A0A096MR68_PAPAN Loading...

Phosphatidylinositol 3-kinase regulatory subunit gamma

Binds to activated (phosphorylated) protein-tyrosine kinases through its SH2 domain and regulates their kinase activity. During insulin stimulation, it also binds to IRS-1.

AlphaFold DB (A0A2K6QPZ6), UniProt , Accession A0A096MR68, Species PAPAN (Papio anubis, Olive baboon), Gene PIK3R3, Length 461 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	30.9	Very low	29.2	Very low	226 Å²	226	167.9 Å²	167.9	100%	1.113	82%	0.822	S	S	*	*				0	98.4	0	-69.1	177.3	-163.4	0	0	106.1
2	Y	27.3	Very low	29.4	Very low	212 Å²	212	166.1 Å²	166.1	83%	0.831	82%	0.818	S	S	*	*				65.5	132.3	110.2	-66	-67.6	0	0	0	111.8
3	N	27.1	Very low	29.5	Very low	126 Å²	126	159.5 Å²	159.5	67%	0.674	81%	0.806	S	S	*	*			cis	-169.6	135.7	7.7	-129.5	-4.5	0	0	0	105.2	V5	N3-V5 HydrophobicContact CB-CG2 4.46Å
4	T	28.8	Very low	29.7	Very low	123 Å²	123	158.2 Å²	158.2	76%	0.755	80%	0.803	S	S	*	*			trans	-101.6	102.7	166.4	-46.5	0	0	0	0	106.9
5	V	28.2	Very low	29.7	Very low	108 Å²	108	164.6 Å²	164.6	66%	0.655	81%	0.813	S	S	*	*			trans	-100.5	112.3	172.4	178.5	0	0	0	0	107.1	N3	N3-V5 HydrophobicContact CB-CG2 4.46Å
6	W	30.1	Very low	29.8	Very low	231 Å²	231	168.1 Å²	168.1	88%	0.875	82%	0.815	S	S	*	*			trans	-99.5	111	160.5	-76.6	95.7	0	0	0	107.2	M8	W6-M8 PolarHBondContact O-N 2.87Å
7	S	27.6	Very low	29.9	Very low	95 Å²	95	169.1 Å²	169.1	66%	0.664	82%	0.818	S	S	*	*			trans	-65.9	119.2	168.6	-60.6	0	0	0	0	109.1
8	M	29.4	Very low	29.8	Very low	191 Å²	191	166.9 Å²	166.9	94%	0.941	82%	0.816	S	S	*	*			trans	-89.3	101.8	159.1	-78.3	171.4	96	0	0	106.8	W6	W6-M8 PolarHBondContact O-N 2.87Å
9	D	30.1	Very low	29.8	Very low	154 Å²	154	168.1 Å²	168.1	82%	0.824	82%	0.822	S	S	*	*			trans	-72	139.5	164	-85	-43.1	0	0	0	110
10	R	30.9	Very low	29.7	Very low	211 Å²	211	167.8 Å²	167.8	80%	0.796	82%	0.821	S	S	*	*			trans	-61.3	147.1	170.8	-65.3	167.3	-171.9	-169	-0.6	109.4
11	D	30.6	Very low	30	Very low	170 Å²	170	164.2 Å²	164.2	91%	0.909	81%	0.81	S	S	*	*			trans	-142.2	98.8	134.2	-91.2	-35.3	0	0	0	108.3
12	D	32.2	Very low	29.8	Very low	146 Å²	146	163.8 Å²	163.8	78%	0.781	80%	0.798	S	S	*	*			trans	-61.5	128.8	156.6	-89.2	-49.7	0	0	0	109.1
13	A	30.3	Very low	29.8	Very low	80 Å²	80	158.1 Å²	158.1	66%	0.661	79%	0.789	S	S	*	*			trans	-144.7	87.2	158.4	0	0	0	0	0	109.6
14	D	32.9	Very low	29.9	Very low	142 Å²	142	159.1 Å²	159.1	76%	0.759	80%	0.8	S	S	*	*			trans	32.4	102.4	134.6	-125.8	-5.1	0	0	0	118.6
15	W	29.9	Very low	30.1	Very low	254 Å²	254	160.9 Å²	160.9	96%	0.962	80%	0.8	S	S	*	*			trans	-119	27.2	167	-72.3	108.1	0	0	0	112.9
16	R	30.1	Very low	30.4	Very low	221 Å²	221	162.2 Å²	162.2	83%	0.834	80%	0.803	S	S	*	*			trans	-87.4	137.3	172.3	-64.7	-165.5	-160.1	-148.4	5.1	110.6
17	E	31.5	Very low	30.3	Very low	185 Å²	185	159.3 Å²	159.3	86%	0.864	80%	0.803	S	S	*	*			trans	75.7	86.7	169.6	-69.5	-174.3	153.9	0	0	118.5
18	V	28.7	Very low	30.6	Very low	130 Å²	130	162 Å²	162	79%	0.788	80%	0.802	S	S	*	*			trans	-137.6	91.7	130.8	-174.4	0	0	0	0	108.6	M20	V18-M20 HydrophobicContact CG1-CB 4.43Å; V18-M20 HydrophobicContact CG1-CG 3.72Å
19	M	29.8	Very low	30.8	Very low	188 Å²	188	160.9 Å²	160.9	93%	0.926	79%	0.789	S	S	*	*			trans	-81.9	119.8	154.8	-92.7	-78.5	-145.9	0	0	106.9
20	M	28	Very low	30.7	Very low	162 Å²	162	159.8 Å²	159.8	80%	0.798	78%	0.782	S	S	*	*			trans	-127.6	122.2	167.7	-84.1	-83.3	-173.3	0	0	108.8	V18	V18-M20 HydrophobicContact CG1-CB 4.43Å; V18-M20 HydrophobicContact CG1-CG 3.72Å
21	P	35.1	Very low	30.8	Very low	93 Å²	93	158.1 Å²	158.1	60%	0.604	78%	0.783	S	S	*	*			trans	-84.8	156.3	169.1	32	-25.4	0	0	0	110.5
22	Y	26.9	Very low	30.7	Very low	217 Å²	217	157.6 Å²	157.6	85%	0.851	78%	0.777	S	S	*	*			trans	104	128.8	158.3	-59.5	-73.2	0	0	0	120.7
23	S	27.1	Very low	30.5	Very low	93 Å²	93	158.4 Å²	158.4	65%	0.65	78%	0.781	S	S	*	*			trans	74.2	125.7	130.7	-152.4	0	0	0	0	119.7	E25	S23-E25 PolarHBondContact O-N 3.43Å
24	T	31	Very low	30.8	Very low	148 Å²	148	159.8 Å²	159.8	91%	0.908	78%	0.784	S	S	*	*	S	Bend	trans	-66.1	27.5	-178.4	33.5	0	0	0	0	115.6
25	E	33	Very low	30.8	Very low	159 Å²	159	158.7 Å²	158.7	74%	0.743	78%	0.784	S	S	*	*			trans	-121.8	52.3	-174.7	-76.4	-85.7	160.2	0	0	110.6	S23	S23-E25 PolarHBondContact O-N 3.43Å
26	L	32.4	Very low	30.8	Very low	137 Å²	137	151.6 Å²	151.6	72%	0.717	78%	0.779	S	S	*	*			trans	-163.7	82.7	174.6	-105.5	129.6	0	0	0	111.6	F28	L26-F28 HydrophobicContact CD2-CB 4.27Å; L26-F28 HydrophobicContact CD2-CD2 3.71Å; L26-F28 HydrophobicContact CD2-CG 4.48Å; L26-F28 HydrophobicContact CG-CD2 4.21Å
27	I	29.7	Very low	31.1	Very low	170 Å²	170	148.8 Å²	148.8	87%	0.872	78%	0.78	S	S	*	*			trans	-106.1	80.9	153.2	-57.8	178.3	0	0	0	106.1
28	F	32.7	Very low	31.4	Very low	150 Å²	150	145 Å²	145	66%	0.658	77%	0.772	S	S	*	*			trans	-99.4	157.4	172.3	-103.7	-64.2	0	0	0	110.9	L26	L26-F28 HydrophobicContact CD2-CB 4.27Å; L26-F28 HydrophobicContact CD2-CD2 3.71Å; L26-F28 HydrophobicContact CD2-CG 4.48Å; L26-F28 HydrophobicContact CG-CD2 4.21Å
29	Y	33.7	Very low	31.7	Very low	168 Å²	168	144.9 Å²	144.9	66%	0.659	77%	0.774	S	S	*	*			trans	44.6	106.6	148.9	-86.2	-87.9	0	0	0	117.9
30	I	29.4	Very low	32.1	Very low	131 Å²	131	145.6 Å²	145.6	67%	0.672	77%	0.772	S	S	*	*			trans	-117.1	105.1	141.4	-66.5	175.9	0	0	0	106.2	M32	I30-M32 HydrophobicContact CG2-CG 3.8Å; I30-M32 PolarHBondContact O-N 3.17Å
31	E	32.4	Very low	32.4	Very low	176 Å²	176	143.1 Å²	143.1	82%	0.822	77%	0.768	S	S	*	*			trans	-62.7	119.4	159	-122.2	171.1	-177.5	0	0	107.6
32	M	28.1	Very low	32.2	Very low	160 Å²	160	144.9 Å²	144.9	79%	0.788	78%	0.779	S	S	*	*			trans	-134.4	115.1	161.4	-75.7	-163.1	78	0	0	107.6	I30 P34	I30-M32 HydrophobicContact CG2-CG 3.8Å; I30-M32 PolarHBondContact O-N 3.17Å; M32-P34 WeakPolarHBondContact O-CD 3.42Å
33	D	28.9	Very low	32.6	Very low	162 Å²	162	143.9 Å²	143.9	87%	0.866	78%	0.779	S	S	*	*	P	Polyproline II helix	trans	-60.9	124.6	164.1	-84.6	-35.1	0	0	0	109.3
34	P	34.8	Very low	32.8	Very low	110 Å²	110	145.1 Å²	145.1	71%	0.714	79%	0.785	S	S	*	*	P	Polyproline II helix	trans	-82.4	146.1	173	30.6	-30	0	0	0	111.2	M32	M32-P34 WeakPolarHBondContact O-CD 3.42Å
35	P	32.9	Very low	33	Very low	118 Å²	118	147.2 Å²	147.2	77%	0.766	79%	0.787	S	S	*	*	P	Polyproline II helix	trans	-67.4	141.6	173.7	26.9	-31.2	0	0	0	111.3	L37	P35-L37 PolarHBondContact O-N 3.38Å
36	A	31.1	Very low	32.8	Very low	105 Å²	105	146.3 Å²	146.3	87%	0.868	79%	0.792	S	S	*	*	P	Polyproline II helix	trans	-58	124	179.8	0	0	0	0	0	112.2
37	L	35.7	Very low	32.7	Very low	162 Å²	162	145.2 Å²	145.2	85%	0.848	80%	0.796	S	S	*	*	P	Polyproline II helix	trans	-84.3	143.5	171.4	-72.4	169.5	0	0	0	110.9	P35	P35-L37 PolarHBondContact O-N 3.38Å
38	P	38.9	Very low	32.8	Very low	107 Å²	107	141.6 Å²	141.6	70%	0.695	79%	0.791	S	S	*	*	P	Polyproline II helix	trans	-72.6	153.7	179.4	29.5	-33.3	0	0	0	112.3
39	P	33.4	Very low	32.6	Very low	127 Å²	127	141 Å²	141	83%	0.825	80%	0.8	S	S	*	*	P	Polyproline II helix	trans	-69.8	135.4	-177.1	27.4	-31.9	0	0	0	111.8
40	K	38.3	Very low	32.7	Very low	202 Å²	202	138.8 Å²	138.8	88%	0.878	80%	0.804	S	S	*	*	P	Polyproline II helix	trans	-74.3	147.5	172.7	-80.7	-179.2	178.1	172.6	0	111.2
41	P	34	Very low	32.8	Very low	111 Å²	111	140.3 Å²	140.3	72%	0.721	81%	0.813	S	S	*	*	P	Polyproline II helix	trans	-72	153.6	-176.9	29.3	-33.4	0	0	0	112.5
42	P	32	Very low	32.6	Very low	129 Å²	129	135.4 Å²	135.4	84%	0.838	81%	0.81	S	S	*	*	P	Polyproline II helix	trans	-71.9	134.9	-178	29.2	-32.3	0	0	0	111
43	K	36	Very low	33	Very low	196 Å²	196	137.3 Å²	137.3	85%	0.852	82%	0.82	S	S	*	*	P	Polyproline II helix	trans	-83	151	170.3	-81.8	-176.5	178.2	-179.6	0	111
44	P	29.7	Very low	33.3	Very low	119 Å²	119	138.4 Å²	138.4	77%	0.773	82%	0.817	S	S	*	*	P	Polyproline II helix	trans	-71.9	144.1	-166.3	-11.2	27.1	0	0	0	112.8	T46	P44-T46 PolarHBondContact O-N 3.32Å
45	M	35.4	Very low	33.4	Very low	193 Å²	193	141 Å²	141	95%	0.951	83%	0.825	S	S	*	*	P	Polyproline II helix	trans	-66.2	123.7	169.1	-60.6	171.9	78.4	0	0	109.6
46	T	29.7	Very low	33.6	Very low	139 Å²	139	139.4 Å²	139.4	85%	0.853	82%	0.816	S	S	*	*			trans	-110.6	129.1	157.4	35.5	0	0	0	0	109.4	P44	P44-T46 PolarHBondContact O-N 3.32Å
47	S	30	Very low	34.3	Very low	114 Å²	114	139.9 Å²	139.9	80%	0.797	81%	0.813	S	S	*	*			trans	-66.6	150.8	-170.3	36.1	0	0	0	0	114.4
48	A	32.4	Very low	35.7	Very low	94 Å²	94	135.9 Å²	135.9	78%	0.777	80%	0.795	S	S	*	*			trans	-36.2	135.2	174.4	0	0	0	0	0	115.8
49	V	28.3	Very low	37.6	Very low	137 Å²	137	133.5 Å²	133.5	83%	0.83	78%	0.781	S	S	*	*			trans	-123.7	106.5	149.8	-178.4	0	0	0	0	107
50	T	36.4	Very low	40.1	Very low	123 Å²	123	128.9 Å²	128.9	76%	0.755	75%	0.749	S	S	*	*			trans	-66.9	121.3	165.7	42.2	0	0	0	0	109.3
51	N	30.3	Very low	42.3	Very low	162 Å²	162	126 Å²	126	87%	0.866	74%	0.739	S	S	*	*			trans	-164	122.4	152.3	-105.5	-12.7	0	0	0	112.4
52	G	27.9	Very low	44.7	Very low	73 Å²	73	125.3 Å²	125.3	75%	0.753	73%	0.729	S	S	*	*			trans	80.9	88.7	148	0	0	0	0	0	117.5	K54	G52-K54 PolarHBondContact O-N 2.89Å
53	M	37.5	Very low	47.3	Very low	200 Å²	200	119.4 Å²	119.4	99%	0.985	69%	0.692	S	S	*	*			trans	-51	105.9	154.4	-80.5	147.8	126.9	0	0	110.1
54	K	33.7	Very low	49.8	Very low	185 Å²	185	113.9 Å²	113.9	80%	0.804	67%	0.669	S	S	*	*			trans	-105.1	99	149.9	-97.4	-174.3	175.5	-179	0	106.4	G52 S56	G52-K54 PolarHBondContact O-N 2.89Å; K54-S56 PolarHBondContact O-N 3.13Å; K54-S56 PolarHBondContact O-OG 3.2Å
55	D	37.1	Very low	52.8	Low	166 Å²	166	109 Å²	109	89%	0.888	64%	0.635	S	S	*	*			trans	-62.9	86.7	168.9	-147.8	-0.4	0	0	0	107.6
56	S	37.3	Very low	55.5	Low	84 Å²	84	101 Å²	101	59%	0.587	59%	0.594	S	S	*	*			trans	-91.1	100.4	171.3	-41.8	0	0	0	0	102.9	K54 V58	K54-S56 PolarHBondContact O-N 3.13Å; K54-S56 PolarHBondContact O-OG 3.2Å; S56-V58 PolarHBondContact O-N 3Å
57	S	46.3	Very low	58.3	Low	115 Å²	115	95.9 Å²	95.9	80%	0.804	56%	0.559	S	S	*	*			trans	-62.1	89.9	173.9	60.1	0	0	0	0	107.9	S59	S57-S59 PolarHBondContact O-N 3.23Å
58	V	64.3	Low	61.1	Low	78 Å²	78	91.1 Å²	91.1	47%	0.473	53%	0.528	S	S	.	.			trans	-61.3	114.5	177.4	-178.4	0	0	0	0	106	S56 D62	S56-V58 PolarHBondContact O-N 3Å; V58-D62 HydrophobicContact CG1-CB 4.14Å
59	S	80.3	Confident	63.6	Low	57 Å²	57	93.6 Å²	93.6	40%	0.399	53%	0.528	S	S	.	.			trans	-59.8	144.3	175.8	179.6	0	0	0	0	108.6	S57 Q61 D62 A63	S57-S59 PolarHBondContact O-N 3.23Å; S59-Q61 PolarHBondContact O-N 2.74Å; S59-Q61 VanDerWaalsContact O-N 3.13Å; S59-Q61 PolarHBondContact OG-N 3.33Å; S59-D62 WeakPolarHBondContact CB-OD2 3.48Å; S59-D62 WeakPolarHBondContact O-CA 3.36Å; S59-D62 PolarHBondContact O-N 3.13Å; S59-A63 PolarHBondContact O-N 2.93Å
60	L	85.4	Confident	66.4	Low	29 Å²	29	87.6 Å²	87.6	15%	0.152	49%	0.492	C	S	.	.	G	3₁₀ helix	trans	-52.6	-35.9	172.5	176.8	62.1	0	0	0	111	D62 A63 W65 Y66 Y100 V133 V134	L60-D62 PolarHBondContact O-N 3.47Å; L60-A63 WeakPolarHBondContact O-CB 3.49Å; L60-A63 PolarHBondContact O-N 3.47Å; L60-W65 HydrophobicContact CD1-CH2 3.75Å; L60-W65 HydrophobicContact CD1-CZ3 3.83Å; L60-Y66 HydrophobicContact CD1-CD2 4.03Å; L60-Y66 HydrophobicContact CD1-CG 3.99Å; L60-Y66 HydrophobicContact CD2-CE2 4.35Å; L60-Y66 HydrophobicContact CG-CD1 4.17Å; L60-Y66 HydrophobicContact CG-CD2 4.21Å; L60-Y66 HydrophobicContact CG-CE1 4.32Å; L60-Y66 HydrophobicContact CG-CE2 4.38Å; L60-Y66 HydrophobicContact CG-CG 4.1Å; L60-Y66 VanDerWaalsContact O-CD1 3.23Å; L60-Y66 WeakPolarHBondContact O-CD1 3.24Å; L60-Y100 HydrophobicContact CD2-CD1 4.42Å; L60-Y100 HydrophobicContact CD2-CE1 3.66Å; L60-Y100 HydrophobicContact CD2-CE2 4Å; L60-Y100 VanDerWaalsContact CD2-CZ 3.41Å; L60-Y100 WeakPolarHBondContact CD2-OH 3.26Å; L60-V133 HydrophobicContact CD1-CB 3.98Å; L60-V133 HydrophobicContact CD1-CG1 3.94Å; L60-V133 HydrophobicContact CD2-CB 4.31Å; L60-V133 HydrophobicContact CD2-CG2 4.3Å; L60-V134 HydrophobicContact CB-CG2 4.31Å; L60-V134 HydrophobicContact CD1-CG2 4.29Å
61	Q	83.9	Confident	68.8	Low	142 Å²	142	83.7 Å²	83.7	66%	0.664	47%	0.469	S	S	*	.	G	3₁₀ helix	trans	-66.4	-19.8	177.2	-71	-157	11.1	0	0	113.8	S59 R162	S59-Q61 PolarHBondContact O-N 2.74Å; S59-Q61 VanDerWaalsContact O-N 3.13Å; S59-Q61 PolarHBondContact OG-N 3.33Å; Q61-R162 PolarHBondContact O-NH1 3.1Å; Q61-R162 PolarHBondContact O-NH2 3.35Å
62	D	84	Confident	71.3	Confident	97 Å²	97	82.2 Å²	82.2	52%	0.519	45%	0.452	S	S	.	.	G	3₁₀ helix	trans	-96.7	-8.6	178.7	-62.7	-37.5	0	0	0	112.5	V58 S59 L60 E64 Y163	V58-D62 HydrophobicContact CG1-CB 4.14Å; S59-D62 WeakPolarHBondContact CB-OD2 3.48Å; S59-D62 WeakPolarHBondContact O-CA 3.36Å; S59-D62 PolarHBondContact O-N 3.13Å; L60-D62 PolarHBondContact O-N 3.47Å; D62-E64 PolarHBondContact O-N 3.32Å; D62-Y163 PolarHBondContact O-OH 2.7Å
63	A	87.6	Confident	74.1	Confident	5 Å²	5	84.5 Å²	84.5	4%	0.041	44%	0.443	C	S	.	.			trans	-67	129.7	-179.5	0	0	0	0	0	111.3	S59 L60 W65 Y66 R162	S59-A63 PolarHBondContact O-N 2.93Å; L60-A63 WeakPolarHBondContact O-CB 3.49Å; L60-A63 PolarHBondContact O-N 3.47Å; A63-W65 VanDerWaalsContact C-N 3.26Å; A63-W65 HydrophobicContact CB-CD2 4.12Å; A63-W65 HydrophobicContact CB-CE3 4.46Å; A63-W65 HydrophobicContact CB-CH2 4.1Å; A63-W65 HydrophobicContact CB-CZ2 3.74Å; A63-W65 HydrophobicContact CB-CZ3 4.44Å; A63-W65 PolarHBondContact O-N 3.2Å; A63-Y66 PolarHBondContact O-N 3.44Å; A63-Y66 VanDerWaalsContact O-N 3.14Å; A63-R162 PolarHBondContact O-NH1 3.21Å
64	E	88	Confident	76.4	Confident	80 Å²	80	79.3 Å²	79.3	37%	0.374	42%	0.416	S	S	.	.	T	Hydrogen-bonded Turn	trans	-64.6	-29.6	-174.8	65.3	173.2	166.7	0	0	114	D62 Y66 P159 S161 R162 Y163	D62-E64 PolarHBondContact O-N 3.32Å; E64-Y66 VanDerWaalsContact C-N 3.33Å; E64-P159 HydrophobicContact CG-CB 4.4Å; E64-P159 WeakPolarHBondContact OE1-CG 3.46Å; E64-S161 CarbonylContact O-C 3.59Å; E64-S161 WeakPolarHBondContact O-CA 3.37Å; E64-S161 WeakPolarHBondContact OE2-CB 3.36Å; E64-S161 PolarHBondContact OE2-OG 3.35Å; E64-R162 PolarHBondContact O-N 2.92Å; E64-Y163 HydrophobicContact CB-CD2 3.75Å; E64-Y163 HydrophobicContact CB-CE2 3.87Å
65	W	92.1	Very high	79	Confident	16 Å²	16	70.6 Å²	70.6	6%	0.061	38%	0.378	C	S	.	.	T	Hydrogen-bonded Turn	trans	-88	-1.5	-179	45.1	-100.6	0	0	0	113	L60 A63 F87 V89 V133 V134 I137 P159	L60-W65 HydrophobicContact CD1-CH2 3.75Å; L60-W65 HydrophobicContact CD1-CZ3 3.83Å; A63-W65 VanDerWaalsContact C-N 3.26Å; A63-W65 HydrophobicContact CB-CD2 4.12Å; A63-W65 HydrophobicContact CB-CE3 4.46Å; A63-W65 HydrophobicContact CB-CH2 4.1Å; A63-W65 HydrophobicContact CB-CZ2 3.74Å; A63-W65 HydrophobicContact CB-CZ3 4.44Å; A63-W65 PolarHBondContact O-N 3.2Å; W65-F87 HydrophobicContact CB-CE2 3.91Å; W65-F87 HydrophobicContact CB-CZ 4.38Å; W65-F87 HydrophobicContact CD2-CE2 4.23Å; W65-F87 AromaticContact CG-CE2 3.85Å; W65-F87 HydrophobicContact CG-CE2 3.85Å; W65-F87 HydrophobicContact CG-CZ 4.26Å; W65-V89 HydrophobicContact CE3-CB 3.67Å; W65-V89 HydrophobicContact CE3-CG2 3.46Å; W65-V89 VanDerWaalsContact CE3-CG2 3.46Å; W65-V89 HydrophobicContact CZ3-CB 3.7Å; W65-V89 HydrophobicContact CZ3-CG1 4.3Å; W65-V89 HydrophobicContact CZ3-CG2 3.49Å; W65-V89 VanDerWaalsContact CZ3-CG2 3.49Å; W65-V89 PolarHBondContact O-N 2.67Å; W65-V133 HydrophobicContact CH2-CG1 4.04Å; W65-V133 HydrophobicContact CZ3-CG1 4.16Å; W65-V134 HydrophobicContact CH2-CG2 4.24Å; W65-V134 HydrophobicContact CZ2-CG2 4.24Å; W65-I137 HydrophobicContact CD2-CG2 4.13Å; W65-I137 HydrophobicContact CE3-CG1 4.4Å; W65-I137 HydrophobicContact CH2-CB 3.91Å; W65-I137 HydrophobicContact CH2-CG1 3.62Å; W65-I137 HydrophobicContact CH2-CG2 4.25Å; W65-I137 HydrophobicContact CZ2-CB 3.75Å; W65-I137 HydrophobicContact CZ2-CG1 3.99Å; W65-I137 HydrophobicContact CZ2-CG2 3.75Å; W65-I137 HydrophobicContact CZ3-CB 4.49Å; W65-I137 HydrophobicContact CZ3-CG1 3.84Å; W65-P159 HydrophobicContact CB-CB 3.85Å; W65-P159 HydrophobicContact CG-CB 4.36Å
66	Y	92.5	Very high	81.5	Confident	26 Å²	26	65.6 Å²	65.6	10%	0.102	35%	0.351	C	S	.	.	B	Isolated β-bridge	trans	-94.4	112.3	178.2	178.9	-114.9	0	0	0	110.8	L60 A63 E64 V89 D91 Y100 R162	L60-Y66 HydrophobicContact CD1-CD2 4.03Å; L60-Y66 HydrophobicContact CD1-CG 3.99Å; L60-Y66 HydrophobicContact CD2-CE2 4.35Å; L60-Y66 HydrophobicContact CG-CD1 4.17Å; L60-Y66 HydrophobicContact CG-CD2 4.21Å; L60-Y66 HydrophobicContact CG-CE1 4.32Å; L60-Y66 HydrophobicContact CG-CE2 4.38Å; L60-Y66 HydrophobicContact CG-CG 4.1Å; L60-Y66 VanDerWaalsContact O-CD1 3.23Å; L60-Y66 WeakPolarHBondContact O-CD1 3.24Å; A63-Y66 PolarHBondContact O-N 3.44Å; A63-Y66 VanDerWaalsContact O-N 3.14Å; E64-Y66 VanDerWaalsContact C-N 3.33Å; Y66-V89 WeakPolarHBondContact CA-O 3.3Å; Y66-V89 HydrophobicContact CD2-CB 4.42Å; Y66-V89 HydrophobicContact CD2-CG1 4.22Å; Y66-D91 WeakPolarHBondContact CE2-OD1 3.49Å; Y66-D91 PolarHBondContact OH-OD1 3.01Å; Y66-D91 PolarHBondContact OH-OD2 2.96Å; Y66-Y100 AromaticContact CE2-CD1 3.95Å; Y66-Y100 HydrophobicContact CE2-CD1 3.95Å; Y66-Y100 AromaticContact CE2-CE1 3.89Å; Y66-Y100 HydrophobicContact CE2-CE1 3.89Å; Y66-R162 VanDerWaalsContact O-CD 3.31Å; Y66-R162 WeakPolarHBondContact O-CD 3.22Å; Y66-R162 PolarHBondContact O-NH1 3.3Å; Y66-R162 VanDerWaalsContact O-NH1 3.13Å
67	W	89.2	Confident	83.8	Confident	31 Å²	31	66.2 Å²	66.2	12%	0.117	35%	0.348	C	S	.	.			trans	-101.5	1.8	-174.5	-76.4	76.9	0	0	0	114.2	I70 K78 V89 V160 R162	W67-I70 HydrophobicContact CB-CB 4.18Å; W67-I70 HydrophobicContact CB-CD1 4.42Å; W67-I70 HydrophobicContact CB-CG2 3.56Å; W67-I70 HydrophobicContact CD2-CD1 4.2Å; W67-I70 HydrophobicContact CE3-CD1 3.77Å; W67-I70 HydrophobicContact CZ3-CD1 4.48Å; W67-K78 HydrophobicContact CD2-CD 4.43Å; W67-K78 HydrophobicContact CE3-CD 4.36Å; W67-K78 HydrophobicContact CH2-CD 4.01Å; W67-K78 HydrophobicContact CZ2-CD 4.02Å; W67-K78 HydrophobicContact CZ3-CD 4.18Å; W67-V89 PolarHBondContact N-O 3.1Å; W67-V160 HydrophobicContact CZ2-CG1 3.88Å; W67-V160 PolarHBondContact NE1-O 3.26Å; W67-R162 HydrophobicContact CD2-CB 4.16Å; W67-R162 HydrophobicContact CE3-CB 4.39Å; W67-R162 HydrophobicContact CH2-CB 4.2Å; W67-R162 VanDerWaalsContact CZ2-CA 3.41Å; W67-R162 HydrophobicContact CZ2-CB 3.99Å; W67-R162 HydrophobicContact CZ3-CB 4.4Å
68	G	88.1	Confident	85.7	Confident	14 Å²	14	63.4 Å²	63.4	14%	0.144	32%	0.321	C	S	.	.	S	Bend	trans	60.8	-137.4	-179.7	0	0	0	0	0	113	I70 R90 D91	G68-I70 PolarHBondContact O-N 3.24Å; G68-R90 CarbonylContact O-C 3.53Å; G68-R90 WeakPolarHBondContact O-CA 3.38Å; G68-R90 WeakPolarHBondContact O-CB 3.45Å; G68-D91 PolarHBondContact O-N 3.38Å
69	D	86.1	Confident	86.9	Confident	145 Å²	145	59.7 Å²	59.7	78%	0.775	30%	0.299	S	S	*	.	S	Bend	trans	-80.4	56.8	-176.6	-162.8	15.8	0	0	0	113	D91	D69-D91 PolarHBondContact N-OD2 3.48Å
70	I	86.3	Confident	87.2	Confident	12 Å²	12	63.1 Å²	63.1	6%	0.062	30%	0.303	C	S	.	.			trans	-86.7	140.4	173.6	-172.7	170.7	0	0	0	111	W67 G68 E74 V75 K78 R90	W67-I70 HydrophobicContact CB-CB 4.18Å; W67-I70 HydrophobicContact CB-CD1 4.42Å; W67-I70 HydrophobicContact CB-CG2 3.56Å; W67-I70 HydrophobicContact CD2-CD1 4.2Å; W67-I70 HydrophobicContact CE3-CD1 3.77Å; W67-I70 HydrophobicContact CZ3-CD1 4.48Å; G68-I70 PolarHBondContact O-N 3.24Å; I70-E74 HydrophobicContact CD1-CB 3.77Å; I70-E74 HydrophobicContact CG1-CB 3.62Å; I70-E74 HydrophobicContact CG1-CG 4.42Å; I70-E74 WeakPolarHBondContact CG1-OE2 3.49Å; I70-V75 HydrophobicContact CD1-CG2 4.21Å; I70-V75 HydrophobicContact CG1-CG2 4.22Å; I70-V75 HydrophobicContact CG2-CG2 3.69Å; I70-K78 HydrophobicContact CD1-CD 3.9Å; I70-R90 HydrophobicContact CG2-CB 3.43Å; I70-R90 VanDerWaalsContact CG2-CB 3.43Å; I70-R90 HydrophobicContact CG2-CG 4.33Å; I70-R90 VanDerWaalsContact O-CD 3.26Å; I70-R90 WeakPolarHBondContact O-CD 3.41Å
71	S	86.1	Confident	87.3	Confident	41 Å²	41	68.1 Å²	68.1	29%	0.287	33%	0.33	S	S	.	.			trans	-68.9	160.5	-179.8	69.2	0	0	0	0	112.8	E73 E74 V75	S71-E73 VanDerWaalsContact C-N 3.26Å; S71-E73 PolarHBondContact O-N 3.4Å; S71-E74 WeakPolarHBondContact CB-OE2 3.04Å; S71-E74 PolarHBondContact N-OE2 3.25Å; S71-E74 WeakPolarHBondContact OG-CB 3.44Å; S71-E74 VanDerWaalsContact OG-CD 3.32Å; S71-E74 WeakPolarHBondContact OG-CG 3.11Å; S71-E74 PolarHBondContact OG-N 2.86Å; S71-E74 PolarHBondContact OG-OE2 2.77Å; S71-V75 WeakPolarHBondContact O-CG2 3.38Å; S71-V75 PolarHBondContact O-N 3.3Å
72	R	84.6	Confident	87.6	Confident	131 Å²	131	65.3 Å²	65.3	49%	0.494	32%	0.318	S	S	.	.	H	α-helix	trans	-64.2	-37.5	177.6	178.2	-176	-68.8	-176.3	-0.8	110.9	V75 N76	R72-V75 PolarHBondContact O-N 3.29Å; R72-N76 PolarHBondContact O-N 3.43Å; R72-N76 PolarHBondContact O-ND2 3.45Å
73	E	86.1	Confident	87.9	Confident	120 Å²	120	63.5 Å²	63.5	56%	0.561	31%	0.312	S	S	*	.	H	α-helix	trans	-63.3	-49	-178.8	-65.1	64.8	-140.4	0	0	110	S71 V75 N76 D77	S71-E73 VanDerWaalsContact C-N 3.26Å; S71-E73 PolarHBondContact O-N 3.4Å; E73-V75 VanDerWaalsContact C-N 3.33Å; E73-V75 PolarHBondContact O-N 3.32Å; E73-N76 WeakPolarHBondContact O-CB 3.39Å; E73-N76 PolarHBondContact O-N 3.29Å; E73-N76 VanDerWaalsContact O-N 3.15Å; E73-D77 PolarHBondContact O-N 2.97Å
74	E	84.9	Confident	88.1	Confident	92 Å²	92	66.3 Å²	66.3	43%	0.43	33%	0.326	S	S	.	.	H	α-helix	trans	-63.6	-36.7	177.2	-70.4	169.5	106.4	0	0	112.9	I70 S71 D77 K78	I70-E74 HydrophobicContact CD1-CB 3.77Å; I70-E74 HydrophobicContact CG1-CB 3.62Å; I70-E74 HydrophobicContact CG1-CG 4.42Å; I70-E74 WeakPolarHBondContact CG1-OE2 3.49Å; S71-E74 WeakPolarHBondContact CB-OE2 3.04Å; S71-E74 PolarHBondContact N-OE2 3.25Å; S71-E74 WeakPolarHBondContact OG-CB 3.44Å; S71-E74 VanDerWaalsContact OG-CD 3.32Å; S71-E74 WeakPolarHBondContact OG-CG 3.11Å; S71-E74 PolarHBondContact OG-N 2.86Å; S71-E74 PolarHBondContact OG-OE2 2.77Å; E74-D77 PolarHBondContact O-N 2.88Å; E74-K78 VanDerWaalsContact O-CG 3.32Å; E74-K78 WeakPolarHBondContact O-CG 3.2Å; E74-K78 PolarHBondContact O-N 3.24Å
75	V	89.2	Confident	88.2	Confident	2 Å²	2	62.5 Å²	62.5	1%	0.012	31%	0.308	C	S	.	.	H	α-helix	trans	-64	-42.7	173.9	168.9	0	0	0	0	111.4	I70 S71 R72 E73 D77 K78 L79 L88 T103	I70-V75 HydrophobicContact CD1-CG2 4.21Å; I70-V75 HydrophobicContact CG1-CG2 4.22Å; I70-V75 HydrophobicContact CG2-CG2 3.69Å; S71-V75 WeakPolarHBondContact O-CG2 3.38Å; S71-V75 PolarHBondContact O-N 3.3Å; R72-V75 PolarHBondContact O-N 3.29Å; E73-V75 VanDerWaalsContact C-N 3.33Å; E73-V75 PolarHBondContact O-N 3.32Å; V75-D77 VanDerWaalsContact C-N 3.3Å; V75-D77 PolarHBondContact O-N 3.35Å; V75-K78 PolarHBondContact O-N 3.29Å; V75-L79 HydrophobicContact CG1-CD1 3.83Å; V75-L79 HydrophobicContact CG1-CG 4.47Å; V75-L79 WeakPolarHBondContact O-CB 3.5Å; V75-L79 WeakPolarHBondContact O-CG 3.07Å; V75-L79 PolarHBondContact O-N 3.01Å; V75-L88 HydrophobicContact CB-CD1 4.36Å; V75-L88 HydrophobicContact CG1-CD1 3.86Å; V75-L88 HydrophobicContact CG1-CD2 4.15Å; V75-L88 HydrophobicContact CG1-CG 4.22Å; V75-L88 HydrophobicContact CG2-CD1 3.57Å; V75-L88 HydrophobicContact CG2-CD2 4.28Å; V75-T103 HydrophobicContact CG1-CG2 3.76Å
76	N	89.2	Confident	88.3	Confident	60 Å²	60	61.9 Å²	61.9	32%	0.321	31%	0.306	S	S	.	.	H	α-helix	trans	-61.7	-40.7	178	-77.6	-28.3	0	0	0	111.7	R72 E73 L79 R80 N110	R72-N76 PolarHBondContact O-N 3.43Å; R72-N76 PolarHBondContact O-ND2 3.45Å; E73-N76 WeakPolarHBondContact O-CB 3.39Å; E73-N76 PolarHBondContact O-N 3.29Å; E73-N76 VanDerWaalsContact O-N 3.15Å; N76-L79 PolarHBondContact O-N 2.77Å; N76-R80 PolarHBondContact O-N 3.44Å; N76-R80 VanDerWaalsContact O-N 3.07Å; N76-N110 PolarHBondContact OD1-ND2 2.82Å
77	D	85.9	Confident	88.5	Confident	97 Å²	97	60.8 Å²	60.8	52%	0.519	30%	0.302	S	S	.	.	H	α-helix	trans	-68.8	-39.7	177.5	-74.8	-21.6	0	0	0	112.5	E73 E74 V75 L79 R80	E73-D77 PolarHBondContact O-N 2.97Å; E74-D77 PolarHBondContact O-N 2.88Å; V75-D77 VanDerWaalsContact C-N 3.3Å; V75-D77 PolarHBondContact O-N 3.35Å; D77-L79 VanDerWaalsContact C-N 3.31Å; D77-L79 PolarHBondContact O-N 3.47Å; D77-R80 WeakPolarHBondContact O-CB 3.36Å; D77-R80 PolarHBondContact O-N 2.88Å; D77-R80 IonicContact OD1-CZ 3.09Å; D77-R80 IonicContact OD1-NE 3.85Å; D77-R80 IonicContact OD1-NH2 3.64Å; D77-R80 PolarHBondContact OD1-NH2 2.92Å
78	K	86.3	Confident	88.7	Confident	56 Å²	56	59.3 Å²	59.3	24%	0.243	30%	0.296	C	S	.	.	H	α-helix	trans	-65.1	-34.1	175.7	-73.9	175.9	-169.3	-66.3	0	113.2	W67 I70 E74 V75 L88	W67-K78 HydrophobicContact CD2-CD 4.43Å; W67-K78 HydrophobicContact CE3-CD 4.36Å; W67-K78 HydrophobicContact CH2-CD 4.01Å; W67-K78 HydrophobicContact CZ2-CD 4.02Å; W67-K78 HydrophobicContact CZ3-CD 4.18Å; I70-K78 HydrophobicContact CD1-CD 3.9Å; E74-K78 VanDerWaalsContact O-CG 3.32Å; E74-K78 WeakPolarHBondContact O-CG 3.2Å; E74-K78 PolarHBondContact O-N 3.24Å; V75-K78 PolarHBondContact O-N 3.29Å; K78-L88 HydrophobicContact CB-CD2 4.47Å; K78-L88 HydrophobicContact CD-CD2 4.44Å
79	L	88.6	Confident	89	Confident	0 Å²	0	58.6 Å²	58.6	0%	0	29%	0.289	C	S	.	.	T	Hydrogen-bonded Turn	trans	-89.1	-3.4	179.2	-66.8	175.9	0	0	0	113	V75 N76 D77 M82 T86 L88 T103 R105 V160	V75-L79 HydrophobicContact CG1-CD1 3.83Å; V75-L79 HydrophobicContact CG1-CG 4.47Å; V75-L79 WeakPolarHBondContact O-CB 3.5Å; V75-L79 WeakPolarHBondContact O-CG 3.07Å; V75-L79 PolarHBondContact O-N 3.01Å; N76-L79 PolarHBondContact O-N 2.77Å; D77-L79 VanDerWaalsContact C-N 3.31Å; D77-L79 PolarHBondContact O-N 3.47Å; L79-M82 PolarHBondContact O-N 2.89Å; L79-T86 HydrophobicContact CD2-CG2 3.55Å; L79-L88 HydrophobicContact CG-CD2 4.4Å; L79-T103 HydrophobicContact CD1-CG2 3.47Å; L79-T103 VanDerWaalsContact CD1-CG2 3.47Å; L79-R105 WeakPolarHBondContact O-CD 3.38Å; L79-R105 PolarHBondContact O-NE 3.39Å; L79-R105 PolarHBondContact O-NH1 3.44Å; L79-V160 HydrophobicContact CD2-CG2 3.7Å
80	R	87.6	Confident	89.3	Confident	130 Å²	130	52 Å²	52	49%	0.491	25%	0.254	S	S	.	.	T	Hydrogen-bonded Turn	trans	-61.6	136.4	179.1	-164.1	-176.2	-64.4	-105.1	2.2	110.5	N76 D77 M82	N76-R80 PolarHBondContact O-N 3.44Å; N76-R80 VanDerWaalsContact O-N 3.07Å; D77-R80 WeakPolarHBondContact O-CB 3.36Å; D77-R80 PolarHBondContact O-N 2.88Å; D77-R80 IonicContact OD1-CZ 3.09Å; D77-R80 IonicContact OD1-NE 3.85Å; D77-R80 IonicContact OD1-NH2 3.64Å; D77-R80 PolarHBondContact OD1-NH2 2.92Å; R80-M82 PolarHBondContact O-N 3.21Å
81	D	87.1	Confident	89.5	Confident	133 Å²	133	53.5 Å²	53.5	71%	0.711	26%	0.262	S	S	*	.	T	Hydrogen-bonded Turn	trans	52.9	22.5	-179.2	-49.8	-36	0	0	0	116.4
82	M	90	Very high	89.3	Confident	83 Å²	83	52.2 Å²	52.2	41%	0.409	25%	0.253	S	S	.	.	P	Polyproline II helix	trans	-87.2	154.6	176.1	-69.1	-81.7	67.6	0	0	113	L79 R80 T86 R105	L79-M82 PolarHBondContact O-N 2.89Å; R80-M82 PolarHBondContact O-N 3.21Å; M82-T86 HydrophobicContact CB-CG2 3.92Å; M82-T86 HydrophobicContact CG-CG2 4.19Å; M82-T86 HydrophobicContact SD-CG2 4.47Å; M82-R105 VanDerWaalsContact O-CD 3.26Å; M82-R105 WeakPolarHBondContact O-CD 3.5Å; M82-R105 PolarHBondContact O-NE 3.25Å
83	P	90.8	Very high	88.9	Confident	60 Å²	60	50.4 Å²	50.4	39%	0.39	26%	0.261	S	S	.	.	P	Polyproline II helix	trans	-67	161.7	177.6	28.3	-35.3	0	0	0	111.9	T86 Y158	P83-T86 WeakPolarHBondContact O-CB 3.33Å; P83-T86 PolarHBondContact O-N 2.91Å; P83-T86 PolarHBondContact O-OG1 3.48Å; P83-Y158 HydrophobicContact CB-CD2 4.41Å; P83-Y158 HydrophobicContact CB-CE2 4.14Å; P83-Y158 HydrophobicContact CG-CD2 3.75Å; P83-Y158 HydrophobicContact CG-CE2 3.83Å; P83-Y158 HydrophobicContact CG-CG 4.49Å
84	D	91.7	Very high	88.1	Confident	63 Å²	63	48.1 Å²	48.1	34%	0.337	26%	0.255	S	S	.	.	T	Hydrogen-bonded Turn	trans	-60.5	138.6	171.7	-81.6	14.8	0	0	0	110.7	R105 K106 G107 M157	D84-R105 WeakPolarHBondContact CA-O 3.46Å; D84-K106 WeakPolarHBondContact OD1-CA 3.37Å; D84-G107 PolarHBondContact OD1-N 3.34Å; D84-G107 PolarHBondContact OD2-N 3.49Å; D84-M157 WeakPolarHBondContact O-CE 3.46Å
85	G	90.3	Very high	86.8	Confident	0 Å²	0	54 Å²	54	0%	0	28%	0.279	C	S	.	.	T	Hydrogen-bonded Turn	trans	92.2	-1.5	-174.5	0	0	0	0	0	114.4	R105 K155 M157 Y158	G85-R105 PolarHBondContact N-O 3.28Å; G85-K155 WeakPolarHBondContact CA-O 3.33Å; G85-M157 PolarHBondContact O-N 3.33Å; G85-Y158 PolarHBondContact O-N 3Å
86	T	94.4	Very high	85.5	Confident	4 Å²	4	60.5 Å²	60.5	3%	0.025	31%	0.311	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-73.8	132.7	170.4	-56.1	0	0	0	0	111.3	L79 M82 P83 L104 R105 Y158 V160	L79-T86 HydrophobicContact CD2-CG2 3.55Å; M82-T86 HydrophobicContact CB-CG2 3.92Å; M82-T86 HydrophobicContact CG-CG2 4.19Å; M82-T86 HydrophobicContact SD-CG2 4.47Å; P83-T86 WeakPolarHBondContact O-CB 3.33Å; P83-T86 PolarHBondContact O-N 2.91Å; P83-T86 PolarHBondContact O-OG1 3.48Å; T86-L104 WeakPolarHBondContact O-CA 3.49Å; T86-R105 PolarHBondContact O-N 3.05Å; T86-Y158 VanDerWaalsContact CA-O 3.29Å; T86-Y158 WeakPolarHBondContact CA-O 3.41Å; T86-V160 HydrophobicContact CG2-CG2 3.45Å; T86-V160 VanDerWaalsContact CG2-CG2 3.45Å
87	F	95.3	Very high	84	Confident	2 Å²	2	67.2 Å²	67.2	1%	0.009	34%	0.341	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-149.1	160.5	-173	76.8	-80.3	0	0	0	114.2	W65 L102 T103 L104 I137 L156 Y158 P159 V160	W65-F87 HydrophobicContact CB-CE2 3.91Å; W65-F87 HydrophobicContact CB-CZ 4.38Å; W65-F87 HydrophobicContact CD2-CE2 4.23Å; W65-F87 AromaticContact CG-CE2 3.85Å; W65-F87 HydrophobicContact CG-CE2 3.85Å; W65-F87 HydrophobicContact CG-CZ 4.26Å; F87-L102 HydrophobicContact CB-CD1 4.03Å; F87-L102 HydrophobicContact CD2-CD1 3.76Å; F87-L102 HydrophobicContact CG-CD1 4.31Å; F87-T103 WeakPolarHBondContact CA-O 3.46Å; F87-L104 HydrophobicContact CB-CD1 4.21Å; F87-I137 HydrophobicContact CE2-CG2 3.59Å; F87-I137 HydrophobicContact CZ-CG2 3.94Å; F87-L156 HydrophobicContact CB-CD2 3.94Å; F87-L156 HydrophobicContact CD1-CB 3.69Å; F87-L156 HydrophobicContact CD1-CD2 4.16Å; F87-L156 HydrophobicContact CD1-CG 4.45Å; F87-L156 HydrophobicContact CD2-CB 4.46Å; F87-L156 HydrophobicContact CD2-CD1 4.32Å; F87-L156 HydrophobicContact CD2-CD2 4.29Å; F87-L156 HydrophobicContact CE1-CB 3.6Å; F87-L156 HydrophobicContact CE2-CB 4.39Å; F87-L156 HydrophobicContact CE2-CD1 4.34Å; F87-L156 HydrophobicContact CG-CB 4.13Å; F87-L156 HydrophobicContact CG-CD2 3.86Å; F87-L156 HydrophobicContact CG-CG 4.42Å; F87-L156 HydrophobicContact CZ-CB 3.97Å; F87-Y158 PolarHBondContact N-O 2.96Å; F87-P159 HydrophobicContact CE1-CB 3.91Å; F87-P159 HydrophobicContact CZ-CB 3.8Å; F87-V160 PolarHBondContact O-N 2.64Å
88	L	94.6	Very high	82.9	Confident	0 Å²	0	63.4 Å²	63.4	0%	0	32%	0.324	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-152.1	161.3	166.7	62.1	85.7	0	0	0	111	V75 K78 L79 T103 V160	V75-L88 HydrophobicContact CB-CD1 4.36Å; V75-L88 HydrophobicContact CG1-CD1 3.86Å; V75-L88 HydrophobicContact CG1-CD2 4.15Å; V75-L88 HydrophobicContact CG1-CG 4.22Å; V75-L88 HydrophobicContact CG2-CD1 3.57Å; V75-L88 HydrophobicContact CG2-CD2 4.28Å; K78-L88 HydrophobicContact CB-CD2 4.47Å; K78-L88 HydrophobicContact CD-CD2 4.44Å; L79-L88 HydrophobicContact CG-CD2 4.4Å; L88-T103 PolarHBondContact N-O 3.02Å; L88-T103 PolarHBondContact O-N 3.29Å; L88-V160 HydrophobicContact CB-CB 4.18Å; L88-V160 HydrophobicContact CD2-CB 4.1Å; L88-V160 HydrophobicContact CD2-CG1 4.28Å; L88-V160 HydrophobicContact CD2-CG2 4.28Å
89	V	94.5	Very high	82.6	Confident	0 Å²	0	62.1 Å²	62.1	0%	0	32%	0.32	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-116.4	136	174.9	-178.1	0	0	0	0	109.8	W65 Y66 W67 T101 L102 I115 I137	W65-V89 HydrophobicContact CE3-CB 3.67Å; W65-V89 HydrophobicContact CE3-CG2 3.46Å; W65-V89 VanDerWaalsContact CE3-CG2 3.46Å; W65-V89 HydrophobicContact CZ3-CB 3.7Å; W65-V89 HydrophobicContact CZ3-CG1 4.3Å; W65-V89 HydrophobicContact CZ3-CG2 3.49Å; W65-V89 VanDerWaalsContact CZ3-CG2 3.49Å; W65-V89 PolarHBondContact O-N 2.67Å; Y66-V89 WeakPolarHBondContact CA-O 3.3Å; Y66-V89 HydrophobicContact CD2-CB 4.42Å; Y66-V89 HydrophobicContact CD2-CG1 4.22Å; W67-V89 PolarHBondContact N-O 3.1Å; V89-T101 WeakPolarHBondContact CA-O 3.49Å; V89-L102 HydrophobicContact CG2-CB 4.38Å; V89-L102 HydrophobicContact CG2-CD1 3.87Å; V89-I115 HydrophobicContact CG1-CD1 4.14Å; V89-I115 HydrophobicContact CG2-CD1 4.5Å; V89-I137 HydrophobicContact CG2-CD1 3.83Å; V89-I137 HydrophobicContact CG2-CG1 4.16Å
90	R	92.1	Very high	82.6	Confident	7 Å²	7	63.9 Å²	63.9	3%	0.026	33%	0.327	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-131.4	167.2	175.6	64.5	165.8	178.9	93.7	0.1	111.3	G68 I70 S93 T101	G68-R90 CarbonylContact O-C 3.53Å; G68-R90 WeakPolarHBondContact O-CA 3.38Å; G68-R90 WeakPolarHBondContact O-CB 3.45Å; I70-R90 HydrophobicContact CG2-CB 3.43Å; I70-R90 VanDerWaalsContact CG2-CB 3.43Å; I70-R90 HydrophobicContact CG2-CG 4.33Å; I70-R90 VanDerWaalsContact O-CD 3.26Å; I70-R90 WeakPolarHBondContact O-CD 3.41Å; R90-S93 PolarHBondContact NH1-OG 3.29Å; R90-T101 PolarHBondContact N-O 3.25Å; R90-T101 PolarHBondContact O-N 3.23Å
91	D	89.1	Confident	82.9	Confident	43 Å²	43	58.4 Å²	58.4	23%	0.23	31%	0.308	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-65.7	142.6	171.5	-63.7	-18.5	0	0	0	110	Y66 G68 D69 Y100	Y66-D91 WeakPolarHBondContact CE2-OD1 3.49Å; Y66-D91 PolarHBondContact OH-OD1 3.01Å; Y66-D91 PolarHBondContact OH-OD2 2.96Å; G68-D91 PolarHBondContact O-N 3.38Å; D69-D91 PolarHBondContact N-OD2 3.48Å; D91-Y100 WeakPolarHBondContact OD1-CE1 3.35Å
92	A	83.9	Confident	83.2	Confident	14 Å²	14	52.1 Å²	52.1	12%	0.116	27%	0.274	C	S	.	.			trans	-68.8	145.7	174.3	0	0	0	0	0	110.1	T94 D99	A92-T94 PolarHBondContact O-N 3.05Å; A92-T94 VanDerWaalsContact O-N 3.08Å; A92-D99 HydrophobicContact CB-CB 3.58Å; A92-D99 WeakPolarHBondContact CB-O 3.47Å; A92-D99 PolarHBondContact N-O 3.14Å
93	S	75.7	Confident	83.4	Confident	93 Å²	93	48.2 Å²	48.2	65%	0.65	26%	0.255	S	S	*	.	S	Bend	trans	-66.8	-12.2	179.4	-52.4	0	0	0	0	113.1	R90	R90-S93 PolarHBondContact NH1-OG 3.29Å
94	T	68.2	Low	83.6	Confident	72 Å²	72	45.4 Å²	45.4	44%	0.442	24%	0.237	S	C	.	.	S	Bend	trans	-83	125.7	171.8	44.8	0	0	0	0	109.7	A92 M96	A92-T94 PolarHBondContact O-N 3.05Å; A92-T94 VanDerWaalsContact O-N 3.08Å; T94-M96 PolarHBondContact O-N 3.49Å
95	K	58.5	Low	83.7	Confident	214 Å²	214	43.8 Å²	43.8	93%	0.93	23%	0.226	S	C	*	.			trans	-64.2	16.8	178.2	-70.9	-172.2	176.2	-175.1	0	115.4
96	M	60.9	Low	83.7	Confident	139 Å²	139	45.7 Å²	45.7	69%	0.685	23%	0.234	S	C	*	.			trans	-80.3	121.1	175.1	-64.9	-64.6	149.9	0	0	108.7	T94 G98 D99	T94-M96 PolarHBondContact O-N 3.49Å; M96-G98 PolarHBondContact O-N 3Å; M96-D99 PolarHBondContact O-N 3.42Å
97	Q	58.7	Low	83.4	Confident	202 Å²	202	48 Å²	48	94%	0.944	26%	0.259	S	S	*	.	T	Hydrogen-bonded Turn	trans	-66.4	116	-174.2	-148.7	163.5	7.1	0	0	110.1
98	G	63.5	Low	83	Confident	17 Å²	17	50 Å²	50	18%	0.175	28%	0.281	C	S	.	.	T	Hydrogen-bonded Turn	trans	108.5	-0.1	176.4	0	0	0	0	0	116.4	M96 Y100 H117	M96-G98 PolarHBondContact O-N 3Å; G98-Y100 WeakPolarHBondContact O-CD2 3.45Å; G98-Y100 WeakPolarHBondContact O-CE2 3.04Å; G98-H117 WeakPolarHBondContact O-CB 3.42Å
99	D	78.2	Confident	82.8	Confident	29 Å²	29	54.7 Å²	54.7	16%	0.155	31%	0.305	C	S	.	.			trans	-85.3	123.8	171.6	-82.6	-5.8	0	0	0	110.5	A92 M96 K114	A92-D99 HydrophobicContact CB-CB 3.58Å; A92-D99 WeakPolarHBondContact CB-O 3.47Å; A92-D99 PolarHBondContact N-O 3.14Å; M96-D99 PolarHBondContact O-N 3.42Å; D99-K114 IonicContact OD1-NZ 3.1Å; D99-K114 WeakPolarHBondContact OD2-CE 3.43Å; D99-K114 IonicContact OD2-NZ 2.67Å; D99-K114 PolarHBondContact OD2-NZ 3.07Å
100	Y	90.3	Very high	82.7	Confident	37 Å²	37	56.5 Å²	56.5	15%	0.145	32%	0.315	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-117.4	156.1	177	-55.8	-79.9	0	0	0	111.2	L60 Y66 D91 G98 I115 Y122 V133	L60-Y100 HydrophobicContact CD2-CD1 4.42Å; L60-Y100 HydrophobicContact CD2-CE1 3.66Å; L60-Y100 HydrophobicContact CD2-CE2 4Å; L60-Y100 VanDerWaalsContact CD2-CZ 3.41Å; L60-Y100 WeakPolarHBondContact CD2-OH 3.26Å; Y66-Y100 AromaticContact CE2-CD1 3.95Å; Y66-Y100 HydrophobicContact CE2-CD1 3.95Å; Y66-Y100 AromaticContact CE2-CE1 3.89Å; Y66-Y100 HydrophobicContact CE2-CE1 3.89Å; D91-Y100 WeakPolarHBondContact OD1-CE1 3.35Å; G98-Y100 WeakPolarHBondContact O-CD2 3.45Å; G98-Y100 WeakPolarHBondContact O-CE2 3.04Å; Y100-I115 PolarHBondContact N-O 2.99Å; Y100-I115 PolarHBondContact O-N 3.07Å; Y100-Y122 HydrophobicContact CD2-CE1 4.48Å; Y100-Y122 HydrophobicContact CE2-CE1 4.07Å; Y100-V133 HydrophobicContact CD2-CG2 3.6Å; Y100-V133 HydrophobicContact CE2-CG2 3.71Å; Y100-V133 HydrophobicContact CG-CG2 4.45Å
101	T	92.5	Very high	82.7	Confident	15 Å²	15	60.1 Å²	60.1	9%	0.092	33%	0.331	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-119.8	118.3	173.7	-50.6	0	0	0	0	109.8	V89 R90 L112	V89-T101 WeakPolarHBondContact CA-O 3.49Å; R90-T101 PolarHBondContact N-O 3.25Å; R90-T101 PolarHBondContact O-N 3.23Å; T101-L112 HydrophobicContact CG2-CB 4.31Å; T101-L112 HydrophobicContact CG2-CD2 4.49Å
102	L	93.7	Very high	82.8	Confident	0 Å²	0	62 Å²	62	0%	0	34%	0.34	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-84.2	125.7	166.4	170	65.3	0	0	0	108.6	F87 V89 I113 I115 F124 I137 L156	F87-L102 HydrophobicContact CB-CD1 4.03Å; F87-L102 HydrophobicContact CD2-CD1 3.76Å; F87-L102 HydrophobicContact CG-CD1 4.31Å; V89-L102 HydrophobicContact CG2-CB 4.38Å; V89-L102 HydrophobicContact CG2-CD1 3.87Å; L102-I113 HydrophobicContact CB-CB 4.33Å; L102-I113 HydrophobicContact CD2-CD1 4.23Å; L102-I113 PolarHBondContact N-O 3.47Å; L102-I113 PolarHBondContact O-N 3.22Å; L102-I115 HydrophobicContact CB-CD1 4.1Å; L102-I115 HydrophobicContact CB-CG1 4.42Å; L102-F124 HydrophobicContact CD2-CE1 3.79Å; L102-F124 HydrophobicContact CD2-CZ 3.59Å; L102-I137 HydrophobicContact CD1-CD1 3.98Å; L102-I137 HydrophobicContact CD2-CD1 4.14Å; L102-L156 HydrophobicContact CD1-CD2 4.35Å; L102-L156 HydrophobicContact CD2-CD1 4.23Å; L102-L156 HydrophobicContact CD2-CD2 4.22Å
103	T	94.3	Very high	83.1	Confident	2 Å²	2	61.7 Å²	61.7	1%	0.012	34%	0.337	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-111.6	124.9	170.8	-48.4	0	0	0	0	109.1	V75 L79 F87 L88 N110 K111 L112	V75-T103 HydrophobicContact CG1-CG2 3.76Å; L79-T103 HydrophobicContact CD1-CG2 3.47Å; L79-T103 VanDerWaalsContact CD1-CG2 3.47Å; F87-T103 WeakPolarHBondContact CA-O 3.46Å; L88-T103 PolarHBondContact N-O 3.02Å; L88-T103 PolarHBondContact O-N 3.29Å; T103-N110 HydrophobicContact CG2-CB 4.06Å; T103-K111 WeakPolarHBondContact CA-O 3.25Å; T103-L112 HydrophobicContact CG2-CD1 4.41Å; T103-L112 HydrophobicContact CG2-CG 4.43Å
104	L	94.3	Very high	83.8	Confident	0 Å²	0	60.9 Å²	60.9	0%	0	32%	0.322	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-127.8	135.7	-174.6	165.5	68.4	0	0	0	110.5	T86 F87 K111 L145 V154 L156	T86-L104 WeakPolarHBondContact O-CA 3.49Å; F87-L104 HydrophobicContact CB-CD1 4.21Å; L104-K111 PolarHBondContact N-O 2.9Å; L104-K111 PolarHBondContact O-N 3.44Å; L104-L145 HydrophobicContact CD2-CD1 3.26Å; L104-V154 HydrophobicContact CD1-CG1 4.35Å; L104-V154 HydrophobicContact CD2-CG1 3.68Å; L104-V154 HydrophobicContact CG-CG1 4.38Å; L104-L156 HydrophobicContact CD1-CD2 3.93Å; L104-L156 HydrophobicContact CD2-CD2 4.3Å
105	R	94.6	Very high	84.9	Confident	29 Å²	29	57.4 Å²	57.4	11%	0.109	30%	0.3	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-87	126	173.3	-171.7	145.8	169.1	139	0.9	111.4	L79 M82 D84 G85 T86	L79-R105 WeakPolarHBondContact O-CD 3.38Å; L79-R105 PolarHBondContact O-NE 3.39Å; L79-R105 PolarHBondContact O-NH1 3.44Å; M82-R105 VanDerWaalsContact O-CD 3.26Å; M82-R105 WeakPolarHBondContact O-CD 3.5Å; M82-R105 PolarHBondContact O-NE 3.25Å; D84-R105 WeakPolarHBondContact CA-O 3.46Å; G85-R105 PolarHBondContact N-O 3.28Å; T86-R105 PolarHBondContact O-N 3.05Å
106	K	91.3	Very high	86.2	Confident	41 Å²	41	52.5 Å²	52.5	18%	0.178	28%	0.277	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-148.3	129.7	173.6	-177.2	174	-178	166.6	0	111.5	D84 G108 N109 K111 K151 L152 D153 V154	D84-K106 WeakPolarHBondContact OD1-CA 3.37Å; K106-G108 VanDerWaalsContact C-N 3.27Å; K106-G108 PolarHBondContact O-N 3.34Å; K106-N109 PolarHBondContact N-O 3.09Å; K106-N109 PolarHBondContact O-N 2.98Å; K106-N109 VanDerWaalsContact O-N 3.14Å; K106-K111 HydrophobicContact CB-CG 4.42Å; K106-K151 WeakPolarHBondContact CE-O 3.39Å; K106-K151 PolarHBondContact NZ-O 2.8Å; K106-L152 HydrophobicContact CD-CD2 3.96Å; K106-D153 PolarHBondContact NZ-O 3.43Å; K106-V154 HydrophobicContact CB-CG1 4.47Å; K106-V154 HydrophobicContact CD-CB 4.28Å; K106-V154 HydrophobicContact CD-CG1 3.92Å; K106-V154 HydrophobicContact CG-CG1 4.45Å
107	G	87.7	Confident	87.4	Confident	53 Å²	53	49.4 Å²	49.4	55%	0.546	26%	0.26	S	S	.	.	T	Hydrogen-bonded Turn	trans	57.2	42.5	179.6	0	0	0	0	0	111.7	D84 N109	D84-G107 PolarHBondContact OD1-N 3.34Å; D84-G107 PolarHBondContact OD2-N 3.49Å; G107-N109 PolarHBondContact O-N 3.28Å; G107-N109 VanDerWaalsContact O-N 3.13Å; G107-N109 PolarHBondContact O-ND2 3.1Å
108	G	87	Confident	88.7	Confident	44 Å²	44	47.1 Å²	47.1	45%	0.454	24%	0.243	S	C	.	.	T	Hydrogen-bonded Turn	trans	70.7	0.9	-178.2	0	0	0	0	0	115.8	K106	K106-G108 VanDerWaalsContact C-N 3.27Å; K106-G108 PolarHBondContact O-N 3.34Å
109	N	89.9	Confident	89.6	Confident	98 Å²	98	53.7 Å²	53.7	52%	0.524	27%	0.274	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-115.6	146.8	-177.1	-72	-81.1	0	0	0	112.1	K106 G107	K106-N109 PolarHBondContact N-O 3.09Å; K106-N109 PolarHBondContact O-N 2.98Å; K106-N109 VanDerWaalsContact O-N 3.14Å; G107-N109 PolarHBondContact O-N 3.28Å; G107-N109 VanDerWaalsContact O-N 3.13Å; G107-N109 PolarHBondContact O-ND2 3.1Å
110	N	92.5	Very high	89.8	Confident	38 Å²	38	54.3 Å²	54.3	20%	0.203	29%	0.288	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-83.2	124	172.8	-64.3	-14.8	0	0	0	110	N76 T103	N76-N110 PolarHBondContact OD1-ND2 2.82Å; T103-N110 HydrophobicContact CG2-CB 4.06Å
111	K	91.8	Very high	89.7	Confident	83 Å²	83	56 Å²	56	36%	0.361	30%	0.296	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-105.7	118.3	177	-56.3	-58.3	-179.8	-170.2	0	108.5	T103 L104 K106 L152	T103-K111 WeakPolarHBondContact CA-O 3.25Å; L104-K111 PolarHBondContact N-O 2.9Å; L104-K111 PolarHBondContact O-N 3.44Å; K106-K111 HydrophobicContact CB-CG 4.42Å; K111-L152 HydrophobicContact CB-CD2 4.46Å; K111-L152 HydrophobicContact CG-CD2 3.97Å
112	L	91.1	Very high	89.5	Confident	81 Å²	81	57.3 Å²	57.3	42%	0.424	30%	0.299	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-92.7	123.8	177.2	-71.4	76.1	0	0	0	108.6	T101 T103	T101-L112 HydrophobicContact CG2-CB 4.31Å; T101-L112 HydrophobicContact CG2-CD2 4.49Å; T103-L112 HydrophobicContact CG2-CD1 4.41Å; T103-L112 HydrophobicContact CG2-CG 4.43Å
113	I	91.1	Very high	89.3	Confident	8 Å²	8	57.4 Å²	57.4	4%	0.041	30%	0.301	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-122.7	121.6	-179.3	-51.8	175.3	0	0	0	107.5	L102 F124 Y148 L152	L102-I113 HydrophobicContact CB-CB 4.33Å; L102-I113 HydrophobicContact CD2-CD1 4.23Å; L102-I113 PolarHBondContact N-O 3.47Å; L102-I113 PolarHBondContact O-N 3.22Å; I113-F124 HydrophobicContact CG2-CB 4.24Å; I113-F124 HydrophobicContact CG2-CD1 3.42Å; I113-F124 VanDerWaalsContact CG2-CD1 3.42Å; I113-F124 HydrophobicContact CG2-CE1 3.83Å; I113-F124 HydrophobicContact CG2-CG 3.86Å; I113-Y148 HydrophobicContact CG2-CE1 4.15Å; I113-L152 HydrophobicContact CD1-CD1 3.91Å
114	K	89.8	Confident	89	Confident	76 Å²	76	57.7 Å²	57.7	33%	0.33	30%	0.302	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-77.2	132.5	176.4	-174.8	168.9	178.8	174.3	0	109.6	D99 Y116	D99-K114 IonicContact OD1-NZ 3.1Å; D99-K114 WeakPolarHBondContact OD2-CE 3.43Å; D99-K114 IonicContact OD2-NZ 2.67Å; D99-K114 PolarHBondContact OD2-NZ 3.07Å; K114-Y116 HydrophobicContact CB-CE2 4.22Å; K114-Y116 HydrophobicContact CD-CD1 4.26Å; K114-Y116 HydrophobicContact CD-CE1 3.67Å; K114-Y116 HydrophobicContact CD-CE2 4.47Å; K114-Y116 HydrophobicContact CG-CD1 4.49Å; K114-Y116 HydrophobicContact CG-CE1 4.21Å; K114-Y116 HydrophobicContact CG-CE2 4.26Å
115	I	90.8	Very high	88.4	Confident	0 Å²	0	60.7 Å²	60.7	0%	0	32%	0.323	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-97.6	116.8	169.8	-60.2	165.8	0	0	0	106.6	V89 Y100 L102 Y122 F124 V133 L136	V89-I115 HydrophobicContact CG1-CD1 4.14Å; V89-I115 HydrophobicContact CG2-CD1 4.5Å; Y100-I115 PolarHBondContact N-O 2.99Å; Y100-I115 PolarHBondContact O-N 3.07Å; L102-I115 HydrophobicContact CB-CD1 4.1Å; L102-I115 HydrophobicContact CB-CG1 4.42Å; I115-Y122 HydrophobicContact CG2-CD1 4.27Å; I115-F124 HydrophobicContact CG1-CD1 4.1Å; I115-F124 HydrophobicContact CG1-CE1 3.79Å; I115-V133 HydrophobicContact CD1-CG1 4.06Å; I115-V133 HydrophobicContact CG2-CG2 4.41Å; I115-L136 HydrophobicContact CD1-CD2 3.98Å; I115-L136 HydrophobicContact CG1-CD2 3.9Å; I115-L136 HydrophobicContact CG2-CD2 3.85Å
116	Y	86.7	Confident	87.6	Confident	111 Å²	111	64.9 Å²	64.9	44%	0.435	35%	0.347	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-87.8	148.1	177.8	-66	-83.4	0	0	0	110.7	K114 Y122 G123 F124	K114-Y116 HydrophobicContact CB-CE2 4.22Å; K114-Y116 HydrophobicContact CD-CD1 4.26Å; K114-Y116 HydrophobicContact CD-CE1 3.67Å; K114-Y116 HydrophobicContact CD-CE2 4.47Å; K114-Y116 HydrophobicContact CG-CD1 4.49Å; K114-Y116 HydrophobicContact CG-CE1 4.21Å; K114-Y116 HydrophobicContact CG-CE2 4.26Å; Y116-Y122 WeakPolarHBondContact O-CA 3.35Å; Y116-G123 PolarHBondContact N-O 2.87Å; Y116-G123 PolarHBondContact O-N 2.86Å; Y116-F124 WeakPolarHBondContact CD2-O 3.32Å; Y116-F124 WeakPolarHBondContact CE2-O 3.49Å
117	H	86.8	Confident	87.2	Confident	73 Å²	73	68 Å²	68	34%	0.338	37%	0.372	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-127.2	124.6	174.8	172.3	-115.5	0	0	0	110.2	G98 K121 Y122	G98-H117 WeakPolarHBondContact O-CB 3.42Å; H117-K121 WeakPolarHBondContact CA-O 3.32Å; H117-Y122 HydrophobicContact CB-CD1 3.99Å; H117-Y122 HydrophobicContact CB-CE1 3.78Å; H117-Y122 AromaticContact CD2-CE1 3.43Å; H117-Y122 VanDerWaalsContact CD2-CE1 3.43Å; H117-Y122 WeakPolarHBondContact CD2-CE1 3.09Å; H117-Y122 AromaticContact CD2-CE2 3.97Å; H117-Y122 AromaticContact CD2-CZ 3.42Å; H117-Y122 VanDerWaalsContact CD2-CZ 3.42Å; H117-Y122 AromaticContact CG-CE1 3.75Å
118	R	84.4	Confident	87.2	Confident	155 Å²	155	66.7 Å²	66.7	59%	0.585	35%	0.352	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-150.3	135.8	173.3	178.7	-177.1	-93	165.7	-8.4	109.2	G120 K121 L128	R118-G120 PolarHBondContact O-N 3.48Å; R118-G120 VanDerWaalsContact O-N 3.14Å; R118-K121 PolarHBondContact N-O 3.25Å; R118-K121 VanDerWaalsContact N-O 3.1Å; R118-K121 WeakPolarHBondContact O-CB 3.47Å; R118-K121 PolarHBondContact O-N 3.36Å; R118-L128 HydrophobicContact CB-CD1 3.69Å
119	D	83.5	Confident	87.2	Confident	154 Å²	154	68.4 Å²	68.4	82%	0.824	35%	0.354	S	S	*	.	T	Hydrogen-bonded Turn	trans	51.6	35.7	176.6	-55	-36.1	0	0	0	114.6	K121	D119-K121 PolarHBondContact O-N 3.11Å
120	G	82.6	Confident	87.1	Confident	43 Å²	43	64.7 Å²	64.7	44%	0.443	33%	0.333	S	S	.	.	T	Hydrogen-bonded Turn	trans	74.2	10.5	-178.5	0	0	0	0	0	114.5	R118	R118-G120 PolarHBondContact O-N 3.48Å; R118-G120 VanDerWaalsContact O-N 3.14Å
121	K	87.4	Confident	87	Confident	73 Å²	73	67.4 Å²	67.4	32%	0.317	35%	0.348	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-110	150.1	175.9	-66.4	-69.4	-165.3	168.2	0	111.5	H117 R118 D119 L128 T129 F130 N131	H117-K121 WeakPolarHBondContact CA-O 3.32Å; R118-K121 PolarHBondContact N-O 3.25Å; R118-K121 VanDerWaalsContact N-O 3.1Å; R118-K121 WeakPolarHBondContact O-CB 3.47Å; R118-K121 PolarHBondContact O-N 3.36Å; D119-K121 PolarHBondContact O-N 3.11Å; K121-L128 HydrophobicContact CB-CB 3.73Å; K121-L128 WeakPolarHBondContact O-CD1 3.37Å; K121-T129 PolarHBondContact NZ-O 3.33Å; K121-F130 CarbonylContact C-O 3.6Å; K121-F130 VanDerWaalsContact CA-O 3.23Å; K121-F130 WeakPolarHBondContact CA-O 3.45Å; K121-F130 VanDerWaalsContact CD-O 3.3Å; K121-F130 WeakPolarHBondContact CD-O 3.27Å; K121-N131 WeakPolarHBondContact CE-OD1 3.44Å; K121-N131 PolarHBondContact NZ-OD1 3.46Å
122	Y	89.3	Confident	86.8	Confident	41 Å²	41	65.6 Å²	65.6	16%	0.161	35%	0.345	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-124.2	151.3	-178.3	-60.4	-89.4	0	0	0	111.9	Y100 I115 Y116 H117 F130 V133	Y100-Y122 HydrophobicContact CD2-CE1 4.48Å; Y100-Y122 HydrophobicContact CE2-CE1 4.07Å; I115-Y122 HydrophobicContact CG2-CD1 4.27Å; Y116-Y122 WeakPolarHBondContact O-CA 3.35Å; H117-Y122 HydrophobicContact CB-CD1 3.99Å; H117-Y122 HydrophobicContact CB-CE1 3.78Å; H117-Y122 AromaticContact CD2-CE1 3.43Å; H117-Y122 VanDerWaalsContact CD2-CE1 3.43Å; H117-Y122 WeakPolarHBondContact CD2-CE1 3.09Å; H117-Y122 AromaticContact CD2-CE2 3.97Å; H117-Y122 AromaticContact CD2-CZ 3.42Å; H117-Y122 VanDerWaalsContact CD2-CZ 3.42Å; H117-Y122 AromaticContact CG-CE1 3.75Å; Y122-F130 PolarHBondContact N-O 3.3Å; Y122-F130 WeakPolarHBondContact O-CB 3.46Å; Y122-F130 WeakPolarHBondContact O-CD2 2.83Å; Y122-F130 PolarHBondContact O-N 3.27Å; Y122-V133 HydrophobicContact CD1-CG2 3.56Å; Y122-V133 HydrophobicContact CE1-CG2 3.75Å; Y122-V133 HydrophobicContact CG-CG2 4.03Å
123	G	88.5	Confident	86.8	Confident	3 Å²	3	61.9 Å²	61.9	3%	0.031	33%	0.326	C	S	.	.	E	Extended strand (participates in β ladder)	trans	176.5	169.3	179.8	0	0	0	0	0	113.7	Y116	Y116-G123 PolarHBondContact N-O 2.87Å; Y116-G123 PolarHBondContact O-N 2.86Å
124	F	87.6	Confident	86.8	Confident	7 Å²	7	62.3 Å²	62.3	3%	0.031	33%	0.329	C	S	.	.	S	Bend	trans	-87.4	-24.9	175.8	-57.2	-46.7	0	0	0	113.3	L102 I113 I115 Y116 L136 Y140 L145 Y148	L102-F124 HydrophobicContact CD2-CE1 3.79Å; L102-F124 HydrophobicContact CD2-CZ 3.59Å; I113-F124 HydrophobicContact CG2-CB 4.24Å; I113-F124 HydrophobicContact CG2-CD1 3.42Å; I113-F124 VanDerWaalsContact CG2-CD1 3.42Å; I113-F124 HydrophobicContact CG2-CE1 3.83Å; I113-F124 HydrophobicContact CG2-CG 3.86Å; I115-F124 HydrophobicContact CG1-CD1 4.1Å; I115-F124 HydrophobicContact CG1-CE1 3.79Å; Y116-F124 WeakPolarHBondContact CD2-O 3.32Å; Y116-F124 WeakPolarHBondContact CE2-O 3.49Å; F124-L136 HydrophobicContact CD1-CD2 4.37Å; F124-L136 HydrophobicContact CE1-CD2 3.76Å; F124-L136 HydrophobicContact CE1-CG 4.42Å; F124-L136 HydrophobicContact CE2-CD1 4.35Å; F124-L136 HydrophobicContact CZ-CD1 4.32Å; F124-L136 HydrophobicContact CZ-CD2 3.99Å; F124-L136 HydrophobicContact CZ-CG 4.17Å; F124-Y140 HydrophobicContact CD2-CD2 4.34Å; F124-Y140 AromaticContact CD2-CE2 3.73Å; F124-Y140 HydrophobicContact CD2-CE2 3.73Å; F124-Y140 AromaticContact CD2-CZ 3.96Å; F124-Y140 AromaticContact CE2-CD2 3.4Å; F124-Y140 HydrophobicContact CE2-CD2 3.4Å; F124-Y140 VanDerWaalsContact CE2-CD2 3.4Å; F124-Y140 HydrophobicContact CE2-CE1 4.4Å; F124-Y140 AromaticContact CE2-CE2 3.24Å; F124-Y140 HydrophobicContact CE2-CE2 3.24Å; F124-Y140 HydrophobicContact CE2-CG 4.08Å; F124-Y140 AromaticContact CE2-CZ 3.77Å; F124-Y140 AromaticContact CZ-CD2 3.99Å; F124-Y140 HydrophobicContact CZ-CD2 3.99Å; F124-Y140 HydrophobicContact CZ-CE2 4.15Å; F124-L145 HydrophobicContact CD2-CD2 4.14Å; F124-L145 HydrophobicContact CE2-CD2 3.41Å; F124-L145 VanDerWaalsContact CE2-CD2 3.41Å; F124-L145 HydrophobicContact CZ-CD2 4.1Å; F124-Y148 HydrophobicContact CB-CD1 4.42Å; F124-Y148 HydrophobicContact CB-CD2 3.62Å; F124-Y148 HydrophobicContact CB-CE1 4.3Å; F124-Y148 HydrophobicContact CB-CE2 3.48Å; F124-Y148 VanDerWaalsContact CB-CE2 3.48Å; F124-Y148 HydrophobicContact CB-CG 4.1Å; F124-Y148 HydrophobicContact CD2-CD1 4.23Å; F124-Y148 HydrophobicContact CD2-CD2 4.32Å; F124-Y148 AromaticContact CD2-CG 3.99Å; F124-Y148 HydrophobicContact CD2-CG 3.99Å; F124-Y148 HydrophobicContact CG-CD2 4.44Å; F124-Y148 HydrophobicContact CG-CG 4.46Å
125	S	83.1	Confident	86.8	Confident	63 Å²	63	62.6 Å²	62.6	44%	0.441	33%	0.331	S	S	.	.	S	Bend	trans	-154	160.2	177.3	54.8	0	0	0	0	110.1	P127	S125-P127 CarbonylContact O-C 3.29Å
126	D	77.6	Confident	86.9	Confident	117 Å²	117	62.6 Å²	62.6	63%	0.626	33%	0.331	S	S	*	.	S	Bend	trans	-65.4	139.4	172.7	-79.6	-48.1	0	0	0	111.3
127	P	81.9	Confident	87.2	Confident	107 Å²	107	57.3 Å²	57.3	70%	0.695	31%	0.311	S	S	*	.	S	Bend	cis	-80.2	140.3	-1	31.8	-33.9	0	0	0	113.8	S125 T129	S125-P127 CarbonylContact O-C 3.29Å; P127-T129 PolarHBondContact O-N 3.5Å
128	L	86.9	Confident	87.4	Confident	25 Å²	25	57.6 Å²	57.6	13%	0.131	32%	0.315	C	S	.	.			trans	-76.3	111.6	175.4	-51.1	-177.6	0	0	0	110.9	R118 K121	R118-L128 HydrophobicContact CB-CD1 3.69Å; K121-L128 HydrophobicContact CB-CB 3.73Å; K121-L128 WeakPolarHBondContact O-CD1 3.37Å
129	T	87.7	Confident	87.7	Confident	80 Å²	80	52.8 Å²	52.8	49%	0.491	30%	0.299	S	S	.	.			trans	-100.4	-26.6	-171.3	49.8	0	0	0	0	114.4	K121 P127	K121-T129 PolarHBondContact NZ-O 3.33Å; P127-T129 PolarHBondContact O-N 3.5Å
130	F	89.1	Confident	88	Confident	21 Å²	21	46.4 Å²	46.4	9%	0.092	26%	0.264	C	S	.	.	B	Isolated β-bridge	trans	-88.8	147.1	-169.1	-56.7	-84.4	0	0	0	112.4	K121 Y122 E135 L136 H139 Y140	K121-F130 CarbonylContact C-O 3.6Å; K121-F130 VanDerWaalsContact CA-O 3.23Å; K121-F130 WeakPolarHBondContact CA-O 3.45Å; K121-F130 VanDerWaalsContact CD-O 3.3Å; K121-F130 WeakPolarHBondContact CD-O 3.27Å; Y122-F130 PolarHBondContact N-O 3.3Å; Y122-F130 WeakPolarHBondContact O-CB 3.46Å; Y122-F130 WeakPolarHBondContact O-CD2 2.83Å; Y122-F130 PolarHBondContact O-N 3.27Å; F130-E135 HydrophobicContact CD1-CG 4.14Å; F130-L136 HydrophobicContact CB-CB 4.18Å; F130-L136 HydrophobicContact CD1-CB 4.46Å; F130-L136 HydrophobicContact CD2-CB 4.26Å; F130-L136 HydrophobicContact CD2-CD1 3.24Å; F130-L136 HydrophobicContact CD2-CG 4.36Å; F130-L136 HydrophobicContact CE2-CD1 3.46Å; F130-L136 VanDerWaalsContact CE2-CD1 3.46Å; F130-L136 HydrophobicContact CG-CB 4.03Å; F130-L136 HydrophobicContact CG-CD1 3.9Å; F130-L136 HydrophobicContact CZ-CD1 4.25Å; F130-H139 HydrophobicContact CD1-CB 4.5Å; F130-H139 HydrophobicContact CE1-CB 3.62Å; F130-H139 AromaticContact CE1-CD2 3.75Å; F130-H139 AromaticContact CE1-CG 3.62Å; F130-H139 HydrophobicContact CZ-CB 4.18Å; F130-H139 AromaticContact CZ-CD2 3.47Å; F130-H139 VanDerWaalsContact CZ-CD2 3.47Å; F130-H139 WeakPolarHBondContact CZ-CD2 3.42Å; F130-H139 AromaticContact CZ-CG 3.85Å; F130-H139 AromaticContact CZ-NE2 4Å; F130-Y140 HydrophobicContact CE2-CE2 4.18Å; F130-Y140 HydrophobicContact CZ-CE2 4.16Å
131	N	88.4	Confident	88.4	Confident	95 Å²	95	48 Å²	48	51%	0.508	26%	0.259	S	S	.	.	S	Bend	trans	-89.9	-16.4	-179.5	-52.4	-72.4	0	0	0	113	K121 E135	K121-N131 WeakPolarHBondContact CE-OD1 3.44Å; K121-N131 PolarHBondContact NZ-OD1 3.46Å; N131-E135 WeakPolarHBondContact CB-OE2 3.46Å; N131-E135 PolarHBondContact N-OE2 3.04Å; N131-E135 PolarHBondContact ND2-OE2 3.5Å; N131-E135 VanDerWaalsContact ND2-OE2 3.08Å
132	S	89.4	Confident	88.3	Confident	44 Å²	44	50.6 Å²	50.6	31%	0.308	27%	0.272	S	S	.	.	S	Bend	trans	-148.7	159.3	175.4	70.6	0	0	0	0	111.7	V134 E135 L136	S132-V134 PolarHBondContact O-N 3.17Å; S132-E135 PolarHBondContact O-N 2.84Å; S132-E135 WeakPolarHBondContact OG-CB 3.49Å; S132-E135 PolarHBondContact OG-N 3.3Å; S132-L136 PolarHBondContact O-N 2.78Å
133	V	89.5	Confident	88.2	Confident	4 Å²	4	52.2 Å²	52.2	2%	0.024	28%	0.281	C	S	.	.	H	α-helix	trans	-62.8	-33.8	171.4	-179.1	0	0	0	0	111.2	L60 W65 Y100 I115 Y122 L136 I137	L60-V133 HydrophobicContact CD1-CB 3.98Å; L60-V133 HydrophobicContact CD1-CG1 3.94Å; L60-V133 HydrophobicContact CD2-CB 4.31Å; L60-V133 HydrophobicContact CD2-CG2 4.3Å; W65-V133 HydrophobicContact CH2-CG1 4.04Å; W65-V133 HydrophobicContact CZ3-CG1 4.16Å; Y100-V133 HydrophobicContact CD2-CG2 3.6Å; Y100-V133 HydrophobicContact CE2-CG2 3.71Å; Y100-V133 HydrophobicContact CG-CG2 4.45Å; I115-V133 HydrophobicContact CD1-CG1 4.06Å; I115-V133 HydrophobicContact CG2-CG2 4.41Å; Y122-V133 HydrophobicContact CD1-CG2 3.56Å; Y122-V133 HydrophobicContact CE1-CG2 3.75Å; Y122-V133 HydrophobicContact CG-CG2 4.03Å; V133-L136 WeakPolarHBondContact O-CB 3.39Å; V133-L136 PolarHBondContact O-N 2.86Å; V133-I137 HydrophobicContact CG1-CG1 4.24Å; V133-I137 VanDerWaalsContact O-CG1 3.3Å; V133-I137 WeakPolarHBondContact O-CG1 3.19Å; V133-I137 PolarHBondContact O-N 3.16Å
134	V	91.4	Very high	88.3	Confident	17 Å²	17	53 Å²	53	10%	0.103	29%	0.287	C	S	.	.	H	α-helix	trans	-64.6	-42.7	177.5	179.3	0	0	0	0	110.8	L60 W65 S132 I137 N138	L60-V134 HydrophobicContact CB-CG2 4.31Å; L60-V134 HydrophobicContact CD1-CG2 4.29Å; W65-V134 HydrophobicContact CH2-CG2 4.24Å; W65-V134 HydrophobicContact CZ2-CG2 4.24Å; S132-V134 PolarHBondContact O-N 3.17Å; V134-I137 PolarHBondContact O-N 3.31Å; V134-N138 VanDerWaalsContact O-CB 3.27Å; V134-N138 WeakPolarHBondContact O-CB 3.36Å; V134-N138 VanDerWaalsContact O-CG 3.24Å; V134-N138 PolarHBondContact O-N 3.48Å; V134-N138 PolarHBondContact O-ND2 2.98Å
135	E	91	Very high	88.4	Confident	81 Å²	81	52.7 Å²	52.7	38%	0.379	29%	0.285	S	S	.	.	H	α-helix	trans	-63.5	-45.1	175.3	-168.8	-174.3	-178.7	0	0	111.7	F130 N131 S132 I137 N138 H139	F130-E135 HydrophobicContact CD1-CG 4.14Å; N131-E135 WeakPolarHBondContact CB-OE2 3.46Å; N131-E135 PolarHBondContact N-OE2 3.04Å; N131-E135 PolarHBondContact ND2-OE2 3.5Å; N131-E135 VanDerWaalsContact ND2-OE2 3.08Å; S132-E135 PolarHBondContact O-N 2.84Å; S132-E135 WeakPolarHBondContact OG-CB 3.49Å; S132-E135 PolarHBondContact OG-N 3.3Å; E135-I137 PolarHBondContact O-N 2.7Å; E135-N138 PolarHBondContact O-N 3.36Å; E135-H139 WeakPolarHBondContact O-CB 3.15Å; E135-H139 PolarHBondContact O-N 2.96Å
136	L	91.8	Very high	88.6	Confident	0 Å²	0	51.1 Å²	51.1	0%	0	28%	0.276	C	S	.	.	H	α-helix	trans	-54.8	-52.8	174.9	176.7	83.9	0	0	0	111.4	I115 F124 F130 S132 V133 H139 Y140	I115-L136 HydrophobicContact CD1-CD2 3.98Å; I115-L136 HydrophobicContact CG1-CD2 3.9Å; I115-L136 HydrophobicContact CG2-CD2 3.85Å; F124-L136 HydrophobicContact CD1-CD2 4.37Å; F124-L136 HydrophobicContact CE1-CD2 3.76Å; F124-L136 HydrophobicContact CE1-CG 4.42Å; F124-L136 HydrophobicContact CE2-CD1 4.35Å; F124-L136 HydrophobicContact CZ-CD1 4.32Å; F124-L136 HydrophobicContact CZ-CD2 3.99Å; F124-L136 HydrophobicContact CZ-CG 4.17Å; F130-L136 HydrophobicContact CB-CB 4.18Å; F130-L136 HydrophobicContact CD1-CB 4.46Å; F130-L136 HydrophobicContact CD2-CB 4.26Å; F130-L136 HydrophobicContact CD2-CD1 3.24Å; F130-L136 HydrophobicContact CD2-CG 4.36Å; F130-L136 HydrophobicContact CE2-CD1 3.46Å; F130-L136 VanDerWaalsContact CE2-CD1 3.46Å; F130-L136 HydrophobicContact CG-CB 4.03Å; F130-L136 HydrophobicContact CG-CD1 3.9Å; F130-L136 HydrophobicContact CZ-CD1 4.25Å; S132-L136 PolarHBondContact O-N 2.78Å; V133-L136 WeakPolarHBondContact O-CB 3.39Å; V133-L136 PolarHBondContact O-N 2.86Å; L136-H139 PolarHBondContact O-N 3.3Å; L136-Y140 HydrophobicContact CD1-CD2 4.19Å; L136-Y140 HydrophobicContact CD1-CE2 3.8Å; L136-Y140 HydrophobicContact CG-CD2 4.36Å; L136-Y140 HydrophobicContact CG-CE2 4.46Å; L136-Y140 VanDerWaalsContact O-CD2 3.26Å; L136-Y140 WeakPolarHBondContact O-CD2 3.38Å; L136-Y140 PolarHBondContact O-N 3.32Å
137	I	93.1	Very high	88.9	Confident	1 Å²	1	51.3 Å²	51.3	1%	0.005	27%	0.273	C	S	.	.	H	α-helix	trans	-66.6	-42.4	-177.8	-65.4	-62.1	0	0	0	110.9	W65 F87 V89 L102 V133 V134 E135 H139 Y140 H141 L156	W65-I137 HydrophobicContact CD2-CG2 4.13Å; W65-I137 HydrophobicContact CE3-CG1 4.4Å; W65-I137 HydrophobicContact CH2-CB 3.91Å; W65-I137 HydrophobicContact CH2-CG1 3.62Å; W65-I137 HydrophobicContact CH2-CG2 4.25Å; W65-I137 HydrophobicContact CZ2-CB 3.75Å; W65-I137 HydrophobicContact CZ2-CG1 3.99Å; W65-I137 HydrophobicContact CZ2-CG2 3.75Å; W65-I137 HydrophobicContact CZ3-CB 4.49Å; W65-I137 HydrophobicContact CZ3-CG1 3.84Å; F87-I137 HydrophobicContact CE2-CG2 3.59Å; F87-I137 HydrophobicContact CZ-CG2 3.94Å; V89-I137 HydrophobicContact CG2-CD1 3.83Å; V89-I137 HydrophobicContact CG2-CG1 4.16Å; L102-I137 HydrophobicContact CD1-CD1 3.98Å; L102-I137 HydrophobicContact CD2-CD1 4.14Å; V133-I137 HydrophobicContact CG1-CG1 4.24Å; V133-I137 VanDerWaalsContact O-CG1 3.3Å; V133-I137 WeakPolarHBondContact O-CG1 3.19Å; V133-I137 PolarHBondContact O-N 3.16Å; V134-I137 PolarHBondContact O-N 3.31Å; E135-I137 PolarHBondContact O-N 2.7Å; I137-H139 VanDerWaalsContact C-N 3.29Å; I137-H139 PolarHBondContact O-N 3.3Å; I137-Y140 CarbonylContact O-C 3.56Å; I137-Y140 PolarHBondContact O-N 3.43Å; I137-H141 WeakPolarHBondContact O-CB 3.43Å; I137-H141 PolarHBondContact O-N 2.9Å; I137-L156 HydrophobicContact CB-CD1 4.47Å; I137-L156 HydrophobicContact CD1-CD1 3.69Å; I137-L156 HydrophobicContact CG2-CD1 4.01Å
138	N	90.3	Very high	89	Confident	79 Å²	79	50.1 Å²	50.1	42%	0.422	26%	0.255	S	S	.	.	H	α-helix	trans	-64	-33	177.3	-77.6	-16.1	0	0	0	112.8	V134 E135 H141 H142	V134-N138 VanDerWaalsContact O-CB 3.27Å; V134-N138 WeakPolarHBondContact O-CB 3.36Å; V134-N138 VanDerWaalsContact O-CG 3.24Å; V134-N138 PolarHBondContact O-N 3.48Å; V134-N138 PolarHBondContact O-ND2 2.98Å; E135-N138 PolarHBondContact O-N 3.36Å; N138-H141 WeakPolarHBondContact O-CB 3.36Å; N138-H142 PolarHBondContact O-ND1 3.22Å
139	H	90.7	Very high	88.9	Confident	53 Å²	53	51.7 Å²	51.7	25%	0.245	26%	0.264	C	S	.	.	H	α-helix	trans	-64.9	-52.4	173.7	177	78.2	0	0	0	111.2	F130 E135 L136 I137 H141 H142 E143	F130-H139 HydrophobicContact CD1-CB 4.5Å; F130-H139 HydrophobicContact CE1-CB 3.62Å; F130-H139 AromaticContact CE1-CD2 3.75Å; F130-H139 AromaticContact CE1-CG 3.62Å; F130-H139 HydrophobicContact CZ-CB 4.18Å; F130-H139 AromaticContact CZ-CD2 3.47Å; F130-H139 VanDerWaalsContact CZ-CD2 3.47Å; F130-H139 WeakPolarHBondContact CZ-CD2 3.42Å; F130-H139 AromaticContact CZ-CG 3.85Å; F130-H139 AromaticContact CZ-NE2 4Å; E135-H139 WeakPolarHBondContact O-CB 3.15Å; E135-H139 PolarHBondContact O-N 2.96Å; L136-H139 PolarHBondContact O-N 3.3Å; I137-H139 VanDerWaalsContact C-N 3.29Å; I137-H139 PolarHBondContact O-N 3.3Å; H139-H141 PolarHBondContact O-N 2.97Å; H139-H142 PolarHBondContact O-N 3.42Å; H139-E143 IonicContact CE1-OE1 3.93Å; H139-E143 PolarHBondContact CE1-OE1 3.49Å; H139-E143 IonicContact CE1-OE2 3.7Å; H139-E143 PolarHBondContact CE1-OE2 3.09Å; H139-E143 IonicContact ND1-OE1 3.1Å; H139-E143 IonicContact NE2-OE2 2.77Å; H139-E143 PolarHBondContact NE2-OE2 3.37Å; H139-E143 PolarHBondContact O-N 2.97Å
140	Y	91.1	Very high	88.9	Confident	21 Å²	21	53 Å²	53	8%	0.082	27%	0.274	C	S	.	.	H	α-helix	trans	-75.4	-4	178.5	-69.2	-70.8	0	0	0	114.8	F124 F130 L136 I137 E143 L145 L156	F124-Y140 HydrophobicContact CD2-CD2 4.34Å; F124-Y140 AromaticContact CD2-CE2 3.73Å; F124-Y140 HydrophobicContact CD2-CE2 3.73Å; F124-Y140 AromaticContact CD2-CZ 3.96Å; F124-Y140 AromaticContact CE2-CD2 3.4Å; F124-Y140 HydrophobicContact CE2-CD2 3.4Å; F124-Y140 VanDerWaalsContact CE2-CD2 3.4Å; F124-Y140 HydrophobicContact CE2-CE1 4.4Å; F124-Y140 AromaticContact CE2-CE2 3.24Å; F124-Y140 HydrophobicContact CE2-CE2 3.24Å; F124-Y140 HydrophobicContact CE2-CG 4.08Å; F124-Y140 AromaticContact CE2-CZ 3.77Å; F124-Y140 AromaticContact CZ-CD2 3.99Å; F124-Y140 HydrophobicContact CZ-CD2 3.99Å; F124-Y140 HydrophobicContact CZ-CE2 4.15Å; F130-Y140 HydrophobicContact CE2-CE2 4.18Å; F130-Y140 HydrophobicContact CZ-CE2 4.16Å; L136-Y140 HydrophobicContact CD1-CD2 4.19Å; L136-Y140 HydrophobicContact CD1-CE2 3.8Å; L136-Y140 HydrophobicContact CG-CD2 4.36Å; L136-Y140 HydrophobicContact CG-CE2 4.46Å; L136-Y140 VanDerWaalsContact O-CD2 3.26Å; L136-Y140 WeakPolarHBondContact O-CD2 3.38Å; L136-Y140 PolarHBondContact O-N 3.32Å; I137-Y140 CarbonylContact O-C 3.56Å; I137-Y140 PolarHBondContact O-N 3.43Å; Y140-E143 CarbonylContact C-O 3.31Å; Y140-E143 WeakPolarHBondContact CA-O 3.5Å; Y140-L145 HydrophobicContact CD1-CD2 3.59Å; Y140-L145 HydrophobicContact CD1-CG 3.98Å; Y140-L145 HydrophobicContact CD2-CD2 4.34Å; Y140-L145 HydrophobicContact CE1-CD2 3.96Å; Y140-L145 HydrophobicContact CG-CD2 3.79Å; Y140-L145 HydrophobicContact CG-CG 4.33Å; Y140-L156 PolarHBondContact O-N 3.01Å
141	H	89.8	Confident	88.6	Confident	75 Å²	75	60.5 Å²	60.5	35%	0.347	31%	0.306	S	S	.	.	H	α-helix	trans	-71	-37.5	163	180	-83.6	0	0	0	110.8	I137 N138 H139 L156	I137-H141 WeakPolarHBondContact O-CB 3.43Å; I137-H141 PolarHBondContact O-N 2.9Å; N138-H141 WeakPolarHBondContact O-CB 3.36Å; H139-H141 PolarHBondContact O-N 2.97Å; H141-L156 PolarHBondContact CD2-O 3.13Å
142	H	85.6	Confident	88.5	Confident	128 Å²	128	56.7 Å²	56.7	59%	0.593	29%	0.286	S	S	*	.	H	α-helix	trans	-94	-32.8	-179.3	-62.5	90.5	0	0	0	112.6	N138 H139 K155	N138-H142 PolarHBondContact O-ND1 3.22Å; H139-H142 PolarHBondContact O-N 3.42Å; H142-K155 VanDerWaalsContact O-CE 3.31Å; H142-K155 WeakPolarHBondContact O-CE 3.48Å; H142-K155 PolarHBondContact O-NZ 3.41Å
143	E	88	Confident	88.5	Confident	76 Å²	76	59.7 Å²	59.7	36%	0.355	30%	0.298	S	S	.	.	S	Bend	trans	-107.8	147.6	-177.6	-61	-167.6	-156.5	0	0	111.7	H139 Y140 Q147	H139-E143 IonicContact CE1-OE1 3.93Å; H139-E143 PolarHBondContact CE1-OE1 3.49Å; H139-E143 IonicContact CE1-OE2 3.7Å; H139-E143 PolarHBondContact CE1-OE2 3.09Å; H139-E143 IonicContact ND1-OE1 3.1Å; H139-E143 IonicContact NE2-OE2 2.77Å; H139-E143 PolarHBondContact NE2-OE2 3.37Å; H139-E143 PolarHBondContact O-N 2.97Å; Y140-E143 CarbonylContact C-O 3.31Å; Y140-E143 WeakPolarHBondContact CA-O 3.5Å; E143-Q147 PolarHBondContact OE2-NE2 3.43Å; E143-Q147 PolarHBondContact OE2-OE1 2.86Å
144	S	89.7	Confident	88.5	Confident	20 Å²	20	60.3 Å²	60.3	14%	0.14	30%	0.302	C	S	.	.			trans	-74.6	139.7	-178.2	-178.4	0	0	0	0	110.9	A146 Q147 D153 V154	S144-A146 PolarHBondContact O-N 2.91Å; S144-A146 WeakPolarHBondContact OG-CB 3.48Å; S144-A146 PolarHBondContact OG-N 3.25Å; S144-Q147 PolarHBondContact O-N 2.97Å; S144-D153 WeakPolarHBondContact OG-CA 3.42Å; S144-D153 PolarHBondContact OG-OD1 2.99Å; S144-V154 PolarHBondContact OG-N 2.77Å
145	L	90.3	Very high	88.6	Confident	0 Å²	0	63.7 Å²	63.7	0%	0	32%	0.316	C	S	.	.	G	3₁₀ helix	trans	-62.5	-6.2	170.3	-77.6	163.3	0	0	0	113.2	L104 F124 Y140 Q147 Y148 N149 L152 V154 L156	L104-L145 HydrophobicContact CD2-CD1 3.26Å; F124-L145 HydrophobicContact CD2-CD2 4.14Å; F124-L145 HydrophobicContact CE2-CD2 3.41Å; F124-L145 VanDerWaalsContact CE2-CD2 3.41Å; F124-L145 HydrophobicContact CZ-CD2 4.1Å; Y140-L145 HydrophobicContact CD1-CD2 3.59Å; Y140-L145 HydrophobicContact CD1-CG 3.98Å; Y140-L145 HydrophobicContact CD2-CD2 4.34Å; Y140-L145 HydrophobicContact CE1-CD2 3.96Å; Y140-L145 HydrophobicContact CG-CD2 3.79Å; Y140-L145 HydrophobicContact CG-CG 4.33Å; L145-Q147 PolarHBondContact O-N 3.29Å; L145-Y148 PolarHBondContact O-N 3.01Å; L145-N149 PolarHBondContact O-N 2.88Å; L145-L152 CarbonylContact C-O 3.58Å; L145-L152 VanDerWaalsContact C-O 3.29Å; L145-L152 HydrophobicContact CB-CB 4.1Å; L145-L152 WeakPolarHBondContact CB-O 3.46Å; L145-V154 WeakPolarHBondContact CB-O 3.33Å; L145-V154 PolarHBondContact N-O 2.93Å; L145-L156 HydrophobicContact CD1-CD2 3.85Å; L145-L156 HydrophobicContact CD1-CG 4.38Å
146	A	86.6	Confident	88.6	Confident	30 Å²	30	59.9 Å²	59.9	25%	0.248	30%	0.297	C	S	.	.	G	3₁₀ helix	trans	-51	-33.1	167.5	0	0	0	0	0	113.3	S144 Y148 N149 L152 D153	S144-A146 PolarHBondContact O-N 2.91Å; S144-A146 WeakPolarHBondContact OG-CB 3.48Å; S144-A146 PolarHBondContact OG-N 3.25Å; A146-Y148 VanDerWaalsContact C-N 3.29Å; A146-Y148 PolarHBondContact O-N 3.03Å; A146-N149 WeakPolarHBondContact CA-O 3.31Å; A146-N149 CarbonylContact O-C 3.4Å; A146-N149 VanDerWaalsContact O-C 3.31Å; A146-N149 PolarHBondContact O-N 3.47Å; A146-L152 PolarHBondContact N-O 2.79Å; A146-D153 HydrophobicContact CB-CB 4Å
147	Q	83.8	Confident	88.5	Confident	120 Å²	120	63.8 Å²	63.8	56%	0.561	32%	0.317	S	S	*	.	G	3₁₀ helix	trans	-63.7	-34.6	177.6	-68.2	176.5	-17.3	0	0	112.7	E143 S144 L145	E143-Q147 PolarHBondContact OE2-NE2 3.43Å; E143-Q147 PolarHBondContact OE2-OE1 2.86Å; S144-Q147 PolarHBondContact O-N 2.97Å; L145-Q147 PolarHBondContact O-N 3.29Å
148	Y	84.6	Confident	88.4	Confident	83 Å²	83	69.2 Å²	69.2	33%	0.325	34%	0.338	S	S	.	.	T	Hydrogen-bonded Turn	trans	-82.4	-47.6	173.8	162.9	-112.6	0	0	0	111.1	I113 F124 L145 A146 L152	I113-Y148 HydrophobicContact CG2-CE1 4.15Å; F124-Y148 HydrophobicContact CB-CD1 4.42Å; F124-Y148 HydrophobicContact CB-CD2 3.62Å; F124-Y148 HydrophobicContact CB-CE1 4.3Å; F124-Y148 HydrophobicContact CB-CE2 3.48Å; F124-Y148 VanDerWaalsContact CB-CE2 3.48Å; F124-Y148 HydrophobicContact CB-CG 4.1Å; F124-Y148 HydrophobicContact CD2-CD1 4.23Å; F124-Y148 HydrophobicContact CD2-CD2 4.32Å; F124-Y148 AromaticContact CD2-CG 3.99Å; F124-Y148 HydrophobicContact CD2-CG 3.99Å; F124-Y148 HydrophobicContact CG-CD2 4.44Å; F124-Y148 HydrophobicContact CG-CG 4.46Å; L145-Y148 PolarHBondContact O-N 3.01Å; A146-Y148 VanDerWaalsContact C-N 3.29Å; A146-Y148 PolarHBondContact O-N 3.03Å; Y148-L152 HydrophobicContact CD1-CD1 4.49Å; Y148-L152 HydrophobicContact CE1-CD1 4.41Å
149	N	85.5	Confident	88.4	Confident	57 Å²	57	67.4 Å²	67.4	31%	0.305	33%	0.331	S	S	.	.			trans	-145.3	116	179.3	-175.8	-21.3	0	0	0	110	L145 A146 K151 L152	L145-N149 PolarHBondContact O-N 2.88Å; A146-N149 WeakPolarHBondContact CA-O 3.31Å; A146-N149 CarbonylContact O-C 3.4Å; A146-N149 VanDerWaalsContact O-C 3.31Å; A146-N149 PolarHBondContact O-N 3.47Å; N149-K151 PolarHBondContact O-N 3.19Å; N149-K151 WeakPolarHBondContact OD1-CB 3.48Å; N149-K151 PolarHBondContact OD1-N 3.23Å; N149-L152 HydrophobicContact CB-CB 4.31Å; N149-L152 HydrophobicContact CB-CD1 4.17Å; N149-L152 HydrophobicContact CB-CG 4.23Å; N149-L152 CarbonylContact O-C 3.58Å; N149-L152 WeakPolarHBondContact O-CA 3.4Å; N149-L152 WeakPolarHBondContact O-CB 3.37Å; N149-L152 PolarHBondContact O-N 3.44Å
150	P	86.6	Confident	88.3	Confident	109 Å²	109	65.5 Å²	65.5	71%	0.708	32%	0.323	S	S	*	.	G	3₁₀ helix	trans	-55.5	-27.9	-179.2	-28.2	35.1	0	0	0	114.4	L152 D153	P150-L152 PolarHBondContact O-N 3.03Å; P150-D153 PolarHBondContact O-N 3.21Å
151	K	84.3	Confident	88.1	Confident	177 Å²	177	65.4 Å²	65.4	77%	0.77	33%	0.325	S	S	*	.	G	3₁₀ helix	trans	-71.2	-16.3	175.8	-64	-175.1	178.2	-179.6	0	112.8	K106 N149	K106-K151 WeakPolarHBondContact CE-O 3.39Å; K106-K151 PolarHBondContact NZ-O 2.8Å; N149-K151 PolarHBondContact O-N 3.19Å; N149-K151 WeakPolarHBondContact OD1-CB 3.48Å; N149-K151 PolarHBondContact OD1-N 3.23Å
152	L	86.2	Confident	87.6	Confident	15 Å²	15	64.4 Å²	64.4	8%	0.079	32%	0.318	C	S	.	.	G	3₁₀ helix	trans	-105.2	40.6	177.5	-61.7	179.4	0	0	0	111.4	K106 K111 I113 L145 A146 Y148 N149 P150 V154	K106-L152 HydrophobicContact CD-CD2 3.96Å; K111-L152 HydrophobicContact CB-CD2 4.46Å; K111-L152 HydrophobicContact CG-CD2 3.97Å; I113-L152 HydrophobicContact CD1-CD1 3.91Å; L145-L152 CarbonylContact C-O 3.58Å; L145-L152 VanDerWaalsContact C-O 3.29Å; L145-L152 HydrophobicContact CB-CB 4.1Å; L145-L152 WeakPolarHBondContact CB-O 3.46Å; A146-L152 PolarHBondContact N-O 2.79Å; Y148-L152 HydrophobicContact CD1-CD1 4.49Å; Y148-L152 HydrophobicContact CE1-CD1 4.41Å; N149-L152 HydrophobicContact CB-CB 4.31Å; N149-L152 HydrophobicContact CB-CD1 4.17Å; N149-L152 HydrophobicContact CB-CG 4.23Å; N149-L152 CarbonylContact O-C 3.58Å; N149-L152 WeakPolarHBondContact O-CA 3.4Å; N149-L152 WeakPolarHBondContact O-CB 3.37Å; N149-L152 PolarHBondContact O-N 3.44Å; P150-L152 PolarHBondContact O-N 3.03Å; L152-V154 VanDerWaalsContact C-N 3.27Å; L152-V154 PolarHBondContact O-N 3.21Å
153	D	88.9	Confident	86.9	Confident	107 Å²	107	62.5 Å²	62.5	57%	0.572	31%	0.306	S	S	*	.			trans	-63.1	87.9	165.7	-170.3	25.9	0	0	0	112	K106 S144 A146 P150	K106-D153 PolarHBondContact NZ-O 3.43Å; S144-D153 WeakPolarHBondContact OG-CA 3.42Å; S144-D153 PolarHBondContact OG-OD1 2.99Å; A146-D153 HydrophobicContact CB-CB 4Å; P150-D153 PolarHBondContact O-N 3.21Å
154	V	90.2	Very high	85.8	Confident	17 Å²	17	64.2 Å²	64.2	10%	0.103	31%	0.314	C	S	.	.			trans	-166.2	148.9	177.2	68.4	0	0	0	0	107.1	L104 K106 S144 L145 L152	L104-V154 HydrophobicContact CD1-CG1 4.35Å; L104-V154 HydrophobicContact CD2-CG1 3.68Å; L104-V154 HydrophobicContact CG-CG1 4.38Å; K106-V154 HydrophobicContact CB-CG1 4.47Å; K106-V154 HydrophobicContact CD-CB 4.28Å; K106-V154 HydrophobicContact CD-CG1 3.92Å; K106-V154 HydrophobicContact CG-CG1 4.45Å; S144-V154 PolarHBondContact OG-N 2.77Å; L145-V154 WeakPolarHBondContact CB-O 3.33Å; L145-V154 PolarHBondContact N-O 2.93Å; L152-V154 VanDerWaalsContact C-N 3.27Å; L152-V154 PolarHBondContact O-N 3.21Å
155	K	91.7	Very high	84.2	Confident	89 Å²	89	64.4 Å²	64.4	39%	0.387	31%	0.313	S	S	.	.			trans	-98.8	159.2	175.4	-60.6	-175.4	-177.8	-167.8	0	110.6	G85 H142 M157	G85-K155 WeakPolarHBondContact CA-O 3.33Å; H142-K155 VanDerWaalsContact O-CE 3.31Å; H142-K155 WeakPolarHBondContact O-CE 3.48Å; H142-K155 PolarHBondContact O-NZ 3.41Å; K155-M157 VanDerWaalsContact C-N 3.31Å; K155-M157 HydrophobicContact CB-CG 3.87Å; K155-M157 PolarHBondContact O-N 3.14Å
156	L	92.6	Very high	82.4	Confident	0 Å²	0	67.8 Å²	67.8	0%	0	33%	0.331	C	S	.	.			trans	-76.3	82.1	170.9	-59.9	-175.1	0	0	0	109.4	F87 L102 L104 I137 Y140 H141 L145	F87-L156 HydrophobicContact CB-CD2 3.94Å; F87-L156 HydrophobicContact CD1-CB 3.69Å; F87-L156 HydrophobicContact CD1-CD2 4.16Å; F87-L156 HydrophobicContact CD1-CG 4.45Å; F87-L156 HydrophobicContact CD2-CB 4.46Å; F87-L156 HydrophobicContact CD2-CD1 4.32Å; F87-L156 HydrophobicContact CD2-CD2 4.29Å; F87-L156 HydrophobicContact CE1-CB 3.6Å; F87-L156 HydrophobicContact CE2-CB 4.39Å; F87-L156 HydrophobicContact CE2-CD1 4.34Å; F87-L156 HydrophobicContact CG-CB 4.13Å; F87-L156 HydrophobicContact CG-CD2 3.86Å; F87-L156 HydrophobicContact CG-CG 4.42Å; F87-L156 HydrophobicContact CZ-CB 3.97Å; L102-L156 HydrophobicContact CD1-CD2 4.35Å; L102-L156 HydrophobicContact CD2-CD1 4.23Å; L102-L156 HydrophobicContact CD2-CD2 4.22Å; L104-L156 HydrophobicContact CD1-CD2 3.93Å; L104-L156 HydrophobicContact CD2-CD2 4.3Å; I137-L156 HydrophobicContact CB-CD1 4.47Å; I137-L156 HydrophobicContact CD1-CD1 3.69Å; I137-L156 HydrophobicContact CG2-CD1 4.01Å; Y140-L156 PolarHBondContact O-N 3.01Å; H141-L156 PolarHBondContact CD2-O 3.13Å; L145-L156 HydrophobicContact CD1-CD2 3.85Å; L145-L156 HydrophobicContact CD1-CG 4.38Å
157	M	88.4	Confident	80.8	Confident	82 Å²	82	74 Å²	74	40%	0.404	36%	0.355	S	S	.	.			trans	-93.2	-36.7	-168.5	-64.7	-167.8	-65	0	0	114.3	D84 G85 K155 P159	D84-M157 WeakPolarHBondContact O-CE 3.46Å; G85-M157 PolarHBondContact O-N 3.33Å; K155-M157 VanDerWaalsContact C-N 3.31Å; K155-M157 HydrophobicContact CB-CG 3.87Å; K155-M157 PolarHBondContact O-N 3.14Å; M157-P159 WeakPolarHBondContact O-CD 3.48Å
158	Y	91.1	Very high	79.5	Confident	115 Å²	115	72.8 Å²	72.8	45%	0.451	35%	0.352	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-122.3	91.1	-170.7	-50.8	-65.5	0	0	0	110	P83 G85 T86 F87 V160	P83-Y158 HydrophobicContact CB-CD2 4.41Å; P83-Y158 HydrophobicContact CB-CE2 4.14Å; P83-Y158 HydrophobicContact CG-CD2 3.75Å; P83-Y158 HydrophobicContact CG-CE2 3.83Å; P83-Y158 HydrophobicContact CG-CG 4.49Å; G85-Y158 PolarHBondContact O-N 3Å; T86-Y158 VanDerWaalsContact CA-O 3.29Å; T86-Y158 WeakPolarHBondContact CA-O 3.41Å; F87-Y158 PolarHBondContact N-O 2.96Å; Y158-V160 PolarHBondContact O-N 2.94Å
159	P	91.4	Very high	78.3	Confident	41 Å²	41	69.2 Å²	69.2	27%	0.266	34%	0.339	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-65.1	129.2	175.7	25.7	-31.8	0	0	0	109.8	E64 W65 F87 M157 S161	E64-P159 HydrophobicContact CG-CB 4.4Å; E64-P159 WeakPolarHBondContact OE1-CG 3.46Å; W65-P159 HydrophobicContact CB-CB 3.85Å; W65-P159 HydrophobicContact CG-CB 4.36Å; F87-P159 HydrophobicContact CE1-CB 3.91Å; F87-P159 HydrophobicContact CZ-CB 3.8Å; M157-P159 WeakPolarHBondContact O-CD 3.48Å; P159-S161 PolarHBondContact O-N 3.36Å; P159-S161 VanDerWaalsContact O-N 3.08Å
160	V	88.9	Confident	77.3	Confident	14 Å²	14	75.7 Å²	75.7	9%	0.085	36%	0.364	C	S	.	.			trans	-76.2	98.1	167.9	-177.1	0	0	0	0	107.3	W67 L79 T86 F87 L88 Y158 R162	W67-V160 HydrophobicContact CZ2-CG1 3.88Å; W67-V160 PolarHBondContact NE1-O 3.26Å; L79-V160 HydrophobicContact CD2-CG2 3.7Å; T86-V160 HydrophobicContact CG2-CG2 3.45Å; T86-V160 VanDerWaalsContact CG2-CG2 3.45Å; F87-V160 PolarHBondContact O-N 2.64Å; L88-V160 HydrophobicContact CB-CB 4.18Å; L88-V160 HydrophobicContact CD2-CB 4.1Å; L88-V160 HydrophobicContact CD2-CG1 4.28Å; L88-V160 HydrophobicContact CD2-CG2 4.28Å; Y158-V160 PolarHBondContact O-N 2.94Å; V160-R162 PolarHBondContact O-N 3.32Å
161	S	85.4	Confident	76.5	Confident	18 Å²	18	73.4 Å²	73.4	13%	0.126	34%	0.344	C	S	.	.			trans	-72.4	125.2	-176.8	-172	0	0	0	0	111.1	E64 P159 Y163 Q164	E64-S161 CarbonylContact O-C 3.59Å; E64-S161 WeakPolarHBondContact O-CA 3.37Å; E64-S161 WeakPolarHBondContact OE2-CB 3.36Å; E64-S161 PolarHBondContact OE2-OG 3.35Å; P159-S161 PolarHBondContact O-N 3.36Å; P159-S161 VanDerWaalsContact O-N 3.08Å; S161-Y163 PolarHBondContact O-N 2.92Å; S161-Y163 PolarHBondContact OG-N 3.49Å; S161-Q164 WeakPolarHBondContact O-CB 3.48Å; S161-Q164 PolarHBondContact O-N 3.02Å; S161-Q164 VanDerWaalsContact O-N 3.1Å
162	R	80	Confident	75.9	Confident	54 Å²	54	71.9 Å²	71.9	20%	0.204	34%	0.344	C	S	.	.	G	3₁₀ helix	trans	-62.2	-28.2	170.7	72.4	-166.6	-177	-175.8	4.8	112.5	Q61 A63 E64 Y66 W67 V160 Q164 Q165	Q61-R162 PolarHBondContact O-NH1 3.1Å; Q61-R162 PolarHBondContact O-NH2 3.35Å; A63-R162 PolarHBondContact O-NH1 3.21Å; E64-R162 PolarHBondContact O-N 2.92Å; Y66-R162 VanDerWaalsContact O-CD 3.31Å; Y66-R162 WeakPolarHBondContact O-CD 3.22Å; Y66-R162 PolarHBondContact O-NH1 3.3Å; Y66-R162 VanDerWaalsContact O-NH1 3.13Å; W67-R162 HydrophobicContact CD2-CB 4.16Å; W67-R162 HydrophobicContact CE3-CB 4.39Å; W67-R162 HydrophobicContact CH2-CB 4.2Å; W67-R162 VanDerWaalsContact CZ2-CA 3.41Å; W67-R162 HydrophobicContact CZ2-CB 3.99Å; W67-R162 HydrophobicContact CZ3-CB 4.4Å; V160-R162 PolarHBondContact O-N 3.32Å; R162-Q164 PolarHBondContact O-N 3.07Å; R162-Q165 PolarHBondContact O-N 2.9Å
163	Y	70.7	Confident	75.8	Confident	88 Å²	88	75.7 Å²	75.7	35%	0.345	37%	0.365	S	S	.	.	G	3₁₀ helix	trans	-76.7	-8.9	176.4	-51.9	-61.8	0	0	0	113.3	D62 E64 S161 Q165 D166 Q167	D62-Y163 PolarHBondContact O-OH 2.7Å; E64-Y163 HydrophobicContact CB-CD2 3.75Å; E64-Y163 HydrophobicContact CB-CE2 3.87Å; S161-Y163 PolarHBondContact O-N 2.92Å; S161-Y163 PolarHBondContact OG-N 3.49Å; Y163-Q165 PolarHBondContact O-N 3.26Å; Y163-Q165 VanDerWaalsContact O-N 3.14Å; Y163-D166 PolarHBondContact O-N 2.92Å; Y163-Q167 PolarHBondContact O-N 2.93Å; Y163-Q167 VanDerWaalsContact O-N 3.1Å
164	Q	64.5	Low	75.5	Confident	112 Å²	112	73 Å²	73	52%	0.523	35%	0.35	S	S	.	.	G	3₁₀ helix	trans	-59.5	-23.8	172.3	-164.6	171.2	16.7	0	0	111.5	S161 R162 L168	S161-Q164 WeakPolarHBondContact O-CB 3.48Å; S161-Q164 PolarHBondContact O-N 3.02Å; S161-Q164 VanDerWaalsContact O-N 3.1Å; R162-Q164 PolarHBondContact O-N 3.07Å; Q164-L168 WeakPolarHBondContact O-CD1 3.07Å; Q164-L168 WeakPolarHBondContact O-CG 3.26Å
165	Q	55.8	Low	75.3	Confident	25 Å²	25	76.5 Å²	76.5	12%	0.117	37%	0.368	C	S	.	.	T	Hydrogen-bonded Turn	trans	-75.5	-39.7	172.6	-70.6	176.6	-29.6	0	0	112.6	R162 Y163 Q167 L168 V169	R162-Q165 PolarHBondContact O-N 2.9Å; Y163-Q165 PolarHBondContact O-N 3.26Å; Y163-Q165 VanDerWaalsContact O-N 3.14Å; Q165-Q167 VanDerWaalsContact C-N 3.31Å; Q165-Q167 PolarHBondContact O-N 2.75Å; Q165-L168 PolarHBondContact O-N 2.63Å; Q165-V169 PolarHBondContact O-N 2.83Å
166	D	53.3	Low	75.1	Confident	71 Å²	71	73.8 Å²	73.8	38%	0.38	36%	0.362	S	S	.	.	T	Hydrogen-bonded Turn	trans	-66.2	-29.8	176	-76.8	-28.3	0	0	0	112.7	Y163 L168 W315	Y163-D166 PolarHBondContact O-N 2.92Å; D166-L168 VanDerWaalsContact C-N 3.32Å; D166-L168 PolarHBondContact O-N 3.1Å; D166-W315 VanDerWaalsContact OD1-CD1 3.22Å; D166-W315 PolarHBondContact OD1-NE1 2.94Å
167	Q	52.7	Low	74.8	Confident	159 Å²	159	73.8 Å²	73.8	74%	0.743	36%	0.362	S	S	*	.	T	Hydrogen-bonded Turn	trans	-73.7	-21.4	175.9	-71.9	-171.1	-1.8	0	0	114	Y163 Q165	Y163-Q167 PolarHBondContact O-N 2.93Å; Y163-Q167 VanDerWaalsContact O-N 3.1Å; Q165-Q167 VanDerWaalsContact C-N 3.31Å; Q165-Q167 PolarHBondContact O-N 2.75Å
168	L	55.7	Low	74.7	Confident	95 Å²	95	69.9 Å²	69.9	50%	0.497	34%	0.343	S	S	.	.	T	Hydrogen-bonded Turn	trans	-87.5	-34.5	-177.7	-71.3	168.6	0	0	0	111.9	Q164 Q165 D166 K170	Q164-L168 WeakPolarHBondContact O-CD1 3.07Å; Q164-L168 WeakPolarHBondContact O-CG 3.26Å; Q165-L168 PolarHBondContact O-N 2.63Å; D166-L168 VanDerWaalsContact C-N 3.32Å; D166-L168 PolarHBondContact O-N 3.1Å; L168-K170 PolarHBondContact O-N 2.78Å
169	V	60.7	Low	74.6	Confident	8 Å²	8	70.5 Å²	70.5	5%	0.048	35%	0.348	C	S	.	.			trans	-90.3	90.2	173.3	-174.9	0	0	0	0	108.2	Q165 E171 V177 W315	Q165-V169 PolarHBondContact O-N 2.83Å; V169-E171 PolarHBondContact O-N 2.88Å; V169-V177 HydrophobicContact CG1-CB 4.21Å; V169-V177 HydrophobicContact CG1-CG1 3.72Å; V169-V177 HydrophobicContact CG1-CG2 3.35Å; V169-W315 HydrophobicContact CB-CD2 4.44Å; V169-W315 HydrophobicContact CB-CG 4.25Å; V169-W315 HydrophobicContact CG1-CD2 4.17Å; V169-W315 HydrophobicContact CG1-CG 4.45Å; V169-W315 HydrophobicContact CG2-CB 4.16Å; V169-W315 HydrophobicContact CG2-CG 4.02Å
170	K	64.9	Low	74.5	Confident	193 Å²	193	71.5 Å²	71.5	84%	0.839	35%	0.348	S	S	*	.			trans	-67.9	8.1	-176.5	-61.2	-174.7	179.3	-179.1	0	115	L168	L168-K170 PolarHBondContact O-N 2.78Å
171	E	69.6	Low	74.5	Confident	62 Å²	62	70.8 Å²	70.8	29%	0.29	34%	0.344	S	S	.	.			trans	-123	124.8	-174.8	-76	176.4	-176.4	0	0	110.3	V169 N173 A176 V177 K180	V169-E171 PolarHBondContact O-N 2.88Å; E171-N173 VanDerWaalsContact C-N 3.34Å; E171-A176 WeakPolarHBondContact OE2-CB 3.48Å; E171-V177 HydrophobicContact CB-CG2 3.85Å; E171-V177 VanDerWaalsContact O-CG2 3.29Å; E171-V177 WeakPolarHBondContact O-CG2 3.39Å; E171-K180 VanDerWaalsContact CD-CE 3.41Å; E171-K180 WeakPolarHBondContact OE1-CE 3.25Å; E171-K180 IonicContact OE1-NZ 3.48Å; E171-K180 PolarHBondContact OE1-NZ 3.07Å; E171-K180 WeakPolarHBondContact OE2-CE 3.38Å; E171-K180 IonicContact OE2-NZ 2.75Å; E171-K180 PolarHBondContact OE2-NZ 2.96Å
172	D	71.3	Confident	74.8	Confident	145 Å²	145	74.7 Å²	74.7	78%	0.775	36%	0.36	S	S	*	.			trans	-82.9	-13	178.3	-63.3	-48.7	0	0	0	112.9	I174	D172-I174 PolarHBondContact O-N 3.42Å
173	N	83.9	Confident	75.3	Confident	94 Å²	94	76.6 Å²	76.6	50%	0.503	37%	0.371	S	S	.	.			trans	-83.6	114.6	-178.2	-174.6	-11.2	0	0	0	111.3	E171 D175 A176 V177	E171-N173 VanDerWaalsContact C-N 3.34Å; N173-D175 PolarHBondContact O-N 3.06Å; N173-D175 PolarHBondContact OD1-N 3.33Å; N173-A176 HydrophobicContact CB-CB 3.99Å; N173-A176 PolarHBondContact O-N 3.43Å; N173-A176 VanDerWaalsContact O-N 3.08Å; N173-V177 WeakPolarHBondContact O-CG2 3.42Å; N173-V177 PolarHBondContact O-N 3.45Å
174	I	83.6	Confident	76.3	Confident	51 Å²	51	75.6 Å²	75.6	26%	0.262	37%	0.367	S	S	.	.	H	α-helix	trans	-51.9	-40.1	178.4	-63.8	174.3	0	0	0	112.4	D172 G178 W315 L316 K319 V321 W329	D172-I174 PolarHBondContact O-N 3.42Å; I174-G178 PolarHBondContact O-N 3.47Å; I174-W315 HydrophobicContact CG1-CH2 4.47Å; I174-W315 HydrophobicContact CG1-CZ3 4.39Å; I174-L316 HydrophobicContact CG2-CD2 3.99Å; I174-K319 HydrophobicContact CD1-CB 4.22Å; I174-K319 HydrophobicContact CG1-CB 4.39Å; I174-V321 HydrophobicContact CG2-CG2 3.49Å; I174-V321 VanDerWaalsContact CG2-CG2 3.49Å; I174-W329 HydrophobicContact CG2-CH2 4.11Å
175	D	84.9	Confident	77.6	Confident	91 Å²	91	71.3 Å²	71.3	49%	0.487	35%	0.347	S	S	.	.	H	α-helix	trans	-71.4	-37.9	179.9	-80.2	-66	0	0	0	113	N173 G178 K179 R325	N173-D175 PolarHBondContact O-N 3.06Å; N173-D175 PolarHBondContact OD1-N 3.33Å; D175-G178 PolarHBondContact O-N 3.22Å; D175-K179 PolarHBondContact O-N 3.04Å; D175-R325 IonicContact OD1-CZ 3.2Å; D175-R325 IonicContact OD1-NH2 3.59Å; D175-R325 PolarHBondContact OD1-NH2 3.36Å; D175-R325 IonicContact OD2-NH2 3.15Å; D175-R325 PolarHBondContact OD2-NH2 3.19Å
176	A	86.9	Confident	79.4	Confident	31 Å²	31	73.3 Å²	73.3	26%	0.256	36%	0.364	S	S	.	.	H	α-helix	trans	-67.4	-43.2	177.1	0	0	0	0	0	111	E171 N173 G178 K179 K180	E171-A176 WeakPolarHBondContact OE2-CB 3.48Å; N173-A176 HydrophobicContact CB-CB 3.99Å; N173-A176 PolarHBondContact O-N 3.43Å; N173-A176 VanDerWaalsContact O-N 3.08Å; A176-G178 VanDerWaalsContact C-N 3.34Å; A176-G178 PolarHBondContact O-N 3Å; A176-K179 PolarHBondContact O-N 3.47Å; A176-K180 PolarHBondContact O-N 2.91Å
177	V	86.6	Confident	81.3	Confident	0 Å²	0	74.2 Å²	74.2	0%	0	37%	0.366	C	S	.	.	H	α-helix	trans	-64.9	-38.8	174.7	-179.5	0	0	0	0	111.3	V169 E171 N173 K180 L181 W315 L316	V169-V177 HydrophobicContact CG1-CB 4.21Å; V169-V177 HydrophobicContact CG1-CG1 3.72Å; V169-V177 HydrophobicContact CG1-CG2 3.35Å; E171-V177 HydrophobicContact CB-CG2 3.85Å; E171-V177 VanDerWaalsContact O-CG2 3.29Å; E171-V177 WeakPolarHBondContact O-CG2 3.39Å; N173-V177 WeakPolarHBondContact O-CG2 3.42Å; N173-V177 PolarHBondContact O-N 3.45Å; V177-K180 PolarHBondContact O-N 3.14Å; V177-L181 WeakPolarHBondContact O-CB 3.33Å; V177-L181 PolarHBondContact O-N 3.16Å; V177-W315 HydrophobicContact CB-CE3 4.11Å; V177-W315 HydrophobicContact CB-CH2 4.42Å; V177-W315 HydrophobicContact CB-CZ3 3.75Å; V177-W315 HydrophobicContact CG1-CD2 4.39Å; V177-W315 HydrophobicContact CG1-CE3 3.62Å; V177-W315 HydrophobicContact CG1-CZ3 3.81Å; V177-W315 HydrophobicContact CG2-CE3 4.19Å; V177-W315 HydrophobicContact CG2-CH2 3.85Å; V177-W315 HydrophobicContact CG2-CZ3 3.67Å; V177-L316 HydrophobicContact CB-CD2 4.15Å; V177-L316 HydrophobicContact CG1-CD1 4.35Å; V177-L316 HydrophobicContact CG1-CD2 3.97Å; V177-L316 HydrophobicContact CG1-CG 4.02Å
178	G	87.2	Confident	83.2	Confident	0 Å²	0	68.8 Å²	68.8	0%	0	34%	0.339	C	S	.	.	H	α-helix	trans	-61.1	-43.2	173.6	0	0	0	0	0	113.1	I174 D175 A176 L181 Q182	I174-G178 PolarHBondContact O-N 3.47Å; D175-G178 PolarHBondContact O-N 3.22Å; A176-G178 VanDerWaalsContact C-N 3.34Å; A176-G178 PolarHBondContact O-N 3Å; G178-L181 WeakPolarHBondContact O-CB 3.37Å; G178-L181 PolarHBondContact O-N 2.94Å; G178-Q182 PolarHBondContact O-N 3.2Å
179	K	88.7	Confident	85	Confident	129 Å²	129	68 Å²	68	56%	0.561	33%	0.333	S	S	*	.	H	α-helix	trans	-64.2	-43.1	174.6	-172.7	177.5	177.4	179.6	0	112.2	D175 A176 L181 Q182 E183	D175-K179 PolarHBondContact O-N 3.04Å; A176-K179 PolarHBondContact O-N 3.47Å; K179-L181 VanDerWaalsContact C-N 3.33Å; K179-L181 PolarHBondContact O-N 2.95Å; K179-Q182 WeakPolarHBondContact O-CB 3.45Å; K179-Q182 PolarHBondContact O-N 3.15Å; K179-E183 WeakPolarHBondContact O-CG 3.46Å; K179-E183 PolarHBondContact O-N 2.76Å
180	K	88.5	Confident	86.6	Confident	61 Å²	61	74.1 Å²	74.1	27%	0.265	36%	0.361	S	S	.	.	H	α-helix	trans	-62.3	-40	173.8	-75.4	-172.7	-179.1	175.7	0	112.6	E171 A176 V177 Q182 E183 Y184	E171-K180 VanDerWaalsContact CD-CE 3.41Å; E171-K180 WeakPolarHBondContact OE1-CE 3.25Å; E171-K180 IonicContact OE1-NZ 3.48Å; E171-K180 PolarHBondContact OE1-NZ 3.07Å; E171-K180 WeakPolarHBondContact OE2-CE 3.38Å; E171-K180 IonicContact OE2-NZ 2.75Å; E171-K180 PolarHBondContact OE2-NZ 2.96Å; A176-K180 PolarHBondContact O-N 2.91Å; V177-K180 PolarHBondContact O-N 3.14Å; K180-Q182 VanDerWaalsContact C-N 3.29Å; K180-Q182 PolarHBondContact O-N 2.97Å; K180-E183 PolarHBondContact O-N 3.33Å; K180-Y184 HydrophobicContact CB-CD2 4.34Å; K180-Y184 HydrophobicContact CB-CE2 4.11Å; K180-Y184 WeakPolarHBondContact O-CD2 3.36Å; K180-Y184 PolarHBondContact O-N 3.24Å
181	L	90.6	Very high	88	Confident	0 Å²	0	67.8 Å²	67.8	0%	0	33%	0.333	C	S	.	.	H	α-helix	trans	-57.6	-45.4	173.7	170.9	65.1	0	0	0	110.7	V177 G178 K179 E183 Y184 H185 R309 H312 L313 L316 W329 L330	V177-L181 WeakPolarHBondContact O-CB 3.33Å; V177-L181 PolarHBondContact O-N 3.16Å; G178-L181 WeakPolarHBondContact O-CB 3.37Å; G178-L181 PolarHBondContact O-N 2.94Å; K179-L181 VanDerWaalsContact C-N 3.33Å; K179-L181 PolarHBondContact O-N 2.95Å; L181-E183 VanDerWaalsContact C-N 3.35Å; L181-E183 PolarHBondContact O-N 3.3Å; L181-Y184 PolarHBondContact O-N 3.38Å; L181-H185 WeakPolarHBondContact O-CB 3.4Å; L181-H185 PolarHBondContact O-N 3.48Å; L181-R309 HydrophobicContact CD1-CG 3.7Å; L181-H312 HydrophobicContact CB-CB 4.19Å; L181-H312 HydrophobicContact CD1-CB 4.02Å; L181-L313 HydrophobicContact CD1-CD2 4.15Å; L181-L313 HydrophobicContact CD1-CG 3.86Å; L181-L313 HydrophobicContact CD2-CD2 3.55Å; L181-L313 HydrophobicContact CD2-CG 4.14Å; L181-L313 HydrophobicContact CG-CD2 4.48Å; L181-L316 HydrophobicContact CB-CD1 4.29Å; L181-L316 HydrophobicContact CD2-CD1 3.55Å; L181-W329 HydrophobicContact CD2-CB 4.4Å; L181-L330 HydrophobicContact CD1-CD2 4.42Å
182	Q	90.1	Very high	89.2	Confident	100 Å²	100	66 Å²	66	47%	0.467	33%	0.328	S	S	.	.	H	α-helix	trans	-60.2	-44	176.8	-175	-178.7	11.2	0	0	111.7	G178 K179 K180 H185 S186	G178-Q182 PolarHBondContact O-N 3.2Å; K179-Q182 WeakPolarHBondContact O-CB 3.45Å; K179-Q182 PolarHBondContact O-N 3.15Å; K180-Q182 VanDerWaalsContact C-N 3.29Å; K180-Q182 PolarHBondContact O-N 2.97Å; Q182-H185 PolarHBondContact O-N 3.25Å; Q182-S186 WeakPolarHBondContact O-CB 3.38Å; Q182-S186 PolarHBondContact O-N 3Å
183	E	91.4	Very high	90.3	Very high	94 Å²	94	64.7 Å²	64.7	44%	0.439	32%	0.315	S	S	.	.	H	α-helix	trans	-62.7	-48.8	177	-70.1	171.3	-168.9	0	0	112.1	K179 K180 L181 H185 S186 Q187	K179-E183 WeakPolarHBondContact O-CG 3.46Å; K179-E183 PolarHBondContact O-N 2.76Å; K180-E183 PolarHBondContact O-N 3.33Å; L181-E183 VanDerWaalsContact C-N 3.35Å; L181-E183 PolarHBondContact O-N 3.3Å; E183-H185 VanDerWaalsContact C-N 3.33Å; E183-H185 PolarHBondContact O-N 2.99Å; E183-S186 PolarHBondContact O-N 2.95Å; E183-Q187 WeakPolarHBondContact O-CG 3.42Å; E183-Q187 PolarHBondContact O-N 2.85Å
184	Y	90.9	Very high	90.9	Very high	66 Å²	66	64.7 Å²	64.7	26%	0.259	31%	0.312	S	S	.	.	H	α-helix	trans	-64.7	-37.8	177.1	-69.7	-51.1	0	0	0	112.4	K180 L181 Y188 L305 I308 H312	K180-Y184 HydrophobicContact CB-CD2 4.34Å; K180-Y184 HydrophobicContact CB-CE2 4.11Å; K180-Y184 WeakPolarHBondContact O-CD2 3.36Å; K180-Y184 PolarHBondContact O-N 3.24Å; L181-Y184 PolarHBondContact O-N 3.38Å; Y184-Y188 VanDerWaalsContact O-CB 3.31Å; Y184-Y188 WeakPolarHBondContact O-CB 3.38Å; Y184-Y188 PolarHBondContact O-N 2.7Å; Y184-L305 HydrophobicContact CD1-CD2 4.15Å; Y184-I308 HydrophobicContact CD1-CG2 4.18Å; Y184-I308 HydrophobicContact CD2-CG2 3.67Å; Y184-I308 HydrophobicContact CE1-CG2 4.16Å; Y184-I308 HydrophobicContact CE2-CG2 3.65Å; Y184-I308 HydrophobicContact CG-CG2 3.96Å; Y184-H312 AromaticContact CE2-CE1 3.66Å; Y184-H312 AromaticContact CE2-NE2 3.64Å
185	H	92.5	Very high	91.5	Very high	23 Å²	23	64.1 Å²	64.1	11%	0.106	31%	0.307	C	S	.	.	H	α-helix	trans	-64.4	-44.8	176.1	-175.3	68.7	0	0	0	111.3	L181 Q182 E183 Y188 Q189 L330	L181-H185 WeakPolarHBondContact O-CB 3.4Å; L181-H185 PolarHBondContact O-N 3.48Å; Q182-H185 PolarHBondContact O-N 3.25Å; E183-H185 VanDerWaalsContact C-N 3.33Å; E183-H185 PolarHBondContact O-N 2.99Å; H185-Y188 WeakPolarHBondContact O-CB 3.47Å; H185-Y188 PolarHBondContact O-N 2.96Å; H185-Q189 PolarHBondContact NE2-NE2 3.02Å; H185-Q189 WeakPolarHBondContact O-CG 3.41Å; H185-Q189 PolarHBondContact O-N 3.42Å; H185-L330 HydrophobicContact CB-CD2 4.25Å; H185-L330 PolarHBondContact CD2-O 3.19Å; H185-L330 PolarHBondContact NE2-O 3.06Å
186	S	92.4	Very high	92	Very high	66 Å²	66	63.3 Å²	63.3	46%	0.462	30%	0.302	S	S	.	.	H	α-helix	trans	-60.7	-48.2	176.4	-172.3	0	0	0	0	111.9	Q182 E183 Y188 Q189 E190	Q182-S186 WeakPolarHBondContact O-CB 3.38Å; Q182-S186 PolarHBondContact O-N 3Å; E183-S186 PolarHBondContact O-N 2.95Å; S186-Y188 VanDerWaalsContact C-N 3.32Å; S186-Y188 PolarHBondContact O-N 3.47Å; S186-Q189 PolarHBondContact O-N 3.32Å; S186-Q189 VanDerWaalsContact O-N 3.17Å; S186-E190 PolarHBondContact O-N 2.92Å
187	Q	93.6	Very high	92.4	Very high	90 Å²	90	70 Å²	70	42%	0.421	32%	0.321	S	S	.	.	H	α-helix	trans	-60.7	-40.5	176.3	-71	174.7	31.6	0	0	112.4	E183 E190 K191 L305	E183-Q187 WeakPolarHBondContact O-CG 3.42Å; E183-Q187 PolarHBondContact O-N 2.85Å; Q187-E190 PolarHBondContact O-N 2.98Å; Q187-K191 PolarHBondContact O-N 3.42Å; Q187-L305 HydrophobicContact CB-CD1 4.23Å; Q187-L305 HydrophobicContact CB-CD2 4.22Å
188	Y	93.7	Very high	92.9	Very high	46 Å²	46	70.9 Å²	70.9	18%	0.18	33%	0.325	C	S	.	.	H	α-helix	trans	-61.4	-46.9	174.5	171	-91.2	0	0	0	111.3	Y184 H185 S186 E190 K191 S192 L302 L305 R306	Y184-Y188 VanDerWaalsContact O-CB 3.31Å; Y184-Y188 WeakPolarHBondContact O-CB 3.38Å; Y184-Y188 PolarHBondContact O-N 2.7Å; H185-Y188 WeakPolarHBondContact O-CB 3.47Å; H185-Y188 PolarHBondContact O-N 2.96Å; S186-Y188 VanDerWaalsContact C-N 3.32Å; S186-Y188 PolarHBondContact O-N 3.47Å; Y188-E190 PolarHBondContact O-N 3.48Å; Y188-K191 PolarHBondContact O-N 3.15Å; Y188-S192 VanDerWaalsContact O-CB 3.24Å; Y188-S192 WeakPolarHBondContact O-CB 3.49Å; Y188-S192 PolarHBondContact O-N 3.3Å; Y188-L302 HydrophobicContact CD2-CD1 3.65Å; Y188-L302 HydrophobicContact CD2-CG 4.34Å; Y188-L302 HydrophobicContact CE2-CD1 3.54Å; Y188-L302 HydrophobicContact CE2-CG 3.9Å; Y188-L302 HydrophobicContact CG-CD1 4.48Å; Y188-L305 HydrophobicContact CD2-CB 4.25Å; Y188-R306 HydrophobicContact CD2-CB 4.1Å; Y188-R306 HydrophobicContact CE2-CB 3.79Å; Y188-R306 HydrophobicContact CE2-CG 4.41Å
189	Q	93.3	Very high	93.3	Very high	78 Å²	78	76.8 Å²	76.8	36%	0.364	35%	0.349	S	S	.	.	H	α-helix	trans	-61.9	-42.9	178.9	-74.2	-171.8	-7.6	0	0	111.9	H185 S186 S192 K193	H185-Q189 PolarHBondContact NE2-NE2 3.02Å; H185-Q189 WeakPolarHBondContact O-CG 3.41Å; H185-Q189 PolarHBondContact O-N 3.42Å; S186-Q189 PolarHBondContact O-N 3.32Å; S186-Q189 VanDerWaalsContact O-N 3.17Å; Q189-S192 PolarHBondContact O-N 3.48Å; Q189-K193 WeakPolarHBondContact O-CB 3.26Å; Q189-K193 VanDerWaalsContact O-CG 3.3Å; Q189-K193 WeakPolarHBondContact O-CG 3.43Å; Q189-K193 PolarHBondContact O-N 2.92Å
190	E	94.1	Very high	93.7	Very high	137 Å²	137	76.7 Å²	76.7	64%	0.64	35%	0.35	S	S	*	.	H	α-helix	trans	-63.4	-49.8	178.5	-173.3	173.2	-162.8	0	0	111.5	S186 Q187 Y188 S192 K193 E194	S186-E190 PolarHBondContact O-N 2.92Å; Q187-E190 PolarHBondContact O-N 2.98Å; Y188-E190 PolarHBondContact O-N 3.48Å; E190-S192 VanDerWaalsContact C-N 3.32Å; E190-S192 PolarHBondContact O-N 2.92Å; E190-K193 PolarHBondContact O-N 3.48Å; E190-E194 PolarHBondContact O-N 3.44Å
191	K	94.1	Very high	94	Very high	59 Å²	59	77.7 Å²	77.7	26%	0.257	36%	0.356	S	S	.	.	H	α-helix	trans	-64.5	-34.9	176.3	-74.9	-160.6	178.6	-178.5	0	113	Q187 Y188 E194 Y195 I298 D301 L302 L305	Q187-K191 PolarHBondContact O-N 3.42Å; Y188-K191 PolarHBondContact O-N 3.15Å; K191-E194 PolarHBondContact O-N 2.88Å; K191-Y195 WeakPolarHBondContact O-CB 3.4Å; K191-Y195 PolarHBondContact O-N 2.87Å; K191-I298 HydrophobicContact CB-CG2 4.43Å; K191-D301 HydrophobicContact CD-CB 4.07Å; K191-D301 VanDerWaalsContact NZ-CB 3.34Å; K191-D301 VanDerWaalsContact NZ-CG 3.34Å; K191-D301 IonicContact NZ-OD2 2.8Å; K191-D301 PolarHBondContact NZ-OD2 3.44Å; K191-L302 HydrophobicContact CB-CD1 4.19Å; K191-L305 HydrophobicContact CD-CD1 3.8Å; K191-L305 HydrophobicContact CG-CD1 4.38Å
192	S	94.4	Very high	94.3	Very high	25 Å²	25	81.2 Å²	81.2	18%	0.175	37%	0.37	C	S	.	.	H	α-helix	trans	-62.9	-48.4	174.5	-167.2	0	0	0	0	110.5	Y188 Q189 E190 E194 Y195 D196	Y188-S192 VanDerWaalsContact O-CB 3.24Å; Y188-S192 WeakPolarHBondContact O-CB 3.49Å; Y188-S192 PolarHBondContact O-N 3.3Å; Q189-S192 PolarHBondContact O-N 3.48Å; E190-S192 VanDerWaalsContact C-N 3.32Å; E190-S192 PolarHBondContact O-N 2.92Å; S192-E194 VanDerWaalsContact C-N 3.31Å; S192-E194 PolarHBondContact O-N 3.42Å; S192-Y195 WeakPolarHBondContact O-CB 3.38Å; S192-Y195 PolarHBondContact O-N 3.45Å; S192-Y195 VanDerWaalsContact O-N 3.16Å; S192-D196 PolarHBondContact O-N 3.41Å
193	K	95.8	Very high	94.6	Very high	118 Å²	118	78.8 Å²	78.8	51%	0.513	36%	0.362	S	S	.	.	H	α-helix	trans	-61.7	-38.1	176.8	-73	173.2	-176.6	176.1	0	112.3	Q189 E190 R197	Q189-K193 WeakPolarHBondContact O-CB 3.26Å; Q189-K193 VanDerWaalsContact O-CG 3.3Å; Q189-K193 WeakPolarHBondContact O-CG 3.43Å; Q189-K193 PolarHBondContact O-N 2.92Å; E190-K193 PolarHBondContact O-N 3.48Å; K193-R197 VanDerWaalsContact O-CG 3.29Å; K193-R197 WeakPolarHBondContact O-CG 3.21Å; K193-R197 PolarHBondContact O-N 3.29Å; K193-R197 VanDerWaalsContact O-N 3.11Å
194	E	95.4	Very high	94.8	Very high	93 Å²	93	80.3 Å²	80.3	44%	0.435	36%	0.363	S	S	.	.	H	α-helix	trans	-63.3	-45.6	174	-174	-178.8	-177.3	0	0	111.5	E190 K191 S192 D196 R197 L198 I298	E190-E194 PolarHBondContact O-N 3.44Å; K191-E194 PolarHBondContact O-N 2.88Å; S192-E194 VanDerWaalsContact C-N 3.31Å; S192-E194 PolarHBondContact O-N 3.42Å; E194-D196 PolarHBondContact O-N 3.4Å; E194-R197 PolarHBondContact O-N 3.36Å; E194-L198 HydrophobicContact CG-CD1 4.38Å; E194-L198 WeakPolarHBondContact O-CG 3.42Å; E194-L198 PolarHBondContact O-N 3.33Å; E194-I298 HydrophobicContact CG-CD1 4.09Å
195	Y	96.4	Very high	95	Very high	40 Å²	40	77.7 Å²	77.7	16%	0.157	35%	0.354	C	S	.	.	H	α-helix	trans	-60	-45	176	-177.2	-90.3	0	0	0	112	K191 S192 R197 L198 Y199 M295 K299	K191-Y195 WeakPolarHBondContact O-CB 3.4Å; K191-Y195 PolarHBondContact O-N 2.87Å; S192-Y195 WeakPolarHBondContact O-CB 3.38Å; S192-Y195 PolarHBondContact O-N 3.45Å; S192-Y195 VanDerWaalsContact O-N 3.16Å; Y195-R197 PolarHBondContact O-N 3.49Å; Y195-L198 PolarHBondContact O-N 2.92Å; Y195-Y199 WeakPolarHBondContact O-CB 3.29Å; Y195-Y199 PolarHBondContact O-N 3.02Å; Y195-M295 HydrophobicContact CD2-CB 4.43Å; Y195-M295 HydrophobicContact CD2-CG 4.48Å; Y195-M295 HydrophobicContact CE2-CB 3.98Å; Y195-M295 HydrophobicContact CE2-CE 4.01Å; Y195-M295 HydrophobicContact CE2-CG 4.26Å; Y195-K299 HydrophobicContact CD2-CG 4.43Å; Y195-K299 HydrophobicContact CE2-CD 4.35Å; Y195-K299 HydrophobicContact CE2-CG 3.68Å; Y195-K299 WeakPolarHBondContact OH-CE 3.42Å
196	D	94.9	Very high	95.2	Very high	73 Å²	73	79.1 Å²	79.1	39%	0.39	37%	0.367	S	S	.	.	H	α-helix	trans	-60.8	-44.4	179.2	-63.8	-25.6	0	0	0	111.2	S192 E194 L198 Y199 E200	S192-D196 PolarHBondContact O-N 3.41Å; E194-D196 PolarHBondContact O-N 3.4Å; D196-L198 PolarHBondContact O-N 3.11Å; D196-Y199 PolarHBondContact O-N 3.05Å; D196-E200 WeakPolarHBondContact O-CG 3.25Å; D196-E200 PolarHBondContact O-N 3.26Å
197	R	96.3	Very high	95.4	Very high	172 Å²	172	81.9 Å²	81.9	65%	0.649	37%	0.373	S	S	*	.	H	α-helix	trans	-60.1	-45.2	174.9	-71.4	172.3	-170.9	173.1	3.8	112.5	K193 E194 Y195 Y199 E200 E201	K193-R197 VanDerWaalsContact O-CG 3.29Å; K193-R197 WeakPolarHBondContact O-CG 3.21Å; K193-R197 PolarHBondContact O-N 3.29Å; K193-R197 VanDerWaalsContact O-N 3.11Å; E194-R197 PolarHBondContact O-N 3.36Å; Y195-R197 PolarHBondContact O-N 3.49Å; R197-Y199 VanDerWaalsContact C-N 3.3Å; R197-Y199 PolarHBondContact O-N 3.15Å; R197-E200 PolarHBondContact O-N 2.99Å; R197-E201 WeakPolarHBondContact O-CB 3.26Å; R197-E201 PolarHBondContact O-N 3.49Å
198	L	96	Very high	95.5	Very high	18 Å²	18	81.2 Å²	81.2	9%	0.094	37%	0.369	C	S	.	.	H	α-helix	trans	-64.1	-38	177.5	-70.8	171.5	0	0	0	111.3	E194 Y195 D196 E201 Y202 I291 K294 M295 I298	E194-L198 HydrophobicContact CG-CD1 4.38Å; E194-L198 WeakPolarHBondContact O-CG 3.42Å; E194-L198 PolarHBondContact O-N 3.33Å; Y195-L198 PolarHBondContact O-N 2.92Å; D196-L198 PolarHBondContact O-N 3.11Å; L198-E201 PolarHBondContact O-N 3.36Å; L198-Y202 VanDerWaalsContact O-CB 3.27Å; L198-Y202 WeakPolarHBondContact O-CB 3.43Å; L198-Y202 PolarHBondContact O-N 3.05Å; L198-I291 HydrophobicContact CB-CG2 4.27Å; L198-I291 HydrophobicContact CD2-CG2 4.26Å; L198-I291 WeakPolarHBondContact O-CG2 3.25Å; L198-K294 HydrophobicContact CD1-CB 4.08Å; L198-K294 HydrophobicContact CD2-CD 4.45Å; L198-M295 HydrophobicContact CB-CG 3.67Å; L198-M295 HydrophobicContact CB-SD 4.29Å; L198-M295 HydrophobicContact CD1-CG 4.21Å; L198-I298 HydrophobicContact CD1-CD1 3.58Å
199	Y	96.4	Very high	95.6	Very high	124 Å²	124	79.5 Å²	79.5	49%	0.486	36%	0.363	S	S	.	.	H	α-helix	trans	-67.1	-42.1	178.1	-173.7	-93.9	0	0	0	112.4	Y195 D196 R197 Y202 T203 M295	Y195-Y199 WeakPolarHBondContact O-CB 3.29Å; Y195-Y199 PolarHBondContact O-N 3.02Å; D196-Y199 PolarHBondContact O-N 3.05Å; R197-Y199 VanDerWaalsContact C-N 3.3Å; R197-Y199 PolarHBondContact O-N 3.15Å; Y199-Y202 PolarHBondContact O-N 3Å; Y199-T203 WeakPolarHBondContact O-CB 3.33Å; Y199-T203 PolarHBondContact O-N 2.95Å; Y199-T203 PolarHBondContact O-OG1 3.07Å; Y199-M295 HydrophobicContact CD2-CE 3.68Å
200	E	96.6	Very high	95.8	Very high	128 Å²	128	80.7 Å²	80.7	60%	0.598	37%	0.369	S	S	*	.	H	α-helix	trans	-60.6	-46.1	173	-73.5	175.8	-175.2	0	0	111.5	D196 R197 T203 R204	D196-E200 WeakPolarHBondContact O-CG 3.25Å; D196-E200 PolarHBondContact O-N 3.26Å; R197-E200 PolarHBondContact O-N 2.99Å; E200-T203 PolarHBondContact O-N 2.93Å; E200-R204 WeakPolarHBondContact O-CB 3.49Å; E200-R204 PolarHBondContact O-N 2.75Å
201	E	95.7	Very high	96	Very high	81 Å²	81	80.6 Å²	80.6	38%	0.379	37%	0.37	S	S	.	.	H	α-helix	trans	-64.1	-43.1	177.4	-175.1	174.7	-168.2	0	0	112.2	R197 L198 R204 T205 I291	R197-E201 WeakPolarHBondContact O-CB 3.26Å; R197-E201 PolarHBondContact O-N 3.49Å; L198-E201 PolarHBondContact O-N 3.36Å; E201-R204 PolarHBondContact O-N 2.87Å; E201-T205 VanDerWaalsContact O-CB 3.24Å; E201-T205 WeakPolarHBondContact O-CB 3.23Å; E201-T205 PolarHBondContact O-N 3.1Å; E201-T205 PolarHBondContact O-OG1 2.87Å; E201-I291 HydrophobicContact CB-CD1 4.49Å; E201-I291 HydrophobicContact CG-CD1 3.69Å
202	Y	96.4	Very high	96.1	Very high	75 Å²	75	80.1 Å²	80.1	29%	0.294	37%	0.368	S	S	.	.	H	α-helix	trans	-58.3	-48.5	175	175.4	-95.9	0	0	0	111.4	L198 Y199 T205 S206 N288 I291 D292 M295	L198-Y202 VanDerWaalsContact O-CB 3.27Å; L198-Y202 WeakPolarHBondContact O-CB 3.43Å; L198-Y202 PolarHBondContact O-N 3.05Å; Y199-Y202 PolarHBondContact O-N 3Å; Y202-T205 PolarHBondContact O-N 3.42Å; Y202-S206 VanDerWaalsContact O-CB 3.25Å; Y202-S206 WeakPolarHBondContact O-CB 3.24Å; Y202-S206 PolarHBondContact O-N 3.31Å; Y202-N288 VanDerWaalsContact CD2-OD1 3.23Å; Y202-N288 WeakPolarHBondContact CD2-OD1 3.47Å; Y202-N288 WeakPolarHBondContact CE2-ND2 3.39Å; Y202-N288 PolarHBondContact O-OD1 2.8Å; Y202-I291 HydrophobicContact CD2-CG2 4.44Å; Y202-D292 HydrophobicContact CD2-CB 4.46Å; Y202-D292 HydrophobicContact CE2-CB 4.13Å; Y202-M295 HydrophobicContact CG-SD 4.31Å
203	T	95.6	Very high	96.2	Very high	48 Å²	48	85 Å²	85	29%	0.294	38%	0.382	S	S	.	.	H	α-helix	trans	-64.3	-45.7	-177.8	-56.9	0	0	0	0	111	Y199 E200 S206 Q207	Y199-T203 WeakPolarHBondContact O-CB 3.33Å; Y199-T203 PolarHBondContact O-N 2.95Å; Y199-T203 PolarHBondContact O-OG1 3.07Å; E200-T203 PolarHBondContact O-N 2.93Å; T203-S206 PolarHBondContact O-N 3.2Å; T203-Q207 WeakPolarHBondContact O-CG 3.41Å; T203-Q207 PolarHBondContact O-N 2.91Å; T203-Q207 VanDerWaalsContact O-N 3.09Å
204	R	96.1	Very high	96.3	Very high	126 Å²	126	83 Å²	83	48%	0.475	38%	0.38	S	S	.	.	H	α-helix	trans	-59.5	-50.1	175.3	-179	178.7	63.9	-118.3	1.4	111.4	E200 E201 S206 Q207 E208	E200-R204 WeakPolarHBondContact O-CB 3.49Å; E200-R204 PolarHBondContact O-N 2.75Å; E201-R204 PolarHBondContact O-N 2.87Å; R204-S206 VanDerWaalsContact C-N 3.3Å; R204-S206 PolarHBondContact O-N 3.38Å; R204-Q207 PolarHBondContact O-N 3.03Å; R204-E208 PolarHBondContact O-N 3.03Å
205	T	94.9	Very high	96.4	Very high	12 Å²	12	80.3 Å²	80.3	7%	0.074	37%	0.374	C	S	.	.	H	α-helix	trans	-62.5	-38.5	-179.8	-57.5	0	0	0	0	111.6	E201 Y202 Q207 E208 I209 Q284 N288	E201-T205 VanDerWaalsContact O-CB 3.24Å; E201-T205 WeakPolarHBondContact O-CB 3.23Å; E201-T205 PolarHBondContact O-N 3.1Å; E201-T205 PolarHBondContact O-OG1 2.87Å; Y202-T205 PolarHBondContact O-N 3.42Å; T205-Q207 PolarHBondContact O-N 2.85Å; T205-E208 PolarHBondContact O-N 3.29Å; T205-I209 HydrophobicContact CG2-CD1 4.13Å; T205-I209 WeakPolarHBondContact O-CB 3.47Å; T205-I209 VanDerWaalsContact O-CG1 3.26Å; T205-I209 WeakPolarHBondContact O-CG1 3.27Å; T205-I209 PolarHBondContact O-N 3.09Å; T205-Q284 HydrophobicContact CG2-CG 3.53Å; T205-N288 HydrophobicContact CG2-CB 3.73Å
206	S	96.3	Very high	96.5	Very high	52 Å²	52	79.1 Å²	79.1	36%	0.364	37%	0.37	S	S	.	.	H	α-helix	trans	-62.9	-40.6	175.8	-171.4	0	0	0	0	112.3	Y202 T203 R204 Q210	Y202-S206 VanDerWaalsContact O-CB 3.25Å; Y202-S206 WeakPolarHBondContact O-CB 3.24Å; Y202-S206 PolarHBondContact O-N 3.31Å; T203-S206 PolarHBondContact O-N 3.2Å; R204-S206 VanDerWaalsContact C-N 3.3Å; R204-S206 PolarHBondContact O-N 3.38Å; S206-Q210 PolarHBondContact O-N 3.35Å; S206-Q210 VanDerWaalsContact O-N 3.15Å
207	Q	96.8	Very high	96.6	Very high	125 Å²	125	81.8 Å²	81.8	58%	0.584	38%	0.38	S	S	*	.	H	α-helix	trans	-65.3	-44.8	174.5	-70	174.1	-0.5	0	0	111.5	T203 R204 T205 I209 Q210 M211	T203-Q207 WeakPolarHBondContact O-CG 3.41Å; T203-Q207 PolarHBondContact O-N 2.91Å; T203-Q207 VanDerWaalsContact O-N 3.09Å; R204-Q207 PolarHBondContact O-N 3.03Å; T205-Q207 PolarHBondContact O-N 2.85Å; Q207-I209 VanDerWaalsContact C-N 3.34Å; Q207-I209 PolarHBondContact O-N 3.28Å; Q207-Q210 WeakPolarHBondContact O-CB 3.43Å; Q207-Q210 PolarHBondContact O-N 2.69Å; Q207-Q210 VanDerWaalsContact O-N 3.1Å; Q207-M211 WeakPolarHBondContact O-CG 3.21Å; Q207-M211 PolarHBondContact O-N 2.83Å
208	E	95.9	Very high	96.7	Very high	75 Å²	75	76.2 Å²	76.2	35%	0.35	37%	0.371	S	S	.	.	H	α-helix	trans	-61.1	-40.7	177	-71.5	178.9	-154.9	0	0	112.4	R204 T205 Q210 M211 K212 Q284	R204-E208 PolarHBondContact O-N 3.03Å; T205-E208 PolarHBondContact O-N 3.29Å; E208-Q210 VanDerWaalsContact C-N 3.3Å; E208-Q210 PolarHBondContact O-N 3.18Å; E208-M211 PolarHBondContact O-N 3.38Å; E208-K212 WeakPolarHBondContact O-CG 3.48Å; E208-K212 PolarHBondContact O-N 3.37Å; E208-Q284 PolarHBondContact OE2-NE2 3.42Å
209	I	96.8	Very high	96.8	Very high	11 Å²	11	78.3 Å²	78.3	6%	0.056	38%	0.38	C	S	.	.	H	α-helix	trans	-57	-45.3	172.7	-75.8	167.8	0	0	0	110.5	T205 Q207 K212 R213 L281 Q284 A285 N288	T205-I209 HydrophobicContact CG2-CD1 4.13Å; T205-I209 WeakPolarHBondContact O-CB 3.47Å; T205-I209 VanDerWaalsContact O-CG1 3.26Å; T205-I209 WeakPolarHBondContact O-CG1 3.27Å; T205-I209 PolarHBondContact O-N 3.09Å; Q207-I209 VanDerWaalsContact C-N 3.34Å; Q207-I209 PolarHBondContact O-N 3.28Å; I209-K212 PolarHBondContact O-N 3.5Å; I209-R213 WeakPolarHBondContact O-CG 3.45Å; I209-R213 PolarHBondContact O-N 3.44Å; I209-L281 HydrophobicContact CB-CD1 4.24Å; I209-L281 HydrophobicContact CG1-CD1 4.33Å; I209-L281 HydrophobicContact CG2-CD1 3.81Å; I209-Q284 HydrophobicContact CD1-CG 4.29Å; I209-Q284 HydrophobicContact CG1-CB 4.35Å; I209-Q284 HydrophobicContact CG1-CG 3.91Å; I209-A285 HydrophobicContact CD1-CB 4.34Å; I209-N288 HydrophobicContact CD1-CB 3.79Å
210	Q	97.6	Very high	96.8	Very high	103 Å²	103	75.5 Å²	75.5	48%	0.481	37%	0.373	S	S	.	.	H	α-helix	trans	-66.5	-39.9	-179.9	-171.1	61.5	13.6	0	0	112.3	S206 Q207 E208 R213 T214	S206-Q210 PolarHBondContact O-N 3.35Å; S206-Q210 VanDerWaalsContact O-N 3.15Å; Q207-Q210 WeakPolarHBondContact O-CB 3.43Å; Q207-Q210 PolarHBondContact O-N 2.69Å; Q207-Q210 VanDerWaalsContact O-N 3.1Å; E208-Q210 VanDerWaalsContact C-N 3.3Å; E208-Q210 PolarHBondContact O-N 3.18Å; Q210-R213 PolarHBondContact O-N 3.38Å; Q210-T214 PolarHBondContact O-N 3.34Å; Q210-T214 VanDerWaalsContact O-N 3.07Å; Q210-T214 PolarHBondContact O-OG1 2.95Å
211	M	96.9	Very high	96.8	Very high	135 Å²	135	74.1 Å²	74.1	67%	0.665	37%	0.367	S	S	*	.	H	α-helix	trans	-61.4	-44.4	173.5	-67.5	171.9	65.9	0	0	111.3	Q207 E208 T214 A215	Q207-M211 WeakPolarHBondContact O-CG 3.21Å; Q207-M211 PolarHBondContact O-N 2.83Å; E208-M211 PolarHBondContact O-N 3.38Å; M211-T214 PolarHBondContact O-N 3.02Å; M211-A215 WeakPolarHBondContact O-CB 3.43Å; M211-A215 PolarHBondContact O-N 3.38Å
212	K	96.9	Very high	96.9	Very high	49 Å²	49	72.9 Å²	72.9	21%	0.213	37%	0.365	C	S	.	.	H	α-helix	trans	-64	-39.5	177.1	-73.5	-178.4	178.5	170.9	0	112.6	E208 I209 A215 I216 L277 L281 Q284	E208-K212 WeakPolarHBondContact O-CG 3.48Å; E208-K212 PolarHBondContact O-N 3.37Å; I209-K212 PolarHBondContact O-N 3.5Å; K212-A215 PolarHBondContact O-N 3.07Å; K212-I216 WeakPolarHBondContact O-CD1 3.48Å; K212-I216 WeakPolarHBondContact O-CG1 3.3Å; K212-I216 PolarHBondContact O-N 2.89Å; K212-L277 HydrophobicContact CB-CD1 4.4Å; K212-L277 HydrophobicContact CD-CD1 4.21Å; K212-L277 HydrophobicContact CG-CD1 3.96Å; K212-L281 HydrophobicContact CB-CB 4.47Å; K212-L281 HydrophobicContact CB-CD1 4.02Å; K212-Q284 VanDerWaalsContact CE-OE1 3.29Å
213	R	97.3	Very high	96.9	Very high	127 Å²	127	69.8 Å²	69.8	48%	0.479	35%	0.353	S	S	.	.	H	α-helix	trans	-59	-49.8	173.6	-75.6	173.9	177.1	175.4	-2.5	111.7	I209 Q210 A215 I216 E217 L281	I209-R213 WeakPolarHBondContact O-CG 3.45Å; I209-R213 PolarHBondContact O-N 3.44Å; Q210-R213 PolarHBondContact O-N 3.38Å; R213-A215 VanDerWaalsContact C-N 3.28Å; R213-A215 PolarHBondContact O-N 3.01Å; R213-I216 PolarHBondContact O-N 2.69Å; R213-I216 VanDerWaalsContact O-N 3.1Å; R213-E217 PolarHBondContact O-N 2.83Å; R213-L281 HydrophobicContact CG-CD1 4.16Å; R213-L281 HydrophobicContact CG-CD2 3.87Å
214	T	97.9	Very high	97	Very high	75 Å²	75	71.9 Å²	71.9	46%	0.46	36%	0.358	S	S	.	.	H	α-helix	trans	-60.3	-40.4	177.8	-50	0	0	0	0	111.2	Q210 M211 E217 A218	Q210-T214 PolarHBondContact O-N 3.34Å; Q210-T214 VanDerWaalsContact O-N 3.07Å; Q210-T214 PolarHBondContact O-OG1 2.95Å; M211-T214 PolarHBondContact O-N 3.02Å; T214-E217 PolarHBondContact O-N 2.9Å; T214-A218 PolarHBondContact O-N 2.8Å
215	A	97.6	Very high	97	Very high	38 Å²	38	70.3 Å²	70.3	31%	0.314	36%	0.359	S	S	.	.	H	α-helix	trans	-64.9	-38	175.6	0	0	0	0	0	112.7	M211 K212 R213 A218 F219 L277	M211-A215 WeakPolarHBondContact O-CB 3.43Å; M211-A215 PolarHBondContact O-N 3.38Å; K212-A215 PolarHBondContact O-N 3.07Å; R213-A215 VanDerWaalsContact C-N 3.28Å; R213-A215 PolarHBondContact O-N 3.01Å; A215-A218 PolarHBondContact O-N 3.47Å; A215-F219 WeakPolarHBondContact O-CD2 3.18Å; A215-F219 PolarHBondContact O-N 3.3Å; A215-L277 HydrophobicContact CB-CD2 3.77Å
216	I	97.4	Very high	97	Very high	15 Å²	15	72.3 Å²	72.3	8%	0.077	37%	0.366	C	S	.	.	H	α-helix	trans	-65.2	-40.1	174.7	-70.5	159.3	0	0	0	111.2	K212 R213 A218 F219 N220 L277 E278 L281	K212-I216 WeakPolarHBondContact O-CD1 3.48Å; K212-I216 WeakPolarHBondContact O-CG1 3.3Å; K212-I216 PolarHBondContact O-N 2.89Å; R213-I216 PolarHBondContact O-N 2.69Å; R213-I216 VanDerWaalsContact O-N 3.1Å; I216-A218 VanDerWaalsContact C-N 3.33Å; I216-A218 PolarHBondContact O-N 2.73Å; I216-F219 WeakPolarHBondContact O-CB 3.49Å; I216-F219 PolarHBondContact O-N 3.1Å; I216-N220 VanDerWaalsContact O-CG 3.3Å; I216-N220 PolarHBondContact O-N 3Å; I216-N220 PolarHBondContact O-ND2 3.4Å; I216-L277 HydrophobicContact CD1-CG 4.29Å; I216-L277 HydrophobicContact CG1-CB 4.42Å; I216-L277 HydrophobicContact CG1-CD2 3.78Å; I216-L277 HydrophobicContact CG1-CG 3.94Å; I216-E278 HydrophobicContact CD1-CG 3.81Å; I216-E278 HydrophobicContact CG1-CG 4.13Å; I216-E278 HydrophobicContact CG2-CG 4.24Å; I216-L281 HydrophobicContact CD1-CB 4.15Å; I216-L281 HydrophobicContact CD1-CD2 3.47Å; I216-L281 VanDerWaalsContact CD1-CD2 3.47Å; I216-L281 HydrophobicContact CD1-CG 4.41Å
217	E	97.5	Very high	96.9	Very high	128 Å²	128	75 Å²	75	60%	0.598	37%	0.373	S	S	*	.	H	α-helix	trans	-60.9	-42.7	173.4	-70.4	170.4	-169.2	0	0	111.5	R213 T214 F219 N220 E221	R213-E217 PolarHBondContact O-N 2.83Å; T214-E217 PolarHBondContact O-N 2.9Å; E217-F219 VanDerWaalsContact C-N 3.35Å; E217-F219 PolarHBondContact O-N 3.03Å; E217-N220 WeakPolarHBondContact O-CB 3.45Å; E217-N220 PolarHBondContact O-N 3.13Å; E217-N220 VanDerWaalsContact O-N 3.17Å; E217-E221 PolarHBondContact O-N 3.12Å
218	A	97.7	Very high	96.8	Very high	56 Å²	56	74 Å²	74	46%	0.463	37%	0.369	S	S	.	.	H	α-helix	trans	-63.5	-38.1	173.8	0	0	0	0	0	112.7	T214 A215 I216 E221 T222	T214-A218 PolarHBondContact O-N 2.8Å; A215-A218 PolarHBondContact O-N 3.47Å; I216-A218 VanDerWaalsContact C-N 3.33Å; I216-A218 PolarHBondContact O-N 2.73Å; A218-E221 PolarHBondContact O-N 3Å; A218-T222 WeakPolarHBondContact O-CB 3.44Å; A218-T222 PolarHBondContact O-N 3.35Å; A218-T222 PolarHBondContact O-OG1 3.3Å
219	F	97.8	Very high	96.7	Very high	61 Å²	61	75.5 Å²	75.5	27%	0.268	38%	0.375	S	S	.	.	H	α-helix	trans	-62.9	-41.3	171.7	-84.7	-65	0	0	0	111.8	A215 I216 E217 T222 I223 I270 K274 L277	A215-F219 WeakPolarHBondContact O-CD2 3.18Å; A215-F219 PolarHBondContact O-N 3.3Å; I216-F219 WeakPolarHBondContact O-CB 3.49Å; I216-F219 PolarHBondContact O-N 3.1Å; E217-F219 VanDerWaalsContact C-N 3.35Å; E217-F219 PolarHBondContact O-N 3.03Å; F219-T222 PolarHBondContact O-N 3.38Å; F219-I223 WeakPolarHBondContact O-CB 3.46Å; F219-I223 VanDerWaalsContact O-CG1 3.27Å; F219-I223 WeakPolarHBondContact O-CG1 3.45Å; F219-I223 PolarHBondContact O-N 2.9Å; F219-I270 HydrophobicContact CD1-CG2 3.99Å; F219-I270 HydrophobicContact CE1-CG2 4.48Å; F219-K274 HydrophobicContact CB-CB 4.08Å; F219-K274 HydrophobicContact CB-CD 4.44Å; F219-K274 HydrophobicContact CB-CG 4.13Å; F219-K274 HydrophobicContact CG-CB 4.19Å; F219-L277 HydrophobicContact CD2-CD2 3.87Å; F219-L277 HydrophobicContact CE2-CD2 3.68Å
220	N	96.9	Very high	96.5	Very high	66 Å²	66	75.6 Å²	75.6	35%	0.353	38%	0.377	S	S	.	.	H	α-helix	trans	-61.3	-45.8	177.7	-71.9	-29.8	0	0	0	111.6	I216 E217 T222 I223 K224 K274	I216-N220 VanDerWaalsContact O-CG 3.3Å; I216-N220 PolarHBondContact O-N 3Å; I216-N220 PolarHBondContact O-ND2 3.4Å; E217-N220 WeakPolarHBondContact O-CB 3.45Å; E217-N220 PolarHBondContact O-N 3.13Å; E217-N220 VanDerWaalsContact O-N 3.17Å; N220-T222 VanDerWaalsContact C-N 3.33Å; N220-T222 PolarHBondContact O-N 3.38Å; N220-I223 PolarHBondContact O-N 2.89Å; N220-K224 WeakPolarHBondContact O-CB 3.34Å; N220-K224 PolarHBondContact O-N 3.06Å; N220-K274 WeakPolarHBondContact OD1-CD 3.35Å; N220-K274 WeakPolarHBondContact OD1-CE 3.23Å; N220-K274 PolarHBondContact OD1-NZ 3.45Å
221	E	97.8	Very high	96.2	Very high	98 Å²	98	76.3 Å²	76.3	46%	0.458	38%	0.38	S	S	.	.	H	α-helix	trans	-67.5	-36.7	177.7	-162.8	61.2	-154.5	0	0	111.5	E217 A218 K224 I225	E217-E221 PolarHBondContact O-N 3.12Å; A218-E221 PolarHBondContact O-N 3Å; E221-K224 WeakPolarHBondContact O-CB 3.27Å; E221-K224 PolarHBondContact O-N 2.71Å; E221-K224 IonicContact OE1-NZ 2.87Å; E221-K224 PolarHBondContact OE1-NZ 3.27Å; E221-K224 IonicContact OE2-NZ 2.74Å; E221-I225 WeakPolarHBondContact O-CG1 3.12Å; E221-I225 PolarHBondContact O-N 3.44Å
222	T	96.4	Very high	96	Very high	55 Å²	55	72.6 Å²	72.6	34%	0.337	37%	0.365	S	S	.	.	H	α-helix	trans	-62.2	-46.6	174.1	-56.5	0	0	0	0	111.2	A218 F219 N220 K224 I225 F226 I270	A218-T222 WeakPolarHBondContact O-CB 3.44Å; A218-T222 PolarHBondContact O-N 3.35Å; A218-T222 PolarHBondContact O-OG1 3.3Å; F219-T222 PolarHBondContact O-N 3.38Å; N220-T222 VanDerWaalsContact C-N 3.33Å; N220-T222 PolarHBondContact O-N 3.38Å; T222-K224 VanDerWaalsContact C-N 3.3Å; T222-K224 PolarHBondContact O-N 3.2Å; T222-I225 PolarHBondContact O-N 2.85Å; T222-F226 HydrophobicContact CG2-CD2 4.01Å; T222-F226 HydrophobicContact CG2-CE2 3.98Å; T222-F226 VanDerWaalsContact O-CD2 3.32Å; T222-F226 WeakPolarHBondContact O-CD2 3.46Å; T222-F226 PolarHBondContact O-N 2.83Å; T222-F226 VanDerWaalsContact O-N 3.09Å; T222-I270 HydrophobicContact CG2-CD1 4.28Å; T222-I270 HydrophobicContact CG2-CG2 4.49Å
223	I	96.6	Very high	95.6	Very high	11 Å²	11	72.4 Å²	72.4	6%	0.056	37%	0.365	C	S	.	.	H	α-helix	trans	-58.2	-46.3	177.2	-74.6	167.6	0	0	0	110	F219 N220 I225 F226 E227 L267 I270 K274	F219-I223 WeakPolarHBondContact O-CB 3.46Å; F219-I223 VanDerWaalsContact O-CG1 3.27Å; F219-I223 WeakPolarHBondContact O-CG1 3.45Å; F219-I223 PolarHBondContact O-N 2.9Å; N220-I223 PolarHBondContact O-N 2.89Å; I223-I225 PolarHBondContact O-N 2.86Å; I223-F226 CarbonylContact O-C 3.42Å; I223-F226 PolarHBondContact O-N 3.41Å; I223-F226 VanDerWaalsContact O-N 3.1Å; I223-E227 HydrophobicContact CG2-CG 4.17Å; I223-E227 WeakPolarHBondContact O-CG 3.48Å; I223-E227 PolarHBondContact O-N 3.03Å; I223-L267 HydrophobicContact CG1-CD1 4.47Å; I223-L267 HydrophobicContact CG2-CD1 4.14Å; I223-I270 HydrophobicContact CD1-CG2 4.26Å; I223-I270 HydrophobicContact CG1-CG2 3.64Å; I223-K274 HydrophobicContact CD1-CB 4.3Å; I223-K274 HydrophobicContact CD1-CD 3.55Å
224	K	97.3	Very high	95.2	Very high	91 Å²	91	69.8 Å²	69.8	40%	0.396	36%	0.358	S	S	.	.	H	α-helix	trans	-57.6	-44.7	178.2	-176.1	-176	165.6	-154.6	0	112.5	N220 E221 T222 F226 E227 E228	N220-K224 WeakPolarHBondContact O-CB 3.34Å; N220-K224 PolarHBondContact O-N 3.06Å; E221-K224 WeakPolarHBondContact O-CB 3.27Å; E221-K224 PolarHBondContact O-N 2.71Å; E221-K224 IonicContact OE1-NZ 2.87Å; E221-K224 PolarHBondContact OE1-NZ 3.27Å; E221-K224 IonicContact OE2-NZ 2.74Å; T222-K224 VanDerWaalsContact C-N 3.3Å; T222-K224 PolarHBondContact O-N 3.2Å; K224-F226 VanDerWaalsContact C-N 3.34Å; K224-F226 PolarHBondContact O-N 2.82Å; K224-E227 PolarHBondContact O-N 2.86Å; K224-E228 WeakPolarHBondContact CE-OE1 3.37Å; K224-E228 WeakPolarHBondContact O-CG 3.38Å; K224-E228 PolarHBondContact O-N 3.08Å
225	I	96.3	Very high	94.7	Very high	94 Å²	94	71.8 Å²	71.8	48%	0.482	36%	0.362	S	S	.	.	H	α-helix	trans	-61.4	-42.3	175.7	-66	165.1	0	0	0	111.2	E221 T222 I223 E228 Q229	E221-I225 WeakPolarHBondContact O-CG1 3.12Å; E221-I225 PolarHBondContact O-N 3.44Å; T222-I225 PolarHBondContact O-N 2.85Å; I223-I225 PolarHBondContact O-N 2.86Å; I225-E228 PolarHBondContact O-N 3.23Å; I225-Q229 WeakPolarHBondContact O-CB 3.3Å; I225-Q229 PolarHBondContact O-N 3.32Å
226	F	95.1	Very high	94.2	Very high	54 Å²	54	74.8 Å²	74.8	24%	0.237	37%	0.37	C	S	.	.	H	α-helix	trans	-69.6	-33.5	177.5	-87.5	-102.7	0	0	0	112.8	T222 I223 K224 Q229 C230 L263 R266 L267 I270	T222-F226 HydrophobicContact CG2-CD2 4.01Å; T222-F226 HydrophobicContact CG2-CE2 3.98Å; T222-F226 VanDerWaalsContact O-CD2 3.32Å; T222-F226 WeakPolarHBondContact O-CD2 3.46Å; T222-F226 PolarHBondContact O-N 2.83Å; T222-F226 VanDerWaalsContact O-N 3.09Å; I223-F226 CarbonylContact O-C 3.42Å; I223-F226 PolarHBondContact O-N 3.41Å; I223-F226 VanDerWaalsContact O-N 3.1Å; K224-F226 VanDerWaalsContact C-N 3.34Å; K224-F226 PolarHBondContact O-N 2.82Å; F226-Q229 PolarHBondContact O-N 2.85Å; F226-C230 WeakPolarHBondContact O-CB 3.42Å; F226-C230 PolarHBondContact O-N 2.99Å; F226-C230 PolarHBondContact O-SG 3.41Å; F226-L263 HydrophobicContact CD1-CD1 3.72Å; F226-L263 HydrophobicContact CE1-CD1 4.03Å; F226-R266 HydrophobicContact CE1-CB 4.34Å; F226-R266 HydrophobicContact CE1-CG 3.71Å; F226-R266 HydrophobicContact CZ-CG 4.22Å; F226-L267 HydrophobicContact CB-CD1 3.81Å; F226-I270 HydrophobicContact CD1-CD1 4.3Å; F226-I270 HydrophobicContact CD2-CD1 3.98Å; F226-I270 HydrophobicContact CE1-CD1 4.12Å; F226-I270 HydrophobicContact CE2-CD1 3.77Å; F226-I270 HydrophobicContact CG-CD1 4.24Å; F226-I270 HydrophobicContact CZ-CD1 3.85Å
227	E	93.9	Very high	93.7	Very high	107 Å²	107	74.8 Å²	74.8	50%	0.5	37%	0.371	S	S	.	.	H	α-helix	trans	-67	-44	173.4	-74.8	178.9	166.1	0	0	111.3	I223 K224 Q229 C230 H231 L267	I223-E227 HydrophobicContact CG2-CG 4.17Å; I223-E227 WeakPolarHBondContact O-CG 3.48Å; I223-E227 PolarHBondContact O-N 3.03Å; K224-E227 PolarHBondContact O-N 2.86Å; E227-Q229 VanDerWaalsContact C-N 3.3Å; E227-Q229 PolarHBondContact O-N 2.91Å; E227-C230 WeakPolarHBondContact O-CB 3.4Å; E227-C230 PolarHBondContact O-N 3Å; E227-H231 WeakPolarHBondContact O-CB 3.43Å; E227-H231 PolarHBondContact O-N 2.71Å; E227-L267 HydrophobicContact CG-CD1 4.42Å; E227-L267 HydrophobicContact CG-CD2 4.08Å
228	E	95.4	Very high	93.2	Very high	106 Å²	106	74.5 Å²	74.5	50%	0.495	37%	0.368	S	S	.	.	H	α-helix	trans	-60.4	-40.3	173	-73.5	174.2	-169.1	0	0	111.4	K224 I225 H231 T232	K224-E228 WeakPolarHBondContact CE-OE1 3.37Å; K224-E228 WeakPolarHBondContact O-CG 3.38Å; K224-E228 PolarHBondContact O-N 3.08Å; I225-E228 PolarHBondContact O-N 3.23Å; E228-H231 PolarHBondContact O-N 3.42Å; E228-T232 WeakPolarHBondContact O-CB 3.4Å; E228-T232 PolarHBondContact O-N 3.06Å; E228-T232 PolarHBondContact O-OG1 3.07Å
229	Q	93.8	Very high	92.6	Very high	106 Å²	106	78.2 Å²	78.2	50%	0.495	38%	0.375	S	S	.	.	H	α-helix	trans	-66.1	-41.1	175.1	-166.9	67.1	8	0	0	112	I225 F226 E227 H231 T232 Q233 L263	I225-Q229 WeakPolarHBondContact O-CB 3.3Å; I225-Q229 PolarHBondContact O-N 3.32Å; F226-Q229 PolarHBondContact O-N 2.85Å; E227-Q229 VanDerWaalsContact C-N 3.3Å; E227-Q229 PolarHBondContact O-N 2.91Å; Q229-H231 VanDerWaalsContact C-N 3.34Å; Q229-T232 PolarHBondContact O-N 3.06Å; Q229-Q233 VanDerWaalsContact O-CB 3.3Å; Q229-Q233 WeakPolarHBondContact O-CB 3.38Å; Q229-Q233 PolarHBondContact O-N 3.15Å; Q229-L263 HydrophobicContact CB-CD2 4.4Å; Q229-L263 HydrophobicContact CG-CD1 4.44Å; Q229-L263 HydrophobicContact CG-CD2 4.03Å
230	C	91.9	Very high	91.9	Very high	13 Å²	13	81 Å²	81	9%	0.088	39%	0.385	C	S	.	.	H	α-helix	trans	-60.1	-45.1	173.4	-77.2	0	0	0	0	111.3	F226 E227 E234 L263	F226-C230 WeakPolarHBondContact O-CB 3.42Å; F226-C230 PolarHBondContact O-N 2.99Å; F226-C230 PolarHBondContact O-SG 3.41Å; E227-C230 WeakPolarHBondContact O-CB 3.4Å; E227-C230 PolarHBondContact O-N 3Å; C230-E234 WeakPolarHBondContact O-CB 3.43Å; C230-E234 PolarHBondContact O-N 3.33Å; C230-L263 HydrophobicContact CB-CD2 4.42Å
231	H	92.3	Very high	91.4	Very high	117 Å²	117	79.3 Å²	79.3	54%	0.542	38%	0.375	S	S	.	.	H	α-helix	trans	-64.3	-45.9	179.4	-171.3	65.5	0	0	0	111.7	E227 E228 Q229 E234 Q235	E227-H231 WeakPolarHBondContact O-CB 3.43Å; E227-H231 PolarHBondContact O-N 2.71Å; E228-H231 PolarHBondContact O-N 3.42Å; Q229-H231 VanDerWaalsContact C-N 3.34Å; H231-E234 PolarHBondContact O-N 3.44Å; H231-Q235 WeakPolarHBondContact O-CB 3.48Å; H231-Q235 PolarHBondContact O-N 3.38Å
232	T	91.7	Very high	90.8	Very high	58 Å²	58	79.4 Å²	79.4	36%	0.356	38%	0.376	S	S	.	.	H	α-helix	trans	-61.2	-47.6	177.7	-58.3	0	0	0	0	111.1	E228 Q229 E234 Q235 H236	E228-T232 WeakPolarHBondContact O-CB 3.4Å; E228-T232 PolarHBondContact O-N 3.06Å; E228-T232 PolarHBondContact O-OG1 3.07Å; Q229-T232 PolarHBondContact O-N 3.06Å; T232-E234 VanDerWaalsContact C-N 3.33Å; T232-E234 PolarHBondContact O-N 3.43Å; T232-Q235 PolarHBondContact O-N 2.81Å; T232-H236 PolarHBondContact O-CD2 3.4Å; T232-H236 PolarHBondContact O-N 3.47Å
233	Q	89.1	Confident	90.3	Very high	45 Å²	45	84.4 Å²	84.4	21%	0.21	39%	0.389	C	S	.	.	H	α-helix	trans	-60.6	-42.2	176.1	177.6	65.6	0.9	0	0	111.4	Q229 S237 Y260	Q229-Q233 VanDerWaalsContact O-CB 3.3Å; Q229-Q233 WeakPolarHBondContact O-CB 3.38Å; Q229-Q233 PolarHBondContact O-N 3.15Å; Q233-S237 WeakPolarHBondContact O-CA 3.41Å; Q233-S237 WeakPolarHBondContact O-CB 3.45Å; Q233-S237 PolarHBondContact O-N 3.48Å; Q233-S237 PolarHBondContact O-OG 3.01Å; Q233-Y260 HydrophobicContact CG-CD2 3.92Å
234	E	87.9	Confident	89.9	Confident	71 Å²	71	85.9 Å²	85.9	33%	0.332	40%	0.395	S	S	.	.	H	α-helix	trans	-65.1	-42.2	178.3	-168.7	-175.9	158.7	0	0	112	C230 H231 T232 S237 K238	C230-E234 WeakPolarHBondContact O-CB 3.43Å; C230-E234 PolarHBondContact O-N 3.33Å; H231-E234 PolarHBondContact O-N 3.44Å; T232-E234 VanDerWaalsContact C-N 3.33Å; T232-E234 PolarHBondContact O-N 3.43Å; E234-S237 PolarHBondContact O-OG 2.92Å; E234-K238 VanDerWaalsContact O-CG 3.26Å; E234-K238 WeakPolarHBondContact O-CG 3.46Å; E234-K238 PolarHBondContact O-N 3.47Å; E234-K238 WeakPolarHBondContact OE1-CE 3.41Å; E234-K238 IonicContact OE1-NZ 3.86Å; E234-K238 PolarHBondContact OE1-NZ 3.37Å
235	Q	88.8	Confident	89.4	Confident	117 Å²	117	90 Å²	90	55%	0.547	41%	0.408	S	S	.	.	H	α-helix	trans	-65.9	-48.1	179.6	-173.1	174	-7.4	0	0	111.9	H231 T232	H231-Q235 WeakPolarHBondContact O-CB 3.48Å; H231-Q235 PolarHBondContact O-N 3.38Å; T232-Q235 PolarHBondContact O-N 2.81Å
236	H	87.1	Confident	89	Confident	102 Å²	102	94.9 Å²	94.9	47%	0.472	42%	0.42	S	S	.	.	H	α-helix	trans	-70.7	-44.8	178.9	-72.2	-66.6	0	0	0	112	T232 K238 E239 Y240	T232-H236 PolarHBondContact O-CD2 3.4Å; T232-H236 PolarHBondContact O-N 3.47Å; H236-K238 VanDerWaalsContact C-N 3.26Å; H236-K238 PolarHBondContact O-N 2.96Å; H236-E239 PolarHBondContact O-N 3.03Å; H236-Y240 VanDerWaalsContact O-CD2 3.24Å; H236-Y240 WeakPolarHBondContact O-CD2 3.11Å; H236-Y240 PolarHBondContact O-N 2.9Å
237	S	87.4	Confident	88.6	Confident	15 Å²	15	98.8 Å²	98.8	11%	0.105	44%	0.439	C	S	.	.	H	α-helix	trans	-62.2	-31.2	-177.4	63	0	0	0	0	113	Q233 E234 E239 Y240 I241	Q233-S237 WeakPolarHBondContact O-CA 3.41Å; Q233-S237 WeakPolarHBondContact O-CB 3.45Å; Q233-S237 PolarHBondContact O-N 3.48Å; Q233-S237 PolarHBondContact O-OG 3.01Å; E234-S237 PolarHBondContact O-OG 2.92Å; S237-E239 PolarHBondContact O-N 3.42Å; S237-Y240 PolarHBondContact O-N 3.44Å; S237-I241 WeakPolarHBondContact O-CB 3.42Å; S237-I241 WeakPolarHBondContact O-CD1 3.45Å; S237-I241 WeakPolarHBondContact O-CG1 3.43Å; S237-I241 PolarHBondContact O-N 2.94Å
238	K	86.7	Confident	88.2	Confident	122 Å²	122	96.5 Å²	96.5	53%	0.53	45%	0.445	S	S	.	.	H	α-helix	trans	-54.3	-48.8	177	-84.1	170	-177.2	165	0	112.5	E234 H236 E242	E234-K238 VanDerWaalsContact O-CG 3.26Å; E234-K238 WeakPolarHBondContact O-CG 3.46Å; E234-K238 PolarHBondContact O-N 3.47Å; E234-K238 WeakPolarHBondContact OE1-CE 3.41Å; E234-K238 IonicContact OE1-NZ 3.86Å; E234-K238 PolarHBondContact OE1-NZ 3.37Å; H236-K238 VanDerWaalsContact C-N 3.26Å; H236-K238 PolarHBondContact O-N 2.96Å; K238-E242 WeakPolarHBondContact O-CB 3.43Å; K238-E242 PolarHBondContact O-N 3.45Å; K238-E242 VanDerWaalsContact O-N 3.13Å
239	E	84.3	Confident	87.9	Confident	133 Å²	133	94.5 Å²	94.5	62%	0.621	44%	0.437	S	S	*	.	H	α-helix	trans	-68.8	-40.5	-179.7	-65.1	-176.7	177.3	0	0	112.3	H236 S237 R243	H236-E239 PolarHBondContact O-N 3.03Å; S237-E239 PolarHBondContact O-N 3.42Å; E239-R243 PolarHBondContact O-N 2.88Å; E239-R243 VanDerWaalsContact O-N 3.17Å
240	Y	84.1	Confident	87.6	Confident	121 Å²	121	96.5 Å²	96.5	48%	0.475	45%	0.446	S	S	.	.	H	α-helix	trans	-68.7	-44.1	178	-77.1	-77.6	0	0	0	112.5	H236 S237 E242 R243 F244	H236-Y240 VanDerWaalsContact O-CD2 3.24Å; H236-Y240 WeakPolarHBondContact O-CD2 3.11Å; H236-Y240 PolarHBondContact O-N 2.9Å; S237-Y240 PolarHBondContact O-N 3.44Å; Y240-E242 VanDerWaalsContact C-N 3.28Å; Y240-E242 PolarHBondContact O-N 2.83Å; Y240-R243 PolarHBondContact O-N 3Å; Y240-F244 HydrophobicContact CD1-CE2 4.19Å; Y240-F244 WeakPolarHBondContact O-CD2 3.43Å; Y240-F244 PolarHBondContact O-N 3.43Å
241	I	85.4	Confident	87.5	Confident	29 Å²	29	103.1 Å²	103.1	15%	0.149	47%	0.474	C	S	.	.	H	α-helix	trans	-60.8	-40.7	177.5	-70.7	167.4	0	0	0	110	S237 R245 I253 I256	S237-I241 WeakPolarHBondContact O-CB 3.42Å; S237-I241 WeakPolarHBondContact O-CD1 3.45Å; S237-I241 WeakPolarHBondContact O-CG1 3.43Å; S237-I241 PolarHBondContact O-N 2.94Å; I241-R245 VanDerWaalsContact O-CB 3.22Å; I241-R245 WeakPolarHBondContact O-CB 3.39Å; I241-R245 PolarHBondContact O-N 3.08Å; I241-I253 HydrophobicContact CG1-CG2 4.41Å; I241-I253 HydrophobicContact CG2-CD1 4.34Å; I241-I253 HydrophobicContact CG2-CG1 4.38Å; I241-I253 HydrophobicContact CG2-CG2 4.09Å; I241-I256 HydrophobicContact CD1-CG2 4.14Å; I241-I256 HydrophobicContact CG1-CD1 4.5Å; I241-I256 HydrophobicContact CG1-CG2 4.39Å
242	E	85.7	Confident	87.3	Confident	101 Å²	101	100.2 Å²	100.2	47%	0.472	46%	0.46	S	S	.	.	H	α-helix	trans	-67.6	-36.5	178	-163.1	172.9	158.9	0	0	112.5	K238 Y240 R246	K238-E242 WeakPolarHBondContact O-CB 3.43Å; K238-E242 PolarHBondContact O-N 3.45Å; K238-E242 VanDerWaalsContact O-N 3.13Å; Y240-E242 VanDerWaalsContact C-N 3.28Å; Y240-E242 PolarHBondContact O-N 2.83Å; E242-R246 WeakPolarHBondContact O-CG 3.26Å; E242-R246 PolarHBondContact O-N 3.44Å; E242-R246 IonicContact OE1-CZ 2.66Å; E242-R246 IonicContact OE1-NH2 3.17Å; E242-R246 PolarHBondContact OE1-NH2 2.95Å
243	R	85.9	Confident	87.1	Confident	159 Å²	159	98.6 Å²	98.6	60%	0.6	45%	0.449	S	S	*	.	H	α-helix	trans	-65.2	-52.2	172	-74.4	-176.1	-177.3	-179.7	3.9	112.3	E239 Y240 R245 R246 E247	E239-R243 PolarHBondContact O-N 2.88Å; E239-R243 VanDerWaalsContact O-N 3.17Å; Y240-R243 PolarHBondContact O-N 3Å; R243-R245 PolarHBondContact O-N 3.49Å; R243-R246 WeakPolarHBondContact O-CB 3.39Å; R243-R246 PolarHBondContact O-N 3.41Å; R243-E247 PolarHBondContact O-N 3.04Å; R243-E247 VanDerWaalsContact O-N 3.13Å
244	F	87.6	Confident	87.1	Confident	42 Å²	42	102.8 Å²	102.8	18%	0.184	47%	0.469	C	S	.	.	H	α-helix	trans	-62.9	-28.8	180	-70.5	-54.7	0	0	0	112.9	Y240 E247 G248 N249 E252 I253 I256	Y240-F244 HydrophobicContact CD1-CE2 4.19Å; Y240-F244 WeakPolarHBondContact O-CD2 3.43Å; Y240-F244 PolarHBondContact O-N 3.43Å; F244-E247 PolarHBondContact O-N 3.11Å; F244-G248 PolarHBondContact O-N 3.42Å; F244-G248 VanDerWaalsContact O-N 3.1Å; F244-N249 HydrophobicContact CB-CB 4.48Å; F244-N249 HydrophobicContact CD1-CB 4.19Å; F244-N249 PolarHBondContact O-N 2.87Å; F244-E252 HydrophobicContact CD1-CB 4.38Å; F244-E252 HydrophobicContact CD1-CG 4.5Å; F244-E252 HydrophobicContact CD2-CB 4.29Å; F244-E252 HydrophobicContact CD2-CG 4.05Å; F244-E252 HydrophobicContact CE1-CG 4.21Å; F244-E252 HydrophobicContact CE2-CB 4.43Å; F244-E252 HydrophobicContact CE2-CG 3.73Å; F244-E252 HydrophobicContact CG-CB 4.27Å; F244-E252 HydrophobicContact CG-CG 4.43Å; F244-E252 HydrophobicContact CZ-CG 3.81Å; F244-I253 HydrophobicContact CB-CD1 4.17Å; F244-I253 HydrophobicContact CB-CG1 3.87Å; F244-I256 HydrophobicContact CD2-CD1 4.4Å; F244-I256 HydrophobicContact CE2-CD1 4.33Å
245	R	87.6	Confident	87.2	Confident	178 Å²	178	106.9 Å²	106.9	67%	0.672	48%	0.481	S	S	*	.	H	α-helix	trans	-66.1	-38.3	173	-172.1	-178.3	-67	172.2	-1.2	112	I241 R243 E247 G248 I253	I241-R245 VanDerWaalsContact O-CB 3.22Å; I241-R245 WeakPolarHBondContact O-CB 3.39Å; I241-R245 PolarHBondContact O-N 3.08Å; R243-R245 PolarHBondContact O-N 3.49Å; R245-E247 VanDerWaalsContact C-N 3.32Å; R245-G248 PolarHBondContact O-N 3.49Å; R245-I253 HydrophobicContact CB-CD1 4.15Å
246	R	87.3	Confident	87.3	Confident	197 Å²	197	102.7 Å²	102.7	74%	0.743	46%	0.462	S	S	*	.	H	α-helix	trans	-70.6	-30	175.6	-66.2	175.7	-168.7	-167.8	4.8	112.2	E242 R243	E242-R246 WeakPolarHBondContact O-CG 3.26Å; E242-R246 PolarHBondContact O-N 3.44Å; E242-R246 IonicContact OE1-CZ 2.66Å; E242-R246 IonicContact OE1-NH2 3.17Å; E242-R246 PolarHBondContact OE1-NH2 2.95Å; R243-R246 WeakPolarHBondContact O-CB 3.39Å; R243-R246 PolarHBondContact O-N 3.41Å
247	E	86.9	Confident	87.4	Confident	135 Å²	135	102.7 Å²	102.7	63%	0.631	46%	0.464	S	S	*	.	H	α-helix	trans	-84.3	-7.3	178.5	-65.7	172.4	-166.8	0	0	113.7	R243 F244 R245 N249	R243-E247 PolarHBondContact O-N 3.04Å; R243-E247 VanDerWaalsContact O-N 3.13Å; F244-E247 PolarHBondContact O-N 3.11Å; R245-E247 VanDerWaalsContact C-N 3.32Å; E247-N249 VanDerWaalsContact C-N 3.3Å; E247-N249 PolarHBondContact O-N 3.28Å
248	G	85.3	Confident	87.7	Confident	60 Å²	60	107.8 Å²	107.8	62%	0.619	49%	0.487	S	S	*	.	T	Hydrogen-bonded Turn	trans	72.2	17.8	-177.8	0	0	0	0	0	114.6	F244 R245 E250	F244-G248 PolarHBondContact O-N 3.42Å; F244-G248 VanDerWaalsContact O-N 3.1Å; R245-G248 PolarHBondContact O-N 3.49Å; G248-E250 PolarHBondContact O-N 2.93Å
249	N	88.7	Confident	87.9	Confident	63 Å²	63	106.1 Å²	106.1	34%	0.337	49%	0.485	S	S	.	.			trans	-92.2	68.9	-176.3	-167.6	0.7	0	0	0	112.2	F244 E247 K251 E252	F244-N249 HydrophobicContact CB-CB 4.48Å; F244-N249 HydrophobicContact CD1-CB 4.19Å; F244-N249 PolarHBondContact O-N 2.87Å; E247-N249 VanDerWaalsContact C-N 3.3Å; E247-N249 PolarHBondContact O-N 3.28Å; N249-K251 VanDerWaalsContact C-N 3.27Å; N249-K251 PolarHBondContact O-N 2.84Å; N249-E252 PolarHBondContact O-N 3.13Å
250	E	87.8	Confident	88.3	Confident	148 Å²	148	102 Å²	102	69%	0.692	46%	0.463	S	S	*	.	H	α-helix	trans	-61.4	-31.6	-176.6	-70.2	-172.3	155.6	0	0	113.9	G248 E252 I253 E254	G248-E250 PolarHBondContact O-N 2.93Å; E250-E252 PolarHBondContact O-N 2.99Å; E250-I253 WeakPolarHBondContact O-CB 3.44Å; E250-I253 PolarHBondContact O-N 2.66Å; E250-I253 VanDerWaalsContact O-N 3.14Å; E250-E254 PolarHBondContact O-N 3.14Å
251	K	90.2	Very high	88.7	Confident	153 Å²	153	100.7 Å²	100.7	67%	0.665	47%	0.465	S	S	*	.	H	α-helix	trans	-62.2	-30.5	-179.5	-68.1	-175.8	178.7	178.8	0	113.2	N249 R255	N249-K251 VanDerWaalsContact C-N 3.27Å; N249-K251 PolarHBondContact O-N 2.84Å; K251-R255 WeakPolarHBondContact O-CG 3.17Å; K251-R255 PolarHBondContact O-N 3.48Å
252	E	87.3	Confident	89.1	Confident	55 Å²	55	106 Å²	106	26%	0.257	49%	0.487	S	S	.	.	H	α-helix	trans	-76.8	-37.6	177.3	-159.7	60.6	-160.7	0	0	111.6	F244 N249 E250 E254 R255 I256	F244-E252 HydrophobicContact CD1-CB 4.38Å; F244-E252 HydrophobicContact CD1-CG 4.5Å; F244-E252 HydrophobicContact CD2-CB 4.29Å; F244-E252 HydrophobicContact CD2-CG 4.05Å; F244-E252 HydrophobicContact CE1-CG 4.21Å; F244-E252 HydrophobicContact CE2-CB 4.43Å; F244-E252 HydrophobicContact CE2-CG 3.73Å; F244-E252 HydrophobicContact CG-CB 4.27Å; F244-E252 HydrophobicContact CG-CG 4.43Å; F244-E252 HydrophobicContact CZ-CG 3.81Å; N249-E252 PolarHBondContact O-N 3.13Å; E250-E252 PolarHBondContact O-N 2.99Å; E252-E254 VanDerWaalsContact C-N 3.34Å; E252-E254 PolarHBondContact O-N 3.1Å; E252-R255 PolarHBondContact O-N 2.94Å; E252-R255 IonicContact OE2-CZ 2.62Å; E252-R255 IonicContact OE2-NE 2.94Å; E252-R255 PolarHBondContact OE2-NE 3.12Å; E252-R255 VanDerWaalsContact OE2-NE 3.1Å; E252-R255 IonicContact OE2-NH2 3.7Å; E252-R255 PolarHBondContact OE2-NH2 3.08Å; E252-I256 WeakPolarHBondContact O-CG1 3.35Å; E252-I256 PolarHBondContact O-N 3.47Å
253	I	87.6	Confident	89.5	Confident	24 Å²	24	102.5 Å²	102.5	12%	0.123	47%	0.471	C	S	.	.	H	α-helix	trans	-61.1	-45.5	174.6	-60	174.2	0	0	0	110	I241 F244 R245 E250 R255 I256 M257	I241-I253 HydrophobicContact CG1-CG2 4.41Å; I241-I253 HydrophobicContact CG2-CD1 4.34Å; I241-I253 HydrophobicContact CG2-CG1 4.38Å; I241-I253 HydrophobicContact CG2-CG2 4.09Å; F244-I253 HydrophobicContact CB-CD1 4.17Å; F244-I253 HydrophobicContact CB-CG1 3.87Å; R245-I253 HydrophobicContact CB-CD1 4.15Å; E250-I253 WeakPolarHBondContact O-CB 3.44Å; E250-I253 PolarHBondContact O-N 2.66Å; E250-I253 VanDerWaalsContact O-N 3.14Å; I253-R255 VanDerWaalsContact C-N 3.34Å; I253-R255 PolarHBondContact O-N 2.9Å; I253-I256 PolarHBondContact O-N 3.08Å; I253-M257 HydrophobicContact CG2-CG 4.47Å; I253-M257 HydrophobicContact CG2-SD 4.19Å; I253-M257 WeakPolarHBondContact O-CG 3.34Å; I253-M257 PolarHBondContact O-N 3.36Å
254	E	90.4	Very high	89.9	Confident	133 Å²	133	99.9 Å²	99.9	62%	0.621	46%	0.464	S	S	*	.	H	α-helix	trans	-58.5	-43.1	175.3	-75.6	-176.4	165.2	0	0	112.3	E250 E252 I256 M257 M258	E250-E254 PolarHBondContact O-N 3.14Å; E252-E254 VanDerWaalsContact C-N 3.34Å; E252-E254 PolarHBondContact O-N 3.1Å; E254-I256 PolarHBondContact O-N 3.3Å; E254-M257 PolarHBondContact O-N 2.97Å; E254-M258 VanDerWaalsContact O-CB 3.25Å; E254-M258 WeakPolarHBondContact O-CB 3.49Å; E254-M258 PolarHBondContact O-N 2.87Å
255	R	90.2	Very high	90.3	Very high	158 Å²	158	101.2 Å²	101.2	60%	0.596	48%	0.479	S	S	*	.	H	α-helix	trans	-62.9	-41.8	178.2	-78	-170.7	-85.4	-167.5	-0.2	112.5	K251 E252 I253 N259	K251-R255 WeakPolarHBondContact O-CG 3.17Å; K251-R255 PolarHBondContact O-N 3.48Å; E252-R255 PolarHBondContact O-N 2.94Å; E252-R255 IonicContact OE2-CZ 2.62Å; E252-R255 IonicContact OE2-NE 2.94Å; E252-R255 PolarHBondContact OE2-NE 3.12Å; E252-R255 VanDerWaalsContact OE2-NE 3.1Å; E252-R255 IonicContact OE2-NH2 3.7Å; E252-R255 PolarHBondContact OE2-NH2 3.08Å; I253-R255 VanDerWaalsContact C-N 3.34Å; I253-R255 PolarHBondContact O-N 2.9Å; R255-N259 PolarHBondContact O-N 2.64Å; R255-N259 VanDerWaalsContact O-N 3.11Å
256	I	89.8	Confident	90.6	Very high	28 Å²	28	98.9 Å²	98.9	14%	0.144	47%	0.47	C	S	.	.	H	α-helix	trans	-65.2	-45.6	177.2	-67.7	169.7	0	0	0	110.7	I241 F244 E252 I253 E254 N259 Y260	I241-I256 HydrophobicContact CD1-CG2 4.14Å; I241-I256 HydrophobicContact CG1-CD1 4.5Å; I241-I256 HydrophobicContact CG1-CG2 4.39Å; F244-I256 HydrophobicContact CD2-CD1 4.4Å; F244-I256 HydrophobicContact CE2-CD1 4.33Å; E252-I256 WeakPolarHBondContact O-CG1 3.35Å; E252-I256 PolarHBondContact O-N 3.47Å; I253-I256 PolarHBondContact O-N 3.08Å; E254-I256 PolarHBondContact O-N 3.3Å; I256-N259 PolarHBondContact O-N 3.24Å; I256-Y260 PolarHBondContact O-N 3.04Å
257	M	89.5	Confident	91	Very high	103 Å²	103	91 Å²	91	51%	0.507	44%	0.442	S	S	.	.	H	α-helix	trans	-63.8	-44.5	177.9	-72.8	-173.6	63.6	0	0	111.9	I253 E254 N259 Y260 D261	I253-M257 HydrophobicContact CG2-CG 4.47Å; I253-M257 HydrophobicContact CG2-SD 4.19Å; I253-M257 WeakPolarHBondContact O-CG 3.34Å; I253-M257 PolarHBondContact O-N 3.36Å; E254-M257 PolarHBondContact O-N 2.97Å; M257-N259 VanDerWaalsContact C-N 3.26Å; M257-N259 PolarHBondContact O-N 2.87Å; M257-Y260 WeakPolarHBondContact O-CB 3.37Å; M257-Y260 PolarHBondContact O-N 3.14Å; M257-Y260 VanDerWaalsContact O-N 3.07Å; M257-D261 PolarHBondContact O-N 3.22Å
258	M	92.8	Very high	91.4	Very high	121 Å²	121	86.1 Å²	86.1	60%	0.596	43%	0.428	S	S	*	.	H	α-helix	trans	-63.9	-32.1	179.4	-161.3	-178.4	-169.6	0	0	112.2	E254 K262	E254-M258 VanDerWaalsContact O-CB 3.25Å; E254-M258 WeakPolarHBondContact O-CB 3.49Å; E254-M258 PolarHBondContact O-N 2.87Å; M258-K262 WeakPolarHBondContact O-CG 3.39Å; M258-K262 PolarHBondContact O-N 3.42Å
259	N	92.4	Very high	92	Very high	88 Å²	88	87.4 Å²	87.4	47%	0.471	42%	0.418	S	S	.	.	H	α-helix	trans	-69	-43.8	171.8	-178.1	-94.6	0	0	0	111.9	R255 I256 M257 D261 K262 L263	R255-N259 PolarHBondContact O-N 2.64Å; R255-N259 VanDerWaalsContact O-N 3.11Å; I256-N259 PolarHBondContact O-N 3.24Å; M257-N259 VanDerWaalsContact C-N 3.26Å; M257-N259 PolarHBondContact O-N 2.87Å; N259-D261 VanDerWaalsContact C-N 3.34Å; N259-D261 PolarHBondContact O-N 2.91Å; N259-K262 WeakPolarHBondContact O-CB 3.35Å; N259-K262 PolarHBondContact O-N 3.19Å; N259-L263 PolarHBondContact O-N 3.01Å
260	Y	91.2	Very high	92.3	Very high	45 Å²	45	85 Å²	85	18%	0.176	41%	0.405	C	S	.	.	H	α-helix	trans	-62.7	-39.8	177.3	-178.3	-107.9	0	0	0	112.4	Q233 I256 M257 K262 L263 K264	Q233-Y260 HydrophobicContact CG-CD2 3.92Å; I256-Y260 PolarHBondContact O-N 3.04Å; M257-Y260 WeakPolarHBondContact O-CB 3.37Å; M257-Y260 PolarHBondContact O-N 3.14Å; M257-Y260 VanDerWaalsContact O-N 3.07Å; Y260-K262 VanDerWaalsContact C-N 3.34Å; Y260-K262 PolarHBondContact O-N 2.82Å; Y260-L263 PolarHBondContact O-N 3.46Å; Y260-K264 HydrophobicContact CD1-CD 4.26Å; Y260-K264 HydrophobicContact CE1-CD 3.69Å; Y260-K264 HydrophobicContact CE1-CG 4.31Å; Y260-K264 VanDerWaalsContact CE1-NZ 3.34Å; Y260-K264 PolarHBondContact O-N 3.48Å; Y260-K264 WeakPolarHBondContact OH-CE 3.47Å; Y260-K264 PolarHBondContact OH-NZ 3.33Å
261	D	92.8	Very high	92.8	Very high	94 Å²	94	82 Å²	82	50%	0.503	39%	0.391	S	S	.	.	H	α-helix	trans	-64.1	-39	175.6	-70.6	-22.7	0	0	0	111.8	M257 N259 K264 S265	M257-D261 PolarHBondContact O-N 3.22Å; N259-D261 VanDerWaalsContact C-N 3.34Å; N259-D261 PolarHBondContact O-N 2.91Å; D261-K264 PolarHBondContact O-N 2.81Å; D261-S265 WeakPolarHBondContact O-CB 3.38Å; D261-S265 PolarHBondContact O-N 3.1Å
262	K	94.6	Very high	93.1	Very high	140 Å²	140	79 Å²	79	61%	0.609	38%	0.382	S	S	*	.	H	α-helix	trans	-64.1	-41.7	173.2	-73.1	179	-174.1	-176.2	0	112	M258 N259 Y260 S265 R266	M258-K262 WeakPolarHBondContact O-CG 3.39Å; M258-K262 PolarHBondContact O-N 3.42Å; N259-K262 WeakPolarHBondContact O-CB 3.35Å; N259-K262 PolarHBondContact O-N 3.19Å; Y260-K262 VanDerWaalsContact C-N 3.34Å; Y260-K262 PolarHBondContact O-N 2.82Å; K262-S265 PolarHBondContact O-N 2.73Å; K262-R266 WeakPolarHBondContact O-CB 3.49Å; K262-R266 PolarHBondContact O-N 3.42Å
263	L	93.9	Very high	93.6	Very high	28 Å²	28	78.2 Å²	78.2	15%	0.147	38%	0.383	C	S	.	.	H	α-helix	trans	-62.9	-45.7	177.1	-177.6	64.1	0	0	0	111	F226 Q229 C230 N259 Y260 R266 L267	F226-L263 HydrophobicContact CD1-CD1 3.72Å; F226-L263 HydrophobicContact CE1-CD1 4.03Å; Q229-L263 HydrophobicContact CB-CD2 4.4Å; Q229-L263 HydrophobicContact CG-CD1 4.44Å; Q229-L263 HydrophobicContact CG-CD2 4.03Å; C230-L263 HydrophobicContact CB-CD2 4.42Å; N259-L263 PolarHBondContact O-N 3.01Å; Y260-L263 PolarHBondContact O-N 3.46Å; L263-R266 PolarHBondContact O-N 3.25Å; L263-L267 PolarHBondContact O-N 2.95Å
264	K	93.6	Very high	94.1	Very high	104 Å²	104	78.7 Å²	78.7	45%	0.452	38%	0.384	S	S	.	.	H	α-helix	trans	-62.2	-43.9	174.8	-85.8	-169.4	167	171.4	0	113.1	Y260 D261 R266 L267 G268	Y260-K264 HydrophobicContact CD1-CD 4.26Å; Y260-K264 HydrophobicContact CE1-CD 3.69Å; Y260-K264 HydrophobicContact CE1-CG 4.31Å; Y260-K264 VanDerWaalsContact CE1-NZ 3.34Å; Y260-K264 PolarHBondContact O-N 3.48Å; Y260-K264 WeakPolarHBondContact OH-CE 3.47Å; Y260-K264 PolarHBondContact OH-NZ 3.33Å; D261-K264 PolarHBondContact O-N 2.81Å; K264-R266 VanDerWaalsContact C-N 3.29Å; K264-R266 PolarHBondContact O-N 2.99Å; K264-L267 PolarHBondContact O-N 3.49Å; K264-G268 PolarHBondContact O-N 3.49Å
265	S	96.1	Very high	94.4	Very high	71 Å²	71	75.8 Å²	75.8	50%	0.497	37%	0.371	S	S	.	.	H	α-helix	trans	-58.7	-44.5	175.8	-170.6	0	0	0	0	110.7	D261 K262 G268 E269	D261-S265 WeakPolarHBondContact O-CB 3.38Å; D261-S265 PolarHBondContact O-N 3.1Å; K262-S265 PolarHBondContact O-N 2.73Å; S265-G268 PolarHBondContact O-N 2.9Å; S265-E269 PolarHBondContact O-N 3.46Å; S265-E269 VanDerWaalsContact O-N 3.09Å
266	R	95.2	Very high	94.8	Very high	129 Å²	129	74.5 Å²	74.5	49%	0.487	37%	0.367	S	S	.	.	H	α-helix	trans	-65.3	-41.1	179	-175.4	55.6	178.3	171.9	2	112.5	F226 K262 L263 K264 G268 E269 I270	F226-R266 HydrophobicContact CE1-CB 4.34Å; F226-R266 HydrophobicContact CE1-CG 3.71Å; F226-R266 HydrophobicContact CZ-CG 4.22Å; K262-R266 WeakPolarHBondContact O-CB 3.49Å; K262-R266 PolarHBondContact O-N 3.42Å; L263-R266 PolarHBondContact O-N 3.25Å; K264-R266 VanDerWaalsContact C-N 3.29Å; K264-R266 PolarHBondContact O-N 2.99Å; R266-G268 VanDerWaalsContact C-N 3.31Å; R266-G268 PolarHBondContact O-N 2.94Å; R266-E269 WeakPolarHBondContact CD-OE2 3.4Å; R266-E269 IonicContact CZ-OE2 3.29Å; R266-E269 IonicContact NH1-OE2 3.91Å; R266-E269 PolarHBondContact NH1-OE2 3.46Å; R266-E269 PolarHBondContact O-N 3.47Å; R266-I270 HydrophobicContact CG-CD1 4.27Å; R266-I270 WeakPolarHBondContact O-CG1 3.32Å; R266-I270 PolarHBondContact O-N 3.23Å; R266-I270 VanDerWaalsContact O-N 3.16Å
267	L	95.1	Very high	95.1	Very high	31 Å²	31	74.7 Å²	74.7	16%	0.162	37%	0.368	C	S	.	.	H	α-helix	trans	-60.3	-41.8	174.5	177.6	58.1	0	0	0	111.4	I223 F226 E227 L263 K264 E269 I270 H271	I223-L267 HydrophobicContact CG1-CD1 4.47Å; I223-L267 HydrophobicContact CG2-CD1 4.14Å; F226-L267 HydrophobicContact CB-CD1 3.81Å; E227-L267 HydrophobicContact CG-CD1 4.42Å; E227-L267 HydrophobicContact CG-CD2 4.08Å; L263-L267 PolarHBondContact O-N 2.95Å; K264-L267 PolarHBondContact O-N 3.49Å; L267-E269 PolarHBondContact O-N 3.16Å; L267-I270 PolarHBondContact O-N 3.35Å; L267-H271 PolarHBondContact O-N 2.92Å
268	G	95.3	Very high	95.5	Very high	32 Å²	32	72.8 Å²	72.8	33%	0.33	36%	0.358	S	S	.	.	H	α-helix	trans	-58.2	-46	174.3	0	0	0	0	0	113.1	K264 S265 R266 I270 H271 D272	K264-G268 PolarHBondContact O-N 3.49Å; S265-G268 PolarHBondContact O-N 2.9Å; R266-G268 VanDerWaalsContact C-N 3.31Å; R266-G268 PolarHBondContact O-N 2.94Å; G268-I270 VanDerWaalsContact C-N 3.32Å; G268-I270 PolarHBondContact O-N 3.49Å; G268-H271 WeakPolarHBondContact O-CB 3.42Å; G268-H271 PolarHBondContact O-N 3.39Å; G268-D272 PolarHBondContact O-N 3.24Å
269	E	96.9	Very high	95.8	Very high	88 Å²	88	72.9 Å²	72.9	41%	0.411	36%	0.357	S	S	.	.	H	α-helix	trans	-61.6	-37.6	177.4	-69.5	169.5	-166.5	0	0	113.3	S265 R266 L267 S273	S265-E269 PolarHBondContact O-N 3.46Å; S265-E269 VanDerWaalsContact O-N 3.09Å; R266-E269 WeakPolarHBondContact CD-OE2 3.4Å; R266-E269 IonicContact CZ-OE2 3.29Å; R266-E269 IonicContact NH1-OE2 3.91Å; R266-E269 PolarHBondContact NH1-OE2 3.46Å; R266-E269 PolarHBondContact O-N 3.47Å; L267-E269 PolarHBondContact O-N 3.16Å; E269-S273 WeakPolarHBondContact O-CB 3.13Å; E269-S273 PolarHBondContact O-N 3.2Å; E269-S273 PolarHBondContact O-OG 2.86Å
270	I	96.1	Very high	96	Very high	12 Å²	12	72.8 Å²	72.8	6%	0.062	36%	0.356	C	S	.	.	H	α-helix	trans	-68.4	-44.2	177.1	-64.6	168.2	0	0	0	109.6	F219 T222 I223 F226 R266 L267 G268 D272 S273 K274	F219-I270 HydrophobicContact CD1-CG2 3.99Å; F219-I270 HydrophobicContact CE1-CG2 4.48Å; T222-I270 HydrophobicContact CG2-CD1 4.28Å; T222-I270 HydrophobicContact CG2-CG2 4.49Å; I223-I270 HydrophobicContact CD1-CG2 4.26Å; I223-I270 HydrophobicContact CG1-CG2 3.64Å; F226-I270 HydrophobicContact CD1-CD1 4.3Å; F226-I270 HydrophobicContact CD2-CD1 3.98Å; F226-I270 HydrophobicContact CE1-CD1 4.12Å; F226-I270 HydrophobicContact CE2-CD1 3.77Å; F226-I270 HydrophobicContact CG-CD1 4.24Å; F226-I270 HydrophobicContact CZ-CD1 3.85Å; R266-I270 HydrophobicContact CG-CD1 4.27Å; R266-I270 WeakPolarHBondContact O-CG1 3.32Å; R266-I270 PolarHBondContact O-N 3.23Å; R266-I270 VanDerWaalsContact O-N 3.16Å; L267-I270 PolarHBondContact O-N 3.35Å; G268-I270 VanDerWaalsContact C-N 3.32Å; G268-I270 PolarHBondContact O-N 3.49Å; I270-D272 VanDerWaalsContact C-N 3.35Å; I270-D272 PolarHBondContact O-N 3.11Å; I270-S273 PolarHBondContact O-N 2.98Å; I270-K274 PolarHBondContact O-N 3Å
271	H	97.5	Very high	96.3	Very high	85 Å²	85	72 Å²	72	39%	0.394	36%	0.355	S	S	.	.	H	α-helix	trans	-59.9	-44.7	176.2	-167.9	-77.1	0	0	0	111.5	L267 G268 S273 K274 M275	L267-H271 PolarHBondContact O-N 2.92Å; G268-H271 WeakPolarHBondContact O-CB 3.42Å; G268-H271 PolarHBondContact O-N 3.39Å; H271-S273 VanDerWaalsContact C-N 3.32Å; H271-S273 PolarHBondContact O-N 3.43Å; H271-K274 PolarHBondContact O-N 3.04Å; H271-M275 VanDerWaalsContact O-CG 3.32Å; H271-M275 WeakPolarHBondContact O-CG 3.39Å; H271-M275 PolarHBondContact O-N 3.37Å
272	D	97.1	Very high	96.5	Very high	89 Å²	89	74.7 Å²	74.7	48%	0.476	36%	0.362	S	S	.	.	H	α-helix	trans	-64.6	-37.2	176.8	-73	-15.5	0	0	0	112.3	G268 I270 M275 R276	G268-D272 PolarHBondContact O-N 3.24Å; I270-D272 VanDerWaalsContact C-N 3.35Å; I270-D272 PolarHBondContact O-N 3.11Å; D272-M275 PolarHBondContact O-N 2.78Å; D272-R276 WeakPolarHBondContact O-CG 3.36Å; D272-R276 PolarHBondContact O-N 2.81Å
273	S	97.3	Very high	96.6	Very high	40 Å²	40	74.5 Å²	74.5	28%	0.28	36%	0.361	S	S	.	.	H	α-helix	trans	-66.3	-42.1	176.1	-59.9	0	0	0	0	112	E269 I270 H271 R276 L277	E269-S273 WeakPolarHBondContact O-CB 3.13Å; E269-S273 PolarHBondContact O-N 3.2Å; E269-S273 PolarHBondContact O-OG 2.86Å; I270-S273 PolarHBondContact O-N 2.98Å; H271-S273 VanDerWaalsContact C-N 3.32Å; H271-S273 PolarHBondContact O-N 3.43Å; S273-R276 PolarHBondContact O-N 2.92Å; S273-R276 PolarHBondContact OG-NH2 3.33Å; S273-L277 PolarHBondContact O-N 3.38Å; S273-L277 VanDerWaalsContact O-N 3.14Å
274	K	97.5	Very high	96.7	Very high	33 Å²	33	74.1 Å²	74.1	14%	0.143	36%	0.358	C	S	.	.	H	α-helix	trans	-60.3	-48.9	172	176	-169.1	157	-175.7	0	110.9	F219 N220 I223 I270 H271 R276 L277 E278	F219-K274 HydrophobicContact CB-CB 4.08Å; F219-K274 HydrophobicContact CB-CD 4.44Å; F219-K274 HydrophobicContact CB-CG 4.13Å; F219-K274 HydrophobicContact CG-CB 4.19Å; N220-K274 WeakPolarHBondContact OD1-CD 3.35Å; N220-K274 WeakPolarHBondContact OD1-CE 3.23Å; N220-K274 PolarHBondContact OD1-NZ 3.45Å; I223-K274 HydrophobicContact CD1-CB 4.3Å; I223-K274 HydrophobicContact CD1-CD 3.55Å; I270-K274 PolarHBondContact O-N 3Å; H271-K274 PolarHBondContact O-N 3.04Å; K274-R276 VanDerWaalsContact C-N 3.3Å; K274-R276 PolarHBondContact O-N 2.66Å; K274-L277 PolarHBondContact O-N 3.21Å; K274-E278 WeakPolarHBondContact CE-OE1 3.42Å; K274-E278 HydrophobicContact CG-CG 4.38Å; K274-E278 IonicContact NZ-OE1 2.58Å; K274-E278 WeakPolarHBondContact O-CG 3.16Å; K274-E278 PolarHBondContact O-N 3.49Å
275	M	97.8	Very high	96.9	Very high	73 Å²	73	70.6 Å²	70.6	36%	0.36	35%	0.349	S	S	.	.	H	α-helix	trans	-58.6	-40.3	-179.5	-76.5	-65.5	-59.9	0	0	112.3	H271 D272 E278 Q279	H271-M275 VanDerWaalsContact O-CG 3.32Å; H271-M275 WeakPolarHBondContact O-CG 3.39Å; H271-M275 PolarHBondContact O-N 3.37Å; D272-M275 PolarHBondContact O-N 2.78Å; M275-E278 PolarHBondContact O-N 2.6Å; M275-Q279 WeakPolarHBondContact O-CG 3.37Å; M275-Q279 PolarHBondContact O-N 3.29Å
276	R	97.8	Very high	96.9	Very high	131 Å²	131	71.4 Å²	71.4	49%	0.494	35%	0.347	S	S	.	.	H	α-helix	trans	-62.1	-45.9	173.3	-75.1	-173.9	-68.2	-89.7	1.8	111.8	D272 S273 K274 E278 Q279 D280	D272-R276 WeakPolarHBondContact O-CG 3.36Å; D272-R276 PolarHBondContact O-N 2.81Å; S273-R276 PolarHBondContact O-N 2.92Å; S273-R276 PolarHBondContact OG-NH2 3.33Å; K274-R276 VanDerWaalsContact C-N 3.3Å; K274-R276 PolarHBondContact O-N 2.66Å; R276-E278 VanDerWaalsContact C-N 3.32Å; R276-E278 PolarHBondContact O-N 2.95Å; R276-Q279 PolarHBondContact O-N 2.84Å; R276-D280 PolarHBondContact O-N 3.13Å
277	L	97.6	Very high	96.8	Very high	32 Å²	32	68.6 Å²	68.6	17%	0.168	34%	0.342	C	S	.	.	H	α-helix	trans	-64.7	-36.5	179.2	-172.1	61.8	0	0	0	112.5	K212 A215 I216 F219 S273 K274 D280 L281	K212-L277 HydrophobicContact CB-CD1 4.4Å; K212-L277 HydrophobicContact CD-CD1 4.21Å; K212-L277 HydrophobicContact CG-CD1 3.96Å; A215-L277 HydrophobicContact CB-CD2 3.77Å; I216-L277 HydrophobicContact CD1-CG 4.29Å; I216-L277 HydrophobicContact CG1-CB 4.42Å; I216-L277 HydrophobicContact CG1-CD2 3.78Å; I216-L277 HydrophobicContact CG1-CG 3.94Å; F219-L277 HydrophobicContact CD2-CD2 3.87Å; F219-L277 HydrophobicContact CE2-CD2 3.68Å; S273-L277 PolarHBondContact O-N 3.38Å; S273-L277 VanDerWaalsContact O-N 3.14Å; K274-L277 PolarHBondContact O-N 3.21Å; L277-D280 PolarHBondContact O-N 3.39Å; L277-L281 WeakPolarHBondContact O-CB 3.44Å; L277-L281 PolarHBondContact O-N 3.23Å
278	E	97.6	Very high	96.9	Very high	63 Å²	63	67.8 Å²	67.8	29%	0.294	34%	0.338	S	S	.	.	H	α-helix	trans	-65.1	-40	174.1	-75.2	-179.9	160.2	0	0	112.3	I216 K274 M275 R276 L281 K282	I216-E278 HydrophobicContact CD1-CG 3.81Å; I216-E278 HydrophobicContact CG1-CG 4.13Å; I216-E278 HydrophobicContact CG2-CG 4.24Å; K274-E278 WeakPolarHBondContact CE-OE1 3.42Å; K274-E278 HydrophobicContact CG-CG 4.38Å; K274-E278 IonicContact NZ-OE1 2.58Å; K274-E278 WeakPolarHBondContact O-CG 3.16Å; K274-E278 PolarHBondContact O-N 3.49Å; M275-E278 PolarHBondContact O-N 2.6Å; R276-E278 VanDerWaalsContact C-N 3.32Å; R276-E278 PolarHBondContact O-N 2.95Å; E278-L281 PolarHBondContact O-N 3.13Å; E278-K282 WeakPolarHBondContact O-CB 3.43Å; E278-K282 PolarHBondContact O-N 3.4Å
279	Q	97.7	Very high	96.9	Very high	123 Å²	123	74.5 Å²	74.5	58%	0.575	35%	0.353	S	S	*	.	H	α-helix	trans	-63.6	-44.3	174.1	-72.1	174.3	2.8	0	0	111.4	M275 R276 K282 K283	M275-Q279 WeakPolarHBondContact O-CG 3.37Å; M275-Q279 PolarHBondContact O-N 3.29Å; R276-Q279 PolarHBondContact O-N 2.84Å; Q279-K282 PolarHBondContact O-N 3.05Å; Q279-K283 PolarHBondContact O-N 3.34Å
280	D	97.1	Very high	96.9	Very high	85 Å²	85	75.5 Å²	75.5	46%	0.455	36%	0.358	S	S	.	.	H	α-helix	trans	-63.8	-41.7	176.6	-75.3	-11.8	0	0	0	112.1	R276 L277 K282 K283 Q284	R276-D280 PolarHBondContact O-N 3.13Å; L277-D280 PolarHBondContact O-N 3.39Å; D280-K282 VanDerWaalsContact C-N 3.33Å; D280-K282 PolarHBondContact O-N 3.27Å; D280-K283 PolarHBondContact O-N 2.63Å; D280-Q284 WeakPolarHBondContact O-CB 3.35Å; D280-Q284 PolarHBondContact O-N 2.76Å
281	L	97.7	Very high	96.8	Very high	30 Å²	30	75.5 Å²	75.5	16%	0.157	36%	0.358	C	S	.	.	H	α-helix	trans	-59.7	-45.2	174.3	174.3	64.6	0	0	0	110.7	I209 K212 R213 I216 L277 E278 Q284 A285	I209-L281 HydrophobicContact CB-CD1 4.24Å; I209-L281 HydrophobicContact CG1-CD1 4.33Å; I209-L281 HydrophobicContact CG2-CD1 3.81Å; K212-L281 HydrophobicContact CB-CB 4.47Å; K212-L281 HydrophobicContact CB-CD1 4.02Å; R213-L281 HydrophobicContact CG-CD1 4.16Å; R213-L281 HydrophobicContact CG-CD2 3.87Å; I216-L281 HydrophobicContact CD1-CB 4.15Å; I216-L281 HydrophobicContact CD1-CD2 3.47Å; I216-L281 VanDerWaalsContact CD1-CD2 3.47Å; I216-L281 HydrophobicContact CD1-CG 4.41Å; L277-L281 WeakPolarHBondContact O-CB 3.44Å; L277-L281 PolarHBondContact O-N 3.23Å; E278-L281 PolarHBondContact O-N 3.13Å; L281-Q284 PolarHBondContact O-N 3.45Å; L281-A285 VanDerWaalsContact O-CB 3.25Å; L281-A285 WeakPolarHBondContact O-CB 3.41Å; L281-A285 PolarHBondContact O-N 3.16Å
282	K	97	Very high	96.8	Very high	150 Å²	150	74.2 Å²	74.2	65%	0.652	35%	0.354	S	S	*	.	H	α-helix	trans	-63.8	-43.8	179.8	-173	177.4	-178.9	179.8	0	111.5	E278 Q279 D280 A285 L286	E278-K282 WeakPolarHBondContact O-CB 3.43Å; E278-K282 PolarHBondContact O-N 3.4Å; Q279-K282 PolarHBondContact O-N 3.05Å; D280-K282 VanDerWaalsContact C-N 3.33Å; D280-K282 PolarHBondContact O-N 3.27Å; K282-A285 PolarHBondContact O-N 3.44Å; K282-L286 WeakPolarHBondContact O-CG 3.32Å; K282-L286 PolarHBondContact O-N 3.32Å; K282-L286 VanDerWaalsContact O-N 3.15Å
283	K	96.9	Very high	96.7	Very high	136 Å²	136	77 Å²	77	59%	0.591	36%	0.362	S	S	*	.	H	α-helix	trans	-60.8	-52.1	175.8	-177.3	-178.1	174.1	-173.1	0	110.7	Q279 D280 A285 L286 D287	Q279-K283 PolarHBondContact O-N 3.34Å; D280-K283 PolarHBondContact O-N 2.63Å; K283-A285 VanDerWaalsContact C-N 3.28Å; K283-A285 PolarHBondContact O-N 2.95Å; K283-L286 WeakPolarHBondContact O-CB 3.38Å; K283-L286 PolarHBondContact O-N 3.42Å; K283-D287 PolarHBondContact O-N 3.47Å
284	Q	96.5	Very high	96.6	Very high	19 Å²	19	80.5 Å²	80.5	9%	0.089	37%	0.372	C	S	.	.	H	α-helix	trans	-62.8	-35.3	-178.7	-168.9	169.4	18.9	0	0	112.8	T205 E208 I209 K212 D280 L281 L286 D287 N288	T205-Q284 HydrophobicContact CG2-CG 3.53Å; E208-Q284 PolarHBondContact OE2-NE2 3.42Å; I209-Q284 HydrophobicContact CD1-CG 4.29Å; I209-Q284 HydrophobicContact CG1-CB 4.35Å; I209-Q284 HydrophobicContact CG1-CG 3.91Å; K212-Q284 VanDerWaalsContact CE-OE1 3.29Å; D280-Q284 WeakPolarHBondContact O-CB 3.35Å; D280-Q284 PolarHBondContact O-N 2.76Å; L281-Q284 PolarHBondContact O-N 3.45Å; Q284-L286 VanDerWaalsContact C-N 3.32Å; Q284-L286 PolarHBondContact O-N 3.48Å; Q284-D287 PolarHBondContact O-N 3.38Å; Q284-N288 WeakPolarHBondContact O-CB 3.39Å; Q284-N288 PolarHBondContact O-N 3.02Å
285	A	96.6	Very high	96.6	Very high	30 Å²	30	79.2 Å²	79.2	25%	0.248	37%	0.367	C	S	.	.	H	α-helix	trans	-66.9	-31.4	174.4	0	0	0	0	0	113.1	I209 L281 K282 K283 R289	I209-A285 HydrophobicContact CD1-CB 4.34Å; L281-A285 VanDerWaalsContact O-CB 3.25Å; L281-A285 WeakPolarHBondContact O-CB 3.41Å; L281-A285 PolarHBondContact O-N 3.16Å; K282-A285 PolarHBondContact O-N 3.44Å; K283-A285 VanDerWaalsContact C-N 3.28Å; K283-A285 PolarHBondContact O-N 2.95Å; A285-R289 WeakPolarHBondContact O-CG 3.5Å; A285-R289 PolarHBondContact O-N 2.94Å
286	L	96.2	Very high	96.4	Very high	88 Å²	88	79.1 Å²	79.1	46%	0.461	37%	0.367	S	S	.	.	H	α-helix	trans	-70.5	-48.3	172.7	-69.9	169.3	0	0	0	110.6	K282 K283 Q284 N288 R289 E290	K282-L286 WeakPolarHBondContact O-CG 3.32Å; K282-L286 PolarHBondContact O-N 3.32Å; K282-L286 VanDerWaalsContact O-N 3.15Å; K283-L286 WeakPolarHBondContact O-CB 3.38Å; K283-L286 PolarHBondContact O-N 3.42Å; Q284-L286 VanDerWaalsContact C-N 3.32Å; Q284-L286 PolarHBondContact O-N 3.48Å; L286-N288 VanDerWaalsContact C-N 3.27Å; L286-N288 PolarHBondContact O-N 2.98Å; L286-R289 WeakPolarHBondContact O-CB 3.41Å; L286-R289 PolarHBondContact O-N 3.33Å; L286-E290 PolarHBondContact O-N 3.43Å
287	D	94.1	Very high	96.3	Very high	70 Å²	70	76.1 Å²	76.1	37%	0.374	37%	0.367	S	S	.	.	H	α-helix	trans	-57.7	-42.3	177.9	-60.8	-17.9	0	0	0	110.7	K283 Q284 R289 E290 I291	K283-D287 PolarHBondContact O-N 3.47Å; Q284-D287 PolarHBondContact O-N 3.38Å; D287-R289 VanDerWaalsContact C-N 3.32Å; D287-R289 PolarHBondContact O-N 2.88Å; D287-E290 WeakPolarHBondContact O-CB 3.39Å; D287-E290 PolarHBondContact O-N 3.43Å; D287-I291 WeakPolarHBondContact O-CG1 3.36Å; D287-I291 PolarHBondContact O-N 2.84Å
288	N	96.4	Very high	96	Very high	15 Å²	15	75.2 Å²	75.2	8%	0.08	36%	0.362	C	S	.	.	H	α-helix	trans	-64.1	-34.5	177.2	-158.6	45.8	0	0	0	113.3	Y202 T205 I209 Q284 L286 E290 I291 D292	Y202-N288 VanDerWaalsContact CD2-OD1 3.23Å; Y202-N288 WeakPolarHBondContact CD2-OD1 3.47Å; Y202-N288 WeakPolarHBondContact CE2-ND2 3.39Å; Y202-N288 PolarHBondContact O-OD1 2.8Å; T205-N288 HydrophobicContact CG2-CB 3.73Å; I209-N288 HydrophobicContact CD1-CB 3.79Å; Q284-N288 WeakPolarHBondContact O-CB 3.39Å; Q284-N288 PolarHBondContact O-N 3.02Å; L286-N288 VanDerWaalsContact C-N 3.27Å; L286-N288 PolarHBondContact O-N 2.98Å; N288-E290 VanDerWaalsContact C-N 3.33Å; N288-I291 PolarHBondContact O-N 2.86Å; N288-D292 PolarHBondContact O-N 3.5Å; N288-D292 VanDerWaalsContact O-N 3.13Å
289	R	95.9	Very high	95.7	Very high	172 Å²	172	74.8 Å²	74.8	65%	0.649	36%	0.359	S	S	*	.	H	α-helix	trans	-69.9	-30.9	173.3	-75.9	174.9	176.2	175.3	-0.2	112	A285 L286 D287 K293	A285-R289 WeakPolarHBondContact O-CG 3.5Å; A285-R289 PolarHBondContact O-N 2.94Å; L286-R289 WeakPolarHBondContact O-CB 3.41Å; L286-R289 PolarHBondContact O-N 3.33Å; D287-R289 VanDerWaalsContact C-N 3.32Å; D287-R289 PolarHBondContact O-N 2.88Å; R289-K293 WeakPolarHBondContact O-CG 3.36Å; R289-K293 PolarHBondContact O-N 3.45Å; R289-K293 VanDerWaalsContact O-N 3.11Å
290	E	96.1	Very high	95.4	Very high	109 Å²	109	72.2 Å²	72.2	51%	0.509	35%	0.353	S	S	.	.	H	α-helix	trans	-69.9	-39.3	174.1	-66.9	-170.6	172.1	0	0	111.8	L286 D287 N288 K293 K294	L286-E290 PolarHBondContact O-N 3.43Å; D287-E290 WeakPolarHBondContact O-CB 3.39Å; D287-E290 PolarHBondContact O-N 3.43Å; N288-E290 VanDerWaalsContact C-N 3.33Å; E290-K293 PolarHBondContact O-N 2.92Å; E290-K294 WeakPolarHBondContact O-CG 3.23Å; E290-K294 PolarHBondContact O-N 3.48Å
291	I	95.5	Very high	95.2	Very high	12 Å²	12	71.2 Å²	71.2	6%	0.062	35%	0.347	C	S	.	.	H	α-helix	trans	-59.5	-47.4	173.3	-64.2	164.7	0	0	0	110.4	L198 E201 Y202 D287 N288 K293 K294 M295	L198-I291 HydrophobicContact CB-CG2 4.27Å; L198-I291 HydrophobicContact CD2-CG2 4.26Å; L198-I291 WeakPolarHBondContact O-CG2 3.25Å; E201-I291 HydrophobicContact CB-CD1 4.49Å; E201-I291 HydrophobicContact CG-CD1 3.69Å; Y202-I291 HydrophobicContact CD2-CG2 4.44Å; D287-I291 WeakPolarHBondContact O-CG1 3.36Å; D287-I291 PolarHBondContact O-N 2.84Å; N288-I291 PolarHBondContact O-N 2.86Å; I291-K293 VanDerWaalsContact C-N 3.34Å; I291-K293 PolarHBondContact O-N 3.48Å; I291-K294 WeakPolarHBondContact O-CB 3.31Å; I291-K294 PolarHBondContact O-N 2.93Å; I291-K294 VanDerWaalsContact O-N 3.12Å; I291-M295 HydrophobicContact CG2-CG 4.43Å; I291-M295 HydrophobicContact CG2-SD 4.04Å; I291-M295 WeakPolarHBondContact O-CG 3.49Å; I291-M295 PolarHBondContact O-N 3.42Å
292	D	95.6	Very high	94.9	Very high	58 Å²	58	71.1 Å²	71.1	31%	0.31	35%	0.347	S	S	.	.	H	α-helix	trans	-59.4	-42	177	179	46.7	0	0	0	112.2	Y202 N288 K294 M295 N296	Y202-D292 HydrophobicContact CD2-CB 4.46Å; Y202-D292 HydrophobicContact CE2-CB 4.13Å; N288-D292 PolarHBondContact O-N 3.5Å; N288-D292 VanDerWaalsContact O-N 3.13Å; D292-K294 PolarHBondContact O-N 3.26Å; D292-M295 PolarHBondContact O-N 2.95Å; D292-N296 VanDerWaalsContact CG-ND2 3.34Å; D292-N296 WeakPolarHBondContact O-CB 3.26Å; D292-N296 VanDerWaalsContact O-CG 3.26Å; D292-N296 PolarHBondContact O-N 3.43Å; D292-N296 PolarHBondContact O-ND2 3.38Å; D292-N296 PolarHBondContact OD1-ND2 3.24Å; D292-N296 PolarHBondContact OD2-ND2 3.17Å
293	K	96	Very high	94.4	Very high	148 Å²	148	69.6 Å²	69.6	64%	0.643	35%	0.345	S	S	*	.	H	α-helix	trans	-60.1	-44	173.6	-74.3	175	-177.1	177.8	0	112.5	R289 E290 I291 N296 S297	R289-K293 WeakPolarHBondContact O-CG 3.36Å; R289-K293 PolarHBondContact O-N 3.45Å; R289-K293 VanDerWaalsContact O-N 3.11Å; E290-K293 PolarHBondContact O-N 2.92Å; I291-K293 VanDerWaalsContact C-N 3.34Å; I291-K293 PolarHBondContact O-N 3.48Å; K293-N296 PolarHBondContact O-N 3.03Å; K293-S297 PolarHBondContact O-N 2.79Å
294	K	95.4	Very high	93.9	Very high	113 Å²	113	68.8 Å²	68.8	49%	0.491	34%	0.343	S	S	.	.	H	α-helix	trans	-62.1	-47.6	177.2	-71.4	175.8	-175.2	173.9	0	110.7	L198 E290 I291 D292 N296 S297 I298	L198-K294 HydrophobicContact CD1-CB 4.08Å; L198-K294 HydrophobicContact CD2-CD 4.45Å; E290-K294 WeakPolarHBondContact O-CG 3.23Å; E290-K294 PolarHBondContact O-N 3.48Å; I291-K294 WeakPolarHBondContact O-CB 3.31Å; I291-K294 PolarHBondContact O-N 2.93Å; I291-K294 VanDerWaalsContact O-N 3.12Å; D292-K294 PolarHBondContact O-N 3.26Å; K294-N296 VanDerWaalsContact C-N 3.34Å; K294-N296 PolarHBondContact O-N 3.14Å; K294-S297 PolarHBondContact O-N 2.94Å; K294-S297 VanDerWaalsContact O-N 3.1Å; K294-S297 PolarHBondContact O-OG 3.1Å; K294-I298 WeakPolarHBondContact O-CG1 3.45Å; K294-I298 PolarHBondContact O-N 3.01Å; K294-I298 VanDerWaalsContact O-N 3.08Å
295	M	96.3	Very high	93.6	Very high	7 Å²	7	68.5 Å²	68.5	3%	0.034	34%	0.342	C	S	.	.	H	α-helix	trans	-56.7	-47.8	175.7	-72.7	172.9	53.6	0	0	111.8	Y195 L198 Y199 Y202 I291 D292 S297 I298 K299	Y195-M295 HydrophobicContact CD2-CB 4.43Å; Y195-M295 HydrophobicContact CD2-CG 4.48Å; Y195-M295 HydrophobicContact CE2-CB 3.98Å; Y195-M295 HydrophobicContact CE2-CE 4.01Å; Y195-M295 HydrophobicContact CE2-CG 4.26Å; L198-M295 HydrophobicContact CB-CG 3.67Å; L198-M295 HydrophobicContact CB-SD 4.29Å; L198-M295 HydrophobicContact CD1-CG 4.21Å; Y199-M295 HydrophobicContact CD2-CE 3.68Å; Y202-M295 HydrophobicContact CG-SD 4.31Å; I291-M295 HydrophobicContact CG2-CG 4.43Å; I291-M295 HydrophobicContact CG2-SD 4.04Å; I291-M295 WeakPolarHBondContact O-CG 3.49Å; I291-M295 PolarHBondContact O-N 3.42Å; D292-M295 PolarHBondContact O-N 2.95Å; M295-S297 PolarHBondContact O-N 3.38Å; M295-I298 PolarHBondContact O-N 3.49Å; M295-I298 VanDerWaalsContact O-N 3.12Å; M295-K299 WeakPolarHBondContact O-CG 3.36Å; M295-K299 PolarHBondContact O-N 3.48Å
296	N	94.1	Very high	93.2	Very high	70 Å²	70	73.6 Å²	73.6	37%	0.374	36%	0.355	S	S	.	.	H	α-helix	trans	-67.1	-23.6	180	-67.8	-35.9	0	0	0	113.1	D292 K293 K294 K299 P300	D292-N296 VanDerWaalsContact CG-ND2 3.34Å; D292-N296 WeakPolarHBondContact O-CB 3.26Å; D292-N296 VanDerWaalsContact O-CG 3.26Å; D292-N296 PolarHBondContact O-N 3.43Å; D292-N296 PolarHBondContact O-ND2 3.38Å; D292-N296 PolarHBondContact OD1-ND2 3.24Å; D292-N296 PolarHBondContact OD2-ND2 3.17Å; K293-N296 PolarHBondContact O-N 3.03Å; K294-N296 VanDerWaalsContact C-N 3.34Å; K294-N296 PolarHBondContact O-N 3.14Å; N296-K299 WeakPolarHBondContact OD1-CE 3.25Å; N296-K299 PolarHBondContact OD1-NZ 3.01Å; N296-P300 WeakPolarHBondContact O-CD 3.42Å
297	S	95.1	Very high	92.6	Very high	69 Å²	69	75.8 Å²	75.8	48%	0.483	36%	0.361	S	S	.	.	H	α-helix	trans	-76.5	-32.1	171.4	75.2	0	0	0	0	113.5	K293 K294 M295 P300	K293-S297 PolarHBondContact O-N 2.79Å; K294-S297 PolarHBondContact O-N 2.94Å; K294-S297 VanDerWaalsContact O-N 3.1Å; K294-S297 PolarHBondContact O-OG 3.1Å; M295-S297 PolarHBondContact O-N 3.38Å; S297-P300 WeakPolarHBondContact O-CD 3.24Å; S297-P300 WeakPolarHBondContact O-CG 3.31Å
298	I	93.1	Very high	92.2	Very high	13 Å²	13	74.1 Å²	74.1	7%	0.067	35%	0.352	C	S	.	.	H	α-helix	trans	-81.9	-33	-179.4	-65.7	166	0	0	0	111.7	K191 E194 L198 K294 M295 D301 L302	K191-I298 HydrophobicContact CB-CG2 4.43Å; E194-I298 HydrophobicContact CG-CD1 4.09Å; L198-I298 HydrophobicContact CD1-CD1 3.58Å; K294-I298 WeakPolarHBondContact O-CG1 3.45Å; K294-I298 PolarHBondContact O-N 3.01Å; K294-I298 VanDerWaalsContact O-N 3.08Å; M295-I298 PolarHBondContact O-N 3.49Å; M295-I298 VanDerWaalsContact O-N 3.12Å; I298-D301 WeakPolarHBondContact O-CB 3.43Å; I298-D301 PolarHBondContact O-N 3.09Å; I298-D301 VanDerWaalsContact O-N 3.13Å; I298-L302 PolarHBondContact O-N 2.94Å
299	K	91.2	Very high	91.8	Very high	54 Å²	54	75.1 Å²	75.1	24%	0.235	35%	0.354	C	S	.	.	H	α-helix	trans	-46.3	-54.3	178.7	-80.3	176.5	-172.3	169.3	0	114.5	Y195 M295 N296 D301 L302 I303	Y195-K299 HydrophobicContact CD2-CG 4.43Å; Y195-K299 HydrophobicContact CE2-CD 4.35Å; Y195-K299 HydrophobicContact CE2-CG 3.68Å; Y195-K299 WeakPolarHBondContact OH-CE 3.42Å; M295-K299 WeakPolarHBondContact O-CG 3.36Å; M295-K299 PolarHBondContact O-N 3.48Å; N296-K299 WeakPolarHBondContact OD1-CE 3.25Å; N296-K299 PolarHBondContact OD1-NZ 3.01Å; K299-D301 VanDerWaalsContact C-N 3.32Å; K299-D301 PolarHBondContact O-N 3.34Å; K299-L302 PolarHBondContact O-N 2.77Å; K299-I303 WeakPolarHBondContact O-CG1 3.29Å; K299-I303 PolarHBondContact O-N 3.23Å; K299-I303 VanDerWaalsContact O-N 3.11Å
300	P	91.8	Very high	91.2	Very high	69 Å²	69	69.4 Å²	69.4	45%	0.448	34%	0.337	S	S	.	.	H	α-helix	trans	-63	-38.8	-179.2	24.3	-34.6	0	0	0	112.4	N296 S297 L302 I303 Q304	N296-P300 WeakPolarHBondContact O-CD 3.42Å; S297-P300 WeakPolarHBondContact O-CD 3.24Å; S297-P300 WeakPolarHBondContact O-CG 3.31Å; P300-L302 VanDerWaalsContact C-N 3.34Å; P300-L302 PolarHBondContact O-N 3.35Å; P300-I303 PolarHBondContact O-N 2.82Å; P300-Q304 WeakPolarHBondContact O-CB 3.48Å; P300-Q304 PolarHBondContact O-N 2.96Å
301	D	90.9	Very high	90.6	Very high	63 Å²	63	66.2 Å²	66.2	34%	0.337	32%	0.322	S	S	.	.	H	α-helix	trans	-63.4	-41.3	177.5	-72	-7	0	0	0	111.7	K191 I298 K299 Q304 L305	K191-D301 HydrophobicContact CD-CB 4.07Å; K191-D301 VanDerWaalsContact NZ-CB 3.34Å; K191-D301 VanDerWaalsContact NZ-CG 3.34Å; K191-D301 IonicContact NZ-OD2 2.8Å; K191-D301 PolarHBondContact NZ-OD2 3.44Å; I298-D301 WeakPolarHBondContact O-CB 3.43Å; I298-D301 PolarHBondContact O-N 3.09Å; I298-D301 VanDerWaalsContact O-N 3.13Å; K299-D301 VanDerWaalsContact C-N 3.32Å; K299-D301 PolarHBondContact O-N 3.34Å; D301-Q304 PolarHBondContact O-N 2.87Å; D301-L305 WeakPolarHBondContact O-CB 3.3Å; D301-L305 WeakPolarHBondContact O-CG 3.48Å; D301-L305 PolarHBondContact O-N 3.48Å
302	L	91.6	Very high	90.1	Very high	28 Å²	28	66.2 Å²	66.2	15%	0.147	32%	0.321	C	S	.	.	H	α-helix	trans	-63.6	-43.2	178.2	-168.8	69.3	0	0	0	111.3	Y188 K191 I298 K299 P300 L305 R306	Y188-L302 HydrophobicContact CD2-CD1 3.65Å; Y188-L302 HydrophobicContact CD2-CG 4.34Å; Y188-L302 HydrophobicContact CE2-CD1 3.54Å; Y188-L302 HydrophobicContact CE2-CG 3.9Å; Y188-L302 HydrophobicContact CG-CD1 4.48Å; K191-L302 HydrophobicContact CB-CD1 4.19Å; I298-L302 PolarHBondContact O-N 2.94Å; K299-L302 PolarHBondContact O-N 2.77Å; P300-L302 VanDerWaalsContact C-N 3.34Å; P300-L302 PolarHBondContact O-N 3.35Å; L302-L305 PolarHBondContact O-N 3.35Å; L302-R306 WeakPolarHBondContact O-CB 3.41Å; L302-R306 PolarHBondContact O-N 2.81Å
303	I	86.4	Confident	89.6	Confident	119 Å²	119	65.3 Å²	65.3	61%	0.61	32%	0.316	S	S	*	.	H	α-helix	trans	-62.7	-44.8	175.6	-66	166.5	0	0	0	110.4	K299 P300 R306 K307	K299-I303 WeakPolarHBondContact O-CG1 3.29Å; K299-I303 PolarHBondContact O-N 3.23Å; K299-I303 VanDerWaalsContact O-N 3.11Å; P300-I303 PolarHBondContact O-N 2.82Å; I303-R306 PolarHBondContact O-N 3.31Å; I303-K307 WeakPolarHBondContact O-CB 3.31Å; I303-K307 PolarHBondContact O-N 3.31Å
304	Q	87.7	Confident	88.9	Confident	118 Å²	118	60.4 Å²	60.4	55%	0.551	30%	0.299	S	S	*	.	H	α-helix	trans	-64.3	-46.2	179.1	-178.6	176.2	-25.9	0	0	111.7	P300 D301 R306 K307 I308	P300-Q304 WeakPolarHBondContact O-CB 3.48Å; P300-Q304 PolarHBondContact O-N 2.96Å; D301-Q304 PolarHBondContact O-N 2.87Å; Q304-R306 PolarHBondContact O-N 3.42Å; Q304-K307 PolarHBondContact O-N 2.86Å; Q304-I308 HydrophobicContact CG-CD1 3.82Å; Q304-I308 HydrophobicContact CG-CG1 4.46Å; Q304-I308 VanDerWaalsContact O-CG1 3.32Å; Q304-I308 WeakPolarHBondContact O-CG1 3.07Å; Q304-I308 PolarHBondContact O-N 2.89Å
305	L	89.8	Confident	88.4	Confident	14 Å²	14	55.3 Å²	55.3	7%	0.073	28%	0.276	C	S	.	.	H	α-helix	trans	-61.7	-43.3	177.3	-77.2	170.2	0	0	0	111.6	Y184 Q187 Y188 K191 D301 L302 K307 I308 R309	Y184-L305 HydrophobicContact CD1-CD2 4.15Å; Q187-L305 HydrophobicContact CB-CD1 4.23Å; Q187-L305 HydrophobicContact CB-CD2 4.22Å; Y188-L305 HydrophobicContact CD2-CB 4.25Å; K191-L305 HydrophobicContact CD-CD1 3.8Å; K191-L305 HydrophobicContact CG-CD1 4.38Å; D301-L305 WeakPolarHBondContact O-CB 3.3Å; D301-L305 WeakPolarHBondContact O-CG 3.48Å; D301-L305 PolarHBondContact O-N 3.48Å; L302-L305 PolarHBondContact O-N 3.35Å; L305-K307 VanDerWaalsContact C-N 3.34Å; L305-K307 PolarHBondContact O-N 3.44Å; L305-I308 PolarHBondContact O-N 3.34Å; L305-R309 VanDerWaalsContact O-CB 3.25Å; L305-R309 WeakPolarHBondContact O-CB 3.41Å; L305-R309 PolarHBondContact O-N 2.91Å
306	R	87.4	Confident	87.8	Confident	137 Å²	137	55 Å²	55	52%	0.517	28%	0.275	S	S	.	.	H	α-helix	trans	-57.5	-48.6	173.4	-178.9	177.1	175.3	-179.1	2.1	111.1	Y188 L302 I303 Q304 I308 R309 D310	Y188-R306 HydrophobicContact CD2-CB 4.1Å; Y188-R306 HydrophobicContact CE2-CB 3.79Å; Y188-R306 HydrophobicContact CE2-CG 4.41Å; L302-R306 WeakPolarHBondContact O-CB 3.41Å; L302-R306 PolarHBondContact O-N 2.81Å; I303-R306 PolarHBondContact O-N 3.31Å; Q304-R306 PolarHBondContact O-N 3.42Å; R306-I308 PolarHBondContact O-N 3.47Å; R306-R309 PolarHBondContact O-N 3.47Å; R306-D310 WeakPolarHBondContact CG-OD2 3.37Å; R306-D310 IonicContact NE-OD2 3.79Å; R306-D310 WeakPolarHBondContact O-CB 3.44Å; R306-D310 PolarHBondContact O-N 3Å
307	K	84.8	Confident	87.1	Confident	133 Å²	133	56.3 Å²	56.3	58%	0.578	28%	0.282	S	S	*	.	H	α-helix	trans	-60.1	-45.5	179.9	-173.8	176.4	-176.5	175.1	0	112	I303 Q304 L305 Q311	I303-K307 WeakPolarHBondContact O-CB 3.31Å; I303-K307 PolarHBondContact O-N 3.31Å; Q304-K307 PolarHBondContact O-N 2.86Å; L305-K307 VanDerWaalsContact C-N 3.34Å; L305-K307 PolarHBondContact O-N 3.44Å; K307-Q311 WeakPolarHBondContact O-CB 3.4Å; K307-Q311 WeakPolarHBondContact O-CG 3.16Å; K307-Q311 PolarHBondContact O-N 3.24Å
308	I	85.8	Confident	86.4	Confident	36 Å²	36	59 Å²	59	19%	0.185	29%	0.286	C	S	.	.	H	α-helix	trans	-65.6	-45.3	178.8	-66.8	168.5	0	0	0	110.5	Y184 Q304 L305 R306 D310 Q311 H312	Y184-I308 HydrophobicContact CD1-CG2 4.18Å; Y184-I308 HydrophobicContact CD2-CG2 3.67Å; Y184-I308 HydrophobicContact CE1-CG2 4.16Å; Y184-I308 HydrophobicContact CE2-CG2 3.65Å; Y184-I308 HydrophobicContact CG-CG2 3.96Å; Q304-I308 HydrophobicContact CG-CD1 3.82Å; Q304-I308 HydrophobicContact CG-CG1 4.46Å; Q304-I308 VanDerWaalsContact O-CG1 3.32Å; Q304-I308 WeakPolarHBondContact O-CG1 3.07Å; Q304-I308 PolarHBondContact O-N 2.89Å; L305-I308 PolarHBondContact O-N 3.34Å; R306-I308 PolarHBondContact O-N 3.47Å; I308-D310 PolarHBondContact O-N 2.93Å; I308-Q311 WeakPolarHBondContact O-CB 3.36Å; I308-Q311 PolarHBondContact O-N 2.93Å; I308-H312 PolarHBondContact O-N 2.99Å; I308-H312 PolarHBondContact O-ND1 3.36Å
309	R	87.4	Confident	85.8	Confident	35 Å²	35	63.2 Å²	63.2	13%	0.132	30%	0.304	C	S	.	.	H	α-helix	trans	-57.7	-49.5	176.2	-179.6	-158.2	68.2	-173.5	7.4	111.4	L181 L305 R306 Q311 H312 L313	L181-R309 HydrophobicContact CD1-CG 3.7Å; L305-R309 VanDerWaalsContact O-CB 3.25Å; L305-R309 WeakPolarHBondContact O-CB 3.41Å; L305-R309 PolarHBondContact O-N 2.91Å; R306-R309 PolarHBondContact O-N 3.47Å; R309-Q311 VanDerWaalsContact C-N 3.3Å; R309-Q311 PolarHBondContact O-N 3.3Å; R309-H312 PolarHBondContact O-N 3.15Å; R309-H312 VanDerWaalsContact O-N 3.16Å; R309-L313 HydrophobicContact CG-CD1 4.33Å; R309-L313 PolarHBondContact O-N 3.43Å
310	D	84.1	Confident	85.2	Confident	53 Å²	53	63.5 Å²	63.5	28%	0.283	32%	0.323	S	S	.	.	H	α-helix	trans	-65.9	-35.3	-178.2	-65.5	-8.7	0	0	0	110.9	R306 I308 L313 V314	R306-D310 WeakPolarHBondContact CG-OD2 3.37Å; R306-D310 IonicContact NE-OD2 3.79Å; R306-D310 WeakPolarHBondContact O-CB 3.44Å; R306-D310 PolarHBondContact O-N 3Å; I308-D310 PolarHBondContact O-N 2.93Å; D310-L313 PolarHBondContact O-N 3.17Å; D310-V314 WeakPolarHBondContact O-CB 3.34Å; D310-V314 VanDerWaalsContact O-CG2 3.26Å; D310-V314 WeakPolarHBondContact O-CG2 3.35Å; D310-V314 PolarHBondContact O-N 2.62Å
311	Q	83.4	Confident	84.9	Confident	41 Å²	41	60.8 Å²	60.8	19%	0.192	31%	0.305	C	S	.	.	H	α-helix	trans	-61.8	-44.6	171.3	-75.2	169.1	-6.2	0	0	112.5	K307 I308 R309 V314 W315	K307-Q311 WeakPolarHBondContact O-CB 3.4Å; K307-Q311 WeakPolarHBondContact O-CG 3.16Å; K307-Q311 PolarHBondContact O-N 3.24Å; I308-Q311 WeakPolarHBondContact O-CB 3.36Å; I308-Q311 PolarHBondContact O-N 2.93Å; R309-Q311 VanDerWaalsContact C-N 3.3Å; R309-Q311 PolarHBondContact O-N 3.3Å; Q311-V314 PolarHBondContact O-N 3.3Å; Q311-W315 WeakPolarHBondContact O-CB 3.15Å; Q311-W315 PolarHBondContact O-N 3.43Å
312	H	84.3	Confident	84.4	Confident	12 Å²	12	67.8 Å²	67.8	6%	0.056	33%	0.327	C	S	.	.	H	α-helix	trans	-66.2	-39.2	177.8	-74.9	65.1	0	0	0	111.6	L181 Y184 I308 R309 W315 L316	L181-H312 HydrophobicContact CB-CB 4.19Å; L181-H312 HydrophobicContact CD1-CB 4.02Å; Y184-H312 AromaticContact CE2-CE1 3.66Å; Y184-H312 AromaticContact CE2-NE2 3.64Å; I308-H312 PolarHBondContact O-N 2.99Å; I308-H312 PolarHBondContact O-ND1 3.36Å; R309-H312 PolarHBondContact O-N 3.15Å; R309-H312 VanDerWaalsContact O-N 3.16Å; H312-W315 PolarHBondContact O-N 3.41Å; H312-L316 VanDerWaalsContact O-CG 3.31Å; H312-L316 WeakPolarHBondContact O-CG 3.09Å; H312-L316 PolarHBondContact O-N 2.88Å
313	L	84.6	Confident	83.8	Confident	39 Å²	39	71.9 Å²	71.9	20%	0.204	35%	0.345	C	S	.	.	H	α-helix	trans	-60	-49.4	174.6	-77.7	170.6	0	0	0	111.8	L181 R309 D310 W315 L316 N317 L326 L330	L181-L313 HydrophobicContact CD1-CD2 4.15Å; L181-L313 HydrophobicContact CD1-CG 3.86Å; L181-L313 HydrophobicContact CD2-CD2 3.55Å; L181-L313 HydrophobicContact CD2-CG 4.14Å; L181-L313 HydrophobicContact CG-CD2 4.48Å; R309-L313 HydrophobicContact CG-CD1 4.33Å; R309-L313 PolarHBondContact O-N 3.43Å; D310-L313 PolarHBondContact O-N 3.17Å; L313-W315 VanDerWaalsContact C-N 3.31Å; L313-W315 PolarHBondContact O-N 3.37Å; L313-L316 PolarHBondContact O-N 3.4Å; L313-N317 WeakPolarHBondContact O-CB 3.41Å; L313-N317 PolarHBondContact O-N 3.23Å; L313-L326 HydrophobicContact CD2-CD2 4.43Å; L313-L330 HydrophobicContact CD1-CD2 4.45Å; L313-L330 HydrophobicContact CD2-CD1 3.95Å; L313-L330 HydrophobicContact CD2-CD2 4.17Å; L313-L330 HydrophobicContact CD2-CG 4.28Å
314	V	81.5	Confident	83.5	Confident	46 Å²	46	73.2 Å²	73.2	28%	0.279	35%	0.347	S	S	.	.	H	α-helix	trans	-62.6	-41	178.5	173.3	0	0	0	0	110.7	D310 Q311 N317 H318	D310-V314 WeakPolarHBondContact O-CB 3.34Å; D310-V314 VanDerWaalsContact O-CG2 3.26Å; D310-V314 WeakPolarHBondContact O-CG2 3.35Å; D310-V314 PolarHBondContact O-N 2.62Å; Q311-V314 PolarHBondContact O-N 3.3Å; V314-N317 PolarHBondContact O-N 2.97Å; V314-H318 WeakPolarHBondContact CG1-CE1 3.29Å; V314-H318 WeakPolarHBondContact CG1-ND1 3.27Å; V314-H318 PolarHBondContact O-N 3.06Å; V314-H318 PolarHBondContact O-ND1 3.02Å
315	W	84.2	Confident	83.2	Confident	5 Å²	5	72.1 Å²	72.1	2%	0.019	34%	0.337	C	S	.	.	H	α-helix	trans	-61.1	-48	176.6	-173.3	91	0	0	0	112.3	D166 V169 I174 V177 Q311 H312 L313 N317 H318 K319	D166-W315 VanDerWaalsContact OD1-CD1 3.22Å; D166-W315 PolarHBondContact OD1-NE1 2.94Å; V169-W315 HydrophobicContact CB-CD2 4.44Å; V169-W315 HydrophobicContact CB-CG 4.25Å; V169-W315 HydrophobicContact CG1-CD2 4.17Å; V169-W315 HydrophobicContact CG1-CG 4.45Å; V169-W315 HydrophobicContact CG2-CB 4.16Å; V169-W315 HydrophobicContact CG2-CG 4.02Å; I174-W315 HydrophobicContact CG1-CH2 4.47Å; I174-W315 HydrophobicContact CG1-CZ3 4.39Å; V177-W315 HydrophobicContact CB-CE3 4.11Å; V177-W315 HydrophobicContact CB-CH2 4.42Å; V177-W315 HydrophobicContact CB-CZ3 3.75Å; V177-W315 HydrophobicContact CG1-CD2 4.39Å; V177-W315 HydrophobicContact CG1-CE3 3.62Å; V177-W315 HydrophobicContact CG1-CZ3 3.81Å; V177-W315 HydrophobicContact CG2-CE3 4.19Å; V177-W315 HydrophobicContact CG2-CH2 3.85Å; V177-W315 HydrophobicContact CG2-CZ3 3.67Å; Q311-W315 WeakPolarHBondContact O-CB 3.15Å; Q311-W315 PolarHBondContact O-N 3.43Å; H312-W315 PolarHBondContact O-N 3.41Å; L313-W315 VanDerWaalsContact C-N 3.31Å; L313-W315 PolarHBondContact O-N 3.37Å; W315-N317 VanDerWaalsContact C-N 3.31Å; W315-N317 PolarHBondContact O-N 3.23Å; W315-H318 PolarHBondContact O-N 3.34Å; W315-K319 HydrophobicContact CD2-CG 4.17Å; W315-K319 HydrophobicContact CE3-CG 4.02Å; W315-K319 HydrophobicContact CH2-CD 4.47Å; W315-K319 HydrophobicContact CH2-CG 3.9Å; W315-K319 HydrophobicContact CZ2-CD 4.3Å; W315-K319 HydrophobicContact CZ2-CG 4.02Å; W315-K319 HydrophobicContact CZ3-CG 3.88Å; W315-K319 PolarHBondContact O-N 2.95Å; W315-K319 VanDerWaalsContact O-N 3.09Å
316	L	84.7	Confident	82.9	Confident	0 Å²	0	71.7 Å²	71.7	0%	0	34%	0.335	C	S	.	.	H	α-helix	trans	-64.1	-36.7	178.5	-69.8	164	0	0	0	111.9	I174 V177 L181 H312 L313 K319 G320 V321 L326 W329	I174-L316 HydrophobicContact CG2-CD2 3.99Å; V177-L316 HydrophobicContact CB-CD2 4.15Å; V177-L316 HydrophobicContact CG1-CD1 4.35Å; V177-L316 HydrophobicContact CG1-CD2 3.97Å; V177-L316 HydrophobicContact CG1-CG 4.02Å; L181-L316 HydrophobicContact CB-CD1 4.29Å; L181-L316 HydrophobicContact CD2-CD1 3.55Å; H312-L316 VanDerWaalsContact O-CG 3.31Å; H312-L316 WeakPolarHBondContact O-CG 3.09Å; H312-L316 PolarHBondContact O-N 2.88Å; L313-L316 PolarHBondContact O-N 3.4Å; L316-K319 PolarHBondContact O-N 3.29Å; L316-G320 PolarHBondContact O-N 2.97Å; L316-V321 HydrophobicContact CB-CB 4.35Å; L316-V321 HydrophobicContact CB-CG2 4.13Å; L316-V321 HydrophobicContact CD2-CG2 4.06Å; L316-V321 WeakPolarHBondContact O-CB 3.48Å; L316-V321 VanDerWaalsContact O-CG2 3.27Å; L316-V321 WeakPolarHBondContact O-CG2 3.38Å; L316-V321 PolarHBondContact O-N 3.08Å; L316-V321 VanDerWaalsContact O-N 3.15Å; L316-L326 HydrophobicContact CB-CD2 3.7Å; L316-L326 HydrophobicContact CD1-CD2 3.93Å; L316-L326 HydrophobicContact CG-CD2 4.44Å; L316-W329 HydrophobicContact CD1-CE3 3.98Å; L316-W329 HydrophobicContact CD1-CZ3 3.77Å; L316-W329 HydrophobicContact CD2-CH2 4.32Å; L316-W329 HydrophobicContact CD2-CZ3 3.89Å; L316-W329 HydrophobicContact CG-CZ3 4.38Å
317	N	80.3	Confident	82.8	Confident	99 Å²	99	67 Å²	67	53%	0.529	32%	0.321	S	S	.	.	H	α-helix	trans	-63.8	-43.5	174.9	-165.9	50.7	0	0	0	111.7	L313 V314 W315 K319 G320	L313-N317 WeakPolarHBondContact O-CB 3.41Å; L313-N317 PolarHBondContact O-N 3.23Å; V314-N317 PolarHBondContact O-N 2.97Å; W315-N317 VanDerWaalsContact C-N 3.31Å; W315-N317 PolarHBondContact O-N 3.23Å; N317-K319 VanDerWaalsContact C-N 3.28Å; N317-K319 PolarHBondContact O-N 2.98Å; N317-G320 PolarHBondContact O-N 3.3Å
318	H	79.7	Confident	82.8	Confident	124 Å²	124	64 Å²	64	57%	0.574	32%	0.32	S	S	*	.	H	α-helix	trans	-62.8	-32.1	175	-75.3	105.1	0	0	0	113.3	V314 W315 G320	V314-H318 WeakPolarHBondContact CG1-CE1 3.29Å; V314-H318 WeakPolarHBondContact CG1-ND1 3.27Å; V314-H318 PolarHBondContact O-N 3.06Å; V314-H318 PolarHBondContact O-ND1 3.02Å; W315-H318 PolarHBondContact O-N 3.34Å; H318-G320 PolarHBondContact O-N 3.48Å
319	K	80.4	Confident	82.8	Confident	102 Å²	102	63.8 Å²	63.8	44%	0.443	32%	0.317	S	S	.	.	T	Hydrogen-bonded Turn	trans	-76.6	3	173.6	-64.2	-64.7	-175.6	-177.4	0	113.6	I174 W315 L316 N317	I174-K319 HydrophobicContact CD1-CB 4.22Å; I174-K319 HydrophobicContact CG1-CB 4.39Å; W315-K319 HydrophobicContact CD2-CG 4.17Å; W315-K319 HydrophobicContact CE3-CG 4.02Å; W315-K319 HydrophobicContact CH2-CD 4.47Å; W315-K319 HydrophobicContact CH2-CG 3.9Å; W315-K319 HydrophobicContact CZ2-CD 4.3Å; W315-K319 HydrophobicContact CZ2-CG 4.02Å; W315-K319 HydrophobicContact CZ3-CG 3.88Å; W315-K319 PolarHBondContact O-N 2.95Å; W315-K319 VanDerWaalsContact O-N 3.09Å; L316-K319 PolarHBondContact O-N 3.29Å; N317-K319 VanDerWaalsContact C-N 3.28Å; N317-K319 PolarHBondContact O-N 2.98Å
320	G	77.7	Confident	82.7	Confident	61 Å²	61	63.1 Å²	63.1	63%	0.629	32%	0.316	S	S	*	.	T	Hydrogen-bonded Turn	trans	77.5	23.3	175.7	0	0	0	0	0	114.3	L316 N317 H318 R322	L316-G320 PolarHBondContact O-N 2.97Å; N317-G320 PolarHBondContact O-N 3.3Å; H318-G320 PolarHBondContact O-N 3.48Å; G320-R322 PolarHBondContact O-N 3.45Å
321	V	85.5	Confident	82.4	Confident	12 Å²	12	63.2 Å²	63.2	7%	0.073	33%	0.329	C	S	.	.			trans	-66.4	129	176.5	179.9	0	0	0	0	110	I174 L316 R325 L326 W329	I174-V321 HydrophobicContact CG2-CG2 3.49Å; I174-V321 VanDerWaalsContact CG2-CG2 3.49Å; L316-V321 HydrophobicContact CB-CB 4.35Å; L316-V321 HydrophobicContact CB-CG2 4.13Å; L316-V321 HydrophobicContact CD2-CG2 4.06Å; L316-V321 WeakPolarHBondContact O-CB 3.48Å; L316-V321 VanDerWaalsContact O-CG2 3.27Å; L316-V321 WeakPolarHBondContact O-CG2 3.38Å; L316-V321 PolarHBondContact O-N 3.08Å; L316-V321 VanDerWaalsContact O-N 3.15Å; V321-R325 HydrophobicContact CG1-CB 3.99Å; V321-R325 HydrophobicContact CG1-CG 4.12Å; V321-L326 HydrophobicContact CB-CD2 4.38Å; V321-L326 HydrophobicContact CG1-CD2 4.02Å; V321-L326 HydrophobicContact CG1-CG 4.09Å; V321-W329 HydrophobicContact CG1-CH2 4.36Å; V321-W329 HydrophobicContact CG1-CZ3 3.91Å
322	R	80.3	Confident	81.8	Confident	210 Å²	210	65.6 Å²	65.6	79%	0.792	34%	0.342	S	S	*	.			trans	-63.1	143.9	179.4	-65	-176.6	-173.3	167.9	2.4	111.9	G320 K324 R325 L326	G320-R322 PolarHBondContact O-N 3.45Å; R322-K324 VanDerWaalsContact C-N 3.29Å; R322-K324 PolarHBondContact O-N 3.46Å; R322-R325 WeakPolarHBondContact O-CB 3.34Å; R322-R325 PolarHBondContact O-N 3.39Å; R322-L326 PolarHBondContact O-N 3.02Å
323	Q	79.8	Confident	80.6	Confident	113 Å²	113	73.6 Å²	73.6	53%	0.528	38%	0.377	S	S	.	.	H	α-helix	trans	-54.4	-38.7	179.9	-167.2	63	38	0	0	114	R325 L326 N327	Q323-R325 VanDerWaalsContact C-N 3.25Å; Q323-R325 PolarHBondContact O-N 3.5Å; Q323-L326 PolarHBondContact O-N 3.02Å; Q323-N327 PolarHBondContact NE2-OD1 3.41Å; Q323-N327 VanDerWaalsContact O-CG 3.25Å; Q323-N327 PolarHBondContact O-N 3.03Å; Q323-N327 PolarHBondContact O-OD1 2.93Å
324	K	80.5	Confident	78.8	Confident	147 Å²	147	77.7 Å²	77.7	64%	0.639	40%	0.399	S	S	*	.	H	α-helix	trans	-56.4	-39.9	177.1	-170.2	-173.6	179.1	-166.1	0	111.9	R322 A328 E348	R322-K324 VanDerWaalsContact C-N 3.29Å; R322-K324 PolarHBondContact O-N 3.46Å; K324-A328 PolarHBondContact O-N 3.26Å; K324-E348 IonicContact NZ-OE1 3.62Å; K324-E348 PolarHBondContact NZ-OE1 2.91Å
325	R	80.7	Confident	77	Confident	95 Å²	95	84.4 Å²	84.4	36%	0.358	43%	0.428	S	S	.	.	H	α-helix	trans	-74.7	-36.3	-179.7	-171.9	170.2	171.1	-170.8	-1.3	111.9	D175 V321 R322 Q323 A328 W329	D175-R325 IonicContact OD1-CZ 3.2Å; D175-R325 IonicContact OD1-NH2 3.59Å; D175-R325 PolarHBondContact OD1-NH2 3.36Å; D175-R325 IonicContact OD2-NH2 3.15Å; D175-R325 PolarHBondContact OD2-NH2 3.19Å; V321-R325 HydrophobicContact CG1-CB 3.99Å; V321-R325 HydrophobicContact CG1-CG 4.12Å; R322-R325 WeakPolarHBondContact O-CB 3.34Å; R322-R325 PolarHBondContact O-N 3.39Å; Q323-R325 VanDerWaalsContact C-N 3.25Å; Q323-R325 PolarHBondContact O-N 3.5Å; R325-A328 PolarHBondContact O-N 3.19Å; R325-W329 HydrophobicContact CG-CD2 4.47Å; R325-W329 HydrophobicContact CG-CE3 4.4Å; R325-W329 HydrophobicContact CG-CH2 3.93Å; R325-W329 HydrophobicContact CG-CZ2 3.98Å; R325-W329 HydrophobicContact CG-CZ3 4.13Å; R325-W329 VanDerWaalsContact NE-CH2 3.35Å; R325-W329 VanDerWaalsContact NE-CZ2 3.34Å; R325-W329 PolarHBondContact O-N 2.99Å
326	L	84.3	Confident	75	Confident	6 Å²	6	92.2 Å²	92.2	3%	0.031	47%	0.47	C	S	.	.	H	α-helix	trans	-62.6	-45.8	170.7	-65.1	176.1	0	0	0	111.5	L313 L316 V321 R322 Q323 A328 W329 L330	L313-L326 HydrophobicContact CD2-CD2 4.43Å; L316-L326 HydrophobicContact CB-CD2 3.7Å; L316-L326 HydrophobicContact CD1-CD2 3.93Å; L316-L326 HydrophobicContact CG-CD2 4.44Å; V321-L326 HydrophobicContact CB-CD2 4.38Å; V321-L326 HydrophobicContact CG1-CD2 4.02Å; V321-L326 HydrophobicContact CG1-CG 4.09Å; R322-L326 PolarHBondContact O-N 3.02Å; Q323-L326 PolarHBondContact O-N 3.02Å; L326-A328 VanDerWaalsContact C-N 3.3Å; L326-A328 PolarHBondContact O-N 2.95Å; L326-W329 HydrophobicContact CD2-CE3 4.17Å; L326-W329 HydrophobicContact CD2-CZ3 4.26Å; L326-W329 PolarHBondContact O-N 3.3Å; L326-L330 WeakPolarHBondContact O-CG 3.47Å; L326-L330 PolarHBondContact O-N 3.08Å
327	N	83.9	Confident	73	Confident	39 Å²	39	95.9 Å²	95.9	21%	0.209	50%	0.5	C	S	.	.	H	α-helix	trans	-61.5	-38.8	178.1	-68.3	0	0	0	0	111.8	Q323 L330 G331 I332	Q323-N327 PolarHBondContact NE2-OD1 3.41Å; Q323-N327 VanDerWaalsContact O-CG 3.25Å; Q323-N327 PolarHBondContact O-N 3.03Å; Q323-N327 PolarHBondContact O-OD1 2.93Å; N327-L330 CarbonylContact O-C 3.36Å; N327-L330 PolarHBondContact O-N 2.98Å; N327-G331 PolarHBondContact O-N 3.19Å; N327-I332 HydrophobicContact CB-CB 4.33Å; N327-I332 PolarHBondContact O-N 2.58Å
328	A	85.7	Confident	70.9	Confident	68 Å²	68	98.7 Å²	98.7	56%	0.562	52%	0.515	S	S	*	.	H	α-helix	trans	-61	-45.9	175	0	0	0	0	0	112.3	K324 R325 L326 L330 G331	K324-A328 PolarHBondContact O-N 3.26Å; R325-A328 PolarHBondContact O-N 3.19Å; L326-A328 VanDerWaalsContact C-N 3.3Å; L326-A328 PolarHBondContact O-N 2.95Å; A328-L330 VanDerWaalsContact C-N 3.32Å; A328-L330 PolarHBondContact O-N 3.28Å; A328-G331 PolarHBondContact O-N 3.43Å; A328-G331 VanDerWaalsContact O-N 3.08Å
329	W	85.3	Confident	69.1	Low	33 Å²	33	102.2 Å²	102.2	13%	0.125	53%	0.532	C	S	.	.	H	α-helix	trans	-67.8	-29.9	175.9	-69	-38.2	0	0	0	113.6	I174 L181 L316 V321 R325 L326 G331	I174-W329 HydrophobicContact CG2-CH2 4.11Å; L181-W329 HydrophobicContact CD2-CB 4.4Å; L316-W329 HydrophobicContact CD1-CE3 3.98Å; L316-W329 HydrophobicContact CD1-CZ3 3.77Å; L316-W329 HydrophobicContact CD2-CH2 4.32Å; L316-W329 HydrophobicContact CD2-CZ3 3.89Å; L316-W329 HydrophobicContact CG-CZ3 4.38Å; V321-W329 HydrophobicContact CG1-CH2 4.36Å; V321-W329 HydrophobicContact CG1-CZ3 3.91Å; R325-W329 HydrophobicContact CG-CD2 4.47Å; R325-W329 HydrophobicContact CG-CE3 4.4Å; R325-W329 HydrophobicContact CG-CH2 3.93Å; R325-W329 HydrophobicContact CG-CZ2 3.98Å; R325-W329 HydrophobicContact CG-CZ3 4.13Å; R325-W329 VanDerWaalsContact NE-CH2 3.35Å; R325-W329 VanDerWaalsContact NE-CZ2 3.34Å; R325-W329 PolarHBondContact O-N 2.99Å; L326-W329 HydrophobicContact CD2-CE3 4.17Å; L326-W329 HydrophobicContact CD2-CZ3 4.26Å; L326-W329 PolarHBondContact O-N 3.3Å; W329-G331 PolarHBondContact O-N 3.2Å
330	L	84.9	Confident	67.2	Low	20 Å²	20	104 Å²	104	11%	0.105	55%	0.546	C	S	.	.	T	Hydrogen-bonded Turn	trans	-79	-4.9	172.7	-66.2	175	0	0	0	113	L181 H185 L313 L326 N327 A328 I332	L181-L330 HydrophobicContact CD1-CD2 4.42Å; H185-L330 HydrophobicContact CB-CD2 4.25Å; H185-L330 PolarHBondContact CD2-O 3.19Å; H185-L330 PolarHBondContact NE2-O 3.06Å; L313-L330 HydrophobicContact CD1-CD2 4.45Å; L313-L330 HydrophobicContact CD2-CD1 3.95Å; L313-L330 HydrophobicContact CD2-CD2 4.17Å; L313-L330 HydrophobicContact CD2-CG 4.28Å; L326-L330 WeakPolarHBondContact O-CG 3.47Å; L326-L330 PolarHBondContact O-N 3.08Å; N327-L330 CarbonylContact O-C 3.36Å; N327-L330 PolarHBondContact O-N 2.98Å; A328-L330 VanDerWaalsContact C-N 3.32Å; A328-L330 PolarHBondContact O-N 3.28Å; L330-I332 HydrophobicContact CB-CD1 4.01Å; L330-I332 HydrophobicContact CB-CG1 3.94Å; L330-I332 HydrophobicContact CD1-CD1 4.05Å; L330-I332 PolarHBondContact O-N 2.99Å
331	G	79	Confident	65.4	Low	55 Å²	55	110.1 Å²	110.1	57%	0.567	55%	0.552	S	S	*	*	T	Hydrogen-bonded Turn	trans	64.9	18.9	-177.5	0	0	0	0	0	113.9	N327 A328 W329 K333	N327-G331 PolarHBondContact O-N 3.19Å; A328-G331 PolarHBondContact O-N 3.43Å; A328-G331 VanDerWaalsContact O-N 3.08Å; W329-G331 PolarHBondContact O-N 3.2Å; G331-K333 VanDerWaalsContact C-N 3.29Å; G331-K333 PolarHBondContact O-N 2.94Å
332	I	71.3	Confident	63.1	Low	91 Å²	91	119.2 Å²	119.2	47%	0.467	59%	0.591	S	S	.	*			trans	-76.3	88.5	173.5	-55.9	171.4	0	0	0	106.5	N327 L330	N327-I332 HydrophobicContact CB-CB 4.33Å; N327-I332 PolarHBondContact O-N 2.58Å; L330-I332 HydrophobicContact CB-CD1 4.01Å; L330-I332 HydrophobicContact CB-CG1 3.94Å; L330-I332 HydrophobicContact CD1-CD1 4.05Å; L330-I332 PolarHBondContact O-N 2.99Å
333	K	57.9	Low	61.2	Low	180 Å²	180	114 Å²	114	78%	0.783	58%	0.577	S	S	*	*			trans	-74.5	126.3	166.5	-64.4	-175.6	178.9	-175.9	0	106.7	G331 E335	G331-K333 VanDerWaalsContact C-N 3.29Å; G331-K333 PolarHBondContact O-N 2.94Å; K333-E335 VanDerWaalsContact C-N 3.31Å; K333-E335 PolarHBondContact O-N 3.2Å
334	N	46.4	Very low	59.4	Low	125 Å²	125	114.3 Å²	114.3	67%	0.668	58%	0.583	S	S	*	*			trans	-64.9	99.4	165.3	-81.1	-5.8	0	0	0	106.5	D336 A337	N334-D336 PolarHBondContact O-N 3.44Å; N334-A337 PolarHBondContact O-N 2.77Å
335	E	44.8	Very low	57.6	Low	188 Å²	188	116.6 Å²	116.6	88%	0.879	60%	0.595	S	S	*	*	T	Hydrogen-bonded Turn	trans	-65.7	-11.9	178.3	-69.8	-177.7	161.8	0	0	112.2	K333	K333-E335 VanDerWaalsContact C-N 3.31Å; K333-E335 PolarHBondContact O-N 3.2Å
336	D	41.5	Very low	56	Low	169 Å²	169	120.3 Å²	120.3	90%	0.904	62%	0.617	S	S	*	*	T	Hydrogen-bonded Turn	trans	-90.6	7.9	-179.8	-64.1	-43.5	0	0	0	115.2	N334	N334-D336 PolarHBondContact O-N 3.44Å
337	A	42.4	Very low	54.3	Low	77 Å²	77	122.1 Å²	122.1	64%	0.636	63%	0.627	S	S	*	*	S	Bend	trans	-102.9	92	170.8	0	0	0	0	0	109.2	N334	N334-A337 PolarHBondContact O-N 2.77Å
338	D	36.8	Very low	52.8	Low	157 Å²	157	126 Å²	126	84%	0.84	64%	0.644	S	S	*	*			trans	-11.1	128.1	171.9	-96.7	-30.5	0	0	0	116.2	N340	D338-N340 PolarHBondContact O-N 2.74Å
339	E	43.2	Very low	51.4	Low	198 Å²	198	130.3 Å²	130.3	93%	0.925	66%	0.657	S	S	*	*	T	Hydrogen-bonded Turn	trans	-60.5	45.3	176.6	-63.2	-176.7	133.2	0	0	115.3
340	N	38.7	Very low	50.7	Low	141 Å²	141	130.6 Å²	130.6	75%	0.754	66%	0.661	S	S	*	*	T	Hydrogen-bonded Turn	trans	-140.1	15.2	-177	-117.5	-4.4	0	0	0	118.7	D338	D338-N340 PolarHBondContact O-N 2.74Å
341	Y	39.7	Very low	50.3	Low	188 Å²	188	132.2 Å²	132.2	74%	0.737	67%	0.673	S	S	*	*			trans	-136	95.1	167.5	-92.9	-94.1	0	0	0	111.4	I343	Y341-I343 VanDerWaalsContact C-N 3.26Å; Y341-I343 HydrophobicContact CD1-CG1 4.45Å; Y341-I343 PolarHBondContact O-N 2.93Å
342	F	38.6	Very low	50.5	Low	204 Å²	204	129.9 Å²	129.9	90%	0.895	65%	0.647	S	S	*	*			trans	-63.1	89.7	156.5	-76.2	-91.5	0	0	0	108.4
343	I	39.5	Very low	51	Low	100 Å²	100	130.2 Å²	130.2	51%	0.513	64%	0.643	S	S	.	*			trans	-86.2	105.3	164	-60.3	-164.4	0	0	0	106.8	Y341 D347	Y341-I343 VanDerWaalsContact C-N 3.26Å; Y341-I343 HydrophobicContact CD1-CG1 4.45Å; Y341-I343 PolarHBondContact O-N 2.93Å; I343-D347 HydrophobicContact CG2-CB 3.72Å
344	N	42.1	Very low	52.2	Low	120 Å²	120	125.4 Å²	125.4	64%	0.642	63%	0.626	S	S	*	*			trans	-61.5	141.8	170.1	-70.4	-36.7	0	0	0	109.3	E346 D347	N344-E346 PolarHBondContact O-N 2.56Å; N344-D347 PolarHBondContact O-N 2.8Å; N344-D347 VanDerWaalsContact O-N 3.1Å
345	E	43.9	Very low	54	Low	194 Å²	194	124.1 Å²	124.1	91%	0.907	62%	0.616	S	S	*	*	T	Hydrogen-bonded Turn	trans	-56.7	-6.2	-177.2	-64.8	179.2	161.1	0	0	115
346	E	46.4	Very low	55.9	Low	174 Å²	174	123.1 Å²	123.1	81%	0.813	61%	0.609	S	S	*	*	T	Hydrogen-bonded Turn	trans	-76.2	-19.1	174.4	-66	-175.1	165	0	0	113.6	N344	N344-E346 PolarHBondContact O-N 2.56Å
347	D	48.2	Very low	58	Low	44 Å²	44	115.9 Å²	115.9	24%	0.235	57%	0.57	C	S	.	*	G	3₁₀ helix	trans	-81.4	-14.8	-176.7	-114.9	15.5	0	0	0	113.6	I343 N344 N349 L350 Y353 Q434	I343-D347 HydrophobicContact CG2-CB 3.72Å; N344-D347 PolarHBondContact O-N 2.8Å; N344-D347 VanDerWaalsContact O-N 3.1Å; D347-N349 VanDerWaalsContact C-N 3.31Å; D347-N349 PolarHBondContact O-N 3.35Å; D347-L350 HydrophobicContact CB-CD1 4.11Å; D347-L350 VanDerWaalsContact CG-CD1 3.47Å; D347-L350 WeakPolarHBondContact O-CD1 3.5Å; D347-L350 WeakPolarHBondContact O-CG 3.32Å; D347-L350 WeakPolarHBondContact OD1-CD1 3.32Å; D347-Y353 VanDerWaalsContact O-CE2 3.27Å; D347-Y353 WeakPolarHBondContact O-CE2 3.27Å; D347-Q434 PolarHBondContact OD2-NE2 3.1Å; D347-Q434 VanDerWaalsContact OD2-NE2 3.11Å
348	E	53.6	Low	60.3	Low	120 Å²	120	112.3 Å²	112.3	56%	0.561	54%	0.541	S	S	*	.	G	3₁₀ helix	trans	-78.1	-9.1	-177.5	-75.9	-162.6	156	0	0	114.2	K324	K324-E348 IonicContact NZ-OE1 3.62Å; K324-E348 PolarHBondContact NZ-OE1 2.91Å
349	N	56.4	Low	62.9	Low	159 Å²	159	106.6 Å²	106.6	85%	0.85	51%	0.508	S	S	*	.	G	3₁₀ helix	trans	-112.6	20.9	175.5	-85.3	-20.2	0	0	0	113.6	D347	D347-N349 VanDerWaalsContact C-N 3.31Å; D347-N349 PolarHBondContact O-N 3.35Å
350	L	70.4	Confident	65.1	Low	38 Å²	38	98.4 Å²	98.4	20%	0.199	47%	0.472	C	S	.	.			trans	-62.2	134.4	176.8	-79.2	163.8	0	0	0	111.4	D347 H352 Y353 Q433	D347-L350 HydrophobicContact CB-CD1 4.11Å; D347-L350 VanDerWaalsContact CG-CD1 3.47Å; D347-L350 WeakPolarHBondContact O-CD1 3.5Å; D347-L350 WeakPolarHBondContact O-CG 3.32Å; D347-L350 WeakPolarHBondContact OD1-CD1 3.32Å; L350-H352 HydrophobicContact CB-CB 4.43Å; L350-H352 PolarHBondContact O-N 3.17Å; L350-Y353 HydrophobicContact CB-CD2 3.93Å; L350-Y353 HydrophobicContact CB-CE2 4.15Å; L350-Y353 HydrophobicContact CD1-CE2 4.43Å; L350-Y353 PolarHBondContact O-N 3.07Å; L350-Y353 VanDerWaalsContact O-N 3.08Å; L350-Q433 VanDerWaalsContact CD1-OE1 3.25Å
351	P	75.7	Confident	66.9	Low	54 Å²	54	97.3 Å²	97.3	35%	0.351	46%	0.462	S	S	.	.	G	3₁₀ helix	trans	-54.8	-27.6	175.8	-26.2	34.3	0	0	0	113.3	Y353 D354 T357 P451 A454	P351-Y353 PolarHBondContact O-N 3.38Å; P351-Y353 VanDerWaalsContact O-N 3.09Å; P351-D354 PolarHBondContact O-N 3.1Å; P351-D354 VanDerWaalsContact O-N 3.07Å; P351-T357 PolarHBondContact O-OG1 3.43Å; P351-P451 HydrophobicContact CB-CG 4.11Å; P351-A454 HydrophobicContact CB-CB 3.55Å; P351-A454 HydrophobicContact CG-CB 3.91Å
352	H	83.4	Confident	68.8	Low	6 Å²	6	95.4 Å²	95.4	3%	0.028	47%	0.465	C	S	.	.	G	3₁₀ helix	trans	-56	-22.8	176.7	-54.2	89.8	0	0	0	114.9	L350 D354 W358 F380 V429 L430 Q433 L448 A449 P451	L350-H352 HydrophobicContact CB-CB 4.43Å; L350-H352 PolarHBondContact O-N 3.17Å; H352-D354 VanDerWaalsContact C-N 3.33Å; H352-W358 PolarHBondContact O-NE1 2.77Å; H352-F380 AromaticContact CD2-CE1 3.74Å; H352-F380 AromaticContact CD2-CZ 3.83Å; H352-F380 AromaticContact NE2-CE1 3.76Å; H352-V429 HydrophobicContact CB-CG1 4.28Å; H352-L430 HydrophobicContact CB-CD2 3.91Å; H352-Q433 VanDerWaalsContact CG-OE1 3.23Å; H352-Q433 PolarHBondContact ND1-OE1 2.77Å; H352-L448 PolarHBondContact NE2-O 2.72Å; H352-A449 PolarHBondContact CE1-O 3.49Å; H352-A449 PolarHBondContact NE2-O 2.97Å; H352-P451 WeakPolarHBondContact NE2-CD 3.43Å
353	Y	81	Confident	71.1	Confident	98 Å²	98	87 Å²	87	38%	0.384	43%	0.429	S	S	.	.	G	3₁₀ helix	trans	-72.1	-24.9	176.8	-80.6	-84.8	0	0	0	113.7	D347 L350 P351 K426 L430	D347-Y353 VanDerWaalsContact O-CE2 3.27Å; D347-Y353 WeakPolarHBondContact O-CE2 3.27Å; L350-Y353 HydrophobicContact CB-CD2 3.93Å; L350-Y353 HydrophobicContact CB-CE2 4.15Å; L350-Y353 HydrophobicContact CD1-CE2 4.43Å; L350-Y353 PolarHBondContact O-N 3.07Å; L350-Y353 VanDerWaalsContact O-N 3.08Å; P351-Y353 PolarHBondContact O-N 3.38Å; P351-Y353 VanDerWaalsContact O-N 3.09Å; Y353-K426 VanDerWaalsContact O-CE 3.32Å; Y353-K426 WeakPolarHBondContact O-CE 3.37Å; Y353-K426 PolarHBondContact O-NZ 3.35Å; Y353-L430 HydrophobicContact CD1-CD1 4.25Å; Y353-L430 HydrophobicContact CD1-CD2 4.47Å; Y353-L430 HydrophobicContact CD2-CD2 4.18Å; Y353-L430 HydrophobicContact CE1-CD1 3.92Å; Y353-L430 HydrophobicContact CE1-CD2 4.31Å; Y353-L430 HydrophobicContact CE2-CD2 3.98Å; Y353-L430 HydrophobicContact CG-CD2 4.41Å
354	D	83.8	Confident	73.4	Confident	80 Å²	80	86.1 Å²	86.1	43%	0.428	43%	0.425	S	S	.	.	S	Bend	trans	-93.1	110.8	176.1	-177.8	5	0	0	0	109.5	P351 H352 K356 T357 W358	P351-D354 PolarHBondContact O-N 3.1Å; P351-D354 VanDerWaalsContact O-N 3.07Å; H352-D354 VanDerWaalsContact C-N 3.33Å; D354-K356 PolarHBondContact O-N 3.46Å; D354-K356 VanDerWaalsContact O-N 3.14Å; D354-K356 WeakPolarHBondContact OD1-CB 3.35Å; D354-K356 PolarHBondContact OD1-N 3.04Å; D354-T357 HydrophobicContact CB-CG2 3.79Å; D354-T357 WeakPolarHBondContact O-CB 3.37Å; D354-T357 PolarHBondContact O-N 2.84Å; D354-T357 PolarHBondContact O-OG1 2.94Å; D354-W358 PolarHBondContact O-NE1 2.97Å
355	E	84.9	Confident	75.6	Confident	98 Å²	98	87.4 Å²	87.4	46%	0.458	42%	0.421	S	S	.	.	G	3₁₀ helix	trans	-56.7	-30.1	-179.6	-65.6	177.4	-179.5	0	0	111.8	T357 W358 F359 K426	E355-T357 PolarHBondContact O-N 3.39Å; E355-T357 VanDerWaalsContact O-N 3.11Å; E355-W358 HydrophobicContact CB-CZ2 4.18Å; E355-W358 HydrophobicContact CG-CH2 4.21Å; E355-W358 HydrophobicContact CG-CZ2 3.76Å; E355-W358 PolarHBondContact O-N 3.11Å; E355-F359 WeakPolarHBondContact O-CA 3.47Å; E355-F359 WeakPolarHBondContact O-CB 3.42Å; E355-F359 PolarHBondContact O-N 2.82Å; E355-K426 HydrophobicContact CG-CD 4.35Å
356	K	84.3	Confident	77.7	Confident	167 Å²	167	82.2 Å²	82.2	73%	0.726	40%	0.402	S	S	*	.	G	3₁₀ helix	trans	-66.2	-15	178.4	-60.9	-180	-179.9	-179.7	0	113.4	D354 H453	D354-K356 PolarHBondContact O-N 3.46Å; D354-K356 VanDerWaalsContact O-N 3.14Å; D354-K356 WeakPolarHBondContact OD1-CB 3.35Å; D354-K356 PolarHBondContact OD1-N 3.04Å; K356-H453 PolarHBondContact O-CD2 3.17Å
357	T	85.6	Confident	79.7	Confident	16 Å²	16	78 Å²	78	10%	0.098	38%	0.383	C	S	.	.	G	3₁₀ helix	trans	-82.7	-23.1	-178	66.9	0	0	0	0	113.1	P351 D354 E355 P451 V452 H453	P351-T357 PolarHBondContact O-OG1 3.43Å; D354-T357 HydrophobicContact CB-CG2 3.79Å; D354-T357 WeakPolarHBondContact O-CB 3.37Å; D354-T357 PolarHBondContact O-N 2.84Å; D354-T357 PolarHBondContact O-OG1 2.94Å; E355-T357 PolarHBondContact O-N 3.39Å; E355-T357 VanDerWaalsContact O-N 3.11Å; T357-P451 CarbonylContact O-C 3.6Å; T357-P451 VanDerWaalsContact O-CB 3.22Å; T357-P451 WeakPolarHBondContact O-CB 3.43Å; T357-P451 WeakPolarHBondContact OG1-CB 3.3Å; T357-V452 PolarHBondContact O-N 3.3Å; T357-H453 PolarHBondContact O-N 3.38Å
358	W	91.1	Very high	81.7	Confident	3 Å²	3	75.9 Å²	75.9	1%	0.011	37%	0.371	C	S	.	.	T	Hydrogen-bonded Turn	trans	-132.5	-20.8	-176.4	49	-95.1	0	0	0	114.3	H352 D354 E355 F380 L381 I382 L425 K426 V429 P451	H352-W358 PolarHBondContact O-NE1 2.77Å; D354-W358 PolarHBondContact O-NE1 2.97Å; E355-W358 HydrophobicContact CB-CZ2 4.18Å; E355-W358 HydrophobicContact CG-CH2 4.21Å; E355-W358 HydrophobicContact CG-CZ2 3.76Å; E355-W358 PolarHBondContact O-N 3.11Å; W358-F380 HydrophobicContact CB-CD2 4.28Å; W358-F380 HydrophobicContact CB-CE2 3.47Å; W358-F380 VanDerWaalsContact CB-CE2 3.47Å; W358-F380 HydrophobicContact CB-CZ 3.62Å; W358-F380 HydrophobicContact CD2-CE2 4.38Å; W358-F380 AromaticContact CG-CE2 3.92Å; W358-F380 HydrophobicContact CG-CE2 3.92Å; W358-F380 AromaticContact CG-CZ 3.94Å; W358-F380 HydrophobicContact CG-CZ 3.94Å; W358-L381 CarbonylContact O-C 3.58Å; W358-L381 WeakPolarHBondContact O-CA 3.33Å; W358-L381 WeakPolarHBondContact O-CB 3.09Å; W358-I382 HydrophobicContact CE3-CB 4.03Å; W358-I382 HydrophobicContact CE3-CD1 3.86Å; W358-I382 HydrophobicContact CE3-CG1 4.09Å; W358-I382 HydrophobicContact CZ3-CB 4.2Å; W358-I382 HydrophobicContact CZ3-CD1 3.77Å; W358-I382 HydrophobicContact CZ3-CG1 4.35Å; W358-I382 PolarHBondContact O-N 3.03Å; W358-L425 HydrophobicContact CH2-CB 3.98Å; W358-L425 HydrophobicContact CZ3-CB 4.19Å; W358-K426 HydrophobicContact CH2-CB 4.32Å; W358-K426 HydrophobicContact CZ2-CB 4Å; W358-K426 HydrophobicContact CZ2-CG 4.41Å; W358-V429 HydrophobicContact CD2-CG1 4.35Å; W358-V429 HydrophobicContact CD2-CG2 4.01Å; W358-V429 HydrophobicContact CE3-CG2 3.88Å; W358-V429 HydrophobicContact CG-CG1 4.46Å; W358-V429 HydrophobicContact CH2-CG2 4.04Å; W358-V429 HydrophobicContact CZ2-CB 4.34Å; W358-V429 HydrophobicContact CZ2-CG2 4.14Å; W358-V429 HydrophobicContact CZ3-CG2 3.9Å; W358-P451 HydrophobicContact CB-CB 3.91Å
359	F	91.2	Very high	83.5	Confident	37 Å²	37	73.1 Å²	73.1	16%	0.162	36%	0.358	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-92.8	125.7	-179.4	-170.3	-119.4	0	0	0	111.3	E355 E361 I382 Y391 L425	E355-F359 WeakPolarHBondContact O-CA 3.47Å; E355-F359 WeakPolarHBondContact O-CB 3.42Å; E355-F359 PolarHBondContact O-N 2.82Å; F359-E361 HydrophobicContact CD1-CG 3.92Å; F359-E361 HydrophobicContact CE1-CG 3.25Å; F359-E361 WeakPolarHBondContact CE1-OE1 3.37Å; F359-E361 HydrophobicContact CZ-CG 3.79Å; F359-I382 CarbonylContact C-O 3.58Å; F359-I382 WeakPolarHBondContact CA-O 3.42Å; F359-I382 HydrophobicContact CD2-CB 4.14Å; F359-I382 HydrophobicContact CD2-CG2 3.97Å; F359-I382 WeakPolarHBondContact CD2-O 3.42Å; F359-I382 HydrophobicContact CE2-CG2 4.17Å; F359-Y391 AromaticContact CE2-CD1 3.84Å; F359-Y391 HydrophobicContact CE2-CD1 3.84Å; F359-Y391 AromaticContact CE2-CE1 3.77Å; F359-Y391 HydrophobicContact CE2-CE1 3.77Å; F359-Y391 HydrophobicContact CZ-CD1 4.31Å; F359-Y391 AromaticContact CZ-CE1 3.79Å; F359-Y391 HydrophobicContact CZ-CE1 3.79Å; F359-L425 HydrophobicContact CD2-CD1 4.41Å; F359-L425 HydrophobicContact CE2-CD1 4Å
360	V	88.3	Confident	85.2	Confident	25 Å²	25	70.9 Å²	70.9	15%	0.152	35%	0.347	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-133.7	102.9	-177.4	-167.2	0	0	0	0	109.2	I363 L381 I382 R383 V452	V360-I363 HydrophobicContact CB-CD1 3.73Å; V360-I363 HydrophobicContact CB-CG1 3.94Å; V360-I363 HydrophobicContact CG1-CB 4.28Å; V360-I363 HydrophobicContact CG1-CD1 3.73Å; V360-I363 HydrophobicContact CG1-CG1 3.73Å; V360-I363 HydrophobicContact CG1-CG2 3.61Å; V360-I363 HydrophobicContact CG2-CD1 4.32Å; V360-L381 HydrophobicContact CG2-CB 4.41Å; V360-I382 PolarHBondContact N-O 3.1Å; V360-R383 VanDerWaalsContact O-CA 3.23Å; V360-R383 WeakPolarHBondContact O-CA 3.4Å; V360-R383 VanDerWaalsContact O-CB 3.31Å; V360-R383 WeakPolarHBondContact O-CB 3.35Å; V360-V452 HydrophobicContact CG2-CG1 4.28Å
361	E	77.9	Confident	86	Confident	118 Å²	118	72.4 Å²	72.4	55%	0.551	35%	0.354	S	S	*	.	T	Hydrogen-bonded Turn	trans	-66	-47.2	-170.8	-68.9	176.1	173.1	0	0	113	F359 I363	F359-E361 HydrophobicContact CD1-CG 3.92Å; F359-E361 HydrophobicContact CE1-CG 3.25Å; F359-E361 WeakPolarHBondContact CE1-OE1 3.37Å; F359-E361 HydrophobicContact CZ-CG 3.79Å; E361-I363 PolarHBondContact O-N 3.17Å
362	D	78.1	Confident	86.7	Confident	148 Å²	148	69.9 Å²	69.9	79%	0.791	34%	0.338	S	S	*	.	T	Hydrogen-bonded Turn	trans	-106.4	52.5	-167.8	-73.5	-33	0	0	0	114.2
363	I	86.9	Confident	86.9	Confident	27 Å²	27	79 Å²	79	14%	0.138	37%	0.373	C	S	.	.			trans	-129.4	142.1	174.4	60.8	167.4	0	0	0	113.8	V360 E361 Q367 A368 L371 L381 R383	V360-I363 HydrophobicContact CB-CD1 3.73Å; V360-I363 HydrophobicContact CB-CG1 3.94Å; V360-I363 HydrophobicContact CG1-CB 4.28Å; V360-I363 HydrophobicContact CG1-CD1 3.73Å; V360-I363 HydrophobicContact CG1-CG1 3.73Å; V360-I363 HydrophobicContact CG1-CG2 3.61Å; V360-I363 HydrophobicContact CG2-CD1 4.32Å; E361-I363 PolarHBondContact O-N 3.17Å; I363-Q367 HydrophobicContact CB-CB 4.16Å; I363-Q367 HydrophobicContact CG2-CB 4.43Å; I363-A368 HydrophobicContact CD1-CB 4.08Å; I363-L371 HydrophobicContact CD1-CD1 4.12Å; I363-L381 HydrophobicContact CD1-CD1 3.62Å; I363-L381 HydrophobicContact CD1-CD2 3.8Å; I363-L381 HydrophobicContact CD1-CG 4.36Å; I363-R383 HydrophobicContact CD1-CB 4.12Å; I363-R383 HydrophobicContact CG1-CB 3.63Å; I363-R383 HydrophobicContact CG1-CG 4.39Å; I363-R383 WeakPolarHBondContact O-CD 3.39Å
364	N	87.4	Confident	87	Confident	82 Å²	82	78 Å²	78	44%	0.439	39%	0.393	S	S	.	.			trans	-89.6	173.4	174.6	72.1	44.3	0	0	0	111.9	V366 Q367 A368	N364-V366 VanDerWaalsContact C-N 3.3Å; N364-V366 PolarHBondContact O-N 3.28Å; N364-V366 WeakPolarHBondContact OD1-CB 3.48Å; N364-V366 PolarHBondContact OD1-N 3.42Å; N364-Q367 VanDerWaalsContact CG-OE1 3.25Å; N364-Q367 PolarHBondContact ND2-OE1 3.32Å; N364-Q367 PolarHBondContact O-N 3.48Å; N364-Q367 WeakPolarHBondContact OD1-CG 3.41Å; N364-Q367 PolarHBondContact OD1-N 3.33Å; N364-A368 PolarHBondContact O-N 3.35Å
365	R	88.7	Confident	87.2	Confident	147 Å²	147	78.3 Å²	78.3	56%	0.555	39%	0.391	S	S	*	.	H	α-helix	trans	-55.2	-42.5	-178.6	-175.9	-178	172	160.5	1.4	113.2	A368 E369 H403	R365-A368 PolarHBondContact O-N 2.83Å; R365-E369 IonicContact CZ-OE1 4Å; R365-E369 IonicContact NE-OE1 2.81Å; R365-E369 PolarHBondContact NE-OE1 3.25Å; R365-E369 VanDerWaalsContact NE-OE1 3.1Å; R365-E369 IonicContact NH2-OE1 3.54Å; R365-E369 WeakPolarHBondContact O-CG 3.4Å; R365-E369 PolarHBondContact O-N 3.04Å; R365-E369 VanDerWaalsContact O-N 3.13Å; R365-H403 VanDerWaalsContact CG-CE1 3.45Å; R365-H403 WeakPolarHBondContact CG-CE1 3.38Å
366	V	89.2	Confident	87.3	Confident	85 Å²	85	75.9 Å²	75.9	52%	0.515	38%	0.384	S	S	.	.	H	α-helix	trans	-70.9	-43	-176.6	-178.4	0	0	0	0	110.3	N364 A368 E369 D370	N364-V366 VanDerWaalsContact C-N 3.3Å; N364-V366 PolarHBondContact O-N 3.28Å; N364-V366 WeakPolarHBondContact OD1-CB 3.48Å; N364-V366 PolarHBondContact OD1-N 3.42Å; V366-A368 VanDerWaalsContact C-N 3.28Å; V366-A368 PolarHBondContact O-N 3.28Å; V366-E369 WeakPolarHBondContact O-CB 3.28Å; V366-E369 PolarHBondContact O-N 3.14Å; V366-E369 VanDerWaalsContact O-N 3.1Å; V366-D370 PolarHBondContact O-N 2.95Å
367	Q	88.2	Confident	87.4	Confident	86 Å²	86	71.4 Å²	71.4	40%	0.402	37%	0.368	S	S	.	.	H	α-helix	trans	-63	-34.8	175.7	-69.6	170	-43.9	0	0	112.4	I363 N364 D370 L371	I363-Q367 HydrophobicContact CB-CB 4.16Å; I363-Q367 HydrophobicContact CG2-CB 4.43Å; N364-Q367 VanDerWaalsContact CG-OE1 3.25Å; N364-Q367 PolarHBondContact ND2-OE1 3.32Å; N364-Q367 PolarHBondContact O-N 3.48Å; N364-Q367 WeakPolarHBondContact OD1-CG 3.41Å; N364-Q367 PolarHBondContact OD1-N 3.33Å; Q367-D370 PolarHBondContact O-N 2.93Å; Q367-L371 WeakPolarHBondContact O-CG 3.22Å; Q367-L371 PolarHBondContact O-N 3.03Å
368	A	89.5	Confident	87.4	Confident	0 Å²	0	70.8 Å²	70.8	0%	0	36%	0.364	C	S	.	.	H	α-helix	trans	-66.9	-38.5	173.4	0	0	0	0	0	112.3	I363 N364 R365 V366 L371 L372 L381	I363-A368 HydrophobicContact CD1-CB 4.08Å; N364-A368 PolarHBondContact O-N 3.35Å; R365-A368 PolarHBondContact O-N 2.83Å; V366-A368 VanDerWaalsContact C-N 3.28Å; V366-A368 PolarHBondContact O-N 3.28Å; A368-L371 PolarHBondContact O-N 3.41Å; A368-L372 WeakPolarHBondContact O-CB 3.42Å; A368-L372 WeakPolarHBondContact O-CG 3.03Å; A368-L372 PolarHBondContact O-N 3.07Å; A368-L372 VanDerWaalsContact O-N 3.14Å; A368-L381 HydrophobicContact CB-CD1 4.04Å; A368-L381 HydrophobicContact CB-CD2 4.26Å
369	E	91.9	Very high	87.5	Confident	61 Å²	61	70.7 Å²	70.7	29%	0.285	36%	0.364	S	S	.	.	H	α-helix	trans	-64	-41.6	174.5	-71	166.4	-174.3	0	0	110.9	R365 V366 L372 Y373 V401 H403	R365-E369 IonicContact CZ-OE1 4Å; R365-E369 IonicContact NE-OE1 2.81Å; R365-E369 PolarHBondContact NE-OE1 3.25Å; R365-E369 VanDerWaalsContact NE-OE1 3.1Å; R365-E369 IonicContact NH2-OE1 3.54Å; R365-E369 WeakPolarHBondContact O-CG 3.4Å; R365-E369 PolarHBondContact O-N 3.04Å; R365-E369 VanDerWaalsContact O-N 3.13Å; V366-E369 WeakPolarHBondContact O-CB 3.28Å; V366-E369 PolarHBondContact O-N 3.14Å; V366-E369 VanDerWaalsContact O-N 3.1Å; E369-L372 PolarHBondContact O-N 2.81Å; E369-Y373 WeakPolarHBondContact O-CB 3.42Å; E369-Y373 PolarHBondContact O-N 3.31Å; E369-V401 HydrophobicContact CG-CB 4.06Å; E369-V401 HydrophobicContact CG-CG1 3.94Å; E369-H403 WeakPolarHBondContact CG-NE2 3.04Å; E369-H403 IonicContact OE1-CD2 3.05Å; E369-H403 IonicContact OE1-CE1 2.71Å; E369-H403 IonicContact OE1-NE2 3.66Å; E369-H403 PolarHBondContact OE1-NE2 3.11Å
370	D	90.9	Very high	87.6	Confident	113 Å²	113	68.9 Å²	68.9	60%	0.604	36%	0.356	S	S	*	.	H	α-helix	trans	-63.5	-41.6	176.1	-68.3	-27.6	0	0	0	112.8	V366 Q367 L372 Y373	V366-D370 PolarHBondContact O-N 2.95Å; Q367-D370 PolarHBondContact O-N 2.93Å; D370-L372 VanDerWaalsContact C-N 3.32Å; D370-L372 PolarHBondContact O-N 3.43Å; D370-Y373 WeakPolarHBondContact O-CB 3.22Å; D370-Y373 PolarHBondContact O-N 2.67Å
371	L	88.2	Confident	87.8	Confident	69 Å²	69	67.7 Å²	67.7	36%	0.361	35%	0.349	S	S	.	.	H	α-helix	trans	-68.7	-31.1	178.9	-75.4	172.4	0	0	0	113.2	I363 Q367 A368 L381 V452	I363-L371 HydrophobicContact CD1-CD1 4.12Å; Q367-L371 WeakPolarHBondContact O-CG 3.22Å; Q367-L371 PolarHBondContact O-N 3.03Å; A368-L371 PolarHBondContact O-N 3.41Å; L371-L381 HydrophobicContact CB-CD2 4.28Å; L371-L381 HydrophobicContact CD1-CD2 4.18Å; L371-V452 HydrophobicContact CB-CG2 4.28Å
372	L	89.7	Confident	88.6	Confident	2 Å²	2	62.1 Å²	62.1	1%	0.01	32%	0.323	C	S	.	.	H	α-helix	trans	-92.7	-5.7	179.5	-67.5	175.1	0	0	0	112.9	A368 E369 D370 G374 K375 A379 L381 V396 V401 V452	A368-L372 WeakPolarHBondContact O-CB 3.42Å; A368-L372 WeakPolarHBondContact O-CG 3.03Å; A368-L372 PolarHBondContact O-N 3.07Å; A368-L372 VanDerWaalsContact O-N 3.14Å; E369-L372 PolarHBondContact O-N 2.81Å; D370-L372 VanDerWaalsContact C-N 3.32Å; D370-L372 PolarHBondContact O-N 3.43Å; L372-G374 PolarHBondContact O-N 2.91Å; L372-K375 WeakPolarHBondContact O-CB 3.4Å; L372-K375 WeakPolarHBondContact O-CG 3.5Å; L372-K375 PolarHBondContact O-N 2.97Å; L372-A379 HydrophobicContact CD2-CB 4.13Å; L372-L381 HydrophobicContact CD1-CD2 4.36Å; L372-L381 HydrophobicContact CD1-CG 4.28Å; L372-L381 HydrophobicContact CG-CD2 4.21Å; L372-V396 HydrophobicContact CB-CG2 3.8Å; L372-V396 HydrophobicContact CD1-CG2 4.46Å; L372-V396 HydrophobicContact CD2-CG2 4.27Å; L372-V396 HydrophobicContact CG-CG2 4.4Å; L372-V401 HydrophobicContact CB-CG1 4.47Å; L372-V401 HydrophobicContact CB-CG2 3.76Å; L372-V401 HydrophobicContact CD1-CG1 3.84Å; L372-V452 HydrophobicContact CD2-CG2 4.26Å
373	Y	88.3	Confident	89.2	Confident	196 Å²	196	55.7 Å²	55.7	77%	0.769	29%	0.288	S	S	*	.	T	Hydrogen-bonded Turn	trans	-60.9	125.8	179.4	-171.8	-97.6	0	0	0	111.4	E369 D370 K375	E369-Y373 WeakPolarHBondContact O-CB 3.42Å; E369-Y373 PolarHBondContact O-N 3.31Å; D370-Y373 WeakPolarHBondContact O-CB 3.22Å; D370-Y373 PolarHBondContact O-N 2.67Å; Y373-K375 VanDerWaalsContact C-N 3.26Å; Y373-K375 PolarHBondContact O-N 3.04Å
374	G	82.2	Confident	89.3	Confident	78 Å²	78	59.1 Å²	59.1	80%	0.804	30%	0.303	S	S	*	.	T	Hydrogen-bonded Turn	trans	72.4	11.4	179.8	0	0	0	0	0	115.4	L372	L372-G374 PolarHBondContact O-N 2.91Å
375	K	88	Confident	89.1	Confident	86 Å²	86	56.4 Å²	56.4	37%	0.374	29%	0.29	S	S	.	.	P	Polyproline II helix	trans	-83.5	156.4	172.9	-61.1	-66.5	-178.3	-177.8	0	111.1	L372 Y373 A379 V396 M456	L372-K375 WeakPolarHBondContact O-CB 3.4Å; L372-K375 WeakPolarHBondContact O-CG 3.5Å; L372-K375 PolarHBondContact O-N 2.97Å; Y373-K375 VanDerWaalsContact C-N 3.26Å; Y373-K375 PolarHBondContact O-N 3.04Å; K375-A379 HydrophobicContact CB-CB 3.62Å; K375-A379 HydrophobicContact CG-CB 4.44Å; K375-V396 HydrophobicContact CB-CG2 4.37Å; K375-M456 HydrophobicContact CD-CE 3.98Å
376	P	87.8	Confident	88.6	Confident	47 Å²	47	55.3 Å²	55.3	31%	0.305	31%	0.305	S	S	.	.	P	Polyproline II helix	trans	-67.7	158.8	176.7	29.4	-36.5	0	0	0	112.2	G378 A379 Y450 M456	P376-G378 PolarHBondContact O-N 3.11Å; P376-A379 WeakPolarHBondContact O-CB 3.41Å; P376-A379 PolarHBondContact O-N 2.81Å; P376-A379 VanDerWaalsContact O-N 3.08Å; P376-Y450 HydrophobicContact CG-CD2 4.06Å; P376-Y450 HydrophobicContact CG-CE2 4.29Å; P376-M456 HydrophobicContact CG-CE 3.71Å; P376-M456 HydrophobicContact CG-SD 3.8Å
377	D	87.4	Confident	88.1	Confident	74 Å²	74	57.3 Å²	57.3	40%	0.396	31%	0.307	S	S	.	.	T	Hydrogen-bonded Turn	trans	-55.6	136.5	172.8	-75.7	5.7	0	0	0	111.3	D398 G399 V446	D377-D398 PolarHBondContact OD1-N 3.47Å; D377-D398 PolarHBondContact OD2-N 2.98Å; D377-D398 VanDerWaalsContact OD2-N 3.11Å; D377-G399 PolarHBondContact OD1-N 2.94Å; D377-V446 HydrophobicContact CB-CG1 4.39Å
378	G	85.4	Confident	87.4	Confident	2 Å²	2	63.4 Å²	63.4	2%	0.021	33%	0.332	C	S	.	.	T	Hydrogen-bonded Turn	trans	86.1	-0.4	-173.1	0	0	0	0	0	114.8	P376 V396 R447 A449 Y450	P376-G378 PolarHBondContact O-N 3.11Å; G378-V396 PolarHBondContact N-O 3.03Å; G378-R447 WeakPolarHBondContact CA-O 3.33Å; G378-A449 PolarHBondContact O-N 3.05Å; G378-Y450 PolarHBondContact O-N 2.94Å; G378-Y450 VanDerWaalsContact O-N 3.09Å
379	A	91.3	Very high	86.7	Confident	1 Å²	1	66 Å²	66	1%	0.008	36%	0.359	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-67.9	131.4	166.7	0	0	0	0	0	110.8	L372 K375 P376 V395 V396 Y450 M456	L372-A379 HydrophobicContact CD2-CB 4.13Å; K375-A379 HydrophobicContact CB-CB 3.62Å; K375-A379 HydrophobicContact CG-CB 4.44Å; P376-A379 WeakPolarHBondContact O-CB 3.41Å; P376-A379 PolarHBondContact O-N 2.81Å; P376-A379 VanDerWaalsContact O-N 3.08Å; A379-V395 CarbonylContact O-C 3.46Å; A379-V395 WeakPolarHBondContact O-CA 3.31Å; A379-V396 HydrophobicContact CB-CG2 4.1Å; A379-V396 PolarHBondContact O-N 3.09Å; A379-Y450 CarbonylContact C-O 3.55Å; A379-Y450 VanDerWaalsContact CA-O 3.29Å; A379-Y450 WeakPolarHBondContact CA-O 3.42Å; A379-M456 HydrophobicContact CB-CE 4.27Å
380	F	94.4	Very high	86.4	Confident	0 Å²	0	64.2 Å²	64.2	0%	0	35%	0.353	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-146.3	160.5	-172	81.4	-78.6	0	0	0	114.1	H352 W358 S394 V395 V429 L448 Y450 P451 V452	H352-F380 AromaticContact CD2-CE1 3.74Å; H352-F380 AromaticContact CD2-CZ 3.83Å; H352-F380 AromaticContact NE2-CE1 3.76Å; W358-F380 HydrophobicContact CB-CD2 4.28Å; W358-F380 HydrophobicContact CB-CE2 3.47Å; W358-F380 VanDerWaalsContact CB-CE2 3.47Å; W358-F380 HydrophobicContact CB-CZ 3.62Å; W358-F380 HydrophobicContact CD2-CE2 4.38Å; W358-F380 AromaticContact CG-CE2 3.92Å; W358-F380 HydrophobicContact CG-CE2 3.92Å; W358-F380 AromaticContact CG-CZ 3.94Å; W358-F380 HydrophobicContact CG-CZ 3.94Å; F380-S394 CarbonylContact C-O 3.52Å; F380-S394 VanDerWaalsContact CA-O 3.23Å; F380-S394 WeakPolarHBondContact CA-O 3.47Å; F380-V395 HydrophobicContact CB-CB 4.08Å; F380-V395 HydrophobicContact CB-CG2 4.03Å; F380-V429 HydrophobicContact CE2-CG1 3.86Å; F380-V429 HydrophobicContact CE2-CG2 3.98Å; F380-V429 HydrophobicContact CZ-CG1 3.52Å; F380-V429 HydrophobicContact CZ-CG2 4.49Å; F380-L448 HydrophobicContact CB-CD2 3.71Å; F380-L448 HydrophobicContact CD1-CB 3.68Å; F380-L448 HydrophobicContact CD1-CD2 4.23Å; F380-L448 HydrophobicContact CD1-CG 4.48Å; F380-L448 HydrophobicContact CD2-CB 4.17Å; F380-L448 HydrophobicContact CD2-CD1 4.12Å; F380-L448 HydrophobicContact CD2-CD2 3.87Å; F380-L448 HydrophobicContact CD2-CG 4.27Å; F380-L448 HydrophobicContact CE1-CB 3.69Å; F380-L448 HydrophobicContact CE2-CB 4.18Å; F380-L448 HydrophobicContact CE2-CD1 4.12Å; F380-L448 HydrophobicContact CG-CB 3.94Å; F380-L448 HydrophobicContact CG-CD2 3.67Å; F380-L448 HydrophobicContact CG-CG 4.26Å; F380-L448 HydrophobicContact CZ-CB 3.96Å; F380-Y450 WeakPolarHBondContact CD1-O 3.23Å; F380-Y450 PolarHBondContact N-O 3.08Å; F380-P451 HydrophobicContact CE1-CB 4.34Å; F380-P451 HydrophobicContact CE1-CG 3.89Å; F380-P451 HydrophobicContact CZ-CB 4.49Å; F380-P451 HydrophobicContact CZ-CG 4.13Å; F380-V452 PolarHBondContact O-N 3.07Å
381	L	93.1	Very high	86.4	Confident	0 Å²	0	61.1 Å²	61.1	0%	0	33%	0.333	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-146.2	156.3	166	63.8	79.7	0	0	0	110.5	W358 V360 I363 A368 L371 L372 R383 S394 V452	W358-L381 CarbonylContact O-C 3.58Å; W358-L381 WeakPolarHBondContact O-CA 3.33Å; W358-L381 WeakPolarHBondContact O-CB 3.09Å; V360-L381 HydrophobicContact CG2-CB 4.41Å; I363-L381 HydrophobicContact CD1-CD1 3.62Å; I363-L381 HydrophobicContact CD1-CD2 3.8Å; I363-L381 HydrophobicContact CD1-CG 4.36Å; A368-L381 HydrophobicContact CB-CD1 4.04Å; A368-L381 HydrophobicContact CB-CD2 4.26Å; L371-L381 HydrophobicContact CB-CD2 4.28Å; L371-L381 HydrophobicContact CD1-CD2 4.18Å; L372-L381 HydrophobicContact CD1-CD2 4.36Å; L372-L381 HydrophobicContact CD1-CG 4.28Å; L372-L381 HydrophobicContact CG-CD2 4.21Å; L381-R383 HydrophobicContact CD1-CB 4.15Å; L381-R383 HydrophobicContact CD1-CG 4.21Å; L381-S394 PolarHBondContact N-O 2.84Å; L381-S394 PolarHBondContact O-N 3.5Å; L381-V452 HydrophobicContact CB-CB 4.09Å; L381-V452 HydrophobicContact CB-CG1 3.75Å; L381-V452 HydrophobicContact CD2-CB 4.36Å; L381-V452 HydrophobicContact CD2-CG1 4.29Å; L381-V452 HydrophobicContact CD2-CG2 4.21Å
382	I	94	Very high	86.5	Confident	0 Å²	0	58.1 Å²	58.1	0%	0	32%	0.318	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-115.3	131	171.7	-62.1	179.9	0	0	0	108	W358 F359 V360 Y391 A392 C393 I406 L425 V429	W358-I382 HydrophobicContact CE3-CB 4.03Å; W358-I382 HydrophobicContact CE3-CD1 3.86Å; W358-I382 HydrophobicContact CE3-CG1 4.09Å; W358-I382 HydrophobicContact CZ3-CB 4.2Å; W358-I382 HydrophobicContact CZ3-CD1 3.77Å; W358-I382 HydrophobicContact CZ3-CG1 4.35Å; W358-I382 PolarHBondContact O-N 3.03Å; F359-I382 CarbonylContact C-O 3.58Å; F359-I382 WeakPolarHBondContact CA-O 3.42Å; F359-I382 HydrophobicContact CD2-CB 4.14Å; F359-I382 HydrophobicContact CD2-CG2 3.97Å; F359-I382 WeakPolarHBondContact CD2-O 3.42Å; F359-I382 HydrophobicContact CE2-CG2 4.17Å; V360-I382 PolarHBondContact N-O 3.1Å; I382-Y391 HydrophobicContact CG2-CD1 4.45Å; I382-A392 WeakPolarHBondContact CA-O 3.44Å; I382-C393 HydrophobicContact CG1-CB 4.35Å; I382-I406 HydrophobicContact CD1-CD1 3.73Å; I382-I406 HydrophobicContact CG1-CD1 4.18Å; I382-I406 HydrophobicContact CG2-CD1 4.16Å; I382-L425 HydrophobicContact CG2-CD1 4.39Å; I382-V429 HydrophobicContact CD1-CG2 3.41Å; I382-V429 VanDerWaalsContact CD1-CG2 3.41Å
383	R	91.3	Very high	86.6	Confident	14 Å²	14	58 Å²	58	5%	0.053	32%	0.317	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-129.9	163.5	-179.5	62	-177.1	177.4	77.8	1.8	111.6	V360 I363 L381 S385 A392 S394 H403	V360-R383 VanDerWaalsContact O-CA 3.23Å; V360-R383 WeakPolarHBondContact O-CA 3.4Å; V360-R383 VanDerWaalsContact O-CB 3.31Å; V360-R383 WeakPolarHBondContact O-CB 3.35Å; I363-R383 HydrophobicContact CD1-CB 4.12Å; I363-R383 HydrophobicContact CG1-CB 3.63Å; I363-R383 HydrophobicContact CG1-CG 4.39Å; I363-R383 WeakPolarHBondContact O-CD 3.39Å; L381-R383 HydrophobicContact CD1-CB 4.15Å; L381-R383 HydrophobicContact CD1-CG 4.21Å; R383-S385 PolarHBondContact O-N 3.39Å; R383-A392 HydrophobicContact CG-CB 4.05Å; R383-A392 PolarHBondContact N-O 3.15Å; R383-A392 PolarHBondContact O-N 3.32Å; R383-S394 PolarHBondContact NE-OG 2.92Å; R383-H403 PolarHBondContact NH2-ND1 3.47Å
384	E	88.1	Confident	86.8	Confident	99 Å²	99	48.7 Å²	48.7	46%	0.463	28%	0.281	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-62.2	136.6	170.2	-67.6	-157.8	158.1	0	0	110.8	Y391	E384-Y391 HydrophobicContact CG-CE1 4.28Å
385	S	83.2	Confident	87.3	Confident	25 Å²	25	45 Å²	45	18%	0.175	24%	0.243	C	C	.	.			trans	-81.3	151.2	174.4	-167.7	0	0	0	0	109.8	R383 K387 C390	R383-S385 PolarHBondContact O-N 3.39Å; S385-K387 PolarHBondContact O-N 2.84Å; S385-K387 PolarHBondContact OG-N 3.28Å; S385-C390 WeakPolarHBondContact CB-O 3.24Å; S385-C390 PolarHBondContact N-O 2.8Å; S385-C390 VanDerWaalsContact N-O 3.1Å
386	S	78.3	Confident	87.5	Confident	124 Å²	124	41 Å²	41	87%	0.867	23%	0.226	S	C	*	.	S	Bend	trans	-63.2	-11	168.6	-45.1	0	0	0	0	112.7
387	K	79	Confident	87.5	Confident	126 Å²	126	38.8 Å²	38.8	55%	0.548	21%	0.211	S	C	.	.	S	Bend	trans	-91.7	123.7	172	-65.7	-178.8	175.3	178.4	0	109.9	S385 G389 C390	S385-K387 PolarHBondContact O-N 2.84Å; S385-K387 PolarHBondContact OG-N 3.28Å; K387-G389 PolarHBondContact O-N 3.26Å; K387-C390 HydrophobicContact CB-CB 4.14Å; K387-C390 PolarHBondContact O-N 2.89Å; K387-C390 VanDerWaalsContact O-N 3.15Å
388	K	74.3	Confident	87.4	Confident	215 Å²	215	40.8 Å²	40.8	94%	0.935	22%	0.222	S	C	*	.	T	Hydrogen-bonded Turn	trans	-55.5	128.3	177.3	-73.1	-170.1	175.7	-174.1	0	111.1
389	G	73.4	Confident	87.1	Confident	55 Å²	55	43.6 Å²	43.6	57%	0.567	25%	0.251	S	S	*	.	T	Hydrogen-bonded Turn	trans	76.5	17.5	178.4	0	0	0	0	0	114.7	K387 S408	K387-G389 PolarHBondContact O-N 3.26Å; G389-S408 VanDerWaalsContact O-CB 3.22Å; G389-S408 WeakPolarHBondContact O-CB 3.16Å
390	C	86.2	Confident	86.9	Confident	22 Å²	22	50 Å²	50	15%	0.149	28%	0.281	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-126.6	155.1	172.8	-65.4	0	0	0	0	110.3	S385 K387 V405	S385-C390 WeakPolarHBondContact CB-O 3.24Å; S385-C390 PolarHBondContact N-O 2.8Å; S385-C390 VanDerWaalsContact N-O 3.1Å; K387-C390 HydrophobicContact CB-CB 4.14Å; K387-C390 PolarHBondContact O-N 2.89Å; K387-C390 VanDerWaalsContact O-N 3.15Å; C390-V405 HydrophobicContact CB-CG1 4.13Å
391	Y	90.7	Very high	86.7	Confident	49 Å²	49	51.7 Å²	51.7	19%	0.192	29%	0.291	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-111.9	162.4	171.7	-63.2	-88.6	0	0	0	110	F359 I382 E384 I406 Y413 L425	F359-Y391 AromaticContact CE2-CD1 3.84Å; F359-Y391 HydrophobicContact CE2-CD1 3.84Å; F359-Y391 AromaticContact CE2-CE1 3.77Å; F359-Y391 HydrophobicContact CE2-CE1 3.77Å; F359-Y391 HydrophobicContact CZ-CD1 4.31Å; F359-Y391 AromaticContact CZ-CE1 3.79Å; F359-Y391 HydrophobicContact CZ-CE1 3.79Å; I382-Y391 HydrophobicContact CG2-CD1 4.45Å; E384-Y391 HydrophobicContact CG-CE1 4.28Å; Y391-I406 PolarHBondContact N-O 3.1Å; Y391-I406 PolarHBondContact O-N 3.2Å; Y391-Y413 HydrophobicContact CD2-CD1 4.39Å; Y391-Y413 HydrophobicContact CD2-CE1 4.09Å; Y391-Y413 AromaticContact CE2-CE1 3.78Å; Y391-Y413 HydrophobicContact CE2-CE1 3.78Å; Y391-L425 HydrophobicContact CD1-CD1 3.85Å; Y391-L425 HydrophobicContact CD2-CD1 3.93Å; Y391-L425 HydrophobicContact CD2-CD2 4.07Å; Y391-L425 HydrophobicContact CD2-CG 4.44Å; Y391-L425 HydrophobicContact CE1-CD1 3.87Å; Y391-L425 HydrophobicContact CE2-CD1 3.97Å; Y391-L425 HydrophobicContact CG-CD1 3.87Å; Y391-L425 HydrophobicContact CG-CD2 4.24Å
392	A	90.3	Very high	86.5	Confident	5 Å²	5	53.9 Å²	53.9	4%	0.041	30%	0.301	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-122.9	125.3	173.5	0	0	0	0	0	109.4	I382 R383 C404	I382-A392 WeakPolarHBondContact CA-O 3.44Å; R383-A392 HydrophobicContact CG-CB 4.05Å; R383-A392 PolarHBondContact N-O 3.15Å; R383-A392 PolarHBondContact O-N 3.32Å; A392-C404 CarbonylContact C-O 3.53Å; A392-C404 WeakPolarHBondContact CA-O 3.22Å
393	C	91.9	Very high	86.3	Confident	0 Å²	0	56.1 Å²	56.1	0%	0	31%	0.311	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-91.8	118.2	169.6	-172.7	0	0	0	0	108.8	I382 H403 C404 I406 F415	I382-C393 HydrophobicContact CG1-CB 4.35Å; C393-H403 CarbonylContact O-C 3.4Å; C393-H403 WeakPolarHBondContact O-CA 3.38Å; C393-C404 HydrophobicContact CB-CB 4.36Å; C393-C404 PolarHBondContact N-O 3.26Å; C393-C404 PolarHBondContact O-N 3.19Å; C393-I406 HydrophobicContact CB-CD1 3.94Å; C393-I406 HydrophobicContact CB-CG1 4.26Å; C393-F415 HydrophobicContact CB-CE1 3.71Å; C393-F415 HydrophobicContact CB-CZ 4.06Å
394	S	92.5	Very high	86.2	Confident	0 Å²	0	56.4 Å²	56.4	0%	0	32%	0.315	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-101.5	123.5	172.1	-61.1	0	0	0	0	108.1	F380 L381 R383 K402 H403	F380-S394 CarbonylContact C-O 3.52Å; F380-S394 VanDerWaalsContact CA-O 3.23Å; F380-S394 WeakPolarHBondContact CA-O 3.47Å; L381-S394 PolarHBondContact N-O 2.84Å; L381-S394 PolarHBondContact O-N 3.5Å; R383-S394 PolarHBondContact NE-OG 2.92Å; S394-K402 WeakPolarHBondContact CA-O 3.32Å; S394-H403 PolarHBondContact OG-CE1 3.09Å; S394-H403 VanDerWaalsContact OG-CE1 3.25Å; S394-H403 PolarHBondContact OG-ND1 2.9Å
395	V	92.8	Very high	86.2	Confident	0 Å²	0	53.9 Å²	53.9	0%	0	31%	0.306	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-139.1	140.3	-174.6	61.9	0	0	0	0	111.1	A379 F380 K402 L437 L444 V446 L448	A379-V395 CarbonylContact O-C 3.46Å; A379-V395 WeakPolarHBondContact O-CA 3.31Å; F380-V395 HydrophobicContact CB-CB 4.08Å; F380-V395 HydrophobicContact CB-CG2 4.03Å; V395-K402 PolarHBondContact N-O 2.94Å; V395-K402 PolarHBondContact O-N 2.98Å; V395-L437 HydrophobicContact CG1-CD1 4.29Å; V395-L444 HydrophobicContact CG1-CD2 4.3Å; V395-V446 HydrophobicContact CG1-CG2 4.49Å; V395-V446 HydrophobicContact CG2-CG2 3.88Å; V395-L448 HydrophobicContact CB-CD2 4.39Å; V395-L448 HydrophobicContact CG2-CD2 4.14Å
396	V	91.3	Very high	86.6	Confident	4 Å²	4	52.7 Å²	52.7	2%	0.024	30%	0.298	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-81.5	125.1	173.8	-174.1	0	0	0	0	109.6	L372 K375 G378 A379 E400 V401	L372-V396 HydrophobicContact CB-CG2 3.8Å; L372-V396 HydrophobicContact CD1-CG2 4.46Å; L372-V396 HydrophobicContact CD2-CG2 4.27Å; L372-V396 HydrophobicContact CG-CG2 4.4Å; K375-V396 HydrophobicContact CB-CG2 4.37Å; G378-V396 PolarHBondContact N-O 3.03Å; A379-V396 HydrophobicContact CB-CG2 4.1Å; A379-V396 PolarHBondContact O-N 3.09Å; V396-E400 WeakPolarHBondContact CA-O 3.22Å; V396-V401 HydrophobicContact CG2-CG2 4.27Å
397	A	88	Confident	87	Confident	0 Å²	0	51.4 Å²	51.4	0%	0	28%	0.275	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-144	128.3	174.7	0	0	0	0	0	110.7	G399 E400 K402 L444 V446	A397-G399 PolarHBondContact O-N 3.28Å; A397-E400 PolarHBondContact N-O 2.9Å; A397-E400 PolarHBondContact O-N 3Å; A397-K402 HydrophobicContact CB-CD 4.05Å; A397-K402 PolarHBondContact O-NZ 2.98Å; A397-L444 HydrophobicContact CB-CD2 4.44Å; A397-V446 HydrophobicContact CB-CB 4.29Å; A397-V446 HydrophobicContact CB-CG1 3.57Å; A397-V446 HydrophobicContact CB-CG2 3.7Å
398	D	84.9	Confident	87.3	Confident	115 Å²	115	48 Å²	48	62%	0.615	27%	0.266	S	S	*	.	T	Hydrogen-bonded Turn	trans	57.8	34.6	-175.5	-47.1	-58	0	0	0	112.3	D377 E400 K402	D377-D398 PolarHBondContact OD1-N 3.47Å; D377-D398 PolarHBondContact OD2-N 2.98Å; D377-D398 VanDerWaalsContact OD2-N 3.11Å; D398-E400 PolarHBondContact O-N 3.27Å; D398-K402 IonicContact OD2-NZ 3.66Å; D398-K402 PolarHBondContact OD2-NZ 3.5Å
399	G	80.9	Confident	87.7	Confident	62 Å²	62	39.8 Å²	39.8	64%	0.639	24%	0.235	S	C	*	.	T	Hydrogen-bonded Turn	trans	74.2	1.4	-176.9	0	0	0	0	0	115.9	D377 A397	D377-G399 PolarHBondContact OD1-N 2.94Å; A397-G399 PolarHBondContact O-N 3.28Å
400	E	86.6	Confident	88.1	Confident	136 Å²	136	42.9 Å²	42.9	64%	0.636	25%	0.254	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-113.5	146.2	176.4	-65.5	-170.2	159	0	0	112.1	V396 A397 D398 K402	V396-E400 WeakPolarHBondContact CA-O 3.22Å; A397-E400 PolarHBondContact N-O 2.9Å; A397-E400 PolarHBondContact O-N 3Å; D398-E400 PolarHBondContact O-N 3.27Å; E400-K402 PolarHBondContact O-N 3.47Å
401	V	89.6	Confident	87.7	Confident	35 Å²	35	50.2 Å²	50.2	21%	0.212	28%	0.279	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-84	115.4	176.6	-177.1	0	0	0	0	110	E369 L372 V396	E369-V401 HydrophobicContact CG-CB 4.06Å; E369-V401 HydrophobicContact CG-CG1 3.94Å; L372-V401 HydrophobicContact CB-CG1 4.47Å; L372-V401 HydrophobicContact CB-CG2 3.76Å; L372-V401 HydrophobicContact CD1-CG1 3.84Å; V396-V401 HydrophobicContact CG2-CG2 4.27Å
402	K	89.3	Confident	87.5	Confident	46 Å²	46	48.3 Å²	48.3	20%	0.2	27%	0.274	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-105.1	147.2	177	-65.3	176.2	-174.5	151	0	110.3	S394 V395 A397 D398 E400 S443 L444	S394-K402 WeakPolarHBondContact CA-O 3.32Å; V395-K402 PolarHBondContact N-O 2.94Å; V395-K402 PolarHBondContact O-N 2.98Å; A397-K402 HydrophobicContact CB-CD 4.05Å; A397-K402 PolarHBondContact O-NZ 2.98Å; D398-K402 IonicContact OD2-NZ 3.66Å; D398-K402 PolarHBondContact OD2-NZ 3.5Å; E400-K402 PolarHBondContact O-N 3.47Å; K402-S443 PolarHBondContact NZ-O 3.13Å; K402-L444 HydrophobicContact CB-CD2 3.66Å; K402-L444 HydrophobicContact CD-CD2 3.41Å; K402-L444 VanDerWaalsContact CD-CD2 3.41Å; K402-L444 HydrophobicContact CD-CG 4.47Å; K402-L444 HydrophobicContact CG-CD2 4.13Å
403	H	89.8	Confident	87.3	Confident	46 Å²	46	50.5 Å²	50.5	21%	0.213	28%	0.282	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-122.3	123.5	-175.7	-58.7	-99	0	0	0	110.7	R365 E369 R383 C393 S394	R365-H403 VanDerWaalsContact CG-CE1 3.45Å; R365-H403 WeakPolarHBondContact CG-CE1 3.38Å; E369-H403 WeakPolarHBondContact CG-NE2 3.04Å; E369-H403 IonicContact OE1-CD2 3.05Å; E369-H403 IonicContact OE1-CE1 2.71Å; E369-H403 IonicContact OE1-NE2 3.66Å; E369-H403 PolarHBondContact OE1-NE2 3.11Å; R383-H403 PolarHBondContact NH2-ND1 3.47Å; C393-H403 CarbonylContact O-C 3.4Å; C393-H403 WeakPolarHBondContact O-CA 3.38Å; S394-H403 PolarHBondContact OG-CE1 3.09Å; S394-H403 VanDerWaalsContact OG-CE1 3.25Å; S394-H403 PolarHBondContact OG-ND1 2.9Å
404	C	88.4	Confident	87.1	Confident	21 Å²	21	50.5 Å²	50.5	14%	0.142	28%	0.282	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-116.2	139.2	-179.8	-53.6	0	0	0	0	110.1	A392 C393 F415 L444	A392-C404 CarbonylContact C-O 3.53Å; A392-C404 WeakPolarHBondContact CA-O 3.22Å; C393-C404 HydrophobicContact CB-CB 4.36Å; C393-C404 PolarHBondContact N-O 3.26Å; C393-C404 PolarHBondContact O-N 3.19Å; C404-F415 HydrophobicContact CB-CD1 3.74Å; C404-F415 HydrophobicContact CB-CE1 3.7Å; C404-L444 WeakPolarHBondContact SG-CD1 3.38Å
405	V	88.7	Confident	86.7	Confident	45 Å²	45	51.4 Å²	51.4	27%	0.273	29%	0.285	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-84.6	130.3	174.9	-178.2	0	0	0	0	108.8	C390 Y407	C390-V405 HydrophobicContact CB-CG1 4.13Å; V405-Y407 HydrophobicContact CB-CE2 4.48Å; V405-Y407 HydrophobicContact CG1-CD1 4.33Å; V405-Y407 HydrophobicContact CG1-CE1 4.02Å; V405-Y407 HydrophobicContact CG1-CE2 4.35Å
406	I	90.6	Very high	86.1	Confident	0 Å²	0	53.1 Å²	53.1	0%	0	30%	0.3	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-100.3	120	167.9	-59	168.5	0	0	0	107.3	I382 Y391 C393 Y413 G414 F415 L425 L428	I382-I406 HydrophobicContact CD1-CD1 3.73Å; I382-I406 HydrophobicContact CG1-CD1 4.18Å; I382-I406 HydrophobicContact CG2-CD1 4.16Å; Y391-I406 PolarHBondContact N-O 3.1Å; Y391-I406 PolarHBondContact O-N 3.2Å; C393-I406 HydrophobicContact CB-CD1 3.94Å; C393-I406 HydrophobicContact CB-CG1 4.26Å; I406-Y413 HydrophobicContact CG2-CD1 4.32Å; I406-G414 CarbonylContact C-O 3.48Å; I406-G414 WeakPolarHBondContact CA-O 3.49Å; I406-F415 HydrophobicContact CD1-CE1 4.04Å; I406-F415 HydrophobicContact CD1-CZ 4.21Å; I406-F415 HydrophobicContact CG1-CD1 3.84Å; I406-F415 HydrophobicContact CG1-CE1 3.4Å; I406-F415 HydrophobicContact CG1-CZ 3.98Å; I406-L425 HydrophobicContact CD1-CD2 4.14Å; I406-L425 HydrophobicContact CG2-CD2 3.86Å; I406-L428 HydrophobicContact CD1-CD2 4.21Å; I406-L428 HydrophobicContact CG2-CD1 3.85Å
407	Y	87.8	Confident	85.2	Confident	98 Å²	98	60.4 Å²	60.4	38%	0.384	33%	0.333	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-83.9	129.7	177.5	-62.7	-80.1	0	0	0	109.8	V405 Y413 G414 F415	V405-Y407 HydrophobicContact CB-CE2 4.48Å; V405-Y407 HydrophobicContact CG1-CD1 4.33Å; V405-Y407 HydrophobicContact CG1-CE1 4.02Å; V405-Y407 HydrophobicContact CG1-CE2 4.35Å; Y407-Y413 WeakPolarHBondContact O-CA 3.45Å; Y407-G414 PolarHBondContact N-O 2.8Å; Y407-G414 PolarHBondContact O-N 2.86Å; Y407-F415 WeakPolarHBondContact CE2-O 3.23Å
408	S	86.3	Confident	84.4	Confident	53 Å²	53	64.2 Å²	64.2	37%	0.371	36%	0.358	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-92.8	114.8	166.1	-171.1	0	0	0	0	108.1	G389 Y413	G389-S408 VanDerWaalsContact O-CB 3.22Å; G389-S408 WeakPolarHBondContact O-CB 3.16Å; S408-Y413 WeakPolarHBondContact OG-CE1 3.42Å
409	T	82.6	Confident	83.8	Confident	44 Å²	44	65 Å²	65	27%	0.27	35%	0.353	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-123.4	166.2	179.2	71.1	0	0	0	0	110.3	R411 G412 N420	T409-R411 PolarHBondContact O-N 2.81Å; T409-R411 VanDerWaalsContact O-N 3.11Å; T409-R411 PolarHBondContact OG1-N 2.78Å; T409-G412 PolarHBondContact N-O 3.05Å; T409-G412 PolarHBondContact O-N 3.44Å; T409-G412 PolarHBondContact OG1-N 3.46Å; T409-G412 PolarHBondContact OG1-O 2.84Å; T409-N420 HydrophobicContact CG2-CB 4.39Å; T409-N420 WeakPolarHBondContact CG2-ND2 3.29Å
410	A	80.6	Confident	83.6	Confident	119 Å²	119	62.3 Å²	62.3	98%	0.983	33%	0.325	S	S	*	.	T	Hydrogen-bonded Turn	trans	-60.9	-19.6	175.2	0	0	0	0	0	113.6
411	R	78.1	Confident	83.3	Confident	177 Å²	177	60.7 Å²	60.7	67%	0.668	32%	0.32	S	S	*	.	T	Hydrogen-bonded Turn	trans	-87.7	-15.6	177.2	-66.6	-177.6	65	-173.3	-2.3	113.4	T409 N420	T409-R411 PolarHBondContact O-N 2.81Å; T409-R411 VanDerWaalsContact O-N 3.11Å; T409-R411 PolarHBondContact OG1-N 2.78Å; R411-N420 CarbonylContact C-O 3.51Å
412	G	85.7	Confident	83.1	Confident	8 Å²	8	60.4 Å²	60.4	8%	0.082	32%	0.315	C	S	.	.	E	Extended strand (participates in β ladder)	trans	135.7	-167.7	-174.2	0	0	0	0	0	113.2	T409 Y422	T409-G412 PolarHBondContact N-O 3.05Å; T409-G412 PolarHBondContact O-N 3.44Å; T409-G412 PolarHBondContact OG1-N 3.46Å; T409-G412 PolarHBondContact OG1-O 2.84Å; G412-Y422 CarbonylContact C-O 3.41Å; G412-Y422 WeakPolarHBondContact CA-O 3.4Å
413	Y	86.7	Confident	82.9	Confident	52 Å²	52	62.7 Å²	62.7	20%	0.204	34%	0.337	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-99	148.1	178.9	-60.8	-90.6	0	0	0	110.8	Y391 I406 Y407 S408 N420 L421 Y422 L425	Y391-Y413 HydrophobicContact CD2-CD1 4.39Å; Y391-Y413 HydrophobicContact CD2-CE1 4.09Å; Y391-Y413 AromaticContact CE2-CE1 3.78Å; Y391-Y413 HydrophobicContact CE2-CE1 3.78Å; I406-Y413 HydrophobicContact CG2-CD1 4.32Å; Y407-Y413 WeakPolarHBondContact O-CA 3.45Å; S408-Y413 WeakPolarHBondContact OG-CE1 3.42Å; Y413-N420 CarbonylContact O-C 3.47Å; Y413-N420 WeakPolarHBondContact O-CA 3.33Å; Y413-L421 PolarHBondContact O-N 2.94Å; Y413-Y422 PolarHBondContact N-O 3.19Å; Y413-Y422 VanDerWaalsContact O-CD2 3.3Å; Y413-Y422 WeakPolarHBondContact O-CD2 3.47Å; Y413-Y422 PolarHBondContact O-N 2.88Å; Y413-L425 HydrophobicContact CD1-CD2 3.59Å; Y413-L425 HydrophobicContact CD1-CG 3.98Å; Y413-L425 HydrophobicContact CE1-CD2 4.1Å; Y413-L425 HydrophobicContact CE1-CG 4.05Å; Y413-L425 HydrophobicContact CG-CD2 4.03Å; Y413-L425 HydrophobicContact CG-CG 4.36Å
414	G	86.9	Confident	82.8	Confident	0 Å²	0	62.5 Å²	62.5	0%	0	34%	0.341	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-178.6	169.2	174.4	0	0	0	0	0	113.6	I406 Y407 N420	I406-G414 CarbonylContact C-O 3.48Å; I406-G414 WeakPolarHBondContact CA-O 3.49Å; Y407-G414 PolarHBondContact N-O 2.8Å; Y407-G414 PolarHBondContact O-N 2.86Å; G414-N420 VanDerWaalsContact C-OD1 3.31Å; G414-N420 VanDerWaalsContact CA-OD1 3.22Å; G414-N420 WeakPolarHBondContact CA-OD1 3.48Å; G414-N420 PolarHBondContact O-OD1 3.2Å
415	F	84.8	Confident	82.8	Confident	18 Å²	18	62.4 Å²	62.4	8%	0.079	34%	0.339	C	S	.	.	S	Bend	trans	-84.8	-24.5	-179.8	-68.3	-70.4	0	0	0	113.5	C393 C404 I406 Y407 L428 Y432 L437 H440	C393-F415 HydrophobicContact CB-CE1 3.71Å; C393-F415 HydrophobicContact CB-CZ 4.06Å; C404-F415 HydrophobicContact CB-CD1 3.74Å; C404-F415 HydrophobicContact CB-CE1 3.7Å; I406-F415 HydrophobicContact CD1-CE1 4.04Å; I406-F415 HydrophobicContact CD1-CZ 4.21Å; I406-F415 HydrophobicContact CG1-CD1 3.84Å; I406-F415 HydrophobicContact CG1-CE1 3.4Å; I406-F415 HydrophobicContact CG1-CZ 3.98Å; Y407-F415 WeakPolarHBondContact CE2-O 3.23Å; F415-L428 HydrophobicContact CE2-CD2 3.8Å; F415-L428 HydrophobicContact CE2-CG 4.43Å; F415-L428 HydrophobicContact CZ-CD2 3.95Å; F415-Y432 HydrophobicContact CD2-CD2 4.14Å; F415-Y432 AromaticContact CD2-CE2 3.69Å; F415-Y432 HydrophobicContact CD2-CE2 3.69Å; F415-Y432 AromaticContact CE2-CD2 3.58Å; F415-Y432 HydrophobicContact CE2-CD2 3.58Å; F415-Y432 AromaticContact CE2-CE2 3.61Å; F415-Y432 HydrophobicContact CE2-CE2 3.61Å; F415-Y432 HydrophobicContact CE2-CG 4.18Å; F415-L437 HydrophobicContact CD2-CD2 3.87Å; F415-L437 HydrophobicContact CE2-CD2 3.42Å; F415-L437 VanDerWaalsContact CE2-CD2 3.42Å; F415-L437 HydrophobicContact CZ-CD2 3.94Å; F415-H440 HydrophobicContact CB-CB 4.4Å; F415-H440 AromaticContact CD2-CD2 3.98Å
416	A	80.8	Confident	82.7	Confident	36 Å²	36	63.1 Å²	63.1	30%	0.298	34%	0.338	S	S	.	.	S	Bend	trans	-158.7	149.2	179.4	0	0	0	0	0	111.6	Y419 N420	A416-Y419 CarbonylContact O-C 3.23Å; A416-Y419 WeakPolarHBondContact O-CA 3.4Å; A416-Y419 WeakPolarHBondContact O-CB 3.14Å; A416-Y419 PolarHBondContact O-N 2.93Å; A416-N420 PolarHBondContact O-OD1 2.93Å
417	E	71.3	Confident	82.5	Confident	157 Å²	157	67.2 Å²	67.2	73%	0.734	36%	0.357	S	S	*	.	T	Hydrogen-bonded Turn	trans	-70	141.9	166.3	-74.4	-172.3	168.3	0	0	110.5	N420	E417-N420 WeakPolarHBondContact CG-ND2 3.25Å
418	P	71	Confident	82.5	Confident	81 Å²	81	62.5 Å²	62.5	53%	0.526	34%	0.339	S	S	.	.	T	Hydrogen-bonded Turn	cis	-88.6	10.1	6.3	35.8	-37.1	0	0	0	115.3	N420	P418-N420 VanDerWaalsContact C-N 3.3Å; P418-N420 PolarHBondContact O-N 3.04Å
419	Y	73.4	Confident	82.7	Confident	130 Å²	130	60 Å²	60	51%	0.51	32%	0.321	S	S	.	.			trans	-88.5	24.4	-169.1	-54.3	-74.4	0	0	0	114.9	A416 L421	A416-Y419 CarbonylContact O-C 3.23Å; A416-Y419 WeakPolarHBondContact O-CA 3.4Å; A416-Y419 WeakPolarHBondContact O-CB 3.14Å; A416-Y419 PolarHBondContact O-N 2.93Å; Y419-L421 PolarHBondContact O-N 3.01Å
420	N	77.6	Confident	82.8	Confident	7 Å²	7	59.5 Å²	59.5	4%	0.037	32%	0.317	C	S	.	.			trans	-81.7	61.8	173.3	-60.7	-26.2	0	0	0	110.6	T409 R411 Y413 G414 A416 E417 P418	T409-N420 HydrophobicContact CG2-CB 4.39Å; T409-N420 WeakPolarHBondContact CG2-ND2 3.29Å; R411-N420 CarbonylContact C-O 3.51Å; Y413-N420 CarbonylContact O-C 3.47Å; Y413-N420 WeakPolarHBondContact O-CA 3.33Å; G414-N420 VanDerWaalsContact C-OD1 3.31Å; G414-N420 VanDerWaalsContact CA-OD1 3.22Å; G414-N420 WeakPolarHBondContact CA-OD1 3.48Å; G414-N420 PolarHBondContact O-OD1 3.2Å; A416-N420 PolarHBondContact O-OD1 2.93Å; E417-N420 WeakPolarHBondContact CG-ND2 3.25Å; P418-N420 VanDerWaalsContact C-N 3.3Å; P418-N420 PolarHBondContact O-N 3.04Å
421	L	79.7	Confident	83	Confident	102 Å²	102	57.2 Å²	57.2	53%	0.534	29%	0.286	S	S	.	.			trans	-105.3	-7.1	-166.3	-62.7	170.9	0	0	0	113.8	Y413 Y419	Y413-L421 PolarHBondContact O-N 2.94Å; Y419-L421 PolarHBondContact O-N 3.01Å
422	Y	85.6	Confident	83.3	Confident	29 Å²	29	49 Å²	49	11%	0.114	25%	0.254	C	S	.	.	B	Isolated β-bridge	trans	-88.9	130.9	-173.8	-54.5	-73.7	0	0	0	111.1	G412 Y413 S424 E427 L428 H431 Y432	G412-Y422 CarbonylContact C-O 3.41Å; G412-Y422 WeakPolarHBondContact CA-O 3.4Å; Y413-Y422 PolarHBondContact N-O 3.19Å; Y413-Y422 VanDerWaalsContact O-CD2 3.3Å; Y413-Y422 WeakPolarHBondContact O-CD2 3.47Å; Y413-Y422 PolarHBondContact O-N 2.88Å; Y422-S424 VanDerWaalsContact C-N 3.26Å; Y422-S424 PolarHBondContact O-N 3.09Å; Y422-E427 HydrophobicContact CD1-CG 4.15Å; Y422-L428 HydrophobicContact CD2-CB 3.85Å; Y422-L428 HydrophobicContact CD2-CD1 3.98Å; Y422-L428 HydrophobicContact CD2-CG 3.89Å; Y422-L428 HydrophobicContact CE2-CG 4.38Å; Y422-L428 HydrophobicContact CG-CB 3.85Å; Y422-L428 HydrophobicContact CG-CG 4.41Å; Y422-H431 HydrophobicContact CD1-CB 4.39Å; Y422-H431 HydrophobicContact CE1-CB 3.61Å; Y422-H431 AromaticContact CE1-CG 3.61Å; Y422-H431 AromaticContact CZ-CD2 3.64Å; Y422-H431 AromaticContact CZ-CG 3.73Å; Y422-H431 PolarHBondContact OH-CD2 2.94Å; Y422-H431 VanDerWaalsContact OH-CG 3.31Å; Y422-H431 PolarHBondContact OH-NE2 2.9Å; Y422-Y432 AromaticContact CE2-CE2 3.71Å; Y422-Y432 HydrophobicContact CE2-CE2 3.71Å; Y422-Y432 PolarHBondContact OH-OH 3.26Å
423	S	83.9	Confident	83.2	Confident	94 Å²	94	49.7 Å²	49.7	66%	0.657	26%	0.256	S	S	*	.	S	Bend	trans	-71.2	-21.4	-176.4	67.2	0	0	0	0	113.3	E427	S423-E427 WeakPolarHBondContact CB-OE2 3.42Å; S423-E427 PolarHBondContact N-OE2 3.36Å; S423-E427 PolarHBondContact OG-OE2 3.35Å
424	S	88.6	Confident	82.8	Confident	41 Å²	41	50.7 Å²	50.7	29%	0.287	26%	0.262	S	S	.	.	S	Bend	trans	-146.2	160.6	177.6	64	0	0	0	0	111.8	Y422 K426 E427 L428	Y422-S424 VanDerWaalsContact C-N 3.26Å; Y422-S424 PolarHBondContact O-N 3.09Å; S424-K426 PolarHBondContact O-N 3.01Å; S424-E427 PolarHBondContact O-N 3.08Å; S424-E427 WeakPolarHBondContact OG-CB 3.42Å; S424-E427 PolarHBondContact OG-N 3.07Å; S424-L428 PolarHBondContact O-N 3.26Å
425	L	87.3	Confident	82.5	Confident	19 Å²	19	52.2 Å²	52.2	10%	0.099	27%	0.272	C	S	.	.	H	α-helix	trans	-58.8	-35.3	171.1	-70.5	174.9	0	0	0	111.9	W358 F359 I382 Y391 I406 Y413 L428 V429	W358-L425 HydrophobicContact CH2-CB 3.98Å; W358-L425 HydrophobicContact CZ3-CB 4.19Å; F359-L425 HydrophobicContact CD2-CD1 4.41Å; F359-L425 HydrophobicContact CE2-CD1 4Å; I382-L425 HydrophobicContact CG2-CD1 4.39Å; Y391-L425 HydrophobicContact CD1-CD1 3.85Å; Y391-L425 HydrophobicContact CD2-CD1 3.93Å; Y391-L425 HydrophobicContact CD2-CD2 4.07Å; Y391-L425 HydrophobicContact CD2-CG 4.44Å; Y391-L425 HydrophobicContact CE1-CD1 3.87Å; Y391-L425 HydrophobicContact CE2-CD1 3.97Å; Y391-L425 HydrophobicContact CG-CD1 3.87Å; Y391-L425 HydrophobicContact CG-CD2 4.24Å; I406-L425 HydrophobicContact CD1-CD2 4.14Å; I406-L425 HydrophobicContact CG2-CD2 3.86Å; Y413-L425 HydrophobicContact CD1-CD2 3.59Å; Y413-L425 HydrophobicContact CD1-CG 3.98Å; Y413-L425 HydrophobicContact CE1-CD2 4.1Å; Y413-L425 HydrophobicContact CE1-CG 4.05Å; Y413-L425 HydrophobicContact CG-CD2 4.03Å; Y413-L425 HydrophobicContact CG-CG 4.36Å; L425-L428 WeakPolarHBondContact O-CB 3.37Å; L425-L428 PolarHBondContact O-N 3.21Å; L425-V429 WeakPolarHBondContact O-CG2 3.47Å; L425-V429 PolarHBondContact O-N 2.98Å
426	K	88.5	Confident	82.4	Confident	60 Å²	60	52.3 Å²	52.3	26%	0.261	27%	0.274	S	S	.	.	H	α-helix	trans	-62	-45.3	177	177.1	173.2	173.9	163.2	0	112.2	Y353 E355 W358 S424 L428 V429 L430	Y353-K426 VanDerWaalsContact O-CE 3.32Å; Y353-K426 WeakPolarHBondContact O-CE 3.37Å; Y353-K426 PolarHBondContact O-NZ 3.35Å; E355-K426 HydrophobicContact CG-CD 4.35Å; W358-K426 HydrophobicContact CH2-CB 4.32Å; W358-K426 HydrophobicContact CZ2-CB 4Å; W358-K426 HydrophobicContact CZ2-CG 4.41Å; S424-K426 PolarHBondContact O-N 3.01Å; K426-L428 VanDerWaalsContact C-N 3.31Å; K426-L428 PolarHBondContact O-N 2.92Å; K426-V429 PolarHBondContact O-N 3.3Å; K426-L430 HydrophobicContact CG-CD1 4.11Å; K426-L430 WeakPolarHBondContact O-CG 3.45Å; K426-L430 PolarHBondContact O-N 2.93Å
427	E	85.1	Confident	82.4	Confident	86 Å²	86	50.7 Å²	50.7	40%	0.402	26%	0.261	S	S	.	.	H	α-helix	trans	-64.6	-38.8	177.7	-168.8	-179.9	-163.4	0	0	111.6	Y422 S423 S424 L430 H431	Y422-E427 HydrophobicContact CD1-CG 4.15Å; S423-E427 WeakPolarHBondContact CB-OE2 3.42Å; S423-E427 PolarHBondContact N-OE2 3.36Å; S423-E427 PolarHBondContact OG-OE2 3.35Å; S424-E427 PolarHBondContact O-N 3.08Å; S424-E427 WeakPolarHBondContact OG-CB 3.42Å; S424-E427 PolarHBondContact OG-N 3.07Å; E427-L430 PolarHBondContact O-N 2.8Å; E427-H431 PolarHBondContact O-N 3.25Å
428	L	88.5	Confident	82.7	Confident	0 Å²	0	45.5 Å²	45.5	0%	0	24%	0.24	C	C	.	.	H	α-helix	trans	-59.2	-46.8	172.6	-178.2	156	0	0	0	111.3	I406 F415 Y422 S424 L425 K426 H431 Y432	I406-L428 HydrophobicContact CD1-CD2 4.21Å; I406-L428 HydrophobicContact CG2-CD1 3.85Å; F415-L428 HydrophobicContact CE2-CD2 3.8Å; F415-L428 HydrophobicContact CE2-CG 4.43Å; F415-L428 HydrophobicContact CZ-CD2 3.95Å; Y422-L428 HydrophobicContact CD2-CB 3.85Å; Y422-L428 HydrophobicContact CD2-CD1 3.98Å; Y422-L428 HydrophobicContact CD2-CG 3.89Å; Y422-L428 HydrophobicContact CE2-CG 4.38Å; Y422-L428 HydrophobicContact CG-CB 3.85Å; Y422-L428 HydrophobicContact CG-CG 4.41Å; S424-L428 PolarHBondContact O-N 3.26Å; L425-L428 WeakPolarHBondContact O-CB 3.37Å; L425-L428 PolarHBondContact O-N 3.21Å; K426-L428 VanDerWaalsContact C-N 3.31Å; K426-L428 PolarHBondContact O-N 2.92Å; L428-H431 PolarHBondContact O-N 3.36Å; L428-Y432 HydrophobicContact CD2-CD2 3.85Å; L428-Y432 HydrophobicContact CD2-CE2 4.33Å; L428-Y432 HydrophobicContact CG-CD2 3.91Å; L428-Y432 HydrophobicContact CG-CE2 4Å; L428-Y432 VanDerWaalsContact O-CD2 3.24Å; L428-Y432 WeakPolarHBondContact O-CD2 3.37Å; L428-Y432 PolarHBondContact O-N 3.32Å
429	V	89.3	Confident	82.6	Confident	0 Å²	0	48.1 Å²	48.1	0%	0	25%	0.245	C	C	.	.	H	α-helix	trans	-62.5	-46.5	178	168.9	0	0	0	0	111.7	H352 W358 F380 I382 L425 K426 H431 Y432 Q433 L448	H352-V429 HydrophobicContact CB-CG1 4.28Å; W358-V429 HydrophobicContact CD2-CG1 4.35Å; W358-V429 HydrophobicContact CD2-CG2 4.01Å; W358-V429 HydrophobicContact CE3-CG2 3.88Å; W358-V429 HydrophobicContact CG-CG1 4.46Å; W358-V429 HydrophobicContact CH2-CG2 4.04Å; W358-V429 HydrophobicContact CZ2-CB 4.34Å; W358-V429 HydrophobicContact CZ2-CG2 4.14Å; W358-V429 HydrophobicContact CZ3-CG2 3.9Å; F380-V429 HydrophobicContact CE2-CG1 3.86Å; F380-V429 HydrophobicContact CE2-CG2 3.98Å; F380-V429 HydrophobicContact CZ-CG1 3.52Å; F380-V429 HydrophobicContact CZ-CG2 4.49Å; I382-V429 HydrophobicContact CD1-CG2 3.41Å; I382-V429 VanDerWaalsContact CD1-CG2 3.41Å; L425-V429 WeakPolarHBondContact O-CG2 3.47Å; L425-V429 PolarHBondContact O-N 2.98Å; K426-V429 PolarHBondContact O-N 3.3Å; V429-H431 PolarHBondContact O-N 2.8Å; V429-Y432 PolarHBondContact O-N 2.83Å; V429-Q433 PolarHBondContact O-N 3.02Å; V429-L448 HydrophobicContact CG2-CD1 4.27Å
430	L	85.1	Confident	82.6	Confident	34 Å²	34	44.5 Å²	44.5	18%	0.178	23%	0.232	C	C	.	.	H	α-helix	trans	-63.5	-27.6	179	-72	172.4	0	0	0	112.9	H352 Y353 K426 E427 Q433	H352-L430 HydrophobicContact CB-CD2 3.91Å; Y353-L430 HydrophobicContact CD1-CD1 4.25Å; Y353-L430 HydrophobicContact CD1-CD2 4.47Å; Y353-L430 HydrophobicContact CD2-CD2 4.18Å; Y353-L430 HydrophobicContact CE1-CD1 3.92Å; Y353-L430 HydrophobicContact CE1-CD2 4.31Å; Y353-L430 HydrophobicContact CE2-CD2 3.98Å; Y353-L430 HydrophobicContact CG-CD2 4.41Å; K426-L430 HydrophobicContact CG-CD1 4.11Å; K426-L430 WeakPolarHBondContact O-CG 3.45Å; K426-L430 PolarHBondContact O-N 2.93Å; E427-L430 PolarHBondContact O-N 2.8Å; L430-Q433 VanDerWaalsContact O-CG 3.28Å; L430-Q433 WeakPolarHBondContact O-CG 3.46Å; L430-Q433 PolarHBondContact O-NE2 3.37Å
431	H	84.2	Confident	82.4	Confident	71 Å²	71	47.8 Å²	47.8	33%	0.329	25%	0.25	S	S	.	.	H	α-helix	trans	-75.5	-51.5	172.8	-175.9	84.6	0	0	0	111.8	Y422 E427 L428 V429 Q433 Q434 T435	Y422-H431 HydrophobicContact CD1-CB 4.39Å; Y422-H431 HydrophobicContact CE1-CB 3.61Å; Y422-H431 AromaticContact CE1-CG 3.61Å; Y422-H431 AromaticContact CZ-CD2 3.64Å; Y422-H431 AromaticContact CZ-CG 3.73Å; Y422-H431 PolarHBondContact OH-CD2 2.94Å; Y422-H431 VanDerWaalsContact OH-CG 3.31Å; Y422-H431 PolarHBondContact OH-NE2 2.9Å; E427-H431 PolarHBondContact O-N 3.25Å; L428-H431 PolarHBondContact O-N 3.36Å; V429-H431 PolarHBondContact O-N 2.8Å; H431-Q433 PolarHBondContact O-N 2.84Å; H431-Q434 PolarHBondContact O-N 3.35Å; H431-T435 PolarHBondContact NE2-OG1 3.14Å; H431-T435 PolarHBondContact O-N 2.89Å
432	Y	84.9	Confident	82	Confident	3 Å²	3	49.9 Å²	49.9	1%	0.012	26%	0.262	C	S	.	.	H	α-helix	trans	-77.2	-3	-176.6	-70.1	-67.6	0	0	0	114.7	F415 Y422 L428 V429 Q434 T435 L437 H440 L448	F415-Y432 HydrophobicContact CD2-CD2 4.14Å; F415-Y432 AromaticContact CD2-CE2 3.69Å; F415-Y432 HydrophobicContact CD2-CE2 3.69Å; F415-Y432 AromaticContact CE2-CD2 3.58Å; F415-Y432 HydrophobicContact CE2-CD2 3.58Å; F415-Y432 AromaticContact CE2-CE2 3.61Å; F415-Y432 HydrophobicContact CE2-CE2 3.61Å; F415-Y432 HydrophobicContact CE2-CG 4.18Å; Y422-Y432 AromaticContact CE2-CE2 3.71Å; Y422-Y432 HydrophobicContact CE2-CE2 3.71Å; Y422-Y432 PolarHBondContact OH-OH 3.26Å; L428-Y432 HydrophobicContact CD2-CD2 3.85Å; L428-Y432 HydrophobicContact CD2-CE2 4.33Å; L428-Y432 HydrophobicContact CG-CD2 3.91Å; L428-Y432 HydrophobicContact CG-CE2 4Å; L428-Y432 VanDerWaalsContact O-CD2 3.24Å; L428-Y432 WeakPolarHBondContact O-CD2 3.37Å; L428-Y432 PolarHBondContact O-N 3.32Å; V429-Y432 PolarHBondContact O-N 2.83Å; Y432-Q434 VanDerWaalsContact C-N 3.29Å; Y432-T435 CarbonylContact C-O 3.5Å; Y432-T435 WeakPolarHBondContact CA-O 3.41Å; Y432-L437 HydrophobicContact CD1-CD2 3.58Å; Y432-L437 HydrophobicContact CD1-CG 4.41Å; Y432-L437 HydrophobicContact CD2-CD2 4.38Å; Y432-L437 HydrophobicContact CE1-CD2 4.07Å; Y432-L437 HydrophobicContact CG-CD2 3.8Å; Y432-H440 AromaticContact CE1-NE2 3.72Å; Y432-H440 AromaticContact CZ-NE2 3.42Å; Y432-H440 PolarHBondContact OH-NE2 3Å; Y432-L448 PolarHBondContact O-N 2.93Å
433	Q	84.8	Confident	81.1	Confident	23 Å²	23	51.8 Å²	51.8	11%	0.107	28%	0.28	C	S	.	.	T	Hydrogen-bonded Turn	trans	-68.4	-32.6	162.1	86.5	-173.3	-34.7	0	0	111	L350 H352 V429 L430 H431 R447 L448	L350-Q433 VanDerWaalsContact CD1-OE1 3.25Å; H352-Q433 VanDerWaalsContact CG-OE1 3.23Å; H352-Q433 PolarHBondContact ND1-OE1 2.77Å; V429-Q433 PolarHBondContact O-N 3.02Å; L430-Q433 VanDerWaalsContact O-CG 3.28Å; L430-Q433 WeakPolarHBondContact O-CG 3.46Å; L430-Q433 PolarHBondContact O-NE2 3.37Å; H431-Q433 PolarHBondContact O-N 2.84Å; Q433-R447 WeakPolarHBondContact O-CD 3.36Å; Q433-L448 WeakPolarHBondContact CA-O 3.39Å; Q433-L448 VanDerWaalsContact CB-O 3.32Å; Q433-L448 WeakPolarHBondContact CB-O 3.46Å
434	Q	77.7	Confident	80.7	Confident	73 Å²	73	47.6 Å²	47.6	34%	0.341	25%	0.25	S	C	.	.	T	Hydrogen-bonded Turn	trans	-98.3	-26.3	-178.4	-66.1	-179.8	-5.5	0	0	111.9	D347 H431 Y432 R447	D347-Q434 PolarHBondContact OD2-NE2 3.1Å; D347-Q434 VanDerWaalsContact OD2-NE2 3.11Å; H431-Q434 PolarHBondContact O-N 3.35Å; Y432-Q434 VanDerWaalsContact C-N 3.29Å; Q434-R447 PolarHBondContact O-NE 3.45Å; Q434-R447 PolarHBondContact O-NH1 3.06Å
435	T	80.2	Confident	80.3	Confident	33 Å²	33	51.1 Å²	51.1	20%	0.202	27%	0.266	C	S	.	.	S	Bend	trans	-110.6	131.7	-177.5	-54.3	0	0	0	0	111.6	H431 Y432	H431-T435 PolarHBondContact NE2-OG1 3.14Å; H431-T435 PolarHBondContact O-N 2.89Å; Y432-T435 CarbonylContact C-O 3.5Å; Y432-T435 WeakPolarHBondContact CA-O 3.41Å
436	S	82.6	Confident	80	Confident	19 Å²	19	50.9 Å²	50.9	13%	0.133	27%	0.265	C	S	.	.			trans	-68.9	141.9	179	-179.2	0	0	0	0	111.7	V438 N445	S436-V438 PolarHBondContact O-N 3.47Å; S436-V438 PolarHBondContact OG-N 3.48Å; S436-N445 PolarHBondContact OG-OD1 2.88Å
437	L	81.4	Confident	80	Confident	2 Å²	2	54.3 Å²	54.3	1%	0.01	28%	0.276	C	S	.	.	G	3₁₀ helix	trans	-70.8	-4.3	175.9	-69.8	173.3	0	0	0	113.6	V395 F415 Y432 Q439 H440 N441 L444 V446 L448	V395-L437 HydrophobicContact CG1-CD1 4.29Å; F415-L437 HydrophobicContact CD2-CD2 3.87Å; F415-L437 HydrophobicContact CE2-CD2 3.42Å; F415-L437 VanDerWaalsContact CE2-CD2 3.42Å; F415-L437 HydrophobicContact CZ-CD2 3.94Å; Y432-L437 HydrophobicContact CD1-CD2 3.58Å; Y432-L437 HydrophobicContact CD1-CG 4.41Å; Y432-L437 HydrophobicContact CD2-CD2 4.38Å; Y432-L437 HydrophobicContact CE1-CD2 4.07Å; Y432-L437 HydrophobicContact CG-CD2 3.8Å; L437-Q439 PolarHBondContact O-N 3.17Å; L437-H440 PolarHBondContact O-N 3.36Å; L437-N441 PolarHBondContact O-N 3.48Å; L437-L444 CarbonylContact C-O 3.59Å; L437-L444 VanDerWaalsContact C-O 3.23Å; L437-L444 HydrophobicContact CB-CB 3.85Å; L437-L444 HydrophobicContact CB-CD1 4.5Å; L437-L444 WeakPolarHBondContact CB-O 3.19Å; L437-V446 PolarHBondContact N-O 2.87Å; L437-L448 HydrophobicContact CD1-CD2 3.96Å
438	V	78	Confident	80.1	Confident	49 Å²	49	50.2 Å²	50.2	30%	0.297	26%	0.257	S	S	.	.	G	3₁₀ helix	trans	-53.5	-29	178	70.8	0	0	0	0	112.6	S436 H440 N441 L444	S436-V438 PolarHBondContact O-N 3.47Å; S436-V438 PolarHBondContact OG-N 3.48Å; V438-H440 PolarHBondContact O-N 3.3Å; V438-N441 WeakPolarHBondContact CA-O 3.45Å; V438-N441 CarbonylContact O-C 3.58Å; V438-N441 PolarHBondContact O-N 3.25Å; V438-L444 PolarHBondContact N-O 3.42Å
439	Q	68.6	Low	79.9	Confident	136 Å²	136	51.9 Å²	51.9	64%	0.636	27%	0.271	S	S	*	.	G	3₁₀ helix	trans	-62.7	-23	178.4	-62.8	-178.7	-9.5	0	0	113.6	L437	L437-Q439 PolarHBondContact O-N 3.17Å
440	H	73.1	Confident	79.9	Confident	53 Å²	53	56.4 Å²	56.4	25%	0.245	29%	0.288	C	S	.	.	T	Hydrogen-bonded Turn	trans	-104.6	-24.4	179.6	-61.7	-65.3	0	0	0	112.9	F415 Y432 L437 V438	F415-H440 HydrophobicContact CB-CB 4.4Å; F415-H440 AromaticContact CD2-CD2 3.98Å; Y432-H440 AromaticContact CE1-NE2 3.72Å; Y432-H440 AromaticContact CZ-NE2 3.42Å; Y432-H440 PolarHBondContact OH-NE2 3Å; L437-H440 PolarHBondContact O-N 3.36Å; V438-H440 PolarHBondContact O-N 3.3Å
441	N	72.4	Confident	80.2	Confident	77 Å²	77	54.9 Å²	54.9	41%	0.412	28%	0.28	S	S	.	.			trans	-158.3	120.8	177.1	-173.7	-22.9	0	0	0	109.5	L437 V438 S443 L444	L437-N441 PolarHBondContact O-N 3.48Å; V438-N441 WeakPolarHBondContact CA-O 3.45Å; V438-N441 CarbonylContact O-C 3.58Å; V438-N441 PolarHBondContact O-N 3.25Å; N441-S443 PolarHBondContact O-N 3.1Å; N441-S443 WeakPolarHBondContact OD1-CB 3.36Å; N441-S443 PolarHBondContact OD1-N 2.97Å; N441-S443 PolarHBondContact OD1-OG 2.8Å; N441-L444 HydrophobicContact CB-CB 4.29Å; N441-L444 HydrophobicContact CB-CD1 3.75Å; N441-L444 HydrophobicContact CB-CG 3.96Å; N441-L444 PolarHBondContact O-N 3.47Å
442	D	71.2	Confident	80.3	Confident	145 Å²	145	52.2 Å²	52.2	78%	0.775	27%	0.269	S	S	*	.	T	Hydrogen-bonded Turn	trans	-57.4	-21.7	179.9	-63.3	-36.5	0	0	0	113.2	L444	D442-L444 VanDerWaalsContact C-N 3.31Å
443	S	67.9	Low	80.2	Confident	70 Å²	70	57.2 Å²	57.2	49%	0.49	29%	0.292	S	S	.	.	T	Hydrogen-bonded Turn	trans	-82.8	0.6	175.3	-53.6	0	0	0	0	114	K402 N441	K402-S443 PolarHBondContact NZ-O 3.13Å; N441-S443 PolarHBondContact O-N 3.1Å; N441-S443 WeakPolarHBondContact OD1-CB 3.36Å; N441-S443 PolarHBondContact OD1-N 2.97Å; N441-S443 PolarHBondContact OD1-OG 2.8Å
444	L	75.8	Confident	80.1	Confident	6 Å²	6	57.1 Å²	57.1	3%	0.031	30%	0.295	C	S	.	.			trans	-116.5	56.5	-179	-66	175	0	0	0	111.3	V395 A397 K402 C404 L437 V438 N441 D442 V446	V395-L444 HydrophobicContact CG1-CD2 4.3Å; A397-L444 HydrophobicContact CB-CD2 4.44Å; K402-L444 HydrophobicContact CB-CD2 3.66Å; K402-L444 HydrophobicContact CD-CD2 3.41Å; K402-L444 VanDerWaalsContact CD-CD2 3.41Å; K402-L444 HydrophobicContact CD-CG 4.47Å; K402-L444 HydrophobicContact CG-CD2 4.13Å; C404-L444 WeakPolarHBondContact SG-CD1 3.38Å; L437-L444 CarbonylContact C-O 3.59Å; L437-L444 VanDerWaalsContact C-O 3.23Å; L437-L444 HydrophobicContact CB-CB 3.85Å; L437-L444 HydrophobicContact CB-CD1 4.5Å; L437-L444 WeakPolarHBondContact CB-O 3.19Å; V438-L444 PolarHBondContact N-O 3.42Å; N441-L444 HydrophobicContact CB-CB 4.29Å; N441-L444 HydrophobicContact CB-CD1 3.75Å; N441-L444 HydrophobicContact CB-CG 3.96Å; N441-L444 PolarHBondContact O-N 3.47Å; D442-L444 VanDerWaalsContact C-N 3.31Å; L444-V446 PolarHBondContact O-N 3.47Å
445	N	79.5	Confident	79.3	Confident	115 Å²	115	62.9 Å²	62.9	62%	0.615	32%	0.322	S	S	*	.			trans	-77.5	55.7	175	-169.1	25.1	0	0	0	112.6	S436	S436-N445 PolarHBondContact OG-OD1 2.88Å
446	V	81.6	Confident	78.3	Confident	13 Å²	13	64.4 Å²	64.4	8%	0.079	33%	0.328	C	S	.	.			trans	-137.3	158.3	179.6	-66.9	0	0	0	0	110.8	D377 V395 A397 L437 L444	D377-V446 HydrophobicContact CB-CG1 4.39Å; V395-V446 HydrophobicContact CG1-CG2 4.49Å; V395-V446 HydrophobicContact CG2-CG2 3.88Å; A397-V446 HydrophobicContact CB-CB 4.29Å; A397-V446 HydrophobicContact CB-CG1 3.57Å; A397-V446 HydrophobicContact CB-CG2 3.7Å; L437-V446 PolarHBondContact N-O 2.87Å; L444-V446 PolarHBondContact O-N 3.47Å
447	R	87.4	Confident	76.6	Confident	133 Å²	133	68.2 Å²	68.2	50%	0.502	35%	0.352	S	S	.	.			trans	-107.8	158.7	172.6	-61.1	179.8	-172.2	-164.5	-3.1	109.1	G378 Q433 Q434 A449	G378-R447 WeakPolarHBondContact CA-O 3.33Å; Q433-R447 WeakPolarHBondContact O-CD 3.36Å; Q434-R447 PolarHBondContact O-NE 3.45Å; Q434-R447 PolarHBondContact O-NH1 3.06Å; R447-A449 PolarHBondContact O-N 2.8Å
448	L	88.3	Confident	74.6	Confident	0 Å²	0	73.6 Å²	73.6	0%	0	39%	0.39	C	S	.	.			trans	-76.7	72.5	171.3	-58.9	-173.9	0	0	0	109	H352 F380 V395 V429 Y432 Q433 L437	H352-L448 PolarHBondContact NE2-O 2.72Å; F380-L448 HydrophobicContact CB-CD2 3.71Å; F380-L448 HydrophobicContact CD1-CB 3.68Å; F380-L448 HydrophobicContact CD1-CD2 4.23Å; F380-L448 HydrophobicContact CD1-CG 4.48Å; F380-L448 HydrophobicContact CD2-CB 4.17Å; F380-L448 HydrophobicContact CD2-CD1 4.12Å; F380-L448 HydrophobicContact CD2-CD2 3.87Å; F380-L448 HydrophobicContact CD2-CG 4.27Å; F380-L448 HydrophobicContact CE1-CB 3.69Å; F380-L448 HydrophobicContact CE2-CB 4.18Å; F380-L448 HydrophobicContact CE2-CD1 4.12Å; F380-L448 HydrophobicContact CG-CB 3.94Å; F380-L448 HydrophobicContact CG-CD2 3.67Å; F380-L448 HydrophobicContact CG-CG 4.26Å; F380-L448 HydrophobicContact CZ-CB 3.96Å; V395-L448 HydrophobicContact CB-CD2 4.39Å; V395-L448 HydrophobicContact CG2-CD2 4.14Å; V429-L448 HydrophobicContact CG2-CD1 4.27Å; Y432-L448 PolarHBondContact O-N 2.93Å; Q433-L448 WeakPolarHBondContact CA-O 3.39Å; Q433-L448 VanDerWaalsContact CB-O 3.32Å; Q433-L448 WeakPolarHBondContact CB-O 3.46Å; L437-L448 HydrophobicContact CD1-CD2 3.96Å
449	A	84.2	Confident	72.9	Confident	35 Å²	35	78.8 Å²	78.8	29%	0.289	42%	0.415	S	S	.	.			trans	-90.8	-30.9	-166.3	0	0	0	0	0	113.7	H352 G378 R447	H352-A449 PolarHBondContact CE1-O 3.49Å; H352-A449 PolarHBondContact NE2-O 2.97Å; G378-A449 PolarHBondContact O-N 3.05Å; R447-A449 PolarHBondContact O-N 2.8Å
450	Y	89	Confident	71.1	Confident	94 Å²	94	78.3 Å²	78.3	37%	0.369	43%	0.425	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-131.1	104	-174.1	-49.5	-72.1	0	0	0	111.1	P376 G378 A379 F380 M456	P376-Y450 HydrophobicContact CG-CD2 4.06Å; P376-Y450 HydrophobicContact CG-CE2 4.29Å; G378-Y450 PolarHBondContact O-N 2.94Å; G378-Y450 VanDerWaalsContact O-N 3.09Å; A379-Y450 CarbonylContact C-O 3.55Å; A379-Y450 VanDerWaalsContact CA-O 3.29Å; A379-Y450 WeakPolarHBondContact CA-O 3.42Å; F380-Y450 WeakPolarHBondContact CD1-O 3.23Å; F380-Y450 PolarHBondContact N-O 3.08Å; Y450-M456 HydrophobicContact CD1-SD 4.32Å; Y450-M456 HydrophobicContact CG-CE 4.4Å; Y450-M456 HydrophobicContact CG-SD 4.23Å
451	P	90.5	Very high	69	Low	2 Å²	2	91 Å²	91	1%	0.013	47%	0.471	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-60	137.2	172	-26.8	39.2	0	0	0	110.6	P351 H352 T357 W358 F380 H453 A454	P351-P451 HydrophobicContact CB-CG 4.11Å; H352-P451 WeakPolarHBondContact NE2-CD 3.43Å; T357-P451 CarbonylContact O-C 3.6Å; T357-P451 VanDerWaalsContact O-CB 3.22Å; T357-P451 WeakPolarHBondContact O-CB 3.43Å; T357-P451 WeakPolarHBondContact OG1-CB 3.3Å; W358-P451 HydrophobicContact CB-CB 3.91Å; F380-P451 HydrophobicContact CE1-CB 4.34Å; F380-P451 HydrophobicContact CE1-CG 3.89Å; F380-P451 HydrophobicContact CZ-CB 4.49Å; F380-P451 HydrophobicContact CZ-CG 4.13Å; P451-H453 PolarHBondContact O-N 2.86Å; P451-H453 VanDerWaalsContact O-N 3.09Å; P451-A454 HydrophobicContact CB-CB 3.97Å; P451-A454 HydrophobicContact CG-CB 4.28Å; P451-A454 WeakPolarHBondContact O-CB 3.5Å; P451-A454 PolarHBondContact O-N 3.29Å
452	V	86.6	Confident	68.9	Low	15 Å²	15	91.7 Å²	91.7	9%	0.091	47%	0.474	C	S	.	.	T	Hydrogen-bonded Turn	trans	-55.1	-31.7	-173.2	67.4	0	0	0	0	114.6	T357 V360 L371 L372 F380 L381	T357-V452 PolarHBondContact O-N 3.3Å; V360-V452 HydrophobicContact CG2-CG1 4.28Å; L371-V452 HydrophobicContact CB-CG2 4.28Å; L372-V452 HydrophobicContact CD2-CG2 4.26Å; F380-V452 PolarHBondContact O-N 3.07Å; L381-V452 HydrophobicContact CB-CB 4.09Å; L381-V452 HydrophobicContact CB-CG1 3.75Å; L381-V452 HydrophobicContact CD2-CB 4.36Å; L381-V452 HydrophobicContact CD2-CG1 4.29Å; L381-V452 HydrophobicContact CD2-CG2 4.21Å
453	H	84.1	Confident	68.7	Low	108 Å²	108	88.8 Å²	88.8	50%	0.5	46%	0.458	S	S	.	.	T	Hydrogen-bonded Turn	trans	-103.3	6.1	179.6	-60.4	-53.9	0	0	0	113.9	K356 T357 P451	K356-H453 PolarHBondContact O-CD2 3.17Å; T357-H453 PolarHBondContact O-N 3.38Å; P451-H453 PolarHBondContact O-N 2.86Å; P451-H453 VanDerWaalsContact O-N 3.09Å
454	A	80.9	Confident	68.8	Low	21 Å²	21	89.9 Å²	89.9	17%	0.174	46%	0.456	C	S	.	.	S	Bend	trans	-73	144.5	171.7	0	0	0	0	0	111.1	P351 P451 M456	P351-A454 HydrophobicContact CB-CB 3.55Å; P351-A454 HydrophobicContact CG-CB 3.91Å; P451-A454 HydrophobicContact CB-CB 3.97Å; P451-A454 HydrophobicContact CG-CB 4.28Å; P451-A454 WeakPolarHBondContact O-CB 3.5Å; P451-A454 PolarHBondContact O-N 3.29Å; A454-M456 PolarHBondContact O-N 3.39Å; A454-M456 VanDerWaalsContact O-N 3.1Å
455	Q	61.9	Low	68.4	Low	194 Å²	194	94.8 Å²	94.8	91%	0.907	48%	0.482	S	S	*	.			trans	-65.5	112.3	170.4	-74.7	-175.7	-5.7	0	0	108.9
456	M	59	Low	67.7	Low	66 Å²	66	93.6 Å²	93.6	33%	0.325	47%	0.473	S	S	.	.			trans	-64.1	134.4	177.9	-73.6	-88.7	-174.2	0	0	109.9	K375 P376 A379 Y450 A454 S458	K375-M456 HydrophobicContact CD-CE 3.98Å; P376-M456 HydrophobicContact CG-CE 3.71Å; P376-M456 HydrophobicContact CG-SD 3.8Å; A379-M456 HydrophobicContact CB-CE 4.27Å; Y450-M456 HydrophobicContact CD1-SD 4.32Å; Y450-M456 HydrophobicContact CG-CE 4.4Å; Y450-M456 HydrophobicContact CG-SD 4.23Å; A454-M456 PolarHBondContact O-N 3.39Å; A454-M456 VanDerWaalsContact O-N 3.1Å; M456-S458 PolarHBondContact O-N 3.11Å
457	P	47.9	Very low	66.7	Low	98 Å²	98	98.9 Å²	98.9	64%	0.636	50%	0.499	S	S	*	.			trans	-59.5	126.3	165.1	-15.1	27.8	0	0	0	108.6	L459	P457-L459 PolarHBondContact O-N 3.4Å
458	S	39.2	Very low	65.3	Low	115 Å²	115	96.5 Å²	96.5	80%	0.804	50%	0.499	S	S	*	.			trans	-56.9	115.6	174.8	-36	0	0	0	0	108.9	M456 C460	M456-S458 PolarHBondContact O-N 3.11Å; S458-C460 PolarHBondContact O-N 3.45Å
459	L	41.5	Very low	63.5	Low	158 Å²	158	103.9 Å²	103.9	83%	0.827	54%	0.538	S	S	*	.			trans	-62.8	99.8	168.6	-87	140.9	0	0	0	108.2	P457 R461	P457-L459 PolarHBondContact O-N 3.4Å; L459-R461 PolarHBondContact O-N 2.99Å
460	C	30.2	Very low	61.8	Low	126 Å²	126	109.7 Å²	109.7	85%	0.851	56%	0.558	S	S	*	*			trans	-60.3	119.8	160.5	-75.7	0	0	0	0	107.4	S458	S458-C460 PolarHBondContact O-N 3.45Å
461	R	30.4	Very low	59.3	Low	319 Å²	319	111.1 Å²	111.1	100%	1.204	58%	0.576	S	S	*	*			trans	-69	0	175.1	-113.8	-175.2	-177.2	-175.7	1.2	112.1	L459	L459-R461 PolarHBondContact O-N 2.99Å

Retrieved 461 of 461 residues in 165.9 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).