A0A5K4F085_SCHMA Loading...

ATP-dependent Clp protease ATP-binding subunit ClpX

AlphaFold DB , UniProt , Accession A0A5K4F085, Species SCHMA (Schistosoma mansoni, Blood fluke), Gene n/a, Length 666 aa.

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(Predicted Aligned Error values between residue pairs)

Download Structure PDB PAE Table

Site	Residue	pLDDT	pLDDT confidence	pLDDT₁₀	pLDDT10 confidence	SASA	SASA [Å²]	SASA₁₀	SASA10 [Å²]	RSA	RSA unformatted	RSA₁₀	RSA10 unformatted	Surface	Surface10 (not used)	Disorder (not used)	Disorder	Sec. str.	Secondary structure	Isomer	Phi (φ)	Psi (ψ)	Omega (ω)	Chi 1 (χ₁)	Chi 2 (χ₂)	Chi 3 (χ₃)	Chi 4 (χ₄)	Chi 5 (χ₅)	Tau (τ)	Contacts (colored by PAE)	Contact details
1	M	34.5	Very low	30.5	Very low	233 Å²	233	138.5 Å²	138.5	100%	1.148	83%	0.828	S	S	*	*				0	136.8	0	-67.2	168.5	74.4	0	0	107.7
2	S	31.4	Very low	30.3	Very low	101 Å²	101	135.2 Å²	135.2	71%	0.706	83%	0.827	S	S	*	*			trans	36.5	137.6	155.7	56.9	0	0	0	0	122.1
3	N	32.1	Very low	29.9	Very low	140 Å²	140	139.8 Å²	139.8	75%	0.749	83%	0.829	S	S	*	*			cis	-173.4	144.5	-21.2	-114.7	-6.1	0	0	0	109.3
4	F	27.8	Very low	29.8	Very low	187 Å²	187	144.5 Å²	144.5	82%	0.82	83%	0.834	S	S	*	*			trans	45.3	113.5	143.4	-84.1	-103.8	0	0	0	122.5
5	A	32.5	Very low	29.4	Very low	90 Å²	90	149.1 Å²	149.1	74%	0.744	83%	0.832	S	S	*	*				60	132.9	113.9	0	0	0	0	0	121.5
6	S	32.9	Very low	29.4	Very low	115 Å²	115	155.8 Å²	155.8	80%	0.804	84%	0.841	S	S	*	*				-172.7	131.3	97.4	-168.2	0	0	0	0	111.9
7	S	30.6	Very low	29.3	Very low	119 Å²	119	157.6 Å²	157.6	83%	0.832	84%	0.839	S	S	*	*			trans	-128.2	112.1	158.4	53.3	0	0	0	0	108.6
8	A	33.2	Very low	29.7	Very low	94 Å²	94	156.6 Å²	156.6	78%	0.777	84%	0.84	S	S	*	*	P	Polyproline II helix	trans	-98.9	118	-177.2	0	0	0	0	0	110.3
9	F	28	Very low	29.8	Very low	212 Å²	212	158.8 Å²	158.8	93%	0.93	84%	0.844	S	S	*	*	P	Polyproline II helix	trans	-91.4	120.6	166.5	-106.1	-90.7	0	0	0	109.7
10	S	26.9	Very low	29.8	Very low	121 Å²	121	154.7 Å²	154.7	85%	0.846	84%	0.841	S	S	*	*	P	Polyproline II helix	trans	-84	125.5	175	-172.5	0	0	0	0	110.2
11	C	25.1	Very low	30.1	Very low	111 Å²	111	152 Å²	152	75%	0.75	83%	0.834	S	S	*	*			trans	-108.2	113.4	178.8	-168.6	0	0	0	0	110.2	F13	C11-F13 PolarHBondContact O-N 2.99Å
12	A	28.5	Very low	30	Very low	99 Å²	99	146.1 Å²	146.1	82%	0.818	82%	0.822	S	S	*	*			trans	-83.2	101.5	-177.8	0	0	0	0	0	111.5
13	F	25.2	Very low	30	Very low	195 Å²	195	150.1 Å²	150.1	86%	0.855	83%	0.827	S	S	*	*			trans	-69	129.2	173.3	-110	-99.1	0	0	0	111.7	C11	C11-F13 PolarHBondContact O-N 2.99Å
14	K	27.9	Very low	29.8	Very low	206 Å²	206	150.9 Å²	150.9	90%	0.896	83%	0.83	S	S	*	*			trans	-125.7	127.5	160.8	-134.1	173.8	-173.8	178.7	0	109.4
15	R	24.2	Very low	29.8	Very low	214 Å²	214	149.7 Å²	149.7	81%	0.808	83%	0.831	S	S	*	*			trans	-101.1	119.2	-158.8	-176.5	179.6	-171.2	167.6	2.7	111.2
16	W	28.8	Very low	29.8	Very low	256 Å²	256	151 Å²	151	97%	0.97	83%	0.829	S	S	*	*			trans	-111	150.9	163.7	-88.9	47.4	0	0	0	110
17	K	28.1	Very low	29.7	Very low	186 Å²	186	149.4 Å²	149.4	81%	0.809	82%	0.823	S	S	*	*			trans	-137	99.7	-161	-161.6	-163.6	-170	-166.3	0	109.7
18	T	37	Very low	29.7	Very low	139 Å²	139	155.2 Å²	155.2	85%	0.853	83%	0.827	S	S	*	*			trans	-144.9	156.3	169.7	32.9	0	0	0	0	110.5
19	H	31.7	Very low	29.6	Very low	200 Å²	200	161.5 Å²	161.5	93%	0.926	83%	0.832	S	S	*	*			trans	-79.8	149.4	-164.3	-84	-130.6	0	0	0	114.4
20	G	29.9	Very low	29.7	Very low	75 Å²	75	154.5 Å²	154.5	77%	0.773	82%	0.82	S	S	*	*			trans	93.7	36.3	130.6	0	0	0	0	0	119.6
21	S	35.9	Very low	29.9	Very low	99 Å²	99	156 Å²	156	69%	0.692	82%	0.819	S	S	*	*			trans	-151.6	134.7	161.1	-55.4	0	0	0	0	111.1
22	A	31.3	Very low	30.2	Very low	110 Å²	110	157.8 Å²	157.8	91%	0.909	82%	0.821	S	S	*	*			trans	-83.5	118.1	174.5	0	0	0	0	0	109.8
23	F	31.5	Very low	30.3	Very low	185 Å²	185	158.4 Å²	158.4	81%	0.811	82%	0.819	S	S	*	*			trans	-111.5	131.1	174.8	-87.9	-85.3	0	0	0	111.5	I25	F23-I25 PolarHBondContact O-N 3.46Å
24	L	28.9	Very low	30.4	Very low	156 Å²	156	160.2 Å²	160.2	82%	0.817	82%	0.821	S	S	*	*			trans	-75.9	116.8	175.2	-173.5	73.5	0	0	0	109.8	V26	L24-V26 HydrophobicContact CD2-CG2 3.92Å; L24-V26 HydrophobicContact CG-CG2 4.09Å; L24-V26 PolarHBondContact O-N 3.39Å
25	I	27.7	Very low	30.3	Very low	161 Å²	161	157.9 Å²	157.9	83%	0.826	82%	0.818	S	S	*	*			trans	-85.1	109.8	174.2	-59.5	174.3	0	0	0	108.7	F23	F23-I25 PolarHBondContact O-N 3.46Å
26	V	32.8	Very low	30.6	Very low	117 Å²	117	153.7 Å²	153.7	71%	0.709	82%	0.816	S	S	*	*			trans	-102.4	100.8	172.2	-176.9	0	0	0	0	109.6	L24	L24-V26 HydrophobicContact CD2-CG2 3.92Å; L24-V26 HydrophobicContact CG-CG2 4.09Å; L24-V26 PolarHBondContact O-N 3.39Å
27	A	30.4	Very low	30.6	Very low	83 Å²	83	147.4 Å²	147.4	69%	0.686	81%	0.81	S	S	*	*			trans	-78.6	129.1	169	0	0	0	0	0	110	Y29	A27-Y29 PolarHBondContact O-N 3.37Å
28	R	30.4	Very low	30.6	Very low	240 Å²	240	146.5 Å²	146.5	91%	0.906	81%	0.809	S	S	*	*			trans	-89	106	-174.1	-165.3	174.7	-172.5	148.9	0.7	111.1
29	Y	30.9	Very low	30.2	Very low	226 Å²	226	146.1 Å²	146.1	89%	0.886	80%	0.801	S	S	*	*			trans	-86.3	151.5	165.4	-103.3	-97.1	0	0	0	111.2	A27	A27-Y29 PolarHBondContact O-N 3.37Å
30	G	30.3	Very low	29.9	Very low	66 Å²	66	144.8 Å²	144.8	68%	0.68	80%	0.8	S	S	*	*			trans	-85.4	167.6	-173.3	0	0	0	0	0	115.5
31	N	32.4	Very low	30	Very low	152 Å²	152	146.9 Å²	146.9	81%	0.813	80%	0.798	S	S	*	*	S	Bend	trans	68.7	102.1	167	-64.4	-6.5	0	0	0	119.2
32	N	29.7	Very low	29.6	Very low	148 Å²	148	151.2 Å²	151.2	79%	0.791	81%	0.807	S	S	*	*	S	Bend	trans	67	135.9	139.1	-59.1	-16.9	0	0	0	120.6
33	S	30.9	Very low	29.5	Very low	113 Å²	113	150.7 Å²	150.7	79%	0.79	80%	0.797	S	S	*	*			trans	69.4	127.9	-177.3	75.3	0	0	0	0	116.1
34	W	27.9	Very low	29.4	Very low	233 Å²	233	150.9 Å²	150.9	88%	0.883	80%	0.8	S	S	*	*			trans	-120.5	105.3	167	-76.7	77.6	0	0	0	107.5
35	N	26.7	Very low	29.5	Very low	157 Å²	157	150.2 Å²	150.2	84%	0.84	80%	0.802	S	S	*	*			trans	-92.4	109.8	159.5	-80.3	-23.9	0	0	0	107.2	C37	N35-C37 PolarHBondContact O-N 2.6Å
36	T	29.8	Very low	29.4	Very low	125 Å²	125	147.6 Å²	147.6	77%	0.767	80%	0.798	S	S	*	*			trans	-83.1	101.2	170.1	43.6	0	0	0	0	109.3
37	C	28.8	Very low	29.3	Very low	125 Å²	125	150.6 Å²	150.6	85%	0.845	80%	0.802	S	S	*	*			trans	-91.9	114.3	163.5	-73.4	0	0	0	0	109.2	N35	N35-C37 PolarHBondContact O-N 2.6Å
38	E	27.9	Very low	29.4	Very low	167 Å²	167	153.7 Å²	153.7	78%	0.78	81%	0.807	S	S	*	*			trans	-75.9	168.5	165.4	-67.5	-175.7	134.8	0	0	111.7
39	N	28	Very low	29.5	Very low	130 Å²	130	145.7 Å²	145.7	70%	0.695	80%	0.799	S	S	*	*			trans	79.6	97	166.8	-56.8	-47.1	0	0	0	118.2
40	L	26.9	Very low	29.3	Very low	173 Å²	173	141.2 Å²	141.2	91%	0.906	80%	0.795	S	S	*	*			trans	-134	70	142.6	-106.5	163.1	0	0	0	109	H42	L40-H42 PolarHBondContact O-N 2.81Å
41	T	32.1	Very low	29.4	Very low	118 Å²	118	145.4 Å²	145.4	72%	0.724	80%	0.797	S	S	*	*			trans	-72	114.7	167.2	40.8	0	0	0	0	109.4	S43	T41-S43 PolarHBondContact O-N 3.21Å
42	H	27.1	Very low	29.2	Very low	190 Å²	190	146 Å²	146	88%	0.88	79%	0.794	S	S	*	*			trans	-66.5	112.8	165.9	-110.4	-99.4	0	0	0	108.9	L40	L40-H42 PolarHBondContact O-N 2.81Å
43	S	28.3	Very low	29.3	Very low	100 Å²	100	146.3 Å²	146.3	70%	0.699	80%	0.796	S	S	*	*			trans	-149.3	113.7	161.7	-116.1	0	0	0	0	114	T41	T41-S43 PolarHBondContact O-N 3.21Å
44	Q	30.1	Very low	29.1	Very low	188 Å²	188	146.2 Å²	146.2	88%	0.879	79%	0.794	S	S	*	*			trans	62.1	135.8	140.3	-58.5	-162.2	-12.9	0	0	122.4
45	V	29.7	Very low	29.1	Very low	142 Å²	142	139.5 Å²	139.5	86%	0.861	78%	0.783	S	S	*	*			trans	-68.2	139.2	166.2	173.8	0	0	0	0	109.5
46	S	26.8	Very low	29.3	Very low	107 Å²	107	139.1 Å²	139.1	75%	0.748	78%	0.779	S	S	*	*			trans	-79.5	149.7	-176.8	40.8	0	0	0	0	114.3
47	K	30.5	Very low	29.2	Very low	180 Å²	180	138.8 Å²	138.8	78%	0.783	78%	0.782	S	S	*	*			trans	-165.9	127.4	134.5	-107	-178.8	179.6	-172	0	113.5
48	D	33	Very low	29.1	Very low	148 Å²	148	136.3 Å²	136.3	79%	0.791	78%	0.778	S	S	*	*			trans	69.2	127.9	144.7	-46.9	-30.3	0	0	0	122.7
49	G	31.5	Very low	29	Very low	72 Å²	72	137.1 Å²	137.1	74%	0.742	79%	0.787	S	S	*	*			trans	90.6	107.7	161.5	0	0	0	0	0	116.7
50	V	27.9	Very low	28.8	Very low	132 Å²	132	137 Å²	137	80%	0.8	79%	0.794	S	S	*	*			cis	97.3	125.9	36.1	176.8	0	0	0	0	114.4
51	H	31	Very low	29	Very low	154 Å²	154	138.7 Å²	138.7	71%	0.713	79%	0.794	S	S	*	*			trans	63.4	114.8	-178.1	-74.1	-65.2	0	0	0	116.8
52	E	29.6	Very low	28.8	Very low	164 Å²	164	141.2 Å²	141.2	77%	0.766	80%	0.8	S	S	*	*				68.2	109.4	58.4	-67.7	-170.1	144.3	0	0	114.6
53	D	30	Very low	28.9	Very low	155 Å²	155	139.3 Å²	139.3	83%	0.829	80%	0.795	S	S	*	*				-170.6	147.4	112.3	-121.3	-34.5	0	0	0	114.5
54	C	27.7	Very low	28.9	Very low	110 Å²	110	140.8 Å²	140.8	74%	0.743	79%	0.791	S	S	*	*			trans	54	155.2	159.8	-80.8	0	0	0	0	123
55	S	27.9	Very low	28.5	Very low	93 Å²	93	137.5 Å²	137.5	65%	0.65	79%	0.787	S	S	*	*			cis	-173.1	179.5	-37.1	49.4	0	0	0	0	109.7
56	I	30.7	Very low	28.4	Very low	149 Å²	149	141.1 Å²	141.1	76%	0.764	79%	0.785	S	S	*	*			trans	91	84.1	164.9	-52.4	176.5	0	0	0	118.4
57	S	26.8	Very low	28.4	Very low	117 Å²	117	145.5 Å²	145.5	82%	0.818	79%	0.791	S	S	*	*			trans	41.2	124.7	132.6	67.8	0	0	0	0	123.1
58	G	28	Very low	28.5	Very low	74 Å²	74	142.4 Å²	142.4	76%	0.763	79%	0.792	S	S	*	*			trans	-177.4	78.5	161.4	0	0	0	0	0	115.5
59	L	26	Very low	28.3	Very low	184 Å²	184	142.2 Å²	142.2	96%	0.963	79%	0.79	S	S	*	*			trans	48.1	80.9	158.5	-77.4	154.2	0	0	0	119
60	C	24.1	Very low	28.2	Very low	126 Å²	126	147.8 Å²	147.8	85%	0.851	79%	0.794	S	S	*	*			trans	-152.4	122.8	144.9	-152.1	0	0	0	0	111.7
61	K	30.4	Very low	28.4	Very low	209 Å²	209	146.1 Å²	146.1	91%	0.909	79%	0.788	S	S	*	*			trans	-130.8	113.7	167.8	-78.6	-176.6	175.1	179.4	0	106.3
62	M	28	Very low	28.5	Very low	171 Å²	171	146.9 Å²	146.9	84%	0.842	79%	0.792	S	S	*	*			cis	85.5	152.4	42.3	-158.6	-150.5	-171	0	0	113.7
63	I	29	Very low	28.6	Very low	151 Å²	151	146.5 Å²	146.5	77%	0.774	80%	0.795	S	S	*	*			trans	92.2	120.8	172.6	-57	171.2	0	0	0	112.6
64	E	27.6	Very low	28.9	Very low	131 Å²	131	144.9 Å²	144.9	61%	0.612	79%	0.794	S	S	*	*			cis	-147.8	174.5	-4.8	-150.1	-144	-129.4	0	0	111	R66	E64-R66 IonicContact OE1-NE 3.35Å; E64-R66 WeakPolarHBondContact OE2-CB 3.25Å; E64-R66 WeakPolarHBondContact OE2-CD 3.46Å; E64-R66 WeakPolarHBondContact OE2-CG 3.16Å; E64-R66 PolarHBondContact OE2-N 2.88Å
65	C	21.7	Very low	29.1	Very low	118 Å²	118	143.4 Å²	143.4	80%	0.797	80%	0.797	S	S	*	*			trans	-142.5	123	160	178.3	0	0	0	0	109.1
66	R	27.4	Very low	29.3	Very low	218 Å²	218	142.7 Å²	142.7	82%	0.823	80%	0.804	S	S	*	*			trans	-115.6	117.4	-178.1	-121.8	171.4	-176.7	-166.4	0.3	112.4	E64	E64-R66 IonicContact OE1-NE 3.35Å; E64-R66 WeakPolarHBondContact OE2-CB 3.25Å; E64-R66 WeakPolarHBondContact OE2-CD 3.46Å; E64-R66 WeakPolarHBondContact OE2-CG 3.16Å; E64-R66 PolarHBondContact OE2-N 2.88Å
67	K	28.3	Very low	29.5	Very low	200 Å²	200	141.5 Å²	141.5	87%	0.87	81%	0.806	S	S	*	*			trans	-85.9	142.3	172	-66.9	173.3	176.2	172.5	0	110.9
68	S	32.7	Very low	29.8	Very low	115 Å²	115	143.6 Å²	143.6	80%	0.804	81%	0.807	S	S	*	*			trans	-161.3	103.2	142.3	58.6	0	0	0	0	114.4
69	N	28.3	Very low	29.8	Very low	143 Å²	143	149 Å²	149	77%	0.765	81%	0.812	S	S	*	*			trans	38.4	126.8	142.1	-80.4	-32.6	0	0	0	123.7
70	K	29	Very low	30	Very low	190 Å²	190	144 Å²	144	83%	0.826	81%	0.806	S	S	*	*				45.7	119.9	127.4	-60.3	176.7	176.3	179.7	0	119.1
71	S	31.6	Very low	30.1	Very low	96 Å²	96	142.3 Å²	142.3	67%	0.671	81%	0.81	S	S	*	*				173.4	130.1	87	-163.9	0	0	0	0	114.1
72	Q	33.8	Very low	30	Very low	170 Å²	170	136 Å²	136	79%	0.794	80%	0.804	S	S	*	*			trans	55.6	105.9	143.4	-68	175.4	16.4	0	0	122.7
73	N	30.7	Very low	30	Very low	156 Å²	156	133.8 Å²	133.8	83%	0.834	81%	0.806	S	S	*	*				77.9	156.6	118.2	-86.2	4.1	0	0	0	121.9
74	P	37.9	Very low	30.1	Very low	122 Å²	122	135 Å²	135	79%	0.792	81%	0.812	S	S	*	*			trans	-129.1	175.7	-131.4	44.2	-31.6	0	0	0	115.3
75	G	31.5	Very low	30	Very low	79 Å²	79	136 Å²	136	81%	0.814	82%	0.822	S	S	*	*			trans	163.3	129.6	154.5	0	0	0	0	0	117.2
76	G	31.1	Very low	30.2	Very low	77 Å²	77	136.1 Å²	136.1	79%	0.794	83%	0.825	S	S	*	*			trans	94.5	118.8	143.9	0	0	0	0	0	117.8
77	P	35.2	Very low	30.4	Very low	124 Å²	124	130.6 Å²	130.6	81%	0.805	83%	0.825	S	S	*	*			trans	-93.3	162.9	170.7	38.2	-33.6	0	0	0	111.9
78	L	32.8	Very low	30.3	Very low	162 Å²	162	128.5 Å²	128.5	85%	0.848	82%	0.824	S	S	*	*			trans	-165.8	168	144.7	-109.4	165	0	0	0	112.3
79	E	28.3	Very low	30.2	Very low	186 Å²	186	130 Å²	130	87%	0.869	83%	0.828	S	S	*	*			trans	-85.8	169.1	-164.6	-56	163.6	124.6	0	0	113.7
80	G	29.6	Very low	30.2	Very low	81 Å²	81	127.3 Å²	127.3	84%	0.835	82%	0.82	S	S	*	*			trans	151.1	112.3	163.8	0	0	0	0	0	113.5
81	G	26.5	Very low	30.2	Very low	90 Å²	90	126 Å²	126	93%	0.928	82%	0.817	S	S	*	*			trans	-80	160.3	175.7	0	0	0	0	0	113.3
82	G	29.1	Very low	30.1	Very low	77 Å²	77	129.4 Å²	129.4	79%	0.794	82%	0.822	S	S	*	*			trans	-173.3	104.8	172.9	0	0	0	0	0	112
83	S	27.8	Very low	29.8	Very low	124 Å²	124	128.7 Å²	128.7	87%	0.867	82%	0.822	S	S	*	*			trans	-71.8	125.6	169.3	-61.9	0	0	0	0	110.2
84	L	31.2	Very low	29.9	Very low	175 Å²	175	129 Å²	129	92%	0.916	82%	0.821	S	S	*	*			trans	-138.1	133.4	161.1	-81.8	174.7	0	0	0	110.2
85	N	25.1	Very low	29.3	Very low	152 Å²	152	126.3 Å²	126.3	81%	0.813	82%	0.816	S	S	*	*			trans	-84.7	155.4	179.2	-72.6	-28.8	0	0	0	111.8
86	S	27.2	Very low	29.6	Very low	122 Å²	122	128 Å²	128	85%	0.853	82%	0.816	S	S	*	*			trans	52	110.7	147.6	-58.7	0	0	0	0	120.3
87	A	31.9	Very low	29.7	Very low	101 Å²	101	132.9 Å²	132.9	84%	0.835	82%	0.815	S	S	*	*			trans	-157.5	132.8	138.7	0	0	0	0	0	111.8
88	N	26	Very low	29.4	Very low	157 Å²	157	132.2 Å²	132.2	84%	0.84	80%	0.801	S	S	*	*			trans	-75.6	144	171.4	-69.1	-34.1	0	0	0	111.6
89	V	30.5	Very low	29.5	Very low	147 Å²	147	134.5 Å²	134.5	89%	0.891	80%	0.798	S	S	*	*			trans	-142.3	148.2	149.3	-175.2	0	0	0	0	109.1
90	S	28	Very low	29.9	Very low	86 Å²	86	131.5 Å²	131.5	60%	0.601	80%	0.798	S	S	*	*			trans	-118.5	-170.5	-154.7	-49	0	0	0	0	114.9
91	H	28.9	Very low	30.1	Very low	163 Å²	163	131.7 Å²	131.7	76%	0.755	80%	0.8	S	S	*	*			trans	92.2	141.6	164.2	-51.3	-76.2	0	0	0	116
92	H	29.2	Very low	30.4	Very low	167 Å²	167	131.6 Å²	131.6	77%	0.773	80%	0.798	S	S	*	*			cis	-130.6	146.8	24.1	-101.7	-90.5	0	0	0	115.8
93	I	28.2	Very low	30.7	Very low	155 Å²	155	133.2 Å²	133.2	80%	0.795	80%	0.804	S	S	*	*			trans	-112.4	140.9	157.4	-68	171.9	0	0	0	107.1
94	I	31.7	Very low	30.9	Very low	161 Å²	161	131.1 Å²	131.1	83%	0.826	80%	0.802	S	S	*	*			trans	-117.7	126.8	161.7	-65.1	175.3	0	0	0	106.9
95	G	26.1	Very low	31	Very low	66 Å²	66	126.9 Å²	126.9	68%	0.68	80%	0.801	S	S	*	*			trans	-141.1	143.3	176.8	0	0	0	0	0	111.2
96	S	36.3	Very low	31.2	Very low	116 Å²	116	123.9 Å²	123.9	81%	0.811	81%	0.806	S	S	*	*			trans	-128.2	103.7	173.2	-70.1	0	0	0	0	109.8
97	K	33.4	Very low	31.4	Very low	178 Å²	178	121.9 Å²	121.9	77%	0.774	81%	0.805	S	S	*	*			trans	15.7	145.4	132.6	-71.5	-172.7	168.4	-130.1	0	118.5
98	E	29.3	Very low	31.5	Very low	111 Å²	111	123.4 Å²	123.4	52%	0.519	81%	0.81	S	S	.	*			cis	-169.8	162	-0.7	-127.2	173.9	-117.1	0	0	109.3
99	R	34.4	Very low	31.8	Very low	210 Å²	210	119.4 Å²	119.4	79%	0.792	81%	0.805	S	S	*	*			trans	85.3	122	153	-68.6	164.4	-161.1	-135.6	-3.5	122.8
100	S	38.1	Very low	31.9	Very low	123 Å²	123	120.9 Å²	120.9	86%	0.86	81%	0.808	S	S	*	*			trans	80	111.7	131	63.5	0	0	0	0	122.1
101	G	33.6	Very low	32.1	Very low	85 Å²	85	120.3 Å²	120.3	88%	0.876	82%	0.816	S	S	*	*				129.4	125.3	129.2	0	0	0	0	0	116.5
102	G	32.6	Very low	32.5	Very low	87 Å²	87	119.5 Å²	119.5	90%	0.897	82%	0.823	S	S	*	*			trans	115.2	121.2	161.8	0	0	0	0	0	114.9
103	A	35.2	Very low	32.9	Very low	111 Å²	111	113.6 Å²	113.6	92%	0.917	81%	0.807	S	S	*	*			trans	-106	159.6	-178.1	0	0	0	0	0	112.5
104	G	32.4	Very low	33.8	Very low	80 Å²	80	111.9 Å²	111.9	83%	0.825	81%	0.809	S	S	*	*			trans	132.7	137.6	147.9	0	0	0	0	0	116.9
105	G	32.5	Very low	35.2	Very low	86 Å²	86	111.5 Å²	111.5	89%	0.887	80%	0.802	S	S	*	*			trans	99.2	105.7	160.4	0	0	0	0	0	115.2
106	G	30	Very low	37.2	Very low	89 Å²	89	112.1 Å²	112.1	92%	0.918	79%	0.788	S	S	*	*			trans	-88.6	160.7	172.9	0	0	0	0	0	113.2
107	G	32.2	Very low	39	Very low	81 Å²	81	114.5 Å²	114.5	84%	0.835	78%	0.779	S	S	*	*			trans	-174.2	111.8	172.8	0	0	0	0	0	110.1
108	S	32.8	Very low	41	Very low	133 Å²	133	106.2 Å²	106.2	93%	0.93	74%	0.744	S	S	*	*			trans	-91.7	138.7	-178.6	-169.8	0	0	0	0	110.8
109	G	33.2	Very low	43.2	Very low	73 Å²	73	108.1 Å²	108.1	75%	0.753	76%	0.758	S	S	*	*			trans	175.9	86.4	179	0	0	0	0	0	113.2
110	N	31.8	Very low	44.9	Very low	177 Å²	177	105.6 Å²	105.6	95%	0.947	75%	0.753	S	S	*	*			trans	-81.3	142	175	-82.9	-20.3	0	0	0	111.6
111	G	32.1	Very low	46.9	Very low	75 Å²	75	101.8 Å²	101.8	77%	0.773	73%	0.725	S	S	*	*			trans	160.7	33.6	172.8	0	0	0	0	0	116.5	G113	G111-G113 PolarHBondContact O-N 3.26Å; G111-G113 VanDerWaalsContact O-N 3.1Å
112	T	36.4	Very low	48.7	Very low	146 Å²	146	99.9 Å²	99.9	90%	0.896	71%	0.705	S	S	*	*			trans	-82	89.4	-176.3	54	0	0	0	0	112.7
113	G	38.4	Very low	50.7	Low	42 Å²	42	96.5 Å²	96.5	43%	0.433	67%	0.671	S	S	.	*			trans	-61.4	137.7	157.5	0	0	0	0	0	110.6	G111 F115	G111-G113 PolarHBondContact O-N 3.26Å; G111-G113 VanDerWaalsContact O-N 3.1Å; G113-F115 VanDerWaalsContact O-CD2 3.26Å; G113-F115 WeakPolarHBondContact O-CD2 3.49Å; G113-F115 PolarHBondContact O-N 3.11Å
114	S	46.6	Very low	52.7	Low	120 Å²	120	93.8 Å²	93.8	84%	0.839	64%	0.644	S	S	*	*			trans	-80.2	78.1	-175.5	54.5	0	0	0	0	112	I116	S114-I116 PolarHBondContact O-N 3.04Å
115	F	60.8	Low	54.6	Low	153 Å²	153	91.1 Å²	91.1	67%	0.671	61%	0.61	S	S	*	*			trans	-63.3	128.1	170.1	-61.7	-82.1	0	0	0	110.8	G113 R117	G113-F115 VanDerWaalsContact O-CD2 3.26Å; G113-F115 WeakPolarHBondContact O-CD2 3.49Å; G113-F115 PolarHBondContact O-N 3.11Å; F115-R117 PolarHBondContact O-N 3.34Å
116	I	68.7	Low	56.5	Low	78 Å²	78	91.8 Å²	91.8	40%	0.4	59%	0.589	S	S	.	*			trans	-67.2	121.6	168.4	-47.2	178.9	0	0	0	107.2	S114 L125	S114-I116 PolarHBondContact O-N 3.04Å; I116-L125 HydrophobicContact CB-CD1 4.42Å; I116-L125 HydrophobicContact CG2-CD1 3.76Å; I116-L125 HydrophobicContact CG2-CG 4.5Å; I116-L125 PolarHBondContact O-N 2.9Å
117	R	73.6	Confident	58.2	Low	166 Å²	166	91.2 Å²	91.2	63%	0.626	57%	0.571	S	S	*	*	B	Isolated β-bridge	trans	-106	140.9	-178.4	-75.4	-179.1	-102	-133.6	-3.7	110.4	F115 G122 G123	F115-R117 PolarHBondContact O-N 3.34Å; R117-G122 VanDerWaalsContact CD-O 3.24Å; R117-G122 WeakPolarHBondContact CD-O 3.25Å; R117-G122 VanDerWaalsContact CG-O 3.29Å; R117-G122 WeakPolarHBondContact CG-O 3.41Å; R117-G123 WeakPolarHBondContact CA-O 3.36Å
118	C	76.5	Confident	59.6	Low	4 Å²	4	89.6 Å²	89.6	3%	0.027	54%	0.543	C	S	.	.			trans	-65.9	130.5	174.3	172.7	0	0	0	0	112.1	K120 C121 G122 G123 L125 C141 Y148	C118-K120 PolarHBondContact O-N 2.85Å; C118-K120 VanDerWaalsContact O-N 3.13Å; C118-K120 PolarHBondContact SG-N 2.84Å; C118-K120 VanDerWaalsContact SG-N 3.37Å; C118-C121 HydrophobicContact CB-CB 4.29Å; C118-C121 WeakPolarHBondContact CB-SG 2.98Å; C118-C121 PolarHBondContact SG-N 3.24Å; C118-C121 PolarHBondContact SG-SG 2.97Å; C118-G122 WeakPolarHBondContact O-CA 3.28Å; C118-G122 PolarHBondContact O-N 3.15Å; C118-G123 PolarHBondContact N-O 2.9Å; C118-L125 HydrophobicContact CB-CD2 3.77Å; C118-L125 HydrophobicContact CB-CG 4.42Å; C118-C141 HydrophobicContact CB-CB 3.78Å; C118-Y148 HydrophobicContact CB-CE2 4.33Å; C118-Y148 PolarHBondContact SG-OH 2.9Å
119	N	74.6	Confident	60.7	Low	151 Å²	151	87.7 Å²	87.7	81%	0.807	52%	0.522	S	S	*	.	T	Hydrogen-bonded Turn	trans	-62.2	-17.9	178	-62.5	47.9	0	0	0	114.5	Y148	N119-Y148 PolarHBondContact N-OH 3.26Å
120	K	71.7	Confident	61.7	Low	158 Å²	158	88.6 Å²	88.6	69%	0.687	52%	0.515	S	S	*	.	T	Hydrogen-bonded Turn	trans	-95.9	-55.5	174.2	-80.2	-175.7	176.9	174.9	0	112.7	C118	C118-K120 PolarHBondContact O-N 2.85Å; C118-K120 VanDerWaalsContact O-N 3.13Å; C118-K120 PolarHBondContact SG-N 2.84Å; C118-K120 VanDerWaalsContact SG-N 3.37Å
121	C	78.9	Confident	62.5	Low	42 Å²	42	83 Å²	83	28%	0.284	49%	0.487	S	S	.	.	T	Hydrogen-bonded Turn	trans	-89.5	-18.8	-167.4	78.8	0	0	0	0	113.3	C118 G123 C141 A143 C144	C118-C121 HydrophobicContact CB-CB 4.29Å; C118-C121 WeakPolarHBondContact CB-SG 2.98Å; C118-C121 PolarHBondContact SG-N 3.24Å; C118-C121 PolarHBondContact SG-SG 2.97Å; C121-G123 PolarHBondContact O-N 3.44Å; C121-G123 PolarHBondContact SG-N 3.37Å; C121-C141 WeakPolarHBondContact CB-SG 3.5Å; C121-C141 WeakPolarHBondContact SG-CB 3.27Å; C121-C141 CovalentContact SG-SG 2.06Å; C121-C141 PolarHBondContact SG-SG 2.68Å; C121-A143 HydrophobicContact CB-CB 4.16Å; C121-C144 HydrophobicContact CB-CB 3.95Å
122	G	71.8	Confident	63.4	Low	45 Å²	45	82 Å²	82	46%	0.464	47%	0.466	S	S	.	.			trans	68	-12.9	-170.8	0	0	0	0	0	115	R117 C118	R117-G122 VanDerWaalsContact CD-O 3.24Å; R117-G122 WeakPolarHBondContact CD-O 3.25Å; R117-G122 VanDerWaalsContact CG-O 3.29Å; R117-G122 WeakPolarHBondContact CG-O 3.41Å; C118-G122 WeakPolarHBondContact O-CA 3.28Å; C118-G122 PolarHBondContact O-N 3.15Å
123	G	75	Confident	63.6	Low	16 Å²	16	77.4 Å²	77.4	17%	0.165	44%	0.44	C	S	.	.	S	Bend	trans	-68.8	164.8	175.5	0	0	0	0	0	113.8	R117 C118 C121	R117-G123 WeakPolarHBondContact CA-O 3.36Å; C118-G123 PolarHBondContact N-O 2.9Å; C121-G123 PolarHBondContact O-N 3.44Å; C121-G123 PolarHBondContact SG-N 3.37Å
124	P	76.5	Confident	63.9	Low	54 Å²	54	86.8 Å²	86.8	35%	0.351	46%	0.464	S	S	.	.	B	Isolated β-bridge	trans	-67.6	143.6	-179.3	30.3	-35.4	0	0	0	111.3
125	L	73.6	Confident	64	Low	24 Å²	24	85.2 Å²	85.2	13%	0.126	45%	0.445	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-90.2	134.7	168	-63.8	-176.4	0	0	0	110.5	I116 C118 M139 E140 C141 Y148	I116-L125 HydrophobicContact CB-CD1 4.42Å; I116-L125 HydrophobicContact CG2-CD1 3.76Å; I116-L125 HydrophobicContact CG2-CG 4.5Å; I116-L125 PolarHBondContact O-N 2.9Å; C118-L125 HydrophobicContact CB-CD2 3.77Å; C118-L125 HydrophobicContact CB-CG 4.42Å; L125-M139 HydrophobicContact CB-CB 4.18Å; L125-M139 HydrophobicContact CB-CE 3.85Å; L125-M139 HydrophobicContact CD1-CB 4.42Å; L125-E140 CarbonylContact C-O 3.5Å; L125-E140 WeakPolarHBondContact CA-O 3.42Å; L125-C141 HydrophobicContact CD2-CB 3.82Å; L125-Y148 HydrophobicContact CD1-CD2 3.99Å; L125-Y148 HydrophobicContact CD1-CE2 4.37Å; L125-Y148 HydrophobicContact CD1-CG 4.19Å; L125-Y148 HydrophobicContact CD2-CD2 3.69Å; L125-Y148 HydrophobicContact CD2-CE2 3.71Å
126	K	71.1	Confident	63.7	Low	101 Å²	101	82 Å²	82	44%	0.439	44%	0.441	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-105.2	142.7	170.8	-75.2	-178.2	168.4	174.9	0	110.6	M139 E140 E142	K126-M139 CarbonylContact O-C 3.53Å; K126-M139 WeakPolarHBondContact O-CA 3.49Å; K126-M139 WeakPolarHBondContact O-CB 3.43Å; K126-E140 HydrophobicContact CB-CG 4.22Å; K126-E140 PolarHBondContact N-O 3.26Å; K126-E140 PolarHBondContact O-N 3.28Å; K126-E142 HydrophobicContact CD-CG 3.87Å; K126-E142 WeakPolarHBondContact CE-OE1 3.15Å; K126-E142 HydrophobicContact CG-CG 4.31Å; K126-E142 IonicContact NZ-OE1 3.93Å; K126-E142 PolarHBondContact NZ-OE1 3.41Å; K126-E142 IonicContact NZ-OE2 3.71Å
127	S	65.3	Low	63.2	Low	77 Å²	77	83.5 Å²	83.5	54%	0.538	44%	0.442	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-72.8	132.3	168	54	0	0	0	0	109.8	M139	S127-M139 WeakPolarHBondContact CA-SD 3.36Å
128	L	62.6	Low	62.9	Low	47 Å²	47	78.9 Å²	78.9	25%	0.246	43%	0.427	C	S	.	.	P	Polyproline II helix	trans	-64.4	141	167.6	-79.4	90.1	0	0	0	109.7	F138 E140 L147	L128-F138 HydrophobicContact CD1-CB 4.07Å; L128-F138 WeakPolarHBondContact CD1-O 3.18Å; L128-F138 PolarHBondContact N-O 3.3Å; L128-F138 VanDerWaalsContact N-O 3.15Å; L128-E140 HydrophobicContact CD1-CB 4.11Å; L128-E140 HydrophobicContact CD1-CG 4.08Å; L128-L147 HydrophobicContact CD1-CD2 3.65Å; L128-L147 HydrophobicContact CD2-CD2 4.49Å
129	D	56	Low	62.6	Low	93 Å²	93	79.5 Å²	79.5	50%	0.497	43%	0.43	S	S	.	.	P	Polyproline II helix	trans	-55.2	136.9	-179.7	-75.1	-38.8	0	0	0	110.5	T131 T132	D129-T131 WeakPolarHBondContact CB-OG1 3.47Å; D129-T131 PolarHBondContact O-N 3.38Å; D129-T132 PolarHBondContact O-N 3.06Å; D129-T132 PolarHBondContact O-OG1 3.4Å
130	P	53.5	Low	62.6	Low	91 Å²	91	76 Å²	76	59%	0.591	41%	0.409	S	S	*	.	T	Hydrogen-bonded Turn	trans	-63.9	-5.5	-179.8	25.9	-34.5	0	0	0	113.6
131	T	49.2	Very low	62.8	Low	60 Å²	60	68.6 Å²	68.6	37%	0.368	38%	0.376	S	S	.	.	T	Hydrogen-bonded Turn	trans	-78.7	-20.7	172.1	49	0	0	0	0	114.5	D129	D129-T131 WeakPolarHBondContact CB-OG1 3.47Å; D129-T131 PolarHBondContact O-N 3.38Å
132	T	51.5	Low	62.5	Low	54 Å²	54	71.8 Å²	71.8	33%	0.331	39%	0.387	S	S	.	.	S	Bend	trans	-93.9	-10.7	-176.6	17.6	0	0	0	0	114	D129	D129-T132 PolarHBondContact O-N 3.06Å; D129-T132 PolarHBondContact O-OG1 3.4Å
133	S	39.2	Very low	62.6	Low	50 Å²	50	73.4 Å²	73.4	35%	0.35	40%	0.396	S	S	.	.			trans	-157	136.2	178.4	-75.5	0	0	0	0	110.9	I135	S133-I135 PolarHBondContact O-N 3.43Å
134	Y	46.3	Very low	62.6	Low	239 Å²	239	75 Å²	75	94%	0.937	40%	0.404	S	S	*	.	S	Bend	trans	-70	12.1	169.8	-143.9	-93.2	0	0	0	112.8
135	I	48.8	Very low	62.3	Low	87 Å²	87	80.7 Å²	80.7	45%	0.446	43%	0.426	S	S	.	.			trans	-132.8	92.1	-172.5	-57.4	174.4	0	0	0	106.1	S133 R137 F138	S133-I135 PolarHBondContact O-N 3.43Å; I135-R137 HydrophobicContact CG2-CB 3.96Å; I135-R137 HydrophobicContact CG2-CG 3.99Å; I135-R137 PolarHBondContact O-N 2.86Å; I135-F138 HydrophobicContact CB-CE2 4.1Å; I135-F138 HydrophobicContact CG2-CD2 4.27Å; I135-F138 HydrophobicContact CG2-CE2 3.69Å; I135-F138 HydrophobicContact CG2-CZ 4.36Å
136	S	52.9	Low	62	Low	84 Å²	84	83.1 Å²	83.1	59%	0.587	44%	0.437	S	S	*	.	T	Hydrogen-bonded Turn	trans	-76	42	-179.2	66.4	0	0	0	0	112.9
137	R	59.3	Low	62	Low	110 Å²	110	83.2 Å²	83.2	42%	0.415	44%	0.441	S	S	.	.	T	Hydrogen-bonded Turn	trans	-113.8	-7.7	-174.5	-64.7	-175.1	176.4	150.1	-4.7	114.1	I135 E149 L150	I135-R137 HydrophobicContact CG2-CB 3.96Å; I135-R137 HydrophobicContact CG2-CG 3.99Å; I135-R137 PolarHBondContact O-N 2.86Å; R137-E149 HydrophobicContact CB-CG 4.05Å; R137-E149 IonicContact NH1-OE1 3.26Å; R137-E149 CarbonylContact O-C 3.6Å; R137-E149 WeakPolarHBondContact O-CA 3.28Å; R137-L150 HydrophobicContact CB-CB 4.49Å; R137-L150 WeakPolarHBondContact O-CD1 3.45Å; R137-L150 PolarHBondContact O-N 2.84Å
138	F	66.9	Low	62.1	Low	69 Å²	69	82.2 Å²	82.2	30%	0.303	43%	0.426	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-97.5	132.8	-173	-60.6	-67.3	0	0	0	112.4	L128 I135 L147 Y148 E149	L128-F138 HydrophobicContact CD1-CB 4.07Å; L128-F138 WeakPolarHBondContact CD1-O 3.18Å; L128-F138 PolarHBondContact N-O 3.3Å; L128-F138 VanDerWaalsContact N-O 3.15Å; I135-F138 HydrophobicContact CB-CE2 4.1Å; I135-F138 HydrophobicContact CG2-CD2 4.27Å; I135-F138 HydrophobicContact CG2-CE2 3.69Å; I135-F138 HydrophobicContact CG2-CZ 4.36Å; F138-L147 HydrophobicContact CB-CD2 3.99Å; F138-Y148 CarbonylContact C-O 3.48Å; F138-Y148 VanDerWaalsContact CA-O 3.29Å; F138-Y148 WeakPolarHBondContact CA-O 3.45Å; F138-E149 HydrophobicContact CD1-CB 4.18Å; F138-E149 HydrophobicContact CD1-CG 4.44Å; F138-E149 HydrophobicContact CE1-CB 3.89Å; F138-E149 HydrophobicContact CE1-CG 3.95Å
139	M	69.7	Low	62.1	Low	18 Å²	18	85.4 Å²	85.4	9%	0.089	44%	0.44	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-122.6	149.7	173.8	-52.9	-80.6	-67.5	0	0	110.5	L125 K126 S127 L147 Y148 L150	L125-M139 HydrophobicContact CB-CB 4.18Å; L125-M139 HydrophobicContact CB-CE 3.85Å; L125-M139 HydrophobicContact CD1-CB 4.42Å; K126-M139 CarbonylContact O-C 3.53Å; K126-M139 WeakPolarHBondContact O-CA 3.49Å; K126-M139 WeakPolarHBondContact O-CB 3.43Å; S127-M139 WeakPolarHBondContact CA-SD 3.36Å; M139-L147 CarbonylContact O-C 3.5Å; M139-L147 VanDerWaalsContact O-CA 3.29Å; M139-L147 WeakPolarHBondContact O-CA 3.38Å; M139-Y148 PolarHBondContact N-O 2.84Å; M139-Y148 PolarHBondContact O-N 3.13Å; M139-L150 HydrophobicContact CG-CD1 3.31Å; M139-L150 HydrophobicContact SD-CD1 4.13Å
140	E	75.4	Confident	62.2	Low	78 Å²	78	82.3 Å²	82.3	36%	0.364	42%	0.423	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-121.1	140.3	179.2	57	-176.2	-158.8	0	0	112.2	L125 K126 L128	L125-E140 CarbonylContact C-O 3.5Å; L125-E140 WeakPolarHBondContact CA-O 3.42Å; K126-E140 HydrophobicContact CB-CG 4.22Å; K126-E140 PolarHBondContact N-O 3.26Å; K126-E140 PolarHBondContact O-N 3.28Å; L128-E140 HydrophobicContact CD1-CB 4.11Å; L128-E140 HydrophobicContact CD1-CG 4.08Å
141	C	74.9	Confident	62.3	Low	1 Å²	1	83.8 Å²	83.8	1%	0.007	43%	0.431	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-82	123.4	165.8	163.8	0	0	0	0	110.1	C118 C121 L125 A143 C144 E145 Q146	C118-C141 HydrophobicContact CB-CB 3.78Å; C121-C141 WeakPolarHBondContact CB-SG 3.5Å; C121-C141 WeakPolarHBondContact SG-CB 3.27Å; C121-C141 CovalentContact SG-SG 2.06Å; C121-C141 PolarHBondContact SG-SG 2.68Å; L125-C141 HydrophobicContact CD2-CB 3.82Å; C141-A143 PolarHBondContact O-N 3.29Å; C141-A143 VanDerWaalsContact O-N 3.16Å; C141-A143 PolarHBondContact SG-N 2.81Å; C141-C144 PolarHBondContact O-N 2.88Å; C141-C144 PolarHBondContact SG-N 3.37Å; C141-C144 VanDerWaalsContact SG-SG 3.62Å; C141-E145 WeakPolarHBondContact O-CA 3.28Å; C141-E145 PolarHBondContact O-N 3.31Å; C141-Q146 PolarHBondContact N-O 3.42Å
142	E	72.5	Confident	62.3	Low	110 Å²	110	85.5 Å²	85.5	51%	0.514	44%	0.437	S	S	.	.	T	Hydrogen-bonded Turn	trans	-58.9	-27.5	176.2	-65.1	-167.9	103.8	0	0	114.4	K126	K126-E142 HydrophobicContact CD-CG 3.87Å; K126-E142 WeakPolarHBondContact CE-OE1 3.15Å; K126-E142 HydrophobicContact CG-CG 4.31Å; K126-E142 IonicContact NZ-OE1 3.93Å; K126-E142 PolarHBondContact NZ-OE1 3.41Å; K126-E142 IonicContact NZ-OE2 3.71Å
143	A	73.7	Confident	62.2	Low	78 Å²	78	91 Å²	91	65%	0.645	46%	0.457	S	S	*	.	T	Hydrogen-bonded Turn	trans	-97.3	-8.4	-174.8	0	0	0	0	0	114.8	C121 C141	C121-A143 HydrophobicContact CB-CB 4.16Å; C141-A143 PolarHBondContact O-N 3.29Å; C141-A143 VanDerWaalsContact O-N 3.16Å; C141-A143 PolarHBondContact SG-N 2.81Å
144	C	75.6	Confident	62.6	Low	50 Å²	50	95.6 Å²	95.6	34%	0.338	48%	0.478	S	S	.	.	T	Hydrogen-bonded Turn	trans	-148.6	10.5	179.7	82	0	0	0	0	115.1	C121 C141 Q146	C121-C144 HydrophobicContact CB-CB 3.95Å; C141-C144 PolarHBondContact O-N 2.88Å; C141-C144 PolarHBondContact SG-N 3.37Å; C141-C144 VanDerWaalsContact SG-SG 3.62Å; C144-Q146 PolarHBondContact O-N 3.14Å
145	E	70.5	Confident	62.3	Low	174 Å²	174	89.4 Å²	89.4	81%	0.813	46%	0.46	S	S	*	.			trans	53.4	19	172.9	-58.7	180	165.8	0	0	114.9	C141 L147	C141-E145 WeakPolarHBondContact O-CA 3.28Å; C141-E145 PolarHBondContact O-N 3.31Å; E145-L147 PolarHBondContact O-N 2.87Å
146	Q	66.2	Low	62	Low	75 Å²	75	89.6 Å²	89.6	35%	0.35	46%	0.462	S	S	.	.			trans	-81.8	121.8	-176.5	-170.7	77.8	68.9	0	0	109.8	C141 C144 Y148	C141-Q146 PolarHBondContact N-O 3.42Å; C144-Q146 PolarHBondContact O-N 3.14Å; Q146-Y148 HydrophobicContact CB-CE2 4.11Å; Q146-Y148 HydrophobicContact CG-CE2 3.99Å; Q146-Y148 WeakPolarHBondContact O-CD2 3.49Å
147	L	71.7	Confident	61.2	Low	102 Å²	102	89.8 Å²	89.8	53%	0.534	46%	0.461	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-75.9	140.4	172.1	-80.5	150.4	0	0	0	112.1	L128 F138 M139 E145	L128-L147 HydrophobicContact CD1-CD2 3.65Å; L128-L147 HydrophobicContact CD2-CD2 4.49Å; F138-L147 HydrophobicContact CB-CD2 3.99Å; M139-L147 CarbonylContact O-C 3.5Å; M139-L147 VanDerWaalsContact O-CA 3.29Å; M139-L147 WeakPolarHBondContact O-CA 3.38Å; E145-L147 PolarHBondContact O-N 2.87Å
148	Y	67.4	Low	59.7	Low	57 Å²	57	88.3 Å²	88.3	22%	0.224	47%	0.468	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-127.6	136.3	176.3	-71.7	-93.5	0	0	0	109.9	C118 N119 L125 F138 M139 Q146	C118-Y148 HydrophobicContact CB-CE2 4.33Å; C118-Y148 PolarHBondContact SG-OH 2.9Å; N119-Y148 PolarHBondContact N-OH 3.26Å; L125-Y148 HydrophobicContact CD1-CD2 3.99Å; L125-Y148 HydrophobicContact CD1-CE2 4.37Å; L125-Y148 HydrophobicContact CD1-CG 4.19Å; L125-Y148 HydrophobicContact CD2-CD2 3.69Å; L125-Y148 HydrophobicContact CD2-CE2 3.71Å; F138-Y148 CarbonylContact C-O 3.48Å; F138-Y148 VanDerWaalsContact CA-O 3.29Å; F138-Y148 WeakPolarHBondContact CA-O 3.45Å; M139-Y148 PolarHBondContact N-O 2.84Å; M139-Y148 PolarHBondContact O-N 3.13Å; Q146-Y148 HydrophobicContact CB-CE2 4.11Å; Q146-Y148 HydrophobicContact CG-CE2 3.99Å; Q146-Y148 WeakPolarHBondContact O-CD2 3.49Å
149	E	61.8	Low	58	Low	113 Å²	113	93.7 Å²	93.7	53%	0.528	49%	0.491	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-97.4	128	171.2	-171.4	177	-176.6	0	0	110.9	R137 F138 T151	R137-E149 HydrophobicContact CB-CG 4.05Å; R137-E149 IonicContact NH1-OE1 3.26Å; R137-E149 CarbonylContact O-C 3.6Å; R137-E149 WeakPolarHBondContact O-CA 3.28Å; F138-E149 HydrophobicContact CD1-CB 4.18Å; F138-E149 HydrophobicContact CD1-CG 4.44Å; F138-E149 HydrophobicContact CE1-CB 3.89Å; F138-E149 HydrophobicContact CE1-CG 3.95Å; E149-T151 PolarHBondContact O-N 3.31Å
150	L	59.5	Low	56.1	Low	29 Å²	29	96.7 Å²	96.7	15%	0.152	51%	0.514	C	S	.	.			trans	-74.7	109	169	-88.3	76.6	0	0	0	110.2	R137 M139 L156	R137-L150 HydrophobicContact CB-CB 4.49Å; R137-L150 WeakPolarHBondContact O-CD1 3.45Å; R137-L150 PolarHBondContact O-N 2.84Å; M139-L150 HydrophobicContact CG-CD1 3.31Å; M139-L150 HydrophobicContact SD-CD1 4.13Å; L150-L156 HydrophobicContact CD2-CD1 3.93Å
151	T	54.9	Low	53.8	Low	122 Å²	122	100 Å²	100	75%	0.748	53%	0.534	S	S	*	.			trans	-70.3	-31.4	172.2	47.9	0	0	0	0	112.8	E149	E149-T151 PolarHBondContact O-N 3.31Å
152	D	50	Low	52.1	Low	95 Å²	95	104.6 Å²	104.6	51%	0.508	56%	0.562	S	S	.	*			trans	-116.1	129.4	-173.6	-76	-68.8	0	0	0	113.8	N154	D152-N154 PolarHBondContact O-N 3.18Å
153	K	49.3	Very low	50	Low	169 Å²	169	105.3 Å²	105.3	74%	0.735	57%	0.57	S	S	*	*	T	Hydrogen-bonded Turn	trans	-71.6	-7.8	-178.4	-67.8	-176	177	-176.7	0	114.4
154	N	47.5	Very low	48.2	Very low	148 Å²	148	111 Å²	111	79%	0.791	58%	0.583	S	S	*	*	T	Hydrogen-bonded Turn	trans	-90.1	-13.4	-176.3	-66.5	-12.9	0	0	0	112.8	D152	D152-N154 PolarHBondContact O-N 3.18Å
155	D	40.3	Very low	46.1	Very low	108 Å²	108	113 Å²	113	58%	0.578	60%	0.598	S	S	*	*			trans	-102.5	13.7	-178.7	-65.3	-34.8	0	0	0	113.4	P157	D155-P157 WeakPolarHBondContact O-CD 3.45Å
156	L	42.4	Very low	44.4	Very low	91 Å²	91	115.3 Å²	115.3	48%	0.476	60%	0.599	S	S	.	*	S	Bend	trans	-61.7	125.3	156.9	-93.2	80.9	0	0	0	106.8	L150 S158	L150-L156 HydrophobicContact CD2-CD1 3.93Å; L156-S158 PolarHBondContact O-N 3.32Å
157	P	35.9	Very low	43.1	Very low	89 Å²	89	116.6 Å²	116.6	58%	0.578	61%	0.613	S	S	*	*	P	Polyproline II helix	trans	-57.3	122.8	168.9	24.9	-32.1	0	0	0	107.3	D155 F159	D155-P157 WeakPolarHBondContact O-CD 3.45Å; P157-F159 PolarHBondContact O-N 3.26Å
158	S	27.6	Very low	42.1	Very low	78 Å²	78	114.2 Å²	114.2	55%	0.545	60%	0.601	S	S	.	*	P	Polyproline II helix	trans	-50.6	137.4	158.4	40.1	0	0	0	0	107.3	L156 S160	L156-S158 PolarHBondContact O-N 3.32Å; S158-S160 PolarHBondContact O-N 2.97Å; S158-S160 PolarHBondContact O-OG 3.38Å; S158-S160 PolarHBondContact OG-OG 2.72Å
159	F	32	Very low	41.3	Very low	183 Å²	183	115.9 Å²	115.9	80%	0.803	62%	0.621	S	S	*	*			trans	-69.7	65.8	166.6	-83.5	-92.8	0	0	0	108.7	P157	P157-F159 PolarHBondContact O-N 3.26Å
160	S	29.1	Very low	41.2	Very low	80 Å²	80	114 Å²	114	56%	0.559	61%	0.614	S	S	*	*			trans	-110.3	56.7	-179.9	54.7	0	0	0	0	108.4	S158	S158-S160 PolarHBondContact O-N 2.97Å; S158-S160 PolarHBondContact O-OG 3.38Å; S158-S160 PolarHBondContact OG-OG 2.72Å
161	N	27.8	Very low	42.1	Very low	147 Å²	147	114.6 Å²	114.6	79%	0.786	62%	0.617	S	S	*	*			trans	-169.2	79.5	152.9	-88.7	-24.4	0	0	0	105	D163	N161-D163 PolarHBondContact O-N 3.36Å
162	V	37.8	Very low	43.7	Very low	99 Å²	99	110.6 Å²	110.6	60%	0.6	59%	0.594	S	S	*	*			trans	-64	114.9	153.2	-173.6	0	0	0	0	103.9	E164 L389	V162-E164 VanDerWaalsContact C-N 3.29Å; V162-E164 PolarHBondContact O-N 3.01Å; V162-L389 HydrophobicContact CG2-CD1 4.37Å
163	D	28.2	Very low	45.7	Very low	125 Å²	125	107.9 Å²	107.9	67%	0.668	58%	0.582	S	S	*	*			trans	-61.3	96.9	174.1	-90.3	-35.4	0	0	0	107.9	N161 S165 R166	N161-D163 PolarHBondContact O-N 3.36Å; D163-S165 PolarHBondContact O-N 3.05Å; D163-R166 PolarHBondContact O-N 3.41Å
164	E	36.4	Very low	47.8	Very low	197 Å²	197	107.5 Å²	107.5	92%	0.921	58%	0.58	S	S	*	*	T	Hydrogen-bonded Turn	trans	-68.2	16.9	-176	-145.3	-174.9	171.2	0	0	112.8	V162	V162-E164 VanDerWaalsContact C-N 3.29Å; V162-E164 PolarHBondContact O-N 3.01Å
165	S	32.5	Very low	50	Low	93 Å²	93	104.8 Å²	104.8	65%	0.65	56%	0.563	S	S	*	*	T	Hydrogen-bonded Turn	trans	-128.4	2.1	-170.5	62.3	0	0	0	0	113.8	D163 P167	D163-S165 PolarHBondContact O-N 3.05Å; S165-P167 VanDerWaalsContact C-CD 3.48Å; S165-P167 WeakPolarHBondContact O-CD 3.5Å
166	R	35	Very low	52.5	Low	222 Å²	222	99.8 Å²	99.8	84%	0.838	54%	0.536	S	S	*	.			trans	-96	92.8	152.7	-79.8	-169.2	179.1	-176.3	1.9	109.2	D163 L168	D163-R166 PolarHBondContact O-N 3.41Å; R166-L168 PolarHBondContact O-N 3.34Å
167	P	38.4	Very low	55	Low	101 Å²	101	97.7 Å²	97.7	66%	0.656	52%	0.523	S	S	*	.			trans	-51.5	144.3	150.8	27.2	-34.2	0	0	0	107.3	S165 S169	S165-P167 VanDerWaalsContact C-CD 3.48Å; S165-P167 WeakPolarHBondContact O-CD 3.5Å; P167-S169 PolarHBondContact O-N 3.43Å
168	L	50.9	Low	57.7	Low	52 Å²	52	99 Å²	99	27%	0.272	52%	0.522	S	S	.	.			trans	-59.5	86.7	172	-85.4	154.7	0	0	0	108.4	R166 L170 Y202 Q206	R166-L168 PolarHBondContact O-N 3.34Å; L168-L170 PolarHBondContact O-N 3.13Å; L168-Y202 HydrophobicContact CD1-CD1 3.69Å; L168-Y202 HydrophobicContact CD1-CE1 4.08Å; L168-Y202 HydrophobicContact CD1-CG 4.39Å; L168-Q206 PolarHBondContact O-NE2 3.03Å
169	S	49.9	Very low	60.8	Low	93 Å²	93	97.3 Å²	97.3	65%	0.65	50%	0.504	S	S	*	.			trans	-75.7	71.9	-177.4	61.2	0	0	0	0	107.7	P167 L171	P167-S169 PolarHBondContact O-N 3.43Å; S169-L171 PolarHBondContact O-N 3.11Å
170	L	59.4	Low	63.8	Low	74 Å²	74	88.6 Å²	88.6	39%	0.387	47%	0.466	S	S	.	.			trans	9.7	77.1	180	-60.1	-172.3	0	0	0	114.1	L168 S172 Y199 N203	L168-L170 PolarHBondContact O-N 3.13Å; L170-S172 PolarHBondContact O-N 3.27Å; L170-S172 VanDerWaalsContact O-N 3.16Å; L170-Y199 HydrophobicContact CB-CE2 4Å; L170-N203 WeakPolarHBondContact CD1-OD1 3.45Å; L170-N203 WeakPolarHBondContact CD2-OD1 3.47Å
171	L	78.8	Confident	66.8	Low	41 Å²	41	88.5 Å²	88.5	22%	0.215	46%	0.459	C	S	.	.			trans	-48.3	122	172.6	-84.6	60.5	0	0	0	108.3	S169 I176 Y199 Y349 L350	S169-L171 PolarHBondContact O-N 3.11Å; L171-I176 HydrophobicContact CB-CD1 4.3Å; L171-I176 HydrophobicContact CB-CG1 4.15Å; L171-Y199 WeakPolarHBondContact O-CD2 3.48Å; L171-Y349 HydrophobicContact CD2-CD1 4.03Å; L171-Y349 HydrophobicContact CD2-CE1 3.51Å; L171-Y349 HydrophobicContact CG-CE1 4.48Å; L171-L350 HydrophobicContact CD2-CD2 4.31Å
172	S	88.7	Confident	69.9	Low	37 Å²	37	87.4 Å²	87.4	26%	0.259	44%	0.444	S	S	.	.			trans	-66.3	147.5	-178.7	70.9	0	0	0	0	110	L170 K174 E175 I176	L170-S172 PolarHBondContact O-N 3.27Å; L170-S172 VanDerWaalsContact O-N 3.16Å; S172-K174 PolarHBondContact O-N 2.92Å; S172-E175 WeakPolarHBondContact CB-OE2 3.38Å; S172-E175 PolarHBondContact N-OE2 2.93Å; S172-E175 PolarHBondContact O-N 3.46Å; S172-E175 VanDerWaalsContact OG-CD 3.26Å; S172-E175 WeakPolarHBondContact OG-CG 3.37Å; S172-E175 PolarHBondContact OG-N 3.34Å; S172-E175 PolarHBondContact OG-OE2 2.98Å; S172-I176 PolarHBondContact O-N 2.76Å; S172-I176 VanDerWaalsContact O-N 3.14Å
173	P	92.5	Very high	72.5	Confident	38 Å²	38	83.8 Å²	83.8	25%	0.247	42%	0.42	C	S	.	.	H	α-helix	trans	-55.5	-23	173.6	-27.9	35.3	0	0	0	113.5	H177 A195 V196 Y199	P173-H177 WeakPolarHBondContact O-CB 3.15Å; P173-H177 PolarHBondContact O-N 2.66Å; P173-A195 HydrophobicContact CB-CB 4.12Å; P173-A195 WeakPolarHBondContact O-CB 3.37Å; P173-V196 HydrophobicContact CB-CG2 4.27Å; P173-Y199 HydrophobicContact CG-CD1 4.05Å; P173-Y199 HydrophobicContact CG-CD2 4.19Å; P173-Y199 HydrophobicContact CG-CG 3.79Å
174	K	93.7	Very high	75.6	Confident	161 Å²	161	78.1 Å²	78.1	70%	0.7	39%	0.389	S	S	*	.	H	α-helix	trans	-71.8	-42.1	175.1	-65.2	-176.3	-180	-179.9	0	112.2	S172 H177 Q178	S172-K174 PolarHBondContact O-N 2.92Å; K174-H177 PolarHBondContact O-N 3.47Å; K174-Q178 WeakPolarHBondContact O-CB 3.2Å; K174-Q178 VanDerWaalsContact O-CG 3.28Å; K174-Q178 WeakPolarHBondContact O-CG 3.09Å; K174-Q178 PolarHBondContact O-N 3.2Å
175	E	93.2	Very high	78.2	Confident	92 Å²	92	69.2 Å²	69.2	43%	0.43	35%	0.348	S	S	.	.	H	α-helix	trans	-67.8	-41.4	176.9	-71.1	156.8	133.7	0	0	111.2	S172 H177 Q178 Y179	S172-E175 WeakPolarHBondContact CB-OE2 3.38Å; S172-E175 PolarHBondContact N-OE2 2.93Å; S172-E175 PolarHBondContact O-N 3.46Å; S172-E175 VanDerWaalsContact OG-CD 3.26Å; S172-E175 WeakPolarHBondContact OG-CG 3.37Å; S172-E175 PolarHBondContact OG-N 3.34Å; S172-E175 PolarHBondContact OG-OE2 2.98Å; E175-H177 PolarHBondContact O-N 3.46Å; E175-Q178 PolarHBondContact O-N 2.77Å; E175-Y179 PolarHBondContact O-N 2.77Å
176	I	92.9	Very high	81	Confident	2 Å²	2	65 Å²	65	1%	0.01	32%	0.32	C	S	.	.	H	α-helix	trans	-58	-48.3	172.4	-59	169	0	0	0	110.2	L171 S172 Q178 Y179 L180 A195 V198 L346 Y349	L171-I176 HydrophobicContact CB-CD1 4.3Å; L171-I176 HydrophobicContact CB-CG1 4.15Å; S172-I176 PolarHBondContact O-N 2.76Å; S172-I176 VanDerWaalsContact O-N 3.14Å; I176-Q178 PolarHBondContact O-N 2.8Å; I176-Y179 PolarHBondContact O-N 2.92Å; I176-L180 HydrophobicContact CG2-CD1 4.11Å; I176-L180 HydrophobicContact CG2-CG 4.46Å; I176-L180 WeakPolarHBondContact O-CG 3.4Å; I176-L180 PolarHBondContact O-N 3.37Å; I176-A195 HydrophobicContact CB-CB 3.9Å; I176-A195 HydrophobicContact CG2-CB 3.8Å; I176-V198 HydrophobicContact CD1-CG1 4.19Å; I176-L346 HydrophobicContact CG2-CD1 3.81Å; I176-Y349 HydrophobicContact CB-CE1 4.25Å; I176-Y349 HydrophobicContact CG1-CD1 4.23Å; I176-Y349 HydrophobicContact CG1-CE1 3.86Å; I176-Y349 HydrophobicContact CG2-CD1 4.5Å
177	H	94.2	Very high	83.8	Confident	47 Å²	47	54.6 Å²	54.6	22%	0.218	28%	0.281	C	S	.	.	H	α-helix	trans	-59.4	-46.5	176.6	-171.4	-71	0	0	0	112.5	P173 K174 E175 Y179 L180 D181 D188	P173-H177 WeakPolarHBondContact O-CB 3.15Å; P173-H177 PolarHBondContact O-N 2.66Å; K174-H177 PolarHBondContact O-N 3.47Å; E175-H177 PolarHBondContact O-N 3.46Å; H177-Y179 VanDerWaalsContact C-N 3.28Å; H177-Y179 PolarHBondContact O-N 2.88Å; H177-L180 PolarHBondContact O-N 3.31Å; H177-D181 WeakPolarHBondContact O-CB 3.05Å; H177-D181 PolarHBondContact O-N 3.28Å; H177-D188 IonicContact CE1-OD1 3.25Å; H177-D188 IonicContact NE2-OD1 3.8Å
178	Q	93.5	Very high	86.4	Confident	117 Å²	117	53.7 Å²	53.7	55%	0.547	27%	0.27	S	S	.	.	H	α-helix	trans	-64.8	-28.2	178.5	-74.9	174.7	8.4	0	0	113.6	K174 E175 I176 R182	K174-Q178 WeakPolarHBondContact O-CB 3.2Å; K174-Q178 VanDerWaalsContact O-CG 3.28Å; K174-Q178 WeakPolarHBondContact O-CG 3.09Å; K174-Q178 PolarHBondContact O-N 3.2Å; E175-Q178 PolarHBondContact O-N 2.77Å; I176-Q178 PolarHBondContact O-N 2.8Å; Q178-R182 WeakPolarHBondContact O-CG 3.19Å; Q178-R182 PolarHBondContact O-NE 3.1Å
179	Y	93	Very high	88.4	Confident	42 Å²	42	56.2 Å²	56.2	17%	0.165	28%	0.279	C	S	.	.	H	α-helix	trans	-73.9	-48.4	173.1	-175.8	-89.5	0	0	0	111.1	E175 I176 H177 D181 R182 Y183 T345 Y349	E175-Y179 PolarHBondContact O-N 2.77Å; I176-Y179 PolarHBondContact O-N 2.92Å; H177-Y179 VanDerWaalsContact C-N 3.28Å; H177-Y179 PolarHBondContact O-N 2.88Å; Y179-D181 PolarHBondContact O-N 3.44Å; Y179-R182 WeakPolarHBondContact O-CB 3.38Å; Y179-R182 PolarHBondContact O-N 2.92Å; Y179-R182 VanDerWaalsContact O-N 3.13Å; Y179-Y183 HydrophobicContact CD1-CE2 4.42Å; Y179-Y183 HydrophobicContact CE1-CD2 4.16Å; Y179-Y183 AromaticContact CE1-CE2 3.8Å; Y179-Y183 HydrophobicContact CE1-CE2 3.8Å; Y179-Y183 HydrophobicContact CE2-CE2 4.1Å; Y179-Y183 AromaticContact CZ-CE2 3.63Å; Y179-T345 HydrophobicContact CD1-CG2 3.98Å; Y179-T345 HydrophobicContact CE1-CG2 3.61Å; Y179-Y349 HydrophobicContact CD1-CD1 4.15Å; Y179-Y349 AromaticContact CD1-CD2 3.7Å; Y179-Y349 HydrophobicContact CD1-CD2 3.7Å; Y179-Y349 HydrophobicContact CD1-CE2 4.49Å; Y179-Y349 AromaticContact CD1-CG 3.52Å; Y179-Y349 HydrophobicContact CD1-CG 3.52Å; Y179-Y349 AromaticContact CD2-CD2 3.31Å; Y179-Y349 HydrophobicContact CD2-CD2 3.31Å; Y179-Y349 AromaticContact CD2-CE2 3.53Å; Y179-Y349 HydrophobicContact CD2-CE2 3.53Å; Y179-Y349 HydrophobicContact CD2-CG 4.03Å; Y179-Y349 AromaticContact CE1-CD2 3.96Å; Y179-Y349 HydrophobicContact CE1-CD2 3.96Å; Y179-Y349 AromaticContact CE1-CG 3.91Å; Y179-Y349 HydrophobicContact CE1-CG 3.91Å; Y179-Y349 AromaticContact CE2-CD2 3.59Å; Y179-Y349 HydrophobicContact CE2-CD2 3.59Å; Y179-Y349 HydrophobicContact CE2-CE2 4.14Å; Y179-Y349 HydrophobicContact CE2-CG 4.37Å; Y179-Y349 HydrophobicContact CG-CD1 4.07Å; Y179-Y349 AromaticContact CG-CD2 3.35Å; Y179-Y349 HydrophobicContact CG-CD2 3.35Å; Y179-Y349 HydrophobicContact CG-CE1 4.36Å; Y179-Y349 AromaticContact CG-CE2 3.72Å; Y179-Y349 HydrophobicContact CG-CE2 3.72Å; Y179-Y349 AromaticContact CG-CG 3.57Å; Y179-Y349 HydrophobicContact CG-CG 3.57Å; Y179-Y349 AromaticContact CZ-CD2 3.9Å
180	L	93.3	Very high	90.5	Very high	0 Å²	0	51.9 Å²	51.9	0%	0	25%	0.249	C	C	.	.	H	α-helix	trans	-57.3	-37.9	178.2	-67.3	174.3	0	0	0	112	I176 H177 R182 Y183 V184 K191 L342 T345 L346	I176-L180 HydrophobicContact CG2-CD1 4.11Å; I176-L180 HydrophobicContact CG2-CG 4.46Å; I176-L180 WeakPolarHBondContact O-CG 3.4Å; I176-L180 PolarHBondContact O-N 3.37Å; H177-L180 PolarHBondContact O-N 3.31Å; L180-R182 PolarHBondContact O-N 3.48Å; L180-R182 VanDerWaalsContact O-N 3.15Å; L180-Y183 PolarHBondContact O-N 3.16Å; L180-Y183 VanDerWaalsContact O-N 3.11Å; L180-V184 PolarHBondContact O-N 2.82Å; L180-K191 HydrophobicContact CB-CD 4.08Å; L180-K191 HydrophobicContact CB-CG 4.22Å; L180-K191 HydrophobicContact CD1-CB 4.34Å; L180-K191 HydrophobicContact CD1-CG 4.36Å; L180-L342 HydrophobicContact CD1-CD1 4.15Å; L180-L342 HydrophobicContact CD2-CD1 4.12Å; L180-L342 HydrophobicContact CG-CD1 4.5Å; L180-T345 HydrophobicContact CD2-CG2 3.89Å; L180-L346 HydrophobicContact CD2-CB 4.1Å
181	D	93.5	Very high	92.2	Very high	78 Å²	78	48.3 Å²	48.3	42%	0.417	23%	0.23	S	C	.	.	T	Hydrogen-bonded Turn	trans	-59.3	-23.5	179.2	-151.6	46.3	0	0	0	114.3	H177 Y179 Y183 K191	H177-D181 WeakPolarHBondContact O-CB 3.05Å; H177-D181 PolarHBondContact O-N 3.28Å; Y179-D181 PolarHBondContact O-N 3.44Å; D181-Y183 VanDerWaalsContact C-N 3.28Å; D181-Y183 PolarHBondContact O-N 2.84Å; D181-K191 IonicContact OD1-NZ 3.6Å; D181-K191 PolarHBondContact OD1-NZ 3.17Å
182	R	92.3	Very high	93	Very high	125 Å²	125	53.2 Å²	53.2	47%	0.472	25%	0.25	S	C	.	.	T	Hydrogen-bonded Turn	trans	-76.6	-13.6	179.1	-58.8	170.3	-172.2	-174.9	-0.5	113.8	Q178 Y179 L180 P573 R574	Q178-R182 WeakPolarHBondContact O-CG 3.19Å; Q178-R182 PolarHBondContact O-NE 3.1Å; Y179-R182 WeakPolarHBondContact O-CB 3.38Å; Y179-R182 PolarHBondContact O-N 2.92Å; Y179-R182 VanDerWaalsContact O-N 3.13Å; L180-R182 PolarHBondContact O-N 3.48Å; L180-R182 VanDerWaalsContact O-N 3.15Å; R182-P573 WeakPolarHBondContact O-CA 3.28Å; R182-R574 PolarHBondContact O-N 3.35Å
183	Y	92.4	Very high	93.3	Very high	23 Å²	23	53.7 Å²	53.7	9%	0.09	25%	0.249	C	C	.	.	T	Hydrogen-bonded Turn	trans	-126.8	-32.6	-174.4	-62.5	-91.5	0	0	0	112.4	Y179 L180 D181 T345 R574	Y179-Y183 HydrophobicContact CD1-CE2 4.42Å; Y179-Y183 HydrophobicContact CE1-CD2 4.16Å; Y179-Y183 AromaticContact CE1-CE2 3.8Å; Y179-Y183 HydrophobicContact CE1-CE2 3.8Å; Y179-Y183 HydrophobicContact CE2-CE2 4.1Å; Y179-Y183 AromaticContact CZ-CE2 3.63Å; L180-Y183 PolarHBondContact O-N 3.16Å; L180-Y183 VanDerWaalsContact O-N 3.11Å; D181-Y183 VanDerWaalsContact C-N 3.28Å; D181-Y183 PolarHBondContact O-N 2.84Å; Y183-T345 HydrophobicContact CD2-CG2 3.6Å; Y183-T345 HydrophobicContact CE2-CG2 4.32Å; Y183-T345 HydrophobicContact CG-CG2 3.82Å; Y183-R574 HydrophobicContact CD1-CB 4.5Å; Y183-R574 HydrophobicContact CE1-CB 4.12Å
184	V	92.9	Very high	93.4	Very high	6 Å²	6	51.9 Å²	51.9	4%	0.036	24%	0.237	C	C	.	.	S	Bend	trans	-116.3	108.5	-179.1	-175.8	0	0	0	0	110.2	L180 Q187 L341 L342	L180-V184 PolarHBondContact O-N 2.82Å; V184-Q187 HydrophobicContact CG1-CG 4.42Å; V184-L341 HydrophobicContact CG2-CD2 4.23Å; V184-L341 HydrophobicContact CG2-CG 4.2Å; V184-L342 HydrophobicContact CB-CD1 4.27Å; V184-L342 HydrophobicContact CG1-CD1 4.26Å; V184-L342 HydrophobicContact CG2-CB 4.26Å; V184-L342 HydrophobicContact CG2-CD1 3.98Å
185	V	92.3	Very high	93.4	Very high	9 Å²	9	44.2 Å²	44.2	6%	0.055	20%	0.204	C	C	.	.			trans	-74.8	132.3	177.1	178.9	0	0	0	0	110.1	R568 V569 E572 P573	V185-R568 HydrophobicContact CG1-CB 3.65Å; V185-V569 HydrophobicContact CB-CG2 3.81Å; V185-V569 HydrophobicContact CG1-CG2 4.42Å; V185-V569 HydrophobicContact CG2-CG2 3.97Å; V185-E572 HydrophobicContact CG2-CB 4.45Å; V185-P573 HydrophobicContact CG2-CG 4.44Å
186	G	91.1	Very high	93.4	Very high	5 Å²	5	42.9 Å²	42.9	5%	0.052	20%	0.202	C	C	.	.	S	Bend	trans	69.1	-150	-178.9	0	0	0	0	0	112.8	D188 K191	G186-D188 VanDerWaalsContact C-N 3.29Å; G186-D188 PolarHBondContact O-N 3.02Å; G186-K191 WeakPolarHBondContact O-CE 3.43Å; G186-K191 PolarHBondContact O-NZ 2.98Å
187	Q	92.9	Very high	93.4	Very high	3 Å²	3	44.2 Å²	44.2	1%	0.014	21%	0.208	C	C	.	.			trans	60.2	30.6	178	-50.8	-64.6	-10.9	0	0	114.6	V184 K189 A190 K191 L558 H559	V184-Q187 HydrophobicContact CG1-CG 4.42Å; Q187-K189 VanDerWaalsContact C-N 3.31Å; Q187-K189 PolarHBondContact O-N 3.4Å; Q187-A190 HydrophobicContact CB-CB 4.45Å; Q187-A190 WeakPolarHBondContact O-CA 3.45Å; Q187-A190 PolarHBondContact O-N 3.32Å; Q187-K191 PolarHBondContact O-N 2.97Å; Q187-L558 HydrophobicContact CG-CD2 4.11Å; Q187-L558 HydrophobicContact CG-CG 4.27Å; Q187-L558 VanDerWaalsContact OE1-CB 3.23Å; Q187-H559 WeakPolarHBondContact CA-NE2 3.42Å; Q187-H559 VanDerWaalsContact CD-NE2 3.35Å; Q187-H559 PolarHBondContact N-NE2 2.94Å; Q187-H559 PolarHBondContact NE2-CE1 3.3Å; Q187-H559 VanDerWaalsContact NE2-CE1 3.33Å; Q187-H559 PolarHBondContact NE2-ND1 2.85Å; Q187-H559 PolarHBondContact NE2-O 3.45Å; Q187-H559 PolarHBondContact OE1-CD2 3.02Å; Q187-H559 PolarHBondContact OE1-NE2 3.45Å
188	D	93.6	Very high	93.2	Very high	83 Å²	83	42 Å²	42	44%	0.444	20%	0.198	S	C	.	.	H	α-helix	trans	-60.2	-35.2	-171.2	-54.1	-71.6	0	0	0	114	H177 G186 A190 K191 K192	H177-D188 IonicContact CE1-OD1 3.25Å; H177-D188 IonicContact NE2-OD1 3.8Å; G186-D188 VanDerWaalsContact C-N 3.29Å; G186-D188 PolarHBondContact O-N 3.02Å; D188-A190 VanDerWaalsContact C-N 3.34Å; D188-A190 PolarHBondContact O-N 3.29Å; D188-K191 WeakPolarHBondContact OD1-CE 3.06Å; D188-K191 IonicContact OD1-NZ 2.85Å; D188-K191 PolarHBondContact OD1-NZ 3.03Å; D188-K192 WeakPolarHBondContact O-CB 3.17Å; D188-K192 PolarHBondContact O-N 3.19Å
189	K	92.9	Very high	93.1	Very high	105 Å²	105	40.2 Å²	40.2	46%	0.457	19%	0.187	S	C	.	.	H	α-helix	trans	-58.7	-45.6	172.2	-169.3	-178.6	-174.4	-177.3	0	111	Q187 I193	Q187-K189 VanDerWaalsContact C-N 3.31Å; Q187-K189 PolarHBondContact O-N 3.4Å; K189-I193 HydrophobicContact CG-CD1 4.22Å; K189-I193 WeakPolarHBondContact O-CD1 3.45Å; K189-I193 VanDerWaalsContact O-CG1 3.29Å; K189-I193 WeakPolarHBondContact O-CG1 3.26Å; K189-I193 PolarHBondContact O-N 3.23Å; K189-I193 VanDerWaalsContact O-N 3.13Å
190	A	94.1	Very high	93	Very high	1 Å²	1	40.1 Å²	40.1	1%	0.008	20%	0.195	C	C	.	.	H	α-helix	trans	-72.7	-44.7	-179.9	0	0	0	0	0	112.4	Q187 D188 K192 I193 L194 L342 T556 L558	Q187-A190 HydrophobicContact CB-CB 4.45Å; Q187-A190 WeakPolarHBondContact O-CA 3.45Å; Q187-A190 PolarHBondContact O-N 3.32Å; D188-A190 VanDerWaalsContact C-N 3.34Å; D188-A190 PolarHBondContact O-N 3.29Å; A190-K192 VanDerWaalsContact C-N 3.3Å; A190-K192 PolarHBondContact O-N 2.93Å; A190-I193 PolarHBondContact O-N 2.89Å; A190-L194 WeakPolarHBondContact O-CB 3.42Å; A190-L194 WeakPolarHBondContact O-CG 3.31Å; A190-L194 PolarHBondContact O-N 3.23Å; A190-L342 HydrophobicContact CB-CD2 4.35Å; A190-T556 HydrophobicContact CB-CG2 3.66Å; A190-L558 HydrophobicContact CB-CD1 3.82Å; A190-L558 HydrophobicContact CB-CG 4.05Å
191	K	95.4	Very high	92.9	Very high	0 Å²	0	40.4 Å²	40.4	0%	0	20%	0.196	C	C	.	.	H	α-helix	trans	-55.6	-44.8	174	-69.2	-177.5	-54.8	-158.1	0	111.3	L180 D181 G186 Q187 D188 A195 L342	L180-K191 HydrophobicContact CB-CD 4.08Å; L180-K191 HydrophobicContact CB-CG 4.22Å; L180-K191 HydrophobicContact CD1-CB 4.34Å; L180-K191 HydrophobicContact CD1-CG 4.36Å; D181-K191 IonicContact OD1-NZ 3.6Å; D181-K191 PolarHBondContact OD1-NZ 3.17Å; G186-K191 WeakPolarHBondContact O-CE 3.43Å; G186-K191 PolarHBondContact O-NZ 2.98Å; Q187-K191 PolarHBondContact O-N 2.97Å; D188-K191 WeakPolarHBondContact OD1-CE 3.06Å; D188-K191 IonicContact OD1-NZ 2.85Å; D188-K191 PolarHBondContact OD1-NZ 3.03Å; K191-A195 VanDerWaalsContact O-CB 3.29Å; K191-A195 WeakPolarHBondContact O-CB 3.43Å; K191-A195 PolarHBondContact O-N 3.12Å; K191-L342 HydrophobicContact CG-CD1 4Å
192	K	95.1	Very high	92.7	Very high	144 Å²	144	37.2 Å²	37.2	63%	0.626	18%	0.178	S	C	*	.	H	α-helix	trans	-63.9	-45.8	178	-176.4	-179.7	178.5	-176.7	0	112.5	D188 A190 V196	D188-K192 WeakPolarHBondContact O-CB 3.17Å; D188-K192 PolarHBondContact O-N 3.19Å; A190-K192 VanDerWaalsContact C-N 3.3Å; A190-K192 PolarHBondContact O-N 2.93Å; K192-V196 WeakPolarHBondContact O-CG2 3.46Å; K192-V196 PolarHBondContact O-N 3.29Å
193	I	94.4	Very high	92.4	Very high	46 Å²	46	33.5 Å²	33.5	24%	0.236	17%	0.168	C	C	.	.	H	α-helix	trans	-64.4	-49.6	179.4	-66.6	164.6	0	0	0	110	K189 A190 A195 V196 Q197 I554 T556	K189-I193 HydrophobicContact CG-CD1 4.22Å; K189-I193 WeakPolarHBondContact O-CD1 3.45Å; K189-I193 VanDerWaalsContact O-CG1 3.29Å; K189-I193 WeakPolarHBondContact O-CG1 3.26Å; K189-I193 PolarHBondContact O-N 3.23Å; K189-I193 VanDerWaalsContact O-N 3.13Å; A190-I193 PolarHBondContact O-N 2.89Å; I193-A195 PolarHBondContact O-N 3.25Å; I193-V196 PolarHBondContact O-N 2.69Å; I193-V196 VanDerWaalsContact O-N 3.17Å; I193-Q197 HydrophobicContact CG2-CG 4.07Å; I193-Q197 WeakPolarHBondContact O-CG 3.37Å; I193-Q197 PolarHBondContact O-N 3.23Å; I193-I554 HydrophobicContact CG2-CG2 3.66Å; I193-T556 HydrophobicContact CD1-CG2 4.05Å; I193-T556 WeakPolarHBondContact CD1-OG1 3.49Å; I193-T556 WeakPolarHBondContact CG2-OG1 3.49Å
194	L	93.9	Very high	92.3	Very high	0 Å²	0	33 Å²	33	0%	0	17%	0.166	C	C	.	.	H	α-helix	trans	-56.3	-46.6	177.6	-74.6	177.4	0	0	0	112.5	A190 V196 Q197 V198 I329 L331 L342 L346	A190-L194 WeakPolarHBondContact O-CB 3.42Å; A190-L194 WeakPolarHBondContact O-CG 3.31Å; A190-L194 PolarHBondContact O-N 3.23Å; L194-V196 VanDerWaalsContact C-N 3.3Å; L194-V196 PolarHBondContact O-N 2.95Å; L194-Q197 PolarHBondContact O-N 3.41Å; L194-V198 WeakPolarHBondContact O-CB 3.45Å; L194-V198 WeakPolarHBondContact O-CG2 3.3Å; L194-V198 PolarHBondContact O-N 3.15Å; L194-I329 HydrophobicContact CD2-CD1 3.69Å; L194-I329 HydrophobicContact CD2-CG2 4.08Å; L194-L331 HydrophobicContact CD1-CD1 4.26Å; L194-L331 HydrophobicContact CD1-CD2 4.4Å; L194-L331 HydrophobicContact CD2-CD2 4.15Å; L194-L331 HydrophobicContact CG-CD2 4.38Å; L194-L342 HydrophobicContact CD1-CD1 4.19Å; L194-L342 HydrophobicContact CD1-CD2 3.42Å; L194-L342 VanDerWaalsContact CD1-CD2 3.42Å; L194-L342 HydrophobicContact CD1-CG 3.52Å; L194-L346 HydrophobicContact CB-CD2 4.41Å; L194-L346 HydrophobicContact CD1-CD2 4.43Å; L194-L346 HydrophobicContact CD2-CD2 4.43Å
195	A	93.5	Very high	92	Very high	1 Å²	1	33.2 Å²	33.2	1%	0.008	17%	0.166	C	C	.	.	H	α-helix	trans	-59.8	-38.6	179	0	0	0	0	0	112.9	P173 I176 K191 I193 Y199	P173-A195 HydrophobicContact CB-CB 4.12Å; P173-A195 WeakPolarHBondContact O-CB 3.37Å; I176-A195 HydrophobicContact CB-CB 3.9Å; I176-A195 HydrophobicContact CG2-CB 3.8Å; K191-A195 VanDerWaalsContact O-CB 3.29Å; K191-A195 WeakPolarHBondContact O-CB 3.43Å; K191-A195 PolarHBondContact O-N 3.12Å; I193-A195 PolarHBondContact O-N 3.25Å; A195-Y199 VanDerWaalsContact O-CB 3.25Å; A195-Y199 WeakPolarHBondContact O-CB 3.26Å; A195-Y199 PolarHBondContact O-N 2.86Å
196	V	93.5	Very high	91.6	Very high	64 Å²	64	36.4 Å²	36.4	39%	0.388	18%	0.181	S	C	.	.	H	α-helix	trans	-71.5	-43.1	176.1	172.5	0	0	0	0	111.8	P173 K192 I193 L194 Y199 A200	P173-V196 HydrophobicContact CB-CG2 4.27Å; K192-V196 WeakPolarHBondContact O-CG2 3.46Å; K192-V196 PolarHBondContact O-N 3.29Å; I193-V196 PolarHBondContact O-N 2.69Å; I193-V196 VanDerWaalsContact O-N 3.17Å; L194-V196 VanDerWaalsContact C-N 3.3Å; L194-V196 PolarHBondContact O-N 2.95Å; V196-Y199 PolarHBondContact O-N 3.24Å; V196-A200 WeakPolarHBondContact O-CB 3.39Å; V196-A200 PolarHBondContact O-N 2.98Å
197	Q	93	Very high	91.4	Very high	30 Å²	30	40.6 Å²	40.6	14%	0.14	20%	0.196	C	C	.	.	H	α-helix	trans	-69.8	-39.7	-178.4	-64.3	-49.7	-42.7	0	0	112.8	I193 L194 A200 H201 I329 I554	I193-Q197 HydrophobicContact CG2-CG 4.07Å; I193-Q197 WeakPolarHBondContact O-CG 3.37Å; I193-Q197 PolarHBondContact O-N 3.23Å; L194-Q197 PolarHBondContact O-N 3.41Å; Q197-A200 PolarHBondContact O-N 3.21Å; Q197-H201 VanDerWaalsContact O-CB 3.32Å; Q197-H201 WeakPolarHBondContact O-CB 3.32Å; Q197-H201 PolarHBondContact O-N 3.44Å; Q197-I329 HydrophobicContact CB-CD1 3.54Å; Q197-I329 HydrophobicContact CB-CG1 4.32Å; Q197-I329 HydrophobicContact CG-CD1 4.06Å; Q197-I554 HydrophobicContact CG-CB 4.49Å; Q197-I554 HydrophobicContact CG-CD1 4.45Å; Q197-I554 HydrophobicContact CG-CG1 3.98Å; Q197-I554 HydrophobicContact CG-CG2 4.06Å
198	V	91.4	Very high	90.9	Very high	1 Å²	1	41.6 Å²	41.6	1%	0.006	20%	0.201	C	C	.	.	H	α-helix	trans	-62.1	-46.1	173.5	163.7	0	0	0	0	111.1	I176 L194 A200 H201 Y202 L346 L350 L458	I176-V198 HydrophobicContact CD1-CG1 4.19Å; L194-V198 WeakPolarHBondContact O-CB 3.45Å; L194-V198 WeakPolarHBondContact O-CG2 3.3Å; L194-V198 PolarHBondContact O-N 3.15Å; V198-A200 VanDerWaalsContact C-N 3.34Å; V198-A200 PolarHBondContact O-N 3.42Å; V198-H201 PolarHBondContact O-N 2.99Å; V198-Y202 HydrophobicContact CG1-CD2 3.87Å; V198-Y202 HydrophobicContact CG1-CE2 3.94Å; V198-Y202 WeakPolarHBondContact O-CD2 3.33Å; V198-Y202 PolarHBondContact O-N 2.98Å; V198-L346 HydrophobicContact CG1-CD1 4.46Å; V198-L346 HydrophobicContact CG2-CD1 4.03Å; V198-L346 HydrophobicContact CG2-CD2 3.74Å; V198-L346 HydrophobicContact CG2-CG 4.17Å; V198-L350 HydrophobicContact CG1-CD1 3.69Å; V198-L350 HydrophobicContact CG1-CD2 3.83Å; V198-L350 HydrophobicContact CG1-CG 4.38Å; V198-L458 HydrophobicContact CG2-CD2 4.12Å
199	Y	91.5	Very high	90.3	Very high	78 Å²	78	44.1 Å²	44.1	31%	0.306	20%	0.204	S	C	.	.	H	α-helix	trans	-57.6	-47.2	175.1	178.9	-101.4	0	0	0	111.8	L170 L171 P173 A195 V196 H201 Y202 N203	L170-Y199 HydrophobicContact CB-CE2 4Å; L171-Y199 WeakPolarHBondContact O-CD2 3.48Å; P173-Y199 HydrophobicContact CG-CD1 4.05Å; P173-Y199 HydrophobicContact CG-CD2 4.19Å; P173-Y199 HydrophobicContact CG-CG 3.79Å; A195-Y199 VanDerWaalsContact O-CB 3.25Å; A195-Y199 WeakPolarHBondContact O-CB 3.26Å; A195-Y199 PolarHBondContact O-N 2.86Å; V196-Y199 PolarHBondContact O-N 3.24Å; Y199-H201 VanDerWaalsContact C-N 3.34Å; Y199-H201 PolarHBondContact O-N 3.31Å; Y199-Y202 PolarHBondContact O-N 3.39Å; Y199-N203 WeakPolarHBondContact CD1-ND2 3.35Å; Y199-N203 WeakPolarHBondContact CE1-ND2 3.32Å; Y199-N203 WeakPolarHBondContact O-CB 3.37Å; Y199-N203 PolarHBondContact O-N 3.28Å; Y199-N203 PolarHBondContact O-ND2 3.23Å
200	A	90.7	Very high	89.7	Confident	41 Å²	41	41.9 Å²	41.9	34%	0.339	20%	0.202	S	C	.	.	H	α-helix	trans	-61	-40.6	175.2	0	0	0	0	0	112.4	V196 Q197 V198 N203 R204	V196-A200 WeakPolarHBondContact O-CB 3.39Å; V196-A200 PolarHBondContact O-N 2.98Å; Q197-A200 PolarHBondContact O-N 3.21Å; V198-A200 VanDerWaalsContact C-N 3.34Å; V198-A200 PolarHBondContact O-N 3.42Å; A200-N203 PolarHBondContact O-N 3.08Å; A200-R204 VanDerWaalsContact O-CB 3.28Å; A200-R204 WeakPolarHBondContact O-CB 3.34Å; A200-R204 PolarHBondContact O-N 2.9Å
201	H	90.2	Very high	88.9	Confident	5 Å²	5	43.7 Å²	43.7	2%	0.023	21%	0.211	C	C	.	.	H	α-helix	trans	-65.9	-41.9	179.2	-178.4	89.2	0	0	0	113	Q197 V198 Y199 R204 I205 N456 I457 L458	Q197-H201 VanDerWaalsContact O-CB 3.32Å; Q197-H201 WeakPolarHBondContact O-CB 3.32Å; Q197-H201 PolarHBondContact O-N 3.44Å; V198-H201 PolarHBondContact O-N 2.99Å; Y199-H201 VanDerWaalsContact C-N 3.34Å; Y199-H201 PolarHBondContact O-N 3.31Å; H201-R204 PolarHBondContact NE2-NH2 2.89Å; H201-R204 VanDerWaalsContact NE2-NH2 3.19Å; H201-R204 VanDerWaalsContact O-CB 3.31Å; H201-R204 WeakPolarHBondContact O-CB 3.25Å; H201-R204 PolarHBondContact O-N 3.45Å; H201-I205 WeakPolarHBondContact O-CG1 3.32Å; H201-I205 PolarHBondContact O-N 3.17Å; H201-N456 PolarHBondContact NE2-O 2.6Å; H201-I457 PolarHBondContact NE2-O 3.24Å; H201-L458 WeakPolarHBondContact NE2-CA 3.46Å; H201-L458 PolarHBondContact NE2-N 2.97Å
202	Y	88.8	Confident	87.8	Confident	11 Å²	11	46 Å²	46	4%	0.043	23%	0.231	C	C	.	.	H	α-helix	trans	-73.6	-34.8	175.9	-75.7	-70.3	0	0	0	112.9	L168 V198 Y199 R204 I205 Q206 L350 V352 Q392	L168-Y202 HydrophobicContact CD1-CD1 3.69Å; L168-Y202 HydrophobicContact CD1-CE1 4.08Å; L168-Y202 HydrophobicContact CD1-CG 4.39Å; V198-Y202 HydrophobicContact CG1-CD2 3.87Å; V198-Y202 HydrophobicContact CG1-CE2 3.94Å; V198-Y202 WeakPolarHBondContact O-CD2 3.33Å; V198-Y202 PolarHBondContact O-N 2.98Å; Y199-Y202 PolarHBondContact O-N 3.39Å; Y202-R204 VanDerWaalsContact C-N 3.26Å; Y202-R204 PolarHBondContact O-N 3.34Å; Y202-I205 HydrophobicContact CD1-CD1 3.87Å; Y202-I205 HydrophobicContact CE1-CD1 3.85Å; Y202-I205 PolarHBondContact O-N 3.14Å; Y202-Q206 WeakPolarHBondContact O-CG 3.46Å; Y202-Q206 PolarHBondContact O-N 3.21Å; Y202-L350 HydrophobicContact CD2-CD2 4.43Å; Y202-L350 HydrophobicContact CE2-CD1 3.99Å; Y202-L350 HydrophobicContact CE2-CD2 4.19Å; Y202-V352 HydrophobicContact CE1-CG1 4.22Å; Y202-Q392 PolarHBondContact OH-O 2.65Å; Y202-Q392 VanDerWaalsContact OH-O 3.11Å
203	N	87.9	Confident	86.7	Confident	47 Å²	47	42.9 Å²	42.9	25%	0.251	22%	0.224	S	C	.	.	H	α-helix	trans	-57	-43.4	168	-70.2	-19.9	0	0	0	111.2	L170 Y199 A200 Q206 Y207	L170-N203 WeakPolarHBondContact CD1-OD1 3.45Å; L170-N203 WeakPolarHBondContact CD2-OD1 3.47Å; Y199-N203 WeakPolarHBondContact CD1-ND2 3.35Å; Y199-N203 WeakPolarHBondContact CE1-ND2 3.32Å; Y199-N203 WeakPolarHBondContact O-CB 3.37Å; Y199-N203 PolarHBondContact O-N 3.28Å; Y199-N203 PolarHBondContact O-ND2 3.23Å; A200-N203 PolarHBondContact O-N 3.08Å; N203-Q206 PolarHBondContact O-N 2.75Å; N203-Y207 WeakPolarHBondContact O-CB 2.94Å; N203-Y207 PolarHBondContact O-N 2.89Å
204	R	88.6	Confident	85.2	Confident	13 Å²	13	44.4 Å²	44.4	5%	0.049	24%	0.239	C	C	.	.	H	α-helix	trans	-61.4	-45.2	177.1	-170.4	-170.1	74.5	104.2	1.8	112.3	A200 H201 Y202 Y207 N208 L324 E325 K326 T455	A200-R204 VanDerWaalsContact O-CB 3.28Å; A200-R204 WeakPolarHBondContact O-CB 3.34Å; A200-R204 PolarHBondContact O-N 2.9Å; H201-R204 PolarHBondContact NE2-NH2 2.89Å; H201-R204 VanDerWaalsContact NE2-NH2 3.19Å; H201-R204 VanDerWaalsContact O-CB 3.31Å; H201-R204 WeakPolarHBondContact O-CB 3.25Å; H201-R204 PolarHBondContact O-N 3.45Å; Y202-R204 VanDerWaalsContact C-N 3.26Å; Y202-R204 PolarHBondContact O-N 3.34Å; R204-Y207 PolarHBondContact O-N 3.38Å; R204-N208 WeakPolarHBondContact O-CB 3.29Å; R204-N208 PolarHBondContact O-N 2.69Å; R204-L324 WeakPolarHBondContact CD-O 3.36Å; R204-L324 HydrophobicContact CG-CB 3.57Å; R204-L324 HydrophobicContact CG-CD1 4.19Å; R204-L324 PolarHBondContact NH1-O 3.07Å; R204-E325 WeakPolarHBondContact CD-O 3.44Å; R204-K326 VanDerWaalsContact CZ-CB 3.47Å; R204-T455 PolarHBondContact NH2-O 3.26Å
205	I	86.2	Confident	83.5	Confident	10 Å²	10	50.3 Å²	50.3	5%	0.051	27%	0.266	C	S	.	.	H	α-helix	trans	-60.3	-47.7	175.1	-70.7	168.3	0	0	0	110.5	H201 Y202 Y207 N208 R209 Q392 N456	H201-I205 WeakPolarHBondContact O-CG1 3.32Å; H201-I205 PolarHBondContact O-N 3.17Å; Y202-I205 HydrophobicContact CD1-CD1 3.87Å; Y202-I205 HydrophobicContact CE1-CD1 3.85Å; Y202-I205 PolarHBondContact O-N 3.14Å; I205-Y207 PolarHBondContact O-N 2.9Å; I205-N208 PolarHBondContact O-N 3.32Å; I205-R209 WeakPolarHBondContact O-CB 3.47Å; I205-R209 PolarHBondContact O-N 3.11Å; I205-Q392 HydrophobicContact CD1-CB 4.5Å; I205-Q392 HydrophobicContact CG2-CG 4.19Å; I205-N456 HydrophobicContact CG1-CB 4.27Å
206	Q	85.7	Confident	81.7	Confident	76 Å²	76	56.2 Å²	56.2	36%	0.355	30%	0.298	S	S	.	.	H	α-helix	trans	-62	-43.3	-179.8	-70	-178.4	18.5	0	0	111.9	L168 Y202 N203 R209 S210	L168-Q206 PolarHBondContact O-NE2 3.03Å; Y202-Q206 WeakPolarHBondContact O-CG 3.46Å; Y202-Q206 PolarHBondContact O-N 3.21Å; N203-Q206 PolarHBondContact O-N 2.75Å; Q206-R209 PolarHBondContact O-N 3.1Å; Q206-S210 PolarHBondContact O-N 2.79Å
207	Y	85.5	Confident	79.5	Confident	94 Å²	94	59.2 Å²	59.2	37%	0.369	31%	0.312	S	S	.	.	H	α-helix	trans	-60.9	-50.7	175.1	-179.5	-101.7	0	0	0	111.9	N203 R204 I205 R209 S210 L211 L322 L324	N203-Y207 WeakPolarHBondContact O-CB 2.94Å; N203-Y207 PolarHBondContact O-N 2.89Å; R204-Y207 PolarHBondContact O-N 3.38Å; I205-Y207 PolarHBondContact O-N 2.9Å; Y207-R209 VanDerWaalsContact C-N 3.3Å; Y207-R209 PolarHBondContact O-N 3.37Å; Y207-S210 PolarHBondContact O-N 2.92Å; Y207-S210 VanDerWaalsContact O-N 3.13Å; Y207-S210 PolarHBondContact O-OG 3.22Å; Y207-L211 HydrophobicContact CD1-CD1 3.98Å; Y207-L211 HydrophobicContact CE1-CD1 3.46Å; Y207-L211 VanDerWaalsContact CE1-CD1 3.46Å; Y207-L211 HydrophobicContact CE1-CG 4.23Å; Y207-L211 PolarHBondContact O-N 2.89Å; Y207-L322 WeakPolarHBondContact CE1-O 3.14Å; Y207-L324 HydrophobicContact CD1-CD1 3.76Å; Y207-L324 HydrophobicContact CD1-CG 4.2Å; Y207-L324 HydrophobicContact CE1-CD1 4.23Å; Y207-L324 HydrophobicContact CE1-CG 4.31Å; Y207-L324 HydrophobicContact CG-CD1 4.33Å
208	N	82.7	Confident	77.1	Confident	23 Å²	23	60 Å²	60	12%	0.123	33%	0.328	C	S	.	.	H	α-helix	trans	-60.8	-36.8	177.3	-69.9	-8.4	0	0	0	112.2	R204 I205 L211 A212	R204-N208 WeakPolarHBondContact O-CB 3.29Å; R204-N208 PolarHBondContact O-N 2.69Å; I205-N208 PolarHBondContact O-N 3.32Å; N208-L211 PolarHBondContact O-N 2.75Å; N208-A212 PolarHBondContact O-N 3.3Å; N208-A212 VanDerWaalsContact O-N 3.11Å
209	R	80.7	Confident	74.8	Confident	136 Å²	136	69.1 Å²	69.1	51%	0.513	37%	0.368	S	S	.	.	H	α-helix	trans	-65.9	-39.9	175.3	-165.8	174.8	-169.3	161.5	11.1	111.7	I205 Q206 Y207 L211 A212 T213 E388	I205-R209 WeakPolarHBondContact O-CB 3.47Å; I205-R209 PolarHBondContact O-N 3.11Å; Q206-R209 PolarHBondContact O-N 3.1Å; Y207-R209 VanDerWaalsContact C-N 3.3Å; Y207-R209 PolarHBondContact O-N 3.37Å; R209-L211 VanDerWaalsContact C-N 3.35Å; R209-A212 PolarHBondContact O-N 3.42Å; R209-T213 PolarHBondContact O-N 3.17Å; R209-T213 PolarHBondContact O-OG1 3.13Å; R209-E388 IonicContact NH2-OE2 3.29Å; R209-E388 PolarHBondContact NH2-OE2 3.17Å
210	S	80.1	Confident	72.2	Confident	59 Å²	59	72.7 Å²	72.7	41%	0.413	39%	0.392	S	S	.	.	H	α-helix	trans	-67.1	-33.7	176.5	71.3	0	0	0	0	113.2	Q206 Y207 T213 S214	Q206-S210 PolarHBondContact O-N 2.79Å; Y207-S210 PolarHBondContact O-N 2.92Å; Y207-S210 VanDerWaalsContact O-N 3.13Å; Y207-S210 PolarHBondContact O-OG 3.22Å; S210-T213 WeakPolarHBondContact CA-OG1 3.44Å; S210-T213 PolarHBondContact O-OG1 2.87Å; S210-S214 PolarHBondContact O-N 2.7Å; S210-S214 PolarHBondContact O-OG 3.27Å
211	L	77.2	Confident	69.7	Low	38 Å²	38	75 Å²	75	20%	0.199	41%	0.405	C	S	.	.	H	α-helix	trans	-64.7	-50.2	172.3	-72.5	175.9	0	0	0	111.6	Y207 N208 R209 T213 S214 E215 P321	Y207-L211 HydrophobicContact CD1-CD1 3.98Å; Y207-L211 HydrophobicContact CE1-CD1 3.46Å; Y207-L211 VanDerWaalsContact CE1-CD1 3.46Å; Y207-L211 HydrophobicContact CE1-CG 4.23Å; Y207-L211 PolarHBondContact O-N 2.89Å; N208-L211 PolarHBondContact O-N 2.75Å; R209-L211 VanDerWaalsContact C-N 3.35Å; L211-T213 VanDerWaalsContact C-N 3.32Å; L211-T213 PolarHBondContact O-N 3.44Å; L211-S214 WeakPolarHBondContact O-CA 3.49Å; L211-S214 VanDerWaalsContact O-CB 3.28Å; L211-S214 WeakPolarHBondContact O-CB 3.28Å; L211-S214 PolarHBondContact O-N 3.36Å; L211-E215 PolarHBondContact O-N 3.22Å; L211-P321 HydrophobicContact CD1-CB 3.85Å; L211-P321 HydrophobicContact CD2-CB 3.47Å; L211-P321 VanDerWaalsContact CD2-CB 3.47Å; L211-P321 HydrophobicContact CD2-CG 4.27Å; L211-P321 HydrophobicContact CG-CB 4.26Å
212	A	73.2	Confident	67.1	Low	50 Å²	50	81.9 Å²	81.9	41%	0.413	44%	0.443	S	S	.	.	H	α-helix	trans	-55.9	-44.7	178.9	0	0	0	0	0	112.4	N208 R209 S214 E215	N208-A212 PolarHBondContact O-N 3.3Å; N208-A212 VanDerWaalsContact O-N 3.11Å; R209-A212 PolarHBondContact O-N 3.42Å; A212-S214 PolarHBondContact O-N 3.35Å; A212-S214 VanDerWaalsContact O-N 3.14Å; A212-E215 PolarHBondContact O-N 3.41Å
213	T	72.2	Confident	64.7	Low	78 Å²	78	87 Å²	87	48%	0.479	48%	0.48	S	S	.	.	H	α-helix	trans	-65.2	-15.3	175.8	52.6	0	0	0	0	114.5	R209 S210 L211 N217	R209-T213 PolarHBondContact O-N 3.17Å; R209-T213 PolarHBondContact O-OG1 3.13Å; S210-T213 WeakPolarHBondContact CA-OG1 3.44Å; S210-T213 PolarHBondContact O-OG1 2.87Å; L211-T213 VanDerWaalsContact C-N 3.32Å; L211-T213 PolarHBondContact O-N 3.44Å; T213-N217 PolarHBondContact O-ND2 3.32Å
214	S	63.2	Low	62.1	Low	78 Å²	78	92.9 Å²	92.9	55%	0.545	51%	0.511	S	S	.	.	H	α-helix	trans	-85.5	-34	177.9	-54.3	0	0	0	0	112	S210 L211 A212	S210-S214 PolarHBondContact O-N 2.7Å; S210-S214 PolarHBondContact O-OG 3.27Å; L211-S214 WeakPolarHBondContact O-CA 3.49Å; L211-S214 VanDerWaalsContact O-CB 3.28Å; L211-S214 WeakPolarHBondContact O-CB 3.28Å; L211-S214 PolarHBondContact O-N 3.36Å; A212-S214 PolarHBondContact O-N 3.35Å; A212-S214 VanDerWaalsContact O-N 3.14Å
215	E	58.6	Low	59.5	Low	124 Å²	124	100.4 Å²	100.4	58%	0.579	55%	0.552	S	S	*	*	H	α-helix	trans	-70.3	-43.9	-179.2	-65.8	-179.4	165.3	0	0	111.6	L211 A212 N217 G218	L211-E215 PolarHBondContact O-N 3.22Å; A212-E215 PolarHBondContact O-N 3.41Å; E215-N217 VanDerWaalsContact C-N 3.28Å; E215-N217 PolarHBondContact O-N 2.95Å; E215-G218 PolarHBondContact O-N 3.14Å; E215-G218 VanDerWaalsContact O-N 3.13Å
216	D	55.5	Low	57	Low	124 Å²	124	105.6 Å²	105.6	66%	0.663	59%	0.589	S	S	*	*	H	α-helix	trans	-62.2	-31.4	179.5	-75.8	-29.7	0	0	0	113.6
217	N	47.3	Very low	54.3	Low	128 Å²	128	105.3 Å²	105.3	68%	0.684	61%	0.606	S	S	*	*	H	α-helix	trans	-79.9	-17.8	179.2	-78	-61.2	0	0	0	113.3	T213 E215	T213-N217 PolarHBondContact O-ND2 3.32Å; E215-N217 VanDerWaalsContact C-N 3.28Å; E215-N217 PolarHBondContact O-N 2.95Å
218	G	41.4	Very low	51.9	Low	47 Å²	47	107.8 Å²	107.8	49%	0.485	63%	0.632	S	S	.	*	H	α-helix	trans	-73	-29.2	-178.6	0	0	0	0	0	114.4	E215	E215-G218 PolarHBondContact O-N 3.14Å; E215-G218 VanDerWaalsContact O-N 3.13Å
219	F	43.9	Very low	49.4	Very low	191 Å²	191	114.4 Å²	114.4	84%	0.838	67%	0.667	S	S	*	*	S	Bend	trans	-88.8	-17.4	-171.3	-96	-87.4	0	0	0	115.6
220	N	36.4	Very low	47.1	Very low	154 Å²	154	117.1 Å²	117.1	82%	0.824	69%	0.685	S	S	*	*	S	Bend	trans	-95.4	10.5	-171.1	-85.6	-33.8	0	0	0	115.8
221	S	38.3	Very low	44.7	Very low	88 Å²	88	120.5 Å²	120.5	62%	0.615	70%	0.703	S	S	*	*	S	Bend	trans	-108.3	-0.7	-171.1	53.7	0	0	0	0	116.5
222	N	36.7	Very low	42.6	Very low	150 Å²	150	128 Å²	128	80%	0.802	73%	0.734	S	S	*	*	S	Bend	trans	-120.1	13.8	-170.1	-83.4	-35.7	0	0	0	117.1
223	S	36.4	Very low	40.6	Very low	119 Å²	119	133.6 Å²	133.6	83%	0.832	75%	0.752	S	S	*	*			trans	-123.8	51.8	-177.1	-71.7	0	0	0	0	114.8
224	L	33.8	Very low	38.5	Very low	171 Å²	171	135.7 Å²	135.7	90%	0.895	77%	0.765	S	S	*	*			trans	-140.7	75	170	-85.5	171.6	0	0	0	111.8
225	N	33.9	Very low	37	Very low	171 Å²	171	138.2 Å²	138.2	91%	0.914	78%	0.776	S	S	*	*	S	Bend	trans	-162.8	145.4	154.6	-111.5	-32.1	0	0	0	113.5
226	S	33.9	Very low	35.5	Very low	119 Å²	119	139.4 Å²	139.4	83%	0.832	79%	0.787	S	S	*	*			trans	62.4	95.4	177.2	-163	0	0	0	0	116.5
227	G	30.2	Very low	34.3	Very low	69 Å²	69	140.8 Å²	140.8	71%	0.711	79%	0.794	S	S	*	*			trans	-90.9	166	167.5	0	0	0	0	0	113.2
228	T	35.1	Very low	33.3	Very low	147 Å²	147	143.1 Å²	143.1	90%	0.902	80%	0.801	S	S	*	*			trans	-153.3	148.6	135.1	27.4	0	0	0	0	108.5
229	N	30	Very low	32.8	Very low	161 Å²	161	151.6 Å²	151.6	86%	0.861	82%	0.819	S	S	*	*			trans	-65.5	142	-173.5	-53.7	-51.6	0	0	0	112.6
230	E	32.9	Very low	32	Very low	194 Å²	194	147.6 Å²	147.6	91%	0.907	82%	0.815	S	S	*	*				-159.5	134.7	126.8	-114.1	176.2	176.5	0	0	112.5
231	T	29.5	Very low	31.9	Very low	129 Å²	129	145.3 Å²	145.3	79%	0.791	81%	0.809	S	S	*	*			trans	-91	133.6	-175.2	45.4	0	0	0	0	112.7
232	K	32.9	Very low	31.5	Very low	195 Å²	195	148.2 Å²	148.2	85%	0.848	82%	0.817	S	S	*	*			trans	-171.4	124.4	139.3	-105.2	150.4	-172.8	174.6	0	115
233	H	31.6	Very low	30.9	Very low	169 Å²	169	149.7 Å²	149.7	78%	0.782	82%	0.82	S	S	*	*			trans	23.4	117.7	148.8	-67.2	-72	0	0	0	122.6
234	T	27.4	Very low	30.5	Very low	121 Å²	121	153.8 Å²	153.8	74%	0.742	82%	0.823	S	S	*	*				37.1	124.1	113.1	-34	0	0	0	0	119.5
235	V	31.8	Very low	30.2	Very low	131 Å²	131	150.8 Å²	150.8	79%	0.794	82%	0.816	S	S	*	*				-173.7	136.3	124.4	144.2	0	0	0	0	110.2
236	N	25.8	Very low	29.9	Very low	149 Å²	149	146.4 Å²	146.4	80%	0.797	81%	0.811	S	S	*	*			trans	-64.6	153	172.6	-69.2	-17.5	0	0	0	111.4
237	N	30.9	Very low	29.6	Very low	153 Å²	153	147.4 Å²	147.4	82%	0.818	81%	0.813	S	S	*	*			trans	-141.4	128.2	151.6	-103.2	-27.7	0	0	0	112.8
238	H	27.6	Very low	29.5	Very low	178 Å²	178	156.2 Å²	156.2	82%	0.824	82%	0.824	S	S	*	*			trans	-63.8	150	164.9	-81.6	-95.9	0	0	0	110.5
239	Y	30.8	Very low	28.9	Very low	224 Å²	224	154.2 Å²	154.2	88%	0.878	82%	0.817	S	S	*	*			trans	-138.9	104.3	158.3	-114.9	-85.1	0	0	0	113.1
240	S	26.5	Very low	28.8	Very low	107 Å²	107	153 Å²	153	75%	0.748	82%	0.819	S	S	*	*			trans	-139.1	160.5	144.8	-60	0	0	0	0	104.2
241	P	33.8	Very low	28.6	Very low	106 Å²	106	149.9 Å²	149.9	69%	0.688	81%	0.813	S	S	*	*			cis	-151.2	-158.7	28.9	41.1	-17.8	0	0	0	115.3
242	N	30.2	Very low	28.3	Very low	149 Å²	149	148.8 Å²	148.8	80%	0.797	81%	0.811	S	S	*	*			trans	98.5	128.3	145.1	-79.9	14.2	0	0	0	121.9
243	E	25	Very low	28.1	Very low	182 Å²	182	146.1 Å²	146.1	85%	0.85	81%	0.811	S	S	*	*			trans	-67.1	149	166.1	-48.6	160.1	122.7	0	0	111.6
244	F	27.8	Very low	27.7	Very low	204 Å²	204	145.2 Å²	145.2	90%	0.895	81%	0.812	S	S	*	*				-157.3	147.5	128	-155.1	-106.1	0	0	0	112.6
245	S	25.8	Very low	27.9	Very low	108 Å²	108	150.1 Å²	150.1	76%	0.755	82%	0.819	S	S	*	*			trans	-73.4	150.7	-175.5	-51.4	0	0	0	0	113.9
246	G	28.9	Very low	27.5	Very low	79 Å²	79	152.9 Å²	152.9	81%	0.814	82%	0.823	S	S	*	*			trans	-171.3	95.7	171.2	0	0	0	0	0	113.5
247	T	26.2	Very low	27.6	Very low	141 Å²	141	149.1 Å²	149.1	87%	0.865	82%	0.819	S	S	*	*			trans	-73	138.5	177.6	44.1	0	0	0	0	112.4
248	R	28.4	Very low	27.4	Very low	253 Å²	253	147.6 Å²	147.6	96%	0.955	82%	0.82	S	S	*	*			trans	-162.3	138.3	143.1	-112.9	165.4	-174.9	-155.3	-1.7	113.1
249	S	24	Very low	27.6	Very low	106 Å²	106	146.9 Å²	146.9	74%	0.741	82%	0.822	S	S	*	*			trans	-87.3	139.5	-174.4	51.2	0	0	0	0	113.5
250	C	27.2	Very low	27.7	Very low	135 Å²	135	141.9 Å²	141.9	91%	0.912	82%	0.819	S	S	*	*			trans	-138.3	148.3	154.5	-70.3	0	0	0	0	109.4
251	T	27.5	Very low	28.1	Very low	128 Å²	128	145.5 Å²	145.5	79%	0.785	83%	0.825	S	S	*	*			trans	-108.2	141.1	-158.9	44.7	0	0	0	0	115
252	S	24.1	Very low	28.2	Very low	107 Å²	107	145 Å²	145	75%	0.748	82%	0.821	S	S	*	*			trans	40.4	123.3	143.3	65.3	0	0	0	0	121.4
253	V	28.6	Very low	28.5	Very low	138 Å²	138	142.8 Å²	142.8	84%	0.836	82%	0.815	S	S	*	*			trans	-137.8	126.7	136	-170.8	0	0	0	0	108.8
254	N	24.2	Very low	29.3	Very low	151 Å²	151	139.6 Å²	139.6	81%	0.807	81%	0.808	S	S	*	*			trans	-73.6	143.7	171.5	-88.4	-25.3	0	0	0	110.6
255	Y	30.1	Very low	30.2	Very low	224 Å²	224	134.3 Å²	134.3	88%	0.878	80%	0.796	S	S	*	*			trans	-133.6	111.6	150.7	-116.7	-88.4	0	0	0	110.1
256	Q	25.1	Very low	31	Very low	188 Å²	188	136.2 Å²	136.2	88%	0.879	79%	0.793	S	S	*	*			trans	-75.5	134.9	162.9	-70.9	174.7	-28.7	0	0	107.8
257	G	27.8	Very low	31.5	Very low	70 Å²	70	138.8 Å²	138.8	72%	0.722	79%	0.787	S	S	*	*			trans	-170.1	67.4	-174.5	0	0	0	0	0	112.2	L259	G257-L259 PolarHBondContact O-N 2.89Å; G257-L259 VanDerWaalsContact O-N 3.17Å
258	S	26.5	Very low	32.3	Very low	121 Å²	121	138.6 Å²	138.6	85%	0.846	78%	0.78	S	S	*	*			trans	-64.7	109.9	171.1	52.7	0	0	0	0	110.3
259	L	31.8	Very low	32.8	Very low	163 Å²	163	133.3 Å²	133.3	85%	0.853	77%	0.77	S	S	*	*			trans	-136.5	110.7	162.4	-136.6	78.4	0	0	0	109.5	G257 Q261	G257-L259 PolarHBondContact O-N 2.89Å; G257-L259 VanDerWaalsContact O-N 3.17Å; L259-Q261 PolarHBondContact O-N 2.86Å
260	S	31.5	Very low	33.4	Very low	119 Å²	119	135.2 Å²	135.2	83%	0.832	77%	0.772	S	S	*	*	P	Polyproline II helix	trans	-63.6	117.9	173.5	50	0	0	0	0	110.2
261	Q	35.9	Very low	34.1	Very low	183 Å²	183	134.5 Å²	134.5	86%	0.855	77%	0.768	S	S	*	*	P	Polyproline II helix	trans	-78.6	141.7	169.1	-68.3	-168.5	-7	0	0	110.4	L259	L259-Q261 PolarHBondContact O-N 2.86Å
262	P	35.6	Very low	34.7	Very low	95 Å²	95	139.3 Å²	139.3	62%	0.617	77%	0.772	S	S	*	*	P	Polyproline II helix	trans	-73.6	151.2	179.4	31.5	-35.1	0	0	0	111.3
263	P	36.1	Very low	35.3	Very low	103 Å²	103	141.9 Å²	141.9	67%	0.669	78%	0.777	S	S	*	*	P	Polyproline II helix	trans	-66.9	154.5	175.7	29.3	-34.9	0	0	0	111.8	S265	P263-S265 PolarHBondContact O-N 3.42Å
264	V	42.8	Very low	35.4	Very low	116 Å²	116	138.9 Å²	138.9	70%	0.703	77%	0.774	S	S	*	*	T	Hydrogen-bonded Turn	trans	-72.5	30	-165	-155.2	0	0	0	0	114.8
265	S	47.2	Very low	35.6	Very low	92 Å²	92	139.6 Å²	139.6	64%	0.643	78%	0.777	S	S	*	*	T	Hydrogen-bonded Turn	trans	-96.4	-16.2	179.7	46.4	0	0	0	0	115	P263	P263-S265 PolarHBondContact O-N 3.42Å
266	E	41	Very low	35.7	Very low	149 Å²	149	137.1 Å²	137.1	70%	0.696	78%	0.778	S	S	*	*	S	Bend	trans	-97.4	-19.6	-175	-66	-162.8	142.8	0	0	115.3	I268	E266-I268 VanDerWaalsContact C-N 3.31Å; E266-I268 PolarHBondContact O-N 3.2Å
267	L	40	Very low	35.9	Very low	132 Å²	132	133.2 Å²	133.2	69%	0.691	77%	0.772	S	S	*	*	G	3₁₀ helix	trans	-77.1	-7.4	-171.6	-79.4	163.5	0	0	0	115.5
268	I	43.1	Very low	36	Very low	138 Å²	138	135.3 Å²	135.3	71%	0.708	78%	0.775	S	S	*	*	G	3₁₀ helix	trans	-80.6	-16.1	-174.2	-65.9	176.7	0	0	0	113	E266	E266-I268 VanDerWaalsContact C-N 3.31Å; E266-I268 PolarHBondContact O-N 3.2Å
269	N	38.5	Very low	36.3	Very low	141 Å²	141	136.7 Å²	136.7	75%	0.754	77%	0.772	S	S	*	*	G	3₁₀ helix	trans	-90.9	-6.5	-174.9	-76.3	-27.2	0	0	0	115.7
270	L	37.6	Very low	36.3	Very low	147 Å²	147	137.8 Å²	137.8	77%	0.77	77%	0.77	S	S	*	*	S	Bend	trans	-93.6	-16.4	-175	-85.9	146.7	0	0	0	115
271	S	41.5	Very low	36.2	Very low	120 Å²	120	138.3 Å²	138.3	84%	0.839	77%	0.774	S	S	*	*	T	Hydrogen-bonded Turn	trans	-91.2	8.3	-175.9	-154.8	0	0	0	0	114.8
272	R	40	Very low	35.9	Very low	229 Å²	229	133.1 Å²	133.1	86%	0.864	77%	0.769	S	S	*	*	T	Hydrogen-bonded Turn	trans	-103	-6	-173.4	-114.6	176.4	178.2	161.8	-0.1	116.3
273	N	35.9	Very low	35.4	Very low	161 Å²	161	136.7 Å²	136.7	86%	0.861	78%	0.783	S	S	*	*			trans	-117.3	81.5	-179.3	-70.5	-14.6	0	0	0	110.6
274	G	31.1	Very low	35.3	Very low	74 Å²	74	137.4 Å²	137.4	76%	0.763	79%	0.791	S	S	*	*			trans	-157.5	23.8	-172.1	0	0	0	0	0	116.3
275	L	29	Very low	34.6	Very low	167 Å²	167	137.2 Å²	137.2	87%	0.874	80%	0.795	S	S	*	*			trans	-137.9	96.8	177.2	-81.5	172.4	0	0	0	110.8
276	L	31	Very low	33.9	Very low	171 Å²	171	139.5 Å²	139.5	90%	0.895	81%	0.805	S	S	*	*			trans	-172	144.1	151.5	-106	153.2	0	0	0	113
277	S	30.2	Very low	33.3	Very low	107 Å²	107	137.4 Å²	137.4	75%	0.748	81%	0.806	S	S	*	*			trans	59.4	86.7	160.8	55.5	0	0	0	0	119.7
278	S	29.1	Very low	33	Very low	114 Å²	114	135.1 Å²	135.1	80%	0.797	80%	0.802	S	S	*	*			trans	-62	134.1	131.9	-60.6	0	0	0	0	109.6
279	L	34.3	Very low	32.4	Very low	150 Å²	150	138.1 Å²	138.1	79%	0.785	81%	0.81	S	S	*	*			trans	176.2	126.3	143.5	-96.1	156	0	0	0	112.9
280	K	32	Very low	31.8	Very low	186 Å²	186	137 Å²	137	81%	0.809	81%	0.813	S	S	*	*			trans	62.3	98.5	150.2	-67.5	174.1	179.1	178.5	0	120.7
281	S	27.9	Very low	31.2	Very low	130 Å²	130	139.7 Å²	139.7	91%	0.909	82%	0.819	S	S	*	*				27.8	122.8	115.5	-163.5	0	0	0	0	119.7
282	G	29.2	Very low	30.5	Very low	74 Å²	74	138.6 Å²	138.6	76%	0.763	81%	0.811	S	S	*	*			trans	-179.9	115.3	164.5	0	0	0	0	0	112.7
283	N	26.8	Very low	30.1	Very low	170 Å²	170	135.6 Å²	135.6	91%	0.909	81%	0.809	S	S	*	*			trans	-70.2	140.5	176.1	-75.3	-19.1	0	0	0	112.2
284	S	32.1	Very low	29.8	Very low	118 Å²	118	133.3 Å²	133.3	83%	0.825	80%	0.801	S	S	*	*				-171.9	129	127.1	53.3	0	0	0	0	113.5
285	S	29.8	Very low	29.8	Very low	112 Å²	112	134.4 Å²	134.4	78%	0.783	80%	0.797	S	S	*	*			trans	-46.6	147.9	170	-30	0	0	0	0	116
286	T	31	Very low	30	Very low	140 Å²	140	135.8 Å²	135.8	86%	0.859	80%	0.799	S	S	*	*				-168	136.7	121.9	26.9	0	0	0	0	113.1
287	S	29.2	Very low	30	Very low	104 Å²	104	133 Å²	133	73%	0.727	79%	0.794	S	S	*	*			trans	-30.9	152.4	159.6	51.8	0	0	0	0	116
288	S	34.5	Very low	30.2	Very low	85 Å²	85	135.4 Å²	135.4	59%	0.594	80%	0.797	S	S	*	*			cis	-174	163.4	44.4	35.3	0	0	0	0	107.8
289	F	29	Very low	30.4	Very low	201 Å²	201	134.8 Å²	134.8	88%	0.882	79%	0.793	S	S	*	*			cis	-146.4	154.4	32.3	-74.9	-93.5	0	0	0	111.8
290	S	26.3	Very low	30.8	Very low	118 Å²	118	133.3 Å²	133.3	83%	0.825	79%	0.786	S	S	*	*			trans	-103.8	139.3	177.5	-41.2	0	0	0	0	111.4
291	F	26.4	Very low	31.6	Very low	203 Å²	203	132.5 Å²	132.5	89%	0.89	79%	0.789	S	S	*	*			trans	-112.8	114.7	154.1	-148.8	-90.1	0	0	0	107.4
292	S	26.1	Very low	32.6	Very low	96 Å²	96	135.3 Å²	135.3	67%	0.671	79%	0.785	S	S	*	*			trans	-118.6	120.2	-174.2	-162.2	0	0	0	0	109
293	M	30.3	Very low	33.7	Very low	167 Å²	167	134.2 Å²	134.2	82%	0.823	76%	0.761	S	S	*	*			trans	-102.3	133.4	161.5	-90.8	-69.1	159.3	0	0	108.5
294	T	31.4	Very low	35.1	Very low	113 Å²	113	130.5 Å²	130.5	69%	0.693	74%	0.741	S	S	*	*			trans	-88	136.1	-161.8	45.7	0	0	0	0	113.2
295	S	31.1	Very low	36.2	Very low	97 Å²	97	134.5 Å²	134.5	68%	0.678	74%	0.738	S	S	*	*			trans	44.2	123.6	141.5	64.2	0	0	0	0	119.7
296	E	32.3	Very low	37.4	Very low	195 Å²	195	134.9 Å²	134.9	91%	0.911	73%	0.728	S	S	*	*				-156.9	158	98.4	-106.4	171.4	174.9	0	0	111
297	S	31.3	Very low	38.4	Very low	112 Å²	112	133.8 Å²	133.8	78%	0.783	71%	0.711	S	S	*	*			trans	-114.2	120.4	-159.6	-51.2	0	0	0	0	112.2
298	L	35	Very low	39.6	Very low	158 Å²	158	136.8 Å²	136.8	83%	0.827	71%	0.707	S	S	*	*			trans	-160.9	127.4	152	-138.1	70.4	0	0	0	114.2
299	S	33.1	Very low	40.6	Very low	102 Å²	102	140.3 Å²	140.3	71%	0.713	71%	0.707	S	S	*	*			trans	50	82.8	150.3	61.7	0	0	0	0	120.8
300	D	42.5	Very low	42.1	Very low	119 Å²	119	134.4 Å²	134.4	64%	0.636	69%	0.687	S	S	*	*			trans	-141.4	76.4	161	-94	-43.2	0	0	0	113.6	D303	D300-D303 HydrophobicContact CB-CB 4.3Å
301	I	47.9	Very low	43.6	Very low	168 Å²	168	131.1 Å²	131.1	86%	0.862	66%	0.664	S	S	*	*	S	Bend	trans	-97.2	-4.4	174.6	-67.2	176.5	0	0	0	112.2
302	K	48.3	Very low	45.2	Very low	190 Å²	190	127 Å²	127	83%	0.826	65%	0.648	S	S	*	*	S	Bend	trans	-92.6	-27	175.6	-74.4	-177.5	175.4	177.8	0	113.6	D304 R305	K302-D304 VanDerWaalsContact C-N 3.33Å; K302-D304 PolarHBondContact O-N 2.86Å; K302-R305 PolarHBondContact O-N 3.48Å
303	D	54.2	Low	46.7	Very low	50 Å²	50	127 Å²	127	27%	0.267	64%	0.639	S	S	.	*	H	α-helix	trans	-72.4	-23.6	-169.2	-151.7	26.9	0	0	0	113.5	D300 R305 E306 K307	D300-D303 HydrophobicContact CB-CB 4.3Å; D303-R305 VanDerWaalsContact C-N 3.35Å; D303-R305 PolarHBondContact O-N 3.46Å; D303-E306 PolarHBondContact O-N 3.42Å; D303-K307 WeakPolarHBondContact O-CB 3.28Å; D303-K307 WeakPolarHBondContact O-CG 3.46Å; D303-K307 PolarHBondContact O-N 3.13Å; D303-K307 WeakPolarHBondContact OD2-CE 3.37Å; D303-K307 IonicContact OD2-NZ 2.6Å; D303-K307 PolarHBondContact OD2-NZ 3.17Å
304	D	55.5	Low	48.1	Very low	92 Å²	92	123.8 Å²	123.8	49%	0.492	63%	0.625	S	S	.	*	H	α-helix	trans	-67.2	-27.7	178.2	-92.4	-17.3	0	0	0	114.3	K302 R308	K302-D304 VanDerWaalsContact C-N 3.33Å; K302-D304 PolarHBondContact O-N 2.86Å; D304-R308 VanDerWaalsContact O-CB 3.25Å; D304-R308 WeakPolarHBondContact O-CB 3.22Å; D304-R308 WeakPolarHBondContact O-CG 3.36Å; D304-R308 PolarHBondContact O-N 3.28Å
305	R	54.7	Low	49.4	Very low	202 Å²	202	124.9 Å²	124.9	76%	0.762	62%	0.62	S	S	*	*	H	α-helix	trans	-74.4	-34	174.4	-78.8	-169.3	177.9	-158.7	-0.1	111.7	K302 D303 R309	K302-R305 PolarHBondContact O-N 3.48Å; D303-R305 VanDerWaalsContact C-N 3.35Å; D303-R305 PolarHBondContact O-N 3.46Å; R305-R309 WeakPolarHBondContact O-CG 3.41Å; R305-R309 PolarHBondContact O-N 3.17Å
306	E	55	Low	50.6	Low	120 Å²	120	124.7 Å²	124.7	56%	0.561	61%	0.612	S	S	*	*	H	α-helix	trans	-73.5	-47.9	178.3	-152.6	119.5	-126.8	0	0	109.8	D303 R308 R309 V310	D303-E306 PolarHBondContact O-N 3.42Å; E306-R308 VanDerWaalsContact C-N 3.31Å; E306-R308 PolarHBondContact O-N 2.93Å; E306-R309 WeakPolarHBondContact O-CB 3.29Å; E306-R309 PolarHBondContact O-N 2.97Å; E306-R309 VanDerWaalsContact O-N 3.11Å; E306-V310 WeakPolarHBondContact O-CG2 3.36Å; E306-V310 PolarHBondContact O-N 3.29Å
307	K	52.6	Low	51.9	Low	118 Å²	118	119.1 Å²	119.1	51%	0.513	59%	0.588	S	S	.	*	H	α-helix	trans	-58	-38.9	171.2	-72.7	170.3	-174.7	159.6	0	112.7	D303 S311	D303-K307 WeakPolarHBondContact O-CB 3.28Å; D303-K307 WeakPolarHBondContact O-CG 3.46Å; D303-K307 PolarHBondContact O-N 3.13Å; D303-K307 WeakPolarHBondContact OD2-CE 3.37Å; D303-K307 IonicContact OD2-NZ 2.6Å; D303-K307 PolarHBondContact OD2-NZ 3.17Å; K307-S311 VanDerWaalsContact O-CB 3.25Å; K307-S311 WeakPolarHBondContact O-CB 3.49Å; K307-S311 PolarHBondContact O-N 3.27Å; K307-S311 PolarHBondContact O-OG 2.89Å
308	R	54.5	Low	53.2	Low	166 Å²	166	122.4 Å²	122.4	63%	0.626	59%	0.588	S	S	*	*	H	α-helix	trans	-63.6	-45.5	173	-79.1	175.1	-166	-164.3	5.6	112.3	D304 E306 S311 Q312	D304-R308 VanDerWaalsContact O-CB 3.25Å; D304-R308 WeakPolarHBondContact O-CB 3.22Å; D304-R308 WeakPolarHBondContact O-CG 3.36Å; D304-R308 PolarHBondContact O-N 3.28Å; E306-R308 VanDerWaalsContact C-N 3.31Å; E306-R308 PolarHBondContact O-N 2.93Å; R308-S311 WeakPolarHBondContact CA-OG 3.41Å; R308-S311 CarbonylContact O-C 3.53Å; R308-S311 PolarHBondContact O-N 3.38Å; R308-S311 PolarHBondContact O-OG 2.92Å; R308-Q312 WeakPolarHBondContact O-CG 3.32Å; R308-Q312 PolarHBondContact O-N 3.17Å
309	R	55.6	Low	54.4	Low	159 Å²	159	121.7 Å²	121.7	60%	0.6	59%	0.586	S	S	*	*	H	α-helix	trans	-60.3	-47.9	174.6	-78	174.3	173.5	165.2	-5.1	112.1	R305 E306 S311 Q312 I313	R305-R309 WeakPolarHBondContact O-CG 3.41Å; R305-R309 PolarHBondContact O-N 3.17Å; E306-R309 WeakPolarHBondContact O-CB 3.29Å; E306-R309 PolarHBondContact O-N 2.97Å; E306-R309 VanDerWaalsContact O-N 3.11Å; R309-S311 VanDerWaalsContact C-N 3.3Å; R309-S311 PolarHBondContact O-N 3.45Å; R309-Q312 PolarHBondContact O-N 3.27Å; R309-I313 WeakPolarHBondContact O-CD1 3.4Å; R309-I313 VanDerWaalsContact O-CG1 3.28Å; R309-I313 WeakPolarHBondContact O-CG1 3.29Å; R309-I313 PolarHBondContact O-N 3.17Å
310	V	59.5	Low	55.9	Low	77 Å²	77	124 Å²	124	47%	0.467	58%	0.579	S	S	.	*	H	α-helix	trans	-59.9	-41.7	175.8	174.7	0	0	0	0	110.8	E306 Q312 I313 L314	E306-V310 WeakPolarHBondContact O-CG2 3.36Å; E306-V310 PolarHBondContact O-N 3.29Å; V310-Q312 VanDerWaalsContact C-N 3.28Å; V310-Q312 PolarHBondContact O-N 3.46Å; V310-I313 PolarHBondContact O-N 3.45Å; V310-L314 HydrophobicContact CG1-CD1 3.92Å; V310-L314 HydrophobicContact CG1-CG 4.4Å; V310-L314 WeakPolarHBondContact O-CB 3.21Å; V310-L314 VanDerWaalsContact O-CG 3.27Å; V310-L314 WeakPolarHBondContact O-CG 3.36Å; V310-L314 PolarHBondContact O-N 3.06Å
311	S	59	Low	57	Low	50 Å²	50	121.2 Å²	121.2	35%	0.35	57%	0.567	S	S	.	*	H	α-helix	trans	-72.2	-15.9	175.7	77.1	0	0	0	0	114.9	K307 R308 R309 K315	K307-S311 VanDerWaalsContact O-CB 3.25Å; K307-S311 WeakPolarHBondContact O-CB 3.49Å; K307-S311 PolarHBondContact O-N 3.27Å; K307-S311 PolarHBondContact O-OG 2.89Å; R308-S311 WeakPolarHBondContact CA-OG 3.41Å; R308-S311 CarbonylContact O-C 3.53Å; R308-S311 PolarHBondContact O-N 3.38Å; R308-S311 PolarHBondContact O-OG 2.92Å; R309-S311 VanDerWaalsContact C-N 3.3Å; R309-S311 PolarHBondContact O-N 3.45Å; S311-K315 VanDerWaalsContact O-CD 3.28Å; S311-K315 WeakPolarHBondContact O-CD 3.38Å; S311-K315 WeakPolarHBondContact O-CG 3.43Å
312	Q	58.5	Low	58.3	Low	116 Å²	116	120 Å²	120	54%	0.542	56%	0.561	S	S	.	*	H	α-helix	trans	-84	-47.7	170.5	-77	176.1	-52.6	0	0	109.8	R308 R309 V310 L314 K315 D316	R308-Q312 WeakPolarHBondContact O-CG 3.32Å; R308-Q312 PolarHBondContact O-N 3.17Å; R309-Q312 PolarHBondContact O-N 3.27Å; V310-Q312 VanDerWaalsContact C-N 3.28Å; V310-Q312 PolarHBondContact O-N 3.46Å; Q312-L314 VanDerWaalsContact C-N 3.28Å; Q312-L314 PolarHBondContact O-N 3.46Å; Q312-K315 CarbonylContact O-C 3.55Å; Q312-K315 WeakPolarHBondContact O-CA 3.4Å; Q312-K315 WeakPolarHBondContact O-CB 3.5Å; Q312-K315 PolarHBondContact O-N 3.03Å; Q312-D316 PolarHBondContact O-N 2.76Å
313	I	59.6	Low	59.4	Low	96 Å²	96	118 Å²	118	49%	0.492	55%	0.553	S	S	.	*	H	α-helix	trans	-54.7	-45	173.6	-65.1	160.5	0	0	0	111	R309 V310 K315 D316 D317	R309-I313 WeakPolarHBondContact O-CD1 3.4Å; R309-I313 VanDerWaalsContact O-CG1 3.28Å; R309-I313 WeakPolarHBondContact O-CG1 3.29Å; R309-I313 PolarHBondContact O-N 3.17Å; V310-I313 PolarHBondContact O-N 3.45Å; I313-K315 VanDerWaalsContact C-N 3.28Å; I313-K315 PolarHBondContact O-N 3.25Å; I313-D316 PolarHBondContact O-N 3.38Å; I313-D317 PolarHBondContact O-N 3.03Å
314	L	58.9	Low	60.6	Low	100 Å²	100	119 Å²	119	52%	0.524	56%	0.558	S	S	.	*	H	α-helix	trans	-70.5	-17.2	176.3	-70.5	173.3	0	0	0	114.3	V310 Q312 F318	V310-L314 HydrophobicContact CG1-CD1 3.92Å; V310-L314 HydrophobicContact CG1-CG 4.4Å; V310-L314 WeakPolarHBondContact O-CB 3.21Å; V310-L314 VanDerWaalsContact O-CG 3.27Å; V310-L314 WeakPolarHBondContact O-CG 3.36Å; V310-L314 PolarHBondContact O-N 3.06Å; Q312-L314 VanDerWaalsContact C-N 3.28Å; Q312-L314 PolarHBondContact O-N 3.46Å; L314-F318 WeakPolarHBondContact O-CD2 3.23Å; L314-F318 WeakPolarHBondContact O-CE2 3.43Å
315	K	58.5	Low	61.7	Low	135 Å²	135	123.2 Å²	123.2	59%	0.587	57%	0.574	S	S	*	*	H	α-helix	trans	-87	-40.8	172.4	-79.5	173.4	-177.2	-178.1	0	111.2	S311 Q312 I313 D317 F318 D319	S311-K315 VanDerWaalsContact O-CD 3.28Å; S311-K315 WeakPolarHBondContact O-CD 3.38Å; S311-K315 WeakPolarHBondContact O-CG 3.43Å; Q312-K315 CarbonylContact O-C 3.55Å; Q312-K315 WeakPolarHBondContact O-CA 3.4Å; Q312-K315 WeakPolarHBondContact O-CB 3.5Å; Q312-K315 PolarHBondContact O-N 3.03Å; I313-K315 VanDerWaalsContact C-N 3.28Å; I313-K315 PolarHBondContact O-N 3.25Å; K315-D317 PolarHBondContact O-N 2.99Å; K315-D317 VanDerWaalsContact O-N 3.15Å; K315-F318 PolarHBondContact O-N 2.94Å; K315-D319 PolarHBondContact O-N 3.06Å
316	D	56.4	Low	63.3	Low	94 Å²	94	114.6 Å²	114.6	50%	0.503	54%	0.542	S	S	.	.	H	α-helix	trans	-59.3	-24.3	175.3	-61.1	-21.1	0	0	0	112	Q312 I313 R320	Q312-D316 PolarHBondContact O-N 2.76Å; I313-D316 PolarHBondContact O-N 3.38Å; D316-R320 WeakPolarHBondContact O-CG 3.42Å
317	D	59.3	Low	64.9	Low	78 Å²	78	110.7 Å²	110.7	42%	0.417	53%	0.529	S	S	.	.	T	Hydrogen-bonded Turn	trans	-76.7	-23.3	173.9	-76	-20.3	0	0	0	114.2	I313 K315 R320	I313-D317 PolarHBondContact O-N 3.03Å; K315-D317 PolarHBondContact O-N 2.99Å; K315-D317 VanDerWaalsContact O-N 3.15Å; D317-R320 IonicContact OD1-CZ 2.9Å; D317-R320 IonicContact OD1-NE 3.41Å; D317-R320 PolarHBondContact OD1-NE 3.23Å; D317-R320 IonicContact OD1-NH1 3.18Å; D317-R320 PolarHBondContact OD1-NH1 3.48Å; D317-R320 IonicContact OD1-NH2 2.68Å; D317-R320 PolarHBondContact OD1-NH2 2.91Å
318	F	59.7	Low	66.9	Low	180 Å²	180	105.2 Å²	105.2	79%	0.789	51%	0.505	S	S	*	.	T	Hydrogen-bonded Turn	trans	-82	-29.2	175.5	-77	-76.5	0	0	0	113.1	L314 K315	L314-F318 WeakPolarHBondContact O-CD2 3.23Å; L314-F318 WeakPolarHBondContact O-CE2 3.43Å; K315-F318 PolarHBondContact O-N 2.94Å
319	D	60	Low	68.8	Low	144 Å²	144	97.3 Å²	97.3	77%	0.77	48%	0.475	S	S	*	.	S	Bend	trans	-89.5	-2.1	-179.5	-70.7	-33.5	0	0	0	113.2	K315	K315-D319 PolarHBondContact O-N 3.06Å
320	R	63.4	Low	70.7	Confident	150 Å²	150	90 Å²	90	57%	0.566	45%	0.448	S	S	*	.	S	Bend	trans	-67.8	131.4	173.7	-84.2	173.3	-154.5	-179.4	19.3	111.1	D316 D317 L322	D316-R320 WeakPolarHBondContact O-CG 3.42Å; D317-R320 IonicContact OD1-CZ 2.9Å; D317-R320 IonicContact OD1-NE 3.41Å; D317-R320 PolarHBondContact OD1-NE 3.23Å; D317-R320 IonicContact OD1-NH1 3.18Å; D317-R320 PolarHBondContact OD1-NH1 3.48Å; D317-R320 IonicContact OD1-NH2 2.68Å; D317-R320 PolarHBondContact OD1-NH2 2.91Å; R320-L322 PolarHBondContact O-N 3.33Å
321	P	66.8	Low	72.4	Confident	60 Å²	60	86.3 Å²	86.3	39%	0.39	43%	0.425	S	S	.	.			trans	-64	129.2	176.2	27.1	-34	0	0	0	110.5	L211 K323	L211-P321 HydrophobicContact CD1-CB 3.85Å; L211-P321 HydrophobicContact CD2-CB 3.47Å; L211-P321 VanDerWaalsContact CD2-CB 3.47Å; L211-P321 HydrophobicContact CD2-CG 4.27Å; L211-P321 HydrophobicContact CG-CB 4.26Å; P321-K323 PolarHBondContact O-N 3.14Å
322	L	74.1	Confident	74.1	Confident	142 Å²	142	83.9 Å²	83.9	74%	0.743	41%	0.409	S	S	*	.			trans	-65.1	101.6	-179.3	-69.2	172.9	0	0	0	110.6	Y207 R320 L324	Y207-L322 WeakPolarHBondContact CE1-O 3.14Å; R320-L322 PolarHBondContact O-N 3.33Å; L322-L324 PolarHBondContact O-N 2.91Å
323	K	71.8	Confident	75.7	Confident	149 Å²	149	78.4 Å²	78.4	65%	0.648	38%	0.383	S	S	*	.	P	Polyproline II helix	trans	-70.2	122.1	175.4	-174.7	175.9	-179.5	178.1	0	110.2	P321	P321-K323 PolarHBondContact O-N 3.14Å
324	L	79.3	Confident	77.2	Confident	72 Å²	72	74.8 Å²	74.8	38%	0.377	37%	0.366	S	S	.	.	P	Polyproline II helix	trans	-83.8	125.2	179.4	-67.4	175.5	0	0	0	111.9	R204 Y207 L322	R204-L324 WeakPolarHBondContact CD-O 3.36Å; R204-L324 HydrophobicContact CG-CB 3.57Å; R204-L324 HydrophobicContact CG-CD1 4.19Å; R204-L324 PolarHBondContact NH1-O 3.07Å; Y207-L324 HydrophobicContact CD1-CD1 3.76Å; Y207-L324 HydrophobicContact CD1-CG 4.2Å; Y207-L324 HydrophobicContact CE1-CD1 4.23Å; Y207-L324 HydrophobicContact CE1-CG 4.31Å; Y207-L324 HydrophobicContact CG-CD1 4.33Å; L322-L324 PolarHBondContact O-N 2.91Å
325	E	79.2	Confident	78.6	Confident	179 Å²	179	73.9 Å²	73.9	84%	0.836	37%	0.365	S	S	*	.	P	Polyproline II helix	trans	-70.3	159.2	176.6	-61.9	-170	163.6	0	0	113.1	R204	R204-E325 WeakPolarHBondContact CD-O 3.44Å
326	K	87.4	Confident	79.9	Confident	21 Å²	21	68.6 Å²	68.6	9%	0.091	35%	0.349	C	S	.	.	P	Polyproline II helix	trans	-92.4	127.3	-177.6	69.4	-165.3	-177.7	83.2	0	112.5	R204 N328 L429 T455 F459	R204-K326 VanDerWaalsContact CZ-CB 3.47Å; K326-N328 PolarHBondContact NZ-ND2 3.36Å; K326-N328 PolarHBondContact NZ-OD1 3.33Å; K326-N328 PolarHBondContact O-N 3.23Å; K326-L429 WeakPolarHBondContact CE-O 3.47Å; K326-L429 PolarHBondContact NZ-O 3.26Å; K326-T455 WeakPolarHBondContact CD-O 3.45Å; K326-F459 VanDerWaalsContact NZ-CD2 3.32Å
327	S	88.1	Confident	81.5	Confident	39 Å²	39	64.5 Å²	64.5	27%	0.273	33%	0.328	S	S	.	.			trans	-87.4	81.3	177	-48.9	0	0	0	0	110.9
328	N	94.3	Very high	83	Confident	2 Å²	2	61.8 Å²	61.8	1%	0.011	32%	0.319	C	S	.	.			trans	-67.7	152.6	172.5	-45.6	-62.4	0	0	0	110.2	K326 F459 R551 F552	K326-N328 PolarHBondContact NZ-ND2 3.36Å; K326-N328 PolarHBondContact NZ-OD1 3.33Å; K326-N328 PolarHBondContact O-N 3.23Å; N328-F459 WeakPolarHBondContact CA-O 3.5Å; N328-F459 HydrophobicContact CB-CB 4.31Å; N328-R551 WeakPolarHBondContact CB-O 3.35Å; N328-R551 PolarHBondContact ND2-O 2.97Å; N328-F552 HydrophobicContact CB-CD1 3.47Å; N328-F552 VanDerWaalsContact CB-CD1 3.47Å; N328-F552 HydrophobicContact CB-CE1 3.6Å; N328-F552 HydrophobicContact CB-CG 4.25Å; N328-F552 HydrophobicContact CB-CZ 4.45Å
329	I	95.4	Very high	84.6	Confident	0 Å²	0	54 Å²	54	0%	0	28%	0.284	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-122.1	134.7	-168.4	-48.7	177.2	0	0	0	111.1	L194 Q197 L331 F459 I460 A461 I554	L194-I329 HydrophobicContact CD2-CD1 3.69Å; L194-I329 HydrophobicContact CD2-CG2 4.08Å; Q197-I329 HydrophobicContact CB-CD1 3.54Å; Q197-I329 HydrophobicContact CB-CG1 4.32Å; Q197-I329 HydrophobicContact CG-CD1 4.06Å; I329-L331 HydrophobicContact CG2-CD2 4.15Å; I329-F459 PolarHBondContact N-O 2.98Å; I329-I460 CarbonylContact O-C 3.03Å; I329-I460 WeakPolarHBondContact O-CA 3.49Å; I329-A461 PolarHBondContact O-N 3.34Å; I329-I554 CarbonylContact C-O 3.6Å; I329-I554 WeakPolarHBondContact CA-O 3.36Å; I329-I554 HydrophobicContact CG1-CB 4.35Å; I329-I554 HydrophobicContact CG2-CB 4.41Å; I329-I554 HydrophobicContact CG2-CG2 4.15Å
330	I	95.5	Very high	86.1	Confident	5 Å²	5	49.1 Å²	49.1	3%	0.026	26%	0.26	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-104.3	126.2	165.7	-70.3	166.9	0	0	0	109.8	L332 A461 L539 F552 I554 I555 T556	I330-L332 HydrophobicContact CG2-CD2 3.42Å; I330-L332 VanDerWaalsContact CG2-CD2 3.42Å; I330-L332 HydrophobicContact CG2-CG 3.97Å; I330-A461 CarbonylContact C-O 3.59Å; I330-A461 WeakPolarHBondContact CA-O 3.43Å; I330-A461 HydrophobicContact CG1-CB 4.13Å; I330-L539 HydrophobicContact CD1-CD1 4.13Å; I330-F552 HydrophobicContact CD1-CB 3.39Å; I330-F552 HydrophobicContact CD1-CD1 4.26Å; I330-F552 HydrophobicContact CD1-CD2 3.99Å; I330-F552 HydrophobicContact CD1-CG 3.64Å; I330-F552 HydrophobicContact CG1-CB 3.63Å; I330-F552 HydrophobicContact CG1-CD1 3.64Å; I330-F552 HydrophobicContact CG1-CD2 4.19Å; I330-F552 HydrophobicContact CG1-CE1 4.32Å; I330-F552 HydrophobicContact CG1-CG 3.57Å; I330-I554 PolarHBondContact N-O 3.38Å; I330-I555 HydrophobicContact CG2-CG2 4.47Å; I330-T556 PolarHBondContact O-N 2.96Å
331	L	95.7	Very high	87.5	Confident	0 Å²	0	44.6 Å²	44.6	0%	0	25%	0.246	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-103.8	109.4	170.7	-62.2	-177.4	0	0	0	110.2	L194 I329 K339 I460 A461 G463 T556 L558	L194-L331 HydrophobicContact CD1-CD1 4.26Å; L194-L331 HydrophobicContact CD1-CD2 4.4Å; L194-L331 HydrophobicContact CD2-CD2 4.15Å; L194-L331 HydrophobicContact CG-CD2 4.38Å; I329-L331 HydrophobicContact CG2-CD2 4.15Å; L331-K339 HydrophobicContact CB-CD 4.46Å; L331-K339 WeakPolarHBondContact O-CD 3.48Å; L331-I460 HydrophobicContact CD1-CG2 3.8Å; L331-I460 HydrophobicContact CG-CG2 4.04Å; L331-A461 PolarHBondContact N-O 3.21Å; L331-G463 PolarHBondContact O-N 3.17Å; L331-G463 VanDerWaalsContact O-N 3.09Å; L331-T556 WeakPolarHBondContact CA-O 3.09Å; L331-T556 HydrophobicContact CD2-CG2 4.07Å; L331-L558 HydrophobicContact CB-CD1 4.42Å; L331-L558 HydrophobicContact CD2-CD1 4.25Å
332	L	94.4	Very high	88.8	Confident	0 Å²	0	41.7 Å²	41.7	0%	0	23%	0.228	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-94.9	157.8	173.5	-49.7	178.8	0	0	0	110.5	I330 F465 L468 V534 L539 I555 T556 A557 L558	I330-L332 HydrophobicContact CG2-CD2 3.42Å; I330-L332 VanDerWaalsContact CG2-CD2 3.42Å; I330-L332 HydrophobicContact CG2-CG 3.97Å; L332-F465 HydrophobicContact CD2-CD2 3.26Å; L332-F465 HydrophobicContact CD2-CE2 3.29Å; L332-F465 HydrophobicContact CD2-CG 3.93Å; L332-F465 HydrophobicContact CD2-CZ 3.99Å; L332-L468 HydrophobicContact CD1-CD2 4.09Å; L332-V534 HydrophobicContact CD1-CB 4.18Å; L332-V534 HydrophobicContact CD1-CG1 3.76Å; L332-V534 HydrophobicContact CD1-CG2 3.93Å; L332-L539 HydrophobicContact CD2-CD2 4.34Å; L332-I555 HydrophobicContact CD1-CG2 3.68Å; L332-I555 HydrophobicContact CG-CG2 4.09Å; L332-T556 PolarHBondContact N-O 3.49Å; L332-A557 HydrophobicContact CB-CB 4.33Å; L332-L558 PolarHBondContact O-N 3.1Å
333	G	92	Very high	89.6	Confident	0 Å²	0	35 Å²	35	0%	0	19%	0.192	C	C	.	.			trans	145.3	167.9	167.1	0	0	0	0	0	112.7	K339 G463 A464	G333-K339 PolarHBondContact O-NZ 3.49Å; G333-G463 PolarHBondContact N-O 3.08Å; G333-A464 WeakPolarHBondContact O-CA 3.47Å
334	S	90	Very high	90.6	Very high	20 Å²	20	30.9 Å²	30.9	14%	0.14	18%	0.176	C	C	.	.			trans	-58.1	162.2	-173.6	-56.2	0	0	0	0	114.3	S337 K339 S560	S334-S337 WeakPolarHBondContact O-CB 3.44Å; S334-S337 PolarHBondContact O-N 2.9Å; S334-S337 PolarHBondContact O-OG 3.14Å; S334-K339 PolarHBondContact O-NZ 2.87Å; S334-S560 PolarHBondContact OG-OG 3.25Å
335	T	88.3	Confident	91.2	Very high	81 Å²	81	27.9 Å²	27.9	50%	0.497	16%	0.16	S	C	.	.	T	Hydrogen-bonded Turn	trans	-61.5	138.2	172.8	38.6	0	0	0	0	110.5	S337 A464	T335-S337 VanDerWaalsContact C-N 3.28Å; T335-S337 PolarHBondContact O-N 2.99Å; T335-A464 HydrophobicContact CG2-CB 4.33Å
336	G	86.8	Confident	91.8	Very high	25 Å²	25	19.4 Å²	19.4	26%	0.258	12%	0.121	S	C	.	.	T	Hydrogen-bonded Turn	trans	73	7.5	-179.2	0	0	0	0	0	116.1	G338 L561 A613	G336-G338 VanDerWaalsContact C-N 3.26Å; G336-G338 PolarHBondContact O-N 3.18Å; G336-L561 WeakPolarHBondContact O-CD1 3.37Å; G336-A613 WeakPolarHBondContact O-CB 3.22Å; G336-A613 PolarHBondContact O-N 2.88Å
337	S	90.4	Very high	91.9	Very high	7 Å²	7	18.5 Å²	18.5	5%	0.049	12%	0.117	C	C	.	.	S	Bend	trans	-74.3	-7.7	177.2	67.6	0	0	0	0	115.3	S334 T335	S334-S337 WeakPolarHBondContact O-CB 3.44Å; S334-S337 PolarHBondContact O-N 2.9Å; S334-S337 PolarHBondContact O-OG 3.14Å; T335-S337 VanDerWaalsContact C-N 3.28Å; T335-S337 PolarHBondContact O-N 2.99Å
338	G	90.6	Very high	91.9	Very high	22 Å²	22	21.5 Å²	21.5	23%	0.227	13%	0.127	C	C	.	.	S	Bend	trans	101.6	5.9	176.7	0	0	0	0	0	116.5	G336 T340 L341 L342	G336-G338 VanDerWaalsContact C-N 3.26Å; G336-G338 PolarHBondContact O-N 3.18Å; G338-T340 PolarHBondContact O-N 3.45Å; G338-L341 PolarHBondContact O-N 3.35Å; G338-L341 VanDerWaalsContact O-N 3.13Å; G338-L342 WeakPolarHBondContact O-CB 3.48Å; G338-L342 PolarHBondContact O-N 2.77Å
339	K	92.8	Very high	91.7	Very high	16 Å²	16	24.1 Å²	24.1	7%	0.07	14%	0.137	C	C	.	.	H	α-helix	trans	-44.2	-56.6	179	-63.5	-173.7	-63.8	-77.2	0	114.2	L331 G333 S334 L342 A343 C462 G463 L558	L331-K339 HydrophobicContact CB-CD 4.46Å; L331-K339 WeakPolarHBondContact O-CD 3.48Å; G333-K339 PolarHBondContact O-NZ 3.49Å; S334-K339 PolarHBondContact O-NZ 2.87Å; K339-L342 PolarHBondContact O-N 3.31Å; K339-A343 PolarHBondContact O-N 3.45Å; K339-C462 HydrophobicContact CB-CB 4.41Å; K339-G463 WeakPolarHBondContact CD-O 3.17Å; K339-G463 WeakPolarHBondContact CE-O 3.29Å; K339-L558 HydrophobicContact CG-CD1 4.31Å; K339-L558 HydrophobicContact CG-CD2 3.94Å
340	T	92	Very high	91.3	Very high	41 Å²	41	24.6 Å²	24.6	25%	0.252	14%	0.139	S	C	.	.	H	α-helix	trans	-65.6	-40.3	-178	-35.4	0	0	0	0	111.9	G338 A343 Q344 L356 D398	G338-T340 PolarHBondContact O-N 3.45Å; T340-A343 PolarHBondContact O-N 3.11Å; T340-Q344 WeakPolarHBondContact O-CB 3.44Å; T340-Q344 VanDerWaalsContact O-CG 3.28Å; T340-Q344 WeakPolarHBondContact O-CG 3.42Å; T340-Q344 PolarHBondContact O-N 3.11Å; T340-L356 HydrophobicContact CG2-CD1 3.85Å; T340-L356 HydrophobicContact CG2-CD2 3.77Å; T340-D398 WeakPolarHBondContact CB-OD2 3.28Å; T340-D398 WeakPolarHBondContact CG2-OD2 3.32Å; T340-D398 PolarHBondContact OG1-OD2 2.9Å
341	L	92.7	Very high	90.9	Very high	55 Å²	55	31.4 Å²	31.4	29%	0.288	18%	0.176	S	C	.	.	H	α-helix	trans	-63.1	-45.6	176.3	177.2	64.3	0	0	0	111.1	V184 G338 A343 Q344 T345	V184-L341 HydrophobicContact CG2-CD2 4.23Å; V184-L341 HydrophobicContact CG2-CG 4.2Å; G338-L341 PolarHBondContact O-N 3.35Å; G338-L341 VanDerWaalsContact O-N 3.13Å; L341-A343 VanDerWaalsContact C-N 3.31Å; L341-A343 PolarHBondContact O-N 3.27Å; L341-Q344 PolarHBondContact O-N 2.62Å; L341-T345 WeakPolarHBondContact O-CB 3.29Å; L341-T345 PolarHBondContact O-N 2.91Å; L341-T345 PolarHBondContact O-OG1 3.2Å; L341-T345 VanDerWaalsContact O-OG1 3.06Å
342	L	93.7	Very high	90.5	Very high	0 Å²	0	32.5 Å²	32.5	0%	0	18%	0.183	C	C	.	.	H	α-helix	trans	-58	-43.1	179.4	-177	65.1	0	0	0	111.5	L180 V184 A190 K191 L194 G338 K339 L346 L558	L180-L342 HydrophobicContact CD1-CD1 4.15Å; L180-L342 HydrophobicContact CD2-CD1 4.12Å; L180-L342 HydrophobicContact CG-CD1 4.5Å; V184-L342 HydrophobicContact CB-CD1 4.27Å; V184-L342 HydrophobicContact CG1-CD1 4.26Å; V184-L342 HydrophobicContact CG2-CB 4.26Å; V184-L342 HydrophobicContact CG2-CD1 3.98Å; A190-L342 HydrophobicContact CB-CD2 4.35Å; K191-L342 HydrophobicContact CG-CD1 4Å; L194-L342 HydrophobicContact CD1-CD1 4.19Å; L194-L342 HydrophobicContact CD1-CD2 3.42Å; L194-L342 VanDerWaalsContact CD1-CD2 3.42Å; L194-L342 HydrophobicContact CD1-CG 3.52Å; G338-L342 WeakPolarHBondContact O-CB 3.48Å; G338-L342 PolarHBondContact O-N 2.77Å; K339-L342 PolarHBondContact O-N 3.31Å; L342-L346 VanDerWaalsContact O-CB 3.23Å; L342-L346 WeakPolarHBondContact O-CB 3.24Å; L342-L346 PolarHBondContact O-N 2.99Å; L342-L346 VanDerWaalsContact O-N 3.11Å; L342-L558 HydrophobicContact CD2-CD2 4.36Å
343	A	92.1	Very high	90.3	Very high	0 Å²	0	33.3 Å²	33.3	0%	0	19%	0.188	C	C	.	.	H	α-helix	trans	-72.2	-36.8	176.8	0	0	0	0	0	113.2	K339 T340 L341 A347 V396	K339-A343 PolarHBondContact O-N 3.45Å; T340-A343 PolarHBondContact O-N 3.11Å; L341-A343 VanDerWaalsContact C-N 3.31Å; L341-A343 PolarHBondContact O-N 3.27Å; A343-A347 PolarHBondContact O-N 3.49Å; A343-V396 HydrophobicContact CB-CG1 4.14Å; A343-V396 HydrophobicContact CB-CG2 3.62Å
344	Q	91.6	Very high	90.4	Very high	64 Å²	64	35.1 Å²	35.1	30%	0.299	20%	0.196	S	C	.	.	H	α-helix	trans	-63.7	-52.1	173	-75.5	171.3	-14.2	0	0	111.9	T340 L341 L346 A347 H348 F354	T340-Q344 WeakPolarHBondContact O-CB 3.44Å; T340-Q344 VanDerWaalsContact O-CG 3.28Å; T340-Q344 WeakPolarHBondContact O-CG 3.42Å; T340-Q344 PolarHBondContact O-N 3.11Å; L341-Q344 PolarHBondContact O-N 2.62Å; Q344-L346 VanDerWaalsContact C-N 3.27Å; Q344-L346 PolarHBondContact O-N 3.16Å; Q344-A347 PolarHBondContact O-N 3.46Å; Q344-H348 PolarHBondContact O-CD2 3.23Å; Q344-H348 PolarHBondContact O-N 3.19Å; Q344-F354 HydrophobicContact CB-CZ 4.35Å; Q344-F354 HydrophobicContact CG-CE1 3.86Å; Q344-F354 HydrophobicContact CG-CZ 3.68Å
345	T	92.2	Very high	90.6	Very high	8 Å²	8	34.1 Å²	34.1	5%	0.049	19%	0.189	C	C	.	.	H	α-helix	trans	-58.4	-40.2	178.6	-60.1	0	0	0	0	111.5	Y179 L180 Y183 L341 Y349	Y179-T345 HydrophobicContact CD1-CG2 3.98Å; Y179-T345 HydrophobicContact CE1-CG2 3.61Å; L180-T345 HydrophobicContact CD2-CG2 3.89Å; Y183-T345 HydrophobicContact CD2-CG2 3.6Å; Y183-T345 HydrophobicContact CE2-CG2 4.32Å; Y183-T345 HydrophobicContact CG-CG2 3.82Å; L341-T345 WeakPolarHBondContact O-CB 3.29Å; L341-T345 PolarHBondContact O-N 2.91Å; L341-T345 PolarHBondContact O-OG1 3.2Å; L341-T345 VanDerWaalsContact O-OG1 3.06Å; T345-Y349 PolarHBondContact O-N 3.47Å; T345-Y349 VanDerWaalsContact O-N 3.07Å
346	L	92	Very high	90.8	Very high	1 Å²	1	32.4 Å²	32.4	1%	0.005	18%	0.176	C	C	.	.	H	α-helix	trans	-60	-48.5	175.9	179.6	60.3	0	0	0	112.2	I176 L180 L194 V198 L342 Q344 Y349 L350 I460	I176-L346 HydrophobicContact CG2-CD1 3.81Å; L180-L346 HydrophobicContact CD2-CB 4.1Å; L194-L346 HydrophobicContact CB-CD2 4.41Å; L194-L346 HydrophobicContact CD1-CD2 4.43Å; L194-L346 HydrophobicContact CD2-CD2 4.43Å; V198-L346 HydrophobicContact CG1-CD1 4.46Å; V198-L346 HydrophobicContact CG2-CD1 4.03Å; V198-L346 HydrophobicContact CG2-CD2 3.74Å; V198-L346 HydrophobicContact CG2-CG 4.17Å; L342-L346 VanDerWaalsContact O-CB 3.23Å; L342-L346 WeakPolarHBondContact O-CB 3.24Å; L342-L346 PolarHBondContact O-N 2.99Å; L342-L346 VanDerWaalsContact O-N 3.11Å; Q344-L346 VanDerWaalsContact C-N 3.27Å; Q344-L346 PolarHBondContact O-N 3.16Å; L346-Y349 WeakPolarHBondContact O-CB 3.45Å; L346-Y349 PolarHBondContact O-N 3.4Å; L346-L350 HydrophobicContact CD1-CD1 4.13Å; L346-L350 HydrophobicContact CG-CD1 4.15Å; L346-L350 WeakPolarHBondContact O-CD1 3.26Å; L346-L350 WeakPolarHBondContact O-CG 3.41Å; L346-L350 PolarHBondContact O-N 3.02Å; L346-I460 HydrophobicContact CD2-CD1 4.17Å
347	A	89.5	Confident	91.1	Very high	2 Å²	2	31.4 Å²	31.4	2%	0.017	17%	0.165	C	C	.	.	H	α-helix	trans	-68.7	-38.8	-179.5	0	0	0	0	0	112.8	A343 Q344 Y349 L350 N351 F354 I394	A343-A347 PolarHBondContact O-N 3.49Å; Q344-A347 PolarHBondContact O-N 3.46Å; A347-Y349 VanDerWaalsContact C-N 3.26Å; A347-Y349 PolarHBondContact O-N 2.88Å; A347-L350 PolarHBondContact O-N 3.19Å; A347-N351 PolarHBondContact O-N 2.89Å; A347-F354 HydrophobicContact CB-CB 3.87Å; A347-F354 HydrophobicContact CB-CD2 3.1Å; A347-F354 HydrophobicContact CB-CE2 3.67Å; A347-F354 HydrophobicContact CB-CG 3.64Å; A347-I394 HydrophobicContact CB-CD1 4.3Å
348	H	88.6	Confident	91.3	Very high	103 Å²	103	34.2 Å²	34.2	48%	0.477	18%	0.179	S	C	.	.	H	α-helix	trans	-59.3	-35.3	171.9	-78	-61	0	0	0	112.8	Q344 N351	Q344-H348 PolarHBondContact O-CD2 3.23Å; Q344-H348 PolarHBondContact O-N 3.19Å; H348-N351 PolarHBondContact O-OD1 3.22Å
349	Y	90.2	Very high	91.4	Very high	56 Å²	56	33.1 Å²	33.1	22%	0.22	17%	0.168	C	C	.	.	H	α-helix	trans	-68.9	-34.2	177.8	-172.2	-135.3	0	0	0	113.4	L171 I176 Y179 T345 L346 A347	L171-Y349 HydrophobicContact CD2-CD1 4.03Å; L171-Y349 HydrophobicContact CD2-CE1 3.51Å; L171-Y349 HydrophobicContact CG-CE1 4.48Å; I176-Y349 HydrophobicContact CB-CE1 4.25Å; I176-Y349 HydrophobicContact CG1-CD1 4.23Å; I176-Y349 HydrophobicContact CG1-CE1 3.86Å; I176-Y349 HydrophobicContact CG2-CD1 4.5Å; Y179-Y349 HydrophobicContact CD1-CD1 4.15Å; Y179-Y349 AromaticContact CD1-CD2 3.7Å; Y179-Y349 HydrophobicContact CD1-CD2 3.7Å; Y179-Y349 HydrophobicContact CD1-CE2 4.49Å; Y179-Y349 AromaticContact CD1-CG 3.52Å; Y179-Y349 HydrophobicContact CD1-CG 3.52Å; Y179-Y349 AromaticContact CD2-CD2 3.31Å; Y179-Y349 HydrophobicContact CD2-CD2 3.31Å; Y179-Y349 AromaticContact CD2-CE2 3.53Å; Y179-Y349 HydrophobicContact CD2-CE2 3.53Å; Y179-Y349 HydrophobicContact CD2-CG 4.03Å; Y179-Y349 AromaticContact CE1-CD2 3.96Å; Y179-Y349 HydrophobicContact CE1-CD2 3.96Å; Y179-Y349 AromaticContact CE1-CG 3.91Å; Y179-Y349 HydrophobicContact CE1-CG 3.91Å; Y179-Y349 AromaticContact CE2-CD2 3.59Å; Y179-Y349 HydrophobicContact CE2-CD2 3.59Å; Y179-Y349 HydrophobicContact CE2-CE2 4.14Å; Y179-Y349 HydrophobicContact CE2-CG 4.37Å; Y179-Y349 HydrophobicContact CG-CD1 4.07Å; Y179-Y349 AromaticContact CG-CD2 3.35Å; Y179-Y349 HydrophobicContact CG-CD2 3.35Å; Y179-Y349 HydrophobicContact CG-CE1 4.36Å; Y179-Y349 AromaticContact CG-CE2 3.72Å; Y179-Y349 HydrophobicContact CG-CE2 3.72Å; Y179-Y349 AromaticContact CG-CG 3.57Å; Y179-Y349 HydrophobicContact CG-CG 3.57Å; Y179-Y349 AromaticContact CZ-CD2 3.9Å; T345-Y349 PolarHBondContact O-N 3.47Å; T345-Y349 VanDerWaalsContact O-N 3.07Å; L346-Y349 WeakPolarHBondContact O-CB 3.45Å; L346-Y349 PolarHBondContact O-N 3.4Å; A347-Y349 VanDerWaalsContact C-N 3.26Å; A347-Y349 PolarHBondContact O-N 2.88Å
350	L	86.4	Confident	91.3	Very high	11 Å²	11	35.6 Å²	35.6	6%	0.058	19%	0.185	C	C	.	.	H	α-helix	trans	-83	-12.8	-174.3	-65.7	161.8	0	0	0	113.2	L171 V198 Y202 L346 A347 V352 I394	L171-L350 HydrophobicContact CD2-CD2 4.31Å; V198-L350 HydrophobicContact CG1-CD1 3.69Å; V198-L350 HydrophobicContact CG1-CD2 3.83Å; V198-L350 HydrophobicContact CG1-CG 4.38Å; Y202-L350 HydrophobicContact CD2-CD2 4.43Å; Y202-L350 HydrophobicContact CE2-CD1 3.99Å; Y202-L350 HydrophobicContact CE2-CD2 4.19Å; L346-L350 HydrophobicContact CD1-CD1 4.13Å; L346-L350 HydrophobicContact CG-CD1 4.15Å; L346-L350 WeakPolarHBondContact O-CD1 3.26Å; L346-L350 WeakPolarHBondContact O-CG 3.41Å; L346-L350 PolarHBondContact O-N 3.02Å; A347-L350 PolarHBondContact O-N 3.19Å; L350-V352 HydrophobicContact CB-CG1 4.22Å; L350-V352 HydrophobicContact CB-CG2 3.94Å; L350-V352 PolarHBondContact O-N 3.1Å; L350-I394 HydrophobicContact CD1-CD1 3.61Å
351	N	86.5	Confident	91.2	Very high	148 Å²	148	35.4 Å²	35.4	79%	0.791	19%	0.185	S	C	*	.	T	Hydrogen-bonded Turn	trans	54.3	35.4	-175.1	-61.2	-49.5	0	0	0	113.9	A347 H348	A347-N351 PolarHBondContact O-N 2.89Å; H348-N351 PolarHBondContact O-OD1 3.22Å
352	V	86.9	Confident	91.1	Very high	23 Å²	23	32.8 Å²	32.8	14%	0.139	17%	0.172	C	C	.	.			trans	-105.3	156	178.3	-63.8	0	0	0	0	111.4	Y202 L350 F354 I394	Y202-V352 HydrophobicContact CE1-CG1 4.22Å; L350-V352 HydrophobicContact CB-CG1 4.22Å; L350-V352 HydrophobicContact CB-CG2 3.94Å; L350-V352 PolarHBondContact O-N 3.1Å; V352-F354 PolarHBondContact O-N 3.1Å; V352-I394 HydrophobicContact CG2-CD1 3.81Å; V352-I394 HydrophobicContact CG2-CG1 3.9Å
353	P	91.6	Very high	91	Very high	17 Å²	17	33.8 Å²	33.8	11%	0.11	18%	0.177	C	C	.	.			trans	-55.6	131.8	172.6	-27.5	37.9	0	0	0	111.3	L379 A383 L389 G393 I394	P353-L379 HydrophobicContact CB-CD1 3.96Å; P353-L379 HydrophobicContact CB-CG 4.49Å; P353-L379 WeakPolarHBondContact O-CD1 3.1Å; P353-A383 HydrophobicContact CB-CB 3.85Å; P353-A383 HydrophobicContact CG-CB 3.67Å; P353-L389 HydrophobicContact CG-CB 3.9Å; P353-L389 WeakPolarHBondContact CG-O 3.21Å; P353-G393 CarbonylContact O-C 3.56Å; P353-G393 WeakPolarHBondContact O-CA 3.4Å; P353-I394 PolarHBondContact O-N 3.33Å
354	F	93.5	Very high	90.6	Very high	37 Å²	37	36.8 Å²	36.8	16%	0.162	19%	0.192	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-127.2	132.9	-174.1	175.7	-105.7	0	0	0	110.4	Q344 A347 V352 L356 N382 I394 V396	Q344-F354 HydrophobicContact CB-CZ 4.35Å; Q344-F354 HydrophobicContact CG-CE1 3.86Å; Q344-F354 HydrophobicContact CG-CZ 3.68Å; A347-F354 HydrophobicContact CB-CB 3.87Å; A347-F354 HydrophobicContact CB-CD2 3.1Å; A347-F354 HydrophobicContact CB-CE2 3.67Å; A347-F354 HydrophobicContact CB-CG 3.64Å; V352-F354 PolarHBondContact O-N 3.1Å; F354-L356 HydrophobicContact CE1-CB 3.96Å; F354-L356 HydrophobicContact CZ-CB 4.17Å; F354-N382 PolarHBondContact O-ND2 2.95Å; F354-I394 WeakPolarHBondContact CA-O 3.49Å; F354-I394 HydrophobicContact CD2-CB 4.42Å; F354-I394 HydrophobicContact CD2-CG2 4.5Å; F354-V396 HydrophobicContact CD2-CG2 4.39Å; F354-V396 HydrophobicContact CE2-CB 4.3Å; F354-V396 HydrophobicContact CE2-CG2 3.37Å; F354-V396 HydrophobicContact CZ-CB 4.38Å; F354-V396 HydrophobicContact CZ-CG2 3.84Å
355	A	93.6	Very high	90.3	Very high	0 Å²	0	37.2 Å²	37.2	0%	0	21%	0.206	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-127.9	119.4	169.6	0	0	0	0	0	110.3	R378 L379 I394 V395 V396	A355-R378 HydrophobicContact CB-CG 4.43Å; A355-L379 HydrophobicContact CB-CB 4.01Å; A355-L379 HydrophobicContact CB-CD1 3.95Å; A355-I394 PolarHBondContact N-O 3.13Å; A355-V395 WeakPolarHBondContact O-CA 3.31Å; A355-V396 PolarHBondContact O-N 3.16Å
356	L	93.7	Very high	89.9	Confident	44 Å²	44	40.6 Å²	40.6	23%	0.23	24%	0.243	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-87.9	130.4	162.1	-179.9	65.9	0	0	0	108.6	T340 F354 R378 V396 D398	T340-L356 HydrophobicContact CG2-CD1 3.85Å; T340-L356 HydrophobicContact CG2-CD2 3.77Å; F354-L356 HydrophobicContact CE1-CB 3.96Å; F354-L356 HydrophobicContact CZ-CB 4.17Å; L356-R378 VanDerWaalsContact O-CZ 3.24Å; L356-R378 PolarHBondContact O-NH1 2.97Å; L356-V396 HydrophobicContact CD1-CB 3.79Å; L356-V396 HydrophobicContact CD1-CG1 3.57Å; L356-D398 HydrophobicContact CD1-CB 4.14Å
357	Y	93.4	Very high	89.6	Confident	5 Å²	5	45.8 Å²	45.8	2%	0.02	26%	0.263	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-134	139.2	-178.8	-161.2	-72.5	0	0	0	109.7	S361 I362 E370 S374 T375 V396 D398	Y357-S361 WeakPolarHBondContact CE1-OG 3.49Å; Y357-S361 PolarHBondContact OH-OG 3.16Å; Y357-I362 HydrophobicContact CD1-CD1 4Å; Y357-I362 HydrophobicContact CD1-CG1 4.16Å; Y357-I362 HydrophobicContact CE1-CD1 3.6Å; Y357-I362 HydrophobicContact CE1-CG1 3.31Å; Y357-E370 WeakPolarHBondContact OH-CB 3.4Å; Y357-E370 PolarHBondContact OH-OE2 3.02Å; Y357-S374 WeakPolarHBondContact CE2-OG 3.46Å; Y357-S374 PolarHBondContact OH-OG 3.28Å; Y357-S374 VanDerWaalsContact OH-OG 3.07Å; Y357-T375 HydrophobicContact CD2-CG2 3.98Å; Y357-T375 WeakPolarHBondContact CD2-OG1 3.39Å; Y357-T375 WeakPolarHBondContact CE2-OG1 3.36Å; Y357-T375 HydrophobicContact CG-CG2 4.07Å; Y357-V396 PolarHBondContact N-O 2.06Å; Y357-D398 PolarHBondContact O-N 2.85Å
358	D	93.4	Very high	89.4	Confident	65 Å²	65	53 Å²	53	35%	0.348	31%	0.306	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-99.3	116.7	179.8	-179.3	-21.4	0	0	0	109.2	T360 S361	D358-T360 VanDerWaalsContact CG-OG1 3.22Å; D358-T360 PolarHBondContact O-N 2.87Å; D358-T360 VanDerWaalsContact O-N 3.1Å; D358-T360 WeakPolarHBondContact OD1-CB 3.45Å; D358-T360 WeakPolarHBondContact OD1-CG2 3.5Å; D358-T360 PolarHBondContact OD1-N 2.89Å; D358-T360 PolarHBondContact OD1-OG1 3.26Å; D358-T360 PolarHBondContact OD2-OG1 3.05Å; D358-S361 PolarHBondContact O-N 2.99Å; D358-S361 PolarHBondContact O-OG 3.05Å
359	C	92.3	Very high	89.2	Confident	0 Å²	0	50.3 Å²	50.3	0%	0	31%	0.306	C	S	.	.	G	3₁₀ helix	trans	-65.3	-13.9	-176.5	-74	0	0	0	0	114.1	S361 I362 D398 I400 I403	C359-S361 VanDerWaalsContact C-N 3.34Å; C359-I362 PolarHBondContact O-N 3.35Å; C359-D398 WeakPolarHBondContact CB-O 3.12Å; C359-D398 PolarHBondContact N-O 3.23Å; C359-I400 HydrophobicContact CB-CD1 4.36Å; C359-I400 VanDerWaalsContact SG-CD1 3.52Å; C359-I403 HydrophobicContact CB-CG2 3.97Å
360	T	91.1	Very high	89.2	Confident	67 Å²	67	52.2 Å²	52.2	41%	0.411	32%	0.317	S	S	.	.	G	3₁₀ helix	trans	-73.7	-20.8	178.3	66.8	0	0	0	0	114.1	D358 E399 K402	D358-T360 VanDerWaalsContact CG-OG1 3.22Å; D358-T360 PolarHBondContact O-N 2.87Å; D358-T360 VanDerWaalsContact O-N 3.1Å; D358-T360 WeakPolarHBondContact OD1-CB 3.45Å; D358-T360 WeakPolarHBondContact OD1-CG2 3.5Å; D358-T360 PolarHBondContact OD1-N 2.89Å; D358-T360 PolarHBondContact OD1-OG1 3.26Å; D358-T360 PolarHBondContact OD2-OG1 3.05Å; T360-E399 HydrophobicContact CG2-CB 4.08Å; T360-K402 HydrophobicContact CG2-CB 3.75Å; T360-K402 HydrophobicContact CG2-CG 3.76Å
361	S	90.6	Very high	89.3	Confident	38 Å²	38	55.4 Å²	55.4	27%	0.266	33%	0.334	S	S	.	.	G	3₁₀ helix	trans	-81.6	-15.7	176.2	71.3	0	0	0	0	113.4	Y357 D358 C359 E370	Y357-S361 WeakPolarHBondContact CE1-OG 3.49Å; Y357-S361 PolarHBondContact OH-OG 3.16Å; D358-S361 PolarHBondContact O-N 2.99Å; D358-S361 PolarHBondContact O-OG 3.05Å; C359-S361 VanDerWaalsContact C-N 3.34Å; S361-E370 WeakPolarHBondContact CB-OE2 3.05Å; S361-E370 PolarHBondContact O-N 2.82Å; S361-E370 PolarHBondContact OG-OE2 2.72Å
362	I	91	Very high	89.5	Confident	0 Å²	0	49 Å²	49	0%	0	30%	0.301	C	S	.	.	B	Isolated β-bridge	trans	-77	135.3	-176.4	-45.8	-178.8	0	0	0	110.4	Y357 C359 E370 V372 V421 M425	Y357-I362 HydrophobicContact CD1-CD1 4Å; Y357-I362 HydrophobicContact CD1-CG1 4.16Å; Y357-I362 HydrophobicContact CE1-CD1 3.6Å; Y357-I362 HydrophobicContact CE1-CG1 3.31Å; C359-I362 PolarHBondContact O-N 3.35Å; I362-E370 WeakPolarHBondContact CA-O 3.47Å; I362-V372 HydrophobicContact CG2-CB 4.44Å; I362-V372 HydrophobicContact CG2-CG2 3.87Å; I362-V421 HydrophobicContact CB-CG1 3.85Å; I362-V421 HydrophobicContact CB-CG2 4.17Å; I362-V421 HydrophobicContact CD1-CG1 4.23Å; I362-V421 HydrophobicContact CG2-CB 4.48Å; I362-V421 HydrophobicContact CG2-CG1 3.73Å; I362-V421 HydrophobicContact CG2-CG2 4Å; I362-V421 WeakPolarHBondContact O-CG2 3.4Å; I362-M425 HydrophobicContact CD1-SD 4.32Å
363	T	90.5	Very high	89.6	Confident	20 Å²	20	52.7 Å²	52.7	12%	0.123	32%	0.316	C	S	.	.			trans	-123	158.2	165.3	54.9	0	0	0	0	110.9	G369 E370	T363-G369 WeakPolarHBondContact OG1-CA 3.41Å; T363-G369 PolarHBondContact OG1-N 3.37Å; T363-E370 PolarHBondContact N-O 2.93Å; T363-E370 VanDerWaalsContact N-O 3.08Å
364	Q	84.9	Confident	89.5	Confident	64 Å²	64	54 Å²	54	30%	0.299	33%	0.325	S	S	.	.			trans	-55.1	141.1	165.3	-170.6	174.6	34.7	0	0	110.5	G366 Y367 V416	Q364-G366 PolarHBondContact O-N 2.9Å; Q364-Y367 HydrophobicContact CB-CD2 4.25Å; Q364-Y367 WeakPolarHBondContact O-CD2 3.39Å; Q364-Y367 PolarHBondContact O-N 3.46Å; Q364-V416 HydrophobicContact CB-CG1 4.17Å; Q364-V416 PolarHBondContact N-O 3.24Å
365	A	84.7	Confident	89.4	Confident	73 Å²	73	52.2 Å²	52.2	60%	0.603	32%	0.318	S	S	*	.	T	Hydrogen-bonded Turn	trans	-53.5	136.9	-179.2	0	0	0	0	0	112.3	D371	A365-D371 WeakPolarHBondContact CA-OD1 3.49Å
366	G	83	Confident	89.3	Confident	79 Å²	79	52.2 Å²	52.2	81%	0.814	32%	0.318	S	S	*	.	T	Hydrogen-bonded Turn	trans	91.7	2.5	-176.4	0	0	0	0	0	115.2	Q364	Q364-G366 PolarHBondContact O-N 2.9Å
367	Y	87.1	Confident	89.2	Confident	110 Å²	110	50.6 Å²	50.6	43%	0.431	31%	0.311	S	S	.	.	S	Bend	trans	-109.8	168.9	171.4	-68.4	-92.2	0	0	0	111.6	Q364 G369 V416	Q364-Y367 HydrophobicContact CB-CD2 4.25Å; Q364-Y367 WeakPolarHBondContact O-CD2 3.39Å; Q364-Y367 PolarHBondContact O-N 3.46Å; Y367-G369 PolarHBondContact O-N 2.96Å; Y367-V416 HydrophobicContact CD1-CG1 3.74Å; Y367-V416 HydrophobicContact CD1-CG2 4Å; Y367-V416 HydrophobicContact CD2-CB 4.42Å; Y367-V416 HydrophobicContact CD2-CG1 3.48Å; Y367-V416 VanDerWaalsContact CD2-CG1 3.48Å; Y367-V416 HydrophobicContact CD2-CG2 4.05Å; Y367-V416 HydrophobicContact CE1-CG1 4.19Å; Y367-V416 HydrophobicContact CE1-CG2 3.57Å; Y367-V416 HydrophobicContact CE2-CB 4.43Å; Y367-V416 HydrophobicContact CE2-CG1 3.95Å; Y367-V416 HydrophobicContact CE2-CG2 3.62Å; Y367-V416 HydrophobicContact CG-CB 4.44Å; Y367-V416 HydrophobicContact CG-CG1 3.34Å; Y367-V416 HydrophobicContact CG-CG2 4.22Å
368	V	84.8	Confident	89.1	Confident	153 Å²	153	56.3 Å²	56.3	93%	0.927	33%	0.333	S	S	*	.	S	Bend	trans	-83.5	103.1	-180	-177.9	0	0	0	0	109.4
369	G	84.7	Confident	89.1	Confident	46 Å²	46	53.2 Å²	53.2	47%	0.474	32%	0.316	S	S	.	.	S	Bend	trans	179.8	-164.5	178.2	0	0	0	0	0	109.8	T363 Y367	T363-G369 WeakPolarHBondContact OG1-CA 3.41Å; T363-G369 PolarHBondContact OG1-N 3.37Å; Y367-G369 PolarHBondContact O-N 2.96Å
370	E	88.7	Confident	89.1	Confident	97 Å²	97	53.3 Å²	53.3	45%	0.453	32%	0.317	S	S	.	.	B	Isolated β-bridge	trans	-89.6	135.2	169.9	-65.9	-178.1	156.8	0	0	110	Y357 S361 I362 T363	Y357-E370 WeakPolarHBondContact OH-CB 3.4Å; Y357-E370 PolarHBondContact OH-OE2 3.02Å; S361-E370 WeakPolarHBondContact CB-OE2 3.05Å; S361-E370 PolarHBondContact O-N 2.82Å; S361-E370 PolarHBondContact OG-OE2 2.72Å; I362-E370 WeakPolarHBondContact CA-O 3.47Å; T363-E370 PolarHBondContact N-O 2.93Å; T363-E370 VanDerWaalsContact N-O 3.08Å
371	D	89.9	Confident	89.1	Confident	78 Å²	78	54.3 Å²	54.3	42%	0.417	32%	0.317	S	S	.	.			trans	-75.5	149.7	173.4	-69.6	-58.7	0	0	0	110.7	A365 E373 S374	A365-D371 WeakPolarHBondContact CA-OD1 3.49Å; D371-E373 PolarHBondContact O-N 3.06Å; D371-E373 VanDerWaalsContact O-N 3.11Å; D371-S374 WeakPolarHBondContact O-CB 3.43Å; D371-S374 PolarHBondContact O-N 2.67Å; D371-S374 PolarHBondContact O-OG 3.44Å
372	V	90.3	Very high	89.1	Confident	14 Å²	14	56.5 Å²	56.5	9%	0.085	33%	0.326	C	S	.	.	T	Hydrogen-bonded Turn	trans	-57.3	-32.1	-178.4	-152.2	0	0	0	0	113	I362 S374 T375 A424 M425 L428	I362-V372 HydrophobicContact CG2-CB 4.44Å; I362-V372 HydrophobicContact CG2-CG2 3.87Å; V372-S374 PolarHBondContact O-N 3.23Å; V372-T375 VanDerWaalsContact O-CB 3.26Å; V372-T375 WeakPolarHBondContact O-CB 3.28Å; V372-T375 PolarHBondContact O-N 2.86Å; V372-T375 VanDerWaalsContact O-N 3.11Å; V372-T375 PolarHBondContact O-OG1 3.28Å; V372-T375 VanDerWaalsContact O-OG1 3.13Å; V372-A424 HydrophobicContact CG2-CB 3.59Å; V372-M425 HydrophobicContact CG1-CB 4.47Å; V372-M425 HydrophobicContact CG1-CG 3.52Å; V372-L428 HydrophobicContact CB-CD1 4.24Å; V372-L428 HydrophobicContact CG1-CD1 3.49Å; V372-L428 VanDerWaalsContact CG1-CD1 3.49Å; V372-L428 HydrophobicContact CG1-CG 4.46Å
373	E	89.7	Confident	89.1	Confident	99 Å²	99	56.8 Å²	56.8	46%	0.463	33%	0.328	S	S	.	.	T	Hydrogen-bonded Turn	trans	-63.3	-23.9	178.6	-59.5	-177.1	155.2	0	0	112.8	D371 T375 I376 G377 V434	D371-E373 PolarHBondContact O-N 3.06Å; D371-E373 VanDerWaalsContact O-N 3.11Å; E373-T375 PolarHBondContact O-N 3.25Å; E373-I376 PolarHBondContact O-N 3.33Å; E373-I376 VanDerWaalsContact O-N 3.11Å; E373-G377 PolarHBondContact O-N 2.83Å; E373-G377 VanDerWaalsContact O-N 3.1Å; E373-V434 HydrophobicContact CB-CG1 4.21Å; E373-V434 HydrophobicContact CG-CG1 3.94Å
374	S	88.9	Confident	89.1	Confident	44 Å²	44	61.1 Å²	61.1	31%	0.308	35%	0.35	S	S	.	.	H	α-helix	trans	-61.4	-25.9	174.5	72.6	0	0	0	0	112.9	Y357 D371 V372 I376 G377 R378	Y357-S374 WeakPolarHBondContact CE2-OG 3.46Å; Y357-S374 PolarHBondContact OH-OG 3.28Å; Y357-S374 VanDerWaalsContact OH-OG 3.07Å; D371-S374 WeakPolarHBondContact O-CB 3.43Å; D371-S374 PolarHBondContact O-N 2.67Å; D371-S374 PolarHBondContact O-OG 3.44Å; V372-S374 PolarHBondContact O-N 3.23Å; S374-I376 VanDerWaalsContact C-N 3.33Å; S374-I376 PolarHBondContact O-N 3.38Å; S374-G377 PolarHBondContact O-N 2.76Å; S374-R378 PolarHBondContact O-N 3.16Å
375	T	90.8	Very high	89.2	Confident	1 Å²	1	60 Å²	60	1%	0.006	35%	0.345	C	S	.	.	H	α-helix	trans	-60.1	-44	174.3	-56.1	0	0	0	0	111	Y357 V372 E373 L379 V395 L397	Y357-T375 HydrophobicContact CD2-CG2 3.98Å; Y357-T375 WeakPolarHBondContact CD2-OG1 3.39Å; Y357-T375 WeakPolarHBondContact CE2-OG1 3.36Å; Y357-T375 HydrophobicContact CG-CG2 4.07Å; V372-T375 VanDerWaalsContact O-CB 3.26Å; V372-T375 WeakPolarHBondContact O-CB 3.28Å; V372-T375 PolarHBondContact O-N 2.86Å; V372-T375 VanDerWaalsContact O-N 3.11Å; V372-T375 PolarHBondContact O-OG1 3.28Å; V372-T375 VanDerWaalsContact O-OG1 3.13Å; E373-T375 PolarHBondContact O-N 3.25Å; T375-L379 PolarHBondContact O-N 3.03Å; T375-V395 HydrophobicContact CG2-CG1 3.42Å; T375-V395 VanDerWaalsContact CG2-CG1 3.42Å; T375-V395 HydrophobicContact CG2-CG2 4.46Å; T375-L397 HydrophobicContact CG2-CD2 4.36Å
376	I	92.7	Very high	89.5	Confident	0 Å²	0	59.9 Å²	59.9	0%	0	33%	0.334	C	S	.	.	H	α-helix	trans	-73.1	-36.3	176.1	-52	-55.3	0	0	0	110.4	E373 S374 R378 L379 L380 L428 V436 V452 T454 I457 F459	E373-I376 PolarHBondContact O-N 3.33Å; E373-I376 VanDerWaalsContact O-N 3.11Å; S374-I376 VanDerWaalsContact C-N 3.33Å; S374-I376 PolarHBondContact O-N 3.38Å; I376-R378 VanDerWaalsContact C-N 3.32Å; I376-R378 PolarHBondContact O-N 3.08Å; I376-L379 WeakPolarHBondContact O-CB 3.29Å; I376-L379 PolarHBondContact O-N 3.13Å; I376-L380 WeakPolarHBondContact O-CB 3.38Å; I376-L380 PolarHBondContact O-N 2.86Å; I376-L428 HydrophobicContact CG1-CD1 4.44Å; I376-L428 HydrophobicContact CG1-CD2 4.28Å; I376-V436 HydrophobicContact CB-CG2 4.08Å; I376-V436 HydrophobicContact CG2-CG2 3.89Å; I376-V452 HydrophobicContact CG2-CB 4.04Å; I376-V452 HydrophobicContact CG2-CG1 3.91Å; I376-V452 HydrophobicContact CG2-CG2 4.31Å; I376-T454 HydrophobicContact CD1-CG2 3.88Å; I376-T454 HydrophobicContact CG1-CG2 4.2Å; I376-I457 HydrophobicContact CD1-CD1 4.09Å; I376-F459 HydrophobicContact CD1-CZ 4.47Å
377	G	90.9	Very high	89.9	Confident	9 Å²	9	57.9 Å²	57.9	9%	0.093	31%	0.306	C	S	.	.	H	α-helix	trans	-58.6	-39.9	173.3	0	0	0	0	0	113.8	E373 S374 L380 Q381	E373-G377 PolarHBondContact O-N 2.83Å; E373-G377 VanDerWaalsContact O-N 3.1Å; S374-G377 PolarHBondContact O-N 2.76Å; G377-L380 PolarHBondContact O-N 3.11Å; G377-Q381 VanDerWaalsContact O-CG 3.28Å; G377-Q381 WeakPolarHBondContact O-CG 3.43Å; G377-Q381 PolarHBondContact O-N 2.81Å
378	R	91.1	Very high	90.1	Very high	125 Å²	125	57.9 Å²	57.9	47%	0.472	31%	0.31	S	S	.	.	H	α-helix	trans	-67.6	-39.3	174.6	-169.6	173.6	-175.1	170.9	-1.2	112.3	A355 L356 S374 I376 Q381 N382	A355-R378 HydrophobicContact CB-CG 4.43Å; L356-R378 VanDerWaalsContact O-CZ 3.24Å; L356-R378 PolarHBondContact O-NH1 2.97Å; S374-R378 PolarHBondContact O-N 3.16Å; I376-R378 VanDerWaalsContact C-N 3.32Å; I376-R378 PolarHBondContact O-N 3.08Å; R378-Q381 PolarHBondContact O-N 3.15Å; R378-N382 PolarHBondContact O-N 3.11Å; R378-N382 VanDerWaalsContact O-N 3.16Å
379	L	92.9	Very high	90.4	Very high	0 Å²	0	53.1 Å²	53.1	0%	0	28%	0.279	C	S	.	.	H	α-helix	trans	-63.3	-43.9	174.8	-172	68.3	0	0	0	111.5	P353 A355 T375 I376 N382 A383 A390 V395 I457	P353-L379 HydrophobicContact CB-CD1 3.96Å; P353-L379 HydrophobicContact CB-CG 4.49Å; P353-L379 WeakPolarHBondContact O-CD1 3.1Å; A355-L379 HydrophobicContact CB-CB 4.01Å; A355-L379 HydrophobicContact CB-CD1 3.95Å; T375-L379 PolarHBondContact O-N 3.03Å; I376-L379 WeakPolarHBondContact O-CB 3.29Å; I376-L379 PolarHBondContact O-N 3.13Å; L379-N382 CarbonylContact O-C 3.29Å; L379-N382 PolarHBondContact O-N 3.21Å; L379-A383 WeakPolarHBondContact O-CB 3.5Å; L379-A383 PolarHBondContact O-N 3.37Å; L379-A390 VanDerWaalsContact CD2-O 3.29Å; L379-A390 WeakPolarHBondContact CD2-O 3.48Å; L379-V395 HydrophobicContact CD2-CG2 3.91Å; L379-I457 HydrophobicContact CD2-CD1 3.86Å; L379-I457 HydrophobicContact CD2-CG1 4.44Å; L379-I457 HydrophobicContact CD2-CG2 4.26Å
380	L	92.3	Very high	90.8	Very high	2 Å²	2	51 Å²	51	1%	0.01	26%	0.256	C	S	.	.	H	α-helix	trans	-65.7	-37.8	178.7	-174.5	65.4	0	0	0	112.4	I376 G377 N382 A383 N384 F385 V387 A390 F450	I376-L380 WeakPolarHBondContact O-CB 3.38Å; I376-L380 PolarHBondContact O-N 2.86Å; G377-L380 PolarHBondContact O-N 3.11Å; L380-N382 VanDerWaalsContact C-N 3.33Å; L380-N382 PolarHBondContact O-N 3.44Å; L380-A383 CarbonylContact O-C 3.44Å; L380-A383 PolarHBondContact O-N 2.86Å; L380-N384 PolarHBondContact O-N 3.37Å; L380-F385 HydrophobicContact CD2-CD1 4.24Å; L380-F385 HydrophobicContact CG-CD1 4.21Å; L380-F385 WeakPolarHBondContact O-CA 3.4Å; L380-F385 PolarHBondContact O-N 3.34Å; L380-V387 HydrophobicContact CD1-CG2 4.37Å; L380-A390 HydrophobicContact CD1-CB 4Å; L380-F450 HydrophobicContact CD2-CB 3.48Å; L380-F450 VanDerWaalsContact CD2-CB 3.48Å; L380-F450 HydrophobicContact CD2-CD1 4.37Å; L380-F450 HydrophobicContact CD2-CD2 3.72Å; L380-F450 HydrophobicContact CD2-CG 3.6Å
381	Q	91.2	Very high	90.9	Very high	88 Å²	88	48.7 Å²	48.7	41%	0.411	25%	0.246	S	C	.	.	H	α-helix	trans	-60	-42.7	171.7	-74.1	170.4	29.9	0	0	111.9	G377 R378 A383 N384 F385	G377-Q381 VanDerWaalsContact O-CG 3.28Å; G377-Q381 WeakPolarHBondContact O-CG 3.43Å; G377-Q381 PolarHBondContact O-N 2.81Å; R378-Q381 PolarHBondContact O-N 3.15Å; Q381-A383 VanDerWaalsContact C-N 3.31Å; Q381-N384 PolarHBondContact O-N 3.36Å; Q381-F385 HydrophobicContact CG-CE2 4.3Å; Q381-F385 HydrophobicContact CG-CZ 3.86Å
382	N	91	Very high	90.9	Very high	85 Å²	85	46.9 Å²	46.9	46%	0.455	24%	0.235	S	C	.	.	H	α-helix	trans	-74.6	-19	177.7	-68.8	-5.5	0	0	0	113.3	F354 R378 L379 L380 N384	F354-N382 PolarHBondContact O-ND2 2.95Å; R378-N382 PolarHBondContact O-N 3.11Å; R378-N382 VanDerWaalsContact O-N 3.16Å; L379-N382 CarbonylContact O-C 3.29Å; L379-N382 PolarHBondContact O-N 3.21Å; L380-N382 VanDerWaalsContact C-N 3.33Å; L380-N382 PolarHBondContact O-N 3.44Å; N382-N384 VanDerWaalsContact C-N 3.29Å
383	A	90.8	Very high	91	Very high	6 Å²	6	46.2 Å²	46.2	5%	0.05	23%	0.231	C	C	.	.	T	Hydrogen-bonded Turn	trans	-88.4	13.5	170.8	0	0	0	0	0	113.2	P353 L379 L380 Q381 F385 N386 L389 A390	P353-A383 HydrophobicContact CB-CB 3.85Å; P353-A383 HydrophobicContact CG-CB 3.67Å; L379-A383 WeakPolarHBondContact O-CB 3.5Å; L379-A383 PolarHBondContact O-N 3.37Å; L380-A383 CarbonylContact O-C 3.44Å; L380-A383 PolarHBondContact O-N 2.86Å; Q381-A383 VanDerWaalsContact C-N 3.31Å; A383-F385 PolarHBondContact O-N 3.31Å; A383-F385 VanDerWaalsContact O-N 3.14Å; A383-N386 VanDerWaalsContact O-CB 3.32Å; A383-N386 WeakPolarHBondContact O-CB 3.26Å; A383-N386 PolarHBondContact O-N 2.96Å; A383-L389 HydrophobicContact CB-CB 4.39Å; A383-A390 HydrophobicContact CB-CB 3.9Å
384	N	90	Very high	91.1	Very high	110 Å²	110	41.5 Å²	41.5	59%	0.588	21%	0.209	S	C	*	.	T	Hydrogen-bonded Turn	trans	52.8	33.3	-175.5	-71.6	63.9	0	0	0	113.8	L380 Q381 N382 N386	L380-N384 PolarHBondContact O-N 3.37Å; Q381-N384 PolarHBondContact O-N 3.36Å; N382-N384 VanDerWaalsContact C-N 3.29Å; N384-N386 PolarHBondContact O-N 3.06Å
385	F	88.2	Confident	91.5	Very high	41 Å²	41	39.4 Å²	39.4	18%	0.18	19%	0.194	C	C	.	.	T	Hydrogen-bonded Turn	trans	66	14.2	-176	-58.7	-101.9	0	0	0	115	L380 Q381 A383 V387 D438 K440 F450	L380-F385 HydrophobicContact CD2-CD1 4.24Å; L380-F385 HydrophobicContact CG-CD1 4.21Å; L380-F385 WeakPolarHBondContact O-CA 3.4Å; L380-F385 PolarHBondContact O-N 3.34Å; Q381-F385 HydrophobicContact CG-CE2 4.3Å; Q381-F385 HydrophobicContact CG-CZ 3.86Å; A383-F385 PolarHBondContact O-N 3.31Å; A383-F385 VanDerWaalsContact O-N 3.14Å; F385-V387 PolarHBondContact O-N 3.14Å; F385-D438 WeakPolarHBondContact CE1-OD1 3.34Å; F385-K440 HydrophobicContact CE2-CD 3.81Å; F385-K440 VanDerWaalsContact CE2-CE 3.43Å; F385-K440 VanDerWaalsContact CE2-NZ 3.32Å; F385-K440 HydrophobicContact CZ-CD 3.7Å; F385-K440 HydrophobicContact CZ-CG 4.06Å; F385-F450 HydrophobicContact CB-CE1 4.47Å; F385-F450 HydrophobicContact CB-CZ 4.23Å; F385-F450 HydrophobicContact CD1-CD2 4.17Å; F385-F450 AromaticContact CD1-CE2 3.55Å; F385-F450 HydrophobicContact CD1-CE2 3.55Å; F385-F450 AromaticContact CD1-CZ 3.85Å; F385-F450 HydrophobicContact CD1-CZ 3.85Å; F385-F450 HydrophobicContact CE1-CE2 4.17Å; F385-F450 HydrophobicContact CG-CZ 4.47Å
386	N	91.2	Very high	91.7	Very high	70 Å²	70	39.4 Å²	39.4	37%	0.374	19%	0.194	S	C	.	.			trans	-79.3	112.9	168.6	-174.1	-30	0	0	0	110.4	A383 N384 E388 L389 A390	A383-N386 VanDerWaalsContact O-CB 3.32Å; A383-N386 WeakPolarHBondContact O-CB 3.26Å; A383-N386 PolarHBondContact O-N 2.96Å; N384-N386 PolarHBondContact O-N 3.06Å; N386-E388 PolarHBondContact OD1-N 3.2Å; N386-L389 HydrophobicContact CB-CB 4.23Å; N386-L389 HydrophobicContact CB-CD1 4.04Å; N386-L389 HydrophobicContact CB-CG 4.22Å; N386-L389 PolarHBondContact OD1-N 2.84Å; N386-A390 WeakPolarHBondContact O-CB 3.43Å; N386-A390 PolarHBondContact O-N 2.82Å; N386-A390 VanDerWaalsContact O-N 3.08Å
387	V	91.7	Very high	91.8	Very high	37 Å²	37	39.5 Å²	39.5	22%	0.224	20%	0.195	C	C	.	.	H	α-helix	trans	-65	-42.9	-179.5	176.9	0	0	0	0	112	L380 F385 L389 A390 Q391 F450 V451 V452	L380-V387 HydrophobicContact CD1-CG2 4.37Å; F385-V387 PolarHBondContact O-N 3.14Å; V387-L389 VanDerWaalsContact C-N 3.33Å; V387-L389 PolarHBondContact O-N 2.84Å; V387-A390 PolarHBondContact O-N 2.99Å; V387-Q391 HydrophobicContact CG1-CG 4.29Å; V387-Q391 VanDerWaalsContact O-CG 3.3Å; V387-Q391 WeakPolarHBondContact O-CG 3.24Å; V387-Q391 PolarHBondContact O-N 3.14Å; V387-F450 HydrophobicContact CG2-CD1 4.16Å; V387-V451 WeakPolarHBondContact CG1-O 3.09Å; V387-V452 HydrophobicContact CG1-CG2 4.41Å
388	E	91	Very high	91.9	Very high	110 Å²	110	40.3 Å²	40.3	51%	0.514	20%	0.197	S	C	.	.	H	α-helix	trans	-63.1	-39.2	-178.1	-67.9	-170.2	-154.7	0	0	112.6	R209 N386 Q392	R209-E388 IonicContact NH2-OE2 3.29Å; R209-E388 PolarHBondContact NH2-OE2 3.17Å; N386-E388 PolarHBondContact OD1-N 3.2Å; E388-Q392 PolarHBondContact O-NE2 2.96Å
389	L	90.6	Very high	92.1	Very high	54 Å²	54	37.7 Å²	37.7	28%	0.283	19%	0.19	S	C	.	.	H	α-helix	trans	-70.7	-41.2	175.6	-64.9	178.9	0	0	0	111	V162 P353 A383 N386 V387 Q391 Q392 G393	V162-L389 HydrophobicContact CG2-CD1 4.37Å; P353-L389 HydrophobicContact CG-CB 3.9Å; P353-L389 WeakPolarHBondContact CG-O 3.21Å; A383-L389 HydrophobicContact CB-CB 4.39Å; N386-L389 HydrophobicContact CB-CB 4.23Å; N386-L389 HydrophobicContact CB-CD1 4.04Å; N386-L389 HydrophobicContact CB-CG 4.22Å; N386-L389 PolarHBondContact OD1-N 2.84Å; V387-L389 VanDerWaalsContact C-N 3.33Å; V387-L389 PolarHBondContact O-N 2.84Å; L389-Q391 VanDerWaalsContact C-N 3.31Å; L389-Q391 PolarHBondContact O-N 3.23Å; L389-Q392 PolarHBondContact O-N 3.24Å; L389-Q392 VanDerWaalsContact O-N 3.12Å; L389-G393 PolarHBondContact O-N 2.94Å
390	A	92.3	Very high	92.1	Very high	0 Å²	0	37.7 Å²	37.7	0%	0	19%	0.19	C	C	.	.	H	α-helix	trans	-61	-38.8	176.8	0	0	0	0	0	112.2	L379 L380 A383 N386 V387 Q392 G393	L379-A390 VanDerWaalsContact CD2-O 3.29Å; L379-A390 WeakPolarHBondContact CD2-O 3.48Å; L380-A390 HydrophobicContact CD1-CB 4Å; A383-A390 HydrophobicContact CB-CB 3.9Å; N386-A390 WeakPolarHBondContact O-CB 3.43Å; N386-A390 PolarHBondContact O-N 2.82Å; N386-A390 VanDerWaalsContact O-N 3.08Å; V387-A390 PolarHBondContact O-N 2.99Å; A390-Q392 PolarHBondContact O-N 3.11Å; A390-G393 PolarHBondContact O-N 3.27Å; A390-G393 VanDerWaalsContact O-N 3.13Å
391	Q	92	Very high	92.1	Very high	50 Å²	50	38 Å²	38	23%	0.234	19%	0.192	C	C	.	.	T	Hydrogen-bonded Turn	trans	-64.2	-19.6	176.1	-69.6	-177.8	9.1	0	0	113.9	V387 L389 V452 D453 N456 I457	V387-Q391 HydrophobicContact CG1-CG 4.29Å; V387-Q391 VanDerWaalsContact O-CG 3.3Å; V387-Q391 WeakPolarHBondContact O-CG 3.24Å; V387-Q391 PolarHBondContact O-N 3.14Å; L389-Q391 VanDerWaalsContact C-N 3.31Å; L389-Q391 PolarHBondContact O-N 3.23Å; Q391-V452 HydrophobicContact CG-CG1 4.13Å; Q391-D453 WeakPolarHBondContact CG-O 3.48Å; Q391-N456 CarbonylContact O-C 3.54Å; Q391-N456 WeakPolarHBondContact O-CB 3.45Å; Q391-I457 PolarHBondContact O-N 3.13Å
392	Q	89.4	Confident	92.1	Very high	40 Å²	40	38.5 Å²	38.5	19%	0.187	19%	0.192	C	C	.	.	T	Hydrogen-bonded Turn	trans	-102.5	5.1	177.9	-61.9	172.7	46.9	0	0	112.8	Y202 I205 E388 L389 A390	Y202-Q392 PolarHBondContact OH-O 2.65Å; Y202-Q392 VanDerWaalsContact OH-O 3.11Å; I205-Q392 HydrophobicContact CD1-CB 4.5Å; I205-Q392 HydrophobicContact CG2-CG 4.19Å; E388-Q392 PolarHBondContact O-NE2 2.96Å; L389-Q392 PolarHBondContact O-N 3.24Å; L389-Q392 VanDerWaalsContact O-N 3.12Å; A390-Q392 PolarHBondContact O-N 3.11Å
393	G	91.7	Very high	92.2	Very high	0 Å²	0	34.5 Å²	34.5	0%	0	17%	0.171	C	C	.	.			trans	-77.4	173.9	-175.9	0	0	0	0	0	114.6	P353 L389 A390 L458	P353-G393 CarbonylContact O-C 3.56Å; P353-G393 WeakPolarHBondContact O-CA 3.4Å; L389-G393 PolarHBondContact O-N 2.94Å; A390-G393 PolarHBondContact O-N 3.27Å; A390-G393 VanDerWaalsContact O-N 3.13Å; G393-L458 PolarHBondContact O-N 3.3Å; G393-L458 VanDerWaalsContact O-N 3.17Å
394	I	93.5	Very high	92.1	Very high	0 Å²	0	35 Å²	35	0%	0	18%	0.175	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-116.9	127.7	178.4	-56.9	177.2	0	0	0	109.4	A347 L350 V352 P353 F354 A355 V396 L458 I460	A347-I394 HydrophobicContact CB-CD1 4.3Å; L350-I394 HydrophobicContact CD1-CD1 3.61Å; V352-I394 HydrophobicContact CG2-CD1 3.81Å; V352-I394 HydrophobicContact CG2-CG1 3.9Å; P353-I394 PolarHBondContact O-N 3.33Å; F354-I394 WeakPolarHBondContact CA-O 3.49Å; F354-I394 HydrophobicContact CD2-CB 4.42Å; F354-I394 HydrophobicContact CD2-CG2 4.5Å; A355-I394 PolarHBondContact N-O 3.13Å; I394-V396 HydrophobicContact CG2-CG2 4.43Å; I394-L458 HydrophobicContact CD1-CD2 4.38Å; I394-L458 HydrophobicContact CG1-CB 4.23Å; I394-L458 HydrophobicContact CG1-CD2 4.33Å; I394-I460 HydrophobicContact CG2-CD1 3.9Å; I394-I460 HydrophobicContact CG2-CG1 4.32Å
395	V	95.2	Very high	91.7	Very high	0 Å²	0	31.3 Å²	31.3	0%	0	16%	0.157	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-108.3	123.5	173.4	175.7	0	0	0	0	109	A355 T375 L379 L397 I457 L458 F459 I460	A355-V395 WeakPolarHBondContact O-CA 3.31Å; T375-V395 HydrophobicContact CG2-CG1 3.42Å; T375-V395 VanDerWaalsContact CG2-CG1 3.42Å; T375-V395 HydrophobicContact CG2-CG2 4.46Å; L379-V395 HydrophobicContact CD2-CG2 3.91Å; V395-L397 HydrophobicContact CG1-CD2 3.92Å; V395-L397 HydrophobicContact CG1-CG 4.18Å; V395-I457 HydrophobicContact CB-CG2 4.37Å; V395-I457 HydrophobicContact CG2-CG2 3.71Å; V395-L458 PolarHBondContact N-O 3.22Å; V395-F459 HydrophobicContact CB-CD1 3.84Å; V395-F459 HydrophobicContact CB-CE1 3.98Å; V395-F459 HydrophobicContact CG1-CD1 3.87Å; V395-F459 HydrophobicContact CG1-CE1 3.97Å; V395-F459 HydrophobicContact CG2-CE1 4.24Å; V395-F459 WeakPolarHBondContact O-CA 3.46Å; V395-I460 PolarHBondContact O-N 3.3Å
396	V	95.4	Very high	91	Very high	0 Å²	0	38.2 Å²	38.2	0%	0	19%	0.187	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-104.6	123.4	172.4	-178.3	0	0	0	0	109.3	A343 F354 A355 L356 Y357 I394 I460	A343-V396 HydrophobicContact CB-CG1 4.14Å; A343-V396 HydrophobicContact CB-CG2 3.62Å; F354-V396 HydrophobicContact CD2-CG2 4.39Å; F354-V396 HydrophobicContact CE2-CB 4.3Å; F354-V396 HydrophobicContact CE2-CG2 3.37Å; F354-V396 HydrophobicContact CZ-CB 4.38Å; F354-V396 HydrophobicContact CZ-CG2 3.84Å; A355-V396 PolarHBondContact O-N 3.16Å; L356-V396 HydrophobicContact CD1-CB 3.79Å; L356-V396 HydrophobicContact CD1-CG1 3.57Å; Y357-V396 PolarHBondContact N-O 2.06Å; I394-V396 HydrophobicContact CG2-CG2 4.43Å; V396-I460 CarbonylContact C-O 3.51Å; V396-I460 VanDerWaalsContact CA-O 3.28Å; V396-I460 WeakPolarHBondContact CA-O 3.42Å; V396-I460 HydrophobicContact CG2-CB 4.33Å
397	L	94.9	Very high	89.7	Confident	2 Å²	2	40.1 Å²	40.1	1%	0.01	20%	0.202	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-105.2	96.1	-179.9	-60	167.2	0	0	0	107.8	T375 V395 M425 F459 I460 A461 C462	T375-L397 HydrophobicContact CG2-CD2 4.36Å; V395-L397 HydrophobicContact CG1-CD2 3.92Å; V395-L397 HydrophobicContact CG1-CG 4.18Å; L397-M425 HydrophobicContact CD1-CE 3.38Å; L397-M425 HydrophobicContact CD2-CE 3.58Å; L397-M425 HydrophobicContact CG-CE 4.01Å; L397-F459 HydrophobicContact CD1-CD1 4.02Å; L397-I460 PolarHBondContact N-O 2.68Å; L397-A461 HydrophobicContact CB-CB 4.39Å; L397-A461 CarbonylContact O-C 3.55Å; L397-A461 WeakPolarHBondContact O-CA 3.34Å; L397-C462 PolarHBondContact O-N 2.95Å
398	D	94.3	Very high	88	Confident	27 Å²	27	41.4 Å²	41.4	14%	0.144	22%	0.222	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-86.7	160.8	179.6	-142.1	-18.6	0	0	0	111.9	T340 L356 Y357 C359 I400 C462	T340-D398 WeakPolarHBondContact CB-OD2 3.28Å; T340-D398 WeakPolarHBondContact CG2-OD2 3.32Å; T340-D398 PolarHBondContact OG1-OD2 2.9Å; L356-D398 HydrophobicContact CD1-CB 4.14Å; Y357-D398 PolarHBondContact O-N 2.85Å; C359-D398 WeakPolarHBondContact CB-O 3.12Å; C359-D398 PolarHBondContact N-O 3.23Å; D398-I400 VanDerWaalsContact C-N 3.27Å; D398-I400 PolarHBondContact O-N 3.15Å; D398-C462 WeakPolarHBondContact OD1-CB 3.13Å
399	E	94	Very high	86	Confident	69 Å²	69	43.6 Å²	43.6	32%	0.322	23%	0.232	S	C	.	.			trans	55.8	32.7	-176.5	-55.9	-141.5	177.5	0	0	115.2	T360 D401 K402 C462	T360-E399 HydrophobicContact CG2-CB 4.08Å; E399-D401 PolarHBondContact O-N 3.03Å; E399-K402 HydrophobicContact CB-CG 3.89Å; E399-K402 WeakPolarHBondContact O-CB 3.44Å; E399-K402 WeakPolarHBondContact O-CG 3.38Å; E399-K402 PolarHBondContact O-N 2.85Å; E399-K402 WeakPolarHBondContact OE2-CE 3.48Å; E399-K402 WeakPolarHBondContact OE2-CG 3.15Å; E399-K402 IonicContact OE2-NZ 3.55Å; E399-C462 PolarHBondContact N-O 3.07Å; E399-C462 VanDerWaalsContact N-O 3.13Å
400	I	93.7	Very high	84.2	Confident	1 Å²	1	47.9 Å²	47.9	1%	0.005	25%	0.25	C	C	.	.	G	3₁₀ helix	trans	-59.7	-22.1	-179.8	-156.5	70.7	0	0	0	113.5	C359 D398 K402 I403 M425 A461 C462 F465 F548	C359-I400 HydrophobicContact CB-CD1 4.36Å; C359-I400 VanDerWaalsContact SG-CD1 3.52Å; D398-I400 VanDerWaalsContact C-N 3.27Å; D398-I400 PolarHBondContact O-N 3.15Å; I400-K402 PolarHBondContact O-N 3.43Å; I400-I403 HydrophobicContact CD1-CD1 3.58Å; I400-I403 HydrophobicContact CD1-CG1 4.06Å; I400-I403 HydrophobicContact CG1-CD1 4.37Å; I400-I403 HydrophobicContact CG1-CG1 4.41Å; I400-I403 WeakPolarHBondContact O-CG1 3.38Å; I400-I403 PolarHBondContact O-N 3.28Å; I400-M425 HydrophobicContact CD1-CE 4.5Å; I400-A461 HydrophobicContact CB-CB 4.35Å; I400-A461 HydrophobicContact CG1-CB 4.24Å; I400-A461 HydrophobicContact CG2-CB 4.29Å; I400-C462 WeakPolarHBondContact CG2-O 3.43Å; I400-C462 PolarHBondContact N-O 2.85Å; I400-F465 HydrophobicContact CG2-CE2 3.72Å; I400-F465 HydrophobicContact CG2-CZ 3.7Å; I400-F548 HydrophobicContact CD1-CE1 4.37Å; I400-F548 HydrophobicContact CD1-CZ 3.78Å; I400-F548 HydrophobicContact CG1-CE1 4.13Å; I400-F548 HydrophobicContact CG1-CZ 4.04Å
401	D	93	Very high	82.5	Confident	9 Å²	9	57.1 Å²	57.1	5%	0.048	30%	0.298	C	S	.	.	G	3₁₀ helix	trans	-71	-8.2	174.7	69.5	-82.6	0	0	0	114	E399 S404 G463 A464 F465 Y542	E399-D401 PolarHBondContact O-N 3.03Å; D401-S404 PolarHBondContact O-OG 3.4Å; D401-G463 WeakPolarHBondContact OD1-CA 3.33Å; D401-A464 PolarHBondContact OD1-N 3.27Å; D401-F465 HydrophobicContact CB-CD1 4.09Å; D401-F465 HydrophobicContact CB-CD2 4Å; D401-F465 HydrophobicContact CB-CE1 4.22Å; D401-F465 HydrophobicContact CB-CE2 4.14Å; D401-F465 HydrophobicContact CB-CG 3.99Å; D401-F465 HydrophobicContact CB-CZ 4.26Å; D401-Y542 HydrophobicContact CB-CE1 4.35Å
402	K	91.4	Very high	80.8	Confident	97 Å²	97	59.9 Å²	59.9	42%	0.422	32%	0.323	S	S	.	.	G	3₁₀ helix	trans	-86.8	-26.6	177.7	-58.5	-64.6	177.5	-69.3	0	113.5	T360 E399 I400 S404	T360-K402 HydrophobicContact CG2-CB 3.75Å; T360-K402 HydrophobicContact CG2-CG 3.76Å; E399-K402 HydrophobicContact CB-CG 3.89Å; E399-K402 WeakPolarHBondContact O-CB 3.44Å; E399-K402 WeakPolarHBondContact O-CG 3.38Å; E399-K402 PolarHBondContact O-N 2.85Å; E399-K402 WeakPolarHBondContact OE2-CE 3.48Å; E399-K402 WeakPolarHBondContact OE2-CG 3.15Å; E399-K402 IonicContact OE2-NZ 3.55Å; I400-K402 PolarHBondContact O-N 3.43Å; K402-S404 PolarHBondContact O-N 3.13Å
403	I	91.4	Very high	79.9	Confident	1 Å²	1	63.1 Å²	63.1	1%	0.005	35%	0.346	C	S	.	.	S	Bend	trans	-85.8	9.3	176.1	68.9	166.1	0	0	0	112.7	C359 I400 S405 S417 G418 V421 Q422 M425	C359-I403 HydrophobicContact CB-CG2 3.97Å; I400-I403 HydrophobicContact CD1-CD1 3.58Å; I400-I403 HydrophobicContact CD1-CG1 4.06Å; I400-I403 HydrophobicContact CG1-CD1 4.37Å; I400-I403 HydrophobicContact CG1-CG1 4.41Å; I400-I403 WeakPolarHBondContact O-CG1 3.38Å; I400-I403 PolarHBondContact O-N 3.28Å; I403-S405 PolarHBondContact O-N 3.37Å; I403-S417 WeakPolarHBondContact CG2-O 3.39Å; I403-G418 CarbonylContact O-C 3.59Å; I403-G418 VanDerWaalsContact O-C 3.29Å; I403-G418 WeakPolarHBondContact O-CA 2.88Å; I403-V421 HydrophobicContact CD1-CG1 3.94Å; I403-V421 HydrophobicContact CG2-CB 4.5Å; I403-V421 HydrophobicContact CG2-CG1 4.24Å; I403-Q422 HydrophobicContact CD1-CG 3.72Å; I403-Q422 HydrophobicContact CG1-CG 4.08Å; I403-Q422 PolarHBondContact O-NE2 2.84Å; I403-M425 HydrophobicContact CD1-SD 4.02Å
404	S	89.5	Confident	79	Confident	18 Å²	18	72.8 Å²	72.8	13%	0.126	38%	0.382	C	S	.	.			trans	-64.4	128.5	173.7	62.7	0	0	0	0	111.3	D401 K402 K406 G543 M544	D401-S404 PolarHBondContact O-OG 3.4Å; K402-S404 PolarHBondContact O-N 3.13Å; S404-K406 PolarHBondContact O-N 2.77Å; S404-G543 CarbonylContact C-O 3.56Å; S404-G543 WeakPolarHBondContact CA-O 3.44Å; S404-M544 VanDerWaalsContact CA-CE 3.49Å; S404-M544 VanDerWaalsContact CB-CE 3.47Å
405	S	82.6	Confident	78.4	Confident	32 Å²	32	75.9 Å²	75.9	22%	0.224	40%	0.399	C	S	.	.			trans	-61.2	124.5	171.3	-177.1	0	0	0	0	109.3	I403 T407 G543	I403-S405 PolarHBondContact O-N 3.37Å; S405-T407 PolarHBondContact O-N 3.21Å; S405-G543 PolarHBondContact N-O 2.96Å; S405-G543 WeakPolarHBondContact O-CA 3.25Å
406	K	71.7	Confident	77.7	Confident	186 Å²	186	77.1 Å²	77.1	81%	0.809	41%	0.407	S	S	*	.			trans	-74.8	98	-177.5	-70.3	176.8	-176.9	168.7	0	109.8	S404 G408	S404-K406 PolarHBondContact O-N 2.77Å; K406-G408 PolarHBondContact O-N 2.68Å
407	T	63.7	Low	77.1	Confident	110 Å²	110	79.8 Å²	79.8	68%	0.675	43%	0.425	S	S	*	.	T	Hydrogen-bonded Turn	trans	-56.7	94.9	174.8	32	0	0	0	0	111.5	S405	S405-T407 PolarHBondContact O-N 3.21Å
408	G	56.3	Low	76.8	Confident	63 Å²	63	79.9 Å²	79.9	65%	0.649	43%	0.427	S	S	*	.	T	Hydrogen-bonded Turn	trans	160.6	-22	171.3	0	0	0	0	0	118.1	K406	K406-G408 PolarHBondContact O-N 2.68Å
409	H	49.6	Very low	76.4	Confident	156 Å²	156	82.7 Å²	82.7	72%	0.722	44%	0.439	S	S	*	.	S	Bend	trans	-135	108.9	-169.6	-74.1	-70.4	0	0	0	115.6
410	H	52.3	Low	76.2	Confident	144 Å²	144	79.8 Å²	79.8	67%	0.667	43%	0.428	S	S	*	.			trans	63	104.2	157.4	-55.1	-69.7	0	0	0	119.8	S412	H410-S412 PolarHBondContact O-N 2.76Å
411	L	56.9	Low	76.1	Confident	194 Å²	194	79.8 Å²	79.8	100%	1.016	43%	0.427	S	S	*	.	T	Hydrogen-bonded Turn	trans	-55.2	3.9	159.2	-89.1	75.6	0	0	0	115.6
412	S	57.5	Low	76	Confident	108 Å²	108	79.3 Å²	79.3	76%	0.755	43%	0.425	S	S	*	.	T	Hydrogen-bonded Turn	trans	-94.5	-31.4	-169.8	-166.6	0	0	0	0	113.4	H410	H410-S412 PolarHBondContact O-N 2.76Å
413	T	68.7	Low	76	Confident	108 Å²	108	78.4 Å²	78.4	66%	0.663	42%	0.422	S	S	*	.	S	Bend	trans	-108.7	123	-178.6	47.6	0	0	0	0	109.9	D415	T413-D415 PolarHBondContact O-N 2.67Å
414	R	73.5	Confident	76	Confident	204 Å²	204	79.8 Å²	79.8	77%	0.77	43%	0.434	S	S	*	.			trans	-58	124.7	173.3	-75.5	-179.6	165.4	176.9	-6	110.1	V416	R414-V416 PolarHBondContact O-N 3.05Å; R414-V416 VanDerWaalsContact O-N 3.14Å
415	D	80.9	Confident	76.2	Confident	64 Å²	64	79.1 Å²	79.1	34%	0.342	43%	0.429	S	S	.	.			trans	-81	92.2	173	-175.7	10.8	0	0	0	110.3	T413 S417 G418 E419 G420	T413-D415 PolarHBondContact O-N 2.67Å; D415-S417 VanDerWaalsContact C-N 3.3Å; D415-S417 PolarHBondContact O-N 3.12Å; D415-S417 PolarHBondContact OD1-N 3.07Å; D415-G418 PolarHBondContact OD1-N 3.47Å; D415-G418 WeakPolarHBondContact OD2-CA 3.35Å; D415-G418 PolarHBondContact OD2-N 3.36Å; D415-E419 HydrophobicContact CB-CB 4.34Å; D415-E419 PolarHBondContact OD2-N 2.79Å; D415-G420 WeakPolarHBondContact O-CA 3.44Å; D415-G420 PolarHBondContact O-N 3.35Å
416	V	80.7	Confident	76.7	Confident	27 Å²	27	78.4 Å²	78.4	16%	0.164	42%	0.422	C	S	.	.	T	Hydrogen-bonded Turn	trans	-70.9	-23.8	-176.5	172.3	0	0	0	0	112.9	Q364 Y367 R414	Q364-V416 HydrophobicContact CB-CG1 4.17Å; Q364-V416 PolarHBondContact N-O 3.24Å; Y367-V416 HydrophobicContact CD1-CG1 3.74Å; Y367-V416 HydrophobicContact CD1-CG2 4Å; Y367-V416 HydrophobicContact CD2-CB 4.42Å; Y367-V416 HydrophobicContact CD2-CG1 3.48Å; Y367-V416 VanDerWaalsContact CD2-CG1 3.48Å; Y367-V416 HydrophobicContact CD2-CG2 4.05Å; Y367-V416 HydrophobicContact CE1-CG1 4.19Å; Y367-V416 HydrophobicContact CE1-CG2 3.57Å; Y367-V416 HydrophobicContact CE2-CB 4.43Å; Y367-V416 HydrophobicContact CE2-CG1 3.95Å; Y367-V416 HydrophobicContact CE2-CG2 3.62Å; Y367-V416 HydrophobicContact CG-CB 4.44Å; Y367-V416 HydrophobicContact CG-CG1 3.34Å; Y367-V416 HydrophobicContact CG-CG2 4.22Å; R414-V416 PolarHBondContact O-N 3.05Å; R414-V416 VanDerWaalsContact O-N 3.14Å
417	S	83.5	Confident	77.5	Confident	56 Å²	56	76.3 Å²	76.3	39%	0.392	41%	0.413	S	S	.	.	T	Hydrogen-bonded Turn	trans	-113.5	-29.7	-169.3	178.3	0	0	0	0	112.9	I403 D415 V421	I403-S417 WeakPolarHBondContact CG2-O 3.39Å; D415-S417 VanDerWaalsContact C-N 3.3Å; D415-S417 PolarHBondContact O-N 3.12Å; D415-S417 PolarHBondContact OD1-N 3.07Å; S417-V421 VanDerWaalsContact O-CG2 3.25Å; S417-V421 WeakPolarHBondContact O-CG2 3.47Å
418	G	87.1	Confident	78.9	Confident	4 Å²	4	71.6 Å²	71.6	4%	0.041	38%	0.384	C	S	.	.	T	Hydrogen-bonded Turn	trans	-89.8	-94.7	170.8	0	0	0	0	0	112.2	I403 D415 G420 V421 Q422	I403-G418 CarbonylContact O-C 3.59Å; I403-G418 VanDerWaalsContact O-C 3.29Å; I403-G418 WeakPolarHBondContact O-CA 2.88Å; D415-G418 PolarHBondContact OD1-N 3.47Å; D415-G418 WeakPolarHBondContact OD2-CA 3.35Å; D415-G418 PolarHBondContact OD2-N 3.36Å; G418-G420 VanDerWaalsContact C-N 3.33Å; G418-G420 PolarHBondContact O-N 2.8Å; G418-V421 WeakPolarHBondContact O-CB 3.43Å; G418-V421 PolarHBondContact O-N 3.05Å; G418-Q422 PolarHBondContact O-N 3.35Å; G418-Q422 VanDerWaalsContact O-N 3.17Å
419	E	87.3	Confident	80.6	Confident	86 Å²	86	68.7 Å²	68.7	40%	0.402	35%	0.354	S	S	.	.	H	α-helix	trans	-57	-41.2	-172.5	-166.2	-176.8	140.3	0	0	113.5	D415 V421 Q422 Q423 I545	D415-E419 HydrophobicContact CB-CB 4.34Å; D415-E419 PolarHBondContact OD2-N 2.79Å; E419-V421 PolarHBondContact O-N 2.99Å; E419-Q422 PolarHBondContact O-N 3.31Å; E419-Q423 HydrophobicContact CG-CG 4.38Å; E419-Q423 WeakPolarHBondContact O-CG 3.35Å; E419-Q423 PolarHBondContact O-N 2.85Å; E419-I545 HydrophobicContact CG-CG2 3.88Å
420	G	88.2	Confident	82.5	Confident	8 Å²	8	66.4 Å²	66.4	8%	0.082	34%	0.343	C	S	.	.	H	α-helix	trans	-60.7	-30.6	178.4	0	0	0	0	0	113.9	D415 G418 A424	D415-G420 WeakPolarHBondContact O-CA 3.44Å; D415-G420 PolarHBondContact O-N 3.35Å; G418-G420 VanDerWaalsContact C-N 3.33Å; G418-G420 PolarHBondContact O-N 2.8Å; G420-A424 WeakPolarHBondContact O-CB 3.35Å; G420-A424 PolarHBondContact O-N 2.99Å
421	V	91.6	Very high	84.2	Confident	0 Å²	0	60.9 Å²	60.9	0%	0	33%	0.325	C	S	.	.	H	α-helix	trans	-75.7	-46.9	173.9	174.1	0	0	0	0	110.4	I362 I403 S417 G418 E419 Q423 A424 M425	I362-V421 HydrophobicContact CB-CG1 3.85Å; I362-V421 HydrophobicContact CB-CG2 4.17Å; I362-V421 HydrophobicContact CD1-CG1 4.23Å; I362-V421 HydrophobicContact CG2-CB 4.48Å; I362-V421 HydrophobicContact CG2-CG1 3.73Å; I362-V421 HydrophobicContact CG2-CG2 4Å; I362-V421 WeakPolarHBondContact O-CG2 3.4Å; I403-V421 HydrophobicContact CD1-CG1 3.94Å; I403-V421 HydrophobicContact CG2-CB 4.5Å; I403-V421 HydrophobicContact CG2-CG1 4.24Å; S417-V421 VanDerWaalsContact O-CG2 3.25Å; S417-V421 WeakPolarHBondContact O-CG2 3.47Å; G418-V421 WeakPolarHBondContact O-CB 3.43Å; G418-V421 PolarHBondContact O-N 3.05Å; E419-V421 PolarHBondContact O-N 2.99Å; V421-Q423 VanDerWaalsContact C-N 3.29Å; V421-Q423 PolarHBondContact O-N 3.22Å; V421-A424 PolarHBondContact O-N 2.86Å; V421-A424 VanDerWaalsContact O-N 3.14Å; V421-M425 HydrophobicContact CG1-CG 4.26Å; V421-M425 HydrophobicContact CG1-SD 3.74Å; V421-M425 VanDerWaalsContact O-CG 3.29Å; V421-M425 WeakPolarHBondContact O-CG 3.38Å; V421-M425 PolarHBondContact O-N 3.31Å
422	Q	92.7	Very high	85.8	Confident	0 Å²	0	53.1 Å²	53.1	0%	0	29%	0.287	C	S	.	.	H	α-helix	trans	-53.9	-47	176.6	-64.2	-175.7	48.9	0	0	111.4	I403 G418 E419 M425 L426 G543 I545 F548	I403-Q422 HydrophobicContact CD1-CG 3.72Å; I403-Q422 HydrophobicContact CG1-CG 4.08Å; I403-Q422 PolarHBondContact O-NE2 2.84Å; G418-Q422 PolarHBondContact O-N 3.35Å; G418-Q422 VanDerWaalsContact O-N 3.17Å; E419-Q422 PolarHBondContact O-N 3.31Å; Q422-M425 PolarHBondContact O-N 3.1Å; Q422-L426 PolarHBondContact O-N 2.98Å; Q422-G543 PolarHBondContact NE2-O 3.45Å; Q422-I545 HydrophobicContact CB-CD1 3.87Å; Q422-I545 HydrophobicContact CB-CG1 4.16Å; Q422-F548 HydrophobicContact CB-CD2 4.28Å
423	Q	91.2	Very high	87.5	Confident	77 Å²	77	52.7 Å²	52.7	36%	0.36	28%	0.279	S	S	.	.	H	α-helix	trans	-63.8	-41.8	177.9	-68.6	-69.9	-4	0	0	112.8	E419 V421 M425 L426 I545	E419-Q423 HydrophobicContact CG-CG 4.38Å; E419-Q423 WeakPolarHBondContact O-CG 3.35Å; E419-Q423 PolarHBondContact O-N 2.85Å; V421-Q423 VanDerWaalsContact C-N 3.29Å; V421-Q423 PolarHBondContact O-N 3.22Å; Q423-M425 VanDerWaalsContact C-N 3.33Å; Q423-M425 PolarHBondContact O-N 3.33Å; Q423-L426 WeakPolarHBondContact O-CB 3.41Å; Q423-L426 PolarHBondContact O-N 3.29Å; Q423-I545 VanDerWaalsContact CD-CD1 3.49Å; Q423-I545 HydrophobicContact CG-CD1 3.98Å
424	A	90.7	Very high	88.5	Confident	31 Å²	31	47.8 Å²	47.8	26%	0.256	25%	0.249	S	C	.	.	H	α-helix	trans	-67.8	-33.8	178.5	0	0	0	0	0	112.4	V372 G420 V421 L426	V372-A424 HydrophobicContact CG2-CB 3.59Å; G420-A424 WeakPolarHBondContact O-CB 3.35Å; G420-A424 PolarHBondContact O-N 2.99Å; V421-A424 PolarHBondContact O-N 2.86Å; V421-A424 VanDerWaalsContact O-N 3.14Å; A424-L426 VanDerWaalsContact C-N 3.32Å; A424-L426 PolarHBondContact O-N 3.42Å
425	M	92.7	Very high	89.3	Confident	4 Å²	4	42.2 Å²	42.2	2%	0.02	24%	0.235	C	C	.	.	H	α-helix	trans	-69.4	-23.1	176.4	-69.7	176.4	84.1	0	0	113.9	I362 V372 L397 I400 I403 V421 Q422 Q423 K427 L428 L429 F548	I362-M425 HydrophobicContact CD1-SD 4.32Å; V372-M425 HydrophobicContact CG1-CB 4.47Å; V372-M425 HydrophobicContact CG1-CG 3.52Å; L397-M425 HydrophobicContact CD1-CE 3.38Å; L397-M425 HydrophobicContact CD2-CE 3.58Å; L397-M425 HydrophobicContact CG-CE 4.01Å; I400-M425 HydrophobicContact CD1-CE 4.5Å; I403-M425 HydrophobicContact CD1-SD 4.02Å; V421-M425 HydrophobicContact CG1-CG 4.26Å; V421-M425 HydrophobicContact CG1-SD 3.74Å; V421-M425 VanDerWaalsContact O-CG 3.29Å; V421-M425 WeakPolarHBondContact O-CG 3.38Å; V421-M425 PolarHBondContact O-N 3.31Å; Q422-M425 PolarHBondContact O-N 3.1Å; Q423-M425 VanDerWaalsContact C-N 3.33Å; Q423-M425 PolarHBondContact O-N 3.33Å; M425-K427 PolarHBondContact O-N 3.07Å; M425-L428 PolarHBondContact O-N 3.18Å; M425-L428 VanDerWaalsContact O-N 3.14Å; M425-L429 HydrophobicContact CB-CD1 4.48Å; M425-L429 WeakPolarHBondContact O-CG 3.47Å; M425-L429 PolarHBondContact O-N 3.2Å; M425-F548 HydrophobicContact CB-CE2 4.21Å; M425-F548 HydrophobicContact SD-CE2 4.39Å
426	L	93.3	Very high	89.5	Confident	16 Å²	16	39.6 Å²	39.6	8%	0.084	22%	0.221	C	C	.	.	H	α-helix	trans	-54.2	-38.6	-179.6	-66	-177.6	0	0	0	112.7	Q422 Q423 A424 L429 E430 I545 E547 F548 R551	Q422-L426 PolarHBondContact O-N 2.98Å; Q423-L426 WeakPolarHBondContact O-CB 3.41Å; Q423-L426 PolarHBondContact O-N 3.29Å; A424-L426 VanDerWaalsContact C-N 3.32Å; A424-L426 PolarHBondContact O-N 3.42Å; L426-L429 CarbonylContact O-C 3.54Å; L426-L429 PolarHBondContact O-N 2.77Å; L426-L429 VanDerWaalsContact O-N 3.14Å; L426-E430 WeakPolarHBondContact O-CG 3.35Å; L426-E430 PolarHBondContact O-N 2.84Å; L426-I545 HydrophobicContact CD1-CD1 4.12Å; L426-I545 HydrophobicContact CD2-CD1 4.48Å; L426-I545 HydrophobicContact CG-CD1 4.48Å; L426-E547 HydrophobicContact CD1-CB 3.89Å; L426-E547 HydrophobicContact CD2-CB 4.25Å; L426-F548 HydrophobicContact CD2-CB 3.99Å; L426-F548 HydrophobicContact CD2-CD2 4.19Å; L426-R551 HydrophobicContact CD2-CG 4.42Å
427	K	89.9	Confident	89.6	Confident	142 Å²	142	42 Å²	42	62%	0.617	24%	0.238	S	C	*	.	H	α-helix	trans	-60	-48.2	178.5	-63.9	-179	178.7	-179.4	0	112.3	M425 L429 E430 G431 S432	M425-K427 PolarHBondContact O-N 3.07Å; K427-L429 VanDerWaalsContact C-N 3.27Å; K427-L429 PolarHBondContact O-N 3.09Å; K427-E430 PolarHBondContact O-N 3.38Å; K427-G431 PolarHBondContact O-N 3.3Å; K427-S432 WeakPolarHBondContact O-CB 3.46Å; K427-S432 PolarHBondContact O-N 2.78Å; K427-S432 PolarHBondContact O-OG 2.85Å
428	L	91.7	Very high	89.2	Confident	11 Å²	11	41.4 Å²	41.4	6%	0.058	23%	0.23	C	C	.	.	H	α-helix	trans	-66.3	-32	176	-52.6	-175	0	0	0	111.6	V372 I376 M425 V434 T454 F459	V372-L428 HydrophobicContact CB-CD1 4.24Å; V372-L428 HydrophobicContact CG1-CD1 3.49Å; V372-L428 VanDerWaalsContact CG1-CD1 3.49Å; V372-L428 HydrophobicContact CG1-CG 4.46Å; I376-L428 HydrophobicContact CG1-CD1 4.44Å; I376-L428 HydrophobicContact CG1-CD2 4.28Å; M425-L428 PolarHBondContact O-N 3.18Å; M425-L428 VanDerWaalsContact O-N 3.14Å; L428-V434 HydrophobicContact CD2-CG2 3.45Å; L428-V434 VanDerWaalsContact CD2-CG2 3.45Å; L428-T454 HydrophobicContact CD2-CG2 4.15Å; L428-F459 HydrophobicContact CB-CE1 4.42Å; L428-F459 HydrophobicContact CB-CZ 4.11Å; L428-F459 WeakPolarHBondContact O-CE2 3.46Å
429	L	92.8	Very high	88.2	Confident	3 Å²	3	46.7 Å²	46.7	2%	0.016	26%	0.261	C	S	.	.	H	α-helix	trans	-79.9	-16.1	179.9	-70.6	178.1	0	0	0	114.4	K326 M425 L426 K427 F459 F548 R551 F552	K326-L429 WeakPolarHBondContact CE-O 3.47Å; K326-L429 PolarHBondContact NZ-O 3.26Å; M425-L429 HydrophobicContact CB-CD1 4.48Å; M425-L429 WeakPolarHBondContact O-CG 3.47Å; M425-L429 PolarHBondContact O-N 3.2Å; L426-L429 CarbonylContact O-C 3.54Å; L426-L429 PolarHBondContact O-N 2.77Å; L426-L429 VanDerWaalsContact O-N 3.14Å; K427-L429 VanDerWaalsContact C-N 3.27Å; K427-L429 PolarHBondContact O-N 3.09Å; L429-F459 HydrophobicContact CD2-CB 3.73Å; L429-F459 HydrophobicContact CD2-CD1 3.91Å; L429-F459 HydrophobicContact CD2-CD2 3.98Å; L429-F459 HydrophobicContact CD2-CG 3.6Å; L429-F548 HydrophobicContact CD1-CD2 3.79Å; L429-F548 HydrophobicContact CD1-CE2 3.47Å; L429-F548 VanDerWaalsContact CD1-CE2 3.47Å; L429-F548 HydrophobicContact CD1-CZ 4.19Å; L429-R551 HydrophobicContact CB-CB 4.11Å; L429-R551 HydrophobicContact CB-CG 4.16Å; L429-R551 HydrophobicContact CD1-CB 4.37Å; L429-F552 HydrophobicContact CD1-CE2 3.51Å; L429-F552 HydrophobicContact CD1-CZ 3.9Å; L429-F552 HydrophobicContact CD2-CE2 4.2Å; L429-F552 HydrophobicContact CD2-CZ 3.77Å
430	E	88.6	Confident	87	Confident	108 Å²	108	49.7 Å²	49.7	51%	0.505	27%	0.273	S	S	.	.	H	α-helix	trans	-83.2	-48.8	171.1	-74.4	163.7	-153.1	0	0	111.6	L426 K427 R551	L426-E430 WeakPolarHBondContact O-CG 3.35Å; L426-E430 PolarHBondContact O-N 2.84Å; K427-E430 PolarHBondContact O-N 3.38Å; E430-R551 IonicContact OE1-CZ 3.2Å; E430-R551 IonicContact OE1-NH1 2.81Å; E430-R551 PolarHBondContact OE1-NH1 3.13Å; E430-R551 IonicContact OE1-NH2 3.09Å; E430-R551 PolarHBondContact OE1-NH2 3.45Å
431	G	88.5	Confident	85.6	Confident	27 Å²	27	51.8 Å²	51.8	28%	0.278	29%	0.286	S	S	.	.	T	Hydrogen-bonded Turn	trans	119.2	68.2	-162.3	0	0	0	0	0	110.3	K427 T454 T455	K427-G431 PolarHBondContact O-N 3.3Å; G431-T454 WeakPolarHBondContact CA-OG1 3.38Å; G431-T455 WeakPolarHBondContact CA-OG1 3.4Å
432	S	90.5	Very high	83.8	Confident	31 Å²	31	57.6 Å²	57.6	22%	0.217	32%	0.324	C	S	.	.			trans	-96	149.4	168.9	63.8	0	0	0	0	111.4	K427 T454	K427-S432 WeakPolarHBondContact O-CB 3.46Å; K427-S432 PolarHBondContact O-N 2.78Å; K427-S432 PolarHBondContact O-OG 2.85Å; S432-T454 PolarHBondContact N-OG1 2.91Å; S432-T454 PolarHBondContact O-N 3.46Å; S432-T454 VanDerWaalsContact O-N 3.15Å; S432-T454 PolarHBondContact O-OG1 2.95Å
433	V	92.4	Very high	82	Confident	99 Å²	99	67.3 Å²	67.3	60%	0.6	36%	0.361	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-77.3	121.2	163.8	179.1	0	0	0	0	108.7	V451	V433-V451 HydrophobicContact CG1-CG1 3.26Å
434	V	91.4	Very high	80.4	Confident	6 Å²	6	73.7 Å²	73.7	4%	0.036	39%	0.387	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-113.8	135.1	-175.3	-175.1	0	0	0	0	109.8	E373 L428 V436 V452 T454	E373-V434 HydrophobicContact CB-CG1 4.21Å; E373-V434 HydrophobicContact CG-CG1 3.94Å; L428-V434 HydrophobicContact CD2-CG2 3.45Å; L428-V434 VanDerWaalsContact CD2-CG2 3.45Å; V434-V436 HydrophobicContact CG1-CG2 4.11Å; V434-V452 PolarHBondContact N-O 2.83Å; V434-V452 PolarHBondContact O-N 2.64Å; V434-T454 HydrophobicContact CG2-CG2 3.83Å
435	N	89	Confident	78.8	Confident	87 Å²	87	80.5 Å²	80.5	47%	0.465	42%	0.418	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-100.6	96.1	178.6	-65.9	-24.2	0	0	0	109.8
436	V	85.8	Confident	77.1	Confident	8 Å²	8	91.4 Å²	91.4	5%	0.048	46%	0.459	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-86.9	125.6	-178.2	-179.7	0	0	0	0	110.2	I376 V434 T449 F450	I376-V436 HydrophobicContact CB-CG2 4.08Å; I376-V436 HydrophobicContact CG2-CG2 3.89Å; V434-V436 HydrophobicContact CG1-CG2 4.11Å; V436-T449 CarbonylContact O-C 3.58Å; V436-T449 VanDerWaalsContact O-CA 3.28Å; V436-T449 WeakPolarHBondContact O-CA 3.49Å; V436-F450 PolarHBondContact N-O 3.26Å; V436-F450 PolarHBondContact O-N 3.43Å
437	P	81.7	Confident	75.5	Confident	79 Å²	79	92.9 Å²	92.9	51%	0.513	48%	0.478	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-71.6	137.3	175.4	29.3	-34.2	0	0	0	111.7	V439	P437-V439 PolarHBondContact O-N 2.99Å; P437-V439 VanDerWaalsContact O-N 3.1Å
438	D	75.1	Confident	74.5	Confident	43 Å²	43	93.8 Å²	93.8	23%	0.23	49%	0.485	C	S	.	.			trans	-69.7	107.1	173.5	-178	20.9	0	0	0	112.1	F385 K440 S441 E448 F450	F385-D438 WeakPolarHBondContact CE1-OD1 3.34Å; D438-K440 PolarHBondContact O-N 3.5Å; D438-K440 WeakPolarHBondContact OD1-CB 3.4Å; D438-K440 PolarHBondContact OD1-N 3.26Å; D438-S441 PolarHBondContact O-N 3.13Å; D438-S441 PolarHBondContact OD2-N 3.31Å; D438-E448 PolarHBondContact N-O 3.17Å; D438-F450 HydrophobicContact CB-CD2 4.34Å; D438-F450 HydrophobicContact CB-CE2 3.84Å
439	V	67.3	Low	74.1	Confident	114 Å²	114	96.6 Å²	96.6	69%	0.691	50%	0.503	S	S	*	.	T	Hydrogen-bonded Turn	trans	-63.9	-22.5	176.1	-173.3	0	0	0	0	112.3	P437	P437-V439 PolarHBondContact O-N 2.99Å; P437-V439 VanDerWaalsContact O-N 3.1Å
440	K	62.2	Low	73.8	Confident	150 Å²	150	99.1 Å²	99.1	65%	0.652	51%	0.513	S	S	*	.	T	Hydrogen-bonded Turn	trans	-83.2	-17.5	-178.8	-67.6	-175.8	175.1	179.3	0	113.9	F385 D438 P442	F385-K440 HydrophobicContact CE2-CD 3.81Å; F385-K440 VanDerWaalsContact CE2-CE 3.43Å; F385-K440 VanDerWaalsContact CE2-NZ 3.32Å; F385-K440 HydrophobicContact CZ-CD 3.7Å; F385-K440 HydrophobicContact CZ-CG 4.06Å; D438-K440 PolarHBondContact O-N 3.5Å; D438-K440 WeakPolarHBondContact OD1-CB 3.4Å; D438-K440 PolarHBondContact OD1-N 3.26Å; K440-P442 VanDerWaalsContact O-CD 3.26Å; K440-P442 WeakPolarHBondContact O-CD 3.34Å
441	S	57.6	Low	73.9	Confident	52 Å²	52	97.7 Å²	97.7	36%	0.364	51%	0.512	S	S	.	.			trans	-78.2	113.7	-176.4	-171.5	0	0	0	0	111.8	D438 R443	D438-S441 PolarHBondContact O-N 3.13Å; D438-S441 PolarHBondContact OD2-N 3.31Å; S441-R443 PolarHBondContact O-N 2.77Å
442	P	55.1	Low	74.1	Confident	122 Å²	122	96.4 Å²	96.4	79%	0.792	50%	0.499	S	S	*	.			trans	-76.1	6.4	-173.7	31.6	-36	0	0	0	114.1	K440	K440-P442 VanDerWaalsContact O-CD 3.26Å; K440-P442 WeakPolarHBondContact O-CD 3.34Å
443	R	55.3	Low	74.2	Confident	204 Å²	204	97 Å²	97	77%	0.77	50%	0.499	S	S	*	.			trans	-118.6	92.2	-172.8	-61.2	-172.2	-165.9	175.8	7.2	112.2	S441 L445	S441-R443 PolarHBondContact O-N 2.77Å; R443-L445 PolarHBondContact O-N 3.02Å
444	K	56.6	Low	74.2	Confident	210 Å²	210	92.2 Å²	92.2	91%	0.913	47%	0.471	S	S	*	.	T	Hydrogen-bonded Turn	trans	-63	9	-177	-62.3	-172.3	174.4	-172.1	0	117.3
445	L	56.9	Low	74.2	Confident	175 Å²	175	92.7 Å²	92.7	92%	0.916	47%	0.474	S	S	*	.	T	Hydrogen-bonded Turn	trans	-98.1	-21.7	-174.4	-88.4	80.2	0	0	0	114.9	R443	R443-L445 PolarHBondContact O-N 3.02Å
446	R	56.9	Low	74.3	Confident	232 Å²	232	90 Å²	90	88%	0.875	46%	0.459	S	S	*	.	S	Bend	trans	-161.6	69.1	175.7	-165.3	171.6	-178.3	152.6	-1.2	109.2	E448	R446-E448 PolarHBondContact O-N 3.06Å
447	G	60	Low	74.7	Confident	47 Å²	47	89.6 Å²	89.6	49%	0.485	46%	0.457	S	S	.	.	P	Polyproline II helix	trans	-64.6	127.8	177.4	0	0	0	0	0	110.1	T449	G447-T449 PolarHBondContact O-N 3.26Å
448	E	69.1	Low	75.3	Confident	161 Å²	161	85.9 Å²	85.9	75%	0.752	43%	0.432	S	S	*	.	P	Polyproline II helix	trans	-67.5	128.7	166.9	-68.2	176.4	172.5	0	0	107.9	D438 R446	D438-E448 PolarHBondContact N-O 3.17Å; R446-E448 PolarHBondContact O-N 3.06Å
449	T	83.6	Confident	76.2	Confident	71 Å²	71	84 Å²	84	44%	0.436	42%	0.422	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-101.5	129	177.3	52.8	0	0	0	0	109.2	V436 G447 V451	V436-T449 CarbonylContact O-C 3.58Å; V436-T449 VanDerWaalsContact O-CA 3.28Å; V436-T449 WeakPolarHBondContact O-CA 3.49Å; G447-T449 PolarHBondContact O-N 3.26Å; T449-V451 PolarHBondContact O-N 3.17Å
450	F	85.5	Confident	77.6	Confident	55 Å²	55	78.6 Å²	78.6	24%	0.241	39%	0.389	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-76.6	123	171.7	-67.2	-82.3	0	0	0	109.4	L380 F385 V387 V436 D438 V452	L380-F450 HydrophobicContact CD2-CB 3.48Å; L380-F450 VanDerWaalsContact CD2-CB 3.48Å; L380-F450 HydrophobicContact CD2-CD1 4.37Å; L380-F450 HydrophobicContact CD2-CD2 3.72Å; L380-F450 HydrophobicContact CD2-CG 3.6Å; F385-F450 HydrophobicContact CB-CE1 4.47Å; F385-F450 HydrophobicContact CB-CZ 4.23Å; F385-F450 HydrophobicContact CD1-CD2 4.17Å; F385-F450 AromaticContact CD1-CE2 3.55Å; F385-F450 HydrophobicContact CD1-CE2 3.55Å; F385-F450 AromaticContact CD1-CZ 3.85Å; F385-F450 HydrophobicContact CD1-CZ 3.85Å; F385-F450 HydrophobicContact CE1-CE2 4.17Å; F385-F450 HydrophobicContact CG-CZ 4.47Å; V387-F450 HydrophobicContact CG2-CD1 4.16Å; V436-F450 PolarHBondContact N-O 3.26Å; V436-F450 PolarHBondContact O-N 3.43Å; D438-F450 HydrophobicContact CB-CD2 4.34Å; D438-F450 HydrophobicContact CB-CE2 3.84Å; F450-V452 HydrophobicContact CB-CG2 4.42Å
451	V	91.1	Very high	79.2	Confident	78 Å²	78	71.4 Å²	71.4	47%	0.473	36%	0.358	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-89.5	112.4	178.3	-175.6	0	0	0	0	107.8	V387 V433 T449	V387-V451 WeakPolarHBondContact CG1-O 3.09Å; V433-V451 HydrophobicContact CG1-CG1 3.26Å; T449-V451 PolarHBondContact O-N 3.17Å
452	V	92.4	Very high	81	Confident	0 Å²	0	69 Å²	69	0%	0	34%	0.341	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-122.3	123.8	-175	-173	0	0	0	0	110.2	I376 V387 Q391 V434 F450	I376-V452 HydrophobicContact CG2-CB 4.04Å; I376-V452 HydrophobicContact CG2-CG1 3.91Å; I376-V452 HydrophobicContact CG2-CG2 4.31Å; V387-V452 HydrophobicContact CG1-CG2 4.41Å; Q391-V452 HydrophobicContact CG-CG1 4.13Å; V434-V452 PolarHBondContact N-O 2.83Å; V434-V452 PolarHBondContact O-N 2.64Å; F450-V452 HydrophobicContact CB-CG2 4.42Å
453	D	93	Very high	82.8	Confident	43 Å²	43	63.2 Å²	63.2	23%	0.23	30%	0.304	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-82	130	170.8	179.6	14.2	0	0	0	110.7	Q391 T455	Q391-D453 WeakPolarHBondContact CG-O 3.48Å; D453-T455 VanDerWaalsContact OD1-CB 3.26Å; D453-T455 WeakPolarHBondContact OD1-CB 3.28Å; D453-T455 PolarHBondContact OD1-N 3.48Å; D453-T455 PolarHBondContact OD1-OG1 2.99Å; D453-T455 WeakPolarHBondContact OD2-CB 3.17Å; D453-T455 PolarHBondContact OD2-OG1 2.94Å
454	T	93.3	Very high	84.6	Confident	0 Å²	0	53.8 Å²	53.8	0%	0	27%	0.27	C	S	.	.			trans	-92.3	-2.9	179.9	55	0	0	0	0	113.9	I376 L428 G431 S432 V434 N456 I457	I376-T454 HydrophobicContact CD1-CG2 3.88Å; I376-T454 HydrophobicContact CG1-CG2 4.2Å; L428-T454 HydrophobicContact CD2-CG2 4.15Å; G431-T454 WeakPolarHBondContact CA-OG1 3.38Å; S432-T454 PolarHBondContact N-OG1 2.91Å; S432-T454 PolarHBondContact O-N 3.46Å; S432-T454 VanDerWaalsContact O-N 3.15Å; S432-T454 PolarHBondContact O-OG1 2.95Å; V434-T454 HydrophobicContact CG2-CG2 3.83Å; T454-N456 VanDerWaalsContact C-N 3.27Å; T454-N456 PolarHBondContact O-N 2.9Å; T454-I457 HydrophobicContact CG2-CD1 4.13Å; T454-I457 PolarHBondContact O-N 3.01Å
455	T	91.1	Very high	86.2	Confident	16 Å²	16	43.9 Å²	43.9	10%	0.098	23%	0.227	C	C	.	.	T	Hydrogen-bonded Turn	trans	-58.2	-33.7	-177.8	-59.3	0	0	0	0	113.9	R204 K326 G431 D453	R204-T455 PolarHBondContact NH2-O 3.26Å; K326-T455 WeakPolarHBondContact CD-O 3.45Å; G431-T455 WeakPolarHBondContact CA-OG1 3.4Å; D453-T455 VanDerWaalsContact OD1-CB 3.26Å; D453-T455 WeakPolarHBondContact OD1-CB 3.28Å; D453-T455 PolarHBondContact OD1-N 3.48Å; D453-T455 PolarHBondContact OD1-OG1 2.99Å; D453-T455 WeakPolarHBondContact OD2-CB 3.17Å; D453-T455 PolarHBondContact OD2-OG1 2.94Å
456	N	91.1	Very high	87.8	Confident	30 Å²	30	40.5 Å²	40.5	16%	0.16	21%	0.209	C	C	.	.	T	Hydrogen-bonded Turn	trans	-98.9	-5.1	-177.2	-71.1	-36	0	0	0	113.9	H201 I205 Q391 T454	H201-N456 PolarHBondContact NE2-O 2.6Å; I205-N456 HydrophobicContact CG1-CB 4.27Å; Q391-N456 CarbonylContact O-C 3.54Å; Q391-N456 WeakPolarHBondContact O-CB 3.45Å; T454-N456 VanDerWaalsContact C-N 3.27Å; T454-N456 PolarHBondContact O-N 2.9Å
457	I	93.6	Very high	89.3	Confident	0 Å²	0	30.4 Å²	30.4	0%	0	18%	0.178	C	C	.	.			trans	-77.8	133.7	-180	-60.2	179.2	0	0	0	110.3	H201 I376 L379 Q391 V395 T454 F459	H201-I457 PolarHBondContact NE2-O 3.24Å; I376-I457 HydrophobicContact CD1-CD1 4.09Å; L379-I457 HydrophobicContact CD2-CD1 3.86Å; L379-I457 HydrophobicContact CD2-CG1 4.44Å; L379-I457 HydrophobicContact CD2-CG2 4.26Å; Q391-I457 PolarHBondContact O-N 3.13Å; V395-I457 HydrophobicContact CB-CG2 4.37Å; V395-I457 HydrophobicContact CG2-CG2 3.71Å; T454-I457 HydrophobicContact CG2-CD1 4.13Å; T454-I457 PolarHBondContact O-N 3.01Å; I457-F459 HydrophobicContact CB-CE2 3.89Å; I457-F459 HydrophobicContact CB-CZ 4.37Å; I457-F459 HydrophobicContact CG2-CD2 4.22Å; I457-F459 HydrophobicContact CG2-CE2 3.74Å; I457-F459 HydrophobicContact CG2-CZ 3.95Å; I457-F459 WeakPolarHBondContact O-CD2 3.25Å
458	L	93.9	Very high	90.8	Very high	0 Å²	0	28.2 Å²	28.2	0%	0	16%	0.155	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-84.8	127.9	172.5	-176.9	60.5	0	0	0	110.5	V198 H201 G393 I394 V395 I460	V198-L458 HydrophobicContact CG2-CD2 4.12Å; H201-L458 WeakPolarHBondContact NE2-CA 3.46Å; H201-L458 PolarHBondContact NE2-N 2.97Å; G393-L458 PolarHBondContact O-N 3.3Å; G393-L458 VanDerWaalsContact O-N 3.17Å; I394-L458 HydrophobicContact CD1-CD2 4.38Å; I394-L458 HydrophobicContact CG1-CB 4.23Å; I394-L458 HydrophobicContact CG1-CD2 4.33Å; V395-L458 PolarHBondContact N-O 3.22Å; L458-I460 HydrophobicContact CD2-CD1 4.26Å; L458-I460 HydrophobicContact CD2-CG1 4.32Å; L458-I460 HydrophobicContact CG-CG1 4.22Å
459	F	95.6	Very high	91.9	Very high	3 Å²	3	21.6 Å²	21.6	1%	0.013	13%	0.125	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-107.4	127	172.7	-65.6	-97.8	0	0	0	110.6	K326 N328 I329 I376 V395 L397 L428 L429 I457 F552	K326-F459 VanDerWaalsContact NZ-CD2 3.32Å; N328-F459 WeakPolarHBondContact CA-O 3.5Å; N328-F459 HydrophobicContact CB-CB 4.31Å; I329-F459 PolarHBondContact N-O 2.98Å; I376-F459 HydrophobicContact CD1-CZ 4.47Å; V395-F459 HydrophobicContact CB-CD1 3.84Å; V395-F459 HydrophobicContact CB-CE1 3.98Å; V395-F459 HydrophobicContact CG1-CD1 3.87Å; V395-F459 HydrophobicContact CG1-CE1 3.97Å; V395-F459 HydrophobicContact CG2-CE1 4.24Å; V395-F459 WeakPolarHBondContact O-CA 3.46Å; L397-F459 HydrophobicContact CD1-CD1 4.02Å; L428-F459 HydrophobicContact CB-CE1 4.42Å; L428-F459 HydrophobicContact CB-CZ 4.11Å; L428-F459 WeakPolarHBondContact O-CE2 3.46Å; L429-F459 HydrophobicContact CD2-CB 3.73Å; L429-F459 HydrophobicContact CD2-CD1 3.91Å; L429-F459 HydrophobicContact CD2-CD2 3.98Å; L429-F459 HydrophobicContact CD2-CG 3.6Å; I457-F459 HydrophobicContact CB-CE2 3.89Å; I457-F459 HydrophobicContact CB-CZ 4.37Å; I457-F459 HydrophobicContact CG2-CD2 4.22Å; I457-F459 HydrophobicContact CG2-CE2 3.74Å; I457-F459 HydrophobicContact CG2-CZ 3.95Å; I457-F459 WeakPolarHBondContact O-CD2 3.25Å; F459-F552 HydrophobicContact CB-CE1 4.48Å
460	I	95.6	Very high	92.2	Very high	1 Å²	1	24.5 Å²	24.5	1%	0.005	13%	0.131	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-118.8	110.6	174.3	-55.3	177.1	0	0	0	107.6	I329 L331 L346 I394 V395 V396 L397 L458	I329-I460 CarbonylContact O-C 3.03Å; I329-I460 WeakPolarHBondContact O-CA 3.49Å; L331-I460 HydrophobicContact CD1-CG2 3.8Å; L331-I460 HydrophobicContact CG-CG2 4.04Å; L346-I460 HydrophobicContact CD2-CD1 4.17Å; I394-I460 HydrophobicContact CG2-CD1 3.9Å; I394-I460 HydrophobicContact CG2-CG1 4.32Å; V395-I460 PolarHBondContact O-N 3.3Å; V396-I460 CarbonylContact C-O 3.51Å; V396-I460 VanDerWaalsContact CA-O 3.28Å; V396-I460 WeakPolarHBondContact CA-O 3.42Å; V396-I460 HydrophobicContact CG2-CB 4.33Å; L397-I460 PolarHBondContact N-O 2.68Å; L458-I460 HydrophobicContact CD2-CD1 4.26Å; L458-I460 HydrophobicContact CD2-CG1 4.32Å; L458-I460 HydrophobicContact CG-CG1 4.22Å
461	A	95.7	Very high	92.5	Very high	0 Å²	0	23.1 Å²	23.1	0%	0	13%	0.126	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-92.7	134.5	175.9	0	0	0	0	0	110.8	I329 I330 L331 L397 I400 F552	I329-A461 PolarHBondContact O-N 3.34Å; I330-A461 CarbonylContact C-O 3.59Å; I330-A461 WeakPolarHBondContact CA-O 3.43Å; I330-A461 HydrophobicContact CG1-CB 4.13Å; L331-A461 PolarHBondContact N-O 3.21Å; L397-A461 HydrophobicContact CB-CB 4.39Å; L397-A461 CarbonylContact O-C 3.55Å; L397-A461 WeakPolarHBondContact O-CA 3.34Å; I400-A461 HydrophobicContact CB-CB 4.35Å; I400-A461 HydrophobicContact CG1-CB 4.24Å; I400-A461 HydrophobicContact CG2-CB 4.29Å; A461-F552 HydrophobicContact CB-CE1 3.79Å; A461-F552 HydrophobicContact CB-CZ 3.89Å
462	C	95.4	Very high	92.6	Very high	0 Å²	0	19.4 Å²	19.4	0%	0	10%	0.104	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-120.8	134.8	-178.7	-71.2	0	0	0	0	109.6	K339 L397 D398 E399 I400	K339-C462 HydrophobicContact CB-CB 4.41Å; L397-C462 PolarHBondContact O-N 2.95Å; D398-C462 WeakPolarHBondContact OD1-CB 3.13Å; E399-C462 PolarHBondContact N-O 3.07Å; E399-C462 VanDerWaalsContact N-O 3.13Å; I400-C462 WeakPolarHBondContact CG2-O 3.43Å; I400-C462 PolarHBondContact N-O 2.85Å
463	G	94	Very high	92.5	Very high	1 Å²	1	21.2 Å²	21.2	1%	0.01	12%	0.117	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-156.7	160.5	176.3	0	0	0	0	0	113.7	L331 G333 K339 D401	L331-G463 PolarHBondContact O-N 3.17Å; L331-G463 VanDerWaalsContact O-N 3.09Å; G333-G463 PolarHBondContact N-O 3.08Å; K339-G463 WeakPolarHBondContact CD-O 3.17Å; K339-G463 WeakPolarHBondContact CE-O 3.29Å; D401-G463 WeakPolarHBondContact OD1-CA 3.33Å
464	A	91.8	Very high	92.3	Very high	7 Å²	7	27.7 Å²	27.7	6%	0.058	14%	0.138	C	C	.	.			trans	-88.1	-35.9	178.7	0	0	0	0	0	113.4	G333 T335 D401	G333-A464 WeakPolarHBondContact O-CA 3.47Å; T335-A464 HydrophobicContact CG2-CB 4.33Å; D401-A464 PolarHBondContact OD1-N 3.27Å
465	F	91.5	Very high	92.1	Very high	2 Å²	2	31.5 Å²	31.5	1%	0.009	15%	0.152	C	C	.	.			trans	51.8	60.2	178	-67.2	-91.2	0	0	0	113.4	L332 I400 D401 G467 L468 R527 L539 Y542 M544	L332-F465 HydrophobicContact CD2-CD2 3.26Å; L332-F465 HydrophobicContact CD2-CE2 3.29Å; L332-F465 HydrophobicContact CD2-CG 3.93Å; L332-F465 HydrophobicContact CD2-CZ 3.99Å; I400-F465 HydrophobicContact CG2-CE2 3.72Å; I400-F465 HydrophobicContact CG2-CZ 3.7Å; D401-F465 HydrophobicContact CB-CD1 4.09Å; D401-F465 HydrophobicContact CB-CD2 4Å; D401-F465 HydrophobicContact CB-CE1 4.22Å; D401-F465 HydrophobicContact CB-CE2 4.14Å; D401-F465 HydrophobicContact CB-CG 3.99Å; D401-F465 HydrophobicContact CB-CZ 4.26Å; F465-G467 PolarHBondContact O-N 3.45Å; F465-L468 HydrophobicContact CB-CB 3.97Å; F465-L468 HydrophobicContact CB-CD2 3.84Å; F465-L468 HydrophobicContact CD1-CD2 4.38Å; F465-L468 HydrophobicContact CG-CD2 4.26Å; F465-L468 WeakPolarHBondContact O-CB 3.29Å; F465-L468 PolarHBondContact O-N 2.81Å; F465-R527 PolarHBondContact O-NH2 3.43Å; F465-L539 HydrophobicContact CD1-CD2 4.05Å; F465-L539 HydrophobicContact CE1-CD2 3.84Å; F465-L539 HydrophobicContact CZ-CD2 4.37Å; F465-Y542 HydrophobicContact CB-CE2 4.42Å; F465-Y542 AromaticContact CD1-CD1 3.76Å; F465-Y542 HydrophobicContact CD1-CD1 3.76Å; F465-Y542 HydrophobicContact CD1-CD2 4.43Å; F465-Y542 AromaticContact CD1-CE1 3.65Å; F465-Y542 HydrophobicContact CD1-CE1 3.65Å; F465-Y542 HydrophobicContact CD1-CE2 4.33Å; F465-Y542 HydrophobicContact CD1-CG 4.18Å; F465-Y542 AromaticContact CD1-CZ 3.96Å; F465-Y542 HydrophobicContact CE1-CD1 4.05Å; F465-Y542 HydrophobicContact CE1-CE1 4.09Å; F465-M544 HydrophobicContact CE1-CE 4.43Å
466	N	89.9	Confident	91.8	Very high	103 Å²	103	34.7 Å²	34.7	55%	0.551	16%	0.164	S	C	*	.	T	Hydrogen-bonded Turn	trans	-68.9	115	-178.7	-66.9	-14	0	0	0	110.8
467	G	88.5	Confident	91.2	Very high	21 Å²	21	38.4 Å²	38.4	22%	0.216	18%	0.181	C	C	.	.	T	Hydrogen-bonded Turn	trans	97.4	-3.2	-178.6	0	0	0	0	0	115	F465 D469 K470 I471	F465-G467 PolarHBondContact O-N 3.45Å; G467-D469 WeakPolarHBondContact CA-OD1 3.5Å; G467-D469 PolarHBondContact N-OD1 2.88Å; G467-D469 PolarHBondContact O-N 2.83Å; G467-K470 WeakPolarHBondContact O-CB 3.29Å; G467-K470 PolarHBondContact O-N 2.81Å; G467-I471 PolarHBondContact O-N 3.07Å
468	L	92	Very high	89.9	Confident	0 Å²	0	46.7 Å²	46.7	0%	0	22%	0.217	C	C	.	.	H	α-helix	trans	-60.5	-36.4	172.3	-177.9	65.9	0	0	0	111.8	L332 F465 K470 I471 I472 L531 V534 D538 L539 Y542	L332-L468 HydrophobicContact CD1-CD2 4.09Å; F465-L468 HydrophobicContact CB-CB 3.97Å; F465-L468 HydrophobicContact CB-CD2 3.84Å; F465-L468 HydrophobicContact CD1-CD2 4.38Å; F465-L468 HydrophobicContact CG-CD2 4.26Å; F465-L468 WeakPolarHBondContact O-CB 3.29Å; F465-L468 PolarHBondContact O-N 2.81Å; L468-K470 VanDerWaalsContact C-N 3.25Å; L468-K470 PolarHBondContact O-N 3.3Å; L468-I471 HydrophobicContact CD1-CD1 4.47Å; L468-I471 WeakPolarHBondContact O-CA 3.32Å; L468-I471 WeakPolarHBondContact O-CB 3.42Å; L468-I471 PolarHBondContact O-N 2.87Å; L468-I472 HydrophobicContact CG-CD1 4.02Å; L468-I472 WeakPolarHBondContact O-CG1 3.28Å; L468-I472 PolarHBondContact O-N 3.46Å; L468-L531 HydrophobicContact CB-CD2 4.44Å; L468-L531 HydrophobicContact CD2-CD2 3.96Å; L468-L531 HydrophobicContact CG-CD2 4.35Å; L468-V534 HydrophobicContact CD2-CG2 4.09Å; L468-D538 HydrophobicContact CD1-CB 3.74Å; L468-L539 HydrophobicContact CD1-CD2 4.21Å; L468-L539 HydrophobicContact CD2-CD2 3.84Å; L468-Y542 HydrophobicContact CB-CD2 4.09Å; L468-Y542 HydrophobicContact CB-CE2 4.4Å; L468-Y542 HydrophobicContact CD1-CD2 4.24Å; L468-Y542 HydrophobicContact CD1-CG 4.45Å
469	D	91.4	Very high	88.1	Confident	22 Å²	22	55 Å²	55	12%	0.118	25%	0.253	C	S	.	.	H	α-helix	trans	-48.5	-42.5	167.2	52.2	-69.3	0	0	0	113.1	G467 I471 I472 S473 R527 L530	G467-D469 WeakPolarHBondContact CA-OD1 3.5Å; G467-D469 PolarHBondContact N-OD1 2.88Å; G467-D469 PolarHBondContact O-N 2.83Å; D469-I471 VanDerWaalsContact C-N 3.32Å; D469-I471 PolarHBondContact O-N 2.93Å; D469-I472 PolarHBondContact O-N 2.78Å; D469-S473 WeakPolarHBondContact O-CB 3.49Å; D469-S473 PolarHBondContact O-N 3.3Å; D469-R527 HydrophobicContact CB-CG 4.14Å; D469-R527 IonicContact OD1-CZ 2.77Å; D469-R527 IonicContact OD1-NH1 3.38Å; D469-R527 PolarHBondContact OD1-NH1 2.94Å; D469-R527 IonicContact OD1-NH2 2.68Å; D469-R527 IonicContact OD2-NH1 3.36Å; D469-L530 HydrophobicContact CB-CD1 4.49Å
470	K	91	Very high	86.2	Confident	132 Å²	132	60.3 Å²	60.3	57%	0.574	29%	0.286	S	S	*	.	H	α-helix	trans	-71.6	-26.9	178.6	-55.5	-176.2	179.9	176.8	0	112.3	G467 L468 R474	G467-K470 WeakPolarHBondContact O-CB 3.29Å; G467-K470 PolarHBondContact O-N 2.81Å; L468-K470 VanDerWaalsContact C-N 3.25Å; L468-K470 PolarHBondContact O-N 3.3Å; K470-R474 VanDerWaalsContact O-CG 3.25Å; K470-R474 WeakPolarHBondContact O-CG 3.49Å; K470-R474 PolarHBondContact O-N 2.85Å; K470-R474 PolarHBondContact O-NE 3.32Å
471	I	91.9	Very high	84.5	Confident	27 Å²	27	68.6 Å²	68.6	14%	0.138	33%	0.328	C	S	.	.	H	α-helix	trans	-74.3	-51.4	175.1	-61	174.2	0	0	0	109.2	G467 L468 D469 S473 R474 R475 D538 T541 Y542	G467-I471 PolarHBondContact O-N 3.07Å; L468-I471 HydrophobicContact CD1-CD1 4.47Å; L468-I471 WeakPolarHBondContact O-CA 3.32Å; L468-I471 WeakPolarHBondContact O-CB 3.42Å; L468-I471 PolarHBondContact O-N 2.87Å; D469-I471 VanDerWaalsContact C-N 3.32Å; D469-I471 PolarHBondContact O-N 2.93Å; I471-S473 VanDerWaalsContact C-N 3.3Å; I471-S473 PolarHBondContact O-N 3.46Å; I471-R474 WeakPolarHBondContact O-CB 3.17Å; I471-R474 PolarHBondContact O-N 3.43Å; I471-R474 VanDerWaalsContact O-N 3.11Å; I471-R475 PolarHBondContact O-N 3.36Å; I471-D538 HydrophobicContact CG2-CB 4.3Å; I471-T541 HydrophobicContact CD1-CG2 4.33Å; I471-T541 HydrophobicContact CG2-CG2 3.74Å; I471-Y542 HydrophobicContact CD1-CD2 4.06Å; I471-Y542 HydrophobicContact CD1-CG 4.44Å
472	I	92.7	Very high	82.4	Confident	0 Å²	0	70.4 Å²	70.4	0%	0	35%	0.346	C	S	.	.	H	α-helix	trans	-58.9	-42.6	177.4	-62.4	166.8	0	0	0	110.7	L468 D469 R474 R475 K476 L530 L531 V534 D538	L468-I472 HydrophobicContact CG-CD1 4.02Å; L468-I472 WeakPolarHBondContact O-CG1 3.28Å; L468-I472 PolarHBondContact O-N 3.46Å; D469-I472 PolarHBondContact O-N 2.78Å; I472-R474 PolarHBondContact O-N 2.94Å; I472-R475 WeakPolarHBondContact O-CB 3.49Å; I472-R475 PolarHBondContact O-N 2.97Å; I472-K476 HydrophobicContact CG2-CD 4.36Å; I472-K476 PolarHBondContact O-N 3Å; I472-L530 HydrophobicContact CB-CB 4.4Å; I472-L530 HydrophobicContact CG2-CB 4.02Å; I472-L530 HydrophobicContact CG2-CD2 3.95Å; I472-L531 HydrophobicContact CD1-CD2 4.39Å; I472-V534 HydrophobicContact CD1-CB 4.06Å; I472-V534 HydrophobicContact CD1-CG2 4.27Å; I472-D538 HydrophobicContact CG1-CB 4.05Å
473	S	89.8	Confident	81	Confident	38 Å²	38	80.1 Å²	80.1	27%	0.266	39%	0.389	S	S	.	.	H	α-helix	trans	-60.4	-42.3	176	-176.1	0	0	0	0	112.2	D469 I471 H477	D469-S473 WeakPolarHBondContact O-CB 3.49Å; D469-S473 PolarHBondContact O-N 3.3Å; I471-S473 VanDerWaalsContact C-N 3.3Å; I471-S473 PolarHBondContact O-N 3.46Å; S473-H477 CarbonylContact O-C 2.95Å; S473-H477 WeakPolarHBondContact O-CA 3.41Å; S473-H477 VanDerWaalsContact O-CB 3.31Å; S473-H477 WeakPolarHBondContact O-CB 3.4Å; S473-H477 PolarHBondContact O-N 3.11Å
474	R	88.5	Confident	79.3	Confident	179 Å²	179	87.1 Å²	87.1	68%	0.675	43%	0.426	S	S	*	.	H	α-helix	trans	-66.2	-34.8	173.7	-71.6	173.5	-147.3	170.8	4.8	113.1	K470 I471 I472 H477 K478	K470-R474 VanDerWaalsContact O-CG 3.25Å; K470-R474 WeakPolarHBondContact O-CG 3.49Å; K470-R474 PolarHBondContact O-N 2.85Å; K470-R474 PolarHBondContact O-NE 3.32Å; I471-R474 WeakPolarHBondContact O-CB 3.17Å; I471-R474 PolarHBondContact O-N 3.43Å; I471-R474 VanDerWaalsContact O-N 3.11Å; I472-R474 PolarHBondContact O-N 2.94Å; R474-H477 CarbonylContact O-C 3.5Å; R474-K478 WeakPolarHBondContact O-CA 3.37Å; R474-K478 PolarHBondContact O-N 2.71Å
475	R	89.1	Confident	77.6	Confident	80 Å²	80	93 Å²	93	30%	0.302	45%	0.454	S	S	.	.	H	α-helix	trans	-66.2	-49.5	176.8	-174.2	-169	67.4	-156.2	-14.4	110.9	I471 I472 E533 E535 D538	I471-R475 PolarHBondContact O-N 3.36Å; I472-R475 WeakPolarHBondContact O-CB 3.49Å; I472-R475 PolarHBondContact O-N 2.97Å; R475-E533 PolarHBondContact NH2-O 3.01Å; R475-E535 IonicContact CZ-OE1 3.57Å; R475-E535 IonicContact CZ-OE2 2.68Å; R475-E535 VanDerWaalsContact NH1-CB 3.29Å; R475-E535 IonicContact NH1-OE1 3.56Å; R475-E535 IonicContact NH1-OE2 3.76Å; R475-E535 PolarHBondContact NH1-OE2 3.23Å; R475-D538 IonicContact CZ-OD1 2.69Å; R475-D538 IonicContact CZ-OD2 2.75Å; R475-D538 IonicContact NE-OD1 3.66Å; R475-D538 IonicContact NH1-OD1 3.98Å; R475-D538 PolarHBondContact NH1-OD1 3.47Å; R475-D538 VanDerWaalsContact NH1-OD1 3.12Å; R475-D538 IonicContact NH1-OD2 2.62Å; R475-D538 PolarHBondContact NH1-OD2 3.18Å; R475-D538 IonicContact NH2-OD2 3.88Å
476	K	85.5	Confident	75.7	Confident	82 Å²	82	100 Å²	100	36%	0.357	49%	0.491	S	S	.	.	H	α-helix	trans	-69.8	-61.4	179.1	-78.2	-176.1	155.7	-159.3	0	112.1	I472 K478 L530 E533	I472-K476 HydrophobicContact CG2-CD 4.36Å; I472-K476 PolarHBondContact O-N 3Å; K476-K478 PolarHBondContact O-N 3.36Å; K476-K478 VanDerWaalsContact O-N 3.07Å; K476-L530 HydrophobicContact CD-CD2 3.83Å; K476-E533 WeakPolarHBondContact CE-OE2 3.16Å; K476-E533 IonicContact NZ-OE1 2.79Å; K476-E533 PolarHBondContact NZ-OE1 2.68Å; K476-E533 IonicContact NZ-OE2 3.42Å; K476-E533 PolarHBondContact NZ-OE2 3.05Å
477	H	77.8	Confident	74	Confident	109 Å²	109	99.7 Å²	99.7	51%	0.505	49%	0.493	S	S	.	.	S	Bend	trans	-86.9	73.6	174.7	-49.5	-76.3	0	0	0	107.8	S473 R474 K479	S473-H477 CarbonylContact O-C 2.95Å; S473-H477 WeakPolarHBondContact O-CA 3.41Å; S473-H477 VanDerWaalsContact O-CB 3.31Å; S473-H477 WeakPolarHBondContact O-CB 3.4Å; S473-H477 PolarHBondContact O-N 3.11Å; R474-H477 CarbonylContact O-C 3.5Å; H477-K479 HydrophobicContact CB-CG 4.29Å; H477-K479 PolarHBondContact O-N 3.29Å
478	K	65.8	Low	72.2	Confident	174 Å²	174	102.5 Å²	102.5	76%	0.757	51%	0.509	S	S	*	.			trans	-66.2	77	167.8	-169.7	176.7	-177.2	179	0	108.2	R474 K476 T480	R474-K478 WeakPolarHBondContact O-CA 3.37Å; R474-K478 PolarHBondContact O-N 2.71Å; K476-K478 PolarHBondContact O-N 3.36Å; K476-K478 VanDerWaalsContact O-N 3.07Å; K478-T480 VanDerWaalsContact C-N 3.26Å; K478-T480 PolarHBondContact O-N 2.91Å
479	K	56.9	Low	70.2	Confident	174 Å²	174	109.7 Å²	109.7	76%	0.757	55%	0.545	S	S	*	.			trans	-66.8	84.6	-178.1	-71.7	-176.2	-178.1	-176.6	0	108.8	H477 I481	H477-K479 HydrophobicContact CB-CG 4.29Å; H477-K479 PolarHBondContact O-N 3.29Å; K479-I481 PolarHBondContact O-N 2.99Å
480	T	55	Low	68	Low	114 Å²	114	112.7 Å²	112.7	70%	0.699	57%	0.567	S	S	*	*			trans	-59.7	102.8	160.4	-58.5	0	0	0	0	106.9	K478 G482	K478-T480 VanDerWaalsContact C-N 3.26Å; K478-T480 PolarHBondContact O-N 2.91Å; T480-G482 PolarHBondContact O-N 2.95Å
481	I	60.1	Low	65.8	Low	176 Å²	176	115.1 Å²	115.1	90%	0.903	58%	0.581	S	S	*	*			trans	-72.2	87.3	170.4	-61.3	176.1	0	0	0	106.3	K479	K479-I481 PolarHBondContact O-N 2.99Å
482	G	52.5	Low	63.4	Low	37 Å²	37	118.1 Å²	118.1	38%	0.381	60%	0.604	S	S	.	*			trans	-146.5	145.4	179.1	0	0	0	0	0	109.3	T480 D484	T480-G482 PolarHBondContact O-N 2.95Å; G482-D484 PolarHBondContact O-N 3.5Å; G482-D484 VanDerWaalsContact O-N 3.11Å
483	F	64.8	Low	60.7	Low	204 Å²	204	124 Å²	124	90%	0.895	64%	0.641	S	S	*	*	G	3₁₀ helix	trans	-64.5	-16.8	-171.1	-72.5	-91.4	0	0	0	114.2	M485	F483-M485 VanDerWaalsContact C-N 3.31Å; F483-M485 PolarHBondContact O-N 2.99Å
484	D	59.8	Low	58.1	Low	148 Å²	148	127 Å²	127	79%	0.791	67%	0.667	S	S	*	*	G	3₁₀ helix	trans	-62.6	-26.3	-176.8	-77.9	-28.2	0	0	0	115.3	G482 L486 T487	G482-D484 PolarHBondContact O-N 3.5Å; G482-D484 VanDerWaalsContact O-N 3.11Å; D484-L486 VanDerWaalsContact C-N 3.35Å; D484-L486 PolarHBondContact O-N 2.74Å; D484-T487 PolarHBondContact O-N 2.76Å; D484-T487 PolarHBondContact O-OG1 3.33Å
485	M	55	Low	55.7	Low	130 Å²	130	126.3 Å²	126.3	64%	0.64	67%	0.672	S	S	*	*	G	3₁₀ helix	trans	-76.8	-16.3	-171	-155.1	179.5	177.1	0	0	114.3	F483 T487 S488	F483-M485 VanDerWaalsContact C-N 3.31Å; F483-M485 PolarHBondContact O-N 2.99Å; M485-T487 PolarHBondContact O-N 3.38Å; M485-S488 PolarHBondContact O-N 3.4Å; M485-S488 PolarHBondContact O-OG 3.25Å
486	L	52.1	Low	53.1	Low	150 Å²	150	128.9 Å²	128.9	79%	0.785	69%	0.691	S	S	*	*	G	3₁₀ helix	trans	-60.6	-33.1	175.8	-109.4	76	0	0	0	112	D484 S488 M489	D484-L486 VanDerWaalsContact C-N 3.35Å; D484-L486 PolarHBondContact O-N 2.74Å; L486-S488 VanDerWaalsContact C-N 3.26Å; L486-S488 PolarHBondContact O-N 2.8Å; L486-M489 PolarHBondContact O-N 2.82Å
487	T	53.6	Low	50.6	Low	97 Å²	97	133.7 Å²	133.7	60%	0.595	71%	0.712	S	S	*	*	G	3₁₀ helix	trans	-64	-28.7	-177.7	-27.9	0	0	0	0	113	D484 M485 M489 S490	D484-T487 PolarHBondContact O-N 2.76Å; D484-T487 PolarHBondContact O-OG1 3.33Å; M485-T487 PolarHBondContact O-N 3.38Å; T487-M489 VanDerWaalsContact C-N 3.33Å; T487-M489 PolarHBondContact O-N 3.3Å; T487-S490 PolarHBondContact O-OG 3.26Å; T487-S490 VanDerWaalsContact O-OG 3.1Å
488	S	51	Low	48.4	Very low	80 Å²	80	134.8 Å²	134.8	56%	0.559	73%	0.731	S	S	*	*	G	3₁₀ helix	trans	-82.6	-2.9	-176.7	57.5	0	0	0	0	115.1	M485 L486	M485-S488 PolarHBondContact O-N 3.4Å; M485-S488 PolarHBondContact O-OG 3.25Å; L486-S488 VanDerWaalsContact C-N 3.26Å; L486-S488 PolarHBondContact O-N 2.8Å
489	M	51	Low	46.9	Very low	150 Å²	150	132.6 Å²	132.6	74%	0.739	73%	0.732	S	S	*	*	T	Hydrogen-bonded Turn	trans	-118	-4.7	178.3	-71.5	-165.7	153.9	0	0	114.2	L486 T487	L486-M489 PolarHBondContact O-N 2.82Å; T487-M489 VanDerWaalsContact C-N 3.33Å; T487-M489 PolarHBondContact O-N 3.3Å
490	S	44	Very low	46.1	Very low	85 Å²	85	129 Å²	129	59%	0.594	73%	0.728	S	S	*	*	S	Bend	trans	-81	-12.1	-179.7	42.2	0	0	0	0	115.4	T487	T487-S490 PolarHBondContact O-OG 3.26Å; T487-S490 VanDerWaalsContact O-OG 3.1Å
491	E	46	Very low	45.4	Very low	183 Å²	183	129.8 Å²	129.8	86%	0.855	74%	0.736	S	S	*	*	S	Bend	trans	-98.4	-5	-173.1	-64.6	-169.4	143.5	0	0	114.7
492	S	40.6	Very low	44.4	Very low	91 Å²	91	127.5 Å²	127.5	64%	0.636	73%	0.73	S	S	*	*	S	Bend	trans	-128.5	64.2	-177.4	62.9	0	0	0	0	112.9
493	T	35.7	Very low	44.1	Very low	124 Å²	124	132.2 Å²	132.2	76%	0.761	75%	0.746	S	S	*	*			trans	175.1	71.9	140.6	-64.1	0	0	0	0	108.5	Q495	T493-Q495 PolarHBondContact O-N 3.4Å
494	A	34.4	Very low	43.1	Very low	99 Å²	99	128 Å²	128	82%	0.818	74%	0.74	S	S	*	*			trans	-88.1	48.4	173.9	0	0	0	0	0	111.8
495	Q	38.5	Very low	42.2	Very low	166 Å²	166	124.9 Å²	124.9	78%	0.776	73%	0.729	S	S	*	*			trans	-169	90.8	175	-106.8	163.3	34.1	0	0	109.4	T493	T493-Q495 PolarHBondContact O-N 3.4Å
496	D	34.7	Very low	41.9	Very low	134 Å²	134	123.7 Å²	123.7	72%	0.717	74%	0.74	S	S	*	*				172.9	115	119.5	-99.7	-37.7	0	0	0	114.6
497	K	34.1	Very low	41.7	Very low	183 Å²	183	121 Å²	121	80%	0.796	73%	0.73	S	S	*	*			trans	42.3	74.5	142.9	-63.7	170.5	-176.5	158.9	0	120.4	T499	K497-T499 PolarHBondContact O-N 3.08Å; K497-T499 VanDerWaalsContact O-N 3.16Å
498	C	30.1	Very low	41.3	Very low	132 Å²	132	120.8 Å²	120.8	89%	0.892	73%	0.725	S	S	*	*			trans	-77.5	77.9	149.3	-74.1	0	0	0	0	112.1
499	T	35.4	Very low	41.1	Very low	127 Å²	127	121.5 Å²	121.5	78%	0.779	73%	0.73	S	S	*	*			trans	-160.1	94.6	164.6	33.5	0	0	0	0	113.8	K497	K497-T499 PolarHBondContact O-N 3.08Å; K497-T499 VanDerWaalsContact O-N 3.16Å
500	S	40.6	Very low	41.2	Very low	98 Å²	98	120.4 Å²	120.4	69%	0.685	73%	0.727	S	S	*	*			trans	-173.8	130.5	140.1	48	0	0	0	0	111.2
501	P	38.9	Very low	41.5	Very low	131 Å²	131	120.5 Å²	120.5	85%	0.851	72%	0.72	S	S	*	*	P	Polyproline II helix	trans	-80.8	118.1	166.3	31.8	-29.1	0	0	0	108.8
502	V	40.6	Very low	41.8	Very low	128 Å²	128	116.9 Å²	116.9	78%	0.776	71%	0.706	S	S	*	*	P	Polyproline II helix	trans	-101.2	130.5	176.6	-177.9	0	0	0	0	109.4
503	N	46.5	Very low	42.3	Very low	136 Å²	136	118.8 Å²	118.8	73%	0.727	70%	0.703	S	S	*	*	P	Polyproline II helix	trans	-67.4	142.3	-174.8	-62.5	-50.9	0	0	0	111.7	S505	N503-S505 PolarHBondContact O-N 3.32Å
504	P	43.6	Very low	43.1	Very low	117 Å²	117	118.4 Å²	118.4	76%	0.76	69%	0.693	S	S	*	*			trans	-74.5	107.3	174	30.5	-32.6	0	0	0	109.9
505	S	40.6	Very low	44.2	Very low	81 Å²	81	117.2 Å²	117.2	57%	0.566	68%	0.678	S	S	*	*			trans	-130.3	84.2	-179.2	61.7	0	0	0	0	112.6	N503 T507	N503-S505 PolarHBondContact O-N 3.32Å; S505-T507 PolarHBondContact O-N 2.81Å; S505-T507 PolarHBondContact O-OG1 3.02Å
506	A	49.3	Very low	45	Very low	106 Å²	106	115.8 Å²	115.8	88%	0.876	67%	0.67	S	S	*	*	S	Bend	trans	53.4	-0.5	154	0	0	0	0	0	120.6
507	T	46.7	Very low	46.1	Very low	92 Å²	92	113.8 Å²	113.8	56%	0.564	66%	0.656	S	S	*	*			trans	-107.8	-3.4	-177.2	50.8	0	0	0	0	114.1	S505 S509	S505-T507 PolarHBondContact O-N 2.81Å; S505-T507 PolarHBondContact O-OG1 3.02Å; T507-S509 VanDerWaalsContact C-N 3.26Å; T507-S509 PolarHBondContact O-N 3.35Å
508	D	44.6	Very low	47.4	Very low	94 Å²	94	108 Å²	108	50%	0.503	64%	0.639	S	S	.	*	H	α-helix	trans	-68.5	-17.5	-173.5	-65.3	-42.1	0	0	0	114.7	L512	D508-L512 VanDerWaalsContact O-CB 3.23Å; D508-L512 WeakPolarHBondContact O-CB 3.41Å; D508-L512 PolarHBondContact O-N 2.98Å
509	S	48.3	Very low	49.3	Very low	94 Å²	94	103.6 Å²	103.6	66%	0.657	61%	0.609	S	S	*	*	H	α-helix	trans	-68	-37	179.9	50.2	0	0	0	0	113.3	T507 F513	T507-S509 VanDerWaalsContact C-N 3.26Å; T507-S509 PolarHBondContact O-N 3.35Å; S509-F513 PolarHBondContact O-N 2.71Å
510	L	52.5	Low	51	Low	128 Å²	128	99.1 Å²	99.1	67%	0.67	59%	0.586	S	S	*	*	H	α-helix	trans	-73.1	-45.8	175.8	-101.6	163.2	0	0	0	111.2	L512 F513 Q514	L510-L512 VanDerWaalsContact C-N 3.34Å; L510-L512 PolarHBondContact O-N 3.46Å; L510-F513 PolarHBondContact O-N 2.84Å; L510-Q514 WeakPolarHBondContact O-CB 3.41Å; L510-Q514 PolarHBondContact O-N 3.29Å
511	N	49.2	Very low	52.5	Low	87 Å²	87	98.3 Å²	98.3	47%	0.465	57%	0.571	S	S	.	*	H	α-helix	trans	-61.7	-41	178.2	-70.8	-20.8	0	0	0	111.8	F513 Q514 S515	N511-F513 PolarHBondContact O-N 3.41Å; N511-Q514 PolarHBondContact O-N 3.31Å; N511-S515 WeakPolarHBondContact O-CB 3.37Å; N511-S515 PolarHBondContact O-N 2.83Å; N511-S515 PolarHBondContact O-OG 3.04Å
512	L	53.5	Low	54.4	Low	106 Å²	106	98 Å²	98	56%	0.555	56%	0.558	S	S	*	*	H	α-helix	trans	-62.9	-43.5	178.1	-175.4	63.6	0	0	0	112.1	D508 L510 S515 F516	D508-L512 VanDerWaalsContact O-CB 3.23Å; D508-L512 WeakPolarHBondContact O-CB 3.41Å; D508-L512 PolarHBondContact O-N 2.98Å; L510-L512 VanDerWaalsContact C-N 3.34Å; L510-L512 PolarHBondContact O-N 3.46Å; L512-S515 PolarHBondContact O-N 2.91Å; L512-F516 HydrophobicContact CD1-CD2 4.23Å; L512-F516 HydrophobicContact CD1-CE2 3.83Å; L512-F516 HydrophobicContact CD2-CE2 4.48Å; L512-F516 HydrophobicContact CG-CD2 4.12Å; L512-F516 HydrophobicContact CG-CE2 3.92Å; L512-F516 VanDerWaalsContact O-CD2 3.24Å; L512-F516 WeakPolarHBondContact O-CD2 3.49Å; L512-F516 PolarHBondContact O-N 2.92Å; L512-F516 VanDerWaalsContact O-N 3.09Å
513	F	50.7	Low	56.2	Low	131 Å²	131	98.2 Å²	98.2	58%	0.575	55%	0.551	S	S	*	*	H	α-helix	trans	-63.4	-43.3	177	-168.3	-95.8	0	0	0	111.5	S509 L510 N511 S515 F516 E517	S509-F513 PolarHBondContact O-N 2.71Å; L510-F513 PolarHBondContact O-N 2.84Å; N511-F513 PolarHBondContact O-N 3.41Å; F513-S515 VanDerWaalsContact C-N 3.32Å; F513-S515 PolarHBondContact O-N 2.86Å; F513-F516 WeakPolarHBondContact O-CB 3.31Å; F513-F516 PolarHBondContact O-N 3.16Å; F513-F516 VanDerWaalsContact O-N 3.11Å; F513-E517 HydrophobicContact CD1-CG 4.32Å; F513-E517 HydrophobicContact CE1-CG 4.02Å; F513-E517 WeakPolarHBondContact CE1-OE1 3.5Å; F513-E517 PolarHBondContact O-N 3.44Å
514	Q	53.3	Low	57.9	Low	117 Å²	117	94.9 Å²	94.9	55%	0.547	53%	0.533	S	S	.	.	H	α-helix	trans	-70.1	-27.3	178.9	-155	162.9	25.2	0	0	113.2	L510 N511 S518	L510-Q514 WeakPolarHBondContact O-CB 3.41Å; L510-Q514 PolarHBondContact O-N 3.29Å; N511-Q514 PolarHBondContact O-N 3.31Å; Q514-S518 WeakPolarHBondContact O-CB 3.41Å; Q514-S518 PolarHBondContact O-N 3.02Å; Q514-S518 VanDerWaalsContact O-N 3.12Å; Q514-S518 PolarHBondContact O-OG 3.45Å
515	S	56.7	Low	59.8	Low	73 Å²	73	91.7 Å²	91.7	51%	0.51	51%	0.509	S	S	.	.	H	α-helix	trans	-67.1	-38.9	167.4	-62.2	0	0	0	0	112.4	N511 L512 F513 S519	N511-S515 WeakPolarHBondContact O-CB 3.37Å; N511-S515 PolarHBondContact O-N 2.83Å; N511-S515 PolarHBondContact O-OG 3.04Å; L512-S515 PolarHBondContact O-N 2.91Å; F513-S515 VanDerWaalsContact C-N 3.32Å; F513-S515 PolarHBondContact O-N 2.86Å; S515-S519 WeakPolarHBondContact O-CB 3.4Å; S515-S519 PolarHBondContact O-N 2.81Å; S515-S519 PolarHBondContact O-OG 3.36Å
516	F	55.8	Low	62	Low	136 Å²	136	93.8 Å²	93.8	60%	0.596	51%	0.51	S	S	*	.	H	α-helix	trans	-69.2	-36.3	176	-86.2	-68.6	0	0	0	113.2	L512 F513 S519 A520	L512-F516 HydrophobicContact CD1-CD2 4.23Å; L512-F516 HydrophobicContact CD1-CE2 3.83Å; L512-F516 HydrophobicContact CD2-CE2 4.48Å; L512-F516 HydrophobicContact CG-CD2 4.12Å; L512-F516 HydrophobicContact CG-CE2 3.92Å; L512-F516 VanDerWaalsContact O-CD2 3.24Å; L512-F516 WeakPolarHBondContact O-CD2 3.49Å; L512-F516 PolarHBondContact O-N 2.92Å; L512-F516 VanDerWaalsContact O-N 3.09Å; F513-F516 WeakPolarHBondContact O-CB 3.31Å; F513-F516 PolarHBondContact O-N 3.16Å; F513-F516 VanDerWaalsContact O-N 3.11Å; F516-S519 PolarHBondContact O-OG 3.35Å; F516-S519 VanDerWaalsContact O-OG 3.08Å; F516-A520 WeakPolarHBondContact O-CB 3.41Å; F516-A520 PolarHBondContact O-N 2.65Å; F516-A520 VanDerWaalsContact O-N 3.13Å
517	E	57.6	Low	63.8	Low	93 Å²	93	90.6 Å²	90.6	44%	0.435	48%	0.475	S	S	.	.	H	α-helix	trans	-68.1	-43.1	174.2	-70	-171	143.3	0	0	111.5	F513 A520 H521	F513-E517 HydrophobicContact CD1-CG 4.32Å; F513-E517 HydrophobicContact CE1-CG 4.02Å; F513-E517 WeakPolarHBondContact CE1-OE1 3.5Å; F513-E517 PolarHBondContact O-N 3.44Å; E517-A520 PolarHBondContact O-N 3.42Å; E517-H521 PolarHBondContact O-N 3.1Å
518	S	60.8	Low	65.8	Low	61 Å²	61	86.9 Å²	86.9	43%	0.427	45%	0.452	S	S	.	.	H	α-helix	trans	-60	-47.9	175.2	-57.1	0	0	0	0	111.7	Q514 A520 H521 E522	Q514-S518 WeakPolarHBondContact O-CB 3.41Å; Q514-S518 PolarHBondContact O-N 3.02Å; Q514-S518 VanDerWaalsContact O-N 3.12Å; Q514-S518 PolarHBondContact O-OG 3.45Å; S518-A520 VanDerWaalsContact C-N 3.3Å; S518-A520 PolarHBondContact O-N 3.28Å; S518-H521 PolarHBondContact O-N 2.84Å; S518-E522 WeakPolarHBondContact O-CG 3.3Å; S518-E522 PolarHBondContact O-N 3.06Å
519	S	70	Confident	68	Low	39 Å²	39	88.4 Å²	88.4	27%	0.273	45%	0.454	S	S	.	.	H	α-helix	trans	-62.8	-37	179.4	70.4	0	0	0	0	112.2	S515 F516 H521 E522 E523	S515-S519 WeakPolarHBondContact O-CB 3.4Å; S515-S519 PolarHBondContact O-N 2.81Å; S515-S519 PolarHBondContact O-OG 3.36Å; F516-S519 PolarHBondContact O-OG 3.35Å; F516-S519 VanDerWaalsContact O-OG 3.08Å; S519-H521 PolarHBondContact O-N 2.86Å; S519-E522 PolarHBondContact O-N 3.33Å; S519-E523 WeakPolarHBondContact O-CB 3.29Å; S519-E523 VanDerWaalsContact O-CG 3.29Å; S519-E523 WeakPolarHBondContact O-CG 3.48Å; S519-E523 PolarHBondContact O-N 2.93Å
520	A	71	Confident	70.1	Confident	34 Å²	34	85 Å²	85	28%	0.281	43%	0.429	S	S	.	.	H	α-helix	trans	-67.3	-33.1	177.4	0	0	0	0	0	113.1	F516 E517 S518 N524	F516-A520 WeakPolarHBondContact O-CB 3.41Å; F516-A520 PolarHBondContact O-N 2.65Å; F516-A520 VanDerWaalsContact O-N 3.13Å; E517-A520 PolarHBondContact O-N 3.42Å; S518-A520 VanDerWaalsContact C-N 3.3Å; S518-A520 PolarHBondContact O-N 3.28Å; A520-N524 PolarHBondContact O-N 2.8Å; A520-N524 PolarHBondContact O-ND2 2.89Å
521	H	73.6	Confident	71.9	Confident	81 Å²	81	79 Å²	79	38%	0.375	40%	0.397	S	S	.	.	H	α-helix	trans	-72	-45	173.6	-162.1	-63.7	0	0	0	111.1	E517 S518 S519 E523 N524 D525 N562	E517-H521 PolarHBondContact O-N 3.1Å; S518-H521 PolarHBondContact O-N 2.84Å; S519-H521 PolarHBondContact O-N 2.86Å; H521-E523 PolarHBondContact O-N 2.92Å; H521-N524 PolarHBondContact O-N 2.72Å; H521-N524 VanDerWaalsContact O-N 3.16Å; H521-D525 IonicContact CE1-OD1 2.74Å; H521-D525 IonicContact CE1-OD2 3.44Å; H521-D525 PolarHBondContact CE1-OD2 3.05Å; H521-D525 IonicContact ND1-OD1 2.73Å; H521-D525 IonicContact ND1-OD2 3.12Å; H521-D525 PolarHBondContact ND1-OD2 3.49Å; H521-D525 PolarHBondContact O-N 2.81Å; H521-N562 PolarHBondContact NE2-ND2 3.41Å
522	E	77.3	Confident	73.9	Confident	125 Å²	125	79.7 Å²	79.7	58%	0.584	40%	0.397	S	S	*	.	H	α-helix	trans	-60.6	-44.5	177.8	-70.5	175.5	177.5	0	0	111.9	S518 S519 N524 D525 E526	S518-E522 WeakPolarHBondContact O-CG 3.3Å; S518-E522 PolarHBondContact O-N 3.06Å; S519-E522 PolarHBondContact O-N 3.33Å; E522-N524 VanDerWaalsContact C-N 3.3Å; E522-N524 PolarHBondContact O-N 3.14Å; E522-D525 PolarHBondContact O-N 3.35Å; E522-E526 WeakPolarHBondContact O-CB 3.16Å; E522-E526 WeakPolarHBondContact O-CG 3.34Å; E522-E526 PolarHBondContact O-N 3.37Å
523	E	78.3	Confident	75.7	Confident	132 Å²	132	79.5 Å²	79.5	62%	0.617	39%	0.394	S	S	*	.	H	α-helix	trans	-59.3	-37.5	174.4	-78.7	179.4	-155.2	0	0	112.6	S519 H521 R527	S519-E523 WeakPolarHBondContact O-CB 3.29Å; S519-E523 VanDerWaalsContact O-CG 3.29Å; S519-E523 WeakPolarHBondContact O-CG 3.48Å; S519-E523 PolarHBondContact O-N 2.93Å; H521-E523 PolarHBondContact O-N 2.92Å; E523-R527 VanDerWaalsContact O-CB 3.22Å; E523-R527 WeakPolarHBondContact O-CB 3.03Å; E523-R527 PolarHBondContact O-N 2.87Å
524	N	82.2	Confident	77.7	Confident	66 Å²	66	74.5 Å²	74.5	35%	0.353	37%	0.374	S	S	.	.	H	α-helix	trans	-72	-41.3	176.4	-76.9	-49	0	0	0	112.1	A520 H521 E522 E526 R527 D528	A520-N524 PolarHBondContact O-N 2.8Å; A520-N524 PolarHBondContact O-ND2 2.89Å; H521-N524 PolarHBondContact O-N 2.72Å; H521-N524 VanDerWaalsContact O-N 3.16Å; E522-N524 VanDerWaalsContact C-N 3.3Å; E522-N524 PolarHBondContact O-N 3.14Å; N524-E526 VanDerWaalsContact C-N 3.34Å; N524-E526 PolarHBondContact O-N 3.27Å; N524-R527 WeakPolarHBondContact O-CB 3.41Å; N524-R527 PolarHBondContact O-N 3.18Å; N524-D528 WeakPolarHBondContact O-CB 3.29Å; N524-D528 VanDerWaalsContact O-CG 3.28Å; N524-D528 PolarHBondContact O-N 3.32Å
525	D	85.1	Confident	79.7	Confident	50 Å²	50	73.3 Å²	73.3	27%	0.267	37%	0.368	S	S	.	.	H	α-helix	trans	-64.9	-37.8	175.2	-73.9	-40.5	0	0	0	111.8	H521 E522 K529	H521-D525 IonicContact CE1-OD1 2.74Å; H521-D525 IonicContact CE1-OD2 3.44Å; H521-D525 PolarHBondContact CE1-OD2 3.05Å; H521-D525 IonicContact ND1-OD1 2.73Å; H521-D525 IonicContact ND1-OD2 3.12Å; H521-D525 PolarHBondContact ND1-OD2 3.49Å; H521-D525 PolarHBondContact O-N 2.81Å; E522-D525 PolarHBondContact O-N 3.35Å; D525-K529 WeakPolarHBondContact O-CB 3.32Å; D525-K529 VanDerWaalsContact O-CD 3.29Å; D525-K529 WeakPolarHBondContact O-CD 3.12Å; D525-K529 WeakPolarHBondContact O-CG 3.18Å; D525-K529 PolarHBondContact O-N 2.88Å
526	E	85.7	Confident	81.4	Confident	125 Å²	125	71.9 Å²	71.9	58%	0.584	36%	0.361	S	S	*	.	H	α-helix	trans	-65.2	-47.5	171.8	-74.7	-166.9	173.9	0	0	111.8	E522 N524 D528 K529 L530	E522-E526 WeakPolarHBondContact O-CB 3.16Å; E522-E526 WeakPolarHBondContact O-CG 3.34Å; E522-E526 PolarHBondContact O-N 3.37Å; N524-E526 VanDerWaalsContact C-N 3.34Å; N524-E526 PolarHBondContact O-N 3.27Å; E526-D528 VanDerWaalsContact C-N 3.3Å; E526-D528 PolarHBondContact O-N 3.27Å; E526-K529 PolarHBondContact O-N 3.48Å; E526-L530 VanDerWaalsContact O-CG 3.28Å; E526-L530 WeakPolarHBondContact O-CG 3.41Å; E526-L530 PolarHBondContact O-N 3.41Å
527	R	86.5	Confident	83.2	Confident	39 Å²	39	70.1 Å²	70.1	15%	0.147	36%	0.358	C	S	.	.	H	α-helix	trans	-53.4	-47.7	174.3	177.1	-173.7	-178.4	71.5	18.6	111.1	F465 D469 E523 N524 L530 L531	F465-R527 PolarHBondContact O-NH2 3.43Å; D469-R527 HydrophobicContact CB-CG 4.14Å; D469-R527 IonicContact OD1-CZ 2.77Å; D469-R527 IonicContact OD1-NH1 3.38Å; D469-R527 PolarHBondContact OD1-NH1 2.94Å; D469-R527 IonicContact OD1-NH2 2.68Å; D469-R527 IonicContact OD2-NH1 3.36Å; E523-R527 VanDerWaalsContact O-CB 3.22Å; E523-R527 WeakPolarHBondContact O-CB 3.03Å; E523-R527 PolarHBondContact O-N 2.87Å; N524-R527 WeakPolarHBondContact O-CB 3.41Å; N524-R527 PolarHBondContact O-N 3.18Å; R527-L530 PolarHBondContact O-N 3.43Å; R527-L531 HydrophobicContact CG-CD1 3.96Å; R527-L531 HydrophobicContact CG-CG 4.47Å; R527-L531 VanDerWaalsContact O-CG 3.31Å; R527-L531 WeakPolarHBondContact O-CG 3.44Å; R527-L531 PolarHBondContact O-N 3.03Å
528	D	89.1	Confident	84.9	Confident	14 Å²	14	65.9 Å²	65.9	8%	0.075	34%	0.338	C	S	.	.	H	α-helix	trans	-67	-41	-178.7	-74.8	-3.3	0	0	0	112.2	N524 E526 L530 L531 Q532 H559 S560	N524-D528 WeakPolarHBondContact O-CB 3.29Å; N524-D528 VanDerWaalsContact O-CG 3.28Å; N524-D528 PolarHBondContact O-N 3.32Å; E526-D528 VanDerWaalsContact C-N 3.3Å; E526-D528 PolarHBondContact O-N 3.27Å; D528-L530 VanDerWaalsContact C-N 3.32Å; D528-L530 PolarHBondContact O-N 3.47Å; D528-L531 PolarHBondContact O-N 2.91Å; D528-Q532 WeakPolarHBondContact O-CG 3.45Å; D528-Q532 PolarHBondContact O-N 3.04Å; D528-H559 WeakPolarHBondContact OD2-CA 3.36Å; D528-H559 WeakPolarHBondContact OD2-CB 3.43Å; D528-S560 VanDerWaalsContact CG-N 3.34Å; D528-S560 PolarHBondContact OD1-N 3.24Å; D528-S560 PolarHBondContact OD1-OG 3.02Å; D528-S560 WeakPolarHBondContact OD2-CB 3.47Å; D528-S560 PolarHBondContact OD2-N 3.45Å
529	K	90.9	Very high	86.4	Confident	125 Å²	125	63 Å²	63	54%	0.543	32%	0.318	S	S	.	.	H	α-helix	trans	-59.8	-41.6	172.9	-71.9	160.1	-165.9	158.6	0	111.5	D525 E526	D525-K529 WeakPolarHBondContact O-CB 3.32Å; D525-K529 VanDerWaalsContact O-CD 3.29Å; D525-K529 WeakPolarHBondContact O-CD 3.12Å; D525-K529 WeakPolarHBondContact O-CG 3.18Å; D525-K529 PolarHBondContact O-N 2.88Å; E526-K529 PolarHBondContact O-N 3.48Å
530	L	91.7	Very high	87.5	Confident	23 Å²	23	63.8 Å²	63.8	12%	0.12	32%	0.319	C	S	.	.	H	α-helix	trans	-65.7	-48	176.3	-66.6	168.4	0	0	0	111.3	D469 I472 K476 E526 R527 D528 Q532 E533	D469-L530 HydrophobicContact CB-CD1 4.49Å; I472-L530 HydrophobicContact CB-CB 4.4Å; I472-L530 HydrophobicContact CG2-CB 4.02Å; I472-L530 HydrophobicContact CG2-CD2 3.95Å; K476-L530 HydrophobicContact CD-CD2 3.83Å; E526-L530 VanDerWaalsContact O-CG 3.28Å; E526-L530 WeakPolarHBondContact O-CG 3.41Å; E526-L530 PolarHBondContact O-N 3.41Å; R527-L530 PolarHBondContact O-N 3.43Å; D528-L530 VanDerWaalsContact C-N 3.32Å; D528-L530 PolarHBondContact O-N 3.47Å; L530-Q532 PolarHBondContact O-N 3.34Å; L530-E533 PolarHBondContact O-N 3.31Å
531	L	91.4	Very high	88.5	Confident	2 Å²	2	66.1 Å²	66.1	1%	0.01	33%	0.329	C	S	.	.	H	α-helix	trans	-62.5	-26.9	-179.9	-71.2	173.4	0	0	0	113.5	L468 I472 R527 D528 E533 V534 A557	L468-L531 HydrophobicContact CB-CD2 4.44Å; L468-L531 HydrophobicContact CD2-CD2 3.96Å; L468-L531 HydrophobicContact CG-CD2 4.35Å; I472-L531 HydrophobicContact CD1-CD2 4.39Å; R527-L531 HydrophobicContact CG-CD1 3.96Å; R527-L531 HydrophobicContact CG-CG 4.47Å; R527-L531 VanDerWaalsContact O-CG 3.31Å; R527-L531 WeakPolarHBondContact O-CG 3.44Å; R527-L531 PolarHBondContact O-N 3.03Å; D528-L531 PolarHBondContact O-N 2.91Å; L531-E533 PolarHBondContact O-N 2.99Å; L531-V534 WeakPolarHBondContact O-CG1 3.32Å; L531-V534 PolarHBondContact O-N 3.41Å; L531-A557 HydrophobicContact CB-CB 4.01Å; L531-A557 WeakPolarHBondContact O-CB 3.39Å
532	Q	91	Very high	89.4	Confident	101 Å²	101	64 Å²	64	47%	0.472	32%	0.318	S	S	.	.	T	Hydrogen-bonded Turn	trans	-69.1	-16.8	174.6	-77.3	-167.5	58.6	0	0	114.6	D528 L530	D528-Q532 WeakPolarHBondContact O-CG 3.45Å; D528-Q532 PolarHBondContact O-N 3.04Å; L530-Q532 PolarHBondContact O-N 3.34Å
533	E	91	Very high	90	Very high	103 Å²	103	58.3 Å²	58.3	48%	0.481	29%	0.293	S	S	.	.	T	Hydrogen-bonded Turn	trans	-114.8	26.5	179.6	-67.9	178.8	-118.9	0	0	112.1	R475 K476 L530 L531	R475-E533 PolarHBondContact NH2-O 3.01Å; K476-E533 WeakPolarHBondContact CE-OE2 3.16Å; K476-E533 IonicContact NZ-OE1 2.79Å; K476-E533 PolarHBondContact NZ-OE1 2.68Å; K476-E533 IonicContact NZ-OE2 3.42Å; K476-E533 PolarHBondContact NZ-OE2 3.05Å; L530-E533 PolarHBondContact O-N 3.31Å; L531-E533 PolarHBondContact O-N 2.99Å
534	V	93.6	Very high	90.7	Very high	25 Å²	25	52.4 Å²	52.4	15%	0.152	27%	0.266	C	S	.	.			trans	-60.4	138.6	171.3	65	0	0	0	0	111.6	L332 L468 I472 L531 D538 L539 I555	L332-V534 HydrophobicContact CD1-CB 4.18Å; L332-V534 HydrophobicContact CD1-CG1 3.76Å; L332-V534 HydrophobicContact CD1-CG2 3.93Å; L468-V534 HydrophobicContact CD2-CG2 4.09Å; I472-V534 HydrophobicContact CD1-CB 4.06Å; I472-V534 HydrophobicContact CD1-CG2 4.27Å; L531-V534 WeakPolarHBondContact O-CG1 3.32Å; L531-V534 PolarHBondContact O-N 3.41Å; V534-D538 HydrophobicContact CG2-CB 4.33Å; V534-L539 HydrophobicContact CG2-CD2 4.35Å; V534-L539 HydrophobicContact CG2-CG 4.37Å; V534-I555 HydrophobicContact CG1-CG2 3.59Å
535	E	93.6	Very high	91.2	Very high	92 Å²	92	50 Å²	50	43%	0.43	25%	0.253	S	S	.	.			trans	-117.1	163.9	169.2	-64.1	169.3	175.4	0	0	110.4	R475 N537 D538	R475-E535 IonicContact CZ-OE1 3.57Å; R475-E535 IonicContact CZ-OE2 2.68Å; R475-E535 VanDerWaalsContact NH1-CB 3.29Å; R475-E535 IonicContact NH1-OE1 3.56Å; R475-E535 IonicContact NH1-OE2 3.76Å; R475-E535 PolarHBondContact NH1-OE2 3.23Å; E535-N537 PolarHBondContact O-N 3.32Å; E535-N537 VanDerWaalsContact O-N 3.16Å; E535-D538 PolarHBondContact N-OD2 2.81Å; E535-D538 PolarHBondContact O-N 3.35Å
536	A	92.9	Very high	91.6	Very high	43 Å²	43	51 Å²	51	36%	0.355	26%	0.262	S	S	.	.	H	α-helix	trans	-52.5	-36	172.5	0	0	0	0	0	113.1	D538 L539 I540 V549	A536-D538 VanDerWaalsContact C-N 3.29Å; A536-D538 PolarHBondContact O-N 2.95Å; A536-L539 PolarHBondContact O-N 2.86Å; A536-I540 WeakPolarHBondContact O-CG1 3.17Å; A536-I540 PolarHBondContact O-N 3.45Å; A536-V549 HydrophobicContact CB-CG1 3.58Å
537	N	93.3	Very high	92	Very high	99 Å²	99	49.7 Å²	49.7	53%	0.529	26%	0.256	S	S	.	.	H	α-helix	trans	-63.1	-31	179	-67.7	-39.4	0	0	0	113.5	E535 T541	E535-N537 PolarHBondContact O-N 3.32Å; E535-N537 VanDerWaalsContact O-N 3.16Å; N537-T541 WeakPolarHBondContact O-CB 3.31Å; N537-T541 PolarHBondContact O-N 3.44Å; N537-T541 PolarHBondContact O-OG1 3.49Å
538	D	93.9	Very high	92.3	Very high	4 Å²	4	47.9 Å²	47.9	2%	0.021	25%	0.249	C	C	.	.	H	α-helix	trans	-71.5	-39.6	178	-53.9	-53.7	0	0	0	110.6	L468 I471 I472 R475 V534 E535 A536 T541 Y542	L468-D538 HydrophobicContact CD1-CB 3.74Å; I471-D538 HydrophobicContact CG2-CB 4.3Å; I472-D538 HydrophobicContact CG1-CB 4.05Å; R475-D538 IonicContact CZ-OD1 2.69Å; R475-D538 IonicContact CZ-OD2 2.75Å; R475-D538 IonicContact NE-OD1 3.66Å; R475-D538 IonicContact NH1-OD1 3.98Å; R475-D538 PolarHBondContact NH1-OD1 3.47Å; R475-D538 VanDerWaalsContact NH1-OD1 3.12Å; R475-D538 IonicContact NH1-OD2 2.62Å; R475-D538 PolarHBondContact NH1-OD2 3.18Å; R475-D538 IonicContact NH2-OD2 3.88Å; V534-D538 HydrophobicContact CG2-CB 4.33Å; E535-D538 PolarHBondContact N-OD2 2.81Å; E535-D538 PolarHBondContact O-N 3.35Å; A536-D538 VanDerWaalsContact C-N 3.29Å; A536-D538 PolarHBondContact O-N 2.95Å; D538-T541 PolarHBondContact O-N 2.87Å; D538-Y542 WeakPolarHBondContact O-CB 3.35Å; D538-Y542 PolarHBondContact O-N 3.45Å
539	L	93.2	Very high	92.5	Very high	0 Å²	0	47.6 Å²	47.6	0%	0	25%	0.248	C	C	.	.	H	α-helix	trans	-65.6	-38.4	175.8	-60.7	-179.4	0	0	0	111.6	I330 L332 F465 L468 V534 A536 Y542 G543 M544 V549 I555	I330-L539 HydrophobicContact CD1-CD1 4.13Å; L332-L539 HydrophobicContact CD2-CD2 4.34Å; F465-L539 HydrophobicContact CD1-CD2 4.05Å; F465-L539 HydrophobicContact CE1-CD2 3.84Å; F465-L539 HydrophobicContact CZ-CD2 4.37Å; L468-L539 HydrophobicContact CD1-CD2 4.21Å; L468-L539 HydrophobicContact CD2-CD2 3.84Å; V534-L539 HydrophobicContact CG2-CD2 4.35Å; V534-L539 HydrophobicContact CG2-CG 4.37Å; A536-L539 PolarHBondContact O-N 2.86Å; L539-Y542 WeakPolarHBondContact O-CB 3.43Å; L539-Y542 PolarHBondContact O-N 3.39Å; L539-G543 PolarHBondContact O-N 3.06Å; L539-M544 HydrophobicContact CB-CB 4.45Å; L539-M544 HydrophobicContact CB-CG 4.21Å; L539-M544 WeakPolarHBondContact O-CB 3.5Å; L539-M544 PolarHBondContact O-N 3.42Å; L539-V549 HydrophobicContact CB-CG2 4.04Å; L539-V549 HydrophobicContact CD1-CG1 4.21Å; L539-I555 HydrophobicContact CD1-CD1 3.72Å; L539-I555 HydrophobicContact CD1-CG1 4.32Å
540	I	92.8	Very high	92.6	Very high	57 Å²	57	44.4 Å²	44.4	29%	0.292	25%	0.251	S	S	.	.	H	α-helix	trans	-63.1	-47.5	172.9	-65.2	164	0	0	0	110.3	A536 Y542 G543 M544 P546 V549	A536-I540 WeakPolarHBondContact O-CG1 3.17Å; A536-I540 PolarHBondContact O-N 3.45Å; I540-Y542 PolarHBondContact O-N 3.44Å; I540-G543 PolarHBondContact O-N 3.43Å; I540-G543 VanDerWaalsContact O-N 3.07Å; I540-M544 WeakPolarHBondContact CA-O 3.17Å; I540-P546 HydrophobicContact CD1-CB 3.92Å; I540-P546 HydrophobicContact CD1-CG 4.02Å; I540-P546 HydrophobicContact CG1-CB 4.38Å; I540-P546 HydrophobicContact CG1-CG 4.2Å; I540-P546 HydrophobicContact CG2-CG 4.12Å; I540-V549 HydrophobicContact CG1-CG2 4.18Å
541	T	91.7	Very high	92.7	Very high	83 Å²	83	46.8 Å²	46.8	51%	0.509	26%	0.258	S	S	.	.	H	α-helix	trans	-62.9	-30.3	177.6	-54.8	0	0	0	0	112.5	I471 N537 D538	I471-T541 HydrophobicContact CD1-CG2 4.33Å; I471-T541 HydrophobicContact CG2-CG2 3.74Å; N537-T541 WeakPolarHBondContact O-CB 3.31Å; N537-T541 PolarHBondContact O-N 3.44Å; N537-T541 PolarHBondContact O-OG1 3.49Å; D538-T541 PolarHBondContact O-N 2.87Å
542	Y	92	Very high	92.8	Very high	36 Å²	36	46.8 Å²	46.8	14%	0.141	26%	0.258	C	S	.	.	H	α-helix	trans	-70.4	-27.5	174.9	-176.2	-87	0	0	0	113.3	D401 F465 L468 I471 D538 L539 I540	D401-Y542 HydrophobicContact CB-CE1 4.35Å; F465-Y542 HydrophobicContact CB-CE2 4.42Å; F465-Y542 AromaticContact CD1-CD1 3.76Å; F465-Y542 HydrophobicContact CD1-CD1 3.76Å; F465-Y542 HydrophobicContact CD1-CD2 4.43Å; F465-Y542 AromaticContact CD1-CE1 3.65Å; F465-Y542 HydrophobicContact CD1-CE1 3.65Å; F465-Y542 HydrophobicContact CD1-CE2 4.33Å; F465-Y542 HydrophobicContact CD1-CG 4.18Å; F465-Y542 AromaticContact CD1-CZ 3.96Å; F465-Y542 HydrophobicContact CE1-CD1 4.05Å; F465-Y542 HydrophobicContact CE1-CE1 4.09Å; L468-Y542 HydrophobicContact CB-CD2 4.09Å; L468-Y542 HydrophobicContact CB-CE2 4.4Å; L468-Y542 HydrophobicContact CD1-CD2 4.24Å; L468-Y542 HydrophobicContact CD1-CG 4.45Å; I471-Y542 HydrophobicContact CD1-CD2 4.06Å; I471-Y542 HydrophobicContact CD1-CG 4.44Å; D538-Y542 WeakPolarHBondContact O-CB 3.35Å; D538-Y542 PolarHBondContact O-N 3.45Å; L539-Y542 WeakPolarHBondContact O-CB 3.43Å; L539-Y542 PolarHBondContact O-N 3.39Å; I540-Y542 PolarHBondContact O-N 3.44Å
543	G	90.7	Very high	92.9	Very high	6 Å²	6	46 Å²	46	6%	0.062	26%	0.261	C	S	.	.	T	Hydrogen-bonded Turn	trans	127.9	15.7	179.6	0	0	0	0	0	115.9	S404 S405 Q422 L539 I540	S404-G543 CarbonylContact C-O 3.56Å; S404-G543 WeakPolarHBondContact CA-O 3.44Å; S405-G543 PolarHBondContact N-O 2.96Å; S405-G543 WeakPolarHBondContact O-CA 3.25Å; Q422-G543 PolarHBondContact NE2-O 3.45Å; L539-G543 PolarHBondContact O-N 3.06Å; I540-G543 PolarHBondContact O-N 3.43Å; I540-G543 VanDerWaalsContact O-N 3.07Å
544	M	92.8	Very high	93	Very high	8 Å²	8	42.8 Å²	42.8	4%	0.039	25%	0.247	C	C	.	.			trans	-85.5	144.1	168.7	-61.6	-72	115.2	0	0	110.6	S404 F465 L539 I540 F548 V549	S404-M544 VanDerWaalsContact CA-CE 3.49Å; S404-M544 VanDerWaalsContact CB-CE 3.47Å; F465-M544 HydrophobicContact CE1-CE 4.43Å; L539-M544 HydrophobicContact CB-CB 4.45Å; L539-M544 HydrophobicContact CB-CG 4.21Å; L539-M544 WeakPolarHBondContact O-CB 3.5Å; L539-M544 PolarHBondContact O-N 3.42Å; I540-M544 WeakPolarHBondContact CA-O 3.17Å; M544-F548 HydrophobicContact SD-CD1 4.1Å; M544-F548 HydrophobicContact SD-CE1 4.15Å; M544-V549 HydrophobicContact CB-CG2 3.48Å; M544-V549 VanDerWaalsContact CB-CG2 3.48Å; M544-V549 HydrophobicContact CG-CG2 4.23Å
545	I	92.6	Very high	93.1	Very high	14 Å²	14	43.7 Å²	43.7	7%	0.072	25%	0.251	C	S	.	.			trans	-73.3	141	172.3	66.9	178.9	0	0	0	110.4	E419 Q422 Q423 L426 E547 F548 V549	E419-I545 HydrophobicContact CG-CG2 3.88Å; Q422-I545 HydrophobicContact CB-CD1 3.87Å; Q422-I545 HydrophobicContact CB-CG1 4.16Å; Q423-I545 VanDerWaalsContact CD-CD1 3.49Å; Q423-I545 HydrophobicContact CG-CD1 3.98Å; L426-I545 HydrophobicContact CD1-CD1 4.12Å; L426-I545 HydrophobicContact CD2-CD1 4.48Å; L426-I545 HydrophobicContact CG-CD1 4.48Å; I545-E547 PolarHBondContact O-N 3.45Å; I545-F548 HydrophobicContact CD1-CB 4.02Å; I545-F548 HydrophobicContact CG1-CB 3.36Å; I545-F548 WeakPolarHBondContact O-CB 3.22Å; I545-F548 PolarHBondContact O-N 3.29Å; I545-F548 VanDerWaalsContact O-N 3.08Å; I545-V549 PolarHBondContact O-N 3.04Å; I545-V549 VanDerWaalsContact O-N 3.16Å
546	P	93.1	Very high	93.1	Very high	72 Å²	72	39.5 Å²	39.5	47%	0.468	23%	0.232	S	C	.	.	H	α-helix	trans	-56.3	-36.2	-178.7	-26.1	34.6	0	0	0	113.9	I540 F548 V549 G550	I540-P546 HydrophobicContact CD1-CB 3.92Å; I540-P546 HydrophobicContact CD1-CG 4.02Å; I540-P546 HydrophobicContact CG1-CB 4.38Å; I540-P546 HydrophobicContact CG1-CG 4.2Å; I540-P546 HydrophobicContact CG2-CG 4.12Å; P546-F548 VanDerWaalsContact C-N 3.31Å; P546-F548 PolarHBondContact O-N 3.13Å; P546-V549 PolarHBondContact O-N 2.84Å; P546-G550 PolarHBondContact O-N 3.28Å
547	E	93.5	Very high	93.2	Very high	98 Å²	98	38.1 Å²	38.1	46%	0.458	22%	0.22	S	C	.	.	H	α-helix	trans	-63.5	-37.9	178.5	-58.9	84.3	170.6	0	0	111.6	L426 I545 R551	L426-E547 HydrophobicContact CD1-CB 3.89Å; L426-E547 HydrophobicContact CD2-CB 4.25Å; I545-E547 PolarHBondContact O-N 3.45Å; E547-R551 WeakPolarHBondContact O-CG 3.48Å; E547-R551 PolarHBondContact O-N 3.34Å
548	F	93.5	Very high	93.2	Very high	1 Å²	1	33.5 Å²	33.5	0%	0.004	20%	0.196	C	C	.	.	H	α-helix	trans	-71.4	-48.2	178.7	-175.9	-92	0	0	0	110.4	I400 Q422 M425 L426 L429 M544 I545 P546 G550 R551 F552	I400-F548 HydrophobicContact CD1-CE1 4.37Å; I400-F548 HydrophobicContact CD1-CZ 3.78Å; I400-F548 HydrophobicContact CG1-CE1 4.13Å; I400-F548 HydrophobicContact CG1-CZ 4.04Å; Q422-F548 HydrophobicContact CB-CD2 4.28Å; M425-F548 HydrophobicContact CB-CE2 4.21Å; M425-F548 HydrophobicContact SD-CE2 4.39Å; L426-F548 HydrophobicContact CD2-CB 3.99Å; L426-F548 HydrophobicContact CD2-CD2 4.19Å; L429-F548 HydrophobicContact CD1-CD2 3.79Å; L429-F548 HydrophobicContact CD1-CE2 3.47Å; L429-F548 VanDerWaalsContact CD1-CE2 3.47Å; L429-F548 HydrophobicContact CD1-CZ 4.19Å; M544-F548 HydrophobicContact SD-CD1 4.1Å; M544-F548 HydrophobicContact SD-CE1 4.15Å; I545-F548 HydrophobicContact CD1-CB 4.02Å; I545-F548 HydrophobicContact CG1-CB 3.36Å; I545-F548 WeakPolarHBondContact O-CB 3.22Å; I545-F548 PolarHBondContact O-N 3.29Å; I545-F548 VanDerWaalsContact O-N 3.08Å; P546-F548 VanDerWaalsContact C-N 3.31Å; P546-F548 PolarHBondContact O-N 3.13Å; F548-G550 VanDerWaalsContact C-N 3.25Å; F548-G550 PolarHBondContact O-N 3.24Å; F548-R551 PolarHBondContact O-N 3.39Å; F548-F552 HydrophobicContact CD1-CD2 4.3Å; F548-F552 HydrophobicContact CD1-CE2 4.18Å; F548-F552 HydrophobicContact CE1-CD2 4.02Å; F548-F552 AromaticContact CE1-CE2 3.59Å; F548-F552 HydrophobicContact CE1-CE2 3.59Å; F548-F552 AromaticContact CE2-CE2 3.99Å; F548-F552 HydrophobicContact CE2-CE2 3.99Å; F548-F552 HydrophobicContact CZ-CD2 4.34Å; F548-F552 AromaticContact CZ-CE2 3.47Å; F548-F552 HydrophobicContact CZ-CE2 3.47Å; F548-F552 VanDerWaalsContact CZ-CE2 3.47Å; F548-F552 HydrophobicContact CZ-CZ 4.17Å; F548-F552 WeakPolarHBondContact O-CD2 3.39Å
549	V	93.6	Very high	93.1	Very high	7 Å²	7	35.6 Å²	35.6	4%	0.042	21%	0.205	C	C	.	.	H	α-helix	trans	-60.4	-37.2	175.8	-175.7	0	0	0	0	111.2	A536 L539 I540 M544 I545 P546 R551 F552	A536-V549 HydrophobicContact CB-CG1 3.58Å; L539-V549 HydrophobicContact CB-CG2 4.04Å; L539-V549 HydrophobicContact CD1-CG1 4.21Å; I540-V549 HydrophobicContact CG1-CG2 4.18Å; M544-V549 HydrophobicContact CB-CG2 3.48Å; M544-V549 VanDerWaalsContact CB-CG2 3.48Å; M544-V549 HydrophobicContact CG-CG2 4.23Å; I545-V549 PolarHBondContact O-N 3.04Å; I545-V549 VanDerWaalsContact O-N 3.16Å; P546-V549 PolarHBondContact O-N 2.84Å; V549-R551 PolarHBondContact O-N 3.23Å; V549-R551 VanDerWaalsContact O-N 3.17Å; V549-F552 PolarHBondContact O-N 3.16Å
550	G	92.9	Very high	93	Very high	59 Å²	59	36 Å²	36	61%	0.608	21%	0.208	S	C	*	.	H	α-helix	trans	-60.1	-21.6	174.7	0	0	0	0	0	114.8	P546 F548	P546-G550 PolarHBondContact O-N 3.28Å; F548-G550 VanDerWaalsContact C-N 3.25Å; F548-G550 PolarHBondContact O-N 3.24Å
551	R	93.2	Very high	92.9	Very high	73 Å²	73	34.2 Å²	34.2	28%	0.275	20%	0.199	S	C	.	.	T	Hydrogen-bonded Turn	trans	-84.6	-7.9	173.8	-57.4	-64.5	157.1	63.2	-12.7	113.7	N328 L426 L429 E430 E547 F548 V549 P553	N328-R551 WeakPolarHBondContact CB-O 3.35Å; N328-R551 PolarHBondContact ND2-O 2.97Å; L426-R551 HydrophobicContact CD2-CG 4.42Å; L429-R551 HydrophobicContact CB-CB 4.11Å; L429-R551 HydrophobicContact CB-CG 4.16Å; L429-R551 HydrophobicContact CD1-CB 4.37Å; E430-R551 IonicContact OE1-CZ 3.2Å; E430-R551 IonicContact OE1-NH1 2.81Å; E430-R551 PolarHBondContact OE1-NH1 3.13Å; E430-R551 IonicContact OE1-NH2 3.09Å; E430-R551 PolarHBondContact OE1-NH2 3.45Å; E547-R551 WeakPolarHBondContact O-CG 3.48Å; E547-R551 PolarHBondContact O-N 3.34Å; F548-R551 PolarHBondContact O-N 3.39Å; V549-R551 PolarHBondContact O-N 3.23Å; V549-R551 VanDerWaalsContact O-N 3.17Å; R551-P553 VanDerWaalsContact C-CD 3.43Å; R551-P553 WeakPolarHBondContact O-CD 3.32Å
552	F	93.9	Very high	92.8	Very high	2 Å²	2	32.5 Å²	32.5	1%	0.009	19%	0.187	C	C	.	.			trans	-116	75.7	178.9	-70.8	-83.5	0	0	0	110.6	N328 I330 L429 F459 A461 F548 V549 I554	N328-F552 HydrophobicContact CB-CD1 3.47Å; N328-F552 VanDerWaalsContact CB-CD1 3.47Å; N328-F552 HydrophobicContact CB-CE1 3.6Å; N328-F552 HydrophobicContact CB-CG 4.25Å; N328-F552 HydrophobicContact CB-CZ 4.45Å; I330-F552 HydrophobicContact CD1-CB 3.39Å; I330-F552 HydrophobicContact CD1-CD1 4.26Å; I330-F552 HydrophobicContact CD1-CD2 3.99Å; I330-F552 HydrophobicContact CD1-CG 3.64Å; I330-F552 HydrophobicContact CG1-CB 3.63Å; I330-F552 HydrophobicContact CG1-CD1 3.64Å; I330-F552 HydrophobicContact CG1-CD2 4.19Å; I330-F552 HydrophobicContact CG1-CE1 4.32Å; I330-F552 HydrophobicContact CG1-CG 3.57Å; L429-F552 HydrophobicContact CD1-CE2 3.51Å; L429-F552 HydrophobicContact CD1-CZ 3.9Å; L429-F552 HydrophobicContact CD2-CE2 4.2Å; L429-F552 HydrophobicContact CD2-CZ 3.77Å; F459-F552 HydrophobicContact CB-CE1 4.48Å; A461-F552 HydrophobicContact CB-CE1 3.79Å; A461-F552 HydrophobicContact CB-CZ 3.89Å; F548-F552 HydrophobicContact CD1-CD2 4.3Å; F548-F552 HydrophobicContact CD1-CE2 4.18Å; F548-F552 HydrophobicContact CE1-CD2 4.02Å; F548-F552 AromaticContact CE1-CE2 3.59Å; F548-F552 HydrophobicContact CE1-CE2 3.59Å; F548-F552 AromaticContact CE2-CE2 3.99Å; F548-F552 HydrophobicContact CE2-CE2 3.99Å; F548-F552 HydrophobicContact CZ-CD2 4.34Å; F548-F552 AromaticContact CZ-CE2 3.47Å; F548-F552 HydrophobicContact CZ-CE2 3.47Å; F548-F552 VanDerWaalsContact CZ-CE2 3.47Å; F548-F552 HydrophobicContact CZ-CZ 4.17Å; F548-F552 WeakPolarHBondContact O-CD2 3.39Å; V549-F552 PolarHBondContact O-N 3.16Å; F552-I554 PolarHBondContact O-N 3.41Å; F552-I554 VanDerWaalsContact O-N 3.17Å
553	P	92.8	Very high	92.8	Very high	83 Å²	83	33.1 Å²	33.1	54%	0.539	19%	0.191	S	C	.	.			trans	-65.1	-18.8	-177.9	27.1	-35.8	0	0	0	113.4	R551	R551-P553 VanDerWaalsContact C-CD 3.43Å; R551-P553 WeakPolarHBondContact O-CD 3.32Å
554	I	94.5	Very high	92.9	Very high	36 Å²	36	40.3 Å²	40.3	19%	0.185	22%	0.223	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-108.9	110.4	179.4	-50	-61.3	0	0	0	109.9	I193 Q197 I329 I330 F552	I193-I554 HydrophobicContact CG2-CG2 3.66Å; Q197-I554 HydrophobicContact CG-CB 4.49Å; Q197-I554 HydrophobicContact CG-CD1 4.45Å; Q197-I554 HydrophobicContact CG-CG1 3.98Å; Q197-I554 HydrophobicContact CG-CG2 4.06Å; I329-I554 CarbonylContact C-O 3.6Å; I329-I554 WeakPolarHBondContact CA-O 3.36Å; I329-I554 HydrophobicContact CG1-CB 4.35Å; I329-I554 HydrophobicContact CG2-CB 4.41Å; I329-I554 HydrophobicContact CG2-CG2 4.15Å; I330-I554 PolarHBondContact N-O 3.38Å; F552-I554 PolarHBondContact O-N 3.41Å; F552-I554 VanDerWaalsContact O-N 3.17Å
555	I	94.5	Very high	92.8	Very high	44 Å²	44	42.2 Å²	42.2	23%	0.226	23%	0.232	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-107	134.9	171.4	-55.2	165.7	0	0	0	108	I330 L332 V534 L539	I330-I555 HydrophobicContact CG2-CG2 4.47Å; L332-I555 HydrophobicContact CD1-CG2 3.68Å; L332-I555 HydrophobicContact CG-CG2 4.09Å; V534-I555 HydrophobicContact CG1-CG2 3.59Å; L539-I555 HydrophobicContact CD1-CD1 3.72Å; L539-I555 HydrophobicContact CD1-CG1 4.32Å
556	T	94.4	Very high	92.9	Very high	5 Å²	5	41.5 Å²	41.5	3%	0.031	23%	0.229	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-142.8	123.5	-177.1	-70.3	0	0	0	0	110.4	A190 I193 I330 L331 L332	A190-T556 HydrophobicContact CB-CG2 3.66Å; I193-T556 HydrophobicContact CD1-CG2 4.05Å; I193-T556 WeakPolarHBondContact CD1-OG1 3.49Å; I193-T556 WeakPolarHBondContact CG2-OG1 3.49Å; I330-T556 PolarHBondContact O-N 2.96Å; L331-T556 WeakPolarHBondContact CA-O 3.09Å; L331-T556 HydrophobicContact CD2-CG2 4.07Å; L332-T556 PolarHBondContact N-O 3.49Å
557	A	94.2	Very high	92.9	Very high	14 Å²	14	39.5 Å²	39.5	12%	0.116	22%	0.215	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-95.1	133.1	174.7	0	0	0	0	0	111.6	L332 L531	L332-A557 HydrophobicContact CB-CB 4.33Å; L531-A557 HydrophobicContact CB-CB 4.01Å; L531-A557 WeakPolarHBondContact O-CB 3.39Å
558	L	94.2	Very high	93	Very high	2 Å²	2	39.6 Å²	39.6	1%	0.01	21%	0.211	C	C	.	.	P	Polyproline II helix	trans	-86.6	140.5	163.3	-79.8	73.2	0	0	0	109	Q187 A190 L331 L332 K339 L342	Q187-L558 HydrophobicContact CG-CD2 4.11Å; Q187-L558 HydrophobicContact CG-CG 4.27Å; Q187-L558 VanDerWaalsContact OE1-CB 3.23Å; A190-L558 HydrophobicContact CB-CD1 3.82Å; A190-L558 HydrophobicContact CB-CG 4.05Å; L331-L558 HydrophobicContact CB-CD1 4.42Å; L331-L558 HydrophobicContact CD2-CD1 4.25Å; L332-L558 PolarHBondContact O-N 3.1Å; K339-L558 HydrophobicContact CG-CD1 4.31Å; K339-L558 HydrophobicContact CG-CD2 3.94Å; L342-L558 HydrophobicContact CD2-CD2 4.36Å
559	H	91.8	Very high	93	Very high	47 Å²	47	41.1 Å²	41.1	22%	0.218	22%	0.221	C	C	.	.	P	Polyproline II helix	trans	-73.9	161.2	172.4	61.9	77.5	0	0	0	110.9	Q187 D528 M565	Q187-H559 WeakPolarHBondContact CA-NE2 3.42Å; Q187-H559 VanDerWaalsContact CD-NE2 3.35Å; Q187-H559 PolarHBondContact N-NE2 2.94Å; Q187-H559 PolarHBondContact NE2-CE1 3.3Å; Q187-H559 VanDerWaalsContact NE2-CE1 3.33Å; Q187-H559 PolarHBondContact NE2-ND1 2.85Å; Q187-H559 PolarHBondContact NE2-O 3.45Å; Q187-H559 PolarHBondContact OE1-CD2 3.02Å; Q187-H559 PolarHBondContact OE1-NE2 3.45Å; D528-H559 WeakPolarHBondContact OD2-CA 3.36Å; D528-H559 WeakPolarHBondContact OD2-CB 3.43Å; H559-M565 VanDerWaalsContact CE1-CE 3.5Å; H559-M565 WeakPolarHBondContact CE1-CE 3.47Å; H559-M565 PolarHBondContact CE1-SD 3.39Å
560	S	90.9	Very high	93	Very high	9 Å²	9	40.8 Å²	40.8	6%	0.063	22%	0.218	C	C	.	.	P	Polyproline II helix	trans	-69.6	162.4	170.3	-60.2	0	0	0	0	110.2	S334 D528	S334-S560 PolarHBondContact OG-OG 3.25Å; D528-S560 VanDerWaalsContact CG-N 3.34Å; D528-S560 PolarHBondContact OD1-N 3.24Å; D528-S560 PolarHBondContact OD1-OG 3.02Å; D528-S560 WeakPolarHBondContact OD2-CB 3.47Å; D528-S560 PolarHBondContact OD2-N 3.45Å
561	L	90.1	Very high	93	Very high	20 Å²	20	40.4 Å²	40.4	11%	0.105	20%	0.204	C	C	.	.	P	Polyproline II helix	trans	-101	122.6	-174	-64.9	177.8	0	0	0	110.5	G336 M565 L566 L607 A613	G336-L561 WeakPolarHBondContact O-CD1 3.37Å; L561-M565 HydrophobicContact CD2-CB 4.44Å; L561-M565 HydrophobicContact CD2-SD 4.48Å; L561-L566 HydrophobicContact CB-CD2 4.01Å; L561-L566 HydrophobicContact CB-CG 4.18Å; L561-L566 HydrophobicContact CD1-CD2 3.84Å; L561-L607 WeakPolarHBondContact O-CD2 3.42Å; L561-A613 HydrophobicContact CD1-CB 3.84Å
562	N	89.9	Confident	93	Very high	47 Å²	47	41.5 Å²	41.5	25%	0.251	21%	0.212	S	C	.	.	P	Polyproline II helix	trans	-86.2	167.8	179.2	-57.5	10.1	0	0	0	111	H521 E564 M565 L566	H521-N562 PolarHBondContact NE2-ND2 3.41Å; N562-E564 VanDerWaalsContact C-N 3.34Å; N562-E564 PolarHBondContact O-N 3.31Å; N562-M565 WeakPolarHBondContact O-CB 3.42Å; N562-M565 PolarHBondContact O-N 3.48Å; N562-L566 PolarHBondContact O-N 3.14Å
563	E	91.2	Very high	92.9	Very high	49 Å²	49	41.8 Å²	41.8	23%	0.229	22%	0.215	C	C	.	.	H	α-helix	trans	-51	-51.2	179.8	-176.7	-178.1	142	0	0	111.8	M565 L566 V567 K600 A603 R604 L607	E563-M565 VanDerWaalsContact C-N 3.3Å; E563-M565 PolarHBondContact O-N 3.27Å; E563-L566 PolarHBondContact O-N 3.33Å; E563-L566 VanDerWaalsContact O-N 3.17Å; E563-V567 WeakPolarHBondContact O-CG2 3.22Å; E563-V567 PolarHBondContact O-N 3.1Å; E563-K600 WeakPolarHBondContact OE1-CB 3.48Å; E563-A603 HydrophobicContact CG-CB 3.92Å; E563-R604 VanDerWaalsContact CD-NE 3.31Å; E563-R604 HydrophobicContact CG-CG 4.27Å; E563-R604 IonicContact OE1-CZ 2.74Å; E563-R604 IonicContact OE1-NE 3.56Å; E563-R604 PolarHBondContact OE1-NE 3.44Å; E563-R604 IonicContact OE1-NH2 3.63Å; E563-R604 PolarHBondContact OE1-NH2 3.38Å; E563-R604 WeakPolarHBondContact OE2-CG 3.43Å; E563-R604 IonicContact OE2-CZ 2.76Å; E563-R604 IonicContact OE2-NE 3.67Å; E563-R604 PolarHBondContact OE2-NE 3.01Å; E563-R604 IonicContact OE2-NH2 3.92Å; E563-L607 HydrophobicContact CB-CD1 4.08Å
564	E	92.5	Very high	92.6	Very high	157 Å²	157	45.5 Å²	45.5	73%	0.734	22%	0.218	S	C	*	.	H	α-helix	trans	-60.5	-38.2	179.3	-58.3	-174.5	163.2	0	0	112.5	N562 V567 R568	N562-E564 VanDerWaalsContact C-N 3.34Å; N562-E564 PolarHBondContact O-N 3.31Å; E564-V567 PolarHBondContact O-N 3.29Å; E564-R568 WeakPolarHBondContact O-CG 3.34Å; E564-R568 PolarHBondContact O-N 2.98Å
565	M	92.3	Very high	92.1	Very high	47 Å²	47	45.4 Å²	45.4	23%	0.232	22%	0.218	C	C	.	.	H	α-helix	trans	-68.8	-37.6	178	-66.3	179.5	171.6	0	0	111.5	H559 L561 N562 E563 R568 V569	H559-M565 VanDerWaalsContact CE1-CE 3.5Å; H559-M565 WeakPolarHBondContact CE1-CE 3.47Å; H559-M565 PolarHBondContact CE1-SD 3.39Å; L561-M565 HydrophobicContact CD2-CB 4.44Å; L561-M565 HydrophobicContact CD2-SD 4.48Å; N562-M565 WeakPolarHBondContact O-CB 3.42Å; N562-M565 PolarHBondContact O-N 3.48Å; E563-M565 VanDerWaalsContact C-N 3.3Å; E563-M565 PolarHBondContact O-N 3.27Å; M565-R568 PolarHBondContact O-N 3Å; M565-V569 VanDerWaalsContact O-CG2 3.29Å; M565-V569 WeakPolarHBondContact O-CG2 3.39Å; M565-V569 PolarHBondContact O-N 3.18Å
566	L	93	Very high	92	Very high	0 Å²	0	43.4 Å²	43.4	0%	0	21%	0.208	C	C	.	.	H	α-helix	trans	-66.8	-39.4	174.8	-68.3	171.1	0	0	0	111.8	L561 N562 E563 R568 V569 L570 A603 L607 A613 L616	L561-L566 HydrophobicContact CB-CD2 4.01Å; L561-L566 HydrophobicContact CB-CG 4.18Å; L561-L566 HydrophobicContact CD1-CD2 3.84Å; N562-L566 PolarHBondContact O-N 3.14Å; E563-L566 PolarHBondContact O-N 3.33Å; E563-L566 VanDerWaalsContact O-N 3.17Å; L566-R568 VanDerWaalsContact C-N 3.31Å; L566-R568 PolarHBondContact O-N 3.36Å; L566-V569 PolarHBondContact O-N 2.78Å; L566-L570 WeakPolarHBondContact O-CG 3.4Å; L566-L570 PolarHBondContact O-N 3.27Å; L566-A603 HydrophobicContact CB-CB 3.81Å; L566-A603 HydrophobicContact CD1-CB 4.41Å; L566-L607 HydrophobicContact CD1-CD1 4.18Å; L566-L607 HydrophobicContact CD1-CD2 3.61Å; L566-L607 HydrophobicContact CD1-CG 3.57Å; L566-A613 HydrophobicContact CD2-CB 4.19Å; L566-L616 HydrophobicContact CD2-CD1 3.99Å; L566-L616 HydrophobicContact CD2-CG 4.41Å
567	V	95	Very high	91.9	Very high	30 Å²	30	44.5 Å²	44.5	18%	0.182	21%	0.213	C	C	.	.	H	α-helix	trans	-60.2	-41.5	172.4	173.7	0	0	0	0	111.2	E563 E564 L570 T571 L599 K600 A603	E563-V567 WeakPolarHBondContact O-CG2 3.22Å; E563-V567 PolarHBondContact O-N 3.1Å; E564-V567 PolarHBondContact O-N 3.29Å; V567-L570 WeakPolarHBondContact O-CB 3.27Å; V567-L570 PolarHBondContact O-N 3.11Å; V567-T571 PolarHBondContact O-N 2.89Å; V567-T571 PolarHBondContact O-OG1 3.17Å; V567-L599 HydrophobicContact CG1-CB 4.16Å; V567-L599 HydrophobicContact CG1-CD1 4.46Å; V567-L599 HydrophobicContact CG2-CB 4.38Å; V567-K600 HydrophobicContact CG2-CG 4.22Å; V567-A603 HydrophobicContact CG2-CB 3.93Å
568	R	94.6	Very high	91.9	Very high	100 Å²	100	44.4 Å²	44.4	38%	0.377	21%	0.211	S	C	.	.	H	α-helix	trans	-65.5	-42.5	173.6	-69.9	179.1	65.1	-160	-9.4	112.3	V185 E564 M565 L566 L570 T571 E572 P573	V185-R568 HydrophobicContact CG1-CB 3.65Å; E564-R568 WeakPolarHBondContact O-CG 3.34Å; E564-R568 PolarHBondContact O-N 2.98Å; M565-R568 PolarHBondContact O-N 3Å; L566-R568 VanDerWaalsContact C-N 3.31Å; L566-R568 PolarHBondContact O-N 3.36Å; R568-L570 VanDerWaalsContact C-N 3.26Å; R568-L570 PolarHBondContact O-N 3.26Å; R568-T571 PolarHBondContact O-N 3.16Å; R568-T571 VanDerWaalsContact O-N 3.08Å; R568-T571 PolarHBondContact O-OG1 3.32Å; R568-E572 HydrophobicContact CB-CG 4.26Å; R568-E572 WeakPolarHBondContact CG-OE1 3.45Å; R568-E572 IonicContact CZ-OE1 3.66Å; R568-E572 IonicContact CZ-OE2 2.82Å; R568-E572 VanDerWaalsContact CZ-OE2 3.29Å; R568-E572 IonicContact NE-OE1 2.67Å; R568-E572 PolarHBondContact NE-OE1 2.87Å; R568-E572 IonicContact NE-OE2 2.72Å; R568-E572 PolarHBondContact NE-OE2 3.42Å; R568-E572 IonicContact NH2-OE1 3.81Å; R568-E572 IonicContact NH2-OE2 3.95Å; R568-E572 PolarHBondContact NH2-OE2 3.49Å; R568-E572 WeakPolarHBondContact O-CB 3.44Å; R568-E572 PolarHBondContact O-N 3.48Å; R568-P573 VanDerWaalsContact O-CD 3.3Å; R568-P573 WeakPolarHBondContact O-CD 3.37Å
569	V	93.6	Very high	91.9	Very high	33 Å²	33	48.4 Å²	48.4	20%	0.2	23%	0.228	C	C	.	.	H	α-helix	trans	-60.1	-33.6	174.2	167.6	0	0	0	0	112.3	V185 M565 L566 T571 P573 A613 L616	V185-V569 HydrophobicContact CB-CG2 3.81Å; V185-V569 HydrophobicContact CG1-CG2 4.42Å; V185-V569 HydrophobicContact CG2-CG2 3.97Å; M565-V569 VanDerWaalsContact O-CG2 3.29Å; M565-V569 WeakPolarHBondContact O-CG2 3.39Å; M565-V569 PolarHBondContact O-N 3.18Å; L566-V569 PolarHBondContact O-N 2.78Å; V569-T571 VanDerWaalsContact C-N 3.3Å; V569-T571 PolarHBondContact O-N 3.26Å; V569-P573 WeakPolarHBondContact O-CD 3.34Å; V569-P573 VanDerWaalsContact O-CG 3.29Å; V569-P573 WeakPolarHBondContact O-CG 3.29Å; V569-A613 HydrophobicContact CG1-CB 4.3Å; V569-L616 HydrophobicContact CG1-CD1 4.06Å
570	L	93.5	Very high	91.9	Very high	0 Å²	0	49.4 Å²	49.4	0%	0	23%	0.233	C	C	.	.	H	α-helix	trans	-69.6	-22	175.6	-76.4	175.8	0	0	0	114.2	L566 V567 R568 A576 L577 I578 L599 I602 L616 L620	L566-L570 WeakPolarHBondContact O-CG 3.4Å; L566-L570 PolarHBondContact O-N 3.27Å; V567-L570 WeakPolarHBondContact O-CB 3.27Å; V567-L570 PolarHBondContact O-N 3.11Å; R568-L570 VanDerWaalsContact C-N 3.26Å; R568-L570 PolarHBondContact O-N 3.26Å; L570-A576 WeakPolarHBondContact O-CB 3.15Å; L570-L577 HydrophobicContact CD2-CB 4.15Å; L570-L577 HydrophobicContact CD2-CD1 4.15Å; L570-I578 HydrophobicContact CB-CG1 4.09Å; L570-I578 HydrophobicContact CD2-CG1 4.42Å; L570-I578 WeakPolarHBondContact O-CB 3.49Å; L570-I578 VanDerWaalsContact O-CG1 3.22Å; L570-I578 WeakPolarHBondContact O-CG1 3.43Å; L570-I578 PolarHBondContact O-N 2.79Å; L570-L599 HydrophobicContact CB-CD2 4.39Å; L570-L599 HydrophobicContact CD1-CD2 3.98Å; L570-I602 HydrophobicContact CD1-CB 4.43Å; L570-I602 HydrophobicContact CD1-CG2 3.9Å; L570-L616 HydrophobicContact CD1-CD2 4.19Å; L570-L616 HydrophobicContact CD2-CB 4.21Å; L570-L616 HydrophobicContact CD2-CD1 4.01Å; L570-L616 HydrophobicContact CD2-CD2 4.18Å; L570-L616 HydrophobicContact CD2-CG 4.38Å; L570-L616 HydrophobicContact CG-CD1 4.14Å; L570-L616 HydrophobicContact CG-CD2 4.21Å; L570-L620 HydrophobicContact CD2-CD1 3.87Å
571	T	93.5	Very high	92.1	Very high	51 Å²	51	49.8 Å²	49.8	31%	0.313	23%	0.233	S	C	.	.	H	α-helix	trans	-126.7	-45.4	-163.8	52.3	0	0	0	0	114.6	V567 R568 V569 K579 L599	V567-T571 PolarHBondContact O-N 2.89Å; V567-T571 PolarHBondContact O-OG1 3.17Å; R568-T571 PolarHBondContact O-N 3.16Å; R568-T571 VanDerWaalsContact O-N 3.08Å; R568-T571 PolarHBondContact O-OG1 3.32Å; V569-T571 VanDerWaalsContact C-N 3.3Å; V569-T571 PolarHBondContact O-N 3.26Å; T571-K579 WeakPolarHBondContact O-CE 3.39Å; T571-K579 PolarHBondContact O-NZ 3.48Å; T571-L599 HydrophobicContact CG2-CD1 3.68Å
572	E	92.2	Very high	92.3	Very high	95 Å²	95	51.8 Å²	51.8	44%	0.444	24%	0.242	S	C	.	.	S	Bend	trans	-71.8	-54.2	-173.5	-65.8	-178.5	177.1	0	0	114.8	V185 R568 K579	V185-E572 HydrophobicContact CG2-CB 4.45Å; R568-E572 HydrophobicContact CB-CG 4.26Å; R568-E572 WeakPolarHBondContact CG-OE1 3.45Å; R568-E572 IonicContact CZ-OE1 3.66Å; R568-E572 IonicContact CZ-OE2 2.82Å; R568-E572 VanDerWaalsContact CZ-OE2 3.29Å; R568-E572 IonicContact NE-OE1 2.67Å; R568-E572 PolarHBondContact NE-OE1 2.87Å; R568-E572 IonicContact NE-OE2 2.72Å; R568-E572 PolarHBondContact NE-OE2 3.42Å; R568-E572 IonicContact NH2-OE1 3.81Å; R568-E572 IonicContact NH2-OE2 3.95Å; R568-E572 PolarHBondContact NH2-OE2 3.49Å; R568-E572 WeakPolarHBondContact O-CB 3.44Å; R568-E572 PolarHBondContact O-N 3.48Å; E572-K579 PolarHBondContact O-NZ 3.05Å
573	P	91.9	Very high	92.5	Very high	9 Å²	9	54.1 Å²	54.1	6%	0.058	25%	0.254	C	S	.	.	S	Bend	trans	-65.2	160	-165.8	24.1	-32.9	0	0	0	112.9	R182 V185 R568 V569 N575 A576 K579	R182-P573 WeakPolarHBondContact O-CA 3.28Å; V185-P573 HydrophobicContact CG2-CG 4.44Å; R568-P573 VanDerWaalsContact O-CD 3.3Å; R568-P573 WeakPolarHBondContact O-CD 3.37Å; V569-P573 WeakPolarHBondContact O-CD 3.34Å; V569-P573 VanDerWaalsContact O-CG 3.29Å; V569-P573 WeakPolarHBondContact O-CG 3.29Å; P573-N575 VanDerWaalsContact C-N 3.27Å; P573-N575 PolarHBondContact O-N 3.02Å; P573-A576 HydrophobicContact CG-CB 3.99Å; P573-A576 WeakPolarHBondContact O-CB 3.43Å; P573-A576 PolarHBondContact O-N 3.48Å; P573-K579 PolarHBondContact O-NZ 3.12Å
574	R	86	Confident	92.5	Very high	160 Å²	160	54.5 Å²	54.5	60%	0.604	26%	0.257	S	S	*	.	T	Hydrogen-bonded Turn	trans	-59.9	-38.5	179.1	-77.2	-171.7	163.8	-151.6	-7.4	112.7	R182 Y183 A576	R182-R574 PolarHBondContact O-N 3.35Å; Y183-R574 HydrophobicContact CD1-CB 4.5Å; Y183-R574 HydrophobicContact CE1-CB 4.12Å; R574-A576 VanDerWaalsContact C-N 3.34Å
575	N	85.9	Confident	92.6	Very high	35 Å²	35	47.1 Å²	47.1	19%	0.187	22%	0.223	C	C	.	.	T	Hydrogen-bonded Turn	trans	-93.4	24.9	175.1	62.8	-25.2	0	0	0	113.1	P573 L577 Q580	P573-N575 VanDerWaalsContact C-N 3.27Å; P573-N575 PolarHBondContact O-N 3.02Å; N575-L577 PolarHBondContact O-N 3.38Å; N575-Q580 PolarHBondContact O-NE2 3.19Å
576	A	91.9	Very high	92.6	Very high	1 Å²	1	49.1 Å²	49.1	1%	0.008	23%	0.234	C	C	.	.			trans	-52.4	134	176.9	0	0	0	0	0	112.6	L570 P573 R574 I578 K579 Q580	L570-A576 WeakPolarHBondContact O-CB 3.15Å; P573-A576 HydrophobicContact CG-CB 3.99Å; P573-A576 WeakPolarHBondContact O-CB 3.43Å; P573-A576 PolarHBondContact O-N 3.48Å; R574-A576 VanDerWaalsContact C-N 3.34Å; A576-I578 VanDerWaalsContact C-N 3.3Å; A576-I578 PolarHBondContact O-N 3.47Å; A576-K579 HydrophobicContact CB-CB 4.43Å; A576-K579 HydrophobicContact CB-CD 4.01Å; A576-K579 HydrophobicContact CB-CG 4.09Å; A576-K579 PolarHBondContact O-N 3.46Å; A576-K579 VanDerWaalsContact O-N 3.13Å; A576-Q580 PolarHBondContact O-N 3.29Å; A576-Q580 VanDerWaalsContact O-N 3.16Å
577	L	92.3	Very high	92.6	Very high	29 Å²	29	55.2 Å²	55.2	15%	0.152	27%	0.265	C	S	.	.	H	α-helix	trans	-59.1	-39.5	-175.8	-69.7	173.9	0	0	0	112.4	L570 N575 K579 Q580 Y581 L616 R617 L620	L570-L577 HydrophobicContact CD2-CB 4.15Å; L570-L577 HydrophobicContact CD2-CD1 4.15Å; N575-L577 PolarHBondContact O-N 3.38Å; L577-K579 VanDerWaalsContact C-N 3.34Å; L577-K579 PolarHBondContact O-N 3.02Å; L577-Q580 WeakPolarHBondContact O-CB 3.47Å; L577-Q580 PolarHBondContact O-N 3.43Å; L577-Y581 WeakPolarHBondContact O-CD2 3.41Å; L577-Y581 PolarHBondContact O-N 3Å; L577-L616 HydrophobicContact CD1-CB 3.7Å; L577-R617 HydrophobicContact CD1-CB 4.32Å; L577-L620 HydrophobicContact CB-CD1 3.89Å; L577-L620 HydrophobicContact CD1-CD1 4.19Å
578	I	93.9	Very high	92.4	Very high	12 Å²	12	57.5 Å²	57.5	6%	0.062	28%	0.277	C	S	.	.	H	α-helix	trans	-63.4	-40.6	178.9	-59.6	-60.5	0	0	0	111.2	L570 A576 Q580 Y581 Q582 V594 L599 L620	L570-I578 HydrophobicContact CB-CG1 4.09Å; L570-I578 HydrophobicContact CD2-CG1 4.42Å; L570-I578 WeakPolarHBondContact O-CB 3.49Å; L570-I578 VanDerWaalsContact O-CG1 3.22Å; L570-I578 WeakPolarHBondContact O-CG1 3.43Å; L570-I578 PolarHBondContact O-N 2.79Å; A576-I578 VanDerWaalsContact C-N 3.3Å; A576-I578 PolarHBondContact O-N 3.47Å; I578-Q580 VanDerWaalsContact C-N 3.34Å; I578-Q580 PolarHBondContact O-N 2.98Å; I578-Y581 PolarHBondContact O-N 3.2Å; I578-Q582 HydrophobicContact CG2-CG 4.25Å; I578-Q582 WeakPolarHBondContact O-CB 3.43Å; I578-Q582 VanDerWaalsContact O-CG 3.27Å; I578-Q582 WeakPolarHBondContact O-CG 3.44Å; I578-Q582 PolarHBondContact O-N 3.13Å; I578-V594 HydrophobicContact CD1-CG2 4.27Å; I578-V594 HydrophobicContact CG2-CG2 4.49Å; I578-L599 HydrophobicContact CD1-CD2 4.02Å; I578-L599 HydrophobicContact CG1-CD2 3.98Å; I578-L620 HydrophobicContact CD1-CD1 4.14Å; I578-L620 HydrophobicContact CD1-CD2 4.09Å
579	K	93.4	Very high	92.1	Very high	86 Å²	86	55.8 Å²	55.8	37%	0.374	29%	0.29	S	S	.	.	H	α-helix	trans	-64	-38.4	176	-62.9	177.5	-168.9	151.5	0	112	T571 E572 P573 A576 L577 Q582 L583	T571-K579 WeakPolarHBondContact O-CE 3.39Å; T571-K579 PolarHBondContact O-NZ 3.48Å; E572-K579 PolarHBondContact O-NZ 3.05Å; P573-K579 PolarHBondContact O-NZ 3.12Å; A576-K579 HydrophobicContact CB-CB 4.43Å; A576-K579 HydrophobicContact CB-CD 4.01Å; A576-K579 HydrophobicContact CB-CG 4.09Å; A576-K579 PolarHBondContact O-N 3.46Å; A576-K579 VanDerWaalsContact O-N 3.13Å; L577-K579 VanDerWaalsContact C-N 3.34Å; L577-K579 PolarHBondContact O-N 3.02Å; K579-Q582 PolarHBondContact O-N 2.85Å; K579-L583 WeakPolarHBondContact O-CB 3.32Å; K579-L583 PolarHBondContact O-N 2.92Å
580	Q	93.2	Very high	92	Very high	68 Å²	68	54.2 Å²	54.2	32%	0.318	28%	0.281	S	S	.	.	H	α-helix	trans	-63.1	-44.6	175.2	-63.9	-179.7	38.1	0	0	111.6	N575 A576 L577 I578 L584	N575-Q580 PolarHBondContact O-NE2 3.19Å; A576-Q580 PolarHBondContact O-N 3.29Å; A576-Q580 VanDerWaalsContact O-N 3.16Å; L577-Q580 WeakPolarHBondContact O-CB 3.47Å; L577-Q580 PolarHBondContact O-N 3.43Å; I578-Q580 VanDerWaalsContact C-N 3.34Å; I578-Q580 PolarHBondContact O-N 2.98Å; Q580-L584 PolarHBondContact O-N 2.74Å; Q580-L584 VanDerWaalsContact O-N 3.1Å
581	Y	94.3	Very high	92	Very high	16 Å²	16	58 Å²	58	6%	0.063	30%	0.298	C	S	.	.	H	α-helix	trans	-69.6	-40	176.8	-73.1	-64.5	0	0	0	112.5	L577 I578 L583 L584 F585 L620 E621 L624	L577-Y581 WeakPolarHBondContact O-CD2 3.41Å; L577-Y581 PolarHBondContact O-N 3Å; I578-Y581 PolarHBondContact O-N 3.2Å; Y581-L583 VanDerWaalsContact C-N 3.34Å; Y581-L583 PolarHBondContact O-N 3.03Å; Y581-L584 WeakPolarHBondContact O-CB 3.13Å; Y581-L584 PolarHBondContact O-N 2.73Å; Y581-L584 VanDerWaalsContact O-N 3.08Å; Y581-F585 WeakPolarHBondContact O-CD2 3.28Å; Y581-F585 PolarHBondContact O-N 3.36Å; Y581-L620 HydrophobicContact CD2-CB 4.42Å; Y581-L620 HydrophobicContact CD2-CD1 4.1Å; Y581-L620 HydrophobicContact CE2-CB 3.68Å; Y581-L620 HydrophobicContact CE2-CD1 3.8Å; Y581-L620 HydrophobicContact CE2-CG 4.31Å; Y581-E621 WeakPolarHBondContact OH-CG 3.29Å; Y581-L624 HydrophobicContact CD1-CD1 3.53Å; Y581-L624 HydrophobicContact CD2-CD1 3.81Å; Y581-L624 HydrophobicContact CE1-CD1 3.92Å; Y581-L624 HydrophobicContact CE2-CD1 4.18Å; Y581-L624 HydrophobicContact CG-CD1 3.48Å; Y581-L624 VanDerWaalsContact CG-CD1 3.48Å
582	Q	94.2	Very high	92.1	Very high	63 Å²	63	55.6 Å²	55.6	29%	0.294	28%	0.283	S	S	.	.	H	α-helix	trans	-58	-45.9	174	-76.9	174.9	-36.5	0	0	111.8	I578 K579 L584 F585 N586 L592	I578-Q582 HydrophobicContact CG2-CG 4.25Å; I578-Q582 WeakPolarHBondContact O-CB 3.43Å; I578-Q582 VanDerWaalsContact O-CG 3.27Å; I578-Q582 WeakPolarHBondContact O-CG 3.44Å; I578-Q582 PolarHBondContact O-N 3.13Å; K579-Q582 PolarHBondContact O-N 2.85Å; Q582-L584 VanDerWaalsContact C-N 3.28Å; Q582-L584 PolarHBondContact O-N 3.36Å; Q582-F585 PolarHBondContact O-N 2.84Å; Q582-N586 WeakPolarHBondContact O-CB 3.42Å; Q582-N586 PolarHBondContact O-N 3.1Å; Q582-N586 PolarHBondContact O-ND2 2.74Å; Q582-N586 PolarHBondContact O-OD1 3.18Å; Q582-L592 HydrophobicContact CG-CB 4.11Å; Q582-L592 WeakPolarHBondContact CG-O 3.4Å; Q582-L592 PolarHBondContact NE2-O 2.98Å
583	L	93.6	Very high	92.2	Very high	96 Å²	96	57.3 Å²	57.3	50%	0.503	29%	0.286	S	S	.	.	H	α-helix	trans	-60.3	-38.6	174.1	-178.5	61	0	0	0	112	K579 Y581 N586 I587	K579-L583 WeakPolarHBondContact O-CB 3.32Å; K579-L583 PolarHBondContact O-N 2.92Å; Y581-L583 VanDerWaalsContact C-N 3.34Å; Y581-L583 PolarHBondContact O-N 3.03Å; L583-N586 PolarHBondContact O-N 2.94Å; L583-I587 WeakPolarHBondContact O-CG1 3.38Å; L583-I587 PolarHBondContact O-N 3.24Å
584	L	92.6	Very high	92.3	Very high	57 Å²	57	58.2 Å²	58.2	30%	0.298	29%	0.291	S	S	.	.	H	α-helix	trans	-65.1	-47.7	178.1	-175.5	63.8	0	0	0	112.5	Q580 Y581 Q582 N586 I587 R628	Q580-L584 PolarHBondContact O-N 2.74Å; Q580-L584 VanDerWaalsContact O-N 3.1Å; Y581-L584 WeakPolarHBondContact O-CB 3.13Å; Y581-L584 PolarHBondContact O-N 2.73Å; Y581-L584 VanDerWaalsContact O-N 3.08Å; Q582-L584 VanDerWaalsContact C-N 3.28Å; Q582-L584 PolarHBondContact O-N 3.36Å; L584-N586 VanDerWaalsContact C-N 3.3Å; L584-N586 PolarHBondContact O-N 2.96Å; L584-I587 WeakPolarHBondContact O-CB 3.49Å; L584-I587 PolarHBondContact O-N 3.39Å; L584-R628 VanDerWaalsContact CD2-CZ 3.46Å
585	F	92.9	Very high	92.8	Very high	2 Å²	2	52.5 Å²	52.5	1%	0.009	27%	0.274	C	S	.	.	H	α-helix	trans	-65.3	-34	176	-80.3	-85.5	0	0	0	112	Y581 Q582 I587 D588 G589 C590 L592 L624 P627 R628 V631 V639	Y581-F585 WeakPolarHBondContact O-CD2 3.28Å; Y581-F585 PolarHBondContact O-N 3.36Å; Q582-F585 PolarHBondContact O-N 2.84Å; F585-I587 PolarHBondContact O-N 3.45Å; F585-D588 CarbonylContact O-C 3.57Å; F585-D588 WeakPolarHBondContact O-CA 3.33Å; F585-D588 PolarHBondContact O-N 2.85Å; F585-G589 PolarHBondContact O-N 3.05Å; F585-C590 CarbonylContact C-O 3.58Å; F585-C590 HydrophobicContact CB-CB 4.4Å; F585-C590 VanDerWaalsContact CB-O 3.28Å; F585-C590 WeakPolarHBondContact CB-O 3.28Å; F585-C590 HydrophobicContact CD1-CB 4.38Å; F585-C590 PolarHBondContact O-N 3.39Å; F585-L592 HydrophobicContact CB-CB 4.2Å; F585-L592 HydrophobicContact CD2-CB 3.85Å; F585-L592 HydrophobicContact CD2-CD1 4.49Å; F585-L592 HydrophobicContact CD2-CD2 3.81Å; F585-L592 HydrophobicContact CD2-CG 4.26Å; F585-L592 HydrophobicContact CE2-CD1 4.35Å; F585-L592 HydrophobicContact CE2-CD2 3.91Å; F585-L592 HydrophobicContact CE2-CG 4.49Å; F585-L592 HydrophobicContact CG-CB 4.12Å; F585-L624 HydrophobicContact CE2-CD1 4.42Å; F585-L624 HydrophobicContact CE2-CD2 3.92Å; F585-L624 HydrophobicContact CZ-CD2 4.1Å; F585-P627 HydrophobicContact CE1-CB 4Å; F585-P627 HydrophobicContact CZ-CB 3.82Å; F585-R628 HydrophobicContact CE1-CG 4.18Å; F585-R628 HydrophobicContact CE2-CG 4Å; F585-R628 HydrophobicContact CZ-CG 3.5Å; F585-V631 HydrophobicContact CD1-CB 4.42Å; F585-V631 HydrophobicContact CD1-CG1 4.28Å; F585-V631 HydrophobicContact CD1-CG2 4.15Å; F585-V631 HydrophobicContact CE1-CB 4.3Å; F585-V631 HydrophobicContact CE1-CG2 3.94Å; F585-V639 HydrophobicContact CE1-CG2 4.27Å
586	N	93.2	Very high	93.2	Very high	89 Å²	89	54.8 Å²	54.8	48%	0.476	29%	0.291	S	S	.	.	H	α-helix	trans	-63	-28.6	176.1	-71.7	-11.4	0	0	0	112.8	Q582 L583 L584 D588 G589 C590	Q582-N586 WeakPolarHBondContact O-CB 3.42Å; Q582-N586 PolarHBondContact O-N 3.1Å; Q582-N586 PolarHBondContact O-ND2 2.74Å; Q582-N586 PolarHBondContact O-OD1 3.18Å; L583-N586 PolarHBondContact O-N 2.94Å; L584-N586 VanDerWaalsContact C-N 3.3Å; L584-N586 PolarHBondContact O-N 2.96Å; N586-D588 VanDerWaalsContact C-N 3.3Å; N586-G589 PolarHBondContact O-N 3.08Å; N586-G589 VanDerWaalsContact O-N 3.14Å; N586-C590 PolarHBondContact N-O 3.2Å; N586-C590 PolarHBondContact OD1-O 2.96Å
587	I	92.6	Very high	93.3	Very high	127 Å²	127	58.1 Å²	58.1	65%	0.651	31%	0.309	S	S	*	.	H	α-helix	trans	-65.1	-37.4	173.6	-67.8	164.9	0	0	0	110.7	L583 L584 F585 G589	L583-I587 WeakPolarHBondContact O-CG1 3.38Å; L583-I587 PolarHBondContact O-N 3.24Å; L584-I587 WeakPolarHBondContact O-CB 3.49Å; L584-I587 PolarHBondContact O-N 3.39Å; F585-I587 PolarHBondContact O-N 3.45Å; I587-G589 PolarHBondContact O-N 3.44Å
588	D	90.7	Very high	93.5	Very high	79 Å²	79	56.8 Å²	56.8	42%	0.422	30%	0.301	S	S	.	.	T	Hydrogen-bonded Turn	trans	-81.7	5.5	174.7	-60.5	-42.1	0	0	0	112.9	F585 N586 V631	F585-D588 CarbonylContact O-C 3.57Å; F585-D588 WeakPolarHBondContact O-CA 3.33Å; F585-D588 PolarHBondContact O-N 2.85Å; N586-D588 VanDerWaalsContact C-N 3.3Å; D588-V631 HydrophobicContact CB-CG1 3.88Å
589	G	89.3	Confident	93.5	Very high	63 Å²	63	57 Å²	57	65%	0.649	30%	0.303	S	S	*	.	T	Hydrogen-bonded Turn	trans	79	15.1	179.6	0	0	0	0	0	115.3	F585 N586 I587	F585-G589 PolarHBondContact O-N 3.05Å; N586-G589 PolarHBondContact O-N 3.08Å; N586-G589 VanDerWaalsContact O-N 3.14Å; I587-G589 PolarHBondContact O-N 3.44Å
590	C	91.6	Very high	93.6	Very high	1 Å²	1	57 Å²	57	1%	0.007	30%	0.303	C	S	.	.			trans	-117	139.3	-174.2	-166.8	0	0	0	0	112.2	F585 N586 V631 I636 S637	F585-C590 CarbonylContact C-O 3.58Å; F585-C590 HydrophobicContact CB-CB 4.4Å; F585-C590 VanDerWaalsContact CB-O 3.28Å; F585-C590 WeakPolarHBondContact CB-O 3.28Å; F585-C590 HydrophobicContact CD1-CB 4.38Å; F585-C590 PolarHBondContact O-N 3.39Å; N586-C590 PolarHBondContact N-O 3.2Å; N586-C590 PolarHBondContact OD1-O 2.96Å; C590-V631 HydrophobicContact CB-CG1 3.62Å; C590-V631 HydrophobicContact CB-CG2 4.47Å; C590-I636 PolarHBondContact SG-O 3.21Å; C590-S637 VanDerWaalsContact SG-C 3.53Å
591	E	94	Very high	93.6	Very high	78 Å²	78	54 Å²	54	36%	0.364	29%	0.289	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-92.9	124.2	176.1	-166	-166.7	157	0	0	111.4	R593 S637 T638 V639	E591-R593 VanDerWaalsContact CD-NE 3.26Å; E591-R593 VanDerWaalsContact CD-NH2 3.33Å; E591-R593 HydrophobicContact CG-CG 4.45Å; E591-R593 IonicContact OE1-CZ 3.93Å; E591-R593 IonicContact OE1-NE 3.52Å; E591-R593 PolarHBondContact OE1-NE 2.97Å; E591-R593 IonicContact OE1-NH2 3.55Å; E591-R593 PolarHBondContact OE1-NH2 3.13Å; E591-R593 VanDerWaalsContact OE1-NH2 3.12Å; E591-R593 IonicContact OE2-CZ 3.29Å; E591-R593 IonicContact OE2-NE 2.99Å; E591-R593 PolarHBondContact OE2-NE 3.35Å; E591-R593 IonicContact OE2-NH2 2.74Å; E591-R593 PolarHBondContact OE2-NH2 3.08Å; E591-S637 PolarHBondContact N-O 2.8Å; E591-T638 HydrophobicContact CB-CG2 4.31Å; E591-T638 CarbonylContact O-C 3.56Å; E591-T638 VanDerWaalsContact O-CA 3.28Å; E591-T638 WeakPolarHBondContact O-CA 3.4Å; E591-T638 WeakPolarHBondContact O-CG2 3.43Å; E591-V639 PolarHBondContact O-N 3.35Å
592	L	94.3	Very high	93.6	Very high	1 Å²	1	53.2 Å²	53.2	1%	0.005	29%	0.286	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-92.1	118.7	172.3	178.7	67.4	0	0	0	111.6	Q582 F585 V594 L624 V639 L641	Q582-L592 HydrophobicContact CG-CB 4.11Å; Q582-L592 WeakPolarHBondContact CG-O 3.4Å; Q582-L592 PolarHBondContact NE2-O 2.98Å; F585-L592 HydrophobicContact CB-CB 4.2Å; F585-L592 HydrophobicContact CD2-CB 3.85Å; F585-L592 HydrophobicContact CD2-CD1 4.49Å; F585-L592 HydrophobicContact CD2-CD2 3.81Å; F585-L592 HydrophobicContact CD2-CG 4.26Å; F585-L592 HydrophobicContact CE2-CD1 4.35Å; F585-L592 HydrophobicContact CE2-CD2 3.91Å; F585-L592 HydrophobicContact CE2-CG 4.49Å; F585-L592 HydrophobicContact CG-CB 4.12Å; L592-V594 HydrophobicContact CG-CG2 4.36Å; L592-L624 HydrophobicContact CD1-CD2 3.99Å; L592-L624 HydrophobicContact CD2-CD1 4.29Å; L592-L624 HydrophobicContact CD2-CD2 4.12Å; L592-V639 HydrophobicContact CD1-CB 4.02Å; L592-V639 HydrophobicContact CD1-CG1 3.95Å; L592-L641 HydrophobicContact CD1-CD1 4.46Å; L592-L641 HydrophobicContact CD1-CG 4.23Å
593	R	94.8	Very high	93.6	Very high	131 Å²	131	50.2 Å²	50.2	49%	0.494	27%	0.272	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-112.8	142.3	172.4	-63.1	-172.7	177.7	177	8.4	111	E591 T638 V639 V640 L641	E591-R593 VanDerWaalsContact CD-NE 3.26Å; E591-R593 VanDerWaalsContact CD-NH2 3.33Å; E591-R593 HydrophobicContact CG-CG 4.45Å; E591-R593 IonicContact OE1-CZ 3.93Å; E591-R593 IonicContact OE1-NE 3.52Å; E591-R593 PolarHBondContact OE1-NE 2.97Å; E591-R593 IonicContact OE1-NH2 3.55Å; E591-R593 PolarHBondContact OE1-NH2 3.13Å; E591-R593 VanDerWaalsContact OE1-NH2 3.12Å; E591-R593 IonicContact OE2-CZ 3.29Å; E591-R593 IonicContact OE2-NE 2.99Å; E591-R593 PolarHBondContact OE2-NE 3.35Å; E591-R593 IonicContact OE2-NH2 2.74Å; E591-R593 PolarHBondContact OE2-NH2 3.08Å; R593-T638 HydrophobicContact CG-CG2 4.2Å; R593-V639 PolarHBondContact N-O 3.04Å; R593-V640 HydrophobicContact CB-CG2 4.32Å; R593-V640 WeakPolarHBondContact O-CA 3.39Å; R593-L641 PolarHBondContact O-N 3.19Å
594	V	94.6	Very high	93.5	Very high	28 Å²	28	50.6 Å²	50.6	17%	0.17	27%	0.267	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-131.6	127.1	179.7	-172.6	0	0	0	0	108.2	I578 L592 A598 L599 L641	I578-V594 HydrophobicContact CD1-CG2 4.27Å; I578-V594 HydrophobicContact CG2-CG2 4.49Å; L592-V594 HydrophobicContact CG-CG2 4.36Å; V594-A598 HydrophobicContact CG1-CB 3.86Å; V594-L599 HydrophobicContact CB-CD2 4.36Å; V594-L599 HydrophobicContact CG1-CD2 3.72Å; V594-L599 HydrophobicContact CG1-CG 3.92Å; V594-L641 HydrophobicContact CB-CB 4.46Å; V594-L641 HydrophobicContact CG1-CB 4.16Å; V594-L641 HydrophobicContact CG2-CB 4.25Å; V594-L641 HydrophobicContact CG2-CD1 4.07Å; V594-L641 HydrophobicContact CG2-CG 4.4Å
595	T	95	Very high	93.4	Very high	40 Å²	40	50.8 Å²	50.8	25%	0.245	27%	0.268	C	S	.	.			trans	-71.2	152.2	179.2	68.3	0	0	0	0	111	D597 A598 L599 V640 L641 T642	T595-D597 PolarHBondContact O-N 3.18Å; T595-A598 WeakPolarHBondContact O-CB 3.2Å; T595-A598 PolarHBondContact O-N 2.93Å; T595-A598 VanDerWaalsContact O-N 3.14Å; T595-A598 WeakPolarHBondContact OG1-CB 3.5Å; T595-A598 PolarHBondContact OG1-N 3.23Å; T595-L599 PolarHBondContact O-N 3.44Å; T595-V640 HydrophobicContact CG2-CG1 4.39Å; T595-L641 PolarHBondContact N-O 3.47Å; T595-L641 PolarHBondContact OG1-O 2.78Å; T595-T642 HydrophobicContact CG2-CG2 4.37Å
596	P	94.8	Very high	93.4	Very high	83 Å²	83	50.7 Å²	50.7	54%	0.539	27%	0.268	S	S	.	.	H	α-helix	trans	-59.8	-31	178	24	-34.6	0	0	0	112.7	L599 K600	P596-L599 PolarHBondContact O-N 3.46Å; P596-K600 PolarHBondContact O-N 3.06Å
597	D	95	Very high	93.1	Very high	72 Å²	72	49.2 Å²	49.2	39%	0.385	26%	0.259	S	S	.	.	H	α-helix	trans	-76.6	-33.6	178.2	-51.2	-54.8	0	0	0	111.7	T595 L599 K600 A601 E643	T595-D597 PolarHBondContact O-N 3.18Å; D597-L599 VanDerWaalsContact C-N 3.33Å; D597-L599 PolarHBondContact O-N 3.41Å; D597-K600 PolarHBondContact O-N 2.93Å; D597-K600 IonicContact OD1-NZ 3.12Å; D597-A601 WeakPolarHBondContact O-CB 3.46Å; D597-A601 PolarHBondContact O-N 3.14Å; D597-E643 HydrophobicContact CB-CB 4.36Å
598	A	95	Very high	92.8	Very high	0 Å²	0	46.5 Å²	46.5	0%	0	25%	0.252	C	S	.	.	H	α-helix	trans	-61.4	-39.7	167.6	0	0	0	0	0	112	V594 T595 K600 A601 I602 L641 V646	V594-A598 HydrophobicContact CG1-CB 3.86Å; T595-A598 WeakPolarHBondContact O-CB 3.2Å; T595-A598 PolarHBondContact O-N 2.93Å; T595-A598 VanDerWaalsContact O-N 3.14Å; T595-A598 WeakPolarHBondContact OG1-CB 3.5Å; T595-A598 PolarHBondContact OG1-N 3.23Å; A598-K600 PolarHBondContact O-N 2.97Å; A598-A601 PolarHBondContact O-N 3.42Å; A598-I602 WeakPolarHBondContact O-CB 3.44Å; A598-I602 WeakPolarHBondContact O-CD1 3.42Å; A598-I602 WeakPolarHBondContact O-CG1 3.49Å; A598-I602 PolarHBondContact O-N 3.21Å; A598-L641 WeakPolarHBondContact CB-O 3.23Å; A598-V646 HydrophobicContact CB-CG2 3.87Å
599	L	95.2	Very high	92.5	Very high	18 Å²	18	46.4 Å²	46.4	9%	0.094	25%	0.249	C	C	.	.	H	α-helix	trans	-62	-41.6	175.3	-66.2	173.8	0	0	0	112.3	V567 L570 T571 I578 V594 T595 P596 D597 I602 A603	V567-L599 HydrophobicContact CG1-CB 4.16Å; V567-L599 HydrophobicContact CG1-CD1 4.46Å; V567-L599 HydrophobicContact CG2-CB 4.38Å; L570-L599 HydrophobicContact CB-CD2 4.39Å; L570-L599 HydrophobicContact CD1-CD2 3.98Å; T571-L599 HydrophobicContact CG2-CD1 3.68Å; I578-L599 HydrophobicContact CD1-CD2 4.02Å; I578-L599 HydrophobicContact CG1-CD2 3.98Å; V594-L599 HydrophobicContact CB-CD2 4.36Å; V594-L599 HydrophobicContact CG1-CD2 3.72Å; V594-L599 HydrophobicContact CG1-CG 3.92Å; T595-L599 PolarHBondContact O-N 3.44Å; P596-L599 PolarHBondContact O-N 3.46Å; D597-L599 VanDerWaalsContact C-N 3.33Å; D597-L599 PolarHBondContact O-N 3.41Å; L599-I602 PolarHBondContact O-N 2.9Å; L599-A603 PolarHBondContact O-N 3.34Å
600	K	95	Very high	92.1	Very high	85 Å²	85	50.6 Å²	50.6	37%	0.37	25%	0.251	S	S	.	.	H	α-helix	trans	-63.6	-45.9	174.3	-70.7	173.6	-173	164.2	0	111.8	E563 V567 P596 D597 A598 I602 A603 R604	E563-K600 WeakPolarHBondContact OE1-CB 3.48Å; V567-K600 HydrophobicContact CG2-CG 4.22Å; P596-K600 PolarHBondContact O-N 3.06Å; D597-K600 PolarHBondContact O-N 2.93Å; D597-K600 IonicContact OD1-NZ 3.12Å; A598-K600 PolarHBondContact O-N 2.97Å; K600-I602 VanDerWaalsContact C-N 3.32Å; K600-I602 PolarHBondContact O-N 3.4Å; K600-A603 WeakPolarHBondContact O-CB 3.49Å; K600-A603 PolarHBondContact O-N 3.23Å; K600-A603 VanDerWaalsContact O-N 3.13Å; K600-R604 PolarHBondContact O-N 3.43Å
601	A	94	Very high	91.6	Very high	4 Å²	4	53 Å²	53	3%	0.033	27%	0.266	C	S	.	.	H	α-helix	trans	-60.6	-40.2	176.3	0	0	0	0	0	112.2	D597 A598 A603 R604 L605 E643 V646	D597-A601 WeakPolarHBondContact O-CB 3.46Å; D597-A601 PolarHBondContact O-N 3.14Å; A598-A601 PolarHBondContact O-N 3.42Å; A601-A603 VanDerWaalsContact C-N 3.35Å; A601-R604 PolarHBondContact O-N 3.34Å; A601-L605 WeakPolarHBondContact O-CB 3.22Å; A601-L605 PolarHBondContact O-N 3Å; A601-E643 HydrophobicContact CB-CG 4.06Å; A601-V646 HydrophobicContact CB-CB 3.94Å; A601-V646 HydrophobicContact CB-CG1 3.64Å; A601-V646 HydrophobicContact CB-CG2 4.44Å
602	I	94.2	Very high	91.1	Very high	0 Å²	0	50 Å²	50	0%	0	26%	0.255	C	S	.	.	H	α-helix	trans	-63	-41.5	174.2	-70.1	161.5	0	0	0	110.7	L570 A598 L599 K600 L605 A606 L616 V619 L620 L623 V646	L570-I602 HydrophobicContact CD1-CB 4.43Å; L570-I602 HydrophobicContact CD1-CG2 3.9Å; A598-I602 WeakPolarHBondContact O-CB 3.44Å; A598-I602 WeakPolarHBondContact O-CD1 3.42Å; A598-I602 WeakPolarHBondContact O-CG1 3.49Å; A598-I602 PolarHBondContact O-N 3.21Å; L599-I602 PolarHBondContact O-N 2.9Å; K600-I602 VanDerWaalsContact C-N 3.32Å; K600-I602 PolarHBondContact O-N 3.4Å; I602-L605 PolarHBondContact O-N 3.41Å; I602-A606 PolarHBondContact O-N 2.86Å; I602-L616 HydrophobicContact CG2-CD2 4.14Å; I602-V619 HydrophobicContact CG1-CG1 4.39Å; I602-V619 HydrophobicContact CG2-CG1 3.97Å; I602-L620 HydrophobicContact CD1-CD2 3.96Å; I602-L623 HydrophobicContact CD1-CD1 4.31Å; I602-L623 HydrophobicContact CG1-CD1 3.94Å; I602-V646 HydrophobicContact CD1-CG2 4.09Å; I602-V646 HydrophobicContact CG1-CB 4.46Å; I602-V646 HydrophobicContact CG1-CG1 3.76Å; I602-V646 HydrophobicContact CG1-CG2 3.77Å
603	A	93.4	Very high	90.7	Very high	0 Å²	0	51.2 Å²	51.2	0%	0	27%	0.266	C	S	.	.	H	α-helix	trans	-63.4	-46.3	176.8	0	0	0	0	0	112.1	E563 L566 V567 L599 K600 A601 L605 A606 L607	E563-A603 HydrophobicContact CG-CB 3.92Å; L566-A603 HydrophobicContact CB-CB 3.81Å; L566-A603 HydrophobicContact CD1-CB 4.41Å; V567-A603 HydrophobicContact CG2-CB 3.93Å; L599-A603 PolarHBondContact O-N 3.34Å; K600-A603 WeakPolarHBondContact O-CB 3.49Å; K600-A603 PolarHBondContact O-N 3.23Å; K600-A603 VanDerWaalsContact O-N 3.13Å; A601-A603 VanDerWaalsContact C-N 3.35Å; A603-L605 PolarHBondContact O-N 2.99Å; A603-A606 PolarHBondContact O-N 2.91Å; A603-L607 WeakPolarHBondContact O-CG 3.33Å; A603-L607 PolarHBondContact O-N 3.16Å
604	R	91.7	Very high	90.4	Very high	104 Å²	104	54.9 Å²	54.9	39%	0.392	28%	0.279	S	S	.	.	H	α-helix	trans	-59.6	-44.1	174.2	-67.9	-177.4	-164.1	137.8	19.6	112.3	E563 K600 A601 A606 L607 S608	E563-R604 VanDerWaalsContact CD-NE 3.31Å; E563-R604 HydrophobicContact CG-CG 4.27Å; E563-R604 IonicContact OE1-CZ 2.74Å; E563-R604 IonicContact OE1-NE 3.56Å; E563-R604 PolarHBondContact OE1-NE 3.44Å; E563-R604 IonicContact OE1-NH2 3.63Å; E563-R604 PolarHBondContact OE1-NH2 3.38Å; E563-R604 WeakPolarHBondContact OE2-CG 3.43Å; E563-R604 IonicContact OE2-CZ 2.76Å; E563-R604 IonicContact OE2-NE 3.67Å; E563-R604 PolarHBondContact OE2-NE 3.01Å; E563-R604 IonicContact OE2-NH2 3.92Å; K600-R604 PolarHBondContact O-N 3.43Å; A601-R604 PolarHBondContact O-N 3.34Å; R604-A606 VanDerWaalsContact C-N 3.27Å; R604-A606 PolarHBondContact O-N 2.89Å; R604-L607 PolarHBondContact O-N 3.37Å; R604-L607 VanDerWaalsContact O-N 3.16Å; R604-S608 PolarHBondContact O-N 3.17Å; R604-S608 PolarHBondContact O-OG 3.18Å
605	L	91	Very high	90.1	Very high	62 Å²	62	53.7 Å²	53.7	33%	0.325	27%	0.273	S	S	.	.	H	α-helix	trans	-66.2	-26.6	178.3	-174.7	56.7	0	0	0	113.1	A601 I602 A603 S608 Q609 V619 V646	A601-L605 WeakPolarHBondContact O-CB 3.22Å; A601-L605 PolarHBondContact O-N 3Å; I602-L605 PolarHBondContact O-N 3.41Å; A603-L605 PolarHBondContact O-N 2.99Å; L605-S608 PolarHBondContact O-OG 3.34Å; L605-Q609 WeakPolarHBondContact O-CG 3.43Å; L605-Q609 PolarHBondContact O-NE2 3.46Å; L605-V619 HydrophobicContact CD2-CG1 3.8Å; L605-V619 HydrophobicContact CD2-CG2 4.38Å; L605-V619 HydrophobicContact CG-CG1 4.27Å; L605-V619 HydrophobicContact CG-CG2 4.1Å; L605-V646 HydrophobicContact CD2-CG1 4.45Å
606	A	91.1	Very high	90	Very high	0 Å²	0	51.8 Å²	51.8	0%	0	26%	0.261	C	S	.	.	H	α-helix	trans	-79.9	-32.4	171.7	0	0	0	0	0	113	I602 A603 R604 Q609 L616	I602-A606 PolarHBondContact O-N 2.86Å; A603-A606 PolarHBondContact O-N 2.91Å; R604-A606 VanDerWaalsContact C-N 3.27Å; R604-A606 PolarHBondContact O-N 2.89Å; A606-Q609 PolarHBondContact O-N 3.06Å; A606-L616 HydrophobicContact CB-CD2 3.63Å; A606-L616 HydrophobicContact CB-CG 4.19Å
607	L	88.2	Confident	89.8	Confident	57 Å²	57	53.9 Å²	53.9	30%	0.298	26%	0.258	S	S	.	.	H	α-helix	trans	-66.5	-45.2	174.2	-72.8	170.5	0	0	0	112	L561 E563 L566 A603 R604 Q609 H610	L561-L607 WeakPolarHBondContact O-CD2 3.42Å; E563-L607 HydrophobicContact CB-CD1 4.08Å; L566-L607 HydrophobicContact CD1-CD1 4.18Å; L566-L607 HydrophobicContact CD1-CD2 3.61Å; L566-L607 HydrophobicContact CD1-CG 3.57Å; A603-L607 WeakPolarHBondContact O-CG 3.33Å; A603-L607 PolarHBondContact O-N 3.16Å; R604-L607 PolarHBondContact O-N 3.37Å; R604-L607 VanDerWaalsContact O-N 3.16Å; L607-Q609 PolarHBondContact O-N 2.87Å; L607-H610 PolarHBondContact O-N 3.15Å
608	S	86.8	Confident	89.6	Confident	71 Å²	71	53 Å²	53	50%	0.497	26%	0.258	S	S	.	.	T	Hydrogen-bonded Turn	trans	-65.8	-18.2	178.1	64.4	0	0	0	0	113.7	R604 L605 H610	R604-S608 PolarHBondContact O-N 3.17Å; R604-S608 PolarHBondContact O-OG 3.18Å; L605-S608 PolarHBondContact O-OG 3.34Å; S608-H610 VanDerWaalsContact C-N 3.34Å
609	Q	84.2	Confident	89.5	Confident	77 Å²	77	53.1 Å²	53.1	36%	0.36	26%	0.259	S	S	.	.	T	Hydrogen-bonded Turn	trans	-83	-5.6	170.6	-70.4	177.3	28.3	0	0	113.8	L605 A606 L607 T611	L605-Q609 WeakPolarHBondContact O-CG 3.43Å; L605-Q609 PolarHBondContact O-NE2 3.46Å; A606-Q609 PolarHBondContact O-N 3.06Å; L607-Q609 PolarHBondContact O-N 2.87Å; Q609-T611 PolarHBondContact O-N 3Å
610	H	79.8	Confident	89.4	Confident	150 Å²	150	52.2 Å²	52.2	69%	0.694	25%	0.254	S	S	*	.	T	Hydrogen-bonded Turn	trans	52.6	25.3	-177.8	-52.7	-59.2	0	0	0	115.2	L607 S608	L607-H610 PolarHBondContact O-N 3.15Å; S608-H610 VanDerWaalsContact C-N 3.34Å
611	T	81.7	Confident	89.2	Confident	53 Å²	53	51.8 Å²	51.8	33%	0.325	25%	0.253	S	S	.	.			trans	-103	-5.6	-178.5	45.5	0	0	0	0	113.6	Q609 R614 G615	Q609-T611 PolarHBondContact O-N 3Å; T611-R614 WeakPolarHBondContact O-CB 3.48Å; T611-R614 PolarHBondContact O-N 3.29Å; T611-G615 WeakPolarHBondContact OG1-CA 3.36Å; T611-G615 PolarHBondContact OG1-N 3Å
612	G	82.6	Confident	89.1	Confident	13 Å²	13	57 Å²	57	13%	0.134	28%	0.28	C	S	.	.	T	Hydrogen-bonded Turn	trans	60.1	-146.6	-177.1	0	0	0	0	0	112	R614 G615	G612-R614 PolarHBondContact O-N 3.17Å; G612-G615 PolarHBondContact O-N 3.46Å
613	A	87.5	Confident	89	Confident	27 Å²	27	58.8 Å²	58.8	22%	0.223	29%	0.29	C	S	.	.	H	α-helix	trans	-61.7	-19.7	-179.6	0	0	0	0	0	114	G336 L561 L566 V569 G615 L616	G336-A613 WeakPolarHBondContact O-CB 3.22Å; G336-A613 PolarHBondContact O-N 2.88Å; L561-A613 HydrophobicContact CD1-CB 3.84Å; L566-A613 HydrophobicContact CD2-CB 4.19Å; V569-A613 HydrophobicContact CG1-CB 4.3Å; A613-G615 VanDerWaalsContact C-N 3.27Å; A613-G615 PolarHBondContact O-N 3.45Å; A613-L616 HydrophobicContact CB-CD1 4.13Å; A613-L616 PolarHBondContact O-N 3.29Å
614	R	88.4	Confident	89	Confident	208 Å²	208	58.9 Å²	58.9	79%	0.785	29%	0.29	S	S	*	.	H	α-helix	trans	-67.3	-27.8	175.6	-169.1	174.7	178.2	170.4	-0.6	112.1	T611 G612	T611-R614 WeakPolarHBondContact O-CB 3.48Å; T611-R614 PolarHBondContact O-N 3.29Å; G612-R614 PolarHBondContact O-N 3.17Å
615	G	88.1	Confident	89	Confident	3 Å²	3	59 Å²	59	3%	0.031	30%	0.298	C	S	.	.	H	α-helix	trans	-74	-31	177.2	0	0	0	0	0	114.5	T611 G612 A613 R617 S618 V619	T611-G615 WeakPolarHBondContact OG1-CA 3.36Å; T611-G615 PolarHBondContact OG1-N 3Å; G612-G615 PolarHBondContact O-N 3.46Å; A613-G615 VanDerWaalsContact C-N 3.27Å; A613-G615 PolarHBondContact O-N 3.45Å; G615-R617 PolarHBondContact O-N 3.03Å; G615-R617 VanDerWaalsContact O-N 3.1Å; G615-S618 WeakPolarHBondContact O-CA 3.46Å; G615-S618 WeakPolarHBondContact O-CB 3.34Å; G615-S618 PolarHBondContact O-N 3.44Å; G615-V619 PolarHBondContact O-N 3.47Å
616	L	92.2	Very high	89	Confident	0 Å²	0	61.5 Å²	61.5	0%	0	31%	0.308	C	S	.	.	H	α-helix	trans	-52.3	-39	-176.3	-66.9	171.6	0	0	0	112.7	L566 V569 L570 L577 I602 A606 A613 L620	L566-L616 HydrophobicContact CD2-CD1 3.99Å; L566-L616 HydrophobicContact CD2-CG 4.41Å; V569-L616 HydrophobicContact CG1-CD1 4.06Å; L570-L616 HydrophobicContact CD1-CD2 4.19Å; L570-L616 HydrophobicContact CD2-CB 4.21Å; L570-L616 HydrophobicContact CD2-CD1 4.01Å; L570-L616 HydrophobicContact CD2-CD2 4.18Å; L570-L616 HydrophobicContact CD2-CG 4.38Å; L570-L616 HydrophobicContact CG-CD1 4.14Å; L570-L616 HydrophobicContact CG-CD2 4.21Å; L577-L616 HydrophobicContact CD1-CB 3.7Å; I602-L616 HydrophobicContact CG2-CD2 4.14Å; A606-L616 HydrophobicContact CB-CD2 3.63Å; A606-L616 HydrophobicContact CB-CG 4.19Å; A613-L616 HydrophobicContact CB-CD1 4.13Å; A613-L616 PolarHBondContact O-N 3.29Å; L616-L620 WeakPolarHBondContact O-CB 3.42Å; L616-L620 WeakPolarHBondContact O-CG 3.23Å; L616-L620 PolarHBondContact O-N 3.11Å
617	R	91.5	Very high	89.1	Confident	127 Å²	127	61.5 Å²	61.5	48%	0.479	31%	0.308	S	S	.	.	H	α-helix	trans	-66.4	-43	177.1	-177.4	173.6	173.7	146.3	8.1	112.3	L577 G615 L620 E621	L577-R617 HydrophobicContact CD1-CB 4.32Å; G615-R617 PolarHBondContact O-N 3.03Å; G615-R617 VanDerWaalsContact O-N 3.1Å; R617-L620 PolarHBondContact O-N 3.46Å; R617-E621 HydrophobicContact CG-CG 4.23Å; R617-E621 IonicContact CZ-OE1 3.57Å; R617-E621 VanDerWaalsContact CZ-OE1 3.25Å; R617-E621 IonicContact NE-OE1 2.78Å; R617-E621 PolarHBondContact NE-OE1 3.09Å; R617-E621 IonicContact NH2-OE1 2.67Å; R617-E621 PolarHBondContact NH2-OE1 2.86Å; R617-E621 WeakPolarHBondContact O-CB 3.37Å; R617-E621 WeakPolarHBondContact O-CG 3.41Å; R617-E621 PolarHBondContact O-N 2.98Å
618	S	91	Very high	89.2	Confident	53 Å²	53	64.2 Å²	64.2	37%	0.371	32%	0.315	S	S	.	.	H	α-helix	trans	-63	-41.9	177	-174.6	0	0	0	0	111.5	G615 N622	G615-S618 WeakPolarHBondContact O-CA 3.46Å; G615-S618 WeakPolarHBondContact O-CB 3.34Å; G615-S618 PolarHBondContact O-N 3.44Å; S618-N622 VanDerWaalsContact O-CG 3.28Å; S618-N622 PolarHBondContact O-N 3.35Å; S618-N622 VanDerWaalsContact O-N 3.15Å; S618-N622 PolarHBondContact O-ND2 3.12Å; S618-N622 VanDerWaalsContact O-ND2 3.17Å
619	V	92.5	Very high	89.5	Confident	3 Å²	3	69.6 Å²	69.6	2%	0.018	33%	0.325	C	S	.	.	H	α-helix	trans	-61	-50.6	174.6	175.4	0	0	0	0	110.7	I602 L605 G615 N622 L623	I602-V619 HydrophobicContact CG1-CG1 4.39Å; I602-V619 HydrophobicContact CG2-CG1 3.97Å; L605-V619 HydrophobicContact CD2-CG1 3.8Å; L605-V619 HydrophobicContact CD2-CG2 4.38Å; L605-V619 HydrophobicContact CG-CG1 4.27Å; L605-V619 HydrophobicContact CG-CG2 4.1Å; G615-V619 PolarHBondContact O-N 3.47Å; V619-N622 PolarHBondContact O-N 3.42Å; V619-L623 HydrophobicContact CG1-CD1 3.75Å; V619-L623 HydrophobicContact CG1-CG 4.45Å; V619-L623 VanDerWaalsContact O-CG 3.3Å; V619-L623 WeakPolarHBondContact O-CG 3.3Å; V619-L623 PolarHBondContact O-N 3.03Å
620	L	92.2	Very high	89.8	Confident	0 Å²	0	68.8 Å²	68.8	0%	0	32%	0.324	C	S	.	.	H	α-helix	trans	-65.5	-39.3	179.6	-76.1	169	0	0	0	113.4	L570 L577 I578 Y581 I602 L616 R617 N622 L623 L624	L570-L620 HydrophobicContact CD2-CD1 3.87Å; L577-L620 HydrophobicContact CB-CD1 3.89Å; L577-L620 HydrophobicContact CD1-CD1 4.19Å; I578-L620 HydrophobicContact CD1-CD1 4.14Å; I578-L620 HydrophobicContact CD1-CD2 4.09Å; Y581-L620 HydrophobicContact CD2-CB 4.42Å; Y581-L620 HydrophobicContact CD2-CD1 4.1Å; Y581-L620 HydrophobicContact CE2-CB 3.68Å; Y581-L620 HydrophobicContact CE2-CD1 3.8Å; Y581-L620 HydrophobicContact CE2-CG 4.31Å; I602-L620 HydrophobicContact CD1-CD2 3.96Å; L616-L620 WeakPolarHBondContact O-CB 3.42Å; L616-L620 WeakPolarHBondContact O-CG 3.23Å; L616-L620 PolarHBondContact O-N 3.11Å; R617-L620 PolarHBondContact O-N 3.46Å; L620-N622 VanDerWaalsContact C-N 3.31Å; L620-N622 PolarHBondContact O-N 3.05Å; L620-L623 PolarHBondContact O-N 3.33Å; L620-L624 HydrophobicContact CD2-CD1 4.42Å; L620-L624 VanDerWaalsContact O-CB 3.25Å; L620-L624 WeakPolarHBondContact O-CB 3.25Å; L620-L624 WeakPolarHBondContact O-CG 3.31Å; L620-L624 PolarHBondContact O-N 3.03Å
621	E	91.4	Very high	90.3	Very high	75 Å²	75	61.9 Å²	61.9	35%	0.35	29%	0.292	S	S	.	.	H	α-helix	trans	-63.2	-37.8	177.3	-75.7	179.6	170	0	0	111.5	Y581 R617 L625	Y581-E621 WeakPolarHBondContact OH-CG 3.29Å; R617-E621 HydrophobicContact CG-CG 4.23Å; R617-E621 IonicContact CZ-OE1 3.57Å; R617-E621 VanDerWaalsContact CZ-OE1 3.25Å; R617-E621 IonicContact NE-OE1 2.78Å; R617-E621 PolarHBondContact NE-OE1 3.09Å; R617-E621 IonicContact NH2-OE1 2.67Å; R617-E621 PolarHBondContact NH2-OE1 2.86Å; R617-E621 WeakPolarHBondContact O-CB 3.37Å; R617-E621 WeakPolarHBondContact O-CG 3.41Å; R617-E621 PolarHBondContact O-N 2.98Å; E621-L625 PolarHBondContact O-N 3.11Å
622	N	91.7	Very high	90.7	Very high	113 Å²	113	62.7 Å²	62.7	60%	0.604	30%	0.298	S	S	*	.	H	α-helix	trans	-69.5	-43.3	175.2	-69.8	-27.3	0	0	0	112.5	S618 V619 L620	S618-N622 VanDerWaalsContact O-CG 3.28Å; S618-N622 PolarHBondContact O-N 3.35Å; S618-N622 VanDerWaalsContact O-N 3.15Å; S618-N622 PolarHBondContact O-ND2 3.12Å; S618-N622 VanDerWaalsContact O-ND2 3.17Å; V619-N622 PolarHBondContact O-N 3.42Å; L620-N622 VanDerWaalsContact C-N 3.31Å; L620-N622 PolarHBondContact O-N 3.05Å
623	L	92.2	Very high	90.9	Very high	39 Å²	39	66.5 Å²	66.5	20%	0.204	34%	0.337	C	S	.	.	H	α-helix	trans	-70.3	-39.3	-179.2	-68.1	171.4	0	0	0	112.8	I602 V619 L620 L625 V646	I602-L623 HydrophobicContact CD1-CD1 4.31Å; I602-L623 HydrophobicContact CG1-CD1 3.94Å; V619-L623 HydrophobicContact CG1-CD1 3.75Å; V619-L623 HydrophobicContact CG1-CG 4.45Å; V619-L623 VanDerWaalsContact O-CG 3.3Å; V619-L623 WeakPolarHBondContact O-CG 3.3Å; V619-L623 PolarHBondContact O-N 3.03Å; L620-L623 PolarHBondContact O-N 3.33Å; L623-L625 VanDerWaalsContact C-N 3.31Å; L623-V646 HydrophobicContact CD1-CB 4.45Å; L623-V646 HydrophobicContact CD1-CG1 4.16Å; L623-V646 HydrophobicContact CD1-CG2 4.18Å
624	L	92.5	Very high	90.9	Very high	1 Å²	1	67.4 Å²	67.4	1%	0.005	34%	0.342	C	S	.	.	T	Hydrogen-bonded Turn	trans	-84.9	-0.7	-178.7	-67.8	171.9	0	0	0	113.5	Y581 F585 L592 L620 Q626 R628 L641	Y581-L624 HydrophobicContact CD1-CD1 3.53Å; Y581-L624 HydrophobicContact CD2-CD1 3.81Å; Y581-L624 HydrophobicContact CE1-CD1 3.92Å; Y581-L624 HydrophobicContact CE2-CD1 4.18Å; Y581-L624 HydrophobicContact CG-CD1 3.48Å; Y581-L624 VanDerWaalsContact CG-CD1 3.48Å; F585-L624 HydrophobicContact CE2-CD1 4.42Å; F585-L624 HydrophobicContact CE2-CD2 3.92Å; F585-L624 HydrophobicContact CZ-CD2 4.1Å; L592-L624 HydrophobicContact CD1-CD2 3.99Å; L592-L624 HydrophobicContact CD2-CD1 4.29Å; L592-L624 HydrophobicContact CD2-CD2 4.12Å; L620-L624 HydrophobicContact CD2-CD1 4.42Å; L620-L624 VanDerWaalsContact O-CB 3.25Å; L620-L624 WeakPolarHBondContact O-CB 3.25Å; L620-L624 WeakPolarHBondContact O-CG 3.31Å; L620-L624 PolarHBondContact O-N 3.03Å; L624-Q626 PolarHBondContact O-N 3.06Å; L624-R628 HydrophobicContact CB-CG 4.46Å; L624-R628 VanDerWaalsContact O-CB 3.29Å; L624-R628 WeakPolarHBondContact O-CB 3.26Å; L624-R628 VanDerWaalsContact O-CG 3.23Å; L624-R628 WeakPolarHBondContact O-CG 3.5Å; L624-R628 PolarHBondContact O-N 3.26Å; L624-L641 HydrophobicContact CD2-CD1 3.82Å; L624-L641 HydrophobicContact CD2-CD2 4.46Å; L624-L641 HydrophobicContact CD2-CG 4.47Å; L624-L641 HydrophobicContact CG-CD1 4.49Å
625	L	92.5	Very high	91	Very high	107 Å²	107	63.2 Å²	63.2	56%	0.56	34%	0.335	S	S	*	.	H	α-helix	trans	-59.4	-46.2	-178.5	-178.4	61.6	0	0	0	112.5	E621 L623 Y629	E621-L625 PolarHBondContact O-N 3.11Å; L623-L625 VanDerWaalsContact C-N 3.31Å; L625-Y629 PolarHBondContact O-N 3.22Å
626	Q	91.2	Very high	91	Very high	115 Å²	115	63.8 Å²	63.8	54%	0.537	34%	0.337	S	S	.	.	H	α-helix	trans	-70.5	-51.7	179.8	-61.9	-66.1	-46	0	0	111.6	L624 R628 Y629 D630	L624-Q626 PolarHBondContact O-N 3.06Å; Q626-R628 VanDerWaalsContact C-N 3.26Å; Q626-R628 PolarHBondContact O-N 3.37Å; Q626-R628 VanDerWaalsContact O-N 3.17Å; Q626-Y629 WeakPolarHBondContact O-CB 3.43Å; Q626-Y629 PolarHBondContact O-N 3.06Å; Q626-D630 PolarHBondContact O-N 2.93Å
627	P	92.1	Very high	91	Very high	0 Å²	0	65.1 Å²	65.1	0%	0	35%	0.346	C	S	.	.	H	α-helix	trans	-53.9	-37	173.9	-31.4	37.3	0	0	0	115.1	F585 Y629 D630 V631 V639 P652 Y654	F585-P627 HydrophobicContact CE1-CB 4Å; F585-P627 HydrophobicContact CZ-CB 3.82Å; P627-Y629 VanDerWaalsContact C-N 3.29Å; P627-Y629 PolarHBondContact O-N 3.26Å; P627-D630 PolarHBondContact O-N 3.29Å; P627-V631 VanDerWaalsContact O-CB 3.31Å; P627-V631 WeakPolarHBondContact O-CB 3.49Å; P627-V631 VanDerWaalsContact O-CG2 3.26Å; P627-V631 WeakPolarHBondContact O-CG2 3.36Å; P627-V631 PolarHBondContact O-N 3.03Å; P627-V639 HydrophobicContact CB-CG1 4.06Å; P627-V639 HydrophobicContact CB-CG2 4.36Å; P627-V639 HydrophobicContact CG-CG1 4.12Å; P627-P652 HydrophobicContact CG-CB 4.18Å; P627-P652 HydrophobicContact CG-CG 3.73Å; P627-Y654 WeakPolarHBondContact CA-OH 3.28Å; P627-Y654 HydrophobicContact CB-CE1 4.2Å; P627-Y654 HydrophobicContact CG-CE1 4.25Å
628	R	91.4	Very high	91.1	Very high	114 Å²	114	60.1 Å²	60.1	43%	0.43	33%	0.33	S	S	.	.	H	α-helix	trans	-74.5	-17.2	177.6	-71.8	-179.7	63.7	-179	-1.2	114.1	L584 F585 L624 Q626 P632	L584-R628 VanDerWaalsContact CD2-CZ 3.46Å; F585-R628 HydrophobicContact CE1-CG 4.18Å; F585-R628 HydrophobicContact CE2-CG 4Å; F585-R628 HydrophobicContact CZ-CG 3.5Å; L624-R628 HydrophobicContact CB-CG 4.46Å; L624-R628 VanDerWaalsContact O-CB 3.29Å; L624-R628 WeakPolarHBondContact O-CB 3.26Å; L624-R628 VanDerWaalsContact O-CG 3.23Å; L624-R628 WeakPolarHBondContact O-CG 3.5Å; L624-R628 PolarHBondContact O-N 3.26Å; Q626-R628 VanDerWaalsContact C-N 3.26Å; Q626-R628 PolarHBondContact O-N 3.37Å; Q626-R628 VanDerWaalsContact O-N 3.17Å; R628-P632 WeakPolarHBondContact O-CD 3.45Å
629	Y	92.8	Very high	91.2	Very high	184 Å²	184	57.6 Å²	57.6	72%	0.722	31%	0.312	S	S	*	.	H	α-helix	trans	-85.4	-40.2	170.7	-180	-99.2	0	0	0	111.1	L625 Q626 P627	L625-Y629 PolarHBondContact O-N 3.22Å; Q626-Y629 WeakPolarHBondContact O-CB 3.43Å; Q626-Y629 PolarHBondContact O-N 3.06Å; P627-Y629 VanDerWaalsContact C-N 3.29Å; P627-Y629 PolarHBondContact O-N 3.26Å
630	D	91.4	Very high	91.3	Very high	60 Å²	60	58.4 Å²	58.4	32%	0.321	32%	0.317	S	S	.	.	H	α-helix	trans	-78.8	-33.8	-174.7	-65.8	-26.8	0	0	0	114.1	Q626 P627 S634 Y654	Q626-D630 PolarHBondContact O-N 2.93Å; P627-D630 PolarHBondContact O-N 3.29Å; D630-S634 VanDerWaalsContact O-CB 3.28Å; D630-S634 WeakPolarHBondContact O-CB 3.49Å; D630-S634 PolarHBondContact O-OG 3.09Å; D630-Y654 PolarHBondContact OD2-OH 3.3Å
631	V	90.2	Very high	91.4	Very high	4 Å²	4	58.6 Å²	58.6	2%	0.024	32%	0.319	C	S	.	.	S	Bend	trans	-68.1	-49.3	-172.8	162.9	0	0	0	0	114	F585 D588 C590 P627 G633 S634 I636 V639	F585-V631 HydrophobicContact CD1-CB 4.42Å; F585-V631 HydrophobicContact CD1-CG1 4.28Å; F585-V631 HydrophobicContact CD1-CG2 4.15Å; F585-V631 HydrophobicContact CE1-CB 4.3Å; F585-V631 HydrophobicContact CE1-CG2 3.94Å; D588-V631 HydrophobicContact CB-CG1 3.88Å; C590-V631 HydrophobicContact CB-CG1 3.62Å; C590-V631 HydrophobicContact CB-CG2 4.47Å; P627-V631 VanDerWaalsContact O-CB 3.31Å; P627-V631 WeakPolarHBondContact O-CB 3.49Å; P627-V631 VanDerWaalsContact O-CG2 3.26Å; P627-V631 WeakPolarHBondContact O-CG2 3.36Å; P627-V631 PolarHBondContact O-N 3.03Å; V631-G633 PolarHBondContact O-N 3.26Å; V631-G633 VanDerWaalsContact O-N 3.11Å; V631-S634 WeakPolarHBondContact CA-OG 3.47Å; V631-S634 WeakPolarHBondContact O-CB 3.47Å; V631-S634 PolarHBondContact O-N 2.64Å; V631-S634 PolarHBondContact O-OG 3.19Å; V631-I636 HydrophobicContact CG2-CB 4.47Å; V631-I636 HydrophobicContact CG2-CG2 4.27Å; V631-V639 HydrophobicContact CG2-CG2 3.82Å
632	P	90.3	Very high	91.6	Very high	70 Å²	70	56.2 Å²	56.2	46%	0.455	31%	0.309	S	S	.	.	T	Hydrogen-bonded Turn	trans	-60.4	115.3	-174.1	-26	36.3	0	0	0	113.2	R628	R628-P632 WeakPolarHBondContact O-CD 3.45Å
633	G	85.7	Confident	91.7	Very high	93 Å²	93	54.4 Å²	54.4	96%	0.959	30%	0.297	S	S	*	.	T	Hydrogen-bonded Turn	trans	83.7	14.6	-178.6	0	0	0	0	0	115.3	V631	V631-G633 PolarHBondContact O-N 3.26Å; V631-G633 VanDerWaalsContact O-N 3.11Å
634	S	87.9	Confident	91.7	Very high	46 Å²	46	53.5 Å²	53.5	32%	0.322	30%	0.297	S	S	.	.	S	Bend	trans	-107.6	166	176.4	75.6	0	0	0	0	113.3	D630 V631 I636	D630-S634 VanDerWaalsContact O-CB 3.28Å; D630-S634 WeakPolarHBondContact O-CB 3.49Å; D630-S634 PolarHBondContact O-OG 3.09Å; V631-S634 WeakPolarHBondContact CA-OG 3.47Å; V631-S634 WeakPolarHBondContact O-CB 3.47Å; V631-S634 PolarHBondContact O-N 2.64Å; V631-S634 PolarHBondContact O-OG 3.19Å; S634-I636 PolarHBondContact O-N 3.21Å; S634-I636 WeakPolarHBondContact OG-CB 3.47Å; S634-I636 WeakPolarHBondContact OG-CD1 3.48Å; S634-I636 WeakPolarHBondContact OG-CG1 3.28Å; S634-I636 PolarHBondContact OG-N 3.4Å
635	D	89.6	Confident	91.6	Very high	120 Å²	120	54.1 Å²	54.1	64%	0.642	30%	0.302	S	S	*	.	S	Bend	trans	-79.6	15.8	175	-50.5	-50.3	0	0	0	113.8	R656 L657	D635-R656 VanDerWaalsContact O-CA 3.23Å; D635-R656 WeakPolarHBondContact O-CA 3.24Å; D635-R656 WeakPolarHBondContact O-CB 3.23Å; D635-L657 PolarHBondContact O-N 3.19Å
636	I	90	Very high	91.6	Very high	16 Å²	16	49.4 Å²	49.4	8%	0.082	28%	0.278	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-85.5	113	-173	-58.2	171.1	0	0	0	110.4	C590 V631 S634 V639 Y654 R656	C590-I636 PolarHBondContact SG-O 3.21Å; V631-I636 HydrophobicContact CG2-CB 4.47Å; V631-I636 HydrophobicContact CG2-CG2 4.27Å; S634-I636 PolarHBondContact O-N 3.21Å; S634-I636 WeakPolarHBondContact OG-CB 3.47Å; S634-I636 WeakPolarHBondContact OG-CD1 3.48Å; S634-I636 WeakPolarHBondContact OG-CG1 3.28Å; S634-I636 PolarHBondContact OG-N 3.4Å; I636-V639 HydrophobicContact CG2-CG2 4.35Å; I636-Y654 HydrophobicContact CD1-CD1 4Å; I636-Y654 HydrophobicContact CD1-CE1 4.45Å; I636-Y654 HydrophobicContact CD1-CG 4.17Å; I636-Y654 HydrophobicContact CG2-CD1 4.05Å; I636-R656 HydrophobicContact CG1-CG 4.17Å
637	S	90.6	Very high	91.6	Very high	27 Å²	27	48.6 Å²	48.6	19%	0.189	28%	0.277	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-93.2	-20.6	178	50.4	0	0	0	0	114.9	C590 E591 H655	C590-S637 VanDerWaalsContact SG-C 3.53Å; E591-S637 PolarHBondContact N-O 2.8Å; S637-H655 PolarHBondContact N-O 3.08Å; S637-H655 PolarHBondContact OG-O 2.76Å
638	T	93.3	Very high	91.4	Very high	22 Å²	22	51.7 Å²	51.7	14%	0.135	31%	0.309	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-147.6	131.6	-178.6	-46.2	0	0	0	0	111.4	E591 R593 V640 H655	E591-T638 HydrophobicContact CB-CG2 4.31Å; E591-T638 CarbonylContact O-C 3.56Å; E591-T638 VanDerWaalsContact O-CA 3.28Å; E591-T638 WeakPolarHBondContact O-CA 3.4Å; E591-T638 WeakPolarHBondContact O-CG2 3.43Å; R593-T638 HydrophobicContact CG-CG2 4.2Å; T638-V640 HydrophobicContact CG2-CG2 4.2Å; T638-H655 PolarHBondContact N-O 2.96Å; T638-H655 PolarHBondContact O-N 2.94Å
639	V	94.1	Very high	91.3	Very high	0 Å²	0	53.7 Å²	53.7	0%	0	32%	0.323	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-106.5	127.6	170.4	179.9	0	0	0	0	108.2	F585 E591 L592 R593 P627 V631 I636 L641 P652 E653 Y654	F585-V639 HydrophobicContact CE1-CG2 4.27Å; E591-V639 PolarHBondContact O-N 3.35Å; L592-V639 HydrophobicContact CD1-CB 4.02Å; L592-V639 HydrophobicContact CD1-CG1 3.95Å; R593-V639 PolarHBondContact N-O 3.04Å; P627-V639 HydrophobicContact CB-CG1 4.06Å; P627-V639 HydrophobicContact CB-CG2 4.36Å; P627-V639 HydrophobicContact CG-CG1 4.12Å; V631-V639 HydrophobicContact CG2-CG2 3.82Å; I636-V639 HydrophobicContact CG2-CG2 4.35Å; V639-L641 HydrophobicContact CG1-CD2 4.49Å; V639-P652 HydrophobicContact CG1-CB 4.45Å; V639-E653 WeakPolarHBondContact CA-O 3.45Å; V639-Y654 HydrophobicContact CG1-CE1 4.36Å; V639-Y654 HydrophobicContact CG2-CD1 3.99Å; V639-Y654 HydrophobicContact CG2-CE1 4.07Å
640	V	95.1	Very high	91.1	Very high	20 Å²	20	47.2 Å²	47.2	12%	0.121	30%	0.304	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-114.5	119.8	175.5	-173.2	0	0	0	0	109.9	R593 T595 T638 T642 E653	R593-V640 HydrophobicContact CB-CG2 4.32Å; R593-V640 WeakPolarHBondContact O-CA 3.39Å; T595-V640 HydrophobicContact CG2-CG1 4.39Å; T638-V640 HydrophobicContact CG2-CG2 4.2Å; V640-T642 HydrophobicContact CG1-CG2 4.43Å; V640-E653 HydrophobicContact CB-CB 4.16Å; V640-E653 PolarHBondContact N-O 3.29Å; V640-E653 PolarHBondContact O-N 3.18Å
641	L	94.6	Very high	91	Very high	5 Å²	5	49.2 Å²	49.2	3%	0.026	32%	0.321	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-91.7	118	172	-64.2	-172.2	0	0	0	110.8	L592 R593 V594 T595 A598 L624 V639 P652	L592-L641 HydrophobicContact CD1-CD1 4.46Å; L592-L641 HydrophobicContact CD1-CG 4.23Å; R593-L641 PolarHBondContact O-N 3.19Å; V594-L641 HydrophobicContact CB-CB 4.46Å; V594-L641 HydrophobicContact CG1-CB 4.16Å; V594-L641 HydrophobicContact CG2-CB 4.25Å; V594-L641 HydrophobicContact CG2-CD1 4.07Å; V594-L641 HydrophobicContact CG2-CG 4.4Å; T595-L641 PolarHBondContact N-O 3.47Å; T595-L641 PolarHBondContact OG1-O 2.78Å; A598-L641 WeakPolarHBondContact CB-O 3.23Å; L624-L641 HydrophobicContact CD2-CD1 3.82Å; L624-L641 HydrophobicContact CD2-CD2 4.46Å; L624-L641 HydrophobicContact CD2-CG 4.47Å; L624-L641 HydrophobicContact CG-CD1 4.49Å; V639-L641 HydrophobicContact CG1-CD2 4.49Å; L641-P652 HydrophobicContact CD2-CB 3.82Å
642	T	94.6	Very high	91	Very high	25 Å²	25	50.1 Å²	50.1	15%	0.153	33%	0.327	C	S	.	.			trans	-103.8	163.8	176	60.5	0	0	0	0	111.3	T595 V640 G644 A645 V646	T595-T642 HydrophobicContact CG2-CG2 4.37Å; V640-T642 HydrophobicContact CG1-CG2 4.43Å; T642-G644 VanDerWaalsContact C-N 3.26Å; T642-G644 PolarHBondContact O-N 3.5Å; T642-A645 WeakPolarHBondContact O-CB 3.44Å; T642-A645 PolarHBondContact O-N 3.34Å; T642-V646 PolarHBondContact O-N 3.37Å
643	E	94.1	Very high	91.1	Very high	74 Å²	74	51.4 Å²	51.4	35%	0.346	33%	0.326	S	S	.	.	H	α-helix	trans	-57.5	-39.4	177.3	176	171.3	-151.1	0	0	112.1	D597 A601 A645 V646 L647	D597-E643 HydrophobicContact CB-CB 4.36Å; A601-E643 HydrophobicContact CB-CG 4.06Å; E643-A645 PolarHBondContact O-N 3.16Å; E643-V646 WeakPolarHBondContact O-CB 3.49Å; E643-V646 PolarHBondContact O-N 2.92Å; E643-L647 HydrophobicContact CG-CD1 3.91Å; E643-L647 HydrophobicContact CG-CG 4.4Å; E643-L647 PolarHBondContact O-N 3.43Å
644	G	92	Very high	91.4	Very high	21 Å²	21	50.4 Å²	50.4	22%	0.216	29%	0.294	C	S	.	.	H	α-helix	trans	-58.8	-32.8	175.3	0	0	0	0	0	113.6	T642 G648 H649 S650	T642-G644 VanDerWaalsContact C-N 3.26Å; T642-G644 PolarHBondContact O-N 3.5Å; G644-G648 PolarHBondContact O-N 3.4Å; G644-H649 PolarHBondContact O-N 3.13Å; G644-S650 PolarHBondContact O-N 2.81Å; G644-S650 VanDerWaalsContact O-N 3.13Å
645	A	91.3	Very high	91.6	Very high	13 Å²	13	52.8 Å²	52.8	11%	0.107	30%	0.3	C	S	.	.	H	α-helix	trans	-74.4	-32.6	175.4	0	0	0	0	0	112.9	T642 E643 S650	T642-A645 WeakPolarHBondContact O-CB 3.44Å; T642-A645 PolarHBondContact O-N 3.34Å; E643-A645 PolarHBondContact O-N 3.16Å; A645-S650 VanDerWaalsContact CA-O 3.28Å; A645-S650 WeakPolarHBondContact CA-O 3.34Å; A645-S650 PolarHBondContact N-OG 3.31Å
646	V	91.8	Very high	91.4	Very high	9 Å²	9	55.5 Å²	55.5	6%	0.055	30%	0.301	C	S	.	.	H	α-helix	trans	-69.2	-40	175.3	-179.6	0	0	0	0	111.6	A598 A601 I602 L605 L623 T642 E643 G648	A598-V646 HydrophobicContact CB-CG2 3.87Å; A601-V646 HydrophobicContact CB-CB 3.94Å; A601-V646 HydrophobicContact CB-CG1 3.64Å; A601-V646 HydrophobicContact CB-CG2 4.44Å; I602-V646 HydrophobicContact CD1-CG2 4.09Å; I602-V646 HydrophobicContact CG1-CB 4.46Å; I602-V646 HydrophobicContact CG1-CG1 3.76Å; I602-V646 HydrophobicContact CG1-CG2 3.77Å; L605-V646 HydrophobicContact CD2-CG1 4.45Å; L623-V646 HydrophobicContact CD1-CB 4.45Å; L623-V646 HydrophobicContact CD1-CG1 4.16Å; L623-V646 HydrophobicContact CD1-CG2 4.18Å; T642-V646 PolarHBondContact O-N 3.37Å; E643-V646 WeakPolarHBondContact O-CB 3.49Å; E643-V646 PolarHBondContact O-N 2.92Å; V646-G648 VanDerWaalsContact C-N 3.31Å
647	L	90.5	Very high	90.8	Very high	97 Å²	97	60.9 Å²	60.9	51%	0.508	33%	0.33	S	S	.	.	T	Hydrogen-bonded Turn	trans	-82.1	-5.6	179.5	-61.9	175.9	0	0	0	113.6	E643	E643-L647 HydrophobicContact CG-CD1 3.91Å; E643-L647 HydrophobicContact CG-CG 4.4Å; E643-L647 PolarHBondContact O-N 3.43Å
648	G	88.3	Confident	89.5	Confident	65 Å²	65	64.1 Å²	64.1	67%	0.67	36%	0.358	S	S	*	.	T	Hydrogen-bonded Turn	trans	77.4	18.2	-179.9	0	0	0	0	0	115	G644 V646	G644-G648 PolarHBondContact O-N 3.4Å; V646-G648 VanDerWaalsContact C-N 3.31Å
649	H	88.9	Confident	87.5	Confident	157 Å²	157	67.8 Å²	67.8	73%	0.727	39%	0.385	S	S	*	.	S	Bend	trans	-85.4	-27.5	176.9	-62.5	-40.3	0	0	0	113.5	G644	G644-H649 PolarHBondContact O-N 3.13Å
650	S	89.1	Confident	85.1	Confident	48 Å²	48	73.7 Å²	73.7	34%	0.336	42%	0.423	S	S	.	.	S	Bend	trans	-137.4	154.9	179.5	61.7	0	0	0	0	111.3	G644 A645	G644-S650 PolarHBondContact O-N 2.81Å; G644-S650 VanDerWaalsContact O-N 3.13Å; A645-S650 VanDerWaalsContact CA-O 3.28Å; A645-S650 WeakPolarHBondContact CA-O 3.34Å; A645-S650 PolarHBondContact N-OG 3.31Å
651	P	88.8	Confident	82.4	Confident	102 Å²	102	78 Å²	78	66%	0.662	45%	0.449	S	S	*	.	P	Polyproline II helix	trans	-66.7	163.6	164.1	30.7	-34.9	0	0	0	111
652	P	90.8	Very high	79.8	Confident	23 Å²	23	82.9 Å²	82.9	15%	0.149	48%	0.484	C	S	.	.	P	Polyproline II helix	trans	-63.5	150.7	167.5	29	-35.3	0	0	0	111.2	P627 V639 L641 Y654	P627-P652 HydrophobicContact CG-CB 4.18Å; P627-P652 HydrophobicContact CG-CG 3.73Å; V639-P652 HydrophobicContact CG1-CB 4.45Å; L641-P652 HydrophobicContact CD2-CB 3.82Å; P652-Y654 HydrophobicContact CG-CE1 4.43Å; P652-Y654 HydrophobicContact CG-CE2 4.33Å
653	E	92	Very high	77	Confident	96 Å²	96	87 Å²	87	45%	0.449	51%	0.514	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-87.7	132.4	-179.6	-70.7	175.3	-162.3	0	0	110.8	V639 V640	V639-E653 WeakPolarHBondContact CA-O 3.45Å; V640-E653 HydrophobicContact CB-CB 4.16Å; V640-E653 PolarHBondContact N-O 3.29Å; V640-E653 PolarHBondContact O-N 3.18Å
654	Y	92.7	Very high	74.3	Confident	72 Å²	72	88.8 Å²	88.8	28%	0.282	53%	0.529	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-116.4	118.9	-178	-62.5	-62.2	0	0	0	110.8	P627 D630 I636 V639 P652	P627-Y654 WeakPolarHBondContact CA-OH 3.28Å; P627-Y654 HydrophobicContact CB-CE1 4.2Å; P627-Y654 HydrophobicContact CG-CE1 4.25Å; D630-Y654 PolarHBondContact OD2-OH 3.3Å; I636-Y654 HydrophobicContact CD1-CD1 4Å; I636-Y654 HydrophobicContact CD1-CE1 4.45Å; I636-Y654 HydrophobicContact CD1-CG 4.17Å; I636-Y654 HydrophobicContact CG2-CD1 4.05Å; V639-Y654 HydrophobicContact CG1-CE1 4.36Å; V639-Y654 HydrophobicContact CG2-CD1 3.99Å; V639-Y654 HydrophobicContact CG2-CE1 4.07Å; P652-Y654 HydrophobicContact CG-CE1 4.43Å; P652-Y654 HydrophobicContact CG-CE2 4.33Å
655	H	90.8	Very high	71.9	Confident	97 Å²	97	94.1 Å²	94.1	45%	0.449	56%	0.557	S	S	.	*	E	Extended strand (participates in β ladder)	trans	-101.2	129.3	169.8	-59	-73	0	0	0	110.5	S637 T638	S637-H655 PolarHBondContact N-O 3.08Å; S637-H655 PolarHBondContact OG-O 2.76Å; T638-H655 PolarHBondContact N-O 2.96Å; T638-H655 PolarHBondContact O-N 2.94Å
656	R	87.3	Confident	69	Low	176 Å²	176	102.6 Å²	102.6	66%	0.664	62%	0.616	S	S	*	*	E	Extended strand (participates in β ladder)	trans	-100	152.2	175.6	-61.8	-179	-173.4	-179.1	0.4	110.5	D635 I636 A658	D635-R656 VanDerWaalsContact O-CA 3.23Å; D635-R656 WeakPolarHBondContact O-CA 3.24Å; D635-R656 WeakPolarHBondContact O-CB 3.23Å; I636-R656 HydrophobicContact CG1-CG 4.17Å; R656-A658 PolarHBondContact O-N 3.22Å
657	L	76.5	Confident	67.8	Low	129 Å²	129	107.3 Å²	107.3	68%	0.675	64%	0.644	S	S	*	*	P	Polyproline II helix	trans	-62.7	121.7	168.5	-70.7	165.6	0	0	0	108.8	D635 S659	D635-L657 PolarHBondContact O-N 3.19Å; L657-S659 PolarHBondContact O-N 3.23Å; L657-S659 VanDerWaalsContact O-N 3.09Å
658	A	62.2	Low	66.6	Low	96 Å²	96	107.8 Å²	107.8	79%	0.793	65%	0.651	S	S	*	*			trans	-64.1	112.6	168.8	0	0	0	0	0	107.9	R656	R656-A658 PolarHBondContact O-N 3.22Å
659	S	52.4	Low	65.4	Low	99 Å²	99	110.2 Å²	110.2	69%	0.692	65%	0.65	S	S	*	*			trans	-59.5	127.3	174.6	48.1	0	0	0	0	109.2	L657 V661	L657-S659 PolarHBondContact O-N 3.23Å; L657-S659 VanDerWaalsContact O-N 3.09Å; S659-V661 PolarHBondContact O-N 3.19Å
660	P	43.8	Very low	64.1	Low	123 Å²	123	107.4 Å²	107.4	80%	0.799	65%	0.645	S	S	*	*	S	Bend	trans	-69.2	123.3	173.5	27.8	-31.7	0	0	0	108.7
661	V	39	Very low	62.5	Low	112 Å²	112	111.1 Å²	111.1	68%	0.679	67%	0.665	S	S	*	*			trans	78	100.5	168.7	-164.8	0	0	0	0	117.2	S659	S659-V661 PolarHBondContact O-N 3.19Å
662	S	38.4	Very low	60.7	Low	107 Å²	107	111.7 Å²	111.7	75%	0.748	67%	0.665	S	S	*	*			trans	-137.3	37	136.2	58	0	0	0	0	112.2	V664	S662-V664 PolarHBondContact O-N 2.75Å; S662-V664 VanDerWaalsContact O-N 3.08Å
663	S	36.3	Very low	58.6	Low	112 Å²	112	118.1 Å²	118.1	78%	0.783	70%	0.702	S	S	*	*			trans	-81.9	48.2	165.4	62.7	0	0	0	0	111.9
664	V	38.2	Very low	56	Low	110 Å²	110	119.8 Å²	119.8	67%	0.667	72%	0.721	S	S	*	*			trans	-153.1	107.8	166.7	-162.7	0	0	0	0	102.3	S662	S662-V664 PolarHBondContact O-N 2.75Å; S662-V664 VanDerWaalsContact O-N 3.08Å
665	V	40.3	Very low	53	Low	134 Å²	134	123.8 Å²	123.8	81%	0.812	76%	0.758	S	S	*	*				-161.2	147.7	77.2	160.1	0	0	0	0	108.6
666	S	30.6	Very low	49.5	Very low	190 Å²	190	126.2 Å²	126.2	100%	1.329	79%	0.786	S	S	*	*			trans	-88	0	168	-54.5	0	0	0	0	112.5

Retrieved 666 of 666 residues in 333.9 ms (Link to these results)

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