-P421 HydrophobicContact CG1-CB 4.31Å; I364-P421 HydrophobicContact CG1-CG 4.03Å; I364-V423 HydrophobicContact CG2-CG2 3.67Å; I364-D424 WeakPolarHBondContact CG2-OD2 3.08Å
365	H	94.1	Very high	95.7	Very high	0 Å²	0	25.2 Å²	25.2	0%	0	12%	0.121	C	C	.	.			trans	-72.9	-51.8	-177.1	-162	-100.1	0	0	0	112.3	D367 I368 T384 D385 F386 F388 C389 D424	H365-D367 VanDerWaalsContact C-N 3.27Å; H365-D367 PolarHBondContact CE1-O 2.84Å; H365-D367 PolarHBondContact ND1-O 3.03Å; H365-D367 PolarHBondContact O-N 2.8Å; H365-I368 HydrophobicContact CB-CD1 3.79Å; H365-I368 HydrophobicContact CB-CG1 4.06Å; H365-I368 WeakPolarHBondContact ND1-CD1 3.35Å; H365-T384 PolarHBondContact CE1-O 2.93Å; H365-T384 VanDerWaalsContact CE1-O 3.29Å; H365-T384 PolarHBondContact NE2-O 3.34Å; H365-D385 PolarHBondContact NE2-O 2.57Å; H365-F386 AromaticContact CD2-CD1 3.89Å; H365-F386 AromaticContact CD2-CE1 3.89Å; H365-F388 CarbonylContact O-C 3.49Å; H365-C389 PolarHBondContact O-N 3.02Å; H365-D424 PolarHBondContact N-OD1 3.11Å; H365-D424 PolarHBondContact N-OD2 2.83Å
366	R	93.2	Very high	95.6	Very high	27 Å²	27	25.5 Å²	25.5	10%	0.102	12%	0.123	C	C	.	.	S	Bend	trans	68.2	9.9	178.1	-49.4	-172.8	-64.7	175.2	-1.5	116.8	I364 F388 C389 A390 T401 V403 G404 Y419 V423 D424	I364-R366 HydrophobicContact CB-CG 4.01Å; I364-R366 HydrophobicContact CG2-CG 3.47Å; I364-R366 VanDerWaalsContact CG2-CG 3.47Å; R366-F388 PolarHBondContact NE-O 3.33Å; R366-F388 PolarHBondContact NH2-O 2.88Å; R366-C389 PolarHBondContact NH2-O 3.03Å; R366-A390 VanDerWaalsContact CZ-CB 3.47Å; R366-T401 PolarHBondContact NH1-OG1 3.42Å; R366-V403 HydrophobicContact CB-CG2 4.15Å; R366-V403 VanDerWaalsContact CZ-CG2 3.45Å; R366-G404 VanDerWaalsContact O-CA 3.23Å; R366-G404 WeakPolarHBondContact O-CA 3.16Å; R366-Y419 VanDerWaalsContact CD-OH 3.31Å; R366-Y419 WeakPolarHBondContact CD-OH 3.28Å; R366-Y419 HydrophobicContact CG-CE2 4.38Å; R366-Y419 PolarHBondContact NH1-OH 2.98Å; R366-V423 HydrophobicContact CG-CG2 4.46Å; R366-D424 WeakPolarHBondContact CA-OD1 3.31Å; R366-D424 PolarHBondContact N-OD1 3.5Å
367	D	93.7	Very high	95.6	Very high	6 Å²	6	26.1 Å²	26.1	3%	0.032	13%	0.127	C	C	.	.			trans	-152.1	59	172.4	-156.2	44.6	0	0	0	110.4	H365 K369 N372 F388 T405	H365-D367 VanDerWaalsContact C-N 3.27Å; H365-D367 PolarHBondContact CE1-O 2.84Å; H365-D367 PolarHBondContact ND1-O 3.03Å; H365-D367 PolarHBondContact O-N 2.8Å; D367-K369 VanDerWaalsContact OD2-CE 3.31Å; D367-K369 WeakPolarHBondContact OD2-CE 3.49Å; D367-N372 PolarHBondContact O-ND2 2.83Å; D367-N372 PolarHBondContact OD2-ND2 3.42Å; D367-N372 VanDerWaalsContact OD2-ND2 3.11Å; D367-F388 HydrophobicContact CB-CB 4.32Å; D367-F388 HydrophobicContact CB-CD2 3.67Å; D367-F388 HydrophobicContact CB-CG 4.43Å; D367-T405 WeakPolarHBondContact OD1-CB 3.36Å; D367-T405 PolarHBondContact OD1-N 2.98Å; D367-T405 PolarHBondContact OD1-OG1 3.21Å
368	I	97.7	Very high	95.5	Very high	0 Å²	0	30.1 Å²	30.1	0%	0	15%	0.15	C	C	.	.			trans	-84	124.2	173.3	-60.8	-65.5	0	0	0	108.8	L355 H365 L383 D424 S427 L428 M431	L355-I368 HydrophobicContact CD2-CD1 3.85Å; L355-I368 HydrophobicContact CD2-CG1 4.12Å; H365-I368 HydrophobicContact CB-CD1 3.79Å; H365-I368 HydrophobicContact CB-CG1 4.06Å; H365-I368 WeakPolarHBondContact ND1-CD1 3.35Å; I368-L383 HydrophobicContact CD1-CD1 3.46Å; I368-L383 VanDerWaalsContact CD1-CD1 3.46Å; I368-L383 HydrophobicContact CD1-CD2 3.9Å; I368-L383 HydrophobicContact CD1-CG 4.35Å; I368-D424 HydrophobicContact CG1-CB 4.01Å; I368-S427 WeakPolarHBondContact O-CB 3.16Å; I368-L428 HydrophobicContact CG2-CB 4.45Å; I368-M431 HydrophobicContact CG2-CE 4.47Å; I368-M431 HydrophobicContact CG2-SD 4.34Å
369	K	96.4	Very high	95.5	Very high	22 Å²	22	30.1 Å²	30.1	10%	0.096	15%	0.15	C	C	.	.	S	Bend	trans	-169.3	165.1	-178.1	54.3	178.4	-177.3	152.6	0	109.2	D367 D371 N372 T405 W408 M431	D367-K369 VanDerWaalsContact OD2-CE 3.31Å; D367-K369 WeakPolarHBondContact OD2-CE 3.49Å; K369-D371 VanDerWaalsContact C-N 3.29Å; K369-D371 HydrophobicContact CD-CB 4.23Å; K369-D371 WeakPolarHBondContact CD-OD2 3.34Å; K369-D371 VanDerWaalsContact CE-OD2 3.31Å; K369-D371 WeakPolarHBondContact CE-OD2 3.15Å; K369-D371 HydrophobicContact CG-CB 4.27Å; K369-D371 IonicContact NZ-OD2 3.96Å; K369-D371 PolarHBondContact NZ-OD2 2.84Å; K369-D371 PolarHBondContact O-N 3.14Å; K369-N372 WeakPolarHBondContact CE-ND2 3.48Å; K369-N372 HydrophobicContact CG-CB 4.27Å; K369-N372 PolarHBondContact O-N 2.69Å; K369-T405 HydrophobicContact CD-CG2 4.48Å; K369-T405 PolarHBondContact NZ-OG1 3.44Å; K369-W408 HydrophobicContact CB-CD2 3.78Å; K369-W408 VanDerWaalsContact CB-CE2 3.46Å; K369-W408 HydrophobicContact CB-CE3 4.43Å; K369-W408 HydrophobicContact CB-CG 3.98Å; K369-W408 HydrophobicContact CB-CH2 4.5Å; K369-W408 HydrophobicContact CB-CZ2 3.86Å; K369-W408 HydrophobicContact CD-CE3 4.49Å; K369-W408 HydrophobicContact CD-CZ3 4.47Å; K369-M431 VanDerWaalsContact C-SD 3.52Å
370	S	96.8	Very high	95.6	Very high	1 Å²	1	30 Å²	30	1%	0.007	15%	0.153	C	C	.	.	G	3₁₀ helix	trans	-48.6	-44.4	177.9	55.9	0	0	0	0	114.1	T331 N372 I373 E434	T331-S370 VanDerWaalsContact OG1-C 3.27Å; T331-S370 WeakPolarHBondContact OG1-CB 3.48Å; T331-S370 PolarHBondContact OG1-OG 3.15Å; T331-S370 VanDerWaalsContact OG1-OG 3.11Å; S370-N372 PolarHBondContact O-N 3.17Å; S370-N372 VanDerWaalsContact O-N 3.12Å; S370-I373 PolarHBondContact O-N 2.95Å; S370-E434 VanDerWaalsContact CB-OE1 3.24Å; S370-E434 WeakPolarHBondContact CB-OE1 3.44Å; S370-E434 VanDerWaalsContact OG-CD 3.22Å; S370-E434 PolarHBondContact OG-OE1 3.1Å; S370-E434 PolarHBondContact OG-OE2 3.35Å
371	D	93.5	Very high	95.7	Very high	49 Å²	49	24.7 Å²	24.7	26%	0.262	13%	0.125	S	C	.	.	G	3₁₀ helix	trans	-56.5	-33.2	-179.4	-55.3	-45.6	0	0	0	113.1	T331 K369	T331-D371 WeakPolarHBondContact OG1-CA 3.24Å; T331-D371 PolarHBondContact OG1-N 3.02Å; T331-D371 PolarHBondContact OG1-OD1 2.99Å; K369-D371 VanDerWaalsContact C-N 3.29Å; K369-D371 HydrophobicContact CD-CB 4.23Å; K369-D371 WeakPolarHBondContact CD-OD2 3.34Å; K369-D371 VanDerWaalsContact CE-OD2 3.31Å; K369-D371 WeakPolarHBondContact CE-OD2 3.15Å; K369-D371 HydrophobicContact CG-CB 4.27Å; K369-D371 IonicContact NZ-OD2 3.96Å; K369-D371 PolarHBondContact NZ-OD2 2.84Å; K369-D371 PolarHBondContact O-N 3.14Å
372	N	95.6	Very high	96	Very high	10 Å²	10	20 Å²	20	5%	0.053	11%	0.108	C	C	.	.	G	3₁₀ helix	trans	-96.4	6.8	-174.3	-67.3	-12.8	0	0	0	112.1	D367 K369 S370 T384	D367-N372 PolarHBondContact O-ND2 2.83Å; D367-N372 PolarHBondContact OD2-ND2 3.42Å; D367-N372 VanDerWaalsContact OD2-ND2 3.11Å; K369-N372 WeakPolarHBondContact CE-ND2 3.48Å; K369-N372 HydrophobicContact CG-CB 4.27Å; K369-N372 PolarHBondContact O-N 2.69Å; S370-N372 PolarHBondContact O-N 3.17Å; S370-N372 VanDerWaalsContact O-N 3.12Å; N372-T384 WeakPolarHBondContact O-CG2 3.33Å; N372-T384 PolarHBondContact O-N 3.19Å
373	I	98.1	Very high	96.3	Very high	0 Å²	0	19.4 Å²	19.4	0%	0	10%	0.102	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-107	116.9	168.8	-55.3	-50.1	0	0	0	108.4	S329 L330 V351 S370 V381 L383 M431	S329-I373 CarbonylContact C-O 3.57Å; S329-I373 WeakPolarHBondContact CA-O 3.48Å; L330-I373 HydrophobicContact CB-CB 3.87Å; L330-I373 HydrophobicContact CB-CG2 4.1Å; L330-I373 HydrophobicContact CD2-CB 4.12Å; L330-I373 HydrophobicContact CD2-CG1 4.31Å; L330-I373 HydrophobicContact CD2-CG2 4.17Å; L330-I373 PolarHBondContact N-O 2.97Å; V351-I373 HydrophobicContact CG1-CD1 4.28Å; V351-I373 HydrophobicContact CG2-CD1 3.59Å; V351-I373 HydrophobicContact CG2-CG1 4.13Å; V351-I373 HydrophobicContact CG2-CG2 4.41Å; S370-I373 PolarHBondContact O-N 2.95Å; I373-V381 HydrophobicContact CG2-CG1 3.49Å; I373-V381 VanDerWaalsContact CG2-CG1 3.49Å; I373-L383 HydrophobicContact CD1-CB 4.47Å; I373-L383 HydrophobicContact CD1-CD1 3.81Å; I373-M431 HydrophobicContact CD1-SD 4.39Å; I373-M431 HydrophobicContact CG1-CE 4.11Å; I373-M431 HydrophobicContact CG1-SD 3.55Å; I373-M431 VanDerWaalsContact CG1-SD 3.55Å
374	L	97.8	Very high	96.3	Very high	40 Å²	40	20.2 Å²	20.2	21%	0.209	11%	0.107	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-102.9	147.6	176.9	-62.9	-173.1	0	0	0	111.6	V306 L325 G328 K382 T384	V306-L374 HydrophobicContact CG2-CD1 4.19Å; L325-L374 HydrophobicContact CB-CB 4.04Å; L325-L374 HydrophobicContact CD1-CB 3.44Å; L325-L374 VanDerWaalsContact CD1-CB 3.44Å; L325-L374 HydrophobicContact CD1-CD1 4.23Å; L325-L374 HydrophobicContact CD1-CG 4.48Å; L325-L374 HydrophobicContact CG-CB 4.41Å; G328-L374 WeakPolarHBondContact O-CA 3.38Å; L374-K382 PolarHBondContact N-O 2.95Å; L374-K382 PolarHBondContact O-N 3.42Å; L374-T384 HydrophobicContact CD1-CG2 3.97Å; L374-T384 HydrophobicContact CD2-CG2 4.42Å; L374-T384 HydrophobicContact CG-CG2 3.78Å
375	L	98.4	Very high	95.8	Very high	2 Å²	2	22 Å²	22	1%	0.01	12%	0.116	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-113.9	136.2	-175	-59.7	179.2	0	0	0	111.5	L325 G327 G328 L330 V333 A380 V381 I512	L325-L375 CarbonylContact C-O 3.4Å; L325-L375 WeakPolarHBondContact CB-O 3.29Å; G327-L375 CarbonylContact C-O 3.58Å; G327-L375 WeakPolarHBondContact CA-O 3.38Å; G327-L375 PolarHBondContact N-O 3.28Å; G328-L375 PolarHBondContact O-N 2.69Å; L330-L375 HydrophobicContact CD1-CD1 4.37Å; V333-L375 HydrophobicContact CG2-CD1 3.69Å; L375-A380 CarbonylContact C-O 3.33Å; L375-A380 WeakPolarHBondContact CA-O 3.24Å; L375-V381 HydrophobicContact CD2-CB 4.45Å; L375-V381 HydrophobicContact CD2-CG1 4.47Å; L375-V381 HydrophobicContact CD2-CG2 3.89Å; L375-I512 HydrophobicContact CB-CD1 3.88Å; L375-I512 HydrophobicContact CB-CG1 4.3Å; L375-I512 HydrophobicContact CD1-CD1 4.09Å; L375-I512 HydrophobicContact CD1-CG1 3.8Å
376	G	97.6	Very high	95.3	Very high	5 Å²	5	22 Å²	22	5%	0.052	12%	0.116	C	C	.	.			trans	-86.3	154.3	166.4	0	0	0	0	0	111.2	N378 G379 A380 I512	G376-N378 PolarHBondContact O-N 3.08Å; G376-N378 VanDerWaalsContact O-N 3.15Å; G376-G379 WeakPolarHBondContact O-CA 3.32Å; G376-G379 PolarHBondContact O-N 3.15Å; G376-A380 PolarHBondContact N-O 3.23Å; G376-I512 WeakPolarHBondContact O-CD1 3.4Å
377	M	96.4	Very high	94.6	Very high	69 Å²	69	21.1 Å²	21.1	34%	0.34	12%	0.116	S	C	.	.	T	Hydrogen-bonded Turn	trans	-63.3	-19.1	176	-68	-60.1	-53.2	0	0	113.3	A326 G379 Y509 I512 V513	A326-M377 HydrophobicContact CB-CG 3.93Å; M377-G379 VanDerWaalsContact C-N 3.26Å; M377-Y509 HydrophobicContact CE-CD2 4.08Å; M377-Y509 HydrophobicContact CE-CE2 3.73Å; M377-Y509 WeakPolarHBondContact O-CD2 3.39Å; M377-I512 HydrophobicContact CE-CG2 4.22Å; M377-I512 HydrophobicContact SD-CG2 3.8Å; M377-V513 HydrophobicContact CE-CG2 4.03Å
378	N	95.4	Very high	93.8	Very high	117 Å²	117	22.3 Å²	22.3	63%	0.626	12%	0.121	S	C	*	.	T	Hydrogen-bonded Turn	trans	-84.7	6.7	170.3	64.7	-12	0	0	0	113.5	G376 A380	G376-N378 PolarHBondContact O-N 3.08Å; G376-N378 VanDerWaalsContact O-N 3.15Å; N378-A380 VanDerWaalsContact OD1-CB 3.24Å; N378-A380 WeakPolarHBondContact OD1-CB 3.47Å; N378-A380 PolarHBondContact OD1-N 2.85Å; N378-A380 VanDerWaalsContact OD1-N 3.1Å
379	G	96.7	Very high	93.1	Very high	0 Å²	0	22.5 Å²	22.5	0%	0	12%	0.122	C	C	.	.			trans	81.4	6.9	-175.4	0	0	0	0	0	115.4	G376 M377 V381 L505	G376-G379 WeakPolarHBondContact O-CA 3.32Å; G376-G379 PolarHBondContact O-N 3.15Å; M377-G379 VanDerWaalsContact C-N 3.26Å; G379-V381 PolarHBondContact O-N 2.95Å; G379-L505 WeakPolarHBondContact CA-O 3.36Å; G379-L505 WeakPolarHBondContact O-CB 3.41Å
380	A	98.1	Very high	92.3	Very high	22 Å²	22	21.7 Å²	21.7	18%	0.182	12%	0.119	C	C	.	.			trans	-58	133.9	175.2	0	0	0	0	0	111.3	L375 G376 N378	L375-A380 CarbonylContact C-O 3.33Å; L375-A380 WeakPolarHBondContact CA-O 3.24Å; G376-A380 PolarHBondContact N-O 3.23Å; N378-A380 VanDerWaalsContact OD1-CB 3.24Å; N378-A380 WeakPolarHBondContact OD1-CB 3.47Å; N378-A380 PolarHBondContact OD1-N 2.85Å; N378-A380 VanDerWaalsContact OD1-N 3.1Å
381	V	98.7	Very high	91.5	Very high	2 Å²	2	25.5 Å²	25.5	1%	0.012	14%	0.137	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-111.8	122.1	-178.8	-179	0	0	0	0	109	N304 V347 E350 V351 I373 L375 G379 L505 L508	N304-V381 PolarHBondContact ND2-O 3.25Å; V347-V381 HydrophobicContact CG1-CG1 4.21Å; V347-V381 HydrophobicContact CG2-CG2 4.18Å; E350-V381 HydrophobicContact CB-CB 3.71Å; E350-V381 HydrophobicContact CB-CG1 4.01Å; E350-V381 HydrophobicContact CB-CG2 4.4Å; E350-V381 HydrophobicContact CG-CB 3.91Å; E350-V381 HydrophobicContact CG-CG2 4.15Å; V351-V381 HydrophobicContact CG2-CG1 4.1Å; I373-V381 HydrophobicContact CG2-CG1 3.49Å; I373-V381 VanDerWaalsContact CG2-CG1 3.49Å; L375-V381 HydrophobicContact CD2-CB 4.45Å; L375-V381 HydrophobicContact CD2-CG1 4.47Å; L375-V381 HydrophobicContact CD2-CG2 3.89Å; G379-V381 PolarHBondContact O-N 2.95Å; V381-L505 HydrophobicContact CG2-CD2 4.05Å; V381-L508 HydrophobicContact CG2-CD1 3.82Å
382	K	98.4	Very high	90.9	Very high	33 Å²	33	24.7 Å²	24.7	14%	0.143	13%	0.132	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-135.3	136.6	-177.7	-52.9	-161	-178	-176.4	0	113.4	P303 N304 V306 E323 L325 L374	P303-K382 WeakPolarHBondContact O-CD 3.25Å; P303-K382 WeakPolarHBondContact O-CE 3.33Å; N304-K382 WeakPolarHBondContact O-CA 3.27Å; V306-K382 HydrophobicContact CG2-CB 3.9Å; E323-K382 WeakPolarHBondContact OE1-CD 3.2Å; E323-K382 IonicContact OE1-NZ 2.62Å; E323-K382 PolarHBondContact OE1-NZ 3.1Å; E323-K382 IonicContact OE2-NZ 3Å; E323-K382 PolarHBondContact OE2-NZ 3.41Å; L325-K382 HydrophobicContact CD1-CB 3.79Å; L325-K382 HydrophobicContact CD1-CD 4.03Å; L325-K382 HydrophobicContact CD1-CG 4.04Å; L325-K382 HydrophobicContact CD2-CD 4.28Å; L374-K382 PolarHBondContact N-O 2.95Å; L374-K382 PolarHBondContact O-N 3.42Å
383	L	97.5	Very high	90	Very high	1 Å²	1	26.4 Å²	26.4	1%	0.005	15%	0.146	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-78.3	136.7	175.3	178.1	61.4	0	0	0	111.7	N304 V306 A354 L358 I368 I373 F386	N304-L383 PolarHBondContact O-N 3.02Å; V306-L383 WeakPolarHBondContact CG2-O 3.31Å; V306-L383 PolarHBondContact N-O 3.26Å; A354-L383 HydrophobicContact CB-CB 4.27Å; A354-L383 HydrophobicContact CB-CD2 4.23Å; L358-L383 HydrophobicContact CD1-CD2 3.77Å; I368-L383 HydrophobicContact CD1-CD1 3.46Å; I368-L383 VanDerWaalsContact CD1-CD1 3.46Å; I368-L383 HydrophobicContact CD1-CD2 3.9Å; I368-L383 HydrophobicContact CD1-CG 4.35Å; I373-L383 HydrophobicContact CD1-CB 4.47Å; I373-L383 HydrophobicContact CD1-CD1 3.81Å; L383-F386 HydrophobicContact CD2-CZ 4.25Å; L383-F386 HydrophobicContact CG-CZ 4.12Å
384	T	93.2	Very high	88.7	Confident	18 Å²	18	32 Å²	32	11%	0.11	18%	0.182	C	C	.	.			trans	-132.8	179.7	178.2	-159.1	0	0	0	0	112.9	H365 N372 L374	H365-T384 PolarHBondContact CE1-O 2.93Å; H365-T384 VanDerWaalsContact CE1-O 3.29Å; H365-T384 PolarHBondContact NE2-O 3.34Å; N372-T384 WeakPolarHBondContact O-CG2 3.33Å; N372-T384 PolarHBondContact O-N 3.19Å; L374-T384 HydrophobicContact CD1-CG2 3.97Å; L374-T384 HydrophobicContact CD2-CG2 4.42Å; L374-T384 HydrophobicContact CG-CG2 3.78Å
385	D	84.8	Confident	87.5	Confident	37 Å²	37	37.3 Å²	37.3	20%	0.198	21%	0.205	C	C	.	.			trans	60.1	64.2	176.8	-153.9	29.2	0	0	0	116.6	K277 H365 G387	K277-D385 IonicContact NZ-OD1 3.8Å; K277-D385 PolarHBondContact NZ-OD1 3.5Å; H365-D385 PolarHBondContact NE2-O 2.57Å; D385-G387 PolarHBondContact O-N 2.99Å
386	F	83.8	Confident	86.3	Confident	0 Å²	0	42.7 Å²	42.7	0%	0	23%	0.231	C	C	.	.	G	3₁₀ helix	trans	-72.1	9.2	178.9	-65.4	-99.9	0	0	0	114.1	E293 V296 M297 I305 L358 H365 L383 F388 C389	E293-F386 HydrophobicContact CG-CB 4.26Å; V296-F386 HydrophobicContact CG1-CB 4.19Å; V296-F386 HydrophobicContact CG1-CD1 3.48Å; V296-F386 VanDerWaalsContact CG1-CD1 3.48Å; V296-F386 HydrophobicContact CG1-CE1 4.23Å; V296-F386 HydrophobicContact CG1-CG 4.08Å; M297-F386 HydrophobicContact CG-CB 4.07Å; M297-F386 HydrophobicContact CG-CD2 3.54Å; M297-F386 HydrophobicContact CG-CE2 4.29Å; M297-F386 HydrophobicContact CG-CG 3.92Å; M297-F386 HydrophobicContact SD-CD2 4.12Å; I305-F386 HydrophobicContact CB-CZ 4.39Å; I305-F386 HydrophobicContact CD1-CE1 4.46Å; I305-F386 HydrophobicContact CD1-CZ 4.14Å; I305-F386 HydrophobicContact CG1-CZ 4.12Å; I305-F386 HydrophobicContact CG2-CE2 3.76Å; I305-F386 HydrophobicContact CG2-CZ 3.51Å; L358-F386 HydrophobicContact CD1-CE1 3.82Å; L358-F386 HydrophobicContact CD1-CZ 4.44Å; L358-F386 HydrophobicContact CD2-CE1 3.95Å; H365-F386 AromaticContact CD2-CD1 3.89Å; H365-F386 AromaticContact CD2-CE1 3.89Å; L383-F386 HydrophobicContact CD2-CZ 4.25Å; L383-F386 HydrophobicContact CG-CZ 4.12Å; F386-F388 PolarHBondContact O-N 3.2Å; F386-F388 VanDerWaalsContact O-N 3.14Å; F386-C389 HydrophobicContact CB-CB 4.46Å; F386-C389 WeakPolarHBondContact CD1-SG 3.2Å; F386-C389 VanDerWaalsContact O-CB 3.23Å; F386-C389 WeakPolarHBondContact O-CB 3.41Å; F386-C389 PolarHBondContact O-N 3.26Å; F386-C389 PolarHBondContact O-SG 3.34Å
387	G	77.5	Confident	85.1	Confident	9 Å²	9	46.8 Å²	46.8	9%	0.093	25%	0.251	C	S	.	.	G	3₁₀ helix	trans	-61.4	-22	-176.8	0	0	0	0	0	114.8	D385	D385-G387 PolarHBondContact O-N 2.99Å
388	F	77.1	Confident	83.8	Confident	31 Å²	31	47.9 Å²	47.9	14%	0.136	25%	0.254	C	S	.	.	G	3₁₀ helix	trans	-100.2	5.7	172.5	-58.1	-53.5	0	0	0	114.7	K138 H365 R366 D367 F386	K138-F388 HydrophobicContact CD-CE1 4.34Å; K138-F388 HydrophobicContact CD-CZ 3.75Å; K138-F388 VanDerWaalsContact CE-CZ 3.41Å; H365-F388 CarbonylContact O-C 3.49Å; R366-F388 PolarHBondContact NE-O 3.33Å; R366-F388 PolarHBondContact NH2-O 2.88Å; D367-F388 HydrophobicContact CB-CB 4.32Å; D367-F388 HydrophobicContact CB-CD2 3.67Å; D367-F388 HydrophobicContact CB-CG 4.43Å; F386-F388 PolarHBondContact O-N 3.2Å; F386-F388 VanDerWaalsContact O-N 3.14Å
389	C	83	Confident	82.6	Confident	4 Å²	4	46 Å²	46	3%	0.027	24%	0.238	C	C	.	.			trans	-60.3	153.3	-177.1	-77.9	0	0	0	0	113.8	N292 V296 V363 I364 H365 R366 F386	N292-C389 PolarHBondContact ND2-O 3.22Å; V296-C389 HydrophobicContact CG2-CB 4.48Å; V363-C389 HydrophobicContact CG1-CB 4.22Å; I364-C389 CarbonylContact O-C 3.01Å; I364-C389 VanDerWaalsContact O-CA 3.23Å; I364-C389 WeakPolarHBondContact O-CA 3.39Å; H365-C389 PolarHBondContact O-N 3.02Å; R366-C389 PolarHBondContact NH2-O 3.03Å; F386-C389 HydrophobicContact CB-CB 4.46Å; F386-C389 WeakPolarHBondContact CD1-SG 3.2Å; F386-C389 VanDerWaalsContact O-CB 3.23Å; F386-C389 WeakPolarHBondContact O-CB 3.41Å; F386-C389 PolarHBondContact O-N 3.26Å; F386-C389 PolarHBondContact O-SG 3.34Å
390	A	80.7	Confident	80.9	Confident	5 Å²	5	50 Å²	50	4%	0.041	26%	0.263	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-133.7	123.4	167	0	0	0	0	0	110.6	I364 R366 R399	I364-A390 PolarHBondContact N-O 2.83Å; I364-A390 PolarHBondContact O-N 2.94Å; R366-A390 VanDerWaalsContact CZ-CB 3.47Å; A390-R399 HydrophobicContact CB-CG 4.23Å
391	Q	79.6	Confident	79.7	Confident	81 Å²	81	52.2 Å²	52.2	38%	0.379	27%	0.274	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-71.8	127	160.9	-67.4	178.1	-13.2	0	0	109	G362 V363 R399	G362-Q391 CarbonylContact O-C 3.51Å; G362-Q391 VanDerWaalsContact O-CA 3.32Å; G362-Q391 WeakPolarHBondContact O-CA 3.32Å; V363-Q391 HydrophobicContact CG2-CG 4.33Å; Q391-R399 PolarHBondContact O-NH2 3.23Å
392	I	80.9	Confident	77.9	Confident	32 Å²	32	53.1 Å²	53.1	16%	0.164	28%	0.278	C	S	.	.			trans	-102.8	149	167.5	53.7	160.6	0	0	0	109	G362 I364 Q396 N397 R399 P421	G362-I392 WeakPolarHBondContact O-CG1 3.22Å; G362-I392 PolarHBondContact O-N 2.86Å; I364-I392 HydrophobicContact CD1-CD1 4.46Å; I364-I392 HydrophobicContact CD1-CG2 3.76Å; I364-I392 HydrophobicContact CG1-CG2 4.4Å; I392-Q396 WeakPolarHBondContact CB-O 3.38Å; I392-N397 WeakPolarHBondContact CD1-O 3.43Å; I392-R399 HydrophobicContact CG2-CG 4.06Å; I392-P421 HydrophobicContact CD1-CG 3.93Å
393	S	76.5	Confident	76.5	Confident	47 Å²	47	52.3 Å²	52.3	33%	0.329	28%	0.277	S	S	.	.	B	Isolated β-bridge	trans	-115.3	166.3	175.4	77.4	0	0	0	0	110.2	E395 Q396 N397	S393-E395 WeakPolarHBondContact CB-OE2 3.28Å; S393-E395 PolarHBondContact O-N 3.43Å; S393-E395 PolarHBondContact OG-N 2.88Å; S393-E395 PolarHBondContact OG-OE2 2.97Å; S393-Q396 PolarHBondContact N-O 2.96Å; S393-Q396 CarbonylContact O-C 3.59Å; S393-Q396 PolarHBondContact O-N 3.26Å; S393-Q396 PolarHBondContact OG-N 3.25Å; S393-N397 WeakPolarHBondContact O-CA 3.13Å; S393-N397 PolarHBondContact O-N 2.81Å
394	P	71.2	Confident	75.1	Confident	117 Å²	117	52.6 Å²	52.6	76%	0.76	28%	0.279	S	S	*	.	T	Hydrogen-bonded Turn	trans	-55	-34.2	175.1	-26.5	36.5	0	0	0	113.2
395	E	73.1	Confident	74.7	Confident	151 Å²	151	52.7 Å²	52.7	71%	0.706	28%	0.28	S	S	*	.	T	Hydrogen-bonded Turn	trans	-79.7	-21.9	178.3	-44.8	74.2	-161.3	0	0	113.1	S393	S393-E395 WeakPolarHBondContact CB-OE2 3.28Å; S393-E395 PolarHBondContact O-N 3.43Å; S393-E395 PolarHBondContact OG-N 2.88Å; S393-E395 PolarHBondContact OG-OE2 2.97Å
396	Q	73	Confident	74.9	Confident	116 Å²	116	51 Å²	51	54%	0.542	27%	0.271	S	S	.	.	B	Isolated β-bridge	trans	-136.8	64.2	179.6	-66	-167.5	-8.2	0	0	110.4	I392 S393 K398	I392-Q396 WeakPolarHBondContact CB-O 3.38Å; S393-Q396 PolarHBondContact N-O 2.96Å; S393-Q396 CarbonylContact O-C 3.59Å; S393-Q396 PolarHBondContact O-N 3.26Å; S393-Q396 PolarHBondContact OG-N 3.25Å; Q396-K398 PolarHBondContact O-N 3.27Å
397	N	71.2	Confident	75.4	Confident	90 Å²	90	52 Å²	52	48%	0.481	28%	0.275	S	S	.	.			trans	-76.1	-7	-175.4	68.1	-3	0	0	0	114.4	I392 S393	I392-N397 WeakPolarHBondContact CD1-O 3.43Å; S393-N397 WeakPolarHBondContact O-CA 3.13Å; S393-N397 PolarHBondContact O-N 2.81Å
398	K	69.6	Low	76.3	Confident	92 Å²	92	51.9 Å²	51.9	40%	0.4	27%	0.271	S	S	.	.			trans	-128.7	155.2	178.3	-65.3	-177.4	-177.1	-169.5	0	112.4	Q396 Q418 Y419	Q396-K398 PolarHBondContact O-N 3.27Å; K398-Q418 HydrophobicContact CB-CB 3.89Å; K398-Q418 HydrophobicContact CD-CB 3.74Å; K398-Q418 HydrophobicContact CG-CB 4.41Å; K398-Y419 CarbonylContact C-O 3.37Å; K398-Y419 WeakPolarHBondContact CA-O 3.19Å; K398-Y419 WeakPolarHBondContact CB-O 3.33Å
399	R	69.1	Low	77.2	Confident	77 Å²	77	50.8 Å²	50.8	29%	0.291	27%	0.267	S	S	.	.	B	Isolated β-bridge	trans	-120	155	176.9	-63.5	-57.4	-166	159.3	2.9	110.8	A390 Q391 I392 Q418 Y419	A390-R399 HydrophobicContact CB-CG 4.23Å; Q391-R399 PolarHBondContact O-NH2 3.23Å; I392-R399 HydrophobicContact CG2-CG 4.06Å; R399-Q418 CarbonylContact O-C 3.57Å; R399-Q418 WeakPolarHBondContact O-CA 3.33Å; R399-Y419 HydrophobicContact CB-CD2 4.28Å; R399-Y419 HydrophobicContact CB-CE1 4.08Å; R399-Y419 HydrophobicContact CB-CE2 3.72Å; R399-Y419 PolarHBondContact N-O 3.47Å; R399-Y419 WeakPolarHBondContact O-CD1 3.38Å; R399-Y419 PolarHBondContact O-N 3.04Å
400	T	62.5	Low	77.8	Confident	86 Å²	86	50.6 Å²	50.6	53%	0.528	27%	0.266	S	S	.	.			trans	-122.6	-2.1	176.8	52.6	0	0	0	0	112.9	M402 Q418	T400-M402 PolarHBondContact O-N 3.09Å; T400-Q418 HydrophobicContact CG2-CG 3.66Å
401	T	71.6	Confident	78.4	Confident	68 Å²	68	50.9 Å²	50.9	42%	0.417	27%	0.267	S	S	.	.			trans	-76.8	115	-177.4	53.2	0	0	0	0	110.1	R366 V403 Y419	R366-T401 PolarHBondContact NH1-OG1 3.42Å; T401-V403 PolarHBondContact O-N 2.67Å; T401-Y419 WeakPolarHBondContact O-CE1 2.91Å; T401-Y419 PolarHBondContact O-OH 3.15Å; T401-Y419 PolarHBondContact OG1-OH 3.48Å
402	M	61.8	Low	79.1	Confident	20 Å²	20	47.5 Å²	47.5	10%	0.099	25%	0.251	C	S	.	.			trans	-70.9	112.1	173.3	-157.7	-179.8	-53.8	0	0	109.8	Y127 T400 M409 V413 V414 R416	Y127-M402 VanDerWaalsContact CB-SD 3.5Å; Y127-M402 HydrophobicContact CD2-CB 4.46Å; Y127-M402 HydrophobicContact CD2-CG 3.76Å; Y127-M402 HydrophobicContact CD2-SD 3.27Å; Y127-M402 WeakPolarHBondContact CD2-SD 3.5Å; Y127-M402 HydrophobicContact CE2-CG 4.28Å; Y127-M402 HydrophobicContact CE2-SD 4.25Å; Y127-M402 HydrophobicContact CG-SD 3.75Å; T400-M402 PolarHBondContact O-N 3.09Å; M402-M409 HydrophobicContact CG-CE 3.35Å; M402-M409 HydrophobicContact SD-CE 3.92Å; M402-V413 WeakPolarHBondContact CE-O 3.38Å; M402-V413 HydrophobicContact CG-CG1 4.09Å; M402-V413 WeakPolarHBondContact CG-O 3.42Å; M402-V414 WeakPolarHBondContact CE-O 3.4Å; M402-R416 HydrophobicContact CE-CG 3.22Å
403	V	68.6	Low	79.6	Confident	17 Å²	17	46.3 Å²	46.3	10%	0.103	25%	0.246	C	C	.	.			trans	-148.9	163.1	177.6	-64.4	0	0	0	0	108.9	R366 T401	R366-V403 HydrophobicContact CB-CG2 4.15Å; R366-V403 VanDerWaalsContact CZ-CG2 3.45Å; T401-V403 PolarHBondContact O-N 2.67Å
404	G	69	Low	80.2	Confident	6 Å²	6	44 Å²	44	6%	0.062	23%	0.23	C	C	.	.	S	Bend	trans	113.4	170	-175.2	0	0	0	0	0	112	Y127 R366	Y127-G404 PolarHBondContact OH-O 3.34Å; R366-G404 VanDerWaalsContact O-CA 3.23Å; R366-G404 WeakPolarHBondContact O-CA 3.16Å
405	T	83.6	Confident	80.9	Confident	21 Å²	21	40 Å²	40	13%	0.129	20%	0.203	C	C	.	.			trans	-80.8	122.9	176.3	-54.4	0	0	0	0	110.3	D367 K369 Y407 W408 M409	D367-T405 WeakPolarHBondContact OD1-CB 3.36Å; D367-T405 PolarHBondContact OD1-N 2.98Å; D367-T405 PolarHBondContact OD1-OG1 3.21Å; K369-T405 HydrophobicContact CD-CG2 4.48Å; K369-T405 PolarHBondContact NZ-OG1 3.44Å; T405-Y407 PolarHBondContact O-N 3.06Å; T405-W408 HydrophobicContact CG2-CE3 3.57Å; T405-W408 HydrophobicContact CG2-CZ3 3.42Å; T405-W408 VanDerWaalsContact CG2-CZ3 3.42Å; T405-W408 PolarHBondContact O-N 3.4Å; T405-W408 VanDerWaalsContact O-N 3.1Å; T405-M409 WeakPolarHBondContact O-CG 3.46Å
406	P	89.6	Confident	81.3	Confident	0 Å²	0	36.5 Å²	36.5	0%	0	18%	0.183	C	C	.	.	G	3₁₀ helix	trans	-40.7	-51	-167.4	-35.7	35.8	0	0	0	117	Y127 F139 W408 M409 P447 I451 I454	Y127-P406 HydrophobicContact CE1-CG 3.98Å; Y127-P406 WeakPolarHBondContact OH-CD 3.39Å; Y127-P406 WeakPolarHBondContact OH-CG 3.47Å; F139-P406 HydrophobicContact CE1-CG 4.35Å; F139-P406 HydrophobicContact CZ-CG 4.14Å; P406-W408 VanDerWaalsContact C-N 3.28Å; P406-W408 PolarHBondContact O-N 2.88Å; P406-M409 WeakPolarHBondContact O-CB 3.31Å; P406-M409 PolarHBondContact O-N 3.27Å; P406-P447 HydrophobicContact CB-CB 3.86Å; P406-P447 HydrophobicContact CG-CB 3.67Å; P406-I451 HydrophobicContact CB-CD1 4.09Å; P406-I451 HydrophobicContact CB-CG1 4.15Å; P406-I451 HydrophobicContact CG-CD1 4.33Å; P406-I454 WeakPolarHBondContact O-CD1 3.13Å
407	Y	94.7	Very high	81.9	Confident	23 Å²	23	37.1 Å²	37.1	9%	0.09	18%	0.184	C	C	.	.	G	3₁₀ helix	trans	-70	-22.1	-169.9	-48.4	-82.4	0	0	0	113.6	T405 P440 Y442 L443 E445 P447 A450	T405-Y407 PolarHBondContact O-N 3.06Å; Y407-P440 HydrophobicContact CG-CG 4.46Å; Y407-Y442 WeakPolarHBondContact CE1-O 3.37Å; Y407-L443 HydrophobicContact CD2-CD1 4.25Å; Y407-L443 HydrophobicContact CE2-CD1 4.18Å; Y407-E445 PolarHBondContact OH-O 2.84Å; Y407-P447 HydrophobicContact CE2-CB 4.49Å; Y407-A450 HydrophobicContact CD1-CB 3.69Å; Y407-A450 HydrophobicContact CE1-CB 3.52Å
408	W	96.9	Very high	82.6	Confident	5 Å²	5	39 Å²	39	2%	0.019	19%	0.19	C	C	.	.	G	3₁₀ helix	trans	-97.8	-3.5	176.8	-63.7	-104.7	0	0	0	113	K369 T405 P406 S427 I430 E434 P440	K369-W408 HydrophobicContact CB-CD2 3.78Å; K369-W408 VanDerWaalsContact CB-CE2 3.46Å; K369-W408 HydrophobicContact CB-CE3 4.43Å; K369-W408 HydrophobicContact CB-CG 3.98Å; K369-W408 HydrophobicContact CB-CH2 4.5Å; K369-W408 HydrophobicContact CB-CZ2 3.86Å; K369-W408 HydrophobicContact CD-CE3 4.49Å; K369-W408 HydrophobicContact CD-CZ3 4.47Å; T405-W408 HydrophobicContact CG2-CE3 3.57Å; T405-W408 HydrophobicContact CG2-CZ3 3.42Å; T405-W408 VanDerWaalsContact CG2-CZ3 3.42Å; T405-W408 PolarHBondContact O-N 3.4Å; T405-W408 VanDerWaalsContact O-N 3.1Å; P406-W408 VanDerWaalsContact C-N 3.28Å; P406-W408 PolarHBondContact O-N 2.88Å; W408-S427 PolarHBondContact O-OG 3.27Å; W408-S427 VanDerWaalsContact O-OG 3.05Å; W408-I430 HydrophobicContact CB-CB 4.48Å; W408-I430 HydrophobicContact CB-CG2 4.38Å; W408-I430 VanDerWaalsContact CD1-CG2 3.47Å; W408-I430 HydrophobicContact CD2-CG2 4.42Å; W408-I430 HydrophobicContact CG-CB 4.26Å; W408-I430 HydrophobicContact CG-CG2 3.83Å; W408-E434 WeakPolarHBondContact CZ2-OE1 3.45Å; W408-E434 WeakPolarHBondContact CZ2-OE2 3.14Å; W408-E434 PolarHBondContact NE1-OE2 1.9Å; W408-P440 HydrophobicContact CD2-CB 4.38Å; W408-P440 HydrophobicContact CH2-CB 4.44Å; W408-P440 HydrophobicContact CH2-CG 3.65Å; W408-P440 HydrophobicContact CZ2-CB 4.05Å; W408-P440 HydrophobicContact CZ2-CG 3.65Å; W408-P440 HydrophobicContact CZ3-CG 4.07Å
409	M	94.3	Very high	83.5	Confident	8 Å²	8	34.8 Å²	34.8	4%	0.039	17%	0.172	C	C	.	.			trans	-71.6	138.9	-175.2	-70.4	170.1	63.9	0	0	112.7	Y127 M402 T405 P406 V413 V414 W426	Y127-M409 HydrophobicContact CD2-CE 4.46Å; Y127-M409 HydrophobicContact CE2-CE 4.16Å; Y127-M409 HydrophobicContact CE2-SD 4.15Å; M402-M409 HydrophobicContact CG-CE 3.35Å; M402-M409 HydrophobicContact SD-CE 3.92Å; T405-M409 WeakPolarHBondContact O-CG 3.46Å; P406-M409 WeakPolarHBondContact O-CB 3.31Å; P406-M409 PolarHBondContact O-N 3.27Å; M409-V413 HydrophobicContact CE-CB 4.32Å; M409-V413 HydrophobicContact CE-CG1 3.61Å; M409-V414 HydrophobicContact CB-CG1 3.99Å; M409-V414 HydrophobicContact CE-CG1 3.8Å; M409-W426 PolarHBondContact O-NE1 3.33Å
410	A	95.6	Very high	84.7	Confident	1 Å²	1	31.6 Å²	31.6	1%	0.008	16%	0.163	C	C	.	.			trans	-74.1	151.1	177.2	0	0	0	0	0	112.9	E412 V413 V414 V423 W426	A410-E412 HydrophobicContact CB-CG 4.48Å; A410-E412 WeakPolarHBondContact CB-OE2 3.45Å; A410-E412 PolarHBondContact O-N 3.22Å; A410-E412 VanDerWaalsContact O-N 3.16Å; A410-V413 HydrophobicContact CB-CG2 4.15Å; A410-V413 WeakPolarHBondContact O-CA 3.46Å; A410-V413 WeakPolarHBondContact O-CB 3.29Å; A410-V413 PolarHBondContact O-N 3.38Å; A410-V414 PolarHBondContact O-N 2.89Å; A410-V423 HydrophobicContact CB-CB 4.28Å; A410-V423 HydrophobicContact CB-CG1 4.19Å; A410-W426 VanDerWaalsContact CA-CD1 3.48Å; A410-W426 HydrophobicContact CB-CB 3.69Å; A410-W426 HydrophobicContact CB-CD2 4.1Å; A410-W426 HydrophobicContact CB-CG 3.59Å
411	P	94.7	Very high	86.3	Confident	11 Å²	11	29 Å²	29	7%	0.071	15%	0.148	C	C	.	.	H	α-helix	trans	-53.4	-37.5	-179.7	-29.3	36.2	0	0	0	113.8	V413 V414 T415 W426 I454	P411-V413 VanDerWaalsContact C-N 3.31Å; P411-V413 PolarHBondContact O-N 3.35Å; P411-V414 VanDerWaalsContact O-CG2 3.25Å; P411-V414 WeakPolarHBondContact O-CG2 3.32Å; P411-T415 WeakPolarHBondContact O-CB 3.4Å; P411-T415 WeakPolarHBondContact O-CG2 3.49Å; P411-T415 PolarHBondContact O-N 3.26Å; P411-T415 PolarHBondContact O-OG1 2.99Å; P411-W426 HydrophobicContact CG-CE3 4.39Å; P411-W426 HydrophobicContact CG-CH2 3.49Å; P411-W426 VanDerWaalsContact CG-CH2 3.49Å; P411-W426 HydrophobicContact CG-CZ2 3.74Å; P411-W426 HydrophobicContact CG-CZ3 3.83Å; P411-I454 HydrophobicContact CG-CG2 4.29Å
412	E	93.6	Very high	87.6	Confident	9 Å²	9	28.1 Å²	28.1	4%	0.042	14%	0.138	C	C	.	.	H	α-helix	trans	-69	-25.7	177	68.4	-88	-157.7	0	0	113.8	A410 R416 K417 V423 V484 R487	A410-E412 HydrophobicContact CB-CG 4.48Å; A410-E412 WeakPolarHBondContact CB-OE2 3.45Å; A410-E412 PolarHBondContact O-N 3.22Å; A410-E412 VanDerWaalsContact O-N 3.16Å; E412-R416 PolarHBondContact O-N 3.44Å; E412-K417 HydrophobicContact CB-CB 4.13Å; E412-K417 HydrophobicContact CB-CD 4.43Å; E412-K417 WeakPolarHBondContact O-CB 3.25Å; E412-K417 PolarHBondContact O-N 3.06Å; E412-V423 HydrophobicContact CG-CG1 4.2Å; E412-V423 WeakPolarHBondContact OE1-CG1 3.23Å; E412-V484 HydrophobicContact CB-CG2 4.14Å; E412-V484 VanDerWaalsContact CD-CG2 3.46Å; E412-V484 HydrophobicContact CG-CG2 3.92Å; E412-R487 IonicContact OE1-CZ 3.02Å; E412-R487 IonicContact OE1-NH1 2.74Å; E412-R487 PolarHBondContact OE1-NH1 3.45Å; E412-R487 IonicContact OE1-NH2 3.94Å; E412-R487 PolarHBondContact OE1-NH2 2.82Å; E412-R487 IonicContact OE2-CZ 3.73Å; E412-R487 IonicContact OE2-NH1 2.75Å; E412-R487 IonicContact OE2-NH2 3.35Å; E412-R487 PolarHBondContact OE2-NH2 3.35Å
413	V	91.5	Very high	89.2	Confident	7 Å²	7	27.3 Å²	27.3	4%	0.042	14%	0.135	C	C	.	.	H	α-helix	trans	-76.5	-46.4	176.5	-173.9	0	0	0	0	109.9	M402 M409 A410 P411 R416 Y419 V423	M402-V413 WeakPolarHBondContact CE-O 3.38Å; M402-V413 HydrophobicContact CG-CG1 4.09Å; M402-V413 WeakPolarHBondContact CG-O 3.42Å; M409-V413 HydrophobicContact CE-CB 4.32Å; M409-V413 HydrophobicContact CE-CG1 3.61Å; A410-V413 HydrophobicContact CB-CG2 4.15Å; A410-V413 WeakPolarHBondContact O-CA 3.46Å; A410-V413 WeakPolarHBondContact O-CB 3.29Å; A410-V413 PolarHBondContact O-N 3.38Å; P411-V413 VanDerWaalsContact C-N 3.31Å; P411-V413 PolarHBondContact O-N 3.35Å; V413-R416 PolarHBondContact O-N 3.03Å; V413-Y419 HydrophobicContact CB-CD1 4.46Å; V413-Y419 HydrophobicContact CG1-CD1 4.45Å; V413-Y419 HydrophobicContact CG1-CE1 4.14Å; V413-Y419 HydrophobicContact CG2-CD1 3.94Å; V413-Y419 HydrophobicContact CG2-CD2 4.35Å; V413-Y419 HydrophobicContact CG2-CE1 4.28Å; V413-Y419 HydrophobicContact CG2-CG 3.98Å; V413-V423 HydrophobicContact CG2-CB 4.05Å; V413-V423 HydrophobicContact CG2-CG1 3.43Å; V413-V423 VanDerWaalsContact CG2-CG1 3.43Å
414	V	89.1	Confident	90.7	Very high	0 Å²	0	26.5 Å²	26.5	0%	0	13%	0.13	C	C	.	.	H	α-helix	trans	-68.4	-35.6	178.4	-66	0	0	0	0	112.8	M402 M409 A410 P411 R416 I451 I454 A455	M402-V414 WeakPolarHBondContact CE-O 3.4Å; M409-V414 HydrophobicContact CB-CG1 3.99Å; M409-V414 HydrophobicContact CE-CG1 3.8Å; A410-V414 PolarHBondContact O-N 2.89Å; P411-V414 VanDerWaalsContact O-CG2 3.25Å; P411-V414 WeakPolarHBondContact O-CG2 3.32Å; V414-R416 PolarHBondContact O-N 2.97Å; V414-I451 HydrophobicContact CB-CG2 3.95Å; V414-I451 HydrophobicContact CG1-CB 4.4Å; V414-I451 HydrophobicContact CG1-CG1 4.06Å; V414-I451 HydrophobicContact CG1-CG2 3.86Å; V414-I454 HydrophobicContact CG2-CG2 3.88Å; V414-A455 HydrophobicContact CG2-CB 4.02Å
415	T	85.8	Confident	92.1	Very high	31 Å²	31	26.2 Å²	26.2	19%	0.19	13%	0.127	C	C	.	.	T	Hydrogen-bonded Turn	trans	-82.5	14.5	174.4	58.2	0	0	0	0	114	P411 K417 A455	P411-T415 WeakPolarHBondContact O-CB 3.4Å; P411-T415 WeakPolarHBondContact O-CG2 3.49Å; P411-T415 PolarHBondContact O-N 3.26Å; P411-T415 PolarHBondContact O-OG1 2.99Å; T415-K417 PolarHBondContact O-N 3.34Å; T415-K417 WeakPolarHBondContact OG1-CD 3.44Å; T415-K417 WeakPolarHBondContact OG1-CE 3.47Å; T415-A455 HydrophobicContact CG2-CB 4.01Å
416	R	80.9	Confident	92.8	Very high	78 Å²	78	25.3 Å²	25.3	29%	0.294	12%	0.121	S	C	.	.	T	Hydrogen-bonded Turn	trans	56.4	21.6	175	-61.9	-176.4	164.4	-142.5	-17.1	115.4	N126 T130 M402 E412 V413 V414	N126-R416 PolarHBondContact O-NH2 3.43Å; T130-R416 PolarHBondContact OG1-NH2 2.96Å; M402-R416 HydrophobicContact CE-CG 3.22Å; E412-R416 PolarHBondContact O-N 3.44Å; V413-R416 PolarHBondContact O-N 3.03Å; V414-R416 PolarHBondContact O-N 2.97Å
417	K	85.5	Confident	93.2	Very high	130 Å²	130	25.6 Å²	25.6	57%	0.565	12%	0.123	S	C	*	.			trans	-71.6	162	176.1	-64.1	174.7	-173.3	170.2	0	109.9	E412 T415 Y419	E412-K417 HydrophobicContact CB-CB 4.13Å; E412-K417 HydrophobicContact CB-CD 4.43Å; E412-K417 WeakPolarHBondContact O-CB 3.25Å; E412-K417 PolarHBondContact O-N 3.06Å; T415-K417 PolarHBondContact O-N 3.34Å; T415-K417 WeakPolarHBondContact OG1-CD 3.44Å; T415-K417 WeakPolarHBondContact OG1-CE 3.47Å; K417-Y419 PolarHBondContact O-N 3.26Å
418	Q	86.2	Confident	93.4	Very high	129 Å²	129	24.5 Å²	24.5	60%	0.603	12%	0.119	S	C	*	.			trans	-69.5	115.2	170.6	-72.7	-173.6	12.7	0	0	109.6	K398 R399 T400	K398-Q418 HydrophobicContact CB-CB 3.89Å; K398-Q418 HydrophobicContact CD-CB 3.74Å; K398-Q418 HydrophobicContact CG-CB 4.41Å; R399-Q418 CarbonylContact O-C 3.57Å; R399-Q418 WeakPolarHBondContact O-CA 3.33Å; T400-Q418 HydrophobicContact CG2-CG 3.66Å
419	Y	89.9	Confident	93.5	Very high	3 Å²	3	24.3 Å²	24.3	1%	0.012	12%	0.118	C	C	.	.	B	Isolated β-bridge	trans	-114.1	156.2	-176.3	68.6	-101	0	0	0	112.6	R366 K398 R399 T401 V413 K417 V423	R366-Y419 VanDerWaalsContact CD-OH 3.31Å; R366-Y419 WeakPolarHBondContact CD-OH 3.28Å; R366-Y419 HydrophobicContact CG-CE2 4.38Å; R366-Y419 PolarHBondContact NH1-OH 2.98Å; K398-Y419 CarbonylContact C-O 3.37Å; K398-Y419 WeakPolarHBondContact CA-O 3.19Å; K398-Y419 WeakPolarHBondContact CB-O 3.33Å; R399-Y419 HydrophobicContact CB-CD2 4.28Å; R399-Y419 HydrophobicContact CB-CE1 4.08Å; R399-Y419 HydrophobicContact CB-CE2 3.72Å; R399-Y419 PolarHBondContact N-O 3.47Å; R399-Y419 WeakPolarHBondContact O-CD1 3.38Å; R399-Y419 PolarHBondContact O-N 3.04Å; T401-Y419 WeakPolarHBondContact O-CE1 2.91Å; T401-Y419 PolarHBondContact O-OH 3.15Å; T401-Y419 PolarHBondContact OG1-OH 3.48Å; V413-Y419 HydrophobicContact CB-CD1 4.46Å; V413-Y419 HydrophobicContact CG1-CD1 4.45Å; V413-Y419 HydrophobicContact CG1-CE1 4.14Å; V413-Y419 HydrophobicContact CG2-CD1 3.94Å; V413-Y419 HydrophobicContact CG2-CD2 4.35Å; V413-Y419 HydrophobicContact CG2-CE1 4.28Å; V413-Y419 HydrophobicContact CG2-CG 3.98Å; K417-Y419 PolarHBondContact O-N 3.26Å; Y419-V423 HydrophobicContact CD2-CB 4.48Å; Y419-V423 HydrophobicContact CD2-CG1 3.61Å; Y419-V423 HydrophobicContact CD2-CG2 4.05Å; Y419-V423 HydrophobicContact CE2-CG2 4.33Å; Y419-V423 HydrophobicContact CG-CG1 3.85Å
420	G	93.8	Very high	93.7	Very high	11 Å²	11	24.1 Å²	24.1	11%	0.113	12%	0.117	C	C	.	.			trans	-127.6	-162.3	178.9	0	0	0	0	0	112.3	K422 V423	G420-K422 PolarHBondContact O-N 3.27Å; G420-V423 WeakPolarHBondContact O-CG2 3.25Å; G420-V423 PolarHBondContact O-N 2.84Å
421	P	96	Very high	93.8	Very high	32 Å²	32	24 Å²	24	21%	0.208	12%	0.116	C	C	.	.	T	Hydrogen-bonded Turn	trans	-57.8	-24.7	-173.7	-24.9	32.9	0	0	0	116	H359 I364 I392 V423 D424	H359-P421 HydrophobicContact CB-CB 4.11Å; H359-P421 PolarHBondContact CE1-O 3.05Å; H359-P421 PolarHBondContact NE2-O 2.92Å; I364-P421 HydrophobicContact CD1-CG 4.31Å; I364-P421 HydrophobicContact CG1-CB 4.31Å; I364-P421 HydrophobicContact CG1-CG 4.03Å; I392-P421 HydrophobicContact CD1-CG 3.93Å; P421-V423 PolarHBondContact O-N 3.3Å; P421-D424 PolarHBondContact O-N 2.89Å; P421-D424 VanDerWaalsContact O-N 3.09Å
422	K	97.7	Very high	94	Very high	48 Å²	48	23.5 Å²	23.5	21%	0.209	11%	0.113	C	C	.	.	H	α-helix	trans	-63	-5.8	178.5	-68.4	-173.7	-176.9	-172.1	0	115	G420 D424 V425 W426 V484 E485 R487	G420-K422 PolarHBondContact O-N 3.27Å; K422-D424 VanDerWaalsContact C-N 3.34Å; K422-V425 PolarHBondContact O-N 3.29Å; K422-W426 PolarHBondContact O-N 3.17Å; K422-V484 HydrophobicContact CB-CG1 4.34Å; K422-V484 HydrophobicContact CD-CG1 4.17Å; K422-V484 WeakPolarHBondContact CD-O 3.42Å; K422-V484 WeakPolarHBondContact CE-O 3.44Å; K422-V484 PolarHBondContact NZ-O 2.94Å; K422-E485 PolarHBondContact NZ-O 3.43Å; K422-R487 HydrophobicContact CD-CB 4.42Å; K422-R487 WeakPolarHBondContact CD-O 3.44Å; K422-R487 WeakPolarHBondContact CE-O 3.48Å; K422-R487 PolarHBondContact NZ-O 3.11Å; K422-R487 WeakPolarHBondContact O-CD 3.21Å; K422-R487 PolarHBondContact O-NH1 2.74Å
423	V	97.2	Very high	94.2	Very high	4 Å²	4	23.1 Å²	23.1	2%	0.024	11%	0.111	C	C	.	.	H	α-helix	trans	-68.6	-33.3	169.5	-59.6	0	0	0	0	112.3	I364 R366 A410 E412 V413 Y419 G420 P421 V425 W426 S427	I364-V423 HydrophobicContact CG2-CG2 3.67Å; R366-V423 HydrophobicContact CG-CG2 4.46Å; A410-V423 HydrophobicContact CB-CB 4.28Å; A410-V423 HydrophobicContact CB-CG1 4.19Å; E412-V423 HydrophobicContact CG-CG1 4.2Å; E412-V423 WeakPolarHBondContact OE1-CG1 3.23Å; V413-V423 HydrophobicContact CG2-CB 4.05Å; V413-V423 HydrophobicContact CG2-CG1 3.43Å; V413-V423 VanDerWaalsContact CG2-CG1 3.43Å; Y419-V423 HydrophobicContact CD2-CB 4.48Å; Y419-V423 HydrophobicContact CD2-CG1 3.61Å; Y419-V423 HydrophobicContact CD2-CG2 4.05Å; Y419-V423 HydrophobicContact CE2-CG2 4.33Å; Y419-V423 HydrophobicContact CG-CG1 3.85Å; G420-V423 WeakPolarHBondContact O-CG2 3.25Å; G420-V423 PolarHBondContact O-N 2.84Å; P421-V423 PolarHBondContact O-N 3.3Å; V423-V425 VanDerWaalsContact C-N 3.27Å; V423-V425 PolarHBondContact O-N 3.45Å; V423-W426 PolarHBondContact O-N 3.06Å; V423-S427 PolarHBondContact O-N 3.42Å; V423-S427 PolarHBondContact O-OG 3.22Å
424	D	98.2	Very high	94.5	Very high	0 Å²	0	22.9 Å²	22.9	0%	0	11%	0.109	C	C	.	.	H	α-helix	trans	-70.1	-29.9	177.6	-62	-27	0	0	0	110.8	L355 H359 I364 H365 R366 I368 P421 K422 S427 L428	L355-D424 HydrophobicContact CD1-CB 4.09Å; L355-D424 HydrophobicContact CD2-CB 3.7Å; H359-D424 IonicContact CD2-OD2 2.72Å; H359-D424 VanDerWaalsContact CE1-CB 3.45Å; H359-D424 WeakPolarHBondContact CE1-CB 3.46Å; H359-D424 WeakPolarHBondContact NE2-CB 3.37Å; H359-D424 IonicContact NE2-OD1 3.46Å; H359-D424 IonicContact NE2-OD2 3.78Å; H359-D424 PolarHBondContact NE2-OD2 2.91Å; I364-D424 WeakPolarHBondContact CG2-OD2 3.08Å; H365-D424 PolarHBondContact N-OD1 3.11Å; H365-D424 PolarHBondContact N-OD2 2.83Å; R366-D424 WeakPolarHBondContact CA-OD1 3.31Å; R366-D424 PolarHBondContact N-OD1 3.5Å; I368-D424 HydrophobicContact CG1-CB 4.01Å; P421-D424 PolarHBondContact O-N 2.89Å; P421-D424 VanDerWaalsContact O-N 3.09Å; K422-D424 VanDerWaalsContact C-N 3.34Å; D424-S427 PolarHBondContact O-N 2.9Å; D424-L428 WeakPolarHBondContact O-CB 3.43Å; D424-L428 PolarHBondContact O-N 3.36Å
425	V	98.7	Very high	94.9	Very high	0 Å²	0	23.2 Å²	23.2	0%	0	11%	0.111	C	C	.	.	H	α-helix	trans	-67.7	-40.6	173.4	170.5	0	0	0	0	111.8	K422 V423 L428 G429 C479 R487 L493	K422-V425 PolarHBondContact O-N 3.29Å; V423-V425 VanDerWaalsContact C-N 3.27Å; V423-V425 PolarHBondContact O-N 3.45Å; V425-L428 PolarHBondContact O-N 3.46Å; V425-G429 PolarHBondContact O-N 2.84Å; V425-C479 HydrophobicContact CG1-CB 4.21Å; V425-R487 HydrophobicContact CG1-CG 4.13Å; V425-L493 HydrophobicContact CB-CD1 4.43Å; V425-L493 HydrophobicContact CG1-CD1 3.4Å; V425-L493 VanDerWaalsContact CG1-CD1 3.4Å; V425-L493 HydrophobicContact CG2-CD1 4.23Å
426	W	98.6	Very high	95.5	Very high	2 Å²	2	22.9 Å²	22.9	1%	0.008	11%	0.109	C	C	.	.	H	α-helix	trans	-61.7	-47.7	172.5	177.6	-79.6	0	0	0	110.9	M409 A410 P411 K422 V423 L428 G429 I430 G458 L480 V482	M409-W426 PolarHBondContact O-NE1 3.33Å; A410-W426 VanDerWaalsContact CA-CD1 3.48Å; A410-W426 HydrophobicContact CB-CB 3.69Å; A410-W426 HydrophobicContact CB-CD2 4.1Å; A410-W426 HydrophobicContact CB-CG 3.59Å; P411-W426 HydrophobicContact CG-CE3 4.39Å; P411-W426 HydrophobicContact CG-CH2 3.49Å; P411-W426 VanDerWaalsContact CG-CH2 3.49Å; P411-W426 HydrophobicContact CG-CZ2 3.74Å; P411-W426 HydrophobicContact CG-CZ3 3.83Å; K422-W426 PolarHBondContact O-N 3.17Å; V423-W426 PolarHBondContact O-N 3.06Å; W426-L428 VanDerWaalsContact C-N 3.3Å; W426-L428 PolarHBondContact O-N 2.88Å; W426-G429 WeakPolarHBondContact O-CA 3.35Å; W426-G429 PolarHBondContact O-N 3.17Å; W426-I430 PolarHBondContact O-N 3.29Å; W426-G458 WeakPolarHBondContact CH2-O 3.35Å; W426-L480 HydrophobicContact CD2-CD2 3.69Å; W426-L480 HydrophobicContact CE3-CB 4.36Å; W426-L480 HydrophobicContact CE3-CD2 4.02Å; W426-L480 HydrophobicContact CG-CD2 4.03Å; W426-L480 HydrophobicContact CH2-CB 4.44Å; W426-L480 HydrophobicContact CZ2-CD2 4.21Å; W426-L480 VanDerWaalsContact CZ3-C 3.5Å; W426-L480 HydrophobicContact CZ3-CB 4.17Å; W426-L480 HydrophobicContact CZ3-CD2 4.43Å; W426-L480 WeakPolarHBondContact CZ3-O 3.4Å; W426-L480 WeakPolarHBondContact O-CD2 3.35Å; W426-V482 HydrophobicContact CH2-CG2 4.35Å; W426-V482 HydrophobicContact CZ3-CG2 4.25Å
427	S	98.5	Very high	96.1	Very high	6 Å²	6	20.2 Å²	20.2	4%	0.042	10%	0.1	C	C	.	.	H	α-helix	trans	-60.7	-38.7	-179.9	-52.7	0	0	0	0	111.7	I368 W408 V423 D424 I430 M431	I368-S427 WeakPolarHBondContact O-CB 3.16Å; W408-S427 PolarHBondContact O-OG 3.27Å; W408-S427 VanDerWaalsContact O-OG 3.05Å; V423-S427 PolarHBondContact O-N 3.42Å; V423-S427 PolarHBondContact O-OG 3.22Å; D424-S427 PolarHBondContact O-N 2.9Å; S427-I430 PolarHBondContact O-N 3.19Å; S427-M431 PolarHBondContact O-N 2.68Å
428	L	98.7	Very high	96.5	Very high	0 Å²	0	14 Å²	14	0%	0	7%	0.073	C	C	.	.	H	α-helix	trans	-60.6	-40.9	168.6	170.6	66.4	0	0	0	112.5	V351 L352 I368 D424 V425 W426 I430 M431 A432	V351-L428 HydrophobicContact CB-CD1 4.43Å; V351-L428 HydrophobicContact CG1-CD1 4.1Å; L352-L428 HydrophobicContact CD1-CD2 4.19Å; L352-L428 HydrophobicContact CD2-CD2 3.44Å; L352-L428 VanDerWaalsContact CD2-CD2 3.44Å; L352-L428 HydrophobicContact CG-CD2 3.56Å; I368-L428 HydrophobicContact CG2-CB 4.45Å; D424-L428 WeakPolarHBondContact O-CB 3.43Å; D424-L428 PolarHBondContact O-N 3.36Å; V425-L428 PolarHBondContact O-N 3.46Å; W426-L428 VanDerWaalsContact C-N 3.3Å; W426-L428 PolarHBondContact O-N 2.88Å; L428-I430 VanDerWaalsContact C-N 3.32Å; L428-I430 PolarHBondContact O-N 3.45Å; L428-M431 HydrophobicContact CD1-CE 3.63Å; L428-M431 CarbonylContact O-C 3.56Å; L428-M431 PolarHBondContact O-N 3.44Å; L428-A432 WeakPolarHBondContact O-CB 3.35Å; L428-A432 PolarHBondContact O-N 3.34Å
429	G	98.6	Very high	96.9	Very high	0 Å²	0	10.1 Å²	10.1	0%	0	6%	0.055	C	C	.	.	H	α-helix	trans	-62.1	-37.9	174.8	0	0	0	0	0	112.9	V425 W426 A432 I433	V425-G429 PolarHBondContact O-N 2.84Å; W426-G429 WeakPolarHBondContact O-CA 3.35Å; W426-G429 PolarHBondContact O-N 3.17Å; G429-A432 PolarHBondContact O-N 3.46Å; G429-I433 PolarHBondContact O-N 3.47Å
430	I	98.5	Very high	97.2	Very high	4 Å²	4	10 Å²	10	2%	0.021	6%	0.055	C	C	.	.	H	α-helix	trans	-67.7	-43.2	172.8	-59.4	-59	0	0	0	110.9	W408 W426 S427 L428 A432 I433 E434 P440 P441 P460 L480	W408-I430 HydrophobicContact CB-CB 4.48Å; W408-I430 HydrophobicContact CB-CG2 4.38Å; W408-I430 VanDerWaalsContact CD1-CG2 3.47Å; W408-I430 HydrophobicContact CD2-CG2 4.42Å; W408-I430 HydrophobicContact CG-CB 4.26Å; W408-I430 HydrophobicContact CG-CG2 3.83Å; W426-I430 PolarHBondContact O-N 3.29Å; S427-I430 PolarHBondContact O-N 3.19Å; L428-I430 VanDerWaalsContact C-N 3.32Å; L428-I430 PolarHBondContact O-N 3.45Å; I430-A432 PolarHBondContact O-N 3.37Å; I430-I433 WeakPolarHBondContact O-CB 3.45Å; I430-I433 PolarHBondContact O-N 2.93Å; I430-I433 VanDerWaalsContact O-N 3.11Å; I430-E434 PolarHBondContact O-N 3.29Å; I430-P440 HydrophobicContact CG2-CB 3.61Å; I430-P441 HydrophobicContact CD1-CG 4.46Å; I430-P460 HydrophobicContact CD1-CG 3.81Å; I430-L480 HydrophobicContact CD1-CD1 4.26Å; I430-L480 HydrophobicContact CD1-CD2 3.76Å; I430-L480 HydrophobicContact CG1-CD2 4.03Å
431	M	98.4	Very high	97.3	Very high	0 Å²	0	10.3 Å²	10.3	0%	0	5%	0.054	C	C	.	.	H	α-helix	trans	-63.7	-26.7	174.3	-167	-176.2	68.4	0	0	112.7	L330 V351 I368 K369 I373 S427 L428 E434 M435	L330-M431 HydrophobicContact CD2-CE 4.49Å; L330-M431 HydrophobicContact CD2-CG 4.41Å; L330-M431 HydrophobicContact CD2-SD 4.04Å; V351-M431 HydrophobicContact CG1-CE 4.32Å; V351-M431 HydrophobicContact CG2-CE 4.2Å; I368-M431 HydrophobicContact CG2-CE 4.47Å; I368-M431 HydrophobicContact CG2-SD 4.34Å; K369-M431 VanDerWaalsContact C-SD 3.52Å; I373-M431 HydrophobicContact CD1-SD 4.39Å; I373-M431 HydrophobicContact CG1-CE 4.11Å; I373-M431 HydrophobicContact CG1-SD 3.55Å; I373-M431 VanDerWaalsContact CG1-SD 3.55Å; S427-M431 PolarHBondContact O-N 2.68Å; L428-M431 HydrophobicContact CD1-CE 3.63Å; L428-M431 CarbonylContact O-C 3.56Å; L428-M431 PolarHBondContact O-N 3.44Å; M431-E434 WeakPolarHBondContact O-CB 3.37Å; M431-E434 PolarHBondContact O-N 3.48Å; M431-M435 HydrophobicContact CE-CE 4.24Å; M431-M435 WeakPolarHBondContact O-CG 3.39Å; M431-M435 PolarHBondContact O-N 3.04Å
432	A	98.6	Very high	97.2	Very high	0 Å²	0	11 Å²	11	0%	0	5%	0.053	C	C	.	.	H	α-helix	trans	-73.4	-34.3	172.6	0	0	0	0	0	112.7	L428 G429 I430 V436 F472 I476	L428-A432 WeakPolarHBondContact O-CB 3.35Å; L428-A432 PolarHBondContact O-N 3.34Å; G429-A432 PolarHBondContact O-N 3.46Å; I430-A432 PolarHBondContact O-N 3.37Å; A432-V436 WeakPolarHBondContact O-CG2 3.48Å; A432-F472 HydrophobicContact CB-CE2 4.28Å; A432-I476 HydrophobicContact CB-CG1 4.33Å
433	I	98	Very high	97	Very high	1 Å²	1	9.9 Å²	9.9	1%	0.005	5%	0.049	C	C	.	.	H	α-helix	trans	-66.7	-41.4	167.9	-66	168	0	0	0	110	G429 I430 M435 V436 E437 P441 P460 F462 I476 L480	G429-I433 PolarHBondContact O-N 3.47Å; I430-I433 WeakPolarHBondContact O-CB 3.45Å; I430-I433 PolarHBondContact O-N 2.93Å; I430-I433 VanDerWaalsContact O-N 3.11Å; I433-M435 VanDerWaalsContact C-N 3.31Å; I433-M435 PolarHBondContact O-N 2.89Å; I433-V436 CarbonylContact O-C 3.57Å; I433-V436 WeakPolarHBondContact O-CA 3.47Å; I433-V436 WeakPolarHBondContact O-CB 3.36Å; I433-V436 PolarHBondContact O-N 3.22Å; I433-E437 HydrophobicContact CG2-CB 4.43Å; I433-E437 HydrophobicContact CG2-CG 3.99Å; I433-E437 PolarHBondContact O-N 2.83Å; I433-P441 HydrophobicContact CD1-CG 4.08Å; I433-P441 HydrophobicContact CG2-CG 4.11Å; I433-P460 HydrophobicContact CD1-CG 4.05Å; I433-F462 HydrophobicContact CD1-CD1 3.74Å; I433-F462 HydrophobicContact CD1-CE1 3.96Å; I433-F462 HydrophobicContact CD1-CG 4.49Å; I433-F462 HydrophobicContact CG1-CD1 3.82Å; I433-F462 HydrophobicContact CG1-CE1 3.79Å; I433-F462 HydrophobicContact CG1-CG 4.32Å; I433-F462 HydrophobicContact CG1-CZ 4.24Å; I433-F462 HydrophobicContact CG2-CB 4.04Å; I433-F462 HydrophobicContact CG2-CD1 4.29Å; I433-F462 HydrophobicContact CG2-CD2 4.34Å; I433-F462 HydrophobicContact CG2-CG 3.99Å; I433-I476 HydrophobicContact CD1-CG2 4.47Å; I433-I476 HydrophobicContact CG1-CG2 4.33Å; I433-L480 HydrophobicContact CD1-CD1 3.52Å; I433-L480 HydrophobicContact CG1-CD1 4.45Å
434	E	97.4	Very high	96.7	Very high	1 Å²	1	15.3 Å²	15.3	1%	0.005	8%	0.078	C	C	.	.	H	α-helix	trans	-59.9	-37.4	177	-173.6	-179.1	-166.6	0	0	112.5	V334 S370 W408 I430 M431 V436 G438	V334-E434 HydrophobicContact CG2-CG 4.11Å; S370-E434 VanDerWaalsContact CB-OE1 3.24Å; S370-E434 WeakPolarHBondContact CB-OE1 3.44Å; S370-E434 VanDerWaalsContact OG-CD 3.22Å; S370-E434 PolarHBondContact OG-OE1 3.1Å; S370-E434 PolarHBondContact OG-OE2 3.35Å; W408-E434 WeakPolarHBondContact CZ2-OE1 3.45Å; W408-E434 WeakPolarHBondContact CZ2-OE2 3.14Å; W408-E434 PolarHBondContact NE1-OE2 1.9Å; I430-E434 PolarHBondContact O-N 3.29Å; M431-E434 WeakPolarHBondContact O-CB 3.37Å; M431-E434 PolarHBondContact O-N 3.48Å; E434-V436 PolarHBondContact O-N 3.33Å; E434-G438 WeakPolarHBondContact O-CA 3.17Å; E434-G438 PolarHBondContact O-N 3.47Å
435	M	98.2	Very high	96.3	Very high	7 Å²	7	17.4 Å²	17.4	3%	0.034	9%	0.088	C	C	.	.	H	α-helix	trans	-68.4	-12.9	171.9	-74.6	-175.5	-83.7	0	0	114.7	L330 V334 M339 I344 V347 M431 I433	L330-M435 HydrophobicContact CD2-CG 4.35Å; L330-M435 HydrophobicContact CD2-SD 4.09Å; V334-M435 HydrophobicContact CG1-CB 4.26Å; V334-M435 HydrophobicContact CG1-CG 3.63Å; M339-M435 HydrophobicContact CE-SD 4.04Å; M339-M435 HydrophobicContact SD-CB 4.08Å; M339-M435 HydrophobicContact SD-CG 3.77Å; M339-M435 HydrophobicContact SD-SD 3.99Å; I344-M435 HydrophobicContact CB-SD 4.41Å; I344-M435 HydrophobicContact CD1-CB 3.99Å; I344-M435 HydrophobicContact CG1-CB 3.96Å; I344-M435 HydrophobicContact CG1-SD 4.39Å; I344-M435 HydrophobicContact CG2-CB 4.19Å; I344-M435 HydrophobicContact CG2-CE 3.87Å; I344-M435 HydrophobicContact CG2-SD 4Å; V347-M435 HydrophobicContact CB-CE 4.41Å; V347-M435 HydrophobicContact CB-SD 3.94Å; V347-M435 HydrophobicContact CG1-CE 4.06Å; V347-M435 HydrophobicContact CG1-SD 3.83Å; V347-M435 HydrophobicContact CG2-SD 4.4Å; M431-M435 HydrophobicContact CE-CE 4.24Å; M431-M435 WeakPolarHBondContact O-CG 3.39Å; M431-M435 PolarHBondContact O-N 3.04Å; I433-M435 VanDerWaalsContact C-N 3.31Å; I433-M435 PolarHBondContact O-N 2.89Å
436	V	97.3	Very high	95.7	Very high	25 Å²	25	20 Å²	20	15%	0.152	10%	0.102	C	C	.	.	H	α-helix	trans	-100.9	-47.4	177.6	173.7	0	0	0	0	111.6	I344 A432 I433 E434 F462 L468 F472	I344-V436 HydrophobicContact CD1-CG2 3.91Å; A432-V436 WeakPolarHBondContact O-CG2 3.48Å; I433-V436 CarbonylContact O-C 3.57Å; I433-V436 WeakPolarHBondContact O-CA 3.47Å; I433-V436 WeakPolarHBondContact O-CB 3.36Å; I433-V436 PolarHBondContact O-N 3.22Å; E434-V436 PolarHBondContact O-N 3.33Å; V436-F462 HydrophobicContact CG1-CE2 4.41Å; V436-L468 HydrophobicContact CG1-CD2 4.05Å; V436-L468 HydrophobicContact CG2-CD1 4.37Å; V436-L468 HydrophobicContact CG2-CD2 4.13Å; V436-F472 HydrophobicContact CG2-CE1 3.5Å; V436-F472 HydrophobicContact CG2-CZ 3.74Å
437	E	95.2	Very high	95.3	Very high	22 Å²	22	21 Å²	21	10%	0.103	11%	0.109	C	C	.	.	H	α-helix	trans	-98	-13.7	-173.8	-61.3	-73.3	-169.8	0	0	112.9	R188 I433 E439 F462 Q463 S464	R188-E437 PolarHBondContact NH2-O 3.11Å; I433-E437 HydrophobicContact CG2-CB 4.43Å; I433-E437 HydrophobicContact CG2-CG 3.99Å; I433-E437 PolarHBondContact O-N 2.83Å; E437-E439 PolarHBondContact O-N 3Å; E437-F462 HydrophobicContact CG-CB 4.18Å; E437-F462 HydrophobicContact CG-CD2 4.09Å; E437-F462 WeakPolarHBondContact OE1-CD2 3.22Å; E437-Q463 WeakPolarHBondContact OE1-CA 3.5Å; E437-Q463 PolarHBondContact OE1-N 3.16Å; E437-S464 PolarHBondContact OE1-N 3.3Å
438	G	93.9	Very high	94.8	Very high	0 Å²	0	20.8 Å²	20.8	0%	0	11%	0.107	C	C	.	.	S	Bend	trans	77.1	-3.6	-177.3	0	0	0	0	0	116	R188 V334 E434	R188-G438 VanDerWaalsContact NH2-N 3.12Å; V334-G438 VanDerWaalsContact O-CA 3.27Å; V334-G438 WeakPolarHBondContact O-CA 3.24Å; E434-G438 WeakPolarHBondContact O-CA 3.17Å; E434-G438 PolarHBondContact O-N 3.47Å
439	E	94.3	Very high	94.4	Very high	47 Å²	47	22.6 Å²	22.6	22%	0.22	11%	0.114	C	C	.	.	S	Bend	trans	-146.9	151.5	173.3	48.9	-179	-130.4	0	0	109.9	S194 V195 E437 L443	S194-E439 WeakPolarHBondContact CA-OE2 3.24Å; V195-E439 PolarHBondContact N-OE2 3.44Å; E437-E439 PolarHBondContact O-N 3Å; E439-L443 HydrophobicContact CB-CB 4.25Å; E439-L443 HydrophobicContact CB-CD2 3.58Å; E439-L443 HydrophobicContact CG-CD2 4.48Å
440	P	96.3	Very high	94.1	Very high	1 Å²	1	22.6 Å²	22.6	1%	0.006	11%	0.114	C	C	.	.			trans	-68.6	156.8	172.2	32.8	-39.1	0	0	0	110.7	Y407 W408 I430 Y442 L443	Y407-P440 HydrophobicContact CG-CG 4.46Å; W408-P440 HydrophobicContact CD2-CB 4.38Å; W408-P440 HydrophobicContact CH2-CB 4.44Å; W408-P440 HydrophobicContact CH2-CG 3.65Å; W408-P440 HydrophobicContact CZ2-CB 4.05Å; W408-P440 HydrophobicContact CZ2-CG 3.65Å; W408-P440 HydrophobicContact CZ3-CG 4.07Å; I430-P440 HydrophobicContact CG2-CB 3.61Å; P440-Y442 PolarHBondContact O-N 3.41Å; P440-L443 HydrophobicContact CG-CB 4.22Å; P440-L443 HydrophobicContact CG-CD1 4.26Å; P440-L443 PolarHBondContact O-N 3.27Å
441	P	95.7	Very high	93.7	Very high	16 Å²	16	22.5 Å²	22.5	10%	0.104	11%	0.113	C	C	.	.	T	Hydrogen-bonded Turn	trans	-53.4	140.5	172.9	-26.4	36.6	0	0	0	112.4	I430 I433 L443 P460	I430-P441 HydrophobicContact CD1-CG 4.46Å; I433-P441 HydrophobicContact CD1-CG 4.08Å; I433-P441 HydrophobicContact CG2-CG 4.11Å; P441-L443 VanDerWaalsContact C-N 3.29Å; P441-L443 PolarHBondContact O-N 3.26Å; P441-P460 HydrophobicContact CB-CB 3.74Å; P441-P460 HydrophobicContact CB-CG 4.31Å; P441-P460 HydrophobicContact CG-CB 3.71Å; P441-P460 HydrophobicContact CG-CG 3.83Å
442	Y	94.3	Very high	93.4	Very high	48 Å²	48	22.8 Å²	22.8	19%	0.188	11%	0.114	C	C	.	.	T	Hydrogen-bonded Turn	trans	66.3	16.4	177.8	-36.6	-58.4	0	0	0	115.5	Y407 P440 N444 E445 L453 I454 N457 P460	Y407-Y442 WeakPolarHBondContact CE1-O 3.37Å; P440-Y442 PolarHBondContact O-N 3.41Å; Y442-N444 PolarHBondContact O-N 3.39Å; Y442-E445 WeakPolarHBondContact O-CA 3.42Å; Y442-E445 WeakPolarHBondContact O-CB 3.46Å; Y442-E445 PolarHBondContact O-N 3.37Å; Y442-L453 HydrophobicContact CD1-CD1 3.83Å; Y442-L453 HydrophobicContact CD2-CB 4.32Å; Y442-L453 HydrophobicContact CE1-CB 4.47Å; Y442-L453 HydrophobicContact CE1-CD1 4.24Å; Y442-L453 HydrophobicContact CE2-CB 4.2Å; Y442-L453 HydrophobicContact CG-CD1 4.11Å; Y442-I454 HydrophobicContact CD2-CG1 4.2Å; Y442-I454 HydrophobicContact CE2-CG1 4.18Å; Y442-N457 PolarHBondContact OH-ND2 3.32Å; Y442-P460 HydrophobicContact CE2-CB 4.29Å
443	L	92.5	Very high	93.2	Very high	23 Å²	23	23.5 Å²	23.5	12%	0.12	12%	0.118	C	C	.	.	T	Hydrogen-bonded Turn	trans	-55.8	-34.6	177.5	-175.2	66.1	0	0	0	113.1	V195 Y196 Y407 E439 P440 P441 E445	V195-L443 HydrophobicContact CB-CD2 4.41Å; Y196-L443 HydrophobicContact CD2-CD2 4.17Å; Y196-L443 HydrophobicContact CE1-CD2 4.25Å; Y196-L443 HydrophobicContact CE2-CD2 3.49Å; Y196-L443 VanDerWaalsContact CE2-CD2 3.49Å; Y196-L443 WeakPolarHBondContact OH-CD1 3.39Å; Y407-L443 HydrophobicContact CD2-CD1 4.25Å; Y407-L443 HydrophobicContact CE2-CD1 4.18Å; E439-L443 HydrophobicContact CB-CB 4.25Å; E439-L443 HydrophobicContact CB-CD2 3.58Å; E439-L443 HydrophobicContact CG-CD2 4.48Å; P440-L443 HydrophobicContact CG-CB 4.22Å; P440-L443 HydrophobicContact CG-CD1 4.26Å; P440-L443 PolarHBondContact O-N 3.27Å; P441-L443 VanDerWaalsContact C-N 3.29Å; P441-L443 PolarHBondContact O-N 3.26Å; L443-E445 PolarHBondContact O-N 2.79Å
444	N	90.1	Very high	93	Very high	119 Å²	119	23.7 Å²	23.7	64%	0.636	12%	0.119	S	C	*	.	T	Hydrogen-bonded Turn	trans	-71.1	-12.8	175.5	69	-44.5	0	0	0	114.3	Y442	Y442-N444 PolarHBondContact O-N 3.39Å
445	E	90.4	Very high	92.8	Very high	43 Å²	43	24.9 Å²	24.9	20%	0.201	13%	0.129	C	C	.	.	S	Bend	trans	-91.8	148.7	176.1	-64.5	-82.3	-148.7	0	0	110.3	Y407 Y442 L443 R449 L453	Y407-E445 PolarHBondContact OH-O 2.84Å; Y442-E445 WeakPolarHBondContact O-CA 3.42Å; Y442-E445 WeakPolarHBondContact O-CB 3.46Å; Y442-E445 PolarHBondContact O-N 3.37Å; L443-E445 PolarHBondContact O-N 2.79Å; E445-R449 HydrophobicContact CB-CB 4.39Å; E445-R449 HydrophobicContact CB-CG 4.37Å; E445-R449 IonicContact OE1-CZ 2.69Å; E445-R449 VanDerWaalsContact OE1-CZ 3.31Å; E445-R449 IonicContact OE1-NE 3.68Å; E445-R449 PolarHBondContact OE1-NE 3.03Å; E445-R449 IonicContact OE1-NH2 2.98Å; E445-R449 PolarHBondContact OE1-NH2 3.17Å; E445-R449 WeakPolarHBondContact OE2-CD 3.4Å; E445-R449 IonicContact OE2-NE 3Å; E445-R449 PolarHBondContact OE2-NE 3.01Å; E445-L453 HydrophobicContact CG-CD1 4.02Å
446	N	87	Confident	92.5	Very high	56 Å²	56	26.5 Å²	26.5	30%	0.299	14%	0.139	S	C	.	.			trans	-64.9	150.9	175.2	101.1	-2.9	0	0	0	110.3	Q106 S107 L448 R449 A450	Q106-N446 PolarHBondContact O-ND2 3.15Å; Q106-N446 VanDerWaalsContact O-ND2 3.16Å; S107-N446 WeakPolarHBondContact CA-ND2 3.34Å; N446-L448 PolarHBondContact O-N 3.16Å; N446-L448 WeakPolarHBondContact OD1-CB 3.44Å; N446-L448 PolarHBondContact OD1-N 3.33Å; N446-L448 VanDerWaalsContact OD1-N 3.08Å; N446-R449 PolarHBondContact O-N 3.05Å; N446-R449 PolarHBondContact OD1-N 3Å; N446-A450 PolarHBondContact O-N 3.41Å
447	P	88.6	Confident	92.4	Very high	23 Å²	23	29.4 Å²	29.4	15%	0.149	15%	0.154	C	C	.	.	H	α-helix	trans	-69.1	-12.4	-168.7	10.1	-13.1	0	0	0	114.6	F128 P406 Y407 I451	F128-P447 HydrophobicContact CE2-CB 3.94Å; F128-P447 HydrophobicContact CE2-CG 3.82Å; F128-P447 HydrophobicContact CZ-CG 4.06Å; P406-P447 HydrophobicContact CB-CB 3.86Å; P406-P447 HydrophobicContact CG-CB 3.67Å; Y407-P447 HydrophobicContact CE2-CB 4.49Å; P447-I451 WeakPolarHBondContact O-CB 3.47Å; P447-I451 WeakPolarHBondContact O-CD1 3.32Å; P447-I451 VanDerWaalsContact O-CG1 3.22Å; P447-I451 WeakPolarHBondContact O-CG1 3.43Å; P447-I451 PolarHBondContact O-N 3.04Å
448	L	88.4	Confident	92.3	Very high	1 Å²	1	28.7 Å²	28.7	1%	0.005	15%	0.153	C	C	.	.	H	α-helix	trans	-75.5	-45.9	170.4	-159.3	160.7	0	0	0	110	L103 I109 A124 L125 F128 N446 I451 Y452	L103-L448 HydrophobicContact CB-CD1 4.02Å; I109-L448 HydrophobicContact CD1-CD2 3.63Å; A124-L448 HydrophobicContact CB-CD2 3.73Å; A124-L448 HydrophobicContact CB-CG 4.25Å; L125-L448 HydrophobicContact CD2-CD1 4.07Å; F128-L448 HydrophobicContact CB-CD1 3.91Å; F128-L448 HydrophobicContact CB-CG 4.32Å; F128-L448 HydrophobicContact CD2-CB 3.65Å; F128-L448 HydrophobicContact CD2-CD1 4.19Å; F128-L448 HydrophobicContact CD2-CG 4.05Å; F128-L448 HydrophobicContact CE2-CB 3.91Å; F128-L448 HydrophobicContact CG-CB 4.28Å; F128-L448 HydrophobicContact CG-CD1 3.96Å; F128-L448 HydrophobicContact CG-CG 4.3Å; N446-L448 PolarHBondContact O-N 3.16Å; N446-L448 WeakPolarHBondContact OD1-CB 3.44Å; N446-L448 PolarHBondContact OD1-N 3.33Å; N446-L448 VanDerWaalsContact OD1-N 3.08Å; L448-I451 PolarHBondContact O-N 2.91Å; L448-Y452 PolarHBondContact O-N 3.15Å
449	R	90.6	Very high	92.4	Very high	38 Å²	38	31.5 Å²	31.5	14%	0.143	17%	0.165	C	C	.	.	H	α-helix	trans	-65.2	-42.9	176	-173.4	154	158.9	79.3	25.6	112.1	S107 M108 I109 E113 E445 N446 I451 Y452 L453	S107-R449 WeakPolarHBondContact O-CB 3.44Å; S107-R449 WeakPolarHBondContact O-CD 3.36Å; M108-R449 PolarHBondContact O-NH1 3.24Å; I109-R449 HydrophobicContact CG1-CB 4.47Å; I109-R449 HydrophobicContact CG1-CG 4.38Å; E113-R449 IonicContact OE1-CZ 3.71Å; E113-R449 IonicContact OE1-NH1 3.67Å; E113-R449 PolarHBondContact OE1-NH1 2.93Å; E113-R449 IonicContact OE1-NH2 2.69Å; E113-R449 IonicContact OE2-NH1 2.69Å; E113-R449 PolarHBondContact OE2-NH1 3.3Å; E445-R449 HydrophobicContact CB-CB 4.39Å; E445-R449 HydrophobicContact CB-CG 4.37Å; E445-R449 IonicContact OE1-CZ 2.69Å; E445-R449 VanDerWaalsContact OE1-CZ 3.31Å; E445-R449 IonicContact OE1-NE 3.68Å; E445-R449 PolarHBondContact OE1-NE 3.03Å; E445-R449 IonicContact OE1-NH2 2.98Å; E445-R449 PolarHBondContact OE1-NH2 3.17Å; E445-R449 WeakPolarHBondContact OE2-CD 3.4Å; E445-R449 IonicContact OE2-NE 3Å; E445-R449 PolarHBondContact OE2-NE 3.01Å; N446-R449 PolarHBondContact O-N 3.05Å; N446-R449 PolarHBondContact OD1-N 3Å; R449-I451 VanDerWaalsContact C-N 3.3Å; R449-I451 PolarHBondContact O-N 2.83Å; R449-Y452 WeakPolarHBondContact O-CB 3.23Å; R449-Y452 PolarHBondContact O-N 2.77Å; R449-L453 HydrophobicContact CG-CD1 4.08Å; R449-L453 HydrophobicContact CG-CG 4.4Å; R449-L453 VanDerWaalsContact O-CG 3.29Å; R449-L453 WeakPolarHBondContact O-CG 3.5Å; R449-L453 PolarHBondContact O-N 2.86Å
450	A	91.7	Very high	92.4	Very high	0 Å²	0	29.4 Å²	29.4	0%	0	16%	0.156	C	C	.	.	H	α-helix	trans	-56.6	-43.8	173.6	0	0	0	0	0	111.8	Y407 N446 L453 I454	Y407-A450 HydrophobicContact CD1-CB 3.69Å; Y407-A450 HydrophobicContact CE1-CB 3.52Å; N446-A450 PolarHBondContact O-N 3.41Å; A450-L453 PolarHBondContact O-N 3.33Å; A450-I454 WeakPolarHBondContact O-CD1 3.5Å; A450-I454 VanDerWaalsContact O-CG1 3.24Å; A450-I454 WeakPolarHBondContact O-CG1 3.07Å; A450-I454 PolarHBondContact O-N 3.43Å
451	I	91.1	Very high	92.3	Very high	1 Å²	1	35.2 Å²	35.2	1%	0.005	18%	0.183	C	C	.	.	H	α-helix	trans	-65.6	-40.1	177.2	-75.5	172.1	0	0	0	112.4	A124 Y127 P406 V414 P447 L448 R449 A455	A124-I451 HydrophobicContact CB-CB 4.37Å; A124-I451 HydrophobicContact CB-CG2 3.79Å; Y127-I451 HydrophobicContact CD1-CD1 3.07Å; Y127-I451 HydrophobicContact CD2-CD1 4.15Å; Y127-I451 HydrophobicContact CE1-CD1 3.32Å; Y127-I451 HydrophobicContact CE2-CD1 4.3Å; Y127-I451 HydrophobicContact CG-CD1 3.5Å; Y127-I451 VanDerWaalsContact CG-CD1 3.5Å; P406-I451 HydrophobicContact CB-CD1 4.09Å; P406-I451 HydrophobicContact CB-CG1 4.15Å; P406-I451 HydrophobicContact CG-CD1 4.33Å; V414-I451 HydrophobicContact CB-CG2 3.95Å; V414-I451 HydrophobicContact CG1-CB 4.4Å; V414-I451 HydrophobicContact CG1-CG1 4.06Å; V414-I451 HydrophobicContact CG1-CG2 3.86Å; P447-I451 WeakPolarHBondContact O-CB 3.47Å; P447-I451 WeakPolarHBondContact O-CD1 3.32Å; P447-I451 VanDerWaalsContact O-CG1 3.22Å; P447-I451 WeakPolarHBondContact O-CG1 3.43Å; P447-I451 PolarHBondContact O-N 3.04Å; L448-I451 PolarHBondContact O-N 2.91Å; R449-I451 VanDerWaalsContact C-N 3.3Å; R449-I451 PolarHBondContact O-N 2.83Å; I451-A455 WeakPolarHBondContact O-CB 3.47Å; I451-A455 PolarHBondContact O-N 3.01Å
452	Y	92.5	Very high	92.2	Very high	6 Å²	6	35.6 Å²	35.6	2%	0.024	18%	0.183	C	C	.	.	H	α-helix	trans	-59.7	-49.3	171.5	168.4	-94.4	0	0	0	111.2	I109 E113 N117 A120 V121 L448 R449 I454 A455 T456	I109-Y452 HydrophobicContact CD1-CD1 4.29Å; I109-Y452 HydrophobicContact CD1-CD2 4.25Å; I109-Y452 HydrophobicContact CD1-CG 3.81Å; I109-Y452 HydrophobicContact CG1-CD1 4.34Å; I109-Y452 HydrophobicContact CG1-CG 4.35Å; I109-Y452 HydrophobicContact CG2-CD1 4.43Å; I109-Y452 HydrophobicContact CG2-CD2 4.49Å; I109-Y452 HydrophobicContact CG2-CE1 4.39Å; I109-Y452 HydrophobicContact CG2-CE2 4.42Å; E113-Y452 HydrophobicContact CB-CE1 4.1Å; E113-Y452 WeakPolarHBondContact CB-OH 3.17Å; E113-Y452 HydrophobicContact CG-CE1 4.16Å; E113-Y452 PolarHBondContact O-OH 3.22Å; N117-Y452 HydrophobicContact CB-CE2 4.02Å; N117-Y452 PolarHBondContact ND2-OH 3.23Å; A120-Y452 HydrophobicContact CB-CD2 3.88Å; A120-Y452 HydrophobicContact CB-CE2 4.04Å; V121-Y452 HydrophobicContact CG2-CD2 3.7Å; V121-Y452 HydrophobicContact CG2-CE2 3.7Å; L448-Y452 PolarHBondContact O-N 3.15Å; R449-Y452 WeakPolarHBondContact O-CB 3.23Å; R449-Y452 PolarHBondContact O-N 2.77Å; Y452-I454 PolarHBondContact O-N 3.02Å; Y452-A455 PolarHBondContact O-N 3.09Å; Y452-A455 VanDerWaalsContact O-N 3.15Å; Y452-T456 HydrophobicContact CD2-CG2 4.1Å; Y452-T456 HydrophobicContact CE1-CG2 4.22Å; Y452-T456 HydrophobicContact CE2-CG2 3.62Å; Y452-T456 WeakPolarHBondContact O-CG2 3.19Å; Y452-T456 PolarHBondContact O-N 3.13Å; Y452-T456 PolarHBondContact O-OG1 3.33Å
453	L	94	Very high	92	Very high	15 Å²	15	40.3 Å²	40.3	8%	0.079	21%	0.207	C	C	.	.	H	α-helix	trans	-61.3	-43	179.7	-68.5	169.6	0	0	0	112.4	Y442 E445 R449 A450 A455 T456 N457	Y442-L453 HydrophobicContact CD1-CD1 3.83Å; Y442-L453 HydrophobicContact CD2-CB 4.32Å; Y442-L453 HydrophobicContact CE1-CB 4.47Å; Y442-L453 HydrophobicContact CE1-CD1 4.24Å; Y442-L453 HydrophobicContact CE2-CB 4.2Å; Y442-L453 HydrophobicContact CG-CD1 4.11Å; E445-L453 HydrophobicContact CG-CD1 4.02Å; R449-L453 HydrophobicContact CG-CD1 4.08Å; R449-L453 HydrophobicContact CG-CG 4.4Å; R449-L453 VanDerWaalsContact O-CG 3.29Å; R449-L453 WeakPolarHBondContact O-CG 3.5Å; R449-L453 PolarHBondContact O-N 2.86Å; A450-L453 PolarHBondContact O-N 3.33Å; L453-A455 VanDerWaalsContact C-N 3.33Å; L453-A455 PolarHBondContact O-N 2.82Å; L453-T456 PolarHBondContact O-N 3.15Å; L453-T456 PolarHBondContact O-OG1 3.29Å; L453-N457 WeakPolarHBondContact O-CB 3.35Å; L453-N457 PolarHBondContact O-N 2.91Å; L453-N457 PolarHBondContact O-ND2 3.16Å
454	I	94	Very high	92	Very high	6 Å²	6	39.7 Å²	39.7	3%	0.031	20%	0.204	C	C	.	.	H	α-helix	trans	-61	-43	174.6	-67.9	162.7	0	0	0	110.5	P406 P411 V414 Y442 A450 Y452 G458	P406-I454 WeakPolarHBondContact O-CD1 3.13Å; P411-I454 HydrophobicContact CG-CG2 4.29Å; V414-I454 HydrophobicContact CG2-CG2 3.88Å; Y442-I454 HydrophobicContact CD2-CG1 4.2Å; Y442-I454 HydrophobicContact CE2-CG1 4.18Å; A450-I454 WeakPolarHBondContact O-CD1 3.5Å; A450-I454 VanDerWaalsContact O-CG1 3.24Å; A450-I454 WeakPolarHBondContact O-CG1 3.07Å; A450-I454 PolarHBondContact O-N 3.43Å; Y452-I454 PolarHBondContact O-N 3.02Å; I454-G458 PolarHBondContact O-N 2.69Å; I454-G458 VanDerWaalsContact O-N 3.16Å
455	A	92.5	Very high	92.2	Very high	25 Å²	25	35.7 Å²	35.7	21%	0.207	18%	0.18	C	C	.	.	H	α-helix	trans	-68.5	-32.5	179.6	0	0	0	0	0	113.5	A120 V414 T415 I451 Y452 L453	A120-A455 HydrophobicContact CB-CB 4.16Å; V414-A455 HydrophobicContact CG2-CB 4.02Å; T415-A455 HydrophobicContact CG2-CB 4.01Å; I451-A455 WeakPolarHBondContact O-CB 3.47Å; I451-A455 PolarHBondContact O-N 3.01Å; Y452-A455 PolarHBondContact O-N 3.09Å; Y452-A455 VanDerWaalsContact O-N 3.15Å; L453-A455 VanDerWaalsContact C-N 3.33Å; L453-A455 PolarHBondContact O-N 2.82Å
456	T	92.8	Very high	92.4	Very high	41 Å²	41	39.9 Å²	39.9	25%	0.252	20%	0.204	S	C	.	.	H	α-helix	trans	-93.5	-33.2	-177.8	60.1	0	0	0	0	114.7	N117 A120 Y452 L453	N117-T456 HydrophobicContact CB-CG2 3.75Å; N117-T456 WeakPolarHBondContact ND2-CG2 3.37Å; A120-T456 HydrophobicContact CB-CG2 3.73Å; Y452-T456 HydrophobicContact CD2-CG2 4.1Å; Y452-T456 HydrophobicContact CE1-CG2 4.22Å; Y452-T456 HydrophobicContact CE2-CG2 3.62Å; Y452-T456 WeakPolarHBondContact O-CG2 3.19Å; Y452-T456 PolarHBondContact O-N 3.13Å; Y452-T456 PolarHBondContact O-OG1 3.33Å; L453-T456 PolarHBondContact O-N 3.15Å; L453-T456 PolarHBondContact O-OG1 3.29Å
457	N	93.7	Very high	92.8	Very high	86 Å²	86	43.7 Å²	43.7	46%	0.46	22%	0.22	S	C	.	.	H	α-helix	trans	-94.5	-28.6	-174.4	-55.3	-11.9	0	0	0	111.6	Y442 L453 K459	Y442-N457 PolarHBondContact OH-ND2 3.32Å; L453-N457 WeakPolarHBondContact O-CB 3.35Å; L453-N457 PolarHBondContact O-N 2.91Å; L453-N457 PolarHBondContact O-ND2 3.16Å; N457-K459 PolarHBondContact O-N 3.01Å
458	G	93.3	Very high	93.2	Very high	8 Å²	8	43.4 Å²	43.4	8%	0.082	22%	0.217	C	C	.	.			trans	71.1	-110.7	-174	0	0	0	0	0	111	W426 I454 P460	W426-G458 WeakPolarHBondContact CH2-O 3.35Å; I454-G458 PolarHBondContact O-N 2.69Å; I454-G458 VanDerWaalsContact O-N 3.16Å; G458-P460 WeakPolarHBondContact O-CD 3.29Å
459	K	95.8	Very high	93.6	Very high	58 Å²	58	45.2 Å²	45.2	25%	0.252	23%	0.229	S	C	.	.	S	Bend	trans	-68.4	123.4	-178.7	-172.8	179.9	76.1	171.9	0	110.1	N457 D477 L480 V482	N457-K459 PolarHBondContact O-N 3.01Å; K459-D477 IonicContact NZ-OD1 2.91Å; K459-D477 PolarHBondContact NZ-OD1 2.94Å; K459-D477 IonicContact NZ-OD2 3.84Å; K459-L480 HydrophobicContact CD-CB 4.29Å; K459-L480 HydrophobicContact CG-CB 3.87Å; K459-V482 HydrophobicContact CB-CG2 4.36Å
460	P	95.5	Very high	94	Very high	4 Å²	4	47 Å²	47	3%	0.026	25%	0.248	C	C	.	.	P	Polyproline II helix	trans	-74.1	145.6	176.1	30.5	-34.4	0	0	0	111.6	I430 I433 P441 Y442 G458 L480	I430-P460 HydrophobicContact CD1-CG 3.81Å; I433-P460 HydrophobicContact CD1-CG 4.05Å; P441-P460 HydrophobicContact CB-CB 3.74Å; P441-P460 HydrophobicContact CB-CG 4.31Å; P441-P460 HydrophobicContact CG-CB 3.71Å; P441-P460 HydrophobicContact CG-CG 3.83Å; Y442-P460 HydrophobicContact CE2-CB 4.29Å; G458-P460 WeakPolarHBondContact O-CD 3.29Å; P460-L480 HydrophobicContact CG-CD1 4.13Å
461	E	92.8	Very high	94.3	Very high	122 Å²	122	50.5 Å²	50.5	57%	0.57	26%	0.264	S	S	*	.	P	Polyproline II helix	trans	-96.1	152.7	166.1	-64.7	-59.3	153.4	0	0	110	R465	E461-R465 VanDerWaalsContact OE2-CD 3.24Å; E461-R465 WeakPolarHBondContact OE2-CD 3.39Å; E461-R465 IonicContact OE2-NE 3.72Å
462	F	93.6	Very high	94.6	Very high	24 Å²	24	50.4 Å²	50.4	11%	0.105	26%	0.264	C	S	.	.			trans	-146	157.1	-177.6	62.2	-83.3	0	0	0	111.1	I433 V436 E437 R465 L468 I476	I433-F462 HydrophobicContact CD1-CD1 3.74Å; I433-F462 HydrophobicContact CD1-CE1 3.96Å; I433-F462 HydrophobicContact CD1-CG 4.49Å; I433-F462 HydrophobicContact CG1-CD1 3.82Å; I433-F462 HydrophobicContact CG1-CE1 3.79Å; I433-F462 HydrophobicContact CG1-CG 4.32Å; I433-F462 HydrophobicContact CG1-CZ 4.24Å; I433-F462 HydrophobicContact CG2-CB 4.04Å; I433-F462 HydrophobicContact CG2-CD1 4.29Å; I433-F462 HydrophobicContact CG2-CD2 4.34Å; I433-F462 HydrophobicContact CG2-CG 3.99Å; V436-F462 HydrophobicContact CG1-CE2 4.41Å; E437-F462 HydrophobicContact CG-CB 4.18Å; E437-F462 HydrophobicContact CG-CD2 4.09Å; E437-F462 WeakPolarHBondContact OE1-CD2 3.22Å; F462-R465 HydrophobicContact CD1-CB 4.25Å; F462-R465 HydrophobicContact CD2-CB 3.94Å; F462-R465 HydrophobicContact CE1-CB 4Å; F462-R465 HydrophobicContact CE1-CG 4.01Å; F462-R465 VanDerWaalsContact CE2-CA 3.41Å; F462-R465 HydrophobicContact CE2-CB 3.67Å; F462-R465 HydrophobicContact CE2-CG 4.34Å; F462-R465 HydrophobicContact CG-CB 4.22Å; F462-R465 HydrophobicContact CZ-CB 3.7Å; F462-R465 HydrophobicContact CZ-CG 3.86Å; F462-R465 VanDerWaalsContact O-CB 3.32Å; F462-R465 WeakPolarHBondContact O-CB 3.4Å; F462-R465 PolarHBondContact O-N 3.35Å; F462-L468 HydrophobicContact CE2-CD1 3.74Å; F462-L468 HydrophobicContact CZ-CD1 3.78Å; F462-I476 HydrophobicContact CE1-CD1 4.38Å; F462-I476 HydrophobicContact CE1-CG2 4.27Å; F462-I476 HydrophobicContact CZ-CD1 3.78Å
463	Q	92	Very high	94.9	Very high	148 Å²	148	54 Å²	54	69%	0.692	28%	0.277	S	S	*	.	G	3₁₀ helix	trans	-71.3	-45.8	-161.8	-60.1	-176.9	22	0	0	113.2	E437 R465	E437-Q463 WeakPolarHBondContact OE1-CA 3.5Å; E437-Q463 PolarHBondContact OE1-N 3.16Å; Q463-R465 PolarHBondContact O-N 3.34Å
464	S	92.3	Very high	95.1	Very high	9 Å²	9	55.1 Å²	55.1	6%	0.063	29%	0.289	C	S	.	.	G	3₁₀ helix	trans	-82.3	7.7	-177.2	-88.8	0	0	0	0	113.2	E437 D466 Q467	E437-S464 PolarHBondContact OE1-N 3.3Å; S464-D466 VanDerWaalsContact C-N 3.31Å; S464-D466 PolarHBondContact O-N 3.06Å; S464-Q467 WeakPolarHBondContact O-CB 3.48Å; S464-Q467 PolarHBondContact O-N 2.87Å; S464-Q467 PolarHBondContact OG-OE1 2.79Å
465	R	94.5	Very high	95.3	Very high	36 Å²	36	54.8 Å²	54.8	14%	0.136	29%	0.287	C	S	.	.	G	3₁₀ helix	trans	-50.9	-45.2	-178.8	-178	174.5	167.7	92.4	9.1	113.3	E461 F462 Q463 Q467 L468 R473 D477	E461-R465 VanDerWaalsContact OE2-CD 3.24Å; E461-R465 WeakPolarHBondContact OE2-CD 3.39Å; E461-R465 IonicContact OE2-NE 3.72Å; F462-R465 HydrophobicContact CD1-CB 4.25Å; F462-R465 HydrophobicContact CD2-CB 3.94Å; F462-R465 HydrophobicContact CE1-CB 4Å; F462-R465 HydrophobicContact CE1-CG 4.01Å; F462-R465 VanDerWaalsContact CE2-CA 3.41Å; F462-R465 HydrophobicContact CE2-CB 3.67Å; F462-R465 HydrophobicContact CE2-CG 4.34Å; F462-R465 HydrophobicContact CG-CB 4.22Å; F462-R465 HydrophobicContact CZ-CB 3.7Å; F462-R465 HydrophobicContact CZ-CG 3.86Å; F462-R465 VanDerWaalsContact O-CB 3.32Å; F462-R465 WeakPolarHBondContact O-CB 3.4Å; F462-R465 PolarHBondContact O-N 3.35Å; Q463-R465 PolarHBondContact O-N 3.34Å; R465-Q467 VanDerWaalsContact C-N 3.26Å; R465-Q467 PolarHBondContact O-N 3.46Å; R465-L468 WeakPolarHBondContact O-CB 3.33Å; R465-L468 PolarHBondContact O-N 3.47Å; R465-R473 HydrophobicContact CG-CG 4.47Å; R465-R473 VanDerWaalsContact O-CD 3.26Å; R465-R473 WeakPolarHBondContact O-CD 3.23Å; R465-D477 IonicContact CZ-OD1 3.32Å; R465-D477 IonicContact CZ-OD2 2.68Å; R465-D477 IonicContact NH1-OD1 2.68Å; R465-D477 PolarHBondContact NH1-OD1 3.05Å; R465-D477 IonicContact NH1-OD2 3.89Å; R465-D477 VanDerWaalsContact NH2-CG 3.3Å; R465-D477 IonicContact NH2-OD1 3.31Å; R465-D477 PolarHBondContact NH2-OD1 3.49Å; R465-D477 IonicContact NH2-OD2 2.92Å; R465-D477 PolarHBondContact NH2-OD2 2.84Å
466	D	94.1	Very high	95.6	Very high	131 Å²	131	53.6 Å²	53.6	70%	0.701	28%	0.277	S	S	*	.	G	3₁₀ helix	trans	-75.7	-10.7	-178.4	-72.1	-35.7	0	0	0	114.5	S464 R473	S464-D466 VanDerWaalsContact C-N 3.31Å; S464-D466 PolarHBondContact O-N 3.06Å; D466-R473 IonicContact OD1-NH1 2.79Å
467	Q	94.8	Very high	95.8	Very high	135 Å²	135	54 Å²	54	63%	0.631	28%	0.278	S	S	*	.	G	3₁₀ helix	trans	-84.9	-13.3	174.7	-62.3	159	22.1	0	0	112	S464 R465	S464-Q467 WeakPolarHBondContact O-CB 3.48Å; S464-Q467 PolarHBondContact O-N 2.87Å; S464-Q467 PolarHBondContact OG-OE1 2.79Å; R465-Q467 VanDerWaalsContact C-N 3.26Å; R465-Q467 PolarHBondContact O-N 3.46Å
468	L	96.7	Very high	96	Very high	18 Å²	18	51.6 Å²	51.6	9%	0.094	27%	0.268	C	S	.	.	S	Bend	trans	-82.4	150.8	-178.7	-55.9	-174.8	0	0	0	112.6	E341 V436 F462 R465 F472 R473 I476	E341-L468 WeakPolarHBondContact OE1-CA 3.36Å; V436-L468 HydrophobicContact CG1-CD2 4.05Å; V436-L468 HydrophobicContact CG2-CD1 4.37Å; V436-L468 HydrophobicContact CG2-CD2 4.13Å; F462-L468 HydrophobicContact CE2-CD1 3.74Å; F462-L468 HydrophobicContact CZ-CD1 3.78Å; R465-L468 WeakPolarHBondContact O-CB 3.33Å; R465-L468 PolarHBondContact O-N 3.47Å; L468-F472 HydrophobicContact CB-CD1 4.17Å; L468-F472 HydrophobicContact CD1-CD1 3.71Å; L468-F472 HydrophobicContact CD1-CE1 3.82Å; L468-F472 HydrophobicContact CD1-CG 4.32Å; L468-F472 HydrophobicContact CD1-CZ 4.5Å; L468-F472 HydrophobicContact CD2-CD1 3.83Å; L468-F472 HydrophobicContact CD2-CE1 3.93Å; L468-F472 HydrophobicContact CG-CD1 4.11Å; L468-F472 HydrophobicContact CG-CE1 4.42Å; L468-R473 HydrophobicContact CB-CG 3.92Å; L468-R473 PolarHBondContact O-NE 2.84Å; L468-R473 PolarHBondContact O-NH2 3.43Å; L468-I476 HydrophobicContact CD1-CD1 3.83Å
469	S	98	Very high	96.3	Very high	38 Å²	38	51.2 Å²	51.2	27%	0.266	26%	0.264	S	S	.	.			trans	-56.1	155.2	173.2	72.5	0	0	0	0	112.1	E341 E471 F472 R473	E341-S469 PolarHBondContact OE1-N 2.99Å; E341-S469 PolarHBondContact OE1-OG 2.92Å; E341-S469 WeakPolarHBondContact OE2-CB 3.35Å; E341-S469 PolarHBondContact OE2-OG 3.04Å; S469-E471 PolarHBondContact O-N 2.99Å; S469-F472 PolarHBondContact O-N 2.93Å; S469-F472 WeakPolarHBondContact OG-CB 3.17Å; S469-F472 PolarHBondContact OG-N 3.46Å; S469-R473 PolarHBondContact O-N 3.17Å
470	S	97.7	Very high	96.4	Very high	76 Å²	76	48.5 Å²	48.5	53%	0.531	25%	0.252	S	S	.	.	H	α-helix	trans	-54.8	-41.9	172.9	26.6	0	0	0	0	111.8	A474	S470-A474 VanDerWaalsContact O-CB 3.29Å; S470-A474 WeakPolarHBondContact O-CB 3.36Å; S470-A474 PolarHBondContact O-N 3.29Å
471	E	98.1	Very high	96.5	Very high	73 Å²	73	51.6 Å²	51.6	34%	0.341	27%	0.266	S	S	.	.	H	α-helix	trans	-65.4	-43.2	179.7	-78.1	65.8	-162.5	0	0	111.9	S469 F475 H496 R497 F498	S469-E471 PolarHBondContact O-N 2.99Å; E471-F475 PolarHBondContact O-N 3.33Å; E471-H496 PolarHBondContact O-CE1 3.26Å; E471-H496 VanDerWaalsContact O-CE1 3.31Å; E471-R497 HydrophobicContact CG-CB 4.02Å; E471-F498 HydrophobicContact CB-CB 4.44Å
472	F	98.4	Very high	96.7	Very high	0 Å²	0	49 Å²	49	0%	0	26%	0.258	C	S	.	.	H	α-helix	trans	-73.8	-41	180	-171.1	-161.2	0	0	0	112	E341 I344 A432 V436 L468 S469 A474 F475 I476 F498	E341-F472 HydrophobicContact CG-CD1 3.72Å; E341-F472 HydrophobicContact CG-CE1 4.31Å; I344-F472 HydrophobicContact CD1-CE1 3.97Å; I344-F472 HydrophobicContact CD1-CZ 4.13Å; I344-F472 HydrophobicContact CG2-CE1 4.36Å; I344-F472 HydrophobicContact CG2-CE2 4.07Å; I344-F472 HydrophobicContact CG2-CZ 3.66Å; A432-F472 HydrophobicContact CB-CE2 4.28Å; V436-F472 HydrophobicContact CG2-CE1 3.5Å; V436-F472 HydrophobicContact CG2-CZ 3.74Å; L468-F472 HydrophobicContact CB-CD1 4.17Å; L468-F472 HydrophobicContact CD1-CD1 3.71Å; L468-F472 HydrophobicContact CD1-CE1 3.82Å; L468-F472 HydrophobicContact CD1-CG 4.32Å; L468-F472 HydrophobicContact CD1-CZ 4.5Å; L468-F472 HydrophobicContact CD2-CD1 3.83Å; L468-F472 HydrophobicContact CD2-CE1 3.93Å; L468-F472 HydrophobicContact CG-CD1 4.11Å; L468-F472 HydrophobicContact CG-CE1 4.42Å; S469-F472 PolarHBondContact O-N 2.93Å; S469-F472 WeakPolarHBondContact OG-CB 3.17Å; S469-F472 PolarHBondContact OG-N 3.46Å; F472-A474 VanDerWaalsContact C-N 3.33Å; F472-A474 PolarHBondContact O-N 3.49Å; F472-F475 HydrophobicContact CD2-CB 4.48Å; F472-F475 HydrophobicContact CD2-CD1 4.33Å; F472-F475 HydrophobicContact CE2-CD1 4.38Å; F472-F475 WeakPolarHBondContact O-CB 3.4Å; F472-F475 PolarHBondContact O-N 3.48Å; F472-F475 VanDerWaalsContact O-N 3.11Å; F472-I476 HydrophobicContact CD2-CD1 4.02Å; F472-I476 HydrophobicContact CD2-CG1 3.99Å; F472-I476 HydrophobicContact CE1-CD1 4.43Å; F472-I476 HydrophobicContact CE2-CD1 3.63Å; F472-I476 HydrophobicContact CE2-CG1 3.7Å; F472-I476 HydrophobicContact CZ-CD1 3.84Å; F472-I476 HydrophobicContact CZ-CG1 4.39Å; F472-I476 PolarHBondContact O-N 3.42Å; F472-F498 HydrophobicContact CB-CD2 3.57Å; F472-F498 HydrophobicContact CB-CE2 3.48Å; F472-F498 VanDerWaalsContact CB-CE2 3.48Å; F472-F498 HydrophobicContact CB-CG 4.41Å; F472-F498 HydrophobicContact CB-CZ 4.26Å; F472-F498 AromaticContact CD1-CE2 3.99Å; F472-F498 HydrophobicContact CD1-CE2 3.99Å; F472-F498 HydrophobicContact CD1-CZ 4.18Å; F472-F498 HydrophobicContact CD2-CD1 4.06Å; F472-F498 AromaticContact CD2-CD2 3.9Å; F472-F498 HydrophobicContact CD2-CD2 3.9Å; F472-F498 AromaticContact CD2-CE1 3.58Å; F472-F498 HydrophobicContact CD2-CE1 3.58Å; F472-F498 AromaticContact CD2-CE2 3.42Å; F472-F498 HydrophobicContact CD2-CE2 3.42Å; F472-F498 VanDerWaalsContact CD2-CE2 3.42Å; F472-F498 HydrophobicContact CD2-CG 4.2Å; F472-F498 AromaticContact CD2-CZ 3.23Å; F472-F498 HydrophobicContact CD2-CZ 3.23Å; F472-F498 HydrophobicContact CE1-CZ 4.4Å; F472-F498 AromaticContact CE2-CE1 3.79Å; F472-F498 HydrophobicContact CE2-CE1 3.79Å; F472-F498 HydrophobicContact CE2-CE2 4.15Å; F472-F498 AromaticContact CE2-CZ 3.52Å; F472-F498 HydrophobicContact CE2-CZ 3.52Å; F472-F498 AromaticContact CG-CD2 3.89Å; F472-F498 HydrophobicContact CG-CD2 3.89Å; F472-F498 HydrophobicContact CG-CE1 4.39Å; F472-F498 AromaticContact CG-CE2 3.35Å; F472-F498 HydrophobicContact CG-CE2 3.35Å; F472-F498 AromaticContact CG-CZ 3.64Å; F472-F498 HydrophobicContact CG-CZ 3.64Å; F472-F498 HydrophobicContact CZ-CZ 4.13Å
473	R	98	Very high	96.9	Very high	80 Å²	80	50.5 Å²	50.5	30%	0.302	27%	0.268	S	S	.	.	H	α-helix	trans	-56.2	-46.7	170.9	-76.7	-174.8	-86.2	175.6	-1.2	112	R465 D466 L468 S469 F475 I476 D477	R465-R473 HydrophobicContact CG-CG 4.47Å; R465-R473 VanDerWaalsContact O-CD 3.26Å; R465-R473 WeakPolarHBondContact O-CD 3.23Å; D466-R473 IonicContact OD1-NH1 2.79Å; L468-R473 HydrophobicContact CB-CG 3.92Å; L468-R473 PolarHBondContact O-NE 2.84Å; L468-R473 PolarHBondContact O-NH2 3.43Å; S469-R473 PolarHBondContact O-N 3.17Å; R473-F475 VanDerWaalsContact C-N 3.31Å; R473-F475 PolarHBondContact O-N 3.34Å; R473-I476 PolarHBondContact O-N 2.86Å; R473-D477 WeakPolarHBondContact O-CB 3.37Å; R473-D477 PolarHBondContact O-N 3.27Å
474	A	98	Very high	97.1	Very high	39 Å²	39	45.3 Å²	45.3	32%	0.322	25%	0.246	S	C	.	.	H	α-helix	trans	-61.9	-37.5	176.4	0	0	0	0	0	112.5	S470 F472 D477 C478	S470-A474 VanDerWaalsContact O-CB 3.29Å; S470-A474 WeakPolarHBondContact O-CB 3.36Å; S470-A474 PolarHBondContact O-N 3.29Å; F472-A474 VanDerWaalsContact C-N 3.33Å; F472-A474 PolarHBondContact O-N 3.49Å; A474-D477 PolarHBondContact O-N 3.15Å; A474-C478 WeakPolarHBondContact O-CB 3.46Å; A474-C478 PolarHBondContact O-N 3.42Å; A474-C478 PolarHBondContact O-SG 3.02Å
475	F	98.6	Very high	97.2	Very high	0 Å²	0	51.5 Å²	51.5	0%	0	27%	0.274	C	S	.	.	H	α-helix	trans	-63.3	-47.5	175.4	179.6	-96.7	0	0	0	112	C348 L352 E471 F472 R473 C478 C479 L493 H496 F498 L499	C348-F475 HydrophobicContact CB-CE1 4.17Å; C348-F475 HydrophobicContact CB-CZ 3.95Å; L352-F475 HydrophobicContact CD1-CE2 3.93Å; L352-F475 HydrophobicContact CD1-CZ 3.91Å; E471-F475 PolarHBondContact O-N 3.33Å; F472-F475 HydrophobicContact CD2-CB 4.48Å; F472-F475 HydrophobicContact CD2-CD1 4.33Å; F472-F475 HydrophobicContact CE2-CD1 4.38Å; F472-F475 WeakPolarHBondContact O-CB 3.4Å; F472-F475 PolarHBondContact O-N 3.48Å; F472-F475 VanDerWaalsContact O-N 3.11Å; R473-F475 VanDerWaalsContact C-N 3.31Å; R473-F475 PolarHBondContact O-N 3.34Å; F475-C478 PolarHBondContact O-N 3.04Å; F475-C479 PolarHBondContact O-N 3.05Å; F475-C479 VanDerWaalsContact O-N 3.11Å; F475-C479 PolarHBondContact O-SG 3.17Å; F475-L493 HydrophobicContact CD2-CD2 3.94Å; F475-L493 HydrophobicContact CE2-CB 4.27Å; F475-L493 HydrophobicContact CE2-CD2 3.84Å; F475-H496 HydrophobicContact CD2-CB 4Å; F475-H496 AromaticContact CD2-CG 3.91Å; F475-H496 AromaticContact CD2-ND1 3.66Å; F475-H496 PolarHBondContact N-CE1 3.16Å; F475-F498 HydrophobicContact CB-CB 3.77Å; F475-F498 HydrophobicContact CB-CD1 3.85Å; F475-F498 HydrophobicContact CB-CG 3.96Å; F475-F498 AromaticContact CD1-CD1 3.65Å; F475-F498 HydrophobicContact CD1-CD1 3.65Å; F475-F498 AromaticContact CD1-CE1 3.93Å; F475-F498 HydrophobicContact CD1-CE1 3.93Å; F475-F498 HydrophobicContact CD2-CB 4.22Å; F475-F498 AromaticContact CD2-CD1 3.83Å; F475-F498 HydrophobicContact CD2-CD1 3.83Å; F475-F498 HydrophobicContact CD2-CG 4.47Å; F475-F498 HydrophobicContact CE1-CD1 4.12Å; F475-F498 HydrophobicContact CE1-CE1 4.2Å; F475-F498 HydrophobicContact CE2-CD1 4.26Å; F475-F498 HydrophobicContact CG-CB 4.13Å; F475-F498 AromaticContact CG-CD1 3.49Å; F475-F498 HydrophobicContact CG-CD1 3.49Å; F475-F498 VanDerWaalsContact CG-CD1 3.49Å; F475-F498 HydrophobicContact CG-CE1 4.25Å; F475-F498 HydrophobicContact CG-CG 4.1Å; F475-F498 HydrophobicContact CZ-CD1 4.39Å; F475-L499 HydrophobicContact CE2-CD2 4Å; F475-L499 HydrophobicContact CE2-CG 4.3Å; F475-L499 HydrophobicContact CZ-CD2 4.3Å
476	I	98.4	Very high	97.4	Very high	0 Å²	0	56.2 Å²	56.2	0%	0	30%	0.295	C	S	.	.	H	α-helix	trans	-61.7	-45.5	176.9	-67.1	173.6	0	0	0	110.3	A432 I433 F462 L468 F472 R473 C478 C479 L480	A432-I476 HydrophobicContact CB-CG1 4.33Å; I433-I476 HydrophobicContact CD1-CG2 4.47Å; I433-I476 HydrophobicContact CG1-CG2 4.33Å; F462-I476 HydrophobicContact CE1-CD1 4.38Å; F462-I476 HydrophobicContact CE1-CG2 4.27Å; F462-I476 HydrophobicContact CZ-CD1 3.78Å; L468-I476 HydrophobicContact CD1-CD1 3.83Å; F472-I476 HydrophobicContact CD2-CD1 4.02Å; F472-I476 HydrophobicContact CD2-CG1 3.99Å; F472-I476 HydrophobicContact CE1-CD1 4.43Å; F472-I476 HydrophobicContact CE2-CD1 3.63Å; F472-I476 HydrophobicContact CE2-CG1 3.7Å; F472-I476 HydrophobicContact CZ-CD1 3.84Å; F472-I476 HydrophobicContact CZ-CG1 4.39Å; F472-I476 PolarHBondContact O-N 3.42Å; R473-I476 PolarHBondContact O-N 2.86Å; I476-C478 VanDerWaalsContact C-N 3.33Å; I476-C478 PolarHBondContact O-N 2.81Å; I476-C479 WeakPolarHBondContact O-CB 3.47Å; I476-C479 PolarHBondContact O-N 2.92Å; I476-L480 HydrophobicContact CG2-CD1 3.65Å; I476-L480 HydrophobicContact CG2-CG 4.28Å; I476-L480 PolarHBondContact O-N 3.25Å
477	D	98.1	Very high	97.6	Very high	48 Å²	48	50 Å²	50	26%	0.257	26%	0.262	S	S	.	.	H	α-helix	trans	-62.8	-37	178.4	-73.3	-26.9	0	0	0	112.4	K459 R465 R473 A474 C479 L480 E481	K459-D477 IonicContact NZ-OD1 2.91Å; K459-D477 PolarHBondContact NZ-OD1 2.94Å; K459-D477 IonicContact NZ-OD2 3.84Å; R465-D477 IonicContact CZ-OD1 3.32Å; R465-D477 IonicContact CZ-OD2 2.68Å; R465-D477 IonicContact NH1-OD1 2.68Å; R465-D477 PolarHBondContact NH1-OD1 3.05Å; R465-D477 IonicContact NH1-OD2 3.89Å; R465-D477 VanDerWaalsContact NH2-CG 3.3Å; R465-D477 IonicContact NH2-OD1 3.31Å; R465-D477 PolarHBondContact NH2-OD1 3.49Å; R465-D477 IonicContact NH2-OD2 2.92Å; R465-D477 PolarHBondContact NH2-OD2 2.84Å; R473-D477 WeakPolarHBondContact O-CB 3.37Å; R473-D477 PolarHBondContact O-N 3.27Å; A474-D477 PolarHBondContact O-N 3.15Å; D477-C479 VanDerWaalsContact C-N 3.3Å; D477-C479 PolarHBondContact O-N 3.33Å; D477-L480 PolarHBondContact O-N 3.5Å; D477-E481 PolarHBondContact O-N 2.86Å; D477-E481 VanDerWaalsContact O-N 3.14Å
478	C	98.3	Very high	97.8	Very high	37 Å²	37	45.2 Å²	45.2	25%	0.25	24%	0.241	C	C	.	.	H	α-helix	trans	-67.1	-27.8	172.9	-75	0	0	0	0	114	A474 F475 I476 L488 L493	A474-C478 WeakPolarHBondContact O-CB 3.46Å; A474-C478 PolarHBondContact O-N 3.42Å; A474-C478 PolarHBondContact O-SG 3.02Å; F475-C478 PolarHBondContact O-N 3.04Å; I476-C478 VanDerWaalsContact C-N 3.33Å; I476-C478 PolarHBondContact O-N 2.81Å; C478-L488 HydrophobicContact CB-CD1 3.72Å; C478-L488 HydrophobicContact CB-CG 3.9Å; C478-L488 PolarHBondContact O-N 2.89Å; C478-L493 HydrophobicContact CB-CD2 3.98Å
479	C	98.6	Very high	97.9	Very high	0 Å²	0	46.1 Å²	46.1	0%	0	25%	0.248	C	C	.	.	H	α-helix	trans	-81.3	-38.8	175.7	-63.4	0	0	0	0	112.2	V425 F475 I476 D477 R487	V425-C479 HydrophobicContact CG1-CB 4.21Å; F475-C479 PolarHBondContact O-N 3.05Å; F475-C479 VanDerWaalsContact O-N 3.11Å; F475-C479 PolarHBondContact O-SG 3.17Å; I476-C479 WeakPolarHBondContact O-CB 3.47Å; I476-C479 PolarHBondContact O-N 2.92Å; D477-C479 VanDerWaalsContact C-N 3.3Å; D477-C479 PolarHBondContact O-N 3.33Å; C479-R487 WeakPolarHBondContact O-CD 3.41Å; C479-R487 WeakPolarHBondContact O-CG 3.45Å
480	L	98.5	Very high	97.9	Very high	1 Å²	1	44.4 Å²	44.4	1%	0.005	24%	0.236	C	C	.	.	S	Bend	trans	-101.2	24.6	-174.8	-57.3	178.9	0	0	0	113.6	W426 I430 I433 K459 P460 I476 D477 V482	W426-L480 HydrophobicContact CD2-CD2 3.69Å; W426-L480 HydrophobicContact CE3-CB 4.36Å; W426-L480 HydrophobicContact CE3-CD2 4.02Å; W426-L480 HydrophobicContact CG-CD2 4.03Å; W426-L480 HydrophobicContact CH2-CB 4.44Å; W426-L480 HydrophobicContact CZ2-CD2 4.21Å; W426-L480 VanDerWaalsContact CZ3-C 3.5Å; W426-L480 HydrophobicContact CZ3-CB 4.17Å; W426-L480 HydrophobicContact CZ3-CD2 4.43Å; W426-L480 WeakPolarHBondContact CZ3-O 3.4Å; W426-L480 WeakPolarHBondContact O-CD2 3.35Å; I430-L480 HydrophobicContact CD1-CD1 4.26Å; I430-L480 HydrophobicContact CD1-CD2 3.76Å; I430-L480 HydrophobicContact CG1-CD2 4.03Å; I433-L480 HydrophobicContact CD1-CD1 3.52Å; I433-L480 HydrophobicContact CG1-CD1 4.45Å; K459-L480 HydrophobicContact CD-CB 4.29Å; K459-L480 HydrophobicContact CG-CB 3.87Å; P460-L480 HydrophobicContact CG-CD1 4.13Å; I476-L480 HydrophobicContact CG2-CD1 3.65Å; I476-L480 HydrophobicContact CG2-CG 4.28Å; I476-L480 PolarHBondContact O-N 3.25Å; D477-L480 PolarHBondContact O-N 3.5Å; L480-V482 PolarHBondContact O-N 2.81Å
481	E	98.1	Very high	97.9	Very high	68 Å²	68	42 Å²	42	32%	0.318	22%	0.219	S	C	.	.			trans	-66.2	128.8	168.3	173	55.5	-95.8	0	0	109.7	D477 D483 K486 R487	D477-E481 PolarHBondContact O-N 2.86Å; D477-E481 VanDerWaalsContact O-N 3.14Å; E481-D483 HydrophobicContact CG-CB 4.37Å; E481-D483 PolarHBondContact OE1-N 3.03Å; E481-K486 HydrophobicContact CG-CB 3.65Å; E481-R487 HydrophobicContact CB-CB 3.98Å; E481-R487 HydrophobicContact CB-CG 4.27Å; E481-R487 HydrophobicContact CG-CB 4.26Å; E481-R487 PolarHBondContact O-NE 3.04Å; E481-R487 PolarHBondContact O-NH2 3Å
482	V	96.8	Very high	97.9	Very high	67 Å²	67	43.4 Å²	43.4	41%	0.406	23%	0.227	S	C	.	.	S	Bend	trans	-77.1	-33.2	-175.1	-179.6	0	0	0	0	110.6	W426 K459 L480 V484	W426-V482 HydrophobicContact CH2-CG2 4.35Å; W426-V482 HydrophobicContact CZ3-CG2 4.25Å; K459-V482 HydrophobicContact CB-CG2 4.36Å; L480-V482 PolarHBondContact O-N 2.81Å; V482-V484 PolarHBondContact O-N 2.72Å
483	D	96.3	Very high	97.9	Very high	57 Å²	57	43.4 Å²	43.4	31%	0.305	23%	0.227	S	C	.	.	S	Bend	trans	-74.7	106.1	172.8	-174.6	-18	0	0	0	110.6	E481 E485 K486 R487	E481-D483 HydrophobicContact CG-CB 4.37Å; E481-D483 PolarHBondContact OE1-N 3.03Å; D483-E485 PolarHBondContact O-N 2.96Å; D483-E485 VanDerWaalsContact O-N 3.11Å; D483-E485 PolarHBondContact OD1-N 2.73Å; D483-K486 HydrophobicContact CB-CB 4.1Å; D483-K486 HydrophobicContact CB-CD 4.04Å; D483-K486 HydrophobicContact CB-CG 4.07Å; D483-K486 PolarHBondContact O-N 2.85Å; D483-K486 VanDerWaalsContact OD2-CE 3.31Å; D483-K486 WeakPolarHBondContact OD2-CE 3.45Å; D483-K486 IonicContact OD2-NZ 2.71Å; D483-K486 PolarHBondContact OD2-NZ 3.23Å; D483-R487 PolarHBondContact O-N 2.67Å
484	V	96.2	Very high	97.9	Very high	39 Å²	39	41.6 Å²	41.6	24%	0.236	22%	0.223	C	C	.	.	T	Hydrogen-bonded Turn	trans	-57	-29.3	-177.1	-176.8	0	0	0	0	112.5	E412 K422 V482	E412-V484 HydrophobicContact CB-CG2 4.14Å; E412-V484 VanDerWaalsContact CD-CG2 3.46Å; E412-V484 HydrophobicContact CG-CG2 3.92Å; K422-V484 HydrophobicContact CB-CG1 4.34Å; K422-V484 HydrophobicContact CD-CG1 4.17Å; K422-V484 WeakPolarHBondContact CD-O 3.42Å; K422-V484 WeakPolarHBondContact CE-O 3.44Å; K422-V484 PolarHBondContact NZ-O 2.94Å; V482-V484 PolarHBondContact O-N 2.72Å
485	E	96.2	Very high	97.9	Very high	139 Å²	139	49.2 Å²	49.2	65%	0.65	24%	0.244	S	C	*	.	T	Hydrogen-bonded Turn	trans	-74.4	-36.8	177.9	-61.2	-54.7	150.6	0	0	111.3	K422 D483	K422-E485 PolarHBondContact NZ-O 3.43Å; D483-E485 PolarHBondContact O-N 2.96Å; D483-E485 VanDerWaalsContact O-N 3.11Å; D483-E485 PolarHBondContact OD1-N 2.73Å
486	K	97.7	Very high	97.9	Very high	135 Å²	135	50.9 Å²	50.9	59%	0.587	25%	0.251	S	S	*	.	T	Hydrogen-bonded Turn	trans	-77.3	-32.9	177	-63.3	-176.5	-171.8	114	0	114.1	E481 D483 L488	E481-K486 HydrophobicContact CG-CB 3.65Å; D483-K486 HydrophobicContact CB-CB 4.1Å; D483-K486 HydrophobicContact CB-CD 4.04Å; D483-K486 HydrophobicContact CB-CG 4.07Å; D483-K486 PolarHBondContact O-N 2.85Å; D483-K486 VanDerWaalsContact OD2-CE 3.31Å; D483-K486 WeakPolarHBondContact OD2-CE 3.45Å; D483-K486 IonicContact OD2-NZ 2.71Å; D483-K486 PolarHBondContact OD2-NZ 3.23Å; K486-L488 PolarHBondContact O-N 2.73Å
487	R	98.5	Very high	97.9	Very high	1 Å²	1	59.4 Å²	59.4	0%	0.004	28%	0.283	C	S	.	.	S	Bend	trans	-54.3	131.1	177.3	-167.4	-171.2	-56.9	151.2	7.9	110	E412 K422 V425 C479 E481 D483	E412-R487 IonicContact OE1-CZ 3.02Å; E412-R487 IonicContact OE1-NH1 2.74Å; E412-R487 PolarHBondContact OE1-NH1 3.45Å; E412-R487 IonicContact OE1-NH2 3.94Å; E412-R487 PolarHBondContact OE1-NH2 2.82Å; E412-R487 IonicContact OE2-CZ 3.73Å; E412-R487 IonicContact OE2-NH1 2.75Å; E412-R487 IonicContact OE2-NH2 3.35Å; E412-R487 PolarHBondContact OE2-NH2 3.35Å; K422-R487 HydrophobicContact CD-CB 4.42Å; K422-R487 WeakPolarHBondContact CD-O 3.44Å; K422-R487 WeakPolarHBondContact CE-O 3.48Å; K422-R487 PolarHBondContact NZ-O 3.11Å; K422-R487 WeakPolarHBondContact O-CD 3.21Å; K422-R487 PolarHBondContact O-NH1 2.74Å; V425-R487 HydrophobicContact CG1-CG 4.13Å; C479-R487 WeakPolarHBondContact O-CD 3.41Å; C479-R487 WeakPolarHBondContact O-CG 3.45Å; E481-R487 HydrophobicContact CB-CB 3.98Å; E481-R487 HydrophobicContact CB-CG 4.27Å; E481-R487 HydrophobicContact CG-CB 4.26Å; E481-R487 PolarHBondContact O-NE 3.04Å; E481-R487 PolarHBondContact O-NH2 3Å; D483-R487 PolarHBondContact O-N 2.67Å
488	L	98.3	Very high	97.9	Very high	34 Å²	34	57.2 Å²	57.2	18%	0.178	27%	0.272	C	S	.	.	P	Polyproline II helix	trans	-67.5	153.3	-175.8	-64.7	-167.8	0	0	0	111.6	C478 K486 M492 L493	C478-L488 HydrophobicContact CB-CD1 3.72Å; C478-L488 HydrophobicContact CB-CG 3.9Å; C478-L488 PolarHBondContact O-N 2.89Å; K486-L488 PolarHBondContact O-N 2.73Å; L488-M492 HydrophobicContact CB-CB 4.14Å; L488-M492 HydrophobicContact CD1-CB 4.39Å; L488-M492 HydrophobicContact CD2-CB 4.4Å; L488-M492 HydrophobicContact CD2-CE 3.8Å; L488-M492 HydrophobicContact CD2-SD 4.12Å; L488-L493 HydrophobicContact CB-CD1 4.3Å; L488-L493 HydrophobicContact CB-CD2 4.09Å; L488-L493 HydrophobicContact CB-CG 3.77Å; L488-L493 HydrophobicContact CD1-CD2 3.98Å; L488-L493 HydrophobicContact CD1-CG 4.35Å
489	S	98.4	Very high	97.9	Very high	36 Å²	36	56.2 Å²	56.2	25%	0.252	26%	0.264	S	S	.	.	P	Polyproline II helix	trans	-81.9	164.2	168	65.8	0	0	0	0	111	S491 M492 L493	S489-S491 VanDerWaalsContact C-N 3.3Å; S489-S491 PolarHBondContact O-N 2.97Å; S489-M492 PolarHBondContact O-N 3.47Å; S489-M492 WeakPolarHBondContact OG-CG 3.45Å; S489-M492 PolarHBondContact OG-N 3.39Å; S489-L493 PolarHBondContact O-N 3.2Å
490	S	98.1	Very high	97.9	Very high	2 Å²	2	64.7 Å²	64.7	1%	0.014	30%	0.301	C	S	.	.	H	α-helix	trans	-52	-47.1	172.8	41.1	0	0	0	0	112	H359 M492 L493 L494	H359-S490 PolarHBondContact ND1-OG 3.32Å; H359-S490 VanDerWaalsContact ND1-OG 3.13Å; S490-M492 VanDerWaalsContact C-N 3.29Å; S490-M492 PolarHBondContact O-N 3.31Å; S490-L493 PolarHBondContact O-N 3.03Å; S490-L494 WeakPolarHBondContact O-CG 3.48Å; S490-L494 PolarHBondContact O-N 2.57Å
491	S	98	Very high	97.9	Very high	25 Å²	25	67.5 Å²	67.5	18%	0.175	32%	0.32	C	S	.	.	H	α-helix	trans	-58.1	-31.4	174.3	-55.9	0	0	0	0	115.5	E356 S489	E356-S491 VanDerWaalsContact OE1-CA 3.22Å; E356-S491 WeakPolarHBondContact OE1-CA 3.44Å; E356-S491 WeakPolarHBondContact OE1-CB 3.48Å; E356-S491 PolarHBondContact OE1-OG 2.94Å; S489-S491 VanDerWaalsContact C-N 3.3Å; S489-S491 PolarHBondContact O-N 2.97Å
492	M	98.3	Very high	97.9	Very high	103 Å²	103	65.2 Å²	65.2	51%	0.507	31%	0.312	S	S	.	.	H	α-helix	trans	-81.6	-39.7	176.6	-69.3	-179.3	79.5	0	0	111.1	L488 S489 S490 L494 R495	L488-M492 HydrophobicContact CB-CB 4.14Å; L488-M492 HydrophobicContact CD1-CB 4.39Å; L488-M492 HydrophobicContact CD2-CB 4.4Å; L488-M492 HydrophobicContact CD2-CE 3.8Å; L488-M492 HydrophobicContact CD2-SD 4.12Å; S489-M492 PolarHBondContact O-N 3.47Å; S489-M492 WeakPolarHBondContact OG-CG 3.45Å; S489-M492 PolarHBondContact OG-N 3.39Å; S490-M492 VanDerWaalsContact C-N 3.29Å; S490-M492 PolarHBondContact O-N 3.31Å; M492-L494 VanDerWaalsContact C-N 3.32Å; M492-L494 PolarHBondContact O-N 3.35Å; M492-R495 PolarHBondContact O-N 2.93Å; M492-R495 VanDerWaalsContact O-N 3.08Å
493	L	98.5	Very high	98	Very high	0 Å²	0	65.4 Å²	65.4	0%	0	31%	0.308	C	S	.	.	H	α-helix	trans	-65.4	-32.7	177.1	-74.8	165.5	0	0	0	112.7	L352 V425 F475 C478 L488 S489 S490 R495 H496 L499	L352-L493 HydrophobicContact CD1-CB 3.73Å; L352-L493 HydrophobicContact CD2-CB 3.73Å; L352-L493 HydrophobicContact CD2-CD1 4.04Å; L352-L493 HydrophobicContact CG-CB 4.42Å; V425-L493 HydrophobicContact CB-CD1 4.43Å; V425-L493 HydrophobicContact CG1-CD1 3.4Å; V425-L493 VanDerWaalsContact CG1-CD1 3.4Å; V425-L493 HydrophobicContact CG2-CD1 4.23Å; F475-L493 HydrophobicContact CD2-CD2 3.94Å; F475-L493 HydrophobicContact CE2-CB 4.27Å; F475-L493 HydrophobicContact CE2-CD2 3.84Å; C478-L493 HydrophobicContact CB-CD2 3.98Å; L488-L493 HydrophobicContact CB-CD1 4.3Å; L488-L493 HydrophobicContact CB-CD2 4.09Å; L488-L493 HydrophobicContact CB-CG 3.77Å; L488-L493 HydrophobicContact CD1-CD2 3.98Å; L488-L493 HydrophobicContact CD1-CG 4.35Å; S489-L493 PolarHBondContact O-N 3.2Å; S490-L493 PolarHBondContact O-N 3.03Å; L493-R495 PolarHBondContact O-N 3.26Å; L493-H496 WeakPolarHBondContact O-CB 3.37Å; L493-H496 PolarHBondContact O-N 3.35Å; L493-L499 WeakPolarHBondContact O-CD1 3.31Å
494	L	98.4	Very high	98	Very high	42 Å²	42	67.3 Å²	67.3	22%	0.22	32%	0.323	C	S	.	.	T	Hydrogen-bonded Turn	trans	-57.2	-18	171.1	-76.9	171.2	0	0	0	114.1	L352 Q353 E356 S490 M492	L352-L494 HydrophobicContact CB-CD2 3.5Å; L352-L494 HydrophobicContact CB-CG 3.85Å; Q353-L494 HydrophobicContact CG-CD2 3.83Å; E356-L494 HydrophobicContact CB-CD1 3.89Å; E356-L494 HydrophobicContact CG-CD1 4.33Å; E356-L494 VanDerWaalsContact OE2-CD1 3.26Å; E356-L494 WeakPolarHBondContact OE2-CD1 3.5Å; S490-L494 WeakPolarHBondContact O-CG 3.48Å; S490-L494 PolarHBondContact O-N 2.57Å; M492-L494 VanDerWaalsContact C-N 3.32Å; M492-L494 PolarHBondContact O-N 3.35Å
495	R	98.1	Very high	98.1	Very high	200 Å²	200	67.3 Å²	67.3	76%	0.755	32%	0.322	S	S	*	.	T	Hydrogen-bonded Turn	trans	-102.9	1.9	177.7	-54.3	176.2	-168.3	166.3	4.6	112.8	M492 L493	M492-R495 PolarHBondContact O-N 2.93Å; M492-R495 VanDerWaalsContact O-N 3.08Å; L493-R495 PolarHBondContact O-N 3.26Å
496	H	98.5	Very high	98.2	Very high	35 Å²	35	63.8 Å²	63.8	16%	0.162	32%	0.317	C	S	.	.			trans	-69	145.9	-176.3	-165.3	-98.5	0	0	0	111.9	E471 F475 L493 F498 L499	E471-H496 PolarHBondContact O-CE1 3.26Å; E471-H496 VanDerWaalsContact O-CE1 3.31Å; F475-H496 HydrophobicContact CD2-CB 4Å; F475-H496 AromaticContact CD2-CG 3.91Å; F475-H496 AromaticContact CD2-ND1 3.66Å; F475-H496 PolarHBondContact N-CE1 3.16Å; L493-H496 WeakPolarHBondContact O-CB 3.37Å; L493-H496 PolarHBondContact O-N 3.35Å; H496-F498 VanDerWaalsContact C-N 3.28Å; H496-F498 WeakPolarHBondContact ND1-CB 3.44Å; H496-F498 PolarHBondContact ND1-N 3.26Å; H496-F498 PolarHBondContact O-N 2.96Å; H496-L499 PolarHBondContact O-N 3.14Å
497	R	98.2	Very high	98.1	Very high	178 Å²	178	58.7 Å²	58.7	67%	0.672	30%	0.298	S	S	*	.	G	3₁₀ helix	trans	-59.9	-36.3	-174.6	-70	-174.1	177.3	-162	1	113.2	E471 L499 K500	E471-R497 HydrophobicContact CG-CB 4.02Å; R497-L499 VanDerWaalsContact C-N 3.28Å; R497-L499 PolarHBondContact O-N 3.5Å; R497-K500 VanDerWaalsContact O-CB 3.27Å; R497-K500 WeakPolarHBondContact O-CB 3.18Å; R497-K500 WeakPolarHBondContact O-CG 3.42Å; R497-K500 PolarHBondContact O-N 2.85Å; R497-K500 VanDerWaalsContact O-N 3.07Å
498	F	98.6	Very high	98.1	Very high	2 Å²	2	58.8 Å²	58.8	1%	0.009	30%	0.298	C	S	.	.	G	3₁₀ helix	trans	-50.5	-44.4	176.1	176.5	-121.9	0	0	0	113.1	E341 I344 A345 E471 F472 F475 H496 K500 C501	E341-F498 HydrophobicContact CB-CE2 4.19Å; I344-F498 HydrophobicContact CB-CZ 4.33Å; I344-F498 HydrophobicContact CG2-CE1 4.48Å; I344-F498 HydrophobicContact CG2-CZ 4.09Å; A345-F498 HydrophobicContact CB-CD1 4.17Å; A345-F498 HydrophobicContact CB-CD2 4.39Å; A345-F498 HydrophobicContact CB-CE1 3.72Å; A345-F498 HydrophobicContact CB-CE2 3.95Å; A345-F498 HydrophobicContact CB-CG 4.49Å; A345-F498 HydrophobicContact CB-CZ 3.6Å; E471-F498 HydrophobicContact CB-CB 4.44Å; F472-F498 HydrophobicContact CB-CD2 3.57Å; F472-F498 HydrophobicContact CB-CE2 3.48Å; F472-F498 VanDerWaalsContact CB-CE2 3.48Å; F472-F498 HydrophobicContact CB-CG 4.41Å; F472-F498 HydrophobicContact CB-CZ 4.26Å; F472-F498 AromaticContact CD1-CE2 3.99Å; F472-F498 HydrophobicContact CD1-CE2 3.99Å; F472-F498 HydrophobicContact CD1-CZ 4.18Å; F472-F498 HydrophobicContact CD2-CD1 4.06Å; F472-F498 AromaticContact CD2-CD2 3.9Å; F472-F498 HydrophobicContact CD2-CD2 3.9Å; F472-F498 AromaticContact CD2-CE1 3.58Å; F472-F498 HydrophobicContact CD2-CE1 3.58Å; F472-F498 AromaticContact CD2-CE2 3.42Å; F472-F498 HydrophobicContact CD2-CE2 3.42Å; F472-F498 VanDerWaalsContact CD2-CE2 3.42Å; F472-F498 HydrophobicContact CD2-CG 4.2Å; F472-F498 AromaticContact CD2-CZ 3.23Å; F472-F498 HydrophobicContact CD2-CZ 3.23Å; F472-F498 HydrophobicContact CE1-CZ 4.4Å; F472-F498 AromaticContact CE2-CE1 3.79Å; F472-F498 HydrophobicContact CE2-CE1 3.79Å; F472-F498 HydrophobicContact CE2-CE2 4.15Å; F472-F498 AromaticContact CE2-CZ 3.52Å; F472-F498 HydrophobicContact CE2-CZ 3.52Å; F472-F498 AromaticContact CG-CD2 3.89Å; F472-F498 HydrophobicContact CG-CD2 3.89Å; F472-F498 HydrophobicContact CG-CE1 4.39Å; F472-F498 AromaticContact CG-CE2 3.35Å; F472-F498 HydrophobicContact CG-CE2 3.35Å; F472-F498 AromaticContact CG-CZ 3.64Å; F472-F498 HydrophobicContact CG-CZ 3.64Å; F472-F498 HydrophobicContact CZ-CZ 4.13Å; F475-F498 HydrophobicContact CB-CB 3.77Å; F475-F498 HydrophobicContact CB-CD1 3.85Å; F475-F498 HydrophobicContact CB-CG 3.96Å; F475-F498 AromaticContact CD1-CD1 3.65Å; F475-F498 HydrophobicContact CD1-CD1 3.65Å; F475-F498 AromaticContact CD1-CE1 3.93Å; F475-F498 HydrophobicContact CD1-CE1 3.93Å; F475-F498 HydrophobicContact CD2-CB 4.22Å; F475-F498 AromaticContact CD2-CD1 3.83Å; F475-F498 HydrophobicContact CD2-CD1 3.83Å; F475-F498 HydrophobicContact CD2-CG 4.47Å; F475-F498 HydrophobicContact CE1-CD1 4.12Å; F475-F498 HydrophobicContact CE1-CE1 4.2Å; F475-F498 HydrophobicContact CE2-CD1 4.26Å; F475-F498 HydrophobicContact CG-CB 4.13Å; F475-F498 AromaticContact CG-CD1 3.49Å; F475-F498 HydrophobicContact CG-CD1 3.49Å; F475-F498 VanDerWaalsContact CG-CD1 3.49Å; F475-F498 HydrophobicContact CG-CE1 4.25Å; F475-F498 HydrophobicContact CG-CG 4.1Å; F475-F498 HydrophobicContact CZ-CD1 4.39Å; H496-F498 VanDerWaalsContact C-N 3.28Å; H496-F498 WeakPolarHBondContact ND1-CB 3.44Å; H496-F498 PolarHBondContact ND1-N 3.26Å; H496-F498 PolarHBondContact O-N 2.96Å; F498-K500 PolarHBondContact O-N 3.45Å; F498-C501 PolarHBondContact O-N 3.4Å; F498-C501 VanDerWaalsContact O-N 3.08Å; F498-C501 PolarHBondContact O-SG 3.07Å
499	L	98.5	Very high	98.1	Very high	16 Å²	16	62.3 Å²	62.3	8%	0.084	31%	0.31	C	S	.	.	G	3₁₀ helix	trans	-67.6	-4.9	-176.6	-54.8	-175.9	0	0	0	113.9	C348 R349 L352 F475 L493 H496 R497 A502	C348-L499 HydrophobicContact CB-CD2 4.01Å; R349-L499 HydrophobicContact CB-CD1 4.39Å; R349-L499 HydrophobicContact CB-CD2 4.35Å; L352-L499 HydrophobicContact CD1-CD1 3.78Å; F475-L499 HydrophobicContact CE2-CD2 4Å; F475-L499 HydrophobicContact CE2-CG 4.3Å; F475-L499 HydrophobicContact CZ-CD2 4.3Å; L493-L499 WeakPolarHBondContact O-CD1 3.31Å; H496-L499 PolarHBondContact O-N 3.14Å; R497-L499 VanDerWaalsContact C-N 3.28Å; R497-L499 PolarHBondContact O-N 3.5Å; L499-A502 VanDerWaalsContact O-CB 3.23Å; L499-A502 WeakPolarHBondContact O-CB 3.05Å
500	K	97.9	Very high	97.9	Very high	178 Å²	178	65.3 Å²	65.3	77%	0.774	32%	0.32	S	S	*	.	G	3₁₀ helix	trans	-76.9	-21.4	172.5	-61.3	-174.1	174.5	-168.7	0	113.8	R497 F498 A502	R497-K500 VanDerWaalsContact O-CB 3.27Å; R497-K500 WeakPolarHBondContact O-CB 3.18Å; R497-K500 WeakPolarHBondContact O-CG 3.42Å; R497-K500 PolarHBondContact O-N 2.85Å; R497-K500 VanDerWaalsContact O-N 3.07Å; F498-K500 PolarHBondContact O-N 3.45Å; K500-A502 VanDerWaalsContact C-N 3.27Å
501	C	98	Very high	97.9	Very high	61 Å²	61	65.5 Å²	65.5	41%	0.412	32%	0.321	S	S	.	.	G	3₁₀ helix	trans	-85.5	0.2	173.7	72.4	0	0	0	0	113.1	G342 F498 K503	G342-C501 WeakPolarHBondContact CA-O 3.45Å; F498-C501 PolarHBondContact O-N 3.4Å; F498-C501 VanDerWaalsContact O-N 3.08Å; F498-C501 PolarHBondContact O-SG 3.07Å; C501-K503 PolarHBondContact O-N 3.11Å; C501-K503 VanDerWaalsContact O-N 3.12Å
502	A	98.4	Very high	97.9	Very high	19 Å²	19	64.4 Å²	64.4	16%	0.157	31%	0.313	C	S	.	.			trans	-59.8	112.2	-176.6	0	0	0	0	0	112.4	G342 A345 A346 L499 K500	G342-A502 CarbonylContact O-C 3.47Å; G342-A502 WeakPolarHBondContact O-CA 3.06Å; A345-A502 HydrophobicContact CB-CB 3.8Å; A346-A502 HydrophobicContact CB-CB 4.25Å; L499-A502 VanDerWaalsContact O-CB 3.23Å; L499-A502 WeakPolarHBondContact O-CB 3.05Å; K500-A502 VanDerWaalsContact C-N 3.27Å
503	K	98.1	Very high	97.8	Very high	71 Å²	71	60.8 Å²	60.8	31%	0.309	30%	0.297	S	S	.	.			trans	-64.1	161.8	178.3	-77.2	-176.7	169.1	-175.3	0	111.4	E340 G342 Q343 A346 C501 S507	E340-K503 IonicContact OE1-NZ 2.76Å; E340-K503 PolarHBondContact OE1-NZ 3.33Å; E340-K503 WeakPolarHBondContact OE2-CE 3.2Å; E340-K503 IonicContact OE2-NZ 2.73Å; E340-K503 PolarHBondContact OE2-NZ 2.92Å; G342-K503 PolarHBondContact O-N 3.19Å; Q343-K503 HydrophobicContact CG-CD 4.36Å; A346-K503 WeakPolarHBondContact CB-O 3.49Å; C501-K503 PolarHBondContact O-N 3.11Å; C501-K503 VanDerWaalsContact O-N 3.12Å; K503-S507 WeakPolarHBondContact CB-OG 3.22Å
504	P	98.1	Very high	97.7	Very high	98 Å²	98	62.1 Å²	62.1	64%	0.636	31%	0.307	S	S	*	.			trans	-56.5	142.5	168	-23.2	34.2	0	0	0	111	A506 S507	P504-A506 PolarHBondContact O-N 2.79Å; P504-A506 VanDerWaalsContact O-N 3.15Å; P504-S507 VanDerWaalsContact O-CB 3.31Å; P504-S507 WeakPolarHBondContact O-CB 3.26Å; P504-S507 PolarHBondContact O-N 2.91Å; P504-S507 PolarHBondContact O-OG 3.31Å
505	L	98	Very high	97.6	Very high	39 Å²	39	60.2 Å²	60.2	20%	0.204	30%	0.298	C	S	.	.	G	3₁₀ helix	trans	-59	-29.7	-178.1	-70.6	-179.2	0	0	0	113.3	A346 E350 G379 V381 S507 L508	A346-L505 HydrophobicContact CB-CD2 4.05Å; E350-L505 HydrophobicContact CG-CD1 4.1Å; E350-L505 HydrophobicContact CG-CD2 3.81Å; G379-L505 WeakPolarHBondContact CA-O 3.36Å; G379-L505 WeakPolarHBondContact O-CB 3.41Å; V381-L505 HydrophobicContact CG2-CD2 4.05Å; L505-S507 PolarHBondContact O-N 3.03Å; L505-L508 HydrophobicContact CD2-CD1 4.13Å; L505-L508 WeakPolarHBondContact O-CB 3.43Å; L505-L508 WeakPolarHBondContact O-CG 3.49Å; L505-L508 PolarHBondContact O-N 3.11Å
506	A	97.2	Very high	97.4	Very high	65 Å²	65	54.9 Å²	54.9	54%	0.537	28%	0.28	S	S	.	.	G	3₁₀ helix	trans	-53.6	-26.4	172.4	0	0	0	0	0	113.6	P504 L508 Y509	P504-A506 PolarHBondContact O-N 2.79Å; P504-A506 VanDerWaalsContact O-N 3.15Å; A506-L508 PolarHBondContact O-N 3.4Å; A506-L508 VanDerWaalsContact O-N 3.16Å; A506-Y509 VanDerWaalsContact O-CB 3.23Å; A506-Y509 WeakPolarHBondContact O-CB 3.16Å; A506-Y509 PolarHBondContact O-N 3.12Å
507	S	97	Very high	97.3	Very high	27 Å²	27	62 Å²	62	19%	0.189	31%	0.305	C	S	.	.	G	3₁₀ helix	trans	-65.7	-12.2	174.6	68.1	0	0	0	0	114.6	Q343 K503 P504 L505	Q343-S507 PolarHBondContact NE2-O 2.97Å; K503-S507 WeakPolarHBondContact CB-OG 3.22Å; P504-S507 VanDerWaalsContact O-CB 3.31Å; P504-S507 WeakPolarHBondContact O-CB 3.26Å; P504-S507 PolarHBondContact O-N 2.91Å; P504-S507 PolarHBondContact O-OG 3.31Å; L505-S507 PolarHBondContact O-N 3.03Å
508	L	97.8	Very high	97	Very high	4 Å²	4	55.5 Å²	55.5	2%	0.021	29%	0.287	C	S	.	.	G	3₁₀ helix	trans	-81.5	-18.8	172.1	-58.7	177.6	0	0	0	112.5	M339 Q343 V347 V381 L505 A506 H510 L511 I512	M339-L508 HydrophobicContact CE-CD2 4.11Å; Q343-L508 HydrophobicContact CB-CD2 3.81Å; Q343-L508 HydrophobicContact CG-CD2 4.02Å; V347-L508 HydrophobicContact CG2-CD1 3.94Å; V347-L508 HydrophobicContact CG2-CD2 4.31Å; V381-L508 HydrophobicContact CG2-CD1 3.82Å; L505-L508 HydrophobicContact CD2-CD1 4.13Å; L505-L508 WeakPolarHBondContact O-CB 3.43Å; L505-L508 WeakPolarHBondContact O-CG 3.49Å; L505-L508 PolarHBondContact O-N 3.11Å; A506-L508 PolarHBondContact O-N 3.4Å; A506-L508 VanDerWaalsContact O-N 3.16Å; L508-H510 VanDerWaalsContact C-N 3.34Å; L508-H510 PolarHBondContact O-N 3.48Å; L508-L511 HydrophobicContact CD2-CD1 4.25Å; L508-L511 PolarHBondContact O-N 2.8Å; L508-L511 VanDerWaalsContact O-N 3.15Å; L508-I512 HydrophobicContact CB-CD1 4.25Å; L508-I512 WeakPolarHBondContact O-CG1 3.18Å; L508-I512 PolarHBondContact O-N 3.31Å
509	Y	97.5	Very high	96.6	Very high	107 Å²	107	57.1 Å²	57.1	42%	0.42	30%	0.295	S	S	.	.	H	α-helix	trans	-55.1	-47.2	-178.1	171.5	-114.5	0	0	0	112.5	M377 A506 L511 I512 V513	M377-Y509 HydrophobicContact CE-CD2 4.08Å; M377-Y509 HydrophobicContact CE-CE2 3.73Å; M377-Y509 WeakPolarHBondContact O-CD2 3.39Å; A506-Y509 VanDerWaalsContact O-CB 3.23Å; A506-Y509 WeakPolarHBondContact O-CB 3.16Å; A506-Y509 PolarHBondContact O-N 3.12Å; Y509-L511 VanDerWaalsContact C-N 3.33Å; Y509-L511 PolarHBondContact O-N 2.85Å; Y509-I512 PolarHBondContact O-N 2.97Å; Y509-V513 HydrophobicContact CD2-CG2 3.98Å; Y509-V513 HydrophobicContact CE1-CG2 4.38Å; Y509-V513 HydrophobicContact CE2-CG2 3.58Å; Y509-V513 WeakPolarHBondContact O-CG2 3.23Å; Y509-V513 PolarHBondContact O-N 3.22Å
510	H	95.7	Very high	96.2	Very high	100 Å²	100	58.2 Å²	58.2	46%	0.463	31%	0.307	S	S	.	.	H	α-helix	trans	-64.4	-36.9	-179.4	-62.9	-80.6	0	0	0	112.3	I185 L508 A514	I185-H510 HydrophobicContact CD1-CB 4.23Å; L508-H510 VanDerWaalsContact C-N 3.34Å; L508-H510 PolarHBondContact O-N 3.48Å; H510-A514 VanDerWaalsContact O-CB 3.28Å; H510-A514 WeakPolarHBondContact O-CB 3.32Å; H510-A514 PolarHBondContact O-N 2.98Å
511	L	97.4	Very high	95.9	Very high	6 Å²	6	51.7 Å²	51.7	3%	0.031	29%	0.286	C	S	.	.	H	α-helix	trans	-66.4	-45.5	174.5	-60.6	-176	0	0	0	111.6	V333 C337 M339 Q343 L508 Y509 V513 A514 A515	V333-L511 HydrophobicContact CG1-CB 3.89Å; V333-L511 HydrophobicContact CG1-CD1 4.04Å; C337-L511 HydrophobicContact CB-CD2 4.07Å; M339-L511 HydrophobicContact CE-CD1 4.35Å; M339-L511 HydrophobicContact CG-CD1 3.98Å; Q343-L511 HydrophobicContact CG-CD1 4.43Å; L508-L511 HydrophobicContact CD2-CD1 4.25Å; L508-L511 PolarHBondContact O-N 2.8Å; L508-L511 VanDerWaalsContact O-N 3.15Å; Y509-L511 VanDerWaalsContact C-N 3.33Å; Y509-L511 PolarHBondContact O-N 2.85Å; L511-V513 VanDerWaalsContact C-N 3.32Å; L511-V513 PolarHBondContact O-N 2.62Å; L511-A514 PolarHBondContact O-N 2.69Å; L511-A515 WeakPolarHBondContact O-CB 3.2Å; L511-A515 PolarHBondContact O-N 2.94Å
512	I	97.6	Very high	95.3	Very high	1 Å²	1	51.5 Å²	51.5	1%	0.005	28%	0.28	C	S	.	.	H	α-helix	trans	-59.1	-44.5	177.5	-68.5	162.3	0	0	0	110.7	V333 L375 G376 M377 L508 Y509 K516	V333-I512 HydrophobicContact CG2-CG1 4.22Å; L375-I512 HydrophobicContact CB-CD1 3.88Å; L375-I512 HydrophobicContact CB-CG1 4.3Å; L375-I512 HydrophobicContact CD1-CD1 4.09Å; L375-I512 HydrophobicContact CD1-CG1 3.8Å; G376-I512 WeakPolarHBondContact O-CD1 3.4Å; M377-I512 HydrophobicContact CE-CG2 4.22Å; M377-I512 HydrophobicContact SD-CG2 3.8Å; L508-I512 HydrophobicContact CB-CD1 4.25Å; L508-I512 WeakPolarHBondContact O-CG1 3.18Å; L508-I512 PolarHBondContact O-N 3.31Å; Y509-I512 PolarHBondContact O-N 2.97Å; I512-K516 HydrophobicContact CG2-CD 4.43Å; I512-K516 WeakPolarHBondContact O-CB 3.33Å; I512-K516 WeakPolarHBondContact O-CG 3.21Å; I512-K516 PolarHBondContact O-N 3.47Å; I512-K516 VanDerWaalsContact O-N 3.12Å
513	V	97.2	Very high	94.3	Very high	28 Å²	28	53.1 Å²	53.1	17%	0.17	28%	0.284	C	S	.	.	H	α-helix	trans	-67.7	-39.6	177.7	172.4	0	0	0	0	111.5	M377 Y509 L511 R517	M377-V513 HydrophobicContact CE-CG2 4.03Å; Y509-V513 HydrophobicContact CD2-CG2 3.98Å; Y509-V513 HydrophobicContact CE1-CG2 4.38Å; Y509-V513 HydrophobicContact CE2-CG2 3.58Å; Y509-V513 WeakPolarHBondContact O-CG2 3.23Å; Y509-V513 PolarHBondContact O-N 3.22Å; L511-V513 VanDerWaalsContact C-N 3.32Å; L511-V513 PolarHBondContact O-N 2.62Å; V513-R517 WeakPolarHBondContact O-CB 3.24Å; V513-R517 VanDerWaalsContact O-CG 3.25Å; V513-R517 WeakPolarHBondContact O-CG 3.4Å; V513-R517 PolarHBondContact O-N 3.02Å; V513-R517 VanDerWaalsContact O-N 3.08Å
514	A	96.3	Very high	93.5	Very high	27 Å²	27	56.9 Å²	56.9	22%	0.223	30%	0.303	C	S	.	.	H	α-helix	trans	-66.1	-50.1	177.6	0	0	0	0	0	112.1	I185 H510 L511 K516 R517 S518	I185-A514 HydrophobicContact CD1-CB 3.81Å; H510-A514 VanDerWaalsContact O-CB 3.28Å; H510-A514 WeakPolarHBondContact O-CB 3.32Å; H510-A514 PolarHBondContact O-N 2.98Å; L511-A514 PolarHBondContact O-N 2.69Å; A514-K516 PolarHBondContact O-N 3.08Å; A514-R517 WeakPolarHBondContact O-CB 3.48Å; A514-R517 PolarHBondContact O-N 3.45Å; A514-R517 VanDerWaalsContact O-N 3.1Å; A514-S518 PolarHBondContact O-N 2.74Å
515	A	96	Very high	92.6	Very high	2 Å²	2	60 Å²	60	2%	0.017	31%	0.308	C	S	.	.	H	α-helix	trans	-54.1	-50.6	175.9	0	0	0	0	0	111.9	D332 V333 E336 L511 R517 S518 I519	D332-A515 VanDerWaalsContact O-CB 3.25Å; D332-A515 WeakPolarHBondContact O-CB 3.32Å; V333-A515 HydrophobicContact CG2-CB 4.2Å; E336-A515 HydrophobicContact CB-CB 4.05Å; E336-A515 HydrophobicContact CG-CB 4.31Å; L511-A515 WeakPolarHBondContact O-CB 3.2Å; L511-A515 PolarHBondContact O-N 2.94Å; A515-R517 VanDerWaalsContact C-N 3.32Å; A515-R517 PolarHBondContact O-N 3.28Å; A515-S518 PolarHBondContact O-N 3.42Å; A515-I519 WeakPolarHBondContact O-CB 3.32Å; A515-I519 WeakPolarHBondContact O-CG1 3.31Å; A515-I519 PolarHBondContact O-N 3.31Å
516	K	94.4	Very high	91.1	Very high	89 Å²	89	64.5 Å²	64.5	39%	0.387	33%	0.328	S	S	.	.	H	α-helix	trans	-58.2	-40.5	175.7	-79.2	-177.3	162.6	-158	0	113.6	A326 I512 A514 A520	A326-K516 WeakPolarHBondContact O-CE 3.37Å; A326-K516 PolarHBondContact O-NZ 2.75Å; I512-K516 HydrophobicContact CG2-CD 4.43Å; I512-K516 WeakPolarHBondContact O-CB 3.33Å; I512-K516 WeakPolarHBondContact O-CG 3.21Å; I512-K516 PolarHBondContact O-N 3.47Å; I512-K516 VanDerWaalsContact O-N 3.12Å; A514-K516 PolarHBondContact O-N 3.08Å; K516-A520 VanDerWaalsContact O-CB 3.24Å; K516-A520 WeakPolarHBondContact O-CB 3.42Å; K516-A520 PolarHBondContact O-N 3.26Å
517	R	94.7	Very high	89.5	Confident	184 Å²	184	66.8 Å²	66.8	69%	0.694	35%	0.347	S	S	*	.	H	α-helix	trans	-66.6	-43.1	176.6	-75.5	171.8	-179.8	-179.3	1.8	111.3	V513 A514 A515 A520 A521	V513-R517 WeakPolarHBondContact O-CB 3.24Å; V513-R517 VanDerWaalsContact O-CG 3.25Å; V513-R517 WeakPolarHBondContact O-CG 3.4Å; V513-R517 PolarHBondContact O-N 3.02Å; V513-R517 VanDerWaalsContact O-N 3.08Å; A514-R517 WeakPolarHBondContact O-CB 3.48Å; A514-R517 PolarHBondContact O-N 3.45Å; A514-R517 VanDerWaalsContact O-N 3.1Å; A515-R517 VanDerWaalsContact C-N 3.32Å; A515-R517 PolarHBondContact O-N 3.28Å; R517-A520 PolarHBondContact O-N 3.07Å; R517-A521 WeakPolarHBondContact O-CB 3.29Å; R517-A521 PolarHBondContact O-N 3.29Å
518	S	92.7	Very high	89.1	Confident	41 Å²	41	68.8 Å²	68.8	29%	0.287	36%	0.355	S	S	.	.	H	α-helix	trans	-60.7	-52.3	176.3	-174.3	0	0	0	0	111.2	E336 A514 A515 A520 A521 Q522	E336-S518 VanDerWaalsContact OE2-CB 3.29Å; E336-S518 WeakPolarHBondContact OE2-CB 3.36Å; E336-S518 PolarHBondContact OE2-OG 3.01Å; A514-S518 PolarHBondContact O-N 2.74Å; A515-S518 PolarHBondContact O-N 3.42Å; S518-A520 VanDerWaalsContact C-N 3.34Å; S518-A520 PolarHBondContact O-N 2.93Å; S518-A521 PolarHBondContact O-N 3.01Å; S518-Q522 WeakPolarHBondContact O-CG 3.43Å; S518-Q522 PolarHBondContact O-N 3.37Å; S518-Q522 PolarHBondContact OG-NE2 3.01Å; S518-Q522 VanDerWaalsContact OG-NE2 3.07Å
519	I	90.3	Very high	88.7	Confident	36 Å²	36	72.2 Å²	72.2	19%	0.185	37%	0.373	C	S	.	.	H	α-helix	trans	-59.1	-42.7	178.8	-73.2	161.6	0	0	0	111.4	D332 E336 A515 Q522 Q523	D332-I519 HydrophobicContact CB-CD1 3.66Å; D332-I519 WeakPolarHBondContact OD1-CD1 3.46Å; E336-I519 HydrophobicContact CG-CD1 3.94Å; E336-I519 HydrophobicContact CG-CG1 3.83Å; A515-I519 WeakPolarHBondContact O-CB 3.32Å; A515-I519 WeakPolarHBondContact O-CG1 3.31Å; A515-I519 PolarHBondContact O-N 3.31Å; I519-Q522 PolarHBondContact O-N 3.37Å; I519-Q523 VanDerWaalsContact O-CG 3.23Å; I519-Q523 WeakPolarHBondContact O-CG 3.27Å; I519-Q523 PolarHBondContact O-N 3.3Å; I519-Q523 PolarHBondContact O-NE2 2.99Å
520	A	90.3	Very high	88.2	Confident	39 Å²	39	70.2 Å²	70.2	32%	0.322	37%	0.37	S	S	.	.	H	α-helix	trans	-66	-35.9	175.6	0	0	0	0	0	113	K516 R517 S518 Q524	K516-A520 VanDerWaalsContact O-CB 3.24Å; K516-A520 WeakPolarHBondContact O-CB 3.42Å; K516-A520 PolarHBondContact O-N 3.26Å; R517-A520 PolarHBondContact O-N 3.07Å; S518-A520 VanDerWaalsContact C-N 3.34Å; S518-A520 PolarHBondContact O-N 2.93Å; A520-Q524 WeakPolarHBondContact O-CG 3.26Å; A520-Q524 PolarHBondContact O-N 3.03Å
521	A	90.4	Very high	87.8	Confident	42 Å²	42	68.5 Å²	68.5	35%	0.347	37%	0.365	S	S	.	.	H	α-helix	trans	-70.7	-40.8	176.7	0	0	0	0	0	112	R517 S518 Q523 Q524 Q525	R517-A521 WeakPolarHBondContact O-CB 3.29Å; R517-A521 PolarHBondContact O-N 3.29Å; S518-A521 PolarHBondContact O-N 3.01Å; A521-Q523 VanDerWaalsContact C-N 3.34Å; A521-Q523 PolarHBondContact O-N 3.36Å; A521-Q524 PolarHBondContact O-N 3.31Å; A521-Q525 WeakPolarHBondContact O-CG 3.47Å; A521-Q525 PolarHBondContact O-N 3.35Å
522	Q	85.8	Confident	87.2	Confident	57 Å²	57	72.4 Å²	72.4	27%	0.266	39%	0.386	S	S	.	.	H	α-helix	trans	-62.2	-41.3	174.7	-70.1	173	28.5	0	0	111.6	E336 S518 I519 Q524 Q525 Q526	E336-Q522 PolarHBondContact OE2-NE2 3.2Å; S518-Q522 WeakPolarHBondContact O-CG 3.43Å; S518-Q522 PolarHBondContact O-N 3.37Å; S518-Q522 PolarHBondContact OG-NE2 3.01Å; S518-Q522 VanDerWaalsContact OG-NE2 3.07Å; I519-Q522 PolarHBondContact O-N 3.37Å; Q522-Q524 VanDerWaalsContact C-N 3.33Å; Q522-Q524 PolarHBondContact O-N 3.35Å; Q522-Q525 PolarHBondContact O-N 2.57Å; Q522-Q525 VanDerWaalsContact O-N 3.15Å; Q522-Q526 WeakPolarHBondContact O-CG 3.2Å; Q522-Q526 PolarHBondContact O-N 3.08Å
523	Q	77.8	Confident	86.5	Confident	52 Å²	52	77.1 Å²	77.1	24%	0.243	41%	0.411	C	S	.	.	H	α-helix	trans	-58.6	-43	173.7	-75.2	171.4	41.8	0	0	112.6	P144 I519 A521 Q525 Q526 A527	P144-Q523 HydrophobicContact CB-CG 3.52Å; P144-Q523 HydrophobicContact CG-CG 3.67Å; I519-Q523 VanDerWaalsContact O-CG 3.23Å; I519-Q523 WeakPolarHBondContact O-CG 3.27Å; I519-Q523 PolarHBondContact O-N 3.3Å; I519-Q523 PolarHBondContact O-NE2 2.99Å; A521-Q523 VanDerWaalsContact C-N 3.34Å; A521-Q523 PolarHBondContact O-N 3.36Å; Q523-Q525 PolarHBondContact O-N 3.09Å; Q523-Q526 PolarHBondContact O-N 2.79Å; Q523-A527 WeakPolarHBondContact O-CB 3.48Å; Q523-A527 PolarHBondContact O-N 3.26Å; Q523-A527 VanDerWaalsContact O-N 3.13Å
524	Q	80.9	Confident	85.7	Confident	151 Å²	151	80.6 Å²	80.6	71%	0.706	43%	0.428	S	S	*	.	H	α-helix	trans	-70.2	-14.4	178.8	-70.7	172.1	20.4	0	0	113.7	A520 A521 Q522	A520-Q524 WeakPolarHBondContact O-CG 3.26Å; A520-Q524 PolarHBondContact O-N 3.03Å; A521-Q524 PolarHBondContact O-N 3.31Å; Q522-Q524 VanDerWaalsContact C-N 3.33Å; Q522-Q524 PolarHBondContact O-N 3.35Å
525	Q	78.9	Confident	84.9	Confident	162 Å²	162	84.8 Å²	84.8	76%	0.757	44%	0.444	S	S	*	.	H	α-helix	trans	-93.4	-14.2	173.4	-66.9	173.3	18.5	0	0	113	A521 Q522 Q523	A521-Q525 WeakPolarHBondContact O-CG 3.47Å; A521-Q525 PolarHBondContact O-N 3.35Å; Q522-Q525 PolarHBondContact O-N 2.57Å; Q522-Q525 VanDerWaalsContact O-N 3.15Å; Q523-Q525 PolarHBondContact O-N 3.09Å
526	Q	68	Low	84	Confident	134 Å²	134	91.7 Å²	91.7	63%	0.626	48%	0.48	S	S	*	.	H	α-helix	trans	-103.8	-12.9	179.8	-67.6	179.7	17.2	0	0	113.7	Q522 Q523	Q522-Q526 WeakPolarHBondContact O-CG 3.2Å; Q522-Q526 PolarHBondContact O-N 3.08Å; Q523-Q526 PolarHBondContact O-N 2.79Å
527	A	63.4	Low	83	Confident	113 Å²	113	91.9 Å²	91.9	93%	0.934	49%	0.488	S	S	*	.			trans	-97.3	0	177.3	0	0	0	0	0	112	M146 Q523	M146-A527 HydrophobicContact CE-CB 3.85Å; Q523-A527 WeakPolarHBondContact O-CB 3.48Å; Q523-A527 PolarHBondContact O-N 3.26Å; Q523-A527 VanDerWaalsContact O-N 3.13Å

Retrieved 527 of 527 residues in 305.6 ms (Link to these results)

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