A0A077ZAB2_TRITR Loading...

Glucosaminidase and NLPC P60 domain containing pr otein

AlphaFold DB , UniProt , Accession A0A077ZAB2, Species TRITR (Trichuris trichiura, Whipworm), Gene n/a, Length 648 aa.

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(Predicted Aligned Error values between residue pairs)

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Site	Residue	pLDDT	pLDDT confidence	pLDDT₁₀	pLDDT10 confidence	SASA	SASA [Å²]	SASA₁₀	SASA10 [Å²]	RSA	RSA unformatted	RSA₁₀	RSA10 unformatted	Surface	Surface10 (not used)	Disorder (not used)	Disorder	Sec. str.	Secondary structure	Isomer	Phi (φ)	Psi (ψ)	Omega (ω)	Chi 1 (χ₁)	Chi 2 (χ₂)	Chi 3 (χ₃)	Chi 4 (χ₄)	Chi 5 (χ₅)	Tau (τ)	Contacts (colored by PAE)	Contact details
1	M	33.8	Very low	28.5	Very low	246 Å²	246	163 Å²	163	100%	1.212	83%	0.833	S	S	*	*				0	136.7	0	-81.6	173.3	174.7	0	0	108.3
2	K	28.7	Very low	28.2	Very low	178 Å²	178	165.1 Å²	165.1	77%	0.774	85%	0.846	S	S	*	*			trans	-55	138.3	179.1	-61.4	171.5	177.4	177.5	0	110.7
3	Y	32.1	Very low	28.3	Very low	240 Å²	240	158.2 Å²	158.2	94%	0.941	84%	0.841	S	S	*	*			trans	-130.4	119.2	140.5	-101.4	-81.9	0	0	0	109.5
4	N	29.8	Very low	28	Very low	130 Å²	130	155.4 Å²	155.4	70%	0.695	84%	0.84	S	S	*	*			trans	-82.2	156.1	-171.5	-82.6	-28.3	0	0	0	111.6
5	K	27.1	Very low	28.2	Very low	191 Å²	191	155.2 Å²	155.2	83%	0.83	84%	0.837	S	S	*	*			trans	-21.6	133.2	149.2	-62	177.7	175.7	-177.4	0	114.2
6	I	32.5	Very low	28.3	Very low	169 Å²	169	157.4 Å²	157.4	87%	0.867	84%	0.837	S	S	*	*			trans	-117.9	107.2	147.4	-66.3	177.5	0	0	0	107
7	V	24.5	Very low	28.2	Very low	128 Å²	128	152.2 Å²	152.2	78%	0.776	83%	0.829	S	S	*	*			trans	-117.7	124.1	158.1	168.2	0	0	0	0	104.5
8	S	24.8	Very low	28.4	Very low	103 Å²	103	150.6 Å²	150.6	72%	0.72	83%	0.828	S	S	*	*			trans	178.2	111.8	147.3	-123.4	0	0	0	0	108.2
9	L	24.1	Very low	28.6	Very low	152 Å²	152	149.6 Å²	149.6	80%	0.796	83%	0.827	S	S	*	*				71.2	105.9	90.2	-126.4	95.9	0	0	0	113.2
10	L	31.1	Very low	28.4	Very low	186 Å²	186	149.7 Å²	149.7	97%	0.974	83%	0.825	S	S	*	*			trans	-135.6	92.6	148.7	-102.1	161	0	0	0	107
11	A	24.5	Very low	28.5	Very low	70 Å²	70	151 Å²	151	58%	0.579	83%	0.83	S	S	*	*			trans	-107.5	155.7	159.2	0	0	0	0	0	107.5
12	L	25.6	Very low	28.1	Very low	188 Å²	188	143.4 Å²	143.4	98%	0.984	81%	0.806	S	S	*	*			trans	106.7	122.8	167.8	-62.9	158.8	0	0	0	115.9
13	G	29	Very low	28.2	Very low	76 Å²	76	140.8 Å²	140.8	78%	0.784	81%	0.81	S	S	*	*			trans	161	58.2	160.2	0	0	0	0	0	116.3
14	S	24.9	Very low	28	Very low	118 Å²	118	137.9 Å²	137.9	83%	0.825	81%	0.805	S	S	*	*			trans	-67.7	134.3	162.8	-45.4	0	0	0	0	110.5
15	L	31.1	Very low	28.2	Very low	153 Å²	153	140.8 Å²	140.8	80%	0.801	82%	0.815	S	S	*	*			trans	-154.6	111.2	163.7	-109.6	126.7	0	0	0	112.9
16	F	29.4	Very low	28.1	Very low	191 Å²	191	135.8 Å²	135.8	84%	0.838	81%	0.809	S	S	*	*			trans	35.3	130.2	143.3	-65.3	-86.5	0	0	0	122.9
17	G	26.5	Very low	28.1	Very low	68 Å²	68	137 Å²	137	70%	0.701	81%	0.808	S	S	*	*			trans	-74.4	175.3	156.8	0	0	0	0	0	113.7
18	P	32.3	Very low	28.3	Very low	124 Å²	124	134.8 Å²	134.8	81%	0.805	80%	0.803	S	S	*	*				-141	162	100	33.5	-15.8	0	0	0	112.5
19	T	32.4	Very low	28.4	Very low	132 Å²	132	138.1 Å²	138.1	81%	0.81	81%	0.807	S	S	*	*				-174.1	138.1	83.7	-51.8	0	0	0	0	111.3
20	L	24.2	Very low	28.6	Very low	150 Å²	150	139.1 Å²	139.1	79%	0.785	81%	0.808	S	S	*	*			trans	-46.2	151.1	169.7	-90.1	70.8	0	0	0	115.8
21	L	29.4	Very low	28.4	Very low	178 Å²	178	134.9 Å²	134.9	93%	0.932	79%	0.794	S	S	*	*				-157.1	141.3	109	-124.8	80.3	0	0	0	111.2
22	A	26.4	Very low	28.5	Very low	86 Å²	86	136.1 Å²	136.1	71%	0.711	80%	0.799	S	S	*	*			trans	-84.9	148.3	-165.5	0	0	0	0	0	114.3
23	S	30.2	Very low	28.5	Very low	123 Å²	123	132.7 Å²	132.7	86%	0.86	79%	0.785	S	S	*	*			trans	-135.9	115.4	137.9	51	0	0	0	0	108.1
24	Q	27.7	Very low	28.2	Very low	179 Å²	179	135.5 Å²	135.5	84%	0.836	79%	0.787	S	S	*	*			trans	-69.8	134.8	172.8	-66.5	-179.3	24.4	0	0	109.3
25	Q	34	Very low	28.3	Very low	191 Å²	191	133.7 Å²	133.7	89%	0.893	78%	0.78	S	S	*	*			trans	-145.5	105.6	143	-123	154.7	-1.4	0	0	108.4
26	A	25.7	Very low	27.8	Very low	86 Å²	86	131.8 Å²	131.8	71%	0.711	78%	0.779	S	S	*	*			trans	-91	123.6	176.7	0	0	0	0	0	109.2
27	F	33.4	Very low	27.6	Very low	195 Å²	195	129.6 Å²	129.6	86%	0.855	78%	0.776	S	S	*	*			trans	-138.6	106.1	146.9	-87.1	-82	0	0	0	102.2
28	A	27	Very low	27.3	Very low	81 Å²	81	131.2 Å²	131.2	67%	0.669	78%	0.776	S	S	*	*				42.3	119.5	73	0	0	0	0	0	110.1
29	E	28.4	Very low	26.9	Very low	173 Å²	173	129.9 Å²	129.9	81%	0.808	78%	0.776	S	S	*	*			cis	-161.7	132.7	15.8	-101.5	163.4	162.3	0	0	103.3
30	E	27.3	Very low	26.5	Very low	174 Å²	174	127.7 Å²	127.7	81%	0.813	77%	0.771	S	S	*	*				92.4	131.6	91.4	-150	-177	-131.9	0	0	113.8
31	S	26.4	Very low	26.4	Very low	96 Å²	96	126.8 Å²	126.8	67%	0.671	77%	0.772	S	S	*	*			trans	73.3	104.3	155.9	-127.8	0	0	0	0	117.4
32	S	26.6	Very low	26	Very low	97 Å²	97	123 Å²	123	68%	0.678	76%	0.76	S	S	*	*				82.1	139.5	94.4	77.4	0	0	0	0	110.7
33	T	26	Very low	25.9	Very low	115 Å²	115	123.8 Å²	123.8	71%	0.706	76%	0.761	S	S	*	*			cis	-174.6	139.3	-0.6	12	0	0	0	0	103.9
34	V	23.7	Very low	25.6	Very low	135 Å²	135	121.9 Å²	121.9	82%	0.818	75%	0.748	S	S	*	*			trans	72.6	129.8	136.9	-177.9	0	0	0	0	120.6
35	A	26.6	Very low	25.5	Very low	81 Å²	81	121.3 Å²	121.3	67%	0.669	75%	0.745	S	S	*	*			trans	83.7	92	149.3	0	0	0	0	0	119.9
36	S	20.2	Very low	25	Very low	112 Å²	112	118.8 Å²	118.8	78%	0.783	73%	0.733	S	S	*	*				9	106.7	110.1	-41.9	0	0	0	0	117.7
37	N	25	Very low	24.8	Very low	146 Å²	146	119.7 Å²	119.7	78%	0.781	73%	0.73	S	S	*	*				177.6	108.8	129	-94.3	-15.3	0	0	0	106.6
38	S	21.7	Very low	24.4	Very low	101 Å²	101	115.2 Å²	115.2	71%	0.706	72%	0.718	S	S	*	*				56.6	120.3	84.2	75.3	0	0	0	0	114
39	A	23.4	Very low	24.2	Very low	97 Å²	97	119.4 Å²	119.4	80%	0.802	72%	0.724	S	S	*	*			trans	82.7	118.2	158.5	0	0	0	0	0	119.6
40	A	23.2	Very low	24.1	Very low	85 Å²	85	116 Å²	116	70%	0.702	72%	0.719	S	S	*	*				90.8	104.7	124.1	0	0	0	0	0	118.9
41	T	21.7	Very low	24	Very low	132 Å²	132	113 Å²	113	81%	0.81	72%	0.717	S	S	*	*				85.6	120.2	112.6	-50.7	0	0	0	0	118.5
42	S	22.3	Very low	24	Very low	98 Å²	98	112.7 Å²	112.7	69%	0.685	72%	0.715	S	S	*	*			trans	85.4	132.8	140.4	-123.9	0	0	0	0	119.8
43	S	24.2	Very low	23.9	Very low	102 Å²	102	114.9 Å²	114.9	71%	0.713	73%	0.725	S	S	*	*			trans	72.3	140.5	138.2	76.1	0	0	0	0	114.2
44	S	23	Very low	24	Very low	84 Å²	84	112.7 Å²	112.7	59%	0.587	73%	0.726	S	S	*	*			cis	167.9	160.5	-1	42.7	0	0	0	0	102
45	Q	25.4	Very low	24.3	Very low	167 Å²	167	115.1 Å²	115.1	78%	0.78	73%	0.728	S	S	*	*			trans	71.3	142.9	155.6	-87.5	172.4	-5.9	0	0	113.7
46	Q	24.5	Very low	24.3	Very low	137 Å²	137	117.8 Å²	117.8	64%	0.64	74%	0.736	S	S	*	*			cis	-176.8	149.4	9.6	-151.3	-179.8	-72	0	0	105.4
47	T	21.9	Very low	24.9	Very low	105 Å²	105	116.1 Å²	116.1	64%	0.644	74%	0.737	S	S	*	*			trans	61.8	151.9	143	45.7	0	0	0	0	118.1
48	T	23.8	Very low	25.2	Very low	101 Å²	101	115.6 Å²	115.6	62%	0.62	74%	0.744	S	S	*	*			cis	-170.8	146.4	20.2	4.8	0	0	0	0	106.4
49	E	24	Very low	26	Very low	170 Å²	170	115.7 Å²	115.7	79%	0.794	75%	0.745	S	S	*	*			trans	69	123.9	133.4	-72	179.1	-177.9	0	0	123
50	S	26	Very low	26.6	Very low	100 Å²	100	120.6 Å²	120.6	70%	0.699	75%	0.751	S	S	*	*				92.8	114.8	122.3	-70.2	0	0	0	0	120.1
51	S	24.7	Very low	27.6	Very low	111 Å²	111	120.4 Å²	120.4	78%	0.776	75%	0.75	S	S	*	*				61.5	143.8	129.2	111.5	0	0	0	0	117.5
52	S	25.3	Very low	28.7	Very low	90 Å²	90	120 Å²	120	63%	0.629	75%	0.749	S	S	*	*			cis	-178.1	149.4	19.4	56.3	0	0	0	0	107.2
53	T	24.9	Very low	29.7	Very low	143 Å²	143	122.6 Å²	122.6	88%	0.877	76%	0.756	S	S	*	*			trans	39.5	129.1	144.6	34.6	0	0	0	0	122.5
54	G	29.6	Very low	31	Very low	70 Å²	70	122.9 Å²	122.9	72%	0.722	76%	0.755	S	S	*	*			trans	150.5	85	157.9	0	0	0	0	0	110.8
55	E	29.1	Very low	32	Very low	185 Å²	185	125 Å²	125	86%	0.864	76%	0.764	S	S	*	*				81.7	110.6	100.3	-92.2	-171.4	173.2	0	0	115.4
56	T	26.8	Very low	33.2	Very low	137 Å²	137	122.7 Å²	122.7	84%	0.84	76%	0.764	S	S	*	*			trans	44.4	105.9	140.2	43.5	0	0	0	0	119.9
57	G	33.2	Very low	34.4	Very low	77 Å²	77	122.7 Å²	122.7	79%	0.794	77%	0.774	S	S	*	*			trans	-160.3	81.1	157.9	0	0	0	0	0	110	S59	G57-S59 PolarHBondContact O-N 2.8Å
58	S	31.6	Very low	35.6	Very low	135 Å²	135	125.9 Å²	125.9	94%	0.944	78%	0.781	S	S	*	*			trans	-66.6	97.2	170.7	-63	0	0	0	0	109.3
59	S	37.9	Very low	36.9	Very low	104 Å²	104	126.4 Å²	126.4	73%	0.727	79%	0.787	S	S	*	*			trans	-129.8	98.8	165	165.3	0	0	0	0	106	G57 A61	G57-S59 PolarHBondContact O-N 2.8Å; S59-A61 PolarHBondContact O-N 2.87Å
60	E	36.5	Very low	38.3	Very low	199 Å²	199	124.4 Å²	124.4	93%	0.93	79%	0.786	S	S	*	*			trans	-54.1	95.4	174.8	-163.1	168.5	-169.9	0	0	109.4
61	A	42.7	Very low	40.1	Very low	81 Å²	81	125.1 Å²	125.1	67%	0.669	79%	0.788	S	S	*	*	P	Polyproline II helix	trans	-80.6	138.3	171.1	0	0	0	0	0	108.3	S59	S59-A61 PolarHBondContact O-N 2.87Å
62	P	45.4	Very low	42.2	Very low	123 Å²	123	128.5 Å²	128.5	80%	0.799	79%	0.792	S	S	*	*	P	Polyproline II helix	trans	-66.3	137.6	-168.6	27.4	-32.9	0	0	0	110.9
63	D	44.6	Very low	44.6	Very low	154 Å²	154	130.1 Å²	130.1	82%	0.824	80%	0.8	S	S	*	*	P	Polyproline II helix	trans	-50.6	128.4	178	-132.6	-6.8	0	0	0	110.1	T65	D63-T65 PolarHBondContact O-N 3.4Å
64	P	51.4	Low	47.2	Very low	107 Å²	107	125.5 Å²	125.5	70%	0.695	78%	0.777	S	S	*	*	P	Polyproline II helix	trans	-62.2	126.7	-179.3	24.7	-32.2	0	0	0	109.4
65	T	43.8	Very low	49.9	Very low	128 Å²	128	129.3 Å²	129.3	79%	0.785	77%	0.773	S	S	*	*	P	Polyproline II helix	trans	-53	126.1	174.7	-31.5	0	0	0	0	108.3	D63 T67	D63-T65 PolarHBondContact O-N 3.4Å; T65-T67 PolarHBondContact O-N 2.95Å
66	P	50.5	Low	52.7	Low	119 Å²	119	126.6 Å²	126.6	77%	0.773	76%	0.761	S	S	*	*	P	Polyproline II helix	trans	-56.2	121.1	-177.1	-21.6	30.6	0	0	0	108.9	E68	P66-E68 PolarHBondContact O-N 3.39Å
67	T	48.2	Very low	55.9	Low	137 Å²	137	121.1 Å²	121.1	84%	0.84	73%	0.725	S	S	*	*			trans	-63.3	105.2	171.5	-44.6	0	0	0	0	106.6	T65	T65-T67 PolarHBondContact O-N 2.95Å
68	E	47.6	Very low	58.7	Low	172 Å²	172	121 Å²	121	80%	0.804	71%	0.706	S	S	*	*	P	Polyproline II helix	trans	-55.4	125.5	176.8	-166.2	172.2	-169.5	0	0	107.9	P66 T70	P66-E68 PolarHBondContact O-N 3.39Å; E68-T70 PolarHBondContact O-N 3.13Å
69	P	51.3	Low	61.7	Low	113 Å²	113	114.9 Å²	114.9	73%	0.734	66%	0.663	S	S	*	*	P	Polyproline II helix	trans	-59.9	126.8	-176.6	22.2	-30.8	0	0	0	108.9	P71	P69-P71 WeakPolarHBondContact O-CD 3.11Å; P69-P71 VanDerWaalsContact O-N 3.16Å
70	T	54.2	Low	64.4	Low	128 Å²	128	111 Å²	111	79%	0.785	63%	0.633	S	S	*	*	P	Polyproline II helix	trans	-54.7	120.9	174.1	-52.1	0	0	0	0	108.2	E68 E72	E68-T70 PolarHBondContact O-N 3.13Å; T70-E72 PolarHBondContact O-N 3.07Å
71	P	62.1	Low	66.9	Low	114 Å²	114	102.6 Å²	102.6	74%	0.74	60%	0.598	S	S	*	*	P	Polyproline II helix	trans	-58.8	130	-177.1	19.4	-29.2	0	0	0	109.9	P69	P69-P71 WeakPolarHBondContact O-CD 3.11Å; P69-P71 VanDerWaalsContact O-N 3.16Å
72	E	70.6	Confident	69	Low	183 Å²	183	106.2 Å²	106.2	86%	0.855	61%	0.606	S	S	*	*	P	Polyproline II helix	trans	-57.9	140.8	174.3	-84.6	-172.3	156.8	0	0	109.9	T70 A74	T70-E72 PolarHBondContact O-N 3.07Å; E72-A74 PolarHBondContact O-N 3.02Å
73	P	74.4	Confident	70.9	Confident	124 Å²	124	103.2 Å²	103.2	81%	0.805	60%	0.597	S	S	*	*	P	Polyproline II helix	trans	-59.8	134	176.2	24.8	-32.3	0	0	0	110.1	K75	P73-K75 PolarHBondContact O-N 2.72Å
74	A	79.2	Confident	73	Confident	46 Å²	46	99.4 Å²	99.4	38%	0.38	58%	0.583	S	S	.	*	P	Polyproline II helix	trans	-57	137.6	178.8	0	0	0	0	0	111.4	E72 Q76 E107 V110	E72-A74 PolarHBondContact O-N 3.02Å; A74-Q76 PolarHBondContact O-N 2.97Å; A74-E107 WeakPolarHBondContact CB-OE2 3.5Å; A74-V110 HydrophobicContact CB-CB 4.3Å; A74-V110 HydrophobicContact CB-CG1 3.63Å
75	K	86.8	Confident	74.7	Confident	149 Å²	149	98.4 Å²	98.4	65%	0.648	58%	0.576	S	S	*	*	P	Polyproline II helix	trans	-64.5	124	-179.1	-174.3	177.4	178.2	-174.3	0	110.5	P73 Y77	P73-K75 PolarHBondContact O-N 2.72Å; K75-Y77 HydrophobicContact CD-CE1 3.98Å; K75-Y77 HydrophobicContact CG-CE1 4.18Å
76	Q	88.4	Confident	76.7	Confident	129 Å²	129	93.3 Å²	93.3	60%	0.603	54%	0.544	S	S	*	.	P	Polyproline II helix	trans	-87.1	147	175.8	-66.6	-171.8	-21.4	0	0	111.9	A74 E107 L109	A74-Q76 PolarHBondContact O-N 2.97Å; Q76-E107 PolarHBondContact NE2-O 3.4Å; Q76-L109 CarbonylContact C-O 3.59Å; Q76-L109 WeakPolarHBondContact CA-O 3.29Å
77	Y	92.8	Very high	77.8	Confident	22 Å²	22	91.1 Å²	91.1	9%	0.086	54%	0.536	C	S	.	.			trans	-123.2	159.9	178.6	-58	-69.1	0	0	0	111.1	K75 L109 A111 M153 D155 S156 D157	K75-Y77 HydrophobicContact CD-CE1 3.98Å; K75-Y77 HydrophobicContact CG-CE1 4.18Å; Y77-L109 PolarHBondContact N-O 2.79Å; Y77-L109 WeakPolarHBondContact O-CB 3.46Å; Y77-L109 WeakPolarHBondContact O-CD1 3.47Å; Y77-A111 HydrophobicContact CE2-CB 4Å; Y77-M153 HydrophobicContact CG-CE 4.44Å; Y77-D155 WeakPolarHBondContact CE1-O 3.31Å; Y77-D155 VanDerWaalsContact CZ-CA 3.44Å; Y77-D155 VanDerWaalsContact OH-CA 3.32Å; Y77-D155 WeakPolarHBondContact OH-CA 3.48Å; Y77-D155 PolarHBondContact OH-O 2.76Å; Y77-S156 VanDerWaalsContact CE1-CA 3.5Å; Y77-S156 VanDerWaalsContact CE1-N 3.3Å; Y77-D157 VanDerWaalsContact CA-OD1 3.31Å; Y77-D157 WeakPolarHBondContact CA-OD1 3.35Å
78	N	93.2	Very high	78.7	Confident	73 Å²	73	90.8 Å²	90.8	39%	0.39	53%	0.529	S	S	.	.			trans	-110	146.6	-176.6	-56.5	-66.6	0	0	0	112.6	L80 D157 V158	N78-L80 HydrophobicContact CB-CD2 3.64Å; N78-L80 HydrophobicContact CB-CG 4.4Å; N78-D157 HydrophobicContact CB-CB 4.47Å; N78-D157 PolarHBondContact N-OD1 3.03Å; N78-D157 PolarHBondContact ND2-OD2 3.32Å; N78-D157 VanDerWaalsContact ND2-OD2 3.09Å; N78-D157 WeakPolarHBondContact O-CA 3.45Å; N78-V158 PolarHBondContact O-N 2.75Å
79	L	93.6	Very high	80.3	Confident	8 Å²	8	84.2 Å²	84.2	4%	0.042	50%	0.499	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-86.6	117.7	160.7	-57.2	-176.6	0	0	0	107.8	P85 I86 F101 L109 V115 F151 M153 V158 I160	L79-P85 WeakPolarHBondContact O-CA 3.39Å; L79-I86 HydrophobicContact CB-CD1 4.09Å; L79-I86 WeakPolarHBondContact O-CG1 3.48Å; L79-I86 PolarHBondContact O-N 3.28Å; L79-F101 HydrophobicContact CD1-CB 3.6Å; L79-F101 HydrophobicContact CD1-CD1 3.88Å; L79-F101 HydrophobicContact CD1-CD2 4Å; L79-F101 HydrophobicContact CD1-CG 3.53Å; L79-L109 HydrophobicContact CD1-CD1 4.24Å; L79-L109 HydrophobicContact CD2-CD1 4.32Å; L79-L109 HydrophobicContact CG-CD1 3.73Å; L79-V115 HydrophobicContact CD1-CG1 4.02Å; L79-V115 HydrophobicContact CD2-CG1 4.36Å; L79-F151 HydrophobicContact CD2-CE2 4.39Å; L79-F151 HydrophobicContact CD2-CZ 3.9Å; L79-M153 HydrophobicContact CD2-CE 4.44Å; L79-M153 HydrophobicContact CD2-SD 4Å; L79-V158 HydrophobicContact CD2-CG2 3.46Å; L79-V158 VanDerWaalsContact CD2-CG2 3.46Å; L79-I160 HydrophobicContact CB-CD1 3.73Å; L79-I160 HydrophobicContact CD2-CD1 4.28Å; L79-I160 HydrophobicContact CG-CD1 4.39Å
80	L	94.6	Very high	81.7	Confident	21 Å²	21	80.4 Å²	80.4	11%	0.11	47%	0.474	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-108.2	135	-178.3	-50.5	-177.5	0	0	0	110.9	N78 S84 P85 T135 D157 V158 S159 I160	N78-L80 HydrophobicContact CB-CD2 3.64Å; N78-L80 HydrophobicContact CB-CG 4.4Å; L80-S84 CarbonylContact C-O 3.53Å; L80-S84 VanDerWaalsContact CA-O 3.24Å; L80-S84 WeakPolarHBondContact CA-O 3.34Å; L80-P85 HydrophobicContact CD2-CB 4.26Å; L80-P85 HydrophobicContact CD2-CG 3.91Å; L80-T135 HydrophobicContact CD1-CG2 3.94Å; L80-D157 HydrophobicContact CD1-CB 4.05Å; L80-D157 HydrophobicContact CG-CB 4.27Å; L80-V158 WeakPolarHBondContact CB-O 3.3Å; L80-V158 PolarHBondContact N-O 3.18Å; L80-S159 CarbonylContact O-C 3.56Å; L80-S159 WeakPolarHBondContact O-CA 3.41Å; L80-I160 PolarHBondContact O-N 3.05Å
81	A	90.2	Very high	83.3	Confident	23 Å²	23	74.9 Å²	74.9	19%	0.19	44%	0.441	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-116.9	129.1	163.8	0	0	0	0	0	108.4	G83 S84 I86 A91	A81-G83 PolarHBondContact O-N 2.92Å; A81-G83 VanDerWaalsContact O-N 3.13Å; A81-S84 PolarHBondContact N-O 3.4Å; A81-S84 PolarHBondContact O-N 2.99Å; A81-I86 HydrophobicContact CB-CD1 3.92Å; A81-I86 HydrophobicContact CB-CG1 3.67Å; A81-A91 HydrophobicContact CB-CB 3.79Å
82	N	86.2	Confident	84.5	Confident	158 Å²	158	72.5 Å²	72.5	85%	0.845	43%	0.432	S	S	*	.	T	Hydrogen-bonded Turn	trans	49.8	38	-176.6	-59.8	-26.6	0	0	0	113.4	S84	N82-S84 VanDerWaalsContact C-N 3.26Å; N82-S84 PolarHBondContact O-N 2.84Å
83	G	84.9	Confident	85.3	Confident	59 Å²	59	65.9 Å²	65.9	61%	0.608	40%	0.402	S	S	*	.	T	Hydrogen-bonded Turn	trans	78.1	-2.5	-179.9	0	0	0	0	0	115.8	A81	A81-G83 PolarHBondContact O-N 2.92Å; A81-G83 VanDerWaalsContact O-N 3.13Å
84	S	88.8	Confident	85.9	Confident	74 Å²	74	65.3 Å²	65.3	52%	0.517	41%	0.408	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-107.6	143.5	177.3	-60.3	0	0	0	0	111.5	L80 A81 N82 I86	L80-S84 CarbonylContact C-O 3.53Å; L80-S84 VanDerWaalsContact CA-O 3.24Å; L80-S84 WeakPolarHBondContact CA-O 3.34Å; A81-S84 PolarHBondContact N-O 3.4Å; A81-S84 PolarHBondContact O-N 2.99Å; N82-S84 VanDerWaalsContact C-N 3.26Å; N82-S84 PolarHBondContact O-N 2.84Å; S84-I86 PolarHBondContact O-N 2.91Å
85	P	88.1	Confident	86.3	Confident	86 Å²	86	67 Å²	67	56%	0.558	41%	0.411	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-54.9	135.3	170.8	-24.9	34.2	0	0	0	111.8	L79 L80 A87	L79-P85 WeakPolarHBondContact O-CA 3.39Å; L80-P85 HydrophobicContact CD2-CB 4.26Å; L80-P85 HydrophobicContact CD2-CG 3.91Å; P85-A87 PolarHBondContact O-N 2.7Å
86	I	85.4	Confident	86	Confident	22 Å²	22	61.8 Å²	61.8	11%	0.113	40%	0.399	C	S	.	.			trans	-73.8	115.9	178.4	-62.8	176.8	0	0	0	109.2	L79 A81 S84 T90 A91 F101 I160	L79-I86 HydrophobicContact CB-CD1 4.09Å; L79-I86 WeakPolarHBondContact O-CG1 3.48Å; L79-I86 PolarHBondContact O-N 3.28Å; A81-I86 HydrophobicContact CB-CD1 3.92Å; A81-I86 HydrophobicContact CB-CG1 3.67Å; S84-I86 PolarHBondContact O-N 2.91Å; I86-T90 VanDerWaalsContact CG2-N 3.25Å; I86-T90 WeakPolarHBondContact CG2-O 3.32Å; I86-A91 HydrophobicContact CD1-CB 3.84Å; I86-A91 HydrophobicContact CG1-CB 4.08Å; I86-A91 HydrophobicContact CG2-CB 4.1Å; I86-F101 HydrophobicContact CD1-CD2 4.12Å; I86-F101 HydrophobicContact CD1-CE2 3.53Å; I86-F101 HydrophobicContact CD1-CZ 4.21Å; I86-I160 HydrophobicContact CD1-CD1 3.39Å
87	A	72.6	Confident	85.9	Confident	72 Å²	72	55.7 Å²	55.7	60%	0.595	37%	0.37	S	S	*	.	G	3₁₀ helix	trans	-70.8	142.6	172.3	0	0	0	0	0	111	P85 N89 T90	P85-A87 PolarHBondContact O-N 2.7Å; A87-N89 PolarHBondContact O-N 2.85Å; A87-T90 PolarHBondContact O-N 3.36Å; A87-T90 VanDerWaalsContact O-N 3.13Å
88	N	67.6	Low	85.6	Confident	131 Å²	131	58.3 Å²	58.3	70%	0.701	38%	0.383	S	S	*	.	G	3₁₀ helix	trans	54.5	25.6	176.7	-55.6	-28.4	0	0	0	114.9	T90 N334	N88-T90 PolarHBondContact O-N 3.32Å; N88-T90 PolarHBondContact O-OG1 2.98Å; N88-N334 PolarHBondContact O-ND2 3.45Å
89	N	81	Confident	85.3	Confident	33 Å²	33	54.9 Å²	54.9	18%	0.176	37%	0.365	C	S	.	.	G	3₁₀ helix	trans	52	25.1	-174.7	-61.5	-20.3	0	0	0	113.7	A87 S100 F101	A87-N89 PolarHBondContact O-N 2.85Å; N89-S100 CarbonylContact O-C 3.58Å; N89-S100 VanDerWaalsContact O-CA 3.32Å; N89-S100 WeakPolarHBondContact O-CA 3.4Å; N89-F101 HydrophobicContact CB-CB 4.22Å; N89-F101 VanDerWaalsContact CB-O 3.29Å; N89-F101 WeakPolarHBondContact CB-O 3.19Å; N89-F101 WeakPolarHBondContact O-CD2 3.46Å; N89-F101 PolarHBondContact O-N 2.77Å
90	T	81.6	Confident	84.6	Confident	33 Å²	33	54.6 Å²	54.6	20%	0.202	36%	0.363	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-133.5	121.5	178.7	-53.3	0	0	0	0	110	I86 A87 N88 Q98 I99 S100	I86-T90 VanDerWaalsContact CG2-N 3.25Å; I86-T90 WeakPolarHBondContact CG2-O 3.32Å; A87-T90 PolarHBondContact O-N 3.36Å; A87-T90 VanDerWaalsContact O-N 3.13Å; N88-T90 PolarHBondContact O-N 3.32Å; N88-T90 PolarHBondContact O-OG1 2.98Å; T90-Q98 HydrophobicContact CG2-CB 4.09Å; T90-I99 CarbonylContact C-O 3.59Å; T90-I99 WeakPolarHBondContact CA-O 3.33Å; T90-S100 PolarHBondContact OG1-OG 2.95Å
91	A	87.1	Confident	84.1	Confident	12 Å²	12	53.6 Å²	53.6	10%	0.099	36%	0.358	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-105.9	141	171.6	0	0	0	0	0	109.9	A81 I86 Q98 I99	A81-A91 HydrophobicContact CB-CB 3.79Å; I86-A91 HydrophobicContact CD1-CB 3.84Å; I86-A91 HydrophobicContact CG1-CB 4.08Å; I86-A91 HydrophobicContact CG2-CB 4.1Å; A91-Q98 CarbonylContact O-C 3.46Å; A91-Q98 VanDerWaalsContact O-CA 3.23Å; A91-Q98 WeakPolarHBondContact O-CA 3.12Å; A91-I99 HydrophobicContact CB-CG2 3.87Å; A91-I99 PolarHBondContact N-O 3.19Å; A91-I99 PolarHBondContact O-N 3.28Å
92	A	87	Confident	83.5	Confident	65 Å²	65	53.8 Å²	53.8	54%	0.537	36%	0.355	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-123.5	147.9	178.3	0	0	0	0	0	111.1	N97 Q98	A92-N97 CarbonylContact C-O 3.52Å; A92-N97 WeakPolarHBondContact CA-O 3.33Å; A92-Q98 HydrophobicContact CB-CG 3.92Å
93	D	88.6	Confident	82.9	Confident	43 Å²	43	49.3 Å²	49.3	23%	0.23	33%	0.327	C	S	.	.			trans	-90.4	173.4	168.2	79.5	1.7	0	0	0	111.5	N95 G96 N97 F162	D93-N95 PolarHBondContact O-N 2.93Å; D93-N95 WeakPolarHBondContact OD1-CA 3.46Å; D93-N95 WeakPolarHBondContact OD1-CB 2.85Å; D93-N95 PolarHBondContact OD1-N 2.82Å; D93-G96 PolarHBondContact O-N 3.09Å; D93-G96 PolarHBondContact OD1-N 2.8Å; D93-N97 PolarHBondContact N-O 3.13Å; D93-N97 WeakPolarHBondContact OD1-CB 3.31Å; D93-N97 PolarHBondContact OD1-N 2.79Å; D93-N97 PolarHBondContact OD1-ND2 3.04Å; D93-N97 PolarHBondContact OD2-ND2 2.79Å; D93-F162 HydrophobicContact CB-CE2 4.27Å; D93-F162 HydrophobicContact CB-CZ 3.91Å
94	A	86.6	Confident	81.6	Confident	112 Å²	112	49.8 Å²	49.8	93%	0.926	32%	0.318	S	S	*	.	T	Hydrogen-bonded Turn	trans	-65.6	-16.3	179.5	0	0	0	0	0	114
95	N	86.7	Confident	80.5	Confident	83 Å²	83	48.2 Å²	48.2	44%	0.444	31%	0.307	S	S	.	.	T	Hydrogen-bonded Turn	trans	-92.8	-2.7	-179.5	-59.6	-54.3	0	0	0	112.3	D93 N97 A122 Y125	D93-N95 PolarHBondContact O-N 2.93Å; D93-N95 WeakPolarHBondContact OD1-CA 3.46Å; D93-N95 WeakPolarHBondContact OD1-CB 2.85Å; D93-N95 PolarHBondContact OD1-N 2.82Å; N95-N97 WeakPolarHBondContact CB-ND2 3.44Å; N95-A122 WeakPolarHBondContact O-CB 3.25Å; N95-Y125 HydrophobicContact CB-CE1 4.44Å; N95-Y125 HydrophobicContact CB-CE2 3.78Å; N95-Y125 PolarHBondContact OD1-OH 2.89Å; N95-Y125 VanDerWaalsContact OD1-OH 3.1Å
96	G	80.9	Confident	79	Confident	39 Å²	39	50.5 Å²	50.5	40%	0.402	32%	0.315	S	S	.	.	S	Bend	trans	87.1	7.8	-178.3	0	0	0	0	0	114.4	D93	D93-G96 PolarHBondContact O-N 3.09Å; D93-G96 PolarHBondContact OD1-N 2.8Å
97	N	85.5	Confident	78.3	Confident	0 Å²	0	54.9 Å²	54.9	0%	0	34%	0.335	C	S	.	.			trans	-71.9	140	168.8	-55.3	-82.4	0	0	0	108.5	A92 D93 N95 S120 L121 A122 Y125 F162 V164	A92-N97 CarbonylContact C-O 3.52Å; A92-N97 WeakPolarHBondContact CA-O 3.33Å; D93-N97 PolarHBondContact N-O 3.13Å; D93-N97 WeakPolarHBondContact OD1-CB 3.31Å; D93-N97 PolarHBondContact OD1-N 2.79Å; D93-N97 PolarHBondContact OD1-ND2 3.04Å; D93-N97 PolarHBondContact OD2-ND2 2.79Å; N95-N97 WeakPolarHBondContact CB-ND2 3.44Å; N97-S120 CarbonylContact C-O 3.51Å; N97-S120 WeakPolarHBondContact CA-O 3.24Å; N97-L121 VanDerWaalsContact OD1-CA 3.3Å; N97-L121 WeakPolarHBondContact OD1-CA 3.44Å; N97-A122 PolarHBondContact OD1-N 3.31Å; N97-Y125 WeakPolarHBondContact OD1-CB 3.4Å; N97-F162 HydrophobicContact CB-CE2 3.76Å; N97-F162 HydrophobicContact CB-CZ 4.45Å; N97-V164 HydrophobicContact CB-CG1 4.18Å
98	Q	86.5	Confident	78.6	Confident	77 Å²	77	52.2 Å²	52.2	36%	0.36	31%	0.314	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-128.7	147.6	-175.4	-53.3	-175.6	12	0	0	110.9	T90 A91 A92 V119 S120	T90-Q98 HydrophobicContact CG2-CB 4.09Å; A91-Q98 CarbonylContact O-C 3.46Å; A91-Q98 VanDerWaalsContact O-CA 3.23Å; A91-Q98 WeakPolarHBondContact O-CA 3.12Å; A92-Q98 HydrophobicContact CB-CG 3.92Å; Q98-V119 CarbonylContact O-C 3.58Å; Q98-V119 VanDerWaalsContact O-CA 3.24Å; Q98-V119 WeakPolarHBondContact O-CA 3.16Å; Q98-S120 PolarHBondContact N-O 3.47Å; Q98-S120 PolarHBondContact O-N 3.37Å
99	I	87	Confident	79.5	Confident	1 Å²	1	46.6 Å²	46.6	1%	0.005	28%	0.284	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-122.1	118.7	166.8	-173.7	169.1	0	0	0	108.9	T90 A91 F101 Y117 V118 V119 V130 I160 F162	T90-I99 CarbonylContact C-O 3.59Å; T90-I99 WeakPolarHBondContact CA-O 3.33Å; A91-I99 HydrophobicContact CB-CG2 3.87Å; A91-I99 PolarHBondContact N-O 3.19Å; A91-I99 PolarHBondContact O-N 3.28Å; I99-F101 HydrophobicContact CB-CE2 4.38Å; I99-F101 HydrophobicContact CB-CZ 4.26Å; I99-F101 HydrophobicContact CD1-CE1 3.95Å; I99-F101 HydrophobicContact CD1-CE2 4.47Å; I99-F101 HydrophobicContact CD1-CZ 3.56Å; I99-F101 HydrophobicContact CG1-CE1 4.09Å; I99-F101 HydrophobicContact CG1-CE2 3.99Å; I99-F101 HydrophobicContact CG1-CZ 3.52Å; I99-F101 HydrophobicContact CG2-CE2 3.83Å; I99-F101 HydrophobicContact CG2-CZ 3.83Å; I99-Y117 HydrophobicContact CD1-CD2 3.72Å; I99-Y117 HydrophobicContact CD1-CE2 4.49Å; I99-Y117 HydrophobicContact CD1-CG 4Å; I99-Y117 HydrophobicContact CG1-CD2 4.19Å; I99-Y117 HydrophobicContact CG1-CG 4.45Å; I99-V118 CarbonylContact C-O 3.58Å; I99-V118 VanDerWaalsContact CA-O 3.31Å; I99-V118 WeakPolarHBondContact CA-O 3.47Å; I99-V119 HydrophobicContact CB-CG2 4.3Å; I99-V119 HydrophobicContact CD1-CG2 4Å; I99-V119 HydrophobicContact CG1-CG2 4.04Å; I99-V130 HydrophobicContact CD1-CG1 3.71Å; I99-V130 HydrophobicContact CD1-CG2 4.17Å; I99-I160 HydrophobicContact CD1-CG2 4.03Å; I99-F162 HydrophobicContact CB-CD1 4.14Å; I99-F162 HydrophobicContact CB-CE1 4.28Å; I99-F162 HydrophobicContact CG2-CD1 3.54Å; I99-F162 HydrophobicContact CG2-CE1 3.55Å; I99-F162 HydrophobicContact CG2-CG 4.41Å; I99-F162 HydrophobicContact CG2-CZ 4.41Å
100	S	80.8	Confident	79.9	Confident	2 Å²	2	45.9 Å²	45.9	1%	0.014	28%	0.28	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-105	136.9	-179.9	-56.1	0	0	0	0	110	N89 T90 Y117 V118	N89-S100 CarbonylContact O-C 3.58Å; N89-S100 VanDerWaalsContact O-CA 3.32Å; N89-S100 WeakPolarHBondContact O-CA 3.4Å; T90-S100 PolarHBondContact OG1-OG 2.95Å; S100-Y117 CarbonylContact O-C 3.49Å; S100-Y117 WeakPolarHBondContact O-CA 3.47Å; S100-V118 PolarHBondContact N-O 2.84Å; S100-V118 PolarHBondContact O-N 2.98Å
101	F	83.9	Confident	80.3	Confident	0 Å²	0	46.3 Å²	46.3	0%	0	29%	0.287	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-112	145.4	-179.7	-55.4	-90.2	0	0	0	111.2	L79 I86 N89 I99 V115 H116 Y117 F151 I160	L79-F101 HydrophobicContact CD1-CB 3.6Å; L79-F101 HydrophobicContact CD1-CD1 3.88Å; L79-F101 HydrophobicContact CD1-CD2 4Å; L79-F101 HydrophobicContact CD1-CG 3.53Å; I86-F101 HydrophobicContact CD1-CD2 4.12Å; I86-F101 HydrophobicContact CD1-CE2 3.53Å; I86-F101 HydrophobicContact CD1-CZ 4.21Å; N89-F101 HydrophobicContact CB-CB 4.22Å; N89-F101 VanDerWaalsContact CB-O 3.29Å; N89-F101 WeakPolarHBondContact CB-O 3.19Å; N89-F101 WeakPolarHBondContact O-CD2 3.46Å; N89-F101 PolarHBondContact O-N 2.77Å; I99-F101 HydrophobicContact CB-CE2 4.38Å; I99-F101 HydrophobicContact CB-CZ 4.26Å; I99-F101 HydrophobicContact CD1-CE1 3.95Å; I99-F101 HydrophobicContact CD1-CE2 4.47Å; I99-F101 HydrophobicContact CD1-CZ 3.56Å; I99-F101 HydrophobicContact CG1-CE1 4.09Å; I99-F101 HydrophobicContact CG1-CE2 3.99Å; I99-F101 HydrophobicContact CG1-CZ 3.52Å; I99-F101 HydrophobicContact CG2-CE2 3.83Å; I99-F101 HydrophobicContact CG2-CZ 3.83Å; F101-V115 HydrophobicContact CB-CG1 4.19Å; F101-V115 HydrophobicContact CD1-CG1 3.99Å; F101-H116 CarbonylContact C-O 3.54Å; F101-H116 WeakPolarHBondContact CA-O 3.43Å; F101-Y117 HydrophobicContact CE1-CG 4.34Å; F101-F151 HydrophobicContact CD1-CE1 4.39Å; F101-F151 HydrophobicContact CE1-CE1 4.38Å; F101-I160 HydrophobicContact CD1-CD1 4.36Å; F101-I160 HydrophobicContact CE1-CD1 3.59Å; F101-I160 HydrophobicContact CE1-CG1 4.09Å; F101-I160 HydrophobicContact CE1-CG2 4.28Å; F101-I160 HydrophobicContact CE2-CD1 3.8Å; F101-I160 HydrophobicContact CZ-CB 4.21Å; F101-I160 HydrophobicContact CZ-CD1 3.3Å; F101-I160 HydrophobicContact CZ-CG1 3.93Å; F101-I160 HydrophobicContact CZ-CG2 3.73Å
102	Q	76	Confident	80.2	Confident	27 Å²	27	48.1 Å²	48.1	13%	0.126	31%	0.308	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-138.2	138.5	173.3	-64.4	-66.2	-10.4	0	0	108.8	H116 Y256 I332	Q102-H116 PolarHBondContact N-O 2.8Å; Q102-H116 PolarHBondContact O-N 3.06Å; Q102-Y256 HydrophobicContact CG-CE2 4.11Å; Q102-Y256 VanDerWaalsContact CG-OH 3.31Å; Q102-Y256 WeakPolarHBondContact CG-OH 3.24Å; Q102-I332 PolarHBondContact NE2-O 3.24Å
103	Y	75	Confident	80.1	Confident	65 Å²	65	45.6 Å²	45.6	26%	0.255	29%	0.285	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-149.2	155.3	177.4	55	-91.5	0	0	0	109.4	L109 T113	Y103-L109 HydrophobicContact CD1-CD1 4.42Å; Y103-L109 HydrophobicContact CD1-CD2 3.52Å; Y103-L109 HydrophobicContact CD1-CG 4.02Å; Y103-L109 HydrophobicContact CD2-CD2 3.85Å; Y103-L109 HydrophobicContact CD2-CG 4.07Å; Y103-L109 HydrophobicContact CE1-CD1 3.82Å; Y103-L109 HydrophobicContact CE1-CD2 3.75Å; Y103-L109 HydrophobicContact CE1-CG 3.7Å; Y103-L109 HydrophobicContact CE2-CD2 4.08Å; Y103-L109 HydrophobicContact CE2-CG 3.77Å; Y103-L109 HydrophobicContact CG-CD2 3.58Å; Y103-L109 HydrophobicContact CG-CG 4.2Å; Y103-T113 HydrophobicContact CD2-CG2 4.25Å; Y103-T113 HydrophobicContact CG-CG2 4.34Å
104	T	56.6	Low	79.8	Confident	69 Å²	69	46.2 Å²	46.2	42%	0.423	29%	0.291	S	S	.	.			trans	-126.1	96.5	-170.1	56.5	0	0	0	0	107.7	T249	T104-T249 WeakPolarHBondContact CB-OG1 3.41Å; T104-T249 HydrophobicContact CG2-CG2 3.64Å; T104-T249 WeakPolarHBondContact CG2-OG1 3.45Å
105	S	65.4	Low	79.7	Confident	40 Å²	40	40.9 Å²	40.9	28%	0.28	25%	0.247	S	C	.	.			trans	-153.2	131.2	176.8	170.6	0	0	0	0	108.8	E107 G108	S105-E107 PolarHBondContact O-N 2.7Å; S105-E107 PolarHBondContact OG-N 2.77Å; S105-G108 WeakPolarHBondContact CB-O 3.43Å; S105-G108 PolarHBondContact O-N 2.86Å; S105-G108 PolarHBondContact OG-N 2.81Å; S105-G108 PolarHBondContact OG-O 3.37Å
106	N	56.4	Low	79.4	Confident	134 Å²	134	38.2 Å²	38.2	72%	0.717	23%	0.231	S	C	*	.	T	Hydrogen-bonded Turn	trans	-66.2	-21.2	171.9	-59.5	-3.5	0	0	0	111	N245	N106-N245 PolarHBondContact OD1-ND2 2.77Å
107	E	72.2	Confident	79.6	Confident	115 Å²	115	36.5 Å²	36.5	54%	0.537	21%	0.213	S	C	.	.	T	Hydrogen-bonded Turn	trans	-98.7	0.8	-176.2	-58.5	-180	-176.9	0	0	112.6	A74 Q76 S105 V110	A74-E107 WeakPolarHBondContact CB-OE2 3.5Å; Q76-E107 PolarHBondContact NE2-O 3.4Å; S105-E107 PolarHBondContact O-N 2.7Å; S105-E107 PolarHBondContact OG-N 2.77Å; E107-V110 HydrophobicContact CB-CG1 3.88Å; E107-V110 HydrophobicContact CB-CG2 4.4Å
108	G	78	Confident	79.2	Confident	15 Å²	15	36.9 Å²	36.9	16%	0.155	22%	0.215	C	C	.	.			trans	78.1	-152.9	-173.2	0	0	0	0	0	112.9	S105 V110 T113	S105-G108 WeakPolarHBondContact CB-O 3.43Å; S105-G108 PolarHBondContact O-N 2.86Å; S105-G108 PolarHBondContact OG-N 2.81Å; S105-G108 PolarHBondContact OG-O 3.37Å; G108-V110 VanDerWaalsContact C-N 3.34Å; G108-V110 PolarHBondContact O-N 2.7Å; G108-T113 PolarHBondContact O-OG1 2.85Å
109	L	86.7	Confident	79	Confident	14 Å²	14	33.5 Å²	33.5	7%	0.073	20%	0.2	C	C	.	.	S	Bend	trans	-80.2	78.5	-176.7	-75	168.1	0	0	0	111.6	Q76 Y77 L79 Y103 T113 V115	Q76-L109 CarbonylContact C-O 3.59Å; Q76-L109 WeakPolarHBondContact CA-O 3.29Å; Y77-L109 PolarHBondContact N-O 2.79Å; Y77-L109 WeakPolarHBondContact O-CB 3.46Å; Y77-L109 WeakPolarHBondContact O-CD1 3.47Å; L79-L109 HydrophobicContact CD1-CD1 4.24Å; L79-L109 HydrophobicContact CD2-CD1 4.32Å; L79-L109 HydrophobicContact CG-CD1 3.73Å; Y103-L109 HydrophobicContact CD1-CD1 4.42Å; Y103-L109 HydrophobicContact CD1-CD2 3.52Å; Y103-L109 HydrophobicContact CD1-CG 4.02Å; Y103-L109 HydrophobicContact CD2-CD2 3.85Å; Y103-L109 HydrophobicContact CD2-CG 4.07Å; Y103-L109 HydrophobicContact CE1-CD1 3.82Å; Y103-L109 HydrophobicContact CE1-CD2 3.75Å; Y103-L109 HydrophobicContact CE1-CG 3.7Å; Y103-L109 HydrophobicContact CE2-CD2 4.08Å; Y103-L109 HydrophobicContact CE2-CG 3.77Å; Y103-L109 HydrophobicContact CG-CD2 3.58Å; Y103-L109 HydrophobicContact CG-CG 4.2Å; L109-T113 HydrophobicContact CD2-CG2 4.4Å; L109-V115 HydrophobicContact CD2-CG2 3.54Å
110	V	89.4	Confident	78.6	Confident	17 Å²	17	35.4 Å²	35.4	10%	0.103	21%	0.213	C	C	.	.			trans	-97.1	163.7	172.4	-59.1	0	0	0	0	110.4	A74 E107 G108 G112 T113	A74-V110 HydrophobicContact CB-CB 4.3Å; A74-V110 HydrophobicContact CB-CG1 3.63Å; E107-V110 HydrophobicContact CB-CG1 3.88Å; E107-V110 HydrophobicContact CB-CG2 4.4Å; G108-V110 VanDerWaalsContact C-N 3.34Å; G108-V110 PolarHBondContact O-N 2.7Å; V110-G112 PolarHBondContact O-N 3.06Å; V110-T113 WeakPolarHBondContact CG2-OG1 3.15Å; V110-T113 PolarHBondContact N-OG1 3.43Å; V110-T113 WeakPolarHBondContact O-CB 3.35Å; V110-T113 PolarHBondContact O-N 3.47Å; V110-T113 PolarHBondContact O-OG1 2.97Å
111	A	90.2	Very high	78.5	Confident	42 Å²	42	38.2 Å²	38.2	35%	0.347	23%	0.228	S	C	.	.	T	Hydrogen-bonded Turn	trans	-56.9	139.7	178.5	0	0	0	0	0	112.2	Y77 T113 M153 D155	Y77-A111 HydrophobicContact CE2-CB 4Å; A111-T113 PolarHBondContact O-N 2.82Å; A111-M153 WeakPolarHBondContact CA-O 3.32Å; A111-D155 WeakPolarHBondContact CB-OD1 3.18Å
112	G	85.1	Confident	78.1	Confident	51 Å²	51	39.2 Å²	39.2	53%	0.526	24%	0.236	S	C	.	.	T	Hydrogen-bonded Turn	trans	81.7	-11.7	-174.4	0	0	0	0	0	114.8	V110 T114 M153	V110-G112 PolarHBondContact O-N 3.06Å; G112-T114 PolarHBondContact O-N 2.88Å; G112-M153 PolarHBondContact N-O 3.49Å
113	T	84.3	Confident	77.4	Confident	11 Å²	11	44.9 Å²	44.9	7%	0.067	26%	0.26	C	S	.	.	P	Polyproline II helix	trans	-56.3	124.3	173.6	-59.4	0	0	0	0	109.4	Y103 G108 L109 V110 A111 V115 M153	Y103-T113 HydrophobicContact CD2-CG2 4.25Å; Y103-T113 HydrophobicContact CG-CG2 4.34Å; G108-T113 PolarHBondContact O-OG1 2.85Å; L109-T113 HydrophobicContact CD2-CG2 4.4Å; V110-T113 WeakPolarHBondContact CG2-OG1 3.15Å; V110-T113 PolarHBondContact N-OG1 3.43Å; V110-T113 WeakPolarHBondContact O-CB 3.35Å; V110-T113 PolarHBondContact O-N 3.47Å; V110-T113 PolarHBondContact O-OG1 2.97Å; A111-T113 PolarHBondContact O-N 2.82Å; T113-V115 PolarHBondContact O-N 3.31Å; T113-M153 WeakPolarHBondContact O-CB 3.32Å; T113-M153 PolarHBondContact O-N 3.4Å
114	T	82.2	Confident	77.5	Confident	56 Å²	56	43.7 Å²	43.7	34%	0.344	27%	0.267	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-76.9	116.6	174.3	-58.4	0	0	0	0	109.1	G112 H116 Q150	G112-T114 PolarHBondContact O-N 2.88Å; T114-H116 WeakPolarHBondContact CG2-NE2 3.27Å; T114-Q150 HydrophobicContact CG2-CB 4.15Å
115	V	85.7	Confident	78.8	Confident	0 Å²	0	43.2 Å²	43.2	0%	0	26%	0.258	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-101.9	121.1	177	-173.8	0	0	0	0	108.3	L79 F101 L109 T113 Q150 F151 M153	L79-V115 HydrophobicContact CD1-CG1 4.02Å; L79-V115 HydrophobicContact CD2-CG1 4.36Å; F101-V115 HydrophobicContact CB-CG1 4.19Å; F101-V115 HydrophobicContact CD1-CG1 3.99Å; L109-V115 HydrophobicContact CD2-CG2 3.54Å; T113-V115 PolarHBondContact O-N 3.31Å; V115-Q150 CarbonylContact O-C 3.52Å; V115-Q150 WeakPolarHBondContact O-CA 3.29Å; V115-F151 HydrophobicContact CB-CD1 4.22Å; V115-F151 HydrophobicContact CB-CD2 4.32Å; V115-F151 HydrophobicContact CB-CE1 3.74Å; V115-F151 HydrophobicContact CB-CE2 3.83Å; V115-F151 HydrophobicContact CB-CZ 3.53Å; V115-F151 HydrophobicContact CG1-CE1 3.69Å; V115-F151 HydrophobicContact CG1-CE2 4.34Å; V115-F151 HydrophobicContact CG1-CZ 3.56Å; V115-F151 HydrophobicContact CG2-CE2 4.03Å; V115-F151 HydrophobicContact CG2-CZ 4.08Å; V115-F151 PolarHBondContact N-O 2.84Å; V115-F151 PolarHBondContact O-N 3.29Å; V115-M153 HydrophobicContact CG2-CB 4.24Å; V115-M153 HydrophobicContact CG2-SD 4.25Å
116	H	80.1	Confident	79.7	Confident	27 Å²	27	44.6 Å²	44.6	13%	0.125	27%	0.265	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-96.1	148.6	172.9	-64.6	-103.7	0	0	0	109.3	F101 Q102 T114 G149 Q150 Q253	F101-H116 CarbonylContact C-O 3.54Å; F101-H116 WeakPolarHBondContact CA-O 3.43Å; Q102-H116 PolarHBondContact N-O 2.8Å; Q102-H116 PolarHBondContact O-N 3.06Å; T114-H116 WeakPolarHBondContact CG2-NE2 3.27Å; H116-G149 CarbonylContact C-O 3.52Å; H116-G149 WeakPolarHBondContact CA-O 3.32Å; H116-Q150 PolarHBondContact CE1-OE1 2.73Å; H116-Q253 PolarHBondContact CD2-NE2 2.78Å; H116-Q253 PolarHBondContact CE1-NE2 3.38Å; H116-Q253 VanDerWaalsContact CE1-NE2 3.27Å; H116-Q253 PolarHBondContact CE1-OE1 2.85Å; H116-Q253 PolarHBondContact ND1-NE2 3.42Å; H116-Q253 PolarHBondContact ND1-OE1 2.81Å; H116-Q253 VanDerWaalsContact ND1-OE1 3.09Å; H116-Q253 PolarHBondContact NE2-NE2 3.25Å; H116-Q253 VanDerWaalsContact NE2-NE2 3.15Å
117	Y	84.3	Confident	81.2	Confident	4 Å²	4	39.3 Å²	39.3	2%	0.016	24%	0.237	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-135	152.4	173.3	70.4	-97.1	0	0	0	111.4	I99 S100 F101 V119 V130 S144 N148 G149 F151	I99-Y117 HydrophobicContact CD1-CD2 3.72Å; I99-Y117 HydrophobicContact CD1-CE2 4.49Å; I99-Y117 HydrophobicContact CD1-CG 4Å; I99-Y117 HydrophobicContact CG1-CD2 4.19Å; I99-Y117 HydrophobicContact CG1-CG 4.45Å; S100-Y117 CarbonylContact O-C 3.49Å; S100-Y117 WeakPolarHBondContact O-CA 3.47Å; F101-Y117 HydrophobicContact CE1-CG 4.34Å; Y117-V119 HydrophobicContact CD2-CG2 4.35Å; Y117-V119 HydrophobicContact CE2-CG2 4.47Å; Y117-V130 HydrophobicContact CD2-CG1 4.28Å; Y117-V130 HydrophobicContact CD2-CG2 4.34Å; Y117-V130 HydrophobicContact CE1-CG1 4.25Å; Y117-V130 HydrophobicContact CE2-CB 3.94Å; Y117-V130 HydrophobicContact CE2-CG1 3.91Å; Y117-V130 HydrophobicContact CE2-CG2 3.69Å; Y117-S144 WeakPolarHBondContact OH-CB 3.49Å; Y117-S144 PolarHBondContact OH-OG 3.42Å; Y117-N148 WeakPolarHBondContact O-CA 3.23Å; Y117-G149 VanDerWaalsContact CZ-CA 3.47Å; Y117-G149 PolarHBondContact N-O 2.95Å; Y117-G149 PolarHBondContact O-N 3.08Å; Y117-F151 HydrophobicContact CD1-CD1 4.17Å; Y117-F151 HydrophobicContact CD1-CE1 4.32Å
118	V	78	Confident	82	Confident	7 Å²	7	39.5 Å²	39.5	4%	0.042	24%	0.236	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-134.1	132.5	170.5	175.6	0	0	0	0	111	I99 S100 I147 N148 Y256 L259 I349	I99-V118 CarbonylContact C-O 3.58Å; I99-V118 VanDerWaalsContact CA-O 3.31Å; I99-V118 WeakPolarHBondContact CA-O 3.47Å; S100-V118 PolarHBondContact N-O 2.84Å; S100-V118 PolarHBondContact O-N 2.98Å; V118-I147 CarbonylContact C-O 3.49Å; V118-I147 VanDerWaalsContact CA-O 3.23Å; V118-I147 WeakPolarHBondContact CA-O 3.37Å; V118-N148 VanDerWaalsContact CG1-OD1 3.3Å; V118-N148 WeakPolarHBondContact CG1-OD1 3.39Å; V118-N148 HydrophobicContact CG2-CB 4.4Å; V118-N148 WeakPolarHBondContact CG2-OD1 3.32Å; V118-Y256 HydrophobicContact CB-CE1 4.06Å; V118-Y256 HydrophobicContact CG2-CD1 3.32Å; V118-Y256 HydrophobicContact CG2-CE1 3.18Å; V118-Y256 HydrophobicContact CG2-CG 4.44Å; V118-L259 HydrophobicContact CG1-CD1 3.78Å; V118-L259 HydrophobicContact CG2-CD1 3.99Å; V118-I349 HydrophobicContact CB-CD1 4.02Å; V118-I349 HydrophobicContact CG1-CD1 3.65Å
119	V	82.3	Confident	82.7	Confident	6 Å²	6	40.9 Å²	40.9	4%	0.036	24%	0.238	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-96.2	120	174.4	-173.1	0	0	0	0	110.1	Q98 I99 Y117 L121 L127 V130 I147 F162	Q98-V119 CarbonylContact O-C 3.58Å; Q98-V119 VanDerWaalsContact O-CA 3.24Å; Q98-V119 WeakPolarHBondContact O-CA 3.16Å; I99-V119 HydrophobicContact CB-CG2 4.3Å; I99-V119 HydrophobicContact CD1-CG2 4Å; I99-V119 HydrophobicContact CG1-CG2 4.04Å; Y117-V119 HydrophobicContact CD2-CG2 4.35Å; Y117-V119 HydrophobicContact CE2-CG2 4.47Å; V119-L121 HydrophobicContact CG1-CD2 3.84Å; V119-L121 HydrophobicContact CG1-CG 4.15Å; V119-L127 HydrophobicContact CB-CD2 4.33Å; V119-L127 HydrophobicContact CG1-CD1 4.28Å; V119-L127 HydrophobicContact CG2-CD1 4.28Å; V119-L127 HydrophobicContact CG2-CD2 4.06Å; V119-V130 HydrophobicContact CG2-CG2 3.61Å; V119-I147 PolarHBondContact N-O 2.77Å; V119-F162 HydrophobicContact CG1-CD2 4.44Å
120	S	77.6	Confident	83.1	Confident	42 Å²	42	40.2 Å²	40.2	29%	0.294	24%	0.235	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-96.9	113	167.4	-63	0	0	0	0	108.9	N97 Q98	N97-S120 CarbonylContact C-O 3.51Å; N97-S120 WeakPolarHBondContact CA-O 3.24Å; Q98-S120 PolarHBondContact N-O 3.47Å; Q98-S120 PolarHBondContact O-N 3.37Å
121	L	78.9	Confident	83.4	Confident	61 Å²	61	41.5 Å²	41.5	32%	0.319	24%	0.239	S	C	.	.	P	Polyproline II helix	trans	-87.6	134.6	-177.2	-64.6	164.3	0	0	0	111.1	N97 V119 L127 I147 V164	N97-L121 VanDerWaalsContact OD1-CA 3.3Å; N97-L121 WeakPolarHBondContact OD1-CA 3.44Å; V119-L121 HydrophobicContact CG1-CD2 3.84Å; V119-L121 HydrophobicContact CG1-CG 4.15Å; L121-L127 HydrophobicContact CD1-CB 4.09Å; L121-L127 HydrophobicContact CD2-CB 4.16Å; L121-I147 HydrophobicContact CD1-CG2 4.38Å; L121-V164 HydrophobicContact CD2-CB 4.45Å; L121-V164 HydrophobicContact CD2-CG1 3.49Å; L121-V164 VanDerWaalsContact CD2-CG1 3.49Å
122	A	75.2	Confident	83.7	Confident	21 Å²	21	39.5 Å²	39.5	17%	0.174	22%	0.222	C	C	.	.	P	Polyproline II helix	trans	-66.2	163.6	168.7	0	0	0	0	0	111.3	N95 N97 G124 Y125	N95-A122 WeakPolarHBondContact O-CB 3.25Å; N97-A122 PolarHBondContact OD1-N 3.31Å; A122-G124 PolarHBondContact O-N 2.84Å; A122-Y125 HydrophobicContact CB-CD2 4.08Å; A122-Y125 PolarHBondContact O-N 2.86Å
123	K	61.5	Low	84.2	Confident	146 Å²	146	38 Å²	38	64%	0.635	20%	0.203	S	C	*	.	T	Hydrogen-bonded Turn	trans	-51.9	126.7	179.6	-179.1	179.8	175.3	170.4	0	111.2	Y125 T473	K123-Y125 VanDerWaalsContact O-CD2 3.29Å; K123-Y125 WeakPolarHBondContact O-CD2 3.36Å; K123-T473 PolarHBondContact NZ-OG1 3.22Å
124	G	77.3	Confident	84.7	Confident	39 Å²	39	38.5 Å²	38.5	40%	0.402	20%	0.204	S	C	.	.	T	Hydrogen-bonded Turn	trans	77.7	25.1	173.5	0	0	0	0	0	114	A122 P166 V167	A122-G124 PolarHBondContact O-N 2.84Å; G124-P166 CarbonylContact O-C 3.5Å; G124-P166 VanDerWaalsContact O-CA 3.32Å; G124-P166 WeakPolarHBondContact O-CA 3.36Å; G124-V167 PolarHBondContact O-N 3.28Å
125	Y	84.5	Confident	85.3	Confident	59 Å²	59	38.2 Å²	38.2	23%	0.231	20%	0.203	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-125.2	145.7	175.1	-70.4	-85.9	0	0	0	111.9	N95 N97 A122 K123 V164 T165 P166	N95-Y125 HydrophobicContact CB-CE1 4.44Å; N95-Y125 HydrophobicContact CB-CE2 3.78Å; N95-Y125 PolarHBondContact OD1-OH 2.89Å; N95-Y125 VanDerWaalsContact OD1-OH 3.1Å; N97-Y125 WeakPolarHBondContact OD1-CB 3.4Å; A122-Y125 HydrophobicContact CB-CD2 4.08Å; A122-Y125 PolarHBondContact O-N 2.86Å; K123-Y125 VanDerWaalsContact O-CD2 3.29Å; K123-Y125 WeakPolarHBondContact O-CD2 3.36Å; Y125-V164 HydrophobicContact CD1-CB 3.97Å; Y125-V164 HydrophobicContact CD1-CG2 3.56Å; Y125-V164 HydrophobicContact CE1-CG2 4.09Å; Y125-V164 HydrophobicContact CG-CB 4.45Å; Y125-V164 HydrophobicContact CG-CG2 4.27Å; Y125-T165 CarbonylContact C-O 3.56Å; Y125-T165 WeakPolarHBondContact CA-O 3.24Å; Y125-P166 HydrophobicContact CD1-CB 4.27Å; Y125-P166 HydrophobicContact CE1-CB 3.94Å
126	T	84.5	Confident	85.7	Confident	70 Å²	70	43.4 Å²	43.4	43%	0.429	24%	0.235	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-115.5	145.2	167.2	50.8	0	0	0	0	110	K128 V164 T165 V167	T126-K128 PolarHBondContact O-N 3.31Å; T126-V164 CarbonylContact O-C 3.51Å; T126-V164 VanDerWaalsContact O-CA 3.25Å; T126-V164 WeakPolarHBondContact O-CA 3.31Å; T126-T165 PolarHBondContact N-O 2.98Å; T126-T165 PolarHBondContact O-N 3.01Å; T126-T165 PolarHBondContact OG1-O 3.49Å; T126-V167 HydrophobicContact CG2-CG2 3.75Å
127	L	86.3	Confident	86.3	Confident	23 Å²	23	46.5 Å²	46.5	12%	0.12	26%	0.255	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-70.9	129.7	173.4	179.5	64.5	0	0	0	109.3	V119 L121 V130 N146 I147 F162	V119-L127 HydrophobicContact CB-CD2 4.33Å; V119-L127 HydrophobicContact CG1-CD1 4.28Å; V119-L127 HydrophobicContact CG2-CD1 4.28Å; V119-L127 HydrophobicContact CG2-CD2 4.06Å; L121-L127 HydrophobicContact CD1-CB 4.09Å; L121-L127 HydrophobicContact CD2-CB 4.16Å; L127-V130 HydrophobicContact CD1-CG2 3.96Å; L127-V130 HydrophobicContact CD2-CG2 4.06Å; L127-N146 VanDerWaalsContact CD2-C 3.45Å; L127-N146 WeakPolarHBondContact CD2-O 3.27Å; L127-I147 HydrophobicContact CB-CG2 4.49Å; L127-I147 HydrophobicContact CD2-CG2 4.18Å; L127-F162 HydrophobicContact CD1-CB 4.45Å
128	K	90.3	Very high	86.7	Confident	118 Å²	118	53 Å²	53	51%	0.513	29%	0.286	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-91	-56.1	170.1	-178.3	-176.3	166.1	-156.3	0	110.2	T126 E163	T126-K128 PolarHBondContact O-N 3.31Å; K128-E163 HydrophobicContact CB-CB 4.15Å; K128-E163 WeakPolarHBondContact CB-O 3.35Å; K128-E163 HydrophobicContact CD-CB 4.28Å; K128-E163 WeakPolarHBondContact CD-OE2 3.39Å; K128-E163 WeakPolarHBondContact CE-OE2 3.08Å; K128-E163 PolarHBondContact N-O 3.15Å; K128-E163 IonicContact NZ-OE2 2.7Å; K128-E163 PolarHBondContact NZ-OE2 3.19Å
129	E	93.3	Very high	87.4	Confident	45 Å²	45	55.1 Å²	55.1	21%	0.21	30%	0.304	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-159	154.2	177.8	60.5	175.6	-155.5	0	0	112.6	K131 S144 F162 E163	E129-K131 WeakPolarHBondContact OE1-CE 3.11Å; E129-K131 IonicContact OE1-NZ 2.7Å; E129-K131 PolarHBondContact OE1-NZ 3.1Å; E129-S144 CarbonylContact C-O 3.4Å; E129-S144 WeakPolarHBondContact CA-O 2.99Å; E129-F162 CarbonylContact O-C 3.43Å; E129-F162 VanDerWaalsContact O-CA 3.27Å; E129-F162 WeakPolarHBondContact O-CA 3.43Å; E129-E163 HydrophobicContact CG-CB 4.26Å; E129-E163 HydrophobicContact CG-CG 4.48Å; E129-E163 PolarHBondContact N-O 3.08Å; E129-E163 PolarHBondContact O-N 3.11Å
130	V	93.6	Very high	88	Confident	0 Å²	0	59.8 Å²	59.8	0%	0	33%	0.328	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-112.8	128.2	162.2	-179.3	0	0	0	0	107.6	I99 Y117 V119 L127 I132 T143 S144 I160 Q161 F162	I99-V130 HydrophobicContact CD1-CG1 3.71Å; I99-V130 HydrophobicContact CD1-CG2 4.17Å; Y117-V130 HydrophobicContact CD2-CG1 4.28Å; Y117-V130 HydrophobicContact CD2-CG2 4.34Å; Y117-V130 HydrophobicContact CE1-CG1 4.25Å; Y117-V130 HydrophobicContact CE2-CB 3.94Å; Y117-V130 HydrophobicContact CE2-CG1 3.91Å; Y117-V130 HydrophobicContact CE2-CG2 3.69Å; V119-V130 HydrophobicContact CG2-CG2 3.61Å; L127-V130 HydrophobicContact CD1-CG2 3.96Å; L127-V130 HydrophobicContact CD2-CG2 4.06Å; V130-I132 HydrophobicContact CG1-CD1 3.98Å; V130-T143 CarbonylContact O-C 3.48Å; V130-T143 VanDerWaalsContact O-CA 3.27Å; V130-T143 WeakPolarHBondContact O-CA 3.3Å; V130-S144 PolarHBondContact N-O 2.73Å; V130-S144 PolarHBondContact O-N 3.03Å; V130-I160 HydrophobicContact CG1-CG2 4.44Å; V130-Q161 CarbonylContact C-O 3.51Å; V130-Q161 WeakPolarHBondContact CA-O 3.36Å; V130-F162 HydrophobicContact CG2-CB 4Å
131	K	95.5	Very high	88.7	Confident	43 Å²	43	59.9 Å²	59.9	19%	0.187	33%	0.327	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-123	125.1	-179.6	-167.6	178.7	-69.7	140.9	0	109.7	E129 I133 I140 Q161	E129-K131 WeakPolarHBondContact OE1-CE 3.11Å; E129-K131 IonicContact OE1-NZ 2.7Å; E129-K131 PolarHBondContact OE1-NZ 3.1Å; K131-I133 HydrophobicContact CD-CD1 3.99Å; K131-I133 HydrophobicContact CD-CG1 4.21Å; K131-I133 HydrophobicContact CG-CD1 4.19Å; K131-I133 HydrophobicContact CG-CG1 3.92Å; K131-I140 HydrophobicContact CD-CD1 4.37Å; K131-I140 HydrophobicContact CD-CG1 4.5Å; K131-I140 HydrophobicContact CG-CG2 4.42Å; K131-Q161 HydrophobicContact CB-CB 4.47Å; K131-Q161 PolarHBondContact N-O 3.29Å; K131-Q161 PolarHBondContact O-N 3.09Å
132	I	96.2	Very high	89.3	Confident	0 Å²	0	58.5 Å²	58.5	0%	0	32%	0.322	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-110.4	122.9	177.9	-47.3	-63.1	0	0	0	107.6	V130 I140 V141 S142 F151 V158 I160	V130-I132 HydrophobicContact CG1-CD1 3.98Å; I132-I140 CarbonylContact O-C 3.58Å; I132-V141 HydrophobicContact CB-CB 4.26Å; I132-V141 HydrophobicContact CG2-CB 4.03Å; I132-V141 HydrophobicContact CG2-CG1 4.45Å; I132-V141 PolarHBondContact O-N 2.88Å; I132-S142 PolarHBondContact N-O 3.1Å; I132-S142 PolarHBondContact O-N 3.18Å; I132-F151 HydrophobicContact CD1-CD1 4.09Å; I132-F151 HydrophobicContact CD1-CE1 3.79Å; I132-F151 HydrophobicContact CD1-CZ 4.32Å; I132-F151 HydrophobicContact CG1-CD1 3.81Å; I132-F151 HydrophobicContact CG1-CE1 4.01Å; I132-F151 HydrophobicContact CG1-CG 4.2Å; I132-F151 HydrophobicContact CG2-CD1 4.32Å; I132-F151 HydrophobicContact CG2-CD2 3.84Å; I132-F151 HydrophobicContact CG2-CE1 4.24Å; I132-F151 HydrophobicContact CG2-CE2 3.75Å; I132-F151 HydrophobicContact CG2-CG 4.12Å; I132-F151 HydrophobicContact CG2-CZ 3.95Å; I132-V158 HydrophobicContact CG2-CB 3.86Å; I132-V158 HydrophobicContact CG2-CG1 4.08Å; I132-V158 HydrophobicContact CG2-CG2 4.05Å; I132-I160 HydrophobicContact CD1-CB 4.25Å; I132-I160 HydrophobicContact CD1-CG1 3.74Å; I132-I160 HydrophobicContact CD1-CG2 3.83Å
133	I	96.4	Very high	90.2	Very high	21 Å²	21	61.3 Å²	61.3	11%	0.108	34%	0.337	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-124.4	129.8	-170.9	-53.4	169.9	0	0	0	109.2	K131 T135 A139 V158 S159	K131-I133 HydrophobicContact CD-CD1 3.99Å; K131-I133 HydrophobicContact CD-CG1 4.21Å; K131-I133 HydrophobicContact CG-CD1 4.19Å; K131-I133 HydrophobicContact CG-CG1 3.92Å; I133-T135 PolarHBondContact O-N 2.85Å; I133-A139 WeakPolarHBondContact CA-O 3.42Å; I133-V158 CarbonylContact O-C 3.46Å; I133-V158 WeakPolarHBondContact O-CA 3.18Å; I133-S159 PolarHBondContact N-O 2.89Å; I133-S159 PolarHBondContact O-N 3.2Å
134	N	95.8	Very high	91.4	Very high	20 Å²	20	55.4 Å²	55.4	11%	0.107	31%	0.314	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-69.3	121.3	172.7	178.3	-54.4	0	0	0	109.5	T136 T137 Q138 A139 V141 S156	N134-T136 VanDerWaalsContact C-N 3.33Å; N134-T136 PolarHBondContact O-N 3.06Å; N134-T136 WeakPolarHBondContact OD1-CA 3.47Å; N134-T136 WeakPolarHBondContact OD1-CB 3.35Å; N134-T136 PolarHBondContact OD1-N 3.13Å; N134-T137 WeakPolarHBondContact CB-OG1 3.38Å; N134-T137 PolarHBondContact OD1-N 2.74Å; N134-T137 PolarHBondContact OD1-OG1 2.81Å; N134-T137 VanDerWaalsContact OD1-OG1 3.07Å; N134-Q138 WeakPolarHBondContact O-CA 3.29Å; N134-Q138 PolarHBondContact O-N 3.2Å; N134-A139 PolarHBondContact N-O 2.79Å; N134-V141 HydrophobicContact CB-CG2 3.86Å; N134-S156 PolarHBondContact ND2-OG 2.82Å; N134-S156 PolarHBondContact OD1-OG 2.83Å
135	T	94.3	Very high	91.8	Very high	50 Å²	50	55.8 Å²	55.8	31%	0.307	32%	0.318	S	S	.	.	T	Hydrogen-bonded Turn	trans	-70	-27.5	-174.2	55.8	0	0	0	0	113.9	L80 I133 D157	L80-T135 HydrophobicContact CD1-CG2 3.94Å; I133-T135 PolarHBondContact O-N 2.85Å; T135-D157 WeakPolarHBondContact CB-O 3.36Å; T135-D157 HydrophobicContact CG2-CB 4.11Å; T135-D157 VanDerWaalsContact CG2-O 3.3Å; T135-D157 WeakPolarHBondContact CG2-O 3.23Å; T135-D157 PolarHBondContact N-O 2.87Å; T135-D157 WeakPolarHBondContact OG1-CB 3.37Å; T135-D157 PolarHBondContact OG1-O 2.79Å
136	T	93.1	Very high	91.6	Very high	110 Å²	110	58.2 Å²	58.2	68%	0.675	34%	0.335	S	S	*	.	T	Hydrogen-bonded Turn	trans	-79.5	-44.9	-179.8	-56.4	0	0	0	0	111.7	N134 S156	N134-T136 VanDerWaalsContact C-N 3.33Å; N134-T136 PolarHBondContact O-N 3.06Å; N134-T136 WeakPolarHBondContact OD1-CA 3.47Å; N134-T136 WeakPolarHBondContact OD1-CB 3.35Å; N134-T136 PolarHBondContact OD1-N 3.13Å; T136-S156 VanDerWaalsContact OG1-CB 3.29Å; T136-S156 WeakPolarHBondContact OG1-CB 3.22Å
137	T	94.3	Very high	91.2	Very high	91 Å²	91	58.1 Å²	58.1	56%	0.558	33%	0.331	S	S	*	.	T	Hydrogen-bonded Turn	trans	-99.5	-12.4	-174	61.7	0	0	0	0	113.5	N134 A139	N134-T137 WeakPolarHBondContact CB-OG1 3.38Å; N134-T137 PolarHBondContact OD1-N 2.74Å; N134-T137 PolarHBondContact OD1-OG1 2.81Å; N134-T137 VanDerWaalsContact OD1-OG1 3.07Å; T137-A139 PolarHBondContact O-N 2.84Å; T137-A139 VanDerWaalsContact O-N 3.13Å; T137-A139 WeakPolarHBondContact OG1-CB 3.47Å; T137-A139 PolarHBondContact OG1-N 2.77Å
138	Q	91.8	Very high	90.5	Very high	142 Å²	142	59.2 Å²	59.2	66%	0.664	34%	0.338	S	S	*	.			trans	58.4	13.8	-170.3	-59	-75	32.6	0	0	114.4	N134	N134-Q138 WeakPolarHBondContact O-CA 3.29Å; N134-Q138 PolarHBondContact O-N 3.2Å
139	A	93.7	Very high	90	Very high	51 Å²	51	54.6 Å²	54.6	42%	0.421	32%	0.324	S	S	.	.			trans	-76.7	143.6	177.5	0	0	0	0	0	111.5	I133 N134 T137 V141	I133-A139 WeakPolarHBondContact CA-O 3.42Å; N134-A139 PolarHBondContact N-O 2.79Å; T137-A139 PolarHBondContact O-N 2.84Å; T137-A139 VanDerWaalsContact O-N 3.13Å; T137-A139 WeakPolarHBondContact OG1-CB 3.47Å; T137-A139 PolarHBondContact OG1-N 2.77Å; A139-V141 PolarHBondContact O-N 2.87Å
140	I	93.4	Very high	89.6	Confident	103 Å²	103	58.1 Å²	58.1	53%	0.528	34%	0.34	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-71.8	115.6	172.1	-61.2	173.2	0	0	0	108.3	K131 I132	K131-I140 HydrophobicContact CD-CD1 4.37Å; K131-I140 HydrophobicContact CD-CG1 4.5Å; K131-I140 HydrophobicContact CG-CG2 4.42Å; I132-I140 CarbonylContact O-C 3.58Å
141	V	92.6	Very high	89.4	Confident	45 Å²	45	58.3 Å²	58.3	27%	0.273	34%	0.341	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-77.3	-41.5	174.6	-179.9	0	0	0	0	110.3	I132 N134 A139 F151 P154 V158	I132-V141 HydrophobicContact CB-CB 4.26Å; I132-V141 HydrophobicContact CG2-CB 4.03Å; I132-V141 HydrophobicContact CG2-CG1 4.45Å; I132-V141 PolarHBondContact O-N 2.88Å; N134-V141 HydrophobicContact CB-CG2 3.86Å; A139-V141 PolarHBondContact O-N 2.87Å; V141-F151 HydrophobicContact CG1-CB 4.3Å; V141-F151 HydrophobicContact CG1-CD2 4.24Å; V141-P154 HydrophobicContact CG2-CG 4.13Å; V141-V158 HydrophobicContact CG2-CG1 4.33Å
142	S	92.6	Very high	89.2	Confident	31 Å²	31	60.1 Å²	60.1	22%	0.217	36%	0.357	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-156.8	147.6	178.3	-174.6	0	0	0	0	110.9	I132	I132-S142 PolarHBondContact N-O 3.1Å; I132-S142 PolarHBondContact O-N 3.18Å
143	T	93.7	Very high	89	Confident	80 Å²	80	60.3 Å²	60.3	49%	0.491	36%	0.358	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-137.6	137.7	168.9	-171.7	0	0	0	0	109.8	V130	V130-T143 CarbonylContact O-C 3.48Å; V130-T143 VanDerWaalsContact O-CA 3.27Å; V130-T143 WeakPolarHBondContact O-CA 3.3Å
144	S	87.5	Confident	88.9	Confident	22 Å²	22	60.5 Å²	60.5	15%	0.154	36%	0.361	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-157.8	137	-175.5	169.9	0	0	0	0	111.7	Y117 E129 V130 N146	Y117-S144 WeakPolarHBondContact OH-CB 3.49Å; Y117-S144 PolarHBondContact OH-OG 3.42Å; E129-S144 CarbonylContact C-O 3.4Å; E129-S144 WeakPolarHBondContact CA-O 2.99Å; V130-S144 PolarHBondContact N-O 2.73Å; V130-S144 PolarHBondContact O-N 3.03Å; S144-N146 VanDerWaalsContact C-N 3.29Å; S144-N146 WeakPolarHBondContact OG-CB 3.45Å; S144-N146 PolarHBondContact OG-N 3.23Å; S144-N146 VanDerWaalsContact OG-N 3.1Å
145	G	84.6	Confident	88.8	Confident	48 Å²	48	65.3 Å²	65.3	50%	0.495	39%	0.386	S	S	.	.	S	Bend	trans	-86.1	3.7	170.8	0	0	0	0	0	114
146	N	79.6	Confident	88.8	Confident	110 Å²	110	63.1 Å²	63.1	59%	0.588	37%	0.373	S	S	*	.	S	Bend	trans	-90.8	141.1	-176.7	-61.9	-44.4	0	0	0	111.1	L127 S144 N148	L127-N146 VanDerWaalsContact CD2-C 3.45Å; L127-N146 WeakPolarHBondContact CD2-O 3.27Å; S144-N146 VanDerWaalsContact C-N 3.29Å; S144-N146 WeakPolarHBondContact OG-CB 3.45Å; S144-N146 PolarHBondContact OG-N 3.23Å; S144-N146 VanDerWaalsContact OG-N 3.1Å; N146-N148 WeakPolarHBondContact CB-O 3.44Å; N146-N148 PolarHBondContact O-N 3.38Å
147	I	76.8	Confident	89	Confident	67 Å²	67	59.9 Å²	59.9	34%	0.344	35%	0.351	S	S	.	.	S	Bend	trans	-59.1	-27	174.5	56.5	169.9	0	0	0	112.4	V118 V119 L121 L127	V118-I147 CarbonylContact C-O 3.49Å; V118-I147 VanDerWaalsContact CA-O 3.23Å; V118-I147 WeakPolarHBondContact CA-O 3.37Å; V119-I147 PolarHBondContact N-O 2.77Å; L121-I147 HydrophobicContact CD1-CG2 4.38Å; L127-I147 HydrophobicContact CB-CG2 4.49Å; L127-I147 HydrophobicContact CD2-CG2 4.18Å
148	N	71.7	Confident	89.1	Confident	47 Å²	47	55.5 Å²	55.5	25%	0.251	33%	0.325	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-117.7	137.6	176.8	-54.2	-29.6	0	0	0	109.2	Y117 V118 N146 L259	Y117-N148 WeakPolarHBondContact O-CA 3.23Å; V118-N148 VanDerWaalsContact CG1-OD1 3.3Å; V118-N148 WeakPolarHBondContact CG1-OD1 3.39Å; V118-N148 HydrophobicContact CG2-CB 4.4Å; V118-N148 WeakPolarHBondContact CG2-OD1 3.32Å; N146-N148 WeakPolarHBondContact CB-O 3.44Å; N146-N148 PolarHBondContact O-N 3.38Å; N148-L259 WeakPolarHBondContact OD1-CD1 3.37Å
149	G	79.6	Confident	89.2	Confident	21 Å²	21	49.9 Å²	49.9	22%	0.216	30%	0.301	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-159.6	179.9	173.4	0	0	0	0	0	112.6	H116 Y117	H116-G149 CarbonylContact C-O 3.52Å; H116-G149 WeakPolarHBondContact CA-O 3.32Å; Y117-G149 VanDerWaalsContact CZ-CA 3.47Å; Y117-G149 PolarHBondContact N-O 2.95Å; Y117-G149 PolarHBondContact O-N 3.08Å
150	Q	84.7	Confident	89.3	Confident	118 Å²	118	47.8 Å²	47.8	55%	0.551	28%	0.282	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-146.4	154.7	177.4	66.7	-175.5	55.6	0	0	110.4	T114 V115 H116	T114-Q150 HydrophobicContact CG2-CB 4.15Å; V115-Q150 CarbonylContact O-C 3.52Å; V115-Q150 WeakPolarHBondContact O-CA 3.29Å; H116-Q150 PolarHBondContact CE1-OE1 2.73Å
151	F	90.1	Very high	89.2	Confident	4 Å²	4	47 Å²	47	2%	0.018	28%	0.277	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-148.4	148.9	173	63.6	-85.5	0	0	0	110.4	L79 F101 V115 Y117 I132 V141 M153 V158	L79-F151 HydrophobicContact CD2-CE2 4.39Å; L79-F151 HydrophobicContact CD2-CZ 3.9Å; F101-F151 HydrophobicContact CD1-CE1 4.39Å; F101-F151 HydrophobicContact CE1-CE1 4.38Å; V115-F151 HydrophobicContact CB-CD1 4.22Å; V115-F151 HydrophobicContact CB-CD2 4.32Å; V115-F151 HydrophobicContact CB-CE1 3.74Å; V115-F151 HydrophobicContact CB-CE2 3.83Å; V115-F151 HydrophobicContact CB-CZ 3.53Å; V115-F151 HydrophobicContact CG1-CE1 3.69Å; V115-F151 HydrophobicContact CG1-CE2 4.34Å; V115-F151 HydrophobicContact CG1-CZ 3.56Å; V115-F151 HydrophobicContact CG2-CE2 4.03Å; V115-F151 HydrophobicContact CG2-CZ 4.08Å; V115-F151 PolarHBondContact N-O 2.84Å; V115-F151 PolarHBondContact O-N 3.29Å; Y117-F151 HydrophobicContact CD1-CD1 4.17Å; Y117-F151 HydrophobicContact CD1-CE1 4.32Å; I132-F151 HydrophobicContact CD1-CD1 4.09Å; I132-F151 HydrophobicContact CD1-CE1 3.79Å; I132-F151 HydrophobicContact CD1-CZ 4.32Å; I132-F151 HydrophobicContact CG1-CD1 3.81Å; I132-F151 HydrophobicContact CG1-CE1 4.01Å; I132-F151 HydrophobicContact CG1-CG 4.2Å; I132-F151 HydrophobicContact CG2-CD1 4.32Å; I132-F151 HydrophobicContact CG2-CD2 3.84Å; I132-F151 HydrophobicContact CG2-CE1 4.24Å; I132-F151 HydrophobicContact CG2-CE2 3.75Å; I132-F151 HydrophobicContact CG2-CG 4.12Å; I132-F151 HydrophobicContact CG2-CZ 3.95Å; V141-F151 HydrophobicContact CG1-CB 4.3Å; V141-F151 HydrophobicContact CG1-CD2 4.24Å; F151-M153 HydrophobicContact CE2-SD 3.95Å; F151-V158 HydrophobicContact CE2-CG2 4.01Å; F151-V158 HydrophobicContact CZ-CG2 4.15Å
152	P	90.9	Very high	89.2	Confident	81 Å²	81	46.7 Å²	46.7	53%	0.526	27%	0.272	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-76.3	135.7	170.1	31.8	-32.3	0	0	0	109.7	P154	P152-P154 WeakPolarHBondContact O-CD 3.24Å
153	M	92.7	Very high	89.2	Confident	4 Å²	4	48.8 Å²	48.8	2%	0.02	28%	0.278	C	S	.	.			trans	-68.7	123.6	176.2	-161.8	59.8	-158.8	0	0	109.9	Y77 L79 A111 G112 T113 V115 F151 S156 V158	Y77-M153 HydrophobicContact CG-CE 4.44Å; L79-M153 HydrophobicContact CD2-CE 4.44Å; L79-M153 HydrophobicContact CD2-SD 4Å; A111-M153 WeakPolarHBondContact CA-O 3.32Å; G112-M153 PolarHBondContact N-O 3.49Å; T113-M153 WeakPolarHBondContact O-CB 3.32Å; T113-M153 PolarHBondContact O-N 3.4Å; V115-M153 HydrophobicContact CG2-CB 4.24Å; V115-M153 HydrophobicContact CG2-SD 4.25Å; F151-M153 HydrophobicContact CE2-SD 3.95Å; M153-S156 WeakPolarHBondContact CE-O 3.21Å; M153-V158 HydrophobicContact CE-CB 4.26Å; M153-V158 HydrophobicContact CE-CG1 3.78Å; M153-V158 HydrophobicContact CE-CG2 3.85Å; M153-V158 HydrophobicContact SD-CG1 4.14Å; M153-V158 HydrophobicContact SD-CG2 4.04Å
154	P	94.3	Very high	89	Confident	26 Å²	26	46.5 Å²	46.5	17%	0.169	26%	0.264	C	S	.	.			trans	-76	175.5	175.6	32.9	-35.5	0	0	0	111.5	V141 P152 S156 V158	V141-P154 HydrophobicContact CG2-CG 4.13Å; P152-P154 WeakPolarHBondContact O-CD 3.24Å; P154-S156 PolarHBondContact O-N 2.74Å; P154-V158 VanDerWaalsContact CD-CG1 3.49Å; P154-V158 HydrophobicContact CG-CG1 3.48Å; P154-V158 VanDerWaalsContact CG-CG1 3.48Å
155	D	93.4	Very high	89.1	Confident	121 Å²	121	48.5 Å²	48.5	65%	0.647	28%	0.275	S	S	*	.	S	Bend	trans	-71.2	38.5	171.2	-62.5	-55.6	0	0	0	113.5	Y77 A111	Y77-D155 WeakPolarHBondContact CE1-O 3.31Å; Y77-D155 VanDerWaalsContact CZ-CA 3.44Å; Y77-D155 VanDerWaalsContact OH-CA 3.32Å; Y77-D155 WeakPolarHBondContact OH-CA 3.48Å; Y77-D155 PolarHBondContact OH-O 2.76Å; A111-D155 WeakPolarHBondContact CB-OD1 3.18Å
156	S	94.4	Very high	89.1	Confident	4 Å²	4	50 Å²	50	3%	0.028	28%	0.276	C	S	.	.	S	Bend	trans	-163	163	-179.8	69.8	0	0	0	0	111.1	Y77 N134 T136 M153 P154	Y77-S156 VanDerWaalsContact CE1-CA 3.5Å; Y77-S156 VanDerWaalsContact CE1-N 3.3Å; N134-S156 PolarHBondContact ND2-OG 2.82Å; N134-S156 PolarHBondContact OD1-OG 2.83Å; T136-S156 VanDerWaalsContact OG1-CB 3.29Å; T136-S156 WeakPolarHBondContact OG1-CB 3.22Å; M153-S156 WeakPolarHBondContact CE-O 3.21Å; P154-S156 PolarHBondContact O-N 2.74Å
157	D	96	Very high	89	Confident	41 Å²	41	48.6 Å²	48.6	22%	0.219	27%	0.271	C	S	.	.			trans	-57.8	150.5	165.1	-66	0.1	0	0	0	110.6	Y77 N78 L80 T135	Y77-D157 VanDerWaalsContact CA-OD1 3.31Å; Y77-D157 WeakPolarHBondContact CA-OD1 3.35Å; N78-D157 HydrophobicContact CB-CB 4.47Å; N78-D157 PolarHBondContact N-OD1 3.03Å; N78-D157 PolarHBondContact ND2-OD2 3.32Å; N78-D157 VanDerWaalsContact ND2-OD2 3.09Å; N78-D157 WeakPolarHBondContact O-CA 3.45Å; L80-D157 HydrophobicContact CD1-CB 4.05Å; L80-D157 HydrophobicContact CG-CB 4.27Å; T135-D157 WeakPolarHBondContact CB-O 3.36Å; T135-D157 HydrophobicContact CG2-CB 4.11Å; T135-D157 VanDerWaalsContact CG2-O 3.3Å; T135-D157 WeakPolarHBondContact CG2-O 3.23Å; T135-D157 PolarHBondContact N-O 2.87Å; T135-D157 WeakPolarHBondContact OG1-CB 3.37Å; T135-D157 PolarHBondContact OG1-O 2.79Å
158	V	96.5	Very high	88.1	Confident	0 Å²	0	54.2 Å²	54.2	0%	0	29%	0.293	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-116.8	138.9	174.6	-64.1	0	0	0	0	110.9	N78 L79 L80 I132 I133 V141 F151 M153 P154 I160	N78-V158 PolarHBondContact O-N 2.75Å; L79-V158 HydrophobicContact CD2-CG2 3.46Å; L79-V158 VanDerWaalsContact CD2-CG2 3.46Å; L80-V158 WeakPolarHBondContact CB-O 3.3Å; L80-V158 PolarHBondContact N-O 3.18Å; I132-V158 HydrophobicContact CG2-CB 3.86Å; I132-V158 HydrophobicContact CG2-CG1 4.08Å; I132-V158 HydrophobicContact CG2-CG2 4.05Å; I133-V158 CarbonylContact O-C 3.46Å; I133-V158 WeakPolarHBondContact O-CA 3.18Å; V141-V158 HydrophobicContact CG2-CG1 4.33Å; F151-V158 HydrophobicContact CE2-CG2 4.01Å; F151-V158 HydrophobicContact CZ-CG2 4.15Å; M153-V158 HydrophobicContact CE-CB 4.26Å; M153-V158 HydrophobicContact CE-CG1 3.78Å; M153-V158 HydrophobicContact CE-CG2 3.85Å; M153-V158 HydrophobicContact SD-CG1 4.14Å; M153-V158 HydrophobicContact SD-CG2 4.04Å; P154-V158 VanDerWaalsContact CD-CG1 3.49Å; P154-V158 HydrophobicContact CG-CG1 3.48Å; P154-V158 VanDerWaalsContact CG-CG1 3.48Å; V158-I160 HydrophobicContact CG2-CG1 4.46Å
159	S	95.4	Very high	86.9	Confident	23 Å²	23	61.1 Å²	61.1	16%	0.161	32%	0.324	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-92.3	131.8	167.7	-174.3	0	0	0	0	109.4	L80 I133	L80-S159 CarbonylContact O-C 3.56Å; L80-S159 WeakPolarHBondContact O-CA 3.41Å; I133-S159 PolarHBondContact N-O 2.89Å; I133-S159 PolarHBondContact O-N 3.2Å
160	I	94.7	Very high	85	Confident	7 Å²	7	68.6 Å²	68.6	4%	0.036	35%	0.353	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-108.6	131.1	178.3	-56.6	141.3	0	0	0	109.3	L79 L80 I86 I99 F101 V130 I132 V158	L79-I160 HydrophobicContact CB-CD1 3.73Å; L79-I160 HydrophobicContact CD2-CD1 4.28Å; L79-I160 HydrophobicContact CG-CD1 4.39Å; L80-I160 PolarHBondContact O-N 3.05Å; I86-I160 HydrophobicContact CD1-CD1 3.39Å; I99-I160 HydrophobicContact CD1-CG2 4.03Å; F101-I160 HydrophobicContact CD1-CD1 4.36Å; F101-I160 HydrophobicContact CE1-CD1 3.59Å; F101-I160 HydrophobicContact CE1-CG1 4.09Å; F101-I160 HydrophobicContact CE1-CG2 4.28Å; F101-I160 HydrophobicContact CE2-CD1 3.8Å; F101-I160 HydrophobicContact CZ-CB 4.21Å; F101-I160 HydrophobicContact CZ-CD1 3.3Å; F101-I160 HydrophobicContact CZ-CG1 3.93Å; F101-I160 HydrophobicContact CZ-CG2 3.73Å; V130-I160 HydrophobicContact CG1-CG2 4.44Å; I132-I160 HydrophobicContact CD1-CB 4.25Å; I132-I160 HydrophobicContact CD1-CG1 3.74Å; I132-I160 HydrophobicContact CD1-CG2 3.83Å; V158-I160 HydrophobicContact CG2-CG1 4.46Å
161	Q	92.1	Very high	82.7	Confident	88 Å²	88	67.4 Å²	67.4	41%	0.411	36%	0.364	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-127.9	133.9	172.7	-63.1	176.3	-1.9	0	0	108	V130 K131	V130-Q161 CarbonylContact C-O 3.51Å; V130-Q161 WeakPolarHBondContact CA-O 3.36Å; K131-Q161 HydrophobicContact CB-CB 4.47Å; K131-Q161 PolarHBondContact N-O 3.29Å; K131-Q161 PolarHBondContact O-N 3.09Å
162	F	91.9	Very high	79.9	Confident	37 Å²	37	75.3 Å²	75.3	16%	0.162	40%	0.398	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-130.2	131.1	169.7	67.7	-81.2	0	0	0	109	D93 N97 I99 V119 L127 E129 V130 V164	D93-F162 HydrophobicContact CB-CE2 4.27Å; D93-F162 HydrophobicContact CB-CZ 3.91Å; N97-F162 HydrophobicContact CB-CE2 3.76Å; N97-F162 HydrophobicContact CB-CZ 4.45Å; I99-F162 HydrophobicContact CB-CD1 4.14Å; I99-F162 HydrophobicContact CB-CE1 4.28Å; I99-F162 HydrophobicContact CG2-CD1 3.54Å; I99-F162 HydrophobicContact CG2-CE1 3.55Å; I99-F162 HydrophobicContact CG2-CG 4.41Å; I99-F162 HydrophobicContact CG2-CZ 4.41Å; V119-F162 HydrophobicContact CG1-CD2 4.44Å; L127-F162 HydrophobicContact CD1-CB 4.45Å; E129-F162 CarbonylContact O-C 3.43Å; E129-F162 VanDerWaalsContact O-CA 3.27Å; E129-F162 WeakPolarHBondContact O-CA 3.43Å; V130-F162 HydrophobicContact CG2-CB 4Å; F162-V164 HydrophobicContact CD2-CG1 4.15Å; F162-V164 HydrophobicContact CE2-CG1 4.35Å
163	E	91.6	Very high	77	Confident	76 Å²	76	77 Å²	77	36%	0.355	41%	0.409	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-106.6	132.7	-179.4	-68.8	-171.8	-176.5	0	0	109.6	K128 E129	K128-E163 HydrophobicContact CB-CB 4.15Å; K128-E163 WeakPolarHBondContact CB-O 3.35Å; K128-E163 HydrophobicContact CD-CB 4.28Å; K128-E163 WeakPolarHBondContact CD-OE2 3.39Å; K128-E163 WeakPolarHBondContact CE-OE2 3.08Å; K128-E163 PolarHBondContact N-O 3.15Å; K128-E163 IonicContact NZ-OE2 2.7Å; K128-E163 PolarHBondContact NZ-OE2 3.19Å; E129-E163 HydrophobicContact CG-CB 4.26Å; E129-E163 HydrophobicContact CG-CG 4.48Å; E129-E163 PolarHBondContact N-O 3.08Å; E129-E163 PolarHBondContact O-N 3.11Å
164	V	90.8	Very high	73.9	Confident	32 Å²	32	82.5 Å²	82.5	19%	0.194	44%	0.443	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-115.7	148.4	175.5	-62.4	0	0	0	0	110.4	N97 L121 Y125 T126 F162	N97-V164 HydrophobicContact CB-CG1 4.18Å; L121-V164 HydrophobicContact CD2-CB 4.45Å; L121-V164 HydrophobicContact CD2-CG1 3.49Å; L121-V164 VanDerWaalsContact CD2-CG1 3.49Å; Y125-V164 HydrophobicContact CD1-CB 3.97Å; Y125-V164 HydrophobicContact CD1-CG2 3.56Å; Y125-V164 HydrophobicContact CE1-CG2 4.09Å; Y125-V164 HydrophobicContact CG-CB 4.45Å; Y125-V164 HydrophobicContact CG-CG2 4.27Å; T126-V164 CarbonylContact O-C 3.51Å; T126-V164 VanDerWaalsContact O-CA 3.25Å; T126-V164 WeakPolarHBondContact O-CA 3.31Å; F162-V164 HydrophobicContact CD2-CG1 4.15Å; F162-V164 HydrophobicContact CE2-CG1 4.35Å
165	T	88.4	Confident	70.7	Confident	63 Å²	63	85.7 Å²	85.7	39%	0.387	46%	0.464	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-110.5	128.9	173.1	-53	0	0	0	0	108.6	Y125 T126 V167	Y125-T165 CarbonylContact C-O 3.56Å; Y125-T165 WeakPolarHBondContact CA-O 3.24Å; T126-T165 PolarHBondContact N-O 2.98Å; T126-T165 PolarHBondContact O-N 3.01Å; T126-T165 PolarHBondContact OG1-O 3.49Å; T165-V167 PolarHBondContact O-N 3.47Å
166	P	85.9	Confident	67.5	Low	79 Å²	79	86.2 Å²	86.2	51%	0.513	47%	0.472	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-62.6	128	170.3	25.2	-31.3	0	0	0	108.9	G124 Y125 K168	G124-P166 CarbonylContact O-C 3.5Å; G124-P166 VanDerWaalsContact O-CA 3.32Å; G124-P166 WeakPolarHBondContact O-CA 3.36Å; Y125-P166 HydrophobicContact CD1-CB 4.27Å; Y125-P166 HydrophobicContact CE1-CB 3.94Å; P166-K168 PolarHBondContact O-N 3.17Å
167	V	77.4	Confident	64.3	Low	81 Å²	81	91.2 Å²	91.2	49%	0.491	50%	0.504	S	S	.	.			trans	-61.9	104	166.3	-178	0	0	0	0	105.5	G124 T126 T165 E169	G124-V167 PolarHBondContact O-N 3.28Å; T126-V167 HydrophobicContact CG2-CG2 3.75Å; T165-V167 PolarHBondContact O-N 3.47Å; V167-E169 PolarHBondContact O-N 3.25Å; V167-E169 VanDerWaalsContact O-N 3.08Å
168	K	57.9	Low	61.1	Low	185 Å²	185	96.9 Å²	96.9	80%	0.804	53%	0.526	S	S	*	.			trans	-54.5	122	163.6	-93.9	-178.3	176	177	0	105.8	P166 E170	P166-K168 PolarHBondContact O-N 3.17Å; K168-E170 PolarHBondContact O-N 3.27Å
169	E	45.7	Very low	57.9	Low	192 Å²	192	101.9 Å²	101.9	90%	0.897	56%	0.559	S	S	*	*			trans	-57	95	169.8	-147.3	173	-154.4	0	0	105.7	V167 A171	V167-E169 PolarHBondContact O-N 3.25Å; V167-E169 VanDerWaalsContact O-N 3.08Å; E169-A171 PolarHBondContact O-N 3.23Å; E169-A171 VanDerWaalsContact O-N 3.17Å
170	E	39.6	Very low	54.5	Low	178 Å²	178	105.7 Å²	105.7	83%	0.832	59%	0.592	S	S	*	*			trans	-56.1	127.4	167.4	-80.5	-169.7	168.6	0	0	105.2	K168 K172	K168-E170 PolarHBondContact O-N 3.27Å; E170-K172 PolarHBondContact O-N 2.68Å
171	A	36.7	Very low	51.5	Low	93 Å²	93	114.2 Å²	114.2	77%	0.769	63%	0.632	S	S	*	*			trans	-43.8	118.7	-178.5	0	0	0	0	0	107.7	E169	E169-A171 PolarHBondContact O-N 3.23Å; E169-A171 VanDerWaalsContact O-N 3.17Å
172	K	31.8	Very low	48.2	Very low	171 Å²	171	119.3 Å²	119.3	74%	0.743	65%	0.652	S	S	*	*			trans	-25.8	112.9	171.5	177.1	-178	-175.2	177.7	0	106.9	E170 T174	E170-K172 PolarHBondContact O-N 2.68Å; K172-T174 PolarHBondContact O-N 2.95Å
173	P	30.2	Very low	45.2	Very low	115 Å²	115	123.9 Å²	123.9	75%	0.747	69%	0.686	S	S	*	*			trans	-51.8	116	177.5	17.6	-28.1	0	0	0	104.4	P175	P173-P175 VanDerWaalsContact O-CD 3.24Å; P173-P175 WeakPolarHBondContact O-CD 3.18Å
174	T	27.1	Very low	42.1	Very low	120 Å²	120	126.2 Å²	126.2	74%	0.736	71%	0.711	S	S	*	*			trans	-54.9	115.3	177.3	-57.8	0	0	0	0	102.3	K172 T176	K172-T174 PolarHBondContact O-N 2.95Å; T174-T176 PolarHBondContact O-N 3.27Å
175	P	27.6	Very low	38.9	Very low	94 Å²	94	127.7 Å²	127.7	61%	0.61	73%	0.732	S	S	*	*			trans	-53	116.7	-176.1	18.1	-28.8	0	0	0	104.6	P173 P177	P173-P175 VanDerWaalsContact O-CD 3.24Å; P173-P175 WeakPolarHBondContact O-CD 3.18Å; P175-P177 WeakPolarHBondContact O-CD 3.3Å
176	T	26.6	Very low	35.7	Very low	132 Å²	132	132.4 Å²	132.4	81%	0.81	76%	0.755	S	S	*	*			trans	-48.5	113.3	173.4	-44.3	0	0	0	0	103.7	T174 K178	T174-T176 PolarHBondContact O-N 3.27Å; T176-K178 PolarHBondContact O-N 2.62Å
177	P	26.6	Very low	32.8	Very low	108 Å²	108	135 Å²	135	70%	0.701	77%	0.77	S	S	*	*			trans	-57	118.5	-178.7	-18.7	29.1	0	0	0	104.6	P175	P175-P177 WeakPolarHBondContact O-CD 3.3Å
178	K	29.7	Very low	30.2	Very low	160 Å²	160	134 Å²	134	70%	0.696	78%	0.775	S	S	*	*			trans	-46	133.2	170	-177.2	178.8	179	-176.7	0	106.3	T176 A180	T176-K178 PolarHBondContact O-N 2.62Å; K178-A180 PolarHBondContact O-N 3.01Å
179	P	28.5	Very low	28.5	Very low	105 Å²	105	132.8 Å²	132.8	68%	0.682	78%	0.778	S	S	*	*			trans	-50.6	131	-163.6	-26.2	32.1	0	0	0	111.3	E181	P179-E181 VanDerWaalsContact C-N 3.26Å; P179-E181 PolarHBondContact O-N 2.65Å
180	A	24.9	Very low	27.3	Very low	103 Å²	103	128 Å²	128	85%	0.851	77%	0.765	S	S	*	*			trans	-64.3	91.3	168.1	0	0	0	0	0	108.1	K178	K178-A180 PolarHBondContact O-N 3.01Å
181	E	30.3	Very low	26.6	Very low	187 Å²	187	126.8 Å²	126.8	87%	0.874	77%	0.765	S	S	*	*	P	Polyproline II helix	trans	-76	125.6	168.9	-82.6	-176.6	163.9	0	0	109.5	P179	P179-E181 VanDerWaalsContact C-N 3.26Å; P179-E181 PolarHBondContact O-N 2.65Å
182	K	22.7	Very low	25.9	Very low	195 Å²	195	128.3 Å²	128.3	85%	0.848	77%	0.769	S	S	*	*	P	Polyproline II helix	trans	-59.7	155.2	-175.6	-84.7	175.4	176.1	173.5	0	112.9	S184	K182-S184 PolarHBondContact O-N 3.1Å
183	P	29.1	Very low	25.5	Very low	132 Å²	132	123.4 Å²	123.4	86%	0.857	77%	0.768	S	S	*	*	P	Polyproline II helix	trans	-75	123.7	-175.1	31.1	-32.4	0	0	0	110.9
184	S	27.3	Very low	25.2	Very low	126 Å²	126	124.6 Å²	124.6	88%	0.881	77%	0.768	S	S	*	*			trans	-122.3	125.3	156.2	-175.7	0	0	0	0	104.3	K182	K182-S184 PolarHBondContact O-N 3.1Å
185	G	24	Very low	24.9	Very low	62 Å²	62	127 Å²	127	64%	0.639	77%	0.768	S	S	*	*			cis	152.5	91.5	26.4	0	0	0	0	0	102.8	T187	G185-T187 PolarHBondContact O-N 3.35Å
186	N	20.4	Very low	25	Very low	162 Å²	162	130.2 Å²	130.2	87%	0.866	78%	0.78	S	S	*	*			trans	-61.8	116.2	-177.9	-176.4	22.1	0	0	0	110.2
187	T	25.7	Very low	24.8	Very low	135 Å²	135	132.5 Å²	132.5	83%	0.828	78%	0.779	S	S	*	*			trans	-138	99.6	158	-30.3	0	0	0	0	103.2	G185	G185-T187 PolarHBondContact O-N 3.35Å
188	G	21.5	Very low	24.8	Very low	59 Å²	59	133.1 Å²	133.1	61%	0.608	78%	0.783	S	S	*	*				76.9	93.4	66.3	0	0	0	0	0	108.8
189	N	22.8	Very low	24.5	Very low	160 Å²	160	129.3 Å²	129.3	86%	0.856	78%	0.781	S	S	*	*				174.5	144.8	106.2	-159.5	19.7	0	0	0	112.4
190	S	19.3	Very low	24.3	Very low	91 Å²	91	130.4 Å²	130.4	64%	0.636	79%	0.791	S	S	*	*			trans	-68.6	153.4	177.2	-58.7	0	0	0	0	114.8
191	N	25.4	Very low	24.4	Very low	153 Å²	153	132.9 Å²	132.9	82%	0.818	79%	0.79	S	S	*	*				175.3	114.7	124.7	-93.7	-10.1	0	0	0	107.4
192	S	21.5	Very low	24.4	Very low	124 Å²	124	129.5 Å²	129.5	87%	0.867	79%	0.785	S	S	*	*				61.3	120.2	64	-164.7	0	0	0	0	114.3
193	G	23.9	Very low	24.3	Very low	69 Å²	69	125.1 Å²	125.1	71%	0.711	78%	0.778	S	S	*	*			trans	134.2	80.2	162.3	0	0	0	0	0	114
194	N	23.3	Very low	23.9	Very low	139 Å²	139	124.1 Å²	124.1	74%	0.743	77%	0.774	S	S	*	*				80.6	121.9	92.9	-119.7	-2.9	0	0	0	116.2
195	K	22.7	Very low	23.7	Very low	170 Å²	170	123.6 Å²	123.6	74%	0.739	77%	0.766	S	S	*	*			trans	43.3	125.1	138.5	-69.6	174.3	-177.1	-178.6	0	119.7
196	D	28.7	Very low	23.6	Very low	162 Å²	162	125.7 Å²	125.7	87%	0.866	77%	0.767	S	S	*	*				-170.1	149.4	99.6	-94	-31.6	0	0	0	114.3
197	K	22	Very low	24	Very low	181 Å²	181	126.2 Å²	126.2	79%	0.787	77%	0.77	S	S	*	*			trans	-120.7	138	175.2	176.7	-170	-179.9	-178	0	106.6
198	P	27.4	Very low	23.8	Very low	121 Å²	121	125 Å²	125	79%	0.786	77%	0.766	S	S	*	*				-137.5	144.1	120.1	29.7	-13.5	0	0	0	109.8
199	A	22.6	Very low	23.9	Very low	80 Å²	80	127.2 Å²	127.2	66%	0.661	78%	0.779	S	S	*	*				66.2	93	50.9	0	0	0	0	0	115
200	S	25.8	Very low	23.9	Very low	127 Å²	127	123.1 Å²	123.1	89%	0.888	78%	0.775	S	S	*	*			trans	-172.1	123.7	143.6	52.8	0	0	0	0	112.5
201	N	25	Very low	24.2	Very low	156 Å²	156	126.8 Å²	126.8	83%	0.834	79%	0.787	S	S	*	*			trans	-88.2	152.8	155.5	-131.1	2.7	0	0	0	107
202	P	31.9	Very low	24	Very low	116 Å²	116	124.6 Å²	124.6	75%	0.753	78%	0.784	S	S	*	*				-148.2	148.3	82	33.4	-12.4	0	0	0	114.2
203	S	19.2	Very low	24.1	Very low	103 Å²	103	124.1 Å²	124.1	72%	0.72	78%	0.78	S	S	*	*				63.4	135.3	94.3	-159.3	0	0	0	0	118.5
204	S	20.6	Very low	24.2	Very low	110 Å²	110	125.5 Å²	125.5	77%	0.769	79%	0.785	S	S	*	*			trans	79.3	135.4	164.4	79.4	0	0	0	0	115.7
205	T	25.1	Very low	24.3	Very low	116 Å²	116	123.1 Å²	123.1	71%	0.712	79%	0.785	S	S	*	*			cis	-160.8	136.9	37.3	-58.1	0	0	0	0	111.4
206	T	20.5	Very low	24.7	Very low	106 Å²	106	122.8 Å²	122.8	65%	0.65	79%	0.791	S	S	*	*			trans	7.6	129.3	140.2	-35.1	0	0	0	0	119.5
207	N	29.2	Very low	24.6	Very low	173 Å²	173	123.6 Å²	123.6	93%	0.925	79%	0.79	S	S	*	*			trans	-145.8	125.1	133.2	-98.8	-19	0	0	0	110.5
208	S	20.5	Very low	24.9	Very low	108 Å²	108	123.8 Å²	123.8	76%	0.755	79%	0.793	S	S	*	*			trans	-92.3	170.8	179.2	-74.3	0	0	0	0	111.9
209	A	25	Very low	25	Very low	107 Å²	107	127 Å²	127	88%	0.884	80%	0.798	S	S	*	*			trans	81.6	123.3	167.4	0	0	0	0	0	114.5
210	G	21.9	Very low	25.3	Very low	74 Å²	74	132.7 Å²	132.7	76%	0.763	81%	0.811	S	S	*	*			cis	123.7	107.2	19.8	0	0	0	0	0	107.8
211	N	26.1	Very low	25.4	Very low	168 Å²	168	131.1 Å²	131.1	90%	0.898	81%	0.805	S	S	*	*			trans	-172.1	137.7	131.5	-131.1	14.3	0	0	0	112.2
212	S	22.3	Very low	25.5	Very low	106 Å²	106	127.8 Å²	127.8	74%	0.741	80%	0.799	S	S	*	*			trans	-63.6	144.4	171.9	-46.4	0	0	0	0	112.6
213	S	23.1	Very low	25	Very low	114 Å²	114	133.8 Å²	133.8	80%	0.797	81%	0.807	S	S	*	*				168	126.8	118	60.1	0	0	0	0	112.9
214	A	25.9	Very low	25.3	Very low	99 Å²	99	136.6 Å²	136.6	82%	0.818	81%	0.809	S	S	*	*			trans	60.2	118.9	139	0	0	0	0	0	120.5
215	A	25.7	Very low	25.6	Very low	88 Å²	88	136.7 Å²	136.7	73%	0.727	81%	0.807	S	S	*	*			trans	-46.2	130.5	162.5	0	0	0	0	0	113.4
216	N	29.7	Very low	25.6	Very low	163 Å²	163	140.3 Å²	140.3	87%	0.872	82%	0.816	S	S	*	*			trans	-130.1	96.3	147.7	-99.4	-15.1	0	0	0	107.4	E218	N216-E218 PolarHBondContact O-N 3.31Å
217	Q	26.6	Very low	25.8	Very low	180 Å²	180	138.7 Å²	138.7	84%	0.841	81%	0.813	S	S	*	*			trans	-71.2	108	159	-70.6	175.6	-7.5	0	0	107.1
218	E	28.4	Very low	25.7	Very low	185 Å²	185	134.9 Å²	134.9	86%	0.864	81%	0.805	S	S	*	*			trans	-176.6	141.7	154.7	-105.3	154.5	-166.6	0	0	109	N216	N216-E218 PolarHBondContact O-N 3.31Å
219	Q	30.7	Very low	25.9	Very low	189 Å²	189	134.2 Å²	134.2	88%	0.883	81%	0.807	S	S	*	*			trans	95.5	42.6	179	-56.6	-177.5	-15.8	0	0	118.9
220	Q	27.6	Very low	25.9	Very low	198 Å²	198	132.9 Å²	132.9	93%	0.925	80%	0.795	S	S	*	*			trans	-102.2	61.7	145	-78.4	-175.6	-0.2	0	0	110.7	A222	Q220-A222 PolarHBondContact O-N 3.06Å; Q220-A222 VanDerWaalsContact O-N 3.09Å
221	A	27.9	Very low	26.3	Very low	94 Å²	94	133.4 Å²	133.4	78%	0.777	78%	0.781	S	S	*	*			trans	-79.4	76	155.3	0	0	0	0	0	107.3	R223	A221-R223 PolarHBondContact O-N 3.34Å
222	A	28.4	Very low	26.6	Very low	86 Å²	86	130.8 Å²	130.8	71%	0.711	77%	0.771	S	S	*	*			trans	-56	110.6	167	0	0	0	0	0	107.8	Q220 Q224	Q220-A222 PolarHBondContact O-N 3.06Å; Q220-A222 VanDerWaalsContact O-N 3.09Å; A222-Q224 PolarHBondContact O-N 3.25Å
223	R	21.5	Very low	27.5	Very low	242 Å²	242	126.8 Å²	126.8	91%	0.913	74%	0.739	S	S	*	*			trans	-59	92.8	160.2	-72.5	-175.8	176.8	-176.8	-1.1	107.1	A221 P225	A221-R223 PolarHBondContact O-N 3.34Å; R223-P225 WeakPolarHBondContact O-CD 3.12Å
224	Q	24	Very low	28.5	Very low	163 Å²	163	127 Å²	127	76%	0.762	73%	0.731	S	S	*	*			trans	-57.6	120.8	160.8	-170.4	171.8	-63	0	0	105.7	A222 E226	A222-Q224 PolarHBondContact O-N 3.25Å; Q224-E226 PolarHBondContact O-N 3.14Å
225	P	27.8	Very low	29.6	Very low	112 Å²	112	123.6 Å²	123.6	73%	0.727	70%	0.7	S	S	*	*			trans	-54	129	169.6	-16.3	28.1	0	0	0	106.4	R223 A227	R223-P225 WeakPolarHBondContact O-CD 3.12Å; P225-A227 PolarHBondContact O-N 3.27Å
226	E	25	Very low	30.8	Very low	192 Å²	192	121.2 Å²	121.2	90%	0.897	68%	0.678	S	S	*	*			trans	-43.3	104.6	174.6	-167.6	160.5	-168	0	0	107.5	Q224 A228	Q224-E226 PolarHBondContact O-N 3.14Å; E226-A228 PolarHBondContact O-N 3.48Å
227	A	25.3	Very low	31.8	Very low	71 Å²	71	120.7 Å²	120.7	59%	0.587	68%	0.675	S	S	*	*			trans	-58.4	113.1	-176.4	0	0	0	0	0	104.6	P225 A229	P225-A227 PolarHBondContact O-N 3.27Å; A227-A229 PolarHBondContact O-N 2.84Å
228	A	25.5	Very low	32.9	Very low	93 Å²	93	118.9 Å²	118.9	77%	0.769	67%	0.666	S	S	*	*			trans	-40.7	116.8	171.2	0	0	0	0	0	106.2	E226 A230	E226-A228 PolarHBondContact O-N 3.48Å; A228-A230 PolarHBondContact O-N 3.21Å
229	A	26	Very low	34.2	Very low	95 Å²	95	117.4 Å²	117.4	79%	0.785	67%	0.665	S	S	*	*			trans	-42.8	111.9	-167	0	0	0	0	0	107.7	A227 D231	A227-A229 PolarHBondContact O-N 2.84Å; A229-D231 PolarHBondContact O-N 2.99Å
230	A	25.6	Very low	35.5	Very low	78 Å²	78	109.8 Å²	109.8	65%	0.645	63%	0.634	S	S	*	*			trans	-51.3	124	173.7	0	0	0	0	0	104.8	A228 V232	A228-A230 PolarHBondContact O-N 3.21Å; A230-V232 HydrophobicContact CB-CG2 4.16Å; A230-V232 WeakPolarHBondContact O-CG2 2.94Å; A230-V232 PolarHBondContact O-N 2.9Å
231	D	30.3	Very low	36.9	Very low	85 Å²	85	101.6 Å²	101.6	46%	0.455	60%	0.598	S	S	.	*			trans	-64.7	75.4	178	-169.8	12.6	0	0	0	107	A229 R233 R604	A229-D231 PolarHBondContact O-N 2.99Å; D231-R233 PolarHBondContact O-N 2.84Å; D231-R233 VanDerWaalsContact OD1-CG 3.29Å; D231-R233 WeakPolarHBondContact OD1-CG 3.3Å; D231-R233 IonicContact OD1-NE 2.93Å; D231-R233 IonicContact OD2-CZ 3.68Å; D231-R233 IonicContact OD2-NE 2.76Å; D231-R233 PolarHBondContact OD2-NE 2.85Å; D231-R604 IonicContact OD1-NH2 3.83Å; D231-R604 IonicContact OD2-CZ 3.92Å; D231-R604 VanDerWaalsContact OD2-CZ 3.32Å; D231-R604 IonicContact OD2-NH1 3.78Å; D231-R604 PolarHBondContact OD2-NH1 3.35Å; D231-R604 IonicContact OD2-NH2 3.95Å; D231-R604 PolarHBondContact OD2-NH2 2.86Å
232	V	31.5	Very low	38.2	Very low	113 Å²	113	102.2 Å²	102.2	69%	0.685	59%	0.592	S	S	*	*			trans	-76.9	74.5	177.2	-174.8	0	0	0	0	105.6	A230 I234	A230-V232 HydrophobicContact CB-CG2 4.16Å; A230-V232 WeakPolarHBondContact O-CG2 2.94Å; A230-V232 PolarHBondContact O-N 2.9Å; V232-I234 HydrophobicContact CG1-CG1 4.25Å; V232-I234 PolarHBondContact O-N 2.87Å
233	R	40.1	Very low	39.5	Very low	22 Å²	22	98.5 Å²	98.5	8%	0.083	56%	0.56	C	S	.	*			trans	-67.1	112.8	167.6	-66.1	179.4	176.3	-176.8	-6.7	106.7	D231 G296 D297 Y300	D231-R233 PolarHBondContact O-N 2.84Å; D231-R233 VanDerWaalsContact OD1-CG 3.29Å; D231-R233 WeakPolarHBondContact OD1-CG 3.3Å; D231-R233 IonicContact OD1-NE 2.93Å; D231-R233 IonicContact OD2-CZ 3.68Å; D231-R233 IonicContact OD2-NE 2.76Å; D231-R233 PolarHBondContact OD2-NE 2.85Å; R233-G296 PolarHBondContact NH1-O 2.95Å; R233-D297 IonicContact CZ-OD1 3.22Å; R233-D297 IonicContact NH1-OD1 3.79Å; R233-D297 PolarHBondContact NH1-OD1 3.3Å; R233-D297 IonicContact NH2-OD1 3.02Å; R233-D297 PolarHBondContact NH2-OD1 3.16Å; R233-Y300 HydrophobicContact CB-CD1 3.65Å; R233-Y300 HydrophobicContact CB-CD2 4.09Å; R233-Y300 HydrophobicContact CB-CE1 3.35Å; R233-Y300 HydrophobicContact CB-CE2 3.84Å; R233-Y300 HydrophobicContact CB-CG 4.01Å; R233-Y300 VanDerWaalsContact CB-CZ 3.47Å; R233-Y300 VanDerWaalsContact CD-CE2 3.42Å; R233-Y300 HydrophobicContact CG-CD2 4.38Å; R233-Y300 HydrophobicContact CG-CE2 4.27Å; R233-Y300 VanDerWaalsContact O-CE1 3.24Å; R233-Y300 WeakPolarHBondContact O-CE1 3.31Å
234	I	45.1	Very low	41.3	Very low	120 Å²	120	89.6 Å²	89.6	62%	0.615	54%	0.535	S	S	*	.	P	Polyproline II helix	trans	-84.2	130.6	175.6	-54.2	-178.2	0	0	0	107.9	V232	V232-I234 HydrophobicContact CG1-CG1 4.25Å; V232-I234 PolarHBondContact O-N 2.87Å
235	P	49.3	Very low	43.3	Very low	26 Å²	26	85.3 Å²	85.3	17%	0.169	52%	0.517	C	S	.	.	P	Polyproline II helix	trans	-50.2	147.3	168.8	-27.8	36.1	0	0	0	111.9	N237 Q304 T322	P235-N237 PolarHBondContact O-N 3.13Å; P235-Q304 HydrophobicContact CB-CB 4.43Å; P235-Q304 HydrophobicContact CB-CG 4.13Å; P235-T322 HydrophobicContact CG-CG2 3.96Å
236	S	50.6	Low	45.3	Very low	38 Å²	38	85.5 Å²	85.5	27%	0.266	51%	0.508	S	S	.	.	P	Polyproline II helix	trans	-65.4	125.5	175.2	178.3	0	0	0	0	110.3	Q238	S236-Q238 PolarHBondContact O-N 3.1Å; S236-Q238 WeakPolarHBondContact OG-CB 3.14Å; S236-Q238 WeakPolarHBondContact OG-CG 3.5Å; S236-Q238 PolarHBondContact OG-N 3.42Å
237	N	50.3	Low	47.6	Very low	153 Å²	153	77.1 Å²	77.1	82%	0.818	47%	0.47	S	S	*	.			trans	-83.3	7.8	170.4	-81.4	5.3	0	0	0	113.1	P235	P235-N237 PolarHBondContact O-N 3.13Å
238	Q	49.5	Very low	50	Low	141 Å²	141	74.8 Å²	74.8	66%	0.659	45%	0.447	S	S	*	.	S	Bend	trans	-73.5	145.5	176.8	-62.1	-63.4	-51.2	0	0	110.3	S236 A240 T303	S236-Q238 PolarHBondContact O-N 3.1Å; S236-Q238 WeakPolarHBondContact OG-CB 3.14Å; S236-Q238 WeakPolarHBondContact OG-CG 3.5Å; S236-Q238 PolarHBondContact OG-N 3.42Å; Q238-A240 PolarHBondContact O-N 2.96Å; Q238-T303 WeakPolarHBondContact O-CG2 3.45Å; Q238-T303 PolarHBondContact O-OG1 3.46Å
239	N	56.9	Low	52.1	Low	155 Å²	155	71.8 Å²	71.8	83%	0.829	42%	0.42	S	S	*	.	P	Polyproline II helix	trans	-53.3	134.1	170.3	-70.2	-21.8	0	0	0	109.5
240	A	57.1	Low	54.5	Low	28 Å²	28	68 Å²	68	23%	0.231	39%	0.388	C	S	.	.	P	Polyproline II helix	trans	-59.9	129.9	178.7	0	0	0	0	0	109.1	Q238 T303 I305 R362	Q238-A240 PolarHBondContact O-N 2.96Å; A240-T303 HydrophobicContact CB-CG2 3.96Å; A240-I305 HydrophobicContact CB-CG2 3.47Å; A240-I305 VanDerWaalsContact CB-CG2 3.47Å; A240-R362 HydrophobicContact CB-CB 4.26Å
241	P	56.8	Low	57.4	Low	27 Å²	27	64.2 Å²	64.2	18%	0.175	36%	0.357	C	S	.	.	P	Polyproline II helix	trans	-59.6	163.2	174.2	23.9	-30.4	0	0	0	109.7	R362 A366	P241-R362 HydrophobicContact CG-CG 4.17Å; P241-R362 WeakPolarHBondContact O-CD 3.18Å; P241-R362 PolarHBondContact O-NH1 2.82Å; P241-A366 HydrophobicContact CB-CB 4.26Å
242	T	55.3	Low	59.8	Low	107 Å²	107	60.7 Å²	60.7	66%	0.656	34%	0.338	S	S	*	.	P	Polyproline II helix	trans	-98.5	124.8	163.8	-54.2	0	0	0	0	106.3
243	F	56.4	Low	62	Low	7 Å²	7	57.4 Å²	57.4	3%	0.031	32%	0.315	C	S	.	.	P	Polyproline II helix	trans	-62.5	139.9	171.4	-67.5	-34.8	0	0	0	108.9	Q248 D314 R362 V363 V365	F243-Q248 HydrophobicContact CB-CG 3.25Å; F243-Q248 HydrophobicContact CD2-CG 3.85Å; F243-Q248 HydrophobicContact CG-CG 4.02Å; F243-Q248 PolarHBondContact O-NE2 3.23Å; F243-D314 WeakPolarHBondContact CE2-OD1 3.49Å; F243-R362 HydrophobicContact CD1-CG 4.26Å; F243-R362 HydrophobicContact CE1-CG 3.66Å; F243-R362 HydrophobicContact CE2-CG 4.02Å; F243-R362 HydrophobicContact CZ-CG 3.58Å; F243-V363 VanDerWaalsContact CE1-O 3.31Å; F243-V363 WeakPolarHBondContact CE1-O 3.26Å; F243-V363 HydrophobicContact CZ-CB 4.42Å; F243-V365 HydrophobicContact CD1-CG2 3.28Å; F243-V365 HydrophobicContact CE1-CG2 3.07Å; F243-V365 HydrophobicContact CZ-CG2 4.19Å
244	S	59.3	Low	64.1	Low	56 Å²	56	57.9 Å²	57.9	39%	0.392	32%	0.319	S	S	.	.	P	Polyproline II helix	trans	-62.7	146.6	165.8	89.5	0	0	0	0	108.8	E246 V247 Q248	S244-E246 WeakPolarHBondContact CB-OE2 3.42Å; S244-E246 PolarHBondContact O-N 2.94Å; S244-E246 VanDerWaalsContact O-N 3.1Å; S244-E246 PolarHBondContact OG-OE2 2.8Å; S244-V247 PolarHBondContact O-N 3.48Å; S244-V247 PolarHBondContact OG-N 3.14Å; S244-Q248 PolarHBondContact O-N 3.02Å; S244-Q248 VanDerWaalsContact O-N 3.11Å
245	N	66.7	Low	66.2	Low	72 Å²	72	52.1 Å²	52.1	39%	0.385	29%	0.289	S	S	.	.	H	α-helix	trans	-58.4	-29.3	-176.2	-72.3	-15.9	0	0	0	111.6	N106 T249	N106-N245 PolarHBondContact OD1-ND2 2.77Å; N245-T249 VanDerWaalsContact O-CB 3.3Å; N245-T249 WeakPolarHBondContact O-CB 3.33Å; N245-T249 PolarHBondContact O-N 2.98Å; N245-T249 PolarHBondContact O-OG1 3.28Å
246	E	69.6	Low	67.8	Low	116 Å²	116	51.7 Å²	51.7	54%	0.542	28%	0.284	S	S	.	.	H	α-helix	trans	-67.1	-39.3	175.8	-53.5	73.8	-156.7	0	0	112.8	S244 A250	S244-E246 WeakPolarHBondContact CB-OE2 3.42Å; S244-E246 PolarHBondContact O-N 2.94Å; S244-E246 VanDerWaalsContact O-N 3.1Å; S244-E246 PolarHBondContact OG-OE2 2.8Å; E246-A250 WeakPolarHBondContact O-CB 3.46Å; E246-A250 PolarHBondContact O-N 3.45Å
247	V	71.9	Confident	69.3	Low	17 Å²	17	58.6 Å²	58.6	10%	0.103	31%	0.305	C	S	.	.	H	α-helix	trans	-71.4	-44.6	178.1	173.4	0	0	0	0	110.6	S244 T249 A250 I251 T287 V365	S244-V247 PolarHBondContact O-N 3.48Å; S244-V247 PolarHBondContact OG-N 3.14Å; V247-T249 VanDerWaalsContact C-N 3.27Å; V247-T249 PolarHBondContact O-N 2.98Å; V247-A250 PolarHBondContact O-N 3.37Å; V247-I251 HydrophobicContact CG1-CD1 3.93Å; V247-I251 WeakPolarHBondContact O-CG1 3.3Å; V247-I251 PolarHBondContact O-N 3.11Å; V247-I251 VanDerWaalsContact O-N 3.07Å; V247-T287 HydrophobicContact CG1-CG2 3.94Å; V247-V365 HydrophobicContact CG1-CG2 4.37Å
248	Q	75.9	Confident	71	Confident	21 Å²	21	51.8 Å²	51.8	10%	0.098	27%	0.268	C	S	.	.	H	α-helix	trans	-53.6	-49.9	173.8	-61.7	-172.7	25.8	0	0	110.4	F243 S244 A250 I251 V252 P312	F243-Q248 HydrophobicContact CB-CG 3.25Å; F243-Q248 HydrophobicContact CD2-CG 3.85Å; F243-Q248 HydrophobicContact CG-CG 4.02Å; F243-Q248 PolarHBondContact O-NE2 3.23Å; S244-Q248 PolarHBondContact O-N 3.02Å; S244-Q248 VanDerWaalsContact O-N 3.11Å; Q248-A250 PolarHBondContact O-N 2.81Å; Q248-I251 PolarHBondContact O-N 3.01Å; Q248-V252 VanDerWaalsContact O-CG2 3.31Å; Q248-V252 WeakPolarHBondContact O-CG2 3.28Å; Q248-V252 PolarHBondContact O-N 2.99Å; Q248-P312 WeakPolarHBondContact CB-O 3.22Å; Q248-P312 VanDerWaalsContact CG-O 3.29Å; Q248-P312 WeakPolarHBondContact CG-O 3.36Å; Q248-P312 PolarHBondContact OE1-O 3.49Å
249	T	69.4	Low	72.6	Confident	31 Å²	31	46.1 Å²	46.1	19%	0.19	24%	0.242	C	C	.	.	H	α-helix	trans	-57.3	-49.7	178.4	-59.1	0	0	0	0	111.6	T104 N245 V247 I251 V252 Q253	T104-T249 WeakPolarHBondContact CB-OG1 3.41Å; T104-T249 HydrophobicContact CG2-CG2 3.64Å; T104-T249 WeakPolarHBondContact CG2-OG1 3.45Å; N245-T249 VanDerWaalsContact O-CB 3.3Å; N245-T249 WeakPolarHBondContact O-CB 3.33Å; N245-T249 PolarHBondContact O-N 2.98Å; N245-T249 PolarHBondContact O-OG1 3.28Å; V247-T249 VanDerWaalsContact C-N 3.27Å; V247-T249 PolarHBondContact O-N 2.98Å; T249-I251 VanDerWaalsContact C-N 3.3Å; T249-I251 PolarHBondContact O-N 3.31Å; T249-V252 PolarHBondContact O-N 2.81Å; T249-Q253 HydrophobicContact CG2-CG 3.95Å; T249-Q253 VanDerWaalsContact O-CB 3.26Å; T249-Q253 WeakPolarHBondContact O-CB 3.42Å; T249-Q253 WeakPolarHBondContact O-CG 3.46Å; T249-Q253 PolarHBondContact O-N 3.33Å
250	A	77.7	Confident	73.5	Confident	14 Å²	14	40.7 Å²	40.7	12%	0.116	22%	0.222	C	C	.	.	H	α-helix	trans	-59.6	-41.9	-178.4	0	0	0	0	0	111.9	E246 V247 Q248 E254 A286	E246-A250 WeakPolarHBondContact O-CB 3.46Å; E246-A250 PolarHBondContact O-N 3.45Å; V247-A250 PolarHBondContact O-N 3.37Å; Q248-A250 PolarHBondContact O-N 2.81Å; A250-E254 VanDerWaalsContact O-CB 3.31Å; A250-E254 WeakPolarHBondContact O-CB 3.31Å; A250-E254 PolarHBondContact O-N 2.99Å; A250-A286 HydrophobicContact CB-CB 3.86Å; A250-A286 WeakPolarHBondContact O-CB 3.49Å
251	I	84.9	Confident	74.7	Confident	0 Å²	0	42 Å²	42	0%	0	22%	0.223	C	C	.	.	H	α-helix	trans	-64.4	-50.1	178.5	-66.8	165.5	0	0	0	110.3	V247 Q248 T249 E254 A255 V282 Y283 A286 T287 I330	V247-I251 HydrophobicContact CG1-CD1 3.93Å; V247-I251 WeakPolarHBondContact O-CG1 3.3Å; V247-I251 PolarHBondContact O-N 3.11Å; V247-I251 VanDerWaalsContact O-N 3.07Å; Q248-I251 PolarHBondContact O-N 3.01Å; T249-I251 VanDerWaalsContact C-N 3.3Å; T249-I251 PolarHBondContact O-N 3.31Å; I251-E254 PolarHBondContact O-N 3.07Å; I251-A255 PolarHBondContact O-N 3.08Å; I251-V282 HydrophobicContact CG2-CG1 3.77Å; I251-V282 VanDerWaalsContact O-CG1 3.25Å; I251-V282 WeakPolarHBondContact O-CG1 3.31Å; I251-Y283 HydrophobicContact CD1-CD1 4.34Å; I251-Y283 HydrophobicContact CD1-CE1 3.78Å; I251-Y283 HydrophobicContact CD1-CE2 4.5Å; I251-Y283 HydrophobicContact CG2-CE2 4.09Å; I251-A286 HydrophobicContact CB-CB 4.25Å; I251-A286 HydrophobicContact CG1-CB 3.72Å; I251-T287 HydrophobicContact CD1-CG2 3.79Å; I251-T287 HydrophobicContact CG1-CG2 3.69Å; I251-I330 HydrophobicContact CG2-CG2 3.7Å
252	V	82.5	Confident	75.8	Confident	10 Å²	10	43.5 Å²	43.5	6%	0.061	23%	0.233	C	C	.	.	H	α-helix	trans	-63.1	-45.3	-178.6	171.2	0	0	0	0	111	Q248 T249 E254 A255 Y256 P312 I332	Q248-V252 VanDerWaalsContact O-CG2 3.31Å; Q248-V252 WeakPolarHBondContact O-CG2 3.28Å; Q248-V252 PolarHBondContact O-N 2.99Å; T249-V252 PolarHBondContact O-N 2.81Å; V252-E254 PolarHBondContact O-N 2.85Å; V252-A255 WeakPolarHBondContact O-CB 3.22Å; V252-A255 PolarHBondContact O-N 3.23Å; V252-Y256 HydrophobicContact CG1-CD2 3.67Å; V252-Y256 HydrophobicContact CG1-CE2 3.39Å; V252-Y256 WeakPolarHBondContact O-CD2 3.38Å; V252-Y256 PolarHBondContact O-N 3.13Å; V252-P312 HydrophobicContact CG2-CB 3.87Å; V252-I332 HydrophobicContact CG1-CB 4.3Å; V252-I332 HydrophobicContact CG1-CG2 4.02Å; V252-I332 HydrophobicContact CG2-CG2 4.31Å
253	Q	77.8	Confident	77.2	Confident	44 Å²	44	39 Å²	39	21%	0.206	20%	0.204	C	C	.	.	H	α-helix	trans	-61.8	-44.2	177.8	-73.3	-59.8	-32	0	0	112.2	H116 T249 A255 Y256 R257	H116-Q253 PolarHBondContact CD2-NE2 2.78Å; H116-Q253 PolarHBondContact CE1-NE2 3.38Å; H116-Q253 VanDerWaalsContact CE1-NE2 3.27Å; H116-Q253 PolarHBondContact CE1-OE1 2.85Å; H116-Q253 PolarHBondContact ND1-NE2 3.42Å; H116-Q253 PolarHBondContact ND1-OE1 2.81Å; H116-Q253 VanDerWaalsContact ND1-OE1 3.09Å; H116-Q253 PolarHBondContact NE2-NE2 3.25Å; H116-Q253 VanDerWaalsContact NE2-NE2 3.15Å; T249-Q253 HydrophobicContact CG2-CG 3.95Å; T249-Q253 VanDerWaalsContact O-CB 3.26Å; T249-Q253 WeakPolarHBondContact O-CB 3.42Å; T249-Q253 WeakPolarHBondContact O-CG 3.46Å; T249-Q253 PolarHBondContact O-N 3.33Å; Q253-A255 VanDerWaalsContact C-N 3.33Å; Q253-A255 PolarHBondContact O-N 2.96Å; Q253-Y256 PolarHBondContact O-N 2.97Å; Q253-R257 WeakPolarHBondContact O-CG 3.42Å; Q253-R257 PolarHBondContact O-N 3.28Å
254	E	83.6	Confident	78	Confident	32 Å²	32	40.5 Å²	40.5	15%	0.15	21%	0.214	C	C	.	.	H	α-helix	trans	-62.7	-43.2	176.4	-175.3	64.5	-172.6	0	0	110.7	A250 I251 V252 Y256 R257 H258 V282 N285 A286	A250-E254 VanDerWaalsContact O-CB 3.31Å; A250-E254 WeakPolarHBondContact O-CB 3.31Å; A250-E254 PolarHBondContact O-N 2.99Å; I251-E254 PolarHBondContact O-N 3.07Å; V252-E254 PolarHBondContact O-N 2.85Å; E254-Y256 VanDerWaalsContact C-N 3.31Å; E254-Y256 PolarHBondContact O-N 2.93Å; E254-R257 WeakPolarHBondContact O-CB 3.29Å; E254-R257 PolarHBondContact O-N 2.74Å; E254-H258 PolarHBondContact O-CD2 3.47Å; E254-H258 IonicContact OE1-CE1 3.92Å; E254-H258 IonicContact OE1-NE2 3.28Å; E254-H258 PolarHBondContact OE1-NE2 2.92Å; E254-V282 HydrophobicContact CB-CG1 4.23Å; E254-V282 HydrophobicContact CG-CB 4.31Å; E254-V282 HydrophobicContact CG-CG1 4.38Å; E254-V282 HydrophobicContact CG-CG2 4.2Å; E254-N285 HydrophobicContact CG-CB 3.86Å; E254-N285 PolarHBondContact OE1-ND2 3.18Å; E254-A286 HydrophobicContact CB-CB 4.38Å
255	A	88.4	Confident	78.3	Confident	0 Å²	0	38.6 Å²	38.6	0%	0	20%	0.198	C	C	.	.	H	α-helix	trans	-57	-42.7	175.3	0	0	0	0	0	112.5	I251 V252 Q253 R257 H258 V282 I330 I338	I251-A255 PolarHBondContact O-N 3.08Å; V252-A255 WeakPolarHBondContact O-CB 3.22Å; V252-A255 PolarHBondContact O-N 3.23Å; Q253-A255 VanDerWaalsContact C-N 3.33Å; Q253-A255 PolarHBondContact O-N 2.96Å; A255-R257 VanDerWaalsContact C-N 3.27Å; A255-R257 PolarHBondContact O-N 2.92Å; A255-H258 PolarHBondContact O-N 3.31Å; A255-H258 VanDerWaalsContact O-N 3.13Å; A255-V282 HydrophobicContact CB-CG1 4.18Å; A255-V282 HydrophobicContact CB-CG2 4.06Å; A255-I330 HydrophobicContact CB-CB 4.38Å; A255-I330 HydrophobicContact CB-CG2 4.32Å; A255-I338 HydrophobicContact CB-CB 4.19Å; A255-I338 HydrophobicContact CB-CD1 3.84Å; A255-I338 HydrophobicContact CB-CG2 4.25Å
256	Y	82.6	Confident	78.2	Confident	16 Å²	16	36.2 Å²	36.2	6%	0.063	19%	0.19	C	C	.	.	H	α-helix	trans	-60.1	-32.3	176.1	-83.8	-65.9	0	0	0	113.7	Q102 V118 V252 Q253 E254 H258 L259 I332 I338 I349	Q102-Y256 HydrophobicContact CG-CE2 4.11Å; Q102-Y256 VanDerWaalsContact CG-OH 3.31Å; Q102-Y256 WeakPolarHBondContact CG-OH 3.24Å; V118-Y256 HydrophobicContact CB-CE1 4.06Å; V118-Y256 HydrophobicContact CG2-CD1 3.32Å; V118-Y256 HydrophobicContact CG2-CE1 3.18Å; V118-Y256 HydrophobicContact CG2-CG 4.44Å; V252-Y256 HydrophobicContact CG1-CD2 3.67Å; V252-Y256 HydrophobicContact CG1-CE2 3.39Å; V252-Y256 WeakPolarHBondContact O-CD2 3.38Å; V252-Y256 PolarHBondContact O-N 3.13Å; Q253-Y256 PolarHBondContact O-N 2.97Å; E254-Y256 VanDerWaalsContact C-N 3.31Å; E254-Y256 PolarHBondContact O-N 2.93Å; Y256-H258 PolarHBondContact O-N 3.32Å; Y256-H258 VanDerWaalsContact O-N 3.14Å; Y256-L259 HydrophobicContact CD1-CD1 3.63Å; Y256-L259 HydrophobicContact CD1-CG 4.49Å; Y256-L259 HydrophobicContact CE1-CD1 4.2Å; Y256-L259 PolarHBondContact O-N 2.87Å; Y256-I332 VanDerWaalsContact OH-CD1 3.24Å; Y256-I332 WeakPolarHBondContact OH-CD1 3.27Å; Y256-I338 HydrophobicContact CD1-CD1 3.62Å; Y256-I338 HydrophobicContact CD2-CD1 4.14Å; Y256-I338 HydrophobicContact CE1-CD1 3.79Å; Y256-I338 HydrophobicContact CE2-CD1 4.3Å; Y256-I338 HydrophobicContact CG-CD1 3.8Å; Y256-I349 HydrophobicContact CE1-CD1 3.99Å
257	R	82.6	Confident	78.3	Confident	184 Å²	184	31.5 Å²	31.5	69%	0.694	17%	0.171	S	C	*	.	T	Hydrogen-bonded Turn	trans	-65.7	-14.2	177.7	-66.5	-176.7	63.7	72.7	3.6	113.8	Q253 E254 A255	Q253-R257 WeakPolarHBondContact O-CG 3.42Å; Q253-R257 PolarHBondContact O-N 3.28Å; E254-R257 WeakPolarHBondContact O-CB 3.29Å; E254-R257 PolarHBondContact O-N 2.74Å; A255-R257 VanDerWaalsContact C-N 3.27Å; A255-R257 PolarHBondContact O-N 2.92Å
258	H	85.7	Confident	78.5	Confident	9 Å²	9	32.1 Å²	32.1	4%	0.042	17%	0.172	C	C	.	.	T	Hydrogen-bonded Turn	trans	-99.8	-6.5	-177.4	-61.1	-75.3	0	0	0	114.1	E254 A255 Y256 K261 F273 L278 V347	E254-H258 PolarHBondContact O-CD2 3.47Å; E254-H258 IonicContact OE1-CE1 3.92Å; E254-H258 IonicContact OE1-NE2 3.28Å; E254-H258 PolarHBondContact OE1-NE2 2.92Å; A255-H258 PolarHBondContact O-N 3.31Å; A255-H258 VanDerWaalsContact O-N 3.13Å; Y256-H258 PolarHBondContact O-N 3.32Å; Y256-H258 VanDerWaalsContact O-N 3.14Å; H258-K261 HydrophobicContact CB-CD 4.32Å; H258-K261 PolarHBondContact ND1-NZ 3.21Å; H258-K261 VanDerWaalsContact O-CB 3.31Å; H258-K261 WeakPolarHBondContact O-CB 3.43Å; H258-K261 VanDerWaalsContact O-CG 3.27Å; H258-K261 WeakPolarHBondContact O-CG 3.2Å; H258-K261 PolarHBondContact O-N 3.41Å; H258-F273 HydrophobicContact CB-CE2 4.29Å; H258-F273 AromaticContact CE1-CZ 3.42Å; H258-F273 VanDerWaalsContact CE1-CZ 3.42Å; H258-F273 WeakPolarHBondContact CE1-CZ 3.31Å; H258-F273 AromaticContact ND1-CE2 3.22Å; H258-F273 WeakPolarHBondContact ND1-CE2 3.46Å; H258-F273 AromaticContact ND1-CZ 3.1Å; H258-F273 WeakPolarHBondContact ND1-CZ 3.38Å; H258-L278 HydrophobicContact CB-CD1 3.53Å; H258-V347 HydrophobicContact CB-CG1 4.12Å; H258-V347 WeakPolarHBondContact O-CB 3.27Å; H258-V347 WeakPolarHBondContact O-CG1 3.31Å
259	L	82.9	Confident	78.8	Confident	22 Å²	22	32.1 Å²	32.1	12%	0.115	18%	0.178	C	C	.	.	T	Hydrogen-bonded Turn	trans	-53	141.7	178.3	-72	175.7	0	0	0	112.4	V118 N148 Y256 K261 I338 V347 I349	V118-L259 HydrophobicContact CG1-CD1 3.78Å; V118-L259 HydrophobicContact CG2-CD1 3.99Å; N148-L259 WeakPolarHBondContact OD1-CD1 3.37Å; Y256-L259 HydrophobicContact CD1-CD1 3.63Å; Y256-L259 HydrophobicContact CD1-CG 4.49Å; Y256-L259 HydrophobicContact CE1-CD1 4.2Å; Y256-L259 PolarHBondContact O-N 2.87Å; L259-K261 PolarHBondContact O-N 3.01Å; L259-I338 HydrophobicContact CD2-CD1 4.46Å; L259-I338 HydrophobicContact CD2-CG1 4.42Å; L259-I338 HydrophobicContact CD2-CG2 4.2Å; L259-V347 CarbonylContact C-O 3.5Å; L259-V347 WeakPolarHBondContact CA-O 3.21Å; L259-V347 HydrophobicContact CD2-CG1 4.35Å; L259-I349 HydrophobicContact CD2-CG1 4.13Å
260	G	77.6	Confident	79.3	Confident	41 Å²	41	34.8 Å²	34.8	42%	0.423	20%	0.195	S	C	.	.	T	Hydrogen-bonded Turn	trans	80.6	-9.7	-179.2	0	0	0	0	0	115	V346 V347	G260-V346 WeakPolarHBondContact O-CG1 3.12Å; G260-V347 PolarHBondContact N-O 3.01Å
261	K	81.5	Confident	79.5	Confident	56 Å²	56	40 Å²	40	24%	0.243	22%	0.221	C	C	.	.	P	Polyproline II helix	trans	-73.5	136.6	178.3	-64.3	-179.6	-177.2	-178	0	110.8	H258 L259 P270 F273 V346 V347	H258-K261 HydrophobicContact CB-CD 4.32Å; H258-K261 PolarHBondContact ND1-NZ 3.21Å; H258-K261 VanDerWaalsContact O-CB 3.31Å; H258-K261 WeakPolarHBondContact O-CB 3.43Å; H258-K261 VanDerWaalsContact O-CG 3.27Å; H258-K261 WeakPolarHBondContact O-CG 3.2Å; H258-K261 PolarHBondContact O-N 3.41Å; L259-K261 PolarHBondContact O-N 3.01Å; K261-P270 WeakPolarHBondContact CD-O 3.25Å; K261-P270 WeakPolarHBondContact CE-O 3.42Å; K261-P270 PolarHBondContact NZ-O 3.48Å; K261-F273 HydrophobicContact CB-CD2 4.2Å; K261-F273 HydrophobicContact CB-CE2 4.45Å; K261-F273 HydrophobicContact CD-CD2 4.1Å; K261-F273 HydrophobicContact CD-CE2 3.52Å; K261-V346 CarbonylContact O-C 3.59Å; K261-V346 WeakPolarHBondContact O-CA 3.33Å; K261-V347 HydrophobicContact CB-CG2 4.28Å; K261-V347 WeakPolarHBondContact O-CG2 3.1Å; K261-V347 PolarHBondContact O-N 2.89Å
262	P	79.6	Confident	79.1	Confident	58 Å²	58	40.8 Å²	40.8	38%	0.377	23%	0.228	S	C	.	.	B	Isolated β-bridge	trans	-61.9	146.7	-176.6	23.8	-35.4	0	0	0	112.8	N271 A272 F273	P262-N271 VanDerWaalsContact CD-O 3.29Å; P262-N271 WeakPolarHBondContact CD-O 3.39Å; P262-A272 HydrophobicContact CG-CB 4.06Å; P262-A272 WeakPolarHBondContact O-CA 3.22Å; P262-A272 WeakPolarHBondContact O-CB 3.15Å; P262-F273 PolarHBondContact O-N 2.78Å; P262-F273 VanDerWaalsContact O-N 3.08Å
263	Y	84.2	Confident	79.1	Confident	13 Å²	13	40.3 Å²	40.3	5%	0.051	23%	0.225	C	C	.	.	B	Isolated β-bridge	trans	-71.8	127.8	165.3	-174	-77.6	0	0	0	110.1	W265 F273 D274 A340 Q342 P343 D345	Y263-W265 HydrophobicContact CE1-CB 4.27Å; Y263-W265 HydrophobicContact CE1-CE3 4.35Å; Y263-W265 VanDerWaalsContact OH-CE3 3.23Å; Y263-F273 WeakPolarHBondContact CA-O 3.29Å; Y263-D274 HydrophobicContact CE1-CB 4.38Å; Y263-D274 HydrophobicContact CE2-CB 4.11Å; Y263-A340 VanDerWaalsContact CD2-C 3.48Å; Y263-A340 HydrophobicContact CD2-CB 3.67Å; Y263-A340 WeakPolarHBondContact CD2-O 3.22Å; Y263-A340 HydrophobicContact CE2-CB 4.24Å; Y263-A340 VanDerWaalsContact CE2-O 3.25Å; Y263-A340 WeakPolarHBondContact CE2-O 3.29Å; Y263-Q342 WeakPolarHBondContact CB-O 3.48Å; Y263-Q342 VanDerWaalsContact CD2-N 3.28Å; Y263-Q342 VanDerWaalsContact CG-O 3.22Å; Y263-P343 HydrophobicContact CD1-CB 4.27Å; Y263-P343 HydrophobicContact CD1-CG 3.8Å; Y263-P343 VanDerWaalsContact CE1-CD 3.41Å; Y263-P343 HydrophobicContact CE1-CG 3.66Å; Y263-D345 WeakPolarHBondContact CB-O 3.19Å; Y263-D345 PolarHBondContact N-O 3.22Å
264	V	73.8	Confident	79.3	Confident	39 Å²	39	38.5 Å²	38.5	24%	0.236	22%	0.217	C	C	.	.			trans	-135.7	125.5	167.1	173.8	0	0	0	0	107.8	G266 A267 A272 F273 D274	V264-G266 PolarHBondContact O-N 3.27Å; V264-A267 HydrophobicContact CB-CB 3.77Å; V264-A267 HydrophobicContact CG1-CB 4.05Å; V264-A267 WeakPolarHBondContact O-CB 3.1Å; V264-A267 PolarHBondContact O-N 3.48Å; V264-A272 HydrophobicContact CB-CB 3.83Å; V264-A272 HydrophobicContact CG2-CB 3.58Å; V264-F273 PolarHBondContact N-O 2.67Å; V264-F273 CarbonylContact O-C 3.46Å; V264-D274 WeakPolarHBondContact O-CB 3.44Å; V264-D274 PolarHBondContact O-N 3.26Å
265	W	65.2	Low	79.6	Confident	16 Å²	16	37.3 Å²	37.3	6%	0.061	21%	0.212	C	C	.	.	T	Hydrogen-bonded Turn	trans	-55.6	132.6	178.9	-178.4	-87.8	0	0	0	112	Y263 A267 F390 T396 L427 G430 S431	Y263-W265 HydrophobicContact CE1-CB 4.27Å; Y263-W265 HydrophobicContact CE1-CE3 4.35Å; Y263-W265 VanDerWaalsContact OH-CE3 3.23Å; W265-A267 PolarHBondContact O-N 3.19Å; W265-F390 AromaticContact CD1-CE2 3.37Å; W265-F390 AromaticContact CD1-CZ 3.86Å; W265-F390 AromaticContact NE1-CE2 3.11Å; W265-F390 AromaticContact NE1-CZ 3.09Å; W265-T396 WeakPolarHBondContact CZ2-OG1 3.47Å; W265-L427 HydrophobicContact CB-CD1 4.18Å; W265-G430 VanDerWaalsContact CH2-C 3.47Å; W265-G430 WeakPolarHBondContact CH2-O 3.32Å; W265-G430 WeakPolarHBondContact CZ3-O 3.41Å; W265-S431 VanDerWaalsContact CH2-CB 3.49Å; W265-S431 WeakPolarHBondContact CH2-OG 3.4Å; W265-S431 WeakPolarHBondContact CZ2-OG 3.24Å
266	G	65.4	Low	79.5	Confident	21 Å²	21	37.6 Å²	37.6	22%	0.216	21%	0.214	C	C	.	.	T	Hydrogen-bonded Turn	trans	79.1	-10.8	-177.5	0	0	0	0	0	114.5	V264 D274	V264-G266 PolarHBondContact O-N 3.27Å; G266-D274 VanDerWaalsContact C-OD2 3.31Å; G266-D274 WeakPolarHBondContact CA-OD2 3.42Å; G266-D274 PolarHBondContact N-OD2 3.05Å
267	A	71.7	Confident	79.6	Confident	18 Å²	18	36.9 Å²	36.9	15%	0.149	21%	0.211	C	C	.	.			trans	-74.6	139.1	-172.6	0	0	0	0	0	112.3	V264 W265 A272 F273 D274	V264-A267 HydrophobicContact CB-CB 3.77Å; V264-A267 HydrophobicContact CG1-CB 4.05Å; V264-A267 WeakPolarHBondContact O-CB 3.1Å; V264-A267 PolarHBondContact O-N 3.48Å; W265-A267 PolarHBondContact O-N 3.19Å; A267-A272 HydrophobicContact CB-CB 4.18Å; A267-A272 WeakPolarHBondContact CB-O 3.28Å; A267-F273 CarbonylContact O-C 3.29Å; A267-F273 WeakPolarHBondContact O-CA 3.42Å; A267-D274 PolarHBondContact O-N 3Å
268	K	76.5	Confident	80.1	Confident	30 Å²	30	28.1 Å²	28.1	13%	0.13	18%	0.178	C	C	.	.	B	Isolated β-bridge	trans	-123.2	31.8	177.9	-63.6	-176.8	162	59	0	111.1	Y280 V281 G293	K268-Y280 HydrophobicContact CD-CD1 3.88Å; K268-Y280 HydrophobicContact CD-CE1 4.19Å; K268-Y280 HydrophobicContact CD-CG 4.46Å; K268-Y280 HydrophobicContact CG-CD1 4.45Å; K268-V281 HydrophobicContact CB-CG2 4.32Å; K268-V281 WeakPolarHBondContact O-CG2 3.19Å; K268-G293 VanDerWaalsContact CE-O 3.28Å; K268-G293 WeakPolarHBondContact CE-O 3.26Å; K268-G293 PolarHBondContact NZ-O 3.18Å
269	G	80.9	Confident	80.4	Confident	20 Å²	20	27.7 Å²	27.7	21%	0.206	18%	0.176	C	C	.	.	S	Bend	trans	88	-172.6	-180	0	0	0	0	0	115.5	N271 A272 F273	G269-N271 VanDerWaalsContact C-N 3.34Å; G269-A272 WeakPolarHBondContact CA-O 3.27Å; G269-A272 PolarHBondContact N-O 3.36Å; G269-F273 VanDerWaalsContact CA-CE1 3.44Å
270	P	80	Confident	80.5	Confident	87 Å²	87	27.9 Å²	27.9	57%	0.565	18%	0.176	S	C	*	.	S	Bend	cis	-76.4	-17.7	-3.6	31.1	-34.8	0	0	0	113.7	K261	K261-P270 WeakPolarHBondContact CD-O 3.25Å; K261-P270 WeakPolarHBondContact CE-O 3.42Å; K261-P270 PolarHBondContact NZ-O 3.48Å
271	N	81.5	Confident	80.8	Confident	123 Å²	123	26.9 Å²	26.9	66%	0.658	16%	0.161	S	C	*	.	S	Bend	trans	-102.5	-13.7	-168.7	-63	-25.8	0	0	0	114.5	P262 G269	P262-N271 VanDerWaalsContact CD-O 3.29Å; P262-N271 WeakPolarHBondContact CD-O 3.39Å; G269-N271 VanDerWaalsContact C-N 3.34Å
272	A	77.4	Confident	81.2	Confident	17 Å²	17	24.2 Å²	24.2	14%	0.14	15%	0.149	C	C	.	.			trans	-150.6	153.7	179	0	0	0	0	0	110.1	P262 V264 A267 G269	P262-A272 HydrophobicContact CG-CB 4.06Å; P262-A272 WeakPolarHBondContact O-CA 3.22Å; P262-A272 WeakPolarHBondContact O-CB 3.15Å; V264-A272 HydrophobicContact CB-CB 3.83Å; V264-A272 HydrophobicContact CG2-CB 3.58Å; A267-A272 HydrophobicContact CB-CB 4.18Å; A267-A272 WeakPolarHBondContact CB-O 3.28Å; G269-A272 WeakPolarHBondContact CA-O 3.27Å; G269-A272 PolarHBondContact N-O 3.36Å
273	F	81.9	Confident	81.4	Confident	1 Å²	1	21.4 Å²	21.4	0%	0.004	13%	0.131	C	C	.	.	B	Isolated β-bridge	trans	-140.6	143.5	-175.7	-66.6	-86.9	0	0	0	111.5	H258 K261 P262 Y263 V264 A267 G269 L278 V281 A340 V347	H258-F273 HydrophobicContact CB-CE2 4.29Å; H258-F273 AromaticContact CE1-CZ 3.42Å; H258-F273 VanDerWaalsContact CE1-CZ 3.42Å; H258-F273 WeakPolarHBondContact CE1-CZ 3.31Å; H258-F273 AromaticContact ND1-CE2 3.22Å; H258-F273 WeakPolarHBondContact ND1-CE2 3.46Å; H258-F273 AromaticContact ND1-CZ 3.1Å; H258-F273 WeakPolarHBondContact ND1-CZ 3.38Å; K261-F273 HydrophobicContact CB-CD2 4.2Å; K261-F273 HydrophobicContact CB-CE2 4.45Å; K261-F273 HydrophobicContact CD-CD2 4.1Å; K261-F273 HydrophobicContact CD-CE2 3.52Å; P262-F273 PolarHBondContact O-N 2.78Å; P262-F273 VanDerWaalsContact O-N 3.08Å; Y263-F273 WeakPolarHBondContact CA-O 3.29Å; V264-F273 PolarHBondContact N-O 2.67Å; V264-F273 CarbonylContact O-C 3.46Å; A267-F273 CarbonylContact O-C 3.29Å; A267-F273 WeakPolarHBondContact O-CA 3.42Å; G269-F273 VanDerWaalsContact CA-CE1 3.44Å; F273-L278 HydrophobicContact CB-CB 3.97Å; F273-L278 HydrophobicContact CD1-CB 4.17Å; F273-L278 HydrophobicContact CD1-CD1 4.29Å; F273-L278 HydrophobicContact CG-CB 4.23Å; F273-L278 HydrophobicContact CG-CD1 4.2Å; F273-V281 HydrophobicContact CE1-CB 3.96Å; F273-V281 HydrophobicContact CE1-CG1 4.22Å; F273-V281 HydrophobicContact CE1-CG2 3.93Å; F273-A340 HydrophobicContact CB-CB 4.19Å; F273-V347 HydrophobicContact CB-CG2 4.27Å; F273-V347 HydrophobicContact CD2-CG2 4.26Å
274	D	82.3	Confident	81.2	Confident	5 Å²	5	20.9 Å²	20.9	3%	0.027	13%	0.13	C	C	.	.			trans	-87.4	175.1	151.4	76.8	40.7	0	0	0	110.1	Y263 V264 G266 A267 S276 G277 L278	Y263-D274 HydrophobicContact CE1-CB 4.38Å; Y263-D274 HydrophobicContact CE2-CB 4.11Å; V264-D274 WeakPolarHBondContact O-CB 3.44Å; V264-D274 PolarHBondContact O-N 3.26Å; G266-D274 VanDerWaalsContact C-OD2 3.31Å; G266-D274 WeakPolarHBondContact CA-OD2 3.42Å; G266-D274 PolarHBondContact N-OD2 3.05Å; A267-D274 PolarHBondContact O-N 3Å; D274-S276 PolarHBondContact O-N 2.72Å; D274-S276 WeakPolarHBondContact OD1-CA 3.38Å; D274-S276 PolarHBondContact OD1-N 3.2Å; D274-S276 PolarHBondContact OD1-OG 3.46Å; D274-G277 PolarHBondContact O-N 3.13Å; D274-G277 PolarHBondContact OD1-N 2.83Å; D274-L278 WeakPolarHBondContact O-CB 3.4Å; D274-L278 PolarHBondContact O-N 2.95Å
275	C	90.8	Very high	81.4	Confident	8 Å²	8	20.4 Å²	20.4	5%	0.054	13%	0.126	C	C	.	.	H	α-helix	trans	-58.1	-48.5	-177.9	57.1	0	0	0	0	112.7	A279 H327 V328 A340	C275-A279 PolarHBondContact O-N 2.89Å; C275-H327 WeakPolarHBondContact CB-CE1 3.38Å; C275-H327 WeakPolarHBondContact CB-ND1 3.44Å; C275-V328 VanDerWaalsContact C-CG1 3.4Å; C275-V328 HydrophobicContact CB-CG1 3.98Å; C275-V328 WeakPolarHBondContact O-CG1 3.49Å; C275-A340 WeakPolarHBondContact CB-O 3.21Å
276	S	84.8	Confident	82	Confident	6 Å²	6	20 Å²	20	4%	0.042	13%	0.126	C	C	.	.	H	α-helix	trans	-72.4	-31.4	179	62.6	0	0	0	0	113.4	D274 A279 Y280 G293 Q298	D274-S276 PolarHBondContact O-N 2.72Å; D274-S276 WeakPolarHBondContact OD1-CA 3.38Å; D274-S276 PolarHBondContact OD1-N 3.2Å; D274-S276 PolarHBondContact OD1-OG 3.46Å; S276-A279 PolarHBondContact O-N 2.82Å; S276-Y280 WeakPolarHBondContact O-CB 3.19Å; S276-Y280 PolarHBondContact O-N 2.94Å; S276-G293 PolarHBondContact OG-O 3.45Å; S276-Q298 PolarHBondContact O-NE2 3.33Å
277	G	85.6	Confident	82.3	Confident	0 Å²	0	19.5 Å²	19.5	0%	0	12%	0.119	C	C	.	.	H	α-helix	trans	-71.7	-35.9	177	0	0	0	0	0	112.2	D274 V281	D274-G277 PolarHBondContact O-N 3.13Å; D274-G277 PolarHBondContact OD1-N 2.83Å; G277-V281 WeakPolarHBondContact O-CG2 2.97Å; G277-V281 PolarHBondContact O-N 2.72Å
278	L	91.9	Very high	82	Confident	0 Å²	0	19.7 Å²	19.7	0%	0	12%	0.122	C	C	.	.	H	α-helix	trans	-61.1	-54.1	169	179.2	66.1	0	0	0	110.3	H258 F273 D274 Y280 V281 V282 I330 I338 A340 V347	H258-L278 HydrophobicContact CB-CD1 3.53Å; F273-L278 HydrophobicContact CB-CB 3.97Å; F273-L278 HydrophobicContact CD1-CB 4.17Å; F273-L278 HydrophobicContact CD1-CD1 4.29Å; F273-L278 HydrophobicContact CG-CB 4.23Å; F273-L278 HydrophobicContact CG-CD1 4.2Å; D274-L278 WeakPolarHBondContact O-CB 3.4Å; D274-L278 PolarHBondContact O-N 2.95Å; L278-Y280 VanDerWaalsContact C-N 3.28Å; L278-Y280 PolarHBondContact O-N 2.64Å; L278-V281 PolarHBondContact O-N 3.5Å; L278-V282 HydrophobicContact CD1-CG2 3.99Å; L278-V282 HydrophobicContact CG-CG2 4.32Å; L278-V282 WeakPolarHBondContact O-CB 3.38Å; L278-V282 VanDerWaalsContact O-CG2 3.22Å; L278-V282 WeakPolarHBondContact O-CG2 3.44Å; L278-V282 PolarHBondContact O-N 2.92Å; L278-I330 HydrophobicContact CD2-CD1 3.94Å; L278-I330 HydrophobicContact CG-CD1 3.89Å; L278-I338 HydrophobicContact CD2-CG2 4.18Å; L278-A340 HydrophobicContact CB-CB 4.42Å; L278-A340 HydrophobicContact CD2-CB 4.3Å; L278-V347 HydrophobicContact CD1-CG1 4.28Å; L278-V347 HydrophobicContact CD1-CG2 4.41Å; L278-V347 HydrophobicContact CD2-CG1 3.84Å; L278-V347 HydrophobicContact CD2-CG2 4.32Å
279	A	92.3	Very high	81.6	Confident	0 Å²	0	20.6 Å²	20.6	0%	0	13%	0.127	C	C	.	.	H	α-helix	trans	-56.5	-44.1	178.8	0	0	0	0	0	111.8	C275 S276 Y283 I291 L315 V328 I330	C275-A279 PolarHBondContact O-N 2.89Å; S276-A279 PolarHBondContact O-N 2.82Å; A279-Y283 WeakPolarHBondContact O-CB 3.31Å; A279-Y283 WeakPolarHBondContact O-CD2 3.22Å; A279-Y283 PolarHBondContact O-N 2.83Å; A279-I291 HydrophobicContact CB-CD1 4.04Å; A279-L315 HydrophobicContact CB-CD2 3.91Å; A279-V328 HydrophobicContact CB-CG1 4.14Å; A279-V328 HydrophobicContact CB-CG2 4.32Å; A279-I330 HydrophobicContact CB-CD1 4.46Å
280	Y	85.8	Confident	81.3	Confident	27 Å²	27	22.6 Å²	22.6	11%	0.106	13%	0.133	C	C	.	.	H	α-helix	trans	-58.3	-52.7	178.6	171.8	-97.3	0	0	0	112.2	K268 S276 L278 A284 N290 F379	K268-Y280 HydrophobicContact CD-CD1 3.88Å; K268-Y280 HydrophobicContact CD-CE1 4.19Å; K268-Y280 HydrophobicContact CD-CG 4.46Å; K268-Y280 HydrophobicContact CG-CD1 4.45Å; S276-Y280 WeakPolarHBondContact O-CB 3.19Å; S276-Y280 PolarHBondContact O-N 2.94Å; L278-Y280 VanDerWaalsContact C-N 3.28Å; L278-Y280 PolarHBondContact O-N 2.64Å; Y280-A284 VanDerWaalsContact O-CB 3.24Å; Y280-A284 WeakPolarHBondContact O-CB 3.44Å; Y280-A284 PolarHBondContact O-N 3.26Å; Y280-N290 WeakPolarHBondContact CE2-OD1 2.73Å; Y280-F379 WeakPolarHBondContact OH-CD1 3.47Å; Y280-F379 VanDerWaalsContact OH-CG 3.27Å; Y280-F379 WeakPolarHBondContact OH-CG 3.4Å
281	V	83.8	Confident	80.8	Confident	19 Å²	19	18.7 Å²	18.7	12%	0.115	11%	0.107	C	C	.	.	H	α-helix	trans	-67.6	-42.1	-178.3	171.1	0	0	0	0	111.5	K268 F273 G277 L278 Y283 A284 N285	K268-V281 HydrophobicContact CB-CG2 4.32Å; K268-V281 WeakPolarHBondContact O-CG2 3.19Å; F273-V281 HydrophobicContact CE1-CB 3.96Å; F273-V281 HydrophobicContact CE1-CG1 4.22Å; F273-V281 HydrophobicContact CE1-CG2 3.93Å; G277-V281 WeakPolarHBondContact O-CG2 2.97Å; G277-V281 PolarHBondContact O-N 2.72Å; L278-V281 PolarHBondContact O-N 3.5Å; V281-Y283 VanDerWaalsContact C-N 3.34Å; V281-Y283 PolarHBondContact O-N 3.21Å; V281-A284 PolarHBondContact O-N 2.88Å; V281-N285 WeakPolarHBondContact CG1-ND2 3.3Å; V281-N285 VanDerWaalsContact O-CB 3.28Å; V281-N285 WeakPolarHBondContact O-CB 3.32Å; V281-N285 VanDerWaalsContact O-CG 3.29Å; V281-N285 PolarHBondContact O-N 2.77Å
282	V	89.3	Confident	80	Confident	0 Å²	0	13.4 Å²	13.4	0%	0	8%	0.082	C	C	.	.	H	α-helix	trans	-56.7	-50.4	178.2	167.1	0	0	0	0	110.4	I251 E254 A255 L278 N285 A286 I330	I251-V282 HydrophobicContact CG2-CG1 3.77Å; I251-V282 VanDerWaalsContact O-CG1 3.25Å; I251-V282 WeakPolarHBondContact O-CG1 3.31Å; E254-V282 HydrophobicContact CB-CG1 4.23Å; E254-V282 HydrophobicContact CG-CB 4.31Å; E254-V282 HydrophobicContact CG-CG1 4.38Å; E254-V282 HydrophobicContact CG-CG2 4.2Å; A255-V282 HydrophobicContact CB-CG1 4.18Å; A255-V282 HydrophobicContact CB-CG2 4.06Å; L278-V282 HydrophobicContact CD1-CG2 3.99Å; L278-V282 HydrophobicContact CG-CG2 4.32Å; L278-V282 WeakPolarHBondContact O-CB 3.38Å; L278-V282 VanDerWaalsContact O-CG2 3.22Å; L278-V282 WeakPolarHBondContact O-CG2 3.44Å; L278-V282 PolarHBondContact O-N 2.92Å; V282-N285 PolarHBondContact O-N 2.77Å; V282-A286 WeakPolarHBondContact O-CB 3.39Å; V282-A286 PolarHBondContact O-N 3.48Å; V282-I330 HydrophobicContact CG1-CG1 4.32Å; V282-I330 HydrophobicContact CG2-CD1 4.4Å
283	Y	83.6	Confident	79.5	Confident	0 Å²	0	13.2 Å²	13.2	0%	0	8%	0.081	C	C	.	.	H	α-helix	trans	-67.2	-43.7	178.9	-93.5	-95.4	0	0	0	112.7	I251 A279 V281 N285 T287 G288 I291 G313 L315 V363	I251-Y283 HydrophobicContact CD1-CD1 4.34Å; I251-Y283 HydrophobicContact CD1-CE1 3.78Å; I251-Y283 HydrophobicContact CD1-CE2 4.5Å; I251-Y283 HydrophobicContact CG2-CE2 4.09Å; A279-Y283 WeakPolarHBondContact O-CB 3.31Å; A279-Y283 WeakPolarHBondContact O-CD2 3.22Å; A279-Y283 PolarHBondContact O-N 2.83Å; V281-Y283 VanDerWaalsContact C-N 3.34Å; V281-Y283 PolarHBondContact O-N 3.21Å; Y283-N285 VanDerWaalsContact C-N 3.28Å; Y283-N285 PolarHBondContact O-N 3.5Å; Y283-T287 HydrophobicContact CD1-CG2 4.23Å; Y283-T287 WeakPolarHBondContact O-CB 3.27Å; Y283-T287 PolarHBondContact O-N 3.09Å; Y283-T287 PolarHBondContact O-OG1 3.02Å; Y283-G288 PolarHBondContact O-N 3.27Å; Y283-I291 HydrophobicContact CD1-CG2 3.66Å; Y283-I291 HydrophobicContact CD2-CD1 3.79Å; Y283-I291 HydrophobicContact CE1-CG2 4.28Å; Y283-I291 HydrophobicContact CE2-CD1 4.49Å; Y283-I291 HydrophobicContact CG-CD1 3.89Å; Y283-I291 HydrophobicContact CG-CG1 4.37Å; Y283-I291 HydrophobicContact CG-CG2 3.81Å; Y283-G313 PolarHBondContact OH-O 2.86Å; Y283-L315 HydrophobicContact CD2-CD2 4.14Å; Y283-L315 HydrophobicContact CE2-CD1 4.15Å; Y283-L315 HydrophobicContact CE2-CD2 3.5Å; Y283-L315 HydrophobicContact CE2-CG 3.72Å; Y283-V363 HydrophobicContact CD1-CB 4.44Å; Y283-V363 HydrophobicContact CD1-CG1 4.39Å; Y283-V363 HydrophobicContact CD1-CG2 4.16Å; Y283-V363 HydrophobicContact CE1-CB 3.61Å; Y283-V363 HydrophobicContact CE1-CG1 4.02Å; Y283-V363 HydrophobicContact CE1-CG2 3.38Å; Y283-V363 HydrophobicContact CE2-CG2 4.48Å; Y283-V363 WeakPolarHBondContact OH-CG2 3.46Å
284	A	79.8	Confident	78.8	Confident	2 Å²	2	15.2 Å²	15.2	2%	0.017	9%	0.089	C	C	.	.	H	α-helix	trans	-60.9	-37.5	178.6	0	0	0	0	0	112.1	Y280 V281 G288	Y280-A284 VanDerWaalsContact O-CB 3.24Å; Y280-A284 WeakPolarHBondContact O-CB 3.44Å; Y280-A284 PolarHBondContact O-N 3.26Å; V281-A284 PolarHBondContact O-N 2.88Å; A284-G288 WeakPolarHBondContact O-CA 3.2Å; A284-G288 PolarHBondContact O-N 2.87Å
285	N	78.6	Confident	78.3	Confident	29 Å²	29	15.4 Å²	15.4	16%	0.155	9%	0.09	C	C	.	.	H	α-helix	trans	-81.1	-41.4	-179.1	-72.8	-9.5	0	0	0	112.9	E254 V281 V282 Y283 S374 S376	E254-N285 HydrophobicContact CG-CB 3.86Å; E254-N285 PolarHBondContact OE1-ND2 3.18Å; V281-N285 WeakPolarHBondContact CG1-ND2 3.3Å; V281-N285 VanDerWaalsContact O-CB 3.28Å; V281-N285 WeakPolarHBondContact O-CB 3.32Å; V281-N285 VanDerWaalsContact O-CG 3.29Å; V281-N285 PolarHBondContact O-N 2.77Å; V282-N285 PolarHBondContact O-N 2.77Å; Y283-N285 VanDerWaalsContact C-N 3.28Å; Y283-N285 PolarHBondContact O-N 3.5Å; N285-S374 PolarHBondContact OD1-OG 3.02Å; N285-S376 VanDerWaalsContact OD1-CB 3.27Å; N285-S376 WeakPolarHBondContact OD1-CB 3.4Å
286	A	77.7	Confident	77.1	Confident	7 Å²	7	15.3 Å²	15.3	6%	0.058	9%	0.09	C	C	.	.	H	α-helix	trans	-75.2	-36.8	-177.8	0	0	0	0	0	113	A250 I251 E254 V282	A250-A286 HydrophobicContact CB-CB 3.86Å; A250-A286 WeakPolarHBondContact O-CB 3.49Å; I251-A286 HydrophobicContact CB-CB 4.25Å; I251-A286 HydrophobicContact CG1-CB 3.72Å; E254-A286 HydrophobicContact CB-CB 4.38Å; V282-A286 WeakPolarHBondContact O-CB 3.39Å; V282-A286 PolarHBondContact O-N 3.48Å
287	T	71.9	Confident	76.2	Confident	11 Å²	11	17.6 Å²	17.6	7%	0.067	10%	0.102	C	C	.	.	H	α-helix	trans	-121.2	-22.6	-168.3	75.4	0	0	0	0	113.1	V247 I251 Y283 H289 V365	V247-T287 HydrophobicContact CG1-CG2 3.94Å; I251-T287 HydrophobicContact CD1-CG2 3.79Å; I251-T287 HydrophobicContact CG1-CG2 3.69Å; Y283-T287 HydrophobicContact CD1-CG2 4.23Å; Y283-T287 WeakPolarHBondContact O-CB 3.27Å; Y283-T287 PolarHBondContact O-N 3.09Å; Y283-T287 PolarHBondContact O-OG1 3.02Å; T287-H289 VanDerWaalsContact C-N 3.25Å; T287-H289 PolarHBondContact O-CD2 2.79Å; T287-H289 VanDerWaalsContact O-CD2 3.29Å; T287-H289 WeakPolarHBondContact OG1-CB 3.13Å; T287-H289 PolarHBondContact OG1-CD2 2.58Å; T287-H289 PolarHBondContact OG1-N 2.83Å; T287-H289 VanDerWaalsContact OG1-N 3.07Å; T287-V365 HydrophobicContact CG2-CG1 4.33Å
288	G	66.1	Low	76	Confident	21 Å²	21	17.6 Å²	17.6	22%	0.216	10%	0.102	C	C	.	.			trans	79.8	2.4	-170	0	0	0	0	0	114.2	Y283 A284 L375	Y283-G288 PolarHBondContact O-N 3.27Å; A284-G288 WeakPolarHBondContact O-CA 3.2Å; A284-G288 PolarHBondContact O-N 2.87Å; G288-L375 WeakPolarHBondContact O-CD1 3.48Å
289	H	67.5	Low	75.2	Confident	50 Å²	50	17.6 Å²	17.6	23%	0.231	10%	0.102	C	C	.	.			trans	-92.1	137.7	-178.3	-69.6	-104.9	0	0	0	112.6	T287 V365	T287-H289 VanDerWaalsContact C-N 3.25Å; T287-H289 PolarHBondContact O-CD2 2.79Å; T287-H289 VanDerWaalsContact O-CD2 3.29Å; T287-H289 WeakPolarHBondContact OG1-CB 3.13Å; T287-H289 PolarHBondContact OG1-CD2 2.58Å; T287-H289 PolarHBondContact OG1-N 2.83Å; T287-H289 VanDerWaalsContact OG1-N 3.07Å; H289-V365 HydrophobicContact CB-CG1 4.43Å
290	N	73.9	Confident	74.5	Confident	62 Å²	62	19.4 Å²	19.4	33%	0.332	11%	0.109	S	C	.	.			trans	-86.5	111.1	167.9	-176.7	-4.6	0	0	0	109.5	Y280 G292	Y280-N290 WeakPolarHBondContact CE2-OD1 2.73Å; N290-G292 VanDerWaalsContact C-N 3.32Å; N290-G292 WeakPolarHBondContact OD1-CA 3.02Å; N290-G292 PolarHBondContact OD1-N 2.84Å
291	I	70	Confident	74	Confident	5 Å²	5	19.4 Å²	19.4	3%	0.026	12%	0.115	C	C	.	.			trans	-90.5	6.8	176.6	58.9	162.8	0	0	0	113.1	A279 Y283 Q298 A301 L315 V363	A279-I291 HydrophobicContact CB-CD1 4.04Å; Y283-I291 HydrophobicContact CD1-CG2 3.66Å; Y283-I291 HydrophobicContact CD2-CD1 3.79Å; Y283-I291 HydrophobicContact CE1-CG2 4.28Å; Y283-I291 HydrophobicContact CE2-CD1 4.49Å; Y283-I291 HydrophobicContact CG-CD1 3.89Å; Y283-I291 HydrophobicContact CG-CG1 4.37Å; Y283-I291 HydrophobicContact CG-CG2 3.81Å; I291-Q298 HydrophobicContact CB-CG 4.37Å; I291-Q298 HydrophobicContact CD1-CG 3.85Å; I291-Q298 HydrophobicContact CG1-CG 3.97Å; I291-Q298 VanDerWaalsContact O-CA 3.22Å; I291-Q298 WeakPolarHBondContact O-CA 3.43Å; I291-Q298 WeakPolarHBondContact O-CG 3.41Å; I291-Q298 PolarHBondContact O-N 2.88Å; I291-A301 HydrophobicContact CB-CB 3.97Å; I291-A301 HydrophobicContact CG2-CB 4.28Å; I291-L315 HydrophobicContact CD1-CD1 3.72Å; I291-V363 HydrophobicContact CG2-CG1 3.82Å; I291-V363 HydrophobicContact CG2-CG2 3.91Å
292	G	65.8	Low	73.8	Confident	12 Å²	12	18.7 Å²	18.7	12%	0.124	11%	0.112	C	C	.	.			trans	90.9	148.5	-168.7	0	0	0	0	0	111.9	N290 W294 Q298	N290-G292 VanDerWaalsContact C-N 3.32Å; N290-G292 WeakPolarHBondContact OD1-CA 3.02Å; N290-G292 PolarHBondContact OD1-N 2.84Å; G292-W294 VanDerWaalsContact C-N 3.32Å; G292-W294 PolarHBondContact O-N 3.3Å; G292-Q298 WeakPolarHBondContact O-CG 3.25Å; G292-Q298 PolarHBondContact O-NE2 3.43Å
293	G	65.3	Low	73.4	Confident	12 Å²	12	19 Å²	19	12%	0.124	11%	0.113	C	C	.	.	S	Bend	trans	-84.1	-1.1	-175.7	0	0	0	0	0	115.2	K268 S276	K268-G293 VanDerWaalsContact CE-O 3.28Å; K268-G293 WeakPolarHBondContact CE-O 3.26Å; K268-G293 PolarHBondContact NZ-O 3.18Å; S276-G293 PolarHBondContact OG-O 3.45Å
294	W	68.1	Low	73.5	Confident	44 Å²	44	20.6 Å²	20.6	17%	0.167	12%	0.121	C	C	.	.	S	Bend	trans	-143.9	152	-169.1	-37.6	103.8	0	0	0	111	G292 G296 D297 Q298 N391 N393	G292-W294 VanDerWaalsContact C-N 3.32Å; G292-W294 PolarHBondContact O-N 3.3Å; W294-G296 PolarHBondContact O-N 2.78Å; W294-D297 PolarHBondContact O-N 3.02Å; W294-Q298 VanDerWaalsContact O-CG 3.24Å; W294-Q298 WeakPolarHBondContact O-CG 3.45Å; W294-Q298 PolarHBondContact O-N 3.33Å; W294-N391 HydrophobicContact CH2-CB 3.41Å; W294-N391 VanDerWaalsContact CH2-CB 3.41Å; W294-N391 HydrophobicContact CZ2-CB 3.15Å; W294-N391 HydrophobicContact CZ3-CB 4.44Å; W294-N393 HydrophobicContact CB-CB 4.13Å; W294-N393 HydrophobicContact CD2-CB 4.02Å; W294-N393 HydrophobicContact CE3-CB 4.15Å; W294-N393 HydrophobicContact CG-CB 3.97Å
295	T	70.8	Confident	73.9	Confident	8 Å²	8	21.1 Å²	21.1	5%	0.049	12%	0.123	C	C	.	.	H	α-helix	trans	-55.3	-38	-179.2	57.4	0	0	0	0	113.3	D297 Q298 Q299 T325 V328 T395	T295-D297 VanDerWaalsContact C-N 3.31Å; T295-D297 PolarHBondContact O-N 3.32Å; T295-Q298 PolarHBondContact O-N 3.08Å; T295-Q299 PolarHBondContact O-N 3.06Å; T295-Q299 VanDerWaalsContact O-N 3.07Å; T295-T325 VanDerWaalsContact C-OG1 3.27Å; T295-T325 WeakPolarHBondContact CB-OG1 3.24Å; T295-T325 PolarHBondContact O-OG1 2.72Å; T295-T325 VanDerWaalsContact O-OG1 3.08Å; T295-T325 PolarHBondContact OG1-O 3.5Å; T295-V328 HydrophobicContact CG2-CB 4.08Å; T295-V328 HydrophobicContact CG2-CG1 3.79Å; T295-T395 PolarHBondContact OG1-OG1 3.07Å
296	G	65.8	Low	74.5	Confident	7 Å²	7	22.8 Å²	22.8	7%	0.072	14%	0.135	C	C	.	.	H	α-helix	trans	-66.1	-26.1	179.1	0	0	0	0	0	114.8	R233 W294 Q299 Y300	R233-G296 PolarHBondContact NH1-O 2.95Å; W294-G296 PolarHBondContact O-N 2.78Å; G296-Q299 WeakPolarHBondContact O-CG 3.46Å; G296-Y300 WeakPolarHBondContact O-CD2 3.45Å; G296-Y300 VanDerWaalsContact O-CE2 3.24Å; G296-Y300 WeakPolarHBondContact O-CE2 3.16Å
297	D	66	Low	75.2	Confident	53 Å²	53	24 Å²	24	28%	0.283	14%	0.142	S	C	.	.	H	α-helix	trans	-88.5	-40.6	172.4	-70.2	-34.7	0	0	0	111.2	R233 W294 T295 Q299 Y300 A301	R233-D297 IonicContact CZ-OD1 3.22Å; R233-D297 IonicContact NH1-OD1 3.79Å; R233-D297 PolarHBondContact NH1-OD1 3.3Å; R233-D297 IonicContact NH2-OD1 3.02Å; R233-D297 PolarHBondContact NH2-OD1 3.16Å; W294-D297 PolarHBondContact O-N 3.02Å; T295-D297 VanDerWaalsContact C-N 3.31Å; T295-D297 PolarHBondContact O-N 3.32Å; D297-Q299 VanDerWaalsContact C-N 3.27Å; D297-Q299 PolarHBondContact O-N 2.92Å; D297-Y300 PolarHBondContact O-N 3.37Å; D297-A301 PolarHBondContact O-N 2.65Å
298	Q	81.4	Confident	76.1	Confident	0 Å²	0	28.9 Å²	28.9	0%	0	18%	0.177	C	C	.	.	H	α-helix	trans	-60.8	-34.8	-178	-67	170.6	-8.5	0	0	112.6	S276 I291 G292 W294 T295 Y300 A301 L315 F317 L361	S276-Q298 PolarHBondContact O-NE2 3.33Å; I291-Q298 HydrophobicContact CB-CG 4.37Å; I291-Q298 HydrophobicContact CD1-CG 3.85Å; I291-Q298 HydrophobicContact CG1-CG 3.97Å; I291-Q298 VanDerWaalsContact O-CA 3.22Å; I291-Q298 WeakPolarHBondContact O-CA 3.43Å; I291-Q298 WeakPolarHBondContact O-CG 3.41Å; I291-Q298 PolarHBondContact O-N 2.88Å; G292-Q298 WeakPolarHBondContact O-CG 3.25Å; G292-Q298 PolarHBondContact O-NE2 3.43Å; W294-Q298 VanDerWaalsContact O-CG 3.24Å; W294-Q298 WeakPolarHBondContact O-CG 3.45Å; W294-Q298 PolarHBondContact O-N 3.33Å; T295-Q298 PolarHBondContact O-N 3.08Å; Q298-Y300 PolarHBondContact O-N 2.82Å; Q298-A301 WeakPolarHBondContact O-CB 3.13Å; Q298-A301 PolarHBondContact O-N 2.88Å; Q298-A301 VanDerWaalsContact O-N 3.11Å; Q298-L315 HydrophobicContact CB-CD1 4.42Å; Q298-F317 VanDerWaalsContact C-CZ 3.49Å; Q298-F317 HydrophobicContact CB-CE1 4.01Å; Q298-F317 HydrophobicContact CB-CZ 3.66Å; Q298-L361 WeakPolarHBondContact O-CD1 3.29Å
299	Q	76.5	Confident	77.2	Confident	0 Å²	0	33 Å²	33	0%	0	19%	0.19	C	C	.	.	T	Hydrogen-bonded Turn	trans	-64.7	-9.3	176.8	67.2	166.6	-71	0	0	114.7	T295 G296 D297 Q304 F317 P321 S323 T325 F359 L361	T295-Q299 PolarHBondContact O-N 3.06Å; T295-Q299 VanDerWaalsContact O-N 3.07Å; G296-Q299 WeakPolarHBondContact O-CG 3.46Å; D297-Q299 VanDerWaalsContact C-N 3.27Å; D297-Q299 PolarHBondContact O-N 2.92Å; Q299-Q304 PolarHBondContact O-NE2 3.07Å; Q299-Q304 VanDerWaalsContact O-NE2 3.07Å; Q299-F317 HydrophobicContact CB-CD1 4.23Å; Q299-F317 HydrophobicContact CB-CE1 4.04Å; Q299-F317 HydrophobicContact CB-CE2 4.47Å; Q299-F317 HydrophobicContact CB-CZ 4.17Å; Q299-P321 PolarHBondContact OE1-O 2.91Å; Q299-P321 VanDerWaalsContact OE1-O 3.09Å; Q299-S323 PolarHBondContact NE2-O 3.35Å; Q299-S323 PolarHBondContact OE1-O 3.46Å; Q299-T325 HydrophobicContact CB-CG2 4.03Å; Q299-T325 HydrophobicContact CG-CG2 4.39Å; Q299-T325 PolarHBondContact NE2-OG1 3.34Å; Q299-T325 VanDerWaalsContact NE2-OG1 3.08Å; Q299-F359 HydrophobicContact CB-CE2 4.36Å; Q299-F359 HydrophobicContact CB-CZ 3.91Å; Q299-L361 WeakPolarHBondContact O-CD1 3.23Å
300	Y	76.4	Confident	78.3	Confident	38 Å²	38	31.3 Å²	31.3	15%	0.149	19%	0.185	C	C	.	.	T	Hydrogen-bonded Turn	trans	-118.2	5.7	176.1	-55.5	-73.6	0	0	0	113.3	R233 G296 D297 Q298 G302	R233-Y300 HydrophobicContact CB-CD1 3.65Å; R233-Y300 HydrophobicContact CB-CD2 4.09Å; R233-Y300 HydrophobicContact CB-CE1 3.35Å; R233-Y300 HydrophobicContact CB-CE2 3.84Å; R233-Y300 HydrophobicContact CB-CG 4.01Å; R233-Y300 VanDerWaalsContact CB-CZ 3.47Å; R233-Y300 VanDerWaalsContact CD-CE2 3.42Å; R233-Y300 HydrophobicContact CG-CD2 4.38Å; R233-Y300 HydrophobicContact CG-CE2 4.27Å; R233-Y300 VanDerWaalsContact O-CE1 3.24Å; R233-Y300 WeakPolarHBondContact O-CE1 3.31Å; G296-Y300 WeakPolarHBondContact O-CD2 3.45Å; G296-Y300 VanDerWaalsContact O-CE2 3.24Å; G296-Y300 WeakPolarHBondContact O-CE2 3.16Å; D297-Y300 PolarHBondContact O-N 3.37Å; Q298-Y300 PolarHBondContact O-N 2.82Å; Y300-G302 PolarHBondContact O-N 3.44Å
301	A	74.8	Confident	78.8	Confident	28 Å²	28	31 Å²	31	23%	0.231	18%	0.182	C	C	.	.	S	Bend	trans	-72.4	-2	-179.8	0	0	0	0	0	113.5	I291 D297 Q298 N364	I291-A301 HydrophobicContact CB-CB 3.97Å; I291-A301 HydrophobicContact CG2-CB 4.28Å; D297-A301 PolarHBondContact O-N 2.65Å; Q298-A301 WeakPolarHBondContact O-CB 3.13Å; Q298-A301 PolarHBondContact O-N 2.88Å; Q298-A301 VanDerWaalsContact O-N 3.11Å; A301-N364 PolarHBondContact O-N 3.33Å
302	G	79.9	Confident	79.5	Confident	4 Å²	4	32.8 Å²	32.8	4%	0.041	19%	0.193	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-165.7	-157.7	-173.2	0	0	0	0	0	113.9	Y300 R362	Y300-G302 PolarHBondContact O-N 3.44Å; G302-R362 CarbonylContact C-O 3.48Å; G302-R362 VanDerWaalsContact CA-O 3.22Å; G302-R362 WeakPolarHBondContact CA-O 3.43Å
303	T	82.5	Confident	80.5	Confident	5 Å²	5	32.2 Å²	32.2	3%	0.031	19%	0.187	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-92	127.7	174.4	-67.3	0	0	0	0	110	Q238 A240 I305 L361 R362	Q238-T303 WeakPolarHBondContact O-CG2 3.45Å; Q238-T303 PolarHBondContact O-OG1 3.46Å; A240-T303 HydrophobicContact CB-CG2 3.96Å; T303-I305 HydrophobicContact CG2-CG2 4.07Å; T303-L361 CarbonylContact O-C 3.53Å; T303-L361 WeakPolarHBondContact O-CA 3.33Å; T303-R362 PolarHBondContact N-O 3.37Å; T303-R362 PolarHBondContact O-N 3.29Å
304	Q	85.1	Confident	81.9	Confident	35 Å²	35	31.6 Å²	31.6	16%	0.164	18%	0.181	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-77.4	135.7	171.2	-63.9	-179.2	-3.9	0	0	109.6	P235 Q299 P321 F359 A360 L361	P235-Q304 HydrophobicContact CB-CB 4.43Å; P235-Q304 HydrophobicContact CB-CG 4.13Å; Q299-Q304 PolarHBondContact O-NE2 3.07Å; Q299-Q304 VanDerWaalsContact O-NE2 3.07Å; Q304-P321 PolarHBondContact NE2-O 2.99Å; Q304-F359 HydrophobicContact CB-CD2 4.07Å; Q304-F359 HydrophobicContact CB-CE2 4.45Å; Q304-F359 HydrophobicContact CG-CD2 3.83Å; Q304-F359 HydrophobicContact CG-CE2 3.7Å; Q304-A360 CarbonylContact C-O 3.47Å; Q304-A360 WeakPolarHBondContact CA-O 3.37Å; Q304-L361 HydrophobicContact CG-CD1 4.25Å
305	I	87.8	Confident	83.2	Confident	12 Å²	12	29.5 Å²	29.5	6%	0.062	17%	0.173	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-134.2	156.8	-177.8	61.1	179.4	0	0	0	110.7	A240 T303 E309 D314 A360 R362	A240-I305 HydrophobicContact CB-CG2 3.47Å; A240-I305 VanDerWaalsContact CB-CG2 3.47Å; T303-I305 HydrophobicContact CG2-CG2 4.07Å; I305-E309 HydrophobicContact CB-CB 4.41Å; I305-E309 HydrophobicContact CD1-CB 4.27Å; I305-D314 WeakPolarHBondContact CD1-OD2 3.38Å; I305-A360 HydrophobicContact CD1-CB 4.24Å; I305-A360 HydrophobicContact CG1-CB 3.72Å; I305-A360 PolarHBondContact N-O 2.84Å; I305-A360 PolarHBondContact O-N 3.06Å; I305-A360 VanDerWaalsContact O-O 3.11Å; I305-R362 HydrophobicContact CD1-CB 4.37Å
306	P	91.5	Very high	84.4	Confident	64 Å²	64	29.1 Å²	29.1	42%	0.416	17%	0.171	S	C	.	.			trans	-55.3	144.1	167.6	-23.9	34.9	0	0	0	111.3	S308 E309	P306-S308 PolarHBondContact O-N 3.02Å; P306-S308 VanDerWaalsContact O-N 3.16Å; P306-E309 HydrophobicContact CB-CG 4.38Å; P306-E309 HydrophobicContact CG-CG 4.45Å; P306-E309 PolarHBondContact O-N 3.34Å
307	V	91.5	Very high	85.6	Confident	34 Å²	34	28.8 Å²	28.8	21%	0.206	17%	0.168	C	C	.	.	G	3₁₀ helix	trans	-57.6	-31.8	177.7	179.7	0	0	0	0	111.6	E309 A310 I352 P357	V307-E309 PolarHBondContact O-N 3.45Å; V307-A310 WeakPolarHBondContact O-CB 3.44Å; V307-A310 PolarHBondContact O-N 3.42Å; V307-A310 VanDerWaalsContact O-N 3.13Å; V307-I352 HydrophobicContact CG1-CD1 3.78Å; V307-P357 HydrophobicContact CB-CG 4.46Å; V307-P357 HydrophobicContact CG1-CG 3.73Å; V307-P357 HydrophobicContact CG2-CB 4.39Å; V307-P357 HydrophobicContact CG2-CG 3.81Å
308	S	91	Very high	86.7	Confident	113 Å²	113	26.9 Å²	26.9	79%	0.79	16%	0.157	S	C	*	.	G	3₁₀ helix	trans	-64.2	-18.9	175.6	52.7	0	0	0	0	114.2	P306	P306-S308 PolarHBondContact O-N 3.02Å; P306-S308 VanDerWaalsContact O-N 3.16Å
309	E	88.9	Confident	86.3	Confident	107 Å²	107	27.8 Å²	27.8	50%	0.5	17%	0.166	S	C	.	.	G	3₁₀ helix	trans	-98.9	1.6	177.6	-65.3	179.4	-153.4	0	0	112.7	I305 P306 V307 Q311 R362	I305-E309 HydrophobicContact CB-CB 4.41Å; I305-E309 HydrophobicContact CD1-CB 4.27Å; P306-E309 HydrophobicContact CB-CG 4.38Å; P306-E309 HydrophobicContact CG-CG 4.45Å; P306-E309 PolarHBondContact O-N 3.34Å; V307-E309 PolarHBondContact O-N 3.45Å; E309-Q311 PolarHBondContact O-N 3.35Å; E309-R362 PolarHBondContact O-NH2 3.15Å
310	A	90.5	Very high	85.8	Confident	14 Å²	14	30.1 Å²	30.1	12%	0.116	19%	0.185	C	C	.	.			trans	-60.9	136.2	-179.8	0	0	0	0	0	111	V307 D314 L316 Y331 A360	V307-A310 WeakPolarHBondContact O-CB 3.44Å; V307-A310 PolarHBondContact O-N 3.42Å; V307-A310 VanDerWaalsContact O-N 3.13Å; A310-D314 WeakPolarHBondContact CA-OD2 3.45Å; A310-L316 HydrophobicContact CB-CD2 4.14Å; A310-Y331 HydrophobicContact CB-CD1 3.57Å; A310-Y331 HydrophobicContact CB-CE1 3.76Å; A310-Y331 HydrophobicContact CB-CG 4.12Å; A310-Y331 VanDerWaalsContact O-CE1 3.22Å; A310-Y331 WeakPolarHBondContact O-CE1 3.46Å; A310-A360 HydrophobicContact CB-CB 3.9Å
311	Q	85.6	Confident	84.8	Confident	57 Å²	57	30.2 Å²	30.2	27%	0.266	19%	0.19	S	C	.	.			trans	-118.8	151.8	174.9	-71.1	173.8	4.1	0	0	109.9	E309 G313 D314 Y331 R362	E309-Q311 PolarHBondContact O-N 3.35Å; Q311-G313 PolarHBondContact O-N 3.48Å; Q311-D314 PolarHBondContact N-OD2 2.83Å; Q311-D314 VanDerWaalsContact O-CB 3.27Å; Q311-D314 WeakPolarHBondContact O-CB 3.46Å; Q311-D314 VanDerWaalsContact O-CG 3.31Å; Q311-D314 PolarHBondContact O-N 3.31Å; Q311-Y331 VanDerWaalsContact C-CD1 3.44Å; Q311-Y331 WeakPolarHBondContact O-CD1 3.45Å; Q311-R362 VanDerWaalsContact CD-NH2 3.35Å; Q311-R362 VanDerWaalsContact CG-NH2 3.29Å
312	P	83.8	Confident	84	Confident	41 Å²	41	33.7 Å²	33.7	27%	0.266	21%	0.209	S	C	.	.	T	Hydrogen-bonded Turn	trans	-48.3	130.9	176.6	-26.6	34.5	0	0	0	112.2	Q248 V252	Q248-P312 WeakPolarHBondContact CB-O 3.22Å; Q248-P312 VanDerWaalsContact CG-O 3.29Å; Q248-P312 WeakPolarHBondContact CG-O 3.36Å; Q248-P312 PolarHBondContact OE1-O 3.49Å; V252-P312 HydrophobicContact CG2-CB 3.87Å
313	G	87.8	Confident	82.8	Confident	0 Å²	0	36.3 Å²	36.3	0%	0	23%	0.227	C	C	.	.	T	Hydrogen-bonded Turn	trans	98.1	-22	-173.4	0	0	0	0	0	114.5	Y283 Q311 Y331	Y283-G313 PolarHBondContact OH-O 2.86Å; Q311-G313 PolarHBondContact O-N 3.48Å; G313-Y331 PolarHBondContact N-O 2.91Å
314	D	93.2	Very high	81.7	Confident	0 Å²	0	37.4 Å²	37.4	0%	0	23%	0.233	C	C	.	.	P	Polyproline II helix	trans	-61.3	152.5	176.2	-73.2	-24.8	0	0	0	111.4	F243 I305 A310 Q311 Y331 R362	F243-D314 WeakPolarHBondContact CE2-OD1 3.49Å; I305-D314 WeakPolarHBondContact CD1-OD2 3.38Å; A310-D314 WeakPolarHBondContact CA-OD2 3.45Å; Q311-D314 PolarHBondContact N-OD2 2.83Å; Q311-D314 VanDerWaalsContact O-CB 3.27Å; Q311-D314 WeakPolarHBondContact O-CB 3.46Å; Q311-D314 VanDerWaalsContact O-CG 3.31Å; Q311-D314 PolarHBondContact O-N 3.31Å; D314-Y331 WeakPolarHBondContact O-CB 3.32Å; D314-Y331 PolarHBondContact O-N 2.91Å; D314-R362 WeakPolarHBondContact OD1-CA 3.44Å; D314-R362 WeakPolarHBondContact OD1-CB 3.34Å; D314-R362 WeakPolarHBondContact OD1-CG 3.16Å; D314-R362 IonicContact OD1-CZ 3.84Å; D314-R362 IonicContact OD1-NE 2.88Å; D314-R362 PolarHBondContact OD1-NE 2.78Å; D314-R362 IonicContact OD1-NH2 3.89Å; D314-R362 IonicContact OD2-CZ 3.4Å; D314-R362 IonicContact OD2-NE 3.21Å; D314-R362 PolarHBondContact OD2-NE 2.99Å; D314-R362 IonicContact OD2-NH2 2.72Å; D314-R362 PolarHBondContact OD2-NH2 2.9Å
315	L	95.6	Very high	80.9	Confident	0 Å²	0	35.8 Å²	35.8	0%	0	23%	0.225	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-89.2	134	172.8	-65.6	175.4	0	0	0	109.9	A279 Y283 I291 Q298 F317 V328 A329 I330 A360 L361 V363	A279-L315 HydrophobicContact CB-CD2 3.91Å; Y283-L315 HydrophobicContact CD2-CD2 4.14Å; Y283-L315 HydrophobicContact CE2-CD1 4.15Å; Y283-L315 HydrophobicContact CE2-CD2 3.5Å; Y283-L315 HydrophobicContact CE2-CG 3.72Å; I291-L315 HydrophobicContact CD1-CD1 3.72Å; Q298-L315 HydrophobicContact CB-CD1 4.42Å; L315-F317 HydrophobicContact CB-CD2 4.24Å; L315-F317 HydrophobicContact CB-CE2 3.51Å; L315-F317 HydrophobicContact CB-CZ 4.08Å; L315-F317 HydrophobicContact CD1-CE2 4.2Å; L315-F317 HydrophobicContact CD1-CZ 4.09Å; L315-V328 HydrophobicContact CB-CG2 4.15Å; L315-V328 HydrophobicContact CD2-CG2 4.05Å; L315-V328 HydrophobicContact CG-CG2 4.48Å; L315-A329 CarbonylContact C-O 3.46Å; L315-A329 VanDerWaalsContact CA-O 3.31Å; L315-A329 WeakPolarHBondContact CA-O 3.36Å; L315-I330 HydrophobicContact CD2-CG1 4.11Å; L315-A360 CarbonylContact O-C 3.54Å; L315-A360 VanDerWaalsContact O-CA 3.24Å; L315-A360 WeakPolarHBondContact O-CA 3.21Å; L315-L361 HydrophobicContact CB-CB 4.43Å; L315-L361 HydrophobicContact CD1-CD2 4.24Å; L315-L361 PolarHBondContact N-O 2.88Å; L315-L361 PolarHBondContact O-N 2.88Å; L315-V363 HydrophobicContact CD1-CG2 4.06Å
316	L	96.1	Very high	80.3	Confident	0 Å²	0	37.5 Å²	37.5	0%	0	24%	0.237	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-102	135.9	172.1	-55.7	177.8	0	0	0	109.3	A310 W318 V328 A329 Y331 Y337 I352 P357 A360	A310-L316 HydrophobicContact CB-CD2 4.14Å; L316-W318 HydrophobicContact CB-CH2 4.15Å; L316-W318 HydrophobicContact CB-CZ3 3.88Å; L316-V328 CarbonylContact O-C 3.42Å; L316-V328 WeakPolarHBondContact O-CA 3.18Å; L316-A329 HydrophobicContact CB-CB 4.33Å; L316-A329 PolarHBondContact N-O 2.96Å; L316-A329 PolarHBondContact O-N 2.99Å; L316-Y331 HydrophobicContact CD1-CD2 3.87Å; L316-Y331 HydrophobicContact CD1-CG 4.32Å; L316-Y331 HydrophobicContact CD2-CD2 4.49Å; L316-Y331 HydrophobicContact CD2-CG 4.35Å; L316-Y337 HydrophobicContact CD1-CD1 3.57Å; L316-Y337 HydrophobicContact CD1-CG 3.9Å; L316-I352 HydrophobicContact CD1-CD1 4.21Å; L316-I352 HydrophobicContact CD1-CG1 4.31Å; L316-P357 HydrophobicContact CB-CB 3.89Å; L316-P357 HydrophobicContact CB-CG 4.13Å; L316-P357 HydrophobicContact CD1-CG 4.15Å; L316-P357 HydrophobicContact CD2-CG 4.26Å; L316-P357 HydrophobicContact CG-CG 4.41Å; L316-A360 HydrophobicContact CD2-CB 3.7Å
317	F	91.7	Very high	80.1	Confident	0 Å²	0	34.9 Å²	34.9	0%	0	22%	0.219	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-123.7	143	-177.1	-74.3	-84.4	0	0	0	112.4	Q298 Q299 L315 T325 H327 V328 P357 T358 F359 L361	Q298-F317 VanDerWaalsContact C-CZ 3.49Å; Q298-F317 HydrophobicContact CB-CE1 4.01Å; Q298-F317 HydrophobicContact CB-CZ 3.66Å; Q299-F317 HydrophobicContact CB-CD1 4.23Å; Q299-F317 HydrophobicContact CB-CE1 4.04Å; Q299-F317 HydrophobicContact CB-CE2 4.47Å; Q299-F317 HydrophobicContact CB-CZ 4.17Å; L315-F317 HydrophobicContact CB-CD2 4.24Å; L315-F317 HydrophobicContact CB-CE2 3.51Å; L315-F317 HydrophobicContact CB-CZ 4.08Å; L315-F317 HydrophobicContact CD1-CE2 4.2Å; L315-F317 HydrophobicContact CD1-CZ 4.09Å; F317-T325 HydrophobicContact CB-CG2 3.96Å; F317-T325 HydrophobicContact CD1-CG2 3.8Å; F317-T325 HydrophobicContact CG-CG2 4.16Å; F317-H327 WeakPolarHBondContact CA-O 3.22Å; F317-V328 HydrophobicContact CD1-CB 3.98Å; F317-V328 HydrophobicContact CD1-CG2 3.97Å; F317-V328 HydrophobicContact CE1-CB 3.74Å; F317-V328 HydrophobicContact CE1-CG2 3.49Å; F317-V328 VanDerWaalsContact CE1-CG2 3.49Å; F317-V328 HydrophobicContact CE2-CG2 4.15Å; F317-V328 HydrophobicContact CZ-CB 4.35Å; F317-V328 HydrophobicContact CZ-CG2 3.58Å; F317-P357 WeakPolarHBondContact O-CB 3.21Å; F317-T358 PolarHBondContact O-N 2.97Å; F317-F359 HydrophobicContact CB-CD1 3.93Å; F317-F359 HydrophobicContact CB-CD2 4.34Å; F317-F359 HydrophobicContact CB-CE1 3.39Å; F317-F359 HydrophobicContact CB-CE2 3.85Å; F317-F359 HydrophobicContact CB-CG 4.38Å; F317-F359 HydrophobicContact CB-CZ 3.35Å; F317-F359 HydrophobicContact CD1-CZ 4.45Å; F317-F359 HydrophobicContact CD2-CD2 4.36Å; F317-F359 AromaticContact CD2-CE2 3.66Å; F317-F359 HydrophobicContact CD2-CE2 3.66Å; F317-F359 AromaticContact CD2-CZ 3.87Å; F317-F359 HydrophobicContact CD2-CZ 3.87Å; F317-F359 HydrophobicContact CG-CE1 4.21Å; F317-F359 AromaticContact CG-CE2 3.94Å; F317-F359 HydrophobicContact CG-CE2 3.94Å; F317-F359 AromaticContact CG-CZ 3.65Å; F317-F359 HydrophobicContact CG-CZ 3.65Å; F317-F359 PolarHBondContact N-O 2.79Å; F317-F359 PolarHBondContact O-N 3.4Å; F317-L361 HydrophobicContact CD2-CB 4.03Å; F317-L361 HydrophobicContact CE2-CB 3.68Å; F317-L361 HydrophobicContact CE2-CD1 4.39Å; F317-L361 HydrophobicContact CE2-CG 4.45Å
318	W	88.2	Confident	80.2	Confident	13 Å²	13	33.3 Å²	33.3	5%	0.049	21%	0.209	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-109.4	135.8	169.2	-70.8	-106	0	0	0	109.3	L316 T325 T326 H327 A329 Y337 F355 A356 P357	L316-W318 HydrophobicContact CB-CH2 4.15Å; L316-W318 HydrophobicContact CB-CZ3 3.88Å; W318-T325 CarbonylContact O-C 3.53Å; W318-T325 WeakPolarHBondContact O-CA 3.47Å; W318-T326 PolarHBondContact O-N 3.29Å; W318-T326 PolarHBondContact O-OG1 3.33Å; W318-H327 HydrophobicContact CB-CB 4.04Å; W318-H327 HydrophobicContact CD2-CB 4.24Å; W318-H327 HydrophobicContact CE3-CB 3.95Å; W318-H327 AromaticContact CE3-CD2 3.43Å; W318-H327 VanDerWaalsContact CE3-CD2 3.43Å; W318-H327 HydrophobicContact CG-CB 4.31Å; W318-H327 AromaticContact CZ3-CD2 3.52Å; W318-H327 PolarHBondContact N-O 3.33Å; W318-H327 VanDerWaalsContact N-O 3.13Å; W318-A329 HydrophobicContact CH2-CB 4Å; W318-A329 HydrophobicContact CZ3-CB 3.77Å; W318-Y337 HydrophobicContact CH2-CD1 4.25Å; W318-Y337 HydrophobicContact CH2-CD2 4.49Å; W318-Y337 AromaticContact CH2-CE1 3.9Å; W318-Y337 HydrophobicContact CH2-CE1 3.9Å; W318-Y337 HydrophobicContact CH2-CE2 4.17Å; W318-Y337 AromaticContact CH2-CZ 3.87Å; W318-Y337 HydrophobicContact CZ2-CE1 4.04Å; W318-Y337 AromaticContact CZ2-CZ 3.98Å; W318-F355 AromaticContact CD1-CE1 3.8Å; W318-F355 AromaticContact CD1-CE2 3.38Å; W318-F355 AromaticContact CD1-CZ 3.24Å; W318-F355 HydrophobicContact CD2-CD1 4.43Å; W318-F355 AromaticContact CD2-CE1 3.85Å; W318-F355 HydrophobicContact CD2-CE1 3.85Å; W318-F355 HydrophobicContact CD2-CZ 4.04Å; W318-F355 AromaticContact CE2-CD1 3.52Å; W318-F355 AromaticContact CE2-CE1 3.37Å; W318-F355 AromaticContact CE2-CG 3.99Å; W318-F355 AromaticContact CE2-CZ 3.71Å; W318-F355 HydrophobicContact CG-CE1 4.09Å; W318-F355 HydrophobicContact CG-CE2 4.32Å; W318-F355 AromaticContact CG-CZ 3.76Å; W318-F355 HydrophobicContact CG-CZ 3.76Å; W318-F355 HydrophobicContact CH2-CD1 4.42Å; W318-F355 AromaticContact CZ2-CD1 3.5Å; W318-F355 HydrophobicContact CZ2-CD1 3.5Å; W318-F355 AromaticContact CZ2-CE1 3.77Å; W318-F355 HydrophobicContact CZ2-CE1 3.77Å; W318-F355 HydrophobicContact CZ2-CG 4.06Å; W318-F355 WeakPolarHBondContact CZ2-O 3.25Å; W318-F355 AromaticContact NE1-CD1 3.52Å; W318-F355 AromaticContact NE1-CD2 3.43Å; W318-F355 AromaticContact NE1-CE1 3.33Å; W318-F355 VanDerWaalsContact NE1-CE1 3.33Å; W318-F355 AromaticContact NE1-CE2 3.23Å; W318-F355 AromaticContact NE1-CG 3.57Å; W318-F355 AromaticContact NE1-CZ 3.18Å; W318-A356 VanDerWaalsContact NE1-C 3.27Å; W318-A356 PolarHBondContact NE1-O 3.05Å; W318-P357 HydrophobicContact CD2-CB 4.07Å; W318-P357 VanDerWaalsContact CE2-CA 3.49Å; W318-P357 HydrophobicContact CE3-CB 4.17Å; W318-P357 HydrophobicContact CH2-CB 3.94Å; W318-P357 HydrophobicContact CZ2-CB 3.83Å; W318-P357 HydrophobicContact CZ2-CG 4.38Å; W318-P357 HydrophobicContact CZ3-CB 4.1Å
319	G	74.1	Confident	80.5	Confident	19 Å²	19	27.9 Å²	27.9	20%	0.196	17%	0.172	C	C	.	.	E	Extended strand (participates in β ladder)	trans	109.2	161.3	-172.7	0	0	0	0	0	111.8	V324 T358	G319-V324 WeakPolarHBondContact CA-O 3.11Å; G319-T358 PolarHBondContact N-OG1 3.23Å; G319-T358 VanDerWaalsContact N-OG1 3.14Å; G319-T358 WeakPolarHBondContact O-CB 3.43Å; G319-T358 WeakPolarHBondContact O-CG2 2.86Å
320	A	66.4	Low	80.8	Confident	49 Å²	49	22.9 Å²	22.9	41%	0.405	15%	0.148	S	C	.	.			trans	-68.7	136.9	-170.9	0	0	0	0	0	111.5	T322 S323	A320-T322 PolarHBondContact O-N 3.16Å; A320-T322 VanDerWaalsContact O-N 3.09Å; A320-S323 CarbonylContact O-C 3.58Å; A320-S323 WeakPolarHBondContact O-CA 3.36Å; A320-S323 PolarHBondContact O-N 3.25Å
321	P	55.4	Low	81	Confident	40 Å²	40	23.5 Å²	23.5	26%	0.26	15%	0.148	S	C	.	.	T	Hydrogen-bonded Turn	trans	-65.6	-16.1	-169.5	-14.5	23.4	0	0	0	116.2	Q299 Q304 F359	Q299-P321 PolarHBondContact OE1-O 2.91Å; Q299-P321 VanDerWaalsContact OE1-O 3.09Å; Q304-P321 PolarHBondContact NE2-O 2.99Å; P321-F359 HydrophobicContact CB-CD1 3.78Å; P321-F359 HydrophobicContact CB-CD2 4.44Å; P321-F359 HydrophobicContact CB-CE1 3.83Å; P321-F359 HydrophobicContact CB-CE2 4.5Å; P321-F359 HydrophobicContact CB-CG 4.1Å; P321-F359 HydrophobicContact CB-CZ 4.19Å; P321-F359 HydrophobicContact CG-CB 4.34Å; P321-F359 HydrophobicContact CG-CD1 3.61Å; P321-F359 HydrophobicContact CG-CE1 4.08Å; P321-F359 HydrophobicContact CG-CG 4.04Å
322	T	56.6	Low	81	Confident	101 Å²	101	20.8 Å²	20.8	62%	0.62	14%	0.135	S	C	*	.	T	Hydrogen-bonded Turn	trans	-113.6	14	175.7	55.8	0	0	0	0	111.9	P235 A320	P235-T322 HydrophobicContact CG-CG2 3.96Å; A320-T322 PolarHBondContact O-N 3.16Å; A320-T322 VanDerWaalsContact O-N 3.09Å
323	S	56.3	Low	80.8	Confident	59 Å²	59	19.1 Å²	19.1	41%	0.413	13%	0.126	S	C	.	.	S	Bend	trans	-134.3	-151.1	-176.8	-160.9	0	0	0	0	110.5	Q299 A320	Q299-S323 PolarHBondContact NE2-O 3.35Å; Q299-S323 PolarHBondContact OE1-O 3.46Å; A320-S323 CarbonylContact O-C 3.58Å; A320-S323 WeakPolarHBondContact O-CA 3.36Å; A320-S323 PolarHBondContact O-N 3.25Å
324	V	59.1	Low	80.2	Confident	28 Å²	28	23.3 Å²	23.3	17%	0.17	15%	0.148	C	C	.	.			trans	-76.8	124.5	-179.7	-172.8	0	0	0	0	110.2	G319 T395 Q398	G319-V324 WeakPolarHBondContact CA-O 3.11Å; V324-T395 HydrophobicContact CG1-CG2 3.96Å; V324-Q398 HydrophobicContact CG2-CB 4.05Å; V324-Q398 HydrophobicContact CG2-CG 3.64Å
325	T	67.9	Low	79.7	Confident	0 Å²	0	24.4 Å²	24.4	0%	0	16%	0.159	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-91.6	127.4	164.5	47.8	0	0	0	0	110.4	T295 Q299 F317 W318 F359 T395	T295-T325 VanDerWaalsContact C-OG1 3.27Å; T295-T325 WeakPolarHBondContact CB-OG1 3.24Å; T295-T325 PolarHBondContact O-OG1 2.72Å; T295-T325 VanDerWaalsContact O-OG1 3.08Å; T295-T325 PolarHBondContact OG1-O 3.5Å; Q299-T325 HydrophobicContact CB-CG2 4.03Å; Q299-T325 HydrophobicContact CG-CG2 4.39Å; Q299-T325 PolarHBondContact NE2-OG1 3.34Å; Q299-T325 VanDerWaalsContact NE2-OG1 3.08Å; F317-T325 HydrophobicContact CB-CG2 3.96Å; F317-T325 HydrophobicContact CD1-CG2 3.8Å; F317-T325 HydrophobicContact CG-CG2 4.16Å; W318-T325 CarbonylContact O-C 3.53Å; W318-T325 WeakPolarHBondContact O-CA 3.47Å; T325-F359 HydrophobicContact CG2-CE1 3.77Å; T325-F359 HydrophobicContact CG2-CZ 3.78Å; T325-T395 PolarHBondContact O-OG1 2.82Å
326	T	75.1	Confident	79.2	Confident	49 Å²	49	25.6 Å²	25.6	30%	0.301	17%	0.165	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-93.4	-26.6	-174.7	50	0	0	0	0	112.8	W318 N433	W318-T326 PolarHBondContact O-N 3.29Å; W318-T326 PolarHBondContact O-OG1 3.33Å; T326-N433 WeakPolarHBondContact CA-OD1 3.46Å; T326-N433 WeakPolarHBondContact CB-OD1 3.18Å; T326-N433 WeakPolarHBondContact CG2-OD1 3.49Å; T326-N433 WeakPolarHBondContact O-CB 3.16Å; T326-N433 PolarHBondContact O-ND2 3.26Å
327	H	88	Confident	79.1	Confident	9 Å²	9	25.8 Å²	25.8	4%	0.042	17%	0.166	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-147	155.3	-178	-169.5	50.5	0	0	0	111.3	C275 F317 W318 H339 A340	C275-H327 WeakPolarHBondContact CB-CE1 3.38Å; C275-H327 WeakPolarHBondContact CB-ND1 3.44Å; F317-H327 WeakPolarHBondContact CA-O 3.22Å; W318-H327 HydrophobicContact CB-CB 4.04Å; W318-H327 HydrophobicContact CD2-CB 4.24Å; W318-H327 HydrophobicContact CE3-CB 3.95Å; W318-H327 AromaticContact CE3-CD2 3.43Å; W318-H327 VanDerWaalsContact CE3-CD2 3.43Å; W318-H327 HydrophobicContact CG-CB 4.31Å; W318-H327 AromaticContact CZ3-CD2 3.52Å; W318-H327 PolarHBondContact N-O 3.33Å; W318-H327 VanDerWaalsContact N-O 3.13Å; H327-H339 AromaticContact CD2-ND1 3.92Å; H327-H339 AromaticContact CE1-ND1 3.73Å; H327-H339 WeakPolarHBondContact NE2-CB 3.35Å; H327-H339 AromaticContact NE2-CG 3.58Å; H327-H339 AromaticContact NE2-ND1 2.99Å; H327-H339 PolarHBondContact NE2-ND1 3.35Å; H327-A340 PolarHBondContact CE1-O 3.24Å
328	V	92.5	Very high	79.1	Confident	0 Å²	0	25.8 Å²	25.8	0%	0	17%	0.166	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-139.4	143.1	173.7	66	0	0	0	0	110.5	C275 A279 T295 L315 L316 F317	C275-V328 VanDerWaalsContact C-CG1 3.4Å; C275-V328 HydrophobicContact CB-CG1 3.98Å; C275-V328 WeakPolarHBondContact O-CG1 3.49Å; A279-V328 HydrophobicContact CB-CG1 4.14Å; A279-V328 HydrophobicContact CB-CG2 4.32Å; T295-V328 HydrophobicContact CG2-CB 4.08Å; T295-V328 HydrophobicContact CG2-CG1 3.79Å; L315-V328 HydrophobicContact CB-CG2 4.15Å; L315-V328 HydrophobicContact CD2-CG2 4.05Å; L315-V328 HydrophobicContact CG-CG2 4.48Å; L316-V328 CarbonylContact O-C 3.42Å; L316-V328 WeakPolarHBondContact O-CA 3.18Å; F317-V328 HydrophobicContact CD1-CB 3.98Å; F317-V328 HydrophobicContact CD1-CG2 3.97Å; F317-V328 HydrophobicContact CE1-CB 3.74Å; F317-V328 HydrophobicContact CE1-CG2 3.49Å; F317-V328 VanDerWaalsContact CE1-CG2 3.49Å; F317-V328 HydrophobicContact CE2-CG2 4.15Å; F317-V328 HydrophobicContact CZ-CB 4.35Å; F317-V328 HydrophobicContact CZ-CG2 3.58Å
329	A	96.9	Very high	79.4	Confident	0 Å²	0	25.7 Å²	25.7	0%	0	17%	0.165	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-137	161.3	175.1	0	0	0	0	0	110.7	L315 L316 W318 Y337 H339	L315-A329 CarbonylContact C-O 3.46Å; L315-A329 VanDerWaalsContact CA-O 3.31Å; L315-A329 WeakPolarHBondContact CA-O 3.36Å; L316-A329 HydrophobicContact CB-CB 4.33Å; L316-A329 PolarHBondContact N-O 2.96Å; L316-A329 PolarHBondContact O-N 2.99Å; W318-A329 HydrophobicContact CH2-CB 4Å; W318-A329 HydrophobicContact CZ3-CB 3.77Å; A329-Y337 HydrophobicContact CB-CD2 3.58Å; A329-Y337 HydrophobicContact CB-CE2 4.34Å; A329-Y337 HydrophobicContact CB-CG 3.84Å; A329-H339 HydrophobicContact CB-CB 3.67Å
330	I	96.2	Very high	80.2	Confident	1 Å²	1	24.8 Å²	24.8	1%	0.005	16%	0.156	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-98.8	116	172.6	-56.9	92.9	0	0	0	107.8	I251 A255 L278 A279 V282 L315 Y337 I338	I251-I330 HydrophobicContact CG2-CG2 3.7Å; A255-I330 HydrophobicContact CB-CB 4.38Å; A255-I330 HydrophobicContact CB-CG2 4.32Å; L278-I330 HydrophobicContact CD2-CD1 3.94Å; L278-I330 HydrophobicContact CG-CD1 3.89Å; A279-I330 HydrophobicContact CB-CD1 4.46Å; V282-I330 HydrophobicContact CG1-CG1 4.32Å; V282-I330 HydrophobicContact CG2-CD1 4.4Å; L315-I330 HydrophobicContact CD2-CG1 4.11Å; I330-Y337 CarbonylContact O-C 3.56Å; I330-Y337 WeakPolarHBondContact O-CA 3.24Å; I330-Y337 VanDerWaalsContact O-CB 3.3Å; I330-Y337 WeakPolarHBondContact O-CB 3.25Å; I330-I338 PolarHBondContact N-O 2.82Å; I330-I338 PolarHBondContact O-N 2.88Å
331	Y	94	Very high	81.2	Confident	27 Å²	27	23.2 Å²	23.2	11%	0.106	14%	0.142	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-66.9	133.9	175.9	-171.4	-127.7	0	0	0	110.3	A310 Q311 G313 D314 L316 G333 N334 G335 Q336 I352	A310-Y331 HydrophobicContact CB-CD1 3.57Å; A310-Y331 HydrophobicContact CB-CE1 3.76Å; A310-Y331 HydrophobicContact CB-CG 4.12Å; A310-Y331 VanDerWaalsContact O-CE1 3.22Å; A310-Y331 WeakPolarHBondContact O-CE1 3.46Å; Q311-Y331 VanDerWaalsContact C-CD1 3.44Å; Q311-Y331 WeakPolarHBondContact O-CD1 3.45Å; G313-Y331 PolarHBondContact N-O 2.91Å; D314-Y331 WeakPolarHBondContact O-CB 3.32Å; D314-Y331 PolarHBondContact O-N 2.91Å; L316-Y331 HydrophobicContact CD1-CD2 3.87Å; L316-Y331 HydrophobicContact CD1-CG 4.32Å; L316-Y331 HydrophobicContact CD2-CD2 4.49Å; L316-Y331 HydrophobicContact CD2-CG 4.35Å; Y331-G333 VanDerWaalsContact CZ-CA 3.49Å; Y331-N334 PolarHBondContact OH-N 2.86Å; Y331-G335 PolarHBondContact OH-N 2.85Å; Y331-G335 VanDerWaalsContact OH-N 3.1Å; Y331-Q336 WeakPolarHBondContact CD2-O 3.48Å; Y331-Q336 VanDerWaalsContact CE2-O 3.31Å; Y331-Q336 WeakPolarHBondContact CE2-O 3.44Å; Y331-I352 HydrophobicContact CD2-CD1 4.24Å; Y331-I352 HydrophobicContact CE2-CD1 3.83Å
332	I	85.8	Confident	82.4	Confident	0 Å²	0	22.4 Å²	22.4	0%	0	14%	0.135	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-118.1	8.2	-178.5	58.8	162.6	0	0	0	112.7	Q102 V252 Y256 Q336 I338 I349	Q102-I332 PolarHBondContact NE2-O 3.24Å; V252-I332 HydrophobicContact CG1-CB 4.3Å; V252-I332 HydrophobicContact CG1-CG2 4.02Å; V252-I332 HydrophobicContact CG2-CG2 4.31Å; Y256-I332 VanDerWaalsContact OH-CD1 3.24Å; Y256-I332 WeakPolarHBondContact OH-CD1 3.27Å; I332-Q336 HydrophobicContact CD1-CB 3.85Å; I332-Q336 VanDerWaalsContact CG1-C 3.45Å; I332-Q336 HydrophobicContact CG1-CB 3.8Å; I332-Q336 WeakPolarHBondContact CG1-O 3.48Å; I332-Q336 PolarHBondContact N-O 2.91Å; I332-I338 HydrophobicContact CD1-CG1 4.14Å; I332-I338 HydrophobicContact CG2-CB 4.47Å; I332-I338 HydrophobicContact CG2-CD1 3.91Å; I332-I338 HydrophobicContact CG2-CG1 3.88Å; I332-I349 HydrophobicContact CD1-CD1 4.38Å; I332-I349 HydrophobicContact CD1-CG1 4.34Å; I332-I349 HydrophobicContact CD1-CG2 4.15Å
333	G	79.1	Confident	83.4	Confident	7 Å²	7	19.1 Å²	19.1	7%	0.072	12%	0.115	C	C	.	.	E	Extended strand (participates in β ladder)	trans	92.8	171.4	-177.2	0	0	0	0	0	113.5	Y331 G335 Q336	Y331-G333 VanDerWaalsContact CZ-CA 3.49Å; G333-G335 PolarHBondContact O-N 3.2Å; G333-G335 VanDerWaalsContact O-N 3.13Å; G333-Q336 WeakPolarHBondContact O-CB 3.31Å; G333-Q336 PolarHBondContact O-N 2.9Å
334	N	77.1	Confident	84.2	Confident	87 Å²	87	18.2 Å²	18.2	47%	0.465	12%	0.115	S	C	.	.	T	Hydrogen-bonded Turn	trans	52.9	33.2	176.5	-60	-21.5	0	0	0	114.9	N88 Y331 Q336	N88-N334 PolarHBondContact O-ND2 3.45Å; Y331-N334 PolarHBondContact OH-N 2.86Å; N334-Q336 PolarHBondContact O-N 3.34Å
335	G	81.1	Confident	85.3	Confident	23 Å²	23	17.9 Å²	17.9	24%	0.237	11%	0.113	C	C	.	.	T	Hydrogen-bonded Turn	trans	70.6	12.9	-176.6	0	0	0	0	0	114.2	Y331 G333 I352	Y331-G335 PolarHBondContact OH-N 2.85Å; Y331-G335 VanDerWaalsContact OH-N 3.1Å; G333-G335 PolarHBondContact O-N 3.2Å; G333-G335 VanDerWaalsContact O-N 3.13Å; G335-I352 WeakPolarHBondContact O-CB 3.3Å; G335-I352 WeakPolarHBondContact O-CG1 3.33Å; G335-I352 PolarHBondContact O-N 3.32Å
336	Q	86.4	Confident	86.1	Confident	26 Å²	26	19.2 Å²	19.2	12%	0.121	12%	0.121	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-111.5	154.1	-179.3	-63	-179.2	10.9	0	0	112	Y331 I332 G333 N334 I349 G350	Y331-Q336 WeakPolarHBondContact CD2-O 3.48Å; Y331-Q336 VanDerWaalsContact CE2-O 3.31Å; Y331-Q336 WeakPolarHBondContact CE2-O 3.44Å; I332-Q336 HydrophobicContact CD1-CB 3.85Å; I332-Q336 VanDerWaalsContact CG1-C 3.45Å; I332-Q336 HydrophobicContact CG1-CB 3.8Å; I332-Q336 WeakPolarHBondContact CG1-O 3.48Å; I332-Q336 PolarHBondContact N-O 2.91Å; G333-Q336 WeakPolarHBondContact O-CB 3.31Å; G333-Q336 PolarHBondContact O-N 2.9Å; N334-Q336 PolarHBondContact O-N 3.34Å; Q336-I349 HydrophobicContact CB-CG2 4.06Å; Q336-I349 HydrophobicContact CG-CG2 4.36Å; Q336-G350 CarbonylContact C-O 3.56Å; Q336-G350 VanDerWaalsContact CA-O 3.31Å; Q336-G350 WeakPolarHBondContact CA-O 3.36Å
337	Y	92.8	Very high	86.6	Confident	4 Å²	4	17 Å²	17	2%	0.016	11%	0.107	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-143.5	156.9	177.1	54.4	-102.9	0	0	0	111.4	L316 W318 A329 I330 H339 I349 G350 S351 I352 F355	L316-Y337 HydrophobicContact CD1-CD1 3.57Å; L316-Y337 HydrophobicContact CD1-CG 3.9Å; W318-Y337 HydrophobicContact CH2-CD1 4.25Å; W318-Y337 HydrophobicContact CH2-CD2 4.49Å; W318-Y337 AromaticContact CH2-CE1 3.9Å; W318-Y337 HydrophobicContact CH2-CE1 3.9Å; W318-Y337 HydrophobicContact CH2-CE2 4.17Å; W318-Y337 AromaticContact CH2-CZ 3.87Å; W318-Y337 HydrophobicContact CZ2-CE1 4.04Å; W318-Y337 AromaticContact CZ2-CZ 3.98Å; A329-Y337 HydrophobicContact CB-CD2 3.58Å; A329-Y337 HydrophobicContact CB-CE2 4.34Å; A329-Y337 HydrophobicContact CB-CG 3.84Å; I330-Y337 CarbonylContact O-C 3.56Å; I330-Y337 WeakPolarHBondContact O-CA 3.24Å; I330-Y337 VanDerWaalsContact O-CB 3.3Å; I330-Y337 WeakPolarHBondContact O-CB 3.25Å; Y337-H339 HydrophobicContact CD2-CB 4.18Å; Y337-H339 HydrophobicContact CE2-CB 4.4Å; Y337-H339 AromaticContact CE2-CE1 3.7Å; Y337-H339 AromaticContact CE2-CG 3.8Å; Y337-H339 AromaticContact CE2-ND1 3.57Å; Y337-I349 CarbonylContact O-C 3.53Å; Y337-I349 VanDerWaalsContact O-CA 3.3Å; Y337-I349 WeakPolarHBondContact O-CA 3.38Å; Y337-G350 PolarHBondContact N-O 3.33Å; Y337-G350 PolarHBondContact O-N 2.86Å; Y337-S351 VanDerWaalsContact CE1-C 3.41Å; Y337-S351 WeakPolarHBondContact CE1-O 3.27Å; Y337-S351 PolarHBondContact OH-O 3.39Å; Y337-I352 HydrophobicContact CD1-CG1 3.98Å; Y337-I352 HydrophobicContact CE1-CG1 4.12Å; Y337-F355 WeakPolarHBondContact OH-CB 3.19Å; Y337-F355 PolarHBondContact OH-O 2.93Å
338	I	91.6	Very high	86.4	Confident	0 Å²	0	20.3 Å²	20.3	0%	0	12%	0.121	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-102.5	131	168.8	-65	175	0	0	0	108.6	A255 Y256 L259 L278 I330 I332 V347 K348 I349	A255-I338 HydrophobicContact CB-CB 4.19Å; A255-I338 HydrophobicContact CB-CD1 3.84Å; A255-I338 HydrophobicContact CB-CG2 4.25Å; Y256-I338 HydrophobicContact CD1-CD1 3.62Å; Y256-I338 HydrophobicContact CD2-CD1 4.14Å; Y256-I338 HydrophobicContact CE1-CD1 3.79Å; Y256-I338 HydrophobicContact CE2-CD1 4.3Å; Y256-I338 HydrophobicContact CG-CD1 3.8Å; L259-I338 HydrophobicContact CD2-CD1 4.46Å; L259-I338 HydrophobicContact CD2-CG1 4.42Å; L259-I338 HydrophobicContact CD2-CG2 4.2Å; L278-I338 HydrophobicContact CD2-CG2 4.18Å; I330-I338 PolarHBondContact N-O 2.82Å; I330-I338 PolarHBondContact O-N 2.88Å; I332-I338 HydrophobicContact CD1-CG1 4.14Å; I332-I338 HydrophobicContact CG2-CB 4.47Å; I332-I338 HydrophobicContact CG2-CD1 3.91Å; I332-I338 HydrophobicContact CG2-CG1 3.88Å; I338-V347 HydrophobicContact CG2-CG1 3.72Å; I338-K348 WeakPolarHBondContact CA-O 3.36Å; I338-I349 HydrophobicContact CG1-CG1 4.1Å
339	H	94.8	Very high	86	Confident	10 Å²	10	21.8 Å²	21.8	5%	0.046	13%	0.129	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-143.7	159.6	177.6	71.4	168.4	0	0	0	112.1	H327 A329 Y337 P341 V347 K348	H327-H339 AromaticContact CD2-ND1 3.92Å; H327-H339 AromaticContact CE1-ND1 3.73Å; H327-H339 WeakPolarHBondContact NE2-CB 3.35Å; H327-H339 AromaticContact NE2-CG 3.58Å; H327-H339 AromaticContact NE2-ND1 2.99Å; H327-H339 PolarHBondContact NE2-ND1 3.35Å; A329-H339 HydrophobicContact CB-CB 3.67Å; Y337-H339 HydrophobicContact CD2-CB 4.18Å; Y337-H339 HydrophobicContact CE2-CB 4.4Å; Y337-H339 AromaticContact CE2-CE1 3.7Å; Y337-H339 AromaticContact CE2-CG 3.8Å; Y337-H339 AromaticContact CE2-ND1 3.57Å; H339-P341 WeakPolarHBondContact O-CD 3.31Å; H339-V347 VanDerWaalsContact O-CA 3.25Å; H339-V347 WeakPolarHBondContact O-CA 3.41Å; H339-K348 PolarHBondContact CD2-O 3.46Å; H339-K348 PolarHBondContact N-O 2.67Å; H339-K348 VanDerWaalsContact N-O 3.09Å; H339-K348 PolarHBondContact O-N 3.3Å
340	A	91.3	Very high	85.4	Confident	0 Å²	0	22.3 Å²	22.3	0%	0	14%	0.135	C	C	.	.			trans	-95.8	101.7	158	0	0	0	0	0	106.4	Y263 F273 C275 L278 H327 V347	Y263-A340 VanDerWaalsContact CD2-C 3.48Å; Y263-A340 HydrophobicContact CD2-CB 3.67Å; Y263-A340 WeakPolarHBondContact CD2-O 3.22Å; Y263-A340 HydrophobicContact CE2-CB 4.24Å; Y263-A340 VanDerWaalsContact CE2-O 3.25Å; Y263-A340 WeakPolarHBondContact CE2-O 3.29Å; F273-A340 HydrophobicContact CB-CB 4.19Å; C275-A340 WeakPolarHBondContact CB-O 3.21Å; L278-A340 HydrophobicContact CB-CB 4.42Å; L278-A340 HydrophobicContact CD2-CB 4.3Å; H327-A340 PolarHBondContact CE1-O 3.24Å; A340-V347 HydrophobicContact CB-CG2 3.94Å
341	P	86.4	Confident	84.9	Confident	17 Å²	17	23.8 Å²	23.8	11%	0.11	15%	0.145	C	C	.	.			trans	-69.2	-57.2	-165.9	21.1	-29.9	0	0	0	113.5	H339 D345 V346 K348	H339-P341 WeakPolarHBondContact O-CD 3.31Å; P341-D345 HydrophobicContact CG-CB 3.83Å; P341-D345 VanDerWaalsContact CG-OD2 3.26Å; P341-D345 WeakPolarHBondContact CG-OD2 3.39Å; P341-V346 WeakPolarHBondContact CD-O 3.49Å; P341-K348 HydrophobicContact CG-CD 4.34Å; P341-K348 HydrophobicContact CG-CG 4.45Å
342	Q	81.5	Confident	84.6	Confident	22 Å²	22	24.2 Å²	24.2	10%	0.103	15%	0.149	C	C	.	.	S	Bend	trans	-170.2	163.7	-168.6	63.7	-175.7	28.8	0	0	112.1	Y263 D345 S435	Y263-Q342 WeakPolarHBondContact CB-O 3.48Å; Y263-Q342 VanDerWaalsContact CD2-N 3.28Å; Y263-Q342 VanDerWaalsContact CG-O 3.22Å; Q342-D345 HydrophobicContact CG-CB 4.1Å; Q342-D345 WeakPolarHBondContact O-CB 3Å; Q342-D345 PolarHBondContact O-N 3.07Å; Q342-S435 PolarHBondContact OE1-OG 3.07Å
343	P	78.3	Confident	84.5	Confident	32 Å²	32	28.6 Å²	28.6	21%	0.208	19%	0.185	C	C	.	.	T	Hydrogen-bonded Turn	trans	-53.1	142.4	172.8	-25.8	35.5	0	0	0	112.9	Y263 D345	Y263-P343 HydrophobicContact CD1-CB 4.27Å; Y263-P343 HydrophobicContact CD1-CG 3.8Å; Y263-P343 VanDerWaalsContact CE1-CD 3.41Å; Y263-P343 HydrophobicContact CE1-CG 3.66Å; P343-D345 VanDerWaalsContact C-N 3.32Å
344	G	73.5	Confident	84.5	Confident	41 Å²	41	35.2 Å²	35.2	42%	0.423	22%	0.218	S	C	.	.	T	Hydrogen-bonded Turn	trans	76.2	17.7	-177.5	0	0	0	0	0	114.3	L461	G344-L461 WeakPolarHBondContact O-CB 3.22Å; G344-L461 PolarHBondContact O-N 2.95Å
345	D	81.7	Confident	84.9	Confident	21 Å²	21	35 Å²	35	11%	0.112	21%	0.214	C	C	.	.	S	Bend	trans	-140.1	177.1	177.3	-159.7	-11	0	0	0	109.5	Y263 P341 Q342 P343 K348	Y263-D345 WeakPolarHBondContact CB-O 3.19Å; Y263-D345 PolarHBondContact N-O 3.22Å; P341-D345 HydrophobicContact CG-CB 3.83Å; P341-D345 VanDerWaalsContact CG-OD2 3.26Å; P341-D345 WeakPolarHBondContact CG-OD2 3.39Å; Q342-D345 HydrophobicContact CG-CB 4.1Å; Q342-D345 WeakPolarHBondContact O-CB 3Å; Q342-D345 PolarHBondContact O-N 3.07Å; P343-D345 VanDerWaalsContact C-N 3.32Å; D345-K348 IonicContact OD1-NZ 3.5Å; D345-K348 PolarHBondContact OD1-NZ 2.73Å; D345-K348 WeakPolarHBondContact OD2-CE 3.43Å; D345-K348 IonicContact OD2-NZ 2.64Å; D345-K348 PolarHBondContact OD2-NZ 2.84Å
346	V	84.4	Confident	85.4	Confident	28 Å²	28	37 Å²	37	17%	0.17	23%	0.228	C	C	.	.	B	Isolated β-bridge	trans	-121.1	161.6	-175.6	-61.4	0	0	0	0	111.8	G260 K261 P341 K348 L461	G260-V346 WeakPolarHBondContact O-CG1 3.12Å; K261-V346 CarbonylContact O-C 3.59Å; K261-V346 WeakPolarHBondContact O-CA 3.33Å; P341-V346 WeakPolarHBondContact CD-O 3.49Å; V346-K348 PolarHBondContact O-N 3.38Å; V346-K348 VanDerWaalsContact O-N 3.14Å; V346-L461 HydrophobicContact CG1-CD2 4.06Å
347	V	85.8	Confident	85.7	Confident	1 Å²	1	36.4 Å²	36.4	1%	0.006	23%	0.226	C	C	.	.	S	Bend	trans	-56.4	119.4	166.9	178.8	0	0	0	0	108.4	H258 L259 G260 K261 F273 L278 I338 H339 A340	H258-V347 HydrophobicContact CB-CG1 4.12Å; H258-V347 WeakPolarHBondContact O-CB 3.27Å; H258-V347 WeakPolarHBondContact O-CG1 3.31Å; L259-V347 CarbonylContact C-O 3.5Å; L259-V347 WeakPolarHBondContact CA-O 3.21Å; L259-V347 HydrophobicContact CD2-CG1 4.35Å; G260-V347 PolarHBondContact N-O 3.01Å; K261-V347 HydrophobicContact CB-CG2 4.28Å; K261-V347 WeakPolarHBondContact O-CG2 3.1Å; K261-V347 PolarHBondContact O-N 2.89Å; F273-V347 HydrophobicContact CB-CG2 4.27Å; F273-V347 HydrophobicContact CD2-CG2 4.26Å; L278-V347 HydrophobicContact CD1-CG1 4.28Å; L278-V347 HydrophobicContact CD1-CG2 4.41Å; L278-V347 HydrophobicContact CD2-CG1 3.84Å; L278-V347 HydrophobicContact CD2-CG2 4.32Å; I338-V347 HydrophobicContact CG2-CG1 3.72Å; H339-V347 VanDerWaalsContact O-CA 3.25Å; H339-V347 WeakPolarHBondContact O-CA 3.41Å; A340-V347 HydrophobicContact CB-CG2 3.94Å
348	K	82.6	Confident	85.6	Confident	80 Å²	80	39.9 Å²	39.9	35%	0.348	25%	0.248	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-146.4	168.4	-172.8	70	-171.5	-170.1	-170.5	0	111.6	I338 H339 P341 D345 V346	I338-K348 WeakPolarHBondContact CA-O 3.36Å; H339-K348 PolarHBondContact CD2-O 3.46Å; H339-K348 PolarHBondContact N-O 2.67Å; H339-K348 VanDerWaalsContact N-O 3.09Å; H339-K348 PolarHBondContact O-N 3.3Å; P341-K348 HydrophobicContact CG-CD 4.34Å; P341-K348 HydrophobicContact CG-CG 4.45Å; D345-K348 IonicContact OD1-NZ 3.5Å; D345-K348 PolarHBondContact OD1-NZ 2.73Å; D345-K348 WeakPolarHBondContact OD2-CE 3.43Å; D345-K348 IonicContact OD2-NZ 2.64Å; D345-K348 PolarHBondContact OD2-NZ 2.84Å; V346-K348 PolarHBondContact O-N 3.38Å; V346-K348 VanDerWaalsContact O-N 3.14Å
349	I	85.8	Confident	85.6	Confident	30 Å²	30	40.4 Å²	40.4	15%	0.154	25%	0.25	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-80.2	131.5	168.4	-59.4	173.9	0	0	0	108.2	V118 Y256 L259 I332 Q336 Y337 I338	V118-I349 HydrophobicContact CB-CD1 4.02Å; V118-I349 HydrophobicContact CG1-CD1 3.65Å; Y256-I349 HydrophobicContact CE1-CD1 3.99Å; L259-I349 HydrophobicContact CD2-CG1 4.13Å; I332-I349 HydrophobicContact CD1-CD1 4.38Å; I332-I349 HydrophobicContact CD1-CG1 4.34Å; I332-I349 HydrophobicContact CD1-CG2 4.15Å; Q336-I349 HydrophobicContact CB-CG2 4.06Å; Q336-I349 HydrophobicContact CG-CG2 4.36Å; Y337-I349 CarbonylContact O-C 3.53Å; Y337-I349 VanDerWaalsContact O-CA 3.3Å; Y337-I349 WeakPolarHBondContact O-CA 3.38Å; I338-I349 HydrophobicContact CG1-CG1 4.1Å
350	G	84.2	Confident	85.5	Confident	12 Å²	12	39.9 Å²	39.9	12%	0.124	25%	0.248	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-118.9	166.2	167.9	0	0	0	0	0	111.2	Q336 Y337	Q336-G350 CarbonylContact C-O 3.56Å; Q336-G350 VanDerWaalsContact CA-O 3.31Å; Q336-G350 WeakPolarHBondContact CA-O 3.36Å; Y337-G350 PolarHBondContact N-O 3.33Å; Y337-G350 PolarHBondContact O-N 2.86Å
351	S	84.9	Confident	85.5	Confident	31 Å²	31	39.9 Å²	39.9	22%	0.217	25%	0.248	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-114.6	140.8	179.2	177.6	0	0	0	0	110.6	Y337 A353 D354 F355	Y337-S351 VanDerWaalsContact CE1-C 3.41Å; Y337-S351 WeakPolarHBondContact CE1-O 3.27Å; Y337-S351 PolarHBondContact OH-O 3.39Å; S351-A353 PolarHBondContact O-N 2.88Å; S351-A353 PolarHBondContact OG-N 2.64Å; S351-D354 WeakPolarHBondContact CB-OD2 3.36Å; S351-D354 PolarHBondContact O-N 2.88Å; S351-F355 PolarHBondContact O-N 3.33Å
352	I	87.6	Confident	85.5	Confident	37 Å²	37	39.6 Å²	39.6	19%	0.19	25%	0.245	C	C	.	.	T	Hydrogen-bonded Turn	trans	-60.3	-32.4	170.9	-70.4	179.9	0	0	0	110.5	V307 L316 Y331 G335 Y337 D354 F355 A356 P357	V307-I352 HydrophobicContact CG1-CD1 3.78Å; L316-I352 HydrophobicContact CD1-CD1 4.21Å; L316-I352 HydrophobicContact CD1-CG1 4.31Å; Y331-I352 HydrophobicContact CD2-CD1 4.24Å; Y331-I352 HydrophobicContact CE2-CD1 3.83Å; G335-I352 WeakPolarHBondContact O-CB 3.3Å; G335-I352 WeakPolarHBondContact O-CG1 3.33Å; G335-I352 PolarHBondContact O-N 3.32Å; Y337-I352 HydrophobicContact CD1-CG1 3.98Å; Y337-I352 HydrophobicContact CE1-CG1 4.12Å; I352-D354 VanDerWaalsContact C-N 3.31Å; I352-D354 PolarHBondContact O-N 3.17Å; I352-F355 CarbonylContact O-C 3.59Å; I352-A356 VanDerWaalsContact O-CA 3.3Å; I352-A356 WeakPolarHBondContact O-CA 3.39Å; I352-A356 WeakPolarHBondContact O-CB 3.21Å; I352-A356 PolarHBondContact O-N 3.31Å; I352-P357 HydrophobicContact CG1-CG 4.37Å
353	A	82.9	Confident	85.6	Confident	92 Å²	92	38.7 Å²	38.7	76%	0.76	24%	0.241	S	C	*	.	T	Hydrogen-bonded Turn	trans	-66.7	-33.5	177.6	0	0	0	0	0	112.5	S351	S351-A353 PolarHBondContact O-N 2.88Å; S351-A353 PolarHBondContact OG-N 2.64Å
354	D	79.3	Confident	85.2	Confident	145 Å²	145	40.9 Å²	40.9	78%	0.775	25%	0.251	S	S	*	.	T	Hydrogen-bonded Turn	trans	-87.1	-35.4	-178	-61.8	-30.2	0	0	0	112.1	S351 I352	S351-D354 WeakPolarHBondContact CB-OD2 3.36Å; S351-D354 PolarHBondContact O-N 2.88Å; I352-D354 VanDerWaalsContact C-N 3.31Å; I352-D354 PolarHBondContact O-N 3.17Å
355	F	86.9	Confident	84.5	Confident	83 Å²	83	39.6 Å²	39.6	36%	0.364	24%	0.235	S	C	.	.	S	Bend	trans	-146.3	102.9	177.1	-180	-135.6	0	0	0	108.7	W318 Y337 S351 I352	W318-F355 AromaticContact CD1-CE1 3.8Å; W318-F355 AromaticContact CD1-CE2 3.38Å; W318-F355 AromaticContact CD1-CZ 3.24Å; W318-F355 HydrophobicContact CD2-CD1 4.43Å; W318-F355 AromaticContact CD2-CE1 3.85Å; W318-F355 HydrophobicContact CD2-CE1 3.85Å; W318-F355 HydrophobicContact CD2-CZ 4.04Å; W318-F355 AromaticContact CE2-CD1 3.52Å; W318-F355 AromaticContact CE2-CE1 3.37Å; W318-F355 AromaticContact CE2-CG 3.99Å; W318-F355 AromaticContact CE2-CZ 3.71Å; W318-F355 HydrophobicContact CG-CE1 4.09Å; W318-F355 HydrophobicContact CG-CE2 4.32Å; W318-F355 AromaticContact CG-CZ 3.76Å; W318-F355 HydrophobicContact CG-CZ 3.76Å; W318-F355 HydrophobicContact CH2-CD1 4.42Å; W318-F355 AromaticContact CZ2-CD1 3.5Å; W318-F355 HydrophobicContact CZ2-CD1 3.5Å; W318-F355 AromaticContact CZ2-CE1 3.77Å; W318-F355 HydrophobicContact CZ2-CE1 3.77Å; W318-F355 HydrophobicContact CZ2-CG 4.06Å; W318-F355 WeakPolarHBondContact CZ2-O 3.25Å; W318-F355 AromaticContact NE1-CD1 3.52Å; W318-F355 AromaticContact NE1-CD2 3.43Å; W318-F355 AromaticContact NE1-CE1 3.33Å; W318-F355 VanDerWaalsContact NE1-CE1 3.33Å; W318-F355 AromaticContact NE1-CE2 3.23Å; W318-F355 AromaticContact NE1-CG 3.57Å; W318-F355 AromaticContact NE1-CZ 3.18Å; Y337-F355 WeakPolarHBondContact OH-CB 3.19Å; Y337-F355 PolarHBondContact OH-O 2.93Å; S351-F355 PolarHBondContact O-N 3.33Å; I352-F355 CarbonylContact O-C 3.59Å
356	A	91.4	Very high	82.6	Confident	65 Å²	65	42.8 Å²	42.8	54%	0.537	26%	0.264	S	S	.	.			trans	-85.7	125.8	-171.3	0	0	0	0	0	111.9	W318 I352	W318-A356 VanDerWaalsContact NE1-C 3.27Å; W318-A356 PolarHBondContact NE1-O 3.05Å; I352-A356 VanDerWaalsContact O-CA 3.3Å; I352-A356 WeakPolarHBondContact O-CA 3.39Å; I352-A356 WeakPolarHBondContact O-CB 3.21Å; I352-A356 PolarHBondContact O-N 3.31Å
357	P	93.3	Very high	80.6	Confident	14 Å²	14	45 Å²	45	9%	0.091	29%	0.293	C	S	.	.			trans	-71.1	159.4	174.2	31.5	-35.9	0	0	0	111.9	V307 L316 F317 W318 I352	V307-P357 HydrophobicContact CB-CG 4.46Å; V307-P357 HydrophobicContact CG1-CG 3.73Å; V307-P357 HydrophobicContact CG2-CB 4.39Å; V307-P357 HydrophobicContact CG2-CG 3.81Å; L316-P357 HydrophobicContact CB-CB 3.89Å; L316-P357 HydrophobicContact CB-CG 4.13Å; L316-P357 HydrophobicContact CD1-CG 4.15Å; L316-P357 HydrophobicContact CD2-CG 4.26Å; L316-P357 HydrophobicContact CG-CG 4.41Å; F317-P357 WeakPolarHBondContact O-CB 3.21Å; W318-P357 HydrophobicContact CD2-CB 4.07Å; W318-P357 VanDerWaalsContact CE2-CA 3.49Å; W318-P357 HydrophobicContact CE3-CB 4.17Å; W318-P357 HydrophobicContact CH2-CB 3.94Å; W318-P357 HydrophobicContact CZ2-CB 3.83Å; W318-P357 HydrophobicContact CZ2-CG 4.38Å; W318-P357 HydrophobicContact CZ3-CB 4.1Å; I352-P357 HydrophobicContact CG1-CG 4.37Å
358	T	89.3	Confident	78.3	Confident	77 Å²	77	50.6 Å²	50.6	47%	0.472	32%	0.322	S	S	.	.	S	Bend	trans	-80.7	-39.2	177.7	-50.9	0	0	0	0	111.9	F317 G319	F317-T358 PolarHBondContact O-N 2.97Å; G319-T358 PolarHBondContact N-OG1 3.23Å; G319-T358 VanDerWaalsContact N-OG1 3.14Å; G319-T358 WeakPolarHBondContact O-CB 3.43Å; G319-T358 WeakPolarHBondContact O-CG2 2.86Å
359	F	91.2	Very high	76.2	Confident	10 Å²	10	52 Å²	52	4%	0.044	34%	0.339	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-155.1	165.1	177.2	66.5	-78.4	0	0	0	110.4	Q299 Q304 F317 P321 T325	Q299-F359 HydrophobicContact CB-CE2 4.36Å; Q299-F359 HydrophobicContact CB-CZ 3.91Å; Q304-F359 HydrophobicContact CB-CD2 4.07Å; Q304-F359 HydrophobicContact CB-CE2 4.45Å; Q304-F359 HydrophobicContact CG-CD2 3.83Å; Q304-F359 HydrophobicContact CG-CE2 3.7Å; F317-F359 HydrophobicContact CB-CD1 3.93Å; F317-F359 HydrophobicContact CB-CD2 4.34Å; F317-F359 HydrophobicContact CB-CE1 3.39Å; F317-F359 HydrophobicContact CB-CE2 3.85Å; F317-F359 HydrophobicContact CB-CG 4.38Å; F317-F359 HydrophobicContact CB-CZ 3.35Å; F317-F359 HydrophobicContact CD1-CZ 4.45Å; F317-F359 HydrophobicContact CD2-CD2 4.36Å; F317-F359 AromaticContact CD2-CE2 3.66Å; F317-F359 HydrophobicContact CD2-CE2 3.66Å; F317-F359 AromaticContact CD2-CZ 3.87Å; F317-F359 HydrophobicContact CD2-CZ 3.87Å; F317-F359 HydrophobicContact CG-CE1 4.21Å; F317-F359 AromaticContact CG-CE2 3.94Å; F317-F359 HydrophobicContact CG-CE2 3.94Å; F317-F359 AromaticContact CG-CZ 3.65Å; F317-F359 HydrophobicContact CG-CZ 3.65Å; F317-F359 PolarHBondContact N-O 2.79Å; F317-F359 PolarHBondContact O-N 3.4Å; P321-F359 HydrophobicContact CB-CD1 3.78Å; P321-F359 HydrophobicContact CB-CD2 4.44Å; P321-F359 HydrophobicContact CB-CE1 3.83Å; P321-F359 HydrophobicContact CB-CE2 4.5Å; P321-F359 HydrophobicContact CB-CG 4.1Å; P321-F359 HydrophobicContact CB-CZ 4.19Å; P321-F359 HydrophobicContact CG-CB 4.34Å; P321-F359 HydrophobicContact CG-CD1 3.61Å; P321-F359 HydrophobicContact CG-CE1 4.08Å; P321-F359 HydrophobicContact CG-CG 4.04Å; T325-F359 HydrophobicContact CG2-CE1 3.77Å; T325-F359 HydrophobicContact CG2-CZ 3.78Å
360	A	93.7	Very high	74.1	Confident	0 Å²	0	56.6 Å²	56.6	0%	0	36%	0.358	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-108.6	158.2	168.7	0	0	0	0	0	110.1	Q304 I305 A310 L315 L316	Q304-A360 CarbonylContact C-O 3.47Å; Q304-A360 WeakPolarHBondContact CA-O 3.37Å; I305-A360 HydrophobicContact CD1-CB 4.24Å; I305-A360 HydrophobicContact CG1-CB 3.72Å; I305-A360 PolarHBondContact N-O 2.84Å; I305-A360 PolarHBondContact O-N 3.06Å; I305-A360 VanDerWaalsContact O-O 3.11Å; A310-A360 HydrophobicContact CB-CB 3.9Å; L315-A360 CarbonylContact O-C 3.54Å; L315-A360 VanDerWaalsContact O-CA 3.24Å; L315-A360 WeakPolarHBondContact O-CA 3.21Å; L316-A360 HydrophobicContact CD2-CB 3.7Å
361	L	90.2	Very high	72.2	Confident	0 Å²	0	57.3 Å²	57.3	0%	0	36%	0.362	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-132.1	127.1	175.5	178.4	141	0	0	0	109.3	Q298 Q299 T303 Q304 L315 F317 V363	Q298-L361 WeakPolarHBondContact O-CD1 3.29Å; Q299-L361 WeakPolarHBondContact O-CD1 3.23Å; T303-L361 CarbonylContact O-C 3.53Å; T303-L361 WeakPolarHBondContact O-CA 3.33Å; Q304-L361 HydrophobicContact CG-CD1 4.25Å; L315-L361 HydrophobicContact CB-CB 4.43Å; L315-L361 HydrophobicContact CD1-CD2 4.24Å; L315-L361 PolarHBondContact N-O 2.88Å; L315-L361 PolarHBondContact O-N 2.88Å; F317-L361 HydrophobicContact CD2-CB 4.03Å; F317-L361 HydrophobicContact CE2-CB 3.68Å; F317-L361 HydrophobicContact CE2-CD1 4.39Å; F317-L361 HydrophobicContact CE2-CG 4.45Å; L361-V363 HydrophobicContact CD2-CB 4.43Å; L361-V363 HydrophobicContact CD2-CG2 3.57Å
362	R	88.3	Confident	70.1	Confident	10 Å²	10	63.1 Å²	63.1	4%	0.038	40%	0.397	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-97.2	112.1	169.7	-168.9	159.7	-64	147.9	10.7	110	A240 P241 F243 G302 T303 I305 E309 Q311 D314	A240-R362 HydrophobicContact CB-CB 4.26Å; P241-R362 HydrophobicContact CG-CG 4.17Å; P241-R362 WeakPolarHBondContact O-CD 3.18Å; P241-R362 PolarHBondContact O-NH1 2.82Å; F243-R362 HydrophobicContact CD1-CG 4.26Å; F243-R362 HydrophobicContact CE1-CG 3.66Å; F243-R362 HydrophobicContact CE2-CG 4.02Å; F243-R362 HydrophobicContact CZ-CG 3.58Å; G302-R362 CarbonylContact C-O 3.48Å; G302-R362 VanDerWaalsContact CA-O 3.22Å; G302-R362 WeakPolarHBondContact CA-O 3.43Å; T303-R362 PolarHBondContact N-O 3.37Å; T303-R362 PolarHBondContact O-N 3.29Å; I305-R362 HydrophobicContact CD1-CB 4.37Å; E309-R362 PolarHBondContact O-NH2 3.15Å; Q311-R362 VanDerWaalsContact CD-NH2 3.35Å; Q311-R362 VanDerWaalsContact CG-NH2 3.29Å; D314-R362 WeakPolarHBondContact OD1-CA 3.44Å; D314-R362 WeakPolarHBondContact OD1-CB 3.34Å; D314-R362 WeakPolarHBondContact OD1-CG 3.16Å; D314-R362 IonicContact OD1-CZ 3.84Å; D314-R362 IonicContact OD1-NE 2.88Å; D314-R362 PolarHBondContact OD1-NE 2.78Å; D314-R362 IonicContact OD1-NH2 3.89Å; D314-R362 IonicContact OD2-CZ 3.4Å; D314-R362 IonicContact OD2-NE 3.21Å; D314-R362 PolarHBondContact OD2-NE 2.99Å; D314-R362 IonicContact OD2-NH2 2.72Å; D314-R362 PolarHBondContact OD2-NH2 2.9Å
363	V	82.3	Confident	67.8	Low	4 Å²	4	63.4 Å²	63.4	2%	0.024	41%	0.409	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-61.1	139.8	179.7	177.3	0	0	0	0	109.9	F243 Y283 I291 L315 L361 V365	F243-V363 VanDerWaalsContact CE1-O 3.31Å; F243-V363 WeakPolarHBondContact CE1-O 3.26Å; F243-V363 HydrophobicContact CZ-CB 4.42Å; Y283-V363 HydrophobicContact CD1-CB 4.44Å; Y283-V363 HydrophobicContact CD1-CG1 4.39Å; Y283-V363 HydrophobicContact CD1-CG2 4.16Å; Y283-V363 HydrophobicContact CE1-CB 3.61Å; Y283-V363 HydrophobicContact CE1-CG1 4.02Å; Y283-V363 HydrophobicContact CE1-CG2 3.38Å; Y283-V363 HydrophobicContact CE2-CG2 4.48Å; Y283-V363 WeakPolarHBondContact OH-CG2 3.46Å; I291-V363 HydrophobicContact CG2-CG1 3.82Å; I291-V363 HydrophobicContact CG2-CG2 3.91Å; L315-V363 HydrophobicContact CD1-CG2 4.06Å; L361-V363 HydrophobicContact CD2-CB 4.43Å; L361-V363 HydrophobicContact CD2-CG2 3.57Å; V363-V365 VanDerWaalsContact C-N 3.3Å; V363-V365 HydrophobicContact CG1-CG1 4.31Å; V363-V365 WeakPolarHBondContact O-CG2 3.39Å; V363-V365 PolarHBondContact O-N 3.47Å
364	N	69.4	Low	65.6	Low	77 Å²	77	62.3 Å²	62.3	41%	0.412	40%	0.396	S	S	.	.			trans	-77.6	82.2	175.8	-69.1	-29.6	0	0	0	110.1	A301	A301-N364 PolarHBondContact O-N 3.33Å
365	V	60.2	Low	63.6	Low	15 Å²	15	58.8 Å²	58.8	9%	0.091	38%	0.376	C	S	.	.			trans	-95.8	3.8	173.9	-91.5	0	0	0	0	113.2	F243 V247 T287 H289 V363 G367	F243-V365 HydrophobicContact CD1-CG2 3.28Å; F243-V365 HydrophobicContact CE1-CG2 3.07Å; F243-V365 HydrophobicContact CZ-CG2 4.19Å; V247-V365 HydrophobicContact CG1-CG2 4.37Å; T287-V365 HydrophobicContact CG2-CG1 4.33Å; H289-V365 HydrophobicContact CB-CG1 4.43Å; V363-V365 VanDerWaalsContact C-N 3.3Å; V363-V365 HydrophobicContact CG1-CG1 4.31Å; V363-V365 WeakPolarHBondContact O-CG2 3.39Å; V363-V365 PolarHBondContact O-N 3.47Å; V365-G367 PolarHBondContact O-N 2.91Å; V365-G367 VanDerWaalsContact O-N 3.16Å
366	A	41.4	Very low	61.3	Low	87 Å²	87	57 Å²	57	72%	0.719	38%	0.375	S	S	*	.	T	Hydrogen-bonded Turn	trans	-60	117.8	-174	0	0	0	0	0	112.3	P241	P241-A366 HydrophobicContact CB-CB 4.26Å
367	G	41.7	Very low	58.5	Low	76 Å²	76	59.1 Å²	59.1	78%	0.784	38%	0.377	S	S	*	.	T	Hydrogen-bonded Turn	trans	117.5	-4.1	167.4	0	0	0	0	0	117.3	V365	V365-G367 PolarHBondContact O-N 2.91Å; V365-G367 VanDerWaalsContact O-N 3.16Å
368	L	38.5	Very low	55.7	Low	118 Å²	118	62 Å²	62	62%	0.618	40%	0.401	S	S	*	.			trans	-120.6	138.7	179.5	-65.2	175.8	0	0	0	112.3
369	P	37.6	Very low	53.4	Low	108 Å²	108	62.3 Å²	62.3	70%	0.701	40%	0.396	S	S	*	.			trans	-65	158.2	177	27.8	-33.9	0	0	0	111.3	A371	P369-A371 PolarHBondContact O-N 3.04Å
370	K	42.9	Very low	50.6	Low	128 Å²	128	63.7 Å²	63.7	56%	0.557	41%	0.414	S	S	*	.			trans	-39.3	131	168.4	178	-179.7	178.4	177	0	109.8	T372	K370-T372 PolarHBondContact O-N 3.06Å
371	A	43.7	Very low	47.6	Very low	26 Å²	26	71.1 Å²	71.1	22%	0.215	45%	0.448	C	S	.	.			trans	-52.6	117.7	176.9	0	0	0	0	0	109.6	P369 G373	P369-A371 PolarHBondContact O-N 3.04Å; A371-G373 PolarHBondContact O-N 2.78Å
372	T	39.7	Very low	44.8	Very low	154 Å²	154	78 Å²	78	95%	0.945	48%	0.475	S	S	*	.	S	Bend	trans	-78.2	3.3	179	50.2	0	0	0	0	112.6	K370	K370-T372 PolarHBondContact O-N 3.06Å
373	G	40.4	Very low	42	Very low	43 Å²	43	80.4 Å²	80.4	44%	0.443	49%	0.494	S	S	.	.	S	Bend	trans	-157.7	146.3	172.8	0	0	0	0	0	111.1	A371 L375	A371-G373 PolarHBondContact O-N 2.78Å; G373-L375 PolarHBondContact O-N 2.91Å
374	S	36.6	Very low	39.8	Very low	69 Å²	69	86.1 Å²	86.1	48%	0.483	53%	0.529	S	S	.	.			trans	-67.2	114.8	175.2	-174.8	0	0	0	0	109.6	N285 S376	N285-S374 PolarHBondContact OD1-OG 3.02Å; S374-S376 PolarHBondContact O-N 3.13Å; S374-S376 WeakPolarHBondContact OG-CB 3.36Å; S374-S376 PolarHBondContact OG-N 3.17Å; S374-S376 PolarHBondContact OG-OG 2.8Å
375	L	38.3	Very low	38	Very low	70 Å²	70	89.1 Å²	89.1	37%	0.366	55%	0.545	S	S	.	.	G	3₁₀ helix	trans	-75.2	0.4	171.5	-65.3	-177.6	0	0	0	112.9	G288 G373 N377 A378 F379	G288-L375 WeakPolarHBondContact O-CD1 3.48Å; G373-L375 PolarHBondContact O-N 2.91Å; L375-N377 PolarHBondContact O-N 3.22Å; L375-N377 VanDerWaalsContact O-N 3.15Å; L375-A378 HydrophobicContact CB-CB 4.44Å; L375-A378 HydrophobicContact CD2-CB 4.36Å; L375-A378 WeakPolarHBondContact O-CA 3.09Å; L375-A378 WeakPolarHBondContact O-CB 3.29Å; L375-A378 PolarHBondContact O-N 3.06Å; L375-F379 HydrophobicContact CB-CD2 4.36Å; L375-F379 HydrophobicContact CB-CE2 4.01Å; L375-F379 WeakPolarHBondContact O-CD2 3.34Å; L375-F379 PolarHBondContact O-N 3.34Å
376	S	37.4	Very low	37	Very low	47 Å²	47	93.9 Å²	93.9	33%	0.329	57%	0.566	S	S	.	*	G	3₁₀ helix	trans	-47.9	-43.1	176.4	50.5	0	0	0	0	113	N285 S374 A378 F379	N285-S376 VanDerWaalsContact OD1-CB 3.27Å; N285-S376 WeakPolarHBondContact OD1-CB 3.4Å; S374-S376 PolarHBondContact O-N 3.13Å; S374-S376 WeakPolarHBondContact OG-CB 3.36Å; S374-S376 PolarHBondContact OG-N 3.17Å; S374-S376 PolarHBondContact OG-OG 2.8Å; S376-A378 VanDerWaalsContact C-N 3.33Å; S376-A378 PolarHBondContact O-N 2.8Å; S376-F379 PolarHBondContact O-N 2.84Å
377	N	33	Very low	37.2	Very low	109 Å²	109	94.3 Å²	94.3	58%	0.583	56%	0.562	S	S	*	*	G	3₁₀ helix	trans	-74.2	-23.4	179.6	-73.7	-26.3	0	0	0	112.9	L375 F379 G380 Q381	L375-N377 PolarHBondContact O-N 3.22Å; L375-N377 VanDerWaalsContact O-N 3.15Å; N377-F379 VanDerWaalsContact C-N 3.31Å; N377-G380 PolarHBondContact O-N 3.07Å; N377-Q381 PolarHBondContact OD1-NE2 3.22Å
378	A	35.3	Very low	37.8	Very low	73 Å²	73	93.9 Å²	93.9	60%	0.603	54%	0.539	S	S	*	.	T	Hydrogen-bonded Turn	trans	-72.7	-26	176.6	0	0	0	0	0	112.2	L375 S376 G380	L375-A378 HydrophobicContact CB-CB 4.44Å; L375-A378 HydrophobicContact CD2-CB 4.36Å; L375-A378 WeakPolarHBondContact O-CA 3.09Å; L375-A378 WeakPolarHBondContact O-CB 3.29Å; L375-A378 PolarHBondContact O-N 3.06Å; S376-A378 VanDerWaalsContact C-N 3.33Å; S376-A378 PolarHBondContact O-N 2.8Å; A378-G380 VanDerWaalsContact C-N 3.28Å
379	F	39.9	Very low	38.3	Very low	84 Å²	84	91.9 Å²	91.9	37%	0.368	53%	0.528	S	S	.	.	T	Hydrogen-bonded Turn	trans	-90.1	11.8	174.5	-64.4	-68.5	0	0	0	114	Y280 L375 S376 N377	Y280-F379 WeakPolarHBondContact OH-CD1 3.47Å; Y280-F379 VanDerWaalsContact OH-CG 3.27Å; Y280-F379 WeakPolarHBondContact OH-CG 3.4Å; L375-F379 HydrophobicContact CB-CD2 4.36Å; L375-F379 HydrophobicContact CB-CE2 4.01Å; L375-F379 WeakPolarHBondContact O-CD2 3.34Å; L375-F379 PolarHBondContact O-N 3.34Å; S376-F379 PolarHBondContact O-N 2.84Å; N377-F379 VanDerWaalsContact C-N 3.31Å
380	G	33.2	Very low	39	Very low	40 Å²	40	87.8 Å²	87.8	41%	0.412	50%	0.499	S	S	.	.			trans	78.9	121	175.8	0	0	0	0	0	111.6	N377 A378 Y382	N377-G380 PolarHBondContact O-N 3.07Å; A378-G380 VanDerWaalsContact C-N 3.28Å; G380-Y382 PolarHBondContact O-N 2.92Å
381	Q	28.8	Very low	39.5	Very low	155 Å²	155	84.1 Å²	84.1	72%	0.724	49%	0.485	S	S	*	.			trans	-59.2	113.1	159.1	-63.6	-152.1	18.8	0	0	107.5	N377 S383	N377-Q381 PolarHBondContact OD1-NE2 3.22Å; Q381-S383 VanDerWaalsContact C-N 3.29Å; Q381-S383 PolarHBondContact O-N 3.1Å
382	Y	33.3	Very low	40.1	Very low	144 Å²	144	88 Å²	88	57%	0.565	50%	0.497	S	S	*	.			trans	-64	97.3	170.7	-76.5	-84	0	0	0	107.6	G380 T384	G380-Y382 PolarHBondContact O-N 2.92Å; Y382-T384 PolarHBondContact O-N 3.45Å
383	S	29.4	Very low	40.9	Very low	62 Å²	62	81.4 Å²	81.4	43%	0.434	46%	0.456	S	S	.	.			trans	-60.5	131.6	174.1	176	0	0	0	0	108.9	Q381 N385 Q386	Q381-S383 VanDerWaalsContact C-N 3.29Å; Q381-S383 PolarHBondContact O-N 3.1Å; S383-N385 PolarHBondContact O-N 3.25Å; S383-Q386 PolarHBondContact O-N 3.22Å
384	T	35.9	Very low	41.8	Very low	124 Å²	124	83 Å²	83	76%	0.761	45%	0.452	S	S	*	.	T	Hydrogen-bonded Turn	trans	-60.5	-8.6	177.8	54.9	0	0	0	0	113.9	Y382	Y382-T384 PolarHBondContact O-N 3.45Å
385	N	31.5	Very low	43.3	Very low	140 Å²	140	80.1 Å²	80.1	75%	0.749	43%	0.432	S	S	*	.	T	Hydrogen-bonded Turn	trans	-98.9	-0.1	178.4	-71.2	0.1	0	0	0	113.7	S383	S383-N385 PolarHBondContact O-N 3.25Å
386	Q	38.2	Very low	45	Very low	115 Å²	115	76.8 Å²	76.8	54%	0.537	41%	0.414	S	S	.	.	S	Bend	trans	-80.3	143.4	173.1	-67.2	-61.3	-49.8	0	0	110.2	S383 F388	S383-Q386 PolarHBondContact O-N 3.22Å; Q386-F388 PolarHBondContact O-N 3.33Å
387	P	46.4	Very low	46.8	Very low	96 Å²	96	77.3 Å²	77.3	62%	0.623	41%	0.413	S	S	*	.			trans	-53.5	139.2	172.3	23.6	-32.5	0	0	0	109	I389	P387-I389 VanDerWaalsContact O-CG1 3.27Å; P387-I389 WeakPolarHBondContact O-CG1 3.47Å; P387-I389 PolarHBondContact O-N 2.8Å
388	F	54.7	Low	48.9	Very low	67 Å²	67	75.2 Å²	75.2	29%	0.294	40%	0.4	S	S	.	.			trans	-57.8	110.7	178	-169.8	-91.6	0	0	0	108.9	Q386 F390 K535 A538	Q386-F388 PolarHBondContact O-N 3.33Å; F388-F390 HydrophobicContact CE1-CB 4.48Å; F388-F390 HydrophobicContact CE1-CD2 4.04Å; F388-F390 PolarHBondContact O-N 3.21Å; F388-K535 HydrophobicContact CD1-CG 4.33Å; F388-K535 HydrophobicContact CD2-CG 4.16Å; F388-K535 HydrophobicContact CE1-CG 4.42Å; F388-K535 HydrophobicContact CE2-CG 4.25Å; F388-K535 HydrophobicContact CG-CG 4.2Å; F388-K535 HydrophobicContact CZ-CG 4.38Å; F388-A538 HydrophobicContact CB-CB 4.36Å; F388-A538 HydrophobicContact CD1-CB 3.82Å; F388-A538 VanDerWaalsContact O-CB 3.23Å; F388-A538 WeakPolarHBondContact O-CB 3.13Å
389	I	47.3	Very low	51.2	Low	76 Å²	76	72 Å²	72	39%	0.39	37%	0.373	S	S	.	.			trans	-91.1	108.5	-179.3	-55.4	-170.1	0	0	0	107.8	P387	P387-I389 VanDerWaalsContact O-CG1 3.27Å; P387-I389 WeakPolarHBondContact O-CG1 3.47Å; P387-I389 PolarHBondContact O-N 2.8Å
390	F	54.1	Low	53.6	Low	21 Å²	21	68.7 Å²	68.7	9%	0.092	36%	0.359	C	S	.	.			trans	-89.6	125.9	170.1	-160.8	-68.6	0	0	0	109.5	W265 F388 I426 A538 I539 A542 Y543	W265-F390 AromaticContact CD1-CE2 3.37Å; W265-F390 AromaticContact CD1-CZ 3.86Å; W265-F390 AromaticContact NE1-CE2 3.11Å; W265-F390 AromaticContact NE1-CZ 3.09Å; F388-F390 HydrophobicContact CE1-CB 4.48Å; F388-F390 HydrophobicContact CE1-CD2 4.04Å; F388-F390 PolarHBondContact O-N 3.21Å; F390-I426 HydrophobicContact CE2-CG2 4.39Å; F390-I426 HydrophobicContact CZ-CG2 4.24Å; F390-A538 HydrophobicContact CB-CB 4.13Å; F390-I539 HydrophobicContact CD2-CB 4.32Å; F390-I539 HydrophobicContact CD2-CD1 4.25Å; F390-I539 HydrophobicContact CD2-CG1 3.27Å; F390-I539 HydrophobicContact CE2-CD1 4.06Å; F390-I539 HydrophobicContact CE2-CG1 3.39Å; F390-I539 HydrophobicContact CG-CG1 4.05Å; F390-I539 HydrophobicContact CZ-CG1 4.29Å; F390-A542 HydrophobicContact CB-CB 3.85Å; F390-A542 HydrophobicContact CD1-CB 3.85Å; F390-A542 HydrophobicContact CG-CB 4.17Å; F390-Y543 HydrophobicContact CD1-CD2 4.39Å; F390-Y543 AromaticContact CD1-CE2 3.65Å; F390-Y543 HydrophobicContact CD1-CE2 3.65Å; F390-Y543 HydrophobicContact CE1-CD2 4.21Å; F390-Y543 AromaticContact CE1-CE2 3.14Å; F390-Y543 HydrophobicContact CE1-CE2 3.14Å; F390-Y543 AromaticContact CE1-CZ 3.66Å; F390-Y543 WeakPolarHBondContact CE1-OH 3.49Å; F390-Y543 AromaticContact CZ-CE2 3.76Å; F390-Y543 HydrophobicContact CZ-CE2 3.76Å
391	N	51.5	Low	56.3	Low	51 Å²	51	73.8 Å²	73.8	27%	0.273	37%	0.369	S	S	.	.			trans	-105.4	134.1	176.6	-64	-67.7	0	0	0	110	W294	W294-N391 HydrophobicContact CH2-CB 3.41Å; W294-N391 VanDerWaalsContact CH2-CB 3.41Å; W294-N391 HydrophobicContact CZ2-CB 3.15Å; W294-N391 HydrophobicContact CZ3-CB 4.44Å
392	K	56.3	Low	59.3	Low	108 Å²	108	73.2 Å²	73.2	47%	0.47	36%	0.364	S	S	.	.			trans	-57.1	141.9	175.1	-66.5	-171.9	179.4	-176.2	0	110.1	A542 Y543 D544	K392-A542 WeakPolarHBondContact CE-O 3.29Å; K392-A542 PolarHBondContact NZ-O 2.98Å; K392-Y543 WeakPolarHBondContact CA-OH 3.49Å; K392-Y543 HydrophobicContact CB-CE1 3.94Å; K392-Y543 HydrophobicContact CD-CD1 4.37Å; K392-Y543 HydrophobicContact CG-CD1 3.99Å; K392-Y543 HydrophobicContact CG-CE1 3.81Å; K392-D544 IonicContact NZ-OD2 3.82Å; K392-D544 PolarHBondContact NZ-OD2 3.07Å
393	N	57.8	Low	62.3	Low	15 Å²	15	66.4 Å²	66.4	8%	0.08	34%	0.338	C	S	.	.			trans	-145.6	152.6	173	74.4	72	0	0	0	110.3	W294 T395 T396 D397 Y543	W294-N393 HydrophobicContact CB-CB 4.13Å; W294-N393 HydrophobicContact CD2-CB 4.02Å; W294-N393 HydrophobicContact CE3-CB 4.15Å; W294-N393 HydrophobicContact CG-CB 3.97Å; N393-T395 VanDerWaalsContact C-N 3.3Å; N393-T395 PolarHBondContact O-N 3.02Å; N393-T395 WeakPolarHBondContact OD1-CB 3.5Å; N393-T395 PolarHBondContact OD1-N 3.08Å; N393-T395 VanDerWaalsContact OD1-N 3.12Å; N393-T396 PolarHBondContact ND2-OG1 3.49Å; N393-T396 PolarHBondContact O-N 3.07Å; N393-T396 PolarHBondContact OD1-N 3.04Å; N393-T396 PolarHBondContact OD1-OG1 3.18Å; N393-D397 PolarHBondContact O-N 3.18Å; N393-Y543 PolarHBondContact N-OH 2.89Å
394	Q	59.6	Low	65.5	Low	77 Å²	77	63.5 Å²	63.5	36%	0.36	32%	0.317	S	S	.	.	H	α-helix	trans	-62.1	-35	-173.5	-173.3	178.7	1	0	0	112.9	D397 Q398	Q394-D397 PolarHBondContact O-N 3.45Å; Q394-Q398 HydrophobicContact CG-CG 4.47Å; Q394-Q398 WeakPolarHBondContact O-CB 3.39Å; Q394-Q398 WeakPolarHBondContact O-CG 3.28Å; Q394-Q398 PolarHBondContact O-N 2.81Å
395	T	67.6	Low	68.5	Low	8 Å²	8	60.8 Å²	60.8	5%	0.049	30%	0.296	C	S	.	.	H	α-helix	trans	-64	-46.1	-180	-55.3	0	0	0	0	110.7	T295 V324 T325 N393 Q398 F399 N433	T295-T395 PolarHBondContact OG1-OG1 3.07Å; V324-T395 HydrophobicContact CG1-CG2 3.96Å; T325-T395 PolarHBondContact O-OG1 2.82Å; N393-T395 VanDerWaalsContact C-N 3.3Å; N393-T395 PolarHBondContact O-N 3.02Å; N393-T395 WeakPolarHBondContact OD1-CB 3.5Å; N393-T395 PolarHBondContact OD1-N 3.08Å; N393-T395 VanDerWaalsContact OD1-N 3.12Å; T395-Q398 PolarHBondContact O-N 3.28Å; T395-F399 WeakPolarHBondContact O-CB 3.46Å; T395-F399 PolarHBondContact O-N 2.59Å; T395-N433 WeakPolarHBondContact CG2-ND2 3.16Å
396	T	72.8	Confident	71.6	Confident	0 Å²	0	56.1 Å²	56.1	0%	0	27%	0.273	C	S	.	.	H	α-helix	trans	-68.9	-39.7	174.6	-50.8	0	0	0	0	112.6	W265 N393 Q398 F399 I400 I426 S431 Y543	W265-T396 WeakPolarHBondContact CZ2-OG1 3.47Å; N393-T396 PolarHBondContact ND2-OG1 3.49Å; N393-T396 PolarHBondContact O-N 3.07Å; N393-T396 PolarHBondContact OD1-N 3.04Å; N393-T396 PolarHBondContact OD1-OG1 3.18Å; T396-Q398 PolarHBondContact O-N 3.11Å; T396-F399 WeakPolarHBondContact O-CB 3.41Å; T396-F399 PolarHBondContact O-N 2.85Å; T396-F399 VanDerWaalsContact O-N 3.13Å; T396-I400 HydrophobicContact CG2-CD1 3.77Å; T396-I400 HydrophobicContact CG2-CG1 4.19Å; T396-I400 VanDerWaalsContact O-CG1 3.28Å; T396-I400 WeakPolarHBondContact O-CG1 3.01Å; T396-I400 PolarHBondContact O-N 2.9Å; T396-I426 HydrophobicContact CG2-CD1 3.59Å; T396-I426 HydrophobicContact CG2-CG1 3.86Å; T396-I426 HydrophobicContact CG2-CG2 4.1Å; T396-S431 WeakPolarHBondContact CB-OG 3.18Å; T396-S431 WeakPolarHBondContact CG2-OG 3.49Å; T396-S431 PolarHBondContact OG1-OG 2.8Å; T396-Y543 VanDerWaalsContact CB-CZ 3.5Å; T396-Y543 WeakPolarHBondContact CB-OH 3.46Å; T396-Y543 HydrophobicContact CG2-CD2 4.19Å; T396-Y543 HydrophobicContact CG2-CE1 3.89Å; T396-Y543 HydrophobicContact CG2-CE2 3.42Å; T396-Y543 VanDerWaalsContact CG2-CE2 3.42Å; T396-Y543 VanDerWaalsContact CG2-OH 3.3Å; T396-Y543 WeakPolarHBondContact CG2-OH 3.46Å; T396-Y543 PolarHBondContact OG1-OH 3.38Å
397	D	77.2	Confident	74.5	Confident	59 Å²	59	50.7 Å²	50.7	32%	0.316	25%	0.247	S	C	.	.	H	α-helix	trans	-57.1	-40.4	176.3	-75.9	-38.1	0	0	0	111.2	N393 Q394 K401 Y543	N393-D397 PolarHBondContact O-N 3.18Å; Q394-D397 PolarHBondContact O-N 3.45Å; D397-K401 VanDerWaalsContact O-CG 3.29Å; D397-K401 WeakPolarHBondContact O-CG 3.19Å; D397-K401 PolarHBondContact O-N 3.47Å; D397-Y543 WeakPolarHBondContact OD1-CD1 3.48Å; D397-Y543 WeakPolarHBondContact OD1-CE1 3.33Å
398	Q	75.8	Confident	77	Confident	64 Å²	64	47 Å²	47	30%	0.299	22%	0.221	S	C	.	.	H	α-helix	trans	-74.7	-35.3	178.5	-66.5	-71.2	-19.9	0	0	111.9	V324 Q394 T395 T396 K401 K402	V324-Q398 HydrophobicContact CG2-CB 4.05Å; V324-Q398 HydrophobicContact CG2-CG 3.64Å; Q394-Q398 HydrophobicContact CG-CG 4.47Å; Q394-Q398 WeakPolarHBondContact O-CB 3.39Å; Q394-Q398 WeakPolarHBondContact O-CG 3.28Å; Q394-Q398 PolarHBondContact O-N 2.81Å; T395-Q398 PolarHBondContact O-N 3.28Å; T396-Q398 PolarHBondContact O-N 3.11Å; Q398-K401 PolarHBondContact O-N 2.95Å; Q398-K402 WeakPolarHBondContact O-CG 3.27Å; Q398-K402 PolarHBondContact O-N 2.82Å; Q398-K402 VanDerWaalsContact O-N 3.07Å
399	F	83.2	Confident	79	Confident	7 Å²	7	50.4 Å²	50.4	3%	0.031	24%	0.238	C	C	.	.	H	α-helix	trans	-61.7	-47	170.8	-177.3	-112.3	0	0	0	111.7	T395 T396 K401 K402 I403 A425 I426 S431 L444 Y482	T395-F399 WeakPolarHBondContact O-CB 3.46Å; T395-F399 PolarHBondContact O-N 2.59Å; T396-F399 WeakPolarHBondContact O-CB 3.41Å; T396-F399 PolarHBondContact O-N 2.85Å; T396-F399 VanDerWaalsContact O-N 3.13Å; F399-K401 VanDerWaalsContact C-N 3.31Å; F399-K401 PolarHBondContact O-N 3.38Å; F399-K402 WeakPolarHBondContact O-CB 3.45Å; F399-K402 PolarHBondContact O-N 3.39Å; F399-I403 HydrophobicContact CD1-CD1 4.2Å; F399-I403 HydrophobicContact CE1-CD1 3.53Å; F399-I403 HydrophobicContact CE1-CG1 4.3Å; F399-I403 HydrophobicContact CE2-CG2 4.13Å; F399-I403 HydrophobicContact CZ-CD1 3.72Å; F399-I403 HydrophobicContact CZ-CG1 4.45Å; F399-I403 HydrophobicContact CZ-CG2 4.3Å; F399-I403 WeakPolarHBondContact O-CG1 3.21Å; F399-I403 PolarHBondContact O-N 3.03Å; F399-I403 VanDerWaalsContact O-N 3.12Å; F399-A425 HydrophobicContact CE1-CB 3.97Å; F399-A425 HydrophobicContact CZ-CB 4.12Å; F399-I426 HydrophobicContact CD1-CG1 3.84Å; F399-I426 HydrophobicContact CE1-CG1 4.02Å; F399-S431 WeakPolarHBondContact CB-O 3.12Å; F399-S431 VanDerWaalsContact CD2-C 3.45Å; F399-S431 WeakPolarHBondContact CD2-O 3.45Å; F399-S431 VanDerWaalsContact CG-C 3.46Å; F399-S431 VanDerWaalsContact CG-O 3.25Å; F399-S431 WeakPolarHBondContact CG-O 3.26Å; F399-L444 HydrophobicContact CE2-CD2 3.75Å; F399-L444 HydrophobicContact CZ-CD1 4.12Å; F399-L444 HydrophobicContact CZ-CD2 3.55Å; F399-L444 HydrophobicContact CZ-CG 4.43Å; F399-Y482 HydrophobicContact CE2-CE2 4.37Å
400	I	90.1	Very high	81.5	Confident	14 Å²	14	47.3 Å²	47.3	7%	0.072	22%	0.222	C	C	.	.	H	α-helix	trans	-58.4	-42.7	174.5	-67.1	162.1	0	0	0	110.4	T396 K402 I403 G404 I422 I426 Y543 L545 F548	T396-I400 HydrophobicContact CG2-CD1 3.77Å; T396-I400 HydrophobicContact CG2-CG1 4.19Å; T396-I400 VanDerWaalsContact O-CG1 3.28Å; T396-I400 WeakPolarHBondContact O-CG1 3.01Å; T396-I400 PolarHBondContact O-N 2.9Å; I400-K402 VanDerWaalsContact C-N 3.27Å; I400-K402 PolarHBondContact O-N 3.14Å; I400-I403 PolarHBondContact O-N 3.41Å; I400-G404 VanDerWaalsContact O-CA 3.24Å; I400-G404 WeakPolarHBondContact O-CA 3.01Å; I400-G404 PolarHBondContact O-N 3.3Å; I400-I422 HydrophobicContact CG1-CG2 4.02Å; I400-I426 HydrophobicContact CD1-CD1 3.97Å; I400-I426 HydrophobicContact CG1-CD1 3.86Å; I400-Y543 HydrophobicContact CD1-CD1 3.4Å; I400-Y543 VanDerWaalsContact CD1-CD1 3.4Å; I400-Y543 HydrophobicContact CD1-CD2 3.99Å; I400-Y543 HydrophobicContact CD1-CE1 3.96Å; I400-Y543 HydrophobicContact CD1-CE2 4.43Å; I400-Y543 HydrophobicContact CD1-CG 3.43Å; I400-Y543 VanDerWaalsContact CD1-CG 3.43Å; I400-L545 HydrophobicContact CD1-CD2 3.86Å; I400-L545 HydrophobicContact CG1-CD2 4.23Å; I400-L545 HydrophobicContact CG2-CD2 4.17Å; I400-F548 HydrophobicContact CG2-CE2 3.87Å; I400-F548 HydrophobicContact CG2-CZ 3.92Å
401	K	90.4	Very high	83.5	Confident	146 Å²	146	46.3 Å²	46.3	64%	0.635	22%	0.218	S	C	*	.	H	α-helix	trans	-59.6	-35.5	174.5	-74.2	170.8	-171.1	177.5	0	113.2	D397 Q398 F399	D397-K401 VanDerWaalsContact O-CG 3.29Å; D397-K401 WeakPolarHBondContact O-CG 3.19Å; D397-K401 PolarHBondContact O-N 3.47Å; Q398-K401 PolarHBondContact O-N 2.95Å; F399-K401 VanDerWaalsContact C-N 3.31Å; F399-K401 PolarHBondContact O-N 3.38Å
402	K	91.7	Very high	85.7	Confident	143 Å²	143	47.2 Å²	47.2	62%	0.622	22%	0.22	S	C	*	.	H	α-helix	trans	-71.4	-37.9	179.4	-72.7	174.3	-178.5	-178.1	0	112.8	Q398 F399 I400	Q398-K402 WeakPolarHBondContact O-CG 3.27Å; Q398-K402 PolarHBondContact O-N 2.82Å; Q398-K402 VanDerWaalsContact O-N 3.07Å; F399-K402 WeakPolarHBondContact O-CB 3.45Å; F399-K402 PolarHBondContact O-N 3.39Å; I400-K402 VanDerWaalsContact C-N 3.27Å; I400-K402 PolarHBondContact O-N 3.14Å
403	I	96.7	Very high	87.7	Confident	1 Å²	1	50.4 Å²	50.4	1%	0.005	23%	0.234	C	C	.	.	H	α-helix	trans	-109.5	-17.3	-171.5	69.3	162.8	0	0	0	114.2	F399 I400 T406 S407 I422 A425 L444 Y482 L486	F399-I403 HydrophobicContact CD1-CD1 4.2Å; F399-I403 HydrophobicContact CE1-CD1 3.53Å; F399-I403 HydrophobicContact CE1-CG1 4.3Å; F399-I403 HydrophobicContact CE2-CG2 4.13Å; F399-I403 HydrophobicContact CZ-CD1 3.72Å; F399-I403 HydrophobicContact CZ-CG1 4.45Å; F399-I403 HydrophobicContact CZ-CG2 4.3Å; F399-I403 WeakPolarHBondContact O-CG1 3.21Å; F399-I403 PolarHBondContact O-N 3.03Å; F399-I403 VanDerWaalsContact O-N 3.12Å; I400-I403 PolarHBondContact O-N 3.41Å; I403-T406 PolarHBondContact O-N 3.12Å; I403-S407 VanDerWaalsContact O-CB 3.26Å; I403-S407 WeakPolarHBondContact O-CB 3.19Å; I403-S407 PolarHBondContact O-N 3.49Å; I403-S407 PolarHBondContact O-OG 3.43Å; I403-I422 HydrophobicContact CD1-CG1 4.26Å; I403-I422 HydrophobicContact CD1-CG2 4.26Å; I403-A425 HydrophobicContact CD1-CB 3.79Å; I403-L444 HydrophobicContact CG2-CD1 4.3Å; I403-Y482 HydrophobicContact CG2-CD2 3.91Å; I403-Y482 HydrophobicContact CG2-CG 4.14Å; I403-L486 HydrophobicContact CB-CD1 4.19Å
404	G	97.4	Very high	89.6	Confident	1 Å²	1	51.9 Å²	51.9	1%	0.01	24%	0.242	C	C	.	.	H	α-helix	trans	-62.6	-50.4	-164.6	0	0	0	0	0	113.7	I400 S407 R408 F548	I400-G404 VanDerWaalsContact O-CA 3.24Å; I400-G404 WeakPolarHBondContact O-CA 3.01Å; I400-G404 PolarHBondContact O-N 3.3Å; G404-S407 WeakPolarHBondContact O-CB 3.41Å; G404-S407 PolarHBondContact O-N 3.32Å; G404-R408 PolarHBondContact O-N 3.49Å; G404-F548 VanDerWaalsContact O-CD1 3.31Å; G404-F548 WeakPolarHBondContact O-CD1 3.24Å
405	E	97.5	Very high	91.4	Very high	68 Å²	68	49.6 Å²	49.6	32%	0.318	24%	0.239	S	C	.	.	H	α-helix	trans	-68.7	-40	-180	-64.8	-68.6	-174.3	0	0	112.2	S407 R408 E409 K552	E405-S407 VanDerWaalsContact C-N 3.31Å; E405-S407 PolarHBondContact O-N 3.04Å; E405-R408 VanDerWaalsContact CD-NH1 3.26Å; E405-R408 WeakPolarHBondContact O-CB 3.37Å; E405-R408 PolarHBondContact O-N 3.4Å; E405-R408 IonicContact OE1-NH1 3.08Å; E405-R408 PolarHBondContact OE1-NH1 3.01Å; E405-R408 VanDerWaalsContact OE1-NH1 3.08Å; E405-R408 IonicContact OE2-CZ 3.7Å; E405-R408 IonicContact OE2-NH1 2.75Å; E405-R408 PolarHBondContact OE2-NH1 3.32Å; E405-E409 PolarHBondContact O-N 2.86Å; E405-K552 IonicContact OE1-NZ 3.17Å; E405-K552 PolarHBondContact OE1-NZ 3.12Å; E405-K552 IonicContact OE2-NZ 3.35Å
406	T	98.1	Very high	92.9	Very high	42 Å²	42	49.4 Å²	49.4	26%	0.258	24%	0.238	S	C	.	.	H	α-helix	trans	-62.6	-40.5	173.2	-53.6	0	0	0	0	111.3	I403 E409 I410 K483 L486	I403-T406 PolarHBondContact O-N 3.12Å; T406-E409 PolarHBondContact O-N 3.29Å; T406-I410 HydrophobicContact CG2-CD1 3.84Å; T406-I410 WeakPolarHBondContact O-CD1 3.43Å; T406-I410 VanDerWaalsContact O-CG1 3.26Å; T406-I410 WeakPolarHBondContact O-CG1 3.17Å; T406-I410 PolarHBondContact O-N 2.9Å; T406-K483 HydrophobicContact CG2-CB 4.26Å; T406-K483 HydrophobicContact CG2-CG 4.04Å; T406-L486 HydrophobicContact CG2-CD1 3.84Å
407	S	98.4	Very high	94.1	Very high	0 Å²	0	50.4 Å²	50.4	0%	0	24%	0.242	C	C	.	.	H	α-helix	trans	-64.8	-40.4	175.7	-57.2	0	0	0	0	111.2	I403 G404 E405 I410 G411 S418 L486	I403-S407 VanDerWaalsContact O-CB 3.26Å; I403-S407 WeakPolarHBondContact O-CB 3.19Å; I403-S407 PolarHBondContact O-N 3.49Å; I403-S407 PolarHBondContact O-OG 3.43Å; G404-S407 WeakPolarHBondContact O-CB 3.41Å; G404-S407 PolarHBondContact O-N 3.32Å; E405-S407 VanDerWaalsContact C-N 3.31Å; E405-S407 PolarHBondContact O-N 3.04Å; S407-I410 PolarHBondContact O-N 2.83Å; S407-G411 PolarHBondContact O-N 3.27Å; S407-S418 PolarHBondContact O-OG 3.47Å; S407-L486 WeakPolarHBondContact OG-CD2 3.44Å
408	R	98.2	Very high	95.1	Very high	20 Å²	20	47.6 Å²	47.6	8%	0.075	23%	0.227	C	C	.	.	H	α-helix	trans	-56.9	-53.5	174.3	177.7	-175.7	-83.7	149.7	-2.2	110.9	G404 E405 I410 G411 Q412 S418 E547 F548 H550	G404-R408 PolarHBondContact O-N 3.49Å; E405-R408 VanDerWaalsContact CD-NH1 3.26Å; E405-R408 WeakPolarHBondContact O-CB 3.37Å; E405-R408 PolarHBondContact O-N 3.4Å; E405-R408 IonicContact OE1-NH1 3.08Å; E405-R408 PolarHBondContact OE1-NH1 3.01Å; E405-R408 VanDerWaalsContact OE1-NH1 3.08Å; E405-R408 IonicContact OE2-CZ 3.7Å; E405-R408 IonicContact OE2-NH1 2.75Å; E405-R408 PolarHBondContact OE2-NH1 3.32Å; R408-I410 VanDerWaalsContact C-N 3.35Å; R408-I410 PolarHBondContact O-N 3.37Å; R408-G411 PolarHBondContact O-N 2.89Å; R408-Q412 WeakPolarHBondContact O-CG 3.22Å; R408-Q412 PolarHBondContact O-N 3.21Å; R408-S418 WeakPolarHBondContact CA-OG 3.36Å; R408-E547 PolarHBondContact NH2-O 3.48Å; R408-E547 IonicContact NH2-OE2 2.75Å; R408-F548 HydrophobicContact CB-CB 4.38Å; R408-F548 HydrophobicContact CB-CD1 4.18Å; R408-H550 WeakPolarHBondContact CD-O 3.31Å; R408-H550 WeakPolarHBondContact CG-O 3.4Å; R408-H550 PolarHBondContact NE-O 2.94Å
409	E	98	Very high	96.2	Very high	137 Å²	137	44.5 Å²	44.5	64%	0.64	21%	0.212	S	C	*	.	H	α-helix	trans	-57.6	-46.8	179.6	-70.8	175.2	-168.4	0	0	112.1	E405 T406 K413	E405-E409 PolarHBondContact O-N 2.86Å; T406-E409 PolarHBondContact O-N 3.29Å; E409-K413 VanDerWaalsContact O-CB 3.29Å; E409-K413 WeakPolarHBondContact O-CB 3.17Å; E409-K413 PolarHBondContact O-N 3.22Å
410	I	98.3	Very high	96.9	Very high	12 Å²	12	44.4 Å²	44.4	6%	0.062	21%	0.212	C	C	.	.	H	α-helix	trans	-66.6	-43.3	179.6	-66.4	167.2	0	0	0	110.8	T406 S407 R408 K413 N414 M421 L486 E487 A490	T406-I410 HydrophobicContact CG2-CD1 3.84Å; T406-I410 WeakPolarHBondContact O-CD1 3.43Å; T406-I410 VanDerWaalsContact O-CG1 3.26Å; T406-I410 WeakPolarHBondContact O-CG1 3.17Å; T406-I410 PolarHBondContact O-N 2.9Å; S407-I410 PolarHBondContact O-N 2.83Å; R408-I410 VanDerWaalsContact C-N 3.35Å; R408-I410 PolarHBondContact O-N 3.37Å; I410-K413 PolarHBondContact O-N 3.36Å; I410-N414 WeakPolarHBondContact O-CB 2.96Å; I410-N414 PolarHBondContact O-N 3.49Å; I410-N414 PolarHBondContact O-ND2 3.05Å; I410-M421 HydrophobicContact CG2-CE 3.95Å; I410-L486 HydrophobicContact CD1-CB 3.46Å; I410-L486 VanDerWaalsContact CD1-CB 3.46Å; I410-L486 HydrophobicContact CD1-CD1 4.44Å; I410-E487 HydrophobicContact CD1-CG 3.68Å; I410-E487 HydrophobicContact CG1-CG 4.13Å; I410-A490 HydrophobicContact CG2-CB 3.49Å; I410-A490 VanDerWaalsContact CG2-CB 3.49Å
411	G	98.1	Very high	97.3	Very high	0 Å²	0	43.7 Å²	43.7	0%	0	21%	0.209	C	C	.	.	H	α-helix	trans	-60.5	-47.6	178.7	0	0	0	0	0	112	S407 R408 K413 N414 G415 I416	S407-G411 PolarHBondContact O-N 3.27Å; R408-G411 PolarHBondContact O-N 2.89Å; G411-K413 PolarHBondContact O-N 3.38Å; G411-N414 PolarHBondContact O-N 2.92Å; G411-G415 PolarHBondContact O-N 2.85Å; G411-I416 CarbonylContact C-O 3.58Å; G411-I416 WeakPolarHBondContact CA-O 3.28Å; G411-I416 PolarHBondContact O-N 2.87Å; G411-I416 VanDerWaalsContact O-N 3.13Å
412	Q	97.3	Very high	97.7	Very high	70 Å²	70	36.8 Å²	36.8	33%	0.327	18%	0.178	S	C	.	.	H	α-helix	trans	-61	-46	175.6	-65.5	-41.2	-72.9	0	0	111.7	R408 N414 D549	R408-Q412 WeakPolarHBondContact O-CG 3.22Å; R408-Q412 PolarHBondContact O-N 3.21Å; Q412-N414 PolarHBondContact O-N 3.37Å; Q412-D549 PolarHBondContact NE2-O 2.94Å
413	K	97.9	Very high	97.9	Very high	174 Å²	174	30 Å²	30	76%	0.757	15%	0.149	S	C	*	.	H	α-helix	trans	-61.6	-30.4	-179.5	-179.4	176.6	177.6	179.5	0	113.3	E409 I410 G411	E409-K413 VanDerWaalsContact O-CB 3.29Å; E409-K413 WeakPolarHBondContact O-CB 3.17Å; E409-K413 PolarHBondContact O-N 3.22Å; I410-K413 PolarHBondContact O-N 3.36Å; G411-K413 PolarHBondContact O-N 3.38Å
414	N	98.1	Very high	97.8	Very high	46 Å²	46	29.9 Å²	29.9	25%	0.246	15%	0.149	C	C	.	.	H	α-helix	trans	-107.4	-5.5	-173	-68.4	-83.6	0	0	0	114	I410 G411 Q412 I416 A490 K494	I410-N414 WeakPolarHBondContact O-CB 2.96Å; I410-N414 PolarHBondContact O-N 3.49Å; I410-N414 PolarHBondContact O-ND2 3.05Å; G411-N414 PolarHBondContact O-N 2.92Å; Q412-N414 PolarHBondContact O-N 3.37Å; N414-I416 HydrophobicContact CB-CD1 4.29Å; N414-I416 HydrophobicContact CB-CG1 4.22Å; N414-A490 HydrophobicContact CB-CB 4.37Å; N414-K494 HydrophobicContact CB-CG 4.1Å; N414-K494 VanDerWaalsContact O-CD 3.24Å; N414-K494 WeakPolarHBondContact O-CD 3.1Å; N414-K494 WeakPolarHBondContact O-CE 3.47Å
415	G	97.4	Very high	97.7	Very high	29 Å²	29	29.9 Å²	29.9	30%	0.299	15%	0.148	S	C	.	.	T	Hydrogen-bonded Turn	trans	68.3	38.8	-177.6	0	0	0	0	0	113.1	G411 K509	G411-G415 PolarHBondContact O-N 2.85Å; G415-K509 PolarHBondContact O-N 2.79Å
416	I	98.2	Very high	97.1	Very high	4 Å²	4	26.6 Å²	26.6	2%	0.021	13%	0.133	C	C	.	.	S	Bend	trans	-124.6	156.8	177.6	62.4	-179.1	0	0	0	110.3	G411 N414 S418 M421 Y489 A490 I493 K494	G411-I416 CarbonylContact C-O 3.58Å; G411-I416 WeakPolarHBondContact CA-O 3.28Å; G411-I416 PolarHBondContact O-N 2.87Å; G411-I416 VanDerWaalsContact O-N 3.13Å; N414-I416 HydrophobicContact CB-CD1 4.29Å; N414-I416 HydrophobicContact CB-CG1 4.22Å; I416-S418 PolarHBondContact O-N 2.94Å; I416-M421 HydrophobicContact CD1-CE 3.45Å; I416-M421 VanDerWaalsContact CD1-CE 3.45Å; I416-M421 HydrophobicContact CG1-CE 4.06Å; I416-Y489 HydrophobicContact CD1-CE1 4.2Å; I416-A490 HydrophobicContact CD1-CB 3.71Å; I416-I493 HydrophobicContact CG2-CG2 3.83Å; I416-K494 HydrophobicContact CG2-CD 3.81Å; I416-K494 HydrophobicContact CG2-CG 4.28Å
417	Y	98.6	Very high	96.5	Very high	21 Å²	21	25.4 Å²	25.4	8%	0.082	13%	0.125	C	C	.	.			trans	-72.7	116.7	177.9	-65.3	-84.3	0	0	0	110.8	S419 V420 M421 K509 T512 S514 A518 D549	Y417-S419 VanDerWaalsContact C-N 3.25Å; Y417-V420 HydrophobicContact CG-CG2 4.22Å; Y417-V420 PolarHBondContact O-N 3.19Å; Y417-M421 PolarHBondContact O-N 2.87Å; Y417-M421 VanDerWaalsContact O-N 3.09Å; Y417-K509 HydrophobicContact CD1-CD 4.43Å; Y417-K509 HydrophobicContact CD1-CG 4.06Å; Y417-K509 HydrophobicContact CD2-CG 3.84Å; Y417-K509 HydrophobicContact CE1-CD 4.5Å; Y417-K509 HydrophobicContact CE1-CG 3.95Å; Y417-K509 HydrophobicContact CE2-CB 4.29Å; Y417-K509 HydrophobicContact CE2-CG 3.71Å; Y417-K509 HydrophobicContact CG-CG 4Å; Y417-T512 WeakPolarHBondContact CE2-OG1 3.47Å; Y417-T512 PolarHBondContact OH-OG1 2.95Å; Y417-S514 VanDerWaalsContact CZ-C 3.46Å; Y417-S514 VanDerWaalsContact OH-C 3.29Å; Y417-S514 WeakPolarHBondContact OH-CA 3.47Å; Y417-A518 HydrophobicContact CD2-CB 3.74Å; Y417-A518 HydrophobicContact CE2-CB 3.89Å; Y417-D549 WeakPolarHBondContact CA-OD1 3.39Å; Y417-D549 HydrophobicContact CD1-CB 4.36Å
418	S	98.5	Very high	95.8	Very high	0 Å²	0	28.1 Å²	28.1	0%	0	14%	0.138	C	C	.	.	H	α-helix	trans	-66.3	-33.4	172.8	-43	0	0	0	0	110.6	S407 R408 I416 V420 M421 I422 F548 D549	S407-S418 PolarHBondContact O-OG 3.47Å; R408-S418 WeakPolarHBondContact CA-OG 3.36Å; I416-S418 PolarHBondContact O-N 2.94Å; S418-V420 VanDerWaalsContact C-N 3.34Å; S418-V420 PolarHBondContact O-N 2.91Å; S418-M421 PolarHBondContact O-N 3.14Å; S418-I422 WeakPolarHBondContact O-CB 3.46Å; S418-I422 WeakPolarHBondContact O-CD1 3.43Å; S418-I422 WeakPolarHBondContact O-CG1 3.27Å; S418-I422 PolarHBondContact O-N 2.87Å; S418-F548 WeakPolarHBondContact CB-O 3.16Å; S418-F548 PolarHBondContact OG-O 2.74Å; S418-D549 PolarHBondContact N-OD1 3.31Å
419	S	98.5	Very high	94.9	Very high	0 Å²	0	27.2 Å²	27.2	0%	0	13%	0.134	C	C	.	.	H	α-helix	trans	-58.3	-46.4	175.4	60.9	0	0	0	0	111.5	Y417 I422 A423 L545 D549	Y417-S419 VanDerWaalsContact C-N 3.25Å; S419-I422 PolarHBondContact O-N 3.01Å; S419-A423 VanDerWaalsContact O-CB 3.24Å; S419-A423 WeakPolarHBondContact O-CB 3.23Å; S419-A423 PolarHBondContact O-N 3.09Å; S419-L545 WeakPolarHBondContact CB-O 3.29Å; S419-D549 WeakPolarHBondContact CB-OD1 3.4Å; S419-D549 WeakPolarHBondContact CB-OD2 3.45Å; S419-D549 PolarHBondContact N-OD1 3.45Å; S419-D549 PolarHBondContact OG-OD1 3.05Å; S419-D549 VanDerWaalsContact OG-OD1 3.05Å; S419-D549 PolarHBondContact OG-OD2 3.4Å
420	V	98.5	Very high	93.7	Very high	4 Å²	4	20.7 Å²	20.7	2%	0.024	10%	0.103	C	C	.	.	H	α-helix	trans	-65.6	-45.1	176.2	179.7	0	0	0	0	110.9	Y417 S418 I422 A423 Q424 A518 T519 L522 L536 I540	Y417-V420 HydrophobicContact CG-CG2 4.22Å; Y417-V420 PolarHBondContact O-N 3.19Å; S418-V420 VanDerWaalsContact C-N 3.34Å; S418-V420 PolarHBondContact O-N 2.91Å; V420-I422 PolarHBondContact O-N 3.46Å; V420-A423 PolarHBondContact O-N 2.98Å; V420-Q424 HydrophobicContact CG1-CG 4.42Å; V420-Q424 WeakPolarHBondContact O-CB 3.25Å; V420-Q424 WeakPolarHBondContact O-CG 3.49Å; V420-Q424 PolarHBondContact O-N 3.43Å; V420-A518 HydrophobicContact CG2-CB 4.44Å; V420-T519 HydrophobicContact CG1-CG2 4.24Å; V420-T519 HydrophobicContact CG2-CG2 3.88Å; V420-L522 HydrophobicContact CG1-CD1 3.44Å; V420-L522 VanDerWaalsContact CG1-CD1 3.44Å; V420-L536 HydrophobicContact CG1-CD1 4.5Å; V420-I540 HydrophobicContact CG2-CD1 4Å
421	M	98.7	Very high	92.9	Very high	0 Å²	0	20.2 Å²	20.2	0%	0	10%	0.102	C	C	.	.	H	α-helix	trans	-57.2	-47.5	175.9	-178.7	-172.8	-50.7	0	0	112.1	I410 I416 Y417 S418 A425 F445 L486 Y489	I410-M421 HydrophobicContact CG2-CE 3.95Å; I416-M421 HydrophobicContact CD1-CE 3.45Å; I416-M421 VanDerWaalsContact CD1-CE 3.45Å; I416-M421 HydrophobicContact CG1-CE 4.06Å; Y417-M421 PolarHBondContact O-N 2.87Å; Y417-M421 VanDerWaalsContact O-N 3.09Å; S418-M421 PolarHBondContact O-N 3.14Å; M421-A425 WeakPolarHBondContact O-CB 3.45Å; M421-A425 PolarHBondContact O-N 2.9Å; M421-F445 HydrophobicContact CG-CE1 4.4Å; M421-F445 HydrophobicContact CG-CZ 3.87Å; M421-L486 HydrophobicContact CG-CD2 3.98Å; M421-L486 HydrophobicContact SD-CB 4.17Å; M421-L486 HydrophobicContact SD-CD2 3.61Å; M421-L486 HydrophobicContact SD-CG 4.46Å; M421-Y489 HydrophobicContact CB-CD1 4.3Å; M421-Y489 HydrophobicContact CB-CE1 3.73Å; M421-Y489 HydrophobicContact CE-CD1 3.82Å; M421-Y489 HydrophobicContact CE-CE1 3.88Å; M421-Y489 HydrophobicContact CG-CD1 3.62Å; M421-Y489 HydrophobicContact CG-CE1 3.57Å; M421-Y489 HydrophobicContact CG-CG 4.47Å; M421-Y489 HydrophobicContact SD-CD1 4.08Å; M421-Y489 HydrophobicContact SD-CE1 4.38Å
422	I	98.1	Very high	92.1	Very high	0 Å²	0	20.5 Å²	20.5	0%	0	10%	0.104	C	C	.	.	H	α-helix	trans	-66.5	-42.2	178.7	-65.7	162.7	0	0	0	110.1	I400 I403 S418 S419 V420 A425 I426 L545 F548	I400-I422 HydrophobicContact CG1-CG2 4.02Å; I403-I422 HydrophobicContact CD1-CG1 4.26Å; I403-I422 HydrophobicContact CD1-CG2 4.26Å; S418-I422 WeakPolarHBondContact O-CB 3.46Å; S418-I422 WeakPolarHBondContact O-CD1 3.43Å; S418-I422 WeakPolarHBondContact O-CG1 3.27Å; S418-I422 PolarHBondContact O-N 2.87Å; S419-I422 PolarHBondContact O-N 3.01Å; V420-I422 PolarHBondContact O-N 3.46Å; I422-A425 WeakPolarHBondContact O-CB 3.31Å; I422-A425 PolarHBondContact O-N 3.09Å; I422-I426 HydrophobicContact CG2-CD1 3.86Å; I422-I426 HydrophobicContact CG2-CG1 4.44Å; I422-I426 VanDerWaalsContact O-CG1 3.28Å; I422-I426 WeakPolarHBondContact O-CG1 3.42Å; I422-I426 PolarHBondContact O-N 3.09Å; I422-L545 HydrophobicContact CB-CD1 4.13Å; I422-L545 HydrophobicContact CG2-CD1 3.76Å; I422-L545 HydrophobicContact CG2-CD2 3.97Å; I422-F548 HydrophobicContact CD1-CB 3.87Å; I422-F548 HydrophobicContact CD1-CD1 4.26Å; I422-F548 HydrophobicContact CD1-CD2 3.61Å; I422-F548 HydrophobicContact CD1-CE2 4.23Å; I422-F548 HydrophobicContact CD1-CG 3.64Å
423	A	95.4	Very high	90.7	Very high	0 Å²	0	18.7 Å²	18.7	0%	0	10%	0.097	C	C	.	.	H	α-helix	trans	-64.1	-42.3	178.8	0	0	0	0	0	112.5	S419 V420 I426 L427 L536 I539 I540 L545	S419-A423 VanDerWaalsContact O-CB 3.24Å; S419-A423 WeakPolarHBondContact O-CB 3.23Å; S419-A423 PolarHBondContact O-N 3.09Å; V420-A423 PolarHBondContact O-N 2.98Å; A423-I426 PolarHBondContact O-N 3.48Å; A423-L427 WeakPolarHBondContact O-CB 3.47Å; A423-L427 PolarHBondContact O-N 3.06Å; A423-L536 HydrophobicContact CB-CD2 3.93Å; A423-I539 HydrophobicContact CB-CB 4.07Å; A423-I539 HydrophobicContact CB-CG2 3.78Å; A423-I540 HydrophobicContact CB-CD1 4.18Å; A423-I540 HydrophobicContact CB-CG1 3.69Å; A423-L545 HydrophobicContact CB-CD1 4.19Å
424	Q	94.5	Very high	89.5	Confident	0 Å²	0	10.8 Å²	10.8	0%	0	6%	0.063	C	C	.	.	H	α-helix	trans	-64.6	-43.9	172.4	-71	-173.7	-93.7	0	0	110.6	V420 I426 L427 E428 F445 Y489 L522 Y526 Y532 L536	V420-Q424 HydrophobicContact CG1-CG 4.42Å; V420-Q424 WeakPolarHBondContact O-CB 3.25Å; V420-Q424 WeakPolarHBondContact O-CG 3.49Å; V420-Q424 PolarHBondContact O-N 3.43Å; Q424-I426 VanDerWaalsContact C-N 3.31Å; Q424-I426 PolarHBondContact O-N 3.35Å; Q424-L427 PolarHBondContact O-N 3.17Å; Q424-E428 VanDerWaalsContact O-CB 3.27Å; Q424-E428 WeakPolarHBondContact O-CB 3.4Å; Q424-E428 WeakPolarHBondContact O-CG 3.3Å; Q424-E428 PolarHBondContact O-N 3.27Å; Q424-F445 HydrophobicContact CB-CD1 4.47Å; Q424-F445 HydrophobicContact CB-CE1 4.28Å; Q424-Y489 PolarHBondContact OE1-OH 2.79Å; Q424-L522 VanDerWaalsContact OE1-CD1 3.3Å; Q424-Y526 VanDerWaalsContact NE2-CD1 3.31Å; Q424-Y526 VanDerWaalsContact NE2-CG 3.32Å; Q424-Y532 HydrophobicContact CG-CE1 4.44Å; Q424-Y532 WeakPolarHBondContact CG-OH 3.21Å; Q424-Y532 PolarHBondContact NE2-OH 3.5Å; Q424-L536 HydrophobicContact CB-CD2 4.41Å; Q424-L536 HydrophobicContact CG-CD1 3.75Å; Q424-L536 HydrophobicContact CG-CD2 3.66Å; Q424-L536 HydrophobicContact CG-CG 4.38Å
425	A	95	Very high	88.5	Confident	0 Å²	0	11 Å²	11	0%	0	7%	0.068	C	C	.	.	H	α-helix	trans	-56.2	-46.8	174.7	0	0	0	0	0	111	F399 I403 M421 I422 L427 S429 L444 F445	F399-A425 HydrophobicContact CE1-CB 3.97Å; F399-A425 HydrophobicContact CZ-CB 4.12Å; I403-A425 HydrophobicContact CD1-CB 3.79Å; M421-A425 WeakPolarHBondContact O-CB 3.45Å; M421-A425 PolarHBondContact O-N 2.9Å; I422-A425 WeakPolarHBondContact O-CB 3.31Å; I422-A425 PolarHBondContact O-N 3.09Å; A425-L427 PolarHBondContact O-N 2.91Å; A425-S429 VanDerWaalsContact O-CB 3.27Å; A425-S429 WeakPolarHBondContact O-CB 3.45Å; A425-S429 PolarHBondContact O-N 3.34Å; A425-S429 PolarHBondContact O-OG 3.36Å; A425-L444 HydrophobicContact CB-CB 4.29Å; A425-L444 HydrophobicContact CB-CD1 4.19Å; A425-F445 HydrophobicContact CB-CE1 3.88Å; A425-F445 HydrophobicContact CB-CZ 3.98Å
426	I	86.4	Confident	87.7	Confident	0 Å²	0	10.3 Å²	10.3	0%	0	6%	0.058	C	C	.	.	H	α-helix	trans	-57.3	-50.2	176.1	-71.3	163.7	0	0	0	111.2	F390 T396 F399 I400 I422 A423 Q424 G430 S431 I539 L545	F390-I426 HydrophobicContact CE2-CG2 4.39Å; F390-I426 HydrophobicContact CZ-CG2 4.24Å; T396-I426 HydrophobicContact CG2-CD1 3.59Å; T396-I426 HydrophobicContact CG2-CG1 3.86Å; T396-I426 HydrophobicContact CG2-CG2 4.1Å; F399-I426 HydrophobicContact CD1-CG1 3.84Å; F399-I426 HydrophobicContact CE1-CG1 4.02Å; I400-I426 HydrophobicContact CD1-CD1 3.97Å; I400-I426 HydrophobicContact CG1-CD1 3.86Å; I422-I426 HydrophobicContact CG2-CD1 3.86Å; I422-I426 HydrophobicContact CG2-CG1 4.44Å; I422-I426 VanDerWaalsContact O-CG1 3.28Å; I422-I426 WeakPolarHBondContact O-CG1 3.42Å; I422-I426 PolarHBondContact O-N 3.09Å; A423-I426 PolarHBondContact O-N 3.48Å; Q424-I426 VanDerWaalsContact C-N 3.31Å; Q424-I426 PolarHBondContact O-N 3.35Å; I426-G430 CarbonylContact O-C 3.59Å; I426-G430 WeakPolarHBondContact O-CA 3.36Å; I426-G430 PolarHBondContact O-N 3.16Å; I426-G430 VanDerWaalsContact O-N 3.08Å; I426-S431 PolarHBondContact O-N 2.77Å; I426-I539 HydrophobicContact CB-CG2 4.35Å; I426-I539 HydrophobicContact CD1-CG2 3.7Å; I426-I539 HydrophobicContact CG2-CD1 4.21Å; I426-I539 HydrophobicContact CG2-CG2 4.24Å; I426-L545 HydrophobicContact CD1-CD1 4.3Å
427	L	84	Confident	87.1	Confident	17 Å²	17	10.1 Å²	10.1	9%	0.089	6%	0.057	C	C	.	.	H	α-helix	trans	-68.4	-48.4	-175	-177.3	58.9	0	0	0	112.5	W265 A423 Q424 A425 Y532 K535 L536 I539	W265-L427 HydrophobicContact CB-CD1 4.18Å; A423-L427 WeakPolarHBondContact O-CB 3.47Å; A423-L427 PolarHBondContact O-N 3.06Å; Q424-L427 PolarHBondContact O-N 3.17Å; A425-L427 PolarHBondContact O-N 2.91Å; L427-Y532 HydrophobicContact CD2-CD2 3.89Å; L427-Y532 HydrophobicContact CD2-CE2 3.49Å; L427-Y532 VanDerWaalsContact CD2-CE2 3.49Å; L427-K535 HydrophobicContact CD2-CB 4.14Å; L427-K535 HydrophobicContact CD2-CD 4.49Å; L427-L536 HydrophobicContact CB-CD2 4.43Å; L427-L536 HydrophobicContact CD2-CD2 3.89Å; L427-I539 HydrophobicContact CB-CD1 3.94Å
428	E	83.5	Confident	86.2	Confident	57 Å²	57	10.9 Å²	10.9	27%	0.266	7%	0.065	S	C	.	.	H	α-helix	trans	-75	-33.3	-173.7	-60.9	-52.9	152.3	0	0	112.7	Q424 L444 Y526 Y532	Q424-E428 VanDerWaalsContact O-CB 3.27Å; Q424-E428 WeakPolarHBondContact O-CB 3.4Å; Q424-E428 WeakPolarHBondContact O-CG 3.3Å; Q424-E428 PolarHBondContact O-N 3.27Å; E428-L444 WeakPolarHBondContact CB-O 3.48Å; E428-Y526 HydrophobicContact CG-CE1 4.18Å; E428-Y532 WeakPolarHBondContact OE1-CE2 3.4Å; E428-Y532 VanDerWaalsContact OE1-CZ 3.29Å; E428-Y532 PolarHBondContact OE1-OH 3.21Å
429	S	81	Confident	85.5	Confident	0 Å²	0	17.8 Å²	17.8	0%	0	10%	0.098	C	C	.	.	H	α-helix	trans	-98.5	-6.5	-178.5	70	0	0	0	0	114.2	A425 S431 G432 N433 S434	A425-S429 VanDerWaalsContact O-CB 3.27Å; A425-S429 WeakPolarHBondContact O-CB 3.45Å; A425-S429 PolarHBondContact O-N 3.34Å; A425-S429 PolarHBondContact O-OG 3.36Å; S429-S431 PolarHBondContact OG-N 3.26Å; S429-G432 PolarHBondContact O-N 3.22Å; S429-G432 WeakPolarHBondContact OG-CA 3.28Å; S429-G432 PolarHBondContact OG-N 3.17Å; S429-N433 PolarHBondContact O-N 3.47Å; S429-N433 VanDerWaalsContact O-N 3.1Å; S429-S434 WeakPolarHBondContact O-CB 3.46Å; S429-S434 PolarHBondContact O-N 3.08Å
430	G	72.8	Confident	85.1	Confident	0 Å²	0	21.1 Å²	21.1	0%	0	12%	0.119	C	C	.	.	T	Hydrogen-bonded Turn	trans	55.6	57.2	-164.1	0	0	0	0	0	112.1	W265 I426 G432 N433	W265-G430 VanDerWaalsContact CH2-C 3.47Å; W265-G430 WeakPolarHBondContact CH2-O 3.32Å; W265-G430 WeakPolarHBondContact CZ3-O 3.41Å; I426-G430 CarbonylContact O-C 3.59Å; I426-G430 WeakPolarHBondContact O-CA 3.36Å; I426-G430 PolarHBondContact O-N 3.16Å; I426-G430 VanDerWaalsContact O-N 3.08Å; G430-G432 VanDerWaalsContact C-N 3.25Å; G430-G432 PolarHBondContact O-N 2.88Å; G430-N433 VanDerWaalsContact O-CB 3.28Å; G430-N433 WeakPolarHBondContact O-CB 3.07Å; G430-N433 VanDerWaalsContact O-CG 3.27Å; G430-N433 PolarHBondContact O-N 2.88Å; G430-N433 PolarHBondContact O-ND2 3.08Å
431	S	81.3	Confident	84.8	Confident	3 Å²	3	21.6 Å²	21.6	2%	0.021	12%	0.122	C	C	.	.	T	Hydrogen-bonded Turn	trans	53	38.4	-175.2	-63.3	0	0	0	0	114.3	W265 T396 F399 I426 S429	W265-S431 VanDerWaalsContact CH2-CB 3.49Å; W265-S431 WeakPolarHBondContact CH2-OG 3.4Å; W265-S431 WeakPolarHBondContact CZ2-OG 3.24Å; T396-S431 WeakPolarHBondContact CB-OG 3.18Å; T396-S431 WeakPolarHBondContact CG2-OG 3.49Å; T396-S431 PolarHBondContact OG1-OG 2.8Å; F399-S431 WeakPolarHBondContact CB-O 3.12Å; F399-S431 VanDerWaalsContact CD2-C 3.45Å; F399-S431 WeakPolarHBondContact CD2-O 3.45Å; F399-S431 VanDerWaalsContact CG-C 3.46Å; F399-S431 VanDerWaalsContact CG-O 3.25Å; F399-S431 WeakPolarHBondContact CG-O 3.26Å; I426-S431 PolarHBondContact O-N 2.77Å; S429-S431 PolarHBondContact OG-N 3.26Å
432	G	80.6	Confident	84.7	Confident	5 Å²	5	24 Å²	24	5%	0.052	13%	0.131	C	C	.	.	T	Hydrogen-bonded Turn	trans	84	6.6	177.2	0	0	0	0	0	114.8	S429 G430	S429-G432 PolarHBondContact O-N 3.22Å; S429-G432 WeakPolarHBondContact OG-CA 3.28Å; S429-G432 PolarHBondContact OG-N 3.17Å; G430-G432 VanDerWaalsContact C-N 3.25Å; G430-G432 PolarHBondContact O-N 2.88Å
433	N	67.2	Low	84.5	Confident	32 Å²	32	24 Å²	24	17%	0.171	13%	0.131	C	C	.	.	T	Hydrogen-bonded Turn	trans	-89.5	-16	-172.4	-59.4	-42.6	0	0	0	113.8	T326 T395 S429 G430	T326-N433 WeakPolarHBondContact CA-OD1 3.46Å; T326-N433 WeakPolarHBondContact CB-OD1 3.18Å; T326-N433 WeakPolarHBondContact CG2-OD1 3.49Å; T326-N433 WeakPolarHBondContact O-CB 3.16Å; T326-N433 PolarHBondContact O-ND2 3.26Å; T395-N433 WeakPolarHBondContact CG2-ND2 3.16Å; S429-N433 PolarHBondContact O-N 3.47Å; S429-N433 VanDerWaalsContact O-N 3.1Å; G430-N433 VanDerWaalsContact O-CB 3.28Å; G430-N433 WeakPolarHBondContact O-CB 3.07Å; G430-N433 VanDerWaalsContact O-CG 3.27Å; G430-N433 PolarHBondContact O-N 2.88Å; G430-N433 PolarHBondContact O-ND2 3.08Å
434	S	73.5	Confident	84.4	Confident	8 Å²	8	24 Å²	24	6%	0.056	13%	0.131	C	C	.	.	S	Bend	trans	-61.3	147	174.5	80.3	0	0	0	0	110.8	S429 L436 A437 S438	S429-S434 WeakPolarHBondContact O-CB 3.46Å; S429-S434 PolarHBondContact O-N 3.08Å; S434-L436 PolarHBondContact O-N 3.45Å; S434-A437 PolarHBondContact O-N 2.94Å; S434-A437 WeakPolarHBondContact OG-CB 3.27Å; S434-A437 PolarHBondContact OG-N 3.02Å; S434-S438 WeakPolarHBondContact O-CB 3.43Å; S434-S438 PolarHBondContact O-N 2.89Å; S434-S438 PolarHBondContact O-OG 3.25Å
435	S	76.5	Confident	84.4	Confident	50 Å²	50	24.4 Å²	24.4	35%	0.35	13%	0.133	S	C	.	.	T	Hydrogen-bonded Turn	trans	-59.9	-27.4	177.8	-57.4	0	0	0	0	112.6	Q342 S438 N441	Q342-S435 PolarHBondContact OE1-OG 3.07Å; S435-S438 WeakPolarHBondContact CA-OG 2.99Å; S435-N441 PolarHBondContact O-ND2 3.34Å
436	L	81.8	Confident	84.1	Confident	16 Å²	16	25.9 Å²	25.9	8%	0.084	15%	0.148	C	C	.	.	T	Hydrogen-bonded Turn	trans	-77.8	-34.1	175.8	178.4	58.9	0	0	0	112.2	S434 N441 N443 V456 F458 F476	S434-L436 PolarHBondContact O-N 3.45Å; L436-N441 HydrophobicContact CD1-CB 4.47Å; L436-N441 WeakPolarHBondContact O-CB 3.5Å; L436-N443 HydrophobicContact CD1-CB 3.83Å; L436-N443 HydrophobicContact CG-CB 3.91Å; L436-N443 PolarHBondContact O-N 3.35Å; L436-V456 HydrophobicContact CD1-CG1 3.74Å; L436-F458 HydrophobicContact CB-CD2 4.31Å; L436-F458 HydrophobicContact CB-CE2 4.03Å; L436-F458 HydrophobicContact CB-CZ 4.21Å; L436-F458 HydrophobicContact CD1-CD2 3.85Å; L436-F458 HydrophobicContact CD1-CE2 3.7Å; L436-F458 HydrophobicContact CG-CE2 4.45Å; L436-F476 HydrophobicContact CD1-CB 3.52Å; L436-F476 HydrophobicContact CD1-CG 4.03Å; L436-F476 HydrophobicContact CD2-CB 3.95Å; L436-F476 HydrophobicContact CD2-CD1 3.61Å; L436-F476 HydrophobicContact CD2-CD2 4.1Å; L436-F476 HydrophobicContact CD2-CE1 4.14Å; L436-F476 HydrophobicContact CD2-CG 3.6Å; L436-F476 HydrophobicContact CG-CB 4.4Å
437	A	84.4	Confident	84.4	Confident	0 Å²	0	26.7 Å²	26.7	0%	0	15%	0.152	C	C	.	.	T	Hydrogen-bonded Turn	trans	-85	-31.5	179.5	0	0	0	0	0	113.4	S434 Y442 N443 L444 Y482	S434-A437 PolarHBondContact O-N 2.94Å; S434-A437 WeakPolarHBondContact OG-CB 3.27Å; S434-A437 PolarHBondContact OG-N 3.02Å; A437-Y442 WeakPolarHBondContact O-CA 3.17Å; A437-Y442 PolarHBondContact O-N 3.49Å; A437-N443 WeakPolarHBondContact CA-O 3.42Å; A437-L444 HydrophobicContact CB-CD2 3.99Å; A437-Y482 WeakPolarHBondContact O-CE1 3.13Å; A437-Y482 PolarHBondContact O-OH 2.9Å
438	S	81.1	Confident	84.6	Confident	37 Å²	37	30.6 Å²	30.6	26%	0.259	17%	0.169	S	C	.	.	S	Bend	trans	-73.7	170.3	-179.8	51.3	0	0	0	0	112.3	S434 S435 N441 Y442	S434-S438 WeakPolarHBondContact O-CB 3.43Å; S434-S438 PolarHBondContact O-N 2.89Å; S434-S438 PolarHBondContact O-OG 3.25Å; S435-S438 WeakPolarHBondContact CA-OG 2.99Å; S438-N441 PolarHBondContact O-N 3.18Å; S438-Y442 PolarHBondContact O-N 2.9Å
439	E	82.2	Confident	85	Confident	145 Å²	145	29.1 Å²	29.1	68%	0.678	17%	0.168	S	C	*	.	T	Hydrogen-bonded Turn	trans	-56.8	139.4	170.7	-177.1	176.2	165.9	0	0	110.1	Y442	E439-Y442 HydrophobicContact CB-CE1 4.12Å; E439-Y442 HydrophobicContact CB-CE2 4.3Å; E439-Y442 WeakPolarHBondContact CB-OH 3.48Å; E439-Y442 HydrophobicContact CG-CE2 4.16Å; E439-Y442 VanDerWaalsContact CG-OH 3.26Å; E439-Y442 WeakPolarHBondContact CG-OH 3.37Å; E439-Y442 PolarHBondContact OE2-OH 2.84Å
440	P	90.9	Very high	85.7	Confident	69 Å²	69	34.4 Å²	34.4	45%	0.448	19%	0.191	S	C	.	.	T	Hydrogen-bonded Turn	cis	-96.1	18.7	4.6	38.3	-36.3	0	0	0	114.7	K478	P440-K478 WeakPolarHBondContact O-CE 3.32Å
441	N	93	Very high	86.8	Confident	15 Å²	15	35.5 Å²	35.5	8%	0.08	20%	0.196	C	C	.	.	T	Hydrogen-bonded Turn	trans	-98.5	-38.9	-168.2	-62.5	-43.2	0	0	0	113.7	S435 L436 S438 N443 V456 Y479	S435-N441 PolarHBondContact O-ND2 3.34Å; L436-N441 HydrophobicContact CD1-CB 4.47Å; L436-N441 WeakPolarHBondContact O-CB 3.5Å; S438-N441 PolarHBondContact O-N 3.18Å; N441-N443 PolarHBondContact O-N 3.47Å; N441-N443 VanDerWaalsContact O-N 3.09Å; N441-V456 HydrophobicContact CB-CG1 4.34Å; N441-Y479 PolarHBondContact O-N 3.4Å
442	Y	95.5	Very high	87.5	Confident	49 Å²	49	43.2 Å²	43.2	19%	0.192	23%	0.229	C	C	.	.			trans	57.5	19.7	174.1	-58.6	-74	0	0	0	116	A437 S438 E439 L444 Y479 Y482 S485	A437-Y442 WeakPolarHBondContact O-CA 3.17Å; A437-Y442 PolarHBondContact O-N 3.49Å; S438-Y442 PolarHBondContact O-N 2.9Å; E439-Y442 HydrophobicContact CB-CE1 4.12Å; E439-Y442 HydrophobicContact CB-CE2 4.3Å; E439-Y442 WeakPolarHBondContact CB-OH 3.48Å; E439-Y442 HydrophobicContact CG-CE2 4.16Å; E439-Y442 VanDerWaalsContact CG-OH 3.26Å; E439-Y442 WeakPolarHBondContact CG-OH 3.37Å; E439-Y442 PolarHBondContact OE2-OH 2.84Å; Y442-L444 PolarHBondContact O-N 2.49Å; Y442-Y479 WeakPolarHBondContact CD2-O 3.26Å; Y442-Y482 AromaticContact CD1-CD1 3.84Å; Y442-Y482 HydrophobicContact CD1-CD1 3.84Å; Y442-Y482 AromaticContact CD1-CE1 3.71Å; Y442-Y482 HydrophobicContact CD1-CE1 3.71Å; Y442-Y482 HydrophobicContact CD1-CE2 4.42Å; Y442-Y482 HydrophobicContact CD1-CG 4.27Å; Y442-Y482 HydrophobicContact CG-CD1 4.45Å; Y442-Y482 HydrophobicContact CG-CE1 4.48Å; Y442-S485 WeakPolarHBondContact O-CB 3.25Å; Y442-S485 PolarHBondContact O-OG 3.05Å
443	N	94.9	Very high	88.1	Confident	1 Å²	1	49.4 Å²	49.4	1%	0.005	26%	0.261	C	S	.	.			trans	-93.9	90.9	-177.3	-176	-9.5	0	0	0	111.5	L436 A437 N441 F445 G446 I447 R477 Y479	L436-N443 HydrophobicContact CD1-CB 3.83Å; L436-N443 HydrophobicContact CG-CB 3.91Å; L436-N443 PolarHBondContact O-N 3.35Å; A437-N443 WeakPolarHBondContact CA-O 3.42Å; N441-N443 PolarHBondContact O-N 3.47Å; N441-N443 VanDerWaalsContact O-N 3.09Å; N443-F445 VanDerWaalsContact C-N 3.28Å; N443-F445 PolarHBondContact O-N 3.15Å; N443-F445 PolarHBondContact OD1-N 3.12Å; N443-G446 PolarHBondContact OD1-N 3.04Å; N443-I447 PolarHBondContact ND2-N 2.9Å; N443-I447 PolarHBondContact ND2-O 3.34Å; N443-I447 PolarHBondContact OD1-N 3.27Å; N443-R477 VanDerWaalsContact CB-O 3.28Å; N443-R477 WeakPolarHBondContact CB-O 3.4Å; N443-R477 PolarHBondContact ND2-N 3.47Å; N443-R477 PolarHBondContact ND2-O 3.4Å; N443-Y479 HydrophobicContact CB-CD2 3.84Å; N443-Y479 HydrophobicContact CB-CE2 3.68Å
444	L	92.8	Very high	89.5	Confident	1 Å²	1	52.9 Å²	52.9	1%	0.005	28%	0.277	C	S	.	.	T	Hydrogen-bonded Turn	trans	-68.9	-23.7	-174.4	-64.5	177.6	0	0	0	114.4	F399 I403 A425 E428 A437 Y442 Y482 S485 L486	F399-L444 HydrophobicContact CE2-CD2 3.75Å; F399-L444 HydrophobicContact CZ-CD1 4.12Å; F399-L444 HydrophobicContact CZ-CD2 3.55Å; F399-L444 HydrophobicContact CZ-CG 4.43Å; I403-L444 HydrophobicContact CG2-CD1 4.3Å; A425-L444 HydrophobicContact CB-CB 4.29Å; A425-L444 HydrophobicContact CB-CD1 4.19Å; E428-L444 WeakPolarHBondContact CB-O 3.48Å; A437-L444 HydrophobicContact CB-CD2 3.99Å; Y442-L444 PolarHBondContact O-N 2.49Å; L444-Y482 HydrophobicContact CD1-CD1 3.75Å; L444-Y482 HydrophobicContact CD1-CE1 4.3Å; L444-Y482 HydrophobicContact CD1-CG 4.19Å; L444-Y482 HydrophobicContact CD2-CD1 3.61Å; L444-Y482 HydrophobicContact CD2-CE1 3.28Å; L444-Y482 HydrophobicContact CG-CD1 3.63Å; L444-Y482 HydrophobicContact CG-CE1 3.85Å; L444-S485 PolarHBondContact N-OG 2.92Å; L444-S485 VanDerWaalsContact N-OG 3.16Å; L444-L486 HydrophobicContact CD1-CD2 4.15Å; L444-L486 HydrophobicContact CD1-CG 4.43Å
445	F	94.4	Very high	90.4	Very high	7 Å²	7	53.8 Å²	53.8	3%	0.031	29%	0.287	C	S	.	.	T	Hydrogen-bonded Turn	trans	-115.8	4.7	-164.9	-58.8	-74.8	0	0	0	113.2	M421 Q424 A425 N443 I447 L486 Y489 Y526	M421-F445 HydrophobicContact CG-CE1 4.4Å; M421-F445 HydrophobicContact CG-CZ 3.87Å; Q424-F445 HydrophobicContact CB-CD1 4.47Å; Q424-F445 HydrophobicContact CB-CE1 4.28Å; A425-F445 HydrophobicContact CB-CE1 3.88Å; A425-F445 HydrophobicContact CB-CZ 3.98Å; N443-F445 VanDerWaalsContact C-N 3.28Å; N443-F445 PolarHBondContact O-N 3.15Å; N443-F445 PolarHBondContact OD1-N 3.12Å; F445-I447 VanDerWaalsContact C-N 3.29Å; F445-I447 HydrophobicContact CB-CD1 4.29Å; F445-I447 HydrophobicContact CB-CG1 3.92Å; F445-I447 PolarHBondContact O-N 2.76Å; F445-L486 HydrophobicContact CE2-CD2 3.99Å; F445-L486 HydrophobicContact CZ-CD2 3.84Å; F445-Y489 HydrophobicContact CB-CD2 4.39Å; F445-Y489 AromaticContact CD1-CD2 3.45Å; F445-Y489 HydrophobicContact CD1-CD2 3.45Å; F445-Y489 VanDerWaalsContact CD1-CD2 3.45Å; F445-Y489 AromaticContact CD1-CE2 3.96Å; F445-Y489 HydrophobicContact CD1-CE2 3.96Å; F445-Y489 HydrophobicContact CD1-CG 4.1Å; F445-Y489 VanDerWaalsContact CD2-CB 3.5Å; F445-Y489 HydrophobicContact CD2-CD2 4.04Å; F445-Y489 HydrophobicContact CD2-CG 4.02Å; F445-Y489 HydrophobicContact CE1-CD1 4.48Å; F445-Y489 AromaticContact CE1-CD2 3.56Å; F445-Y489 HydrophobicContact CE1-CD2 3.56Å; F445-Y489 AromaticContact CE1-CE2 3.94Å; F445-Y489 HydrophobicContact CE1-CE2 3.94Å; F445-Y489 AromaticContact CE1-CG 3.87Å; F445-Y489 HydrophobicContact CE1-CG 3.87Å; F445-Y489 VanDerWaalsContact CE2-CB 3.41Å; F445-Y489 HydrophobicContact CE2-CD2 4.15Å; F445-Y489 AromaticContact CE2-CG 3.8Å; F445-Y489 HydrophobicContact CE2-CG 3.8Å; F445-Y489 AromaticContact CG-CD2 3.7Å; F445-Y489 HydrophobicContact CG-CD2 3.7Å; F445-Y489 HydrophobicContact CG-CG 4.16Å; F445-Y489 HydrophobicContact CZ-CD1 4.21Å; F445-Y489 AromaticContact CZ-CD2 3.91Å; F445-Y489 HydrophobicContact CZ-CD2 3.91Å; F445-Y489 AromaticContact CZ-CG 3.71Å; F445-Y489 HydrophobicContact CZ-CG 3.71Å; F445-Y526 PolarHBondContact O-OH 3.41Å
446	G	89	Confident	91.1	Very high	32 Å²	32	52.9 Å²	52.9	33%	0.33	28%	0.279	S	S	.	.			trans	64.5	29.6	-179.2	0	0	0	0	0	113.8	N443 K448 F476	N443-G446 PolarHBondContact OD1-N 3.04Å; G446-K448 PolarHBondContact O-N 3.23Å; G446-F476 WeakPolarHBondContact O-CD1 3.4Å; G446-F476 VanDerWaalsContact O-CE1 3.29Å; G446-F476 WeakPolarHBondContact O-CE1 3.4Å
447	I	91.5	Very high	91.4	Very high	16 Å²	16	56.1 Å²	56.1	8%	0.082	30%	0.3	C	S	.	.			trans	-71.6	120.5	-175.9	-50.3	178.1	0	0	0	109.9	N443 F445 R477 L492	N443-I447 PolarHBondContact ND2-N 2.9Å; N443-I447 PolarHBondContact ND2-O 3.34Å; N443-I447 PolarHBondContact OD1-N 3.27Å; F445-I447 VanDerWaalsContact C-N 3.29Å; F445-I447 HydrophobicContact CB-CD1 4.29Å; F445-I447 HydrophobicContact CB-CG1 3.92Å; F445-I447 PolarHBondContact O-N 2.76Å; I447-R477 HydrophobicContact CG2-CG 4.49Å; I447-R477 VanDerWaalsContact CG2-NH1 3.34Å; I447-R477 WeakPolarHBondContact O-CG 3.23Å; I447-R477 PolarHBondContact O-N 2.74Å; I447-L492 HydrophobicContact CD1-CD2 4.31Å
448	K	89	Confident	90.9	Very high	100 Å²	100	58.1 Å²	58.1	44%	0.435	31%	0.309	S	S	.	.	B	Isolated β-bridge	trans	-72.5	153.5	-178.9	-64.5	-174.5	-177.2	-169.6	0	112.5	G446 E462 S474 E475 F476 R477	G446-K448 PolarHBondContact O-N 3.23Å; K448-E462 IonicContact NZ-OE1 3.75Å; K448-E462 PolarHBondContact NZ-OE1 3.2Å; K448-S474 PolarHBondContact NZ-OG 3.39Å; K448-E475 CarbonylContact C-O 3.45Å; K448-E475 VanDerWaalsContact CA-O 3.29Å; K448-E475 WeakPolarHBondContact CA-O 3.24Å; K448-F476 HydrophobicContact CD-CE1 4.26Å; K448-F476 HydrophobicContact CD-CZ 4.46Å; K448-F476 HydrophobicContact CG-CD1 3.85Å; K448-F476 HydrophobicContact CG-CE1 3.45Å; K448-F476 VanDerWaalsContact CG-CE1 3.45Å; K448-F476 HydrophobicContact CG-CZ 4.05Å; K448-R477 PolarHBondContact O-NE 3.33Å
449	G	92.1	Very high	90.1	Very high	25 Å²	25	59.8 Å²	59.8	26%	0.258	31%	0.312	S	S	.	.	S	Bend	trans	97.6	-154.7	177.9	0	0	0	0	0	114.1	E475 F476 R477	G449-E475 PolarHBondContact N-O 2.86Å; G449-F476 CarbonylContact O-C 3.45Å; G449-R477 VanDerWaalsContact O-CA 3.23Å; G449-R477 WeakPolarHBondContact O-CA 3.24Å; G449-R477 PolarHBondContact O-N 3.28Å
450	K	96	Very high	89.1	Confident	111 Å²	111	54 Å²	54	48%	0.483	29%	0.287	S	S	.	.			trans	-113.8	144.2	-178	-63	-179.1	178	-176.7	0	112.1	Q454 E475	K450-Q454 CarbonylContact C-O 3.59Å; K450-Q454 WeakPolarHBondContact CA-O 3.33Å; K450-E475 WeakPolarHBondContact CE-OE1 3.13Å; K450-E475 WeakPolarHBondContact CE-OE2 3.43Å; K450-E475 WeakPolarHBondContact CG-OE2 3.35Å; K450-E475 IonicContact NZ-OE1 2.77Å
451	F	95.6	Very high	87.6	Confident	24 Å²	24	52.9 Å²	52.9	11%	0.105	28%	0.277	C	S	.	.	B	Isolated β-bridge	trans	-106.5	111.7	167.7	177.8	-96.8	0	0	0	108.6	D453 Q454 R477 Y479 P480 E484	F451-D453 VanDerWaalsContact C-N 3.29Å; F451-D453 PolarHBondContact O-N 3.09Å; F451-Q454 PolarHBondContact N-O 2.85Å; F451-Q454 WeakPolarHBondContact O-CB 3.4Å; F451-Q454 PolarHBondContact O-N 2.72Å; F451-R477 HydrophobicContact CB-CB 4.01Å; F451-R477 HydrophobicContact CB-CG 4.26Å; F451-Y479 HydrophobicContact CB-CD1 3.94Å; F451-Y479 HydrophobicContact CB-CE1 3.83Å; F451-Y479 AromaticContact CD1-CD1 3.82Å; F451-Y479 HydrophobicContact CD1-CD1 3.82Å; F451-Y479 HydrophobicContact CD1-CE1 4.38Å; F451-Y479 AromaticContact CD2-CD1 3.76Å; F451-Y479 HydrophobicContact CD2-CD1 3.76Å; F451-Y479 AromaticContact CD2-CE1 3.51Å; F451-Y479 HydrophobicContact CD2-CE1 3.51Å; F451-Y479 HydrophobicContact CE1-CD1 4.22Å; F451-Y479 HydrophobicContact CE2-CD1 4.15Å; F451-Y479 HydrophobicContact CE2-CE1 4.11Å; F451-Y479 AromaticContact CG-CD1 3.56Å; F451-Y479 HydrophobicContact CG-CD1 3.56Å; F451-Y479 AromaticContact CG-CE1 3.66Å; F451-Y479 HydrophobicContact CG-CE1 3.66Å; F451-Y479 HydrophobicContact CZ-CD1 4.37Å; F451-P480 HydrophobicContact CE1-CG 4.34Å; F451-E484 HydrophobicContact CE1-CB 4.18Å; F451-E484 HydrophobicContact CE1-CG 4.11Å; F451-E484 HydrophobicContact CE2-CB 4.49Å; F451-E484 HydrophobicContact CZ-CB 3.88Å; F451-E484 HydrophobicContact CZ-CG 3.88Å
452	K	94.5	Very high	86.2	Confident	164 Å²	164	55.2 Å²	55.2	71%	0.713	29%	0.287	S	S	*	.	T	Hydrogen-bonded Turn	trans	47.8	52.1	-175.3	-57.5	-179.8	179.9	178.2	0	112	Q454	K452-Q454 PolarHBondContact O-N 3.38Å; K452-Q454 VanDerWaalsContact O-N 3.09Å
453	D	93.6	Very high	84.3	Confident	136 Å²	136	58.6 Å²	58.6	73%	0.727	31%	0.305	S	S	*	.	T	Hydrogen-bonded Turn	trans	65.6	1.2	-176.7	-53.2	-50	0	0	0	116.6	F451	F451-D453 VanDerWaalsContact C-N 3.29Å; F451-D453 PolarHBondContact O-N 3.09Å
454	Q	96.1	Very high	82.8	Confident	105 Å²	105	61.6 Å²	61.6	49%	0.491	32%	0.321	S	S	.	.	B	Isolated β-bridge	trans	-91.8	119.4	174.2	-58	-62	-50.8	0	0	110.9	K450 F451 K452 K478	K450-Q454 CarbonylContact C-O 3.59Å; K450-Q454 WeakPolarHBondContact CA-O 3.33Å; F451-Q454 PolarHBondContact N-O 2.85Å; F451-Q454 WeakPolarHBondContact O-CB 3.4Å; F451-Q454 PolarHBondContact O-N 2.72Å; K452-Q454 PolarHBondContact O-N 3.38Å; K452-Q454 VanDerWaalsContact O-N 3.09Å; Q454-K478 HydrophobicContact CB-CB 4.04Å; Q454-K478 HydrophobicContact CB-CG 4.38Å; Q454-K478 PolarHBondContact O-N 2.94Å
455	G	94.3	Very high	81.6	Confident	27 Å²	27	70.3 Å²	70.3	28%	0.278	36%	0.359	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-138.5	160	174.5	0	0	0	0	0	111.2	F476	G455-F476 CarbonylContact C-O 3.51Å; G455-F476 WeakPolarHBondContact CA-O 3.46Å
456	V	90.3	Very high	80.1	Confident	30 Å²	30	75.8 Å²	75.8	18%	0.182	39%	0.389	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-136.2	141.2	174.6	60.7	0	0	0	0	108.7	L436 N441 F458 F476 K478	L436-V456 HydrophobicContact CD1-CG1 3.74Å; N441-V456 HydrophobicContact CB-CG1 4.34Å; V456-F458 HydrophobicContact CB-CE2 4.19Å; V456-F458 HydrophobicContact CG1-CD2 3.99Å; V456-F458 HydrophobicContact CG1-CE2 3.63Å; V456-F458 HydrophobicContact CG2-CD2 4.04Å; V456-F458 HydrophobicContact CG2-CE2 3.5Å; V456-F458 HydrophobicContact CG2-CZ 4.33Å; V456-F476 HydrophobicContact CG1-CB 4.34Å; V456-F476 PolarHBondContact N-O 3.24Å; V456-F476 PolarHBondContact O-N 3.04Å; V456-K478 HydrophobicContact CG1-CB 4.48Å
457	T	87.9	Confident	78.5	Confident	84 Å²	84	76 Å²	76	52%	0.515	39%	0.39	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-101.3	129.2	-176.1	-63.4	0	0	0	0	110.6	T473 S474	T457-T473 HydrophobicContact CG2-CG2 3.12Å; T457-S474 WeakPolarHBondContact CA-O 3.36Å
458	F	73.4	Confident	76.9	Confident	43 Å²	43	77.8 Å²	77.8	19%	0.189	41%	0.408	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-128.9	154.2	175.9	-78.8	-92.6	0	0	0	110.6	L436 V456 S474 F476	L436-F458 HydrophobicContact CB-CD2 4.31Å; L436-F458 HydrophobicContact CB-CE2 4.03Å; L436-F458 HydrophobicContact CB-CZ 4.21Å; L436-F458 HydrophobicContact CD1-CD2 3.85Å; L436-F458 HydrophobicContact CD1-CE2 3.7Å; L436-F458 HydrophobicContact CG-CE2 4.45Å; V456-F458 HydrophobicContact CB-CE2 4.19Å; V456-F458 HydrophobicContact CG1-CD2 3.99Å; V456-F458 HydrophobicContact CG1-CE2 3.63Å; V456-F458 HydrophobicContact CG2-CD2 4.04Å; V456-F458 HydrophobicContact CG2-CE2 3.5Å; V456-F458 HydrophobicContact CG2-CZ 4.33Å; F458-S474 PolarHBondContact N-O 3.12Å; F458-S474 PolarHBondContact O-N 2.85Å; F458-F476 HydrophobicContact CB-CD2 3.99Å; F458-F476 HydrophobicContact CB-CE2 3.94Å; F458-F476 HydrophobicContact CD2-CD2 4.28Å
459	Q	64	Low	75.1	Confident	71 Å²	71	76.2 Å²	76.2	33%	0.332	41%	0.409	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-79.4	136.4	161.7	-63.8	-75.4	33.1	0	0	108.6	I472 T473	Q459-I472 CarbonylContact C-O 3.45Å; Q459-I472 WeakPolarHBondContact CA-O 3.41Å; Q459-I472 PolarHBondContact OE1-O 2.88Å; Q459-T473 VanDerWaalsContact CD-OG1 3.31Å; Q459-T473 PolarHBondContact NE2-OG1 2.93Å; Q459-T473 VanDerWaalsContact OE1-CA 3.25Å; Q459-T473 PolarHBondContact OE1-OG1 2.83Å
460	T	63	Low	73.8	Confident	24 Å²	24	79.7 Å²	79.7	15%	0.147	42%	0.417	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-125.3	141.1	175.1	54.3	0	0	0	0	111.3	E462 Q471 I472 F476	T460-E462 PolarHBondContact O-N 3.27Å; T460-E462 PolarHBondContact OG1-OE1 2.91Å; T460-Q471 CarbonylContact O-C 2.9Å; T460-Q471 VanDerWaalsContact O-CA 3.28Å; T460-Q471 WeakPolarHBondContact O-CA 3.41Å; T460-I472 PolarHBondContact N-O 3.36Å; T460-I472 PolarHBondContact O-N 3.01Å; T460-I472 PolarHBondContact OG1-O 3.33Å; T460-F476 HydrophobicContact CG2-CE1 4.46Å; T460-F476 HydrophobicContact CG2-CE2 3.58Å; T460-F476 HydrophobicContact CG2-CZ 3.31Å
461	L	58	Low	72.2	Confident	45 Å²	45	80 Å²	80	24%	0.236	42%	0.421	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-77.5	116.5	168.4	-162.4	72.7	0	0	0	109.2	G344 V346 F470 Q471	G344-L461 WeakPolarHBondContact O-CB 3.22Å; G344-L461 PolarHBondContact O-N 2.95Å; V346-L461 HydrophobicContact CG1-CD2 4.06Å; L461-F470 CarbonylContact C-O 3.47Å; L461-F470 WeakPolarHBondContact CA-O 3.4Å; L461-Q471 HydrophobicContact CD1-CG 4.03Å
462	E	63.6	Low	71.1	Confident	64 Å²	64	82.6 Å²	82.6	30%	0.299	44%	0.435	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-110.1	161.2	172.8	-59.1	-71.9	170.7	0	0	108.7	K448 T460 S469 F470 I472	K448-E462 IonicContact NZ-OE1 3.75Å; K448-E462 PolarHBondContact NZ-OE1 3.2Å; T460-E462 PolarHBondContact O-N 3.27Å; T460-E462 PolarHBondContact OG1-OE1 2.91Å; E462-S469 CarbonylContact O-C 3.53Å; E462-S469 VanDerWaalsContact O-CA 3.27Å; E462-S469 WeakPolarHBondContact O-CA 3.15Å; E462-F470 HydrophobicContact CB-CD1 4.3Å; E462-F470 HydrophobicContact CB-CD2 4.29Å; E462-F470 HydrophobicContact CB-CE1 3.75Å; E462-F470 HydrophobicContact CB-CE2 3.74Å; E462-F470 HydrophobicContact CB-CZ 3.44Å; E462-F470 VanDerWaalsContact CB-CZ 3.44Å; E462-F470 HydrophobicContact CG-CE2 4.26Å; E462-F470 HydrophobicContact CG-CZ 4.28Å; E462-F470 PolarHBondContact N-O 3.17Å; E462-F470 PolarHBondContact O-N 3.39Å; E462-I472 HydrophobicContact CG-CG2 3.47Å; E462-I472 VanDerWaalsContact CG-CG2 3.47Å
463	Q	55.4	Low	70.2	Confident	121 Å²	121	77.4 Å²	77.4	57%	0.565	42%	0.417	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-114	137.5	175.1	-71.4	-177.8	-25.5	0	0	110.2	A468	Q463-A468 WeakPolarHBondContact CA-O 3.47Å
464	D	64.8	Low	69.5	Low	64 Å²	64	71.7 Å²	71.7	34%	0.342	39%	0.388	S	S	.	.			trans	-75.4	-179.8	169.2	71.7	14.9	0	0	0	111.4	D466 G467 A468 F470	D464-D466 PolarHBondContact O-N 2.83Å; D464-D466 VanDerWaalsContact OD1-C 3.32Å; D464-D466 WeakPolarHBondContact OD1-CA 3.33Å; D464-D466 PolarHBondContact OD1-N 3.42Å; D464-G467 PolarHBondContact O-N 2.92Å; D464-G467 VanDerWaalsContact O-N 3.08Å; D464-G467 PolarHBondContact OD1-N 3.22Å; D464-A468 PolarHBondContact N-O 3.35Å; D464-A468 PolarHBondContact OD1-N 3.06Å; D464-A468 WeakPolarHBondContact OD2-CB 3.47Å; D464-F470 HydrophobicContact CB-CD1 4.4Å; D464-F470 HydrophobicContact CB-CE1 4.26Å
465	K	66.7	Low	69.4	Low	183 Å²	183	70.3 Å²	70.3	80%	0.796	38%	0.381	S	S	*	.	T	Hydrogen-bonded Turn	trans	-61.3	-21.8	179	61.1	169.1	-175.6	60.8	0	113.9
466	D	63.1	Low	69.3	Low	123 Å²	123	69.4 Å²	69.4	66%	0.658	37%	0.37	S	S	*	.	T	Hydrogen-bonded Turn	trans	-97.3	-1	-178.4	-55.6	-42.6	0	0	0	111.3	D464 A468	D464-D466 PolarHBondContact O-N 2.83Å; D464-D466 VanDerWaalsContact OD1-C 3.32Å; D464-D466 WeakPolarHBondContact OD1-CA 3.33Å; D464-D466 PolarHBondContact OD1-N 3.42Å; D466-A468 VanDerWaalsContact C-N 3.34Å
467	G	56.4	Low	69.6	Low	35 Å²	35	70.9 Å²	70.9	36%	0.361	37%	0.372	S	S	.	.			trans	84.3	3.3	-179.7	0	0	0	0	0	114.1	D464	D464-G467 PolarHBondContact O-N 2.92Å; D464-G467 VanDerWaalsContact O-N 3.08Å; D464-G467 PolarHBondContact OD1-N 3.22Å
468	A	56.3	Low	70	Confident	55 Å²	55	70 Å²	70	46%	0.455	36%	0.361	S	S	.	.			trans	-70.6	134.6	174.9	0	0	0	0	0	109.3	Q463 D464 D466	Q463-A468 WeakPolarHBondContact CA-O 3.47Å; D464-A468 PolarHBondContact N-O 3.35Å; D464-A468 PolarHBondContact OD1-N 3.06Å; D464-A468 WeakPolarHBondContact OD2-CB 3.47Å; D466-A468 VanDerWaalsContact C-N 3.34Å
469	S	51.1	Low	71.2	Confident	67 Å²	67	68.1 Å²	68.1	47%	0.469	35%	0.353	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-89	133.5	-175.4	-56.3	0	0	0	0	110.8	E462	E462-S469 CarbonylContact O-C 3.53Å; E462-S469 VanDerWaalsContact O-CA 3.27Å; E462-S469 WeakPolarHBondContact O-CA 3.15Å
470	F	65.1	Low	72.8	Confident	97 Å²	97	68.9 Å²	68.9	43%	0.425	36%	0.363	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-132.2	157.8	174.8	67	-86.7	0	0	0	110.1	L461 E462 D464 I472	L461-F470 CarbonylContact C-O 3.47Å; L461-F470 WeakPolarHBondContact CA-O 3.4Å; E462-F470 HydrophobicContact CB-CD1 4.3Å; E462-F470 HydrophobicContact CB-CD2 4.29Å; E462-F470 HydrophobicContact CB-CE1 3.75Å; E462-F470 HydrophobicContact CB-CE2 3.74Å; E462-F470 HydrophobicContact CB-CZ 3.44Å; E462-F470 VanDerWaalsContact CB-CZ 3.44Å; E462-F470 HydrophobicContact CG-CE2 4.26Å; E462-F470 HydrophobicContact CG-CZ 4.28Å; E462-F470 PolarHBondContact N-O 3.17Å; E462-F470 PolarHBondContact O-N 3.39Å; D464-F470 HydrophobicContact CB-CD1 4.4Å; D464-F470 HydrophobicContact CB-CE1 4.26Å; F470-I472 HydrophobicContact CE2-CB 4.32Å
471	Q	63.3	Low	74.4	Confident	118 Å²	118	69.7 Å²	69.7	55%	0.551	37%	0.37	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-101.7	136.3	177.4	-70.9	-175.6	57.7	0	0	111.3	T460 L461	T460-Q471 CarbonylContact O-C 2.9Å; T460-Q471 VanDerWaalsContact O-CA 3.28Å; T460-Q471 WeakPolarHBondContact O-CA 3.41Å; L461-Q471 HydrophobicContact CD1-CG 4.03Å
472	I	72	Confident	76.3	Confident	79 Å²	79	69.5 Å²	69.5	41%	0.405	37%	0.367	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-131.1	149.6	172.1	-166.9	170.4	0	0	0	110.9	Q459 T460 E462 F470	Q459-I472 CarbonylContact C-O 3.45Å; Q459-I472 WeakPolarHBondContact CA-O 3.41Å; Q459-I472 PolarHBondContact OE1-O 2.88Å; T460-I472 PolarHBondContact N-O 3.36Å; T460-I472 PolarHBondContact O-N 3.01Å; T460-I472 PolarHBondContact OG1-O 3.33Å; E462-I472 HydrophobicContact CG-CG2 3.47Å; E462-I472 VanDerWaalsContact CG-CG2 3.47Å; F470-I472 HydrophobicContact CE2-CB 4.32Å
473	T	76.4	Confident	77.9	Confident	55 Å²	55	71 Å²	71	34%	0.337	37%	0.372	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-83.3	122	173.2	-55.6	0	0	0	0	109.7	K123 T457 Q459	K123-T473 PolarHBondContact NZ-OG1 3.22Å; T457-T473 HydrophobicContact CG2-CG2 3.12Å; Q459-T473 VanDerWaalsContact CD-OG1 3.31Å; Q459-T473 PolarHBondContact NE2-OG1 2.93Å; Q459-T473 VanDerWaalsContact OE1-CA 3.25Å; Q459-T473 PolarHBondContact OE1-OG1 2.83Å
474	S	79	Confident	80	Confident	15 Å²	15	67 Å²	67	11%	0.105	35%	0.354	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-125.9	141.8	178.6	-68.1	0	0	0	0	110.9	K448 T457 F458 F476	K448-S474 PolarHBondContact NZ-OG 3.39Å; T457-S474 WeakPolarHBondContact CA-O 3.36Å; F458-S474 PolarHBondContact N-O 3.12Å; F458-S474 PolarHBondContact O-N 2.85Å; S474-F476 VanDerWaalsContact CB-CE2 3.41Å; S474-F476 VanDerWaalsContact O-CD2 3.31Å; S474-F476 WeakPolarHBondContact O-CD2 3.48Å; S474-F476 WeakPolarHBondContact O-CE2 3.2Å
475	E	92.9	Very high	81.6	Confident	77 Å²	77	64 Å²	64	36%	0.36	34%	0.338	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-86.3	133.5	169.2	-173.1	176.6	-126.3	0	0	109.8	K448 G449 K450	K448-E475 CarbonylContact C-O 3.45Å; K448-E475 VanDerWaalsContact CA-O 3.29Å; K448-E475 WeakPolarHBondContact CA-O 3.24Å; G449-E475 PolarHBondContact N-O 2.86Å; K450-E475 WeakPolarHBondContact CE-OE1 3.13Å; K450-E475 WeakPolarHBondContact CE-OE2 3.43Å; K450-E475 WeakPolarHBondContact CG-OE2 3.35Å; K450-E475 IonicContact NZ-OE1 2.77Å
476	F	91.9	Very high	83.1	Confident	8 Å²	8	55.3 Å²	55.3	4%	0.035	30%	0.3	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-122.3	149.7	-179.2	-65.9	-85.4	0	0	0	111.5	L436 G446 K448 G449 G455 V456 F458 T460 S474 K478	L436-F476 HydrophobicContact CD1-CB 3.52Å; L436-F476 HydrophobicContact CD1-CG 4.03Å; L436-F476 HydrophobicContact CD2-CB 3.95Å; L436-F476 HydrophobicContact CD2-CD1 3.61Å; L436-F476 HydrophobicContact CD2-CD2 4.1Å; L436-F476 HydrophobicContact CD2-CE1 4.14Å; L436-F476 HydrophobicContact CD2-CG 3.6Å; L436-F476 HydrophobicContact CG-CB 4.4Å; G446-F476 WeakPolarHBondContact O-CD1 3.4Å; G446-F476 VanDerWaalsContact O-CE1 3.29Å; G446-F476 WeakPolarHBondContact O-CE1 3.4Å; K448-F476 HydrophobicContact CD-CE1 4.26Å; K448-F476 HydrophobicContact CD-CZ 4.46Å; K448-F476 HydrophobicContact CG-CD1 3.85Å; K448-F476 HydrophobicContact CG-CE1 3.45Å; K448-F476 VanDerWaalsContact CG-CE1 3.45Å; K448-F476 HydrophobicContact CG-CZ 4.05Å; G449-F476 CarbonylContact O-C 3.45Å; G455-F476 CarbonylContact C-O 3.51Å; G455-F476 WeakPolarHBondContact CA-O 3.46Å; V456-F476 HydrophobicContact CG1-CB 4.34Å; V456-F476 PolarHBondContact N-O 3.24Å; V456-F476 PolarHBondContact O-N 3.04Å; F458-F476 HydrophobicContact CB-CD2 3.99Å; F458-F476 HydrophobicContact CB-CE2 3.94Å; F458-F476 HydrophobicContact CD2-CD2 4.28Å; T460-F476 HydrophobicContact CG2-CE1 4.46Å; T460-F476 HydrophobicContact CG2-CE2 3.58Å; T460-F476 HydrophobicContact CG2-CZ 3.31Å; S474-F476 VanDerWaalsContact CB-CE2 3.41Å; S474-F476 VanDerWaalsContact O-CD2 3.31Å; S474-F476 WeakPolarHBondContact O-CD2 3.48Å; S474-F476 WeakPolarHBondContact O-CE2 3.2Å; F476-K478 PolarHBondContact O-N 2.99Å
477	R	96.9	Very high	84.8	Confident	61 Å²	61	52.2 Å²	52.2	23%	0.23	28%	0.281	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-61.5	136.9	178.8	-66.6	-176.9	-175.8	162.3	8	109.3	N443 I447 K448 G449 F451 Y479 D488	N443-R477 VanDerWaalsContact CB-O 3.28Å; N443-R477 WeakPolarHBondContact CB-O 3.4Å; N443-R477 PolarHBondContact ND2-N 3.47Å; N443-R477 PolarHBondContact ND2-O 3.4Å; I447-R477 HydrophobicContact CG2-CG 4.49Å; I447-R477 VanDerWaalsContact CG2-NH1 3.34Å; I447-R477 WeakPolarHBondContact O-CG 3.23Å; I447-R477 PolarHBondContact O-N 2.74Å; K448-R477 PolarHBondContact O-NE 3.33Å; G449-R477 VanDerWaalsContact O-CA 3.23Å; G449-R477 WeakPolarHBondContact O-CA 3.24Å; G449-R477 PolarHBondContact O-N 3.28Å; F451-R477 HydrophobicContact CB-CB 4.01Å; F451-R477 HydrophobicContact CB-CG 4.26Å; R477-Y479 HydrophobicContact CB-CE1 4.08Å; R477-Y479 HydrophobicContact CB-CE2 3.85Å; R477-Y479 WeakPolarHBondContact CD-OH 3.33Å; R477-D488 VanDerWaalsContact CD-OD2 3.24Å; R477-D488 WeakPolarHBondContact CD-OD2 3.4Å; R477-D488 IonicContact CZ-OD2 3Å; R477-D488 IonicContact NE-OD2 2.64Å; R477-D488 IonicContact NH1-OD1 3.84Å; R477-D488 PolarHBondContact NH1-OD1 2.97Å; R477-D488 IonicContact NH1-OD2 2.87Å; R477-D488 PolarHBondContact NH1-OD2 3.32Å
478	K	97.3	Very high	86.8	Confident	64 Å²	64	51.4 Å²	51.4	28%	0.278	27%	0.269	S	S	.	.			trans	-108.7	123.7	169.8	172.1	172.3	-174.9	-177	0	108.6	P440 Q454 V456 F476	P440-K478 WeakPolarHBondContact O-CE 3.32Å; Q454-K478 HydrophobicContact CB-CB 4.04Å; Q454-K478 HydrophobicContact CB-CG 4.38Å; Q454-K478 PolarHBondContact O-N 2.94Å; V456-K478 HydrophobicContact CG1-CB 4.48Å; F476-K478 PolarHBondContact O-N 2.99Å
479	Y	97.9	Very high	88.8	Confident	5 Å²	5	49 Å²	49	2%	0.02	25%	0.248	C	C	.	.			trans	-105.9	155.4	-176.4	-59.1	-75	0	0	0	111.9	N441 Y442 N443 F451 R477 S481 E484 D488	N441-Y479 PolarHBondContact O-N 3.4Å; Y442-Y479 WeakPolarHBondContact CD2-O 3.26Å; N443-Y479 HydrophobicContact CB-CD2 3.84Å; N443-Y479 HydrophobicContact CB-CE2 3.68Å; F451-Y479 HydrophobicContact CB-CD1 3.94Å; F451-Y479 HydrophobicContact CB-CE1 3.83Å; F451-Y479 AromaticContact CD1-CD1 3.82Å; F451-Y479 HydrophobicContact CD1-CD1 3.82Å; F451-Y479 HydrophobicContact CD1-CE1 4.38Å; F451-Y479 AromaticContact CD2-CD1 3.76Å; F451-Y479 HydrophobicContact CD2-CD1 3.76Å; F451-Y479 AromaticContact CD2-CE1 3.51Å; F451-Y479 HydrophobicContact CD2-CE1 3.51Å; F451-Y479 HydrophobicContact CE1-CD1 4.22Å; F451-Y479 HydrophobicContact CE2-CD1 4.15Å; F451-Y479 HydrophobicContact CE2-CE1 4.11Å; F451-Y479 AromaticContact CG-CD1 3.56Å; F451-Y479 HydrophobicContact CG-CD1 3.56Å; F451-Y479 AromaticContact CG-CE1 3.66Å; F451-Y479 HydrophobicContact CG-CE1 3.66Å; F451-Y479 HydrophobicContact CZ-CD1 4.37Å; R477-Y479 HydrophobicContact CB-CE1 4.08Å; R477-Y479 HydrophobicContact CB-CE2 3.85Å; R477-Y479 WeakPolarHBondContact CD-OH 3.33Å; Y479-S481 VanDerWaalsContact C-N 3.33Å; Y479-E484 HydrophobicContact CD1-CB 3.82Å; Y479-E484 HydrophobicContact CG-CB 4.31Å; Y479-D488 HydrophobicContact CE1-CB 3.85Å; Y479-D488 WeakPolarHBondContact CE1-OD2 3.32Å; Y479-D488 PolarHBondContact OH-OD2 2.82Å
480	P	97	Very high	91	Very high	86 Å²	86	45.9 Å²	45.9	56%	0.558	23%	0.226	S	C	*	.	S	Bend	trans	-65	-34.8	170.5	-21.9	33.6	0	0	0	113.5	F451 E484	F451-P480 HydrophobicContact CE1-CG 4.34Å; P480-E484 HydrophobicContact CG-CG 4.19Å
481	S	97.3	Very high	92.5	Very high	42 Å²	42	45.3 Å²	45.3	29%	0.294	22%	0.223	S	C	.	.	S	Bend	trans	-158.8	177.6	179.4	79.6	0	0	0	0	111.2	Y479 K483 E484	Y479-S481 VanDerWaalsContact C-N 3.33Å; S481-K483 PolarHBondContact O-N 3.4Å; S481-K483 WeakPolarHBondContact OG-CB 3.25Å; S481-K483 PolarHBondContact OG-N 3.21Å; S481-K483 VanDerWaalsContact OG-N 3.12Å; S481-E484 WeakPolarHBondContact CB-OE2 3.46Å; S481-E484 PolarHBondContact N-OE2 2.97Å; S481-E484 PolarHBondContact O-N 2.78Å; S481-E484 PolarHBondContact OG-OE2 3.47Å
482	Y	97.7	Very high	94.1	Very high	41 Å²	41	41.4 Å²	41.4	16%	0.161	21%	0.206	C	C	.	.	H	α-helix	trans	-60.7	-26.6	172.1	-67.2	-39.9	0	0	0	113.8	F399 I403 A437 Y442 L444 E484 S485 L486	F399-Y482 HydrophobicContact CE2-CE2 4.37Å; I403-Y482 HydrophobicContact CG2-CD2 3.91Å; I403-Y482 HydrophobicContact CG2-CG 4.14Å; A437-Y482 WeakPolarHBondContact O-CE1 3.13Å; A437-Y482 PolarHBondContact O-OH 2.9Å; Y442-Y482 AromaticContact CD1-CD1 3.84Å; Y442-Y482 HydrophobicContact CD1-CD1 3.84Å; Y442-Y482 AromaticContact CD1-CE1 3.71Å; Y442-Y482 HydrophobicContact CD1-CE1 3.71Å; Y442-Y482 HydrophobicContact CD1-CE2 4.42Å; Y442-Y482 HydrophobicContact CD1-CG 4.27Å; Y442-Y482 HydrophobicContact CG-CD1 4.45Å; Y442-Y482 HydrophobicContact CG-CE1 4.48Å; L444-Y482 HydrophobicContact CD1-CD1 3.75Å; L444-Y482 HydrophobicContact CD1-CE1 4.3Å; L444-Y482 HydrophobicContact CD1-CG 4.19Å; L444-Y482 HydrophobicContact CD2-CD1 3.61Å; L444-Y482 HydrophobicContact CD2-CE1 3.28Å; L444-Y482 HydrophobicContact CG-CD1 3.63Å; L444-Y482 HydrophobicContact CG-CE1 3.85Å; Y482-E484 PolarHBondContact O-N 3.1Å; Y482-S485 PolarHBondContact O-N 2.84Å; Y482-L486 WeakPolarHBondContact O-CG 3.5Å; Y482-L486 PolarHBondContact O-N 3.13Å
483	K	98.2	Very high	95.3	Very high	94 Å²	94	37.7 Å²	37.7	41%	0.409	19%	0.187	S	C	.	.	H	α-helix	trans	-59.9	-47.8	179.4	-178	175.4	176.8	-67	0	111.3	T406 S481 S485 L486 E487	T406-K483 HydrophobicContact CG2-CB 4.26Å; T406-K483 HydrophobicContact CG2-CG 4.04Å; S481-K483 PolarHBondContact O-N 3.4Å; S481-K483 WeakPolarHBondContact OG-CB 3.25Å; S481-K483 PolarHBondContact OG-N 3.21Å; S481-K483 VanDerWaalsContact OG-N 3.12Å; K483-S485 VanDerWaalsContact C-N 3.34Å; K483-S485 PolarHBondContact O-N 2.89Å; K483-L486 PolarHBondContact O-N 2.96Å; K483-E487 IonicContact NZ-OE1 3.82Å; K483-E487 PolarHBondContact NZ-OE1 3.39Å; K483-E487 IonicContact NZ-OE2 2.66Å; K483-E487 WeakPolarHBondContact O-CG 3.27Å; K483-E487 PolarHBondContact O-N 3.38Å
484	E	98.5	Very high	96.3	Very high	39 Å²	39	37.8 Å²	37.8	18%	0.182	18%	0.183	C	C	.	.	H	α-helix	trans	-67.3	-36.4	178.9	-67.5	74.2	-158.8	0	0	111.7	F451 Y479 P480 S481 Y482 L486 E487 D488	F451-E484 HydrophobicContact CE1-CB 4.18Å; F451-E484 HydrophobicContact CE1-CG 4.11Å; F451-E484 HydrophobicContact CE2-CB 4.49Å; F451-E484 HydrophobicContact CZ-CB 3.88Å; F451-E484 HydrophobicContact CZ-CG 3.88Å; Y479-E484 HydrophobicContact CD1-CB 3.82Å; Y479-E484 HydrophobicContact CG-CB 4.31Å; P480-E484 HydrophobicContact CG-CG 4.19Å; S481-E484 WeakPolarHBondContact CB-OE2 3.46Å; S481-E484 PolarHBondContact N-OE2 2.97Å; S481-E484 PolarHBondContact O-N 2.78Å; S481-E484 PolarHBondContact OG-OE2 3.47Å; Y482-E484 PolarHBondContact O-N 3.1Å; E484-L486 PolarHBondContact O-N 3.27Å; E484-E487 PolarHBondContact O-N 2.88Å; E484-D488 VanDerWaalsContact O-CB 3.24Å; E484-D488 WeakPolarHBondContact O-CB 3.27Å; E484-D488 PolarHBondContact O-N 2.98Å
485	S	98.5	Very high	97.1	Very high	0 Å²	0	44.1 Å²	44.1	0%	0	21%	0.209	C	C	.	.	H	α-helix	trans	-60.6	-44.4	174.2	-176.4	0	0	0	0	112	Y442 L444 Y482 K483 D488 Y489	Y442-S485 WeakPolarHBondContact O-CB 3.25Å; Y442-S485 PolarHBondContact O-OG 3.05Å; L444-S485 PolarHBondContact N-OG 2.92Å; L444-S485 VanDerWaalsContact N-OG 3.16Å; Y482-S485 PolarHBondContact O-N 2.84Å; K483-S485 VanDerWaalsContact C-N 3.34Å; K483-S485 PolarHBondContact O-N 2.89Å; S485-D488 PolarHBondContact O-N 3.23Å; S485-Y489 WeakPolarHBondContact O-CB 3.31Å; S485-Y489 PolarHBondContact O-N 3.09Å
486	L	98.7	Very high	97.1	Very high	1 Å²	1	40.9 Å²	40.9	1%	0.005	20%	0.195	C	C	.	.	H	α-helix	trans	-67.7	-41.4	178	-64.6	165.1	0	0	0	111.9	I403 T406 S407 I410 M421 L444 F445 Y482 K483 E484 D488 Y489 A490	I403-L486 HydrophobicContact CB-CD1 4.19Å; T406-L486 HydrophobicContact CG2-CD1 3.84Å; S407-L486 WeakPolarHBondContact OG-CD2 3.44Å; I410-L486 HydrophobicContact CD1-CB 3.46Å; I410-L486 VanDerWaalsContact CD1-CB 3.46Å; I410-L486 HydrophobicContact CD1-CD1 4.44Å; M421-L486 HydrophobicContact CG-CD2 3.98Å; M421-L486 HydrophobicContact SD-CB 4.17Å; M421-L486 HydrophobicContact SD-CD2 3.61Å; M421-L486 HydrophobicContact SD-CG 4.46Å; L444-L486 HydrophobicContact CD1-CD2 4.15Å; L444-L486 HydrophobicContact CD1-CG 4.43Å; F445-L486 HydrophobicContact CE2-CD2 3.99Å; F445-L486 HydrophobicContact CZ-CD2 3.84Å; Y482-L486 WeakPolarHBondContact O-CG 3.5Å; Y482-L486 PolarHBondContact O-N 3.13Å; K483-L486 PolarHBondContact O-N 2.96Å; E484-L486 PolarHBondContact O-N 3.27Å; L486-D488 VanDerWaalsContact C-N 3.34Å; L486-Y489 PolarHBondContact O-N 3.32Å; L486-A490 PolarHBondContact O-N 2.63Å
487	E	98.5	Very high	96.9	Very high	57 Å²	57	43.8 Å²	43.8	27%	0.266	21%	0.211	S	C	.	.	H	α-helix	trans	-65.3	-37.8	176.4	-75.1	179.8	173.5	0	0	112.2	I410 K483 E484 A490 K491	I410-E487 HydrophobicContact CD1-CG 3.68Å; I410-E487 HydrophobicContact CG1-CG 4.13Å; K483-E487 IonicContact NZ-OE1 3.82Å; K483-E487 PolarHBondContact NZ-OE1 3.39Å; K483-E487 IonicContact NZ-OE2 2.66Å; K483-E487 WeakPolarHBondContact O-CG 3.27Å; K483-E487 PolarHBondContact O-N 3.38Å; E484-E487 PolarHBondContact O-N 2.88Å; E487-A490 PolarHBondContact O-N 2.94Å; E487-K491 WeakPolarHBondContact O-CG 3.5Å; E487-K491 PolarHBondContact O-N 3.41Å
488	D	98	Very high	96.3	Very high	18 Å²	18	47 Å²	47	10%	0.096	24%	0.243	C	C	.	.	H	α-helix	trans	-74.7	-35.1	179.8	-152.5	17.5	0	0	0	112	R477 Y479 E484 S485 L486 K491 L492	R477-D488 VanDerWaalsContact CD-OD2 3.24Å; R477-D488 WeakPolarHBondContact CD-OD2 3.4Å; R477-D488 IonicContact CZ-OD2 3Å; R477-D488 IonicContact NE-OD2 2.64Å; R477-D488 IonicContact NH1-OD1 3.84Å; R477-D488 PolarHBondContact NH1-OD1 2.97Å; R477-D488 IonicContact NH1-OD2 2.87Å; R477-D488 PolarHBondContact NH1-OD2 3.32Å; Y479-D488 HydrophobicContact CE1-CB 3.85Å; Y479-D488 WeakPolarHBondContact CE1-OD2 3.32Å; Y479-D488 PolarHBondContact OH-OD2 2.82Å; E484-D488 VanDerWaalsContact O-CB 3.24Å; E484-D488 WeakPolarHBondContact O-CB 3.27Å; E484-D488 PolarHBondContact O-N 2.98Å; S485-D488 PolarHBondContact O-N 3.23Å; L486-D488 VanDerWaalsContact C-N 3.34Å; D488-K491 WeakPolarHBondContact O-CB 3.46Å; D488-K491 PolarHBondContact O-N 2.99Å; D488-L492 PolarHBondContact O-N 2.94Å
489	Y	98.2	Very high	96	Very high	5 Å²	5	48.1 Å²	48.1	2%	0.02	27%	0.272	C	S	.	.	H	α-helix	trans	-58	-48.2	165.5	168.1	-87.8	0	0	0	111.7	I416 M421 Q424 F445 S485 L486 K491 L492 I493 Y526	I416-Y489 HydrophobicContact CD1-CE1 4.2Å; M421-Y489 HydrophobicContact CB-CD1 4.3Å; M421-Y489 HydrophobicContact CB-CE1 3.73Å; M421-Y489 HydrophobicContact CE-CD1 3.82Å; M421-Y489 HydrophobicContact CE-CE1 3.88Å; M421-Y489 HydrophobicContact CG-CD1 3.62Å; M421-Y489 HydrophobicContact CG-CE1 3.57Å; M421-Y489 HydrophobicContact CG-CG 4.47Å; M421-Y489 HydrophobicContact SD-CD1 4.08Å; M421-Y489 HydrophobicContact SD-CE1 4.38Å; Q424-Y489 PolarHBondContact OE1-OH 2.79Å; F445-Y489 HydrophobicContact CB-CD2 4.39Å; F445-Y489 AromaticContact CD1-CD2 3.45Å; F445-Y489 HydrophobicContact CD1-CD2 3.45Å; F445-Y489 VanDerWaalsContact CD1-CD2 3.45Å; F445-Y489 AromaticContact CD1-CE2 3.96Å; F445-Y489 HydrophobicContact CD1-CE2 3.96Å; F445-Y489 HydrophobicContact CD1-CG 4.1Å; F445-Y489 VanDerWaalsContact CD2-CB 3.5Å; F445-Y489 HydrophobicContact CD2-CD2 4.04Å; F445-Y489 HydrophobicContact CD2-CG 4.02Å; F445-Y489 HydrophobicContact CE1-CD1 4.48Å; F445-Y489 AromaticContact CE1-CD2 3.56Å; F445-Y489 HydrophobicContact CE1-CD2 3.56Å; F445-Y489 AromaticContact CE1-CE2 3.94Å; F445-Y489 HydrophobicContact CE1-CE2 3.94Å; F445-Y489 AromaticContact CE1-CG 3.87Å; F445-Y489 HydrophobicContact CE1-CG 3.87Å; F445-Y489 VanDerWaalsContact CE2-CB 3.41Å; F445-Y489 HydrophobicContact CE2-CD2 4.15Å; F445-Y489 AromaticContact CE2-CG 3.8Å; F445-Y489 HydrophobicContact CE2-CG 3.8Å; F445-Y489 AromaticContact CG-CD2 3.7Å; F445-Y489 HydrophobicContact CG-CD2 3.7Å; F445-Y489 HydrophobicContact CG-CG 4.16Å; F445-Y489 HydrophobicContact CZ-CD1 4.21Å; F445-Y489 AromaticContact CZ-CD2 3.91Å; F445-Y489 HydrophobicContact CZ-CD2 3.91Å; F445-Y489 AromaticContact CZ-CG 3.71Å; F445-Y489 HydrophobicContact CZ-CG 3.71Å; S485-Y489 WeakPolarHBondContact O-CB 3.31Å; S485-Y489 PolarHBondContact O-N 3.09Å; L486-Y489 PolarHBondContact O-N 3.32Å; Y489-K491 PolarHBondContact O-N 3.49Å; Y489-L492 WeakPolarHBondContact O-CA 3.26Å; Y489-L492 WeakPolarHBondContact O-CB 3.31Å; Y489-L492 PolarHBondContact O-N 3.25Å; Y489-I493 HydrophobicContact CD1-CG1 4.24Å; Y489-I493 HydrophobicContact CD2-CG1 4.33Å; Y489-I493 HydrophobicContact CE1-CG1 3.68Å; Y489-I493 HydrophobicContact CE2-CD1 3.94Å; Y489-I493 HydrophobicContact CE2-CG1 3.79Å; Y489-I493 VanDerWaalsContact CZ-CG1 3.41Å; Y489-I493 WeakPolarHBondContact O-CG1 3.49Å; Y489-I493 PolarHBondContact O-N 3.02Å; Y489-Y526 HydrophobicContact CE2-CE2 4.23Å
490	A	98.3	Very high	95.8	Very high	1 Å²	1	50.3 Å²	50.3	1%	0.008	28%	0.284	C	S	.	.	H	α-helix	trans	-60.3	-37.4	178.5	0	0	0	0	0	111.8	I410 N414 I416 L486 E487 I493 K494	I410-A490 HydrophobicContact CG2-CB 3.49Å; I410-A490 VanDerWaalsContact CG2-CB 3.49Å; N414-A490 HydrophobicContact CB-CB 4.37Å; I416-A490 HydrophobicContact CD1-CB 3.71Å; L486-A490 PolarHBondContact O-N 2.63Å; E487-A490 PolarHBondContact O-N 2.94Å; A490-I493 PolarHBondContact O-N 3.36Å; A490-K494 WeakPolarHBondContact O-CB 3.35Å; A490-K494 WeakPolarHBondContact O-CG 3.08Å; A490-K494 PolarHBondContact O-N 3.03Å
491	K	97.1	Very high	95.7	Very high	85 Å²	85	49.1 Å²	49.1	37%	0.37	28%	0.281	S	S	.	.	H	α-helix	trans	-63.4	-43.7	172.2	-70	168	-161.2	157	0	112	E487 D488 Y489 K494 K495	E487-K491 WeakPolarHBondContact O-CG 3.5Å; E487-K491 PolarHBondContact O-N 3.41Å; D488-K491 WeakPolarHBondContact O-CB 3.46Å; D488-K491 PolarHBondContact O-N 2.99Å; Y489-K491 PolarHBondContact O-N 3.49Å; K491-K494 PolarHBondContact O-N 3.25Å; K491-K495 WeakPolarHBondContact O-CB 3.24Å; K491-K495 WeakPolarHBondContact O-CG 3.46Å; K491-K495 PolarHBondContact O-N 3.29Å
492	L	95.9	Very high	95.6	Very high	37 Å²	37	51.1 Å²	51.1	19%	0.194	29%	0.289	C	S	.	.	H	α-helix	trans	-58	-49.1	176.2	175.5	66	0	0	0	111	I447 D488 Y489 K494 G496 I497 Y504 Y526	I447-L492 HydrophobicContact CD1-CD2 4.31Å; D488-L492 PolarHBondContact O-N 2.94Å; Y489-L492 WeakPolarHBondContact O-CA 3.26Å; Y489-L492 WeakPolarHBondContact O-CB 3.31Å; Y489-L492 PolarHBondContact O-N 3.25Å; L492-K494 VanDerWaalsContact C-N 3.34Å; L492-K494 PolarHBondContact O-N 3.41Å; L492-G496 WeakPolarHBondContact O-CA 3.3Å; L492-G496 PolarHBondContact O-N 3.49Å; L492-I497 HydrophobicContact CD1-CG2 4.31Å; L492-Y504 HydrophobicContact CD1-CE2 4.14Å; L492-Y504 HydrophobicContact CG-CE2 4Å; L492-Y526 HydrophobicContact CD2-CE2 4.49Å
493	I	97.5	Very high	95.5	Very high	1 Å²	1	51.5 Å²	51.5	1%	0.005	29%	0.291	C	S	.	.	H	α-helix	trans	-65.4	-36.5	179.6	-61.2	-56.1	0	0	0	112	I416 Y489 A490 Y504 T507 W508 L522	I416-I493 HydrophobicContact CG2-CG2 3.83Å; Y489-I493 HydrophobicContact CD1-CG1 4.24Å; Y489-I493 HydrophobicContact CD2-CG1 4.33Å; Y489-I493 HydrophobicContact CE1-CG1 3.68Å; Y489-I493 HydrophobicContact CE2-CD1 3.94Å; Y489-I493 HydrophobicContact CE2-CG1 3.79Å; Y489-I493 VanDerWaalsContact CZ-CG1 3.41Å; Y489-I493 WeakPolarHBondContact O-CG1 3.49Å; Y489-I493 PolarHBondContact O-N 3.02Å; A490-I493 PolarHBondContact O-N 3.36Å; I493-Y504 HydrophobicContact CD1-CD1 4.24Å; I493-Y504 HydrophobicContact CD1-CD2 4Å; I493-Y504 HydrophobicContact CD1-CE2 4.39Å; I493-Y504 HydrophobicContact CD1-CG 3.93Å; I493-Y504 WeakPolarHBondContact O-CB 3.34Å; I493-T507 WeakPolarHBondContact CG2-OG1 3.38Å; I493-W508 PolarHBondContact O-NE1 2.96Å; I493-L522 HydrophobicContact CD1-CD2 4.42Å
494	K	97.2	Very high	95.4	Very high	57 Å²	57	47.8 Å²	47.8	25%	0.248	28%	0.275	C	S	.	.	H	α-helix	trans	-85.9	-23	-178.3	-69	-59.9	-62.2	-175.3	0	115.2	N414 I416 A490 K491 L492 W508	N414-K494 HydrophobicContact CB-CG 4.1Å; N414-K494 VanDerWaalsContact O-CD 3.24Å; N414-K494 WeakPolarHBondContact O-CD 3.1Å; N414-K494 WeakPolarHBondContact O-CE 3.47Å; I416-K494 HydrophobicContact CG2-CD 3.81Å; I416-K494 HydrophobicContact CG2-CG 4.28Å; A490-K494 WeakPolarHBondContact O-CB 3.35Å; A490-K494 WeakPolarHBondContact O-CG 3.08Å; A490-K494 PolarHBondContact O-N 3.03Å; K491-K494 PolarHBondContact O-N 3.25Å; L492-K494 VanDerWaalsContact C-N 3.34Å; L492-K494 PolarHBondContact O-N 3.41Å; K494-W508 HydrophobicContact CD-CD2 4.06Å; K494-W508 HydrophobicContact CD-CG 4.24Å; K494-W508 HydrophobicContact CD-CZ2 4.08Å; K494-W508 VanDerWaalsContact NZ-CZ3 3.31Å; K494-W508 WeakPolarHBondContact O-CZ2 3.37Å
495	K	95	Very high	95.4	Very high	148 Å²	148	49.5 Å²	49.5	64%	0.643	28%	0.282	S	S	*	.	H	α-helix	trans	-110	-2.1	-178.8	-60.7	-173.2	175.4	-171.9	0	113.3	K491 A501	K491-K495 WeakPolarHBondContact O-CB 3.24Å; K491-K495 WeakPolarHBondContact O-CG 3.46Å; K491-K495 PolarHBondContact O-N 3.29Å; K495-A501 CarbonylContact C-O 3.52Å; K495-A501 VanDerWaalsContact O-CA 3.3Å; K495-A501 WeakPolarHBondContact O-CA 3.42Å
496	G	92.8	Very high	95.3	Very high	8 Å²	8	51.2 Å²	51.2	8%	0.082	30%	0.296	C	S	.	.			trans	63.3	-152.4	-178.3	0	0	0	0	0	112.6	L492 A501	L492-G496 WeakPolarHBondContact O-CA 3.3Å; L492-G496 PolarHBondContact O-N 3.49Å; G496-A501 WeakPolarHBondContact CA-O 3.42Å; G496-A501 PolarHBondContact N-O 2.98Å
497	I	88.8	Confident	95.2	Very high	70 Å²	70	51.6 Å²	51.6	36%	0.359	30%	0.299	S	S	.	.	B	Isolated β-bridge	trans	-109.7	168.3	-178.7	63.1	174.7	0	0	0	110.4	L492 G499 N500 F503 Y504	L492-I497 HydrophobicContact CD1-CG2 4.31Å; I497-G499 PolarHBondContact O-N 3.48Å; I497-N500 HydrophobicContact CG1-CB 4.06Å; I497-N500 PolarHBondContact N-O 2.93Å; I497-N500 CarbonylContact O-C 3.58Å; I497-N500 VanDerWaalsContact O-C 3.29Å; I497-N500 PolarHBondContact O-N 2.89Å; I497-N500 VanDerWaalsContact O-O 3.14Å; I497-F503 HydrophobicContact CD1-CB 4.4Å; I497-F503 HydrophobicContact CD1-CD1 4.19Å; I497-F503 HydrophobicContact CD1-CD2 3.65Å; I497-F503 HydrophobicContact CD1-CE1 4.38Å; I497-F503 HydrophobicContact CD1-CE2 3.87Å; I497-F503 HydrophobicContact CD1-CG 3.82Å; I497-F503 HydrophobicContact CD1-CZ 4.23Å; I497-F503 HydrophobicContact CG1-CB 3.92Å; I497-F503 HydrophobicContact CG1-CD1 4.34Å; I497-F503 HydrophobicContact CG1-CD2 4.11Å; I497-F503 HydrophobicContact CG1-CG 3.87Å; I497-F503 HydrophobicContact CG2-CD1 4.11Å; I497-F503 HydrophobicContact CG2-CG 4.46Å; I497-Y504 HydrophobicContact CG2-CE2 4.12Å
498	S	84.6	Confident	95.2	Very high	129 Å²	129	50.4 Å²	50.4	90%	0.902	29%	0.292	S	S	*	.	T	Hydrogen-bonded Turn	trans	-54.3	126.8	175.7	-169.5	0	0	0	0	111.1	N500	S498-N500 PolarHBondContact O-N 3.3Å
499	G	91.1	Very high	95.2	Very high	87 Å²	87	52.5 Å²	52.5	90%	0.897	30%	0.3	S	S	*	.	T	Hydrogen-bonded Turn	trans	77.6	-4.3	-177.7	0	0	0	0	0	115.6	I497	I497-G499 PolarHBondContact O-N 3.48Å
500	N	93.2	Very high	95.1	Very high	51 Å²	51	57.7 Å²	57.7	27%	0.273	33%	0.328	S	S	.	.	B	Isolated β-bridge	trans	-146.5	89.7	174.9	-170.7	-5.3	0	0	0	111.6	I497 S498 D502 F503	I497-N500 HydrophobicContact CG1-CB 4.06Å; I497-N500 PolarHBondContact N-O 2.93Å; I497-N500 CarbonylContact O-C 3.58Å; I497-N500 VanDerWaalsContact O-C 3.29Å; I497-N500 PolarHBondContact O-N 2.89Å; I497-N500 VanDerWaalsContact O-O 3.14Å; S498-N500 PolarHBondContact O-N 3.3Å; N500-D502 VanDerWaalsContact C-N 3.26Å; N500-D502 PolarHBondContact O-N 3.5Å; N500-D502 PolarHBondContact OD1-N 3.34Å; N500-F503 HydrophobicContact CB-CB 4.18Å; N500-F503 WeakPolarHBondContact O-CB 3.21Å; N500-F503 PolarHBondContact O-N 3.41Å; N500-F503 PolarHBondContact OD1-N 3.2Å
501	A	94.1	Very high	95.1	Very high	60 Å²	60	62.3 Å²	62.3	50%	0.496	35%	0.35	S	S	.	.	T	Hydrogen-bonded Turn	trans	-66.9	-27.5	-179.1	0	0	0	0	0	113.4	K495 G496 F503	K495-A501 CarbonylContact C-O 3.52Å; K495-A501 VanDerWaalsContact O-CA 3.3Å; K495-A501 WeakPolarHBondContact O-CA 3.42Å; G496-A501 WeakPolarHBondContact CA-O 3.42Å; G496-A501 PolarHBondContact N-O 2.98Å; A501-F503 VanDerWaalsContact C-N 3.34Å
502	D	95.4	Very high	95.1	Very high	85 Å²	85	59.2 Å²	59.2	46%	0.455	34%	0.338	S	S	.	.	T	Hydrogen-bonded Turn	trans	-92.1	7.4	-177.9	-78	4.5	0	0	0	112.5	N500 Y504 K505	N500-D502 VanDerWaalsContact C-N 3.26Å; N500-D502 PolarHBondContact O-N 3.5Å; N500-D502 PolarHBondContact OD1-N 3.34Å; D502-Y504 PolarHBondContact O-N 2.86Å; D502-Y504 VanDerWaalsContact O-N 3.09Å; D502-K505 HydrophobicContact CB-CB 4.05Å; D502-K505 HydrophobicContact CB-CD 3.97Å; D502-K505 VanDerWaalsContact CG-CD 3.41Å; D502-K505 VanDerWaalsContact O-CB 3.23Å; D502-K505 WeakPolarHBondContact O-CB 3.5Å; D502-K505 PolarHBondContact O-N 2.95Å; D502-K505 WeakPolarHBondContact OD2-CD 3.47Å; D502-K505 IonicContact OD2-NZ 3.49Å; D502-K505 PolarHBondContact OD2-NZ 3.34Å
503	F	95.3	Very high	95.1	Very high	48 Å²	48	66.6 Å²	66.6	21%	0.211	37%	0.371	C	S	.	.	T	Hydrogen-bonded Turn	trans	-54.2	-36.3	-172.6	-172.9	-98	0	0	0	114.2	I497 N500 A501 R525	I497-F503 HydrophobicContact CD1-CB 4.4Å; I497-F503 HydrophobicContact CD1-CD1 4.19Å; I497-F503 HydrophobicContact CD1-CD2 3.65Å; I497-F503 HydrophobicContact CD1-CE1 4.38Å; I497-F503 HydrophobicContact CD1-CE2 3.87Å; I497-F503 HydrophobicContact CD1-CG 3.82Å; I497-F503 HydrophobicContact CD1-CZ 4.23Å; I497-F503 HydrophobicContact CG1-CB 3.92Å; I497-F503 HydrophobicContact CG1-CD1 4.34Å; I497-F503 HydrophobicContact CG1-CD2 4.11Å; I497-F503 HydrophobicContact CG1-CG 3.87Å; I497-F503 HydrophobicContact CG2-CD1 4.11Å; I497-F503 HydrophobicContact CG2-CG 4.46Å; N500-F503 HydrophobicContact CB-CB 4.18Å; N500-F503 WeakPolarHBondContact O-CB 3.21Å; N500-F503 PolarHBondContact O-N 3.41Å; N500-F503 PolarHBondContact OD1-N 3.2Å; A501-F503 VanDerWaalsContact C-N 3.34Å; F503-R525 HydrophobicContact CE1-CB 3.96Å; F503-R525 HydrophobicContact CZ-CB 4Å; F503-R525 HydrophobicContact CZ-CG 4.4Å
504	Y	97	Very high	95.1	Very high	16 Å²	16	68.3 Å²	68.3	6%	0.063	38%	0.384	C	S	.	.	T	Hydrogen-bonded Turn	trans	-109.2	11.7	176.4	-63	-63.3	0	0	0	113.3	L492 I493 I497 D502 A506 T507 W508 L522 R525 Y526	L492-Y504 HydrophobicContact CD1-CE2 4.14Å; L492-Y504 HydrophobicContact CG-CE2 4Å; I493-Y504 HydrophobicContact CD1-CD1 4.24Å; I493-Y504 HydrophobicContact CD1-CD2 4Å; I493-Y504 HydrophobicContact CD1-CE2 4.39Å; I493-Y504 HydrophobicContact CD1-CG 3.93Å; I493-Y504 WeakPolarHBondContact O-CB 3.34Å; I497-Y504 HydrophobicContact CG2-CE2 4.12Å; D502-Y504 PolarHBondContact O-N 2.86Å; D502-Y504 VanDerWaalsContact O-N 3.09Å; Y504-A506 VanDerWaalsContact C-N 3.25Å; Y504-A506 PolarHBondContact O-N 3.48Å; Y504-T507 PolarHBondContact O-N 2.9Å; Y504-T507 PolarHBondContact O-OG1 3.31Å; Y504-W508 PolarHBondContact O-NE1 2.98Å; Y504-L522 HydrophobicContact CD1-CD2 3.98Å; Y504-L522 HydrophobicContact CE1-CD2 4.1Å; Y504-R525 HydrophobicContact CE1-CB 4.44Å; Y504-Y526 HydrophobicContact CE1-CD2 4.15Å
505	K	97.3	Very high	95.1	Very high	75 Å²	75	67.4 Å²	67.4	33%	0.326	38%	0.379	S	S	.	.	G	3₁₀ helix	trans	-56.7	-39.9	-175.7	-179.4	171.6	177.4	-177.7	0	113.1	D502 T507 W508 Q511	D502-K505 HydrophobicContact CB-CB 4.05Å; D502-K505 HydrophobicContact CB-CD 3.97Å; D502-K505 VanDerWaalsContact CG-CD 3.41Å; D502-K505 VanDerWaalsContact O-CB 3.23Å; D502-K505 WeakPolarHBondContact O-CB 3.5Å; D502-K505 PolarHBondContact O-N 2.95Å; D502-K505 WeakPolarHBondContact OD2-CD 3.47Å; D502-K505 IonicContact OD2-NZ 3.49Å; D502-K505 PolarHBondContact OD2-NZ 3.34Å; K505-T507 PolarHBondContact O-N 2.8Å; K505-T507 VanDerWaalsContact O-N 3.07Å; K505-W508 HydrophobicContact CB-CD2 4.48Å; K505-W508 HydrophobicContact CB-CH2 4.4Å; K505-W508 HydrophobicContact CB-CZ2 4.18Å; K505-W508 HydrophobicContact CD-CH2 4.45Å; K505-W508 HydrophobicContact CD-CZ3 4.4Å; K505-W508 HydrophobicContact CG-CD2 4.18Å; K505-W508 HydrophobicContact CG-CE3 3.94Å; K505-W508 HydrophobicContact CG-CH2 4.04Å; K505-W508 HydrophobicContact CG-CZ2 4.26Å; K505-W508 HydrophobicContact CG-CZ3 3.88Å; K505-W508 WeakPolarHBondContact O-CB 3.33Å; K505-W508 PolarHBondContact O-N 3.43Å; K505-W508 VanDerWaalsContact O-N 3.14Å; K505-Q511 HydrophobicContact CG-CG 4.28Å; K505-Q511 WeakPolarHBondContact O-CG 3.49Å
506	A	97	Very high	95.2	Very high	37 Å²	37	65.5 Å²	65.5	31%	0.306	37%	0.37	S	S	.	.	G	3₁₀ helix	trans	-68.3	-2.7	179.1	0	0	0	0	0	114.5	Y504 T512 H521	Y504-A506 VanDerWaalsContact C-N 3.25Å; Y504-A506 PolarHBondContact O-N 3.48Å; A506-T512 WeakPolarHBondContact O-CG2 3.47Å; A506-H521 HydrophobicContact CB-CB 4.34Å; A506-H521 WeakPolarHBondContact CB-CD2 3.24Å; A506-H521 PolarHBondContact O-ND1 3.09Å
507	T	97.2	Very high	95.5	Very high	9 Å²	9	67.2 Å²	67.2	6%	0.055	38%	0.378	C	S	.	.	G	3₁₀ helix	trans	-97.4	-1.2	174.8	80.9	0	0	0	0	112.8	I493 Y504 K505 H521 L522	I493-T507 WeakPolarHBondContact CG2-OG1 3.38Å; Y504-T507 PolarHBondContact O-N 2.9Å; Y504-T507 PolarHBondContact O-OG1 3.31Å; K505-T507 PolarHBondContact O-N 2.8Å; K505-T507 VanDerWaalsContact O-N 3.07Å; T507-H521 HydrophobicContact CG2-CB 3.82Å; T507-L522 HydrophobicContact CG2-CD2 3.88Å; T507-L522 HydrophobicContact CG2-CG 3.86Å
508	W	98.3	Very high	95.9	Very high	32 Å²	32	63.9 Å²	63.9	12%	0.121	36%	0.361	C	S	.	.	S	Bend	trans	-79	149.9	-176.7	-57.6	-5.3	0	0	0	111	I493 K494 Y504 K505 D510 Q511 T512	I493-W508 PolarHBondContact O-NE1 2.96Å; K494-W508 HydrophobicContact CD-CD2 4.06Å; K494-W508 HydrophobicContact CD-CG 4.24Å; K494-W508 HydrophobicContact CD-CZ2 4.08Å; K494-W508 VanDerWaalsContact NZ-CZ3 3.31Å; K494-W508 WeakPolarHBondContact O-CZ2 3.37Å; Y504-W508 PolarHBondContact O-NE1 2.98Å; K505-W508 HydrophobicContact CB-CD2 4.48Å; K505-W508 HydrophobicContact CB-CH2 4.4Å; K505-W508 HydrophobicContact CB-CZ2 4.18Å; K505-W508 HydrophobicContact CD-CH2 4.45Å; K505-W508 HydrophobicContact CD-CZ3 4.4Å; K505-W508 HydrophobicContact CG-CD2 4.18Å; K505-W508 HydrophobicContact CG-CE3 3.94Å; K505-W508 HydrophobicContact CG-CH2 4.04Å; K505-W508 HydrophobicContact CG-CZ2 4.26Å; K505-W508 HydrophobicContact CG-CZ3 3.88Å; K505-W508 WeakPolarHBondContact O-CB 3.33Å; K505-W508 PolarHBondContact O-N 3.43Å; K505-W508 VanDerWaalsContact O-N 3.14Å; W508-D510 VanDerWaalsContact CB-OD1 3.32Å; W508-D510 WeakPolarHBondContact CB-OD1 3.38Å; W508-D510 PolarHBondContact O-N 3.13Å; W508-D510 VanDerWaalsContact O-N 3.1Å; W508-Q511 HydrophobicContact CB-CG 4.19Å; W508-Q511 PolarHBondContact O-N 2.94Å; W508-T512 PolarHBondContact O-N 3.03Å; W508-T512 PolarHBondContact O-OG1 3.27Å
509	K	97.4	Very high	96.4	Very high	62 Å²	62	57.8 Å²	57.8	27%	0.27	32%	0.318	S	S	.	.	T	Hydrogen-bonded Turn	trans	-59.1	-27.7	-176	-70.2	-177	64.7	176.3	0	114	G415 Y417 Q511 T512 D549	G415-K509 PolarHBondContact O-N 2.79Å; Y417-K509 HydrophobicContact CD1-CD 4.43Å; Y417-K509 HydrophobicContact CD1-CG 4.06Å; Y417-K509 HydrophobicContact CD2-CG 3.84Å; Y417-K509 HydrophobicContact CE1-CD 4.5Å; Y417-K509 HydrophobicContact CE1-CG 3.95Å; Y417-K509 HydrophobicContact CE2-CB 4.29Å; Y417-K509 HydrophobicContact CE2-CG 3.71Å; Y417-K509 HydrophobicContact CG-CG 4Å; K509-Q511 VanDerWaalsContact C-N 3.35Å; K509-T512 VanDerWaalsContact O-O 3.12Å; K509-D549 PolarHBondContact NZ-O 3.12Å
510	D	97.1	Very high	96.6	Very high	113 Å²	113	59.8 Å²	59.8	60%	0.604	30%	0.304	S	S	*	.	T	Hydrogen-bonded Turn	trans	-86.2	-7	179.3	65.5	-12.4	0	0	0	113.3	W508	W508-D510 VanDerWaalsContact CB-OD1 3.32Å; W508-D510 WeakPolarHBondContact CB-OD1 3.38Å; W508-D510 PolarHBondContact O-N 3.13Å; W508-D510 VanDerWaalsContact O-N 3.1Å
511	Q	97.3	Very high	96.7	Very high	99 Å²	99	60.3 Å²	60.3	46%	0.463	31%	0.305	S	S	.	.	S	Bend	trans	-105	-1.2	175.7	-55.3	-51.5	-67.2	0	0	112.8	K505 W508 K509	K505-Q511 HydrophobicContact CG-CG 4.28Å; K505-Q511 WeakPolarHBondContact O-CG 3.49Å; W508-Q511 HydrophobicContact CB-CG 4.19Å; W508-Q511 PolarHBondContact O-N 2.94Å; K509-Q511 VanDerWaalsContact C-N 3.35Å
512	T	97.5	Very high	96.7	Very high	20 Å²	20	57.5 Å²	57.5	12%	0.123	28%	0.281	C	S	.	.			trans	-137.2	150.3	-170.3	54.4	0	0	0	0	111	Y417 A506 W508 K509 D517 A518	Y417-T512 WeakPolarHBondContact CE2-OG1 3.47Å; Y417-T512 PolarHBondContact OH-OG1 2.95Å; A506-T512 WeakPolarHBondContact O-CG2 3.47Å; W508-T512 PolarHBondContact O-N 3.03Å; W508-T512 PolarHBondContact O-OG1 3.27Å; K509-T512 VanDerWaalsContact O-O 3.12Å; T512-D517 HydrophobicContact CG2-CB 3.75Å; T512-A518 HydrophobicContact CG2-CB 4.36Å
513	E	96.1	Very high	96.4	Very high	191 Å²	191	55.9 Å²	55.9	89%	0.893	27%	0.271	S	S	*	.	S	Bend	trans	-80.6	-32.7	173	-59.8	-173.1	168.2	0	0	110.8	D517	E513-D517 WeakPolarHBondContact CA-OD2 3.28Å; E513-D517 WeakPolarHBondContact CB-OD2 3.21Å; E513-D517 PolarHBondContact N-OD2 3.44Å
514	S	97.1	Very high	95.6	Very high	38 Å²	38	56.2 Å²	56.2	27%	0.266	29%	0.288	S	S	.	.	S	Bend	trans	-149.9	170.1	-177.9	76.8	0	0	0	0	113.3	Y417 K516 D517 A518	Y417-S514 VanDerWaalsContact CZ-C 3.46Å; Y417-S514 VanDerWaalsContact OH-C 3.29Å; Y417-S514 WeakPolarHBondContact OH-CA 3.47Å; S514-K516 PolarHBondContact O-N 2.99Å; S514-K516 VanDerWaalsContact O-N 3.12Å; S514-K516 WeakPolarHBondContact OG-CB 3.45Å; S514-K516 PolarHBondContact OG-N 3.38Å; S514-D517 PolarHBondContact N-OD2 3.03Å; S514-D517 PolarHBondContact O-N 3.29Å; S514-A518 PolarHBondContact O-N 3.32Å
515	Y	97.9	Very high	95.2	Very high	37 Å²	37	61.2 Å²	61.2	15%	0.145	31%	0.307	C	S	.	.	H	α-helix	trans	-58.8	-23.5	173	71.5	-95.9	0	0	0	112.7	A518 T519 N537 I540 T546	Y515-A518 WeakPolarHBondContact O-CB 3.29Å; Y515-A518 PolarHBondContact O-N 3.17Å; Y515-T519 WeakPolarHBondContact O-CG2 3.38Å; Y515-T519 PolarHBondContact O-N 3.02Å; Y515-T519 PolarHBondContact O-OG1 2.92Å; Y515-N537 WeakPolarHBondContact CD2-OD1 3.31Å; Y515-N537 VanDerWaalsContact CE2-OD1 3.29Å; Y515-N537 WeakPolarHBondContact CE2-OD1 3.5Å; Y515-I540 HydrophobicContact CD1-CG2 4.36Å; Y515-I540 HydrophobicContact CD2-CB 4.44Å; Y515-I540 HydrophobicContact CD2-CD1 3.43Å; Y515-I540 VanDerWaalsContact CD2-CD1 3.43Å; Y515-I540 HydrophobicContact CD2-CG2 4.02Å; Y515-I540 HydrophobicContact CE1-CG2 4.02Å; Y515-I540 HydrophobicContact CE2-CB 4.04Å; Y515-I540 HydrophobicContact CE2-CD1 3.85Å; Y515-I540 HydrophobicContact CE2-CG2 3.65Å; Y515-I540 HydrophobicContact CG-CD1 4.14Å; Y515-I540 HydrophobicContact CG-CG2 4.36Å; Y515-T546 HydrophobicContact CD1-CG2 3.63Å; Y515-T546 HydrophobicContact CE1-CG2 3.41Å; Y515-T546 VanDerWaalsContact CE1-CG2 3.41Å
516	K	97.7	Very high	94.5	Very high	108 Å²	108	59.6 Å²	59.6	47%	0.47	30%	0.299	S	S	.	.	H	α-helix	trans	-66.8	-38.5	-180	-66	172.3	173.8	-100.5	0	111.4	S514 A518 T519 E520	S514-K516 PolarHBondContact O-N 2.99Å; S514-K516 VanDerWaalsContact O-N 3.12Å; S514-K516 WeakPolarHBondContact OG-CB 3.45Å; S514-K516 PolarHBondContact OG-N 3.38Å; K516-A518 VanDerWaalsContact C-N 3.3Å; K516-T519 PolarHBondContact O-N 3.27Å; K516-T519 PolarHBondContact O-OG1 3.32Å; K516-E520 WeakPolarHBondContact O-CB 3.49Å; K516-E520 PolarHBondContact O-N 3.44Å
517	D	97.7	Very high	93.3	Very high	44 Å²	44	58.9 Å²	58.9	24%	0.235	29%	0.293	C	S	.	.	H	α-helix	trans	-67.2	-39.7	175.7	-42	-38.5	0	0	0	109.2	T512 E513 S514 E520 H521	T512-D517 HydrophobicContact CG2-CB 3.75Å; E513-D517 WeakPolarHBondContact CA-OD2 3.28Å; E513-D517 WeakPolarHBondContact CB-OD2 3.21Å; E513-D517 PolarHBondContact N-OD2 3.44Å; S514-D517 PolarHBondContact N-OD2 3.03Å; S514-D517 PolarHBondContact O-N 3.29Å; D517-E520 PolarHBondContact O-N 3.47Å; D517-H521 PolarHBondContact O-N 2.85Å; D517-H521 PolarHBondContact O-ND1 2.99Å
518	A	97.9	Very high	91.9	Very high	1 Å²	1	64.2 Å²	64.2	1%	0.008	33%	0.326	C	S	.	.	H	α-helix	trans	-62.9	-43.2	176.7	0	0	0	0	0	112.2	Y417 V420 T512 S514 Y515 K516 H521 L522	Y417-A518 HydrophobicContact CD2-CB 3.74Å; Y417-A518 HydrophobicContact CE2-CB 3.89Å; V420-A518 HydrophobicContact CG2-CB 4.44Å; T512-A518 HydrophobicContact CG2-CB 4.36Å; S514-A518 PolarHBondContact O-N 3.32Å; Y515-A518 WeakPolarHBondContact O-CB 3.29Å; Y515-A518 PolarHBondContact O-N 3.17Å; K516-A518 VanDerWaalsContact C-N 3.3Å; A518-H521 PolarHBondContact O-N 2.72Å; A518-L522 WeakPolarHBondContact O-CG 3.28Å; A518-L522 PolarHBondContact O-N 3.15Å
519	T	96	Very high	90.3	Very high	0 Å²	0	65 Å²	65	0%	0	33%	0.332	C	S	.	.	H	α-helix	trans	-68.1	-36.9	177.7	58	0	0	0	0	112.3	V420 Y515 K516 L522 Q523 A533 L536 N537 I540	V420-T519 HydrophobicContact CG1-CG2 4.24Å; V420-T519 HydrophobicContact CG2-CG2 3.88Å; Y515-T519 WeakPolarHBondContact O-CG2 3.38Å; Y515-T519 PolarHBondContact O-N 3.02Å; Y515-T519 PolarHBondContact O-OG1 2.92Å; K516-T519 PolarHBondContact O-N 3.27Å; K516-T519 PolarHBondContact O-OG1 3.32Å; T519-L522 PolarHBondContact O-N 3.28Å; T519-Q523 PolarHBondContact O-N 3.22Å; T519-Q523 VanDerWaalsContact O-N 3.12Å; T519-A533 WeakPolarHBondContact O-CB 3.14Å; T519-L536 HydrophobicContact CG2-CB 3.64Å; T519-L536 HydrophobicContact CG2-CD1 3.79Å; T519-L536 HydrophobicContact CG2-CG 4.4Å; T519-N537 PolarHBondContact OG1-ND2 3.26Å; T519-N537 PolarHBondContact OG1-OD1 2.88Å; T519-I540 HydrophobicContact CG2-CD1 4.25Å
520	E	95.2	Very high	89.2	Confident	129 Å²	129	70.4 Å²	70.4	60%	0.603	36%	0.356	S	S	*	.	H	α-helix	trans	-61.7	-42.2	172.4	-174.8	172.9	-166.3	0	0	111.9	K516 D517 L522 Q523	K516-E520 WeakPolarHBondContact O-CB 3.49Å; K516-E520 PolarHBondContact O-N 3.44Å; D517-E520 PolarHBondContact O-N 3.47Å; E520-L522 VanDerWaalsContact C-N 3.31Å; E520-L522 PolarHBondContact O-N 3Å; E520-Q523 WeakPolarHBondContact O-CB 3.43Å; E520-Q523 PolarHBondContact O-N 3.14Å
521	H	95.3	Very high	88.3	Confident	62 Å²	62	70.1 Å²	70.1	29%	0.287	35%	0.351	S	S	.	.	H	α-helix	trans	-67.1	-30.7	175.4	-75.4	96.3	0	0	0	112.9	A506 T507 D517 A518 R525	A506-H521 HydrophobicContact CB-CB 4.34Å; A506-H521 WeakPolarHBondContact CB-CD2 3.24Å; A506-H521 PolarHBondContact O-ND1 3.09Å; T507-H521 HydrophobicContact CG2-CB 3.82Å; D517-H521 PolarHBondContact O-N 2.85Å; D517-H521 PolarHBondContact O-ND1 2.99Å; A518-H521 PolarHBondContact O-N 2.72Å; H521-R525 WeakPolarHBondContact O-CD 3.38Å; H521-R525 WeakPolarHBondContact O-CG 2.99Å; H521-R525 PolarHBondContact O-NH1 3.3Å
522	L	93.8	Very high	87.6	Confident	1 Å²	1	65.6 Å²	65.6	1%	0.005	33%	0.329	C	S	.	.	H	α-helix	trans	-71.3	-30.6	175.7	-72	167.1	0	0	0	112.7	V420 Q424 I493 Y504 T507 A518 T519 E520 G524 R525 Y526 Y532 L536	V420-L522 HydrophobicContact CG1-CD1 3.44Å; V420-L522 VanDerWaalsContact CG1-CD1 3.44Å; Q424-L522 VanDerWaalsContact OE1-CD1 3.3Å; I493-L522 HydrophobicContact CD1-CD2 4.42Å; Y504-L522 HydrophobicContact CD1-CD2 3.98Å; Y504-L522 HydrophobicContact CE1-CD2 4.1Å; T507-L522 HydrophobicContact CG2-CD2 3.88Å; T507-L522 HydrophobicContact CG2-CG 3.86Å; A518-L522 WeakPolarHBondContact O-CG 3.28Å; A518-L522 PolarHBondContact O-N 3.15Å; T519-L522 PolarHBondContact O-N 3.28Å; E520-L522 VanDerWaalsContact C-N 3.31Å; E520-L522 PolarHBondContact O-N 3Å; L522-G524 PolarHBondContact O-N 2.93Å; L522-R525 PolarHBondContact O-N 2.98Å; L522-Y526 HydrophobicContact CD2-CD2 4.16Å; L522-Y526 HydrophobicContact CD2-CG 4.28Å; L522-Y526 PolarHBondContact O-N 3.06Å; L522-Y532 HydrophobicContact CB-CD1 4.2Å; L522-Y532 HydrophobicContact CB-CE1 4.12Å; L522-L536 HydrophobicContact CD1-CD1 4.18Å
523	Q	87.8	Confident	87.2	Confident	51 Å²	51	65 Å²	65	24%	0.238	33%	0.326	C	S	.	.	B	Isolated β-bridge	trans	-60.4	131.6	177.5	178.1	157.8	-63.1	0	0	111.6	T519 E520 R525 K530 A533 E534	T519-Q523 PolarHBondContact O-N 3.22Å; T519-Q523 VanDerWaalsContact O-N 3.12Å; E520-Q523 WeakPolarHBondContact O-CB 3.43Å; E520-Q523 PolarHBondContact O-N 3.14Å; Q523-R525 PolarHBondContact O-N 3.09Å; Q523-R525 VanDerWaalsContact O-N 3.14Å; Q523-K530 PolarHBondContact NE2-O 3.25Å; Q523-K530 PolarHBondContact OE1-O 2.93Å; Q523-A533 HydrophobicContact CB-CB 4.17Å; Q523-E534 PolarHBondContact OE1-OE2 3.07Å
524	G	79.6	Confident	86.7	Confident	55 Å²	55	60.4 Å²	60.4	57%	0.567	31%	0.305	S	S	*	.	T	Hydrogen-bonded Turn	trans	70.5	-2.6	-175.3	0	0	0	0	0	115	L522 A527	L522-G524 PolarHBondContact O-N 2.93Å; G524-A527 CarbonylContact C-O 3.54Å; G524-A527 WeakPolarHBondContact CA-O 3.3Å; G524-A527 PolarHBondContact N-O 3.49Å
525	R	87.8	Confident	86	Confident	122 Å²	122	59.7 Å²	59.7	46%	0.46	30%	0.297	S	S	.	.	T	Hydrogen-bonded Turn	trans	-113.7	-52	178.2	-65.7	-170.4	-175.6	66.7	1.6	112.4	F503 Y504 H521 L522 Q523	F503-R525 HydrophobicContact CE1-CB 3.96Å; F503-R525 HydrophobicContact CZ-CB 4Å; F503-R525 HydrophobicContact CZ-CG 4.4Å; Y504-R525 HydrophobicContact CE1-CB 4.44Å; H521-R525 WeakPolarHBondContact O-CD 3.38Å; H521-R525 WeakPolarHBondContact O-CG 2.99Å; H521-R525 PolarHBondContact O-NH1 3.3Å; L522-R525 PolarHBondContact O-N 2.98Å; Q523-R525 PolarHBondContact O-N 3.09Å; Q523-R525 VanDerWaalsContact O-N 3.14Å
526	Y	83.9	Confident	85.6	Confident	41 Å²	41	57.9 Å²	57.9	16%	0.161	29%	0.29	C	S	.	.	T	Hydrogen-bonded Turn	trans	-79.3	-47.7	175.1	-168.9	-80.8	0	0	0	110.5	Q424 E428 F445 Y489 L492 Y504 L522 Y532	Q424-Y526 VanDerWaalsContact NE2-CD1 3.31Å; Q424-Y526 VanDerWaalsContact NE2-CG 3.32Å; E428-Y526 HydrophobicContact CG-CE1 4.18Å; F445-Y526 PolarHBondContact O-OH 3.41Å; Y489-Y526 HydrophobicContact CE2-CE2 4.23Å; L492-Y526 HydrophobicContact CD2-CE2 4.49Å; Y504-Y526 HydrophobicContact CE1-CD2 4.15Å; L522-Y526 HydrophobicContact CD2-CD2 4.16Å; L522-Y526 HydrophobicContact CD2-CG 4.28Å; L522-Y526 PolarHBondContact O-N 3.06Å; Y526-Y532 HydrophobicContact CD1-CE1 4.06Å; Y526-Y532 AromaticContact CD1-CZ 3.76Å; Y526-Y532 WeakPolarHBondContact CD1-OH 3.46Å; Y526-Y532 WeakPolarHBondContact CE1-OH 2.59Å; Y526-Y532 HydrophobicContact CG-CE1 4.41Å
527	A	71.6	Confident	85.3	Confident	22 Å²	22	54.3 Å²	54.3	18%	0.182	28%	0.276	C	S	.	.	B	Isolated β-bridge	trans	-125.3	146.1	174.4	0	0	0	0	0	109.9	G524 D529 Y532	G524-A527 CarbonylContact C-O 3.54Å; G524-A527 WeakPolarHBondContact CA-O 3.3Å; G524-A527 PolarHBondContact N-O 3.49Å; A527-D529 HydrophobicContact CB-CB 4.24Å; A527-D529 PolarHBondContact O-N 3.25Å; A527-Y532 HydrophobicContact CB-CD1 4.33Å; A527-Y532 HydrophobicContact CB-CD2 3.56Å; A527-Y532 HydrophobicContact CB-CE1 4.42Å; A527-Y532 HydrophobicContact CB-CE2 3.67Å; A527-Y532 HydrophobicContact CB-CG 3.91Å
528	T	66.1	Low	84.6	Confident	121 Å²	121	53 Å²	53	74%	0.742	27%	0.271	S	S	*	.	S	Bend	trans	-71.8	-9.2	172.9	50.4	0	0	0	0	112.9	K530	T528-K530 PolarHBondContact O-N 2.95Å
529	D	65.3	Low	83.8	Confident	48 Å²	48	53 Å²	53	26%	0.257	27%	0.271	S	S	.	.			trans	-61.3	120.8	177.4	-177.1	2.2	0	0	0	111.7	A527 Q531 Y532 K535	A527-D529 HydrophobicContact CB-CB 4.24Å; A527-D529 PolarHBondContact O-N 3.25Å; D529-Q531 PolarHBondContact O-N 3.01Å; D529-Q531 PolarHBondContact OD1-N 3.37Å; D529-Y532 HydrophobicContact CB-CD2 4.42Å; D529-Y532 WeakPolarHBondContact O-CB 3.42Å; D529-Y532 PolarHBondContact O-N 3.43Å; D529-K535 IonicContact OD1-NZ 2.72Å; D529-K535 WeakPolarHBondContact OD2-CE 3.19Å; D529-K535 IonicContact OD2-NZ 3.32Å; D529-K535 PolarHBondContact OD2-NZ 3.25Å
530	K	75.5	Confident	83.5	Confident	176 Å²	176	53 Å²	53	77%	0.765	27%	0.271	S	S	*	.	T	Hydrogen-bonded Turn	trans	-74.7	-7.2	179.2	-64.4	-174.6	-179.4	179.9	0	113.8	Q523 T528	Q523-K530 PolarHBondContact NE2-O 3.25Å; Q523-K530 PolarHBondContact OE1-O 2.93Å; T528-K530 PolarHBondContact O-N 2.95Å
531	Q	78	Confident	83.1	Confident	107 Å²	107	52.9 Å²	52.9	50%	0.5	27%	0.269	S	S	.	.	T	Hydrogen-bonded Turn	trans	-114.6	16.4	177.1	-58.5	-173.2	-64.3	0	0	112	D529 A533 E534 K535	D529-Q531 PolarHBondContact O-N 3.01Å; D529-Q531 PolarHBondContact OD1-N 3.37Å; Q531-A533 PolarHBondContact O-N 3.12Å; Q531-E534 VanDerWaalsContact C-OE2 3.26Å; Q531-E534 WeakPolarHBondContact CA-OE2 3.37Å; Q531-E534 PolarHBondContact O-N 3.22Å; Q531-K535 VanDerWaalsContact O-CG 3.29Å; Q531-K535 WeakPolarHBondContact O-CG 3.27Å; Q531-K535 PolarHBondContact O-N 2.92Å
532	Y	81	Confident	82.2	Confident	3 Å²	3	50.9 Å²	50.9	1%	0.012	26%	0.263	C	S	.	.	H	α-helix	trans	-62	-44.4	-174.8	-164.7	-113.4	0	0	0	111.6	Q424 L427 E428 L522 Y526 A527 D529 E534 K535 L536	Q424-Y532 HydrophobicContact CG-CE1 4.44Å; Q424-Y532 WeakPolarHBondContact CG-OH 3.21Å; Q424-Y532 PolarHBondContact NE2-OH 3.5Å; L427-Y532 HydrophobicContact CD2-CD2 3.89Å; L427-Y532 HydrophobicContact CD2-CE2 3.49Å; L427-Y532 VanDerWaalsContact CD2-CE2 3.49Å; E428-Y532 WeakPolarHBondContact OE1-CE2 3.4Å; E428-Y532 VanDerWaalsContact OE1-CZ 3.29Å; E428-Y532 PolarHBondContact OE1-OH 3.21Å; L522-Y532 HydrophobicContact CB-CD1 4.2Å; L522-Y532 HydrophobicContact CB-CE1 4.12Å; Y526-Y532 HydrophobicContact CD1-CE1 4.06Å; Y526-Y532 AromaticContact CD1-CZ 3.76Å; Y526-Y532 WeakPolarHBondContact CD1-OH 3.46Å; Y526-Y532 WeakPolarHBondContact CE1-OH 2.59Å; Y526-Y532 HydrophobicContact CG-CE1 4.41Å; A527-Y532 HydrophobicContact CB-CD1 4.33Å; A527-Y532 HydrophobicContact CB-CD2 3.56Å; A527-Y532 HydrophobicContact CB-CE1 4.42Å; A527-Y532 HydrophobicContact CB-CE2 3.67Å; A527-Y532 HydrophobicContact CB-CG 3.91Å; D529-Y532 HydrophobicContact CB-CD2 4.42Å; D529-Y532 WeakPolarHBondContact O-CB 3.42Å; D529-Y532 PolarHBondContact O-N 3.43Å; Y532-E534 PolarHBondContact O-N 2.93Å; Y532-K535 PolarHBondContact O-N 2.92Å; Y532-L536 HydrophobicContact CD1-CD1 3.81Å; Y532-L536 HydrophobicContact CD1-CG 4.35Å; Y532-L536 HydrophobicContact CE1-CD1 3.49Å; Y532-L536 VanDerWaalsContact CE1-CD1 3.49Å; Y532-L536 HydrophobicContact CE1-CG 4.18Å; Y532-L536 WeakPolarHBondContact O-CG 3.35Å; Y532-L536 PolarHBondContact O-N 3.25Å
533	A	89.6	Confident	81.8	Confident	7 Å²	7	51.4 Å²	51.4	6%	0.058	27%	0.265	C	S	.	.	H	α-helix	trans	-63.6	-44	-179.8	0	0	0	0	0	111.3	T519 Q523 Q531 K535 L536 N537	T519-A533 WeakPolarHBondContact O-CB 3.14Å; Q523-A533 HydrophobicContact CB-CB 4.17Å; Q531-A533 PolarHBondContact O-N 3.12Å; A533-K535 PolarHBondContact O-N 3.28Å; A533-L536 PolarHBondContact O-N 3.19Å; A533-N537 VanDerWaalsContact O-CB 3.27Å; A533-N537 WeakPolarHBondContact O-CB 3.46Å; A533-N537 PolarHBondContact O-N 3.17Å; A533-N537 PolarHBondContact O-ND2 2.82Å; A533-N537 VanDerWaalsContact O-ND2 3.1Å
534	E	85.7	Confident	82	Confident	96 Å²	96	53.4 Å²	53.4	45%	0.449	28%	0.277	S	S	.	.	H	α-helix	trans	-62	-42.1	177.2	-66.3	82.3	176.1	0	0	111.7	Q523 Q531 Y532 N537 A538	Q523-E534 PolarHBondContact OE1-OE2 3.07Å; Q531-E534 VanDerWaalsContact C-OE2 3.26Å; Q531-E534 WeakPolarHBondContact CA-OE2 3.37Å; Q531-E534 PolarHBondContact O-N 3.22Å; Y532-E534 PolarHBondContact O-N 2.93Å; E534-N537 PolarHBondContact O-N 3.11Å; E534-A538 VanDerWaalsContact O-CB 3.27Å; E534-A538 WeakPolarHBondContact O-CB 3.4Å; E534-A538 PolarHBondContact O-N 2.92Å
535	K	82.8	Confident	82.7	Confident	22 Å²	22	50.8 Å²	50.8	10%	0.096	25%	0.25	C	C	.	.	H	α-helix	trans	-62.2	-48.2	176.6	-73.2	170.3	-177.4	177.4	0	111.7	F388 L427 D529 Q531 Y532 A533 A538 I539	F388-K535 HydrophobicContact CD1-CG 4.33Å; F388-K535 HydrophobicContact CD2-CG 4.16Å; F388-K535 HydrophobicContact CE1-CG 4.42Å; F388-K535 HydrophobicContact CE2-CG 4.25Å; F388-K535 HydrophobicContact CG-CG 4.2Å; F388-K535 HydrophobicContact CZ-CG 4.38Å; L427-K535 HydrophobicContact CD2-CB 4.14Å; L427-K535 HydrophobicContact CD2-CD 4.49Å; D529-K535 IonicContact OD1-NZ 2.72Å; D529-K535 WeakPolarHBondContact OD2-CE 3.19Å; D529-K535 IonicContact OD2-NZ 3.32Å; D529-K535 PolarHBondContact OD2-NZ 3.25Å; Q531-K535 VanDerWaalsContact O-CG 3.29Å; Q531-K535 WeakPolarHBondContact O-CG 3.27Å; Q531-K535 PolarHBondContact O-N 2.92Å; Y532-K535 PolarHBondContact O-N 2.92Å; A533-K535 PolarHBondContact O-N 3.28Å; K535-A538 PolarHBondContact O-N 3.39Å; K535-I539 WeakPolarHBondContact O-CG1 3.01Å; K535-I539 PolarHBondContact O-N 3.04Å
536	L	89.4	Confident	83.2	Confident	0 Å²	0	47.6 Å²	47.6	0%	0	24%	0.244	C	C	.	.	H	α-helix	trans	-63	-45.9	177.9	-65.9	-176.5	0	0	0	111.4	V420 A423 Q424 L427 T519 L522 Y532 A533 A538 I539 I540	V420-L536 HydrophobicContact CG1-CD1 4.5Å; A423-L536 HydrophobicContact CB-CD2 3.93Å; Q424-L536 HydrophobicContact CB-CD2 4.41Å; Q424-L536 HydrophobicContact CG-CD1 3.75Å; Q424-L536 HydrophobicContact CG-CD2 3.66Å; Q424-L536 HydrophobicContact CG-CG 4.38Å; L427-L536 HydrophobicContact CB-CD2 4.43Å; L427-L536 HydrophobicContact CD2-CD2 3.89Å; T519-L536 HydrophobicContact CG2-CB 3.64Å; T519-L536 HydrophobicContact CG2-CD1 3.79Å; T519-L536 HydrophobicContact CG2-CG 4.4Å; L522-L536 HydrophobicContact CD1-CD1 4.18Å; Y532-L536 HydrophobicContact CD1-CD1 3.81Å; Y532-L536 HydrophobicContact CD1-CG 4.35Å; Y532-L536 HydrophobicContact CE1-CD1 3.49Å; Y532-L536 VanDerWaalsContact CE1-CD1 3.49Å; Y532-L536 HydrophobicContact CE1-CG 4.18Å; Y532-L536 WeakPolarHBondContact O-CG 3.35Å; Y532-L536 PolarHBondContact O-N 3.25Å; A533-L536 PolarHBondContact O-N 3.19Å; L536-A538 VanDerWaalsContact C-N 3.28Å; L536-A538 PolarHBondContact O-N 3.21Å; L536-I539 PolarHBondContact O-N 2.95Å; L536-I540 VanDerWaalsContact O-CG1 3.26Å; L536-I540 WeakPolarHBondContact O-CG1 3.36Å; L536-I540 PolarHBondContact O-N 3.31Å
537	N	91.1	Very high	83.7	Confident	32 Å²	32	50.7 Å²	50.7	17%	0.171	26%	0.26	C	S	.	.	H	α-helix	trans	-62.4	-36.9	178.5	-69.8	-25.2	0	0	0	111.9	Y515 T519 A533 E534 K541	Y515-N537 WeakPolarHBondContact CD2-OD1 3.31Å; Y515-N537 VanDerWaalsContact CE2-OD1 3.29Å; Y515-N537 WeakPolarHBondContact CE2-OD1 3.5Å; T519-N537 PolarHBondContact OG1-ND2 3.26Å; T519-N537 PolarHBondContact OG1-OD1 2.88Å; A533-N537 VanDerWaalsContact O-CB 3.27Å; A533-N537 WeakPolarHBondContact O-CB 3.46Å; A533-N537 PolarHBondContact O-N 3.17Å; A533-N537 PolarHBondContact O-ND2 2.82Å; A533-N537 VanDerWaalsContact O-ND2 3.1Å; E534-N537 PolarHBondContact O-N 3.11Å; N537-K541 WeakPolarHBondContact O-CB 3.47Å; N537-K541 PolarHBondContact O-N 3.23Å
538	A	82.3	Confident	84.9	Confident	16 Å²	16	50.3 Å²	50.3	13%	0.132	26%	0.255	C	S	.	.	H	α-helix	trans	-65.8	-42.1	174.4	0	0	0	0	0	112.1	F388 F390 E534 K535 L536 A542	F388-A538 HydrophobicContact CB-CB 4.36Å; F388-A538 HydrophobicContact CD1-CB 3.82Å; F388-A538 VanDerWaalsContact O-CB 3.23Å; F388-A538 WeakPolarHBondContact O-CB 3.13Å; F390-A538 HydrophobicContact CB-CB 4.13Å; E534-A538 VanDerWaalsContact O-CB 3.27Å; E534-A538 WeakPolarHBondContact O-CB 3.4Å; E534-A538 PolarHBondContact O-N 2.92Å; K535-A538 PolarHBondContact O-N 3.39Å; L536-A538 VanDerWaalsContact C-N 3.28Å; L536-A538 PolarHBondContact O-N 3.21Å; A538-A542 WeakPolarHBondContact O-CB 3.16Å; A538-A542 PolarHBondContact O-N 2.87Å
539	I	82.7	Confident	86.5	Confident	1 Å²	1	44.9 Å²	44.9	1%	0.005	22%	0.221	C	C	.	.	H	α-helix	trans	-62.7	-48.3	174.7	-67.2	161.8	0	0	0	110.8	F390 A423 I426 L427 K535 L536 K541 A542 Y543 L545	F390-I539 HydrophobicContact CD2-CB 4.32Å; F390-I539 HydrophobicContact CD2-CD1 4.25Å; F390-I539 HydrophobicContact CD2-CG1 3.27Å; F390-I539 HydrophobicContact CE2-CD1 4.06Å; F390-I539 HydrophobicContact CE2-CG1 3.39Å; F390-I539 HydrophobicContact CG-CG1 4.05Å; F390-I539 HydrophobicContact CZ-CG1 4.29Å; A423-I539 HydrophobicContact CB-CB 4.07Å; A423-I539 HydrophobicContact CB-CG2 3.78Å; I426-I539 HydrophobicContact CB-CG2 4.35Å; I426-I539 HydrophobicContact CD1-CG2 3.7Å; I426-I539 HydrophobicContact CG2-CD1 4.21Å; I426-I539 HydrophobicContact CG2-CG2 4.24Å; L427-I539 HydrophobicContact CB-CD1 3.94Å; K535-I539 WeakPolarHBondContact O-CG1 3.01Å; K535-I539 PolarHBondContact O-N 3.04Å; L536-I539 PolarHBondContact O-N 2.95Å; I539-K541 PolarHBondContact O-N 3.02Å; I539-A542 PolarHBondContact O-N 3.42Å; I539-Y543 HydrophobicContact CG2-CD2 4.27Å; I539-Y543 PolarHBondContact O-N 2.94Å; I539-L545 HydrophobicContact CG2-CD1 3.97Å
540	I	89.5	Confident	87.8	Confident	2 Å²	2	48.4 Å²	48.4	1%	0.01	24%	0.236	C	C	.	.	H	α-helix	trans	-60.4	-47.8	-179.2	-68.1	167.5	0	0	0	110.6	V420 A423 Y515 T519 L536 D544 L545 T546	V420-I540 HydrophobicContact CG2-CD1 4Å; A423-I540 HydrophobicContact CB-CD1 4.18Å; A423-I540 HydrophobicContact CB-CG1 3.69Å; Y515-I540 HydrophobicContact CD1-CG2 4.36Å; Y515-I540 HydrophobicContact CD2-CB 4.44Å; Y515-I540 HydrophobicContact CD2-CD1 3.43Å; Y515-I540 VanDerWaalsContact CD2-CD1 3.43Å; Y515-I540 HydrophobicContact CD2-CG2 4.02Å; Y515-I540 HydrophobicContact CE1-CG2 4.02Å; Y515-I540 HydrophobicContact CE2-CB 4.04Å; Y515-I540 HydrophobicContact CE2-CD1 3.85Å; Y515-I540 HydrophobicContact CE2-CG2 3.65Å; Y515-I540 HydrophobicContact CG-CD1 4.14Å; Y515-I540 HydrophobicContact CG-CG2 4.36Å; T519-I540 HydrophobicContact CG2-CD1 4.25Å; L536-I540 VanDerWaalsContact O-CG1 3.26Å; L536-I540 WeakPolarHBondContact O-CG1 3.36Å; L536-I540 PolarHBondContact O-N 3.31Å; I540-D544 PolarHBondContact O-N 3.41Å; I540-L545 HydrophobicContact CG1-CD1 4.3Å; I540-L545 HydrophobicContact CG2-CB 4.32Å; I540-L545 PolarHBondContact O-N 3.3Å; I540-L545 VanDerWaalsContact O-N 3.09Å; I540-T546 HydrophobicContact CG2-CG2 3.84Å
541	K	85.9	Confident	88.6	Confident	126 Å²	126	43.3 Å²	43.3	55%	0.548	23%	0.226	S	C	.	.	H	α-helix	trans	-63	-45.6	176.1	-175.4	-175.5	175.7	-167.3	0	110.8	N537 I539 Y543 D544 D571	N537-K541 WeakPolarHBondContact O-CB 3.47Å; N537-K541 PolarHBondContact O-N 3.23Å; I539-K541 PolarHBondContact O-N 3.02Å; K541-Y543 PolarHBondContact O-N 3.04Å; K541-D544 PolarHBondContact O-N 3.16Å; K541-D571 IonicContact NZ-OD1 2.63Å; K541-D571 IonicContact NZ-OD2 3.03Å; K541-D571 PolarHBondContact NZ-OD2 3.38Å
542	A	78	Confident	89.1	Confident	19 Å²	19	44.2 Å²	44.2	16%	0.157	23%	0.228	C	C	.	.	H	α-helix	trans	-60.2	-46.2	-176.2	0	0	0	0	0	111	F390 K392 A538 I539	F390-A542 HydrophobicContact CB-CB 3.85Å; F390-A542 HydrophobicContact CD1-CB 3.85Å; F390-A542 HydrophobicContact CG-CB 4.17Å; K392-A542 WeakPolarHBondContact CE-O 3.29Å; K392-A542 PolarHBondContact NZ-O 2.98Å; A538-A542 WeakPolarHBondContact O-CB 3.16Å; A538-A542 PolarHBondContact O-N 2.87Å; I539-A542 PolarHBondContact O-N 3.42Å
543	Y	84.6	Confident	89.1	Confident	12 Å²	12	51.5 Å²	51.5	5%	0.047	26%	0.262	C	S	.	.	T	Hydrogen-bonded Turn	trans	-99.3	12.7	-176.8	-68.3	-82.9	0	0	0	115.5	F390 K392 N393 T396 D397 I400 I539 K541 L545	F390-Y543 HydrophobicContact CD1-CD2 4.39Å; F390-Y543 AromaticContact CD1-CE2 3.65Å; F390-Y543 HydrophobicContact CD1-CE2 3.65Å; F390-Y543 HydrophobicContact CE1-CD2 4.21Å; F390-Y543 AromaticContact CE1-CE2 3.14Å; F390-Y543 HydrophobicContact CE1-CE2 3.14Å; F390-Y543 AromaticContact CE1-CZ 3.66Å; F390-Y543 WeakPolarHBondContact CE1-OH 3.49Å; F390-Y543 AromaticContact CZ-CE2 3.76Å; F390-Y543 HydrophobicContact CZ-CE2 3.76Å; K392-Y543 WeakPolarHBondContact CA-OH 3.49Å; K392-Y543 HydrophobicContact CB-CE1 3.94Å; K392-Y543 HydrophobicContact CD-CD1 4.37Å; K392-Y543 HydrophobicContact CG-CD1 3.99Å; K392-Y543 HydrophobicContact CG-CE1 3.81Å; N393-Y543 PolarHBondContact N-OH 2.89Å; T396-Y543 VanDerWaalsContact CB-CZ 3.5Å; T396-Y543 WeakPolarHBondContact CB-OH 3.46Å; T396-Y543 HydrophobicContact CG2-CD2 4.19Å; T396-Y543 HydrophobicContact CG2-CE1 3.89Å; T396-Y543 HydrophobicContact CG2-CE2 3.42Å; T396-Y543 VanDerWaalsContact CG2-CE2 3.42Å; T396-Y543 VanDerWaalsContact CG2-OH 3.3Å; T396-Y543 WeakPolarHBondContact CG2-OH 3.46Å; T396-Y543 PolarHBondContact OG1-OH 3.38Å; D397-Y543 WeakPolarHBondContact OD1-CD1 3.48Å; D397-Y543 WeakPolarHBondContact OD1-CE1 3.33Å; I400-Y543 HydrophobicContact CD1-CD1 3.4Å; I400-Y543 VanDerWaalsContact CD1-CD1 3.4Å; I400-Y543 HydrophobicContact CD1-CD2 3.99Å; I400-Y543 HydrophobicContact CD1-CE1 3.96Å; I400-Y543 HydrophobicContact CD1-CE2 4.43Å; I400-Y543 HydrophobicContact CD1-CG 3.43Å; I400-Y543 VanDerWaalsContact CD1-CG 3.43Å; I539-Y543 HydrophobicContact CG2-CD2 4.27Å; I539-Y543 PolarHBondContact O-N 2.94Å; K541-Y543 PolarHBondContact O-N 3.04Å; Y543-L545 PolarHBondContact O-N 3.41Å; Y543-L545 VanDerWaalsContact O-N 3.13Å
544	D	91.2	Very high	87.9	Confident	93 Å²	93	57.5 Å²	57.5	50%	0.497	30%	0.299	S	S	.	.	T	Hydrogen-bonded Turn	trans	55.3	32.1	179.3	-53.5	-64.9	0	0	0	112.9	K392 I540 K541 T546 E547	K392-D544 IonicContact NZ-OD2 3.82Å; K392-D544 PolarHBondContact NZ-OD2 3.07Å; I540-D544 PolarHBondContact O-N 3.41Å; K541-D544 PolarHBondContact O-N 3.16Å; D544-T546 PolarHBondContact O-N 2.76Å; D544-E547 PolarHBondContact O-N 3.32Å; D544-E547 VanDerWaalsContact O-N 3.15Å
545	L	95.6	Very high	86.1	Confident	0 Å²	0	61.2 Å²	61.2	0%	0	31%	0.313	C	S	.	.	G	3₁₀ helix	trans	-64.9	-12.8	-167.7	-60.9	-178.3	0	0	0	114.2	I400 S419 I422 A423 I426 I539 I540 Y543 E547 F548	I400-L545 HydrophobicContact CD1-CD2 3.86Å; I400-L545 HydrophobicContact CG1-CD2 4.23Å; I400-L545 HydrophobicContact CG2-CD2 4.17Å; S419-L545 WeakPolarHBondContact CB-O 3.29Å; I422-L545 HydrophobicContact CB-CD1 4.13Å; I422-L545 HydrophobicContact CG2-CD1 3.76Å; I422-L545 HydrophobicContact CG2-CD2 3.97Å; A423-L545 HydrophobicContact CB-CD1 4.19Å; I426-L545 HydrophobicContact CD1-CD1 4.3Å; I539-L545 HydrophobicContact CG2-CD1 3.97Å; I540-L545 HydrophobicContact CG1-CD1 4.3Å; I540-L545 HydrophobicContact CG2-CB 4.32Å; I540-L545 PolarHBondContact O-N 3.3Å; I540-L545 VanDerWaalsContact O-N 3.09Å; Y543-L545 PolarHBondContact O-N 3.41Å; Y543-L545 VanDerWaalsContact O-N 3.13Å; L545-E547 PolarHBondContact O-N 3.39Å; L545-E547 VanDerWaalsContact O-N 3.13Å; L545-F548 HydrophobicContact CB-CD2 4.48Å; L545-F548 HydrophobicContact CD2-CD2 4.2Å; L545-F548 HydrophobicContact CD2-CE2 4.06Å; L545-F548 WeakPolarHBondContact O-CD2 3.41Å; L545-F548 PolarHBondContact O-N 2.91Å
546	T	97.1	Very high	84	Confident	55 Å²	55	68.2 Å²	68.2	34%	0.337	35%	0.346	S	S	.	.	G	3₁₀ helix	trans	-58.7	-20.8	174.2	51	0	0	0	0	112.4	Y515 I540 D544 F548 D549 H550	Y515-T546 HydrophobicContact CD1-CG2 3.63Å; Y515-T546 HydrophobicContact CE1-CG2 3.41Å; Y515-T546 VanDerWaalsContact CE1-CG2 3.41Å; I540-T546 HydrophobicContact CG2-CG2 3.84Å; D544-T546 PolarHBondContact O-N 2.76Å; T546-F548 PolarHBondContact O-N 3.32Å; T546-D549 WeakPolarHBondContact O-CB 3.44Å; T546-D549 PolarHBondContact O-N 3.45Å; T546-H550 PolarHBondContact O-CD2 2.97Å
547	E	95.4	Very high	81.2	Confident	107 Å²	107	78.1 Å²	78.1	50%	0.5	39%	0.389	S	S	.	.	G	3₁₀ helix	trans	-58.4	-26.7	172.4	72.8	166.6	139.6	0	0	113.2	R408 D544 L545 D549	R408-E547 PolarHBondContact NH2-O 3.48Å; R408-E547 IonicContact NH2-OE2 2.75Å; D544-E547 PolarHBondContact O-N 3.32Å; D544-E547 VanDerWaalsContact O-N 3.15Å; L545-E547 PolarHBondContact O-N 3.39Å; L545-E547 VanDerWaalsContact O-N 3.13Å; E547-D549 VanDerWaalsContact C-N 3.34Å
548	F	97.2	Very high	78.3	Confident	14 Å²	14	82.3 Å²	82.3	6%	0.061	42%	0.416	C	S	.	.	G	3₁₀ helix	trans	-84.1	-10.6	179.6	-61.8	-77.2	0	0	0	112.8	I400 G404 R408 S418 I422 L545 T546 H550	I400-F548 HydrophobicContact CG2-CE2 3.87Å; I400-F548 HydrophobicContact CG2-CZ 3.92Å; G404-F548 VanDerWaalsContact O-CD1 3.31Å; G404-F548 WeakPolarHBondContact O-CD1 3.24Å; R408-F548 HydrophobicContact CB-CB 4.38Å; R408-F548 HydrophobicContact CB-CD1 4.18Å; S418-F548 WeakPolarHBondContact CB-O 3.16Å; S418-F548 PolarHBondContact OG-O 2.74Å; I422-F548 HydrophobicContact CD1-CB 3.87Å; I422-F548 HydrophobicContact CD1-CD1 4.26Å; I422-F548 HydrophobicContact CD1-CD2 3.61Å; I422-F548 HydrophobicContact CD1-CE2 4.23Å; I422-F548 HydrophobicContact CD1-CG 3.64Å; L545-F548 HydrophobicContact CB-CD2 4.48Å; L545-F548 HydrophobicContact CD2-CD2 4.2Å; L545-F548 HydrophobicContact CD2-CE2 4.06Å; L545-F548 WeakPolarHBondContact O-CD2 3.41Å; L545-F548 PolarHBondContact O-N 2.91Å; T546-F548 PolarHBondContact O-N 3.32Å; F548-H550 PolarHBondContact O-N 2.6Å
549	D	97.8	Very high	76.1	Confident	7 Å²	7	87.4 Å²	87.4	4%	0.037	45%	0.448	C	S	.	.	G	3₁₀ helix	trans	-76.9	-8.8	179.1	-68.5	-30.5	0	0	0	113.4	Q412 Y417 S418 S419 K509 T546 E547	Q412-D549 PolarHBondContact NE2-O 2.94Å; Y417-D549 WeakPolarHBondContact CA-OD1 3.39Å; Y417-D549 HydrophobicContact CD1-CB 4.36Å; S418-D549 PolarHBondContact N-OD1 3.31Å; S419-D549 WeakPolarHBondContact CB-OD1 3.4Å; S419-D549 WeakPolarHBondContact CB-OD2 3.45Å; S419-D549 PolarHBondContact N-OD1 3.45Å; S419-D549 PolarHBondContact OG-OD1 3.05Å; S419-D549 VanDerWaalsContact OG-OD1 3.05Å; S419-D549 PolarHBondContact OG-OD2 3.4Å; K509-D549 PolarHBondContact NZ-O 3.12Å; T546-D549 WeakPolarHBondContact O-CB 3.44Å; T546-D549 PolarHBondContact O-N 3.45Å; E547-D549 VanDerWaalsContact C-N 3.34Å
550	H	94.3	Very high	73.3	Confident	122 Å²	122	90.6 Å²	90.6	57%	0.565	48%	0.482	S	S	*	.	S	Bend	trans	-115.6	154.5	178.8	-53.7	-71.5	0	0	0	110.9	R408 T546 F548	R408-H550 WeakPolarHBondContact CD-O 3.31Å; R408-H550 WeakPolarHBondContact CG-O 3.4Å; R408-H550 PolarHBondContact NE-O 2.94Å; T546-H550 PolarHBondContact O-CD2 2.97Å; F548-H550 PolarHBondContact O-N 2.6Å
551	A	91.9	Very high	70.6	Confident	68 Å²	68	96.5 Å²	96.5	56%	0.562	52%	0.52	S	S	*	.	P	Polyproline II helix	trans	-57.1	144.4	169.6	0	0	0	0	0	109.8	E553	A551-E553 PolarHBondContact O-N 3.07Å; A551-E553 VanDerWaalsContact O-N 3.12Å
552	K	89.1	Confident	67.7	Low	127 Å²	127	99.1 Å²	99.1	55%	0.552	53%	0.534	S	S	*	.	P	Polyproline II helix	trans	-64.4	116.8	179.8	-172.6	168.6	-174.2	157.4	0	108.9	E405 T554	E405-K552 IonicContact OE1-NZ 3.17Å; E405-K552 PolarHBondContact OE1-NZ 3.12Å; E405-K552 IonicContact OE2-NZ 3.35Å; K552-T554 PolarHBondContact O-N 3.33Å; K552-T554 VanDerWaalsContact O-N 3.09Å
553	E	80.9	Confident	65.2	Low	155 Å²	155	104.1 Å²	104.1	72%	0.724	57%	0.568	S	S	*	*	P	Polyproline II helix	trans	-60.7	116.7	173.2	-69.7	-170.6	174.1	0	0	108.9	A551 K555	A551-E553 PolarHBondContact O-N 3.07Å; A551-E553 VanDerWaalsContact O-N 3.12Å; E553-K555 VanDerWaalsContact C-N 3.26Å; E553-K555 PolarHBondContact O-N 3.32Å
554	T	63.2	Low	62.5	Low	134 Å²	134	109.8 Å²	109.8	82%	0.822	60%	0.604	S	S	*	*			trans	-78.2	85	170.3	-51.6	0	0	0	0	106.4	K552 E556	K552-T554 PolarHBondContact O-N 3.33Å; K552-T554 VanDerWaalsContact O-N 3.09Å; T554-E556 PolarHBondContact O-N 3.35Å
555	K	47.4	Very low	59.5	Low	173 Å²	173	112 Å²	112	75%	0.752	62%	0.62	S	S	*	*			trans	-66.7	100.1	169	-69.4	-166.6	177.6	-176.2	0	107.7	E553 K557	E553-K555 VanDerWaalsContact C-N 3.26Å; E553-K555 PolarHBondContact O-N 3.32Å; K555-K557 PolarHBondContact O-N 3.02Å
556	E	40	Very low	56.5	Low	169 Å²	169	118 Å²	118	79%	0.79	66%	0.658	S	S	*	*			trans	-51.3	130.6	157.2	-86.9	-172	153.6	0	0	107.6	T554 T558	T554-E556 PolarHBondContact O-N 3.35Å; E556-T558 PolarHBondContact O-N 2.67Å
557	K	30.4	Very low	53.3	Low	208 Å²	208	124.7 Å²	124.7	90%	0.904	68%	0.682	S	S	*	*			trans	-63.5	96	179	-77.5	179.6	175.6	177.1	0	109.2	K555	K555-K557 PolarHBondContact O-N 3.02Å
558	T	31.1	Very low	50.4	Low	120 Å²	120	123.7 Å²	123.7	74%	0.736	69%	0.692	S	S	*	*			trans	-111.3	131.9	160.9	-44.1	0	0	0	0	108.6	E556	E556-T558 PolarHBondContact O-N 2.67Å
559	P	34.1	Very low	47.2	Very low	123 Å²	123	132.4 Å²	132.4	80%	0.799	73%	0.73	S	S	*	*			trans	-73.3	136	-170.8	-8.5	25	0	0	0	111.8
560	G	25	Very low	44.4	Very low	69 Å²	69	137.5 Å²	137.5	71%	0.711	75%	0.752	S	S	*	*			trans	-73.5	-179.5	165	0	0	0	0	0	112.7
561	P	32.3	Very low	41.9	Very low	125 Å²	125	135.1 Å²	135.1	81%	0.812	74%	0.743	S	S	*	*			cis	-128.2	172.4	31.4	39.9	-22.2	0	0	0	113.3
562	E	25.2	Very low	39.4	Very low	182 Å²	182	136.2 Å²	136.2	85%	0.85	74%	0.743	S	S	*	*				-153.9	141.7	86.4	-88.1	179.8	170.8	0	0	113	T564	E562-T564 PolarHBondContact O-N 2.79Å
563	S	25.1	Very low	37.2	Very low	123 Å²	123	133.4 Å²	133.4	86%	0.86	73%	0.734	S	S	*	*			trans	-68.4	112.7	177.2	-168.4	0	0	0	0	110.3
564	T	27.3	Very low	35.4	Very low	131 Å²	131	127.6 Å²	127.6	80%	0.804	71%	0.708	S	S	*	*			trans	-94.1	125.6	168.9	36.4	0	0	0	0	109.5	E562 T566	E562-T564 PolarHBondContact O-N 2.79Å; T564-T566 PolarHBondContact O-N 3.44Å
565	V	29.7	Very low	34.3	Very low	139 Å²	139	126.3 Å²	126.3	84%	0.842	69%	0.693	S	S	*	*			trans	-42.4	122.9	-175.9	179.8	0	0	0	0	112.8	K567	V565-K567 PolarHBondContact O-N 3.29Å
566	T	32.1	Very low	33.9	Very low	128 Å²	128	121.7 Å²	121.7	79%	0.785	68%	0.675	S	S	*	*			trans	-55.7	123.6	174.4	-30	0	0	0	0	110.2	T564 A568	T564-T566 PolarHBondContact O-N 3.44Å; T566-A568 PolarHBondContact O-N 3.42Å
567	K	29.4	Very low	33.9	Very low	194 Å²	194	117 Å²	117	84%	0.843	65%	0.653	S	S	*	*			trans	-61.3	120.4	179.6	-75.4	173.5	177.7	169.9	0	110.6	V565 K569	V565-K567 PolarHBondContact O-N 3.29Å; K567-K569 VanDerWaalsContact C-N 3.3Å; K567-K569 PolarHBondContact O-N 2.73Å
568	A	35.1	Very low	34.4	Very low	87 Å²	87	108.2 Å²	108.2	72%	0.719	62%	0.618	S	S	*	*			trans	-72.9	74.3	172.2	0	0	0	0	0	112.2	T566	T566-A568 PolarHBondContact O-N 3.42Å
569	K	29.8	Very low	34.6	Very low	196 Å²	196	109.8 Å²	109.8	85%	0.852	62%	0.615	S	S	*	*			trans	-117.7	102.4	161.1	-73.9	-169.5	179.1	-175.1	0	108	K567	K567-K569 VanDerWaalsContact C-N 3.3Å; K567-K569 PolarHBondContact O-N 2.73Å
570	F	38.5	Very low	34.9	Very low	115 Å²	115	108.1 Å²	108.1	50%	0.504	60%	0.599	S	S	.	*			trans	-72.8	130.8	177.8	-64.9	-80.6	0	0	0	110.6	D574 A613	F570-D574 HydrophobicContact CB-CB 4.28Å; F570-D574 HydrophobicContact CD1-CB 4.22Å; F570-A613 HydrophobicContact CZ-CB 4.24Å
571	D	42.9	Very low	35.6	Very low	71 Å²	71	105.2 Å²	105.2	38%	0.38	57%	0.567	S	S	.	*			trans	-77.9	160.8	175.5	-167.2	2.6	0	0	0	109.7	K541 N573 D574 Q575	K541-D571 IonicContact NZ-OD1 2.63Å; K541-D571 IonicContact NZ-OD2 3.03Å; K541-D571 PolarHBondContact NZ-OD2 3.38Å; D571-N573 PolarHBondContact O-N 3.02Å; D571-N573 VanDerWaalsContact O-N 3.13Å; D571-D574 PolarHBondContact N-OD2 2.82Å; D571-D574 WeakPolarHBondContact O-CB 3.42Å; D571-D574 PolarHBondContact O-N 2.84Å; D571-Q575 PolarHBondContact O-N 3.47Å
572	V	38.9	Very low	35.9	Very low	92 Å²	92	101.5 Å²	101.5	56%	0.558	55%	0.547	S	S	*	.	H	α-helix	trans	-55.5	-29.5	176	177.1	0	0	0	0	111.4	Q575 I576	V572-Q575 WeakPolarHBondContact O-CB 3.43Å; V572-Q575 PolarHBondContact O-N 2.99Å; V572-I576 HydrophobicContact CG1-CD1 4.06Å; V572-I576 HydrophobicContact CG1-CG1 4.43Å; V572-I576 WeakPolarHBondContact O-CG1 3.22Å; V572-I576 PolarHBondContact O-N 2.66Å
573	N	43.9	Very low	36.4	Very low	68 Å²	68	96.7 Å²	96.7	36%	0.364	53%	0.533	S	S	.	.	H	α-helix	trans	-61.9	-42.1	173.9	-164.8	26	0	0	0	112.1	D571 Q575 I576 Q577	D571-N573 PolarHBondContact O-N 3.02Å; D571-N573 VanDerWaalsContact O-N 3.13Å; N573-Q575 VanDerWaalsContact C-N 3.27Å; N573-Q575 PolarHBondContact O-N 3.13Å; N573-I576 PolarHBondContact O-N 3.33Å; N573-Q577 WeakPolarHBondContact O-CB 3.37Å; N573-Q577 VanDerWaalsContact O-CG 3.32Å; N573-Q577 WeakPolarHBondContact O-CG 3.46Å; N573-Q577 PolarHBondContact O-N 2.92Å
574	D	42.4	Very low	37.1	Very low	33 Å²	33	93.5 Å²	93.5	18%	0.176	51%	0.506	C	S	.	.	H	α-helix	trans	-66.1	-32.6	176.8	-54.9	-35	0	0	0	111.1	F570 D571 S578	F570-D574 HydrophobicContact CB-CB 4.28Å; F570-D574 HydrophobicContact CD1-CB 4.22Å; D571-D574 PolarHBondContact N-OD2 2.82Å; D571-D574 WeakPolarHBondContact O-CB 3.42Å; D571-D574 PolarHBondContact O-N 2.84Å; D574-S578 VanDerWaalsContact O-CB 3.31Å; D574-S578 WeakPolarHBondContact O-CB 3.36Å; D574-S578 PolarHBondContact O-N 3.05Å; D574-S578 PolarHBondContact O-OG 3.42Å
575	Q	40.9	Very low	37.8	Very low	107 Å²	107	92.8 Å²	92.8	50%	0.5	50%	0.496	S	S	.	.	H	α-helix	trans	-70.9	-38.8	174.6	-68.1	-166.8	15.3	0	0	113.3	D571 V572 N573 S578 K579	D571-Q575 PolarHBondContact O-N 3.47Å; V572-Q575 WeakPolarHBondContact O-CB 3.43Å; V572-Q575 PolarHBondContact O-N 2.99Å; N573-Q575 VanDerWaalsContact C-N 3.27Å; N573-Q575 PolarHBondContact O-N 3.13Å; Q575-S578 VanDerWaalsContact CA-OG 3.26Å; Q575-S578 WeakPolarHBondContact CA-OG 3.38Å; Q575-S578 PolarHBondContact O-OG 3.1Å; Q575-K579 WeakPolarHBondContact O-CB 3.45Å; Q575-K579 WeakPolarHBondContact O-CG 3.26Å; Q575-K579 PolarHBondContact O-N 3Å
576	I	38.6	Very low	38.2	Very low	76 Å²	76	92.5 Å²	92.5	39%	0.39	49%	0.49	S	S	.	.	H	α-helix	trans	-70.1	-44.3	177.8	-67.4	170.4	0	0	0	109.9	V572 N573 K579 L580	V572-I576 HydrophobicContact CG1-CD1 4.06Å; V572-I576 HydrophobicContact CG1-CG1 4.43Å; V572-I576 WeakPolarHBondContact O-CG1 3.22Å; V572-I576 PolarHBondContact O-N 2.66Å; N573-I576 PolarHBondContact O-N 3.33Å; I576-K579 PolarHBondContact O-N 2.98Å; I576-L580 WeakPolarHBondContact O-CB 3.47Å; I576-L580 PolarHBondContact O-N 3.41Å
577	Q	40.2	Very low	38.6	Very low	69 Å²	69	88.4 Å²	88.4	32%	0.322	47%	0.466	S	S	.	.	H	α-helix	trans	-61	-45.4	175.1	-67.5	-63.8	-26.3	0	0	110.8	N573 K579 L580 I581	N573-Q577 WeakPolarHBondContact O-CB 3.37Å; N573-Q577 VanDerWaalsContact O-CG 3.32Å; N573-Q577 WeakPolarHBondContact O-CG 3.46Å; N573-Q577 PolarHBondContact O-N 2.92Å; Q577-K579 PolarHBondContact O-N 2.62Å; Q577-L580 WeakPolarHBondContact O-CB 3.49Å; Q577-L580 PolarHBondContact O-N 3.13Å; Q577-I581 WeakPolarHBondContact O-CB 3.4Å; Q577-I581 WeakPolarHBondContact O-CD1 3.24Å; Q577-I581 WeakPolarHBondContact O-CG1 3.39Å; Q577-I581 PolarHBondContact O-N 3.03Å
578	S	39.1	Very low	38.9	Very low	25 Å²	25	85.4 Å²	85.4	18%	0.175	47%	0.467	C	S	.	.	H	α-helix	trans	-63.3	-35.9	175.8	54.4	0	0	0	0	114.1	D574 Q575 I581 A582	D574-S578 VanDerWaalsContact O-CB 3.31Å; D574-S578 WeakPolarHBondContact O-CB 3.36Å; D574-S578 PolarHBondContact O-N 3.05Å; D574-S578 PolarHBondContact O-OG 3.42Å; Q575-S578 VanDerWaalsContact CA-OG 3.26Å; Q575-S578 WeakPolarHBondContact CA-OG 3.38Å; Q575-S578 PolarHBondContact O-OG 3.1Å; S578-I581 PolarHBondContact O-N 3.48Å; S578-A582 WeakPolarHBondContact O-CB 3.48Å; S578-A582 PolarHBondContact O-N 2.88Å
579	K	37.3	Very low	38.8	Very low	153 Å²	153	92.2 Å²	92.2	67%	0.665	47%	0.474	S	S	*	.	H	α-helix	trans	-67	-41.4	172.2	-78.9	-178.5	179.5	-179.8	0	112.5	Q575 I576 Q577 I581 A582 S583	Q575-K579 WeakPolarHBondContact O-CB 3.45Å; Q575-K579 WeakPolarHBondContact O-CG 3.26Å; Q575-K579 PolarHBondContact O-N 3Å; I576-K579 PolarHBondContact O-N 2.98Å; Q577-K579 PolarHBondContact O-N 2.62Å; K579-I581 VanDerWaalsContact C-N 3.28Å; K579-I581 PolarHBondContact O-N 2.84Å; K579-A582 PolarHBondContact O-N 2.95Å; K579-S583 WeakPolarHBondContact O-CB 3.45Å; K579-S583 PolarHBondContact O-N 3.01Å
580	L	38.6	Very low	39.1	Very low	87 Å²	87	86.8 Å²	86.8	46%	0.455	45%	0.453	S	S	.	.	H	α-helix	trans	-59.8	-43.9	173.2	-177.8	65.2	0	0	0	110	I576 Q577 S583 I584	I576-L580 WeakPolarHBondContact O-CB 3.47Å; I576-L580 PolarHBondContact O-N 3.41Å; Q577-L580 WeakPolarHBondContact O-CB 3.49Å; Q577-L580 PolarHBondContact O-N 3.13Å; L580-S583 PolarHBondContact O-N 3.13Å; L580-I584 HydrophobicContact CD1-CD1 4.16Å; L580-I584 HydrophobicContact CG-CD1 3.86Å; L580-I584 WeakPolarHBondContact O-CB 3.24Å; L580-I584 VanDerWaalsContact O-CG1 3.25Å; L580-I584 WeakPolarHBondContact O-CG1 3.49Å; L580-I584 PolarHBondContact O-N 3.15Å
581	I	39.9	Very low	38.8	Very low	8 Å²	8	86.6 Å²	86.6	4%	0.041	46%	0.464	C	S	.	.	H	α-helix	trans	-61.3	-48.2	176.3	-64.6	160.3	0	0	0	111.7	Q577 S578 K579 S583 I584 I585 F603 L611	Q577-I581 WeakPolarHBondContact O-CB 3.4Å; Q577-I581 WeakPolarHBondContact O-CD1 3.24Å; Q577-I581 WeakPolarHBondContact O-CG1 3.39Å; Q577-I581 PolarHBondContact O-N 3.03Å; S578-I581 PolarHBondContact O-N 3.48Å; K579-I581 VanDerWaalsContact C-N 3.28Å; K579-I581 PolarHBondContact O-N 2.84Å; I581-S583 VanDerWaalsContact C-N 3.27Å; I581-S583 PolarHBondContact O-N 3.43Å; I581-I584 PolarHBondContact O-N 3.15Å; I581-I585 HydrophobicContact CG2-CD1 3.57Å; I581-I585 HydrophobicContact CG2-CG1 4.29Å; I581-I585 VanDerWaalsContact O-CG1 3.31Å; I581-I585 WeakPolarHBondContact O-CG1 3.29Å; I581-I585 PolarHBondContact O-N 2.93Å; I581-F603 HydrophobicContact CD1-CE1 4.45Å; I581-F603 HydrophobicContact CG1-CE1 4.01Å; I581-L611 HydrophobicContact CB-CD1 4.41Å; I581-L611 HydrophobicContact CD1-CB 4.38Å; I581-L611 HydrophobicContact CD1-CD1 4.42Å; I581-L611 HydrophobicContact CG2-CD1 3.3Å; I581-L611 HydrophobicContact CG2-CD2 4.33Å; I581-L611 HydrophobicContact CG2-CG 4.36Å
582	A	39.5	Very low	38.8	Very low	48 Å²	48	92.7 Å²	92.7	40%	0.397	49%	0.49	S	S	.	.	H	α-helix	trans	-61.7	-36.5	177	0	0	0	0	0	112.1	S578 K579 N586	S578-A582 WeakPolarHBondContact O-CB 3.48Å; S578-A582 PolarHBondContact O-N 2.88Å; K579-A582 PolarHBondContact O-N 2.95Å; A582-N586 VanDerWaalsContact O-CB 3.3Å; A582-N586 WeakPolarHBondContact O-CB 3.2Å; A582-N586 PolarHBondContact O-N 2.97Å
583	S	36.1	Very low	38.6	Very low	81 Å²	81	94.2 Å²	94.2	57%	0.566	50%	0.499	S	S	*	.	H	α-helix	trans	-72.3	-33.2	177	-165.5	0	0	0	0	112.9	K579 L580 I581 S587	K579-S583 WeakPolarHBondContact O-CB 3.45Å; K579-S583 PolarHBondContact O-N 3.01Å; L580-S583 PolarHBondContact O-N 3.13Å; I581-S583 VanDerWaalsContact C-N 3.27Å; I581-S583 PolarHBondContact O-N 3.43Å; S583-S587 VanDerWaalsContact O-CB 3.25Å; S583-S587 WeakPolarHBondContact O-CB 3.15Å; S583-S587 PolarHBondContact O-N 3.23Å
584	I	40	Very low	38.7	Very low	55 Å²	55	94.9 Å²	94.9	28%	0.282	50%	0.501	S	S	.	.	H	α-helix	trans	-72.1	-44.8	176	-72	167.4	0	0	0	110.3	L580 I581 S587 I590	L580-I584 HydrophobicContact CD1-CD1 4.16Å; L580-I584 HydrophobicContact CG-CD1 3.86Å; L580-I584 WeakPolarHBondContact O-CB 3.24Å; L580-I584 VanDerWaalsContact O-CG1 3.25Å; L580-I584 WeakPolarHBondContact O-CG1 3.49Å; L580-I584 PolarHBondContact O-N 3.15Å; I581-I584 PolarHBondContact O-N 3.15Å; I584-S587 PolarHBondContact O-N 3.19Å; I584-I590 HydrophobicContact CB-CD1 4.17Å; I584-I590 HydrophobicContact CG1-CD1 4.18Å; I584-I590 HydrophobicContact CG2-CD1 3.8Å
585	I	40.4	Very low	38.4	Very low	116 Å²	116	96.7 Å²	96.7	60%	0.595	52%	0.516	S	S	*	.	H	α-helix	trans	-66.9	-40.6	-179.5	-66.5	169.6	0	0	0	111.5	I581 S587 L611	I581-I585 HydrophobicContact CG2-CD1 3.57Å; I581-I585 HydrophobicContact CG2-CG1 4.29Å; I581-I585 VanDerWaalsContact O-CG1 3.31Å; I581-I585 WeakPolarHBondContact O-CG1 3.29Å; I581-I585 PolarHBondContact O-N 2.93Å; I585-S587 VanDerWaalsContact C-N 3.32Å; I585-L611 HydrophobicContact CD1-CD1 4.38Å
586	N	39.4	Very low	38.1	Very low	133 Å²	133	95.7 Å²	95.7	71%	0.711	52%	0.517	S	S	*	.	T	Hydrogen-bonded Turn	trans	-87.3	3.7	180	-70.7	-22.7	0	0	0	113.8	A582 P588	A582-N586 VanDerWaalsContact O-CB 3.3Å; A582-N586 WeakPolarHBondContact O-CB 3.2Å; A582-N586 PolarHBondContact O-N 2.97Å; N586-P588 WeakPolarHBondContact O-CD 3.44Å
587	S	39.2	Very low	38.1	Very low	42 Å²	42	98.2 Å²	98.2	29%	0.294	53%	0.525	S	S	.	.			trans	-82.7	112.7	176.6	-177.3	0	0	0	0	110	S583 I584 I585 R589 I590	S583-S587 VanDerWaalsContact O-CB 3.25Å; S583-S587 WeakPolarHBondContact O-CB 3.15Å; S583-S587 PolarHBondContact O-N 3.23Å; I584-S587 PolarHBondContact O-N 3.19Å; I585-S587 VanDerWaalsContact C-N 3.32Å; S587-R589 PolarHBondContact O-N 2.87Å; S587-I590 PolarHBondContact O-N 2.81Å
588	P	36.4	Very low	38.2	Very low	132 Å²	132	99.2 Å²	99.2	86%	0.857	53%	0.53	S	S	*	.	T	Hydrogen-bonded Turn	trans	-67.1	-2.2	179.8	27.5	-34.5	0	0	0	113.7	N586	N586-P588 WeakPolarHBondContact O-CD 3.44Å
589	R	33.9	Very low	38.5	Very low	230 Å²	230	101.9 Å²	101.9	87%	0.868	54%	0.539	S	S	*	.	T	Hydrogen-bonded Turn	trans	-108.5	3.7	-176.2	-69.1	-168.6	178.1	161.8	0.5	114.8	S587	S587-R589 PolarHBondContact O-N 2.87Å
590	I	35.5	Very low	38.7	Very low	81 Å²	81	97.9 Å²	97.9	42%	0.415	53%	0.527	S	S	.	.	S	Bend	trans	-96.8	118	173	-57.6	179.3	0	0	0	108	I584 S587 Q592	I584-I590 HydrophobicContact CB-CD1 4.17Å; I584-I590 HydrophobicContact CG1-CD1 4.18Å; I584-I590 HydrophobicContact CG2-CD1 3.8Å; S587-I590 PolarHBondContact O-N 2.81Å; I590-Q592 PolarHBondContact O-N 2.66Å
591	P	32.5	Very low	38.9	Very low	112 Å²	112	96.8 Å²	96.8	73%	0.727	52%	0.521	S	S	*	.			trans	-59.1	129.6	-176.8	19.8	-28.9	0	0	0	111	V593	P591-V593 PolarHBondContact O-N 2.79Å
592	Q	42	Very low	39	Very low	198 Å²	198	99.7 Å²	99.7	93%	0.925	54%	0.537	S	S	*	.	S	Bend	trans	-70.7	25.3	-165.6	-118.5	177.9	7.5	0	0	115.7	I590	I590-Q592 PolarHBondContact O-N 2.66Å
593	V	35.9	Very low	39.1	Very low	124 Å²	124	98.3 Å²	98.3	75%	0.752	52%	0.522	S	S	*	.			trans	-140.5	97.7	-178.8	-139.3	0	0	0	0	110.2	P591	P591-V593 PolarHBondContact O-N 2.79Å
594	M	45	Very low	39.3	Very low	83 Å²	83	99.8 Å²	99.8	41%	0.409	52%	0.515	S	S	.	.			trans	-103.3	136.3	171.4	-175.8	179.2	-69	0	0	108.8	H598 F599 L602 F603	M594-H598 HydrophobicContact CG-CB 3.71Å; M594-H598 HydrophobicContact SD-CB 4.35Å; M594-F599 HydrophobicContact SD-CB 4.13Å; M594-L602 HydrophobicContact CE-CD2 3.73Å; M594-L602 HydrophobicContact SD-CD2 4.15Å; M594-F603 HydrophobicContact SD-CE2 4.35Å
595	S	36.6	Very low	39.6	Very low	70 Å²	70	99.7 Å²	99.7	49%	0.49	53%	0.528	S	S	.	.			trans	-68.6	150.5	177.1	77.2	0	0	0	0	111.3	K597 H598 F599	S595-K597 PolarHBondContact O-N 3.48Å; S595-K597 VanDerWaalsContact O-N 3.15Å; S595-H598 CarbonylContact O-C 3.35Å; S595-H598 WeakPolarHBondContact O-CA 3.16Å; S595-H598 PolarHBondContact O-N 3.02Å; S595-H598 WeakPolarHBondContact OG-CB 3.32Å; S595-H598 PolarHBondContact OG-N 3.31Å; S595-F599 PolarHBondContact O-N 3.06Å
596	T	34.2	Very low	39.4	Very low	86 Å²	86	100.5 Å²	100.5	53%	0.528	53%	0.529	S	S	.	.	H	α-helix	trans	-52.5	-38.8	177.2	-42.8	0	0	0	0	112.1	F599 V600	T596-F599 PolarHBondContact O-N 3.42Å; T596-V600 WeakPolarHBondContact O-CB 3.42Å; T596-V600 VanDerWaalsContact O-CG2 3.31Å; T596-V600 WeakPolarHBondContact O-CG2 3.33Å; T596-V600 PolarHBondContact O-N 3.42Å
597	K	38.7	Very low	39.3	Very low	129 Å²	129	95.7 Å²	95.7	56%	0.561	51%	0.506	S	S	*	.	H	α-helix	trans	-65.1	-41.3	176.7	-171.8	176.9	-178.1	-179	0	111.5	S595 N601	S595-K597 PolarHBondContact O-N 3.48Å; S595-K597 VanDerWaalsContact O-N 3.15Å; K597-N601 WeakPolarHBondContact O-CB 3.46Å; K597-N601 PolarHBondContact O-N 3.33Å; K597-N601 PolarHBondContact O-ND2 3.44Å
598	H	42.7	Very low	39.4	Very low	90 Å²	90	96.7 Å²	96.7	42%	0.417	51%	0.508	S	S	.	.	H	α-helix	trans	-73.3	-35.6	179.3	-151.9	92	0	0	0	111.6	M594 S595 N601 L602	M594-H598 HydrophobicContact CG-CB 3.71Å; M594-H598 HydrophobicContact SD-CB 4.35Å; S595-H598 CarbonylContact O-C 3.35Å; S595-H598 WeakPolarHBondContact O-CA 3.16Å; S595-H598 PolarHBondContact O-N 3.02Å; S595-H598 WeakPolarHBondContact OG-CB 3.32Å; S595-H598 PolarHBondContact OG-N 3.31Å; H598-N601 PolarHBondContact O-N 2.79Å; H598-L602 VanDerWaalsContact O-CB 3.25Å; H598-L602 WeakPolarHBondContact O-CB 3.42Å; H598-L602 PolarHBondContact O-N 3.03Å
599	F	44.8	Very low	39.5	Very low	81 Å²	81	95.6 Å²	95.6	36%	0.355	49%	0.493	S	S	.	.	H	α-helix	trans	-61.3	-54	171.1	-175.2	-90.7	0	0	0	110.9	M594 S595 T596 N601 L602 F603 L608 L611	M594-F599 HydrophobicContact SD-CB 4.13Å; S595-F599 PolarHBondContact O-N 3.06Å; T596-F599 PolarHBondContact O-N 3.42Å; F599-N601 PolarHBondContact O-N 3.07Å; F599-L602 PolarHBondContact O-N 3.24Å; F599-L602 VanDerWaalsContact O-N 3.12Å; F599-F603 HydrophobicContact CB-CD2 4.32Å; F599-F603 AromaticContact CD1-CD2 3.91Å; F599-F603 HydrophobicContact CD1-CD2 3.91Å; F599-F603 AromaticContact CD2-CD2 3.33Å; F599-F603 HydrophobicContact CD2-CD2 3.33Å; F599-F603 AromaticContact CD2-CE2 3.25Å; F599-F603 HydrophobicContact CD2-CE2 3.25Å; F599-F603 HydrophobicContact CD2-CZ 4.46Å; F599-F603 AromaticContact CE1-CD2 3.98Å; F599-F603 HydrophobicContact CE1-CD2 3.98Å; F599-F603 AromaticContact CE2-CD2 3.38Å; F599-F603 HydrophobicContact CE2-CD2 3.38Å; F599-F603 AromaticContact CE2-CE2 3.35Å; F599-F603 HydrophobicContact CE2-CE2 3.35Å; F599-F603 HydrophobicContact CE2-CG 4.39Å; F599-F603 HydrophobicContact CE2-CZ 4.31Å; F599-F603 AromaticContact CG-CD2 3.58Å; F599-F603 HydrophobicContact CG-CD2 3.58Å; F599-F603 AromaticContact CG-CE2 3.94Å; F599-F603 HydrophobicContact CG-CE2 3.94Å; F599-F603 AromaticContact CZ-CD2 3.71Å; F599-F603 HydrophobicContact CZ-CD2 3.71Å; F599-F603 HydrophobicContact CZ-CE2 4.14Å; F599-F603 HydrophobicContact CZ-CG 4.4Å; F599-F603 WeakPolarHBondContact O-CB 3.33Å; F599-F603 WeakPolarHBondContact O-CD2 3.22Å; F599-F603 PolarHBondContact O-N 2.84Å; F599-L608 HydrophobicContact CD1-CD2 4.47Å; F599-L608 HydrophobicContact CE1-CD2 3.49Å; F599-L608 VanDerWaalsContact CE1-CD2 3.49Å; F599-L608 HydrophobicContact CZ-CD2 3.84Å; F599-L611 HydrophobicContact CZ-CD2 4.35Å
600	V	41.9	Very low	39.6	Very low	70 Å²	70	85 Å²	85	42%	0.424	46%	0.456	S	S	.	.	H	α-helix	trans	-62.8	-30.6	178.2	174	0	0	0	0	112.4	T596 F603 R604	T596-V600 WeakPolarHBondContact O-CB 3.42Å; T596-V600 VanDerWaalsContact O-CG2 3.31Å; T596-V600 WeakPolarHBondContact O-CG2 3.33Å; T596-V600 PolarHBondContact O-N 3.42Å; V600-F603 CarbonylContact O-C 3.52Å; V600-R604 VanDerWaalsContact O-CG 3.27Å; V600-R604 WeakPolarHBondContact O-CG 3.4Å
601	N	41.5	Very low	39.7	Very low	63 Å²	63	82.7 Å²	82.7	34%	0.337	44%	0.444	S	S	.	.	H	α-helix	trans	-76	-32.3	175.5	-76.1	-16.5	0	0	0	113.1	K597 H598 F599	K597-N601 WeakPolarHBondContact O-CB 3.46Å; K597-N601 PolarHBondContact O-N 3.33Å; K597-N601 PolarHBondContact O-ND2 3.44Å; H598-N601 PolarHBondContact O-N 2.79Å; F599-N601 PolarHBondContact O-N 3.07Å
602	L	42.1	Very low	39.8	Very low	69 Å²	69	80.5 Å²	80.5	36%	0.361	44%	0.435	S	S	.	.	H	α-helix	trans	-78.4	-30.4	175.1	-163.6	68.8	0	0	0	111.8	M594 H598 F599	M594-L602 HydrophobicContact CE-CD2 3.73Å; M594-L602 HydrophobicContact SD-CD2 4.15Å; H598-L602 VanDerWaalsContact O-CB 3.25Å; H598-L602 WeakPolarHBondContact O-CB 3.42Å; H598-L602 PolarHBondContact O-N 3.03Å; F599-L602 PolarHBondContact O-N 3.24Å; F599-L602 VanDerWaalsContact O-N 3.12Å
603	F	42.3	Very low	39.4	Very low	20 Å²	20	73 Å²	73	9%	0.088	41%	0.406	C	S	.	.	S	Bend	trans	-123.4	93.2	-173.3	-51	-68.1	0	0	0	110.6	I581 M594 F599 V600 L608	I581-F603 HydrophobicContact CD1-CE1 4.45Å; I581-F603 HydrophobicContact CG1-CE1 4.01Å; M594-F603 HydrophobicContact SD-CE2 4.35Å; F599-F603 HydrophobicContact CB-CD2 4.32Å; F599-F603 AromaticContact CD1-CD2 3.91Å; F599-F603 HydrophobicContact CD1-CD2 3.91Å; F599-F603 AromaticContact CD2-CD2 3.33Å; F599-F603 HydrophobicContact CD2-CD2 3.33Å; F599-F603 AromaticContact CD2-CE2 3.25Å; F599-F603 HydrophobicContact CD2-CE2 3.25Å; F599-F603 HydrophobicContact CD2-CZ 4.46Å; F599-F603 AromaticContact CE1-CD2 3.98Å; F599-F603 HydrophobicContact CE1-CD2 3.98Å; F599-F603 AromaticContact CE2-CD2 3.38Å; F599-F603 HydrophobicContact CE2-CD2 3.38Å; F599-F603 AromaticContact CE2-CE2 3.35Å; F599-F603 HydrophobicContact CE2-CE2 3.35Å; F599-F603 HydrophobicContact CE2-CG 4.39Å; F599-F603 HydrophobicContact CE2-CZ 4.31Å; F599-F603 AromaticContact CG-CD2 3.58Å; F599-F603 HydrophobicContact CG-CD2 3.58Å; F599-F603 AromaticContact CG-CE2 3.94Å; F599-F603 HydrophobicContact CG-CE2 3.94Å; F599-F603 AromaticContact CZ-CD2 3.71Å; F599-F603 HydrophobicContact CZ-CD2 3.71Å; F599-F603 HydrophobicContact CZ-CE2 4.14Å; F599-F603 HydrophobicContact CZ-CG 4.4Å; F599-F603 WeakPolarHBondContact O-CB 3.33Å; F599-F603 WeakPolarHBondContact O-CD2 3.22Å; F599-F603 PolarHBondContact O-N 2.84Å; V600-F603 CarbonylContact O-C 3.52Å; F603-L608 HydrophobicContact CB-CD2 3.46Å; F603-L608 VanDerWaalsContact CB-CD2 3.46Å; F603-L608 HydrophobicContact CB-CG 3.76Å; F603-L608 HydrophobicContact CG-CD2 4.25Å; F603-L608 WeakPolarHBondContact O-CD1 3.48Å; F603-L608 WeakPolarHBondContact O-CG 3.39Å
604	R	40.2	Very low	39.6	Very low	111 Å²	111	70.9 Å²	70.9	42%	0.419	39%	0.394	S	S	.	.			trans	-107.6	142	176.5	-71.1	-173	170.6	-155.2	-16.4	112.9	D231 V600 E606 S607	D231-R604 IonicContact OD1-NH2 3.83Å; D231-R604 IonicContact OD2-CZ 3.92Å; D231-R604 VanDerWaalsContact OD2-CZ 3.32Å; D231-R604 IonicContact OD2-NH1 3.78Å; D231-R604 PolarHBondContact OD2-NH1 3.35Å; D231-R604 IonicContact OD2-NH2 3.95Å; D231-R604 PolarHBondContact OD2-NH2 2.86Å; V600-R604 VanDerWaalsContact O-CG 3.27Å; V600-R604 WeakPolarHBondContact O-CG 3.4Å; R604-E606 PolarHBondContact O-N 3.28Å; R604-S607 WeakPolarHBondContact O-CB 3.48Å; R604-S607 PolarHBondContact O-N 2.85Å
605	G	45.8	Very low	39.2	Very low	54 Å²	54	70.4 Å²	70.4	56%	0.557	40%	0.403	S	S	*	.	T	Hydrogen-bonded Turn	trans	57.9	-118.3	167	0	0	0	0	0	114	S607 L608	G605-S607 PolarHBondContact O-N 2.91Å; G605-L608 PolarHBondContact O-N 2.93Å
606	E	36.3	Very low	38.8	Very low	133 Å²	133	73 Å²	73	62%	0.621	41%	0.411	S	S	*	.	H	α-helix	trans	-56.3	-30.2	179.6	-64.2	-81.8	145.7	0	0	113.1	R604 L608 I609 A610	R604-E606 PolarHBondContact O-N 3.28Å; E606-L608 VanDerWaalsContact C-N 3.34Å; E606-L608 PolarHBondContact O-N 3.26Å; E606-I609 PolarHBondContact O-N 3.29Å; E606-A610 WeakPolarHBondContact O-CB 3.42Å; E606-A610 PolarHBondContact O-N 2.95Å
607	S	38.5	Very low	38.7	Very low	32 Å²	32	74.1 Å²	74.1	22%	0.224	42%	0.42	C	S	.	.	H	α-helix	trans	-67.7	-31.4	-177.7	-59.3	0	0	0	0	113.2	R604 G605 L611	R604-S607 WeakPolarHBondContact O-CB 3.48Å; R604-S607 PolarHBondContact O-N 2.85Å; G605-S607 PolarHBondContact O-N 2.91Å; S607-L611 WeakPolarHBondContact O-CB 3.29Å; S607-L611 PolarHBondContact O-N 2.82Å
608	L	40	Very low	38.3	Very low	62 Å²	62	74.6 Å²	74.6	33%	0.325	43%	0.434	S	S	.	.	H	α-helix	trans	-74	-37.1	174.4	-76.5	173	0	0	0	111.7	F599 F603 G605 E606 L611 A612	F599-L608 HydrophobicContact CD1-CD2 4.47Å; F599-L608 HydrophobicContact CE1-CD2 3.49Å; F599-L608 VanDerWaalsContact CE1-CD2 3.49Å; F599-L608 HydrophobicContact CZ-CD2 3.84Å; F603-L608 HydrophobicContact CB-CD2 3.46Å; F603-L608 VanDerWaalsContact CB-CD2 3.46Å; F603-L608 HydrophobicContact CB-CG 3.76Å; F603-L608 HydrophobicContact CG-CD2 4.25Å; F603-L608 WeakPolarHBondContact O-CD1 3.48Å; F603-L608 WeakPolarHBondContact O-CG 3.39Å; G605-L608 PolarHBondContact O-N 2.93Å; E606-L608 VanDerWaalsContact C-N 3.34Å; E606-L608 PolarHBondContact O-N 3.26Å; L608-L611 PolarHBondContact O-N 2.75Å; L608-A612 WeakPolarHBondContact O-CB 3.31Å; L608-A612 PolarHBondContact O-N 3.05Å
609	I	38.6	Very low	37.8	Very low	109 Å²	109	78.9 Å²	78.9	56%	0.559	45%	0.451	S	S	*	.	H	α-helix	trans	-65.7	-43.5	175.4	-60.8	176.2	0	0	0	109.7	E606 A612 A613	E606-I609 PolarHBondContact O-N 3.29Å; I609-A612 PolarHBondContact O-N 3.17Å; I609-A613 WeakPolarHBondContact O-CB 3.26Å; I609-A613 PolarHBondContact O-N 2.8Å
610	A	35.9	Very low	37.1	Very low	9 Å²	9	83.7 Å²	83.7	7%	0.074	47%	0.472	C	S	.	.	H	α-helix	trans	-61.9	-43.6	174.8	0	0	0	0	0	112.1	E606 A613 T614	E606-A610 WeakPolarHBondContact O-CB 3.42Å; E606-A610 PolarHBondContact O-N 2.95Å; A610-A613 PolarHBondContact O-N 2.77Å; A610-T614 WeakPolarHBondContact O-CG2 3.32Å; A610-T614 PolarHBondContact O-N 3.36Å; A610-T614 PolarHBondContact O-OG1 3.2Å
611	L	37.6	Very low	36.8	Very low	32 Å²	32	87.1 Å²	87.1	17%	0.168	49%	0.486	C	S	.	.	H	α-helix	trans	-60.4	-49.5	175	-179.2	54	0	0	0	111.9	I581 I585 F599 S607 L608 A613 T614 A615	I581-L611 HydrophobicContact CB-CD1 4.41Å; I581-L611 HydrophobicContact CD1-CB 4.38Å; I581-L611 HydrophobicContact CD1-CD1 4.42Å; I581-L611 HydrophobicContact CG2-CD1 3.3Å; I581-L611 HydrophobicContact CG2-CD2 4.33Å; I581-L611 HydrophobicContact CG2-CG 4.36Å; I585-L611 HydrophobicContact CD1-CD1 4.38Å; F599-L611 HydrophobicContact CZ-CD2 4.35Å; S607-L611 WeakPolarHBondContact O-CB 3.29Å; S607-L611 PolarHBondContact O-N 2.82Å; L608-L611 PolarHBondContact O-N 2.75Å; L611-A613 VanDerWaalsContact C-N 3.25Å; L611-A613 PolarHBondContact O-N 3.46Å; L611-T614 PolarHBondContact O-N 3.35Å; L611-T614 VanDerWaalsContact O-N 3.16Å; L611-T614 PolarHBondContact O-OG1 3.26Å; L611-A615 PolarHBondContact O-N 2.75Å
612	A	35	Very low	36.1	Very low	66 Å²	66	91.1 Å²	91.1	55%	0.545	50%	0.503	S	S	.	.	H	α-helix	trans	-58.9	-37	177.4	0	0	0	0	0	112.2	L608 I609	L608-A612 WeakPolarHBondContact O-CB 3.31Å; L608-A612 PolarHBondContact O-N 3.05Å; I609-A612 PolarHBondContact O-N 3.17Å
613	A	34.6	Very low	35.7	Very low	39 Å²	39	94.6 Å²	94.6	32%	0.322	53%	0.527	S	S	.	.	H	α-helix	trans	-70.2	-37.5	176.2	0	0	0	0	0	113	F570 I609 A610 L611 A615 L616	F570-A613 HydrophobicContact CZ-CB 4.24Å; I609-A613 WeakPolarHBondContact O-CB 3.26Å; I609-A613 PolarHBondContact O-N 2.8Å; A610-A613 PolarHBondContact O-N 2.77Å; L611-A613 VanDerWaalsContact C-N 3.25Å; L611-A613 PolarHBondContact O-N 3.46Å; A613-A615 VanDerWaalsContact C-N 3.35Å; A613-L616 WeakPolarHBondContact O-CB 3.44Å; A613-L616 PolarHBondContact O-N 3.25Å
614	T	39.5	Very low	35.2	Very low	80 Å²	80	101.1 Å²	101.1	49%	0.491	56%	0.558	S	S	.	*	H	α-helix	trans	-75.3	-20.3	177.3	55.1	0	0	0	0	114.3	A610 L611 L616	A610-T614 WeakPolarHBondContact O-CG2 3.32Å; A610-T614 PolarHBondContact O-N 3.36Å; A610-T614 PolarHBondContact O-OG1 3.2Å; L611-T614 PolarHBondContact O-N 3.35Å; L611-T614 VanDerWaalsContact O-N 3.16Å; L611-T614 PolarHBondContact O-OG1 3.26Å; T614-L616 PolarHBondContact O-N 2.75Å
615	A	35.9	Very low	34.8	Very low	73 Å²	73	102.6 Å²	102.6	60%	0.603	58%	0.58	S	S	*	*	T	Hydrogen-bonded Turn	trans	-74.2	-9.6	173.2	0	0	0	0	0	113.2	L611 A613 P617	L611-A615 PolarHBondContact O-N 2.75Å; A613-A615 VanDerWaalsContact C-N 3.35Å; A615-P617 VanDerWaalsContact O-CD 3.31Å; A615-P617 WeakPolarHBondContact O-CD 3.41Å
616	L	28.2	Very low	34.2	Very low	126 Å²	126	106.3 Å²	106.3	66%	0.66	59%	0.585	S	S	*	*	S	Bend	trans	-69.6	115.5	169.3	-68.4	164.1	0	0	0	107.9	A613 T614 T618	A613-L616 WeakPolarHBondContact O-CB 3.44Å; A613-L616 PolarHBondContact O-N 3.25Å; T614-L616 PolarHBondContact O-N 2.75Å; L616-T618 PolarHBondContact O-N 2.75Å; L616-T618 VanDerWaalsContact O-N 3.07Å
617	P	31.8	Very low	34.1	Very low	109 Å²	109	104.4 Å²	104.4	71%	0.708	59%	0.585	S	S	*	*			trans	-56.3	123.1	-175.8	20.1	-30.2	0	0	0	109.2	A615 K619	A615-P617 VanDerWaalsContact O-CD 3.31Å; A615-P617 WeakPolarHBondContact O-CD 3.41Å; P617-K619 PolarHBondContact O-N 2.8Å
618	T	31.2	Very low	34.3	Very low	138 Å²	138	110 Å²	110	85%	0.847	62%	0.617	S	S	*	*			trans	-50.6	109.3	172	42	0	0	0	0	108	L616 K620	L616-T618 PolarHBondContact O-N 2.75Å; L616-T618 VanDerWaalsContact O-N 3.07Å; T618-K620 VanDerWaalsContact C-N 3.32Å; T618-K620 PolarHBondContact O-N 3.08Å
619	K	31.7	Very low	34.3	Very low	180 Å²	180	110.4 Å²	110.4	78%	0.783	63%	0.63	S	S	*	*			trans	-56.5	91.7	-178.7	-168.7	175.9	-175.2	177.2	0	109.7	P617 I621	P617-K619 PolarHBondContact O-N 2.8Å; K619-I621 PolarHBondContact O-N 3.39Å
620	K	31.4	Very low	34.1	Very low	183 Å²	183	109.4 Å²	109.4	80%	0.796	63%	0.633	S	S	*	*			trans	-60.9	118.2	141.1	-115.2	-179.1	-179	179	0	104	T618 Q622	T618-K620 VanDerWaalsContact C-N 3.32Å; T618-K620 PolarHBondContact O-N 3.08Å; K620-Q622 PolarHBondContact O-N 2.91Å
621	I	33.7	Very low	34.2	Very low	142 Å²	142	111 Å²	111	73%	0.728	64%	0.643	S	S	*	*			trans	-63.5	87.7	177.8	-57.7	166.9	0	0	0	106.4	K619	K619-I621 PolarHBondContact O-N 3.39Å
622	Q	28	Very low	34.4	Very low	147 Å²	147	114.6 Å²	114.6	69%	0.687	66%	0.661	S	S	*	*			trans	-117.7	117.9	159	-72.5	-168.2	20.4	0	0	105.9	K620 E624	K620-Q622 PolarHBondContact O-N 2.91Å; Q622-E624 PolarHBondContact O-N 3.37Å
623	T	34.3	Very low	34.5	Very low	141 Å²	141	118.8 Å²	118.8	87%	0.865	66%	0.664	S	S	*	*			trans	-75	58	-175.5	-27.1	0	0	0	0	109.2
624	E	30.7	Very low	34.7	Very low	157 Å²	157	120 Å²	120	73%	0.734	67%	0.667	S	S	*	*			trans	-107.9	117.9	161.8	-74	-172.1	175.6	0	0	106.7	Q622 I626	Q622-E624 PolarHBondContact O-N 3.37Å; E624-I626 VanDerWaalsContact C-N 3.3Å; E624-I626 PolarHBondContact O-N 3.37Å
625	T	32.8	Very low	34.2	Very low	143 Å²	143	122 Å²	122	88%	0.877	68%	0.679	S	S	*	*			trans	-52.4	95.1	171.3	34	0	0	0	0	108.8	P627	T625-P627 WeakPolarHBondContact O-CD 3.39Å
626	I	32.3	Very low	34.3	Very low	131 Å²	131	121.5 Å²	121.5	67%	0.672	67%	0.666	S	S	*	*			trans	-59.4	121.6	168.2	-56.8	-176.3	0	0	0	105.7	E624 T628	E624-I626 VanDerWaalsContact C-N 3.3Å; E624-I626 PolarHBondContact O-N 3.37Å; I626-T628 PolarHBondContact O-N 3.19Å
627	P	33.8	Very low	34.8	Very low	94 Å²	94	121.2 Å²	121.2	61%	0.61	68%	0.675	S	S	*	*			trans	-59.8	130.5	178.6	22	-29.1	0	0	0	108.4	T625 A629	T625-P627 WeakPolarHBondContact O-CD 3.39Å; P627-A629 PolarHBondContact O-N 3.09Å
628	T	44	Very low	34.8	Very low	149 Å²	149	120.7 Å²	120.7	91%	0.914	67%	0.674	S	S	*	*	S	Bend	trans	-63.9	20.5	-173.1	24.4	0	0	0	0	115.2	I626	I626-T628 PolarHBondContact O-N 3.19Å
629	A	40	Very low	34.8	Very low	70 Å²	70	117.8 Å²	117.8	58%	0.579	67%	0.671	S	S	*	*			trans	-148.5	81.7	-179.6	0	0	0	0	0	110.1	P627	P627-A629 PolarHBondContact O-N 3.09Å
630	S	34.9	Very low	34.6	Very low	89 Å²	89	114.8 Å²	114.8	62%	0.622	66%	0.663	S	S	*	*			trans	-116.1	111.8	162.8	-63.5	0	0	0	0	108.4
631	S	37.3	Very low	34.7	Very low	41 Å²	41	110.2 Å²	110.2	29%	0.287	65%	0.647	S	S	.	*			trans	-71.4	142.5	174.5	-55.6	0	0	0	0	110.4	Y633	S631-Y633 WeakPolarHBondContact O-CD2 3.18Å; S631-Y633 WeakPolarHBondContact O-CE2 3.42Å
632	I	41.9	Very low	35	Very low	108 Å²	108	105.7 Å²	105.7	55%	0.554	63%	0.63	S	S	*	*	E	Extended strand (participates in β ladder)	trans	-86.5	128.6	171.9	-60.7	175	0	0	0	108.4	V634 I644	I632-V634 HydrophobicContact CG2-CG2 4.38Å; I632-I644 PolarHBondContact O-N 3Å
633	Y	36.6	Very low	35.4	Very low	155 Å²	155	101.8 Å²	101.8	61%	0.608	62%	0.617	S	S	*	*	E	Extended strand (participates in β ladder)	trans	-105	120.7	179.6	-65.6	-81.1	0	0	0	110.2	S631 L641 V643	S631-Y633 WeakPolarHBondContact O-CD2 3.18Å; S631-Y633 WeakPolarHBondContact O-CE2 3.42Å; Y633-L641 HydrophobicContact CD1-CD1 3.97Å; Y633-L641 HydrophobicContact CD1-CD2 3.8Å; Y633-L641 HydrophobicContact CD1-CG 4.09Å; Y633-L641 HydrophobicContact CE1-CD2 4.15Å; Y633-V643 HydrophobicContact CD1-CG2 4Å; Y633-V643 HydrophobicContact CE1-CG1 4.38Å; Y633-V643 HydrophobicContact CE1-CG2 3.95Å
634	V	39	Very low	36.2	Very low	65 Å²	65	99.9 Å²	99.9	39%	0.394	60%	0.6	S	S	.	*	E	Extended strand (participates in β ladder)	trans	-115.2	118.8	172.8	-175.8	0	0	0	0	108.8	I632 L636 A642	I632-V634 HydrophobicContact CG2-CG2 4.38Å; V634-L636 HydrophobicContact CG1-CD2 4.3Å; V634-A642 HydrophobicContact CB-CB 4.46Å; V634-A642 PolarHBondContact N-O 3.35Å; V634-A642 VanDerWaalsContact N-O 3.15Å; V634-A642 PolarHBondContact O-N 3.12Å; V634-A642 VanDerWaalsContact O-N 3.11Å
635	T	29.6	Very low	36.3	Very low	120 Å²	120	96.8 Å²	96.8	74%	0.736	59%	0.593	S	S	*	*	E	Extended strand (participates in β ladder)	trans	-90.5	127.3	177.3	63.7	0	0	0	0	109.8	L641	T635-L641 HydrophobicContact CG2-CD1 4.11Å
636	L	38	Very low	36.5	Very low	63 Å²	63	93.3 Å²	93.3	33%	0.33	57%	0.574	S	S	.	*			trans	-109.9	147.9	174.6	-58.9	174.7	0	0	0	109.6	V634 S638 G639 L640	V634-L636 HydrophobicContact CG1-CD2 4.3Å; L636-S638 PolarHBondContact O-N 2.84Å; L636-G639 PolarHBondContact O-N 3.33Å; L636-L640 WeakPolarHBondContact CB-O 3.35Å; L636-L640 PolarHBondContact N-O 2.95Å; L636-L640 VanDerWaalsContact N-O 3.17Å
637	S	37.7	Very low	36.7	Very low	121 Å²	121	96 Å²	96	85%	0.846	59%	0.586	S	S	*	*	T	Hydrogen-bonded Turn	trans	-58.9	-14.2	-171.9	58.1	0	0	0	0	115.3
638	S	31.2	Very low	36.9	Very low	98 Å²	98	105.1 Å²	105.1	69%	0.685	62%	0.616	S	S	*	*	T	Hydrogen-bonded Turn	trans	-96.8	20.6	174.5	60.9	0	0	0	0	113.7	L636 L640	L636-S638 PolarHBondContact O-N 2.84Å; S638-L640 PolarHBondContact O-N 3.03Å
639	G	31.4	Very low	36.6	Very low	76 Å²	76	103 Å²	103	78%	0.784	60%	0.601	S	S	*	*	S	Bend	trans	73.2	8.4	177.3	0	0	0	0	0	114.6	L636	L636-G639 PolarHBondContact O-N 3.33Å
640	L	27.9	Very low	36.4	Very low	117 Å²	117	104.7 Å²	104.7	61%	0.613	60%	0.602	S	S	*	*			trans	-86	120.6	175.5	-129.4	109.9	0	0	0	109.8	L636 S638	L636-L640 WeakPolarHBondContact CB-O 3.35Å; L636-L640 PolarHBondContact N-O 2.95Å; L636-L640 VanDerWaalsContact N-O 3.17Å; S638-L640 PolarHBondContact O-N 3.03Å
641	L	34.6	Very low	36.5	Very low	88 Å²	88	105.6 Å²	105.6	46%	0.461	60%	0.601	S	S	.	*	E	Extended strand (participates in β ladder)	trans	-95.1	111.6	175	-173.6	70.7	0	0	0	108.3	Y633 T635 V643	Y633-L641 HydrophobicContact CD1-CD1 3.97Å; Y633-L641 HydrophobicContact CD1-CD2 3.8Å; Y633-L641 HydrophobicContact CD1-CG 4.09Å; Y633-L641 HydrophobicContact CE1-CD2 4.15Å; T635-L641 HydrophobicContact CG2-CD1 4.11Å; L641-V643 HydrophobicContact CD2-CG2 3.84Å; L641-V643 HydrophobicContact CG-CG2 3.92Å; L641-V643 PolarHBondContact O-N 2.87Å
642	A	39.5	Very low	36.5	Very low	46 Å²	46	109.4 Å²	109.4	38%	0.38	62%	0.619	S	S	.	*	E	Extended strand (participates in β ladder)	trans	-83.5	111.1	167.5	0	0	0	0	0	108	V634	V634-A642 HydrophobicContact CB-CB 4.46Å; V634-A642 PolarHBondContact N-O 3.35Å; V634-A642 VanDerWaalsContact N-O 3.15Å; V634-A642 PolarHBondContact O-N 3.12Å; V634-A642 VanDerWaalsContact O-N 3.11Å
643	V	36.1	Very low	36.1	Very low	66 Å²	66	109.4 Å²	109.4	40%	0.4	62%	0.623	S	S	.	*	E	Extended strand (participates in β ladder)	trans	-96.6	112	172.1	-175.7	0	0	0	0	106.7	Y633 L641 P645	Y633-V643 HydrophobicContact CD1-CG2 4Å; Y633-V643 HydrophobicContact CE1-CG1 4.38Å; Y633-V643 HydrophobicContact CE1-CG2 3.95Å; L641-V643 HydrophobicContact CD2-CG2 3.84Å; L641-V643 HydrophobicContact CG-CG2 3.92Å; L641-V643 PolarHBondContact O-N 2.87Å; V643-P645 WeakPolarHBondContact O-CD 3.46Å
644	I	50.6	Low	36.1	Very low	101 Å²	101	106.4 Å²	106.4	52%	0.518	62%	0.624	S	S	.	*	E	Extended strand (participates in β ladder)	trans	-85.1	108.2	171.6	-56.3	176.7	0	0	0	106.5	I632	I632-I644 PolarHBondContact O-N 3Å
645	P	32.6	Very low	35.9	Very low	91 Å²	91	109.4 Å²	109.4	59%	0.591	64%	0.641	S	S	*	*	P	Polyproline II helix	trans	-68.1	151.2	176.2	29.6	-33.6	0	0	0	109.7	V643 M647	V643-P645 WeakPolarHBondContact O-CD 3.46Å; P645-M647 PolarHBondContact O-N 3.09Å
646	P	36.8	Very low	36.4	Very low	71 Å²	71	108.5 Å²	108.5	46%	0.461	63%	0.633	S	S	.	*	P	Polyproline II helix	trans	-59.2	134.3	176.5	24.7	-32.7	0	0	0	110	K648	P646-K648 PolarHBondContact O-N 3.46Å
647	M	37.8	Very low	36.2	Very low	188 Å²	188	112.3 Å²	112.3	93%	0.926	66%	0.659	S	S	*	*	P	Polyproline II helix	trans	-65.2	127.3	169.2	-60.2	-159.9	-51.9	0	0	108.1	P645	P645-M647 PolarHBondContact O-N 3.09Å
648	K	38.7	Very low	36.1	Very low	285 Å²	285	111.5 Å²	111.5	100%	1.239	64%	0.642	S	S	*	*			trans	-70.5	0	175	-85.7	-171.6	176.9	-178.7	0	111.9	P646	P646-K648 PolarHBondContact O-N 3.46Å

Retrieved 648 of 648 residues in 984.3 ms (Link to these results)

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