A0A087X9E6_POEFO Loading...

Tyrosine-protein kinase

AlphaFold DB , UniProt , Accession A0A087X9E6, Species POEFO (Poecilia formosa, Amazon molly), Gene FYN, Length 543 aa.

Structure Viewer

Loading PAE data...

(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	34.1	Very low	31.2	Very low	251 Å²	251	157 Å²	157	100%	1.236	87%	0.869	S	S	*	*				0	128.1	0	-92.7	-169.5	-108.2	0	0	108.5
2	G	32.6	Very low	31	Very low	85 Å²	85	154.9 Å²	154.9	88%	0.876	86%	0.864	S	S	*	*			trans	89	89.6	152.8	0	0	0	0	0	118.3
3	C	26.5	Very low	31	Very low	120 Å²	120	158.3 Å²	158.3	81%	0.811	86%	0.864	S	S	*	*			trans	-85.5	143	162.3	-173.4	0	0	0	0	109.8
4	V	34.7	Very low	30.8	Very low	135 Å²	135	159 Å²	159	82%	0.818	87%	0.865	S	S	*	*			trans	-147.1	98.1	158.1	-174.8	0	0	0	0	111.5
5	Q	32.7	Very low	30.9	Very low	173 Å²	173	156.9 Å²	156.9	81%	0.808	86%	0.86	S	S	*	*				43.7	133.1	129.8	-73.4	177.8	-20.3	0	0	125.1
6	C	30.2	Very low	30.8	Very low	115 Å²	115	156.8 Å²	156.8	78%	0.777	86%	0.858	S	S	*	*			trans	-47	160.2	163.4	-48.3	0	0	0	0	117.6
7	K	30.6	Very low	30.9	Very low	209 Å²	209	155.9 Å²	155.9	91%	0.909	85%	0.852	S	S	*	*			trans	-146.6	110.9	142.6	-107.7	179.5	-178	174.8	0	111
8	D	30.4	Very low	30.9	Very low	148 Å²	148	160.9 Å²	160.9	79%	0.791	86%	0.856	S	S	*	*			trans	-72.4	150.9	161.1	-70.7	-49.9	0	0	0	111.2
9	K	32.5	Very low	30.8	Very low	210 Å²	210	161.1 Å²	161.1	91%	0.913	86%	0.857	S	S	*	*			trans	-148.8	97.7	153	-85.4	-166.4	175.6	-177.4	0	110.3
10	E	28.2	Very low	30.8	Very low	196 Å²	196	157.5 Å²	157.5	92%	0.916	85%	0.851	S	S	*	*			trans	-79.7	161	138.6	-75.9	-174.6	140.1	0	0	107.6
11	A	30.9	Very low	30.8	Very low	85 Å²	85	155.8 Å²	155.8	70%	0.702	85%	0.851	S	S	*	*			cis	-151.6	173.9	13.4	0	0	0	0	0	108.2
12	T	28.4	Very low	30.5	Very low	132 Å²	132	151.5 Å²	151.5	81%	0.81	83%	0.832	S	S	*	*				172.1	125.4	114.1	-55.5	0	0	0	0	110.7
13	K	31.8	Very low	30.3	Very low	199 Å²	199	153.2 Å²	153.2	87%	0.865	83%	0.83	S	S	*	*			trans	-66.6	140.5	165.8	-86.2	175.4	169.6	176.4	0	110.7
14	L	27.8	Very low	30.5	Very low	168 Å²	168	156.5 Å²	156.5	88%	0.88	83%	0.834	S	S	*	*			trans	-143	124.6	152.6	-97.3	160.6	0	0	0	109.3
15	T	32.3	Very low	30.1	Very low	128 Å²	128	153.8 Å²	153.8	79%	0.785	83%	0.833	S	S	*	*			trans	-69.6	142.1	165.9	44.1	0	0	0	0	110.2
16	D	29.5	Very low	30	Very low	155 Å²	155	150.5 Å²	150.5	83%	0.829	84%	0.836	S	S	*	*			trans	-163.1	142	131.8	-136.9	-10.9	0	0	0	112.3
17	D	31.6	Very low	29.7	Very low	142 Å²	142	147.8 Å²	147.8	76%	0.759	83%	0.826	S	S	*	*			trans	-69.5	154	173.3	-75	-55.4	0	0	0	111.6
18	R	31.3	Very low	29.6	Very low	246 Å²	246	149.5 Å²	149.5	93%	0.928	83%	0.829	S	S	*	*			trans	-169	113.7	138.8	-106.4	165.2	-164.6	-155.9	3.9	113.1
19	D	29.3	Very low	29.6	Very low	164 Å²	164	152.5 Å²	152.5	88%	0.877	83%	0.829	S	S	*	*			trans	-54.8	145.9	155.1	-82.1	-45.1	0	0	0	112.8
20	A	30.8	Very low	29.4	Very low	88 Å²	88	152.3 Å²	152.3	73%	0.727	82%	0.824	S	S	*	*				157.3	116.5	116.6	0	0	0	0	0	111.8
21	S	29.8	Very low	29.3	Very low	123 Å²	123	146.8 Å²	146.8	86%	0.86	82%	0.82	S	S	*	*				158.2	100.7	108.5	52.3	0	0	0	0	111.5
22	I	28.6	Very low	29.2	Very low	160 Å²	160	147.6 Å²	147.6	82%	0.821	83%	0.826	S	S	*	*			trans	-82.3	130.4	161.2	-72.2	165.4	0	0	0	107	Q24	I22-Q24 HydrophobicContact CG2-CG 4.41Å
23	S	28.2	Very low	29.3	Very low	121 Å²	121	148.9 Å²	148.9	85%	0.846	83%	0.828	S	S	*	*			trans	-104.5	123.8	158.5	57.7	0	0	0	0	108.9
24	Q	30.1	Very low	29.3	Very low	190 Å²	190	145.1 Å²	145.1	89%	0.888	82%	0.824	S	S	*	*			trans	-79	139.3	177.3	-70.3	175.5	-16.2	0	0	110.4	I22	I22-Q24 HydrophobicContact CG2-CG 4.41Å
25	G	26.7	Very low	29.6	Very low	77 Å²	77	143.2 Å²	143.2	79%	0.794	82%	0.82	S	S	*	*			trans	-125.9	119.1	154.3	0	0	0	0	0	108.7
26	A	29.9	Very low	29.5	Very low	105 Å²	105	143 Å²	143	87%	0.868	82%	0.821	S	S	*	*			trans	-48.2	145.4	172.8	0	0	0	0	0	111.8
27	G	25.9	Very low	29.4	Very low	57 Å²	57	144.3 Å²	144.3	59%	0.588	82%	0.822	S	S	*	*			cis	105.9	95.2	31.3	0	0	0	0	0	108.7
28	Y	27.3	Very low	29.2	Very low	246 Å²	246	146.3 Å²	146.3	97%	0.965	83%	0.826	S	S	*	*			trans	-155.2	125.1	149.8	-84.4	-68.8	0	0	0	109.7
29	R	29.8	Very low	28.9	Very low	210 Å²	210	144.6 Å²	144.6	79%	0.792	82%	0.821	S	S	*	*			trans	-104.5	157.5	173.2	-88.3	-171	174.8	177.4	-1	110.3
30	Y	28.6	Very low	28.8	Very low	207 Å²	207	141.3 Å²	141.3	81%	0.812	81%	0.809	S	S	*	*			trans	95.1	110	154.8	-72.1	-72.2	0	0	0	119
31	G	26.3	Very low	28.5	Very low	79 Å²	79	144.9 Å²	144.9	81%	0.814	82%	0.816	S	S	*	*			trans	-160.7	117.7	150.9	0	0	0	0	0	108.4
32	A	29.2	Very low	28.3	Very low	102 Å²	102	147.9 Å²	147.9	84%	0.843	81%	0.814	S	S	*	*			trans	-78.8	163.5	-175.9	0	0	0	0	0	112.9
33	D	30.3	Very low	28.3	Very low	159 Å²	159	143.6 Å²	143.6	85%	0.85	81%	0.809	S	S	*	*			trans	-36.3	155.2	175.7	-77.1	-43.7	0	0	0	116.3
34	P	31.7	Very low	28.2	Very low	120 Å²	120	143.9 Å²	143.9	78%	0.779	81%	0.805	S	S	*	*				-125.7	143.1	123.5	30.9	-17.9	0	0	0	112.9
35	T	33.8	Very low	28.1	Very low	128 Å²	128	140.7 Å²	140.7	79%	0.785	80%	0.799	S	S	*	*	P	Polyproline II helix	trans	-51.2	161.7	174.3	22.7	0	0	0	0	115.4
36	P	31.1	Very low	28.1	Very low	124 Å²	124	141.6 Å²	141.6	81%	0.805	80%	0.799	S	S	*	*	P	Polyproline II helix	trans	-80.6	132.9	-164.8	32.3	-33.7	0	0	0	112.6
37	Q	27.1	Very low	27.9	Very low	183 Å²	183	144 Å²	144	86%	0.855	80%	0.795	S	S	*	*	P	Polyproline II helix	trans	-83.7	123.1	171.5	-81.6	-174.2	-14.1	0	0	111.7
38	H	26.9	Very low	27.9	Very low	184 Å²	184	145.4 Å²	145.4	85%	0.852	79%	0.794	S	S	*	*	P	Polyproline II helix	trans	-65.7	133.2	170.3	-128.6	41.4	0	0	0	111.7
39	Y	26.5	Very low	27.9	Very low	209 Å²	209	140.3 Å²	140.3	82%	0.82	78%	0.784	S	S	*	*			trans	-149.4	156.8	157.7	-91.2	-69	0	0	0	108.7
40	P	27	Very low	27.8	Very low	96 Å²	96	139.2 Å²	139.2	62%	0.623	78%	0.781	S	S	*	*				-99	153.3	-111.1	35.9	-33.6	0	0	0	114	F42	P40-F42 PolarHBondContact O-N 3.01Å
41	N	24.2	Very low	27.6	Very low	163 Å²	163	135.9 Å²	135.9	87%	0.872	78%	0.777	S	S	*	*			trans	-70.1	101.3	175	-157.6	13.2	0	0	0	110	G43	N41-G43 PolarHBondContact O-N 3.17Å
42	F	26.3	Very low	27.7	Very low	186 Å²	186	138.9 Å²	138.9	82%	0.816	77%	0.774	S	S	*	*			trans	-82.8	100.1	161	-93.4	-86	0	0	0	108.1	P40 V44	P40-F42 PolarHBondContact O-N 3.01Å; F42-V44 PolarHBondContact O-N 2.83Å; F42-V44 VanDerWaalsContact O-N 3.14Å
43	G	26.8	Very low	27.4	Very low	70 Å²	70	142.6 Å²	142.6	72%	0.722	77%	0.772	S	S	*	*			trans	-62.3	111.2	170.4	0	0	0	0	0	110.2	N41	N41-G43 PolarHBondContact O-N 3.17Å
44	V	26.5	Very low	27.3	Very low	127 Å²	127	143.9 Å²	143.9	77%	0.77	77%	0.772	S	S	*	*			trans	-102.9	112.3	157.4	-174.2	0	0	0	0	106.3	F42	F42-V44 PolarHBondContact O-N 2.83Å; F42-V44 VanDerWaalsContact O-N 3.14Å
45	T	27.6	Very low	26.9	Very low	122 Å²	122	142 Å²	142	75%	0.748	77%	0.768	S	S	*	*			trans	-39.2	136.2	173.1	43.7	0	0	0	0	112.6	I47	T45-I47 PolarHBondContact O-N 3.03Å
46	A	27.7	Very low	26.4	Very low	96 Å²	96	141.6 Å²	141.6	79%	0.793	77%	0.767	S	S	*	*			trans	-33.7	119.8	171.1	0	0	0	0	0	112.6
47	I	25.7	Very low	26.5	Very low	155 Å²	155	143.3 Å²	143.3	80%	0.795	78%	0.775	S	S	*	*			trans	-74.7	124	169.5	-60.7	176.6	0	0	0	106.8	T45 N49	T45-I47 PolarHBondContact O-N 3.03Å; I47-N49 PolarHBondContact O-N 3.12Å
48	P	25.9	Very low	26.4	Very low	87 Å²	87	137.8 Å²	137.8	57%	0.565	77%	0.766	S	S	*	*			trans	-62.8	134.6	-172.2	-19.4	29.5	0	0	0	113	Y50	P48-Y50 HydrophobicContact CB-CD2 4.11Å; P48-Y50 HydrophobicContact CB-CE2 3.94Å; P48-Y50 HydrophobicContact CG-CE2 4.34Å; P48-Y50 PolarHBondContact O-N 3.49Å; P48-Y50 VanDerWaalsContact O-N 3.15Å
49	N	27.5	Very low	26.3	Very low	139 Å²	139	138.1 Å²	138.1	74%	0.743	77%	0.769	S	S	*	*			trans	-67.5	101.4	168.7	-170.8	2.7	0	0	0	109.4	I47 N51	I47-N49 PolarHBondContact O-N 3.12Å; N49-N51 PolarHBondContact O-N 3.17Å
50	Y	26.3	Very low	26.3	Very low	187 Å²	187	131.5 Å²	131.5	73%	0.733	76%	0.763	S	S	*	*			trans	-88.6	36.8	177.3	-90.5	-81.7	0	0	0	113.2	P48 N52	P48-Y50 HydrophobicContact CB-CD2 4.11Å; P48-Y50 HydrophobicContact CB-CE2 3.94Å; P48-Y50 HydrophobicContact CG-CE2 4.34Å; P48-Y50 PolarHBondContact O-N 3.49Å; P48-Y50 VanDerWaalsContact O-N 3.15Å; Y50-N52 PolarHBondContact O-N 2.88Å
51	N	25.6	Very low	26.2	Very low	138 Å²	138	133.9 Å²	133.9	74%	0.738	78%	0.776	S	S	*	*			trans	-87.6	49.5	168.2	-87.3	-9.2	0	0	0	112.5	N49	N49-N51 PolarHBondContact O-N 3.17Å
52	N	27.4	Very low	26.5	Very low	141 Å²	141	131.2 Å²	131.2	75%	0.754	77%	0.766	S	S	*	*			trans	-159.1	87.4	164.1	-110.8	-12.2	0	0	0	111.7	Y50	Y50-N52 PolarHBondContact O-N 2.88Å
53	F	23.1	Very low	27	Very low	181 Å²	181	128 Å²	128	79%	0.794	76%	0.761	S	S	*	*			trans	-126.6	110.1	147.3	-102.5	-88.2	0	0	0	107.8	A55	F53-A55 PolarHBondContact O-N 3.06Å; F53-A55 VanDerWaalsContact O-N 3.08Å
54	H	27.8	Very low	27.6	Very low	185 Å²	185	127.7 Å²	127.7	86%	0.856	74%	0.74	S	S	*	*			trans	-56.6	105.9	150.8	-94.4	-76.1	0	0	0	107.3
55	A	23.6	Very low	27.8	Very low	82 Å²	82	125.1 Å²	125.1	68%	0.678	74%	0.739	S	S	*	*			trans	-92.6	138.6	164	0	0	0	0	0	108.7	F53	F53-A55 PolarHBondContact O-N 3.06Å; F53-A55 VanDerWaalsContact O-N 3.08Å
56	P	23.8	Very low	27.7	Very low	119 Å²	119	122.9 Å²	122.9	77%	0.773	74%	0.741	S	S	*	*			trans	-70.1	151.9	-178.9	31	-32.8	0	0	0	110	G58	P56-G58 PolarHBondContact O-N 3.26Å
57	V	32.9	Very low	27.9	Very low	160 Å²	160	124.6 Å²	124.6	97%	0.97	74%	0.741	S	S	*	*			trans	-41.4	112.4	170.7	179.7	0	0	0	0	110.2
58	G	24.7	Very low	27.9	Very low	66 Å²	66	125 Å²	125	68%	0.68	75%	0.745	S	S	*	*			trans	-142.3	100.8	-173.8	0	0	0	0	0	111.8	P56	P56-G58 PolarHBondContact O-N 3.26Å
59	Q	25.9	Very low	28	Very low	192 Å²	192	127 Å²	127	90%	0.897	76%	0.755	S	S	*	*			trans	35.5	108.1	154.6	-67.5	179.2	-23	0	0	118.7
60	G	25.7	Very low	27.9	Very low	69 Å²	69	125.5 Å²	125.5	71%	0.711	76%	0.756	S	S	*	*			trans	-56.5	142.8	165.4	0	0	0	0	0	112.5	T62	G60-T62 PolarHBondContact O-N 3.35Å; G60-T62 VanDerWaalsContact O-N 3.13Å
61	V	24.6	Very low	27.9	Very low	146 Å²	146	122 Å²	122	89%	0.885	76%	0.758	S	S	*	*			trans	-62.2	109.2	172.1	179.1	0	0	0	0	108.6
62	T	31.6	Very low	28	Very low	108 Å²	108	124.3 Å²	124.3	66%	0.663	76%	0.764	S	S	*	*			trans	-82	134.7	171.5	50.7	0	0	0	0	110.3	G60 F64	G60-T62 PolarHBondContact O-N 3.35Å; G60-T62 VanDerWaalsContact O-N 3.13Å; T62-F64 PolarHBondContact O-N 3.4Å; T62-F64 VanDerWaalsContact O-N 3.08Å; T62-F64 PolarHBondContact OG1-O 3.32Å
63	V	36.3	Very low	28.1	Very low	119 Å²	119	124.4 Å²	124.4	72%	0.721	77%	0.77	S	S	*	*	S	Bend	trans	-59.4	-16.3	178.3	171.2	0	0	0	0	113.2
64	F	39.5	Very low	28.2	Very low	63 Å²	63	119.5 Å²	119.5	28%	0.276	77%	0.771	S	S	.	*	S	Bend	trans	-110.2	126.9	174.9	-69.1	-95.7	0	0	0	110.2	T62 W126 P146 Q151	T62-F64 PolarHBondContact O-N 3.4Å; T62-F64 VanDerWaalsContact O-N 3.08Å; T62-F64 PolarHBondContact OG1-O 3.32Å; F64-W126 HydrophobicContact CE2-CH2 4.21Å; F64-P146 HydrophobicContact CE1-CG 4.49Å; F64-Q151 HydrophobicContact CD1-CG 4.42Å; F64-Q151 HydrophobicContact CE1-CB 4.16Å; F64-Q151 HydrophobicContact CE1-CG 3.71Å
65	G	30	Very low	28.3	Very low	73 Å²	73	117.3 Å²	117.3	75%	0.753	77%	0.77	S	S	*	*			trans	-56.2	138.3	174.7	0	0	0	0	0	111.4
66	G	26.8	Very low	28.5	Very low	75 Å²	75	120.9 Å²	120.9	77%	0.773	78%	0.778	S	S	*	*			trans	-53.6	137.6	-165.5	0	0	0	0	0	115.8
67	V	30.4	Very low	28.6	Very low	131 Å²	131	125.6 Å²	125.6	79%	0.794	78%	0.78	S	S	*	*			trans	-94.4	113.2	168	-178.2	0	0	0	0	107.5	T69	V67-T69 PolarHBondContact O-N 3.38Å
68	N	26.4	Very low	28.4	Very low	165 Å²	165	124.3 Å²	124.3	88%	0.882	77%	0.772	S	S	*	*			trans	-73.8	112.4	173.6	-84.2	-11.1	0	0	0	109.8
69	T	27.5	Very low	28.5	Very low	128 Å²	128	133.2 Å²	133.2	79%	0.785	79%	0.786	S	S	*	*			trans	-94.4	110.9	163.8	45.2	0	0	0	0	109	V67 S71	V67-T69 PolarHBondContact O-N 3.38Å; T69-S71 PolarHBondContact O-N 3.16Å
70	S	26.7	Very low	28.8	Very low	108 Å²	108	128 Å²	128	76%	0.755	78%	0.784	S	S	*	*			trans	-70.8	118.3	174.7	50.4	0	0	0	0	110.7
71	S	25.4	Very low	28.8	Very low	112 Å²	112	128 Å²	128	78%	0.783	78%	0.783	S	S	*	*			trans	-86.3	110.9	172	44.5	0	0	0	0	110.6	T69	T69-S71 PolarHBondContact O-N 3.16Å
72	H	28.2	Very low	29.5	Very low	187 Å²	187	128.6 Å²	128.6	87%	0.866	79%	0.787	S	S	*	*			trans	-93.3	115	163.2	-92.3	-65.6	0	0	0	109.6
73	T	28.5	Very low	29.3	Very low	144 Å²	144	127.7 Å²	127.7	88%	0.883	79%	0.791	S	S	*	*			trans	-82.1	122.1	167.8	36.6	0	0	0	0	109.7
74	G	26.3	Very low	29	Very low	78 Å²	78	131.3 Å²	131.3	80%	0.804	80%	0.797	S	S	*	*			trans	-151.9	104.5	171.9	0	0	0	0	0	110.1
75	T	29.6	Very low	28.7	Very low	138 Å²	138	134.3 Å²	134.3	85%	0.847	82%	0.823	S	S	*	*			trans	-76.1	133.3	174.8	11.9	0	0	0	0	110.7
76	L	26.8	Very low	28.8	Very low	158 Å²	158	142.4 Å²	142.4	83%	0.827	83%	0.831	S	S	*	*			trans	179.3	116.5	138.5	-96.1	151.4	0	0	0	114.1
77	R	25.8	Very low	29.3	Very low	217 Å²	217	143.4 Å²	143.4	82%	0.819	83%	0.826	S	S	*	*			trans	45.5	113.3	138.6	-74.3	-178	173.8	-173	-2.5	122.9
78	T	30.2	Very low	30	Very low	133 Å²	133	141.3 Å²	141.3	82%	0.816	82%	0.822	S	S	*	*			trans	38.2	114	130.9	53.8	0	0	0	0	120.9
79	R	26.7	Very low	31.2	Very low	254 Å²	254	136.9 Å²	136.9	96%	0.958	82%	0.815	S	S	*	*				-166.9	141.3	118.7	-134.7	172.7	176.7	171.6	-2.4	110.6
80	G	31.5	Very low	33.3	Very low	83 Å²	83	134.2 Å²	134.2	86%	0.856	80%	0.799	S	S	*	*			trans	-65.3	148.4	-170.7	0	0	0	0	0	115.2
81	G	26.4	Very low	35.9	Very low	68 Å²	68	133.5 Å²	133.5	70%	0.701	79%	0.79	S	S	*	*			trans	-175.3	116.3	170.1	0	0	0	0	0	107.9	A83	G81-A83 PolarHBondContact O-N 3.42Å
82	T	37.7	Very low	39.1	Very low	158 Å²	158	131 Å²	131	97%	0.969	77%	0.768	S	S	*	*			trans	-55.7	104.2	174.5	41.7	0	0	0	0	110
83	A	28.6	Very low	42.3	Very low	89 Å²	89	123.3 Å²	123.3	74%	0.736	73%	0.732	S	S	*	*			trans	-123.1	123	171.1	0	0	0	0	0	108.1	G81	G81-A83 PolarHBondContact O-N 3.42Å
84	F	30.2	Very low	45.5	Very low	196 Å²	196	117.5 Å²	117.5	86%	0.86	70%	0.696	S	S	*	*			trans	-44.2	144.2	167.9	-73.3	-94.6	0	0	0	110.6	R86	F84-R86 PolarHBondContact O-N 3.4Å
85	P	32	Very low	48.7	Very low	125 Å²	125	113.9 Å²	113.9	81%	0.812	66%	0.658	S	S	*	*			trans	-59.3	118	174.6	-10.2	23.2	0	0	0	107.9	S87	P85-S87 PolarHBondContact O-N 2.84Å
86	R	33.8	Very low	51.6	Low	244 Å²	244	108.2 Å²	108.2	92%	0.921	62%	0.623	S	S	*	*			trans	-55.3	112.1	163.7	-77.2	173.6	115.5	133.7	-2.3	106.1	F84 A88	F84-R86 PolarHBondContact O-N 3.4Å; R86-A88 PolarHBondContact O-N 3.38Å; R86-A88 VanDerWaalsContact O-N 3.11Å
87	S	37.5	Very low	54.6	Low	96 Å²	96	102.5 Å²	102.5	67%	0.671	59%	0.591	S	S	*	*			trans	-44.8	119.4	166.7	165.2	0	0	0	0	107.7	P85 G89	P85-S87 PolarHBondContact O-N 2.84Å; S87-G89 PolarHBondContact O-N 3Å
88	A	44.9	Very low	57.8	Low	87 Å²	87	95 Å²	95	72%	0.719	57%	0.567	S	S	*	*			trans	-49	124.6	156.2	0	0	0	0	0	106	R86 V90	R86-A88 PolarHBondContact O-N 3.38Å; R86-A88 VanDerWaalsContact O-N 3.11Å; A88-V90 PolarHBondContact O-N 3.23Å
89	G	51.9	Low	60.7	Low	71 Å²	71	89 Å²	89	73%	0.732	53%	0.529	S	S	*	.			trans	-57.1	115.7	-174.7	0	0	0	0	0	109.2	S87 T91	S87-G89 PolarHBondContact O-N 3Å; G89-T91 PolarHBondContact O-N 3.27Å
90	V	71.1	Confident	63.8	Low	73 Å²	73	84.3 Å²	84.3	44%	0.442	52%	0.518	S	S	.	.			trans	-69.3	113.1	171.8	177.4	0	0	0	0	106.2	A88 L92 Q116	A88-V90 PolarHBondContact O-N 3.23Å; V90-L92 HydrophobicContact CG1-CD2 4.35Å; V90-L92 PolarHBondContact O-N 3.48Å; V90-L92 VanDerWaalsContact O-N 3.1Å; V90-Q116 HydrophobicContact CG1-CG 3.72Å
91	T	81.1	Confident	66.7	Low	93 Å²	93	81.8 Å²	81.8	57%	0.571	49%	0.489	S	S	*	.			trans	-60.6	115.1	174.7	-55.5	0	0	0	0	108.7	G89 F93 P146	G89-T91 PolarHBondContact O-N 3.27Å; T91-F93 HydrophobicContact CG2-CD2 4.4Å; T91-F93 HydrophobicContact CG2-CE2 3.81Å; T91-F93 HydrophobicContact CG2-CZ 4.37Å; T91-P146 HydrophobicContact CG2-CB 4.17Å
92	L	93.1	Very high	69.7	Low	60 Å²	60	80.7 Å²	80.7	31%	0.314	46%	0.464	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-87.5	148.6	176.2	-62.2	-176.5	0	0	0	110.3	V90 L131 P146 V147	V90-L92 HydrophobicContact CG1-CD2 4.35Å; V90-L92 PolarHBondContact O-N 3.48Å; V90-L92 VanDerWaalsContact O-N 3.1Å; L92-L131 HydrophobicContact CD1-CD1 4.1Å; L92-L131 HydrophobicContact CD2-CD1 3.79Å; L92-P146 WeakPolarHBondContact O-CA 3.28Å; L92-V147 HydrophobicContact CB-CG2 3.81Å; L92-V147 PolarHBondContact O-N 3.16Å
93	F	94.8	Very high	72	Confident	24 Å²	24	74.3 Å²	74.3	11%	0.105	43%	0.425	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-117.2	153.5	176.8	-74.7	-106.8	0	0	0	110.5	T91 R114 F115 I117 W126 V144 A145 P146	T91-F93 HydrophobicContact CG2-CD2 4.4Å; T91-F93 HydrophobicContact CG2-CE2 3.81Å; T91-F93 HydrophobicContact CG2-CZ 4.37Å; F93-R114 CarbonylContact O-C 3.58Å; F93-R114 WeakPolarHBondContact O-CA 3.24Å; F93-F115 HydrophobicContact CB-CB 4.47Å; F93-F115 PolarHBondContact N-O 3.43Å; F93-F115 PolarHBondContact O-N 2.91Å; F93-I117 HydrophobicContact CB-CD1 4.38Å; F93-I117 HydrophobicContact CB-CG1 4.42Å; F93-I117 HydrophobicContact CD1-CG1 4.46Å; F93-I117 HydrophobicContact CD2-CB 4.5Å; F93-I117 HydrophobicContact CD2-CD1 4.21Å; F93-I117 HydrophobicContact CD2-CG1 3.37Å; F93-I117 HydrophobicContact CE2-CB 4.47Å; F93-I117 HydrophobicContact CE2-CG1 3.6Å; F93-I117 HydrophobicContact CG-CD1 4.2Å; F93-I117 HydrophobicContact CG-CG1 3.84Å; F93-I117 HydrophobicContact CZ-CG1 4.25Å; F93-W126 HydrophobicContact CD1-CZ3 4.14Å; F93-W126 HydrophobicContact CE1-CH2 4.24Å; F93-W126 AromaticContact CE1-CZ3 3.64Å; F93-W126 HydrophobicContact CE1-CZ3 3.64Å; F93-W126 HydrophobicContact CZ-CZ3 4.15Å; F93-V144 HydrophobicContact CB-CB 4.26Å; F93-V144 HydrophobicContact CD1-CB 4.27Å; F93-V144 HydrophobicContact CD1-CG2 4Å; F93-A145 CarbonylContact C-O 3.49Å; F93-A145 VanDerWaalsContact CA-O 3.25Å; F93-A145 WeakPolarHBondContact CA-O 3.45Å; F93-A145 VanDerWaalsContact CD1-C 3.43Å; F93-P146 HydrophobicContact CD1-CG 4.28Å; F93-P146 HydrophobicContact CE1-CB 4.48Å; F93-P146 HydrophobicContact CE1-CG 3.72Å; F93-P146 HydrophobicContact CZ-CG 4.02Å
94	V	94.8	Very high	74.9	Confident	22 Å²	22	79.8 Å²	79.8	13%	0.133	44%	0.435	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-121.8	139	175.6	62.2	0	0	0	0	110.3	L96 E113 V144 A145 V147 A152	V94-L96 HydrophobicContact CG1-CD2 4.49Å; V94-L96 PolarHBondContact O-N 2.72Å; V94-E113 CarbonylContact C-O 3.52Å; V94-E113 WeakPolarHBondContact CA-O 3.31Å; V94-V144 VanDerWaalsContact O-CA 3.26Å; V94-V144 WeakPolarHBondContact O-CA 3.34Å; V94-A145 PolarHBondContact N-O 3.43Å; V94-A145 PolarHBondContact O-N 2.98Å; V94-V147 HydrophobicContact CB-CG2 4.18Å; V94-A152 HydrophobicContact CG1-CB 3.84Å
95	A	93.9	Very high	77.8	Confident	2 Å²	2	73.2 Å²	73.2	2%	0.017	41%	0.409	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-68.6	125.6	171.5	0	0	0	0	0	111.1	F109 R110 G112 E113 F115	A95-F109 HydrophobicContact CB-CD2 3.51Å; A95-F109 HydrophobicContact CB-CE2 3.72Å; A95-R110 WeakPolarHBondContact CB-O 3.06Å; A95-G112 PolarHBondContact O-N 3.15Å; A95-E113 HydrophobicContact CB-CB 4.43Å; A95-E113 PolarHBondContact N-O 3.47Å; A95-F115 HydrophobicContact CB-CE2 3.8Å; A95-F115 HydrophobicContact CB-CZ 4.48Å
96	L	90.4	Very high	80.6	Confident	20 Å²	20	67.9 Å²	67.9	11%	0.105	37%	0.373	C	S	.	.	S	Bend	trans	-85.1	-22.8	175.3	-54.5	-178.6	0	0	0	112.1	V94 K111 Y143 A145	V94-L96 HydrophobicContact CG1-CD2 4.49Å; V94-L96 PolarHBondContact O-N 2.72Å; L96-K111 VanDerWaalsContact O-CD 3.28Å; L96-K111 WeakPolarHBondContact O-CD 3.24Å; L96-K111 VanDerWaalsContact O-CE 3.27Å; L96-K111 WeakPolarHBondContact O-CE 3.31Å; L96-K111 WeakPolarHBondContact O-CG 3.25Å; L96-Y143 WeakPolarHBondContact CB-O 3.47Å; L96-Y143 PolarHBondContact N-O 3.42Å; L96-A145 HydrophobicContact CD1-CB 4.12Å; L96-A145 HydrophobicContact CD2-CB 3.97Å; L96-A145 HydrophobicContact CG-CB 4.33Å
97	Y	90.9	Very high	83.5	Confident	37 Å²	37	57.1 Å²	57.1	15%	0.145	33%	0.334	C	S	.	.	S	Bend	trans	-141.2	164.3	-176	-47.3	-82.6	0	0	0	110.8	F109 Y143 K254 P257	Y97-F109 WeakPolarHBondContact O-CE2 3.26Å; Y97-Y143 HydrophobicContact CD2-CD1 4.19Å; Y97-Y143 HydrophobicContact CD2-CG 4.18Å; Y97-Y143 HydrophobicContact CG-CD1 4.45Å; Y97-K254 HydrophobicContact CE1-CB 4.09Å; Y97-P257 VanDerWaalsContact CD2-CD 3.44Å; Y97-P257 HydrophobicContact CD2-CG 3.68Å; Y97-P257 HydrophobicContact CE2-CG 3.36Å; Y97-P257 HydrophobicContact CG-CG 4.45Å
98	D	92	Very high	86.3	Confident	59 Å²	59	55.6 Å²	55.6	32%	0.316	32%	0.323	S	S	.	.			trans	-72.4	143.5	165.1	-74.6	12.1	0	0	0	109.6	R110 K111 Y143 M256	D98-R110 WeakPolarHBondContact OD1-CA 3.38Å; D98-R110 WeakPolarHBondContact OD2-CD 3.26Å; D98-R110 IonicContact OD2-CZ 3.01Å; D98-R110 IonicContact OD2-NH1 3.77Å; D98-R110 PolarHBondContact OD2-NH1 3.17Å; D98-K111 WeakPolarHBondContact OD1-CB 3.44Å; D98-K111 PolarHBondContact OD1-N 2.99Å; D98-Y143 WeakPolarHBondContact O-CE1 3.41Å; D98-M256 VanDerWaalsContact O-CE 3.23Å; D98-M256 WeakPolarHBondContact O-CE 3.44Å
99	Y	92.5	Very high	88.7	Confident	9 Å²	9	51.8 Å²	51.8	4%	0.035	29%	0.291	C	S	.	.	B	Isolated β-bridge	trans	-137.7	129.7	174.3	179.9	-106	0	0	0	110.3	D106 L107 S108 F109 W125 P140 Y143 L259	Y99-D106 HydrophobicContact CE1-CB 4.14Å; Y99-D106 PolarHBondContact OH-OD2 3.11Å; Y99-L107 VanDerWaalsContact CD1-O 3.32Å; Y99-L107 WeakPolarHBondContact CD1-O 3.45Å; Y99-S108 CarbonylContact O-C 3.53Å; Y99-S108 WeakPolarHBondContact O-CA 3.47Å; Y99-F109 VanDerWaalsContact CB-CE1 3.45Å; Y99-F109 VanDerWaalsContact CB-CE2 3.48Å; Y99-F109 HydrophobicContact CD1-CD1 4.02Å; Y99-F109 AromaticContact CD1-CE1 3.54Å; Y99-F109 HydrophobicContact CD1-CE1 3.54Å; Y99-F109 HydrophobicContact CD1-CZ 4.13Å; Y99-F109 HydrophobicContact CG-CD1 4.4Å; Y99-F109 AromaticContact CG-CE1 3.74Å; Y99-F109 HydrophobicContact CG-CE1 3.74Å; Y99-F109 AromaticContact CG-CZ 3.84Å; Y99-F109 HydrophobicContact CG-CZ 3.84Å; Y99-F109 PolarHBondContact N-O 2.99Å; Y99-F109 PolarHBondContact O-N 2.94Å; Y99-W125 VanDerWaalsContact OH-CH2 3.23Å; Y99-W125 WeakPolarHBondContact OH-CH2 3.4Å; Y99-W125 WeakPolarHBondContact OH-CZ3 3.43Å; Y99-P140 HydrophobicContact CD2-CG 3.85Å; Y99-P140 HydrophobicContact CE1-CG 4.42Å; Y99-P140 HydrophobicContact CE2-CG 3.67Å; Y99-P140 HydrophobicContact CG-CG 4.34Å; Y99-Y143 HydrophobicContact CD2-CD1 4.27Å; Y99-Y143 AromaticContact CD2-CE1 3.94Å; Y99-Y143 HydrophobicContact CD2-CE1 3.94Å; Y99-Y143 HydrophobicContact CG-CD1 4.48Å; Y99-Y143 HydrophobicContact CG-CE1 4.5Å; Y99-L259 HydrophobicContact CE2-CD1 3.84Å
100	E	91.6	Very high	90.7	Very high	155 Å²	155	56 Å²	56	72%	0.724	29%	0.285	S	S	*	.			trans	-104.4	125.2	172.8	-65.5	-177.5	175.2	0	0	108.5	R102	E100-R102 PolarHBondContact O-N 3.01Å
101	A	91.1	Very high	91.8	Very high	30 Å²	30	57.5 Å²	57.5	25%	0.248	29%	0.285	C	S	.	.			trans	-51.9	129.9	176.9	0	0	0	0	0	111.1	D106 S108	A101-D106 HydrophobicContact CB-CB 3.66Å; A101-S108 WeakPolarHBondContact CB-OG 2.88Å; A101-S108 PolarHBondContact N-OG 3.29Å
102	R	88.8	Confident	92.3	Very high	45 Å²	45	55.1 Å²	55.1	17%	0.17	28%	0.279	C	S	.	.	S	Bend	trans	-99	-20.5	179.6	-59.6	171.5	175.7	-171.7	-0.2	112.2	E100 D106 L259 L262 W296 T300	E100-R102 PolarHBondContact O-N 3.01Å; R102-D106 WeakPolarHBondContact CB-OD2 3.35Å; R102-D106 PolarHBondContact N-OD2 3.1Å; R102-L259 VanDerWaalsContact NH2-CD1 3.3Å; R102-L262 WeakPolarHBondContact CD-O 3.31Å; R102-L262 PolarHBondContact NH1-O 2.88Å; R102-W296 HydrophobicContact CB-CZ3 3.98Å; R102-T300 WeakPolarHBondContact CD-OG1 3.43Å
103	T	87.9	Confident	92.4	Very high	24 Å²	24	53.3 Å²	53.3	15%	0.147	27%	0.269	C	S	.	.	S	Bend	trans	-132.1	169	176	82.2	0	0	0	0	110	D105 D106 W296	T103-D105 PolarHBondContact O-N 3.18Å; T103-D105 PolarHBondContact OG1-N 3.49Å; T103-D106 PolarHBondContact N-OD2 2.9Å; T103-D106 PolarHBondContact O-N 2.89Å; T103-D106 PolarHBondContact OG1-OD1 3.13Å; T103-W296 HydrophobicContact CG2-CH2 3.68Å; T103-W296 HydrophobicContact CG2-CZ3 4.33Å
104	E	88.4	Confident	92.5	Very high	204 Å²	204	58.3 Å²	58.3	95%	0.953	29%	0.287	S	S	*	.	T	Hydrogen-bonded Turn	trans	-68.2	-20.8	176.6	-61.5	-179.4	176.5	0	0	113.1
105	D	90.6	Very high	92.5	Very high	57 Å²	57	57.2 Å²	57.2	31%	0.305	28%	0.281	S	S	.	.	T	Hydrogen-bonded Turn	trans	-86	-12.7	179	-46.8	-76	0	0	0	112.5	T103 G137 Y138 K265	T103-D105 PolarHBondContact O-N 3.18Å; T103-D105 PolarHBondContact OG1-N 3.49Å; D105-G137 WeakPolarHBondContact O-CA 3.27Å; D105-Y138 HydrophobicContact CB-CD2 3.95Å; D105-Y138 HydrophobicContact CB-CE2 4.39Å; D105-Y138 PolarHBondContact O-N 2.82Å; D105-K265 IonicContact OD1-NZ 3.52Å; D105-K265 PolarHBondContact OD1-NZ 3.42Å; D105-K265 WeakPolarHBondContact OD2-CE 3.32Å; D105-K265 IonicContact OD2-NZ 2.77Å; D105-K265 PolarHBondContact OD2-NZ 3.49Å
106	D	92.3	Very high	92.6	Very high	13 Å²	13	60.1 Å²	60.1	7%	0.07	29%	0.294	C	S	.	.	B	Isolated β-bridge	trans	-82	148	-178.4	-64.6	10.7	0	0	0	111	Y99 A101 R102 T103 Y138	Y99-D106 HydrophobicContact CE1-CB 4.14Å; Y99-D106 PolarHBondContact OH-OD2 3.11Å; A101-D106 HydrophobicContact CB-CB 3.66Å; R102-D106 WeakPolarHBondContact CB-OD2 3.35Å; R102-D106 PolarHBondContact N-OD2 3.1Å; T103-D106 PolarHBondContact N-OD2 2.9Å; T103-D106 PolarHBondContact O-N 2.89Å; T103-D106 PolarHBondContact OG1-OD1 3.13Å; D106-Y138 WeakPolarHBondContact CA-O 3.46Å
107	L	94.2	Very high	92.7	Very high	19 Å²	19	60.7 Å²	60.7	10%	0.099	30%	0.297	C	S	.	.	P	Polyproline II helix	trans	-102.3	117.1	173.4	-178.7	64.6	0	0	0	110.6	Y99 F109 F115 Y138 I139	Y99-L107 VanDerWaalsContact CD1-O 3.32Å; Y99-L107 WeakPolarHBondContact CD1-O 3.45Å; L107-F109 WeakPolarHBondContact O-CD1 3.34Å; L107-F115 HydrophobicContact CD2-CD1 4.29Å; L107-F115 HydrophobicContact CD2-CE1 3.98Å; L107-Y138 PolarHBondContact N-O 2.86Å; L107-I139 HydrophobicContact CB-CG2 3.9Å; L107-I139 HydrophobicContact CD2-CG2 4.25Å; L107-I139 HydrophobicContact CG-CG2 4.45Å
108	S	95.1	Very high	92.7	Very high	63 Å²	63	63 Å²	63	44%	0.441	31%	0.311	S	S	.	.	P	Polyproline II helix	trans	-69.9	143.8	170.5	-65.9	0	0	0	0	111.6	Y99 A101	Y99-S108 CarbonylContact O-C 3.53Å; Y99-S108 WeakPolarHBondContact O-CA 3.47Å; A101-S108 WeakPolarHBondContact CB-OG 2.88Å; A101-S108 PolarHBondContact N-OG 3.29Å
109	F	95.2	Very high	92.5	Very high	8 Å²	8	63.1 Å²	63.1	4%	0.035	31%	0.312	C	S	.	.	B	Isolated β-bridge	trans	-154.8	163.5	177.3	54.7	-96.7	0	0	0	114.5	A95 Y97 Y99 L107 E113 F115 I139 Y143	A95-F109 HydrophobicContact CB-CD2 3.51Å; A95-F109 HydrophobicContact CB-CE2 3.72Å; Y97-F109 WeakPolarHBondContact O-CE2 3.26Å; Y99-F109 VanDerWaalsContact CB-CE1 3.45Å; Y99-F109 VanDerWaalsContact CB-CE2 3.48Å; Y99-F109 HydrophobicContact CD1-CD1 4.02Å; Y99-F109 AromaticContact CD1-CE1 3.54Å; Y99-F109 HydrophobicContact CD1-CE1 3.54Å; Y99-F109 HydrophobicContact CD1-CZ 4.13Å; Y99-F109 HydrophobicContact CG-CD1 4.4Å; Y99-F109 AromaticContact CG-CE1 3.74Å; Y99-F109 HydrophobicContact CG-CE1 3.74Å; Y99-F109 AromaticContact CG-CZ 3.84Å; Y99-F109 HydrophobicContact CG-CZ 3.84Å; Y99-F109 PolarHBondContact N-O 2.99Å; Y99-F109 PolarHBondContact O-N 2.94Å; L107-F109 WeakPolarHBondContact O-CD1 3.34Å; F109-E113 WeakPolarHBondContact CA-OE2 3.36Å; F109-E113 HydrophobicContact CB-CB 4.47Å; F109-E113 VanDerWaalsContact CB-OE2 3.28Å; F109-E113 WeakPolarHBondContact CB-OE2 3.36Å; F109-F115 HydrophobicContact CB-CE1 4.13Å; F109-F115 HydrophobicContact CB-CZ 3.49Å; F109-F115 VanDerWaalsContact CB-CZ 3.49Å; F109-F115 HydrophobicContact CD1-CE1 4.29Å; F109-F115 AromaticContact CD1-CZ 3.92Å; F109-F115 HydrophobicContact CD1-CZ 3.92Å; F109-F115 HydrophobicContact CD2-CE2 4.49Å; F109-F115 HydrophobicContact CD2-CZ 4.12Å; F109-F115 HydrophobicContact CG-CE1 4.33Å; F109-F115 HydrophobicContact CG-CE2 4.38Å; F109-F115 AromaticContact CG-CZ 3.6Å; F109-F115 HydrophobicContact CG-CZ 3.6Å; F109-I139 HydrophobicContact CD1-CB 4.49Å; F109-I139 HydrophobicContact CD1-CG2 3.79Å; F109-I139 HydrophobicContact CE1-CB 3.72Å; F109-I139 HydrophobicContact CE1-CG2 3.5Å; F109-I139 VanDerWaalsContact CE1-CG2 3.5Å; F109-I139 HydrophobicContact CZ-CB 4.43Å; F109-Y143 HydrophobicContact CE2-CD1 4.19Å; F109-Y143 HydrophobicContact CZ-CD1 4.09Å; F109-Y143 HydrophobicContact CZ-CG 4.36Å
110	R	95.3	Very high	92.2	Very high	159 Å²	159	66.1 Å²	66.1	60%	0.6	33%	0.334	S	S	*	.			trans	-104.5	152.4	174.4	-65.2	-70.3	-175.9	178.1	-4.7	111.6	A95 D98 G112 E113	A95-R110 WeakPolarHBondContact CB-O 3.06Å; D98-R110 WeakPolarHBondContact OD1-CA 3.38Å; D98-R110 WeakPolarHBondContact OD2-CD 3.26Å; D98-R110 IonicContact OD2-CZ 3.01Å; D98-R110 IonicContact OD2-NH1 3.77Å; D98-R110 PolarHBondContact OD2-NH1 3.17Å; R110-G112 PolarHBondContact O-N 3.37Å; R110-E113 PolarHBondContact N-OE2 3Å; R110-E113 VanDerWaalsContact N-OE2 3.09Å; R110-E113 WeakPolarHBondContact O-CB 3.43Å; R110-E113 PolarHBondContact O-N 3.46Å
111	K	92.9	Very high	91.8	Very high	104 Å²	104	64 Å²	64	45%	0.452	33%	0.332	S	S	.	.	T	Hydrogen-bonded Turn	trans	-51.7	134	170.9	-178.7	176	-176.6	-178.2	0	110.1	L96 D98 E113 D154	L96-K111 VanDerWaalsContact O-CD 3.28Å; L96-K111 WeakPolarHBondContact O-CD 3.24Å; L96-K111 VanDerWaalsContact O-CE 3.27Å; L96-K111 WeakPolarHBondContact O-CE 3.31Å; L96-K111 WeakPolarHBondContact O-CG 3.25Å; D98-K111 WeakPolarHBondContact OD1-CB 3.44Å; D98-K111 PolarHBondContact OD1-N 2.99Å; K111-E113 VanDerWaalsContact C-N 3.32Å; K111-D154 IonicContact NZ-OD1 2.64Å; K111-D154 PolarHBondContact NZ-OD1 3.37Å; K111-D154 IonicContact NZ-OD2 3.38Å; K111-D154 PolarHBondContact NZ-OD2 3.32Å
112	G	92.6	Very high	90.7	Very high	44 Å²	44	65.6 Å²	65.6	45%	0.454	33%	0.334	S	S	.	.	T	Hydrogen-bonded Turn	trans	87.9	-9.7	-178.4	0	0	0	0	0	114.8	A95 R110	A95-G112 PolarHBondContact O-N 3.15Å; R110-G112 PolarHBondContact O-N 3.37Å
113	E	95.7	Very high	90.2	Very high	21 Å²	21	65 Å²	65	10%	0.098	34%	0.342	C	S	.	.			trans	-63.6	147.3	174.1	-169.8	164.3	176.7	0	0	111.4	V94 A95 F109 R110 K111 F115 S130	V94-E113 CarbonylContact C-O 3.52Å; V94-E113 WeakPolarHBondContact CA-O 3.31Å; A95-E113 HydrophobicContact CB-CB 4.43Å; A95-E113 PolarHBondContact N-O 3.47Å; F109-E113 WeakPolarHBondContact CA-OE2 3.36Å; F109-E113 HydrophobicContact CB-CB 4.47Å; F109-E113 VanDerWaalsContact CB-OE2 3.28Å; F109-E113 WeakPolarHBondContact CB-OE2 3.36Å; R110-E113 PolarHBondContact N-OE2 3Å; R110-E113 VanDerWaalsContact N-OE2 3.09Å; R110-E113 WeakPolarHBondContact O-CB 3.43Å; R110-E113 PolarHBondContact O-N 3.46Å; K111-E113 VanDerWaalsContact C-N 3.32Å; E113-F115 HydrophobicContact CB-CE2 4.08Å; E113-F115 HydrophobicContact CB-CZ 3.96Å; E113-F115 HydrophobicContact CG-CE1 4.36Å; E113-F115 HydrophobicContact CG-CE2 4.21Å; E113-F115 HydrophobicContact CG-CZ 3.77Å; E113-F115 VanDerWaalsContact O-CE2 3.3Å; E113-F115 WeakPolarHBondContact O-CE2 3.47Å; E113-S130 WeakPolarHBondContact OE1-CB 3.44Å; E113-S130 PolarHBondContact OE1-OG 3.37Å
114	R	96.1	Very high	90	Very high	129 Å²	129	66.7 Å²	66.7	49%	0.487	35%	0.35	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-111.9	143.4	-174.7	-65.4	-178.3	-178.4	-179	-2	112.2	F93 L131	F93-R114 CarbonylContact O-C 3.58Å; F93-R114 WeakPolarHBondContact O-CA 3.24Å; R114-L131 HydrophobicContact CB-CD1 4.18Å; R114-L131 WeakPolarHBondContact O-CB 3.31Å; R114-L131 PolarHBondContact O-N 2.69Å
115	F	95.5	Very high	90	Very high	0 Å²	0	57.1 Å²	57.1	0%	0	31%	0.305	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-129.6	147.5	-174.5	-55.1	-87.3	0	0	0	112.3	F93 A95 L107 F109 E113 I117 A128 R129 I139 V144	F93-F115 HydrophobicContact CB-CB 4.47Å; F93-F115 PolarHBondContact N-O 3.43Å; F93-F115 PolarHBondContact O-N 2.91Å; A95-F115 HydrophobicContact CB-CE2 3.8Å; A95-F115 HydrophobicContact CB-CZ 4.48Å; L107-F115 HydrophobicContact CD2-CD1 4.29Å; L107-F115 HydrophobicContact CD2-CE1 3.98Å; F109-F115 HydrophobicContact CB-CE1 4.13Å; F109-F115 HydrophobicContact CB-CZ 3.49Å; F109-F115 VanDerWaalsContact CB-CZ 3.49Å; F109-F115 HydrophobicContact CD1-CE1 4.29Å; F109-F115 AromaticContact CD1-CZ 3.92Å; F109-F115 HydrophobicContact CD1-CZ 3.92Å; F109-F115 HydrophobicContact CD2-CE2 4.49Å; F109-F115 HydrophobicContact CD2-CZ 4.12Å; F109-F115 HydrophobicContact CG-CE1 4.33Å; F109-F115 HydrophobicContact CG-CE2 4.38Å; F109-F115 AromaticContact CG-CZ 3.6Å; F109-F115 HydrophobicContact CG-CZ 3.6Å; E113-F115 HydrophobicContact CB-CE2 4.08Å; E113-F115 HydrophobicContact CB-CZ 3.96Å; E113-F115 HydrophobicContact CG-CE1 4.36Å; E113-F115 HydrophobicContact CG-CE2 4.21Å; E113-F115 HydrophobicContact CG-CZ 3.77Å; E113-F115 VanDerWaalsContact O-CE2 3.3Å; E113-F115 WeakPolarHBondContact O-CE2 3.47Å; F115-I117 HydrophobicContact CB-CD1 4.44Å; F115-A128 HydrophobicContact CB-CB 4.27Å; F115-A128 HydrophobicContact CD1-CB 4.21Å; F115-R129 WeakPolarHBondContact CA-O 3.42Å; F115-I139 HydrophobicContact CD1-CD1 4.4Å; F115-I139 HydrophobicContact CG-CD1 4.24Å; F115-V144 HydrophobicContact CD2-CG1 4.14Å; F115-V144 HydrophobicContact CE2-CG1 4.32Å
116	Q	94.8	Very high	90.1	Very high	63 Å²	63	55.3 Å²	55.3	29%	0.294	29%	0.294	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-96.3	123.6	154.9	176	174.5	21.3	0	0	108.1	V90 L118 A128 R129 L131	V90-Q116 HydrophobicContact CG1-CG 3.72Å; Q116-L118 HydrophobicContact CG-CD2 4.3Å; Q116-L118 PolarHBondContact O-N 2.89Å; Q116-A128 WeakPolarHBondContact O-CA 2.93Å; Q116-R129 PolarHBondContact N-O 2.83Å; Q116-R129 PolarHBondContact O-N 3.32Å; Q116-L131 HydrophobicContact CB-CD2 4.36Å
117	I	93.6	Very high	90.2	Very high	32 Å²	32	56.8 Å²	56.8	16%	0.164	30%	0.302	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-79	120	173.3	-54	-57	0	0	0	108.3	F93 F115 W126 A128 I139	F93-I117 HydrophobicContact CB-CD1 4.38Å; F93-I117 HydrophobicContact CB-CG1 4.42Å; F93-I117 HydrophobicContact CD1-CG1 4.46Å; F93-I117 HydrophobicContact CD2-CB 4.5Å; F93-I117 HydrophobicContact CD2-CD1 4.21Å; F93-I117 HydrophobicContact CD2-CG1 3.37Å; F93-I117 HydrophobicContact CE2-CB 4.47Å; F93-I117 HydrophobicContact CE2-CG1 3.6Å; F93-I117 HydrophobicContact CG-CD1 4.2Å; F93-I117 HydrophobicContact CG-CG1 3.84Å; F93-I117 HydrophobicContact CZ-CG1 4.25Å; F115-I117 HydrophobicContact CB-CD1 4.44Å; I117-W126 HydrophobicContact CD1-CE3 3.97Å; I117-W126 HydrophobicContact CG1-CE3 4.23Å; I117-W126 HydrophobicContact CG2-CB 4.24Å; I117-W126 HydrophobicContact CG2-CE3 4.42Å; I117-A128 HydrophobicContact CD1-CB 3.88Å; I117-I139 HydrophobicContact CD1-CD1 3.98Å
118	L	91.1	Very high	90.2	Very high	85 Å²	85	55.9 Å²	55.9	45%	0.445	30%	0.297	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-86.3	-42.5	178.9	-58.3	-179.7	0	0	0	110.4	Q116 D127 R129	Q116-L118 HydrophobicContact CG-CD2 4.3Å; Q116-L118 PolarHBondContact O-N 2.89Å; L118-D127 HydrophobicContact CB-CB 4.42Å; L118-D127 PolarHBondContact N-O 3.48Å; L118-R129 HydrophobicContact CD1-CB 4.18Å; L118-R129 HydrophobicContact CD2-CB 4.32Å; L118-R129 HydrophobicContact CG-CB 4.29Å
119	N	87.9	Confident	90.2	Very high	62 Å²	62	58.6 Å²	58.6	33%	0.332	30%	0.298	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-144.7	128.3	176.1	-170.8	2.2	0	0	0	111.5	T121 W126 D127	N119-T121 PolarHBondContact ND2-OG1 2.67Å; N119-T121 VanDerWaalsContact ND2-OG1 3.16Å; N119-T121 WeakPolarHBondContact OD1-CB 3.34Å; N119-T121 VanDerWaalsContact OD1-CG2 3.31Å; N119-T121 WeakPolarHBondContact OD1-CG2 3.22Å; N119-T121 PolarHBondContact OD1-N 3.33Å; N119-T121 PolarHBondContact OD1-OG1 3.06Å; N119-W126 CarbonylContact O-C 3.54Å; N119-W126 WeakPolarHBondContact O-CA 3.19Å; N119-W126 WeakPolarHBondContact O-CB 3.45Å; N119-D127 HydrophobicContact CB-CB 3.99Å; N119-D127 PolarHBondContact N-O 3.25Å; N119-D127 VanDerWaalsContact N-O 3.11Å; N119-D127 PolarHBondContact O-N 3.2Å
120	S	85.8	Confident	90.3	Very high	72 Å²	72	58.2 Å²	58.2	50%	0.503	30%	0.297	S	S	.	.			trans	-116.4	14	176.8	70.3	0	0	0	0	113.5	E122	S120-E122 PolarHBondContact O-N 2.85Å
121	T	82.4	Confident	90.3	Very high	109 Å²	109	55 Å²	55	67%	0.669	29%	0.291	S	S	*	.	T	Hydrogen-bonded Turn	trans	-71.2	-21.3	-178.3	58.2	0	0	0	0	112.7	N119 G123	N119-T121 PolarHBondContact ND2-OG1 2.67Å; N119-T121 VanDerWaalsContact ND2-OG1 3.16Å; N119-T121 WeakPolarHBondContact OD1-CB 3.34Å; N119-T121 VanDerWaalsContact OD1-CG2 3.31Å; N119-T121 WeakPolarHBondContact OD1-CG2 3.22Å; N119-T121 PolarHBondContact OD1-N 3.33Å; N119-T121 PolarHBondContact OD1-OG1 3.06Å; T121-G123 VanDerWaalsContact C-N 3.29Å; T121-G123 PolarHBondContact O-N 3.07Å; T121-G123 VanDerWaalsContact O-N 3.16Å
122	E	69.1	Low	90.3	Very high	64 Å²	64	55.1 Å²	55.1	30%	0.299	30%	0.3	S	S	.	.	T	Hydrogen-bonded Turn	trans	-88.4	35.5	-170.9	-64.2	-160.8	-171.7	0	0	115.2	S120 D124 W125 V264 K267	S120-E122 PolarHBondContact O-N 2.85Å; E122-D124 PolarHBondContact O-N 3.33Å; E122-W125 CarbonylContact C-O 3.56Å; E122-W125 VanDerWaalsContact CB-O 3.27Å; E122-W125 WeakPolarHBondContact CB-O 3.4Å; E122-W125 PolarHBondContact O-N 3.34Å; E122-V264 WeakPolarHBondContact OE2-CG2 3.5Å; E122-K267 PolarHBondContact O-NZ 3.28Å
123	G	77.4	Confident	90.3	Very high	32 Å²	32	57.6 Å²	57.6	33%	0.33	31%	0.307	S	S	.	.	T	Hydrogen-bonded Turn	trans	60.2	-106.6	169.5	0	0	0	0	0	113.3	T121 W126 S141	T121-G123 VanDerWaalsContact C-N 3.29Å; T121-G123 PolarHBondContact O-N 3.07Å; T121-G123 VanDerWaalsContact O-N 3.16Å; G123-W126 PolarHBondContact O-NE1 3.02Å; G123-S141 PolarHBondContact O-OG 3.33Å
124	D	84.3	Confident	90.2	Very high	61 Å²	61	58.3 Å²	58.3	33%	0.326	32%	0.32	S	S	.	.	T	Hydrogen-bonded Turn	trans	-78.6	-13.8	-174.9	-63.1	-29	0	0	0	114.1	E122 S141 R328	E122-D124 PolarHBondContact O-N 3.33Å; D124-S141 WeakPolarHBondContact CA-OG 3.34Å; D124-S141 PolarHBondContact O-N 3.35Å; D124-S141 PolarHBondContact O-OG 3.4Å; D124-R328 IonicContact OD2-NH1 3.43Å; D124-R328 PolarHBondContact OD2-NH1 3.4Å
125	W	88.6	Confident	90.1	Very high	3 Å²	3	53.5 Å²	53.5	1%	0.011	31%	0.311	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-124.8	131.5	178.6	-67.2	88.1	0	0	0	110.4	Y99 E122 Y138 I139 P140 L259 V264	Y99-W125 VanDerWaalsContact OH-CH2 3.23Å; Y99-W125 WeakPolarHBondContact OH-CH2 3.4Å; Y99-W125 WeakPolarHBondContact OH-CZ3 3.43Å; E122-W125 CarbonylContact C-O 3.56Å; E122-W125 VanDerWaalsContact CB-O 3.27Å; E122-W125 WeakPolarHBondContact CB-O 3.4Å; E122-W125 PolarHBondContact O-N 3.34Å; W125-Y138 HydrophobicContact CB-CD1 4.5Å; W125-I139 WeakPolarHBondContact CA-O 3.35Å; W125-P140 HydrophobicContact CE3-CG 4.31Å; W125-P140 HydrophobicContact CH2-CG 4.08Å; W125-P140 HydrophobicContact CZ3-CG 3.82Å; W125-L259 HydrophobicContact CH2-CD1 3.67Å; W125-L259 HydrophobicContact CZ2-CD1 3.76Å; W125-V264 HydrophobicContact CB-CB 4.05Å; W125-V264 HydrophobicContact CB-CG2 4.05Å; W125-V264 HydrophobicContact CD2-CB 4.42Å; W125-V264 HydrophobicContact CG-CB 4.02Å; W125-V264 HydrophobicContact CG-CG2 4.46Å
126	W	92.4	Very high	90.1	Very high	18 Å²	18	56.8 Å²	56.8	7%	0.068	33%	0.334	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-121.2	139.9	-179.1	-64.5	-13.7	0	0	0	110.6	F64 F93 I117 N119 G123 Y138 I139 S141 V144	F64-W126 HydrophobicContact CE2-CH2 4.21Å; F93-W126 HydrophobicContact CD1-CZ3 4.14Å; F93-W126 HydrophobicContact CE1-CH2 4.24Å; F93-W126 AromaticContact CE1-CZ3 3.64Å; F93-W126 HydrophobicContact CE1-CZ3 3.64Å; F93-W126 HydrophobicContact CZ-CZ3 4.15Å; I117-W126 HydrophobicContact CD1-CE3 3.97Å; I117-W126 HydrophobicContact CG1-CE3 4.23Å; I117-W126 HydrophobicContact CG2-CB 4.24Å; I117-W126 HydrophobicContact CG2-CE3 4.42Å; N119-W126 CarbonylContact O-C 3.54Å; N119-W126 WeakPolarHBondContact O-CA 3.19Å; N119-W126 WeakPolarHBondContact O-CB 3.45Å; G123-W126 PolarHBondContact O-NE1 3.02Å; W126-Y138 CarbonylContact O-C 3.56Å; W126-Y138 WeakPolarHBondContact O-CA 3.4Å; W126-I139 HydrophobicContact CB-CG1 4.44Å; W126-I139 PolarHBondContact N-O 2.95Å; W126-I139 WeakPolarHBondContact O-CG1 3.43Å; W126-I139 PolarHBondContact O-N 3.02Å; W126-S141 VanDerWaalsContact CD2-CB 3.42Å; W126-V144 HydrophobicContact CE3-CG2 4.07Å; W126-V144 HydrophobicContact CZ3-CG2 3.96Å
127	D	93.6	Very high	90	Very high	44 Å²	44	54.3 Å²	54.3	24%	0.235	32%	0.324	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-78.2	124.5	170.4	-177.4	9.1	0	0	0	108.6	L118 N119 Y138	L118-D127 HydrophobicContact CB-CB 4.42Å; L118-D127 PolarHBondContact N-O 3.48Å; N119-D127 HydrophobicContact CB-CB 3.99Å; N119-D127 PolarHBondContact N-O 3.25Å; N119-D127 VanDerWaalsContact N-O 3.11Å; N119-D127 PolarHBondContact O-N 3.2Å; D127-Y138 HydrophobicContact CB-CD1 4.34Å; D127-Y138 HydrophobicContact CB-CE1 4.13Å
128	A	94.9	Very high	90	Very high	0 Å²	0	55.5 Å²	55.5	0%	0	33%	0.327	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-137.9	152.2	-173.8	0	0	0	0	0	111.7	F115 Q116 I117 S136 G137 I139	F115-A128 HydrophobicContact CB-CB 4.27Å; F115-A128 HydrophobicContact CD1-CB 4.21Å; Q116-A128 WeakPolarHBondContact O-CA 2.93Å; I117-A128 HydrophobicContact CD1-CB 3.88Å; A128-S136 VanDerWaalsContact O-CA 3.24Å; A128-S136 WeakPolarHBondContact O-CA 3.38Å; A128-G137 PolarHBondContact N-O 2.83Å; A128-G137 PolarHBondContact O-N 3.21Å; A128-I139 HydrophobicContact CB-CD1 3.43Å; A128-I139 VanDerWaalsContact CB-CD1 3.43Å; A128-I139 HydrophobicContact CB-CG1 3.66Å; A128-I139 HydrophobicContact CB-CG2 4.22Å
129	R	96.1	Very high	90.2	Very high	120 Å²	120	51.5 Å²	51.5	45%	0.453	31%	0.306	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-111.6	123.4	170.6	-172.1	176	-174	-169.5	0.2	110	F115 Q116 L118 L131 G134 G135 S136	F115-R129 WeakPolarHBondContact CA-O 3.42Å; Q116-R129 PolarHBondContact N-O 2.83Å; Q116-R129 PolarHBondContact O-N 3.32Å; L118-R129 HydrophobicContact CD1-CB 4.18Å; L118-R129 HydrophobicContact CD2-CB 4.32Å; L118-R129 HydrophobicContact CG-CB 4.29Å; R129-L131 PolarHBondContact O-N 3.18Å; R129-G134 PolarHBondContact NE-O 2.77Å; R129-G135 CarbonylContact C-O 3.55Å; R129-G135 WeakPolarHBondContact CA-O 3.47Å; R129-S136 WeakPolarHBondContact CG-OG 3.39Å
130	S	96.4	Very high	90.4	Very high	1 Å²	1	48.5 Å²	48.5	1%	0.007	29%	0.291	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-67.9	131	171.1	167.6	0	0	0	0	110	E113 T132 T133 G134 G135	E113-S130 WeakPolarHBondContact OE1-CB 3.44Å; E113-S130 PolarHBondContact OE1-OG 3.37Å; S130-T132 VanDerWaalsContact C-N 3.29Å; S130-T132 PolarHBondContact OG-N 3.02Å; S130-T133 VanDerWaalsContact CB-OG1 3.26Å; S130-T133 WeakPolarHBondContact CB-OG1 3.3Å; S130-T133 PolarHBondContact OG-N 3.4Å; S130-T133 PolarHBondContact OG-OG1 2.9Å; S130-G134 WeakPolarHBondContact O-CA 3.33Å; S130-G134 PolarHBondContact O-N 2.93Å; S130-G135 PolarHBondContact N-O 2.84Å
131	L	94.5	Very high	90.6	Very high	91 Å²	91	45.8 Å²	45.8	48%	0.476	27%	0.271	S	S	.	.	T	Hydrogen-bonded Turn	trans	-80.1	-14.6	172.3	-59.5	-175.7	0	0	0	112.6	L92 R114 Q116 R129	L92-L131 HydrophobicContact CD1-CD1 4.1Å; L92-L131 HydrophobicContact CD2-CD1 3.79Å; R114-L131 HydrophobicContact CB-CD1 4.18Å; R114-L131 WeakPolarHBondContact O-CB 3.31Å; R114-L131 PolarHBondContact O-N 2.69Å; Q116-L131 HydrophobicContact CB-CD2 4.36Å; R129-L131 PolarHBondContact O-N 3.18Å
132	T	93.4	Very high	90.9	Very high	106 Å²	106	43.8 Å²	43.8	65%	0.65	26%	0.257	S	S	*	.	T	Hydrogen-bonded Turn	trans	-88.9	-48.5	-179.7	-55	0	0	0	0	111.2	S130	S130-T132 VanDerWaalsContact C-N 3.29Å; S130-T132 PolarHBondContact OG-N 3.02Å
133	T	93.6	Very high	92	Very high	96 Å²	96	41 Å²	41	59%	0.589	24%	0.244	S	C	*	.	T	Hydrogen-bonded Turn	trans	-96.1	-19.3	-177.2	66.5	0	0	0	0	112.7	S130 G135	S130-T133 VanDerWaalsContact CB-OG1 3.26Å; S130-T133 WeakPolarHBondContact CB-OG1 3.3Å; S130-T133 PolarHBondContact OG-N 3.4Å; S130-T133 PolarHBondContact OG-OG1 2.9Å; T133-G135 PolarHBondContact O-N 2.9Å; T133-G135 PolarHBondContact OG1-N 3.22Å
134	G	92.9	Very high	92.7	Very high	36 Å²	36	39.8 Å²	39.8	37%	0.371	23%	0.229	S	C	.	.			trans	77.7	-8.2	-175.4	0	0	0	0	0	114.7	R129 S130	R129-G134 PolarHBondContact NE-O 2.77Å; S130-G134 WeakPolarHBondContact O-CA 3.33Å; S130-G134 PolarHBondContact O-N 2.93Å
135	G	93.4	Very high	93.1	Very high	29 Å²	29	36.9 Å²	36.9	30%	0.299	21%	0.214	S	C	.	.			trans	-73.8	158.2	178.3	0	0	0	0	0	113	R129 S130 T133	R129-G135 CarbonylContact C-O 3.55Å; R129-G135 WeakPolarHBondContact CA-O 3.47Å; S130-G135 PolarHBondContact N-O 2.84Å; T133-G135 PolarHBondContact O-N 2.9Å; T133-G135 PolarHBondContact OG1-N 3.22Å
136	S	95.1	Very high	93.3	Very high	69 Å²	69	38 Å²	38	48%	0.483	22%	0.221	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-126.3	152.4	178.4	-59.2	0	0	0	0	111.2	A128 R129	A128-S136 VanDerWaalsContact O-CA 3.24Å; A128-S136 WeakPolarHBondContact O-CA 3.38Å; R129-S136 WeakPolarHBondContact CG-OG 3.39Å
137	G	94.5	Very high	93.1	Very high	10 Å²	10	38.8 Å²	38.8	10%	0.103	23%	0.228	C	C	.	.	E	Extended strand (participates in β ladder)	trans	168.1	-178.9	176.1	0	0	0	0	0	111.2	D105 A128	D105-G137 WeakPolarHBondContact O-CA 3.27Å; A128-G137 PolarHBondContact N-O 2.83Å; A128-G137 PolarHBondContact O-N 3.21Å
138	Y	93.8	Very high	92.7	Very high	58 Å²	58	44.3 Å²	44.3	23%	0.227	26%	0.258	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-76.9	136	-179.9	-68.9	-79.2	0	0	0	111.9	D105 D106 L107 W125 W126 D127 V264	D105-Y138 HydrophobicContact CB-CD2 3.95Å; D105-Y138 HydrophobicContact CB-CE2 4.39Å; D105-Y138 PolarHBondContact O-N 2.82Å; D106-Y138 WeakPolarHBondContact CA-O 3.46Å; L107-Y138 PolarHBondContact N-O 2.86Å; W125-Y138 HydrophobicContact CB-CD1 4.5Å; W126-Y138 CarbonylContact O-C 3.56Å; W126-Y138 WeakPolarHBondContact O-CA 3.4Å; D127-Y138 HydrophobicContact CB-CD1 4.34Å; D127-Y138 HydrophobicContact CB-CE1 4.13Å; Y138-V264 HydrophobicContact CD1-CB 4.4Å; Y138-V264 HydrophobicContact CD1-CG1 4.48Å; Y138-V264 HydrophobicContact CD1-CG2 4.14Å; Y138-V264 HydrophobicContact CD2-CG1 3.82Å; Y138-V264 HydrophobicContact CE1-CG2 4.05Å; Y138-V264 HydrophobicContact CE2-CG1 4.04Å; Y138-V264 HydrophobicContact CG-CB 4.33Å; Y138-V264 HydrophobicContact CG-CG1 4.06Å
139	I	93.7	Very high	92.5	Very high	0 Å²	0	45.2 Å²	45.2	0%	0	26%	0.264	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-124.3	150.4	173.2	64.1	169.8	0	0	0	110.4	L107 F109 F115 I117 W125 W126 A128 S141 V144	L107-I139 HydrophobicContact CB-CG2 3.9Å; L107-I139 HydrophobicContact CD2-CG2 4.25Å; L107-I139 HydrophobicContact CG-CG2 4.45Å; F109-I139 HydrophobicContact CD1-CB 4.49Å; F109-I139 HydrophobicContact CD1-CG2 3.79Å; F109-I139 HydrophobicContact CE1-CB 3.72Å; F109-I139 HydrophobicContact CE1-CG2 3.5Å; F109-I139 VanDerWaalsContact CE1-CG2 3.5Å; F109-I139 HydrophobicContact CZ-CB 4.43Å; F115-I139 HydrophobicContact CD1-CD1 4.4Å; F115-I139 HydrophobicContact CG-CD1 4.24Å; I117-I139 HydrophobicContact CD1-CD1 3.98Å; W125-I139 WeakPolarHBondContact CA-O 3.35Å; W126-I139 HydrophobicContact CB-CG1 4.44Å; W126-I139 PolarHBondContact N-O 2.95Å; W126-I139 WeakPolarHBondContact O-CG1 3.43Å; W126-I139 PolarHBondContact O-N 3.02Å; A128-I139 HydrophobicContact CB-CD1 3.43Å; A128-I139 VanDerWaalsContact CB-CD1 3.43Å; A128-I139 HydrophobicContact CB-CG1 3.66Å; A128-I139 HydrophobicContact CB-CG2 4.22Å; I139-S141 PolarHBondContact O-N 2.91Å; I139-V144 HydrophobicContact CD1-CG1 3.76Å; I139-V144 HydrophobicContact CD1-CG2 4.2Å
140	P	91.8	Very high	92.1	Very high	0 Å²	0	41 Å²	41	0%	0	25%	0.25	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-68.5	128.9	172	-19	32.2	0	0	0	112	Y99 W125 N142 Y143 L259	Y99-P140 HydrophobicContact CD2-CG 3.85Å; Y99-P140 HydrophobicContact CE1-CG 4.42Å; Y99-P140 HydrophobicContact CE2-CG 3.67Å; Y99-P140 HydrophobicContact CG-CG 4.34Å; W125-P140 HydrophobicContact CE3-CG 4.31Å; W125-P140 HydrophobicContact CH2-CG 4.08Å; W125-P140 HydrophobicContact CZ3-CG 3.82Å; P140-N142 VanDerWaalsContact C-N 3.28Å; P140-N142 WeakPolarHBondContact CB-OD1 3.5Å; P140-N142 PolarHBondContact O-N 2.79Å; P140-Y143 HydrophobicContact CB-CD2 3.67Å; P140-Y143 HydrophobicContact CB-CE2 4.28Å; P140-Y143 HydrophobicContact CB-CG 4.04Å; P140-Y143 HydrophobicContact CG-CD2 4.14Å; P140-Y143 HydrophobicContact CG-CG 4.25Å; P140-Y143 WeakPolarHBondContact O-CB 3.34Å; P140-Y143 PolarHBondContact O-N 3.45Å; P140-Y143 VanDerWaalsContact O-N 3.11Å; P140-L259 HydrophobicContact CB-CD1 4.49Å; P140-L259 HydrophobicContact CB-CD2 3.4Å; P140-L259 HydrophobicContact CG-CD1 3.9Å; P140-L259 HydrophobicContact CG-CD2 3.65Å; P140-L259 HydrophobicContact CG-CG 4.46Å
141	S	90.3	Very high	91.8	Very high	14 Å²	14	43.8 Å²	43.8	10%	0.098	26%	0.263	C	S	.	.	G	3₁₀ helix	trans	-66.4	-30.3	-177.2	65.8	0	0	0	0	113.1	G123 D124 W126 I139 Y143 V144	G123-S141 PolarHBondContact O-OG 3.33Å; D124-S141 WeakPolarHBondContact CA-OG 3.34Å; D124-S141 PolarHBondContact O-N 3.35Å; D124-S141 PolarHBondContact O-OG 3.4Å; W126-S141 VanDerWaalsContact CD2-CB 3.42Å; I139-S141 PolarHBondContact O-N 2.91Å; S141-Y143 PolarHBondContact O-N 2.87Å; S141-V144 WeakPolarHBondContact O-CG2 3.35Å; S141-V144 PolarHBondContact O-N 3.26Å
142	N	88.7	Confident	91.6	Very high	68 Å²	68	40.6 Å²	40.6	36%	0.364	25%	0.25	S	S	.	.	G	3₁₀ helix	trans	-77.6	-1.7	176.8	66.6	-26	0	0	0	114.1	P140 R258	P140-N142 VanDerWaalsContact C-N 3.28Å; P140-N142 WeakPolarHBondContact CB-OD1 3.5Å; P140-N142 PolarHBondContact O-N 2.79Å; N142-R258 PolarHBondContact ND2-O 2.81Å; N142-R258 VanDerWaalsContact ND2-O 3.13Å
143	Y	91.8	Very high	91.5	Very high	6 Å²	6	38 Å²	38	2%	0.024	23%	0.231	C	C	.	.	G	3₁₀ helix	trans	-96	-6.4	175.7	-84.5	-127.7	0	0	0	112.9	L96 Y97 D98 Y99 F109 P140 S141 M256 P257 L259	L96-Y143 WeakPolarHBondContact CB-O 3.47Å; L96-Y143 PolarHBondContact N-O 3.42Å; Y97-Y143 HydrophobicContact CD2-CD1 4.19Å; Y97-Y143 HydrophobicContact CD2-CG 4.18Å; Y97-Y143 HydrophobicContact CG-CD1 4.45Å; D98-Y143 WeakPolarHBondContact O-CE1 3.41Å; Y99-Y143 HydrophobicContact CD2-CD1 4.27Å; Y99-Y143 AromaticContact CD2-CE1 3.94Å; Y99-Y143 HydrophobicContact CD2-CE1 3.94Å; Y99-Y143 HydrophobicContact CG-CD1 4.48Å; Y99-Y143 HydrophobicContact CG-CE1 4.5Å; F109-Y143 HydrophobicContact CE2-CD1 4.19Å; F109-Y143 HydrophobicContact CZ-CD1 4.09Å; F109-Y143 HydrophobicContact CZ-CG 4.36Å; P140-Y143 HydrophobicContact CB-CD2 3.67Å; P140-Y143 HydrophobicContact CB-CE2 4.28Å; P140-Y143 HydrophobicContact CB-CG 4.04Å; P140-Y143 HydrophobicContact CG-CD2 4.14Å; P140-Y143 HydrophobicContact CG-CG 4.25Å; P140-Y143 WeakPolarHBondContact O-CB 3.34Å; P140-Y143 PolarHBondContact O-N 3.45Å; P140-Y143 VanDerWaalsContact O-N 3.11Å; S141-Y143 PolarHBondContact O-N 2.87Å; Y143-M256 HydrophobicContact CE1-CG 3.98Å; Y143-M256 HydrophobicContact CE1-SD 4.05Å; Y143-M256 VanDerWaalsContact OH-CG 3.22Å; Y143-M256 WeakPolarHBondContact OH-CG 3.4Å; Y143-M256 PolarHBondContact OH-SD 3.25Å; Y143-P257 HydrophobicContact CD2-CG 3.83Å; Y143-P257 HydrophobicContact CE2-CB 4.44Å; Y143-P257 HydrophobicContact CE2-CG 3.65Å; Y143-P257 WeakPolarHBondContact CE2-O 3.48Å; Y143-P257 PolarHBondContact OH-O 3.34Å; Y143-P257 VanDerWaalsContact OH-O 3.08Å; Y143-L259 HydrophobicContact CD2-CD2 3.89Å; Y143-L259 HydrophobicContact CE2-CD2 3.34Å; Y143-L259 HydrophobicContact CE2-CG 4.19Å
144	V	92.4	Very high	91.3	Very high	5 Å²	5	37 Å²	37	3%	0.03	22%	0.222	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-127.2	153.5	-176.4	-66	0	0	0	0	112	F93 V94 F115 W126 I139 S141	F93-V144 HydrophobicContact CB-CB 4.26Å; F93-V144 HydrophobicContact CD1-CB 4.27Å; F93-V144 HydrophobicContact CD1-CG2 4Å; V94-V144 VanDerWaalsContact O-CA 3.26Å; V94-V144 WeakPolarHBondContact O-CA 3.34Å; F115-V144 HydrophobicContact CD2-CG1 4.14Å; F115-V144 HydrophobicContact CE2-CG1 4.32Å; W126-V144 HydrophobicContact CE3-CG2 4.07Å; W126-V144 HydrophobicContact CZ3-CG2 3.96Å; I139-V144 HydrophobicContact CD1-CG1 3.76Å; I139-V144 HydrophobicContact CD1-CG2 4.2Å; S141-V144 WeakPolarHBondContact O-CG2 3.35Å; S141-V144 PolarHBondContact O-N 3.26Å
145	A	92.4	Very high	91.4	Very high	1 Å²	1	36 Å²	36	1%	0.008	21%	0.207	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-136.3	155.9	169.5	0	0	0	0	0	110.5	F93 V94 L96 V147 Q151 A152	F93-A145 CarbonylContact C-O 3.49Å; F93-A145 VanDerWaalsContact CA-O 3.25Å; F93-A145 WeakPolarHBondContact CA-O 3.45Å; F93-A145 VanDerWaalsContact CD1-C 3.43Å; V94-A145 PolarHBondContact N-O 3.43Å; V94-A145 PolarHBondContact O-N 2.98Å; L96-A145 HydrophobicContact CD1-CB 4.12Å; L96-A145 HydrophobicContact CD2-CB 3.97Å; L96-A145 HydrophobicContact CG-CB 4.33Å; A145-V147 PolarHBondContact O-N 3.28Å; A145-Q151 VanDerWaalsContact CB-C 3.48Å; A145-Q151 HydrophobicContact CB-CB 3.65Å; A145-A152 HydrophobicContact CB-CB 4.27Å
146	P	93.1	Very high	91.5	Very high	25 Å²	25	35.3 Å²	35.3	16%	0.162	20%	0.195	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-57.9	136.6	170.3	-18.5	28.5	0	0	0	110.8	F64 T91 L92 F93 D148 S149	F64-P146 HydrophobicContact CE1-CG 4.49Å; T91-P146 HydrophobicContact CG2-CB 4.17Å; L92-P146 WeakPolarHBondContact O-CA 3.28Å; F93-P146 HydrophobicContact CD1-CG 4.28Å; F93-P146 HydrophobicContact CE1-CB 4.48Å; F93-P146 HydrophobicContact CE1-CG 3.72Å; F93-P146 HydrophobicContact CZ-CG 4.02Å; P146-D148 VanDerWaalsContact C-N 3.3Å; P146-D148 PolarHBondContact O-N 2.69Å; P146-S149 WeakPolarHBondContact CD-OG 3.32Å; P146-S149 WeakPolarHBondContact O-CB 3.21Å; P146-S149 PolarHBondContact O-N 3.03Å; P146-S149 PolarHBondContact O-OG 3.19Å
147	V	89.1	Confident	91.3	Very high	35 Å²	35	33.4 Å²	33.4	21%	0.212	18%	0.178	C	C	.	.	T	Hydrogen-bonded Turn	trans	-53.8	-42.6	-169.3	177	0	0	0	0	113.2	L92 V94 A145	L92-V147 HydrophobicContact CB-CG2 3.81Å; L92-V147 PolarHBondContact O-N 3.16Å; V94-V147 HydrophobicContact CB-CG2 4.18Å; A145-V147 PolarHBondContact O-N 3.28Å
148	D	85.4	Confident	91.2	Very high	160 Å²	160	33.6 Å²	33.6	86%	0.856	18%	0.181	S	C	*	.	T	Hydrogen-bonded Turn	trans	-97.6	17.2	-174.9	-56	-44.9	0	0	0	113.1	P146	P146-D148 VanDerWaalsContact C-N 3.3Å; P146-D148 PolarHBondContact O-N 2.69Å
149	S	89.3	Confident	91.1	Very high	19 Å²	19	39.2 Å²	39.2	13%	0.133	21%	0.206	C	C	.	.	S	Bend	trans	-96.6	155.2	-177.9	75.8	0	0	0	0	112	P146 Q151 A152	P146-S149 WeakPolarHBondContact CD-OG 3.32Å; P146-S149 WeakPolarHBondContact O-CB 3.21Å; P146-S149 PolarHBondContact O-N 3.03Å; P146-S149 PolarHBondContact O-OG 3.19Å; S149-Q151 PolarHBondContact O-N 3.44Å; S149-Q151 VanDerWaalsContact O-N 3.16Å; S149-Q151 PolarHBondContact OG-N 3.1Å; S149-Q151 PolarHBondContact OG-OE1 3.18Å; S149-A152 WeakPolarHBondContact O-CB 3.44Å; S149-A152 PolarHBondContact O-N 3.06Å
150	I	89.2	Confident	90.9	Very high	31 Å²	31	40.5 Å²	40.5	16%	0.159	21%	0.213	C	C	.	.	G	3₁₀ helix	trans	-60.4	-24.7	172.3	-171.6	165.5	0	0	0	112.5	A152 E153 W155 Y156 L230	I150-A152 PolarHBondContact O-N 3.03Å; I150-E153 HydrophobicContact CG1-CG 4.45Å; I150-E153 VanDerWaalsContact O-CB 3.27Å; I150-E153 WeakPolarHBondContact O-CB 3.47Å; I150-E153 WeakPolarHBondContact O-CG 3.23Å; I150-E153 PolarHBondContact O-N 3.05Å; I150-W155 HydrophobicContact CD1-CH2 3.85Å; I150-W155 HydrophobicContact CD1-CZ3 3.93Å; I150-W155 HydrophobicContact CG1-CH2 3.89Å; I150-W155 HydrophobicContact CG1-CZ3 4.11Å; I150-Y156 HydrophobicContact CD1-CD2 3.59Å; I150-Y156 HydrophobicContact CD1-CE2 3.85Å; I150-Y156 HydrophobicContact CD1-CG 4.08Å; I150-Y156 HydrophobicContact CG1-CD1 4.11Å; I150-Y156 HydrophobicContact CG1-CD2 3.68Å; I150-Y156 HydrophobicContact CG1-CE2 4.19Å; I150-Y156 HydrophobicContact CG1-CG 3.62Å; I150-Y156 HydrophobicContact CG2-CD1 4.3Å; I150-Y156 HydrophobicContact CG2-CE1 4.1Å; I150-Y156 VanDerWaalsContact O-CB 3.31Å; I150-Y156 WeakPolarHBondContact O-CB 3.11Å; I150-L230 HydrophobicContact CD1-CB 4.05Å; I150-L230 HydrophobicContact CD1-CD1 3.18Å; I150-L230 HydrophobicContact CD1-CG 4.2Å
151	Q	89.4	Confident	90.8	Very high	60 Å²	60	41.1 Å²	41.1	28%	0.28	22%	0.22	S	C	.	.	G	3₁₀ helix	trans	-66.6	-20.6	177	-65.7	84.7	-7.2	0	0	112.8	F64 A145 S149 E153 Y156	F64-Q151 HydrophobicContact CD1-CG 4.42Å; F64-Q151 HydrophobicContact CE1-CB 4.16Å; F64-Q151 HydrophobicContact CE1-CG 3.71Å; A145-Q151 VanDerWaalsContact CB-C 3.48Å; A145-Q151 HydrophobicContact CB-CB 3.65Å; S149-Q151 PolarHBondContact O-N 3.44Å; S149-Q151 VanDerWaalsContact O-N 3.16Å; S149-Q151 PolarHBondContact OG-N 3.1Å; S149-Q151 PolarHBondContact OG-OE1 3.18Å; Q151-E153 VanDerWaalsContact C-N 3.25Å; Q151-E153 PolarHBondContact O-N 3.03Å; Q151-Y156 HydrophobicContact CG-CD1 4.32Å; Q151-Y156 HydrophobicContact CG-CE1 4.02Å
152	A	89.6	Confident	90.8	Very high	25 Å²	25	42.4 Å²	42.4	21%	0.207	22%	0.222	C	C	.	.	G	3₁₀ helix	trans	-74.6	-14.9	172.8	0	0	0	0	0	113.4	V94 A145 S149 I150	V94-A152 HydrophobicContact CG1-CB 3.84Å; A145-A152 HydrophobicContact CB-CB 4.27Å; S149-A152 WeakPolarHBondContact O-CB 3.44Å; S149-A152 PolarHBondContact O-N 3.06Å; I150-A152 PolarHBondContact O-N 3.03Å
153	E	91.9	Very high	90.6	Very high	52 Å²	52	41 Å²	41	24%	0.243	21%	0.213	C	C	.	.			trans	-78.6	129.7	-175.7	-60.8	-70.6	163	0	0	111.9	I150 Q151 W155 Y156 Q231 K254	I150-E153 HydrophobicContact CG1-CG 4.45Å; I150-E153 VanDerWaalsContact O-CB 3.27Å; I150-E153 WeakPolarHBondContact O-CB 3.47Å; I150-E153 WeakPolarHBondContact O-CG 3.23Å; I150-E153 PolarHBondContact O-N 3.05Å; Q151-E153 VanDerWaalsContact C-N 3.25Å; Q151-E153 PolarHBondContact O-N 3.03Å; E153-W155 HydrophobicContact CB-CD2 3.96Å; E153-W155 HydrophobicContact CB-CE3 4.45Å; E153-W155 HydrophobicContact CB-CG 4.41Å; E153-W155 HydrophobicContact CB-CH2 4.22Å; E153-W155 HydrophobicContact CB-CZ2 3.7Å; E153-W155 HydrophobicContact CG-CH2 4.07Å; E153-W155 HydrophobicContact CG-CZ2 3.48Å; E153-W155 VanDerWaalsContact CG-CZ2 3.48Å; E153-W155 PolarHBondContact O-N 2.78Å; E153-W155 VanDerWaalsContact O-N 3.16Å; E153-W155 PolarHBondContact OE2-NE1 2.74Å; E153-Y156 PolarHBondContact O-N 2.85Å; E153-Y156 VanDerWaalsContact O-N 3.08Å; E153-Q231 VanDerWaalsContact OE1-CG 3.24Å; E153-Q231 WeakPolarHBondContact OE1-CG 3.39Å; E153-Q231 PolarHBondContact OE1-NE2 2.5Å; E153-K254 PolarHBondContact O-NZ 2.65Å
154	D	90.3	Very high	90.4	Very high	75 Å²	75	42.7 Å²	42.7	40%	0.401	22%	0.222	S	C	.	.	T	Hydrogen-bonded Turn	trans	-60.3	-28.7	-179.7	-82.8	-20.9	0	0	0	112.9	K111 K254	K111-D154 IonicContact NZ-OD1 2.64Å; K111-D154 PolarHBondContact NZ-OD1 3.37Å; K111-D154 IonicContact NZ-OD2 3.38Å; K111-D154 PolarHBondContact NZ-OD2 3.32Å; D154-K254 WeakPolarHBondContact O-CE 3.47Å; D154-K254 PolarHBondContact O-NZ 2.74Å
155	W	94.3	Very high	90.4	Very high	15 Å²	15	42.4 Å²	42.4	6%	0.057	22%	0.221	C	C	.	.	T	Hydrogen-bonded Turn	trans	-86.6	-5.3	179.9	49.9	-97.4	0	0	0	114.1	I150 E153 F157 Y179 L180 I181 L230 Q231 V234 P251	I150-W155 HydrophobicContact CD1-CH2 3.85Å; I150-W155 HydrophobicContact CD1-CZ3 3.93Å; I150-W155 HydrophobicContact CG1-CH2 3.89Å; I150-W155 HydrophobicContact CG1-CZ3 4.11Å; E153-W155 HydrophobicContact CB-CD2 3.96Å; E153-W155 HydrophobicContact CB-CE3 4.45Å; E153-W155 HydrophobicContact CB-CG 4.41Å; E153-W155 HydrophobicContact CB-CH2 4.22Å; E153-W155 HydrophobicContact CB-CZ2 3.7Å; E153-W155 HydrophobicContact CG-CH2 4.07Å; E153-W155 HydrophobicContact CG-CZ2 3.48Å; E153-W155 VanDerWaalsContact CG-CZ2 3.48Å; E153-W155 PolarHBondContact O-N 2.78Å; E153-W155 VanDerWaalsContact O-N 3.16Å; E153-W155 PolarHBondContact OE2-NE1 2.74Å; W155-F157 WeakPolarHBondContact O-CD2 3.5Å; W155-Y179 HydrophobicContact CB-CD2 4.29Å; W155-Y179 HydrophobicContact CB-CE2 3.58Å; W155-Y179 HydrophobicContact CG-CE2 4.03Å; W155-L180 WeakPolarHBondContact O-CA 3.11Å; W155-I181 HydrophobicContact CE3-CB 3.72Å; W155-I181 HydrophobicContact CE3-CD1 3.7Å; W155-I181 HydrophobicContact CE3-CG1 3.84Å; W155-I181 HydrophobicContact CH2-CD1 4.38Å; W155-I181 HydrophobicContact CZ3-CB 3.81Å; W155-I181 HydrophobicContact CZ3-CD1 3.55Å; W155-I181 HydrophobicContact CZ3-CG1 4.04Å; W155-I181 HydrophobicContact CZ3-CG2 4.23Å; W155-I181 PolarHBondContact O-N 2.99Å; W155-L230 HydrophobicContact CH2-CB 3.67Å; W155-L230 HydrophobicContact CZ3-CB 4.29Å; W155-Q231 HydrophobicContact CZ2-CG 4.13Å; W155-V234 HydrophobicContact CD2-CG2 3.94Å; W155-V234 HydrophobicContact CE3-CG2 4.11Å; W155-V234 HydrophobicContact CH2-CG2 4.26Å; W155-V234 HydrophobicContact CZ2-CG2 4.06Å; W155-V234 HydrophobicContact CZ3-CG2 4.28Å; W155-P251 HydrophobicContact CB-CB 4Å; W155-P251 HydrophobicContact CB-CG 4.25Å
156	Y	94.6	Very high	90.4	Very high	14 Å²	14	44 Å²	44	6%	0.055	23%	0.228	C	C	.	.	B	Isolated β-bridge	trans	-98.2	116.6	-176.9	-178.9	-106.3	0	0	0	113.8	I150 Q151 E153 G158 I181 E183 F191 K254	I150-Y156 HydrophobicContact CD1-CD2 3.59Å; I150-Y156 HydrophobicContact CD1-CE2 3.85Å; I150-Y156 HydrophobicContact CD1-CG 4.08Å; I150-Y156 HydrophobicContact CG1-CD1 4.11Å; I150-Y156 HydrophobicContact CG1-CD2 3.68Å; I150-Y156 HydrophobicContact CG1-CE2 4.19Å; I150-Y156 HydrophobicContact CG1-CG 3.62Å; I150-Y156 HydrophobicContact CG2-CD1 4.3Å; I150-Y156 HydrophobicContact CG2-CE1 4.1Å; I150-Y156 VanDerWaalsContact O-CB 3.31Å; I150-Y156 WeakPolarHBondContact O-CB 3.11Å; Q151-Y156 HydrophobicContact CG-CD1 4.32Å; Q151-Y156 HydrophobicContact CG-CE1 4.02Å; E153-Y156 PolarHBondContact O-N 2.85Å; E153-Y156 VanDerWaalsContact O-N 3.08Å; Y156-G158 VanDerWaalsContact CE1-CA 3.5Å; Y156-I181 CarbonylContact C-O 3.57Å; Y156-I181 WeakPolarHBondContact CA-O 3.23Å; Y156-I181 HydrophobicContact CD2-CG2 4.21Å; Y156-E183 PolarHBondContact OH-OE1 3.08Å; Y156-F191 AromaticContact CE2-CD1 3.86Å; Y156-F191 HydrophobicContact CE2-CD1 3.86Å; Y156-F191 AromaticContact CE2-CE1 3.62Å; Y156-F191 HydrophobicContact CE2-CE1 3.62Å; Y156-K254 WeakPolarHBondContact O-CE 3.24Å; Y156-K254 PolarHBondContact O-NZ 3.19Å
157	F	92.6	Very high	90.2	Very high	28 Å²	28	44.9 Å²	44.9	12%	0.123	23%	0.228	C	C	.	.			trans	-105.7	12.3	-172	-75.8	-112.7	0	0	0	113.7	W155 K159 L160 L180 I181 C252 K254	W155-F157 WeakPolarHBondContact O-CD2 3.5Å; F157-K159 PolarHBondContact O-N 2.64Å; F157-L160 HydrophobicContact CB-CB 3.87Å; F157-L160 HydrophobicContact CB-CD2 3.83Å; F157-L160 HydrophobicContact CB-CG 4.46Å; F157-L160 HydrophobicContact CD1-CD2 3.76Å; F157-L160 HydrophobicContact CG-CD2 4.06Å; F157-L160 PolarHBondContact O-N 2.86Å; F157-L180 HydrophobicContact CD1-CD2 4.31Å; F157-L180 HydrophobicContact CD2-CB 3.43Å; F157-L180 VanDerWaalsContact CD2-CB 3.43Å; F157-L180 HydrophobicContact CD2-CD2 4.26Å; F157-L180 HydrophobicContact CD2-CG 4.3Å; F157-L180 HydrophobicContact CE1-CD2 4.3Å; F157-L180 HydrophobicContact CE2-CB 3.49Å; F157-L180 VanDerWaalsContact CE2-CB 3.49Å; F157-L180 HydrophobicContact CE2-CD2 4.28Å; F157-L180 HydrophobicContact CE2-CG 4.49Å; F157-L180 HydrophobicContact CG-CB 4.16Å; F157-L180 HydrophobicContact CG-CD2 4.26Å; F157-L180 HydrophobicContact CZ-CB 4.25Å; F157-L180 HydrophobicContact CZ-CD2 4.27Å; F157-I181 PolarHBondContact N-O 2.85Å; F157-C252 HydrophobicContact CE2-CB 4.16Å; F157-C252 HydrophobicContact CZ-CB 3.76Å; F157-C252 WeakPolarHBondContact CZ-O 3.33Å; F157-K254 HydrophobicContact CD1-CG 4.03Å; F157-K254 HydrophobicContact CD2-CG 4.35Å; F157-K254 HydrophobicContact CE1-CB 4.3Å; F157-K254 HydrophobicContact CE1-CD 4.44Å; F157-K254 HydrophobicContact CE1-CG 3.36Å; F157-K254 HydrophobicContact CE2-CD 4.33Å; F157-K254 HydrophobicContact CE2-CG 3.73Å; F157-K254 HydrophobicContact CZ-CB 4.28Å; F157-K254 HydrophobicContact CZ-CD 4.24Å; F157-K254 HydrophobicContact CZ-CG 3.2Å
158	G	92	Very high	90.2	Very high	15 Å²	15	45.5 Å²	45.5	16%	0.155	23%	0.229	C	C	.	.	T	Hydrogen-bonded Turn	trans	57.3	-132.7	177.1	0	0	0	0	0	112.6	Y156 L160 R182 E183	Y156-G158 VanDerWaalsContact CE1-CA 3.5Å; G158-L160 PolarHBondContact O-N 2.87Å; G158-R182 CarbonylContact O-C 3.46Å; G158-R182 WeakPolarHBondContact O-CA 3.43Å; G158-E183 PolarHBondContact O-N 2.91Å
159	K	90.3	Very high	90.6	Very high	176 Å²	176	37.9 Å²	37.9	77%	0.765	19%	0.188	S	C	*	.	T	Hydrogen-bonded Turn	trans	-78.3	31.8	-177.7	-65.5	-178.6	-179.8	177.5	0	114.4	F157 G161 E183	F157-K159 PolarHBondContact O-N 2.64Å; K159-G161 PolarHBondContact O-N 3.15Å; K159-E183 WeakPolarHBondContact CE-OE2 3.41Å; K159-E183 VanDerWaalsContact CG-CD 3.46Å; K159-E183 HydrophobicContact CG-CG 4.43Å; K159-E183 WeakPolarHBondContact CG-OE1 3.37Å; K159-E183 WeakPolarHBondContact CG-OE2 3.26Å
160	L	89.6	Confident	90.6	Very high	26 Å²	26	40.3 Å²	40.3	14%	0.136	20%	0.199	C	C	.	.			trans	-65.3	127	176.2	-169.2	70.6	0	0	0	110.3	F157 G158 D164 A165 L180 R182	F157-L160 HydrophobicContact CB-CB 3.87Å; F157-L160 HydrophobicContact CB-CD2 3.83Å; F157-L160 HydrophobicContact CB-CG 4.46Å; F157-L160 HydrophobicContact CD1-CD2 3.76Å; F157-L160 HydrophobicContact CG-CD2 4.06Å; F157-L160 PolarHBondContact O-N 2.86Å; G158-L160 PolarHBondContact O-N 2.87Å; L160-D164 HydrophobicContact CD1-CB 3.54Å; L160-D164 HydrophobicContact CG-CB 4Å; L160-A165 HydrophobicContact CD2-CB 3.79Å; L160-A165 HydrophobicContact CG-CB 4.36Å; L160-L180 HydrophobicContact CD2-CD1 4.24Å; L160-L180 HydrophobicContact CD2-CD2 3.97Å; L160-R182 HydrophobicContact CB-CB 4.15Å; L160-R182 VanDerWaalsContact O-CD 3.32Å; L160-R182 WeakPolarHBondContact O-CD 3.45Å
161	G	89.9	Confident	90.5	Very high	14 Å²	14	40.1 Å²	40.1	14%	0.144	20%	0.2	C	C	.	.			trans	-68.6	158.6	176.1	0	0	0	0	0	112.4	K159 K163 D164 A165 E185	K159-G161 PolarHBondContact O-N 3.15Å; G161-K163 PolarHBondContact O-N 3.25Å; G161-D164 PolarHBondContact O-N 2.9Å; G161-A165 PolarHBondContact O-N 2.95Å; G161-E185 WeakPolarHBondContact CA-OE1 3.28Å
162	R	90.1	Very high	90.1	Very high	41 Å²	41	44.3 Å²	44.3	16%	0.155	23%	0.23	C	C	.	.	H	α-helix	trans	-55.1	-49.7	-180	178.2	-179	178.7	147.8	4.6	112.2	A165 E166 R182 E185 H208 Q536	R162-A165 WeakPolarHBondContact O-CB 3.47Å; R162-A165 PolarHBondContact O-N 3.02Å; R162-E166 WeakPolarHBondContact CG-OE1 3.48Å; R162-E166 IonicContact CZ-OE1 3.74Å; R162-E166 IonicContact NE-OE1 2.78Å; R162-E166 PolarHBondContact NE-OE1 3.42Å; R162-E166 IonicContact NH2-OE1 3.7Å; R162-E166 WeakPolarHBondContact O-CG 3.03Å; R162-E166 PolarHBondContact O-N 3.1Å; R162-R182 VanDerWaalsContact CA-CZ 3.5Å; R162-R182 VanDerWaalsContact CB-NH2 3.33Å; R162-E185 VanDerWaalsContact CB-OE2 3.23Å; R162-E185 WeakPolarHBondContact CB-OE2 3.27Å; R162-E185 VanDerWaalsContact N-CD 3.27Å; R162-E185 PolarHBondContact N-OE1 3.45Å; R162-E185 PolarHBondContact N-OE2 2.98Å; R162-H208 PolarHBondContact NE-NE2 3.49Å; R162-H208 PolarHBondContact NH2-CD2 2.94Å; R162-Q536 VanDerWaalsContact CZ-O 3.32Å; R162-Q536 VanDerWaalsContact NH1-CA 3.3Å; R162-Q536 VanDerWaalsContact NH1-CB 3.31Å; R162-Q536 PolarHBondContact NH1-O 2.64Å; R162-Q536 PolarHBondContact NH2-O 3.12Å
163	K	85.8	Confident	89.9	Confident	37 Å²	37	46.5 Å²	46.5	16%	0.161	26%	0.255	C	S	.	.	H	α-helix	trans	-68	-37.3	-176.9	-64.6	-65	179.7	171.6	0	112.3	G161 A165 E166 R167 E527	G161-K163 PolarHBondContact O-N 3.25Å; K163-A165 VanDerWaalsContact C-N 3.32Å; K163-A165 PolarHBondContact O-N 2.75Å; K163-E166 WeakPolarHBondContact CD-OE2 3.23Å; K163-E166 IonicContact NZ-OE2 2.85Å; K163-E166 PolarHBondContact O-N 3.36Å; K163-R167 WeakPolarHBondContact O-CG 3.48Å; K163-R167 PolarHBondContact O-N 3.21Å; K163-E527 WeakPolarHBondContact CE-O 3.26Å; K163-E527 PolarHBondContact NZ-O 3.38Å
164	D	87.6	Confident	89.9	Confident	42 Å²	42	45.1 Å²	45.1	23%	0.225	25%	0.25	C	C	.	.	H	α-helix	trans	-64.8	-37.3	172.4	-73.6	-54	0	0	0	112	L160 G161 R167 Q168 K331	L160-D164 HydrophobicContact CD1-CB 3.54Å; L160-D164 HydrophobicContact CG-CB 4Å; G161-D164 PolarHBondContact O-N 2.9Å; D164-R167 VanDerWaalsContact CG-NH2 3.26Å; D164-R167 PolarHBondContact O-N 2.91Å; D164-R167 IonicContact OD1-CZ 3.92Å; D164-R167 IonicContact OD1-NE 3.88Å; D164-R167 PolarHBondContact OD1-NE 2.83Å; D164-R167 IonicContact OD1-NH2 3.99Å; D164-R167 PolarHBondContact OD1-NH2 3.32Å; D164-R167 IonicContact OD2-NH2 2.97Å; D164-Q168 WeakPolarHBondContact O-CG 3.42Å; D164-Q168 PolarHBondContact O-N 2.84Å; D164-K331 IonicContact OD1-NZ 3.7Å
165	A	92	Very high	90.1	Very high	0 Å²	0	44.6 Å²	44.6	0%	0	25%	0.25	C	S	.	.	H	α-helix	trans	-63.1	-44.2	172	0	0	0	0	0	112.3	L160 G161 R162 K163 Q168 L169 L180	L160-A165 HydrophobicContact CD2-CB 3.79Å; L160-A165 HydrophobicContact CG-CB 4.36Å; G161-A165 PolarHBondContact O-N 2.95Å; R162-A165 WeakPolarHBondContact O-CB 3.47Å; R162-A165 PolarHBondContact O-N 3.02Å; K163-A165 VanDerWaalsContact C-N 3.32Å; K163-A165 PolarHBondContact O-N 2.75Å; A165-Q168 PolarHBondContact O-N 3.47Å; A165-L169 WeakPolarHBondContact O-CB 3.32Å; A165-L169 VanDerWaalsContact O-CG 3.27Å; A165-L169 WeakPolarHBondContact O-CG 3.38Å; A165-L169 PolarHBondContact O-N 2.94Å; A165-L180 HydrophobicContact CB-CD1 3.88Å; A165-L180 HydrophobicContact CB-CD2 4.13Å
166	E	92.1	Very high	90.2	Very high	35 Å²	35	50 Å²	50	16%	0.164	27%	0.27	C	S	.	.	H	α-helix	trans	-58.2	-47.9	175.6	-69.5	173.8	-169.8	0	0	110.9	R162 K163 Q168 L169 L170 V206 H208	R162-E166 WeakPolarHBondContact CG-OE1 3.48Å; R162-E166 IonicContact CZ-OE1 3.74Å; R162-E166 IonicContact NE-OE1 2.78Å; R162-E166 PolarHBondContact NE-OE1 3.42Å; R162-E166 IonicContact NH2-OE1 3.7Å; R162-E166 WeakPolarHBondContact O-CG 3.03Å; R162-E166 PolarHBondContact O-N 3.1Å; K163-E166 WeakPolarHBondContact CD-OE2 3.23Å; K163-E166 IonicContact NZ-OE2 2.85Å; K163-E166 PolarHBondContact O-N 3.36Å; E166-Q168 PolarHBondContact O-N 2.97Å; E166-L169 PolarHBondContact O-N 2.88Å; E166-L170 VanDerWaalsContact O-CB 3.28Å; E166-L170 WeakPolarHBondContact O-CB 3.38Å; E166-L170 VanDerWaalsContact O-CG 3.23Å; E166-L170 WeakPolarHBondContact O-CG 3.44Å; E166-L170 PolarHBondContact O-N 2.75Å; E166-V206 HydrophobicContact CB-CG2 4.48Å; E166-V206 HydrophobicContact CG-CB 4.05Å; E166-V206 HydrophobicContact CG-CG1 4.27Å; E166-V206 HydrophobicContact CG-CG2 4.4Å; E166-H208 IonicContact OE1-CE1 3.18Å; E166-H208 IonicContact OE1-NE2 3.68Å; E166-H208 PolarHBondContact OE1-NE2 3.21Å; E166-H208 VanDerWaalsContact OE1-NE2 3.1Å
167	R	88.2	Confident	90.2	Very high	42 Å²	42	49.3 Å²	49.3	16%	0.158	27%	0.268	C	S	.	.	H	α-helix	trans	-57.7	-47.1	176.4	-76.1	-173.1	-80.3	-99.7	4	113.1	K163 D164 S171 D375	K163-R167 WeakPolarHBondContact O-CG 3.48Å; K163-R167 PolarHBondContact O-N 3.21Å; D164-R167 VanDerWaalsContact CG-NH2 3.26Å; D164-R167 PolarHBondContact O-N 2.91Å; D164-R167 IonicContact OD1-CZ 3.92Å; D164-R167 IonicContact OD1-NE 3.88Å; D164-R167 PolarHBondContact OD1-NE 2.83Å; D164-R167 IonicContact OD1-NH2 3.99Å; D164-R167 PolarHBondContact OD1-NH2 3.32Å; D164-R167 IonicContact OD2-NH2 2.97Å; R167-S171 PolarHBondContact O-N 3.19Å; R167-D375 WeakPolarHBondContact CD-OD2 3.1Å; R167-D375 IonicContact CZ-OD1 3.87Å; R167-D375 VanDerWaalsContact NH1-CG 3.26Å; R167-D375 IonicContact NH1-OD1 2.71Å; R167-D375 PolarHBondContact NH1-OD1 3.34Å; R167-D375 IonicContact NH1-OD2 3.1Å; R167-D375 PolarHBondContact NH1-OD2 3.16Å
168	Q	89.9	Confident	90.5	Very high	49 Å²	49	48 Å²	48	23%	0.229	26%	0.262	C	S	.	.	H	α-helix	trans	-67	-42.7	-179	-71.1	-167.5	43.8	0	0	111.8	D164 A165 E166 S171 N174	D164-Q168 WeakPolarHBondContact O-CG 3.42Å; D164-Q168 PolarHBondContact O-N 2.84Å; A165-Q168 PolarHBondContact O-N 3.47Å; E166-Q168 PolarHBondContact O-N 2.97Å; Q168-S171 WeakPolarHBondContact O-CB 2.98Å; Q168-S171 PolarHBondContact O-N 3Å; Q168-S171 PolarHBondContact O-OG 2.75Å; Q168-N174 PolarHBondContact O-ND2 3.49Å
169	L	92.9	Very high	90.8	Very high	0 Å²	0	47.8 Å²	47.8	0%	0	26%	0.257	C	S	.	.	H	α-helix	trans	-67.1	-40.4	179	-72.8	170.1	0	0	0	112.3	A165 E166 S171 N174 T178 L180 R196 V206 C252	A165-L169 WeakPolarHBondContact O-CB 3.32Å; A165-L169 VanDerWaalsContact O-CG 3.27Å; A165-L169 WeakPolarHBondContact O-CG 3.38Å; A165-L169 PolarHBondContact O-N 2.94Å; E166-L169 PolarHBondContact O-N 2.88Å; L169-S171 PolarHBondContact O-N 2.92Å; L169-N174 WeakPolarHBondContact O-CB 3.26Å; L169-N174 PolarHBondContact O-ND2 3.06Å; L169-T178 HydrophobicContact CD2-CG2 3.8Å; L169-T178 WeakPolarHBondContact CD2-O 3.34Å; L169-L180 HydrophobicContact CD1-CD2 4.19Å; L169-L180 HydrophobicContact CD1-CG 4.2Å; L169-L180 HydrophobicContact CD2-CD2 4.19Å; L169-L180 HydrophobicContact CD2-CG 4.39Å; L169-L180 HydrophobicContact CG-CD2 3.92Å; L169-L180 HydrophobicContact CG-CG 4.35Å; L169-R196 HydrophobicContact CB-CB 4.41Å; L169-R196 WeakPolarHBondContact O-CD 3.35Å; L169-R196 PolarHBondContact O-NH1 3Å; L169-V206 HydrophobicContact CB-CG2 3.84Å; L169-V206 HydrophobicContact CD1-CG1 3.6Å; L169-V206 HydrophobicContact CD1-CG2 4.12Å; L169-C252 HydrophobicContact CD2-CB 3.78Å
170	L	90.7	Very high	91.1	Very high	70 Å²	70	39.4 Å²	39.4	37%	0.366	22%	0.22	S	C	.	.	T	Hydrogen-bonded Turn	trans	-79.4	-0.1	179.5	-64.7	173.7	0	0	0	114	E166 D204 V206	E166-L170 VanDerWaalsContact O-CB 3.28Å; E166-L170 WeakPolarHBondContact O-CB 3.38Å; E166-L170 VanDerWaalsContact O-CG 3.23Å; E166-L170 WeakPolarHBondContact O-CG 3.44Å; E166-L170 PolarHBondContact O-N 2.75Å; L170-D204 HydrophobicContact CD2-CB 3.96Å; L170-V206 HydrophobicContact CD1-CG2 4.26Å; L170-V206 HydrophobicContact CD2-CG2 3.98Å; L170-V206 HydrophobicContact CG-CG2 3.8Å
171	S	86.1	Confident	91.5	Very high	26 Å²	26	38.2 Å²	38.2	18%	0.182	21%	0.214	C	C	.	.	S	Bend	trans	-58.6	149.2	174	66	0	0	0	0	111.9	R167 Q168 L169 G173 N174 R196	R167-S171 PolarHBondContact O-N 3.19Å; Q168-S171 WeakPolarHBondContact O-CB 2.98Å; Q168-S171 PolarHBondContact O-N 3Å; Q168-S171 PolarHBondContact O-OG 2.75Å; L169-S171 PolarHBondContact O-N 2.92Å; S171-G173 PolarHBondContact O-N 2.77Å; S171-N174 PolarHBondContact O-N 2.64Å; S171-N174 PolarHBondContact OG-ND2 3.01Å; S171-N174 VanDerWaalsContact OG-ND2 3.09Å; S171-R196 PolarHBondContact O-NH1 3.47Å
172	T	82.3	Confident	91.8	Very high	149 Å²	149	37.5 Å²	37.5	91%	0.914	21%	0.207	S	C	*	.	T	Hydrogen-bonded Turn	trans	-61.9	133.5	-178.2	-51.3	0	0	0	0	110.6
173	G	85.1	Confident	92	Very high	71 Å²	71	39 Å²	39	73%	0.732	22%	0.216	S	C	*	.	T	Hydrogen-bonded Turn	trans	99.9	-13.5	178.2	0	0	0	0	0	114.7	S171 P175	S171-G173 PolarHBondContact O-N 2.77Å; G173-P175 WeakPolarHBondContact O-CD 3.25Å
174	N	91.3	Very high	92.3	Very high	23 Å²	23	37.8 Å²	37.8	12%	0.123	21%	0.212	C	C	.	.	P	Polyproline II helix	trans	-75.1	124.1	172.7	-78.1	-24.8	0	0	0	111.2	Q168 L169 S171 T178 R196	Q168-N174 PolarHBondContact O-ND2 3.49Å; L169-N174 WeakPolarHBondContact O-CB 3.26Å; L169-N174 PolarHBondContact O-ND2 3.06Å; S171-N174 PolarHBondContact O-N 2.64Å; S171-N174 PolarHBondContact OG-ND2 3.01Å; S171-N174 VanDerWaalsContact OG-ND2 3.09Å; N174-T178 HydrophobicContact CB-CG2 4.18Å; N174-R196 PolarHBondContact O-NE 2.91Å; N174-R196 PolarHBondContact O-NH1 3.08Å
175	P	94.4	Very high	92.3	Very high	63 Å²	63	41.3 Å²	41.3	41%	0.409	23%	0.227	S	C	.	.	P	Polyproline II helix	trans	-74	166.5	174.1	30.5	-36.6	0	0	0	112.9	G173 G177 T178 V250	G173-P175 WeakPolarHBondContact O-CD 3.25Å; P175-G177 PolarHBondContact O-N 3.5Å; P175-T178 VanDerWaalsContact CD-OG1 3.26Å; P175-T178 WeakPolarHBondContact CD-OG1 3.21Å; P175-T178 WeakPolarHBondContact O-CB 3.32Å; P175-T178 PolarHBondContact O-N 3.07Å; P175-T178 VanDerWaalsContact O-N 3.15Å; P175-T178 PolarHBondContact O-OG1 3.36Å; P175-V250 HydrophobicContact CG-CG2 3.81Å
176	R	95.8	Very high	91.9	Very high	128 Å²	128	44.9 Å²	44.9	48%	0.483	25%	0.249	S	C	.	.	T	Hydrogen-bonded Turn	trans	-56.6	135.1	167.3	-176.3	179.9	-177.6	-166.8	1.9	110	D197 C245	R176-D197 IonicContact CZ-OD1 3.31Å; R176-D197 IonicContact NE-OD1 3.65Å; R176-D197 PolarHBondContact NE-OD1 3.02Å; R176-D197 IonicContact NH2-OD1 2.83Å; R176-D197 PolarHBondContact NH2-OD1 3.36Å; R176-C245 PolarHBondContact NH2-O 3.45Å
177	G	96.4	Very high	91.5	Very high	0 Å²	0	45.8 Å²	45.8	0%	0	26%	0.257	C	S	.	.	T	Hydrogen-bonded Turn	trans	86.4	4.7	-176.3	0	0	0	0	0	114.5	P175 R196 V249	P175-G177 PolarHBondContact O-N 3.5Å; G177-R196 PolarHBondContact N-O 3.36Å; G177-V249 PolarHBondContact O-N 3.21Å
178	T	97.9	Very high	91.4	Very high	0 Å²	0	54 Å²	54	0%	0	29%	0.294	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-60	135.5	163.5	-61.7	0	0	0	0	109.8	L169 N174 P175 I195 R196 V250 C252	L169-T178 HydrophobicContact CD2-CG2 3.8Å; L169-T178 WeakPolarHBondContact CD2-O 3.34Å; N174-T178 HydrophobicContact CB-CG2 4.18Å; P175-T178 VanDerWaalsContact CD-OG1 3.26Å; P175-T178 WeakPolarHBondContact CD-OG1 3.21Å; P175-T178 WeakPolarHBondContact O-CB 3.32Å; P175-T178 PolarHBondContact O-N 3.07Å; P175-T178 VanDerWaalsContact O-N 3.15Å; P175-T178 PolarHBondContact O-OG1 3.36Å; T178-I195 WeakPolarHBondContact O-CA 3.41Å; T178-R196 PolarHBondContact O-N 3.01Å; T178-V250 CarbonylContact C-O 3.59Å; T178-V250 VanDerWaalsContact CA-O 3.24Å; T178-V250 WeakPolarHBondContact CA-O 3.32Å; T178-V250 HydrophobicContact CG2-CG2 4.39Å; T178-V250 WeakPolarHBondContact OG1-CG2 3.48Å; T178-C252 VanDerWaalsContact CG2-CA 3.49Å; T178-C252 HydrophobicContact CG2-CB 3.89Å
179	Y	98.1	Very high	91.1	Very high	12 Å²	12	54.4 Å²	54.4	5%	0.047	31%	0.311	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-142.4	161.5	-171.9	72	-81.8	0	0	0	114.2	W155 L193 S194 V234 L248 V250 P251 C252	W155-Y179 HydrophobicContact CB-CD2 4.29Å; W155-Y179 HydrophobicContact CB-CE2 3.58Å; W155-Y179 HydrophobicContact CG-CE2 4.03Å; Y179-L193 HydrophobicContact CD2-CD1 4Å; Y179-S194 CarbonylContact C-O 3.57Å; Y179-S194 VanDerWaalsContact CA-O 3.23Å; Y179-S194 WeakPolarHBondContact CA-O 3.38Å; Y179-V234 HydrophobicContact CE2-CG1 3.78Å; Y179-V234 HydrophobicContact CE2-CG2 4.36Å; Y179-V234 WeakPolarHBondContact OH-CG1 3.44Å; Y179-L248 HydrophobicContact CD1-CB 3.63Å; Y179-L248 HydrophobicContact CD1-CD2 4.1Å; Y179-L248 HydrophobicContact CD1-CG 4.27Å; Y179-L248 HydrophobicContact CD2-CD1 4Å; Y179-L248 HydrophobicContact CD2-CD2 4.23Å; Y179-L248 HydrophobicContact CD2-CG 4.49Å; Y179-L248 HydrophobicContact CE1-CB 3.67Å; Y179-L248 HydrophobicContact CE2-CD1 4.04Å; Y179-L248 HydrophobicContact CG-CB 4.11Å; Y179-L248 HydrophobicContact CG-CD1 4.25Å; Y179-L248 HydrophobicContact CG-CD2 3.76Å; Y179-L248 HydrophobicContact CG-CG 4.24Å; Y179-V250 WeakPolarHBondContact CD1-O 3.38Å; Y179-V250 WeakPolarHBondContact CE1-O 3.4Å; Y179-V250 PolarHBondContact N-O 2.8Å; Y179-P251 HydrophobicContact CE1-CG 4.34Å; Y179-P251 CarbonylContact O-C 3.58Å; Y179-P251 WeakPolarHBondContact O-CA 3.48Å; Y179-C252 WeakPolarHBondContact O-CB 3.49Å; Y179-C252 PolarHBondContact O-N 3.35Å
180	L	97.6	Very high	91	Very high	0 Å²	0	54.9 Å²	54.9	0%	0	32%	0.315	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-148.7	156.8	168.4	60.5	84.4	0	0	0	111.3	W155 F157 L160 A165 L169 R182 S194 C252	W155-L180 WeakPolarHBondContact O-CA 3.11Å; F157-L180 HydrophobicContact CD1-CD2 4.31Å; F157-L180 HydrophobicContact CD2-CB 3.43Å; F157-L180 VanDerWaalsContact CD2-CB 3.43Å; F157-L180 HydrophobicContact CD2-CD2 4.26Å; F157-L180 HydrophobicContact CD2-CG 4.3Å; F157-L180 HydrophobicContact CE1-CD2 4.3Å; F157-L180 HydrophobicContact CE2-CB 3.49Å; F157-L180 VanDerWaalsContact CE2-CB 3.49Å; F157-L180 HydrophobicContact CE2-CD2 4.28Å; F157-L180 HydrophobicContact CE2-CG 4.49Å; F157-L180 HydrophobicContact CG-CB 4.16Å; F157-L180 HydrophobicContact CG-CD2 4.26Å; F157-L180 HydrophobicContact CZ-CB 4.25Å; F157-L180 HydrophobicContact CZ-CD2 4.27Å; L160-L180 HydrophobicContact CD2-CD1 4.24Å; L160-L180 HydrophobicContact CD2-CD2 3.97Å; A165-L180 HydrophobicContact CB-CD1 3.88Å; A165-L180 HydrophobicContact CB-CD2 4.13Å; L169-L180 HydrophobicContact CD1-CD2 4.19Å; L169-L180 HydrophobicContact CD1-CG 4.2Å; L169-L180 HydrophobicContact CD2-CD2 4.19Å; L169-L180 HydrophobicContact CD2-CG 4.39Å; L169-L180 HydrophobicContact CG-CD2 3.92Å; L169-L180 HydrophobicContact CG-CG 4.35Å; L180-R182 HydrophobicContact CD1-CB 4.22Å; L180-R182 HydrophobicContact CD1-CG 4.22Å; L180-S194 PolarHBondContact N-O 2.77Å; L180-S194 PolarHBondContact O-N 2.87Å; L180-C252 HydrophobicContact CB-CB 4.13Å; L180-C252 HydrophobicContact CD2-CB 3.98Å
181	I	97.3	Very high	91.2	Very high	0 Å²	0	52.8 Å²	52.8	0%	0	30%	0.303	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-112.7	136.5	169.4	-62.9	-176.8	0	0	0	109	W155 Y156 F157 F191 S192 L193 I211 V234	W155-I181 HydrophobicContact CE3-CB 3.72Å; W155-I181 HydrophobicContact CE3-CD1 3.7Å; W155-I181 HydrophobicContact CE3-CG1 3.84Å; W155-I181 HydrophobicContact CH2-CD1 4.38Å; W155-I181 HydrophobicContact CZ3-CB 3.81Å; W155-I181 HydrophobicContact CZ3-CD1 3.55Å; W155-I181 HydrophobicContact CZ3-CG1 4.04Å; W155-I181 HydrophobicContact CZ3-CG2 4.23Å; W155-I181 PolarHBondContact O-N 2.99Å; Y156-I181 CarbonylContact C-O 3.57Å; Y156-I181 WeakPolarHBondContact CA-O 3.23Å; Y156-I181 HydrophobicContact CD2-CG2 4.21Å; F157-I181 PolarHBondContact N-O 2.85Å; I181-F191 HydrophobicContact CG2-CB 3.98Å; I181-F191 HydrophobicContact CG2-CD1 4.3Å; I181-F191 HydrophobicContact CG2-CG 4.42Å; I181-S192 WeakPolarHBondContact CA-O 2.99Å; I181-L193 HydrophobicContact CD1-CD1 4.38Å; I181-L193 HydrophobicContact CG1-CB 4.46Å; I181-L193 HydrophobicContact CG1-CD1 3.82Å; I181-I211 HydrophobicContact CD1-CD1 3.75Å; I181-I211 HydrophobicContact CG1-CD1 4.17Å; I181-I211 HydrophobicContact CG2-CD1 4.04Å; I181-V234 HydrophobicContact CD1-CG2 3.51Å
182	R	96.1	Very high	91.8	Very high	0 Å²	0	51.6 Å²	51.6	0%	0	29%	0.294	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-138	163.2	-179.8	62.3	-166.7	-177.6	80	-2	110.3	G158 L160 R162 L180 E185 F191 S192 S194	G158-R182 CarbonylContact O-C 3.46Å; G158-R182 WeakPolarHBondContact O-CA 3.43Å; L160-R182 HydrophobicContact CB-CB 4.15Å; L160-R182 VanDerWaalsContact O-CD 3.32Å; L160-R182 WeakPolarHBondContact O-CD 3.45Å; R162-R182 VanDerWaalsContact CA-CZ 3.5Å; R162-R182 VanDerWaalsContact CB-NH2 3.33Å; L180-R182 HydrophobicContact CD1-CB 4.22Å; L180-R182 HydrophobicContact CD1-CG 4.22Å; R182-E185 IonicContact CZ-OE2 2.68Å; R182-E185 IonicContact NH1-OE2 3.73Å; R182-E185 PolarHBondContact NH1-OE2 3.13Å; R182-E185 IonicContact NH2-OE2 2.74Å; R182-F191 CarbonylContact O-C 3.32Å; R182-F191 VanDerWaalsContact O-CA 3.3Å; R182-F191 WeakPolarHBondContact O-CA 3.3Å; R182-S192 PolarHBondContact N-O 3.4Å; R182-S192 PolarHBondContact O-N 2.91Å; R182-S194 PolarHBondContact NE-OG 3.05Å
183	E	94.9	Very high	92.5	Very high	72 Å²	72	44.5 Å²	44.5	34%	0.336	25%	0.251	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-61.2	144	169.3	-67.1	-178.6	-149.6	0	0	110.1	Y156 G158 K159 F191	Y156-E183 PolarHBondContact OH-OE1 3.08Å; G158-E183 PolarHBondContact O-N 2.91Å; K159-E183 WeakPolarHBondContact CE-OE2 3.41Å; K159-E183 VanDerWaalsContact CG-CD 3.46Å; K159-E183 HydrophobicContact CG-CG 4.43Å; K159-E183 WeakPolarHBondContact CG-OE1 3.37Å; K159-E183 WeakPolarHBondContact CG-OE2 3.26Å; E183-F191 HydrophobicContact CG-CE1 4.34Å
184	S	91.4	Very high	93.1	Very high	11 Å²	11	41.1 Å²	41.1	8%	0.077	22%	0.216	C	C	.	.			trans	-79.3	122.4	177.5	-176.8	0	0	0	0	110.5	T186 T187 A190 Y537	S184-T186 VanDerWaalsContact C-N 3.28Å; S184-T186 PolarHBondContact O-N 3.08Å; S184-T186 PolarHBondContact OG-OG1 3.15Å; S184-T187 PolarHBondContact OG-N 2.87Å; S184-A190 WeakPolarHBondContact CB-O 3.23Å; S184-A190 PolarHBondContact N-O 2.91Å; S184-Y537 PolarHBondContact OG-OH 3.49Å
185	E	86.9	Confident	93.4	Very high	116 Å²	116	40 Å²	40	54%	0.542	21%	0.21	S	C	.	.	S	Bend	trans	-67.9	-29.8	175.4	-69	154.4	120.5	0	0	112.3	G161 R162 R182	G161-E185 WeakPolarHBondContact CA-OE1 3.28Å; R162-E185 VanDerWaalsContact CB-OE2 3.23Å; R162-E185 WeakPolarHBondContact CB-OE2 3.27Å; R162-E185 VanDerWaalsContact N-CD 3.27Å; R162-E185 PolarHBondContact N-OE1 3.45Å; R162-E185 PolarHBondContact N-OE2 2.98Å; R182-E185 IonicContact CZ-OE2 2.68Å; R182-E185 IonicContact NH1-OE2 3.73Å; R182-E185 PolarHBondContact NH1-OE2 3.13Å; R182-E185 IonicContact NH2-OE2 2.74Å
186	T	84.8	Confident	93.5	Very high	75 Å²	75	38.2 Å²	38.2	46%	0.46	20%	0.195	S	C	.	.	S	Bend	trans	-91.1	-13.4	-175.6	58.3	0	0	0	0	113.2	S184 Y537	S184-T186 VanDerWaalsContact C-N 3.28Å; S184-T186 PolarHBondContact O-N 3.08Å; S184-T186 PolarHBondContact OG-OG1 3.15Å; T186-Y537 HydrophobicContact CG2-CE2 4.27Å
187	T	83.9	Confident	93.4	Very high	54 Å²	54	32.2 Å²	32.2	33%	0.331	17%	0.173	S	C	.	.	S	Bend	trans	-148.3	107.7	-176.5	-62.2	0	0	0	0	111.1	S184 G189 A190 K210	S184-T187 PolarHBondContact OG-N 2.87Å; T187-G189 PolarHBondContact O-N 3.25Å; T187-A190 HydrophobicContact CG2-CB 3.77Å; T187-A190 WeakPolarHBondContact O-CB 3.35Å; T187-A190 PolarHBondContact O-N 3.3Å; T187-K210 WeakPolarHBondContact OG1-CE 3.28Å; T187-K210 PolarHBondContact OG1-NZ 3.45Å
188	K	85.3	Confident	93.3	Very high	215 Å²	215	37.6 Å²	37.6	94%	0.935	19%	0.193	S	C	*	.	T	Hydrogen-bonded Turn	trans	-55.4	128.1	179.7	-170.3	175.9	-178.3	179	0	111.1	A190	K188-A190 VanDerWaalsContact C-N 3.26Å; K188-A190 PolarHBondContact O-N 3.23Å
189	G	84.7	Confident	92.9	Very high	58 Å²	58	39.7 Å²	39.7	60%	0.598	20%	0.204	S	C	*	.	T	Hydrogen-bonded Turn	trans	80.2	-3.1	179.3	0	0	0	0	0	115.4	T187	T187-G189 PolarHBondContact O-N 3.25Å
190	A	90.7	Very high	92.4	Very high	9 Å²	9	46.1 Å²	46.1	7%	0.074	24%	0.239	C	C	.	.			trans	-92.6	166.5	169.5	0	0	0	0	0	111.1	S184 T187 K188	S184-A190 WeakPolarHBondContact CB-O 3.23Å; S184-A190 PolarHBondContact N-O 2.91Å; T187-A190 HydrophobicContact CG2-CB 3.77Å; T187-A190 WeakPolarHBondContact O-CB 3.35Å; T187-A190 PolarHBondContact O-N 3.3Å; K188-A190 VanDerWaalsContact C-N 3.26Å; K188-A190 PolarHBondContact O-N 3.23Å
191	F	95.2	Very high	91.9	Very high	27 Å²	27	52.6 Å²	52.6	12%	0.118	28%	0.279	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-118.4	167.1	177.1	-59.4	-86.3	0	0	0	111.1	Y156 I181 R182 E183 I211 Y219 L230	Y156-F191 AromaticContact CE2-CD1 3.86Å; Y156-F191 HydrophobicContact CE2-CD1 3.86Å; Y156-F191 AromaticContact CE2-CE1 3.62Å; Y156-F191 HydrophobicContact CE2-CE1 3.62Å; I181-F191 HydrophobicContact CG2-CB 3.98Å; I181-F191 HydrophobicContact CG2-CD1 4.3Å; I181-F191 HydrophobicContact CG2-CG 4.42Å; R182-F191 CarbonylContact O-C 3.32Å; R182-F191 VanDerWaalsContact O-CA 3.3Å; R182-F191 WeakPolarHBondContact O-CA 3.3Å; E183-F191 HydrophobicContact CG-CE1 4.34Å; F191-I211 HydrophobicContact CB-CB 4.03Å; F191-I211 HydrophobicContact CB-CD1 4.09Å; F191-I211 HydrophobicContact CB-CG1 4.45Å; F191-I211 PolarHBondContact N-O 3.14Å; F191-I211 PolarHBondContact O-N 2.96Å; F191-Y219 HydrophobicContact CD2-CD1 4.34Å; F191-Y219 AromaticContact CD2-CE1 4Å; F191-Y219 HydrophobicContact CD2-CE1 4Å; F191-Y219 HydrophobicContact CE2-CD1 4.5Å; F191-Y219 AromaticContact CE2-CE1 3.72Å; F191-Y219 HydrophobicContact CE2-CE1 3.72Å; F191-L230 HydrophobicContact CD1-CD1 4.31Å; F191-L230 HydrophobicContact CD2-CD1 3.73Å; F191-L230 HydrophobicContact CE1-CD1 4.35Å; F191-L230 HydrophobicContact CE2-CD1 3.78Å; F191-L230 HydrophobicContact CG-CD1 4Å; F191-L230 HydrophobicContact CZ-CD1 4.09Å
192	S	96.9	Very high	91.1	Very high	0 Å²	0	57.5 Å²	57.5	0%	0	30%	0.3	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-132.5	125.7	174.4	-63.2	0	0	0	0	109.7	I181 R182 Y209 Y537	I181-S192 WeakPolarHBondContact CA-O 2.99Å; R182-S192 PolarHBondContact N-O 3.4Å; R182-S192 PolarHBondContact O-N 2.91Å; S192-Y209 CarbonylContact C-O 3.43Å; S192-Y209 WeakPolarHBondContact CA-O 3.1Å; S192-Y537 WeakPolarHBondContact OG-CE1 3.33Å; S192-Y537 PolarHBondContact OG-OH 3.04Å
193	L	97.4	Very high	90.7	Very high	0 Å²	0	58.6 Å²	58.6	0%	0	31%	0.312	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-87.2	124.6	168.3	174.7	62.6	0	0	0	108.3	Y179 I181 I195 H208 Y209 I211 I221 L244 L248	Y179-L193 HydrophobicContact CD2-CD1 4Å; I181-L193 HydrophobicContact CD1-CD1 4.38Å; I181-L193 HydrophobicContact CG1-CB 4.46Å; I181-L193 HydrophobicContact CG1-CD1 3.82Å; L193-I195 HydrophobicContact CD1-CG1 4.23Å; L193-I195 HydrophobicContact CD2-CD1 3.93Å; L193-I195 HydrophobicContact CD2-CG1 4.34Å; L193-I195 HydrophobicContact CG-CD1 4.03Å; L193-I195 HydrophobicContact CG-CG1 3.89Å; L193-H208 CarbonylContact O-C 3.59Å; L193-H208 WeakPolarHBondContact O-CA 3.34Å; L193-Y209 PolarHBondContact N-O 3.03Å; L193-Y209 PolarHBondContact O-N 2.94Å; L193-I211 HydrophobicContact CB-CD1 4.04Å; L193-I211 HydrophobicContact CB-CG1 4.19Å; L193-I221 HydrophobicContact CB-CD1 4.43Å; L193-I221 HydrophobicContact CD2-CD1 3.7Å; L193-L244 HydrophobicContact CD2-CD1 3.87Å; L193-L248 HydrophobicContact CD1-CD1 4.38Å; L193-L248 HydrophobicContact CD1-CD2 4.15Å; L193-L248 HydrophobicContact CD2-CD1 4.48Å; L193-L248 HydrophobicContact CD2-CD2 4.23Å
194	S	97.9	Very high	90.5	Very high	0 Å²	0	59.2 Å²	59.2	0%	0	32%	0.317	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-117.6	130.1	178.7	-49.5	0	0	0	0	109	Y179 L180 R182 K207 H208	Y179-S194 CarbonylContact C-O 3.57Å; Y179-S194 VanDerWaalsContact CA-O 3.23Å; Y179-S194 WeakPolarHBondContact CA-O 3.38Å; L180-S194 PolarHBondContact N-O 2.77Å; L180-S194 PolarHBondContact O-N 2.87Å; R182-S194 PolarHBondContact NE-OG 3.05Å; S194-K207 WeakPolarHBondContact CA-O 3.46Å; S194-H208 WeakPolarHBondContact CB-ND1 3.3Å; S194-H208 PolarHBondContact OG-ND1 3.37Å
195	I	97.5	Very high	90.5	Very high	0 Å²	0	59.9 Å²	59.9	0%	0	32%	0.319	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-132.9	130.4	-171.3	-46.4	174.8	0	0	0	109.8	T178 L193 V206 K207 Y209 L244 L248	T178-I195 WeakPolarHBondContact O-CA 3.41Å; L193-I195 HydrophobicContact CD1-CG1 4.23Å; L193-I195 HydrophobicContact CD2-CD1 3.93Å; L193-I195 HydrophobicContact CD2-CG1 4.34Å; L193-I195 HydrophobicContact CG-CD1 4.03Å; L193-I195 HydrophobicContact CG-CG1 3.89Å; I195-V206 WeakPolarHBondContact O-CA 3.41Å; I195-K207 PolarHBondContact N-O 3.28Å; I195-K207 PolarHBondContact O-N 2.99Å; I195-Y209 HydrophobicContact CD1-CD2 3.95Å; I195-Y209 HydrophobicContact CD1-CE2 3.71Å; I195-Y209 HydrophobicContact CG1-CD2 4.43Å; I195-Y209 HydrophobicContact CG1-CE2 4.35Å; I195-L244 HydrophobicContact CD1-CB 4.48Å; I195-L244 HydrophobicContact CD1-CD1 3.9Å; I195-L248 HydrophobicContact CD1-CD2 3.56Å; I195-L248 HydrophobicContact CG1-CD2 3.9Å; I195-L248 HydrophobicContact CG2-CD2 4.48Å
196	R	96.4	Very high	90.8	Very high	25 Å²	25	55.2 Å²	55.2	9%	0.094	30%	0.298	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-70.1	126	168.9	-177	-178.8	-178.7	150.8	-10.9	109.9	L169 S171 N174 G177 T178 D204	L169-R196 HydrophobicContact CB-CB 4.41Å; L169-R196 WeakPolarHBondContact O-CD 3.35Å; L169-R196 PolarHBondContact O-NH1 3Å; S171-R196 PolarHBondContact O-NH1 3.47Å; N174-R196 PolarHBondContact O-NE 2.91Å; N174-R196 PolarHBondContact O-NH1 3.08Å; G177-R196 PolarHBondContact N-O 3.36Å; T178-R196 PolarHBondContact O-N 3.01Å; R196-D204 IonicContact CZ-OD1 2.84Å; R196-D204 IonicContact NE-OD1 3.33Å; R196-D204 PolarHBondContact NE-OD1 3.43Å; R196-D204 VanDerWaalsContact NH2-CG 3.27Å; R196-D204 IonicContact NH2-OD1 3.46Å; R196-D204 PolarHBondContact NH2-OD1 3.12Å; R196-D204 IonicContact NH2-OD2 3.69Å
197	D	94.9	Very high	91.2	Very high	3 Å²	3	53.9 Å²	53.9	2%	0.016	29%	0.286	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-130.4	170.6	177.4	-162.2	23.3	0	0	0	110.3	R176 H205 K207 C245	R176-D197 IonicContact CZ-OD1 3.31Å; R176-D197 IonicContact NE-OD1 3.65Å; R176-D197 PolarHBondContact NE-OD1 3.02Å; R176-D197 IonicContact NH2-OD1 2.83Å; R176-D197 PolarHBondContact NH2-OD1 3.36Å; D197-H205 PolarHBondContact N-O 3.05Å; D197-H205 PolarHBondContact O-N 3.47Å; D197-H205 VanDerWaalsContact O-O 3.08Å; D197-H205 IonicContact OD2-NE2 2.92Å; D197-K207 HydrophobicContact CB-CD 4.41Å; D197-K207 IonicContact OD2-NZ 3.85Å; D197-K207 PolarHBondContact OD2-NZ 2.91Å; D197-C245 VanDerWaalsContact OD2-CB 3.28Å; D197-C245 WeakPolarHBondContact OD2-CB 3.39Å
198	W	93	Very high	91.7	Very high	113 Å²	113	51.4 Å²	51.4	43%	0.428	27%	0.271	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-145.8	138.5	177.5	179.4	96.4	0	0	0	110.1	D200 G203	W198-D200 WeakPolarHBondContact CH2-OD1 3.37Å; W198-G203 WeakPolarHBondContact CA-O 3.47Å; W198-G203 VanDerWaalsContact CD1-C 3.45Å
199	D	90	Very high	92.2	Very high	44 Å²	44	41.5 Å²	41.5	24%	0.235	23%	0.228	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-142.5	163.7	169	70.1	56.8	0	0	0	111.8	V201 K202 G203 H205	D199-V201 PolarHBondContact O-N 2.99Å; D199-V201 WeakPolarHBondContact OD1-CA 3.47Å; D199-V201 WeakPolarHBondContact OD1-CB 3.27Å; D199-V201 PolarHBondContact OD1-N 3.09Å; D199-K202 PolarHBondContact OD1-N 3.38Å; D199-G203 PolarHBondContact N-O 3.45Å; D199-G203 VanDerWaalsContact O-CA 3.23Å; D199-G203 WeakPolarHBondContact O-CA 3.28Å; D199-G203 PolarHBondContact O-N 2.91Å; D199-H205 IonicContact OD2-CE1 3.03Å; D199-H205 PolarHBondContact OD2-CE1 3.08Å; D199-H205 IonicContact OD2-ND1 2.95Å; D199-H205 IonicContact OD2-NE2 3.86Å
200	D	88.4	Confident	92.6	Very high	146 Å²	146	40.9 Å²	40.9	78%	0.781	21%	0.209	S	C	*	.	T	Hydrogen-bonded Turn	trans	-64.5	-21.4	-175.9	-65.6	-57.9	0	0	0	114	W198	W198-D200 WeakPolarHBondContact CH2-OD1 3.37Å
201	V	85.3	Confident	92.7	Very high	137 Å²	137	40.5 Å²	40.5	83%	0.83	21%	0.205	S	C	*	.	T	Hydrogen-bonded Turn	trans	-91.8	-46.4	-173	-179.3	0	0	0	0	110.8	D199	D199-V201 PolarHBondContact O-N 2.99Å; D199-V201 WeakPolarHBondContact OD1-CA 3.47Å; D199-V201 WeakPolarHBondContact OD1-CB 3.27Å; D199-V201 PolarHBondContact OD1-N 3.09Å
202	K	81.3	Confident	92.4	Very high	103 Å²	103	45.4 Å²	45.4	45%	0.448	22%	0.223	S	C	.	.	T	Hydrogen-bonded Turn	trans	-99.4	-19.3	-173.8	-61	-175.3	-176	-174.6	0	112.8	D199 E534	D199-K202 PolarHBondContact OD1-N 3.38Å; K202-E534 WeakPolarHBondContact CE-OE1 3.48Å; K202-E534 IonicContact NZ-OE1 2.6Å; K202-E534 PolarHBondContact NZ-OE1 3.24Å; K202-E534 IonicContact NZ-OE2 2.61Å; K202-E534 PolarHBondContact NZ-OE2 2.64Å
203	G	88.6	Confident	92	Very high	23 Å²	23	51.1 Å²	51.1	24%	0.237	25%	0.248	C	C	.	.	E	Extended strand (participates in β ladder)	trans	68.1	-146.2	-167.4	0	0	0	0	0	111.5	W198 D199 H205	W198-G203 WeakPolarHBondContact CA-O 3.47Å; W198-G203 VanDerWaalsContact CD1-C 3.45Å; D199-G203 PolarHBondContact N-O 3.45Å; D199-G203 VanDerWaalsContact O-CA 3.23Å; D199-G203 WeakPolarHBondContact O-CA 3.28Å; D199-G203 PolarHBondContact O-N 2.91Å; G203-H205 PolarHBondContact O-N 3.34Å; G203-H205 PolarHBondContact O-ND1 2.97Å
204	D	89.7	Confident	91.3	Very high	84 Å²	84	53 Å²	53	45%	0.449	26%	0.258	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-64.2	125.9	176.1	-75.6	-74.7	0	0	0	111.3	L170 R196	L170-D204 HydrophobicContact CD2-CB 3.96Å; R196-D204 IonicContact CZ-OD1 2.84Å; R196-D204 IonicContact NE-OD1 3.33Å; R196-D204 PolarHBondContact NE-OD1 3.43Å; R196-D204 VanDerWaalsContact NH2-CG 3.27Å; R196-D204 IonicContact NH2-OD1 3.46Å; R196-D204 PolarHBondContact NH2-OD1 3.12Å; R196-D204 IonicContact NH2-OD2 3.69Å
205	H	90.8	Very high	90.7	Very high	25 Å²	25	61.6 Å²	61.6	12%	0.116	30%	0.304	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-149.4	176.8	178	63.5	-82	0	0	0	110.8	D197 D199 G203 K207	D197-H205 PolarHBondContact N-O 3.05Å; D197-H205 PolarHBondContact O-N 3.47Å; D197-H205 VanDerWaalsContact O-O 3.08Å; D197-H205 IonicContact OD2-NE2 2.92Å; D199-H205 IonicContact OD2-CE1 3.03Å; D199-H205 PolarHBondContact OD2-CE1 3.08Å; D199-H205 IonicContact OD2-ND1 2.95Å; D199-H205 IonicContact OD2-NE2 3.86Å; G203-H205 PolarHBondContact O-N 3.34Å; G203-H205 PolarHBondContact O-ND1 2.97Å; H205-K207 VanDerWaalsContact NE2-CE 3.34Å; H205-K207 WeakPolarHBondContact NE2-CE 3.44Å
206	V	93.9	Very high	89.9	Confident	19 Å²	19	66.9 Å²	66.9	12%	0.115	34%	0.34	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-125	134.5	179.4	177.4	0	0	0	0	110	E166 L169 L170 I195	E166-V206 HydrophobicContact CB-CG2 4.48Å; E166-V206 HydrophobicContact CG-CB 4.05Å; E166-V206 HydrophobicContact CG-CG1 4.27Å; E166-V206 HydrophobicContact CG-CG2 4.4Å; L169-V206 HydrophobicContact CB-CG2 3.84Å; L169-V206 HydrophobicContact CD1-CG1 3.6Å; L169-V206 HydrophobicContact CD1-CG2 4.12Å; L170-V206 HydrophobicContact CD1-CG2 4.26Å; L170-V206 HydrophobicContact CD2-CG2 3.98Å; L170-V206 HydrophobicContact CG-CG2 3.8Å; I195-V206 WeakPolarHBondContact O-CA 3.41Å
207	K	93.7	Very high	89.2	Confident	46 Å²	46	67.3 Å²	67.3	20%	0.2	35%	0.353	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-107.2	139.2	173.5	-74.5	174.4	175.7	158.2	0	110.4	S194 I195 D197 H205 Y209 C245 Q538	S194-K207 WeakPolarHBondContact CA-O 3.46Å; I195-K207 PolarHBondContact N-O 3.28Å; I195-K207 PolarHBondContact O-N 2.99Å; D197-K207 HydrophobicContact CB-CD 4.41Å; D197-K207 IonicContact OD2-NZ 3.85Å; D197-K207 PolarHBondContact OD2-NZ 2.91Å; H205-K207 VanDerWaalsContact NE2-CE 3.34Å; H205-K207 WeakPolarHBondContact NE2-CE 3.44Å; K207-Y209 HydrophobicContact CB-CE2 3.86Å; K207-C245 HydrophobicContact CD-CB 3.39Å; K207-Q538 HydrophobicContact CB-CG 4.38Å; K207-Q538 HydrophobicContact CG-CG 4.49Å
208	H	94.8	Very high	88.9	Confident	3 Å²	3	67.5 Å²	67.5	1%	0.014	36%	0.356	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-116.1	130.2	179.5	-54.2	-84.7	0	0	0	111	R162 E166 L193 S194 Y537 Q538	R162-H208 PolarHBondContact NE-NE2 3.49Å; R162-H208 PolarHBondContact NH2-CD2 2.94Å; E166-H208 IonicContact OE1-CE1 3.18Å; E166-H208 IonicContact OE1-NE2 3.68Å; E166-H208 PolarHBondContact OE1-NE2 3.21Å; E166-H208 VanDerWaalsContact OE1-NE2 3.1Å; L193-H208 CarbonylContact O-C 3.59Å; L193-H208 WeakPolarHBondContact O-CA 3.34Å; S194-H208 WeakPolarHBondContact CB-ND1 3.3Å; S194-H208 PolarHBondContact OG-ND1 3.37Å; H208-Y537 HydrophobicContact CB-CD1 4.06Å; H208-Y537 HydrophobicContact CB-CE1 4.17Å; H208-Q538 PolarHBondContact O-N 2.77Å
209	Y	94.3	Very high	88.9	Confident	7 Å²	7	64 Å²	64	3%	0.027	34%	0.343	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-118.2	129.4	176.8	-57.6	-94	0	0	0	108.8	S192 L193 I195 K207 I221 L244 C245 Q538 L543	S192-Y209 CarbonylContact C-O 3.43Å; S192-Y209 WeakPolarHBondContact CA-O 3.1Å; L193-Y209 PolarHBondContact N-O 3.03Å; L193-Y209 PolarHBondContact O-N 2.94Å; I195-Y209 HydrophobicContact CD1-CD2 3.95Å; I195-Y209 HydrophobicContact CD1-CE2 3.71Å; I195-Y209 HydrophobicContact CG1-CD2 4.43Å; I195-Y209 HydrophobicContact CG1-CE2 4.35Å; K207-Y209 HydrophobicContact CB-CE2 3.86Å; Y209-I221 HydrophobicContact CD1-CG2 4.3Å; Y209-L244 HydrophobicContact CD1-CD2 3.5Å; Y209-L244 HydrophobicContact CD2-CD2 3.98Å; Y209-L244 HydrophobicContact CE1-CD2 3.55Å; Y209-L244 HydrophobicContact CE2-CD2 4.05Å; Y209-L244 HydrophobicContact CG-CD2 3.73Å; Y209-C245 WeakPolarHBondContact OH-CB 3.37Å; Y209-C245 PolarHBondContact OH-N 3.44Å; Y209-C245 PolarHBondContact OH-SG 2.81Å; Y209-Q538 HydrophobicContact CD1-CB 3.78Å; Y209-Q538 HydrophobicContact CD1-CG 4.44Å; Y209-Q538 HydrophobicContact CE1-CB 3.54Å; Y209-Q538 HydrophobicContact CE1-CG 3.93Å; Y209-L543 HydrophobicContact CD1-CD1 4.29Å; Y209-L543 HydrophobicContact CE1-CD1 4.49Å; Y209-L543 HydrophobicContact CE1-CD2 4.48Å
210	K	93.1	Very high	89	Confident	45 Å²	45	63.7 Å²	63.7	20%	0.196	34%	0.338	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-79.7	124.7	178.8	-170.2	170.8	-174.7	171.1	0	109.3	T187 R212 Y537	T187-K210 WeakPolarHBondContact OG1-CE 3.28Å; T187-K210 PolarHBondContact OG1-NZ 3.45Å; K210-R212 HydrophobicContact CG-CG 4.43Å; K210-Y537 HydrophobicContact CB-CD1 3.83Å; K210-Y537 HydrophobicContact CB-CE1 4.02Å; K210-Y537 HydrophobicContact CB-CG 4.35Å
211	I	93.9	Very high	89.1	Confident	0 Å²	0	57.4 Å²	57.4	0%	0	31%	0.305	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-96.6	116.1	172.3	-47.1	173.8	0	0	0	107.6	I181 F191 L193 Y219 Y220 I221 L230 L233	I181-I211 HydrophobicContact CD1-CD1 3.75Å; I181-I211 HydrophobicContact CG1-CD1 4.17Å; I181-I211 HydrophobicContact CG2-CD1 4.04Å; F191-I211 HydrophobicContact CB-CB 4.03Å; F191-I211 HydrophobicContact CB-CD1 4.09Å; F191-I211 HydrophobicContact CB-CG1 4.45Å; F191-I211 PolarHBondContact N-O 3.14Å; F191-I211 PolarHBondContact O-N 2.96Å; L193-I211 HydrophobicContact CB-CD1 4.04Å; L193-I211 HydrophobicContact CB-CG1 4.19Å; I211-Y219 HydrophobicContact CG2-CD1 4.36Å; I211-Y220 CarbonylContact C-O 3.58Å; I211-Y220 WeakPolarHBondContact CA-O 3.26Å; I211-I221 HydrophobicContact CG1-CD1 4.33Å; I211-I221 HydrophobicContact CG1-CG1 3.98Å; I211-L230 HydrophobicContact CD1-CD2 3.9Å; I211-L230 HydrophobicContact CG2-CD2 3.81Å; I211-L233 HydrophobicContact CD1-CD1 4.45Å; I211-L233 HydrophobicContact CD1-CD2 4.33Å; I211-L233 HydrophobicContact CG2-CD1 3.72Å
212	R	88.7	Confident	89.1	Confident	130 Å²	130	51.3 Å²	51.3	49%	0.491	27%	0.268	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-94.5	150.8	178.7	-64.9	-179.1	-178.5	-131.5	4.5	109.9	K210 Y219 Y220	K210-R212 HydrophobicContact CG-CG 4.43Å; R212-Y219 VanDerWaalsContact O-CA 3.31Å; R212-Y219 WeakPolarHBondContact O-CA 3.34Å; R212-Y220 HydrophobicContact CB-CD1 4.16Å; R212-Y220 HydrophobicContact CB-CE1 3.6Å; R212-Y220 HydrophobicContact CB-CE2 4.02Å; R212-Y220 WeakPolarHBondContact CD-OH 3.47Å; R212-Y220 HydrophobicContact CG-CE2 4.46Å; R212-Y220 PolarHBondContact N-O 3.37Å; R212-Y220 PolarHBondContact O-N 3.35Å
213	K	87.4	Confident	89.1	Confident	120 Å²	120	50.8 Å²	50.8	52%	0.522	27%	0.273	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-100.4	137.7	172.5	-166.1	176.6	-179.1	178.4	0	109	G218 Y219	K213-G218 WeakPolarHBondContact CA-O 3.33Å; K213-G218 WeakPolarHBondContact CG-O 3.2Å; K213-Y219 HydrophobicContact CB-CD1 4.48Å; K213-Y219 HydrophobicContact CB-CE1 4.4Å; K213-Y219 HydrophobicContact CD-CE1 4.26Å; K213-Y219 HydrophobicContact CG-CD1 4.44Å; K213-Y219 HydrophobicContact CG-CE1 4.07Å
214	L	84.3	Confident	88.9	Confident	40 Å²	40	58.7 Å²	58.7	21%	0.209	30%	0.296	C	S	.	.	P	Polyproline II helix	trans	-84	150.4	173.2	-67.6	162.1	0	0	0	110.4	S216 G217 G218 Y220 Q226	L214-S216 PolarHBondContact O-N 2.77Å; L214-G217 PolarHBondContact O-N 3.42Å; L214-G218 PolarHBondContact N-O 3.39Å; L214-Y220 HydrophobicContact CD1-CD1 4.19Å; L214-Y220 HydrophobicContact CD2-CD1 3.82Å; L214-Y220 HydrophobicContact CD2-CE1 3.42Å; L214-Y220 VanDerWaalsContact CD2-CE1 3.42Å; L214-Y220 HydrophobicContact CG-CD1 3.69Å; L214-Y220 HydrophobicContact CG-CE1 3.69Å; L214-Q226 HydrophobicContact CD1-CB 4.26Å; L214-Q226 HydrophobicContact CD1-CG 4.11Å; L214-Q226 VanDerWaalsContact CD1-OE1 3.25Å
215	D	83.7	Confident	88.8	Confident	181 Å²	181	55.6 Å²	55.6	97%	0.968	28%	0.282	S	S	*	.	T	Hydrogen-bonded Turn	trans	-62.9	-32.3	176.3	-63.2	-26.3	0	0	0	111.9	G217	D215-G217 PolarHBondContact O-N 3.48Å
216	S	82.1	Confident	88.9	Confident	110 Å²	110	59.9 Å²	59.9	77%	0.769	30%	0.302	S	S	*	.	T	Hydrogen-bonded Turn	trans	-73.9	-0.8	175.6	54.5	0	0	0	0	114.3	L214	L214-S216 PolarHBondContact O-N 2.77Å
217	G	80.6	Confident	88.9	Confident	35 Å²	35	59.9 Å²	59.9	36%	0.361	30%	0.301	S	S	.	.	S	Bend	trans	84.9	153.5	-162.9	0	0	0	0	0	111.6	L214 D215	L214-G217 PolarHBondContact O-N 3.42Å; D215-G217 PolarHBondContact O-N 3.48Å
218	G	88.8	Confident	88.9	Confident	7 Å²	7	63.6 Å²	63.6	7%	0.072	32%	0.322	C	S	.	.			trans	103.4	170.9	-175.5	0	0	0	0	0	114.6	K213 L214 F227	K213-G218 WeakPolarHBondContact CA-O 3.33Å; K213-G218 WeakPolarHBondContact CG-O 3.2Å; L214-G218 PolarHBondContact N-O 3.39Å; G218-F227 CarbonylContact C-O 3.58Å; G218-F227 WeakPolarHBondContact CA-O 3.47Å
219	Y	93.4	Very high	88.9	Confident	40 Å²	40	65.9 Å²	65.9	16%	0.157	34%	0.337	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-136.4	146.1	-168.1	-58.4	-81.4	0	0	0	111.3	F191 I211 R212 K213 F227 L230	F191-Y219 HydrophobicContact CD2-CD1 4.34Å; F191-Y219 AromaticContact CD2-CE1 4Å; F191-Y219 HydrophobicContact CD2-CE1 4Å; F191-Y219 HydrophobicContact CE2-CD1 4.5Å; F191-Y219 AromaticContact CE2-CE1 3.72Å; F191-Y219 HydrophobicContact CE2-CE1 3.72Å; I211-Y219 HydrophobicContact CG2-CD1 4.36Å; R212-Y219 VanDerWaalsContact O-CA 3.31Å; R212-Y219 WeakPolarHBondContact O-CA 3.34Å; K213-Y219 HydrophobicContact CB-CD1 4.48Å; K213-Y219 HydrophobicContact CB-CE1 4.4Å; K213-Y219 HydrophobicContact CD-CE1 4.26Å; K213-Y219 HydrophobicContact CG-CD1 4.44Å; K213-Y219 HydrophobicContact CG-CE1 4.07Å; Y219-F227 PolarHBondContact N-O 3.33Å; Y219-F227 PolarHBondContact O-N 3.06Å; Y219-L230 HydrophobicContact CD1-CD1 4.36Å; Y219-L230 HydrophobicContact CD1-CD2 3.83Å; Y219-L230 HydrophobicContact CD1-CG 3.97Å; Y219-L230 HydrophobicContact CD2-CD2 4.3Å; Y219-L230 HydrophobicContact CD2-CG 3.96Å; Y219-L230 HydrophobicContact CE1-CD1 4.17Å; Y219-L230 HydrophobicContact CE1-CD2 4.44Å; Y219-L230 HydrophobicContact CE1-CG 4.14Å; Y219-L230 HydrophobicContact CE2-CG 4.12Å; Y219-L230 HydrophobicContact CG-CD2 3.75Å; Y219-L230 HydrophobicContact CG-CG 3.88Å
220	Y	91.8	Very high	88.9	Confident	37 Å²	37	65.7 Å²	65.7	15%	0.145	34%	0.336	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-155.6	156.6	175.2	68.7	-82	0	0	0	112.3	I211 R212 L214 T223 A225	I211-Y220 CarbonylContact C-O 3.58Å; I211-Y220 WeakPolarHBondContact CA-O 3.26Å; R212-Y220 HydrophobicContact CB-CD1 4.16Å; R212-Y220 HydrophobicContact CB-CE1 3.6Å; R212-Y220 HydrophobicContact CB-CE2 4.02Å; R212-Y220 WeakPolarHBondContact CD-OH 3.47Å; R212-Y220 HydrophobicContact CG-CE2 4.46Å; R212-Y220 PolarHBondContact N-O 3.37Å; R212-Y220 PolarHBondContact O-N 3.35Å; L214-Y220 HydrophobicContact CD1-CD1 4.19Å; L214-Y220 HydrophobicContact CD2-CD1 3.82Å; L214-Y220 HydrophobicContact CD2-CE1 3.42Å; L214-Y220 VanDerWaalsContact CD2-CE1 3.42Å; L214-Y220 HydrophobicContact CG-CD1 3.69Å; L214-Y220 HydrophobicContact CG-CE1 3.69Å; Y220-T223 HydrophobicContact CD2-CG2 4.27Å; Y220-T223 HydrophobicContact CE2-CG2 3.79Å; Y220-A225 VanDerWaalsContact CB-O 3.31Å; Y220-A225 WeakPolarHBondContact CB-O 3.46Å
221	I	90.1	Very high	89	Confident	14 Å²	14	66.8 Å²	66.8	7%	0.072	34%	0.342	C	S	.	.	S	Bend	trans	-102.5	-47.6	166.2	-65.6	173.7	0	0	0	109.3	L193 Y209 I211 L233 Y237 L244 L543	L193-I221 HydrophobicContact CB-CD1 4.43Å; L193-I221 HydrophobicContact CD2-CD1 3.7Å; Y209-I221 HydrophobicContact CD1-CG2 4.3Å; I211-I221 HydrophobicContact CG1-CD1 4.33Å; I211-I221 HydrophobicContact CG1-CG1 3.98Å; I221-L233 HydrophobicContact CD1-CD2 4.37Å; I221-L233 HydrophobicContact CG1-CD1 4.37Å; I221-Y237 HydrophobicContact CD1-CD2 4.35Å; I221-Y237 HydrophobicContact CD1-CE2 3.78Å; I221-Y237 HydrophobicContact CG1-CE2 4.44Å; I221-L244 HydrophobicContact CD1-CD2 4.2Å; I221-L543 HydrophobicContact CG2-CD1 3.72Å
222	T	85.4	Confident	89	Confident	9 Å²	9	71 Å²	71	6%	0.055	36%	0.362	C	S	.	.	S	Bend	trans	-111.9	144.2	171	174	0	0	0	0	109.6	R224 A225 L543	T222-R224 HydrophobicContact CG2-CB 4.32Å; T222-R224 PolarHBondContact O-N 2.83Å; T222-R224 VanDerWaalsContact O-N 3.12Å; T222-R224 PolarHBondContact OG1-N 2.74Å; T222-A225 HydrophobicContact CG2-CB 4.18Å; T222-A225 PolarHBondContact O-N 2.81Å; T222-A225 VanDerWaalsContact O-N 3.17Å; T222-A225 VanDerWaalsContact O-O 3.04Å; T222-L543 HydrophobicContact CG2-CB 4.29Å
223	T	82.4	Confident	89.4	Confident	92 Å²	92	64.8 Å²	64.8	56%	0.564	34%	0.338	S	S	*	.	T	Hydrogen-bonded Turn	trans	-64.1	-16.7	-179.8	51.6	0	0	0	0	113.2	Y220 A225 Q226	Y220-T223 HydrophobicContact CD2-CG2 4.27Å; Y220-T223 HydrophobicContact CE2-CG2 3.79Å; T223-A225 VanDerWaalsContact C-N 3.33Å; T223-Q226 PolarHBondContact O-NE2 2.82Å
224	R	84.2	Confident	89.8	Confident	188 Å²	188	59.5 Å²	59.5	71%	0.709	32%	0.316	S	S	*	.	T	Hydrogen-bonded Turn	trans	-71.8	-22.2	176.6	-62.4	177.7	-179.5	166.3	-3.3	113.8	T222 L543	T222-R224 HydrophobicContact CG2-CB 4.32Å; T222-R224 PolarHBondContact O-N 2.83Å; T222-R224 VanDerWaalsContact O-N 3.12Å; T222-R224 PolarHBondContact OG1-N 2.74Å; R224-L543 PolarHBondContact NH1-O 2.86Å
225	A	87.6	Confident	90.4	Very high	19 Å²	19	62.7 Å²	62.7	16%	0.157	33%	0.33	C	S	.	.	S	Bend	trans	-135.3	108.6	-177.1	0	0	0	0	0	110.1	Y220 T222 T223 F227	Y220-A225 VanDerWaalsContact CB-O 3.31Å; Y220-A225 WeakPolarHBondContact CB-O 3.46Å; T222-A225 HydrophobicContact CG2-CB 4.18Å; T222-A225 PolarHBondContact O-N 2.81Å; T222-A225 VanDerWaalsContact O-N 3.17Å; T222-A225 VanDerWaalsContact O-O 3.04Å; T223-A225 VanDerWaalsContact C-N 3.33Å; A225-F227 HydrophobicContact CB-CE2 4.12Å; A225-F227 HydrophobicContact CB-CZ 4Å
226	Q	92.9	Very high	91	Very high	115 Å²	115	55.8 Å²	55.8	54%	0.537	29%	0.292	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-116	146	-177.5	-58	173.9	25.5	0	0	109.5	L214 T223	L214-Q226 HydrophobicContact CD1-CB 4.26Å; L214-Q226 HydrophobicContact CD1-CG 4.11Å; L214-Q226 VanDerWaalsContact CD1-OE1 3.25Å; T223-Q226 PolarHBondContact O-NE2 2.82Å
227	F	94.8	Very high	91.7	Very high	20 Å²	20	50.6 Å²	50.6	9%	0.088	26%	0.255	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-135.6	143.2	-173.6	-53.2	-79.9	0	0	0	109.9	G218 Y219 A225 T229 Q232 L233 H236 Y237	G218-F227 CarbonylContact C-O 3.58Å; G218-F227 WeakPolarHBondContact CA-O 3.47Å; Y219-F227 PolarHBondContact N-O 3.33Å; Y219-F227 PolarHBondContact O-N 3.06Å; A225-F227 HydrophobicContact CB-CE2 4.12Å; A225-F227 HydrophobicContact CB-CZ 4Å; F227-T229 VanDerWaalsContact C-N 3.33Å; F227-Q232 HydrophobicContact CB-CB 4.12Å; F227-Q232 HydrophobicContact CD1-CB 4.16Å; F227-L233 HydrophobicContact CB-CB 4.12Å; F227-L233 HydrophobicContact CD2-CB 3.6Å; F227-L233 HydrophobicContact CD2-CD1 3.83Å; F227-L233 HydrophobicContact CD2-CG 3.74Å; F227-L233 HydrophobicContact CE2-CB 4.12Å; F227-L233 HydrophobicContact CE2-CD1 4.24Å; F227-L233 HydrophobicContact CE2-CG 3.92Å; F227-L233 HydrophobicContact CG-CB 3.81Å; F227-L233 HydrophobicContact CG-CG 4.46Å; F227-H236 HydrophobicContact CD1-CB 4.49Å; F227-H236 HydrophobicContact CE1-CB 3.48Å; F227-H236 VanDerWaalsContact CE1-CB 3.48Å; F227-H236 AromaticContact CE1-CG 3.6Å; F227-H236 AromaticContact CE1-ND1 3.58Å; F227-H236 HydrophobicContact CZ-CB 3.67Å; F227-H236 AromaticContact CZ-CD2 3.87Å; F227-H236 AromaticContact CZ-CG 3.52Å; F227-H236 AromaticContact CZ-ND1 3.72Å; F227-Y237 HydrophobicContact CE2-CE2 4.1Å; F227-Y237 HydrophobicContact CZ-CE2 4.41Å
228	D	93.7	Very high	92.5	Very high	123 Å²	123	50.3 Å²	50.3	66%	0.658	25%	0.248	S	C	*	.	S	Bend	trans	-73.1	-33	178.8	-61.5	-38.1	0	0	0	111.1
229	T	93.4	Very high	92.9	Very high	52 Å²	52	55.2 Å²	55.2	32%	0.319	27%	0.272	S	S	.	.	S	Bend	trans	-130.8	158.3	-178	72.7	0	0	0	0	112.3	F227 Q231 Q232 L233	F227-T229 VanDerWaalsContact C-N 3.33Å; T229-Q231 VanDerWaalsContact C-N 3.27Å; T229-Q231 PolarHBondContact O-N 3.09Å; T229-Q232 PolarHBondContact O-N 3.47Å; T229-Q232 WeakPolarHBondContact OG1-CG 3.24Å; T229-Q232 PolarHBondContact OG1-N 3.34Å; T229-L233 PolarHBondContact O-N 3.11Å
230	L	94.4	Very high	92.9	Very high	3 Å²	3	60.5 Å²	60.5	2%	0.016	29%	0.292	C	S	.	.	H	α-helix	trans	-68.5	-28.8	175.2	-74.2	171.2	0	0	0	112	I150 W155 F191 I211 Y219 L233 V234	I150-L230 HydrophobicContact CD1-CB 4.05Å; I150-L230 HydrophobicContact CD1-CD1 3.18Å; I150-L230 HydrophobicContact CD1-CG 4.2Å; W155-L230 HydrophobicContact CH2-CB 3.67Å; W155-L230 HydrophobicContact CZ3-CB 4.29Å; F191-L230 HydrophobicContact CD1-CD1 4.31Å; F191-L230 HydrophobicContact CD2-CD1 3.73Å; F191-L230 HydrophobicContact CE1-CD1 4.35Å; F191-L230 HydrophobicContact CE2-CD1 3.78Å; F191-L230 HydrophobicContact CG-CD1 4Å; F191-L230 HydrophobicContact CZ-CD1 4.09Å; I211-L230 HydrophobicContact CD1-CD2 3.9Å; I211-L230 HydrophobicContact CG2-CD2 3.81Å; Y219-L230 HydrophobicContact CD1-CD1 4.36Å; Y219-L230 HydrophobicContact CD1-CD2 3.83Å; Y219-L230 HydrophobicContact CD1-CG 3.97Å; Y219-L230 HydrophobicContact CD2-CD2 4.3Å; Y219-L230 HydrophobicContact CD2-CG 3.96Å; Y219-L230 HydrophobicContact CE1-CD1 4.17Å; Y219-L230 HydrophobicContact CE1-CD2 4.44Å; Y219-L230 HydrophobicContact CE1-CG 4.14Å; Y219-L230 HydrophobicContact CE2-CG 4.12Å; Y219-L230 HydrophobicContact CG-CD2 3.75Å; Y219-L230 HydrophobicContact CG-CG 3.88Å; L230-L233 HydrophobicContact CD2-CD1 4.3Å; L230-L233 WeakPolarHBondContact O-CB 3.41Å; L230-L233 PolarHBondContact O-N 3.32Å; L230-V234 WeakPolarHBondContact O-CG2 3.5Å; L230-V234 PolarHBondContact O-N 3.5Å
231	Q	95.1	Very high	92.8	Very high	67 Å²	67	60.3 Å²	60.3	31%	0.313	30%	0.298	S	S	.	.	H	α-helix	trans	-58.9	-46.3	171.8	-68.5	80.2	-5.1	0	0	111.5	E153 W155 T229 L233 V234 Q235	E153-Q231 VanDerWaalsContact OE1-CG 3.24Å; E153-Q231 WeakPolarHBondContact OE1-CG 3.39Å; E153-Q231 PolarHBondContact OE1-NE2 2.5Å; W155-Q231 HydrophobicContact CZ2-CG 4.13Å; T229-Q231 VanDerWaalsContact C-N 3.27Å; T229-Q231 PolarHBondContact O-N 3.09Å; Q231-L233 VanDerWaalsContact C-N 3.34Å; Q231-L233 PolarHBondContact O-N 3.04Å; Q231-V234 PolarHBondContact O-N 3.23Å; Q231-Q235 WeakPolarHBondContact O-CB 3.31Å; Q231-Q235 PolarHBondContact O-N 3.05Å
232	Q	95.5	Very high	92.8	Very high	89 Å²	89	61.3 Å²	61.3	42%	0.416	31%	0.308	S	S	.	.	H	α-helix	trans	-63.8	-40.1	176.9	-72.6	174.1	-4.4	0	0	111.8	F227 T229 Q235 H236	F227-Q232 HydrophobicContact CB-CB 4.12Å; F227-Q232 HydrophobicContact CD1-CB 4.16Å; T229-Q232 PolarHBondContact O-N 3.47Å; T229-Q232 WeakPolarHBondContact OG1-CG 3.24Å; T229-Q232 PolarHBondContact OG1-N 3.34Å; Q232-Q235 PolarHBondContact O-N 3.29Å; Q232-H236 WeakPolarHBondContact O-CB 3.44Å; Q232-H236 PolarHBondContact O-N 3.36Å
233	L	96.2	Very high	92.8	Very high	0 Å²	0	62.8 Å²	62.8	0%	0	33%	0.325	C	S	.	.	H	α-helix	trans	-59.8	-48.6	174.7	-177.1	154.8	0	0	0	111	I211 I221 F227 T229 L230 Q231 H236 Y237	I211-L233 HydrophobicContact CD1-CD1 4.45Å; I211-L233 HydrophobicContact CD1-CD2 4.33Å; I211-L233 HydrophobicContact CG2-CD1 3.72Å; I221-L233 HydrophobicContact CD1-CD2 4.37Å; I221-L233 HydrophobicContact CG1-CD1 4.37Å; F227-L233 HydrophobicContact CB-CB 4.12Å; F227-L233 HydrophobicContact CD2-CB 3.6Å; F227-L233 HydrophobicContact CD2-CD1 3.83Å; F227-L233 HydrophobicContact CD2-CG 3.74Å; F227-L233 HydrophobicContact CE2-CB 4.12Å; F227-L233 HydrophobicContact CE2-CD1 4.24Å; F227-L233 HydrophobicContact CE2-CG 3.92Å; F227-L233 HydrophobicContact CG-CB 3.81Å; F227-L233 HydrophobicContact CG-CG 4.46Å; T229-L233 PolarHBondContact O-N 3.11Å; L230-L233 HydrophobicContact CD2-CD1 4.3Å; L230-L233 WeakPolarHBondContact O-CB 3.41Å; L230-L233 PolarHBondContact O-N 3.32Å; Q231-L233 VanDerWaalsContact C-N 3.34Å; Q231-L233 PolarHBondContact O-N 3.04Å; L233-H236 PolarHBondContact O-N 3.21Å; L233-Y237 HydrophobicContact CD2-CD2 3.76Å; L233-Y237 HydrophobicContact CD2-CE2 4.06Å; L233-Y237 HydrophobicContact CG-CD2 3.98Å; L233-Y237 HydrophobicContact CG-CE2 3.93Å; L233-Y237 VanDerWaalsContact O-CD2 3.24Å; L233-Y237 WeakPolarHBondContact O-CD2 3.35Å; L233-Y237 PolarHBondContact O-N 3Å; L233-Y237 VanDerWaalsContact O-N 3.15Å
234	V	96.8	Very high	93.4	Very high	8 Å²	8	58.8 Å²	58.8	5%	0.048	30%	0.3	C	S	.	.	H	α-helix	trans	-62.4	-44.4	178.9	169.5	0	0	0	0	111	W155 Y179 I181 L230 Q231 H236 Y237 S238 L248	W155-V234 HydrophobicContact CD2-CG2 3.94Å; W155-V234 HydrophobicContact CE3-CG2 4.11Å; W155-V234 HydrophobicContact CH2-CG2 4.26Å; W155-V234 HydrophobicContact CZ2-CG2 4.06Å; W155-V234 HydrophobicContact CZ3-CG2 4.28Å; Y179-V234 HydrophobicContact CE2-CG1 3.78Å; Y179-V234 HydrophobicContact CE2-CG2 4.36Å; Y179-V234 WeakPolarHBondContact OH-CG1 3.44Å; I181-V234 HydrophobicContact CD1-CG2 3.51Å; L230-V234 WeakPolarHBondContact O-CG2 3.5Å; L230-V234 PolarHBondContact O-N 3.5Å; Q231-V234 PolarHBondContact O-N 3.23Å; V234-H236 PolarHBondContact O-N 2.96Å; V234-Y237 PolarHBondContact O-N 2.87Å; V234-S238 VanDerWaalsContact O-CB 3.31Å; V234-S238 WeakPolarHBondContact O-CB 3.49Å; V234-S238 PolarHBondContact O-N 2.91Å; V234-S238 PolarHBondContact O-OG 3.01Å; V234-L248 HydrophobicContact CG1-CD1 4.36Å
235	Q	96.4	Very high	93.8	Very high	108 Å²	108	51.2 Å²	51.2	51%	0.505	28%	0.276	S	S	.	.	H	α-helix	trans	-59	-47.7	177.6	-176.1	60.3	49.6	0	0	111.2	Q231 Q232 Y237 S238 D239	Q231-Q235 WeakPolarHBondContact O-CB 3.31Å; Q231-Q235 PolarHBondContact O-N 3.05Å; Q232-Q235 PolarHBondContact O-N 3.29Å; Q235-Y237 PolarHBondContact O-N 3.18Å; Q235-S238 WeakPolarHBondContact O-CB 3.44Å; Q235-S238 PolarHBondContact O-N 2.9Å; Q235-S238 VanDerWaalsContact O-N 3.13Å; Q235-D239 PolarHBondContact NE2-OD1 2.92Å; Q235-D239 PolarHBondContact NE2-OD2 3.16Å; Q235-D239 PolarHBondContact O-N 2.8Å
236	H	96.3	Very high	94.1	Very high	36 Å²	36	51.1 Å²	51.1	17%	0.167	27%	0.274	C	S	.	.	H	α-helix	trans	-56.4	-48.1	178.7	-177.8	106.4	0	0	0	112.9	F227 Q232 L233 V234 S238 D239 R240	F227-H236 HydrophobicContact CD1-CB 4.49Å; F227-H236 HydrophobicContact CE1-CB 3.48Å; F227-H236 VanDerWaalsContact CE1-CB 3.48Å; F227-H236 AromaticContact CE1-CG 3.6Å; F227-H236 AromaticContact CE1-ND1 3.58Å; F227-H236 HydrophobicContact CZ-CB 3.67Å; F227-H236 AromaticContact CZ-CD2 3.87Å; F227-H236 AromaticContact CZ-CG 3.52Å; F227-H236 AromaticContact CZ-ND1 3.72Å; Q232-H236 WeakPolarHBondContact O-CB 3.44Å; Q232-H236 PolarHBondContact O-N 3.36Å; L233-H236 PolarHBondContact O-N 3.21Å; V234-H236 PolarHBondContact O-N 2.96Å; H236-S238 VanDerWaalsContact C-N 3.28Å; H236-S238 PolarHBondContact O-N 3.11Å; H236-D239 PolarHBondContact O-N 3.04Å; H236-R240 PolarHBondContact CE1-NH2 3.18Å; H236-R240 PolarHBondContact NE2-NE 3.48Å; H236-R240 PolarHBondContact O-N 3.25Å
237	Y	97	Very high	94.3	Very high	1 Å²	1	51.9 Å²	51.9	0%	0.004	27%	0.272	C	S	.	.	H	α-helix	trans	-78.7	-13.9	-178.7	-70.9	-65.4	0	0	0	113.4	I221 F227 L233 V234 Q235 R240 A241 A242 L244 L248	I221-Y237 HydrophobicContact CD1-CD2 4.35Å; I221-Y237 HydrophobicContact CD1-CE2 3.78Å; I221-Y237 HydrophobicContact CG1-CE2 4.44Å; F227-Y237 HydrophobicContact CE2-CE2 4.1Å; F227-Y237 HydrophobicContact CZ-CE2 4.41Å; L233-Y237 HydrophobicContact CD2-CD2 3.76Å; L233-Y237 HydrophobicContact CD2-CE2 4.06Å; L233-Y237 HydrophobicContact CG-CD2 3.98Å; L233-Y237 HydrophobicContact CG-CE2 3.93Å; L233-Y237 VanDerWaalsContact O-CD2 3.24Å; L233-Y237 WeakPolarHBondContact O-CD2 3.35Å; L233-Y237 PolarHBondContact O-N 3Å; L233-Y237 VanDerWaalsContact O-N 3.15Å; V234-Y237 PolarHBondContact O-N 2.87Å; Q235-Y237 PolarHBondContact O-N 3.18Å; Y237-R240 CarbonylContact C-O 3.37Å; Y237-R240 VanDerWaalsContact CA-O 3.26Å; Y237-R240 WeakPolarHBondContact CA-O 3.36Å; Y237-A241 WeakPolarHBondContact CD1-O 3.4Å; Y237-A242 HydrophobicContact CD1-CB 4.08Å; Y237-A242 HydrophobicContact CE1-CB 3.78Å; Y237-L244 HydrophobicContact CD1-CD1 3.25Å; Y237-L244 HydrophobicContact CD1-CG 3.57Å; Y237-L244 HydrophobicContact CD2-CD1 4.14Å; Y237-L244 HydrophobicContact CE1-CD1 3.76Å; Y237-L244 HydrophobicContact CE1-CD2 4.23Å; Y237-L244 HydrophobicContact CE1-CG 3.63Å; Y237-L244 HydrophobicContact CG-CD1 3.46Å; Y237-L244 VanDerWaalsContact CG-CD1 3.46Å; Y237-L244 HydrophobicContact CG-CG 4.27Å; Y237-L248 PolarHBondContact O-N 3.41Å
238	S	96.8	Very high	94.4	Very high	28 Å²	28	51 Å²	51	20%	0.196	27%	0.268	C	S	.	.	H	α-helix	trans	-77.3	-32.6	167.4	-57.4	0	0	0	0	112	V234 Q235 H236 R247 L248	V234-S238 VanDerWaalsContact O-CB 3.31Å; V234-S238 WeakPolarHBondContact O-CB 3.49Å; V234-S238 PolarHBondContact O-N 2.91Å; V234-S238 PolarHBondContact O-OG 3.01Å; Q235-S238 WeakPolarHBondContact O-CB 3.44Å; Q235-S238 PolarHBondContact O-N 2.9Å; Q235-S238 VanDerWaalsContact O-N 3.13Å; H236-S238 VanDerWaalsContact C-N 3.28Å; H236-S238 PolarHBondContact O-N 3.11Å; S238-R247 WeakPolarHBondContact O-CD 3.49Å; S238-R247 VanDerWaalsContact O-CG 3.25Å; S238-R247 WeakPolarHBondContact O-CG 3.41Å; S238-L248 WeakPolarHBondContact CA-O 3.4Å
239	D	96	Very high	94.6	Very high	111 Å²	111	48.2 Å²	48.2	59%	0.594	26%	0.255	S	S	*	.	H	α-helix	trans	-76.7	-35.2	177.3	-64.6	-25.7	0	0	0	111.9	Q235 H236	Q235-D239 PolarHBondContact NE2-OD1 2.92Å; Q235-D239 PolarHBondContact NE2-OD2 3.16Å; Q235-D239 PolarHBondContact O-N 2.8Å; H236-D239 PolarHBondContact O-N 3.04Å
240	R	93.3	Very high	94.7	Very high	151 Å²	151	48.5 Å²	48.5	57%	0.57	26%	0.257	S	S	*	.			trans	-153.9	152	-178.4	56.9	179.9	-178.8	-142.8	11.9	112.3	H236 Y237 A242	H236-R240 PolarHBondContact CE1-NH2 3.18Å; H236-R240 PolarHBondContact NE2-NE 3.48Å; H236-R240 PolarHBondContact O-N 3.25Å; Y237-R240 CarbonylContact C-O 3.37Å; Y237-R240 VanDerWaalsContact CA-O 3.26Å; Y237-R240 WeakPolarHBondContact CA-O 3.36Å; R240-A242 VanDerWaalsContact C-N 3.34Å; R240-A242 HydrophobicContact CG-CB 4.09Å; R240-A242 PolarHBondContact O-N 3.38Å
241	A	90.8	Very high	94.8	Very high	33 Å²	33	50.9 Å²	50.9	27%	0.273	27%	0.272	S	S	.	.			trans	-65.1	-36.4	178.7	0	0	0	0	0	113	Y237 G243 L244	Y237-A241 WeakPolarHBondContact CD1-O 3.4Å; A241-G243 VanDerWaalsContact C-N 3.27Å; A241-G243 PolarHBondContact O-N 3.14Å; A241-G243 VanDerWaalsContact O-N 3.16Å; A241-L244 VanDerWaalsContact O-CB 3.26Å; A241-L244 WeakPolarHBondContact O-CB 3.23Å; A241-L244 WeakPolarHBondContact O-CG 3.37Å; A241-L244 PolarHBondContact O-N 2.94Å
242	A	89.9	Confident	94.7	Very high	34 Å²	34	47.9 Å²	47.9	28%	0.281	26%	0.259	S	S	.	.	T	Hydrogen-bonded Turn	trans	43.5	50.8	176.9	0	0	0	0	0	113.6	Y237 R240	Y237-A242 HydrophobicContact CD1-CB 4.08Å; Y237-A242 HydrophobicContact CE1-CB 3.78Å; R240-A242 VanDerWaalsContact C-N 3.34Å; R240-A242 HydrophobicContact CG-CB 4.09Å; R240-A242 PolarHBondContact O-N 3.38Å
243	G	86.6	Confident	94.1	Very high	40 Å²	40	50.6 Å²	50.6	41%	0.412	27%	0.271	S	S	.	.	T	Hydrogen-bonded Turn	trans	94.5	-27.8	-178.6	0	0	0	0	0	114.3	A241 L543	A241-G243 VanDerWaalsContact C-N 3.27Å; A241-G243 PolarHBondContact O-N 3.14Å; A241-G243 VanDerWaalsContact O-N 3.16Å; G243-L543 WeakPolarHBondContact O-CD2 3.28Å
244	L	93	Very high	93.2	Very high	9 Å²	9	52.1 Å²	52.1	5%	0.047	28%	0.278	C	S	.	.	S	Bend	trans	-60.3	157.2	176.2	-57.1	-176.9	0	0	0	111.1	L193 I195 Y209 I221 Y237 A241 C246 L248	L193-L244 HydrophobicContact CD2-CD1 3.87Å; I195-L244 HydrophobicContact CD1-CB 4.48Å; I195-L244 HydrophobicContact CD1-CD1 3.9Å; Y209-L244 HydrophobicContact CD1-CD2 3.5Å; Y209-L244 HydrophobicContact CD2-CD2 3.98Å; Y209-L244 HydrophobicContact CE1-CD2 3.55Å; Y209-L244 HydrophobicContact CE2-CD2 4.05Å; Y209-L244 HydrophobicContact CG-CD2 3.73Å; I221-L244 HydrophobicContact CD1-CD2 4.2Å; Y237-L244 HydrophobicContact CD1-CD1 3.25Å; Y237-L244 HydrophobicContact CD1-CG 3.57Å; Y237-L244 HydrophobicContact CD2-CD1 4.14Å; Y237-L244 HydrophobicContact CE1-CD1 3.76Å; Y237-L244 HydrophobicContact CE1-CD2 4.23Å; Y237-L244 HydrophobicContact CE1-CG 3.63Å; Y237-L244 HydrophobicContact CG-CD1 3.46Å; Y237-L244 VanDerWaalsContact CG-CD1 3.46Å; Y237-L244 HydrophobicContact CG-CG 4.27Å; A241-L244 VanDerWaalsContact O-CB 3.26Å; A241-L244 WeakPolarHBondContact O-CB 3.23Å; A241-L244 WeakPolarHBondContact O-CG 3.37Å; A241-L244 PolarHBondContact O-N 2.94Å; L244-C246 PolarHBondContact O-N 3.19Å; L244-C246 VanDerWaalsContact O-N 3.1Å; L244-L248 HydrophobicContact CD1-CD2 4.46Å
245	C	92.8	Very high	91.9	Very high	28 Å²	28	54 Å²	54	19%	0.189	30%	0.298	C	S	.	.	S	Bend	trans	-55.3	-30.3	178.7	56.2	0	0	0	0	114.4	R176 D197 K207 Y209	R176-C245 PolarHBondContact NH2-O 3.45Å; D197-C245 VanDerWaalsContact OD2-CB 3.28Å; D197-C245 WeakPolarHBondContact OD2-CB 3.39Å; K207-C245 HydrophobicContact CD-CB 3.39Å; Y209-C245 WeakPolarHBondContact OH-CB 3.37Å; Y209-C245 PolarHBondContact OH-N 3.44Å; Y209-C245 PolarHBondContact OH-SG 2.81Å
246	C	94.4	Very high	91	Very high	18 Å²	18	54 Å²	54	12%	0.122	30%	0.3	C	S	.	.	S	Bend	trans	-159.3	166.1	172.2	56.3	0	0	0	0	109.7	L244	L244-C246 PolarHBondContact O-N 3.19Å; L244-C246 VanDerWaalsContact O-N 3.1Å
247	R	96.9	Very high	90	Very high	131 Å²	131	53.8 Å²	53.8	49%	0.494	30%	0.302	S	S	.	.			trans	-62.1	146.2	168.9	152.9	171.1	65.7	97.1	-6	110	S238 V249	S238-R247 WeakPolarHBondContact O-CD 3.49Å; S238-R247 VanDerWaalsContact O-CG 3.25Å; S238-R247 WeakPolarHBondContact O-CG 3.41Å; R247-V249 HydrophobicContact CG-CG2 4.44Å; R247-V249 WeakPolarHBondContact O-CG2 3.43Å; R247-V249 PolarHBondContact O-N 2.67Å
248	L	97.9	Very high	88.8	Confident	2 Å²	2	59.2 Å²	59.2	1%	0.01	32%	0.322	C	S	.	.			trans	-69.5	121.2	167.6	-54.4	-175.1	0	0	0	109.3	Y179 L193 I195 V234 Y237 S238 L244	Y179-L248 HydrophobicContact CD1-CB 3.63Å; Y179-L248 HydrophobicContact CD1-CD2 4.1Å; Y179-L248 HydrophobicContact CD1-CG 4.27Å; Y179-L248 HydrophobicContact CD2-CD1 4Å; Y179-L248 HydrophobicContact CD2-CD2 4.23Å; Y179-L248 HydrophobicContact CD2-CG 4.49Å; Y179-L248 HydrophobicContact CE1-CB 3.67Å; Y179-L248 HydrophobicContact CE2-CD1 4.04Å; Y179-L248 HydrophobicContact CG-CB 4.11Å; Y179-L248 HydrophobicContact CG-CD1 4.25Å; Y179-L248 HydrophobicContact CG-CD2 3.76Å; Y179-L248 HydrophobicContact CG-CG 4.24Å; L193-L248 HydrophobicContact CD1-CD1 4.38Å; L193-L248 HydrophobicContact CD1-CD2 4.15Å; L193-L248 HydrophobicContact CD2-CD1 4.48Å; L193-L248 HydrophobicContact CD2-CD2 4.23Å; I195-L248 HydrophobicContact CD1-CD2 3.56Å; I195-L248 HydrophobicContact CG1-CD2 3.9Å; I195-L248 HydrophobicContact CG2-CD2 4.48Å; V234-L248 HydrophobicContact CG1-CD1 4.36Å; Y237-L248 PolarHBondContact O-N 3.41Å; S238-L248 WeakPolarHBondContact CA-O 3.4Å; L244-L248 HydrophobicContact CD1-CD2 4.46Å
249	V	96.6	Very high	87.9	Confident	64 Å²	64	58.2 Å²	58.2	39%	0.388	32%	0.315	S	S	.	.			trans	-104.4	-57.6	-172.7	-178.6	0	0	0	0	110.9	G177 R247	G177-V249 PolarHBondContact O-N 3.21Å; R247-V249 HydrophobicContact CG-CG2 4.44Å; R247-V249 WeakPolarHBondContact O-CG2 3.43Å; R247-V249 PolarHBondContact O-N 2.67Å
250	V	96.2	Very high	86.6	Confident	58 Å²	58	54.5 Å²	54.5	35%	0.352	30%	0.299	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-141.3	142.9	179.4	-71.3	0	0	0	0	110.8	P175 T178 Y179	P175-V250 HydrophobicContact CG-CG2 3.81Å; T178-V250 CarbonylContact C-O 3.59Å; T178-V250 VanDerWaalsContact CA-O 3.24Å; T178-V250 WeakPolarHBondContact CA-O 3.32Å; T178-V250 HydrophobicContact CG2-CG2 4.39Å; T178-V250 WeakPolarHBondContact OG1-CG2 3.48Å; Y179-V250 WeakPolarHBondContact CD1-O 3.38Å; Y179-V250 WeakPolarHBondContact CE1-O 3.4Å; Y179-V250 PolarHBondContact N-O 2.8Å
251	P	95.4	Very high	85.9	Confident	52 Å²	52	47.4 Å²	47.4	34%	0.338	27%	0.273	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-55.8	143.5	167.2	-24.5	34.8	0	0	0	111.1	W155 Y179	W155-P251 HydrophobicContact CB-CB 4Å; W155-P251 HydrophobicContact CB-CG 4.25Å; Y179-P251 HydrophobicContact CE1-CG 4.34Å; Y179-P251 CarbonylContact O-C 3.58Å; Y179-P251 WeakPolarHBondContact O-CA 3.48Å
252	C	93.4	Very high	85.5	Confident	4 Å²	4	45.9 Å²	45.9	3%	0.027	26%	0.26	C	S	.	.			trans	-60.1	138.8	169.9	-170.5	0	0	0	0	109.2	F157 L169 T178 Y179 L180 K254	F157-C252 HydrophobicContact CE2-CB 4.16Å; F157-C252 HydrophobicContact CZ-CB 3.76Å; F157-C252 WeakPolarHBondContact CZ-O 3.33Å; L169-C252 HydrophobicContact CD2-CB 3.78Å; T178-C252 VanDerWaalsContact CG2-CA 3.49Å; T178-C252 HydrophobicContact CG2-CB 3.89Å; Y179-C252 WeakPolarHBondContact O-CB 3.49Å; Y179-C252 PolarHBondContact O-N 3.35Å; L180-C252 HydrophobicContact CB-CB 4.13Å; L180-C252 HydrophobicContact CD2-CB 3.98Å; C252-K254 PolarHBondContact O-N 3.45Å; C252-K254 VanDerWaalsContact O-N 3.14Å
253	H	83.4	Confident	85	Confident	147 Å²	147	44.4 Å²	44.4	68%	0.681	25%	0.247	S	C	*	.			trans	-67.6	115.5	177.5	-174.5	71.1	0	0	0	110	G255	H253-G255 PolarHBondContact O-N 3.16Å
254	K	76.6	Confident	84.5	Confident	32 Å²	32	43.1 Å²	43.1	14%	0.139	23%	0.232	C	C	.	.			trans	-73.3	112.5	166.8	-72.6	177.2	-179.4	167.5	0	108.2	Y97 E153 D154 Y156 F157 C252	Y97-K254 HydrophobicContact CE1-CB 4.09Å; E153-K254 PolarHBondContact O-NZ 2.65Å; D154-K254 WeakPolarHBondContact O-CE 3.47Å; D154-K254 PolarHBondContact O-NZ 2.74Å; Y156-K254 WeakPolarHBondContact O-CE 3.24Å; Y156-K254 PolarHBondContact O-NZ 3.19Å; F157-K254 HydrophobicContact CD1-CG 4.03Å; F157-K254 HydrophobicContact CD2-CG 4.35Å; F157-K254 HydrophobicContact CE1-CB 4.3Å; F157-K254 HydrophobicContact CE1-CD 4.44Å; F157-K254 HydrophobicContact CE1-CG 3.36Å; F157-K254 HydrophobicContact CE2-CD 4.33Å; F157-K254 HydrophobicContact CE2-CG 3.73Å; F157-K254 HydrophobicContact CZ-CB 4.28Å; F157-K254 HydrophobicContact CZ-CD 4.24Å; F157-K254 HydrophobicContact CZ-CG 3.2Å; C252-K254 PolarHBondContact O-N 3.45Å; C252-K254 VanDerWaalsContact O-N 3.14Å
255	G	70.8	Confident	83.8	Confident	46 Å²	46	48.9 Å²	48.9	47%	0.474	26%	0.256	S	S	.	.	P	Polyproline II helix	trans	-57.4	149.6	164.9	0	0	0	0	0	110.2	H253	H253-G255 PolarHBondContact O-N 3.16Å
256	M	76.1	Confident	82.9	Confident	109 Å²	109	47.9 Å²	47.9	54%	0.537	25%	0.249	S	C	.	.	P	Polyproline II helix	trans	-58.5	126.3	176.5	-172.8	178.8	-75.9	0	0	109.3	D98 Y143	D98-M256 VanDerWaalsContact O-CE 3.23Å; D98-M256 WeakPolarHBondContact O-CE 3.44Å; Y143-M256 HydrophobicContact CE1-CG 3.98Å; Y143-M256 HydrophobicContact CE1-SD 4.05Å; Y143-M256 VanDerWaalsContact OH-CG 3.22Å; Y143-M256 WeakPolarHBondContact OH-CG 3.4Å; Y143-M256 PolarHBondContact OH-SD 3.25Å
257	P	76.2	Confident	81.7	Confident	32 Å²	32	49.3 Å²	49.3	21%	0.208	25%	0.253	C	S	.	.	P	Polyproline II helix	trans	-64.6	141	-178	24	-30.6	0	0	0	109.1	Y97 Y143	Y97-P257 VanDerWaalsContact CD2-CD 3.44Å; Y97-P257 HydrophobicContact CD2-CG 3.68Å; Y97-P257 HydrophobicContact CE2-CG 3.36Å; Y97-P257 HydrophobicContact CG-CG 4.45Å; Y143-P257 HydrophobicContact CD2-CG 3.83Å; Y143-P257 HydrophobicContact CE2-CB 4.44Å; Y143-P257 HydrophobicContact CE2-CG 3.65Å; Y143-P257 WeakPolarHBondContact CE2-O 3.48Å; Y143-P257 PolarHBondContact OH-O 3.34Å; Y143-P257 VanDerWaalsContact OH-O 3.08Å
258	R	72.2	Confident	80.2	Confident	115 Å²	115	49.4 Å²	49.4	43%	0.434	26%	0.263	S	S	.	.	P	Polyproline II helix	trans	-74.2	143.5	176.4	-63.3	-174.3	-174.7	-147.8	-5.5	108.8	N142 E349	N142-R258 PolarHBondContact ND2-O 2.81Å; N142-R258 VanDerWaalsContact ND2-O 3.13Å; R258-E349 IonicContact CZ-OE2 3.59Å; R258-E349 IonicContact NH1-OE2 3.33Å; R258-E349 PolarHBondContact NH1-OE2 3.1Å
259	L	77.8	Confident	78.9	Confident	7 Å²	7	54 Å²	54	4%	0.037	29%	0.292	C	S	.	.	P	Polyproline II helix	trans	-79	136.9	169.7	-61.3	-170.7	0	0	0	109.1	Y99 R102 W125 P140 Y143 D261	Y99-L259 HydrophobicContact CE2-CD1 3.84Å; R102-L259 VanDerWaalsContact NH2-CD1 3.3Å; W125-L259 HydrophobicContact CH2-CD1 3.67Å; W125-L259 HydrophobicContact CZ2-CD1 3.76Å; P140-L259 HydrophobicContact CB-CD1 4.49Å; P140-L259 HydrophobicContact CB-CD2 3.4Å; P140-L259 HydrophobicContact CG-CD1 3.9Å; P140-L259 HydrophobicContact CG-CD2 3.65Å; P140-L259 HydrophobicContact CG-CG 4.46Å; Y143-L259 HydrophobicContact CD2-CD2 3.89Å; Y143-L259 HydrophobicContact CE2-CD2 3.34Å; Y143-L259 HydrophobicContact CE2-CG 4.19Å; L259-D261 WeakPolarHBondContact CB-O 3.2Å; L259-D261 PolarHBondContact O-N 3.08Å
260	A	68.6	Low	77.9	Confident	32 Å²	32	52.6 Å²	52.6	26%	0.264	28%	0.279	S	S	.	.	S	Bend	trans	-67.5	-28.7	178.5	0	0	0	0	0	112
261	D	79.1	Confident	77.5	Confident	3 Å²	3	54.2 Å²	54.2	2%	0.016	28%	0.283	C	S	.	.	S	Bend	trans	-136.5	168.3	-176.4	-64.3	-56.8	0	0	0	110.8	L259 R328	L259-D261 WeakPolarHBondContact CB-O 3.2Å; L259-D261 PolarHBondContact O-N 3.08Å; D261-R328 VanDerWaalsContact CG-NH2 3.32Å; D261-R328 IonicContact OD1-NH2 3.32Å; D261-R328 PolarHBondContact OD1-NH2 3.44Å; D261-R328 IonicContact OD2-CZ 2.75Å; D261-R328 IonicContact OD2-NH1 3.05Å; D261-R328 IonicContact OD2-NH2 2.77Å; D261-R328 PolarHBondContact OD2-NH2 3.25Å
262	L	81.1	Confident	77.3	Confident	0 Å²	0	52.4 Å²	52.4	0%	0	27%	0.271	C	S	.	.	S	Bend	trans	-74.8	-43	-178.1	-70.1	169	0	0	0	112.2	R102 T266 W296 T300 V302 Y336 A337	R102-L262 WeakPolarHBondContact CD-O 3.31Å; R102-L262 PolarHBondContact NH1-O 2.88Å; L262-T266 HydrophobicContact CB-CG2 4.09Å; L262-T266 PolarHBondContact N-OG1 2.82Å; L262-W296 HydrophobicContact CB-CD2 4.13Å; L262-W296 HydrophobicContact CB-CE3 3.88Å; L262-W296 HydrophobicContact CB-CH2 3.83Å; L262-W296 HydrophobicContact CB-CZ2 4.09Å; L262-W296 HydrophobicContact CB-CZ3 3.72Å; L262-W296 HydrophobicContact CD1-CD2 3.87Å; L262-W296 HydrophobicContact CD1-CE3 4.38Å; L262-W296 HydrophobicContact CD1-CG 3.96Å; L262-W296 HydrophobicContact CD2-CB 4.4Å; L262-W296 HydrophobicContact CD2-CD2 4.06Å; L262-W296 HydrophobicContact CD2-CE3 3.85Å; L262-W296 HydrophobicContact CD2-CG 4.31Å; L262-W296 HydrophobicContact CD2-CZ3 4.47Å; L262-W296 HydrophobicContact CG-CD2 4.23Å; L262-W296 HydrophobicContact CG-CE3 4.24Å; L262-T300 HydrophobicContact CD2-CG2 3.89Å; L262-V302 HydrophobicContact CD2-CG1 4.21Å; L262-Y336 HydrophobicContact CD2-CD2 3.99Å; L262-Y336 HydrophobicContact CD2-CG 4.16Å; L262-Y336 HydrophobicContact CG-CD2 4.46Å; L262-Y336 HydrophobicContact CG-CG 4.14Å; L262-A337 HydrophobicContact CD1-CB 3.95Å
263	S	79.6	Confident	77.3	Confident	3 Å²	3	56.1 Å²	56.1	2%	0.021	30%	0.295	C	S	.	.			trans	-158	171.8	175.6	71.2	0	0	0	0	111.8	K265 T266 K267	S263-K265 VanDerWaalsContact C-N 3.26Å; S263-K265 PolarHBondContact O-N 3.23Å; S263-K265 PolarHBondContact OG-N 2.91Å; S263-T266 PolarHBondContact N-OG1 3.3Å; S263-T266 PolarHBondContact O-N 2.9Å; S263-T266 VanDerWaalsContact O-N 3.13Å; S263-T266 PolarHBondContact O-OG1 3.39Å; S263-T266 PolarHBondContact OG-N 2.65Å; S263-K267 PolarHBondContact O-N 2.85Å
264	V	77.1	Confident	77.8	Confident	14 Å²	14	51.6 Å²	51.6	9%	0.085	27%	0.271	C	S	.	.	H	α-helix	trans	-53.6	-41.5	172.4	70	0	0	0	0	112.5	E122 W125 Y138 T266 K267	E122-V264 WeakPolarHBondContact OE2-CG2 3.5Å; W125-V264 HydrophobicContact CB-CB 4.05Å; W125-V264 HydrophobicContact CB-CG2 4.05Å; W125-V264 HydrophobicContact CD2-CB 4.42Å; W125-V264 HydrophobicContact CG-CB 4.02Å; W125-V264 HydrophobicContact CG-CG2 4.46Å; Y138-V264 HydrophobicContact CD1-CB 4.4Å; Y138-V264 HydrophobicContact CD1-CG1 4.48Å; Y138-V264 HydrophobicContact CD1-CG2 4.14Å; Y138-V264 HydrophobicContact CD2-CG1 3.82Å; Y138-V264 HydrophobicContact CE1-CG2 4.05Å; Y138-V264 HydrophobicContact CE2-CG1 4.04Å; Y138-V264 HydrophobicContact CG-CB 4.33Å; Y138-V264 HydrophobicContact CG-CG1 4.06Å; V264-T266 VanDerWaalsContact C-N 3.33Å; V264-T266 PolarHBondContact O-N 2.86Å; V264-K267 WeakPolarHBondContact O-CB 3.48Å; V264-K267 PolarHBondContact O-N 3.3Å
265	K	77.7	Confident	78.7	Confident	129 Å²	129	57.7 Å²	57.7	56%	0.561	30%	0.3	S	S	*	.	H	α-helix	trans	-68.2	-31.5	-179.9	-71	177.5	174.3	164.2	0	112.6	D105 S263 K267 V269	D105-K265 IonicContact OD1-NZ 3.52Å; D105-K265 PolarHBondContact OD1-NZ 3.42Å; D105-K265 WeakPolarHBondContact OD2-CE 3.32Å; D105-K265 IonicContact OD2-NZ 2.77Å; D105-K265 PolarHBondContact OD2-NZ 3.49Å; S263-K265 VanDerWaalsContact C-N 3.26Å; S263-K265 PolarHBondContact O-N 3.23Å; S263-K265 PolarHBondContact OG-N 2.91Å; K265-K267 VanDerWaalsContact C-N 3.28Å; K265-K267 PolarHBondContact O-N 3.08Å; K265-V269 PolarHBondContact O-N 3.08Å
266	T	74.1	Confident	79.8	Confident	7 Å²	7	56.2 Å²	56.2	4%	0.043	28%	0.283	C	S	.	.	H	α-helix	trans	-79.1	-10.1	178	61.1	0	0	0	0	114.4	L262 S263 V264 V269 I272 W296	L262-T266 HydrophobicContact CB-CG2 4.09Å; L262-T266 PolarHBondContact N-OG1 2.82Å; S263-T266 PolarHBondContact N-OG1 3.3Å; S263-T266 PolarHBondContact O-N 2.9Å; S263-T266 VanDerWaalsContact O-N 3.13Å; S263-T266 PolarHBondContact O-OG1 3.39Å; S263-T266 PolarHBondContact OG-N 2.65Å; V264-T266 VanDerWaalsContact C-N 3.33Å; V264-T266 PolarHBondContact O-N 2.86Å; T266-V269 VanDerWaalsContact CA-O 3.3Å; T266-V269 WeakPolarHBondContact CA-O 3.38Å; T266-I272 HydrophobicContact CG2-CG2 4.03Å; T266-W296 HydrophobicContact CG2-CZ2 4.12Å
267	K	68.9	Low	80.8	Confident	49 Å²	49	51.9 Å²	51.9	21%	0.213	26%	0.262	C	S	.	.	H	α-helix	trans	-61.8	-46.2	-178.3	-174.5	-174.9	174.4	-170.2	0	111.8	E122 S263 V264 K265 K325	E122-K267 PolarHBondContact O-NZ 3.28Å; S263-K267 PolarHBondContact O-N 2.85Å; V264-K267 WeakPolarHBondContact O-CB 3.48Å; V264-K267 PolarHBondContact O-N 3.3Å; K265-K267 VanDerWaalsContact C-N 3.28Å; K265-K267 PolarHBondContact O-N 3.08Å; K267-K325 PolarHBondContact O-NZ 3.48Å
268	D	64.9	Low	81.7	Confident	132 Å²	132	56 Å²	56	71%	0.706	28%	0.279	S	S	*	.	H	α-helix	trans	-105.7	-29	-178.8	-63.3	-38.3	0	0	0	112.5
269	V	70.1	Confident	82.9	Confident	100 Å²	100	53.1 Å²	53.1	61%	0.606	27%	0.271	S	S	*	.			trans	-110.2	89.6	175.7	-175.2	0	0	0	0	109	K265 T266	K265-V269 PolarHBondContact O-N 3.08Å; T266-V269 VanDerWaalsContact CA-O 3.3Å; T266-V269 WeakPolarHBondContact CA-O 3.38Å
270	W	75.9	Confident	83.8	Confident	34 Å²	34	56.9 Å²	56.9	13%	0.129	29%	0.29	C	S	.	.			trans	-86.9	-12	-174	60.4	-100.4	0	0	0	112.5	I272 L318 A337 V338	W270-I272 PolarHBondContact O-N 3.21Å; W270-L318 HydrophobicContact CH2-CD2 3Å; W270-L318 HydrophobicContact CH2-CG 4.43Å; W270-L318 HydrophobicContact CZ2-CD2 3.49Å; W270-L318 VanDerWaalsContact CZ2-CD2 3.49Å; W270-L318 HydrophobicContact CZ3-CD2 4.05Å; W270-A337 WeakPolarHBondContact O-CA 3.32Å; W270-A337 VanDerWaalsContact O-CB 3.3Å; W270-A337 WeakPolarHBondContact O-CB 3.45Å; W270-V338 HydrophobicContact CD2-CG2 4.41Å; W270-V338 HydrophobicContact CE3-CB 4.15Å; W270-V338 HydrophobicContact CE3-CG2 3.3Å; W270-V338 HydrophobicContact CH2-CG2 3.58Å; W270-V338 HydrophobicContact CZ3-CB 4Å; W270-V338 HydrophobicContact CZ3-CG2 2.86Å; W270-V338 PolarHBondContact O-N 3.49Å
271	E	88.2	Confident	85.1	Confident	92 Å²	92	61.5 Å²	61.5	43%	0.43	31%	0.305	S	S	.	.	B	Isolated β-bridge	trans	-66.7	117.6	169.3	-73.3	-172.9	-118.4	0	0	108.5	V338 S340	E271-V338 WeakPolarHBondContact CA-O 3.39Å; E271-S340 WeakPolarHBondContact OE2-CB 3.48Å; E271-S340 PolarHBondContact OE2-OG 2.93Å
272	I	91.5	Very high	85.9	Confident	14 Å²	14	67.9 Å²	67.9	7%	0.072	33%	0.328	C	S	.	.			trans	-112.4	147.1	177.6	61.9	172.2	0	0	0	110.6	T266 W270 L277 A337 V338 V339 V347	T266-I272 HydrophobicContact CG2-CG2 4.03Å; W270-I272 PolarHBondContact O-N 3.21Å; I272-L277 HydrophobicContact CD1-CD1 4Å; I272-L277 HydrophobicContact CD1-CD2 4Å; I272-L277 HydrophobicContact CD1-CG 3.96Å; I272-A337 HydrophobicContact CD1-CB 3.7Å; I272-A337 HydrophobicContact CG1-CB 3.92Å; I272-A337 HydrophobicContact CG2-CB 3.87Å; I272-V338 PolarHBondContact N-O 2.82Å; I272-V339 HydrophobicContact CG1-CG2 4.16Å; I272-V347 HydrophobicContact CD1-CG2 4.14Å
273	P	92.4	Very high	86.3	Confident	82 Å²	82	71.5 Å²	71.5	53%	0.532	35%	0.347	S	S	.	.			trans	-64.1	139.3	173.7	25.9	-32.7	0	0	0	110.1	E275 S276	P273-E275 WeakPolarHBondContact CB-OE2 3.42Å; P273-E275 PolarHBondContact O-N 2.9Å; P273-S276 WeakPolarHBondContact O-CB 3.27Å; P273-S276 PolarHBondContact O-N 2.9Å; P273-S276 PolarHBondContact O-OG 3.13Å
274	R	94.7	Very high	86.6	Confident	51 Å²	51	72.8 Å²	72.8	19%	0.192	36%	0.361	C	S	.	.	G	3₁₀ helix	trans	-58.3	-33.2	-177.9	-172.1	-176.8	-58.8	-77.2	-0.1	111.9	S276 L277 V339 E341 E342 P343 Y345	R274-S276 PolarHBondContact O-N 3.07Å; R274-L277 WeakPolarHBondContact O-CB 2.91Å; R274-L277 PolarHBondContact O-N 3.4Å; R274-V339 HydrophobicContact CB-CG1 4.21Å; R274-E341 PolarHBondContact NH2-O 3.45Å; R274-E342 PolarHBondContact NH2-O 3.46Å; R274-P343 PolarHBondContact NH1-O 3.38Å; R274-P343 PolarHBondContact NH2-O 2.64Å; R274-Y345 HydrophobicContact CG-CE2 4.05Å
275	E	94.8	Very high	86.9	Confident	160 Å²	160	77.2 Å²	77.2	75%	0.748	38%	0.384	S	S	*	.	G	3₁₀ helix	trans	-66.2	-20.8	-178.8	-56.1	69.8	-148.1	0	0	112.4	P273 L277	P273-E275 WeakPolarHBondContact CB-OE2 3.42Å; P273-E275 PolarHBondContact O-N 2.9Å; E275-L277 PolarHBondContact O-N 3.42Å
276	S	94.1	Very high	86.5	Confident	15 Å²	15	73.1 Å²	73.1	11%	0.105	38%	0.378	C	S	.	.	G	3₁₀ helix	trans	-70.9	-12.1	173	69.8	0	0	0	0	113.2	P273 R274 W296 N297	P273-S276 WeakPolarHBondContact O-CB 3.27Å; P273-S276 PolarHBondContact O-N 2.9Å; P273-S276 PolarHBondContact O-OG 3.13Å; R274-S276 PolarHBondContact O-N 3.07Å; S276-W296 CarbonylContact O-C 3.57Å; S276-W296 WeakPolarHBondContact O-CA 3.2Å; S276-N297 WeakPolarHBondContact CB-OD1 3.38Å; S276-N297 PolarHBondContact O-N 3.4Å
277	L	96.8	Very high	86.1	Confident	18 Å²	18	76.6 Å²	76.6	9%	0.094	39%	0.394	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-108.1	127.7	-178.7	-65.1	169.7	0	0	0	111.3	I272 R274 E275 T295 W296 V302 V304 V339 Y345 V347	I272-L277 HydrophobicContact CD1-CD1 4Å; I272-L277 HydrophobicContact CD1-CD2 4Å; I272-L277 HydrophobicContact CD1-CG 3.96Å; R274-L277 WeakPolarHBondContact O-CB 2.91Å; R274-L277 PolarHBondContact O-N 3.4Å; E275-L277 PolarHBondContact O-N 3.42Å; L277-T295 WeakPolarHBondContact CA-O 3.44Å; L277-W296 HydrophobicContact CD2-CB 4.08Å; L277-V302 HydrophobicContact CD2-CG2 4.18Å; L277-V304 HydrophobicContact CD1-CG1 4.46Å; L277-V304 HydrophobicContact CD1-CG2 4.49Å; L277-V304 HydrophobicContact CD2-CG2 4.25Å; L277-V339 HydrophobicContact CD1-CG2 3.91Å; L277-Y345 HydrophobicContact CD1-CD2 3.84Å; L277-V347 HydrophobicContact CD1-CG2 3.7Å; L277-V347 HydrophobicContact CD2-CG1 4.28Å; L277-V347 HydrophobicContact CD2-CG2 4.11Å
278	Q	97	Very high	86.1	Confident	120 Å²	120	76.8 Å²	76.8	56%	0.561	40%	0.395	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-107	116	168.5	-169.7	179.4	24.8	0	0	109.6	I280 G294 T295	Q278-I280 HydrophobicContact CG-CG1 4.27Å; Q278-G294 CarbonylContact O-C 3.56Å; Q278-G294 WeakPolarHBondContact O-CA 3.36Å; Q278-T295 PolarHBondContact N-O 3.1Å; Q278-T295 PolarHBondContact O-N 3.3Å; Q278-T295 PolarHBondContact OE1-OG1 2.99Å
279	L	96.6	Very high	86.9	Confident	54 Å²	54	70.7 Å²	70.7	28%	0.283	36%	0.364	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-81	120.8	173.1	-53.4	-174.1	0	0	0	109.3	W292 V304 Y345	L279-W292 HydrophobicContact CB-CB 4.38Å; L279-W292 HydrophobicContact CB-CD2 4.19Å; L279-W292 HydrophobicContact CB-CE3 3.95Å; L279-W292 HydrophobicContact CB-CG 4.38Å; L279-W292 HydrophobicContact CD1-CD2 4.26Å; L279-W292 HydrophobicContact CD1-CG 4.16Å; L279-W292 HydrophobicContact CD2-CB 4Å; L279-W292 HydrophobicContact CD2-CG 4.43Å; L279-V304 HydrophobicContact CD2-CB 3.72Å; L279-V304 HydrophobicContact CD2-CG1 3.87Å; L279-V304 HydrophobicContact CD2-CG2 3.88Å; L279-Y345 HydrophobicContact CD1-CE2 4.3Å; L279-Y345 HydrophobicContact CD2-CE2 4.47Å
280	I	96.4	Very high	87.9	Confident	85 Å²	85	68.3 Å²	68.3	44%	0.436	35%	0.346	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-108.1	-52.6	-170.2	-62.4	171.1	0	0	0	111.4	Q278 M293 T295	Q278-I280 HydrophobicContact CG-CG1 4.27Å; I280-M293 WeakPolarHBondContact CA-O 3.38Å; I280-M293 HydrophobicContact CB-CE 3.79Å; I280-M293 WeakPolarHBondContact CB-O 3.38Å; I280-M293 HydrophobicContact CD1-CE 4.49Å; I280-M293 HydrophobicContact CG2-CE 3.52Å; I280-M293 PolarHBondContact N-O 3.24Å; I280-T295 HydrophobicContact CD1-CG2 3.67Å
281	K	95.9	Very high	88.7	Confident	130 Å²	130	68.8 Å²	68.8	57%	0.565	35%	0.352	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-137.8	124.4	-174.9	-179.4	-175.9	176	-176.4	0	110.4	L283 W292 M293	K281-L283 PolarHBondContact O-N 3.45Å; K281-W292 CarbonylContact O-C 3.55Å; K281-W292 WeakPolarHBondContact O-CA 3.42Å; K281-M293 HydrophobicContact CB-CB 4.32Å; K281-M293 HydrophobicContact CB-CE 3.87Å; K281-M293 PolarHBondContact N-O 2.99Å; K281-M293 PolarHBondContact O-N 2.91Å
282	R	95.4	Very high	89.1	Confident	137 Å²	137	67.2 Å²	67.2	52%	0.517	34%	0.343	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-66.4	124.3	171.1	-165.3	172.6	65.3	-177.2	-2.6	109.8	E290 W292	R282-E290 VanDerWaalsContact CD-OE1 3.26Å; R282-E290 WeakPolarHBondContact CD-OE1 3.36Å; R282-E290 IonicContact CZ-OE1 2.92Å; R282-E290 IonicContact NE-OE1 2.69Å; R282-E290 IonicContact NH1-OE1 2.81Å; R282-E290 PolarHBondContact NH1-OE1 3.16Å; R282-W292 HydrophobicContact CB-CD2 4.01Å; R282-W292 HydrophobicContact CB-CE3 3.92Å; R282-W292 HydrophobicContact CB-CH2 3.9Å; R282-W292 HydrophobicContact CB-CZ2 3.98Å; R282-W292 HydrophobicContact CB-CZ3 3.86Å; R282-W292 HydrophobicContact CG-CD2 4.27Å; R282-W292 HydrophobicContact CG-CH2 4.49Å; R282-W292 HydrophobicContact CG-CZ2 4.08Å; R282-W292 VanDerWaalsContact N-CE3 3.3Å
283	L	90.8	Very high	89.3	Confident	76 Å²	76	68 Å²	68	40%	0.398	35%	0.346	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-93.9	-37.5	179.7	-62.8	176.3	0	0	0	111.6	K281 V291 M293 Y350	K281-L283 PolarHBondContact O-N 3.45Å; L283-V291 WeakPolarHBondContact CA-O 3.26Å; L283-V291 HydrophobicContact CB-CG1 4.38Å; L283-V291 WeakPolarHBondContact CB-O 3.42Å; L283-V291 HydrophobicContact CD1-CG1 4.25Å; L283-V291 PolarHBondContact N-O 3.28Å; L283-M293 HydrophobicContact CD1-CB 3.97Å; L283-M293 HydrophobicContact CD2-CB 3.96Å; L283-M293 HydrophobicContact CG-CB 3.98Å; L283-Y350 HydrophobicContact CD1-CD2 4.1Å; L283-Y350 HydrophobicContact CD1-CE2 3.76Å; L283-Y350 HydrophobicContact CD2-CE2 4.24Å
284	G	86.1	Confident	89.5	Confident	30 Å²	30	64.1 Å²	64.1	31%	0.309	32%	0.321	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-164.2	165	-177.7	0	0	0	0	0	112.5	V291	G284-V291 PolarHBondContact N-O 2.87Å; G284-V291 PolarHBondContact O-N 3.18Å
285	N	82.2	Confident	89.6	Confident	107 Å²	107	62.8 Å²	62.8	57%	0.572	32%	0.318	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-128.7	112.5	172.7	-174.8	7.3	0	0	0	107.9	G289	N285-G289 PolarHBondContact OD1-O 2.82Å
286	G	70.1	Confident	89.6	Confident	42 Å²	42	55.6 Å²	55.6	43%	0.433	28%	0.284	S	S	.	.			trans	-100	-179.3	178.8	0	0	0	0	0	112	F288 G289	G286-F288 PolarHBondContact O-N 3.4Å; G286-G289 WeakPolarHBondContact CA-O 3.38Å; G286-G289 PolarHBondContact N-O 2.89Å
287	Q	65.7	Low	89.4	Confident	80 Å²	80	58.4 Å²	58.4	37%	0.374	30%	0.299	S	S	.	.	S	Bend	trans	-60.5	-40.1	175.2	-178.4	174	-16.7	0	0	111.7	K308	Q287-K308 PolarHBondContact O-NZ 2.86Å
288	F	68.3	Low	89.1	Confident	54 Å²	54	60.4 Å²	60.4	24%	0.237	32%	0.324	C	S	.	.	S	Bend	trans	-90.3	-8.5	-169.9	-46.7	-58.5	0	0	0	113.8	G286 L307 K308 I421	G286-F288 PolarHBondContact O-N 3.4Å; F288-L307 HydrophobicContact CB-CD2 4.26Å; F288-L307 WeakPolarHBondContact O-CA 3.4Å; F288-K308 PolarHBondContact O-N 3.41Å; F288-I421 HydrophobicContact CD1-CD1 3.41Å; F288-I421 VanDerWaalsContact CD1-CD1 3.41Å; F288-I421 HydrophobicContact CD1-CG1 4.44Å; F288-I421 HydrophobicContact CD2-CD1 4.2Å; F288-I421 HydrophobicContact CE1-CD1 3.41Å; F288-I421 VanDerWaalsContact CE1-CD1 3.41Å; F288-I421 HydrophobicContact CE1-CG1 4.47Å; F288-I421 HydrophobicContact CE1-CG2 4.34Å; F288-I421 HydrophobicContact CE2-CD1 4.17Å; F288-I421 HydrophobicContact CG-CD1 3.84Å; F288-I421 HydrophobicContact CZ-CD1 3.79Å
289	G	81.6	Confident	88.5	Confident	4 Å²	4	58.4 Å²	58.4	4%	0.041	32%	0.32	C	S	.	.			trans	146.1	-159	177.7	0	0	0	0	0	111.7	N285 G286 T306	N285-G289 PolarHBondContact OD1-O 2.82Å; G286-G289 WeakPolarHBondContact CA-O 3.38Å; G286-G289 PolarHBondContact N-O 2.89Å; G289-T306 CarbonylContact C-O 3.58Å; G289-T306 VanDerWaalsContact CA-O 3.24Å; G289-T306 WeakPolarHBondContact CA-O 3.43Å
290	E	91	Very high	88.2	Confident	49 Å²	49	56.5 Å²	56.5	23%	0.229	31%	0.31	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-106.5	151.2	-171.9	-60.9	-175	135.9	0	0	111.3	R282 W292 K305 T306	R282-E290 VanDerWaalsContact CD-OE1 3.26Å; R282-E290 WeakPolarHBondContact CD-OE1 3.36Å; R282-E290 IonicContact CZ-OE1 2.92Å; R282-E290 IonicContact NE-OE1 2.69Å; R282-E290 IonicContact NH1-OE1 2.81Å; R282-E290 PolarHBondContact NH1-OE1 3.16Å; E290-W292 VanDerWaalsContact CB-NE1 3.34Å; E290-W292 WeakPolarHBondContact OE2-CZ2 3.42Å; E290-W292 PolarHBondContact OE2-NE1 3.24Å; E290-K305 CarbonylContact O-C 3.56Å; E290-K305 WeakPolarHBondContact O-CA 3.45Å; E290-T306 PolarHBondContact N-O 3.35Å; E290-T306 PolarHBondContact N-OG1 2.85Å; E290-T306 PolarHBondContact O-N 3.42Å; E290-T306 PolarHBondContact O-OG1 2.81Å
291	V	93.4	Very high	88.1	Confident	45 Å²	45	58.3 Å²	58.3	27%	0.273	32%	0.315	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-112.5	129.7	172	-173.6	0	0	0	0	108.1	L283 G284 K305	L283-V291 WeakPolarHBondContact CA-O 3.26Å; L283-V291 HydrophobicContact CB-CG1 4.38Å; L283-V291 WeakPolarHBondContact CB-O 3.42Å; L283-V291 HydrophobicContact CD1-CG1 4.25Å; L283-V291 PolarHBondContact N-O 3.28Å; G284-V291 PolarHBondContact N-O 2.87Å; G284-V291 PolarHBondContact O-N 3.18Å; V291-K305 HydrophobicContact CG2-CB 4.36Å; V291-K305 HydrophobicContact CG2-CG 4.1Å
292	W	96.1	Very high	88	Confident	59 Å²	59	52.1 Å²	52.1	22%	0.223	29%	0.288	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-123	140.7	-176.6	-68.5	80.5	0	0	0	110.5	L279 K281 R282 E290 A303 V304	L279-W292 HydrophobicContact CB-CB 4.38Å; L279-W292 HydrophobicContact CB-CD2 4.19Å; L279-W292 HydrophobicContact CB-CE3 3.95Å; L279-W292 HydrophobicContact CB-CG 4.38Å; L279-W292 HydrophobicContact CD1-CD2 4.26Å; L279-W292 HydrophobicContact CD1-CG 4.16Å; L279-W292 HydrophobicContact CD2-CB 4Å; L279-W292 HydrophobicContact CD2-CG 4.43Å; K281-W292 CarbonylContact O-C 3.55Å; K281-W292 WeakPolarHBondContact O-CA 3.42Å; R282-W292 HydrophobicContact CB-CD2 4.01Å; R282-W292 HydrophobicContact CB-CE3 3.92Å; R282-W292 HydrophobicContact CB-CH2 3.9Å; R282-W292 HydrophobicContact CB-CZ2 3.98Å; R282-W292 HydrophobicContact CB-CZ3 3.86Å; R282-W292 HydrophobicContact CG-CD2 4.27Å; R282-W292 HydrophobicContact CG-CH2 4.49Å; R282-W292 HydrophobicContact CG-CZ2 4.08Å; R282-W292 VanDerWaalsContact N-CE3 3.3Å; E290-W292 VanDerWaalsContact CB-NE1 3.34Å; E290-W292 WeakPolarHBondContact OE2-CZ2 3.42Å; E290-W292 PolarHBondContact OE2-NE1 3.24Å; W292-A303 CarbonylContact O-C 3.59Å; W292-A303 WeakPolarHBondContact O-CA 3.46Å; W292-V304 PolarHBondContact N-O 3.05Å; W292-V304 PolarHBondContact O-N 3.07Å
293	M	96.4	Very high	88.1	Confident	30 Å²	30	45.9 Å²	45.9	15%	0.148	27%	0.266	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-79.6	132.1	158.2	-178.3	-162.6	76.9	0	0	107.3	I280 K281 L283 K301 Y350	I280-M293 WeakPolarHBondContact CA-O 3.38Å; I280-M293 HydrophobicContact CB-CE 3.79Å; I280-M293 WeakPolarHBondContact CB-O 3.38Å; I280-M293 HydrophobicContact CD1-CE 4.49Å; I280-M293 HydrophobicContact CG2-CE 3.52Å; I280-M293 PolarHBondContact N-O 3.24Å; K281-M293 HydrophobicContact CB-CB 4.32Å; K281-M293 HydrophobicContact CB-CE 3.87Å; K281-M293 PolarHBondContact N-O 2.99Å; K281-M293 PolarHBondContact O-N 2.91Å; L283-M293 HydrophobicContact CD1-CB 3.97Å; L283-M293 HydrophobicContact CD2-CB 3.96Å; L283-M293 HydrophobicContact CG-CB 3.98Å; M293-K301 HydrophobicContact CG-CG 4.37Å; M293-K301 HydrophobicContact SD-CD 4.47Å; M293-Y350 HydrophobicContact CB-CD2 4.42Å; M293-Y350 HydrophobicContact CB-CE2 4.17Å; M293-Y350 HydrophobicContact CG-CD2 4.1Å; M293-Y350 HydrophobicContact CG-CE2 3.97Å; M293-Y350 HydrophobicContact SD-CE2 4.49Å
294	G	96.3	Very high	88.3	Confident	0 Å²	0	42.3 Å²	42.3	0%	0	25%	0.247	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-145.5	-175	178.4	0	0	0	0	0	113.2	Q278 V302	Q278-G294 CarbonylContact O-C 3.56Å; Q278-G294 WeakPolarHBondContact O-CA 3.36Å; G294-V302 PolarHBondContact N-O 3.2Å; G294-V302 PolarHBondContact O-N 3.15Å
295	T	96.1	Very high	88.6	Confident	23 Å²	23	41.8 Å²	41.8	14%	0.141	24%	0.236	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-123.5	139.5	171	49.1	0	0	0	0	110	L277 Q278 I280 T300	L277-T295 WeakPolarHBondContact CA-O 3.44Å; Q278-T295 PolarHBondContact N-O 3.1Å; Q278-T295 PolarHBondContact O-N 3.3Å; Q278-T295 PolarHBondContact OE1-OG1 2.99Å; I280-T295 HydrophobicContact CD1-CG2 3.67Å; T295-T300 CarbonylContact C-O 3.43Å; T295-T300 VanDerWaalsContact CA-O 3.28Å; T295-T300 WeakPolarHBondContact CA-O 3.38Å
296	W	94.3	Very high	89	Confident	9 Å²	9	37.5 Å²	37.5	3%	0.034	21%	0.214	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-96.7	128.9	166.5	175.6	74.2	0	0	0	109.1	R102 T103 L262 T266 S276 L277 G298 T299 T300 V302	R102-W296 HydrophobicContact CB-CZ3 3.98Å; T103-W296 HydrophobicContact CG2-CH2 3.68Å; T103-W296 HydrophobicContact CG2-CZ3 4.33Å; L262-W296 HydrophobicContact CB-CD2 4.13Å; L262-W296 HydrophobicContact CB-CE3 3.88Å; L262-W296 HydrophobicContact CB-CH2 3.83Å; L262-W296 HydrophobicContact CB-CZ2 4.09Å; L262-W296 HydrophobicContact CB-CZ3 3.72Å; L262-W296 HydrophobicContact CD1-CD2 3.87Å; L262-W296 HydrophobicContact CD1-CE3 4.38Å; L262-W296 HydrophobicContact CD1-CG 3.96Å; L262-W296 HydrophobicContact CD2-CB 4.4Å; L262-W296 HydrophobicContact CD2-CD2 4.06Å; L262-W296 HydrophobicContact CD2-CE3 3.85Å; L262-W296 HydrophobicContact CD2-CG 4.31Å; L262-W296 HydrophobicContact CD2-CZ3 4.47Å; L262-W296 HydrophobicContact CG-CD2 4.23Å; L262-W296 HydrophobicContact CG-CE3 4.24Å; T266-W296 HydrophobicContact CG2-CZ2 4.12Å; S276-W296 CarbonylContact O-C 3.57Å; S276-W296 WeakPolarHBondContact O-CA 3.2Å; L277-W296 HydrophobicContact CD2-CB 4.08Å; W296-G298 PolarHBondContact O-N 2.91Å; W296-T299 PolarHBondContact O-N 3.38Å; W296-T299 VanDerWaalsContact O-N 3.1Å; W296-T299 PolarHBondContact O-OG1 2.8Å; W296-T300 PolarHBondContact N-O 3.32Å; W296-T300 PolarHBondContact O-N 3.13Å; W296-V302 HydrophobicContact CB-CG1 4.21Å; W296-V302 HydrophobicContact CB-CG2 4.49Å
297	N	91.4	Very high	89.8	Confident	75 Å²	75	36 Å²	36	40%	0.401	20%	0.196	S	C	.	.	T	Hydrogen-bonded Turn	trans	49.7	27.7	-174.8	-75.1	-5.2	0	0	0	114.3	S276 T299	S276-N297 WeakPolarHBondContact CB-OD1 3.38Å; S276-N297 PolarHBondContact O-N 3.4Å; N297-T299 PolarHBondContact O-N 3.2Å
298	G	88.9	Confident	90.7	Very high	60 Å²	60	37.2 Å²	37.2	62%	0.619	20%	0.2	S	C	*	.	T	Hydrogen-bonded Turn	trans	68.7	-6.7	-176.9	0	0	0	0	0	115.6	W296	W296-G298 PolarHBondContact O-N 2.91Å
299	T	86.1	Confident	91.5	Very high	78 Å²	78	39 Å²	39	48%	0.479	22%	0.217	S	C	.	.	T	Hydrogen-bonded Turn	trans	-106	-42.5	-172.9	56.4	0	0	0	0	112.5	W296 N297	W296-T299 PolarHBondContact O-N 3.38Å; W296-T299 VanDerWaalsContact O-N 3.1Å; W296-T299 PolarHBondContact O-OG1 2.8Å; N297-T299 PolarHBondContact O-N 3.2Å
300	T	89.9	Confident	91.3	Very high	13 Å²	13	41.8 Å²	41.8	8%	0.08	25%	0.246	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-106.3	118.8	-166.8	-55	0	0	0	0	110.9	R102 L262 T295 W296 V302	R102-T300 WeakPolarHBondContact CD-OG1 3.43Å; L262-T300 HydrophobicContact CD2-CG2 3.89Å; T295-T300 CarbonylContact C-O 3.43Å; T295-T300 VanDerWaalsContact CA-O 3.28Å; T295-T300 WeakPolarHBondContact CA-O 3.38Å; W296-T300 PolarHBondContact N-O 3.32Å; W296-T300 PolarHBondContact O-N 3.13Å; T300-V302 HydrophobicContact CG2-CG1 4.4Å
301	K	93.4	Very high	90.5	Very high	123 Å²	123	40.9 Å²	40.9	54%	0.535	24%	0.244	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-70.6	130.6	176.7	-170.3	179.4	-65.7	175.6	0	110.9	M293 Y350	M293-K301 HydrophobicContact CG-CG 4.37Å; M293-K301 HydrophobicContact SD-CD 4.47Å; K301-Y350 HydrophobicContact CD-CD1 3.42Å; K301-Y350 VanDerWaalsContact CD-CD1 3.42Å; K301-Y350 HydrophobicContact CD-CE1 3.82Å; K301-Y350 HydrophobicContact CD-CG 4.04Å; K301-Y350 HydrophobicContact CG-CD1 4.02Å; K301-Y350 HydrophobicContact CG-CG 4.14Å
302	V	95.3	Very high	89.6	Confident	0 Å²	0	39.3 Å²	39.3	0%	0	23%	0.234	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-137.3	160	-176.3	-65.8	0	0	0	0	111.8	L262 L277 G294 W296 T300 V304 Y336 V347	L262-V302 HydrophobicContact CD2-CG1 4.21Å; L277-V302 HydrophobicContact CD2-CG2 4.18Å; G294-V302 PolarHBondContact N-O 3.2Å; G294-V302 PolarHBondContact O-N 3.15Å; W296-V302 HydrophobicContact CB-CG1 4.21Å; W296-V302 HydrophobicContact CB-CG2 4.49Å; T300-V302 HydrophobicContact CG2-CG1 4.4Å; V302-V304 HydrophobicContact CG2-CG2 3.88Å; V302-Y336 HydrophobicContact CG1-CD2 4.18Å; V302-Y336 HydrophobicContact CG1-CE2 4.49Å; V302-V347 HydrophobicContact CB-CG1 3.74Å; V302-V347 HydrophobicContact CG1-CG1 3.85Å; V302-V347 HydrophobicContact CG2-CG1 3.99Å
303	A	95.8	Very high	88.9	Confident	7 Å²	7	38.8 Å²	38.8	6%	0.058	24%	0.239	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-102.2	127.8	163.7	0	0	0	0	0	109.2	W292 V347 T348 Y350	W292-A303 CarbonylContact O-C 3.59Å; W292-A303 WeakPolarHBondContact O-CA 3.46Å; A303-V347 WeakPolarHBondContact O-CA 3.45Å; A303-T348 PolarHBondContact N-O 2.97Å; A303-T348 PolarHBondContact O-N 3.32Å; A303-T348 PolarHBondContact O-OG1 3.48Å; A303-Y350 HydrophobicContact CB-CD2 4.46Å
304	V	95.6	Very high	88.3	Confident	0 Å²	0	39.2 Å²	39.2	0%	0	24%	0.244	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-116	113.2	-178.8	-172.6	0	0	0	0	108.9	L277 L279 W292 V302 Y345 I346 V347	L277-V304 HydrophobicContact CD1-CG1 4.46Å; L277-V304 HydrophobicContact CD1-CG2 4.49Å; L277-V304 HydrophobicContact CD2-CG2 4.25Å; L279-V304 HydrophobicContact CD2-CB 3.72Å; L279-V304 HydrophobicContact CD2-CG1 3.87Å; L279-V304 HydrophobicContact CD2-CG2 3.88Å; W292-V304 PolarHBondContact N-O 3.05Å; W292-V304 PolarHBondContact O-N 3.07Å; V302-V304 HydrophobicContact CG2-CG2 3.88Å; V304-Y345 HydrophobicContact CG1-CD2 3.63Å; V304-Y345 HydrophobicContact CG1-CE2 4.3Å; V304-Y345 HydrophobicContact CG1-CG 3.77Å; V304-I346 WeakPolarHBondContact CA-O 3.49Å; V304-V347 HydrophobicContact CG2-CG2 4.47Å
305	K	92.5	Very high	87.7	Confident	19 Å²	19	45.1 Å²	45.1	8%	0.083	27%	0.271	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-93.6	120.4	172	-175.5	175.6	-165.8	174.4	0	108.8	E290 V291 Y345 I346 D414 L417	E290-K305 CarbonylContact O-C 3.56Å; E290-K305 WeakPolarHBondContact O-CA 3.45Å; V291-K305 HydrophobicContact CG2-CB 4.36Å; V291-K305 HydrophobicContact CG2-CG 4.1Å; K305-Y345 CarbonylContact O-C 3.57Å; K305-Y345 WeakPolarHBondContact O-CA 3.33Å; K305-I346 HydrophobicContact CB-CB 4.27Å; K305-I346 HydrophobicContact CD-CD1 4.39Å; K305-I346 PolarHBondContact N-O 3.39Å; K305-I346 PolarHBondContact O-N 2.97Å; K305-D414 IonicContact NZ-OD1 3.77Å; K305-D414 PolarHBondContact NZ-OD1 2.59Å; K305-D414 IonicContact NZ-OD2 2.88Å; K305-D414 PolarHBondContact NZ-OD2 3.46Å; K305-L417 HydrophobicContact CD-CD1 4.03Å
306	T	91.5	Very high	86.9	Confident	18 Å²	18	46.5 Å²	46.5	11%	0.11	28%	0.282	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-92.2	134.5	175.1	69.3	0	0	0	0	108.6	G289 E290 Y345	G289-T306 CarbonylContact C-O 3.58Å; G289-T306 VanDerWaalsContact CA-O 3.24Å; G289-T306 WeakPolarHBondContact CA-O 3.43Å; E290-T306 PolarHBondContact N-O 3.35Å; E290-T306 PolarHBondContact N-OG1 2.85Å; E290-T306 PolarHBondContact O-N 3.42Å; E290-T306 PolarHBondContact O-OG1 2.81Å; T306-Y345 HydrophobicContact CG2-CD1 3.64Å; T306-Y345 HydrophobicContact CG2-CE1 3.31Å; T306-Y345 HydrophobicContact CG2-CG 4.45Å
307	L	86.4	Confident	86.3	Confident	10 Å²	10	46.1 Å²	46.1	5%	0.052	28%	0.281	C	S	.	.	P	Polyproline II helix	trans	-97	141.2	170.8	-59.1	-177.7	0	0	0	109.6	F288 M312 F317 I344 I346	F288-L307 HydrophobicContact CB-CD2 4.26Å; F288-L307 WeakPolarHBondContact O-CA 3.4Å; L307-M312 HydrophobicContact CD1-SD 4.07Å; L307-F317 HydrophobicContact CD1-CD2 4.45Å; L307-F317 HydrophobicContact CD1-CE2 4.49Å; L307-I344 HydrophobicContact CB-CB 4.24Å; L307-I344 HydrophobicContact CD1-CB 4.2Å; L307-I344 HydrophobicContact CD1-CG2 3.86Å; L307-I344 HydrophobicContact CG-CB 4.45Å; L307-I344 HydrophobicContact CG-CG2 4.32Å; L307-I344 PolarHBondContact N-O 3.3Å; L307-I346 HydrophobicContact CD1-CD1 4.32Å; L307-I346 HydrophobicContact CD2-CD1 4.43Å; L307-I346 HydrophobicContact CG-CD1 4.43Å
308	K	83.9	Confident	86	Confident	105 Å²	105	44.4 Å²	44.4	46%	0.457	27%	0.271	S	S	.	.	P	Polyproline II helix	trans	-64.5	139.9	174.5	-68.9	172.5	-177.3	162.1	0	109.6	Q287 F288 G310 T311	Q287-K308 PolarHBondContact O-NZ 2.86Å; F288-K308 PolarHBondContact O-N 3.41Å; K308-G310 PolarHBondContact O-N 2.82Å; K308-T311 VanDerWaalsContact O-CB 3.28Å; K308-T311 WeakPolarHBondContact O-CB 3.22Å; K308-T311 PolarHBondContact O-N 3.11Å; K308-T311 VanDerWaalsContact O-N 3.12Å; K308-T311 PolarHBondContact O-OG1 3.2Å
309	P	84.6	Confident	85.6	Confident	92 Å²	92	47.9 Å²	47.9	60%	0.597	27%	0.272	S	S	*	.	T	Hydrogen-bonded Turn	trans	-52.8	140.7	173.8	-26.3	34.7	0	0	0	111.8	T311	P309-T311 PolarHBondContact O-N 2.97Å
310	G	77.6	Confident	85.2	Confident	63 Å²	63	44.3 Å²	44.3	65%	0.649	25%	0.249	S	C	*	.	T	Hydrogen-bonded Turn	trans	74.2	7.5	-177.8	0	0	0	0	0	115.3	K308 M312 E342	K308-G310 PolarHBondContact O-N 2.82Å; G310-M312 VanDerWaalsContact C-N 3.29Å; G310-E342 PolarHBondContact N-OE1 2.94Å
311	T	75.1	Confident	84.8	Confident	29 Å²	29	43.9 Å²	43.9	18%	0.178	25%	0.247	C	C	.	.	S	Bend	trans	-64.2	-38.6	170.2	-59.1	0	0	0	0	110.6	K308 P309 I421	K308-T311 VanDerWaalsContact O-CB 3.28Å; K308-T311 WeakPolarHBondContact O-CB 3.22Å; K308-T311 PolarHBondContact O-N 3.11Å; K308-T311 VanDerWaalsContact O-N 3.12Å; K308-T311 PolarHBondContact O-OG1 3.2Å; P309-T311 PolarHBondContact O-N 2.97Å; T311-I421 HydrophobicContact CG2-CG1 4.31Å
312	M	74.8	Confident	84.2	Confident	13 Å²	13	43 Å²	43	6%	0.064	25%	0.245	C	C	.	.	S	Bend	trans	-165	164.2	179.7	62.1	-173.9	-52.2	0	0	111.4	L307 G310 F317 I344 L420	L307-M312 HydrophobicContact CD1-SD 4.07Å; G310-M312 VanDerWaalsContact C-N 3.29Å; M312-F317 HydrophobicContact CE-CB 3.5Å; M312-F317 VanDerWaalsContact CE-CB 3.5Å; M312-F317 HydrophobicContact CE-CD2 4.42Å; M312-F317 HydrophobicContact CE-CG 4.47Å; M312-F317 VanDerWaalsContact CE-N 3.25Å; M312-F317 HydrophobicContact CG-CB 4.3Å; M312-F317 HydrophobicContact SD-CB 3.75Å; M312-F317 HydrophobicContact SD-CD2 3.94Å; M312-F317 HydrophobicContact SD-CG 4.26Å; M312-I344 HydrophobicContact CG-CD1 4.19Å; M312-L420 HydrophobicContact CE-CB 3.65Å; M312-L420 HydrophobicContact CE-CD1 3.77Å; M312-L420 HydrophobicContact CE-CD2 3.39Å; M312-L420 HydrophobicContact CE-CG 3.77Å; M312-L420 HydrophobicContact SD-CB 3.98Å; M312-L420 HydrophobicContact SD-CD1 3.9Å; M312-L420 HydrophobicContact SD-CG 4.35Å
313	S	81.4	Confident	83.4	Confident	48 Å²	48	45.8 Å²	45.8	34%	0.336	26%	0.259	S	S	.	.			trans	-73.9	147.9	171.8	64.3	0	0	0	0	111.5	E315 S316 F317	S313-E315 VanDerWaalsContact C-N 3.25Å; S313-E315 WeakPolarHBondContact CB-OE2 3.23Å; S313-E315 PolarHBondContact O-N 3.2Å; S313-S316 PolarHBondContact O-N 3.25Å; S313-S316 WeakPolarHBondContact OG-CB 3.36Å; S313-S316 PolarHBondContact OG-N 3.28Å; S313-S316 PolarHBondContact OG-OG 2.96Å; S313-F317 PolarHBondContact O-N 3.21Å; S313-F317 VanDerWaalsContact O-N 3.16Å
314	P	83.3	Confident	82.6	Confident	38 Å²	38	46 Å²	46	25%	0.247	26%	0.259	C	S	.	.	H	α-helix	trans	-53.7	-41.3	172.2	-27.9	36.7	0	0	0	112.5	S316 F317 L318	P314-S316 PolarHBondContact O-N 3.2Å; P314-F317 WeakPolarHBondContact O-CB 3.34Å; P314-F317 PolarHBondContact O-N 3.47Å; P314-F317 VanDerWaalsContact O-N 3.16Å; P314-L318 WeakPolarHBondContact O-CG 3.41Å; P314-L318 PolarHBondContact O-N 3.04Å
315	E	83.2	Confident	81.8	Confident	124 Å²	124	48.3 Å²	48.3	58%	0.579	27%	0.269	S	S	*	.	H	α-helix	trans	-61.9	-48.2	-176.9	-61.8	74.7	-162	0	0	112.1	S313 F317 L318 E319	S313-E315 VanDerWaalsContact C-N 3.25Å; S313-E315 WeakPolarHBondContact CB-OE2 3.23Å; S313-E315 PolarHBondContact O-N 3.2Å; E315-F317 PolarHBondContact O-N 3.4Å; E315-L318 PolarHBondContact O-N 2.87Å; E315-E319 PolarHBondContact O-N 3.3Å
316	S	79.3	Confident	81.3	Confident	53 Å²	53	54.5 Å²	54.5	37%	0.371	30%	0.296	S	S	.	.	H	α-helix	trans	-65.7	-31.1	177.6	-62.2	0	0	0	0	112.1	S313 P314 E320	S313-S316 PolarHBondContact O-N 3.25Å; S313-S316 WeakPolarHBondContact OG-CB 3.36Å; S313-S316 PolarHBondContact OG-N 3.28Å; S313-S316 PolarHBondContact OG-OG 2.96Å; P314-S316 PolarHBondContact O-N 3.2Å; S316-E320 PolarHBondContact O-N 2.85Å
317	F	83.2	Confident	81	Confident	1 Å²	1	54 Å²	54	0%	0.004	29%	0.293	C	S	.	.	H	α-helix	trans	-66.9	-43.8	174.7	171.4	-112	0	0	0	111.9	L307 M312 S313 P314 E315 E319 E320 A321 V338 I344 I346 L420	L307-F317 HydrophobicContact CD1-CD2 4.45Å; L307-F317 HydrophobicContact CD1-CE2 4.49Å; M312-F317 HydrophobicContact CE-CB 3.5Å; M312-F317 VanDerWaalsContact CE-CB 3.5Å; M312-F317 HydrophobicContact CE-CD2 4.42Å; M312-F317 HydrophobicContact CE-CG 4.47Å; M312-F317 VanDerWaalsContact CE-N 3.25Å; M312-F317 HydrophobicContact CG-CB 4.3Å; M312-F317 HydrophobicContact SD-CB 3.75Å; M312-F317 HydrophobicContact SD-CD2 3.94Å; M312-F317 HydrophobicContact SD-CG 4.26Å; S313-F317 PolarHBondContact O-N 3.21Å; S313-F317 VanDerWaalsContact O-N 3.16Å; P314-F317 WeakPolarHBondContact O-CB 3.34Å; P314-F317 PolarHBondContact O-N 3.47Å; P314-F317 VanDerWaalsContact O-N 3.16Å; E315-F317 PolarHBondContact O-N 3.4Å; F317-E319 PolarHBondContact O-N 3.23Å; F317-E320 PolarHBondContact O-N 3.45Å; F317-A321 VanDerWaalsContact O-CB 3.29Å; F317-A321 WeakPolarHBondContact O-CB 3.16Å; F317-A321 PolarHBondContact O-N 3.12Å; F317-V338 HydrophobicContact CD1-CG2 4.32Å; F317-V338 HydrophobicContact CE1-CB 3.64Å; F317-V338 HydrophobicContact CE1-CG1 4.12Å; F317-V338 HydrophobicContact CE1-CG2 3.3Å; F317-V338 HydrophobicContact CZ-CB 3.63Å; F317-V338 HydrophobicContact CZ-CG1 3.63Å; F317-V338 HydrophobicContact CZ-CG2 3.71Å; F317-I344 HydrophobicContact CB-CD1 4.02Å; F317-I344 HydrophobicContact CD1-CD1 4.1Å; F317-I344 HydrophobicContact CD1-CG1 4.39Å; F317-I344 HydrophobicContact CD1-CG2 3.6Å; F317-I344 HydrophobicContact CD2-CG2 4.06Å; F317-I344 HydrophobicContact CE1-CG2 3.23Å; F317-I344 HydrophobicContact CE2-CG2 3.78Å; F317-I344 HydrophobicContact CG-CD1 4.06Å; F317-I344 HydrophobicContact CG-CG2 3.97Å; F317-I344 HydrophobicContact CZ-CG2 3.34Å; F317-I346 HydrophobicContact CE2-CD1 3.91Å; F317-I346 HydrophobicContact CE2-CG1 3.59Å; F317-I346 HydrophobicContact CZ-CD1 4.42Å; F317-I346 HydrophobicContact CZ-CG1 3.59Å; F317-L420 HydrophobicContact CD2-CD1 4.35Å
318	L	83.7	Confident	81	Confident	38 Å²	38	57.7 Å²	57.7	20%	0.199	31%	0.306	C	S	.	.	H	α-helix	trans	-61.6	-42	178.6	-67.9	-180	0	0	0	112.4	W270 P314 E315 E320 A321 Q322	W270-L318 HydrophobicContact CH2-CD2 3Å; W270-L318 HydrophobicContact CH2-CG 4.43Å; W270-L318 HydrophobicContact CZ2-CD2 3.49Å; W270-L318 VanDerWaalsContact CZ2-CD2 3.49Å; W270-L318 HydrophobicContact CZ3-CD2 4.05Å; P314-L318 WeakPolarHBondContact O-CG 3.41Å; P314-L318 PolarHBondContact O-N 3.04Å; E315-L318 PolarHBondContact O-N 2.87Å; L318-E320 PolarHBondContact O-N 3.24Å; L318-A321 PolarHBondContact O-N 3.4Å; L318-Q322 WeakPolarHBondContact O-CG 3.47Å; L318-Q322 PolarHBondContact O-N 3.3Å
319	E	81.6	Confident	81.3	Confident	134 Å²	134	55 Å²	55	63%	0.626	30%	0.295	S	S	*	.	H	α-helix	trans	-59.8	-44.3	177.3	-71.7	-178.9	175.2	0	0	112.1	E315 F317 Q322 I323	E315-E319 PolarHBondContact O-N 3.3Å; F317-E319 PolarHBondContact O-N 3.23Å; E319-Q322 WeakPolarHBondContact O-CB 3.49Å; E319-Q322 PolarHBondContact O-N 3.48Å; E319-I323 PolarHBondContact O-N 3.42Å
320	E	76.8	Confident	81.6	Confident	3 Å²	3	56.2 Å²	56.2	1%	0.014	30%	0.296	C	S	.	.	H	α-helix	trans	-76.6	-35.8	179.6	-165	72.8	-143.2	0	0	112.2	S316 F317 L318 Q322 I323 M324 Y392 R419 L420	S316-E320 PolarHBondContact O-N 2.85Å; F317-E320 PolarHBondContact O-N 3.45Å; L318-E320 PolarHBondContact O-N 3.24Å; E320-Q322 PolarHBondContact O-N 3.4Å; E320-I323 WeakPolarHBondContact O-CA 3.36Å; E320-I323 WeakPolarHBondContact O-CB 3.49Å; E320-I323 PolarHBondContact O-N 2.77Å; E320-M324 WeakPolarHBondContact O-CG 3.37Å; E320-M324 PolarHBondContact O-N 3.47Å; E320-Y392 PolarHBondContact OE1-OH 3Å; E320-R419 IonicContact OE1-NE 3.67Å; E320-R419 IonicContact OE2-CZ 2.74Å; E320-R419 IonicContact OE2-NE 2.65Å; E320-R419 PolarHBondContact OE2-NE 3.03Å; E320-R419 IonicContact OE2-NH2 2.75Å; E320-R419 PolarHBondContact OE2-NH2 3.45Å; E320-L420 HydrophobicContact CB-CD1 3.87Å; E320-L420 HydrophobicContact CB-CD2 3.23Å; E320-L420 HydrophobicContact CB-CG 3.83Å; E320-L420 HydrophobicContact CG-CD1 3.86Å; E320-L420 HydrophobicContact CG-CD2 3.61Å; E320-L420 HydrophobicContact CG-CG 3.71Å
321	A	81.5	Confident	82.4	Confident	3 Å²	3	54 Å²	54	3%	0.025	27%	0.269	C	S	.	.	H	α-helix	trans	-58.1	-34.9	173.3	0	0	0	0	0	111.5	F317 L318 I323 M324 K325 L335 V338	F317-A321 VanDerWaalsContact O-CB 3.29Å; F317-A321 WeakPolarHBondContact O-CB 3.16Å; F317-A321 PolarHBondContact O-N 3.12Å; L318-A321 PolarHBondContact O-N 3.4Å; A321-I323 VanDerWaalsContact C-N 3.34Å; A321-I323 PolarHBondContact O-N 3.24Å; A321-M324 PolarHBondContact O-N 2.96Å; A321-K325 WeakPolarHBondContact O-CB 3.48Å; A321-K325 PolarHBondContact O-N 3.17Å; A321-L335 HydrophobicContact CB-CD2 4.48Å; A321-V338 HydrophobicContact CB-CG1 4.49Å; A321-V338 HydrophobicContact CB-CG2 4.41Å
322	Q	81.1	Confident	83.3	Confident	104 Å²	104	52.7 Å²	52.7	49%	0.486	26%	0.261	S	S	.	.	H	α-helix	trans	-64.3	-35.6	172.7	-73.2	177.7	8.3	0	0	112.9	L318 E319 E320 K326	L318-Q322 WeakPolarHBondContact O-CG 3.47Å; L318-Q322 PolarHBondContact O-N 3.3Å; E319-Q322 WeakPolarHBondContact O-CB 3.49Å; E319-Q322 PolarHBondContact O-N 3.48Å; E320-Q322 PolarHBondContact O-N 3.4Å; Q322-K326 WeakPolarHBondContact O-CG 3.47Å
323	I	78.9	Confident	84.2	Confident	60 Å²	60	52.4 Å²	52.4	31%	0.308	26%	0.26	S	S	.	.	H	α-helix	trans	-70.9	-48.1	175.1	-59.1	170.3	0	0	0	109.6	E319 E320 A321 K325 K326 L327 Y392	E319-I323 PolarHBondContact O-N 3.42Å; E320-I323 WeakPolarHBondContact O-CA 3.36Å; E320-I323 WeakPolarHBondContact O-CB 3.49Å; E320-I323 PolarHBondContact O-N 2.77Å; A321-I323 VanDerWaalsContact C-N 3.34Å; A321-I323 PolarHBondContact O-N 3.24Å; I323-K325 PolarHBondContact O-N 3.01Å; I323-K326 WeakPolarHBondContact O-CB 3.43Å; I323-K326 PolarHBondContact O-N 3.13Å; I323-L327 PolarHBondContact O-N 2.92Å; I323-Y392 HydrophobicContact CG2-CD2 3.94Å; I323-Y392 HydrophobicContact CG2-CE2 3.52Å
324	M	78.8	Confident	84.6	Confident	10 Å²	10	51.2 Å²	51.2	5%	0.049	25%	0.249	C	C	.	.	H	α-helix	trans	-55.3	-38.9	177.5	-68	175.2	67.9	0	0	111.9	E320 A321 K326 L327 L335 F415 L417	E320-M324 WeakPolarHBondContact O-CG 3.37Å; E320-M324 PolarHBondContact O-N 3.47Å; A321-M324 PolarHBondContact O-N 2.96Å; M324-K326 VanDerWaalsContact C-N 3.33Å; M324-K326 PolarHBondContact O-N 3.2Å; M324-L327 PolarHBondContact O-N 2.69Å; M324-L335 HydrophobicContact CB-CD2 3.96Å; M324-F415 HydrophobicContact CB-CE2 4.19Å; M324-F415 WeakPolarHBondContact CE-O 3.26Å; M324-F415 HydrophobicContact CG-CD2 4.44Å; M324-F415 HydrophobicContact CG-CE2 4.28Å; M324-L417 HydrophobicContact CE-CD2 4.36Å; M324-L417 HydrophobicContact SD-CD2 4.14Å
325	K	77.7	Confident	84.8	Confident	49 Å²	49	50.1 Å²	50.1	21%	0.213	24%	0.24	C	C	.	.	H	α-helix	trans	-63	-35	176.7	-176.4	176.1	179	176.7	0	113.6	K267 A321 I323 L327	K267-K325 PolarHBondContact O-NZ 3.48Å; A321-K325 WeakPolarHBondContact O-CB 3.48Å; A321-K325 PolarHBondContact O-N 3.17Å; I323-K325 PolarHBondContact O-N 3.01Å; K325-L327 PolarHBondContact O-N 3.08Å
326	K	82	Confident	85	Confident	150 Å²	150	45.3 Å²	45.3	65%	0.652	22%	0.217	S	C	*	.	H	α-helix	trans	-71.5	-23.2	179.5	-68.2	174.9	-172.2	175.7	0	112.2	Q322 I323 M324 R328 Y386	Q322-K326 WeakPolarHBondContact O-CG 3.47Å; I323-K326 WeakPolarHBondContact O-CB 3.43Å; I323-K326 PolarHBondContact O-N 3.13Å; M324-K326 VanDerWaalsContact C-N 3.33Å; M324-K326 PolarHBondContact O-N 3.2Å; K326-R328 PolarHBondContact O-N 2.74Å; K326-R328 VanDerWaalsContact O-N 3.14Å; K326-Y386 PolarHBondContact O-OH 3.17Å
327	L	85.5	Confident	85.6	Confident	7 Å²	7	42.9 Å²	42.9	4%	0.037	20%	0.2	C	C	.	.			trans	-82.2	87.8	178.7	-60.4	177.3	0	0	0	109.8	I323 M324 K325 L332 Y386 M390 Y392 F415	I323-L327 PolarHBondContact O-N 2.92Å; M324-L327 PolarHBondContact O-N 2.69Å; K325-L327 PolarHBondContact O-N 3.08Å; L327-L332 HydrophobicContact CB-CD1 4.07Å; L327-Y386 HydrophobicContact CB-CE1 4.18Å; L327-Y386 HydrophobicContact CD2-CE1 4.05Å; L327-M390 HydrophobicContact CD2-CB 3.62Å; L327-M390 HydrophobicContact CD2-CE 4.31Å; L327-M390 HydrophobicContact CD2-CG 3.74Å; L327-Y392 HydrophobicContact CD1-CD1 3.76Å; L327-Y392 HydrophobicContact CD1-CD2 4.37Å; L327-Y392 HydrophobicContact CD1-CE1 4Å; L327-Y392 HydrophobicContact CD1-CG 3.94Å; L327-F415 HydrophobicContact CB-CE2 3.95Å; L327-F415 HydrophobicContact CD1-CD2 3.78Å; L327-F415 HydrophobicContact CD1-CE2 3.79Å; L327-F415 HydrophobicContact CG-CE2 4.49Å
328	R	86.8	Confident	86	Confident	88 Å²	88	42.9 Å²	42.9	33%	0.332	20%	0.2	S	C	.	.			trans	-109.3	114.9	177.3	-69.1	-172.2	172.6	-164.6	-7.1	110.3	D124 D261 K326 Y386	D124-R328 IonicContact OD2-NH1 3.43Å; D124-R328 PolarHBondContact OD2-NH1 3.4Å; D261-R328 VanDerWaalsContact CG-NH2 3.32Å; D261-R328 IonicContact OD1-NH2 3.32Å; D261-R328 PolarHBondContact OD1-NH2 3.44Å; D261-R328 IonicContact OD2-CZ 2.75Å; D261-R328 IonicContact OD2-NH1 3.05Å; D261-R328 IonicContact OD2-NH2 2.77Å; D261-R328 PolarHBondContact OD2-NH2 3.25Å; K326-R328 PolarHBondContact O-N 2.74Å; K326-R328 VanDerWaalsContact O-N 3.14Å; R328-Y386 PolarHBondContact N-OH 3.48Å; R328-Y386 VanDerWaalsContact N-OH 3.1Å; R328-Y386 PolarHBondContact O-OH 2.89Å
329	H	90.9	Very high	86.5	Confident	49 Å²	49	41.3 Å²	41.3	23%	0.227	19%	0.192	C	C	.	.			trans	-157.9	145.9	177.3	-177.9	-98.9	0	0	0	111.1	K331 L332 Y386	H329-K331 PolarHBondContact ND1-N 3.19Å; H329-K331 VanDerWaalsContact ND1-N 3.13Å; H329-K331 PolarHBondContact O-N 3.46Å; H329-L332 HydrophobicContact CB-CB 4.46Å; H329-L332 HydrophobicContact CB-CD1 4.12Å; H329-L332 HydrophobicContact CB-CG 3.99Å; H329-L332 PolarHBondContact O-N 2.98Å; H329-Y386 HydrophobicContact CB-CD1 3.61Å; H329-Y386 HydrophobicContact CB-CD2 4.09Å; H329-Y386 HydrophobicContact CB-CE1 3.86Å; H329-Y386 HydrophobicContact CB-CE2 4.33Å; H329-Y386 HydrophobicContact CB-CG 3.73Å; H329-Y386 AromaticContact CD2-CD2 3.83Å; H329-Y386 AromaticContact CD2-CG 3.78Å; H329-Y386 AromaticContact CG-CG 3.78Å
330	D	90.5	Very high	86.8	Confident	116 Å²	116	35.7 Å²	35.7	62%	0.62	17%	0.168	S	C	*	.	T	Hydrogen-bonded Turn	trans	-60.4	-20.7	-175	-71.5	-10.4	0	0	0	114.6	K411	D330-K411 WeakPolarHBondContact O-CE 3.4Å
331	K	95.3	Very high	87.4	Confident	17 Å²	17	42.3 Å²	42.3	7%	0.074	20%	0.199	C	C	.	.	T	Hydrogen-bonded Turn	trans	-105.6	12.9	179.1	-51.7	-60.6	-177.1	-82.2	0	113.2	D164 H329 Q379 A382 C410 K411 I412	D164-K331 IonicContact OD1-NZ 3.7Å; H329-K331 PolarHBondContact ND1-N 3.19Å; H329-K331 VanDerWaalsContact ND1-N 3.13Å; H329-K331 PolarHBondContact O-N 3.46Å; K331-Q379 WeakPolarHBondContact CB-O 3.34Å; K331-Q379 HydrophobicContact CD-CB 4.02Å; K331-Q379 HydrophobicContact CD-CG 4.27Å; K331-Q379 WeakPolarHBondContact CG-O 3.43Å; K331-A382 HydrophobicContact CG-CB 4.4Å; K331-C410 WeakPolarHBondContact CD-O 3.46Å; K331-K411 CarbonylContact O-C 3.6Å; K331-K411 WeakPolarHBondContact O-CA 3.42Å; K331-I412 PolarHBondContact O-N 3.34Å
332	L	93.9	Very high	87.7	Confident	2 Å²	2	46.7 Å²	46.7	1%	0.01	22%	0.219	C	C	.	.	B	Isolated β-bridge	trans	-112.2	145.6	167.4	-59.9	-174.3	0	0	0	109.3	L327 H329 Q334 Y386 I387 I412 F415	L327-L332 HydrophobicContact CB-CD1 4.07Å; H329-L332 HydrophobicContact CB-CB 4.46Å; H329-L332 HydrophobicContact CB-CD1 4.12Å; H329-L332 HydrophobicContact CB-CG 3.99Å; H329-L332 PolarHBondContact O-N 2.98Å; L332-Q334 PolarHBondContact O-N 3.21Å; L332-Y386 HydrophobicContact CD1-CD1 3.68Å; L332-Y386 HydrophobicContact CD1-CE1 3.8Å; L332-I387 HydrophobicContact CD1-CG1 4.23Å; L332-I387 HydrophobicContact CD2-CD1 3.74Å; L332-I387 HydrophobicContact CD2-CG1 4.16Å; L332-I412 HydrophobicContact CD2-CB 3.73Å; L332-I412 HydrophobicContact CD2-CD1 3.83Å; L332-I412 HydrophobicContact CD2-CG1 4.21Å; L332-I412 HydrophobicContact CD2-CG2 4.4Å; L332-F415 HydrophobicContact CB-CE1 3.93Å; L332-F415 HydrophobicContact CB-CZ 4.27Å; L332-F415 HydrophobicContact CD1-CE1 4.44Å; L332-F415 HydrophobicContact CD1-CZ 4.31Å; L332-F415 HydrophobicContact CD2-CD1 4.42Å; L332-F415 HydrophobicContact CD2-CE1 4.46Å
333	V	92.9	Very high	88.1	Confident	7 Å²	7	44 Å²	44	4%	0.042	21%	0.21	C	C	.	.	P	Polyproline II helix	trans	-70.2	122.7	172.1	171.8	0	0	0	0	108.8	L335 T348 E349 L403 K411 I412 A413	V333-L335 PolarHBondContact O-N 3.07Å; V333-T348 HydrophobicContact CG1-CG2 4.04Å; V333-E349 WeakPolarHBondContact CA-OE1 3.44Å; V333-E349 HydrophobicContact CG1-CG 3.92Å; V333-L403 HydrophobicContact CG2-CB 4.46Å; V333-L403 HydrophobicContact CG2-CD1 3.97Å; V333-L403 HydrophobicContact CG2-CG 4.4Å; V333-K411 HydrophobicContact CG2-CB 3.65Å; V333-I412 WeakPolarHBondContact CG2-O 3.23Å; V333-I412 PolarHBondContact N-O 2.97Å; V333-A413 HydrophobicContact CB-CB 4.32Å; V333-A413 HydrophobicContact CG2-CB 3.82Å
334	Q	88.9	Confident	88.6	Confident	23 Å²	23	41.3 Å²	41.3	11%	0.107	20%	0.197	C	C	.	.	P	Polyproline II helix	trans	-71.6	123.8	-179	-172.2	58.3	56.2	0	0	110.5	L332 Y336 T348 E349	L332-Q334 PolarHBondContact O-N 3.21Å; Q334-Y336 HydrophobicContact CB-CE1 4.29Å; Q334-Y336 HydrophobicContact CG-CD1 3.96Å; Q334-Y336 HydrophobicContact CG-CE1 3.82Å; Q334-T348 VanDerWaalsContact O-CA 3.28Å; Q334-T348 WeakPolarHBondContact O-CA 3.19Å; Q334-T348 WeakPolarHBondContact O-CB 3.5Å; Q334-E349 HydrophobicContact CB-CG 4.44Å; Q334-E349 WeakPolarHBondContact CB-OE1 3.39Å; Q334-E349 PolarHBondContact N-OE1 3.24Å; Q334-E349 PolarHBondContact O-N 3.48Å; Q334-E349 VanDerWaalsContact O-N 3.17Å
335	L	88.4	Confident	89.3	Confident	14 Å²	14	42.3 Å²	42.3	7%	0.073	20%	0.2	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-75.8	124	164.1	-178.6	67.5	0	0	0	108.8	A321 M324 V333 V338 I346 T348	A321-L335 HydrophobicContact CB-CD2 4.48Å; M324-L335 HydrophobicContact CB-CD2 3.96Å; V333-L335 PolarHBondContact O-N 3.07Å; L335-V338 HydrophobicContact CD1-CG1 3.81Å; L335-V338 HydrophobicContact CD2-CG1 4.4Å; L335-I346 HydrophobicContact CD1-CG2 3.47Å; L335-I346 VanDerWaalsContact CD1-CG2 3.47Å; L335-T348 HydrophobicContact CD1-CG2 4.26Å
336	Y	88.4	Confident	90	Very high	24 Å²	24	40.2 Å²	40.2	9%	0.094	19%	0.191	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-97.5	-48.6	178.7	-74.5	-34.4	0	0	0	112.5	L262 V302 Q334 V347 E349	L262-Y336 HydrophobicContact CD2-CD2 3.99Å; L262-Y336 HydrophobicContact CD2-CG 4.16Å; L262-Y336 HydrophobicContact CG-CD2 4.46Å; L262-Y336 HydrophobicContact CG-CG 4.14Å; V302-Y336 HydrophobicContact CG1-CD2 4.18Å; V302-Y336 HydrophobicContact CG1-CE2 4.49Å; Q334-Y336 HydrophobicContact CB-CE1 4.29Å; Q334-Y336 HydrophobicContact CG-CD1 3.96Å; Q334-Y336 HydrophobicContact CG-CE1 3.82Å; Y336-V347 PolarHBondContact N-O 3.34Å; Y336-E349 HydrophobicContact CE2-CB 3.85Å
337	A	90.9	Very high	90.5	Very high	1 Å²	1	33.1 Å²	33.1	1%	0.008	16%	0.16	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-160.8	165.5	-173.3	0	0	0	0	0	109.9	L262 W270 I272 V347	L262-A337 HydrophobicContact CD1-CB 3.95Å; W270-A337 WeakPolarHBondContact O-CA 3.32Å; W270-A337 VanDerWaalsContact O-CB 3.3Å; W270-A337 WeakPolarHBondContact O-CB 3.45Å; I272-A337 HydrophobicContact CD1-CB 3.7Å; I272-A337 HydrophobicContact CG1-CB 3.92Å; I272-A337 HydrophobicContact CG2-CB 3.87Å; A337-V347 HydrophobicContact CB-CB 4.23Å; A337-V347 PolarHBondContact N-O 3.03Å; A337-V347 WeakPolarHBondContact O-CA 3.39Å; A337-V347 VanDerWaalsContact O-CB 3.27Å; A337-V347 WeakPolarHBondContact O-CB 3.46Å; A337-V347 PolarHBondContact O-N 3.14Å
338	V	92.1	Very high	90.9	Very high	1 Å²	1	34 Å²	34	1%	0.006	17%	0.166	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-136.6	156.3	168.1	-48.7	0	0	0	0	111	W270 E271 I272 F317 A321 L335 Y345 I346	W270-V338 HydrophobicContact CD2-CG2 4.41Å; W270-V338 HydrophobicContact CE3-CB 4.15Å; W270-V338 HydrophobicContact CE3-CG2 3.3Å; W270-V338 HydrophobicContact CH2-CG2 3.58Å; W270-V338 HydrophobicContact CZ3-CB 4Å; W270-V338 HydrophobicContact CZ3-CG2 2.86Å; W270-V338 PolarHBondContact O-N 3.49Å; E271-V338 WeakPolarHBondContact CA-O 3.39Å; I272-V338 PolarHBondContact N-O 2.82Å; F317-V338 HydrophobicContact CD1-CG2 4.32Å; F317-V338 HydrophobicContact CE1-CB 3.64Å; F317-V338 HydrophobicContact CE1-CG1 4.12Å; F317-V338 HydrophobicContact CE1-CG2 3.3Å; F317-V338 HydrophobicContact CZ-CB 3.63Å; F317-V338 HydrophobicContact CZ-CG1 3.63Å; F317-V338 HydrophobicContact CZ-CG2 3.71Å; A321-V338 HydrophobicContact CB-CG1 4.49Å; A321-V338 HydrophobicContact CB-CG2 4.41Å; L335-V338 HydrophobicContact CD1-CG1 3.81Å; L335-V338 HydrophobicContact CD2-CG1 4.4Å; V338-Y345 CarbonylContact C-O 3.59Å; V338-Y345 WeakPolarHBondContact CA-O 3.4Å; V338-Y345 VanDerWaalsContact CB-O 3.22Å; V338-Y345 WeakPolarHBondContact CB-O 3.47Å; V338-I346 HydrophobicContact CG1-CG2 4.41Å
339	V	93.3	Very high	91.1	Very high	5 Å²	5	29.9 Å²	29.9	3%	0.03	15%	0.151	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-106.2	112.7	167.5	-177.1	0	0	0	0	105.8	I272 R274 L277 I344 Y345	I272-V339 HydrophobicContact CG1-CG2 4.16Å; R274-V339 HydrophobicContact CB-CG1 4.21Å; L277-V339 HydrophobicContact CD1-CG2 3.91Å; V339-I344 WeakPolarHBondContact O-CA 3.19Å; V339-Y345 HydrophobicContact CB-CG 4.36Å; V339-Y345 HydrophobicContact CG2-CD2 4.19Å; V339-Y345 HydrophobicContact CG2-CG 4.34Å; V339-Y345 PolarHBondContact N-O 3.22Å; V339-Y345 PolarHBondContact O-N 3.22Å
340	S	88.8	Confident	91.2	Very high	17 Å²	17	30.3 Å²	30.3	12%	0.119	15%	0.151	C	C	.	.			trans	-78.6	-30	-173.5	54.8	0	0	0	0	112.9	E271 I344	E271-S340 WeakPolarHBondContact OE2-CB 3.48Å; E271-S340 PolarHBondContact OE2-OG 2.93Å; S340-I344 WeakPolarHBondContact O-CG1 3.19Å
341	E	88.4	Confident	91.4	Very high	142 Å²	142	25.1 Å²	25.1	66%	0.664	12%	0.122	S	C	*	.	S	Bend	trans	-66	140.7	175.9	-62.8	-177.1	172.7	0	0	111.7	R274 P343 I344	R274-E341 PolarHBondContact NH2-O 3.45Å; E341-P343 CarbonylContact O-C 3.13Å; E341-P343 VanDerWaalsContact O-O 3.05Å; E341-I344 PolarHBondContact O-N 2.91Å
342	E	87.5	Confident	91.3	Very high	94 Å²	94	26.5 Å²	26.5	44%	0.439	14%	0.135	S	C	.	.	S	Bend	trans	-66.8	139.6	176	-72.9	-159	142.2	0	0	112.2	R274 G310	R274-E342 PolarHBondContact NH2-O 3.46Å; G310-E342 PolarHBondContact N-OE1 2.94Å
343	P	89.3	Confident	91.3	Very high	48 Å²	48	29.9 Å²	29.9	31%	0.312	15%	0.149	S	C	.	.	S	Bend	cis	-70.8	130.8	-7.2	29	-33.6	0	0	0	111.8	R274 E341 Y345	R274-P343 PolarHBondContact NH1-O 3.38Å; R274-P343 PolarHBondContact NH2-O 2.64Å; E341-P343 CarbonylContact O-C 3.13Å; E341-P343 VanDerWaalsContact O-O 3.05Å; P343-Y345 HydrophobicContact CB-CE1 4.38Å; P343-Y345 HydrophobicContact CG-CE1 3.99Å; P343-Y345 VanDerWaalsContact O-CD1 3.26Å; P343-Y345 WeakPolarHBondContact O-CD1 3.33Å; P343-Y345 PolarHBondContact O-N 3.03Å
344	I	90.4	Very high	91.4	Very high	4 Å²	4	31 Å²	31	2%	0.021	16%	0.162	C	C	.	.	P	Polyproline II helix	trans	-63.2	132.9	-177	-70.9	166.5	0	0	0	110.5	L307 M312 F317 V339 S340 E341	L307-I344 HydrophobicContact CB-CB 4.24Å; L307-I344 HydrophobicContact CD1-CB 4.2Å; L307-I344 HydrophobicContact CD1-CG2 3.86Å; L307-I344 HydrophobicContact CG-CB 4.45Å; L307-I344 HydrophobicContact CG-CG2 4.32Å; L307-I344 PolarHBondContact N-O 3.3Å; M312-I344 HydrophobicContact CG-CD1 4.19Å; F317-I344 HydrophobicContact CB-CD1 4.02Å; F317-I344 HydrophobicContact CD1-CD1 4.1Å; F317-I344 HydrophobicContact CD1-CG1 4.39Å; F317-I344 HydrophobicContact CD1-CG2 3.6Å; F317-I344 HydrophobicContact CD2-CG2 4.06Å; F317-I344 HydrophobicContact CE1-CG2 3.23Å; F317-I344 HydrophobicContact CE2-CG2 3.78Å; F317-I344 HydrophobicContact CG-CD1 4.06Å; F317-I344 HydrophobicContact CG-CG2 3.97Å; F317-I344 HydrophobicContact CZ-CG2 3.34Å; V339-I344 WeakPolarHBondContact O-CA 3.19Å; S340-I344 WeakPolarHBondContact O-CG1 3.19Å; E341-I344 PolarHBondContact O-N 2.91Å
345	Y	93.5	Very high	91.7	Very high	31 Å²	31	30.6 Å²	30.6	12%	0.122	16%	0.162	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-114.2	133.3	174.6	-67.4	-0.5	0	0	0	111.6	R274 L277 L279 V304 K305 T306 V338 V339 P343	R274-Y345 HydrophobicContact CG-CE2 4.05Å; L277-Y345 HydrophobicContact CD1-CD2 3.84Å; L279-Y345 HydrophobicContact CD1-CE2 4.3Å; L279-Y345 HydrophobicContact CD2-CE2 4.47Å; V304-Y345 HydrophobicContact CG1-CD2 3.63Å; V304-Y345 HydrophobicContact CG1-CE2 4.3Å; V304-Y345 HydrophobicContact CG1-CG 3.77Å; K305-Y345 CarbonylContact O-C 3.57Å; K305-Y345 WeakPolarHBondContact O-CA 3.33Å; T306-Y345 HydrophobicContact CG2-CD1 3.64Å; T306-Y345 HydrophobicContact CG2-CE1 3.31Å; T306-Y345 HydrophobicContact CG2-CG 4.45Å; V338-Y345 CarbonylContact C-O 3.59Å; V338-Y345 WeakPolarHBondContact CA-O 3.4Å; V338-Y345 VanDerWaalsContact CB-O 3.22Å; V338-Y345 WeakPolarHBondContact CB-O 3.47Å; V339-Y345 HydrophobicContact CB-CG 4.36Å; V339-Y345 HydrophobicContact CG2-CD2 4.19Å; V339-Y345 HydrophobicContact CG2-CG 4.34Å; V339-Y345 PolarHBondContact N-O 3.22Å; V339-Y345 PolarHBondContact O-N 3.22Å; P343-Y345 HydrophobicContact CB-CE1 4.38Å; P343-Y345 HydrophobicContact CG-CE1 3.99Å; P343-Y345 VanDerWaalsContact O-CD1 3.26Å; P343-Y345 WeakPolarHBondContact O-CD1 3.33Å; P343-Y345 PolarHBondContact O-N 3.03Å
346	I	91.9	Very high	92.2	Very high	5 Å²	5	29.9 Å²	29.9	3%	0.026	16%	0.158	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-106	120.3	170.3	-56.9	160	0	0	0	108.2	V304 K305 L307 F317 L335 V338 T348 L417	V304-I346 WeakPolarHBondContact CA-O 3.49Å; K305-I346 HydrophobicContact CB-CB 4.27Å; K305-I346 HydrophobicContact CD-CD1 4.39Å; K305-I346 PolarHBondContact N-O 3.39Å; K305-I346 PolarHBondContact O-N 2.97Å; L307-I346 HydrophobicContact CD1-CD1 4.32Å; L307-I346 HydrophobicContact CD2-CD1 4.43Å; L307-I346 HydrophobicContact CG-CD1 4.43Å; F317-I346 HydrophobicContact CE2-CD1 3.91Å; F317-I346 HydrophobicContact CE2-CG1 3.59Å; F317-I346 HydrophobicContact CZ-CD1 4.42Å; F317-I346 HydrophobicContact CZ-CG1 3.59Å; L335-I346 HydrophobicContact CD1-CG2 3.47Å; L335-I346 VanDerWaalsContact CD1-CG2 3.47Å; V338-I346 HydrophobicContact CG1-CG2 4.41Å; I346-T348 HydrophobicContact CG2-CG2 4.07Å; I346-L417 HydrophobicContact CD1-CD1 4.07Å; I346-L417 HydrophobicContact CD1-CD2 3.62Å
347	V	93.8	Very high	92.5	Very high	0 Å²	0	30.3 Å²	30.3	0%	0	16%	0.162	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-105.8	120.6	-177.6	-170.6	0	0	0	0	109.9	I272 L277 V302 A303 V304 Y336 A337	I272-V347 HydrophobicContact CD1-CG2 4.14Å; L277-V347 HydrophobicContact CD1-CG2 3.7Å; L277-V347 HydrophobicContact CD2-CG1 4.28Å; L277-V347 HydrophobicContact CD2-CG2 4.11Å; V302-V347 HydrophobicContact CB-CG1 3.74Å; V302-V347 HydrophobicContact CG1-CG1 3.85Å; V302-V347 HydrophobicContact CG2-CG1 3.99Å; A303-V347 WeakPolarHBondContact O-CA 3.45Å; V304-V347 HydrophobicContact CG2-CG2 4.47Å; Y336-V347 PolarHBondContact N-O 3.34Å; A337-V347 HydrophobicContact CB-CB 4.23Å; A337-V347 PolarHBondContact N-O 3.03Å; A337-V347 WeakPolarHBondContact O-CA 3.39Å; A337-V347 VanDerWaalsContact O-CB 3.27Å; A337-V347 WeakPolarHBondContact O-CB 3.46Å; A337-V347 PolarHBondContact O-N 3.14Å
348	T	92.9	Very high	92.8	Very high	25 Å²	25	34.4 Å²	34.4	15%	0.153	18%	0.184	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-130.6	169.9	-175.8	55.2	0	0	0	0	111.5	A303 V333 Q334 L335 I346	A303-T348 PolarHBondContact N-O 2.97Å; A303-T348 PolarHBondContact O-N 3.32Å; A303-T348 PolarHBondContact O-OG1 3.48Å; V333-T348 HydrophobicContact CG1-CG2 4.04Å; Q334-T348 VanDerWaalsContact O-CA 3.28Å; Q334-T348 WeakPolarHBondContact O-CA 3.19Å; Q334-T348 WeakPolarHBondContact O-CB 3.5Å; L335-T348 HydrophobicContact CD1-CG2 4.26Å; I346-T348 HydrophobicContact CG2-CG2 4.07Å
349	E	91.1	Very high	93	Very high	3 Å²	3	34.7 Å²	34.7	1%	0.014	19%	0.185	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-58.7	137.4	168.5	66.5	-176.8	127.3	0	0	112.1	R258 V333 Q334 Y336 K411	R258-E349 IonicContact CZ-OE2 3.59Å; R258-E349 IonicContact NH1-OE2 3.33Å; R258-E349 PolarHBondContact NH1-OE2 3.1Å; V333-E349 WeakPolarHBondContact CA-OE1 3.44Å; V333-E349 HydrophobicContact CG1-CG 3.92Å; Q334-E349 HydrophobicContact CB-CG 4.44Å; Q334-E349 WeakPolarHBondContact CB-OE1 3.39Å; Q334-E349 PolarHBondContact N-OE1 3.24Å; Q334-E349 PolarHBondContact O-N 3.48Å; Q334-E349 VanDerWaalsContact O-N 3.17Å; Y336-E349 HydrophobicContact CE2-CB 3.85Å; E349-K411 WeakPolarHBondContact OE1-CD 3.4Å; E349-K411 IonicContact OE1-NZ 3.62Å; E349-K411 PolarHBondContact OE1-NZ 2.93Å; E349-K411 WeakPolarHBondContact OE2-CE 3.19Å; E349-K411 IonicContact OE2-NZ 2.94Å; E349-K411 PolarHBondContact OE2-NZ 3.39Å
350	Y	93.6	Very high	93.1	Very high	58 Å²	58	34.5 Å²	34.5	23%	0.227	18%	0.183	C	C	.	.			trans	-80.1	128.3	174.9	174.7	-106.2	0	0	0	111.1	L283 M293 K301 A303	L283-Y350 HydrophobicContact CD1-CD2 4.1Å; L283-Y350 HydrophobicContact CD1-CE2 3.76Å; L283-Y350 HydrophobicContact CD2-CE2 4.24Å; M293-Y350 HydrophobicContact CB-CD2 4.42Å; M293-Y350 HydrophobicContact CB-CE2 4.17Å; M293-Y350 HydrophobicContact CG-CD2 4.1Å; M293-Y350 HydrophobicContact CG-CE2 3.97Å; M293-Y350 HydrophobicContact SD-CE2 4.49Å; K301-Y350 HydrophobicContact CD-CD1 3.42Å; K301-Y350 VanDerWaalsContact CD-CD1 3.42Å; K301-Y350 HydrophobicContact CD-CE1 3.82Å; K301-Y350 HydrophobicContact CD-CG 4.04Å; K301-Y350 HydrophobicContact CG-CD1 4.02Å; K301-Y350 HydrophobicContact CG-CG 4.14Å; A303-Y350 HydrophobicContact CB-CD2 4.46Å
351	M	94.3	Very high	93.4	Very high	6 Å²	6	37.1 Å²	37.1	3%	0.03	19%	0.193	C	C	.	.			trans	-106.6	112.3	177.8	-65.6	-67.3	-79	0	0	110.1	K353 G354 L403 G405 K411	M351-K353 VanDerWaalsContact C-N 3.31Å; M351-K353 PolarHBondContact O-N 3.25Å; M351-G354 PolarHBondContact O-N 3.45Å; M351-L403 HydrophobicContact CB-CB 3.67Å; M351-L403 HydrophobicContact CB-CD1 4.01Å; M351-L403 HydrophobicContact CB-CG 4.43Å; M351-L403 HydrophobicContact CE-CB 4.21Å; M351-L403 WeakPolarHBondContact CE-O 3.18Å; M351-L403 HydrophobicContact CG-CB 3.64Å; M351-L403 HydrophobicContact CG-CD1 3.84Å; M351-L403 HydrophobicContact CG-CG 4.41Å; M351-G405 VanDerWaalsContact CE-N 3.32Å; M351-K411 HydrophobicContact CE-CB 3.99Å; M351-K411 HydrophobicContact CE-CD 3.9Å; M351-K411 HydrophobicContact CE-CG 3.79Å; M351-K411 HydrophobicContact SD-CD 4Å
352	S	92.6	Very high	93.4	Very high	47 Å²	47	37.2 Å²	37.2	33%	0.329	20%	0.198	S	C	.	.	T	Hydrogen-bonded Turn	trans	-64.1	-27.9	-165.1	54.6	0	0	0	0	114.9	D406	S352-D406 PolarHBondContact OG-OD1 3.14Å
353	K	94.4	Very high	93.5	Very high	72 Å²	72	34.3 Å²	34.3	31%	0.313	19%	0.194	S	C	.	.	T	Hydrogen-bonded Turn	trans	-99.3	4.4	-176.8	-54.5	-66.4	-173.8	170.9	0	113.4	M351 F359 E364 V404	M351-K353 VanDerWaalsContact C-N 3.31Å; M351-K353 PolarHBondContact O-N 3.25Å; K353-F359 HydrophobicContact CB-CD2 3.97Å; K353-F359 HydrophobicContact CB-CE2 4.31Å; K353-F359 HydrophobicContact CG-CE2 4.43Å; K353-E364 IonicContact NZ-OE1 3.55Å; K353-E364 PolarHBondContact NZ-OE1 3.18Å; K353-E364 IonicContact NZ-OE2 2.8Å; K353-E364 PolarHBondContact NZ-OE2 3.35Å; K353-V404 WeakPolarHBondContact CA-O 3.45Å; K353-V404 HydrophobicContact CB-CB 3.87Å; K353-V404 HydrophobicContact CB-CG1 3.9Å; K353-V404 VanDerWaalsContact CB-O 3.3Å; K353-V404 WeakPolarHBondContact CB-O 3.39Å; K353-V404 HydrophobicContact CG-CG1 4.3Å; K353-V404 PolarHBondContact N-O 3.43Å
354	G	94.6	Very high	93.5	Very high	31 Å²	31	37.9 Å²	37.9	32%	0.32	21%	0.206	S	C	.	.			trans	71.8	-152.1	176.4	0	0	0	0	0	113.3	M351 L403 V404	M351-G354 PolarHBondContact O-N 3.45Å; G354-L403 CarbonylContact O-C 3.5Å; G354-L403 WeakPolarHBondContact O-CA 3.48Å; G354-V404 PolarHBondContact O-N 3.38Å
355	S	95.9	Very high	93.5	Very high	14 Å²	14	37.7 Å²	37.7	10%	0.098	21%	0.205	C	C	.	.	B	Isolated β-bridge	trans	-73	150.1	-179.9	79.4	0	0	0	0	111.7	L357 D358 F359 I402	S355-L357 PolarHBondContact O-N 2.95Å; S355-D358 PolarHBondContact O-N 2.92Å; S355-D358 PolarHBondContact OG-N 3.32Å; S355-D358 VanDerWaalsContact OG-N 3.12Å; S355-D358 PolarHBondContact OG-OD2 3.31Å; S355-F359 VanDerWaalsContact O-CB 3.25Å; S355-F359 WeakPolarHBondContact O-CB 3.27Å; S355-F359 PolarHBondContact O-N 2.78Å; S355-I402 CarbonylContact C-O 3.57Å; S355-I402 WeakPolarHBondContact CA-O 3.28Å
356	L	97.8	Very high	93.4	Very high	0 Å²	0	45.2 Å²	45.2	0%	0	23%	0.233	C	C	.	.	H	α-helix	trans	-60.6	-35	174	175.7	61.3	0	0	0	111	F359 L360 M376 S399 I402 V404 L465	L356-F359 HydrophobicContact CD1-CD1 4.35Å; L356-F359 PolarHBondContact O-N 3.36Å; L356-L360 HydrophobicContact CD1-CD1 3.89Å; L356-L360 HydrophobicContact CD1-CD2 4.39Å; L356-L360 HydrophobicContact CD1-CG 3.86Å; L356-L360 HydrophobicContact CG-CD1 3.84Å; L356-L360 HydrophobicContact CG-CG 4.28Å; L356-L360 WeakPolarHBondContact O-CB 3.45Å; L356-L360 WeakPolarHBondContact O-CG 3.38Å; L356-L360 PolarHBondContact O-N 3.35Å; L356-M376 HydrophobicContact CD1-CE 3.21Å; L356-M376 HydrophobicContact CD1-SD 4.31Å; L356-S399 WeakPolarHBondContact CB-O 3.47Å; L356-S399 PolarHBondContact N-O 3.32Å; L356-I402 HydrophobicContact CB-CB 3.79Å; L356-I402 HydrophobicContact CB-CG2 4.04Å; L356-I402 HydrophobicContact CD2-CB 3.97Å; L356-I402 HydrophobicContact CD2-CG1 4.27Å; L356-I402 HydrophobicContact CD2-CG2 3.97Å; L356-I402 PolarHBondContact N-O 2.96Å; L356-V404 HydrophobicContact CB-CG2 3.96Å; L356-V404 HydrophobicContact CD1-CG2 3.9Å; L356-L465 HydrophobicContact CD1-CD2 4.26Å; L356-L465 HydrophobicContact CD2-CD2 3.98Å; L356-L465 HydrophobicContact CD2-CG 4.44Å
357	L	96.4	Very high	93.4	Very high	33 Å²	33	49.1 Å²	49.1	17%	0.173	27%	0.266	C	S	.	.	H	α-helix	trans	-57.2	-53.9	175.1	-178.6	60	0	0	0	111.8	S355 F359 L360 K361 S399 A400	S355-L357 PolarHBondContact O-N 2.95Å; L357-F359 VanDerWaalsContact C-N 3.34Å; L357-L360 PolarHBondContact O-N 2.68Å; L357-K361 HydrophobicContact CD1-CD 4.02Å; L357-K361 VanDerWaalsContact CD1-CE 3.45Å; L357-K361 HydrophobicContact CD1-CG 4.47Å; L357-K361 HydrophobicContact CG-CD 4.34Å; L357-K361 WeakPolarHBondContact O-CG 3.36Å; L357-K361 PolarHBondContact O-N 3.41Å; L357-K361 VanDerWaalsContact O-N 3.1Å; L357-S399 WeakPolarHBondContact CB-OG 3.42Å; L357-S399 WeakPolarHBondContact CD1-OG 3.29Å; L357-S399 PolarHBondContact N-O 3.13Å; L357-A400 HydrophobicContact CB-CB 4.49Å; L357-A400 HydrophobicContact CD2-CB 4.1Å
358	D	95.4	Very high	93.3	Very high	87 Å²	87	50.6 Å²	50.6	47%	0.465	27%	0.274	S	S	.	.	H	α-helix	trans	-68.9	-38.7	-178.5	-57.2	-37.3	0	0	0	110.5	S355 L360 K361 D362 G363	S355-D358 PolarHBondContact O-N 2.92Å; S355-D358 PolarHBondContact OG-N 3.32Å; S355-D358 VanDerWaalsContact OG-N 3.12Å; S355-D358 PolarHBondContact OG-OD2 3.31Å; D358-L360 VanDerWaalsContact C-N 3.32Å; D358-L360 PolarHBondContact O-N 3.23Å; D358-K361 PolarHBondContact O-N 3.09Å; D358-D362 PolarHBondContact O-N 3.15Å; D358-G363 PolarHBondContact O-N 3.46Å; D358-G363 VanDerWaalsContact O-N 3.13Å
359	F	96.9	Very high	93.3	Very high	7 Å²	7	57 Å²	57	3%	0.031	30%	0.3	C	S	.	.	H	α-helix	trans	-59.4	-40.7	176.5	-178.7	-103.1	0	0	0	112.6	K353 S355 L356 L357 G363 E364 G365 L368 M376 V404 L408	K353-F359 HydrophobicContact CB-CD2 3.97Å; K353-F359 HydrophobicContact CB-CE2 4.31Å; K353-F359 HydrophobicContact CG-CE2 4.43Å; S355-F359 VanDerWaalsContact O-CB 3.25Å; S355-F359 WeakPolarHBondContact O-CB 3.27Å; S355-F359 PolarHBondContact O-N 2.78Å; L356-F359 HydrophobicContact CD1-CD1 4.35Å; L356-F359 PolarHBondContact O-N 3.36Å; L357-F359 VanDerWaalsContact C-N 3.34Å; F359-G363 CarbonylContact O-C 3.58Å; F359-G363 VanDerWaalsContact O-CA 3.32Å; F359-G363 WeakPolarHBondContact O-CA 3.39Å; F359-G363 PolarHBondContact O-N 2.71Å; F359-E364 HydrophobicContact CE2-CB 3.8Å; F359-E364 HydrophobicContact CZ-CB 4.13Å; F359-G365 WeakPolarHBondContact O-CA 3.37Å; F359-G365 PolarHBondContact O-N 3.32Å; F359-L368 HydrophobicContact CE1-CD1 3.73Å; F359-L368 HydrophobicContact CZ-CD1 4.32Å; F359-M376 HydrophobicContact CD1-CE 4.01Å; F359-M376 HydrophobicContact CE1-CE 3.89Å; F359-V404 HydrophobicContact CB-CG2 4.2Å; F359-V404 HydrophobicContact CD1-CG1 4.28Å; F359-V404 HydrophobicContact CD1-CG2 4.18Å; F359-V404 HydrophobicContact CD2-CG1 4.3Å; F359-V404 HydrophobicContact CE1-CG1 4.3Å; F359-V404 HydrophobicContact CE2-CG1 4.33Å; F359-V404 HydrophobicContact CG-CB 4.37Å; F359-V404 HydrophobicContact CG-CG1 4.28Å; F359-V404 HydrophobicContact CG-CG2 4.19Å; F359-V404 HydrophobicContact CZ-CG1 4.35Å; F359-L408 HydrophobicContact CE1-CD2 3.93Å; F359-L408 HydrophobicContact CZ-CD2 3.51Å
360	L	96.6	Very high	93.3	Very high	0 Å²	0	59 Å²	59	0%	0	31%	0.311	C	S	.	.	H	α-helix	trans	-74.6	-38.7	178.2	-71.9	169.2	0	0	0	113.3	L356 L357 D358 L373 L465 K468	L356-L360 HydrophobicContact CD1-CD1 3.89Å; L356-L360 HydrophobicContact CD1-CD2 4.39Å; L356-L360 HydrophobicContact CD1-CG 3.86Å; L356-L360 HydrophobicContact CG-CD1 3.84Å; L356-L360 HydrophobicContact CG-CG 4.28Å; L356-L360 WeakPolarHBondContact O-CB 3.45Å; L356-L360 WeakPolarHBondContact O-CG 3.38Å; L356-L360 PolarHBondContact O-N 3.35Å; L357-L360 PolarHBondContact O-N 2.68Å; D358-L360 VanDerWaalsContact C-N 3.32Å; D358-L360 PolarHBondContact O-N 3.23Å; L360-L373 HydrophobicContact CD2-CD2 3.66Å; L360-L465 HydrophobicContact CD1-CD2 4.11Å; L360-L465 HydrophobicContact CD2-CD2 4.49Å; L360-K468 HydrophobicContact CD2-CD 4.43Å
361	K	93.3	Very high	93.1	Very high	73 Å²	73	59.5 Å²	59.5	32%	0.317	32%	0.32	S	S	.	.	H	α-helix	trans	-78	-55	-176.1	-76.3	-178.7	176.1	174.3	0	112.7	L357 D358 G469	L357-K361 HydrophobicContact CD1-CD 4.02Å; L357-K361 VanDerWaalsContact CD1-CE 3.45Å; L357-K361 HydrophobicContact CD1-CG 4.47Å; L357-K361 HydrophobicContact CG-CD 4.34Å; L357-K361 WeakPolarHBondContact O-CG 3.36Å; L357-K361 PolarHBondContact O-N 3.41Å; L357-K361 VanDerWaalsContact O-N 3.1Å; D358-K361 PolarHBondContact O-N 3.09Å; K361-G469 WeakPolarHBondContact CE-O 3.2Å; K361-G469 PolarHBondContact NZ-O 3.06Å
362	D	88.7	Confident	92.9	Very high	143 Å²	143	62.1 Å²	62.1	77%	0.765	34%	0.335	S	S	*	.	T	Hydrogen-bonded Turn	trans	-119	-8.2	-163.7	-59.3	-41.5	0	0	0	112.3	D358	D358-D362 PolarHBondContact O-N 3.15Å
363	G	89.3	Confident	93.1	Very high	34 Å²	34	60.3 Å²	60.3	35%	0.351	32%	0.321	S	S	.	.	S	Bend	trans	-103.5	-165.2	-178.6	0	0	0	0	0	115.4	D358 F359 G365 R366	D358-G363 PolarHBondContact O-N 3.46Å; D358-G363 VanDerWaalsContact O-N 3.13Å; F359-G363 CarbonylContact O-C 3.58Å; F359-G363 VanDerWaalsContact O-CA 3.32Å; F359-G363 WeakPolarHBondContact O-CA 3.39Å; F359-G363 PolarHBondContact O-N 2.71Å; G363-G365 PolarHBondContact O-N 3.31Å; G363-R366 PolarHBondContact O-N 3.11Å
364	E	89.8	Confident	93.1	Very high	122 Å²	122	57.1 Å²	57.1	57%	0.57	31%	0.308	S	S	*	.	G	3₁₀ helix	trans	-61.8	-22	178.1	-63.2	162.6	-143.6	0	0	112.4	K353 F359 R366 A367	K353-E364 IonicContact NZ-OE1 3.55Å; K353-E364 PolarHBondContact NZ-OE1 3.18Å; K353-E364 IonicContact NZ-OE2 2.8Å; K353-E364 PolarHBondContact NZ-OE2 3.35Å; F359-E364 HydrophobicContact CE2-CB 3.8Å; F359-E364 HydrophobicContact CZ-CB 4.13Å; E364-R366 PolarHBondContact O-N 2.69Å; E364-R366 VanDerWaalsContact O-N 3.16Å; E364-A367 PolarHBondContact O-N 2.93Å
365	G	90.5	Very high	93.1	Very high	0 Å²	0	57.4 Å²	57.4	0%	0	30%	0.302	C	S	.	.	G	3₁₀ helix	trans	-61.6	-21.4	179.3	0	0	0	0	0	114.6	F359 G363 A367 L368 K468	F359-G365 WeakPolarHBondContact O-CA 3.37Å; F359-G365 PolarHBondContact O-N 3.32Å; G363-G365 PolarHBondContact O-N 3.31Å; G365-A367 VanDerWaalsContact C-N 3.26Å; G365-A367 PolarHBondContact O-N 3.07Å; G365-L368 WeakPolarHBondContact O-CB 3.48Å; G365-L368 PolarHBondContact O-N 3.37Å; G365-K468 PolarHBondContact O-NZ 3.09Å
366	R	91.3	Very high	93.2	Very high	189 Å²	189	56.8 Å²	56.8	71%	0.713	30%	0.297	S	S	*	.	G	3₁₀ helix	trans	-60.8	-35.7	179	-171.8	173.8	175.9	-179.6	-0.8	112.5	G363 E364	G363-R366 PolarHBondContact O-N 3.11Å; E364-R366 PolarHBondContact O-N 2.69Å; E364-R366 VanDerWaalsContact O-N 3.16Å
367	A	91.6	Very high	93.2	Very high	88 Å²	88	56.9 Å²	56.9	73%	0.727	30%	0.298	S	S	*	.	G	3₁₀ helix	trans	-85.7	-6.6	-178.7	0	0	0	0	0	113.8	E364 G365	E364-A367 PolarHBondContact O-N 2.93Å; G365-A367 VanDerWaalsContact C-N 3.26Å; G365-A367 PolarHBondContact O-N 3.07Å
368	L	92.9	Very high	93.2	Very high	30 Å²	30	55.4 Å²	55.4	16%	0.157	29%	0.291	C	S	.	.			trans	-64.5	141	-176.8	-69.3	-177.6	0	0	0	112.1	F359 G365 N372 L373 M376 L408 K468	F359-L368 HydrophobicContact CE1-CD1 3.73Å; F359-L368 HydrophobicContact CZ-CD1 4.32Å; G365-L368 WeakPolarHBondContact O-CB 3.48Å; G365-L368 PolarHBondContact O-N 3.37Å; L368-N372 HydrophobicContact CB-CB 4.08Å; L368-N372 HydrophobicContact CD1-CB 4.16Å; L368-N372 HydrophobicContact CD2-CB 3.93Å; L368-N372 HydrophobicContact CG-CB 4.28Å; L368-L373 HydrophobicContact CB-CD2 4.31Å; L368-M376 HydrophobicContact CD1-SD 3.73Å; L368-L408 HydrophobicContact CD1-CD1 4.21Å; L368-L408 HydrophobicContact CD1-CD2 4.13Å; L368-L408 HydrophobicContact CD2-CD1 3.89Å; L368-L408 HydrophobicContact CD2-CD2 4.44Å; L368-K468 PolarHBondContact O-NZ 2.81Å
369	K	91.9	Very high	93.3	Very high	160 Å²	160	51.4 Å²	51.4	70%	0.696	27%	0.27	S	S	*	.			trans	-88.6	168.1	175.1	-64.2	-179.1	-179.9	178.1	0	110.3	P371 N372 L373	K369-P371 VanDerWaalsContact C-CD 3.43Å; K369-P371 VanDerWaalsContact C-N 3.31Å; K369-N372 PolarHBondContact O-N 3.28Å; K369-N372 VanDerWaalsContact O-N 3.1Å; K369-L373 PolarHBondContact O-N 3.16Å
370	L	91.1	Very high	93.4	Very high	46 Å²	46	51.1 Å²	51.1	24%	0.241	27%	0.268	C	S	.	.	H	α-helix	trans	-50	-42.4	179.9	-179.3	71.2	0	0	0	113.8	N372 L373 V374 V466 P498 L501 F530	L370-N372 VanDerWaalsContact C-N 3.31Å; L370-N372 PolarHBondContact O-N 3.02Å; L370-L373 PolarHBondContact O-N 2.91Å; L370-L373 VanDerWaalsContact O-N 3.07Å; L370-V374 HydrophobicContact CD1-CG2 3.97Å; L370-V374 HydrophobicContact CG-CG2 4.1Å; L370-V374 WeakPolarHBondContact O-CG2 3.38Å; L370-V374 PolarHBondContact O-N 3.44Å; L370-V466 HydrophobicContact CD1-CG1 4.49Å; L370-P498 HydrophobicContact CD2-CG 3.37Å; L370-L501 HydrophobicContact CD1-CD2 4.23Å; L370-F530 HydrophobicContact CD2-CZ 4.18Å; L370-F530 HydrophobicContact CG-CZ 4.2Å
371	P	88.8	Confident	93.5	Very high	67 Å²	67	51.1 Å²	51.1	44%	0.435	27%	0.268	S	S	.	.	H	α-helix	trans	-57	-41	178.4	-27.4	36.9	0	0	0	114.1	K369 D375 F530	K369-P371 VanDerWaalsContact C-CD 3.43Å; K369-P371 VanDerWaalsContact C-N 3.31Å; P371-D375 WeakPolarHBondContact O-CB 3.46Å; P371-D375 PolarHBondContact O-N 3.36Å; P371-F530 HydrophobicContact CB-CE2 4Å; P371-F530 HydrophobicContact CB-CZ 4.24Å; P371-F530 HydrophobicContact CG-CE1 4.43Å; P371-F530 HydrophobicContact CG-CE2 4.24Å; P371-F530 HydrophobicContact CG-CZ 3.98Å
372	N	91.9	Very high	93.7	Very high	61 Å²	61	48 Å²	48	33%	0.326	26%	0.256	S	S	.	.	H	α-helix	trans	-68	-39	176.4	-56.8	104.6	0	0	0	111.6	L368 K369 L370 D375 M376 L408	L368-N372 HydrophobicContact CB-CB 4.08Å; L368-N372 HydrophobicContact CD1-CB 4.16Å; L368-N372 HydrophobicContact CD2-CB 3.93Å; L368-N372 HydrophobicContact CG-CB 4.28Å; K369-N372 PolarHBondContact O-N 3.28Å; K369-N372 VanDerWaalsContact O-N 3.1Å; L370-N372 VanDerWaalsContact C-N 3.31Å; L370-N372 PolarHBondContact O-N 3.02Å; N372-D375 PolarHBondContact O-N 3.04Å; N372-M376 WeakPolarHBondContact O-CG 3.44Å; N372-M376 PolarHBondContact O-N 2.9Å; N372-L408 HydrophobicContact CB-CD1 4.22Å
373	L	96.1	Very high	94.1	Very high	9 Å²	9	41.2 Å²	41.2	5%	0.047	22%	0.22	C	C	.	.	H	α-helix	trans	-66.5	-40.7	179.1	-62.9	177.3	0	0	0	112.2	L360 L368 K369 L370 M376 A377 L465	L360-L373 HydrophobicContact CD2-CD2 3.66Å; L368-L373 HydrophobicContact CB-CD2 4.31Å; K369-L373 PolarHBondContact O-N 3.16Å; L370-L373 PolarHBondContact O-N 2.91Å; L370-L373 VanDerWaalsContact O-N 3.07Å; L373-M376 PolarHBondContact O-N 3.33Å; L373-A377 PolarHBondContact O-N 2.82Å; L373-L465 WeakPolarHBondContact CD1-O 3.39Å; L373-L465 HydrophobicContact CD2-CD2 4.02Å
374	V	95	Very high	94.6	Very high	5 Å²	5	39.6 Å²	39.6	3%	0.03	20%	0.203	C	C	.	.	H	α-helix	trans	-65.5	-40.6	174.5	172.1	0	0	0	0	110.6	L370 A377 A378 L501 L526 Y529 F530	L370-V374 HydrophobicContact CD1-CG2 3.97Å; L370-V374 HydrophobicContact CG-CG2 4.1Å; L370-V374 WeakPolarHBondContact O-CG2 3.38Å; L370-V374 PolarHBondContact O-N 3.44Å; V374-A377 WeakPolarHBondContact O-CB 3.49Å; V374-A377 PolarHBondContact O-N 3.48Å; V374-A378 PolarHBondContact O-N 3.43Å; V374-L501 HydrophobicContact CG2-CD2 4.35Å; V374-L526 HydrophobicContact CG1-CD2 4.13Å; V374-Y529 HydrophobicContact CG1-CD1 4.1Å; V374-Y529 HydrophobicContact CG1-CG 3.94Å; V374-Y529 HydrophobicContact CG2-CD1 4.19Å; V374-Y529 HydrophobicContact CG2-CE1 4.35Å; V374-F530 HydrophobicContact CB-CE2 3.95Å; V374-F530 HydrophobicContact CG1-CE2 4.07Å; V374-F530 HydrophobicContact CG2-CE2 4.08Å; V374-F530 HydrophobicContact CG2-CZ 4.29Å
375	D	93.6	Very high	95	Very high	38 Å²	38	33.8 Å²	33.8	20%	0.203	18%	0.176	C	C	.	.	H	α-helix	trans	-61.1	-44.7	174.5	-177.8	84	0	0	0	112.1	R167 P371 N372 A377 A378 Q379	R167-D375 WeakPolarHBondContact CD-OD2 3.1Å; R167-D375 IonicContact CZ-OD1 3.87Å; R167-D375 VanDerWaalsContact NH1-CG 3.26Å; R167-D375 IonicContact NH1-OD1 2.71Å; R167-D375 PolarHBondContact NH1-OD1 3.34Å; R167-D375 IonicContact NH1-OD2 3.1Å; R167-D375 PolarHBondContact NH1-OD2 3.16Å; P371-D375 WeakPolarHBondContact O-CB 3.46Å; P371-D375 PolarHBondContact O-N 3.36Å; N372-D375 PolarHBondContact O-N 3.04Å; D375-A377 VanDerWaalsContact C-N 3.31Å; D375-A377 PolarHBondContact O-N 3.29Å; D375-A378 WeakPolarHBondContact O-CB 3.36Å; D375-A378 PolarHBondContact O-N 3.05Å; D375-Q379 WeakPolarHBondContact O-CG 3.46Å; D375-Q379 PolarHBondContact O-N 3.1Å; D375-Q379 PolarHBondContact OD2-NE2 3.32Å
376	M	97.8	Very high	95.2	Very high	0 Å²	0	35.3 Å²	35.3	0%	0	18%	0.182	C	C	.	.	H	α-helix	trans	-61	-40.2	174.3	-66.4	172	92.7	0	0	111.5	L356 F359 L368 N372 L373 Q379 V380 V404 C410 L465	L356-M376 HydrophobicContact CD1-CE 3.21Å; L356-M376 HydrophobicContact CD1-SD 4.31Å; F359-M376 HydrophobicContact CD1-CE 4.01Å; F359-M376 HydrophobicContact CE1-CE 3.89Å; L368-M376 HydrophobicContact CD1-SD 3.73Å; N372-M376 WeakPolarHBondContact O-CG 3.44Å; N372-M376 PolarHBondContact O-N 2.9Å; L373-M376 PolarHBondContact O-N 3.33Å; M376-Q379 PolarHBondContact O-N 3.4Å; M376-V380 WeakPolarHBondContact O-CG2 3.35Å; M376-V380 PolarHBondContact O-N 3.15Å; M376-V380 VanDerWaalsContact O-N 3.12Å; M376-V404 HydrophobicContact CE-CG1 4.42Å; M376-V404 HydrophobicContact CE-CG2 4.03Å; M376-C410 WeakPolarHBondContact CE-SG 3.47Å; M376-L465 HydrophobicContact CB-CD2 4.2Å
377	A	98.4	Very high	95.4	Very high	2 Å²	2	26.3 Å²	26.3	2%	0.017	15%	0.148	C	C	.	.	H	α-helix	trans	-62.4	-43.7	173.6	0	0	0	0	0	112.3	L373 V374 D375 Q379 V380 A381 F458 L462 L465 L526	L373-A377 PolarHBondContact O-N 2.82Å; V374-A377 WeakPolarHBondContact O-CB 3.49Å; V374-A377 PolarHBondContact O-N 3.48Å; D375-A377 VanDerWaalsContact C-N 3.31Å; D375-A377 PolarHBondContact O-N 3.29Å; A377-Q379 VanDerWaalsContact C-N 3.31Å; A377-Q379 PolarHBondContact O-N 2.97Å; A377-V380 PolarHBondContact O-N 3.4Å; A377-A381 WeakPolarHBondContact O-CB 3.4Å; A377-A381 PolarHBondContact O-N 3.32Å; A377-F458 HydrophobicContact CB-CZ 4.44Å; A377-L462 HydrophobicContact CB-CD2 3.53Å; A377-L465 HydrophobicContact CB-CD1 3.69Å; A377-L526 HydrophobicContact CB-CD1 3.88Å; A377-L526 HydrophobicContact CB-CD2 4.35Å
378	A	96.9	Very high	95.6	Very high	3 Å²	3	23.8 Å²	23.8	3%	0.025	12%	0.122	C	C	.	.	H	α-helix	trans	-60.7	-41.6	177.3	0	0	0	0	0	111.4	V374 D375 A381 A382 L526 E527	V374-A378 PolarHBondContact O-N 3.43Å; D375-A378 WeakPolarHBondContact O-CB 3.36Å; D375-A378 PolarHBondContact O-N 3.05Å; A378-A381 PolarHBondContact O-N 3.44Å; A378-A382 WeakPolarHBondContact O-CB 3.23Å; A378-A382 PolarHBondContact O-N 3.3Å; A378-L526 HydrophobicContact CB-CB 3.74Å; A378-E527 HydrophobicContact CB-CG 4.05Å
379	Q	97.8	Very high	95.7	Very high	3 Å²	3	29.2 Å²	29.2	1%	0.014	14%	0.14	C	C	.	.	H	α-helix	trans	-61.5	-43.4	175.2	-70.6	-176.2	62.2	0	0	112.5	K331 D375 M376 A377 A382 G383 L408 C410	K331-Q379 WeakPolarHBondContact CB-O 3.34Å; K331-Q379 HydrophobicContact CD-CB 4.02Å; K331-Q379 HydrophobicContact CD-CG 4.27Å; K331-Q379 WeakPolarHBondContact CG-O 3.43Å; D375-Q379 WeakPolarHBondContact O-CG 3.46Å; D375-Q379 PolarHBondContact O-N 3.1Å; D375-Q379 PolarHBondContact OD2-NE2 3.32Å; M376-Q379 PolarHBondContact O-N 3.4Å; A377-Q379 VanDerWaalsContact C-N 3.31Å; A377-Q379 PolarHBondContact O-N 2.97Å; Q379-A382 PolarHBondContact O-N 3.46Å; Q379-G383 PolarHBondContact O-N 3.42Å; Q379-L408 PolarHBondContact NE2-O 2.82Å; Q379-L408 VanDerWaalsContact NE2-O 3.11Å; Q379-C410 HydrophobicContact CB-CB 4.1Å
380	V	98.6	Very high	95.7	Very high	0 Å²	0	25.8 Å²	25.8	0%	0	13%	0.127	C	C	.	.	H	α-helix	trans	-66	-42.8	175.2	175.8	0	0	0	0	110.8	M376 A377 A382 G383 M384 L397 I402 C410 I412 F458 L461	M376-V380 WeakPolarHBondContact O-CG2 3.35Å; M376-V380 PolarHBondContact O-N 3.15Å; M376-V380 VanDerWaalsContact O-N 3.12Å; A377-V380 PolarHBondContact O-N 3.4Å; V380-A382 VanDerWaalsContact C-N 3.31Å; V380-A382 PolarHBondContact O-N 2.84Å; V380-G383 PolarHBondContact O-N 2.86Å; V380-M384 PolarHBondContact O-N 2.61Å; V380-L397 HydrophobicContact CG1-CD1 4.25Å; V380-I402 HydrophobicContact CG1-CD1 3.94Å; V380-I402 HydrophobicContact CG2-CD1 3.97Å; V380-I402 HydrophobicContact CG2-CG1 4.03Å; V380-I402 HydrophobicContact CG2-CG2 3.87Å; V380-C410 HydrophobicContact CG2-CB 4.27Å; V380-I412 HydrophobicContact CG1-CD1 4.38Å; V380-I412 HydrophobicContact CG1-CG1 4.32Å; V380-F458 HydrophobicContact CB-CE2 4.16Å; V380-F458 HydrophobicContact CG1-CD2 4.08Å; V380-F458 HydrophobicContact CG1-CE2 3.92Å; V380-L461 HydrophobicContact CG1-CD1 4.11Å
381	A	98.6	Very high	95.7	Very high	0 Å²	0	30.8 Å²	30.8	0%	0	16%	0.155	C	C	.	.	H	α-helix	trans	-59.8	-40.9	175.9	0	0	0	0	0	111.9	A377 A378 G383 M384 A385 F458 L522 Q523 L526	A377-A381 WeakPolarHBondContact O-CB 3.4Å; A377-A381 PolarHBondContact O-N 3.32Å; A378-A381 PolarHBondContact O-N 3.44Å; A381-G383 PolarHBondContact O-N 2.77Å; A381-M384 CarbonylContact O-C 3.6Å; A381-M384 PolarHBondContact O-N 3.21Å; A381-A385 WeakPolarHBondContact O-CB 3.28Å; A381-A385 PolarHBondContact O-N 2.98Å; A381-F458 HydrophobicContact CB-CE2 4.11Å; A381-F458 HydrophobicContact CB-CZ 3.83Å; A381-L522 HydrophobicContact CB-CB 4.37Å; A381-Q523 HydrophobicContact CB-CB 4.09Å; A381-L526 HydrophobicContact CB-CD1 4.16Å
382	A	97.7	Very high	95.7	Very high	8 Å²	8	28.7 Å²	28.7	7%	0.066	14%	0.138	C	C	.	.	H	α-helix	trans	-62	-41.2	175.4	0	0	0	0	0	112.7	K331 A378 Q379 V380 A385 Y386 Q523	K331-A382 HydrophobicContact CG-CB 4.4Å; A378-A382 WeakPolarHBondContact O-CB 3.23Å; A378-A382 PolarHBondContact O-N 3.3Å; Q379-A382 PolarHBondContact O-N 3.46Å; V380-A382 VanDerWaalsContact C-N 3.31Å; V380-A382 PolarHBondContact O-N 2.84Å; A382-A385 PolarHBondContact O-N 2.75Å; A382-Y386 PolarHBondContact O-N 2.86Å; A382-Y386 VanDerWaalsContact O-N 3.14Å; A382-Q523 HydrophobicContact CB-CG 4.04Å
383	G	97.6	Very high	95.6	Very high	0 Å²	0	27.8 Å²	27.8	0%	0	13%	0.133	C	C	.	.	H	α-helix	trans	-63.5	-42.4	173.3	0	0	0	0	0	112.7	Q379 V380 A381 Y386 I387	Q379-G383 PolarHBondContact O-N 3.42Å; V380-G383 PolarHBondContact O-N 2.86Å; A381-G383 PolarHBondContact O-N 2.77Å; G383-Y386 WeakPolarHBondContact O-CB 3.25Å; G383-Y386 PolarHBondContact O-N 3.42Å; G383-I387 PolarHBondContact O-N 3.13Å; G383-I387 VanDerWaalsContact O-N 3.07Å
384	M	98.2	Very high	95.4	Very high	0 Å²	0	27.4 Å²	27.4	0%	0	13%	0.131	C	C	.	.	H	α-helix	trans	-71.6	-32.2	177.4	-72.1	-57.2	-56.3	0	0	113.2	V380 A381 Y386 I387 E388 H394 L397 I412 I451 D454 F519	V380-M384 PolarHBondContact O-N 2.61Å; A381-M384 CarbonylContact O-C 3.6Å; A381-M384 PolarHBondContact O-N 3.21Å; M384-Y386 VanDerWaalsContact C-N 3.29Å; M384-Y386 PolarHBondContact O-N 3.41Å; M384-I387 HydrophobicContact CE-CG2 4.16Å; M384-I387 WeakPolarHBondContact O-CB 3.33Å; M384-I387 PolarHBondContact O-N 3.22Å; M384-I387 HydrophobicContact SD-CD1 3.8Å; M384-E388 WeakPolarHBondContact O-CB 3.44Å; M384-E388 PolarHBondContact O-N 2.97Å; M384-H394 HydrophobicContact CE-CB 3.96Å; M384-H394 HydrophobicContact SD-CB 4.12Å; M384-L397 HydrophobicContact CE-CD2 4.28Å; M384-L397 HydrophobicContact CG-CD1 4.32Å; M384-L397 HydrophobicContact CG-CD2 3.85Å; M384-L397 HydrophobicContact SD-CD1 4Å; M384-L397 HydrophobicContact SD-CD2 3.96Å; M384-I412 HydrophobicContact CG-CD1 3.69Å; M384-I412 HydrophobicContact SD-CD1 3.78Å; M384-I451 HydrophobicContact CE-CD1 3.97Å; M384-D454 HydrophobicContact CE-CB 3.65Å; M384-F519 HydrophobicContact CB-CB 4.21Å; M384-F519 HydrophobicContact CB-CD1 3.31Å; M384-F519 HydrophobicContact CB-CD2 3.77Å; M384-F519 HydrophobicContact CB-CE1 3.39Å; M384-F519 HydrophobicContact CB-CE2 3.85Å; M384-F519 HydrophobicContact CB-CG 3.49Å; M384-F519 VanDerWaalsContact CB-CG 3.49Å; M384-F519 HydrophobicContact CB-CZ 3.66Å; M384-F519 HydrophobicContact CE-CD2 4.31Å; M384-F519 HydrophobicContact CE-CE2 3.57Å; M384-F519 HydrophobicContact CE-CZ 3.71Å; M384-F519 HydrophobicContact CG-CD1 4.16Å; M384-F519 HydrophobicContact CG-CE1 3.72Å; M384-F519 HydrophobicContact CG-CE2 4.34Å; M384-F519 HydrophobicContact CG-CZ 3.82Å
385	A	98	Very high	95.2	Very high	1 Å²	1	29.4 Å²	29.4	1%	0.008	14%	0.138	C	C	.	.	H	α-helix	trans	-64.8	-36.3	172.7	0	0	0	0	0	111.1	A381 A382 R389 F519	A381-A385 WeakPolarHBondContact O-CB 3.28Å; A381-A385 PolarHBondContact O-N 2.98Å; A382-A385 PolarHBondContact O-N 2.75Å; A385-R389 WeakPolarHBondContact O-CG 3.49Å; A385-R389 PolarHBondContact O-N 3.1Å; A385-F519 HydrophobicContact CB-CB 3.9Å
386	Y	96.5	Very high	95	Very high	32 Å²	32	28.6 Å²	28.6	13%	0.125	13%	0.133	C	C	.	.	H	α-helix	trans	-64.7	-46.6	169.8	174.8	-93.8	0	0	0	112	K326 L327 R328 H329 L332 A382 G383 M384 E388 R389 M390	K326-Y386 PolarHBondContact O-OH 3.17Å; L327-Y386 HydrophobicContact CB-CE1 4.18Å; L327-Y386 HydrophobicContact CD2-CE1 4.05Å; R328-Y386 PolarHBondContact N-OH 3.48Å; R328-Y386 VanDerWaalsContact N-OH 3.1Å; R328-Y386 PolarHBondContact O-OH 2.89Å; H329-Y386 HydrophobicContact CB-CD1 3.61Å; H329-Y386 HydrophobicContact CB-CD2 4.09Å; H329-Y386 HydrophobicContact CB-CE1 3.86Å; H329-Y386 HydrophobicContact CB-CE2 4.33Å; H329-Y386 HydrophobicContact CB-CG 3.73Å; H329-Y386 AromaticContact CD2-CD2 3.83Å; H329-Y386 AromaticContact CD2-CG 3.78Å; H329-Y386 AromaticContact CG-CG 3.78Å; L332-Y386 HydrophobicContact CD1-CD1 3.68Å; L332-Y386 HydrophobicContact CD1-CE1 3.8Å; A382-Y386 PolarHBondContact O-N 2.86Å; A382-Y386 VanDerWaalsContact O-N 3.14Å; G383-Y386 WeakPolarHBondContact O-CB 3.25Å; G383-Y386 PolarHBondContact O-N 3.42Å; M384-Y386 VanDerWaalsContact C-N 3.29Å; M384-Y386 PolarHBondContact O-N 3.41Å; Y386-E388 VanDerWaalsContact C-N 3.3Å; Y386-E388 PolarHBondContact O-N 3.42Å; Y386-R389 PolarHBondContact O-N 2.9Å; Y386-M390 HydrophobicContact CD1-CG 4.24Å; Y386-M390 HydrophobicContact CD2-CG 4.41Å; Y386-M390 HydrophobicContact CE1-CG 3.8Å; Y386-M390 HydrophobicContact CE2-CG 3.97Å; Y386-M390 HydrophobicContact CE2-SD 4.18Å; Y386-M390 VanDerWaalsContact O-CG 3.32Å; Y386-M390 WeakPolarHBondContact O-CG 3.48Å; Y386-M390 PolarHBondContact O-N 3.38Å
387	I	94.1	Very high	94.9	Very high	0 Å²	0	28.6 Å²	28.6	0%	0	13%	0.133	C	C	.	.	H	α-helix	trans	-56.6	-43.7	175.2	-75.3	173.1	0	0	0	111.4	L332 G383 M384 M390 N391 Y392 I412 F415 I451	L332-I387 HydrophobicContact CD1-CG1 4.23Å; L332-I387 HydrophobicContact CD2-CD1 3.74Å; L332-I387 HydrophobicContact CD2-CG1 4.16Å; G383-I387 PolarHBondContact O-N 3.13Å; G383-I387 VanDerWaalsContact O-N 3.07Å; M384-I387 HydrophobicContact CE-CG2 4.16Å; M384-I387 WeakPolarHBondContact O-CB 3.33Å; M384-I387 PolarHBondContact O-N 3.22Å; M384-I387 HydrophobicContact SD-CD1 3.8Å; I387-M390 CarbonylContact O-C 3.55Å; I387-M390 PolarHBondContact O-N 3.38Å; I387-N391 PolarHBondContact O-N 3.19Å; I387-Y392 HydrophobicContact CG2-CD1 4.3Å; I387-Y392 VanDerWaalsContact CG2-O 3.25Å; I387-Y392 WeakPolarHBondContact CG2-O 3.47Å; I387-Y392 PolarHBondContact O-N 2.62Å; I387-I412 HydrophobicContact CD1-CD1 4.44Å; I387-F415 HydrophobicContact CD1-CB 4.43Å; I387-I451 HydrophobicContact CG2-CD1 4.28Å
388	E	95.3	Very high	94.8	Very high	35 Å²	35	31.3 Å²	31.3	16%	0.164	14%	0.143	C	C	.	.	H	α-helix	trans	-58.1	-49.4	175.6	179	170.5	-120.5	0	0	111.5	M384 Y386 M390 N391 I451 F519 E520	M384-E388 WeakPolarHBondContact O-CB 3.44Å; M384-E388 PolarHBondContact O-N 2.97Å; Y386-E388 VanDerWaalsContact C-N 3.3Å; Y386-E388 PolarHBondContact O-N 3.42Å; E388-M390 PolarHBondContact O-N 3.29Å; E388-N391 WeakPolarHBondContact O-CA 3.45Å; E388-N391 PolarHBondContact O-N 2.86Å; E388-I451 HydrophobicContact CB-CD1 3.97Å; E388-I451 HydrophobicContact CB-CG1 3.85Å; E388-I451 HydrophobicContact CG-CG1 3.92Å; E388-F519 PolarHBondContact OE2-N 2.9Å; E388-E520 PolarHBondContact OE2-N 2.86Å
389	R	95.8	Very high	94.8	Very high	144 Å²	144	31.1 Å²	31.1	54%	0.543	14%	0.142	S	C	.	.	H	α-helix	trans	-62.6	-30.8	177.2	-72.8	-173.4	-59.9	-124.5	-2	113.6	A385 Y386 N391	A385-R389 WeakPolarHBondContact O-CG 3.49Å; A385-R389 PolarHBondContact O-N 3.1Å; Y386-R389 PolarHBondContact O-N 2.9Å; R389-N391 PolarHBondContact O-N 3.37Å
390	M	92.6	Very high	94.6	Very high	87 Å²	87	32.4 Å²	32.4	43%	0.429	15%	0.153	S	C	.	.	T	Hydrogen-bonded Turn	trans	-81.5	4.6	176.3	-62.7	-56.3	-65.8	0	0	112.7	L327 Y386 I387 E388 Y392	L327-M390 HydrophobicContact CD2-CB 3.62Å; L327-M390 HydrophobicContact CD2-CE 4.31Å; L327-M390 HydrophobicContact CD2-CG 3.74Å; Y386-M390 HydrophobicContact CD1-CG 4.24Å; Y386-M390 HydrophobicContact CD2-CG 4.41Å; Y386-M390 HydrophobicContact CE1-CG 3.8Å; Y386-M390 HydrophobicContact CE2-CG 3.97Å; Y386-M390 HydrophobicContact CE2-SD 4.18Å; Y386-M390 VanDerWaalsContact O-CG 3.32Å; Y386-M390 WeakPolarHBondContact O-CG 3.48Å; Y386-M390 PolarHBondContact O-N 3.38Å; I387-M390 CarbonylContact O-C 3.55Å; I387-M390 PolarHBondContact O-N 3.38Å; E388-M390 PolarHBondContact O-N 3.29Å; M390-Y392 PolarHBondContact O-N 3.37Å
391	N	89.9	Confident	94.5	Very high	152 Å²	152	33 Å²	33	81%	0.813	16%	0.156	S	C	*	.	T	Hydrogen-bonded Turn	trans	54.1	40	-176.4	-61.2	-66.5	0	0	0	112.7	I387 E388 R389	I387-N391 PolarHBondContact O-N 3.19Å; E388-N391 WeakPolarHBondContact O-CA 3.45Å; E388-N391 PolarHBondContact O-N 2.86Å; R389-N391 PolarHBondContact O-N 3.37Å
392	Y	89.8	Confident	94.5	Very high	22 Å²	22	33 Å²	33	9%	0.086	16%	0.156	C	C	.	.			trans	-113.2	160.9	-178.3	-161.6	-99.8	0	0	0	111.3	E320 I323 L327 I387 M390 G416	E320-Y392 PolarHBondContact OE1-OH 3Å; I323-Y392 HydrophobicContact CG2-CD2 3.94Å; I323-Y392 HydrophobicContact CG2-CE2 3.52Å; L327-Y392 HydrophobicContact CD1-CD1 3.76Å; L327-Y392 HydrophobicContact CD1-CD2 4.37Å; L327-Y392 HydrophobicContact CD1-CE1 4Å; L327-Y392 HydrophobicContact CD1-CG 3.94Å; I387-Y392 HydrophobicContact CG2-CD1 4.3Å; I387-Y392 VanDerWaalsContact CG2-O 3.25Å; I387-Y392 WeakPolarHBondContact CG2-O 3.47Å; I387-Y392 PolarHBondContact O-N 2.62Å; M390-Y392 PolarHBondContact O-N 3.37Å; Y392-G416 WeakPolarHBondContact OH-CA 3.46Å
393	I	90.1	Very high	94.4	Very high	43 Å²	43	34.4 Å²	34.4	22%	0.221	16%	0.162	C	C	.	.			trans	-130.8	129.1	-175.7	-52.6	166.1	0	0	0	108.6	R395 F449 D454	I393-R395 HydrophobicContact CB-CG 4.37Å; I393-R395 HydrophobicContact CG2-CG 3.7Å; I393-F449 WeakPolarHBondContact CD1-O 3.43Å; I393-F449 HydrophobicContact CG2-CB 4.43Å; I393-D454 WeakPolarHBondContact CG2-OD2 3.27Å
394	H	91.9	Very high	94.4	Very high	1 Å²	1	34.4 Å²	34.4	1%	0.005	16%	0.162	C	C	.	.			trans	-77.9	-44.7	-177.8	-172.6	-70.6	0	0	0	112.8	M384 D396 L397 I412 A413 D454	M384-H394 HydrophobicContact CE-CB 3.96Å; M384-H394 HydrophobicContact SD-CB 4.12Å; H394-D396 PolarHBondContact CE1-O 2.89Å; H394-D396 PolarHBondContact ND1-N 3.23Å; H394-D396 PolarHBondContact ND1-O 3.42Å; H394-D396 PolarHBondContact O-N 2.94Å; H394-L397 PolarHBondContact ND1-N 2.95Å; H394-L397 VanDerWaalsContact ND1-N 3.17Å; H394-I412 WeakPolarHBondContact CD2-CG2 3.25Å; H394-I412 WeakPolarHBondContact NE2-CG2 3.3Å; H394-A413 PolarHBondContact NE2-O 2.68Å; H394-A413 VanDerWaalsContact NE2-O 3.1Å; H394-D454 WeakPolarHBondContact CB-OD2 3.3Å; H394-D454 PolarHBondContact N-OD2 3.37Å
395	R	90.3	Very high	94.1	Very high	47 Å²	47	34.4 Å²	34.4	18%	0.177	16%	0.163	C	C	.	.	S	Bend	trans	71.4	-28.4	178.5	-50.7	-176.2	176.7	-154.8	-2.8	117.2	I393 A418 E422 F449 D454	I393-R395 HydrophobicContact CB-CG 4.37Å; I393-R395 HydrophobicContact CG2-CG 3.7Å; R395-A418 HydrophobicContact CB-CB 3.92Å; R395-E422 IonicContact CZ-OE2 3.66Å; R395-E422 IonicContact NH1-OE2 3.94Å; R395-E422 PolarHBondContact NH1-OE2 3.13Å; R395-F449 HydrophobicContact CB-CD1 4Å; R395-F449 HydrophobicContact CB-CE1 4.3Å; R395-F449 HydrophobicContact CG-CB 4.17Å; R395-F449 HydrophobicContact CG-CD1 4Å; R395-F449 HydrophobicContact CG-CG 4.18Å; R395-D454 WeakPolarHBondContact CA-OD1 3.45Å; R395-D454 PolarHBondContact N-OD1 2.98Å
396	D	89.8	Confident	93.6	Very high	20 Å²	20	38.6 Å²	38.6	11%	0.107	19%	0.185	C	C	.	.			trans	-126	50.2	176.1	-170.3	15.4	0	0	0	113.2	H394 R398 N401 P435	H394-D396 PolarHBondContact CE1-O 2.89Å; H394-D396 PolarHBondContact ND1-N 3.23Å; H394-D396 PolarHBondContact ND1-O 3.42Å; H394-D396 PolarHBondContact O-N 2.94Å; D396-R398 PolarHBondContact O-N 3.49Å; D396-R398 WeakPolarHBondContact OD1-CD 3.08Å; D396-R398 IonicContact OD1-CZ 2.63Å; D396-R398 IonicContact OD1-NE 3.86Å; D396-R398 PolarHBondContact OD1-NE 2.6Å; D396-R398 IonicContact OD1-NH2 3.54Å; D396-R398 IonicContact OD2-CZ 3.42Å; D396-R398 IonicContact OD2-NE 2.86Å; D396-R398 PolarHBondContact OD2-NE 3.38Å; D396-R398 IonicContact OD2-NH2 3.78Å; D396-R398 PolarHBondContact OD2-NH2 3.32Å; D396-N401 PolarHBondContact O-ND2 3.49Å; D396-N401 PolarHBondContact OD2-ND2 2.62Å; D396-P435 WeakPolarHBondContact OD1-CG 3.3Å
397	L	95.9	Very high	93.1	Very high	0 Å²	0	41.9 Å²	41.9	0%	0	21%	0.205	C	C	.	.			trans	-77.7	116.1	-178.4	-176.9	68	0	0	0	111.2	V380 M384 H394 I402 I412 S457 F458 L461 F519	V380-L397 HydrophobicContact CG1-CD1 4.25Å; M384-L397 HydrophobicContact CE-CD2 4.28Å; M384-L397 HydrophobicContact CG-CD1 4.32Å; M384-L397 HydrophobicContact CG-CD2 3.85Å; M384-L397 HydrophobicContact SD-CD1 4Å; M384-L397 HydrophobicContact SD-CD2 3.96Å; H394-L397 PolarHBondContact ND1-N 2.95Å; H394-L397 VanDerWaalsContact ND1-N 3.17Å; L397-I402 HydrophobicContact CD1-CD1 3.92Å; L397-I412 HydrophobicContact CD1-CG2 4.4Å; L397-S457 WeakPolarHBondContact O-CB 3.34Å; L397-F458 HydrophobicContact CD2-CB 3.86Å; L397-F458 HydrophobicContact CD2-CD2 4.24Å; L397-L461 HydrophobicContact CD1-CD1 4.27Å; L397-L461 HydrophobicContact CG-CD1 4.22Å; L397-F519 HydrophobicContact CD2-CZ 4.24Å
398	R	96.3	Very high	93	Very high	59 Å²	59	43.9 Å²	43.9	22%	0.223	22%	0.215	C	C	.	.	S	Bend	trans	-163.8	165	178.6	54.3	179.6	165.6	149.5	1.2	111.3	D396 A400 N401 I402 W438	D396-R398 PolarHBondContact O-N 3.49Å; D396-R398 WeakPolarHBondContact OD1-CD 3.08Å; D396-R398 IonicContact OD1-CZ 2.63Å; D396-R398 IonicContact OD1-NE 3.86Å; D396-R398 PolarHBondContact OD1-NE 2.6Å; D396-R398 IonicContact OD1-NH2 3.54Å; D396-R398 IonicContact OD2-CZ 3.42Å; D396-R398 IonicContact OD2-NE 2.86Å; D396-R398 PolarHBondContact OD2-NE 3.38Å; D396-R398 IonicContact OD2-NH2 3.78Å; D396-R398 PolarHBondContact OD2-NH2 3.32Å; R398-A400 HydrophobicContact CG-CB 4.23Å; R398-A400 PolarHBondContact O-N 3.49Å; R398-A400 VanDerWaalsContact O-N 3.09Å; R398-N401 HydrophobicContact CG-CB 4.46Å; R398-N401 PolarHBondContact O-N 3.46Å; R398-I402 PolarHBondContact O-N 3.46Å; R398-W438 HydrophobicContact CB-CD2 4.22Å; R398-W438 HydrophobicContact CB-CG 3.92Å
399	S	97	Very high	92.9	Very high	0 Å²	0	44 Å²	44	0%	0	22%	0.218	C	C	.	.	G	3₁₀ helix	trans	-57.8	-26.6	-178.9	71.9	0	0	0	0	114.4	L356 L357 N401 I402 E464	L356-S399 WeakPolarHBondContact CB-O 3.47Å; L356-S399 PolarHBondContact N-O 3.32Å; L357-S399 WeakPolarHBondContact CB-OG 3.42Å; L357-S399 WeakPolarHBondContact CD1-OG 3.29Å; L357-S399 PolarHBondContact N-O 3.13Å; S399-N401 VanDerWaalsContact C-N 3.27Å; S399-N401 PolarHBondContact O-N 3.16Å; S399-I402 PolarHBondContact O-N 3.33Å; S399-E464 PolarHBondContact N-OE2 3.13Å; S399-E464 PolarHBondContact OG-OE1 3.37Å; S399-E464 PolarHBondContact OG-OE2 3.29Å
400	A	93.8	Very high	92.9	Very high	30 Å²	30	37.2 Å²	37.2	25%	0.248	19%	0.193	C	C	.	.	G	3₁₀ helix	trans	-67.4	-25.3	174.8	0	0	0	0	0	113.7	L357 R398	L357-A400 HydrophobicContact CB-CB 4.49Å; L357-A400 HydrophobicContact CD2-CB 4.1Å; R398-A400 HydrophobicContact CG-CB 4.23Å; R398-A400 PolarHBondContact O-N 3.49Å; R398-A400 VanDerWaalsContact O-N 3.09Å
401	N	95	Very high	93.2	Very high	12 Å²	12	34 Å²	34	6%	0.064	18%	0.176	C	C	.	.	G	3₁₀ helix	trans	-104.3	10.4	-179.6	-66.6	-15.5	0	0	0	112.4	D396 R398 S399 A413	D396-N401 PolarHBondContact O-ND2 3.49Å; D396-N401 PolarHBondContact OD2-ND2 2.62Å; R398-N401 HydrophobicContact CG-CB 4.46Å; R398-N401 PolarHBondContact O-N 3.46Å; S399-N401 VanDerWaalsContact C-N 3.27Å; S399-N401 PolarHBondContact O-N 3.16Å; N401-A413 WeakPolarHBondContact O-CB 3.32Å; N401-A413 PolarHBondContact O-N 3.19Å
402	I	98.1	Very high	93.5	Very high	0 Å²	0	26.8 Å²	26.8	0%	0	14%	0.138	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-101.6	129.9	166.2	-53.1	-52.3	0	0	0	107.4	S355 L356 V380 L397 R398 S399 C410 K411 I412 L461	S355-I402 CarbonylContact C-O 3.57Å; S355-I402 WeakPolarHBondContact CA-O 3.28Å; L356-I402 HydrophobicContact CB-CB 3.79Å; L356-I402 HydrophobicContact CB-CG2 4.04Å; L356-I402 HydrophobicContact CD2-CB 3.97Å; L356-I402 HydrophobicContact CD2-CG1 4.27Å; L356-I402 HydrophobicContact CD2-CG2 3.97Å; L356-I402 PolarHBondContact N-O 2.96Å; V380-I402 HydrophobicContact CG1-CD1 3.94Å; V380-I402 HydrophobicContact CG2-CD1 3.97Å; V380-I402 HydrophobicContact CG2-CG1 4.03Å; V380-I402 HydrophobicContact CG2-CG2 3.87Å; L397-I402 HydrophobicContact CD1-CD1 3.92Å; R398-I402 PolarHBondContact O-N 3.46Å; S399-I402 PolarHBondContact O-N 3.33Å; I402-C410 HydrophobicContact CG2-CB 3.94Å; I402-K411 CarbonylContact C-O 3.44Å; I402-K411 WeakPolarHBondContact CA-O 3.27Å; I402-I412 HydrophobicContact CD1-CB 4.22Å; I402-I412 HydrophobicContact CD1-CG1 3.81Å; I402-I412 HydrophobicContact CD1-CG2 4.28Å; I402-L461 HydrophobicContact CD1-CD1 4.24Å; I402-L461 HydrophobicContact CG1-CD1 3.82Å
403	L	97.4	Very high	93.6	Very high	37 Å²	37	26.1 Å²	26.1	19%	0.194	14%	0.137	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-104.3	143.1	175.7	-59.8	-175	0	0	0	111	V333 M351 G354 C410 K411 A413	V333-L403 HydrophobicContact CG2-CB 4.46Å; V333-L403 HydrophobicContact CG2-CD1 3.97Å; V333-L403 HydrophobicContact CG2-CG 4.4Å; M351-L403 HydrophobicContact CB-CB 3.67Å; M351-L403 HydrophobicContact CB-CD1 4.01Å; M351-L403 HydrophobicContact CB-CG 4.43Å; M351-L403 HydrophobicContact CE-CB 4.21Å; M351-L403 WeakPolarHBondContact CE-O 3.18Å; M351-L403 HydrophobicContact CG-CB 3.64Å; M351-L403 HydrophobicContact CG-CD1 3.84Å; M351-L403 HydrophobicContact CG-CG 4.41Å; G354-L403 CarbonylContact O-C 3.5Å; G354-L403 WeakPolarHBondContact O-CA 3.48Å; L403-C410 WeakPolarHBondContact O-CA 3.39Å; L403-K411 PolarHBondContact N-O 3.45Å; L403-K411 PolarHBondContact O-N 3.41Å; L403-A413 HydrophobicContact CD1-CB 3.97Å; L403-A413 HydrophobicContact CG-CB 3.87Å
404	V	97.1	Very high	93.4	Very high	0 Å²	0	26.7 Å²	26.7	0%	0	14%	0.14	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-108.9	129.7	-178.3	-174.4	0	0	0	0	109.8	K353 G354 L356 F359 M376 V409	K353-V404 WeakPolarHBondContact CA-O 3.45Å; K353-V404 HydrophobicContact CB-CB 3.87Å; K353-V404 HydrophobicContact CB-CG1 3.9Å; K353-V404 VanDerWaalsContact CB-O 3.3Å; K353-V404 WeakPolarHBondContact CB-O 3.39Å; K353-V404 HydrophobicContact CG-CG1 4.3Å; K353-V404 PolarHBondContact N-O 3.43Å; G354-V404 PolarHBondContact O-N 3.38Å; L356-V404 HydrophobicContact CB-CG2 3.96Å; L356-V404 HydrophobicContact CD1-CG2 3.9Å; F359-V404 HydrophobicContact CB-CG2 4.2Å; F359-V404 HydrophobicContact CD1-CG1 4.28Å; F359-V404 HydrophobicContact CD1-CG2 4.18Å; F359-V404 HydrophobicContact CD2-CG1 4.3Å; F359-V404 HydrophobicContact CE1-CG1 4.3Å; F359-V404 HydrophobicContact CE2-CG1 4.33Å; F359-V404 HydrophobicContact CG-CB 4.37Å; F359-V404 HydrophobicContact CG-CG1 4.28Å; F359-V404 HydrophobicContact CG-CG2 4.19Å; F359-V404 HydrophobicContact CZ-CG1 4.35Å; M376-V404 HydrophobicContact CE-CG1 4.42Å; M376-V404 HydrophobicContact CE-CG2 4.03Å; V404-V409 CarbonylContact C-O 3.49Å; V404-V409 WeakPolarHBondContact CA-O 3.32Å
405	G	92.5	Very high	92.6	Very high	1 Å²	1	26.8 Å²	26.8	1%	0.01	14%	0.141	C	C	.	.			trans	-106.6	-166.5	175	0	0	0	0	0	111.7	M351 V409	M351-G405 VanDerWaalsContact CE-N 3.32Å; G405-V409 PolarHBondContact N-O 3.33Å
406	D	87.3	Confident	91.4	Very high	89 Å²	89	24.6 Å²	24.6	48%	0.476	13%	0.133	S	C	.	.	G	3₁₀ helix	trans	-65.8	154.8	174.5	-51.4	-42.4	0	0	0	110.7	S352 L408 V409	S352-D406 PolarHBondContact OG-OD1 3.14Å; D406-L408 PolarHBondContact O-N 3.47Å; D406-V409 WeakPolarHBondContact O-CG2 3.38Å; D406-V409 PolarHBondContact O-N 3.33Å
407	N	85.1	Confident	90.3	Very high	101 Å²	101	24.3 Å²	24.3	54%	0.54	13%	0.131	S	C	.	.	G	3₁₀ helix	trans	54.7	32.8	-177.7	-57.3	-31	0	0	0	114.4	V409	N407-V409 PolarHBondContact O-N 3.04Å
408	L	91.6	Very high	88.6	Confident	41 Å²	41	25.4 Å²	25.4	22%	0.215	14%	0.141	C	C	.	.	G	3₁₀ helix	trans	60.2	23.7	178.7	-50.8	179	0	0	0	114.1	F359 L368 N372 Q379 D406 C410	F359-L408 HydrophobicContact CE1-CD2 3.93Å; F359-L408 HydrophobicContact CZ-CD2 3.51Å; L368-L408 HydrophobicContact CD1-CD1 4.21Å; L368-L408 HydrophobicContact CD1-CD2 4.13Å; L368-L408 HydrophobicContact CD2-CD1 3.89Å; L368-L408 HydrophobicContact CD2-CD2 4.44Å; N372-L408 HydrophobicContact CB-CD1 4.22Å; Q379-L408 PolarHBondContact NE2-O 2.82Å; Q379-L408 VanDerWaalsContact NE2-O 3.11Å; D406-L408 PolarHBondContact O-N 3.47Å; L408-C410 PolarHBondContact O-N 3.14Å
409	V	92.9	Very high	87	Confident	38 Å²	38	27.1 Å²	27.1	23%	0.23	15%	0.147	C	C	.	.			trans	-64.2	124.6	174.2	172.4	0	0	0	0	109.4	V404 G405 D406 N407 K411	V404-V409 CarbonylContact C-O 3.49Å; V404-V409 WeakPolarHBondContact CA-O 3.32Å; G405-V409 PolarHBondContact N-O 3.33Å; D406-V409 WeakPolarHBondContact O-CG2 3.38Å; D406-V409 PolarHBondContact O-N 3.33Å; N407-V409 PolarHBondContact O-N 3.04Å; V409-K411 HydrophobicContact CG1-CG 4.24Å
410	C	97.4	Very high	85.1	Confident	1 Å²	1	27.8 Å²	27.8	1%	0.007	15%	0.151	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-104.8	132.2	176.7	-65.7	0	0	0	0	110.4	K331 M376 Q379 V380 I402 L403 L408	K331-C410 WeakPolarHBondContact CD-O 3.46Å; M376-C410 WeakPolarHBondContact CE-SG 3.47Å; Q379-C410 HydrophobicContact CB-CB 4.1Å; V380-C410 HydrophobicContact CG2-CB 4.27Å; I402-C410 HydrophobicContact CG2-CB 3.94Å; L403-C410 WeakPolarHBondContact O-CA 3.39Å; L408-C410 PolarHBondContact O-N 3.14Å
411	K	97.5	Very high	83.2	Confident	20 Å²	20	29 Å²	29	9%	0.087	15%	0.152	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-129.9	138.4	174.4	-62.7	-171.9	169.4	-145.4	0	111.2	D330 K331 V333 E349 M351 I402 L403 V409	D330-K411 WeakPolarHBondContact O-CE 3.4Å; K331-K411 CarbonylContact O-C 3.6Å; K331-K411 WeakPolarHBondContact O-CA 3.42Å; V333-K411 HydrophobicContact CG2-CB 3.65Å; E349-K411 WeakPolarHBondContact OE1-CD 3.4Å; E349-K411 IonicContact OE1-NZ 3.62Å; E349-K411 PolarHBondContact OE1-NZ 2.93Å; E349-K411 WeakPolarHBondContact OE2-CE 3.19Å; E349-K411 IonicContact OE2-NZ 2.94Å; E349-K411 PolarHBondContact OE2-NZ 3.39Å; M351-K411 HydrophobicContact CE-CB 3.99Å; M351-K411 HydrophobicContact CE-CD 3.9Å; M351-K411 HydrophobicContact CE-CG 3.79Å; M351-K411 HydrophobicContact SD-CD 4Å; I402-K411 CarbonylContact C-O 3.44Å; I402-K411 WeakPolarHBondContact CA-O 3.27Å; L403-K411 PolarHBondContact N-O 3.45Å; L403-K411 PolarHBondContact O-N 3.41Å; V409-K411 HydrophobicContact CG1-CG 4.24Å
412	I	96.8	Very high	81.2	Confident	0 Å²	0	31.3 Å²	31.3	0%	0	16%	0.163	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-77.9	126.6	176.5	-54.2	168.3	0	0	0	108.6	K331 L332 V333 V380 M384 I387 H394 L397 I402	K331-I412 PolarHBondContact O-N 3.34Å; L332-I412 HydrophobicContact CD2-CB 3.73Å; L332-I412 HydrophobicContact CD2-CD1 3.83Å; L332-I412 HydrophobicContact CD2-CG1 4.21Å; L332-I412 HydrophobicContact CD2-CG2 4.4Å; V333-I412 WeakPolarHBondContact CG2-O 3.23Å; V333-I412 PolarHBondContact N-O 2.97Å; V380-I412 HydrophobicContact CG1-CD1 4.38Å; V380-I412 HydrophobicContact CG1-CG1 4.32Å; M384-I412 HydrophobicContact CG-CD1 3.69Å; M384-I412 HydrophobicContact SD-CD1 3.78Å; I387-I412 HydrophobicContact CD1-CD1 4.44Å; H394-I412 WeakPolarHBondContact CD2-CG2 3.25Å; H394-I412 WeakPolarHBondContact NE2-CG2 3.3Å; L397-I412 HydrophobicContact CD1-CG2 4.4Å; I402-I412 HydrophobicContact CD1-CB 4.22Å; I402-I412 HydrophobicContact CD1-CG1 3.81Å; I402-I412 HydrophobicContact CD1-CG2 4.28Å
413	A	92.6	Very high	78.8	Confident	8 Å²	8	36.9 Å²	36.9	7%	0.066	19%	0.193	C	C	.	.			trans	-111.6	171.1	177	0	0	0	0	0	110.8	V333 H394 N401 L403 F415	V333-A413 HydrophobicContact CB-CB 4.32Å; V333-A413 HydrophobicContact CG2-CB 3.82Å; H394-A413 PolarHBondContact NE2-O 2.68Å; H394-A413 VanDerWaalsContact NE2-O 3.1Å; N401-A413 WeakPolarHBondContact O-CB 3.32Å; N401-A413 PolarHBondContact O-N 3.19Å; L403-A413 HydrophobicContact CD1-CB 3.97Å; L403-A413 HydrophobicContact CG-CB 3.87Å; A413-F415 PolarHBondContact O-N 3.34Å
414	D	84.3	Confident	76.2	Confident	55 Å²	55	40.5 Å²	40.5	29%	0.294	21%	0.212	S	C	.	.			trans	58.1	15.1	173.1	-72.5	-9.1	0	0	0	115.8	K305 G416 L417	K305-D414 IonicContact NZ-OD1 3.77Å; K305-D414 PolarHBondContact NZ-OD1 2.59Å; K305-D414 IonicContact NZ-OD2 2.88Å; K305-D414 PolarHBondContact NZ-OD2 3.46Å; D414-G416 PolarHBondContact O-N 3.09Å; D414-L417 HydrophobicContact CB-CD1 4.16Å; D414-L417 PolarHBondContact O-N 3.16Å; D414-L417 WeakPolarHBondContact OD1-CD1 3.46Å
415	F	75.5	Confident	73.5	Confident	3 Å²	3	46.3 Å²	46.3	1%	0.013	24%	0.239	C	C	.	.	T	Hydrogen-bonded Turn	trans	-62	130.7	170.3	60.1	-90.3	0	0	0	109.8	M324 L327 L332 I387 A413 L417	M324-F415 HydrophobicContact CB-CE2 4.19Å; M324-F415 WeakPolarHBondContact CE-O 3.26Å; M324-F415 HydrophobicContact CG-CD2 4.44Å; M324-F415 HydrophobicContact CG-CE2 4.28Å; L327-F415 HydrophobicContact CB-CE2 3.95Å; L327-F415 HydrophobicContact CD1-CD2 3.78Å; L327-F415 HydrophobicContact CD1-CE2 3.79Å; L327-F415 HydrophobicContact CG-CE2 4.49Å; L332-F415 HydrophobicContact CB-CE1 3.93Å; L332-F415 HydrophobicContact CB-CZ 4.27Å; L332-F415 HydrophobicContact CD1-CE1 4.44Å; L332-F415 HydrophobicContact CD1-CZ 4.31Å; L332-F415 HydrophobicContact CD2-CD1 4.42Å; L332-F415 HydrophobicContact CD2-CE1 4.46Å; I387-F415 HydrophobicContact CD1-CB 4.43Å; A413-F415 PolarHBondContact O-N 3.34Å; F415-L417 VanDerWaalsContact C-N 3.34Å; F415-L417 PolarHBondContact O-N 2.97Å
416	G	65.4	Low	70.7	Confident	2 Å²	2	56.8 Å²	56.8	2%	0.021	28%	0.28	C	S	.	.	T	Hydrogen-bonded Turn	trans	88.1	-17.6	179.4	0	0	0	0	0	116.8	Y392 D414 A418 R419	Y392-G416 WeakPolarHBondContact OH-CA 3.46Å; D414-G416 PolarHBondContact O-N 3.09Å; G416-A418 PolarHBondContact O-N 2.99Å; G416-R419 PolarHBondContact O-N 3.46Å
417	L	66.8	Low	68.4	Low	13 Å²	13	56.5 Å²	56.5	7%	0.068	28%	0.282	C	S	.	.	T	Hydrogen-bonded Turn	trans	-72.2	-29.1	179.6	-62.2	-178.2	0	0	0	113.2	K305 M324 I346 D414 F415 R419 L420 I421	K305-L417 HydrophobicContact CD-CD1 4.03Å; M324-L417 HydrophobicContact CE-CD2 4.36Å; M324-L417 HydrophobicContact SD-CD2 4.14Å; I346-L417 HydrophobicContact CD1-CD1 4.07Å; I346-L417 HydrophobicContact CD1-CD2 3.62Å; D414-L417 HydrophobicContact CB-CD1 4.16Å; D414-L417 PolarHBondContact O-N 3.16Å; D414-L417 WeakPolarHBondContact OD1-CD1 3.46Å; F415-L417 VanDerWaalsContact C-N 3.34Å; F415-L417 PolarHBondContact O-N 2.97Å; L417-R419 VanDerWaalsContact C-N 3.28Å; L417-R419 PolarHBondContact O-N 2.91Å; L417-L420 HydrophobicContact CD2-CD1 3.96Å; L417-L420 PolarHBondContact O-N 3.44Å; L417-I421 WeakPolarHBondContact O-CD1 3.33Å
418	A	61.2	Low	66.3	Low	24 Å²	24	56.4 Å²	56.4	20%	0.198	30%	0.295	C	S	.	.	T	Hydrogen-bonded Turn	trans	-65.7	-32.1	177.6	0	0	0	0	0	112.6	R395 G416	R395-A418 HydrophobicContact CB-CB 3.92Å; G416-A418 PolarHBondContact O-N 2.99Å
419	R	62.5	Low	63.7	Low	94 Å²	94	62.5 Å²	62.5	36%	0.355	32%	0.315	S	S	.	.	H	α-helix	trans	-68.8	-36.2	-178.9	-152.4	173.7	90.5	76.6	9.1	112.1	E320 G416 L417 I421 E422	E320-R419 IonicContact OE1-NE 3.67Å; E320-R419 IonicContact OE2-CZ 2.74Å; E320-R419 IonicContact OE2-NE 2.65Å; E320-R419 PolarHBondContact OE2-NE 3.03Å; E320-R419 IonicContact OE2-NH2 2.75Å; E320-R419 PolarHBondContact OE2-NH2 3.45Å; G416-R419 PolarHBondContact O-N 3.46Å; L417-R419 VanDerWaalsContact C-N 3.28Å; L417-R419 PolarHBondContact O-N 2.91Å; R419-I421 PolarHBondContact O-N 3.3Å; R419-E422 PolarHBondContact O-N 3.35Å
420	L	56.8	Low	61.1	Low	15 Å²	15	70.6 Å²	70.6	8%	0.079	35%	0.35	C	S	.	.	H	α-helix	trans	-66.2	-19	-178.3	-68.7	174.5	0	0	0	114.6	M312 F317 E320 L417	M312-L420 HydrophobicContact CE-CB 3.65Å; M312-L420 HydrophobicContact CE-CD1 3.77Å; M312-L420 HydrophobicContact CE-CD2 3.39Å; M312-L420 HydrophobicContact CE-CG 3.77Å; M312-L420 HydrophobicContact SD-CB 3.98Å; M312-L420 HydrophobicContact SD-CD1 3.9Å; M312-L420 HydrophobicContact SD-CG 4.35Å; F317-L420 HydrophobicContact CD2-CD1 4.35Å; E320-L420 HydrophobicContact CB-CD1 3.87Å; E320-L420 HydrophobicContact CB-CD2 3.23Å; E320-L420 HydrophobicContact CB-CG 3.83Å; E320-L420 HydrophobicContact CG-CD1 3.86Å; E320-L420 HydrophobicContact CG-CD2 3.61Å; E320-L420 HydrophobicContact CG-CG 3.71Å; L417-L420 HydrophobicContact CD2-CD1 3.96Å; L417-L420 PolarHBondContact O-N 3.44Å
421	I	54.4	Low	58.5	Low	54 Å²	54	74 Å²	74	28%	0.277	39%	0.386	S	S	.	.	H	α-helix	trans	-101.2	-22.8	-173.1	-62.8	157.1	0	0	0	111	F288 T311 L417 R419	F288-I421 HydrophobicContact CD1-CD1 3.41Å; F288-I421 VanDerWaalsContact CD1-CD1 3.41Å; F288-I421 HydrophobicContact CD1-CG1 4.44Å; F288-I421 HydrophobicContact CD2-CD1 4.2Å; F288-I421 HydrophobicContact CE1-CD1 3.41Å; F288-I421 VanDerWaalsContact CE1-CD1 3.41Å; F288-I421 HydrophobicContact CE1-CG1 4.47Å; F288-I421 HydrophobicContact CE1-CG2 4.34Å; F288-I421 HydrophobicContact CE2-CD1 4.17Å; F288-I421 HydrophobicContact CG-CD1 3.84Å; F288-I421 HydrophobicContact CZ-CD1 3.79Å; T311-I421 HydrophobicContact CG2-CG1 4.31Å; L417-I421 WeakPolarHBondContact O-CD1 3.33Å; R419-I421 PolarHBondContact O-N 3.3Å
422	E	52.3	Low	55.9	Low	62 Å²	62	76.2 Å²	76.2	29%	0.29	41%	0.407	S	S	.	.	H	α-helix	trans	-74.6	-24.3	-178.1	-75.3	178.7	-175.6	0	0	113.6	R395 R419 N424 E425 F449	R395-E422 IonicContact CZ-OE2 3.66Å; R395-E422 IonicContact NH1-OE2 3.94Å; R395-E422 PolarHBondContact NH1-OE2 3.13Å; R419-E422 PolarHBondContact O-N 3.35Å; E422-N424 PolarHBondContact O-N 3.26Å; E422-E425 PolarHBondContact O-N 3.29Å; E422-F449 WeakPolarHBondContact OE1-CE2 3.48Å
423	D	46.8	Very low	54.2	Low	117 Å²	117	84.4 Å²	84.4	63%	0.626	44%	0.443	S	S	*	.	T	Hydrogen-bonded Turn	trans	-69.3	-14.1	-179.5	-77.9	-20.9	0	0	0	113.6
424	N	43	Very low	53.2	Low	113 Å²	113	87 Å²	87	60%	0.604	45%	0.453	S	S	*	.	T	Hydrogen-bonded Turn	trans	-94.4	-13.5	178.4	-81.1	-24.1	0	0	0	114.8	E422	E422-N424 PolarHBondContact O-N 3.26Å
425	E	40.1	Very low	53.4	Low	121 Å²	121	85.2 Å²	85.2	57%	0.565	45%	0.445	S	S	*	.			trans	-148	95	174	-73.3	-167.3	145.6	0	0	111.3	E422 T427	E422-E425 PolarHBondContact O-N 3.29Å; E425-T427 PolarHBondContact O-N 3.16Å
426	Y	33.6	Very low	54.1	Low	221 Å²	221	86.9 Å²	86.9	87%	0.867	45%	0.453	S	S	*	.	S	Bend	trans	-65.6	23.6	-179.8	-139.7	-94.9	0	0	0	115.5
427	T	39.5	Very low	55.6	Low	84 Å²	84	87.8 Å²	87.8	52%	0.515	46%	0.456	S	S	.	.	S	Bend	trans	-150.4	132.3	172.9	15.3	0	0	0	0	108.3	E425 R429	E425-T427 PolarHBondContact O-N 3.16Å; T427-R429 PolarHBondContact O-N 3.03Å
428	A	41.3	Very low	57	Low	98 Å²	98	88.8 Å²	88.8	81%	0.81	46%	0.459	S	S	*	.			trans	-58.5	75	160.9	0	0	0	0	0	109.3	Q430	A428-Q430 PolarHBondContact O-N 2.88Å
429	R	37.8	Very low	58.6	Low	170 Å²	170	88.2 Å²	88.2	64%	0.642	45%	0.453	S	S	*	.			trans	-71.8	121.3	172.8	-70.9	-175.5	177.8	-172.9	-1.4	105.8	T427 G431	T427-R429 PolarHBondContact O-N 3.03Å; R429-G431 PolarHBondContact O-N 3.45Å
430	Q	36.9	Very low	60.2	Low	207 Å²	207	83.8 Å²	83.8	97%	0.967	44%	0.437	S	S	*	.	T	Hydrogen-bonded Turn	trans	-44.9	103.1	173.1	-70.5	170.8	-13.5	0	0	109.4	A428	A428-Q430 PolarHBondContact O-N 2.88Å
431	G	42.5	Very low	62	Low	74 Å²	74	83.7 Å²	83.7	76%	0.763	44%	0.437	S	S	*	.	T	Hydrogen-bonded Turn	trans	157.7	-35	-176.7	0	0	0	0	0	114.7	R429	R429-G431 PolarHBondContact O-N 3.45Å
432	A	44	Very low	63.8	Low	65 Å²	65	82.4 Å²	82.4	54%	0.537	43%	0.43	S	S	.	.	S	Bend	trans	-73.6	136	172.3	0	0	0	0	0	110.3	F434	A432-F434 PolarHBondContact O-N 2.8Å
433	K	60.4	Low	65.7	Low	173 Å²	173	79.7 Å²	79.7	75%	0.752	42%	0.418	S	S	*	.			trans	-70.5	54.5	177.1	-68.1	177.8	176.9	178	0	111.9
434	F	72.8	Confident	67.7	Low	62 Å²	62	75 Å²	75	27%	0.272	40%	0.396	S	S	.	.			trans	-65.9	137.8	176.2	-173	-95.8	0	0	0	110.1	A432 I436 T439 F449	A432-F434 PolarHBondContact O-N 2.8Å; F434-I436 HydrophobicContact CD1-CD1 3.54Å; F434-I436 HydrophobicContact CD1-CG1 3.96Å; F434-I436 HydrophobicContact CE1-CD1 4.08Å; F434-I436 PolarHBondContact O-N 3.4Å; F434-T439 HydrophobicContact CE1-CG2 3.61Å; F434-T439 WeakPolarHBondContact CE1-OG1 3.32Å; F434-T439 HydrophobicContact CZ-CG2 3.68Å; F434-T439 WeakPolarHBondContact CZ-OG1 3.4Å; F434-F449 HydrophobicContact CE2-CE1 4.37Å; F434-F449 AromaticContact CE2-CZ 3.82Å; F434-F449 HydrophobicContact CE2-CZ 3.82Å; F434-F449 HydrophobicContact CZ-CE1 4.01Å; F434-F449 AromaticContact CZ-CZ 3.63Å; F434-F449 HydrophobicContact CZ-CZ 3.63Å
435	P	87.2	Confident	69.7	Low	18 Å²	18	72.7 Å²	72.7	12%	0.117	38%	0.383	C	S	.	.			trans	-78.6	57.5	-172	35	-39	0	0	0	112.4	D396 K437 W438 T439	D396-P435 WeakPolarHBondContact OD1-CG 3.3Å; P435-K437 PolarHBondContact O-N 3.4Å; P435-W438 HydrophobicContact CB-CE3 4.05Å; P435-W438 PolarHBondContact O-N 2.84Å; P435-T439 PolarHBondContact O-N 3.26Å; P435-T439 PolarHBondContact O-OG1 2.74Å; P435-T439 VanDerWaalsContact O-OG1 3.14Å
436	I	91.1	Very high	71.9	Confident	37 Å²	37	74.1 Å²	74.1	19%	0.19	38%	0.384	C	S	.	.	T	Hydrogen-bonded Turn	trans	-45.5	-38.4	-172.7	-67	-73.2	0	0	0	113.8	F434 W438 T439 N478	F434-I436 HydrophobicContact CD1-CD1 3.54Å; F434-I436 HydrophobicContact CD1-CG1 3.96Å; F434-I436 HydrophobicContact CE1-CD1 4.08Å; F434-I436 PolarHBondContact O-N 3.4Å; I436-W438 PolarHBondContact O-N 2.81Å; I436-T439 PolarHBondContact O-N 2.9Å; I436-N478 HydrophobicContact CB-CB 4.01Å; I436-N478 HydrophobicContact CG1-CB 4.19Å; I436-N478 HydrophobicContact CG2-CB 4Å; I436-N478 WeakPolarHBondContact CG2-O 3.47Å
437	K	96.1	Very high	74.3	Confident	21 Å²	21	66 Å²	66	9%	0.091	37%	0.367	C	S	.	.	T	Hydrogen-bonded Turn	trans	-68.9	-18.9	-178	-62.4	-169.6	167.5	-159.2	0	114.5	P435 V471 P472 Y473 M476 V481	P435-K437 PolarHBondContact O-N 3.4Å; K437-V471 HydrophobicContact CD-CG1 4.14Å; K437-P472 HydrophobicContact CB-CB 4.3Å; K437-P472 VanDerWaalsContact CD-O 3.3Å; K437-P472 WeakPolarHBondContact CD-O 3.47Å; K437-P472 PolarHBondContact NZ-O 3.23Å; K437-Y473 HydrophobicContact CB-CD2 4.17Å; K437-Y473 HydrophobicContact CG-CD2 4.42Å; K437-Y473 PolarHBondContact NZ-O 3.09Å; K437-Y473 WeakPolarHBondContact O-CE2 3.35Å; K437-M476 VanDerWaalsContact CE-O 3.27Å; K437-M476 WeakPolarHBondContact CE-O 3.38Å; K437-M476 PolarHBondContact NZ-O 3.39Å; K437-V481 HydrophobicContact CG-CG2 4.25Å
438	W	96.9	Very high	76.7	Confident	35 Å²	35	70.1 Å²	70.1	13%	0.133	37%	0.374	C	S	.	.	T	Hydrogen-bonded Turn	trans	-99.1	-20.7	175.8	-70.1	-99.1	0	0	0	112.2	R398 P435 I436 W456 S457 I460 E464 P472	R398-W438 HydrophobicContact CB-CD2 4.22Å; R398-W438 HydrophobicContact CB-CG 3.92Å; P435-W438 HydrophobicContact CB-CE3 4.05Å; P435-W438 PolarHBondContact O-N 2.84Å; I436-W438 PolarHBondContact O-N 2.81Å; W438-W456 VanDerWaalsContact O-CD1 3.25Å; W438-S457 WeakPolarHBondContact O-CA 3.48Å; W438-S457 PolarHBondContact O-OG 3.14Å; W438-I460 HydrophobicContact CD2-CG2 4.36Å; W438-I460 HydrophobicContact CG-CB 4.45Å; W438-I460 HydrophobicContact CG-CG2 3.9Å; W438-E464 WeakPolarHBondContact CZ2-OE1 3.35Å; W438-E464 PolarHBondContact NE1-OE2 3.46Å; W438-P472 HydrophobicContact CD2-CG 4.46Å; W438-P472 HydrophobicContact CH2-CG 4.16Å; W438-P472 VanDerWaalsContact CZ2-CD 3.46Å; W438-P472 HydrophobicContact CZ2-CG 3.63Å
439	T	94.6	Very high	79	Confident	11 Å²	11	66.7 Å²	66.7	7%	0.067	34%	0.341	C	S	.	.	S	Bend	trans	-78.3	136.5	-172.8	-46.9	0	0	0	0	112.2	F434 P435 I436 A443 A444 F449 W456	F434-T439 HydrophobicContact CE1-CG2 3.61Å; F434-T439 WeakPolarHBondContact CE1-OG1 3.32Å; F434-T439 HydrophobicContact CZ-CG2 3.68Å; F434-T439 WeakPolarHBondContact CZ-OG1 3.4Å; P435-T439 PolarHBondContact O-N 3.26Å; P435-T439 PolarHBondContact O-OG1 2.74Å; P435-T439 VanDerWaalsContact O-OG1 3.14Å; I436-T439 PolarHBondContact O-N 2.9Å; T439-A443 HydrophobicContact CG2-CB 3.6Å; T439-A444 HydrophobicContact CG2-CB 3.98Å; T439-F449 HydrophobicContact CG2-CE1 4.35Å; T439-W456 PolarHBondContact O-NE1 3.04Å
440	A	96.1	Very high	81.6	Confident	1 Å²	1	61 Å²	61	1%	0.008	33%	0.325	C	S	.	.			trans	-61	147.7	171.4	0	0	0	0	0	111.8	E442 A443 A444 W456	A440-E442 VanDerWaalsContact C-N 3.3Å; A440-E442 WeakPolarHBondContact CB-OE1 3.28Å; A440-E442 WeakPolarHBondContact CB-OE2 3.46Å; A440-E442 PolarHBondContact O-N 3.01Å; A440-A443 HydrophobicContact CB-CB 4.41Å; A440-A443 PolarHBondContact O-N 2.91Å; A440-A443 VanDerWaalsContact O-N 3.09Å; A440-A444 PolarHBondContact O-N 3.27Å; A440-W456 HydrophobicContact CB-CB 3.7Å; A440-W456 HydrophobicContact CB-CD2 4.06Å; A440-W456 HydrophobicContact CB-CE3 4.48Å; A440-W456 HydrophobicContact CB-CG 3.69Å
441	P	93.7	Very high	84.5	Confident	14 Å²	14	52.8 Å²	52.8	9%	0.091	29%	0.287	C	S	.	.	H	α-helix	trans	-59	-39.3	-175.7	22.5	-33	0	0	0	112.8	A443 A444 L445 W456 V485	P441-A443 VanDerWaalsContact C-N 3.33Å; P441-A443 PolarHBondContact O-N 2.83Å; P441-A444 PolarHBondContact O-N 3.43Å; P441-L445 VanDerWaalsContact O-CB 3.26Å; P441-L445 WeakPolarHBondContact O-CB 3.39Å; P441-L445 VanDerWaalsContact O-CG 3.27Å; P441-L445 WeakPolarHBondContact O-CG 3.42Å; P441-L445 PolarHBondContact O-N 3.34Å; P441-W456 HydrophobicContact CG-CH2 4.2Å; P441-W456 HydrophobicContact CG-CZ3 4.12Å; P441-V485 HydrophobicContact CB-CG1 4.34Å; P441-V485 HydrophobicContact CG-CG1 4.37Å
442	E	93.5	Very high	87.1	Confident	27 Å²	27	50.4 Å²	50.4	13%	0.126	26%	0.256	C	S	.	.	H	α-helix	trans	-67.7	-31.8	178.3	72.1	-74.1	176.4	0	0	113.5	A440 Y446 R448 R516	A440-E442 VanDerWaalsContact C-N 3.3Å; A440-E442 WeakPolarHBondContact CB-OE1 3.28Å; A440-E442 WeakPolarHBondContact CB-OE2 3.46Å; A440-E442 PolarHBondContact O-N 3.01Å; E442-Y446 HydrophobicContact CB-CD2 4.32Å; E442-Y446 WeakPolarHBondContact O-CA 3.15Å; E442-Y446 WeakPolarHBondContact O-CB 3.47Å; E442-Y446 PolarHBondContact O-N 2.91Å; E442-Y446 VanDerWaalsContact O-N 3.08Å; E442-R448 HydrophobicContact CG-CB 4.35Å; E442-R448 PolarHBondContact O-N 3.12Å; E442-R516 IonicContact OE1-CZ 3.77Å; E442-R516 IonicContact OE1-NH1 3.35Å; E442-R516 PolarHBondContact OE1-NH1 2.93Å; E442-R516 IonicContact OE1-NH2 3.25Å; E442-R516 PolarHBondContact OE1-NH2 2.82Å; E442-R516 IonicContact OE2-CZ 2.65Å; E442-R516 IonicContact OE2-NH1 3.62Å; E442-R516 IonicContact OE2-NH2 3.19Å; E442-R516 PolarHBondContact OE2-NH2 3.14Å
443	A	91.2	Very high	89.7	Confident	4 Å²	4	47.4 Å²	47.4	3%	0.033	23%	0.231	C	C	.	.	H	α-helix	trans	-75.5	-42.2	175.7	0	0	0	0	0	110.9	T439 A440 P441 G447 F449	T439-A443 HydrophobicContact CG2-CB 3.6Å; A440-A443 HydrophobicContact CB-CB 4.41Å; A440-A443 PolarHBondContact O-N 2.91Å; A440-A443 VanDerWaalsContact O-N 3.09Å; P441-A443 VanDerWaalsContact C-N 3.33Å; P441-A443 PolarHBondContact O-N 2.83Å; A443-G447 VanDerWaalsContact O-CA 3.23Å; A443-G447 WeakPolarHBondContact O-CA 3.46Å; A443-G447 PolarHBondContact O-N 3.41Å; A443-F449 HydrophobicContact CB-CD1 3.84Å; A443-F449 HydrophobicContact CB-CE1 3.85Å; A443-F449 HydrophobicContact CB-CG 4.28Å; A443-F449 HydrophobicContact CB-CZ 4.27Å
444	A	88.4	Confident	91.5	Very high	19 Å²	19	39.2 Å²	39.2	16%	0.157	20%	0.195	C	C	.	.	H	α-helix	trans	-69.3	-37.8	179	0	0	0	0	0	113.4	T439 A440 P441 L482	T439-A444 HydrophobicContact CG2-CB 3.98Å; A440-A444 PolarHBondContact O-N 3.27Å; P441-A444 PolarHBondContact O-N 3.43Å; A444-L482 HydrophobicContact CB-CD1 3.83Å
445	L	86.4	Confident	92.7	Very high	65 Å²	65	36.2 Å²	36.2	34%	0.34	18%	0.182	S	C	.	.	H	α-helix	trans	-88	-36.9	-176.2	-66.6	169.9	0	0	0	113.3	P441 L482	P441-L445 VanDerWaalsContact O-CB 3.26Å; P441-L445 WeakPolarHBondContact O-CB 3.39Å; P441-L445 VanDerWaalsContact O-CG 3.27Å; P441-L445 WeakPolarHBondContact O-CG 3.42Å; P441-L445 PolarHBondContact O-N 3.34Å; L445-L482 HydrophobicContact CD2-CD1 4.07Å; L445-L482 HydrophobicContact CD2-CD2 3.79Å; L445-L482 HydrophobicContact CD2-CG 4.04Å; L445-L482 HydrophobicContact CG-CD1 4.08Å
446	Y	86.1	Confident	93.2	Very high	150 Å²	150	35.5 Å²	35.5	59%	0.588	18%	0.177	S	C	*	.	H	α-helix	trans	-123.9	3.7	-169.2	-45.8	-60.6	0	0	0	113.6	E442 R448	E442-Y446 HydrophobicContact CB-CD2 4.32Å; E442-Y446 WeakPolarHBondContact O-CA 3.15Å; E442-Y446 WeakPolarHBondContact O-CB 3.47Å; E442-Y446 PolarHBondContact O-N 2.91Å; E442-Y446 VanDerWaalsContact O-N 3.08Å; Y446-R448 PolarHBondContact O-N 3.37Å
447	G	84	Confident	93.6	Very high	50 Å²	50	34 Å²	34	52%	0.515	17%	0.17	S	C	.	.			trans	65.5	18.5	-177	0	0	0	0	0	113.9	A443 F449	A443-G447 VanDerWaalsContact O-CA 3.23Å; A443-G447 WeakPolarHBondContact O-CA 3.46Å; A443-G447 PolarHBondContact O-N 3.41Å; G447-F449 WeakPolarHBondContact O-CD2 3.5Å; G447-F449 PolarHBondContact O-N 2.84Å; G447-F449 VanDerWaalsContact O-N 3.14Å
448	R	88.9	Confident	93.7	Very high	172 Å²	172	33 Å²	33	65%	0.649	17%	0.165	S	C	*	.			trans	-85.5	81.9	-177.5	-67.8	-177.7	-177.5	-174.7	0.9	111.5	E442 Y446	E442-R448 HydrophobicContact CG-CB 4.35Å; E442-R448 PolarHBondContact O-N 3.12Å; Y446-R448 PolarHBondContact O-N 3.37Å
449	F	89.6	Confident	93.8	Very high	26 Å²	26	31.3 Å²	31.3	11%	0.114	16%	0.159	C	C	.	.			trans	-82.8	128.2	173.4	-63.7	-87.7	0	0	0	111.5	I393 R395 E422 F434 T439 A443 G447	I393-F449 WeakPolarHBondContact CD1-O 3.43Å; I393-F449 HydrophobicContact CG2-CB 4.43Å; R395-F449 HydrophobicContact CB-CD1 4Å; R395-F449 HydrophobicContact CB-CE1 4.3Å; R395-F449 HydrophobicContact CG-CB 4.17Å; R395-F449 HydrophobicContact CG-CD1 4Å; R395-F449 HydrophobicContact CG-CG 4.18Å; E422-F449 WeakPolarHBondContact OE1-CE2 3.48Å; F434-F449 HydrophobicContact CE2-CE1 4.37Å; F434-F449 AromaticContact CE2-CZ 3.82Å; F434-F449 HydrophobicContact CE2-CZ 3.82Å; F434-F449 HydrophobicContact CZ-CE1 4.01Å; F434-F449 AromaticContact CZ-CZ 3.63Å; F434-F449 HydrophobicContact CZ-CZ 3.63Å; T439-F449 HydrophobicContact CG2-CE1 4.35Å; A443-F449 HydrophobicContact CB-CD1 3.84Å; A443-F449 HydrophobicContact CB-CE1 3.85Å; A443-F449 HydrophobicContact CB-CG 4.28Å; A443-F449 HydrophobicContact CB-CZ 4.27Å; G447-F449 WeakPolarHBondContact O-CD2 3.5Å; G447-F449 PolarHBondContact O-N 2.84Å; G447-F449 VanDerWaalsContact O-N 3.14Å
450	T	94.3	Very high	94	Very high	51 Å²	51	30.8 Å²	30.8	31%	0.313	16%	0.156	S	C	.	.			trans	-144.1	170.2	176.9	66.9	0	0	0	0	109.8	K452 S453 D454	T450-K452 PolarHBondContact O-N 2.81Å; T450-K452 PolarHBondContact OG1-N 3.06Å; T450-S453 PolarHBondContact N-OG 2.89Å; T450-S453 WeakPolarHBondContact O-CB 3.37Å; T450-S453 PolarHBondContact O-N 2.84Å; T450-S453 PolarHBondContact O-OG 2.94Å; T450-S453 PolarHBondContact OG1-N 3.33Å; T450-D454 PolarHBondContact O-N 3.22Å
451	I	96.4	Very high	94.1	Very high	33 Å²	33	30.7 Å²	30.7	17%	0.169	16%	0.155	C	C	.	.	H	α-helix	trans	-57.6	-30.8	170.4	-166.7	63.9	0	0	0	112.1	M384 I387 E388 S453 D454 V455 F519	M384-I451 HydrophobicContact CE-CD1 3.97Å; I387-I451 HydrophobicContact CG2-CD1 4.28Å; E388-I451 HydrophobicContact CB-CD1 3.97Å; E388-I451 HydrophobicContact CB-CG1 3.85Å; E388-I451 HydrophobicContact CG-CG1 3.92Å; I451-S453 VanDerWaalsContact C-N 3.33Å; I451-S453 PolarHBondContact O-N 2.71Å; I451-D454 HydrophobicContact CD1-CB 4.43Å; I451-D454 WeakPolarHBondContact O-CB 2.86Å; I451-D454 PolarHBondContact O-N 2.93Å; I451-D454 VanDerWaalsContact O-N 3.1Å; I451-V455 WeakPolarHBondContact O-CG2 3.36Å; I451-V455 PolarHBondContact O-N 3.38Å; I451-F519 HydrophobicContact CD1-CD2 3.8Å; I451-F519 HydrophobicContact CD1-CE2 3.72Å; I451-F519 HydrophobicContact CG1-CD2 3.94Å; I451-F519 HydrophobicContact CG1-CE2 4.07Å
452	K	98.4	Very high	94.4	Very high	24 Å²	24	30.2 Å²	30.2	10%	0.104	15%	0.152	C	C	.	.	H	α-helix	trans	-69.5	-28.8	175.2	-61.1	-60.5	-171.7	175	0	112.9	T450 D454 V455 W456 A513 R516 P517	T450-K452 PolarHBondContact O-N 2.81Å; T450-K452 PolarHBondContact OG1-N 3.06Å; K452-D454 VanDerWaalsContact C-N 3.34Å; K452-V455 PolarHBondContact O-N 3.01Å; K452-W456 PolarHBondContact O-N 3.32Å; K452-A513 HydrophobicContact CB-CB 3.91Å; K452-A513 WeakPolarHBondContact CD-O 3.42Å; K452-A513 WeakPolarHBondContact CG-O 3.27Å; K452-R516 HydrophobicContact CD-CB 4.32Å; K452-R516 PolarHBondContact NZ-O 3.25Å; K452-R516 WeakPolarHBondContact O-CD 3.45Å; K452-R516 PolarHBondContact O-NH1 3.1Å; K452-P517 PolarHBondContact NZ-O 2.88Å
453	S	96.9	Very high	94.6	Very high	3 Å²	3	29.1 Å²	29.1	2%	0.021	15%	0.147	C	C	.	.	H	α-helix	trans	-70.8	-30.2	169.5	73.1	0	0	0	0	112.1	T450 I451 W456 S457	T450-S453 PolarHBondContact N-OG 2.89Å; T450-S453 WeakPolarHBondContact O-CB 3.37Å; T450-S453 PolarHBondContact O-N 2.84Å; T450-S453 PolarHBondContact O-OG 2.94Å; T450-S453 PolarHBondContact OG1-N 3.33Å; I451-S453 VanDerWaalsContact C-N 3.33Å; I451-S453 PolarHBondContact O-N 2.71Å; S453-W456 WeakPolarHBondContact O-CB 3.29Å; S453-W456 PolarHBondContact O-N 2.87Å; S453-S457 PolarHBondContact O-N 2.96Å; S453-S457 PolarHBondContact O-OG 3.43Å; S453-S457 VanDerWaalsContact O-OG 3.12Å
454	D	97.9	Very high	94.9	Very high	0 Å²	0	29 Å²	29	0%	0	15%	0.146	C	C	.	.	H	α-helix	trans	-71.9	-33.2	170.8	-70.4	-32.8	0	0	0	112.2	M384 I393 H394 R395 T450 I451 K452 W456 S457 F458 F519	M384-D454 HydrophobicContact CE-CB 3.65Å; I393-D454 WeakPolarHBondContact CG2-OD2 3.27Å; H394-D454 WeakPolarHBondContact CB-OD2 3.3Å; H394-D454 PolarHBondContact N-OD2 3.37Å; R395-D454 WeakPolarHBondContact CA-OD1 3.45Å; R395-D454 PolarHBondContact N-OD1 2.98Å; T450-D454 PolarHBondContact O-N 3.22Å; I451-D454 HydrophobicContact CD1-CB 4.43Å; I451-D454 WeakPolarHBondContact O-CB 2.86Å; I451-D454 PolarHBondContact O-N 2.93Å; I451-D454 VanDerWaalsContact O-N 3.1Å; K452-D454 VanDerWaalsContact C-N 3.34Å; D454-W456 VanDerWaalsContact C-N 3.27Å; D454-W456 PolarHBondContact O-N 3.4Å; D454-S457 CarbonylContact O-C 3.52Å; D454-S457 WeakPolarHBondContact O-CB 3.48Å; D454-S457 PolarHBondContact O-N 3.17Å; D454-S457 VanDerWaalsContact O-N 3.15Å; D454-F458 PolarHBondContact O-N 3.23Å; D454-F519 HydrophobicContact CB-CE2 4Å; D454-F519 HydrophobicContact CB-CZ 4.16Å
455	V	98.8	Very high	95.4	Very high	0 Å²	0	28.3 Å²	28.3	0%	0	14%	0.139	C	C	.	.	H	α-helix	trans	-59.4	-40.1	172.8	171.8	0	0	0	0	111	I451 K452 F458 G459 C508 R516 P517 F519 L522	I451-V455 WeakPolarHBondContact O-CG2 3.36Å; I451-V455 PolarHBondContact O-N 3.38Å; K452-V455 PolarHBondContact O-N 3.01Å; V455-F458 WeakPolarHBondContact O-CB 3.45Å; V455-F458 PolarHBondContact O-N 3.1Å; V455-G459 PolarHBondContact O-N 3.01Å; V455-C508 HydrophobicContact CG1-CB 4.07Å; V455-C508 WeakPolarHBondContact O-CB 3.35Å; V455-R516 HydrophobicContact CB-CB 4.46Å; V455-R516 HydrophobicContact CG1-CB 3.86Å; V455-P517 HydrophobicContact CG1-CG 4.16Å; V455-P517 WeakPolarHBondContact CG2-O 3.31Å; V455-F519 HydrophobicContact CB-CE2 4.47Å; V455-F519 HydrophobicContact CB-CZ 4.49Å; V455-F519 HydrophobicContact CG2-CD2 3.85Å; V455-F519 HydrophobicContact CG2-CE2 3.54Å; V455-F519 HydrophobicContact CG2-CG 4.5Å; V455-F519 HydrophobicContact CG2-CZ 3.94Å; V455-L522 HydrophobicContact CG1-CD1 4.17Å
456	W	98.8	Very high	95.9	Very high	2 Å²	2	26.3 Å²	26.3	1%	0.008	13%	0.13	C	C	.	.	H	α-helix	trans	-59.1	-50.2	172.3	177.8	-74.3	0	0	0	111.6	W438 T439 A440 P441 K452 S453 D454 F458 G459 I460 V485 W509	W438-W456 VanDerWaalsContact O-CD1 3.25Å; T439-W456 PolarHBondContact O-NE1 3.04Å; A440-W456 HydrophobicContact CB-CB 3.7Å; A440-W456 HydrophobicContact CB-CD2 4.06Å; A440-W456 HydrophobicContact CB-CE3 4.48Å; A440-W456 HydrophobicContact CB-CG 3.69Å; P441-W456 HydrophobicContact CG-CH2 4.2Å; P441-W456 HydrophobicContact CG-CZ3 4.12Å; K452-W456 PolarHBondContact O-N 3.32Å; S453-W456 WeakPolarHBondContact O-CB 3.29Å; S453-W456 PolarHBondContact O-N 2.87Å; D454-W456 VanDerWaalsContact C-N 3.27Å; D454-W456 PolarHBondContact O-N 3.4Å; W456-F458 VanDerWaalsContact C-N 3.25Å; W456-F458 PolarHBondContact O-N 2.85Å; W456-G459 WeakPolarHBondContact O-CA 3.43Å; W456-G459 PolarHBondContact O-N 2.49Å; W456-I460 PolarHBondContact O-N 2.95Å; W456-I460 VanDerWaalsContact O-N 3.13Å; W456-V485 HydrophobicContact CH2-CG1 3.48Å; W456-V485 VanDerWaalsContact CH2-CG1 3.48Å; W456-V485 HydrophobicContact CZ2-CG1 3.53Å; W456-W509 HydrophobicContact CD2-CB 4.5Å; W456-W509 AromaticContact CD2-CD1 3.7Å; W456-W509 HydrophobicContact CD2-CG 4.43Å; W456-W509 AromaticContact CE2-CD1 3.83Å; W456-W509 HydrophobicContact CE3-CB 4.05Å; W456-W509 HydrophobicContact CE3-CG 4.44Å; W456-W509 AromaticContact CG-CD1 3.98Å; W456-W509 HydrophobicContact CH2-CB 4.01Å; W456-W509 HydrophobicContact CH2-CG 4.49Å; W456-W509 HydrophobicContact CZ2-CB 4.47Å; W456-W509 HydrophobicContact CZ2-CG 4.49Å; W456-W509 HydrophobicContact CZ3-CB 3.8Å; W456-W509 HydrophobicContact CZ3-CG 4.49Å; W456-W509 WeakPolarHBondContact CZ3-O 3.17Å; W456-W509 PolarHBondContact O-NE1 2.75Å
457	S	98.6	Very high	96.4	Very high	5 Å²	5	20.6 Å²	20.6	4%	0.035	11%	0.111	C	C	.	.	H	α-helix	trans	-58.3	-38.2	178	-54.5	0	0	0	0	111.7	L397 W438 S453 D454 I460 L461	L397-S457 WeakPolarHBondContact O-CB 3.34Å; W438-S457 WeakPolarHBondContact O-CA 3.48Å; W438-S457 PolarHBondContact O-OG 3.14Å; S453-S457 PolarHBondContact O-N 2.96Å; S453-S457 PolarHBondContact O-OG 3.43Å; S453-S457 VanDerWaalsContact O-OG 3.12Å; D454-S457 CarbonylContact O-C 3.52Å; D454-S457 WeakPolarHBondContact O-CB 3.48Å; D454-S457 PolarHBondContact O-N 3.17Å; D454-S457 VanDerWaalsContact O-N 3.15Å; S457-I460 WeakPolarHBondContact O-CB 2.75Å; S457-I460 PolarHBondContact O-N 3.26Å; S457-I460 VanDerWaalsContact O-N 3.16Å; S457-L461 PolarHBondContact O-N 3.47Å
458	F	98.9	Very high	97	Very high	0 Å²	0	20.8 Å²	20.8	0%	0	10%	0.098	C	C	.	.	H	α-helix	trans	-62.6	-42.1	173.3	-176.5	-101	0	0	0	112.2	A377 V380 A381 L397 D454 V455 W456 I460 L461 L462 F519 L522 L526	A377-F458 HydrophobicContact CB-CZ 4.44Å; V380-F458 HydrophobicContact CB-CE2 4.16Å; V380-F458 HydrophobicContact CG1-CD2 4.08Å; V380-F458 HydrophobicContact CG1-CE2 3.92Å; A381-F458 HydrophobicContact CB-CE2 4.11Å; A381-F458 HydrophobicContact CB-CZ 3.83Å; L397-F458 HydrophobicContact CD2-CB 3.86Å; L397-F458 HydrophobicContact CD2-CD2 4.24Å; D454-F458 PolarHBondContact O-N 3.23Å; V455-F458 WeakPolarHBondContact O-CB 3.45Å; V455-F458 PolarHBondContact O-N 3.1Å; W456-F458 VanDerWaalsContact C-N 3.25Å; W456-F458 PolarHBondContact O-N 2.85Å; F458-I460 VanDerWaalsContact C-N 3.26Å; F458-I460 PolarHBondContact O-N 3.33Å; F458-L461 HydrophobicContact CE2-CD2 4.46Å; F458-L461 WeakPolarHBondContact O-CB 3.35Å; F458-L461 PolarHBondContact O-N 2.86Å; F458-L461 VanDerWaalsContact O-N 3.1Å; F458-L462 HydrophobicContact CD1-CD1 4.19Å; F458-L462 HydrophobicContact CD1-CG 4.21Å; F458-L462 HydrophobicContact CE1-CD1 3.86Å; F458-L462 HydrophobicContact CE1-CD2 3.89Å; F458-L462 HydrophobicContact CE1-CG 3.89Å; F458-L462 HydrophobicContact CZ-CD2 3.85Å; F458-L462 HydrophobicContact CZ-CG 4.29Å; F458-L462 WeakPolarHBondContact O-CG 3.48Å; F458-L462 PolarHBondContact O-N 3.05Å; F458-F519 HydrophobicContact CB-CE1 3.68Å; F458-F519 HydrophobicContact CB-CZ 3.95Å; F458-F519 HydrophobicContact CD1-CE1 4.29Å; F458-F519 AromaticContact CD2-CE1 3.94Å; F458-F519 HydrophobicContact CD2-CE1 3.94Å; F458-F519 AromaticContact CG-CE1 3.71Å; F458-F519 HydrophobicContact CG-CE1 3.71Å; F458-F519 HydrophobicContact CG-CZ 4.47Å; F458-L522 HydrophobicContact CD1-CD1 3.73Å; F458-L522 HydrophobicContact CE1-CB 4.32Å; F458-L522 HydrophobicContact CE1-CD1 4.04Å; F458-L522 HydrophobicContact CE1-CD2 4.39Å; F458-L522 HydrophobicContact CE1-CG 4.49Å; F458-L526 HydrophobicContact CE1-CD1 3.96Å; F458-L526 HydrophobicContact CZ-CD1 3.61Å
459	G	98.8	Very high	97.3	Very high	0 Å²	0	12.7 Å²	12.7	0%	0	7%	0.067	C	C	.	.	H	α-helix	trans	-56.5	-40.7	172.2	0	0	0	0	0	112.4	V455 W456 L462 T463 W509	V455-G459 PolarHBondContact O-N 3.01Å; W456-G459 WeakPolarHBondContact O-CA 3.43Å; W456-G459 PolarHBondContact O-N 2.49Å; G459-L462 PolarHBondContact O-N 2.87Å; G459-T463 PolarHBondContact O-N 3.3Å; G459-W509 VanDerWaalsContact C-CZ2 3.47Å; G459-W509 VanDerWaalsContact O-CZ2 3.26Å; G459-W509 WeakPolarHBondContact O-CZ2 3.33Å
460	I	98.8	Very high	97.5	Very high	0 Å²	0	20 Å²	20	0%	0	9%	0.094	C	C	.	.	H	α-helix	trans	-66.6	-43	174.1	-56	-67.4	0	0	0	111	W438 W456 S457 F458 L462 T463 E464 P472 Y473 M491 W509	W438-I460 HydrophobicContact CD2-CG2 4.36Å; W438-I460 HydrophobicContact CG-CB 4.45Å; W438-I460 HydrophobicContact CG-CG2 3.9Å; W456-I460 PolarHBondContact O-N 2.95Å; W456-I460 VanDerWaalsContact O-N 3.13Å; S457-I460 WeakPolarHBondContact O-CB 2.75Å; S457-I460 PolarHBondContact O-N 3.26Å; S457-I460 VanDerWaalsContact O-N 3.16Å; F458-I460 VanDerWaalsContact C-N 3.26Å; F458-I460 PolarHBondContact O-N 3.33Å; I460-L462 VanDerWaalsContact C-N 3.29Å; I460-L462 PolarHBondContact O-N 3.42Å; I460-T463 WeakPolarHBondContact O-CA 3.44Å; I460-T463 WeakPolarHBondContact O-CB 3.22Å; I460-T463 PolarHBondContact O-N 3.47Å; I460-T463 PolarHBondContact O-OG1 2.76Å; I460-E464 PolarHBondContact O-N 2.89Å; I460-E464 VanDerWaalsContact O-N 3.16Å; I460-P472 HydrophobicContact CG2-CB 3.85Å; I460-P472 HydrophobicContact CG2-CG 3.43Å; I460-P472 VanDerWaalsContact CG2-CG 3.43Å; I460-Y473 HydrophobicContact CD1-CE2 3.83Å; I460-M491 HydrophobicContact CD1-CE 3.57Å; I460-W509 HydrophobicContact CD1-CZ2 3.68Å; I460-W509 HydrophobicContact CG1-CZ2 4.44Å
461	L	98.7	Very high	97.6	Very high	0 Å²	0	21.5 Å²	21.5	0%	0	10%	0.103	C	C	.	.	H	α-helix	trans	-57.9	-38.8	175.6	-178.6	156.8	0	0	0	112.4	V380 L397 I402 S457 F458 T463 E464 L465	V380-L461 HydrophobicContact CG1-CD1 4.11Å; L397-L461 HydrophobicContact CD1-CD1 4.27Å; L397-L461 HydrophobicContact CG-CD1 4.22Å; I402-L461 HydrophobicContact CD1-CD1 4.24Å; I402-L461 HydrophobicContact CG1-CD1 3.82Å; S457-L461 PolarHBondContact O-N 3.47Å; F458-L461 HydrophobicContact CE2-CD2 4.46Å; F458-L461 WeakPolarHBondContact O-CB 3.35Å; F458-L461 PolarHBondContact O-N 2.86Å; F458-L461 VanDerWaalsContact O-N 3.1Å; L461-T463 PolarHBondContact O-N 3.4Å; L461-E464 WeakPolarHBondContact O-CB 3.47Å; L461-E464 PolarHBondContact O-N 3.1Å; L461-E464 VanDerWaalsContact O-N 3.09Å; L461-L465 HydrophobicContact CD2-CD1 3.63Å; L461-L465 HydrophobicContact CD2-CG 4.24Å; L461-L465 PolarHBondContact O-N 3.48Å
462	L	98.7	Very high	97.6	Very high	3 Å²	3	20 Å²	20	2%	0.016	10%	0.096	C	C	.	.	H	α-helix	trans	-59	-38	173.7	-66.5	178.8	0	0	0	111.5	A377 F458 G459 I460 E464 L465 V466 L501 L504 M505	A377-L462 HydrophobicContact CB-CD2 3.53Å; F458-L462 HydrophobicContact CD1-CD1 4.19Å; F458-L462 HydrophobicContact CD1-CG 4.21Å; F458-L462 HydrophobicContact CE1-CD1 3.86Å; F458-L462 HydrophobicContact CE1-CD2 3.89Å; F458-L462 HydrophobicContact CE1-CG 3.89Å; F458-L462 HydrophobicContact CZ-CD2 3.85Å; F458-L462 HydrophobicContact CZ-CG 4.29Å; F458-L462 WeakPolarHBondContact O-CG 3.48Å; F458-L462 PolarHBondContact O-N 3.05Å; G459-L462 PolarHBondContact O-N 2.87Å; I460-L462 VanDerWaalsContact C-N 3.29Å; I460-L462 PolarHBondContact O-N 3.42Å; L462-E464 VanDerWaalsContact C-N 3.35Å; L462-L465 HydrophobicContact CD2-CD1 4.43Å; L462-L465 PolarHBondContact O-N 3.3Å; L462-V466 WeakPolarHBondContact O-CG2 3.41Å; L462-V466 PolarHBondContact O-N 3.12Å; L462-V466 VanDerWaalsContact O-N 3.14Å; L462-L501 HydrophobicContact CD1-CD1 4.43Å; L462-L504 HydrophobicContact CD1-CD2 4.07Å; L462-M505 HydrophobicContact CB-CE 3.61Å; L462-M505 HydrophobicContact CB-CG 3.93Å; L462-M505 HydrophobicContact CB-SD 4.48Å; L462-M505 HydrophobicContact CD1-CG 3.98Å
463	T	98.2	Very high	97.6	Very high	5 Å²	5	19 Å²	19	3%	0.031	9%	0.091	C	C	.	.	H	α-helix	trans	-65	-40.1	174.8	71.3	0	0	0	0	111.8	G459 I460 L461 L465 V466 T467 M491 M505 W509	G459-T463 PolarHBondContact O-N 3.3Å; I460-T463 WeakPolarHBondContact O-CA 3.44Å; I460-T463 WeakPolarHBondContact O-CB 3.22Å; I460-T463 PolarHBondContact O-N 3.47Å; I460-T463 PolarHBondContact O-OG1 2.76Å; L461-T463 PolarHBondContact O-N 3.4Å; T463-L465 VanDerWaalsContact C-N 3.33Å; T463-L465 PolarHBondContact O-N 3.17Å; T463-V466 PolarHBondContact O-N 3.17Å; T463-T467 VanDerWaalsContact O-CB 3.28Å; T463-T467 WeakPolarHBondContact O-CB 3.37Å; T463-T467 VanDerWaalsContact O-CG2 3.27Å; T463-T467 WeakPolarHBondContact O-CG2 3.39Å; T463-T467 PolarHBondContact O-N 2.72Å; T463-T467 PolarHBondContact O-OG1 3.13Å; T463-M491 HydrophobicContact CG2-CE 3.8Å; T463-M505 HydrophobicContact CG2-CE 4.34Å; T463-M505 HydrophobicContact CG2-SD 3.72Å; T463-W509 HydrophobicContact CG2-CH2 3.42Å; T463-W509 VanDerWaalsContact CG2-CH2 3.42Å; T463-W509 HydrophobicContact CG2-CZ2 3.6Å
464	E	98.2	Very high	97.5	Very high	2 Å²	2	24 Å²	24	1%	0.009	12%	0.123	C	C	.	.	H	α-helix	trans	-61.2	-43.7	176.5	-60	-177.7	91.7	0	0	110.7	S399 W438 I460 L461 L462 T467 K468 G469 P472	S399-E464 PolarHBondContact N-OE2 3.13Å; S399-E464 PolarHBondContact OG-OE1 3.37Å; S399-E464 PolarHBondContact OG-OE2 3.29Å; W438-E464 WeakPolarHBondContact CZ2-OE1 3.35Å; W438-E464 PolarHBondContact NE1-OE2 3.46Å; I460-E464 PolarHBondContact O-N 2.89Å; I460-E464 VanDerWaalsContact O-N 3.16Å; L461-E464 WeakPolarHBondContact O-CB 3.47Å; L461-E464 PolarHBondContact O-N 3.1Å; L461-E464 VanDerWaalsContact O-N 3.09Å; L462-E464 VanDerWaalsContact C-N 3.35Å; E464-T467 PolarHBondContact O-N 2.96Å; E464-K468 PolarHBondContact O-N 3.42Å; E464-G469 PolarHBondContact O-N 3.22Å; E464-P472 HydrophobicContact CG-CG 4.3Å
465	L	97.9	Very high	97.4	Very high	3 Å²	3	28 Å²	28	2%	0.016	17%	0.165	C	C	.	.	H	α-helix	trans	-58.1	-54.7	177	-82.5	166.3	0	0	0	112.3	L356 L360 L373 M376 A377 L461 L462 T463 T467 K468	L356-L465 HydrophobicContact CD1-CD2 4.26Å; L356-L465 HydrophobicContact CD2-CD2 3.98Å; L356-L465 HydrophobicContact CD2-CG 4.44Å; L360-L465 HydrophobicContact CD1-CD2 4.11Å; L360-L465 HydrophobicContact CD2-CD2 4.49Å; L373-L465 WeakPolarHBondContact CD1-O 3.39Å; L373-L465 HydrophobicContact CD2-CD2 4.02Å; M376-L465 HydrophobicContact CB-CD2 4.2Å; A377-L465 HydrophobicContact CB-CD1 3.69Å; L461-L465 HydrophobicContact CD2-CD1 3.63Å; L461-L465 HydrophobicContact CD2-CG 4.24Å; L461-L465 PolarHBondContact O-N 3.48Å; L462-L465 HydrophobicContact CD2-CD1 4.43Å; L462-L465 PolarHBondContact O-N 3.3Å; T463-L465 VanDerWaalsContact C-N 3.33Å; T463-L465 PolarHBondContact O-N 3.17Å; L465-T467 VanDerWaalsContact C-N 3.28Å; L465-T467 PolarHBondContact O-N 3.24Å; L465-K468 PolarHBondContact O-N 2.6Å
466	V	97.1	Very high	97.2	Very high	24 Å²	24	30.3 Å²	30.3	15%	0.145	18%	0.176	C	C	.	.	H	α-helix	trans	-71.9	-23.7	-175.6	-57.5	0	0	0	0	112.8	L370 L462 T463 P494 C497 L501 M505	L370-V466 HydrophobicContact CD1-CG1 4.49Å; L462-V466 WeakPolarHBondContact O-CG2 3.41Å; L462-V466 PolarHBondContact O-N 3.12Å; L462-V466 VanDerWaalsContact O-N 3.14Å; T463-V466 PolarHBondContact O-N 3.17Å; V466-P494 HydrophobicContact CG2-CB 4.03Å; V466-P494 HydrophobicContact CG2-CG 3.81Å; V466-C497 HydrophobicContact CG2-CB 4.4Å; V466-L501 HydrophobicContact CG1-CD2 3.68Å; V466-M505 HydrophobicContact CG1-CE 4.33Å; V466-M505 HydrophobicContact CG2-CE 3.99Å
467	T	96.5	Very high	96.9	Very high	30 Å²	30	34.2 Å²	34.2	18%	0.184	20%	0.197	C	C	.	.	T	Hydrogen-bonded Turn	trans	-97.1	6.5	177.9	64.4	0	0	0	0	114.2	T463 E464 L465 R470 P494	T463-T467 VanDerWaalsContact O-CB 3.28Å; T463-T467 WeakPolarHBondContact O-CB 3.37Å; T463-T467 VanDerWaalsContact O-CG2 3.27Å; T463-T467 WeakPolarHBondContact O-CG2 3.39Å; T463-T467 PolarHBondContact O-N 2.72Å; T463-T467 PolarHBondContact O-OG1 3.13Å; E464-T467 PolarHBondContact O-N 2.96Å; L465-T467 VanDerWaalsContact C-N 3.28Å; L465-T467 PolarHBondContact O-N 3.24Å; T467-R470 WeakPolarHBondContact O-CG 3.25Å; T467-P494 HydrophobicContact CG2-CB 3.79Å; T467-P494 HydrophobicContact CG2-CG 4.04Å
468	K	96.1	Very high	96.5	Very high	54 Å²	54	37.8 Å²	37.8	24%	0.235	22%	0.216	C	C	.	.	T	Hydrogen-bonded Turn	trans	60.9	45.9	-179.9	-50.3	-57.8	-170	171.3	0	113.3	L360 G365 L368 E464 L465	L360-K468 HydrophobicContact CD2-CD 4.43Å; G365-K468 PolarHBondContact O-NZ 3.09Å; L368-K468 PolarHBondContact O-NZ 2.81Å; E464-K468 PolarHBondContact O-N 3.42Å; L465-K468 PolarHBondContact O-N 2.6Å
469	G	95.4	Very high	96.1	Very high	1 Å²	1	46.5 Å²	46.5	1%	0.01	25%	0.249	C	C	.	.	S	Bend	trans	77.7	16.6	175.9	0	0	0	0	0	114.4	K361 E464 V471	K361-G469 WeakPolarHBondContact CE-O 3.2Å; K361-G469 PolarHBondContact NZ-O 3.06Å; E464-G469 PolarHBondContact O-N 3.22Å; G469-V471 PolarHBondContact O-N 3.49Å
470	R	95.3	Very high	96	Very high	181 Å²	181	50.4 Å²	50.4	68%	0.683	27%	0.267	S	S	*	.	P	Polyproline II helix	trans	-59.1	144	173.8	-73.3	179.3	-172.9	-179.9	1.2	109.9	T467	T467-R470 WeakPolarHBondContact O-CG 3.25Å
471	V	95.1	Very high	95.8	Very high	81 Å²	81	50.6 Å²	50.6	49%	0.491	27%	0.268	S	S	.	.	P	Polyproline II helix	trans	-62.9	130.5	177.6	179.9	0	0	0	0	108.7	K437 G469	K437-V471 HydrophobicContact CD-CG1 4.14Å; G469-V471 PolarHBondContact O-N 3.49Å
472	P	97.3	Very high	95.4	Very high	3 Å²	3	52.5 Å²	52.5	2%	0.019	28%	0.278	C	S	.	.	S	Bend	trans	-57.6	153.8	176.6	-25.7	34.5	0	0	0	112.3	K437 W438 I460 E464 M491	K437-P472 HydrophobicContact CB-CB 4.3Å; K437-P472 VanDerWaalsContact CD-O 3.3Å; K437-P472 WeakPolarHBondContact CD-O 3.47Å; K437-P472 PolarHBondContact NZ-O 3.23Å; W438-P472 HydrophobicContact CD2-CG 4.46Å; W438-P472 HydrophobicContact CH2-CG 4.16Å; W438-P472 VanDerWaalsContact CZ2-CD 3.46Å; W438-P472 HydrophobicContact CZ2-CG 3.63Å; I460-P472 HydrophobicContact CG2-CB 3.85Å; I460-P472 HydrophobicContact CG2-CG 3.43Å; I460-P472 VanDerWaalsContact CG2-CG 3.43Å; E464-P472 HydrophobicContact CG-CG 4.3Å; P472-M491 HydrophobicContact CB-CE 4.19Å; P472-M491 HydrophobicContact CB-SD 4.28Å
473	Y	97.2	Very high	95.2	Very high	2 Å²	2	55.5 Å²	55.5	1%	0.008	29%	0.292	C	S	.	.	S	Bend	trans	49.4	64.4	-179.4	-53.4	-86.1	0	0	0	112	K437 I460 G475 M476 V481 V485 Y489 M491	K437-Y473 HydrophobicContact CB-CD2 4.17Å; K437-Y473 HydrophobicContact CG-CD2 4.42Å; K437-Y473 PolarHBondContact NZ-O 3.09Å; K437-Y473 WeakPolarHBondContact O-CE2 3.35Å; I460-Y473 HydrophobicContact CD1-CE2 3.83Å; Y473-G475 PolarHBondContact O-N 3.34Å; Y473-M476 HydrophobicContact CD1-SD 4.34Å; Y473-M476 PolarHBondContact O-N 2.9Å; Y473-V481 VanDerWaalsContact CB-CG2 3.47Å; Y473-V481 HydrophobicContact CD1-CG1 4.27Å; Y473-V481 HydrophobicContact CD1-CG2 4.31Å; Y473-V481 HydrophobicContact CD2-CG1 3.71Å; Y473-V481 HydrophobicContact CD2-CG2 4.01Å; Y473-V481 HydrophobicContact CE1-CG1 4.38Å; Y473-V481 HydrophobicContact CE2-CG1 3.83Å; Y473-V481 HydrophobicContact CG-CB 4.49Å; Y473-V481 HydrophobicContact CG-CG1 3.95Å; Y473-V481 HydrophobicContact CG-CG2 3.69Å; Y473-V485 HydrophobicContact CE1-CG2 3.91Å; Y473-Y489 HydrophobicContact CD1-CD1 4.27Å; Y473-Y489 AromaticContact CD1-CE1 3.75Å; Y473-Y489 HydrophobicContact CD1-CE1 3.75Å; Y473-Y489 HydrophobicContact CE1-CD1 4.1Å; Y473-Y489 AromaticContact CE1-CE1 3.87Å; Y473-Y489 HydrophobicContact CE1-CE1 3.87Å; Y473-M491 HydrophobicContact CD1-CG 3.68Å; Y473-M491 HydrophobicContact CD1-SD 4.16Å; Y473-M491 HydrophobicContact CD2-CE 4.35Å; Y473-M491 HydrophobicContact CD2-SD 4.28Å; Y473-M491 HydrophobicContact CE1-CE 4.32Å; Y473-M491 HydrophobicContact CE1-CG 3.63Å; Y473-M491 HydrophobicContact CE1-SD 4.28Å; Y473-M491 HydrophobicContact CE2-CE 3.95Å; Y473-M491 HydrophobicContact CE2-SD 4.41Å; Y473-M491 HydrophobicContact CG-CG 4.26Å; Y473-M491 HydrophobicContact CG-SD 4.14Å; Y473-M491 PolarHBondContact N-SD 2.86Å
474	P	95.3	Very high	95.2	Very high	108 Å²	108	58.6 Å²	58.6	70%	0.701	31%	0.306	S	S	*	.	T	Hydrogen-bonded Turn	trans	-59.7	134.8	-176.6	25.9	-34.5	0	0	0	110.5	M476	P474-M476 VanDerWaalsContact C-N 3.31Å; P474-M476 PolarHBondContact O-N 3.28Å
475	G	95.1	Very high	95.1	Very high	85 Å²	85	58.9 Å²	58.9	88%	0.876	31%	0.308	S	S	*	.	T	Hydrogen-bonded Turn	trans	82.6	-4.8	-178.9	0	0	0	0	0	115.7	Y473	Y473-G475 PolarHBondContact O-N 3.34Å
476	M	95.7	Very high	94.8	Very high	48 Å²	48	63.6 Å²	63.6	24%	0.236	33%	0.33	C	S	.	.			trans	-106	137.9	176.9	-59.4	178	-176.9	0	0	111.6	K437 Y473 P474 E480 V481 Y489	K437-M476 VanDerWaalsContact CE-O 3.27Å; K437-M476 WeakPolarHBondContact CE-O 3.38Å; K437-M476 PolarHBondContact NZ-O 3.39Å; Y473-M476 HydrophobicContact CD1-SD 4.34Å; Y473-M476 PolarHBondContact O-N 2.9Å; P474-M476 VanDerWaalsContact C-N 3.31Å; P474-M476 PolarHBondContact O-N 3.28Å; M476-E480 WeakPolarHBondContact CA-OE2 3.37Å; M476-E480 HydrophobicContact CB-CB 4.23Å; M476-V481 HydrophobicContact CB-CG2 3.63Å; M476-V481 HydrophobicContact SD-CG2 4.37Å; M476-Y489 HydrophobicContact CE-CE1 4.06Å; M476-Y489 HydrophobicContact CE-CE2 4.41Å; M476-Y489 HydrophobicContact SD-CE1 4.43Å
477	N	93.1	Very high	94.8	Very high	83 Å²	83	71.3 Å²	71.3	44%	0.444	36%	0.357	S	S	.	.			trans	-81.2	171	169.2	73.3	52.8	0	0	0	111.5	R479 E480 V481	N477-R479 VanDerWaalsContact C-N 3.32Å; N477-R479 PolarHBondContact O-N 2.85Å; N477-R479 WeakPolarHBondContact OD1-CB 2.92Å; N477-R479 PolarHBondContact OD1-N 2.8Å; N477-E480 VanDerWaalsContact CG-OE2 3.28Å; N477-E480 PolarHBondContact N-OE2 2.91Å; N477-E480 PolarHBondContact ND2-OE1 2.86Å; N477-E480 PolarHBondContact ND2-OE2 2.78Å; N477-E480 VanDerWaalsContact ND2-OE2 3.09Å; N477-E480 PolarHBondContact O-N 3.3Å; N477-E480 PolarHBondContact OD1-N 3.33Å; N477-V481 WeakPolarHBondContact O-CG2 3.27Å; N477-V481 PolarHBondContact O-N 2.96Å
478	N	90.4	Very high	94.7	Very high	80 Å²	80	72.1 Å²	72.1	43%	0.428	37%	0.371	S	S	.	.	H	α-helix	trans	-59.7	-38.4	-174.5	-73.4	-1.7	0	0	0	113.7	I436 L482	I436-N478 HydrophobicContact CB-CB 4.01Å; I436-N478 HydrophobicContact CG1-CB 4.19Å; I436-N478 HydrophobicContact CG2-CB 4Å; I436-N478 WeakPolarHBondContact CG2-O 3.47Å; N478-L482 PolarHBondContact O-N 3.27Å
479	R	90.3	Very high	94.8	Very high	183 Å²	183	73.2 Å²	73.2	69%	0.691	38%	0.375	S	S	*	.	H	α-helix	trans	-68.4	-46.2	179.4	177.8	-178.3	169.5	171.2	-0.3	110.8	N477 V481 L482 E483	N477-R479 VanDerWaalsContact C-N 3.32Å; N477-R479 PolarHBondContact O-N 2.85Å; N477-R479 WeakPolarHBondContact OD1-CB 2.92Å; N477-R479 PolarHBondContact OD1-N 2.8Å; R479-V481 VanDerWaalsContact C-N 3.31Å; R479-V481 PolarHBondContact O-N 3.5Å; R479-L482 PolarHBondContact O-N 2.91Å; R479-E483 IonicContact CZ-OE1 3.54Å; R479-E483 IonicContact NE-OE1 2.82Å; R479-E483 PolarHBondContact NE-OE1 2.92Å; R479-E483 IonicContact NH2-OE1 3.33Å; R479-E483 PolarHBondContact NH2-OE1 3.09Å; R479-E483 WeakPolarHBondContact O-CG 3.26Å; R479-E483 PolarHBondContact O-N 3.45Å; R479-E483 VanDerWaalsContact O-N 3.08Å
480	E	94.9	Very high	95	Very high	82 Å²	82	75.4 Å²	75.4	38%	0.383	38%	0.382	S	S	.	.	H	α-helix	trans	-60.2	-42	177.7	-70.6	166.9	160.1	0	0	111.7	M476 N477 L482 E483 Q484	M476-E480 WeakPolarHBondContact CA-OE2 3.37Å; M476-E480 HydrophobicContact CB-CB 4.23Å; N477-E480 VanDerWaalsContact CG-OE2 3.28Å; N477-E480 PolarHBondContact N-OE2 2.91Å; N477-E480 PolarHBondContact ND2-OE1 2.86Å; N477-E480 PolarHBondContact ND2-OE2 2.78Å; N477-E480 VanDerWaalsContact ND2-OE2 3.09Å; N477-E480 PolarHBondContact O-N 3.3Å; N477-E480 PolarHBondContact OD1-N 3.33Å; E480-L482 PolarHBondContact O-N 3.14Å; E480-E483 PolarHBondContact O-N 3.43Å; E480-Q484 WeakPolarHBondContact O-CB 3.49Å; E480-Q484 WeakPolarHBondContact O-CG 3.33Å; E480-Q484 PolarHBondContact O-N 2.76Å
481	V	95	Very high	95.1	Very high	4 Å²	4	67.6 Å²	67.6	2%	0.024	35%	0.354	C	S	.	.	H	α-helix	trans	-58.6	-48.6	176.9	170.9	0	0	0	0	110.9	K437 Y473 M476 N477 R479 E483 Q484 V485	K437-V481 HydrophobicContact CG-CG2 4.25Å; Y473-V481 VanDerWaalsContact CB-CG2 3.47Å; Y473-V481 HydrophobicContact CD1-CG1 4.27Å; Y473-V481 HydrophobicContact CD1-CG2 4.31Å; Y473-V481 HydrophobicContact CD2-CG1 3.71Å; Y473-V481 HydrophobicContact CD2-CG2 4.01Å; Y473-V481 HydrophobicContact CE1-CG1 4.38Å; Y473-V481 HydrophobicContact CE2-CG1 3.83Å; Y473-V481 HydrophobicContact CG-CB 4.49Å; Y473-V481 HydrophobicContact CG-CG1 3.95Å; Y473-V481 HydrophobicContact CG-CG2 3.69Å; M476-V481 HydrophobicContact CB-CG2 3.63Å; M476-V481 HydrophobicContact SD-CG2 4.37Å; N477-V481 WeakPolarHBondContact O-CG2 3.27Å; N477-V481 PolarHBondContact O-N 2.96Å; R479-V481 VanDerWaalsContact C-N 3.31Å; R479-V481 PolarHBondContact O-N 3.5Å; V481-E483 PolarHBondContact O-N 3.41Å; V481-Q484 PolarHBondContact O-N 3.03Å; V481-V485 HydrophobicContact CG1-CG2 4.09Å; V481-V485 VanDerWaalsContact O-CB 3.25Å; V481-V485 WeakPolarHBondContact O-CB 3.4Å; V481-V485 WeakPolarHBondContact O-CG2 3.46Å; V481-V485 PolarHBondContact O-N 3.08Å
482	L	91.8	Very high	95.2	Very high	41 Å²	41	68.1 Å²	68.1	22%	0.215	36%	0.359	C	S	.	.	H	α-helix	trans	-60.4	-48.4	-179.3	-172	60.5	0	0	0	111.5	A444 L445 N478 R479 E480 Q484 E486	A444-L482 HydrophobicContact CB-CD1 3.83Å; L445-L482 HydrophobicContact CD2-CD1 4.07Å; L445-L482 HydrophobicContact CD2-CD2 3.79Å; L445-L482 HydrophobicContact CD2-CG 4.04Å; L445-L482 HydrophobicContact CG-CD1 4.08Å; N478-L482 PolarHBondContact O-N 3.27Å; R479-L482 PolarHBondContact O-N 2.91Å; E480-L482 PolarHBondContact O-N 3.14Å; L482-Q484 PolarHBondContact O-N 2.74Å; L482-E486 WeakPolarHBondContact O-CB 3.49Å; L482-E486 PolarHBondContact O-N 3.31Å; L482-E486 VanDerWaalsContact O-N 3.09Å
483	E	93.5	Very high	95.2	Very high	66 Å²	66	70.5 Å²	70.5	31%	0.308	38%	0.375	S	S	.	.	H	α-helix	trans	-62.1	-42	178.9	-69.8	177.7	-171.4	0	0	112.3	R479 E480 V481 R487	R479-E483 IonicContact CZ-OE1 3.54Å; R479-E483 IonicContact NE-OE1 2.82Å; R479-E483 PolarHBondContact NE-OE1 2.92Å; R479-E483 IonicContact NH2-OE1 3.33Å; R479-E483 PolarHBondContact NH2-OE1 3.09Å; R479-E483 WeakPolarHBondContact O-CG 3.26Å; R479-E483 PolarHBondContact O-N 3.45Å; R479-E483 VanDerWaalsContact O-N 3.08Å; E480-E483 PolarHBondContact O-N 3.43Å; V481-E483 PolarHBondContact O-N 3.41Å; E483-R487 VanDerWaalsContact O-CG 3.31Å; E483-R487 WeakPolarHBondContact O-CG 3.5Å; E483-R487 PolarHBondContact O-N 3.24Å
484	Q	97.4	Very high	95.1	Very high	69 Å²	69	71.6 Å²	71.6	32%	0.322	38%	0.383	S	S	.	.	H	α-helix	trans	-72.6	-42.6	-178.9	-68.4	-68.2	-9.1	0	0	112.1	E480 V481 L482 E486 R487 G488 Y489	E480-Q484 WeakPolarHBondContact O-CB 3.49Å; E480-Q484 WeakPolarHBondContact O-CG 3.33Å; E480-Q484 PolarHBondContact O-N 2.76Å; V481-Q484 PolarHBondContact O-N 3.03Å; L482-Q484 PolarHBondContact O-N 2.74Å; Q484-E486 VanDerWaalsContact C-N 3.29Å; Q484-E486 PolarHBondContact O-N 2.75Å; Q484-R487 CarbonylContact O-C 3.6Å; Q484-R487 WeakPolarHBondContact O-CB 3.05Å; Q484-R487 PolarHBondContact O-N 2.88Å; Q484-R487 VanDerWaalsContact O-N 3.13Å; Q484-G488 PolarHBondContact O-N 2.9Å; Q484-Y489 HydrophobicContact CB-CD1 4.4Å; Q484-Y489 HydrophobicContact CB-CG 4.31Å; Q484-Y489 WeakPolarHBondContact O-CB 3.38Å; Q484-Y489 PolarHBondContact O-N 3.45Å
485	V	96.6	Very high	94.9	Very high	8 Å²	8	74.1 Å²	74.1	5%	0.048	39%	0.385	C	S	.	.	H	α-helix	trans	-61.5	-40.2	177.9	165.8	0	0	0	0	111	P441 W456 Y473 V481 R487 G488 R490	P441-V485 HydrophobicContact CB-CG1 4.34Å; P441-V485 HydrophobicContact CG-CG1 4.37Å; W456-V485 HydrophobicContact CH2-CG1 3.48Å; W456-V485 VanDerWaalsContact CH2-CG1 3.48Å; W456-V485 HydrophobicContact CZ2-CG1 3.53Å; Y473-V485 HydrophobicContact CE1-CG2 3.91Å; V481-V485 HydrophobicContact CG1-CG2 4.09Å; V481-V485 VanDerWaalsContact O-CB 3.25Å; V481-V485 WeakPolarHBondContact O-CB 3.4Å; V481-V485 WeakPolarHBondContact O-CG2 3.46Å; V481-V485 PolarHBondContact O-N 3.08Å; V485-R487 VanDerWaalsContact C-N 3.32Å; V485-R487 PolarHBondContact O-N 3.01Å; V485-G488 PolarHBondContact O-N 3.42Å; V485-R490 PolarHBondContact O-NH1 3.46Å
486	E	92	Very high	94.5	Very high	102 Å²	102	77.1 Å²	77.1	48%	0.477	38%	0.381	S	S	.	.	H	α-helix	trans	-63.1	-37.6	174.9	-173.1	176.3	-166.5	0	0	112.1	L482 Q484 G488	L482-E486 WeakPolarHBondContact O-CB 3.49Å; L482-E486 PolarHBondContact O-N 3.31Å; L482-E486 VanDerWaalsContact O-N 3.09Å; Q484-E486 VanDerWaalsContact C-N 3.29Å; Q484-E486 PolarHBondContact O-N 2.75Å; E486-G488 PolarHBondContact O-N 3.39Å
487	R	96.1	Very high	94.5	Very high	186 Å²	186	75.4 Å²	75.4	70%	0.702	37%	0.374	S	S	*	.	T	Hydrogen-bonded Turn	trans	-71.7	-2.4	173	-70.6	173.8	-177.8	171.6	4.3	114.3	E483 Q484 V485	E483-R487 VanDerWaalsContact O-CG 3.31Å; E483-R487 WeakPolarHBondContact O-CG 3.5Å; E483-R487 PolarHBondContact O-N 3.24Å; Q484-R487 CarbonylContact O-C 3.6Å; Q484-R487 WeakPolarHBondContact O-CB 3.05Å; Q484-R487 PolarHBondContact O-N 2.88Å; Q484-R487 VanDerWaalsContact O-N 3.13Å; V485-R487 VanDerWaalsContact C-N 3.32Å; V485-R487 PolarHBondContact O-N 3.01Å
488	G	95.8	Very high	94.5	Very high	48 Å²	48	73.2 Å²	73.2	50%	0.495	36%	0.364	S	S	.	.	T	Hydrogen-bonded Turn	trans	96.3	4.7	176.9	0	0	0	0	0	114.7	Q484 V485 E486	Q484-G488 PolarHBondContact O-N 2.9Å; V485-G488 PolarHBondContact O-N 3.42Å; E486-G488 PolarHBondContact O-N 3.39Å
489	Y	98.2	Very high	94.6	Very high	77 Å²	77	73.3 Å²	73.3	30%	0.302	37%	0.371	S	S	.	.			trans	-62	138.4	173.4	175.5	-92.9	0	0	0	110.9	Y473 M476 Q484 M491	Y473-Y489 HydrophobicContact CD1-CD1 4.27Å; Y473-Y489 AromaticContact CD1-CE1 3.75Å; Y473-Y489 HydrophobicContact CD1-CE1 3.75Å; Y473-Y489 HydrophobicContact CE1-CD1 4.1Å; Y473-Y489 AromaticContact CE1-CE1 3.87Å; Y473-Y489 HydrophobicContact CE1-CE1 3.87Å; M476-Y489 HydrophobicContact CE-CE1 4.06Å; M476-Y489 HydrophobicContact CE-CE2 4.41Å; M476-Y489 HydrophobicContact SD-CE1 4.43Å; Q484-Y489 HydrophobicContact CB-CD1 4.4Å; Q484-Y489 HydrophobicContact CB-CG 4.31Å; Q484-Y489 WeakPolarHBondContact O-CB 3.38Å; Q484-Y489 PolarHBondContact O-N 3.45Å; Y489-M491 HydrophobicContact CE1-CG 4.41Å
490	R	98.3	Very high	94.7	Very high	46 Å²	46	67 Å²	67	17%	0.174	35%	0.354	C	S	.	.			trans	-133.4	150.5	169.9	-61.5	-62.3	179.7	-93.2	3.4	108.9	V485 L506 W509	V485-R490 PolarHBondContact O-NH1 3.46Å; R490-L506 HydrophobicContact CB-CD2 3.95Å; R490-L506 HydrophobicContact CG-CD2 4.28Å; R490-W509 HydrophobicContact CB-CE3 4.23Å; R490-W509 VanDerWaalsContact CZ-O 3.31Å; R490-W509 PolarHBondContact NE-O 3.19Å; R490-W509 PolarHBondContact NH2-O 2.84Å
491	M	98.1	Very high	94.7	Very high	17 Å²	17	63.2 Å²	63.2	8%	0.084	34%	0.337	C	S	.	.	P	Polyproline II helix	trans	-61.7	137.8	179	-71.9	-176.7	-77.7	0	0	110.9	I460 T463 P472 Y473 Y489 H502 W509	I460-M491 HydrophobicContact CD1-CE 3.57Å; T463-M491 HydrophobicContact CG2-CE 3.8Å; P472-M491 HydrophobicContact CB-CE 4.19Å; P472-M491 HydrophobicContact CB-SD 4.28Å; Y473-M491 HydrophobicContact CD1-CG 3.68Å; Y473-M491 HydrophobicContact CD1-SD 4.16Å; Y473-M491 HydrophobicContact CD2-CE 4.35Å; Y473-M491 HydrophobicContact CD2-SD 4.28Å; Y473-M491 HydrophobicContact CE1-CE 4.32Å; Y473-M491 HydrophobicContact CE1-CG 3.63Å; Y473-M491 HydrophobicContact CE1-SD 4.28Å; Y473-M491 HydrophobicContact CE2-CE 3.95Å; Y473-M491 HydrophobicContact CE2-SD 4.41Å; Y473-M491 HydrophobicContact CG-CG 4.26Å; Y473-M491 HydrophobicContact CG-SD 4.14Å; Y473-M491 PolarHBondContact N-SD 2.86Å; Y489-M491 HydrophobicContact CE1-CG 4.41Å; M491-H502 PolarHBondContact O-NE2 3.36Å; M491-H502 VanDerWaalsContact O-NE2 3.11Å; M491-W509 HydrophobicContact CB-CH2 4.37Å; M491-W509 HydrophobicContact CB-CZ3 4.42Å; M491-W509 HydrophobicContact CE-CH2 3.86Å; M491-W509 HydrophobicContact CE-CZ2 3.88Å
492	P	97.6	Very high	94.9	Very high	92 Å²	92	64.3 Å²	64.3	60%	0.597	34%	0.342	S	S	*	.	P	Polyproline II helix	trans	-65.6	162.9	175.1	29.7	-35.6	0	0	0	111	P494	P492-P494 VanDerWaalsContact O-CD 3.32Å; P492-P494 WeakPolarHBondContact O-CD 3.23Å
493	C	97.6	Very high	95.1	Very high	54 Å²	54	67.6 Å²	67.6	37%	0.365	36%	0.356	S	S	.	.	P	Polyproline II helix	trans	-56.9	122.3	175.6	-170.9	0	0	0	0	109.8	H502	C493-H502 HydrophobicContact CB-CB 4.19Å; C493-H502 PolarHBondContact N-CE1 3.04Å; C493-H502 PolarHBondContact N-NE2 3.33Å
494	P	94.9	Very high	95.4	Very high	25 Å²	25	64.5 Å²	64.5	16%	0.162	34%	0.341	C	S	.	.	P	Polyproline II helix	trans	-62.3	152.8	176.2	-23.7	35.1	0	0	0	112	V466 T467 P492 D496 C497	V466-P494 HydrophobicContact CG2-CB 4.03Å; V466-P494 HydrophobicContact CG2-CG 3.81Å; T467-P494 HydrophobicContact CG2-CB 3.79Å; T467-P494 HydrophobicContact CG2-CG 4.04Å; P492-P494 VanDerWaalsContact O-CD 3.32Å; P492-P494 WeakPolarHBondContact O-CD 3.23Å; P494-D496 PolarHBondContact O-N 2.62Å; P494-C497 HydrophobicContact CB-CB 4.04Å; P494-C497 HydrophobicContact CG-CB 4.35Å; P494-C497 WeakPolarHBondContact O-CB 3.4Å; P494-C497 PolarHBondContact O-N 3.17Å; P494-C497 VanDerWaalsContact O-N 3.15Å
495	Q	90.8	Very high	95.4	Very high	161 Å²	161	61.2 Å²	61.2	75%	0.752	33%	0.326	S	S	*	.	T	Hydrogen-bonded Turn	trans	-56.6	138.6	173.4	-172	180	-8.9	0	0	110.6	C497	Q495-C497 PolarHBondContact O-N 3.03Å; Q495-C497 VanDerWaalsContact O-N 3.09Å
496	D	87.3	Confident	95.5	Very high	147 Å²	147	64 Å²	64	79%	0.786	34%	0.341	S	S	*	.	T	Hydrogen-bonded Turn	trans	61.5	9.6	-178.6	-49.4	-42.7	0	0	0	115.1	P494	P494-D496 PolarHBondContact O-N 2.62Å
497	C	94.1	Very high	95.8	Very high	13 Å²	13	62.4 Å²	62.4	9%	0.088	33%	0.333	C	S	.	.			trans	-83.4	128.4	170.3	-172.4	0	0	0	0	109.8	V466 P494 Q495	V466-C497 HydrophobicContact CG2-CB 4.4Å; P494-C497 HydrophobicContact CB-CB 4.04Å; P494-C497 HydrophobicContact CG-CB 4.35Å; P494-C497 WeakPolarHBondContact O-CB 3.4Å; P494-C497 PolarHBondContact O-N 3.17Å; P494-C497 VanDerWaalsContact O-N 3.15Å; Q495-C497 PolarHBondContact O-N 3.03Å; Q495-C497 VanDerWaalsContact O-N 3.09Å
498	P	93.2	Very high	96	Very high	37 Å²	37	53.5 Å²	53.5	24%	0.24	30%	0.3	C	S	.	.			trans	-65.6	143.8	173.5	-16.2	27.9	0	0	0	111.8	L370 S500 L501 H502 Y529	L370-P498 HydrophobicContact CD2-CG 3.37Å; P498-S500 VanDerWaalsContact C-N 3.27Å; P498-S500 PolarHBondContact O-N 3.34Å; P498-L501 PolarHBondContact O-N 3.27Å; P498-H502 PolarHBondContact O-N 2.63Å; P498-Y529 VanDerWaalsContact CB-OH 3.26Å; P498-Y529 WeakPolarHBondContact CB-OH 3.45Å; P498-Y529 WeakPolarHBondContact CG-OH 3.47Å
499	S	93.4	Very high	96.1	Very high	81 Å²	81	51.4 Å²	51.4	57%	0.566	28%	0.277	S	S	*	.	H	α-helix	trans	-55.3	-40.7	-179.9	-55.4	0	0	0	0	112.9	L501 H502 E503	S499-L501 VanDerWaalsContact C-N 3.3Å; S499-L501 PolarHBondContact O-N 3.45Å; S499-H502 PolarHBondContact O-N 3.24Å; S499-H502 VanDerWaalsContact O-N 3.13Å; S499-E503 WeakPolarHBondContact O-CG 3.36Å; S499-E503 PolarHBondContact O-N 3.16Å
500	S	93.1	Very high	96.1	Very high	50 Å²	50	52 Å²	52	35%	0.35	28%	0.281	S	S	.	.	H	α-helix	trans	-59.5	-36.6	177.6	45.7	0	0	0	0	113.5	P498 L504 Y529	P498-S500 VanDerWaalsContact C-N 3.27Å; P498-S500 PolarHBondContact O-N 3.34Å; S500-L504 PolarHBondContact O-N 3.46Å; S500-Y529 PolarHBondContact OG-OH 3.47Å
501	L	94.6	Very high	96.1	Very high	4 Å²	4	57.7 Å²	57.7	2%	0.021	31%	0.307	C	S	.	.	H	α-helix	trans	-76	-34.3	177.2	-171.9	61.2	0	0	0	111.4	L370 V374 L462 V466 P498 S499 L504 M505 L526 Y529	L370-L501 HydrophobicContact CD1-CD2 4.23Å; V374-L501 HydrophobicContact CG2-CD2 4.35Å; L462-L501 HydrophobicContact CD1-CD1 4.43Å; V466-L501 HydrophobicContact CG1-CD2 3.68Å; P498-L501 PolarHBondContact O-N 3.27Å; S499-L501 VanDerWaalsContact C-N 3.3Å; S499-L501 PolarHBondContact O-N 3.45Å; L501-L504 HydrophobicContact CD1-CD2 4.23Å; L501-L504 WeakPolarHBondContact O-CB 3.37Å; L501-L504 PolarHBondContact O-N 2.57Å; L501-M505 HydrophobicContact CG-CE 4.15Å; L501-M505 WeakPolarHBondContact O-CG 3.34Å; L501-M505 PolarHBondContact O-N 3.26Å; L501-M505 VanDerWaalsContact O-N 3.15Å; L501-L526 HydrophobicContact CD1-CD2 3.89Å; L501-Y529 HydrophobicContact CB-CE2 4.29Å
502	H	98.1	Very high	96	Very high	26 Å²	26	61 Å²	61	12%	0.12	33%	0.325	C	S	.	.	H	α-helix	trans	-69	-38.1	172.9	-178.7	-117.6	0	0	0	112.4	M491 C493 P498 S499 L504 M505 L506	M491-H502 PolarHBondContact O-NE2 3.36Å; M491-H502 VanDerWaalsContact O-NE2 3.11Å; C493-H502 HydrophobicContact CB-CB 4.19Å; C493-H502 PolarHBondContact N-CE1 3.04Å; C493-H502 PolarHBondContact N-NE2 3.33Å; P498-H502 PolarHBondContact O-N 2.63Å; S499-H502 PolarHBondContact O-N 3.24Å; S499-H502 VanDerWaalsContact O-N 3.13Å; H502-L504 VanDerWaalsContact C-N 3.27Å; H502-L504 PolarHBondContact O-N 3.39Å; H502-M505 WeakPolarHBondContact O-CA 3.22Å; H502-M505 WeakPolarHBondContact O-CB 3.18Å; H502-M505 PolarHBondContact O-N 3.23Å; H502-M505 VanDerWaalsContact O-N 3.07Å; H502-L506 WeakPolarHBondContact O-CG 3.36Å; H502-L506 PolarHBondContact O-N 2.93Å
503	E	97.8	Very high	96	Very high	111 Å²	111	57.4 Å²	57.4	52%	0.519	30%	0.303	S	S	.	.	H	α-helix	trans	-58.7	-40.7	171.7	-75.8	169.8	-161.5	0	0	111.3	S499 M505 L506 Q507	S499-E503 WeakPolarHBondContact O-CG 3.36Å; S499-E503 PolarHBondContact O-N 3.16Å; E503-M505 VanDerWaalsContact C-N 3.34Å; E503-M505 PolarHBondContact O-N 3.16Å; E503-L506 PolarHBondContact O-N 3.38Å; E503-Q507 WeakPolarHBondContact O-CG 3.2Å; E503-Q507 PolarHBondContact O-N 3.44Å
504	L	97.9	Very high	96	Very high	0 Å²	0	61.5 Å²	61.5	0%	0	32%	0.316	C	S	.	.	H	α-helix	trans	-59.9	-43	172.5	-164	73.9	0	0	0	111.8	L462 S500 L501 H502 L506 Q507 C508 Y521 L522 F525 L526	L462-L504 HydrophobicContact CD1-CD2 4.07Å; S500-L504 PolarHBondContact O-N 3.46Å; L501-L504 HydrophobicContact CD1-CD2 4.23Å; L501-L504 WeakPolarHBondContact O-CB 3.37Å; L501-L504 PolarHBondContact O-N 2.57Å; H502-L504 VanDerWaalsContact C-N 3.27Å; H502-L504 PolarHBondContact O-N 3.39Å; L504-L506 VanDerWaalsContact C-N 3.33Å; L504-L506 PolarHBondContact O-N 3.46Å; L504-Q507 WeakPolarHBondContact O-CB 3.47Å; L504-Q507 PolarHBondContact O-N 3.17Å; L504-C508 PolarHBondContact O-N 3.17Å; L504-C508 PolarHBondContact O-SG 2.9Å; L504-C508 VanDerWaalsContact O-SG 3.4Å; L504-Y521 HydrophobicContact CD1-CE1 4.04Å; L504-L522 HydrophobicContact CD1-CD2 3.72Å; L504-L522 HydrophobicContact CD2-CD2 3.96Å; L504-L522 HydrophobicContact CG-CD2 3.8Å; L504-F525 HydrophobicContact CB-CE1 4.31Å; L504-F525 HydrophobicContact CD1-CD1 3.83Å; L504-F525 HydrophobicContact CD1-CD2 4.44Å; L504-F525 HydrophobicContact CD1-CE1 4.03Å; L504-F525 HydrophobicContact CD1-CG 4.05Å; L504-F525 HydrophobicContact CD1-CZ 4.42Å; L504-F525 HydrophobicContact CD2-CD1 3.59Å; L504-F525 HydrophobicContact CD2-CE1 3.76Å; L504-F525 HydrophobicContact CG-CD1 4.26Å; L504-F525 HydrophobicContact CG-CE1 4.26Å; L504-L526 HydrophobicContact CD2-CD2 4Å; L504-L526 HydrophobicContact CD2-CG 4.21Å
505	M	98.7	Very high	96.2	Very high	0 Å²	0	66 Å²	66	0%	0	34%	0.335	C	S	.	.	H	α-helix	trans	-60.9	-42.3	174.8	-61.4	164.6	-172.5	0	0	111.6	L462 T463 V466 L501 H502 E503 Q507 C508 W509	L462-M505 HydrophobicContact CB-CE 3.61Å; L462-M505 HydrophobicContact CB-CG 3.93Å; L462-M505 HydrophobicContact CB-SD 4.48Å; L462-M505 HydrophobicContact CD1-CG 3.98Å; T463-M505 HydrophobicContact CG2-CE 4.34Å; T463-M505 HydrophobicContact CG2-SD 3.72Å; V466-M505 HydrophobicContact CG1-CE 4.33Å; V466-M505 HydrophobicContact CG2-CE 3.99Å; L501-M505 HydrophobicContact CG-CE 4.15Å; L501-M505 WeakPolarHBondContact O-CG 3.34Å; L501-M505 PolarHBondContact O-N 3.26Å; L501-M505 VanDerWaalsContact O-N 3.15Å; H502-M505 WeakPolarHBondContact O-CA 3.22Å; H502-M505 WeakPolarHBondContact O-CB 3.18Å; H502-M505 PolarHBondContact O-N 3.23Å; H502-M505 VanDerWaalsContact O-N 3.07Å; E503-M505 VanDerWaalsContact C-N 3.34Å; E503-M505 PolarHBondContact O-N 3.16Å; M505-Q507 VanDerWaalsContact C-N 3.31Å; M505-Q507 PolarHBondContact O-N 2.92Å; M505-C508 WeakPolarHBondContact O-CB 3.37Å; M505-C508 PolarHBondContact O-N 3.43Å; M505-C508 VanDerWaalsContact O-N 3.16Å; M505-W509 HydrophobicContact CB-CE3 4.22Å; M505-W509 HydrophobicContact CB-CH2 3.69Å; M505-W509 HydrophobicContact CB-CZ2 4.03Å; M505-W509 HydrophobicContact CB-CZ3 3.81Å; M505-W509 HydrophobicContact CG-CH2 4.31Å; M505-W509 VanDerWaalsContact O-CD2 3.23Å; M505-W509 PolarHBondContact O-N 3Å; M505-W509 HydrophobicContact SD-CH2 4.25Å
506	L	98.7	Very high	96.6	Very high	68 Å²	68	58.5 Å²	58.5	36%	0.356	30%	0.3	S	S	.	.	H	α-helix	trans	-64.5	-34.6	177.1	-67.9	175.4	0	0	0	112.4	R490 H502 E503 L504 W509 K510	R490-L506 HydrophobicContact CB-CD2 3.95Å; R490-L506 HydrophobicContact CG-CD2 4.28Å; H502-L506 WeakPolarHBondContact O-CG 3.36Å; H502-L506 PolarHBondContact O-N 2.93Å; E503-L506 PolarHBondContact O-N 3.38Å; L504-L506 VanDerWaalsContact C-N 3.33Å; L504-L506 PolarHBondContact O-N 3.46Å; L506-W509 HydrophobicContact CD2-CE3 4.19Å; L506-W509 HydrophobicContact CD2-CZ3 4.47Å; L506-W509 CarbonylContact O-C 3.53Å; L506-W509 PolarHBondContact O-N 3.42Å; L506-K510 PolarHBondContact O-N 3.47Å
507	Q	98.6	Very high	97.1	Very high	67 Å²	67	52.4 Å²	52.4	31%	0.313	27%	0.268	S	S	.	.	H	α-helix	trans	-64	-42.4	171.3	-68	172.9	29.1	0	0	111.3	E503 L504 M505 W509 K510 P517	E503-Q507 WeakPolarHBondContact O-CG 3.2Å; E503-Q507 PolarHBondContact O-N 3.44Å; L504-Q507 WeakPolarHBondContact O-CB 3.47Å; L504-Q507 PolarHBondContact O-N 3.17Å; M505-Q507 VanDerWaalsContact C-N 3.31Å; M505-Q507 PolarHBondContact O-N 2.92Å; Q507-W509 PolarHBondContact O-N 2.81Å; Q507-K510 VanDerWaalsContact O-CG 3.29Å; Q507-K510 WeakPolarHBondContact O-CG 3.36Å; Q507-K510 PolarHBondContact O-N 3.31Å; Q507-P517 HydrophobicContact CB-CG 4.4Å
508	C	98.8	Very high	97.3	Very high	0 Å²	0	54.4 Å²	54.4	0%	0	28%	0.28	C	S	.	.	H	α-helix	trans	-62.9	-29.2	174.3	-66.4	0	0	0	0	113.1	V455 L504 M505 R516	V455-C508 HydrophobicContact CG1-CB 4.07Å; V455-C508 WeakPolarHBondContact O-CB 3.35Å; L504-C508 PolarHBondContact O-N 3.17Å; L504-C508 PolarHBondContact O-SG 2.9Å; L504-C508 VanDerWaalsContact O-SG 3.4Å; M505-C508 WeakPolarHBondContact O-CB 3.37Å; M505-C508 PolarHBondContact O-N 3.43Å; M505-C508 VanDerWaalsContact O-N 3.16Å; C508-R516 VanDerWaalsContact O-CD 3.27Å; C508-R516 WeakPolarHBondContact O-CD 3.3Å
509	W	98.7	Very high	97.6	Very high	3 Å²	3	52.6 Å²	52.6	1%	0.011	27%	0.269	C	S	.	.	T	Hydrogen-bonded Turn	trans	-99.6	22.6	-178.4	-52.9	-38	0	0	0	114.7	W456 G459 I460 T463 R490 M491 M505 L506 Q507 K511	W456-W509 HydrophobicContact CD2-CB 4.5Å; W456-W509 AromaticContact CD2-CD1 3.7Å; W456-W509 HydrophobicContact CD2-CG 4.43Å; W456-W509 AromaticContact CE2-CD1 3.83Å; W456-W509 HydrophobicContact CE3-CB 4.05Å; W456-W509 HydrophobicContact CE3-CG 4.44Å; W456-W509 AromaticContact CG-CD1 3.98Å; W456-W509 HydrophobicContact CH2-CB 4.01Å; W456-W509 HydrophobicContact CH2-CG 4.49Å; W456-W509 HydrophobicContact CZ2-CB 4.47Å; W456-W509 HydrophobicContact CZ2-CG 4.49Å; W456-W509 HydrophobicContact CZ3-CB 3.8Å; W456-W509 HydrophobicContact CZ3-CG 4.49Å; W456-W509 WeakPolarHBondContact CZ3-O 3.17Å; W456-W509 PolarHBondContact O-NE1 2.75Å; G459-W509 VanDerWaalsContact C-CZ2 3.47Å; G459-W509 VanDerWaalsContact O-CZ2 3.26Å; G459-W509 WeakPolarHBondContact O-CZ2 3.33Å; I460-W509 HydrophobicContact CD1-CZ2 3.68Å; I460-W509 HydrophobicContact CG1-CZ2 4.44Å; T463-W509 HydrophobicContact CG2-CH2 3.42Å; T463-W509 VanDerWaalsContact CG2-CH2 3.42Å; T463-W509 HydrophobicContact CG2-CZ2 3.6Å; R490-W509 HydrophobicContact CB-CE3 4.23Å; R490-W509 VanDerWaalsContact CZ-O 3.31Å; R490-W509 PolarHBondContact NE-O 3.19Å; R490-W509 PolarHBondContact NH2-O 2.84Å; M491-W509 HydrophobicContact CB-CH2 4.37Å; M491-W509 HydrophobicContact CB-CZ3 4.42Å; M491-W509 HydrophobicContact CE-CH2 3.86Å; M491-W509 HydrophobicContact CE-CZ2 3.88Å; M505-W509 HydrophobicContact CB-CE3 4.22Å; M505-W509 HydrophobicContact CB-CH2 3.69Å; M505-W509 HydrophobicContact CB-CZ2 4.03Å; M505-W509 HydrophobicContact CB-CZ3 3.81Å; M505-W509 HydrophobicContact CG-CH2 4.31Å; M505-W509 VanDerWaalsContact O-CD2 3.23Å; M505-W509 PolarHBondContact O-N 3Å; M505-W509 HydrophobicContact SD-CH2 4.25Å; L506-W509 HydrophobicContact CD2-CE3 4.19Å; L506-W509 HydrophobicContact CD2-CZ3 4.47Å; L506-W509 CarbonylContact O-C 3.53Å; L506-W509 PolarHBondContact O-N 3.42Å; Q507-W509 PolarHBondContact O-N 2.81Å; W509-K511 PolarHBondContact O-N 3.47Å
510	K	98.6	Very high	97.8	Very high	90 Å²	90	55 Å²	55	39%	0.391	27%	0.271	S	S	.	.			trans	-55.7	139.8	169.3	-72.3	-70	-167.1	155.3	0	110.6	L506 Q507 E515 R516	L506-K510 PolarHBondContact O-N 3.47Å; Q507-K510 VanDerWaalsContact O-CG 3.29Å; Q507-K510 WeakPolarHBondContact O-CG 3.36Å; Q507-K510 PolarHBondContact O-N 3.31Å; K510-E515 HydrophobicContact CB-CB 4Å; K510-E515 HydrophobicContact CG-CB 4.15Å; K510-E515 IonicContact NZ-OE2 2.95Å; K510-R516 HydrophobicContact CB-CG 3.98Å; K510-R516 PolarHBondContact O-NE 2.77Å; K510-R516 PolarHBondContact O-NH2 3.04Å
511	K	96.6	Very high	98	Very high	165 Å²	165	57.5 Å²	57.5	72%	0.717	27%	0.273	S	S	*	.	S	Bend	trans	-63.3	-48.9	-178.1	-178.4	178.7	178.9	176.1	0	110	W509	W509-K511 PolarHBondContact O-N 3.47Å
512	D	97.6	Very high	98.1	Very high	87 Å²	87	57.3 Å²	57.3	47%	0.465	27%	0.272	S	S	.	.	S	Bend	trans	-71.4	129.8	170	-166	-15.9	0	0	0	109.5	E514 E515	D512-E514 VanDerWaalsContact C-N 3.31Å; D512-E514 PolarHBondContact OD1-N 3.37Å; D512-E514 VanDerWaalsContact OD1-N 3.13Å; D512-E515 HydrophobicContact CB-CB 4.36Å; D512-E515 HydrophobicContact CB-CG 4Å
513	A	97.8	Very high	98	Very high	16 Å²	16	57.9 Å²	57.9	13%	0.132	28%	0.275	C	S	.	.	S	Bend	trans	-68.5	-33.2	-179	0	0	0	0	0	111.7	K452 E515 R516	K452-A513 HydrophobicContact CB-CB 3.91Å; K452-A513 WeakPolarHBondContact CD-O 3.42Å; K452-A513 WeakPolarHBondContact CG-O 3.27Å; A513-E515 VanDerWaalsContact C-N 3.32Å; A513-E515 PolarHBondContact O-N 3.49Å; A513-R516 WeakPolarHBondContact O-CB 3.48Å; A513-R516 WeakPolarHBondContact O-CG 3.49Å; A513-R516 PolarHBondContact O-N 3.08Å
514	E	97.5	Very high	97.6	Very high	140 Å²	140	54.9 Å²	54.9	65%	0.654	27%	0.27	S	S	*	.	T	Hydrogen-bonded Turn	trans	-75.3	-22.2	-177	-61.4	-52.6	126.7	0	0	112.7	D512 R516	D512-E514 VanDerWaalsContact C-N 3.31Å; D512-E514 PolarHBondContact OD1-N 3.37Å; D512-E514 VanDerWaalsContact OD1-N 3.13Å; E514-R516 VanDerWaalsContact C-N 3.25Å; E514-R516 PolarHBondContact O-N 3.26Å
515	E	98.4	Very high	97.3	Very high	120 Å²	120	57.6 Å²	57.6	56%	0.561	28%	0.282	S	S	*	.	T	Hydrogen-bonded Turn	trans	-75.9	-11.6	173.2	-70.3	-170.1	171.3	0	0	113.5	K510 D512 A513	K510-E515 HydrophobicContact CB-CB 4Å; K510-E515 HydrophobicContact CG-CB 4.15Å; K510-E515 IonicContact NZ-OE2 2.95Å; D512-E515 HydrophobicContact CB-CB 4.36Å; D512-E515 HydrophobicContact CB-CG 4Å; A513-E515 VanDerWaalsContact C-N 3.32Å; A513-E515 PolarHBondContact O-N 3.49Å
516	R	98.8	Very high	97	Very high	4 Å²	4	57.8 Å²	57.8	2%	0.015	28%	0.283	C	S	.	.	S	Bend	trans	-74	146.1	179.1	-57.8	173.1	-167.3	155.8	9.6	109.4	E442 K452 V455 C508 K510 A513 E514	E442-R516 IonicContact OE1-CZ 3.77Å; E442-R516 IonicContact OE1-NH1 3.35Å; E442-R516 PolarHBondContact OE1-NH1 2.93Å; E442-R516 IonicContact OE1-NH2 3.25Å; E442-R516 PolarHBondContact OE1-NH2 2.82Å; E442-R516 IonicContact OE2-CZ 2.65Å; E442-R516 IonicContact OE2-NH1 3.62Å; E442-R516 IonicContact OE2-NH2 3.19Å; E442-R516 PolarHBondContact OE2-NH2 3.14Å; K452-R516 HydrophobicContact CD-CB 4.32Å; K452-R516 PolarHBondContact NZ-O 3.25Å; K452-R516 WeakPolarHBondContact O-CD 3.45Å; K452-R516 PolarHBondContact O-NH1 3.1Å; V455-R516 HydrophobicContact CB-CB 4.46Å; V455-R516 HydrophobicContact CG1-CB 3.86Å; C508-R516 VanDerWaalsContact O-CD 3.27Å; C508-R516 WeakPolarHBondContact O-CD 3.3Å; K510-R516 HydrophobicContact CB-CG 3.98Å; K510-R516 PolarHBondContact O-NE 2.77Å; K510-R516 PolarHBondContact O-NH2 3.04Å; A513-R516 WeakPolarHBondContact O-CB 3.48Å; A513-R516 WeakPolarHBondContact O-CG 3.49Å; A513-R516 PolarHBondContact O-N 3.08Å; E514-R516 VanDerWaalsContact C-N 3.25Å; E514-R516 PolarHBondContact O-N 3.26Å
517	P	98.6	Very high	96.5	Very high	18 Å²	18	57.7 Å²	57.7	12%	0.117	28%	0.28	C	S	.	.	P	Polyproline II helix	trans	-63.6	168.8	-179.8	26.3	-34.3	0	0	0	112.6	K452 V455 Q507 Y521 L522	K452-P517 PolarHBondContact NZ-O 2.88Å; V455-P517 HydrophobicContact CG1-CG 4.16Å; V455-P517 WeakPolarHBondContact CG2-O 3.31Å; Q507-P517 HydrophobicContact CB-CG 4.4Å; P517-Y521 HydrophobicContact CB-CD1 3.6Å; P517-Y521 HydrophobicContact CB-CE1 4.26Å; P517-Y521 HydrophobicContact CB-CG 4.36Å; P517-L522 HydrophobicContact CB-CD2 4.35Å; P517-L522 HydrophobicContact CB-CG 4.3Å; P517-L522 HydrophobicContact CG-CD1 4.3Å; P517-L522 HydrophobicContact CG-CD2 3.76Å; P517-L522 HydrophobicContact CG-CG 4.02Å
518	T	98.7	Very high	95.8	Very high	55 Å²	55	58.2 Å²	58.2	34%	0.337	29%	0.285	S	S	.	.	P	Polyproline II helix	trans	-84.2	159.7	167.3	58.9	0	0	0	0	110.3	E520 Y521 L522	T518-E520 VanDerWaalsContact C-N 3.27Å; T518-E520 PolarHBondContact O-N 2.81Å; T518-Y521 PolarHBondContact O-N 3.31Å; T518-Y521 PolarHBondContact OG1-N 2.8Å; T518-L522 WeakPolarHBondContact O-CG 3.24Å; T518-L522 PolarHBondContact O-N 3.03Å; T518-L522 VanDerWaalsContact O-N 3.08Å
519	F	98.7	Very high	95.2	Very high	0 Å²	0	60.1 Å²	60.1	0%	0	29%	0.292	C	S	.	.	H	α-helix	trans	-69.2	-29	174.1	-83	-71.9	0	0	0	112.3	M384 A385 E388 L397 I451 D454 V455 F458 Y521 L522 Q523	M384-F519 HydrophobicContact CB-CB 4.21Å; M384-F519 HydrophobicContact CB-CD1 3.31Å; M384-F519 HydrophobicContact CB-CD2 3.77Å; M384-F519 HydrophobicContact CB-CE1 3.39Å; M384-F519 HydrophobicContact CB-CE2 3.85Å; M384-F519 HydrophobicContact CB-CG 3.49Å; M384-F519 VanDerWaalsContact CB-CG 3.49Å; M384-F519 HydrophobicContact CB-CZ 3.66Å; M384-F519 HydrophobicContact CE-CD2 4.31Å; M384-F519 HydrophobicContact CE-CE2 3.57Å; M384-F519 HydrophobicContact CE-CZ 3.71Å; M384-F519 HydrophobicContact CG-CD1 4.16Å; M384-F519 HydrophobicContact CG-CE1 3.72Å; M384-F519 HydrophobicContact CG-CE2 4.34Å; M384-F519 HydrophobicContact CG-CZ 3.82Å; A385-F519 HydrophobicContact CB-CB 3.9Å; E388-F519 PolarHBondContact OE2-N 2.9Å; L397-F519 HydrophobicContact CD2-CZ 4.24Å; I451-F519 HydrophobicContact CD1-CD2 3.8Å; I451-F519 HydrophobicContact CD1-CE2 3.72Å; I451-F519 HydrophobicContact CG1-CD2 3.94Å; I451-F519 HydrophobicContact CG1-CE2 4.07Å; D454-F519 HydrophobicContact CB-CE2 4Å; D454-F519 HydrophobicContact CB-CZ 4.16Å; V455-F519 HydrophobicContact CB-CE2 4.47Å; V455-F519 HydrophobicContact CB-CZ 4.49Å; V455-F519 HydrophobicContact CG2-CD2 3.85Å; V455-F519 HydrophobicContact CG2-CE2 3.54Å; V455-F519 HydrophobicContact CG2-CG 4.5Å; V455-F519 HydrophobicContact CG2-CZ 3.94Å; F458-F519 HydrophobicContact CB-CE1 3.68Å; F458-F519 HydrophobicContact CB-CZ 3.95Å; F458-F519 HydrophobicContact CD1-CE1 4.29Å; F458-F519 AromaticContact CD2-CE1 3.94Å; F458-F519 HydrophobicContact CD2-CE1 3.94Å; F458-F519 AromaticContact CG-CE1 3.71Å; F458-F519 HydrophobicContact CG-CE1 3.71Å; F458-F519 HydrophobicContact CG-CZ 4.47Å; F519-Y521 VanDerWaalsContact C-N 3.34Å; F519-Y521 PolarHBondContact O-N 3.32Å; F519-L522 HydrophobicContact CD1-CD1 3.79Å; F519-L522 HydrophobicContact CE1-CD1 4.04Å; F519-L522 HydrophobicContact CG-CD1 4.44Å; F519-L522 PolarHBondContact O-N 3.48Å; F519-Q523 WeakPolarHBondContact O-CB 3.4Å; F519-Q523 PolarHBondContact O-N 2.88Å
520	E	97.1	Very high	94.2	Very high	131 Å²	131	65 Å²	65	61%	0.612	31%	0.314	S	S	*	.	H	α-helix	trans	-56.9	-45.9	170	-177.2	173.8	-148.8	0	0	112	E388 T518 Q523 A524	E388-E520 PolarHBondContact OE2-N 2.86Å; T518-E520 VanDerWaalsContact C-N 3.27Å; T518-E520 PolarHBondContact O-N 2.81Å; E520-Q523 PolarHBondContact O-N 2.8Å; E520-A524 PolarHBondContact O-N 3.37Å; E520-A524 VanDerWaalsContact O-N 3.08Å
521	Y	96.9	Very high	92.7	Very high	102 Å²	102	62.1 Å²	62.1	40%	0.4	30%	0.304	S	S	.	.	H	α-helix	trans	-64.7	-45.5	175.3	172.8	-93.2	0	0	0	111.8	L504 P517 T518 F519 Q523 A524 F525	L504-Y521 HydrophobicContact CD1-CE1 4.04Å; P517-Y521 HydrophobicContact CB-CD1 3.6Å; P517-Y521 HydrophobicContact CB-CE1 4.26Å; P517-Y521 HydrophobicContact CB-CG 4.36Å; T518-Y521 PolarHBondContact O-N 3.31Å; T518-Y521 PolarHBondContact OG1-N 2.8Å; F519-Y521 VanDerWaalsContact C-N 3.34Å; F519-Y521 PolarHBondContact O-N 3.32Å; Y521-Q523 VanDerWaalsContact C-N 3.31Å; Y521-Q523 PolarHBondContact O-N 2.98Å; Y521-A524 PolarHBondContact O-N 3.2Å; Y521-F525 HydrophobicContact CE1-CB 4.47Å; Y521-F525 WeakPolarHBondContact O-CB 3.39Å; Y521-F525 PolarHBondContact O-N 3.34Å
522	L	97.9	Very high	90.8	Very high	0 Å²	0	58.8 Å²	58.8	0%	0	31%	0.307	C	S	.	.	H	α-helix	trans	-60.3	-41.9	179	-68.1	171	0	0	0	111.7	A381 V455 F458 L504 P517 T518 F519 L526	A381-L522 HydrophobicContact CB-CB 4.37Å; V455-L522 HydrophobicContact CG1-CD1 4.17Å; F458-L522 HydrophobicContact CD1-CD1 3.73Å; F458-L522 HydrophobicContact CE1-CB 4.32Å; F458-L522 HydrophobicContact CE1-CD1 4.04Å; F458-L522 HydrophobicContact CE1-CD2 4.39Å; F458-L522 HydrophobicContact CE1-CG 4.49Å; L504-L522 HydrophobicContact CD1-CD2 3.72Å; L504-L522 HydrophobicContact CD2-CD2 3.96Å; L504-L522 HydrophobicContact CG-CD2 3.8Å; P517-L522 HydrophobicContact CB-CD2 4.35Å; P517-L522 HydrophobicContact CB-CG 4.3Å; P517-L522 HydrophobicContact CG-CD1 4.3Å; P517-L522 HydrophobicContact CG-CD2 3.76Å; P517-L522 HydrophobicContact CG-CG 4.02Å; T518-L522 WeakPolarHBondContact O-CG 3.24Å; T518-L522 PolarHBondContact O-N 3.03Å; T518-L522 VanDerWaalsContact O-N 3.08Å; F519-L522 HydrophobicContact CD1-CD1 3.79Å; F519-L522 HydrophobicContact CE1-CD1 4.04Å; F519-L522 HydrophobicContact CG-CD1 4.44Å; F519-L522 PolarHBondContact O-N 3.48Å; L522-L526 WeakPolarHBondContact O-CB 3.37Å; L522-L526 WeakPolarHBondContact O-CD1 3.47Å; L522-L526 VanDerWaalsContact O-CG 3.23Å; L522-L526 WeakPolarHBondContact O-CG 3.48Å; L522-L526 PolarHBondContact O-N 3.33Å; L522-L526 VanDerWaalsContact O-N 3.08Å
523	Q	95.9	Very high	88.4	Confident	39 Å²	39	60.8 Å²	60.8	18%	0.182	32%	0.323	C	S	.	.	H	α-helix	trans	-59	-55.3	174.9	179.9	-173.2	-5.9	0	0	110.4	A381 A382 F519 E520 Y521 F525 L526 E527	A381-Q523 HydrophobicContact CB-CB 4.09Å; A382-Q523 HydrophobicContact CB-CG 4.04Å; F519-Q523 WeakPolarHBondContact O-CB 3.4Å; F519-Q523 PolarHBondContact O-N 2.88Å; E520-Q523 PolarHBondContact O-N 2.8Å; Y521-Q523 VanDerWaalsContact C-N 3.31Å; Y521-Q523 PolarHBondContact O-N 2.98Å; Q523-F525 VanDerWaalsContact C-N 3.34Å; Q523-F525 PolarHBondContact O-N 3.14Å; Q523-L526 PolarHBondContact O-N 3.09Å; Q523-E527 HydrophobicContact CG-CG 4.32Å; Q523-E527 WeakPolarHBondContact CG-OE1 3.36Å; Q523-E527 PolarHBondContact NE2-OE1 3Å; Q523-E527 WeakPolarHBondContact O-CB 3.4Å; Q523-E527 WeakPolarHBondContact O-CG 3.42Å; Q523-E527 PolarHBondContact O-N 2.8Å
524	A	88.3	Confident	86.3	Confident	48 Å²	48	64.7 Å²	64.7	40%	0.397	34%	0.338	S	S	.	.	H	α-helix	trans	-58.9	-45.1	-178.2	0	0	0	0	0	112	E520 Y521 L526 E527 D528	E520-A524 PolarHBondContact O-N 3.37Å; E520-A524 VanDerWaalsContact O-N 3.08Å; Y521-A524 PolarHBondContact O-N 3.2Å; A524-L526 PolarHBondContact O-N 3.42Å; A524-E527 PolarHBondContact O-N 2.77Å; A524-D528 PolarHBondContact O-N 2.99Å; A524-D528 VanDerWaalsContact O-N 3.12Å
525	F	92.4	Very high	84.5	Confident	57 Å²	57	62 Å²	62	25%	0.25	33%	0.333	C	S	.	.	H	α-helix	trans	-59.3	-44.2	178	179.5	-86.7	0	0	0	112.4	L504 Y521 Q523 Y529	L504-F525 HydrophobicContact CB-CE1 4.31Å; L504-F525 HydrophobicContact CD1-CD1 3.83Å; L504-F525 HydrophobicContact CD1-CD2 4.44Å; L504-F525 HydrophobicContact CD1-CE1 4.03Å; L504-F525 HydrophobicContact CD1-CG 4.05Å; L504-F525 HydrophobicContact CD1-CZ 4.42Å; L504-F525 HydrophobicContact CD2-CD1 3.59Å; L504-F525 HydrophobicContact CD2-CE1 3.76Å; L504-F525 HydrophobicContact CG-CD1 4.26Å; L504-F525 HydrophobicContact CG-CE1 4.26Å; Y521-F525 HydrophobicContact CE1-CB 4.47Å; Y521-F525 WeakPolarHBondContact O-CB 3.39Å; Y521-F525 PolarHBondContact O-N 3.34Å; Q523-F525 VanDerWaalsContact C-N 3.34Å; Q523-F525 PolarHBondContact O-N 3.14Å; F525-Y529 HydrophobicContact CD1-CD2 4.25Å; F525-Y529 AromaticContact CE1-CD2 3.57Å; F525-Y529 HydrophobicContact CE1-CD2 3.57Å; F525-Y529 AromaticContact CE1-CE2 3.79Å; F525-Y529 HydrophobicContact CE1-CE2 3.79Å; F525-Y529 HydrophobicContact CZ-CD2 4.07Å; F525-Y529 HydrophobicContact CZ-CE2 4.09Å; F525-Y529 PolarHBondContact O-N 3.33Å; F525-Y529 VanDerWaalsContact O-N 3.16Å
526	L	93.1	Very high	83.1	Confident	4 Å²	4	61.1 Å²	61.1	2%	0.021	33%	0.329	C	S	.	.	H	α-helix	trans	-76.5	-35.7	-177.1	-68.5	166.5	0	0	0	112.5	V374 A377 A378 A381 F458 L501 L504 L522 Q523 A524 D528 Y529	V374-L526 HydrophobicContact CG1-CD2 4.13Å; A377-L526 HydrophobicContact CB-CD1 3.88Å; A377-L526 HydrophobicContact CB-CD2 4.35Å; A378-L526 HydrophobicContact CB-CB 3.74Å; A381-L526 HydrophobicContact CB-CD1 4.16Å; F458-L526 HydrophobicContact CE1-CD1 3.96Å; F458-L526 HydrophobicContact CZ-CD1 3.61Å; L501-L526 HydrophobicContact CD1-CD2 3.89Å; L504-L526 HydrophobicContact CD2-CD2 4Å; L504-L526 HydrophobicContact CD2-CG 4.21Å; L522-L526 WeakPolarHBondContact O-CB 3.37Å; L522-L526 WeakPolarHBondContact O-CD1 3.47Å; L522-L526 VanDerWaalsContact O-CG 3.23Å; L522-L526 WeakPolarHBondContact O-CG 3.48Å; L522-L526 PolarHBondContact O-N 3.33Å; L522-L526 VanDerWaalsContact O-N 3.08Å; Q523-L526 PolarHBondContact O-N 3.09Å; A524-L526 PolarHBondContact O-N 3.42Å; L526-D528 VanDerWaalsContact C-N 3.29Å; L526-D528 PolarHBondContact O-N 3.29Å; L526-Y529 WeakPolarHBondContact O-CB 3.38Å; L526-Y529 PolarHBondContact O-N 2.82Å
527	E	87	Confident	82.1	Confident	65 Å²	65	62.9 Å²	62.9	30%	0.304	34%	0.336	S	S	.	.	H	α-helix	trans	-62.5	-38.7	174.5	-74.3	179.8	178.3	0	0	111.3	K163 A378 Q523 A524	K163-E527 WeakPolarHBondContact CE-O 3.26Å; K163-E527 PolarHBondContact NZ-O 3.38Å; A378-E527 HydrophobicContact CB-CG 4.05Å; Q523-E527 HydrophobicContact CG-CG 4.32Å; Q523-E527 WeakPolarHBondContact CG-OE1 3.36Å; Q523-E527 PolarHBondContact NE2-OE1 3Å; Q523-E527 WeakPolarHBondContact O-CB 3.4Å; Q523-E527 WeakPolarHBondContact O-CG 3.42Å; Q523-E527 PolarHBondContact O-N 2.8Å; A524-E527 PolarHBondContact O-N 2.77Å
528	D	84.4	Confident	81.2	Confident	78 Å²	78	65.2 Å²	65.2	42%	0.417	35%	0.345	S	S	.	.	T	Hydrogen-bonded Turn	trans	-93.8	5.2	-178	-78.4	-34.9	0	0	0	115.6	A524 L526 F530 T531 A532	A524-D528 PolarHBondContact O-N 2.99Å; A524-D528 VanDerWaalsContact O-N 3.12Å; L526-D528 VanDerWaalsContact C-N 3.29Å; L526-D528 PolarHBondContact O-N 3.29Å; D528-F530 PolarHBondContact O-N 2.81Å; D528-T531 VanDerWaalsContact CA-OG1 3.3Å; D528-T531 WeakPolarHBondContact CA-OG1 3.43Å; D528-T531 PolarHBondContact O-N 3.49Å; D528-T531 PolarHBondContact O-OG1 3.3Å; D528-T531 PolarHBondContact OD1-OG1 3.02Å; D528-T531 VanDerWaalsContact OD1-OG1 3.08Å; D528-A532 PolarHBondContact O-N 2.81Å
529	Y	85.6	Confident	80	Confident	40 Å²	40	65.5 Å²	65.5	16%	0.157	35%	0.348	C	S	.	.	T	Hydrogen-bonded Turn	trans	-54.5	-32.8	-170.9	-168.5	-94.6	0	0	0	114.7	V374 P498 S500 L501 F525 L526	V374-Y529 HydrophobicContact CG1-CD1 4.1Å; V374-Y529 HydrophobicContact CG1-CG 3.94Å; V374-Y529 HydrophobicContact CG2-CD1 4.19Å; V374-Y529 HydrophobicContact CG2-CE1 4.35Å; P498-Y529 VanDerWaalsContact CB-OH 3.26Å; P498-Y529 WeakPolarHBondContact CB-OH 3.45Å; P498-Y529 WeakPolarHBondContact CG-OH 3.47Å; S500-Y529 PolarHBondContact OG-OH 3.47Å; L501-Y529 HydrophobicContact CB-CE2 4.29Å; F525-Y529 HydrophobicContact CD1-CD2 4.25Å; F525-Y529 AromaticContact CE1-CD2 3.57Å; F525-Y529 HydrophobicContact CE1-CD2 3.57Å; F525-Y529 AromaticContact CE1-CE2 3.79Å; F525-Y529 HydrophobicContact CE1-CE2 3.79Å; F525-Y529 HydrophobicContact CZ-CD2 4.07Å; F525-Y529 HydrophobicContact CZ-CE2 4.09Å; F525-Y529 PolarHBondContact O-N 3.33Å; F525-Y529 VanDerWaalsContact O-N 3.16Å; L526-Y529 WeakPolarHBondContact O-CB 3.38Å; L526-Y529 PolarHBondContact O-N 2.82Å
530	F	77.4	Confident	78.1	Confident	105 Å²	105	66.4 Å²	66.4	46%	0.461	36%	0.357	S	S	.	.	T	Hydrogen-bonded Turn	trans	-110	-7	178.2	-61.9	-75.6	0	0	0	114.2	L370 P371 V374 D528	L370-F530 HydrophobicContact CD2-CZ 4.18Å; L370-F530 HydrophobicContact CG-CZ 4.2Å; P371-F530 HydrophobicContact CB-CE2 4Å; P371-F530 HydrophobicContact CB-CZ 4.24Å; P371-F530 HydrophobicContact CG-CE1 4.43Å; P371-F530 HydrophobicContact CG-CE2 4.24Å; P371-F530 HydrophobicContact CG-CZ 3.98Å; V374-F530 HydrophobicContact CB-CE2 3.95Å; V374-F530 HydrophobicContact CG1-CE2 4.07Å; V374-F530 HydrophobicContact CG2-CE2 4.08Å; V374-F530 HydrophobicContact CG2-CZ 4.29Å; D528-F530 PolarHBondContact O-N 2.81Å
531	T	67.2	Low	76.1	Confident	31 Å²	31	66.7 Å²	66.7	19%	0.19	36%	0.363	C	S	.	.	T	Hydrogen-bonded Turn	trans	-99.9	-8.3	-171	30.9	0	0	0	0	114.4	D528 T533 E534	D528-T531 VanDerWaalsContact CA-OG1 3.3Å; D528-T531 WeakPolarHBondContact CA-OG1 3.43Å; D528-T531 PolarHBondContact O-N 3.49Å; D528-T531 PolarHBondContact O-OG1 3.3Å; D528-T531 PolarHBondContact OD1-OG1 3.02Å; D528-T531 VanDerWaalsContact OD1-OG1 3.08Å; T531-T533 PolarHBondContact O-N 2.74Å; T531-E534 PolarHBondContact O-N 3.39Å
532	A	57.1	Low	73.7	Confident	94 Å²	94	68.5 Å²	68.5	78%	0.777	38%	0.38	S	S	*	.	T	Hydrogen-bonded Turn	trans	-58.7	-11.4	-175.3	0	0	0	0	0	115.7	D528	D528-A532 PolarHBondContact O-N 2.81Å
533	T	46.8	Very low	71.4	Confident	130 Å²	130	70.5 Å²	70.5	80%	0.798	39%	0.39	S	S	*	.	T	Hydrogen-bonded Turn	trans	-109.1	-3.5	-177.9	52.9	0	0	0	0	115.4	T531	T531-T533 PolarHBondContact O-N 2.74Å
534	E	55.3	Low	70.2	Confident	97 Å²	97	72.1 Å²	72.1	45%	0.453	40%	0.401	S	S	.	.	S	Bend	trans	-119.5	147.7	-175.5	-67.1	-166.8	-174.8	0	0	113.6	K202 T531 Q536	K202-E534 WeakPolarHBondContact CE-OE1 3.48Å; K202-E534 IonicContact NZ-OE1 2.6Å; K202-E534 PolarHBondContact NZ-OE1 3.24Å; K202-E534 IonicContact NZ-OE2 2.61Å; K202-E534 PolarHBondContact NZ-OE2 2.64Å; T531-E534 PolarHBondContact O-N 3.39Å; E534-Q536 PolarHBondContact O-N 2.91Å
535	P	59.8	Low	69.2	Low	84 Å²	84	73.4 Å²	73.4	55%	0.545	40%	0.401	S	S	.	.			trans	-62.4	126	175.3	25.5	-32.4	0	0	0	110.2	Y537	P535-Y537 PolarHBondContact O-N 3.33Å
536	Q	68.9	Low	67.9	Low	101 Å²	101	74.3 Å²	74.3	47%	0.472	41%	0.409	S	S	.	.	S	Bend	trans	-60.3	-29.2	-177.1	-75.4	-174.1	1.4	0	0	113.4	R162 E534	R162-Q536 VanDerWaalsContact CZ-O 3.32Å; R162-Q536 VanDerWaalsContact NH1-CA 3.3Å; R162-Q536 VanDerWaalsContact NH1-CB 3.31Å; R162-Q536 PolarHBondContact NH1-O 2.64Å; R162-Q536 PolarHBondContact NH2-O 3.12Å; E534-Q536 PolarHBondContact O-N 2.91Å
537	Y	76.1	Confident	66.4	Low	42 Å²	42	78.4 Å²	78.4	17%	0.165	43%	0.432	C	S	.	.	S	Bend	trans	-130.9	145.1	176.3	-75.2	-83.2	0	0	0	109.7	S184 T186 S192 H208 K210 P535	S184-Y537 PolarHBondContact OG-OH 3.49Å; T186-Y537 HydrophobicContact CG2-CE2 4.27Å; S192-Y537 WeakPolarHBondContact OG-CE1 3.33Å; S192-Y537 PolarHBondContact OG-OH 3.04Å; H208-Y537 HydrophobicContact CB-CD1 4.06Å; H208-Y537 HydrophobicContact CB-CE1 4.17Å; K210-Y537 HydrophobicContact CB-CD1 3.83Å; K210-Y537 HydrophobicContact CB-CE1 4.02Å; K210-Y537 HydrophobicContact CB-CG 4.35Å; P535-Y537 PolarHBondContact O-N 3.33Å
538	Q	81.3	Confident	65.2	Low	66 Å²	66	79.3 Å²	79.3	31%	0.308	44%	0.44	S	S	.	.			trans	-71	135.5	173	-63.2	-59.7	-35.5	0	0	110.3	K207 H208 Y209	K207-Q538 HydrophobicContact CB-CG 4.38Å; K207-Q538 HydrophobicContact CG-CG 4.49Å; H208-Q538 PolarHBondContact O-N 2.77Å; Y209-Q538 HydrophobicContact CD1-CB 3.78Å; Y209-Q538 HydrophobicContact CD1-CG 4.44Å; Y209-Q538 HydrophobicContact CE1-CB 3.54Å; Y209-Q538 HydrophobicContact CE1-CG 3.93Å
539	P	72.4	Confident	63.9	Low	61 Å²	61	79.3 Å²	79.3	40%	0.396	44%	0.442	S	S	.	.			trans	-66.5	140.5	-179.9	27.1	-33.2	0	0	0	111	D541	P539-D541 VanDerWaalsContact C-N 3.32Å
540	G	59.6	Low	62.3	Low	19 Å²	19	82.1 Å²	82.1	20%	0.196	46%	0.462	C	S	.	.	S	Bend	trans	-77.3	-17.5	177.1	0	0	0	0	0	114.1	N542 L543	G540-N542 VanDerWaalsContact C-N 3.31Å; G540-N542 PolarHBondContact O-N 3.37Å; G540-L543 WeakPolarHBondContact O-CB 3.26Å; G540-L543 PolarHBondContact O-N 2.9Å
541	D	53.8	Low	61.2	Low	137 Å²	137	80.4 Å²	80.4	73%	0.733	46%	0.462	S	S	*	.	T	Hydrogen-bonded Turn	trans	-77.9	-15	-167.4	-58.3	-41.5	0	0	0	113.9	P539	P539-D541 VanDerWaalsContact C-N 3.32Å
542	N	48.1	Very low	60.7	Low	141 Å²	141	84.5 Å²	84.5	75%	0.754	49%	0.485	S	S	*	.	T	Hydrogen-bonded Turn	trans	-98.5	6.2	176.3	-66.2	-21.5	0	0	0	113.2	G540	G540-N542 VanDerWaalsContact C-N 3.31Å; G540-N542 PolarHBondContact O-N 3.37Å
543	L	48.8	Very low	61	Low	42 Å²	42	83.6 Å²	83.6	22%	0.22	46%	0.458	C	S	.	.			trans	-98.6	0	-174.9	-53.5	175.2	0	0	0	113.2	Y209 I221 T222 R224 G243 G540	Y209-L543 HydrophobicContact CD1-CD1 4.29Å; Y209-L543 HydrophobicContact CE1-CD1 4.49Å; Y209-L543 HydrophobicContact CE1-CD2 4.48Å; I221-L543 HydrophobicContact CG2-CD1 3.72Å; T222-L543 HydrophobicContact CG2-CB 4.29Å; R224-L543 PolarHBondContact NH1-O 2.86Å; G243-L543 WeakPolarHBondContact O-CD2 3.28Å; G540-L543 WeakPolarHBondContact O-CB 3.26Å; G540-L543 PolarHBondContact O-N 2.9Å

Retrieved 543 of 543 residues in 1589.5 ms (Link to these results)

U.S. Privacy Notice - Disclaimer / Registrations / Copyright Statement - Linking Policy - Notice of Privacy Practices (HIPAA) - Notice of Non‑Discrimination
© Copyright 2026 St. Jude Children's Research Hospital, a not-for-profit, section 501(c)(3).