A0A087YAI4_POEFO Loading...

Beta-1,3-N-acetylglucosaminyltransferase

AlphaFold DB , UniProt , Accession A0A087YAI4, Species POEFO (Poecilia formosa, Amazon molly), Gene n/a, Length 367 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	I	37	Very low	26.5	Very low	225 Å²	225	159.8 Å²	159.8	100%	1.154	87%	0.865	S	S	*	*				0	88.2	0	-60.3	169.9	0	0	0	107.2
2	L	22.6	Very low	26.6	Very low	166 Å²	166	155.7 Å²	155.7	87%	0.869	85%	0.848	S	S	*	*			trans	-122.3	120.2	173	-111.7	97.9	0	0	0	106.6
3	K	24	Very low	26.9	Very low	213 Å²	213	151.1 Å²	151.1	93%	0.926	84%	0.835	S	S	*	*			trans	-92.5	115.7	171.8	-91.8	177.6	173	173.1	0	108
4	V	25	Very low	27.3	Very low	122 Å²	122	148.2 Å²	148.2	74%	0.739	82%	0.824	S	S	*	*			trans	-106.5	121.9	162.9	176	0	0	0	0	107.5
5	K	26.1	Very low	27.4	Very low	208 Å²	208	144.9 Å²	144.9	90%	0.904	81%	0.808	S	S	*	*	P	Polyproline II helix	trans	-80.1	120.6	172.1	-116.2	174.4	174.8	179.8	0	107.5
6	L	24.9	Very low	27.5	Very low	168 Å²	168	147.9 Å²	147.9	88%	0.88	80%	0.804	S	S	*	*	P	Polyproline II helix	trans	-91.7	119.8	165.7	-94	138.7	0	0	0	108.6
7	S	25.3	Very low	27.9	Very low	118 Å²	118	147.6 Å²	147.6	83%	0.825	81%	0.808	S	S	*	*	P	Polyproline II helix	trans	-84.9	126.3	171.3	-177.4	0	0	0	0	109.1
8	S	26.3	Very low	28.2	Very low	102 Å²	102	147.7 Å²	147.7	71%	0.713	80%	0.802	S	S	*	*	P	Polyproline II helix	trans	-82.7	146.1	169.7	45.6	0	0	0	0	111
9	S	26	Very low	28.3	Very low	126 Å²	126	144.9 Å²	144.9	88%	0.881	79%	0.786	S	S	*	*			trans	-177.3	99.2	141	-79.2	0	0	0	0	108.2
10	I	26.8	Very low	28.5	Very low	162 Å²	162	144.2 Å²	144.2	83%	0.831	79%	0.79	S	S	*	*			trans	-103.8	121.7	162.4	-67.1	173.5	0	0	0	105.5	V12	I10-V12 PolarHBondContact O-N 2.73Å
11	D	27.1	Very low	28.7	Very low	148 Å²	148	142.8 Å²	142.8	79%	0.791	79%	0.79	S	S	*	*			trans	-75.4	112.6	-175.1	-154.3	-15.4	0	0	0	109.9
12	V	28.1	Very low	28.4	Very low	110 Å²	110	139.7 Å²	139.7	67%	0.667	77%	0.77	S	S	*	*			trans	-115	72.3	178.8	-172.9	0	0	0	0	107.8	I10	I10-V12 PolarHBondContact O-N 2.73Å
13	S	30.4	Very low	28.8	Very low	96 Å²	96	139.8 Å²	139.8	67%	0.671	76%	0.764	S	S	*	*			trans	-121.2	2.9	-176.5	-173.6	0	0	0	0	115.2
14	T	32.1	Very low	29.2	Very low	111 Å²	111	138.6 Å²	138.6	68%	0.681	76%	0.761	S	S	*	*	S	Bend	trans	-129	8.6	-166	-27.8	0	0	0	0	116.2
15	V	29.6	Very low	29.3	Very low	98 Å²	98	139.2 Å²	139.2	59%	0.594	77%	0.765	S	S	*	*	S	Bend	trans	-114.9	-5.9	-169.7	-176.4	0	0	0	0	115.3
16	W	28.3	Very low	29.2	Very low	194 Å²	194	139.2 Å²	139.2	74%	0.735	77%	0.766	S	S	*	*	S	Bend	trans	-96.6	-14.2	-168.4	-73	96.1	0	0	0	116.6	Q18	W16-Q18 VanDerWaalsContact C-N 3.31Å; W16-Q18 PolarHBondContact O-N 3.14Å
17	T	34.2	Very low	29.2	Very low	142 Å²	142	140.4 Å²	140.4	87%	0.871	76%	0.764	S	S	*	*	S	Bend	trans	-79.9	-13.2	179.5	-31.5	0	0	0	0	113.1
18	Q	34.5	Very low	29.2	Very low	149 Å²	149	140.8 Å²	140.8	70%	0.696	76%	0.761	S	S	*	*	S	Bend	trans	-98.7	-9.3	-175.9	-158.1	148.6	-8.7	0	0	114.3	W16	W16-Q18 VanDerWaalsContact C-N 3.31Å; W16-Q18 PolarHBondContact O-N 3.14Å
19	L	29.9	Very low	29.1	Very low	96 Å²	96	141.8 Å²	141.8	50%	0.503	76%	0.763	S	S	.	*	T	Hydrogen-bonded Turn	trans	-92.9	-4.9	-173.5	-108.1	92.8	0	0	0	116.3
20	C	31.9	Very low	29.1	Very low	129 Å²	129	144.4 Å²	144.4	87%	0.872	76%	0.761	S	S	*	*	T	Hydrogen-bonded Turn	trans	-89.8	-5.1	-179.2	-80.1	0	0	0	0	115.1
21	C	32.6	Very low	29.1	Very low	116 Å²	116	145.1 Å²	145.1	78%	0.784	76%	0.761	S	S	*	*	S	Bend	trans	-116.4	-5.1	-179.6	-89.8	0	0	0	0	116.6
22	E	31.2	Very low	29	Very low	159 Å²	159	146.9 Å²	146.9	74%	0.743	76%	0.764	S	S	*	*	S	Bend	trans	-127.3	42.1	-170.5	-83.3	-168.2	160.2	0	0	115.9
23	K	30.7	Very low	28.8	Very low	168 Å²	168	152.7 Å²	152.7	73%	0.73	77%	0.774	S	S	*	*			trans	-139.5	86	163.9	-72.4	-167.6	179.6	-178	0	111.8
24	H	31.5	Very low	28.6	Very low	189 Å²	189	154.2 Å²	154.2	88%	0.875	78%	0.779	S	S	*	*			trans	-173	90.4	140	-90.4	-56.6	0	0	0	110.4
25	T	27.9	Very low	28.2	Very low	134 Å²	134	157.1 Å²	157.1	82%	0.822	79%	0.785	S	S	*	*			trans	-178.1	96.2	140.9	27.9	0	0	0	0	108.8
26	F	23.5	Very low	28.1	Very low	208 Å²	208	159.3 Å²	159.3	91%	0.912	80%	0.798	S	S	*	*			trans	-118	99.9	154.4	-102.7	-87.6	0	0	0	105.7
27	F	25.5	Very low	28	Very low	194 Å²	194	154.7 Å²	154.7	85%	0.851	80%	0.801	S	S	*	*			trans	-106.9	108.2	158.7	-100.6	-83.4	0	0	0	107	V29	F27-V29 PolarHBondContact O-N 2.76Å
28	T	24.2	Very low	27.5	Very low	125 Å²	125	157 Å²	157	77%	0.767	80%	0.802	S	S	*	*			trans	-61.4	116.4	167.6	28	0	0	0	0	110
29	V	25.8	Very low	27	Very low	124 Å²	124	158.5 Å²	158.5	75%	0.752	81%	0.809	S	S	*	*			trans	-94.7	104.1	160.1	177.5	0	0	0	0	106.9	F27 H31	F27-V29 PolarHBondContact O-N 2.76Å; V29-H31 PolarHBondContact O-N 2.87Å
30	Q	25.6	Very low	26.8	Very low	180 Å²	180	159.3 Å²	159.3	84%	0.841	82%	0.819	S	S	*	*			trans	-73.7	114.4	168.1	-88.4	178	-36.9	0	0	108.8	H32	Q30-H32 PolarHBondContact O-N 2.75Å
31	H	26.1	Very low	26.6	Very low	177 Å²	177	161 Å²	161	82%	0.819	82%	0.819	S	S	*	*			trans	-72.9	113.6	164.8	-89.3	-80.1	0	0	0	109.5	V29	V29-H31 PolarHBondContact O-N 2.87Å
32	H	25.8	Very low	26.2	Very low	186 Å²	186	158.7 Å²	158.7	86%	0.861	82%	0.815	S	S	*	*			trans	-77.9	122.2	161.9	-103.1	-13.4	0	0	0	109.9	Q30	Q30-H32 PolarHBondContact O-N 2.75Å
33	R	23.3	Very low	26.1	Very low	231 Å²	231	159.9 Å²	159.9	87%	0.872	82%	0.821	S	S	*	*			trans	-84.7	117.6	175.9	-167.8	179.4	-172.9	169	1.1	107.3
34	V	25.8	Very low	25.9	Very low	129 Å²	129	159.2 Å²	159.2	78%	0.782	83%	0.825	S	S	*	*			trans	-114.3	119.8	165.3	175.9	0	0	0	0	107.4
35	Q	24.4	Very low	25.7	Very low	172 Å²	172	154.3 Å²	154.3	80%	0.804	82%	0.817	S	S	*	*			trans	-75.4	138.8	172.7	-69	170.9	-52.1	0	0	109.6
36	V	26.9	Very low	25.7	Very low	144 Å²	144	152.8 Å²	152.8	87%	0.873	82%	0.818	S	S	*	*			trans	-137.5	137	153	-175.8	0	0	0	0	107.8
37	A	25.8	Very low	25.8	Very low	97 Å²	97	146.5 Å²	146.5	80%	0.802	81%	0.805	S	S	*	*			trans	-80	163.3	-162.7	0	0	0	0	0	115.1
38	E	24.9	Very low	25.9	Very low	191 Å²	191	148.8 Å²	148.8	89%	0.893	81%	0.808	S	S	*	*			trans	-68.2	151.9	167.3	-69.7	171.4	132.1	0	0	112.9
39	E	24.5	Very low	26	Very low	179 Å²	179	148.1 Å²	148.1	84%	0.836	81%	0.808	S	S	*	*			trans	-170.7	103.2	142.9	-104.3	175.4	-175.3	0	0	106.4
40	T	25.4	Very low	26.1	Very low	114 Å²	114	146.2 Å²	146.2	70%	0.699	81%	0.805	S	S	*	*				85.9	147.7	91.1	51.1	0	0	0	0	115.8
41	D	26.8	Very low	26.2	Very low	163 Å²	163	145.5 Å²	145.5	87%	0.872	80%	0.802	S	S	*	*			trans	82.8	129.8	169.9	-52.1	-21	0	0	0	116.4
42	G	25.4	Very low	26.4	Very low	69 Å²	69	144.7 Å²	144.7	71%	0.711	80%	0.799	S	S	*	*			cis	157	132.3	6.9	0	0	0	0	0	108.8
43	E	27.6	Very low	26.6	Very low	184 Å²	184	143.2 Å²	143.2	86%	0.86	80%	0.797	S	S	*	*			trans	62.1	110.1	145.4	-74.5	177.6	163.2	0	0	122.9
44	D	26.5	Very low	26.7	Very low	153 Å²	153	138 Å²	138	82%	0.818	80%	0.796	S	S	*	*				82.3	130.4	110.3	-85	-11.3	0	0	0	125.5
45	A	27.6	Very low	27	Very low	87 Å²	87	136.4 Å²	136.4	72%	0.719	80%	0.796	S	S	*	*				101.8	109.4	129.8	0	0	0	0	0	121.2
46	A	27.2	Very low	27.9	Very low	101 Å²	101	133.8 Å²	133.8	84%	0.835	79%	0.794	S	S	*	*				69.5	151.9	123	0	0	0	0	0	119.9
47	A	26.4	Very low	28	Very low	77 Å²	77	138.5 Å²	138.5	64%	0.636	80%	0.796	S	S	*	*			cis	-178.9	158.9	-21.9	0	0	0	0	0	106.4
48	R	28.1	Very low	28.7	Very low	241 Å²	241	138.4 Å²	138.4	91%	0.909	80%	0.796	S	S	*	*			trans	78.4	142.9	159.1	-57.4	174.5	-177.4	-167.2	-0.4	116.9
49	S	26.3	Very low	29.4	Very low	112 Å²	112	137.6 Å²	137.6	78%	0.783	79%	0.792	S	S	*	*			cis	-176.2	146.8	-0.7	42.3	0	0	0	0	111.5
50	A	28.3	Very low	30.3	Very low	83 Å²	83	136.8 Å²	136.8	69%	0.686	79%	0.793	S	S	*	*			trans	70.9	123.6	139.3	0	0	0	0	0	124.5
51	Q	28	Very low	31.2	Very low	166 Å²	166	140.6 Å²	140.6	78%	0.776	80%	0.8	S	S	*	*			trans	49.7	145.3	131.8	-80.3	167.2	-64.2	0	0	120.4
52	E	28.6	Very low	32.2	Very low	160 Å²	160	141.7 Å²	141.7	75%	0.748	80%	0.797	S	S	*	*			cis	-167.5	174	17.6	-137.4	157.4	-143.4	0	0	110.1
53	D	29.8	Very low	33.2	Very low	154 Å²	154	140.9 Å²	140.9	82%	0.824	79%	0.788	S	S	*	*			trans	-35.9	145.4	-175.4	-77	-47.3	0	0	0	121.9
54	S	27.1	Very low	34.1	Very low	123 Å²	123	139.6 Å²	139.6	86%	0.86	78%	0.78	S	S	*	*				-175.4	130.9	124.2	46.6	0	0	0	0	113.1
55	A	30.5	Very low	35.3	Very low	94 Å²	94	136 Å²	136	78%	0.777	77%	0.767	S	S	*	*			trans	-107.4	178.6	159.7	0	0	0	0	0	108.5
56	P	44.5	Very low	36.4	Very low	118 Å²	118	136.2 Å²	136.2	77%	0.766	76%	0.759	S	S	*	*			cis	-137.6	174.8	-6.5	37.1	-18.6	0	0	0	114.1
57	R	28.4	Very low	37.5	Very low	242 Å²	242	139.6 Å²	139.6	91%	0.913	75%	0.752	S	S	*	*			trans	-152.8	126.2	142.6	-128.5	173.6	-176.7	-177	0.8	114.3
58	A	41.3	Very low	38.7	Very low	95 Å²	95	142.6 Å²	142.6	79%	0.785	75%	0.751	S	S	*	*			trans	-89.1	116.7	-178.4	0	0	0	0	0	111
59	Q	39.6	Very low	39.9	Very low	175 Å²	175	135.2 Å²	135.2	82%	0.818	73%	0.733	S	S	*	*			trans	-146.9	-9	164.8	-115.1	166.6	-7	0	0	116.1
60	D	42.4	Very low	41.2	Very low	161 Å²	161	138.1 Å²	138.1	86%	0.861	73%	0.731	S	S	*	*	T	Hydrogen-bonded Turn	trans	-97.4	14	-176.5	-84.4	-30.2	0	0	0	116.9
61	K	45.5	Very low	42.1	Very low	195 Å²	195	139.3 Å²	139.3	85%	0.848	73%	0.726	S	S	*	*	T	Hydrogen-bonded Turn	trans	-95.6	4.6	-179.8	-72.2	-171.8	177.2	-179.5	0	115.6
62	K	47.4	Very low	43.2	Very low	186 Å²	186	134.3 Å²	134.3	81%	0.809	71%	0.712	S	S	*	*	S	Bend	trans	-98.1	-13.7	-178.6	-86.9	-176.5	175.3	179.9	0	115.7	T66	K62-T66 PolarHBondContact O-OG1 3.07Å
63	G	47.1	Very low	44.4	Very low	51 Å²	51	135.8 Å²	135.8	53%	0.526	71%	0.711	S	S	.	*	S	Bend	trans	-87	-31	179.7	0	0	0	0	0	115	T66	G63-T66 PolarHBondContact O-OG1 3.05Å
64	F	45.8	Very low	45.2	Very low	158 Å²	158	130.6 Å²	130.6	69%	0.693	69%	0.694	S	S	*	*	H	α-helix	trans	-84.3	-34.2	-174.1	-103.9	-102.8	0	0	0	113.5	T66 F68	F64-T66 PolarHBondContact O-N 2.97Å; F64-F68 AromaticContact CD1-CE2 3.97Å; F64-F68 HydrophobicContact CD1-CE2 3.97Å; F64-F68 HydrophobicContact CE1-CE2 4.45Å; F64-F68 VanDerWaalsContact O-CD2 3.31Å; F64-F68 WeakPolarHBondContact O-CD2 3.4Å
65	S	52.2	Low	46.2	Very low	77 Å²	77	134.6 Å²	134.6	54%	0.538	69%	0.691	S	S	.	*	H	α-helix	trans	-70.4	-32.7	-177.4	177.8	0	0	0	0	113.4	T69	S65-T69 PolarHBondContact O-N 3.4Å; S65-T69 PolarHBondContact O-OG1 3.32Å
66	T	49.4	Very low	47	Very low	91 Å²	91	140.4 Å²	140.4	56%	0.558	69%	0.692	S	S	*	*	H	α-helix	trans	-72.8	-30.9	-179.9	46.3	0	0	0	0	112.7	K62 G63 F64 K70	K62-T66 PolarHBondContact O-OG1 3.07Å; G63-T66 PolarHBondContact O-OG1 3.05Å; F64-T66 PolarHBondContact O-N 2.97Å; T66-K70 PolarHBondContact O-N 3.33Å
67	Y	51	Low	47.2	Very low	173 Å²	173	142.6 Å²	142.6	68%	0.678	69%	0.692	S	S	*	*	H	α-helix	trans	-69.7	-44.7	175.7	-122.5	-95.3	0	0	0	112.4	T69 K70 L71	Y67-T69 VanDerWaalsContact C-N 3.34Å; Y67-T69 PolarHBondContact O-N 2.64Å; Y67-K70 PolarHBondContact O-N 3.47Å; Y67-L71 HydrophobicContact CD1-CD1 4.49Å; Y67-L71 PolarHBondContact O-N 3.17Å
68	F	51.2	Low	48.2	Very low	139 Å²	139	137.2 Å²	137.2	61%	0.61	69%	0.686	S	S	*	*	H	α-helix	trans	-68.1	-32.4	177.4	-79	-74.4	0	0	0	113	F64 A72	F64-F68 AromaticContact CD1-CE2 3.97Å; F64-F68 HydrophobicContact CD1-CE2 3.97Å; F64-F68 HydrophobicContact CE1-CE2 4.45Å; F64-F68 VanDerWaalsContact O-CD2 3.31Å; F64-F68 WeakPolarHBondContact O-CD2 3.4Å; F68-A72 VanDerWaalsContact O-CB 3.32Å; F68-A72 WeakPolarHBondContact O-CB 3.41Å; F68-A72 PolarHBondContact O-N 3.26Å
69	T	53.6	Low	48.5	Very low	86 Å²	86	140.6 Å²	140.6	53%	0.528	69%	0.686	S	S	.	*	H	α-helix	trans	-70.9	-32.8	177.9	-47.5	0	0	0	0	111.9	S65 Y67 R73	S65-T69 PolarHBondContact O-N 3.4Å; S65-T69 PolarHBondContact O-OG1 3.32Å; Y67-T69 VanDerWaalsContact C-N 3.34Å; Y67-T69 PolarHBondContact O-N 2.64Å; T69-R73 PolarHBondContact O-N 3.11Å; T69-R73 VanDerWaalsContact O-N 3.09Å
70	K	52.6	Low	48.4	Very low	174 Å²	174	141.6 Å²	141.6	76%	0.757	69%	0.687	S	S	*	*	H	α-helix	trans	-73.9	-37.1	177	-136.2	175.8	-175.1	-178.7	0	112.4	T66 Y67 R73 G74	T66-K70 PolarHBondContact O-N 3.33Å; Y67-K70 PolarHBondContact O-N 3.47Å; K70-R73 PolarHBondContact O-N 2.92Å; K70-G74 PolarHBondContact O-N 2.7Å
71	L	48.8	Very low	48.4	Very low	108 Å²	108	139.3 Å²	139.3	57%	0.565	68%	0.681	S	S	*	*	H	α-helix	trans	-68.7	-36.2	172.1	-83.6	156.5	0	0	0	112.5	Y67 R75	Y67-L71 HydrophobicContact CD1-CD1 4.49Å; Y67-L71 PolarHBondContact O-N 3.17Å; L71-R75 WeakPolarHBondContact O-CB 3.42Å; L71-R75 PolarHBondContact O-N 3.45Å; L71-R75 VanDerWaalsContact O-N 3.1Å
72	A	50.6	Low	48.2	Very low	60 Å²	60	134.2 Å²	134.2	50%	0.496	68%	0.675	S	S	.	*	H	α-helix	trans	-70.9	-29.6	175.6	0	0	0	0	0	113.2	F68	F68-A72 VanDerWaalsContact O-CB 3.32Å; F68-A72 WeakPolarHBondContact O-CB 3.41Å; F68-A72 PolarHBondContact O-N 3.26Å
73	R	53	Low	48.1	Very low	191 Å²	191	137.2 Å²	137.2	72%	0.721	68%	0.682	S	S	*	*	H	α-helix	trans	-82.7	-32.9	175.6	-137.2	173.3	91.7	158.9	6.5	113	T69 K70 R76	T69-R73 PolarHBondContact O-N 3.11Å; T69-R73 VanDerWaalsContact O-N 3.09Å; K70-R73 PolarHBondContact O-N 2.92Å; R73-R76 PolarHBondContact O-N 3.19Å
74	G	46.8	Very low	47.8	Very low	46 Å²	46	140.7 Å²	140.7	47%	0.474	69%	0.693	S	S	.	*	H	α-helix	trans	-70.6	-30.8	172.5	0	0	0	0	0	114	K70	K70-G74 PolarHBondContact O-N 2.7Å
75	R	48.7	Very low	48	Very low	207 Å²	207	138.9 Å²	138.9	78%	0.781	70%	0.7	S	S	*	*	T	Hydrogen-bonded Turn	trans	-75.5	-18.2	172.3	-94.7	-176.2	172.7	172.3	-2.1	114.4	L71	L71-R75 WeakPolarHBondContact O-CB 3.42Å; L71-R75 PolarHBondContact O-N 3.45Å; L71-R75 VanDerWaalsContact O-N 3.1Å
76	R	46.8	Very low	47.9	Very low	215 Å²	215	139 Å²	139	81%	0.811	71%	0.705	S	S	*	*	T	Hydrogen-bonded Turn	trans	-90.8	-7.4	-178.7	-110.2	-179.6	179	-179.2	0.4	115	R73	R73-R76 PolarHBondContact O-N 3.19Å
77	E	48	Very low	47.9	Very low	164 Å²	164	139.1 Å²	139.1	77%	0.766	72%	0.716	S	S	*	*	S	Bend	trans	-105.3	-4.7	176.6	-72.1	-165.9	161.7	0	0	114.2
78	V	50.9	Low	48.1	Very low	129 Å²	129	135.8 Å²	135.8	78%	0.782	72%	0.724	S	S	*	*	S	Bend	trans	-101.6	-9.1	175.9	-175.4	0	0	0	0	113
79	E	47.8	Very low	48.9	Very low	166 Å²	166	134.1 Å²	134.1	78%	0.776	73%	0.729	S	S	*	*			trans	-116.9	78.3	172.2	-84	-176.3	149.6	0	0	111
80	K	36.7	Very low	49.8	Very low	196 Å²	196	135 Å²	135	85%	0.852	73%	0.731	S	S	*	*			trans	-121	90.6	159.4	-143.9	-178.8	-170.4	-178.3	0	107.1	A82	K80-A82 PolarHBondContact O-N 3.23Å
81	P	43.4	Very low	51.1	Low	114 Å²	114	131.2 Å²	131.2	74%	0.74	72%	0.724	S	S	*	*			trans	-65.1	127	169.8	6.5	3.8	0	0	0	107.4	R83	P81-R83 PolarHBondContact O-N 3.38Å; P81-R83 VanDerWaalsContact O-N 3.13Å
82	A	41.3	Very low	53	Low	87 Å²	87	131.5 Å²	131.5	72%	0.719	73%	0.732	S	S	*	*			trans	-52.4	121.4	164.8	0	0	0	0	0	107.7	K80 T84	K80-A82 PolarHBondContact O-N 3.23Å; A82-T84 PolarHBondContact O-N 3.36Å
83	R	43.9	Very low	55	Low	250 Å²	250	132.3 Å²	132.3	94%	0.943	73%	0.733	S	S	*	*			trans	-66.3	85.7	170.1	-81.6	179.7	171.9	-178.8	-3.5	108.3	P81 S85	P81-R83 PolarHBondContact O-N 3.38Å; P81-R83 VanDerWaalsContact O-N 3.13Å; R83-S85 PolarHBondContact O-N 3.24Å
84	T	41.9	Very low	57.1	Low	124 Å²	124	126.1 Å²	126.1	76%	0.761	72%	0.722	S	S	*	*			trans	-83.6	91.8	148.5	42.3	0	0	0	0	106.6	A82 A86	A82-T84 PolarHBondContact O-N 3.36Å; T84-A86 PolarHBondContact O-N 2.56Å
85	S	49.7	Very low	59.5	Low	120 Å²	120	125.5 Å²	125.5	84%	0.839	71%	0.707	S	S	*	*			trans	-71.1	70.7	163.7	53.6	0	0	0	0	109	R83	R83-S85 PolarHBondContact O-N 3.24Å
86	A	48.8	Very low	61.7	Low	79 Å²	79	122.5 Å²	122.5	65%	0.653	71%	0.706	S	S	*	*			trans	-96.4	117.5	151.6	0	0	0	0	0	104.6	T84 A88	T84-A86 PolarHBondContact O-N 2.56Å; A86-A88 PolarHBondContact O-N 3.5Å; A86-A88 VanDerWaalsContact O-N 3.09Å
87	A	50.5	Low	64.2	Low	94 Å²	94	112.8 Å²	112.8	78%	0.777	67%	0.67	S	S	*	*			trans	-48.4	123.4	161.2	0	0	0	0	0	106.1	S89	A87-S89 PolarHBondContact O-N 3.25Å
88	A	55.6	Low	66.5	Low	102 Å²	102	107.6 Å²	107.6	84%	0.843	65%	0.652	S	S	*	*			trans	-63.2	91.4	178.1	0	0	0	0	0	107.3	A86 D90	A86-A88 PolarHBondContact O-N 3.5Å; A86-A88 VanDerWaalsContact O-N 3.09Å; A88-D90 PolarHBondContact O-N 2.85Å
89	S	66.6	Low	68.8	Low	104 Å²	104	102.9 Å²	102.9	73%	0.727	63%	0.627	S	S	*	*	P	Polyproline II helix	trans	-61	133.3	166.2	52	0	0	0	0	106.4	A87	A87-S89 PolarHBondContact O-N 3.25Å
90	D	73.8	Confident	71.1	Confident	105 Å²	105	97.4 Å²	97.4	56%	0.561	61%	0.61	S	S	*	*	P	Polyproline II helix	trans	-48.8	139.2	171.8	-70.4	-48.6	0	0	0	109.2	A88 K200	A88-D90 PolarHBondContact O-N 2.85Å; D90-K200 IonicContact OD1-NZ 2.72Å; D90-K200 VanDerWaalsContact OD2-CE 3.31Å; D90-K200 WeakPolarHBondContact OD2-CE 3.3Å; D90-K200 IonicContact OD2-NZ 2.78Å; D90-K200 PolarHBondContact OD2-NZ 3.03Å
91	P	79.6	Confident	74.1	Confident	95 Å²	95	89.9 Å²	89.9	62%	0.617	58%	0.579	S	S	*	*	P	Polyproline II helix	trans	-55.2	145.4	175.5	23.6	-32.2	0	0	0	109.2
92	P	88.2	Confident	76.7	Confident	114 Å²	114	84.5 Å²	84.5	74%	0.74	54%	0.544	S	S	*	.	P	Polyproline II helix	trans	-57	147.7	178.1	25.7	-34	0	0	0	110
93	P	93.7	Very high	79.5	Confident	77 Å²	77	80.4 Å²	80.4	50%	0.5	51%	0.51	S	S	.	.	P	Polyproline II helix	trans	-59.1	142.4	178	26.3	-34.1	0	0	0	110.3	E95 S203	P93-E95 VanDerWaalsContact C-N 3.25Å; P93-S203 CarbonylContact C-O 3.51Å
94	A	96.3	Very high	82.1	Confident	61 Å²	61	68.6 Å²	68.6	50%	0.504	47%	0.465	S	S	.	.	S	Bend	trans	-70.6	-27.5	173.3	0	0	0	0	0	111.5	S203 Q204 P206	A94-S203 PolarHBondContact N-O 3.03Å; A94-Q204 VanDerWaalsContact CB-C 3.5Å; A94-Q204 VanDerWaalsContact CB-O 3.27Å; A94-Q204 WeakPolarHBondContact CB-O 3.46Å; A94-P206 HydrophobicContact CB-CG 4.45Å
95	E	96.9	Very high	84.8	Confident	33 Å²	33	62.7 Å²	62.7	15%	0.154	43%	0.429	C	S	.	.	S	Bend	trans	-143.6	135.3	174.1	-169.8	-179.7	172.4	0	0	110.8	P93 I97 K182 S203 P206 H207	P93-E95 VanDerWaalsContact C-N 3.25Å; E95-I97 HydrophobicContact CB-CG2 4.27Å; E95-I97 HydrophobicContact CG-CG2 3.85Å; E95-I97 PolarHBondContact O-N 3.29Å; E95-K182 WeakPolarHBondContact OE1-CD 3.3Å; E95-K182 WeakPolarHBondContact OE1-CE 3.34Å; E95-K182 IonicContact OE1-NZ 2.73Å; E95-K182 PolarHBondContact OE1-NZ 3.01Å; E95-S203 PolarHBondContact N-O 3.47Å; E95-S203 WeakPolarHBondContact O-CB 3.49Å; E95-P206 WeakPolarHBondContact OE2-CA 3.21Å; E95-H207 IonicContact OE1-CE1 2.87Å; E95-H207 PolarHBondContact OE1-CE1 2.99Å; E95-H207 IonicContact OE1-CG 2.92Å; E95-H207 IonicContact OE1-ND1 3.31Å; E95-H207 PolarHBondContact OE1-ND1 3.01Å; E95-H207 IonicContact OE2-CE1 3.57Å; E95-H207 IonicContact OE2-CG 3.58Å; E95-H207 PolarHBondContact OE2-N 3.2Å; E95-H207 IonicContact OE2-ND1 2.69Å; E95-H207 PolarHBondContact OE2-ND1 3.42Å
96	D	96.3	Very high	87.2	Confident	143 Å²	143	57 Å²	57	77%	0.765	39%	0.389	S	S	*	.			trans	-74.6	111	170.2	-169.8	16.8	0	0	0	109.8	K182	D96-K182 PolarHBondContact O-NZ 2.64Å
97	I	97.8	Very high	89.5	Confident	11 Å²	11	53.7 Å²	53.7	6%	0.056	36%	0.36	C	S	.	.			trans	-132.9	150.6	178.1	66.5	167.9	0	0	0	110.1	E95 D101 K182 V199 L202	E95-I97 HydrophobicContact CB-CG2 4.27Å; E95-I97 HydrophobicContact CG-CG2 3.85Å; E95-I97 PolarHBondContact O-N 3.29Å; I97-D101 HydrophobicContact CB-CB 4.27Å; I97-K182 HydrophobicContact CG2-CD 3.87Å; I97-V199 HydrophobicContact CG1-CG1 4.29Å; I97-V199 WeakPolarHBondContact O-CG1 3.34Å; I97-L202 HydrophobicContact CD1-CB 3.62Å
98	S	97.8	Very high	91.8	Very high	56 Å²	56	49.5 Å²	49.5	39%	0.392	33%	0.325	S	S	.	.			trans	-115	173.3	175.3	71.9	0	0	0	0	110.8	A100 D101	S98-A100 PolarHBondContact O-N 2.89Å; S98-A100 PolarHBondContact OG-N 3.35Å; S98-D101 PolarHBondContact N-OD2 3.16Å; S98-D101 WeakPolarHBondContact O-CB 3.47Å; S98-D101 PolarHBondContact O-N 3.11Å; S98-D101 VanDerWaalsContact O-N 3.1Å; S98-D101 PolarHBondContact OG-OD2 2.71Å
99	A	97.8	Very high	93.9	Very high	30 Å²	30	45.4 Å²	45.4	25%	0.248	29%	0.289	C	S	.	.	G	3₁₀ helix	trans	-60.7	-26.3	173.5	0	0	0	0	0	112.8	D101 I102 Q131 V195 V199	A99-D101 PolarHBondContact O-N 2.94Å; A99-I102 PolarHBondContact O-N 3.33Å; A99-Q131 WeakPolarHBondContact O-CB 3.31Å; A99-V195 HydrophobicContact CB-CG1 4Å; A99-V199 HydrophobicContact CB-CG2 4.05Å
100	A	97.7	Very high	95.3	Very high	50 Å²	50	45.8 Å²	45.8	41%	0.413	28%	0.278	S	S	.	.	G	3₁₀ helix	trans	-69.8	-19.6	177.8	0	0	0	0	0	113.1	S98 I102 K181	S98-A100 PolarHBondContact O-N 2.89Å; S98-A100 PolarHBondContact OG-N 3.35Å; A100-I102 VanDerWaalsContact C-N 3.29Å; A100-K181 PolarHBondContact O-NZ 2.8Å
101	D	98.6	Very high	96.5	Very high	39 Å²	39	47.3 Å²	47.3	21%	0.209	28%	0.28	C	S	.	.	G	3₁₀ helix	trans	-81.4	-7.9	177.1	-64.2	-70.8	0	0	0	113.3	I97 S98 A99 K182 W183	I97-D101 HydrophobicContact CB-CB 4.27Å; S98-D101 PolarHBondContact N-OD2 3.16Å; S98-D101 WeakPolarHBondContact O-CB 3.47Å; S98-D101 PolarHBondContact O-N 3.11Å; S98-D101 VanDerWaalsContact O-N 3.1Å; S98-D101 PolarHBondContact OG-OD2 2.71Å; A99-D101 PolarHBondContact O-N 2.94Å; D101-K182 HydrophobicContact CB-CB 4.17Å; D101-K182 HydrophobicContact CB-CD 3.89Å; D101-K182 HydrophobicContact CB-CG 4.04Å; D101-K182 PolarHBondContact O-N 3.07Å; D101-K182 VanDerWaalsContact OD1-CE 3.3Å; D101-K182 WeakPolarHBondContact OD1-CE 3.41Å; D101-K182 IonicContact OD1-NZ 2.96Å; D101-W183 PolarHBondContact O-N 2.91Å
102	I	98.8	Very high	97.4	Very high	0 Å²	0	45.1 Å²	45.1	0%	0	26%	0.261	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-104.9	135.1	-177.2	-52.6	173.8	0	0	0	109.1	A99 A100 I104 Q131 K181 W183 C185 L198 V199 L202	A99-I102 PolarHBondContact O-N 3.33Å; A100-I102 VanDerWaalsContact C-N 3.29Å; I102-I104 HydrophobicContact CG2-CG1 3.88Å; I102-Q131 VanDerWaalsContact O-CB 3.25Å; I102-Q131 WeakPolarHBondContact O-CB 3.48Å; I102-K181 VanDerWaalsContact O-CD 3.23Å; I102-K181 WeakPolarHBondContact O-CD 3.37Å; I102-W183 HydrophobicContact CG1-CB 4.34Å; I102-W183 HydrophobicContact CG2-CB 4.32Å; I102-C185 HydrophobicContact CG2-CB 4.39Å; I102-L198 HydrophobicContact CD1-CD2 4.24Å; I102-L198 HydrophobicContact CD1-CG 4.16Å; I102-L198 HydrophobicContact CG2-CD2 4.22Å; I102-V199 HydrophobicContact CD1-CB 4.39Å; I102-V199 HydrophobicContact CD1-CG2 3.51Å; I102-L202 HydrophobicContact CD1-CD1 3.91Å; I102-L202 HydrophobicContact CG1-CD1 4.23Å
103	F	98.9	Very high	97.8	Very high	2 Å²	2	39.8 Å²	39.8	1%	0.009	23%	0.226	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-102	111.9	169.9	-170.1	-84.7	0	0	0	108.5	A105 Y133 F135 K175 F176 S179 K181 W183 F184 C185	F103-A105 HydrophobicContact CD1-CB 4.34Å; F103-A105 HydrophobicContact CE1-CB 4.03Å; F103-Y133 HydrophobicContact CD1-CD2 4.32Å; F103-Y133 AromaticContact CD2-CD2 3.63Å; F103-Y133 HydrophobicContact CD2-CD2 3.63Å; F103-Y133 AromaticContact CD2-CE2 3.43Å; F103-Y133 HydrophobicContact CD2-CE2 3.43Å; F103-Y133 VanDerWaalsContact CD2-CE2 3.43Å; F103-Y133 HydrophobicContact CD2-CG 4.44Å; F103-Y133 HydrophobicContact CE1-CD2 4.03Å; F103-Y133 HydrophobicContact CE1-CG 4.26Å; F103-Y133 HydrophobicContact CE2-CD1 4.01Å; F103-Y133 AromaticContact CE2-CD2 3.27Å; F103-Y133 HydrophobicContact CE2-CD2 3.27Å; F103-Y133 HydrophobicContact CE2-CE1 4.03Å; F103-Y133 AromaticContact CE2-CE2 3.31Å; F103-Y133 HydrophobicContact CE2-CE2 3.31Å; F103-Y133 AromaticContact CE2-CG 3.65Å; F103-Y133 HydrophobicContact CE2-CG 3.65Å; F103-Y133 AromaticContact CE2-CZ 3.7Å; F103-Y133 HydrophobicContact CG-CD2 4.14Å; F103-Y133 HydrophobicContact CG-CE2 4.24Å; F103-Y133 HydrophobicContact CZ-CD1 4.1Å; F103-Y133 AromaticContact CZ-CD2 3.49Å; F103-Y133 HydrophobicContact CZ-CD2 3.49Å; F103-Y133 VanDerWaalsContact CZ-CD2 3.49Å; F103-Y133 HydrophobicContact CZ-CE2 4.04Å; F103-Y133 AromaticContact CZ-CG 3.53Å; F103-Y133 HydrophobicContact CZ-CG 3.53Å; F103-F135 AromaticContact CE1-CE2 3.94Å; F103-F135 HydrophobicContact CE1-CE2 3.94Å; F103-F135 AromaticContact CE1-CZ 3.96Å; F103-F135 HydrophobicContact CE1-CZ 3.96Å; F103-F135 HydrophobicContact CZ-CE2 4.13Å; F103-F135 AromaticContact CZ-CZ 3.85Å; F103-F135 HydrophobicContact CZ-CZ 3.85Å; F103-K175 HydrophobicContact CZ-CB 3.96Å; F103-F176 HydrophobicContact CB-CD2 3.53Å; F103-F176 HydrophobicContact CB-CE2 4.18Å; F103-F176 HydrophobicContact CD1-CB 3.95Å; F103-F176 HydrophobicContact CD1-CD2 4.36Å; F103-F176 HydrophobicContact CD2-CD2 4.5Å; F103-F176 HydrophobicContact CE1-CB 4.19Å; F103-F176 HydrophobicContact CG-CB 4.15Å; F103-F176 AromaticContact CG-CD2 3.91Å; F103-F176 HydrophobicContact CG-CD2 3.91Å; F103-S179 WeakPolarHBondContact CD2-OG 3.45Å; F103-K181 HydrophobicContact CB-CB 4.16Å; F103-K181 HydrophobicContact CB-CD 3.85Å; F103-K181 HydrophobicContact CD2-CD 4.14Å; F103-W183 WeakPolarHBondContact CB-O 3.43Å; F103-W183 PolarHBondContact N-O 2.71Å; F103-F184 AromaticContact CD1-CD2 3.92Å; F103-F184 HydrophobicContact CD1-CD2 3.92Å; F103-F184 HydrophobicContact CD1-CE2 4.22Å; F103-F184 HydrophobicContact CE1-CE2 4.48Å; F103-C185 PolarHBondContact O-N 3.07Å
104	I	98.9	Very high	98	Very high	1 Å²	1	41 Å²	41	1%	0.005	23%	0.225	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-102.1	109	178.3	-55.9	174	0	0	0	108.4	I102 V106 W124 Q131 T132 Y133 C185 V187 V195 L198	I102-I104 HydrophobicContact CG2-CG1 3.88Å; I104-V106 HydrophobicContact CG2-CG2 4.46Å; I104-W124 HydrophobicContact CD1-CZ3 4.45Å; I104-W124 HydrophobicContact CG2-CH2 3.89Å; I104-W124 HydrophobicContact CG2-CZ3 4.16Å; I104-Q131 HydrophobicContact CD1-CG 4.02Å; I104-Q131 PolarHBondContact N-O 2.97Å; I104-T132 WeakPolarHBondContact O-CA 3.46Å; I104-Y133 PolarHBondContact O-N 3.19Å; I104-C185 CarbonylContact C-O 3.57Å; I104-C185 WeakPolarHBondContact CA-O 3.44Å; I104-V187 HydrophobicContact CG2-CG2 4.16Å; I104-V195 HydrophobicContact CD1-CG1 4.44Å; I104-V195 HydrophobicContact CD1-CG2 3.74Å; I104-L198 HydrophobicContact CD1-CD2 4.37Å
105	A	98.9	Very high	98	Very high	0 Å²	0	41.8 Å²	41.8	0%	0	23%	0.227	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-91.3	120.3	173.4	0	0	0	0	0	110	F103 F135 E172 F184 C185 V187	F103-A105 HydrophobicContact CD1-CB 4.34Å; F103-A105 HydrophobicContact CE1-CB 4.03Å; A105-F135 HydrophobicContact CB-CD2 3.97Å; A105-F135 HydrophobicContact CB-CE2 3.67Å; A105-E172 HydrophobicContact CB-CB 4.09Å; A105-E172 HydrophobicContact CB-CG 3.91Å; A105-E172 WeakPolarHBondContact CB-OE2 3.23Å; A105-F184 HydrophobicContact CB-CE2 3.81Å; A105-F184 HydrophobicContact CB-CZ 4.42Å; A105-C185 PolarHBondContact N-O 2.99Å; A105-V187 PolarHBondContact O-N 3.08Å
106	V	98.9	Very high	98.1	Very high	0 Å²	0	43.2 Å²	43.2	0%	0	23%	0.231	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-104.3	114.9	172.1	-175.9	0	0	0	0	108.2	I104 L120 W124 I125 T132 Y133 I134 F135 V187 D189	I104-V106 HydrophobicContact CG2-CG2 4.46Å; V106-L120 HydrophobicContact CG1-CD1 4.21Å; V106-W124 HydrophobicContact CG2-CH2 3.61Å; V106-W124 HydrophobicContact CG2-CZ2 3.85Å; V106-I125 HydrophobicContact CG2-CD1 4.41Å; V106-T132 HydrophobicContact CG2-CG2 3.65Å; V106-Y133 PolarHBondContact N-O 3.19Å; V106-I134 HydrophobicContact CB-CD1 3.68Å; V106-I134 HydrophobicContact CG1-CD1 4.24Å; V106-I134 HydrophobicContact CG2-CD1 3.93Å; V106-F135 PolarHBondContact O-N 3.02Å; V106-V187 WeakPolarHBondContact CA-O 3.46Å; V106-V187 HydrophobicContact CB-CG2 4.41Å; V106-V187 HydrophobicContact CG2-CG2 3.81Å; V106-D189 HydrophobicContact CG1-CB 4.44Å
107	K	98.8	Very high	98.2	Very high	10 Å²	10	36.5 Å²	36.5	4%	0.043	20%	0.195	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-86.8	128.9	176.3	-168.1	-170.9	-56.5	133.5	0	110.1	L165 K168 E172 H186 V187 D188 D189 D277	K107-L165 HydrophobicContact CD-CD2 4.13Å; K107-K168 HydrophobicContact CD-CB 4.28Å; K107-K168 HydrophobicContact CD-CD 4.41Å; K107-K168 HydrophobicContact CG-CB 4.2Å; K107-K168 HydrophobicContact CG-CD 3.94Å; K107-E172 WeakPolarHBondContact CB-OE1 3.32Å; K107-E172 WeakPolarHBondContact CE-OE1 3.49Å; K107-E172 WeakPolarHBondContact CG-OE1 3.49Å; K107-H186 WeakPolarHBondContact CE-CE1 3.44Å; K107-H186 PolarHBondContact NZ-CE1 3.17Å; K107-H186 PolarHBondContact NZ-NE2 3.11Å; K107-V187 PolarHBondContact N-O 2.79Å; K107-D188 IonicContact NZ-OD1 2.64Å; K107-D189 WeakPolarHBondContact O-CB 3.45Å; K107-D189 PolarHBondContact O-N 3.18Å; K107-D189 VanDerWaalsContact O-N 3.15Å; K107-D277 WeakPolarHBondContact CE-OD2 3.37Å; K107-D277 IonicContact NZ-OD2 2.7Å; K107-D277 PolarHBondContact NZ-OD2 3.27Å
108	T	98.6	Very high	98.2	Very high	7 Å²	7	37.3 Å²	37.3	4%	0.043	20%	0.199	C	C	.	.			trans	-144.9	-174.3	176.7	-166	0	0	0	0	110.8	L117 I134 F135 K168 D189	T108-L117 HydrophobicContact CG2-CD2 4.36Å; T108-I134 HydrophobicContact CG2-CG2 3.58Å; T108-F135 PolarHBondContact N-O 2.92Å; T108-K168 VanDerWaalsContact O-CE 3.31Å; T108-K168 WeakPolarHBondContact O-CE 3.34Å; T108-D189 WeakPolarHBondContact CB-OD2 3.47Å; T108-D189 PolarHBondContact OG1-OD2 3.47Å
109	T	98.3	Very high	98.2	Very high	15 Å²	15	35.9 Å²	35.9	9%	0.092	19%	0.187	C	C	.	.			trans	-139.4	153.6	175	173.9	0	0	0	0	109.2	K111 F112 H113 D137	T109-K111 HydrophobicContact CG2-CD 4.16Å; T109-K111 HydrophobicContact CG2-CG 3.44Å; T109-K111 VanDerWaalsContact CG2-CG 3.44Å; T109-K111 PolarHBondContact O-N 3.45Å; T109-F112 HydrophobicContact CG2-CB 4.14Å; T109-F112 HydrophobicContact CG2-CD2 3.32Å; T109-F112 HydrophobicContact CG2-CE2 3.89Å; T109-F112 HydrophobicContact CG2-CG 3.85Å; T109-F112 PolarHBondContact O-N 3.38Å; T109-H113 PolarHBondContact O-CD2 3.2Å; T109-H113 VanDerWaalsContact O-CD2 3.27Å; T109-D137 WeakPolarHBondContact CA-OD2 3.41Å; T109-D137 WeakPolarHBondContact CB-OD2 3.42Å; T109-D137 VanDerWaalsContact OG1-CG 3.27Å; T109-D137 PolarHBondContact OG1-OD1 3.44Å; T109-D137 PolarHBondContact OG1-OD2 3.36Å
110	K	97.7	Very high	98.3	Very high	113 Å²	113	34.5 Å²	34.5	49%	0.491	18%	0.175	S	C	.	.	G	3₁₀ helix	trans	-53.4	-35.6	-176.8	-177.5	165.8	177.8	159.6	0	113.3	F112 H113 T136 D137 E139	K110-F112 PolarHBondContact O-N 2.79Å; K110-F112 VanDerWaalsContact O-N 3.17Å; K110-H113 WeakPolarHBondContact CA-NE2 3.39Å; K110-H113 PolarHBondContact O-N 3.31Å; K110-T136 PolarHBondContact N-OG1 2.68Å; K110-D137 PolarHBondContact N-OD1 2.88Å; K110-E139 WeakPolarHBondContact CE-O 3.38Å; K110-E139 PolarHBondContact NZ-O 3.36Å
111	K	97.6	Very high	98.3	Very high	136 Å²	136	33.1 Å²	33.1	59%	0.591	16%	0.161	S	C	*	.	G	3₁₀ helix	trans	-63.9	-18.1	178	64.1	169.8	-179.3	174	0	114.3	T109	T109-K111 HydrophobicContact CG2-CD 4.16Å; T109-K111 HydrophobicContact CG2-CG 3.44Å; T109-K111 VanDerWaalsContact CG2-CG 3.44Å; T109-K111 PolarHBondContact O-N 3.45Å
112	F	98.1	Very high	98.3	Very high	49 Å²	49	36 Å²	36	22%	0.215	17%	0.173	C	C	.	.	G	3₁₀ helix	trans	-110.6	3.4	-176.8	-65.2	-29.7	0	0	0	114.2	T109 K110 Q114 R116 L117 D189	T109-F112 HydrophobicContact CG2-CB 4.14Å; T109-F112 HydrophobicContact CG2-CD2 3.32Å; T109-F112 HydrophobicContact CG2-CE2 3.89Å; T109-F112 HydrophobicContact CG2-CG 3.85Å; T109-F112 PolarHBondContact O-N 3.38Å; K110-F112 PolarHBondContact O-N 2.79Å; K110-F112 VanDerWaalsContact O-N 3.17Å; F112-Q114 VanDerWaalsContact C-N 3.26Å; F112-Q114 PolarHBondContact O-N 3.1Å; F112-R116 HydrophobicContact CB-CB 4.22Å; F112-R116 HydrophobicContact CB-CG 4.07Å; F112-R116 HydrophobicContact CD1-CG 4.49Å; F112-R116 HydrophobicContact CG-CG 4.24Å; F112-R116 PolarHBondContact O-N 3.21Å; F112-L117 PolarHBondContact O-N 2.81Å; F112-L117 VanDerWaalsContact O-N 3.07Å; F112-D189 WeakPolarHBondContact CB-OD2 3.41Å
113	H	98.3	Very high	98.3	Very high	3 Å²	3	36 Å²	36	1%	0.014	17%	0.173	C	C	.	.	I	π-helix	trans	-53.8	-44.1	175.7	-71	-173.6	0	0	0	112.3	T109 K110 L117 N118 T136 D140	T109-H113 PolarHBondContact O-CD2 3.2Å; T109-H113 VanDerWaalsContact O-CD2 3.27Å; K110-H113 WeakPolarHBondContact CA-NE2 3.39Å; K110-H113 PolarHBondContact O-N 3.31Å; H113-L117 WeakPolarHBondContact O-CB 3.48Å; H113-N118 PolarHBondContact O-N 2.76Å; H113-N118 VanDerWaalsContact O-N 3.1Å; H113-T136 WeakPolarHBondContact NE2-CB 3.39Å; H113-T136 PolarHBondContact NE2-OG1 2.91Å; H113-D140 IonicContact CE1-OD2 2.82Å; H113-D140 IonicContact CG-OD2 3.78Å; H113-D140 WeakPolarHBondContact ND1-CB 3.33Å; H113-D140 IonicContact ND1-OD2 3.69Å; H113-D140 PolarHBondContact ND1-OD2 3.05Å
114	Q	97.1	Very high	98.3	Very high	101 Å²	101	35.9 Å²	35.9	47%	0.472	17%	0.173	S	C	.	.	I	π-helix	trans	-85.1	-42.9	-177.3	-60.3	-65.5	-26	0	0	112.5	F112 N118 E142	F112-Q114 VanDerWaalsContact C-N 3.26Å; F112-Q114 PolarHBondContact O-N 3.1Å; Q114-N118 PolarHBondContact O-ND2 2.89Å; Q114-N118 PolarHBondContact OE1-ND2 3.27Å; Q114-E142 PolarHBondContact NE2-OE2 2.9Å; Q114-E142 VanDerWaalsContact NE2-OE2 3.1Å
115	S	96.7	Very high	98.2	Very high	78 Å²	78	35.9 Å²	35.9	55%	0.545	17%	0.173	S	C	.	.	I	π-helix	trans	-81.7	-24.3	-171.3	55.6	0	0	0	0	114.7
116	R	98.1	Very high	98.2	Very high	64 Å²	64	38.3 Å²	38.3	24%	0.242	19%	0.189	C	C	.	.	I	π-helix	trans	-122.7	-54.4	-179.1	-57.5	-173	176	-156.5	-9.2	112	F112 N118 L119 L120 D189 D190	F112-R116 HydrophobicContact CB-CB 4.22Å; F112-R116 HydrophobicContact CB-CG 4.07Å; F112-R116 HydrophobicContact CD1-CG 4.49Å; F112-R116 HydrophobicContact CG-CG 4.24Å; F112-R116 PolarHBondContact O-N 3.21Å; R116-N118 PolarHBondContact O-N 3.2Å; R116-L119 WeakPolarHBondContact O-CB 3.47Å; R116-L119 PolarHBondContact O-N 2.85Å; R116-L119 VanDerWaalsContact O-N 3.15Å; R116-L120 PolarHBondContact O-N 2.86Å; R116-D189 HydrophobicContact CB-CB 4.37Å; R116-D189 WeakPolarHBondContact CD-OD1 3.34Å; R116-D189 IonicContact CZ-OD1 3.79Å; R116-D189 IonicContact NE-OD1 3.96Å; R116-D189 IonicContact NH1-OD1 3.59Å; R116-D189 PolarHBondContact NH1-OD1 3.36Å; R116-D190 IonicContact CZ-OD2 3.75Å; R116-D190 IonicContact NH1-OD2 2.72Å; R116-D190 PolarHBondContact NH1-OD2 2.91Å
117	L	98.4	Very high	98.1	Very high	1 Å²	1	42.9 Å²	42.9	1%	0.005	21%	0.207	C	C	.	.	I	π-helix	trans	-65.9	-36.4	-170.7	-178.8	66	0	0	0	113.3	T108 F112 H113 L119 L120 L121 I125 I134 L143	T108-L117 HydrophobicContact CG2-CD2 4.36Å; F112-L117 PolarHBondContact O-N 2.81Å; F112-L117 VanDerWaalsContact O-N 3.07Å; H113-L117 WeakPolarHBondContact O-CB 3.48Å; L117-L119 VanDerWaalsContact C-N 3.27Å; L117-L119 PolarHBondContact O-N 2.75Å; L117-L120 PolarHBondContact O-N 3.35Å; L117-L121 HydrophobicContact CD1-CG 4.45Å; L117-L121 HydrophobicContact CG-CD1 4.08Å; L117-L121 HydrophobicContact CG-CG 4.25Å; L117-L121 WeakPolarHBondContact O-CG 3.44Å; L117-L121 PolarHBondContact O-N 2.95Å; L117-I125 HydrophobicContact CD1-CD1 4.27Å; L117-I134 HydrophobicContact CD1-CD1 3.78Å; L117-I134 HydrophobicContact CD1-CG1 4.26Å; L117-I134 HydrophobicContact CD1-CG2 4.22Å; L117-I134 HydrophobicContact CD2-CG2 3.81Å; L117-L143 HydrophobicContact CD2-CD1 3.54Å; L117-L143 HydrophobicContact CD2-CD2 3.69Å; L117-L143 HydrophobicContact CD2-CG 4.25Å; L117-L143 HydrophobicContact CG-CD1 4.45Å
118	N	98.1	Very high	98	Very high	29 Å²	29	42.9 Å²	42.9	16%	0.155	21%	0.207	C	C	.	.	H	α-helix	trans	-55.3	-41.8	174.5	-82.3	-17.7	0	0	0	112.7	H113 Q114 R116 L120 L121 E122 K146	H113-N118 PolarHBondContact O-N 2.76Å; H113-N118 VanDerWaalsContact O-N 3.1Å; Q114-N118 PolarHBondContact O-ND2 2.89Å; Q114-N118 PolarHBondContact OE1-ND2 3.27Å; R116-N118 PolarHBondContact O-N 3.2Å; N118-L120 VanDerWaalsContact C-N 3.29Å; N118-L120 PolarHBondContact O-N 2.93Å; N118-L121 PolarHBondContact O-N 3.43Å; N118-E122 WeakPolarHBondContact O-CB 3.41Å; N118-E122 WeakPolarHBondContact O-CG 3.43Å; N118-E122 PolarHBondContact O-N 3.1Å; N118-K146 PolarHBondContact OD1-NZ 3.47Å
119	L	98.6	Very high	97.9	Very high	26 Å²	26	46.2 Å²	46.2	14%	0.136	22%	0.223	C	C	.	.	H	α-helix	trans	-60.5	-41.2	176.3	170.3	67	0	0	0	111	R116 L117 E122 T123 Y322 S345 F347 K348	R116-L119 WeakPolarHBondContact O-CB 3.47Å; R116-L119 PolarHBondContact O-N 2.85Å; R116-L119 VanDerWaalsContact O-N 3.15Å; L117-L119 VanDerWaalsContact C-N 3.27Å; L117-L119 PolarHBondContact O-N 2.75Å; L119-E122 PolarHBondContact O-N 3.3Å; L119-T123 HydrophobicContact CD1-CG2 4.05Å; L119-T123 WeakPolarHBondContact O-CB 3.4Å; L119-T123 WeakPolarHBondContact O-CG2 3.3Å; L119-T123 PolarHBondContact O-N 2.65Å; L119-T123 VanDerWaalsContact O-N 3.08Å; L119-T123 PolarHBondContact O-OG1 2.99Å; L119-Y322 HydrophobicContact CD2-CE1 4.46Å; L119-S345 VanDerWaalsContact CD2-OG 3.27Å; L119-S345 WeakPolarHBondContact CD2-OG 3.23Å; L119-F347 HydrophobicContact CD1-CB 4.32Å; L119-F347 HydrophobicContact CD2-CB 4.1Å; L119-F347 HydrophobicContact CD2-CD2 3.95Å; L119-F347 HydrophobicContact CD2-CG 4.36Å; L119-F347 HydrophobicContact CG-CB 4.36Å; L119-F347 HydrophobicContact CG-CD2 4.45Å; L119-K348 HydrophobicContact CD1-CG 3.86Å
120	L	98.8	Very high	97.8	Very high	0 Å²	0	52.9 Å²	52.9	0%	0	25%	0.253	C	S	.	.	H	α-helix	trans	-68	-41	178.6	-51.7	-165.2	0	0	0	111.4	V106 R116 L117 N118 T123 W124 I125 D189 N191 F347	V106-L120 HydrophobicContact CG1-CD1 4.21Å; R116-L120 PolarHBondContact O-N 2.86Å; L117-L120 PolarHBondContact O-N 3.35Å; N118-L120 VanDerWaalsContact C-N 3.29Å; N118-L120 PolarHBondContact O-N 2.93Å; L120-T123 CarbonylContact O-C 3.53Å; L120-T123 PolarHBondContact O-N 3.24Å; L120-T123 PolarHBondContact O-OG1 3Å; L120-W124 HydrophobicContact CD1-CZ2 4.23Å; L120-W124 PolarHBondContact O-N 3.5Å; L120-I125 HydrophobicContact CB-CD1 3.5Å; L120-I125 HydrophobicContact CB-CG1 3.98Å; L120-I125 HydrophobicContact CD1-CD1 4.42Å; L120-I125 VanDerWaalsContact O-CB 3.32Å; L120-I125 WeakPolarHBondContact O-CB 3.47Å; L120-I125 WeakPolarHBondContact O-CG1 3.29Å; L120-I125 PolarHBondContact O-N 3.15Å; L120-D189 WeakPolarHBondContact CD1-O 3.13Å; L120-N191 WeakPolarHBondContact CD2-O 3.27Å; L120-F347 HydrophobicContact CD2-CD2 3.81Å; L120-F347 HydrophobicContact CD2-CE2 3.8Å
121	L	98.6	Very high	97.8	Very high	22 Å²	22	48 Å²	48	12%	0.115	23%	0.233	C	C	.	.	H	α-helix	trans	-61.9	-38.9	175.7	-69.9	172.1	0	0	0	112.7	L117 N118 T123 I125 S126 L143 K146 I147	L117-L121 HydrophobicContact CD1-CG 4.45Å; L117-L121 HydrophobicContact CG-CD1 4.08Å; L117-L121 HydrophobicContact CG-CG 4.25Å; L117-L121 WeakPolarHBondContact O-CG 3.44Å; L117-L121 PolarHBondContact O-N 2.95Å; N118-L121 PolarHBondContact O-N 3.43Å; L121-T123 VanDerWaalsContact C-N 3.32Å; L121-I125 HydrophobicContact CD2-CB 4.37Å; L121-I125 HydrophobicContact CD2-CD1 4.35Å; L121-I125 HydrophobicContact CD2-CG2 3.89Å; L121-S126 WeakPolarHBondContact O-CB 3.45Å; L121-S126 PolarHBondContact O-N 2.99Å; L121-L143 HydrophobicContact CD1-CD1 3.81Å; L121-K146 HydrophobicContact CD1-CB 4.48Å; L121-K146 HydrophobicContact CD1-CD 3.87Å; L121-I147 HydrophobicContact CD2-CD1 4.35Å
122	E	97.9	Very high	97.9	Very high	99 Å²	99	41.6 Å²	41.6	46%	0.463	20%	0.204	S	C	.	.	H	α-helix	trans	-73.1	-25.4	175.1	-73.9	174.2	-167	0	0	112.9	N118 L119 W360	N118-E122 WeakPolarHBondContact O-CB 3.41Å; N118-E122 WeakPolarHBondContact O-CG 3.43Å; N118-E122 PolarHBondContact O-N 3.1Å; L119-E122 PolarHBondContact O-N 3.3Å; E122-W360 WeakPolarHBondContact O-CZ2 3.26Å
123	T	98.7	Very high	97.9	Very high	0 Å²	0	41 Å²	41	0%	0	20%	0.201	C	C	.	.	T	Hydrogen-bonded Turn	trans	-107.7	-112.6	-174.7	61.1	0	0	0	0	111.9	L119 L120 L121 I125 S126 K348 H351 W360	L119-T123 HydrophobicContact CD1-CG2 4.05Å; L119-T123 WeakPolarHBondContact O-CB 3.4Å; L119-T123 WeakPolarHBondContact O-CG2 3.3Å; L119-T123 PolarHBondContact O-N 2.65Å; L119-T123 VanDerWaalsContact O-N 3.08Å; L119-T123 PolarHBondContact O-OG1 2.99Å; L120-T123 CarbonylContact O-C 3.53Å; L120-T123 PolarHBondContact O-N 3.24Å; L120-T123 PolarHBondContact O-OG1 3Å; L121-T123 VanDerWaalsContact C-N 3.32Å; T123-I125 VanDerWaalsContact C-N 3.32Å; T123-I125 PolarHBondContact O-N 3.11Å; T123-S126 WeakPolarHBondContact O-CB 3.47Å; T123-S126 PolarHBondContact O-N 3.41Å; T123-S126 PolarHBondContact O-OG 2.97Å; T123-K348 HydrophobicContact CG2-CG 4.28Å; T123-H351 VanDerWaalsContact C-CE1 3.41Å; T123-H351 VanDerWaalsContact C-ND1 3.33Å; T123-H351 HydrophobicContact CG2-CB 4.04Å; T123-H351 PolarHBondContact O-CE1 3.47Å; T123-W360 HydrophobicContact CG2-CH2 4.14Å; T123-W360 HydrophobicContact CG2-CZ2 4.31Å
124	W	98.6	Very high	98	Very high	0 Å²	0	40.9 Å²	40.9	0%	0	20%	0.201	C	C	.	.	G	3₁₀ helix	trans	-66.9	-29.5	-166.5	70	-95.3	0	0	0	113.6	I104 V106 L120 S126 R127 N128 T132 V187 N191 Y192 V193 V195	I104-W124 HydrophobicContact CD1-CZ3 4.45Å; I104-W124 HydrophobicContact CG2-CH2 3.89Å; I104-W124 HydrophobicContact CG2-CZ3 4.16Å; V106-W124 HydrophobicContact CG2-CH2 3.61Å; V106-W124 HydrophobicContact CG2-CZ2 3.85Å; L120-W124 HydrophobicContact CD1-CZ2 4.23Å; L120-W124 PolarHBondContact O-N 3.5Å; W124-S126 VanDerWaalsContact C-N 3.32Å; W124-R127 PolarHBondContact O-N 2.99Å; W124-N128 PolarHBondContact O-ND2 2.97Å; W124-T132 HydrophobicContact CH2-CG2 3.98Å; W124-T132 HydrophobicContact CZ3-CG2 4.21Å; W124-V187 HydrophobicContact CH2-CG2 4.36Å; W124-V187 HydrophobicContact CZ2-CG2 4.35Å; W124-N191 PolarHBondContact NE1-O 3.15Å; W124-Y192 HydrophobicContact CB-CD1 4.31Å; W124-Y192 HydrophobicContact CB-CD2 4.19Å; W124-Y192 HydrophobicContact CB-CE1 3.91Å; W124-Y192 HydrophobicContact CB-CE2 3.84Å; W124-Y192 HydrophobicContact CB-CG 4.42Å; W124-Y192 AromaticContact CD1-CD2 3.74Å; W124-Y192 AromaticContact CD1-CG 3.94Å; W124-Y192 HydrophobicContact CG-CD2 4.32Å; W124-Y192 HydrophobicContact CG-CE2 4.43Å; W124-Y192 HydrophobicContact CG-CG 4.42Å; W124-V193 WeakPolarHBondContact CB-O 2.95Å; W124-V193 HydrophobicContact CD2-CB 3.97Å; W124-V193 HydrophobicContact CD2-CG2 4.22Å; W124-V193 HydrophobicContact CE3-CB 3.8Å; W124-V193 HydrophobicContact CE3-CG2 4.22Å; W124-V193 HydrophobicContact CH2-CB 4.29Å; W124-V193 HydrophobicContact CH2-CG2 3.83Å; W124-V193 HydrophobicContact CZ2-CB 4.43Å; W124-V193 HydrophobicContact CZ2-CG2 3.81Å; W124-V193 HydrophobicContact CZ3-CB 3.97Å; W124-V193 HydrophobicContact CZ3-CG2 4.03Å; W124-V195 HydrophobicContact CE3-CG2 4.5Å
125	I	98.6	Very high	98	Very high	1 Å²	1	36.1 Å²	36.1	1%	0.005	18%	0.178	C	C	.	.	G	3₁₀ helix	trans	-70.2	-32.2	178.2	-57.5	179	0	0	0	110.6	V106 L117 L120 L121 T123 R127 N128 M129 T132 I134 I147	V106-I125 HydrophobicContact CG2-CD1 4.41Å; L117-I125 HydrophobicContact CD1-CD1 4.27Å; L120-I125 HydrophobicContact CB-CD1 3.5Å; L120-I125 HydrophobicContact CB-CG1 3.98Å; L120-I125 HydrophobicContact CD1-CD1 4.42Å; L120-I125 VanDerWaalsContact O-CB 3.32Å; L120-I125 WeakPolarHBondContact O-CB 3.47Å; L120-I125 WeakPolarHBondContact O-CG1 3.29Å; L120-I125 PolarHBondContact O-N 3.15Å; L121-I125 HydrophobicContact CD2-CB 4.37Å; L121-I125 HydrophobicContact CD2-CD1 4.35Å; L121-I125 HydrophobicContact CD2-CG2 3.89Å; T123-I125 VanDerWaalsContact C-N 3.32Å; T123-I125 PolarHBondContact O-N 3.11Å; I125-R127 PolarHBondContact O-N 3.39Å; I125-N128 CarbonylContact O-C 3.59Å; I125-N128 PolarHBondContact O-N 3.48Å; I125-M129 HydrophobicContact CG2-CG 4.31Å; I125-M129 WeakPolarHBondContact O-CG 3.5Å; I125-M129 PolarHBondContact O-N 3Å; I125-T132 HydrophobicContact CD1-CG2 4.06Å; I125-T132 HydrophobicContact CG1-CG2 4.13Å; I125-T132 HydrophobicContact CG2-CG2 4.04Å; I125-I134 HydrophobicContact CD1-CD1 4.02Å; I125-I147 HydrophobicContact CG2-CD1 4.17Å
126	S	97.8	Very high	98.1	Very high	50 Å²	50	32.6 Å²	32.6	35%	0.35	15%	0.153	S	C	.	.	G	3₁₀ helix	trans	-55.4	-27.7	177.7	73.8	0	0	0	0	113.4	L121 T123 W124	L121-S126 WeakPolarHBondContact O-CB 3.45Å; L121-S126 PolarHBondContact O-N 2.99Å; T123-S126 WeakPolarHBondContact O-CB 3.47Å; T123-S126 PolarHBondContact O-N 3.41Å; T123-S126 PolarHBondContact O-OG 2.97Å; W124-S126 VanDerWaalsContact C-N 3.32Å
127	R	97.1	Very high	98.1	Very high	97 Å²	97	30.6 Å²	30.6	37%	0.366	15%	0.148	S	C	.	.	G	3₁₀ helix	trans	-92.9	-6.2	179.4	-51.4	-64.6	-105.4	179.7	-5.8	113	W124 I125 Y355 D357	W124-R127 PolarHBondContact O-N 2.99Å; I125-R127 PolarHBondContact O-N 3.39Å; R127-Y355 HydrophobicContact CG-CD1 4.44Å; R127-Y355 HydrophobicContact CG-CD2 4.34Å; R127-Y355 HydrophobicContact CG-CE1 4.32Å; R127-Y355 HydrophobicContact CG-CE2 4.26Å; R127-Y355 HydrophobicContact CG-CG 4.43Å; R127-D357 IonicContact CZ-OD2 3.57Å; R127-D357 IonicContact NH1-OD2 2.71Å; R127-D357 IonicContact NH2-OD1 2.9Å; R127-D357 PolarHBondContact NH2-OD1 3.14Å; R127-D357 IonicContact NH2-OD2 2.55Å; R127-D357 PolarHBondContact NH2-OD2 3.39Å
128	N	97.1	Very high	98	Very high	10 Å²	10	31 Å²	31	5%	0.053	15%	0.152	C	C	.	.	T	Hydrogen-bonded Turn	trans	-142.5	21.8	-164.3	-63.3	-70.5	0	0	0	113.8	W124 I125 Q130 Q131 T132 V195	W124-N128 PolarHBondContact O-ND2 2.97Å; I125-N128 CarbonylContact O-C 3.59Å; I125-N128 PolarHBondContact O-N 3.48Å; N128-Q130 VanDerWaalsContact C-N 3.25Å; N128-Q130 PolarHBondContact O-N 2.87Å; N128-Q130 VanDerWaalsContact O-N 3.15Å; N128-Q131 HydrophobicContact CB-CG 4.19Å; N128-Q131 VanDerWaalsContact CG-NE2 3.33Å; N128-Q131 WeakPolarHBondContact O-CG 3.49Å; N128-Q131 PolarHBondContact O-N 3.12Å; N128-Q131 PolarHBondContact O-OE1 3.1Å; N128-Q131 VanDerWaalsContact O-OE1 3.09Å; N128-Q131 PolarHBondContact OD1-NE2 3.26Å; N128-T132 PolarHBondContact O-N 3.46Å; N128-T132 PolarHBondContact O-OG1 2.96Å; N128-T132 VanDerWaalsContact O-OG1 3.04Å; N128-V195 HydrophobicContact CB-CG2 4.07Å; N128-V195 WeakPolarHBondContact ND2-CG2 3.5Å; N128-V195 VanDerWaalsContact OD1-CB 3.23Å; N128-V195 WeakPolarHBondContact OD1-CB 3.19Å; N128-V195 WeakPolarHBondContact OD1-CG1 3.43Å; N128-V195 WeakPolarHBondContact OD1-CG2 3.32Å
129	M	96.9	Very high	98	Very high	77 Å²	77	33.8 Å²	33.8	38%	0.379	16%	0.164	S	C	.	.	T	Hydrogen-bonded Turn	trans	-58	-33.1	-172	-62.7	180	68.7	0	0	114.1	I125 Q131 T132 K146 I147 H150	I125-M129 HydrophobicContact CG2-CG 4.31Å; I125-M129 WeakPolarHBondContact O-CG 3.5Å; I125-M129 PolarHBondContact O-N 3Å; M129-Q131 VanDerWaalsContact C-N 3.29Å; M129-Q131 PolarHBondContact O-N 3.37Å; M129-T132 PolarHBondContact O-N 3.36Å; M129-K146 WeakPolarHBondContact CE-O 3.46Å; M129-I147 HydrophobicContact CE-CG1 4.17Å; M129-H150 PolarHBondContact O-CE1 2.85Å; M129-H150 PolarHBondContact O-ND1 3.11Å
130	Q	96.4	Very high	97.9	Very high	154 Å²	154	34 Å²	34	72%	0.72	17%	0.165	S	C	*	.	T	Hydrogen-bonded Turn	trans	-70.1	-24.5	-175.4	-69.3	-173.9	-17.9	0	0	113.8	N128 H150	N128-Q130 VanDerWaalsContact C-N 3.25Å; N128-Q130 PolarHBondContact O-N 2.87Å; N128-Q130 VanDerWaalsContact O-N 3.15Å; Q130-H150 PolarHBondContact O-CE1 2.84Å; Q130-H150 VanDerWaalsContact O-CE1 3.26Å
131	Q	97.4	Very high	97.8	Very high	12 Å²	12	39.2 Å²	39.2	6%	0.056	19%	0.193	C	C	.	.	T	Hydrogen-bonded Turn	trans	-106.7	-6.5	-178.6	59.4	-87.9	30.7	0	0	112.8	A99 I102 I104 N128 M129	A99-Q131 WeakPolarHBondContact O-CB 3.31Å; I102-Q131 VanDerWaalsContact O-CB 3.25Å; I102-Q131 WeakPolarHBondContact O-CB 3.48Å; I104-Q131 HydrophobicContact CD1-CG 4.02Å; I104-Q131 PolarHBondContact N-O 2.97Å; N128-Q131 HydrophobicContact CB-CG 4.19Å; N128-Q131 VanDerWaalsContact CG-NE2 3.33Å; N128-Q131 WeakPolarHBondContact O-CG 3.49Å; N128-Q131 PolarHBondContact O-N 3.12Å; N128-Q131 PolarHBondContact O-OE1 3.1Å; N128-Q131 VanDerWaalsContact O-OE1 3.09Å; N128-Q131 PolarHBondContact OD1-NE2 3.26Å; M129-Q131 VanDerWaalsContact C-N 3.29Å; M129-Q131 PolarHBondContact O-N 3.37Å
132	T	98.8	Very high	97.7	Very high	0 Å²	0	43 Å²	43	0%	0	21%	0.21	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-102.5	127.9	-176.5	-58.4	0	0	0	0	111.6	I104 V106 W124 I125 N128 M129 I134 H150	I104-T132 WeakPolarHBondContact O-CA 3.46Å; V106-T132 HydrophobicContact CG2-CG2 3.65Å; W124-T132 HydrophobicContact CH2-CG2 3.98Å; W124-T132 HydrophobicContact CZ3-CG2 4.21Å; I125-T132 HydrophobicContact CD1-CG2 4.06Å; I125-T132 HydrophobicContact CG1-CG2 4.13Å; I125-T132 HydrophobicContact CG2-CG2 4.04Å; N128-T132 PolarHBondContact O-N 3.46Å; N128-T132 PolarHBondContact O-OG1 2.96Å; N128-T132 VanDerWaalsContact O-OG1 3.04Å; M129-T132 PolarHBondContact O-N 3.36Å; T132-I134 HydrophobicContact CG2-CD1 3.98Å; T132-H150 WeakPolarHBondContact O-CB 3.35Å; T132-H150 PolarHBondContact O-ND1 2.84Å
133	Y	98.9	Very high	97.6	Very high	38 Å²	38	38.6 Å²	38.6	15%	0.149	19%	0.19	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-121.6	130	179.5	-61.8	-98.1	0	0	0	109.1	F103 I104 V106 H150 I152	F103-Y133 HydrophobicContact CD1-CD2 4.32Å; F103-Y133 AromaticContact CD2-CD2 3.63Å; F103-Y133 HydrophobicContact CD2-CD2 3.63Å; F103-Y133 AromaticContact CD2-CE2 3.43Å; F103-Y133 HydrophobicContact CD2-CE2 3.43Å; F103-Y133 VanDerWaalsContact CD2-CE2 3.43Å; F103-Y133 HydrophobicContact CD2-CG 4.44Å; F103-Y133 HydrophobicContact CE1-CD2 4.03Å; F103-Y133 HydrophobicContact CE1-CG 4.26Å; F103-Y133 HydrophobicContact CE2-CD1 4.01Å; F103-Y133 AromaticContact CE2-CD2 3.27Å; F103-Y133 HydrophobicContact CE2-CD2 3.27Å; F103-Y133 HydrophobicContact CE2-CE1 4.03Å; F103-Y133 AromaticContact CE2-CE2 3.31Å; F103-Y133 HydrophobicContact CE2-CE2 3.31Å; F103-Y133 AromaticContact CE2-CG 3.65Å; F103-Y133 HydrophobicContact CE2-CG 3.65Å; F103-Y133 AromaticContact CE2-CZ 3.7Å; F103-Y133 HydrophobicContact CG-CD2 4.14Å; F103-Y133 HydrophobicContact CG-CE2 4.24Å; F103-Y133 HydrophobicContact CZ-CD1 4.1Å; F103-Y133 AromaticContact CZ-CD2 3.49Å; F103-Y133 HydrophobicContact CZ-CD2 3.49Å; F103-Y133 VanDerWaalsContact CZ-CD2 3.49Å; F103-Y133 HydrophobicContact CZ-CE2 4.04Å; F103-Y133 AromaticContact CZ-CG 3.53Å; F103-Y133 HydrophobicContact CZ-CG 3.53Å; I104-Y133 PolarHBondContact O-N 3.19Å; V106-Y133 PolarHBondContact N-O 3.19Å; Y133-H150 HydrophobicContact CD1-CB 4.07Å; Y133-H150 AromaticContact CD1-CD2 3.79Å; Y133-H150 AromaticContact CD1-CG 3.81Å; Y133-H150 AromaticContact CE1-CD2 3.38Å; Y133-H150 WeakPolarHBondContact CE1-CD2 3.39Å; Y133-H150 AromaticContact CE1-CE1 3.95Å; Y133-H150 AromaticContact CE1-CG 3.81Å; Y133-H150 AromaticContact CE1-NE2 3.51Å; Y133-H150 AromaticContact CZ-CE1 3.88Å; Y133-H150 AromaticContact CZ-NE2 3.74Å; Y133-I152 HydrophobicContact CD1-CD1 4.13Å
134	I	98.9	Very high	97.5	Very high	0 Å²	0	42.6 Å²	42.6	0%	0	21%	0.208	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-100.8	121.6	-178.2	-49.9	-53.4	0	0	0	109.1	V106 T108 L117 I125 T132 L143 I147 H150 I152	V106-I134 HydrophobicContact CB-CD1 3.68Å; V106-I134 HydrophobicContact CG1-CD1 4.24Å; V106-I134 HydrophobicContact CG2-CD1 3.93Å; T108-I134 HydrophobicContact CG2-CG2 3.58Å; L117-I134 HydrophobicContact CD1-CD1 3.78Å; L117-I134 HydrophobicContact CD1-CG1 4.26Å; L117-I134 HydrophobicContact CD1-CG2 4.22Å; L117-I134 HydrophobicContact CD2-CG2 3.81Å; I125-I134 HydrophobicContact CD1-CD1 4.02Å; T132-I134 HydrophobicContact CG2-CD1 3.98Å; I134-L143 HydrophobicContact CG2-CD2 4.23Å; I134-I147 HydrophobicContact CD1-CD1 4.26Å; I134-I147 HydrophobicContact CG1-CD1 3.85Å; I134-I147 HydrophobicContact CG1-CG2 4.36Å; I134-H150 PolarHBondContact N-O 3.48Å; I134-I152 PolarHBondContact O-N 3.32Å
135	F	98.8	Very high	97.5	Very high	0 Å²	0	50.9 Å²	50.9	0%	0	24%	0.244	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-106.7	114.5	178.7	-66.8	-98.3	0	0	0	109.4	F103 A105 V106 T108 I152 T154 V171 E172 K175	F103-F135 AromaticContact CE1-CE2 3.94Å; F103-F135 HydrophobicContact CE1-CE2 3.94Å; F103-F135 AromaticContact CE1-CZ 3.96Å; F103-F135 HydrophobicContact CE1-CZ 3.96Å; F103-F135 HydrophobicContact CZ-CE2 4.13Å; F103-F135 AromaticContact CZ-CZ 3.85Å; F103-F135 HydrophobicContact CZ-CZ 3.85Å; A105-F135 HydrophobicContact CB-CD2 3.97Å; A105-F135 HydrophobicContact CB-CE2 3.67Å; V106-F135 PolarHBondContact O-N 3.02Å; T108-F135 PolarHBondContact N-O 2.92Å; F135-I152 HydrophobicContact CD1-CB 4.2Å; F135-I152 HydrophobicContact CD1-CD1 4.37Å; F135-I152 HydrophobicContact CD1-CG2 4.09Å; F135-I152 HydrophobicContact CE1-CB 4.34Å; F135-I152 HydrophobicContact CE1-CD1 3.72Å; F135-I152 HydrophobicContact CE1-CG2 4.17Å; F135-I152 HydrophobicContact CE2-CD1 4.35Å; F135-I152 HydrophobicContact CZ-CD1 3.7Å; F135-T154 HydrophobicContact CB-CG2 4.03Å; F135-T154 HydrophobicContact CD1-CG2 4.01Å; F135-V171 HydrophobicContact CD1-CB 4.41Å; F135-V171 HydrophobicContact CD1-CG1 4.02Å; F135-V171 HydrophobicContact CE1-CG1 3.98Å; F135-E172 HydrophobicContact CB-CG 3.96Å; F135-E172 HydrophobicContact CD1-CB 4.44Å; F135-E172 HydrophobicContact CD1-CG 3.69Å; F135-E172 HydrophobicContact CD2-CG 3.55Å; F135-E172 VanDerWaalsContact CE1-CA 3.46Å; F135-E172 HydrophobicContact CE1-CB 4.3Å; F135-E172 HydrophobicContact CE1-CG 4Å; F135-E172 HydrophobicContact CE2-CB 4.36Å; F135-E172 HydrophobicContact CE2-CG 3.87Å; F135-E172 HydrophobicContact CG-CG 3.45Å; F135-E172 VanDerWaalsContact CG-CG 3.45Å; F135-E172 HydrophobicContact CZ-CB 4.26Å; F135-E172 HydrophobicContact CZ-CG 4.09Å; F135-K175 HydrophobicContact CE1-CB 3.92Å; F135-K175 HydrophobicContact CE1-CG 3.81Å; F135-K175 HydrophobicContact CZ-CB 3.77Å; F135-K175 HydrophobicContact CZ-CG 4.12Å
136	T	98.6	Very high	97.4	Very high	4 Å²	4	55.2 Å²	55.2	3%	0.025	26%	0.262	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-129.9	173.5	-175.4	-170	0	0	0	0	112	K110 H113 G138 I152 T154	K110-T136 PolarHBondContact N-OG1 2.68Å; H113-T136 WeakPolarHBondContact NE2-CB 3.39Å; H113-T136 PolarHBondContact NE2-OG1 2.91Å; T136-G138 VanDerWaalsContact CG2-O 3.31Å; T136-G138 WeakPolarHBondContact CG2-O 3.31Å; T136-I152 PolarHBondContact N-O 3.03Å; T136-T154 WeakPolarHBondContact O-CB 3.48Å; T136-T154 WeakPolarHBondContact O-CG2 3.43Å; T136-T154 PolarHBondContact O-N 3.42Å; T136-T154 PolarHBondContact O-OG1 2.82Å
137	D	98.1	Very high	97.3	Very high	23 Å²	23	53.4 Å²	53.4	12%	0.123	25%	0.248	C	C	.	.	S	Bend	trans	-107.4	9	179.1	46.4	57.9	0	0	0	113.6	T109 K110 C156 A158 K168	T109-D137 WeakPolarHBondContact CA-OD2 3.41Å; T109-D137 WeakPolarHBondContact CB-OD2 3.42Å; T109-D137 VanDerWaalsContact OG1-CG 3.27Å; T109-D137 PolarHBondContact OG1-OD1 3.44Å; T109-D137 PolarHBondContact OG1-OD2 3.36Å; K110-D137 PolarHBondContact N-OD1 2.88Å; D137-C156 VanDerWaalsContact CB-O 3.32Å; D137-C156 WeakPolarHBondContact CB-O 3.41Å; D137-A158 HydrophobicContact CB-CB 4.11Å; D137-A158 WeakPolarHBondContact OD2-CA 3.43Å; D137-K168 WeakPolarHBondContact OD2-CE 3.36Å; D137-K168 IonicContact OD2-NZ 2.71Å; D137-K168 PolarHBondContact OD2-NZ 2.91Å
138	G	96.6	Very high	97.2	Very high	10 Å²	10	50.5 Å²	50.5	10%	0.103	25%	0.249	C	C	.	.	S	Bend	trans	-161.5	152.7	173.8	0	0	0	0	0	114.8	T136	T136-G138 VanDerWaalsContact CG2-O 3.31Å; T136-G138 WeakPolarHBondContact CG2-O 3.31Å
139	E	96.1	Very high	97.2	Very high	86 Å²	86	55.2 Å²	55.2	40%	0.402	28%	0.283	S	S	.	.			trans	-64.3	142.1	177.4	-59.7	-60	159	0	0	112.3	K110 K144 N153	K110-E139 WeakPolarHBondContact CE-O 3.38Å; K110-E139 PolarHBondContact NZ-O 3.36Å; E139-K144 WeakPolarHBondContact OE2-CE 3.46Å; E139-K144 IonicContact OE2-NZ 3.14Å; E139-K144 PolarHBondContact OE2-NZ 2.78Å; E139-N153 WeakPolarHBondContact OE1-CB 3.3Å; E139-N153 PolarHBondContact OE1-ND2 2.99Å
140	D	97.2	Very high	97.3	Very high	30 Å²	30	53.1 Å²	53.1	16%	0.16	27%	0.272	C	S	.	.			trans	-151.3	111.1	176.6	-174.7	-35	0	0	0	109.9	H113 E142 L143 K144	H113-D140 IonicContact CE1-OD2 2.82Å; H113-D140 IonicContact CG-OD2 3.78Å; H113-D140 WeakPolarHBondContact ND1-CB 3.33Å; H113-D140 IonicContact ND1-OD2 3.69Å; H113-D140 PolarHBondContact ND1-OD2 3.05Å; D140-E142 VanDerWaalsContact C-N 3.33Å; D140-E142 PolarHBondContact O-N 3.06Å; D140-E142 WeakPolarHBondContact OD1-CA 3.36Å; D140-E142 WeakPolarHBondContact OD1-CB 3.28Å; D140-E142 PolarHBondContact OD1-N 3.27Å; D140-L143 HydrophobicContact CB-CB 3.87Å; D140-L143 PolarHBondContact O-N 3.46Å; D140-L143 PolarHBondContact OD1-N 3.23Å; D140-K144 WeakPolarHBondContact O-CG 3.27Å; D140-K144 PolarHBondContact O-N 2.76Å
141	D	96.8	Very high	97.4	Very high	110 Å²	110	46.6 Å²	46.6	59%	0.588	24%	0.244	S	C	*	.	H	α-helix	trans	-70.5	-27.9	-177.3	-68.2	-27.2	0	0	0	112.8	K145	D141-K145 WeakPolarHBondContact O-CB 3.37Å; D141-K145 WeakPolarHBondContact O-CD 3.42Å; D141-K145 WeakPolarHBondContact O-CG 3.37Å; D141-K145 PolarHBondContact O-N 2.05Å
142	E	96.3	Very high	97.4	Very high	101 Å²	101	47.1 Å²	47.1	47%	0.472	25%	0.247	S	C	.	.	H	α-helix	trans	-70.9	-43.2	175.5	-62.9	-172.8	163.4	0	0	110.6	Q114 D140 K145 K146	Q114-E142 PolarHBondContact NE2-OE2 2.9Å; Q114-E142 VanDerWaalsContact NE2-OE2 3.1Å; D140-E142 VanDerWaalsContact C-N 3.33Å; D140-E142 PolarHBondContact O-N 3.06Å; D140-E142 WeakPolarHBondContact OD1-CA 3.36Å; D140-E142 WeakPolarHBondContact OD1-CB 3.28Å; D140-E142 PolarHBondContact OD1-N 3.27Å; E142-K145 PolarHBondContact O-N 2.76Å; E142-K146 WeakPolarHBondContact O-CG 3.34Å; E142-K146 PolarHBondContact O-N 3.48Å
143	L	97	Very high	97.4	Very high	8 Å²	8	48.6 Å²	48.6	4%	0.042	26%	0.255	C	S	.	.	H	α-helix	trans	-61.3	-45.5	174.5	178.8	57.4	0	0	0	111	L117 L121 I134 D140 K145 K146 I147 A151	L117-L143 HydrophobicContact CD2-CD1 3.54Å; L117-L143 HydrophobicContact CD2-CD2 3.69Å; L117-L143 HydrophobicContact CD2-CG 4.25Å; L117-L143 HydrophobicContact CG-CD1 4.45Å; L121-L143 HydrophobicContact CD1-CD1 3.81Å; I134-L143 HydrophobicContact CG2-CD2 4.23Å; D140-L143 HydrophobicContact CB-CB 3.87Å; D140-L143 PolarHBondContact O-N 3.46Å; D140-L143 PolarHBondContact OD1-N 3.23Å; L143-K145 VanDerWaalsContact C-N 3.32Å; L143-K145 PolarHBondContact O-N 2.84Å; L143-K146 PolarHBondContact O-N 3.26Å; L143-I147 HydrophobicContact CD1-CG2 3.97Å; L143-I147 HydrophobicContact CG-CG2 4.36Å; L143-I147 PolarHBondContact O-N 3.38Å; L143-A151 HydrophobicContact CD2-CB 4.09Å; L143-A151 HydrophobicContact CG-CB 3.87Å
144	K	96.6	Very high	97.3	Very high	84 Å²	84	47.5 Å²	47.5	37%	0.365	25%	0.252	S	S	.	.	H	α-helix	trans	-61	-38.1	175.2	-76	179.7	-180	177.2	0	112.8	E139 D140 K146 G148 A151	E139-K144 WeakPolarHBondContact OE2-CE 3.46Å; E139-K144 IonicContact OE2-NZ 3.14Å; E139-K144 PolarHBondContact OE2-NZ 2.78Å; D140-K144 WeakPolarHBondContact O-CG 3.27Å; D140-K144 PolarHBondContact O-N 2.76Å; K144-K146 VanDerWaalsContact C-N 3.28Å; K144-K146 PolarHBondContact O-N 3.09Å; K144-G148 WeakPolarHBondContact O-CA 3.34Å; K144-G148 PolarHBondContact O-N 3.24Å; K144-A151 HydrophobicContact CG-CB 4.11Å
145	K	97.1	Very high	97.3	Very high	174 Å²	174	54 Å²	54	76%	0.757	29%	0.287	S	S	*	.	H	α-helix	trans	-63	-36	173.3	-75.6	166.3	-173.4	172.6	0	111.9	D141 E142 L143	D141-K145 WeakPolarHBondContact O-CB 3.37Å; D141-K145 WeakPolarHBondContact O-CD 3.42Å; D141-K145 WeakPolarHBondContact O-CG 3.37Å; D141-K145 PolarHBondContact O-N 2.05Å; E142-K145 PolarHBondContact O-N 2.76Å; L143-K145 VanDerWaalsContact C-N 3.32Å; L143-K145 PolarHBondContact O-N 2.84Å
146	K	96.3	Very high	97.2	Very high	92 Å²	92	54.4 Å²	54.4	40%	0.4	29%	0.29	S	S	.	.	H	α-helix	trans	-76.4	-46.8	-179	-70.9	174.5	-177.4	175.5	0	113	N118 L121 M129 E142 L143 K144	N118-K146 PolarHBondContact OD1-NZ 3.47Å; L121-K146 HydrophobicContact CD1-CB 4.48Å; L121-K146 HydrophobicContact CD1-CD 3.87Å; M129-K146 WeakPolarHBondContact CE-O 3.46Å; E142-K146 WeakPolarHBondContact O-CG 3.34Å; E142-K146 PolarHBondContact O-N 3.48Å; L143-K146 PolarHBondContact O-N 3.26Å; K144-K146 VanDerWaalsContact C-N 3.28Å; K144-K146 PolarHBondContact O-N 3.09Å
147	I	96.3	Very high	97.2	Very high	11 Å²	11	57.5 Å²	57.5	6%	0.056	31%	0.311	C	S	.	.	H	α-helix	trans	-121.1	4.7	-171.3	-148.4	-175.7	0	0	0	114.3	L121 I125 M129 I134 L143 H150 A151	L121-I147 HydrophobicContact CD2-CD1 4.35Å; I125-I147 HydrophobicContact CG2-CD1 4.17Å; M129-I147 HydrophobicContact CE-CG1 4.17Å; I134-I147 HydrophobicContact CD1-CD1 4.26Å; I134-I147 HydrophobicContact CG1-CD1 3.85Å; I134-I147 HydrophobicContact CG1-CG2 4.36Å; L143-I147 HydrophobicContact CD1-CG2 3.97Å; L143-I147 HydrophobicContact CG-CG2 4.36Å; L143-I147 PolarHBondContact O-N 3.38Å; I147-H150 HydrophobicContact CD1-CB 4.05Å; I147-H150 HydrophobicContact CG1-CB 3.98Å; I147-H150 HydrophobicContact CG2-CB 4.35Å; I147-H150 WeakPolarHBondContact O-CB 3.28Å; I147-H150 PolarHBondContact O-N 3.15Å; I147-A151 HydrophobicContact CG2-CB 3.77Å
148	G	95.8	Very high	97.1	Very high	37 Å²	37	59 Å²	59	38%	0.381	33%	0.327	S	S	.	.	G	3₁₀ helix	trans	62.5	-137	172.9	0	0	0	0	0	113.4	K144 H150 A151	K144-G148 WeakPolarHBondContact O-CA 3.34Å; K144-G148 PolarHBondContact O-N 3.24Å; G148-H150 PolarHBondContact O-N 2.98Å; G148-H150 VanDerWaalsContact O-N 3.12Å; G148-A151 PolarHBondContact O-N 2.8Å
149	S	96.3	Very high	97	Very high	108 Å²	108	60.6 Å²	60.6	76%	0.755	34%	0.34	S	S	*	.	G	3₁₀ helix	trans	-67.2	-6.1	179.9	55	0	0	0	0	114.2	A151	S149-A151 VanDerWaalsContact C-N 3.28Å
150	H	98.3	Very high	96.8	Very high	34 Å²	34	64 Å²	64	16%	0.157	36%	0.355	C	S	.	.	G	3₁₀ helix	trans	-81.8	-7.4	175.3	-66.5	-171.1	0	0	0	112.6	M129 Q130 T132 Y133 I134 I147 G148 I152	M129-H150 PolarHBondContact O-CE1 2.85Å; M129-H150 PolarHBondContact O-ND1 3.11Å; Q130-H150 PolarHBondContact O-CE1 2.84Å; Q130-H150 VanDerWaalsContact O-CE1 3.26Å; T132-H150 WeakPolarHBondContact O-CB 3.35Å; T132-H150 PolarHBondContact O-ND1 2.84Å; Y133-H150 HydrophobicContact CD1-CB 4.07Å; Y133-H150 AromaticContact CD1-CD2 3.79Å; Y133-H150 AromaticContact CD1-CG 3.81Å; Y133-H150 AromaticContact CE1-CD2 3.38Å; Y133-H150 WeakPolarHBondContact CE1-CD2 3.39Å; Y133-H150 AromaticContact CE1-CE1 3.95Å; Y133-H150 AromaticContact CE1-CG 3.81Å; Y133-H150 AromaticContact CE1-NE2 3.51Å; Y133-H150 AromaticContact CZ-CE1 3.88Å; Y133-H150 AromaticContact CZ-NE2 3.74Å; I134-H150 PolarHBondContact N-O 3.48Å; I147-H150 HydrophobicContact CD1-CB 4.05Å; I147-H150 HydrophobicContact CG1-CB 3.98Å; I147-H150 HydrophobicContact CG2-CB 4.35Å; I147-H150 WeakPolarHBondContact O-CB 3.28Å; I147-H150 PolarHBondContact O-N 3.15Å; G148-H150 PolarHBondContact O-N 2.98Å; G148-H150 VanDerWaalsContact O-N 3.12Å; H150-I152 PolarHBondContact O-N 3.31Å
151	A	98.4	Very high	96.7	Very high	16 Å²	16	64.6 Å²	64.6	13%	0.132	36%	0.362	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-83.8	103.5	167.1	0	0	0	0	0	109.9	L143 K144 I147 G148 S149	L143-A151 HydrophobicContact CD2-CB 4.09Å; L143-A151 HydrophobicContact CG-CB 3.87Å; K144-A151 HydrophobicContact CG-CB 4.11Å; I147-A151 HydrophobicContact CG2-CB 3.77Å; G148-A151 PolarHBondContact O-N 2.8Å; S149-A151 VanDerWaalsContact C-N 3.28Å
152	I	98.6	Very high	96.6	Very high	24 Å²	24	63.5 Å²	63.5	12%	0.123	35%	0.349	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-107.2	110	-173.8	-59.4	169.5	0	0	0	109	Y133 I134 F135 T136 H150 T154 V171 K175	Y133-I152 HydrophobicContact CD1-CD1 4.13Å; I134-I152 PolarHBondContact O-N 3.32Å; F135-I152 HydrophobicContact CD1-CB 4.2Å; F135-I152 HydrophobicContact CD1-CD1 4.37Å; F135-I152 HydrophobicContact CD1-CG2 4.09Å; F135-I152 HydrophobicContact CE1-CB 4.34Å; F135-I152 HydrophobicContact CE1-CD1 3.72Å; F135-I152 HydrophobicContact CE1-CG2 4.17Å; F135-I152 HydrophobicContact CE2-CD1 4.35Å; F135-I152 HydrophobicContact CZ-CD1 3.7Å; T136-I152 PolarHBondContact N-O 3.03Å; H150-I152 PolarHBondContact O-N 3.31Å; I152-T154 PolarHBondContact O-N 3.42Å; I152-V171 HydrophobicContact CG2-CG1 4.34Å; I152-K175 HydrophobicContact CD1-CD 4.12Å; I152-K175 HydrophobicContact CD1-CG 4.08Å
153	N	98.3	Very high	96.6	Very high	31 Å²	31	62.6 Å²	62.6	17%	0.166	35%	0.345	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-77	113.7	165.3	179	11.2	0	0	0	109.3	E139 N155	E139-N153 WeakPolarHBondContact OE1-CB 3.3Å; E139-N153 PolarHBondContact OE1-ND2 2.99Å; N153-N155 VanDerWaalsContact C-N 3.26Å; N153-N155 PolarHBondContact ND2-OD1 2.81Å; N153-N155 VanDerWaalsContact ND2-OD1 3.07Å; N153-N155 PolarHBondContact O-N 3.05Å; N153-N155 PolarHBondContact OD1-N 3.27Å
154	T	98	Very high	96.6	Very high	15 Å²	15	62.4 Å²	62.4	9%	0.092	35%	0.345	C	S	.	.			trans	-74.5	-16.7	-179	61	0	0	0	0	113	F135 T136 I152 C156 K168 V171	F135-T154 HydrophobicContact CB-CG2 4.03Å; F135-T154 HydrophobicContact CD1-CG2 4.01Å; T136-T154 WeakPolarHBondContact O-CB 3.48Å; T136-T154 WeakPolarHBondContact O-CG2 3.43Å; T136-T154 PolarHBondContact O-N 3.42Å; T136-T154 PolarHBondContact O-OG1 2.82Å; I152-T154 PolarHBondContact O-N 3.42Å; T154-C156 PolarHBondContact O-N 3.33Å; T154-C156 VanDerWaalsContact O-N 3.09Å; T154-C156 WeakPolarHBondContact OG1-CB 3.33Å; T154-C156 PolarHBondContact OG1-N 3.42Å; T154-K168 HydrophobicContact CG2-CG 4.26Å; T154-V171 HydrophobicContact CG2-CB 3.98Å; T154-V171 HydrophobicContact CG2-CG1 3.99Å; T154-V171 HydrophobicContact CG2-CG2 4.29Å
155	N	97.5	Very high	96.6	Very high	135 Å²	135	59.9 Å²	59.9	72%	0.722	34%	0.335	S	S	*	.			trans	55.9	15.7	-167.3	-58	-52	0	0	0	113.9	N153	N153-N155 VanDerWaalsContact C-N 3.26Å; N153-N155 PolarHBondContact ND2-OD1 2.81Å; N153-N155 VanDerWaalsContact ND2-OD1 3.07Å; N153-N155 PolarHBondContact O-N 3.05Å; N153-N155 PolarHBondContact OD1-N 3.27Å
156	C	97.6	Very high	96.7	Very high	9 Å²	9	51.6 Å²	51.6	6%	0.061	30%	0.299	C	S	.	.			trans	-76.1	162.7	170.6	-63	0	0	0	0	110.6	D137 T154 C167 K168	D137-C156 VanDerWaalsContact CB-O 3.32Å; D137-C156 WeakPolarHBondContact CB-O 3.41Å; T154-C156 PolarHBondContact O-N 3.33Å; T154-C156 VanDerWaalsContact O-N 3.09Å; T154-C156 WeakPolarHBondContact OG1-CB 3.33Å; T154-C156 PolarHBondContact OG1-N 3.42Å; C156-C167 HydrophobicContact CB-CB 3.72Å; C156-C167 WeakPolarHBondContact CB-SG 3.44Å; C156-C167 WeakPolarHBondContact SG-CB 3.25Å; C156-C167 PolarHBondContact SG-O 3Å; C156-C167 CovalentContact SG-SG 2.04Å; C156-C167 PolarHBondContact SG-SG 3.44Å; C156-K168 HydrophobicContact CB-CG 3.95Å; C156-K168 PolarHBondContact SG-N 3.22Å
157	S	97.2	Very high	96.8	Very high	69 Å²	69	49 Å²	49	48%	0.483	29%	0.292	S	S	.	.			trans	-60	144.7	175.1	178.8	0	0	0	0	112.2	A159 K168	S157-A159 PolarHBondContact O-N 3.12Å; S157-A159 WeakPolarHBondContact OG-CB 3.37Å; S157-A159 PolarHBondContact OG-N 2.81Å; S157-A159 VanDerWaalsContact OG-N 3.13Å; S157-K168 PolarHBondContact O-NZ 3.05Å
158	A	96.1	Very high	96.9	Very high	55 Å²	55	48.7 Å²	48.7	46%	0.455	29%	0.29	S	S	.	.	S	Bend	trans	-78	-2.6	171.3	0	0	0	0	0	113.6	D137	D137-A158 HydrophobicContact CB-CB 4.11Å; D137-A158 WeakPolarHBondContact OD2-CA 3.43Å
159	A	95.1	Very high	97	Very high	44 Å²	44	46.9 Å²	46.9	36%	0.364	27%	0.272	S	S	.	.	S	Bend	trans	-64.5	152	175.2	0	0	0	0	0	111.5	S157 S161 A164	S157-A159 PolarHBondContact O-N 3.12Å; S157-A159 WeakPolarHBondContact OG-CB 3.37Å; S157-A159 PolarHBondContact OG-N 2.81Å; S157-A159 VanDerWaalsContact OG-N 3.13Å; A159-S161 PolarHBondContact O-N 3.44Å; A159-A164 HydrophobicContact CB-CB 4.28Å; A159-A164 WeakPolarHBondContact O-CB 3.23Å
160	H	91.5	Very high	97.1	Very high	156 Å²	156	42.1 Å²	42.1	72%	0.722	24%	0.239	S	C	*	.			trans	-92.6	45.3	171.6	-159.9	83.8	0	0	0	110.7
161	S	96.1	Very high	97.2	Very high	43 Å²	43	42.1 Å²	42.1	30%	0.301	24%	0.241	S	C	.	.	S	Bend	trans	-96.9	158	178.5	69.8	0	0	0	0	111.2	A159 Q163 A164 L165	A159-S161 PolarHBondContact O-N 3.44Å; S161-Q163 PolarHBondContact O-N 2.94Å; S161-A164 PolarHBondContact O-N 3.5Å; S161-A164 WeakPolarHBondContact OG-CB 3.1Å; S161-A164 PolarHBondContact OG-N 3.42Å; S161-L165 WeakPolarHBondContact O-CG 3.49Å; S161-L165 PolarHBondContact O-N 3.45Å
162	R	94.9	Very high	97.2	Very high	87 Å²	87	41.4 Å²	41.4	33%	0.328	24%	0.235	S	C	.	.	H	α-helix	trans	-52.6	-42.8	176.9	-64	179.1	-62.5	111.3	-0.5	112	S166 R274	R162-S166 WeakPolarHBondContact O-CB 3.09Å; R162-S166 PolarHBondContact O-N 3Å; R162-S166 PolarHBondContact O-OG 3.04Å; R162-R274 PolarHBondContact NH1-O 2.86Å
163	Q	96.3	Very high	97.2	Very high	82 Å²	82	40.3 Å²	40.3	38%	0.383	23%	0.229	S	C	.	.	H	α-helix	trans	-65.9	-42.3	177.6	-64.9	86.4	-2.8	0	0	112.3	S161 C167 M267	S161-Q163 PolarHBondContact O-N 2.94Å; Q163-C167 VanDerWaalsContact O-CB 3.25Å; Q163-C167 WeakPolarHBondContact O-CB 3.46Å; Q163-C167 PolarHBondContact O-N 3.06Å; Q163-M267 HydrophobicContact CB-CE 4.1Å; Q163-M267 WeakPolarHBondContact O-CE 3.49Å
164	A	96.9	Very high	97.2	Very high	4 Å²	4	40.5 Å²	40.5	3%	0.033	23%	0.231	C	C	.	.	H	α-helix	trans	-67.5	-42.1	-179.4	0	0	0	0	0	112.2	A159 S161 C167 K168	A159-A164 HydrophobicContact CB-CB 4.28Å; A159-A164 WeakPolarHBondContact O-CB 3.23Å; S161-A164 PolarHBondContact O-N 3.5Å; S161-A164 WeakPolarHBondContact OG-CB 3.1Å; S161-A164 PolarHBondContact OG-N 3.42Å; A164-C167 WeakPolarHBondContact O-CB 3.42Å; A164-C167 PolarHBondContact O-N 3.32Å; A164-K168 PolarHBondContact O-N 2.96Å
165	L	97.2	Very high	97.2	Very high	31 Å²	31	43.3 Å²	43.3	16%	0.162	24%	0.242	C	C	.	.	H	α-helix	trans	-66.9	-45.2	176.2	-64.9	174.5	0	0	0	111.5	K107 S161 C167 K168 M169 D277	K107-L165 HydrophobicContact CD-CD2 4.13Å; S161-L165 WeakPolarHBondContact O-CG 3.49Å; S161-L165 PolarHBondContact O-N 3.45Å; L165-C167 PolarHBondContact O-N 3.27Å; L165-K168 PolarHBondContact O-N 3.38Å; L165-K168 VanDerWaalsContact O-N 3.16Å; L165-M169 PolarHBondContact O-N 3.25Å; L165-D277 HydrophobicContact CB-CB 4.47Å
166	S	97.9	Very high	97.3	Very high	1 Å²	1	36.9 Å²	36.9	1%	0.007	21%	0.207	C	C	.	.	H	α-helix	trans	-61.6	-34	175.8	-59.5	0	0	0	0	112.3	R162 M169 A170 F266 M267	R162-S166 WeakPolarHBondContact O-CB 3.09Å; R162-S166 PolarHBondContact O-N 3Å; R162-S166 PolarHBondContact O-OG 3.04Å; S166-M169 PolarHBondContact O-N 2.95Å; S166-A170 WeakPolarHBondContact O-CB 3.38Å; S166-A170 PolarHBondContact O-N 3.46Å; S166-F266 WeakPolarHBondContact O-CD1 3.29Å; S166-M267 VanDerWaalsContact CB-SD 3.52Å
167	C	98.4	Very high	97.4	Very high	36 Å²	36	38 Å²	38	24%	0.243	21%	0.212	C	C	.	.	H	α-helix	trans	-64.5	-46.1	176.1	-179.9	0	0	0	0	110.8	C156 Q163 A164 L165 A170 V171 M267	C156-C167 HydrophobicContact CB-CB 3.72Å; C156-C167 WeakPolarHBondContact CB-SG 3.44Å; C156-C167 WeakPolarHBondContact SG-CB 3.25Å; C156-C167 PolarHBondContact SG-O 3Å; C156-C167 CovalentContact SG-SG 2.04Å; C156-C167 PolarHBondContact SG-SG 3.44Å; Q163-C167 VanDerWaalsContact O-CB 3.25Å; Q163-C167 WeakPolarHBondContact O-CB 3.46Å; Q163-C167 PolarHBondContact O-N 3.06Å; A164-C167 WeakPolarHBondContact O-CB 3.42Å; A164-C167 PolarHBondContact O-N 3.32Å; L165-C167 PolarHBondContact O-N 3.27Å; C167-A170 WeakPolarHBondContact O-CB 3.42Å; C167-A170 PolarHBondContact O-N 2.8Å; C167-V171 WeakPolarHBondContact O-CG2 3.49Å; C167-V171 PolarHBondContact O-N 3.32Å; C167-M267 WeakPolarHBondContact CA-SD 3.48Å; C167-M267 HydrophobicContact CB-CE 4.31Å; C167-M267 HydrophobicContact CB-SD 3.88Å; C167-M267 PolarHBondContact N-SD 3.25Å
168	K	98.6	Very high	97.4	Very high	5 Å²	5	40.9 Å²	40.9	2%	0.022	22%	0.218	C	C	.	.	H	α-helix	trans	-62.6	-46.1	175.9	-68.2	-172.5	175.1	95.3	0	111.4	K107 T108 D137 T154 C156 S157 A164 L165 A170 V171 E172	K107-K168 HydrophobicContact CD-CB 4.28Å; K107-K168 HydrophobicContact CD-CD 4.41Å; K107-K168 HydrophobicContact CG-CB 4.2Å; K107-K168 HydrophobicContact CG-CD 3.94Å; T108-K168 VanDerWaalsContact O-CE 3.31Å; T108-K168 WeakPolarHBondContact O-CE 3.34Å; D137-K168 WeakPolarHBondContact OD2-CE 3.36Å; D137-K168 IonicContact OD2-NZ 2.71Å; D137-K168 PolarHBondContact OD2-NZ 2.91Å; T154-K168 HydrophobicContact CG2-CG 4.26Å; C156-K168 HydrophobicContact CB-CG 3.95Å; C156-K168 PolarHBondContact SG-N 3.22Å; S157-K168 PolarHBondContact O-NZ 3.05Å; A164-K168 PolarHBondContact O-N 2.96Å; L165-K168 PolarHBondContact O-N 3.38Å; L165-K168 VanDerWaalsContact O-N 3.16Å; K168-A170 VanDerWaalsContact C-N 3.29Å; K168-A170 PolarHBondContact O-N 2.79Å; K168-V171 PolarHBondContact O-N 2.9Å; K168-E172 WeakPolarHBondContact O-CG 3.37Å; K168-E172 PolarHBondContact O-N 2.84Å
169	M	98.8	Very high	97.5	Very high	0 Å²	0	40.2 Å²	40.2	0%	0	21%	0.21	C	C	.	.	H	α-helix	trans	-58.9	-37.8	176.5	-178.9	59.2	61.5	0	0	112.6	L165 S166 V171 E172 Y173 F184 H186 F247 F266 D277 I281	L165-M169 PolarHBondContact O-N 3.25Å; S166-M169 PolarHBondContact O-N 2.95Å; M169-V171 VanDerWaalsContact C-N 3.32Å; M169-V171 PolarHBondContact O-N 3.47Å; M169-E172 WeakPolarHBondContact O-CB 3.4Å; M169-E172 PolarHBondContact O-N 3.33Å; M169-Y173 WeakPolarHBondContact O-CB 3.25Å; M169-Y173 PolarHBondContact O-N 3.43Å; M169-F184 HydrophobicContact SD-CE1 4.38Å; M169-F184 HydrophobicContact SD-CZ 4.2Å; M169-H186 HydrophobicContact CE-CB 4.36Å; M169-F247 HydrophobicContact CE-CE1 4.39Å; M169-F247 HydrophobicContact CE-CZ 4.08Å; M169-F247 HydrophobicContact SD-CZ 4.32Å; M169-F266 HydrophobicContact CB-CD1 4.48Å; M169-F266 HydrophobicContact CB-CE1 3.87Å; M169-F266 HydrophobicContact CB-CZ 4.16Å; M169-F266 HydrophobicContact CG-CD1 4.45Å; M169-F266 HydrophobicContact CG-CE1 3.7Å; M169-F266 HydrophobicContact CG-CE2 4.05Å; M169-F266 HydrophobicContact CG-CZ 3.45Å; M169-F266 VanDerWaalsContact CG-CZ 3.45Å; M169-D277 HydrophobicContact CB-CB 3.97Å; M169-D277 HydrophobicContact CG-CB 4.27Å; M169-I281 HydrophobicContact CG-CD1 4.38Å; M169-I281 HydrophobicContact CG-CG1 4.4Å; M169-I281 HydrophobicContact SD-CD1 4.27Å; M169-I281 HydrophobicContact SD-CG1 4.35Å
170	A	98.6	Very high	97.7	Very high	7 Å²	7	40.2 Å²	40.2	6%	0.058	21%	0.214	C	C	.	.	H	α-helix	trans	-60.2	-43.6	174.5	0	0	0	0	0	111.6	S166 C167 K168 Y173 D174 F266	S166-A170 WeakPolarHBondContact O-CB 3.38Å; S166-A170 PolarHBondContact O-N 3.46Å; C167-A170 WeakPolarHBondContact O-CB 3.42Å; C167-A170 PolarHBondContact O-N 2.8Å; K168-A170 VanDerWaalsContact C-N 3.29Å; K168-A170 PolarHBondContact O-N 2.79Å; A170-Y173 PolarHBondContact O-N 3.24Å; A170-D174 PolarHBondContact O-N 3.47Å; A170-F266 HydrophobicContact CB-CB 3.79Å; A170-F266 HydrophobicContact CB-CD1 4.29Å; A170-F266 HydrophobicContact CB-CG 4.3Å
171	V	98.7	Very high	98	Very high	35 Å²	35	34.6 Å²	34.6	21%	0.212	19%	0.188	C	C	.	.	H	α-helix	trans	-69.5	-38	177.7	-176.7	0	0	0	0	111.5	F135 I152 T154 C167 K168 M169 Y173 K175	F135-V171 HydrophobicContact CD1-CB 4.41Å; F135-V171 HydrophobicContact CD1-CG1 4.02Å; F135-V171 HydrophobicContact CE1-CG1 3.98Å; I152-V171 HydrophobicContact CG2-CG1 4.34Å; T154-V171 HydrophobicContact CG2-CB 3.98Å; T154-V171 HydrophobicContact CG2-CG1 3.99Å; T154-V171 HydrophobicContact CG2-CG2 4.29Å; C167-V171 WeakPolarHBondContact O-CG2 3.49Å; C167-V171 PolarHBondContact O-N 3.32Å; K168-V171 PolarHBondContact O-N 2.9Å; M169-V171 VanDerWaalsContact C-N 3.32Å; M169-V171 PolarHBondContact O-N 3.47Å; V171-Y173 VanDerWaalsContact C-N 3.33Å; V171-Y173 PolarHBondContact O-N 3.49Å; V171-K175 HydrophobicContact CG1-CG 4.33Å; V171-K175 WeakPolarHBondContact O-CB 3.44Å; V171-K175 VanDerWaalsContact O-CG 3.28Å; V171-K175 WeakPolarHBondContact O-CG 3.09Å; V171-K175 PolarHBondContact O-N 3.17Å
172	E	98.8	Very high	98.1	Very high	0 Å²	0	34.6 Å²	34.6	0%	0	18%	0.182	C	C	.	.	H	α-helix	trans	-56	-49.7	172.3	-69.4	173.1	-131.3	0	0	111.5	A105 K107 F135 K168 M169 K175 F176 F184 H186	A105-E172 HydrophobicContact CB-CB 4.09Å; A105-E172 HydrophobicContact CB-CG 3.91Å; A105-E172 WeakPolarHBondContact CB-OE2 3.23Å; K107-E172 WeakPolarHBondContact CB-OE1 3.32Å; K107-E172 WeakPolarHBondContact CE-OE1 3.49Å; K107-E172 WeakPolarHBondContact CG-OE1 3.49Å; F135-E172 HydrophobicContact CB-CG 3.96Å; F135-E172 HydrophobicContact CD1-CB 4.44Å; F135-E172 HydrophobicContact CD1-CG 3.69Å; F135-E172 HydrophobicContact CD2-CG 3.55Å; F135-E172 VanDerWaalsContact CE1-CA 3.46Å; F135-E172 HydrophobicContact CE1-CB 4.3Å; F135-E172 HydrophobicContact CE1-CG 4Å; F135-E172 HydrophobicContact CE2-CB 4.36Å; F135-E172 HydrophobicContact CE2-CG 3.87Å; F135-E172 HydrophobicContact CG-CG 3.45Å; F135-E172 VanDerWaalsContact CG-CG 3.45Å; F135-E172 HydrophobicContact CZ-CB 4.26Å; F135-E172 HydrophobicContact CZ-CG 4.09Å; K168-E172 WeakPolarHBondContact O-CG 3.37Å; K168-E172 PolarHBondContact O-N 2.84Å; M169-E172 WeakPolarHBondContact O-CB 3.4Å; M169-E172 PolarHBondContact O-N 3.33Å; E172-K175 PolarHBondContact O-N 3.38Å; E172-F176 PolarHBondContact O-N 2.87Å; E172-F184 HydrophobicContact CB-CE2 4.2Å; E172-F184 HydrophobicContact CB-CZ 4.08Å; E172-H186 IonicContact OE1-ND1 3.97Å; E172-H186 IonicContact OE2-CE1 3.81Å; E172-H186 IonicContact OE2-CG 2.76Å; E172-H186 IonicContact OE2-ND1 3.57Å; E172-H186 PolarHBondContact OE2-ND1 3.43Å
173	Y	98.8	Very high	98.3	Very high	1 Å²	1	30.5 Å²	30.5	0%	0.004	17%	0.167	C	C	.	.	H	α-helix	trans	-63.1	-50	-179.8	-178.3	-83.7	0	0	0	111.9	M169 A170 V171 K175 F176 I177 A254 M257 S258 A261	M169-Y173 WeakPolarHBondContact O-CB 3.25Å; M169-Y173 PolarHBondContact O-N 3.43Å; A170-Y173 PolarHBondContact O-N 3.24Å; V171-Y173 VanDerWaalsContact C-N 3.33Å; V171-Y173 PolarHBondContact O-N 3.49Å; Y173-K175 VanDerWaalsContact C-N 3.32Å; Y173-K175 PolarHBondContact O-N 3.08Å; Y173-F176 WeakPolarHBondContact O-CB 3.42Å; Y173-F176 PolarHBondContact O-N 3.01Å; Y173-F176 VanDerWaalsContact O-N 3.15Å; Y173-I177 HydrophobicContact CD1-CG1 3.99Å; Y173-I177 HydrophobicContact CE1-CD1 4.02Å; Y173-I177 HydrophobicContact CE1-CG1 3.51Å; Y173-I177 WeakPolarHBondContact O-CG1 3.35Å; Y173-I177 PolarHBondContact O-N 3.45Å; Y173-A254 HydrophobicContact CE2-CB 4.22Å; Y173-A254 PolarHBondContact OH-O 2.96Å; Y173-M257 HydrophobicContact CE2-CB 4.21Å; Y173-M257 HydrophobicContact CE2-CE 4.06Å; Y173-M257 HydrophobicContact CE2-SD 4.36Å; Y173-M257 WeakPolarHBondContact OH-CB 3.47Å; Y173-S258 PolarHBondContact OH-N 3.18Å; Y173-S258 VanDerWaalsContact OH-N 3.16Å; Y173-S258 PolarHBondContact OH-OG 2.56Å; Y173-A261 HydrophobicContact CD1-CB 3.91Å; Y173-A261 HydrophobicContact CD2-CB 4.08Å; Y173-A261 HydrophobicContact CE1-CB 3.64Å; Y173-A261 HydrophobicContact CE2-CB 3.79Å; Y173-A261 HydrophobicContact CG-CB 4.12Å
174	D	98.7	Very high	98.5	Very high	36 Å²	36	26.7 Å²	26.7	19%	0.193	15%	0.149	C	C	.	.	H	α-helix	trans	-61.1	-42.1	179.9	-78.8	-25.9	0	0	0	111.3	A170 F176 I177 E178 S262 G263	A170-D174 PolarHBondContact O-N 3.47Å; D174-F176 VanDerWaalsContact C-N 3.33Å; D174-F176 PolarHBondContact O-N 3.43Å; D174-I177 PolarHBondContact O-N 3.49Å; D174-E178 WeakPolarHBondContact O-CG 3.42Å; D174-E178 PolarHBondContact O-N 3.22Å; D174-S262 WeakPolarHBondContact OD1-CA 3.4Å; D174-S262 WeakPolarHBondContact OD1-CB 3.4Å; D174-S262 PolarHBondContact OD1-OG 3.48Å; D174-G263 PolarHBondContact OD1-N 2.9Å; D174-G263 PolarHBondContact OD2-N 3.49Å
175	K	98.7	Very high	98.6	Very high	74 Å²	74	26.7 Å²	26.7	32%	0.322	15%	0.149	S	C	.	.	H	α-helix	trans	-64.7	-36	176.1	-74.4	-73.8	163.7	-147.9	0	112.8	F103 F135 I152 V171 E172 Y173 E178 S179	F103-K175 HydrophobicContact CZ-CB 3.96Å; F135-K175 HydrophobicContact CE1-CB 3.92Å; F135-K175 HydrophobicContact CE1-CG 3.81Å; F135-K175 HydrophobicContact CZ-CB 3.77Å; F135-K175 HydrophobicContact CZ-CG 4.12Å; I152-K175 HydrophobicContact CD1-CD 4.12Å; I152-K175 HydrophobicContact CD1-CG 4.08Å; V171-K175 HydrophobicContact CG1-CG 4.33Å; V171-K175 WeakPolarHBondContact O-CB 3.44Å; V171-K175 VanDerWaalsContact O-CG 3.28Å; V171-K175 WeakPolarHBondContact O-CG 3.09Å; V171-K175 PolarHBondContact O-N 3.17Å; E172-K175 PolarHBondContact O-N 3.38Å; Y173-K175 VanDerWaalsContact C-N 3.32Å; Y173-K175 PolarHBondContact O-N 3.08Å; K175-E178 WeakPolarHBondContact CD-OE2 3.4Å; K175-E178 IonicContact NZ-OE1 3.61Å; K175-E178 IonicContact NZ-OE2 2.79Å; K175-E178 PolarHBondContact NZ-OE2 3.09Å; K175-S179 WeakPolarHBondContact O-CB 3.36Å; K175-S179 PolarHBondContact O-N 2.85Å
176	F	98.8	Very high	98.6	Very high	0 Å²	0	25.2 Å²	25.2	0%	0	14%	0.141	C	C	.	.	H	α-helix	trans	-63.2	-47.1	171.8	163.8	-107.5	0	0	0	111.9	F103 E172 Y173 D174 E178 S179 K181 W183 F184 R251 A254	F103-F176 HydrophobicContact CB-CD2 3.53Å; F103-F176 HydrophobicContact CB-CE2 4.18Å; F103-F176 HydrophobicContact CD1-CB 3.95Å; F103-F176 HydrophobicContact CD1-CD2 4.36Å; F103-F176 HydrophobicContact CD2-CD2 4.5Å; F103-F176 HydrophobicContact CE1-CB 4.19Å; F103-F176 HydrophobicContact CG-CB 4.15Å; F103-F176 AromaticContact CG-CD2 3.91Å; F103-F176 HydrophobicContact CG-CD2 3.91Å; E172-F176 PolarHBondContact O-N 2.87Å; Y173-F176 WeakPolarHBondContact O-CB 3.42Å; Y173-F176 PolarHBondContact O-N 3.01Å; Y173-F176 VanDerWaalsContact O-N 3.15Å; D174-F176 VanDerWaalsContact C-N 3.33Å; D174-F176 PolarHBondContact O-N 3.43Å; F176-E178 VanDerWaalsContact C-N 3.32Å; F176-E178 PolarHBondContact O-N 2.59Å; F176-S179 WeakPolarHBondContact O-CB 3.4Å; F176-S179 PolarHBondContact O-N 2.97Å; F176-S179 VanDerWaalsContact O-N 3.11Å; F176-S179 PolarHBondContact O-OG 2.04Å; F176-K181 HydrophobicContact CE2-CB 4.19Å; F176-K181 VanDerWaalsContact CE2-O 3.3Å; F176-K181 WeakPolarHBondContact CE2-O 3.29Å; F176-K181 WeakPolarHBondContact CZ-O 3.28Å; F176-W183 WeakPolarHBondContact CE2-O 3.33Å; F176-F184 HydrophobicContact CB-CB 4.4Å; F176-F184 HydrophobicContact CB-CD2 3.6Å; F176-F184 HydrophobicContact CB-CE2 4.19Å; F176-F184 HydrophobicContact CB-CG 4.21Å; F176-F184 HydrophobicContact CD1-CB 3.62Å; F176-F184 HydrophobicContact CD1-CD2 4.31Å; F176-F184 HydrophobicContact CD1-CG 4.07Å; F176-F184 HydrophobicContact CD2-CB 3.69Å; F176-F184 HydrophobicContact CD2-CD2 4.17Å; F176-F184 HydrophobicContact CD2-CG 4.35Å; F176-F184 HydrophobicContact CE1-CB 3.69Å; F176-F184 HydrophobicContact CE2-CB 3.75Å; F176-F184 HydrophobicContact CG-CB 3.59Å; F176-F184 AromaticContact CG-CD2 3.74Å; F176-F184 HydrophobicContact CG-CD2 3.74Å; F176-F184 AromaticContact CG-CG 3.91Å; F176-F184 HydrophobicContact CG-CG 3.91Å; F176-F184 HydrophobicContact CZ-CB 3.74Å; F176-R251 HydrophobicContact CZ-CB 4.17Å; F176-R251 HydrophobicContact CZ-CG 4.44Å; F176-A254 HydrophobicContact CD1-CB 4.24Å; F176-A254 HydrophobicContact CE1-CB 3.52Å; F176-A254 HydrophobicContact CZ-CB 4.49Å
177	I	98.6	Very high	98.7	Very high	31 Å²	31	25.4 Å²	25.4	16%	0.159	14%	0.142	C	C	.	.	H	α-helix	trans	-57.6	-48	179.1	-65.8	-61.2	0	0	0	110.4	Y173 D174 S179 G180 R251 A254 L255	Y173-I177 HydrophobicContact CD1-CG1 3.99Å; Y173-I177 HydrophobicContact CE1-CD1 4.02Å; Y173-I177 HydrophobicContact CE1-CG1 3.51Å; Y173-I177 WeakPolarHBondContact O-CG1 3.35Å; Y173-I177 PolarHBondContact O-N 3.45Å; D174-I177 PolarHBondContact O-N 3.49Å; I177-S179 VanDerWaalsContact C-N 3.3Å; I177-S179 PolarHBondContact O-N 2.72Å; I177-G180 PolarHBondContact O-N 3.2Å; I177-R251 PolarHBondContact O-NH2 3.09Å; I177-A254 HydrophobicContact CD1-CB 4.04Å; I177-L255 HydrophobicContact CD1-CD2 4.31Å
178	E	98.3	Very high	98.7	Very high	131 Å²	131	25.5 Å²	25.5	61%	0.612	14%	0.14	S	C	*	.	H	α-helix	trans	-58.1	-37.4	175.8	-72.2	173.4	-173.9	0	0	112.8	D174 K175 F176 G180	D174-E178 WeakPolarHBondContact O-CG 3.42Å; D174-E178 PolarHBondContact O-N 3.22Å; K175-E178 WeakPolarHBondContact CD-OE2 3.4Å; K175-E178 IonicContact NZ-OE1 3.61Å; K175-E178 IonicContact NZ-OE2 2.79Å; K175-E178 PolarHBondContact NZ-OE2 3.09Å; F176-E178 VanDerWaalsContact C-N 3.32Å; F176-E178 PolarHBondContact O-N 2.59Å; E178-G180 PolarHBondContact O-N 3.03Å
179	S	98.4	Very high	98.7	Very high	40 Å²	40	25.7 Å²	25.7	28%	0.28	14%	0.141	S	C	.	.	H	α-helix	trans	-66.1	-19.2	-174.5	77.7	0	0	0	0	114.9	F103 K175 F176 I177 K181	F103-S179 WeakPolarHBondContact CD2-OG 3.45Å; K175-S179 WeakPolarHBondContact O-CB 3.36Å; K175-S179 PolarHBondContact O-N 2.85Å; F176-S179 WeakPolarHBondContact O-CB 3.4Å; F176-S179 PolarHBondContact O-N 2.97Å; F176-S179 VanDerWaalsContact O-N 3.11Å; F176-S179 PolarHBondContact O-OG 2.04Å; I177-S179 VanDerWaalsContact C-N 3.3Å; I177-S179 PolarHBondContact O-N 2.72Å; S179-K181 PolarHBondContact O-N 3.14Å; S179-K181 WeakPolarHBondContact OG-CB 3.49Å; S179-K181 WeakPolarHBondContact OG-CG 3.49Å; S179-K181 PolarHBondContact OG-N 3.46Å
180	G	98.3	Very high	98.7	Very high	44 Å²	44	26 Å²	26	45%	0.454	14%	0.143	S	C	.	.			trans	72.4	-1.8	-175.6	0	0	0	0	0	115.3	I177 E178 R251	I177-G180 PolarHBondContact O-N 3.2Å; E178-G180 PolarHBondContact O-N 3.03Å; G180-R251 VanDerWaalsContact C-NH1 3.3Å
181	K	98.8	Very high	98.7	Very high	39 Å²	39	25.7 Å²	25.7	17%	0.17	14%	0.14	C	C	.	.			trans	-67	155.4	-175.4	-66.6	-165	-172.8	-63.9	0	112.6	A100 I102 F103 F176 S179 R251	A100-K181 PolarHBondContact O-NZ 2.8Å; I102-K181 VanDerWaalsContact O-CD 3.23Å; I102-K181 WeakPolarHBondContact O-CD 3.37Å; F103-K181 HydrophobicContact CB-CB 4.16Å; F103-K181 HydrophobicContact CB-CD 3.85Å; F103-K181 HydrophobicContact CD2-CD 4.14Å; F176-K181 HydrophobicContact CE2-CB 4.19Å; F176-K181 VanDerWaalsContact CE2-O 3.3Å; F176-K181 WeakPolarHBondContact CE2-O 3.29Å; F176-K181 WeakPolarHBondContact CZ-O 3.28Å; S179-K181 PolarHBondContact O-N 3.14Å; S179-K181 WeakPolarHBondContact OG-CB 3.49Å; S179-K181 WeakPolarHBondContact OG-CG 3.49Å; S179-K181 PolarHBondContact OG-N 3.46Å; K181-R251 WeakPolarHBondContact O-CD 3.11Å; K181-R251 PolarHBondContact O-NH1 3.01Å; K181-R251 VanDerWaalsContact O-NH1 3.11Å
182	K	98.8	Very high	98.7	Very high	43 Å²	43	24.1 Å²	24.1	19%	0.187	13%	0.131	C	C	.	.	S	Bend	trans	-75	-33.8	-174.1	-63.4	-172.1	-176.4	-176.5	0	112.9	E95 D96 I97 D101 H207 R251	E95-K182 WeakPolarHBondContact OE1-CD 3.3Å; E95-K182 WeakPolarHBondContact OE1-CE 3.34Å; E95-K182 IonicContact OE1-NZ 2.73Å; E95-K182 PolarHBondContact OE1-NZ 3.01Å; D96-K182 PolarHBondContact O-NZ 2.64Å; I97-K182 HydrophobicContact CG2-CD 3.87Å; D101-K182 HydrophobicContact CB-CB 4.17Å; D101-K182 HydrophobicContact CB-CD 3.89Å; D101-K182 HydrophobicContact CB-CG 4.04Å; D101-K182 PolarHBondContact O-N 3.07Å; D101-K182 VanDerWaalsContact OD1-CE 3.3Å; D101-K182 WeakPolarHBondContact OD1-CE 3.41Å; D101-K182 IonicContact OD1-NZ 2.96Å; K182-H207 HydrophobicContact CB-CB 3.77Å; K182-H207 HydrophobicContact CG-CB 4.44Å; K182-R251 WeakPolarHBondContact O-CB 3.47Å; K182-R251 PolarHBondContact O-N 3.44Å
183	W	98.9	Very high	98.7	Very high	0 Å²	0	24.2 Å²	24.2	0%	0	13%	0.131	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-131.1	132.9	-175.8	-69.7	96.9	0	0	0	111.5	D101 I102 F103 F176 L202 H207 L211 I213	D101-W183 PolarHBondContact O-N 2.91Å; I102-W183 HydrophobicContact CG1-CB 4.34Å; I102-W183 HydrophobicContact CG2-CB 4.32Å; F103-W183 WeakPolarHBondContact CB-O 3.43Å; F103-W183 PolarHBondContact N-O 2.71Å; F176-W183 WeakPolarHBondContact CE2-O 3.33Å; W183-L202 HydrophobicContact CB-CD1 3.92Å; W183-L202 HydrophobicContact CD2-CB 4.29Å; W183-L202 HydrophobicContact CD2-CD1 3.92Å; W183-L202 HydrophobicContact CD2-CD2 4.06Å; W183-L202 HydrophobicContact CD2-CG 4.32Å; W183-L202 HydrophobicContact CE3-CD1 4.27Å; W183-L202 HydrophobicContact CE3-CD2 3.82Å; W183-L202 HydrophobicContact CG-CD1 3.76Å; W183-L202 HydrophobicContact CH2-CD2 4.21Å; W183-L202 HydrophobicContact CZ2-CB 4.39Å; W183-L202 HydrophobicContact CZ2-CD2 4.44Å; W183-L202 HydrophobicContact CZ3-CD2 3.89Å; W183-H207 HydrophobicContact CZ2-CB 4.29Å; W183-L211 HydrophobicContact CH2-CB 3.83Å; W183-L211 HydrophobicContact CH2-CG 4.24Å; W183-L211 HydrophobicContact CZ3-CB 3.97Å; W183-I213 HydrophobicContact CH2-CD1 4.24Å; W183-I213 HydrophobicContact CZ3-CD1 4.12Å
184	F	98.9	Very high	98.7	Very high	2 Å²	2	24.6 Å²	24.6	1%	0.009	13%	0.133	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-95.7	126.4	167	175.9	-124.9	0	0	0	108.5	F103 A105 M169 E172 F176 H186 F247 C248 V249	F103-F184 AromaticContact CD1-CD2 3.92Å; F103-F184 HydrophobicContact CD1-CD2 3.92Å; F103-F184 HydrophobicContact CD1-CE2 4.22Å; F103-F184 HydrophobicContact CE1-CE2 4.48Å; A105-F184 HydrophobicContact CB-CE2 3.81Å; A105-F184 HydrophobicContact CB-CZ 4.42Å; M169-F184 HydrophobicContact SD-CE1 4.38Å; M169-F184 HydrophobicContact SD-CZ 4.2Å; E172-F184 HydrophobicContact CB-CE2 4.2Å; E172-F184 HydrophobicContact CB-CZ 4.08Å; F176-F184 HydrophobicContact CB-CB 4.4Å; F176-F184 HydrophobicContact CB-CD2 3.6Å; F176-F184 HydrophobicContact CB-CE2 4.19Å; F176-F184 HydrophobicContact CB-CG 4.21Å; F176-F184 HydrophobicContact CD1-CB 3.62Å; F176-F184 HydrophobicContact CD1-CD2 4.31Å; F176-F184 HydrophobicContact CD1-CG 4.07Å; F176-F184 HydrophobicContact CD2-CB 3.69Å; F176-F184 HydrophobicContact CD2-CD2 4.17Å; F176-F184 HydrophobicContact CD2-CG 4.35Å; F176-F184 HydrophobicContact CE1-CB 3.69Å; F176-F184 HydrophobicContact CE2-CB 3.75Å; F176-F184 HydrophobicContact CG-CB 3.59Å; F176-F184 AromaticContact CG-CD2 3.74Å; F176-F184 HydrophobicContact CG-CD2 3.74Å; F176-F184 AromaticContact CG-CG 3.91Å; F176-F184 HydrophobicContact CG-CG 3.91Å; F176-F184 HydrophobicContact CZ-CB 3.74Å; F184-H186 HydrophobicContact CE1-CB 4.29Å; F184-H186 HydrophobicContact CZ-CB 4.12Å; F184-F247 HydrophobicContact CD1-CE2 4.3Å; F184-F247 AromaticContact CE1-CE2 3.9Å; F184-F247 HydrophobicContact CE1-CE2 3.9Å; F184-F247 HydrophobicContact CE1-CZ 4.34Å; F184-C248 CarbonylContact O-C 3.51Å; F184-C248 WeakPolarHBondContact O-CA 3.19Å; F184-C248 WeakPolarHBondContact O-CB 3.46Å; F184-V249 HydrophobicContact CB-CB 4.42Å; F184-V249 HydrophobicContact CD1-CB 4.3Å; F184-V249 HydrophobicContact CD1-CG2 4.45Å; F184-V249 PolarHBondContact N-O 2.87Å; F184-V249 PolarHBondContact O-N 3.5Å
185	C	98.9	Very high	98.7	Very high	4 Å²	4	23 Å²	23	3%	0.027	13%	0.125	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-128.1	123.2	171.3	-64.8	0	0	0	0	109.9	I102 F103 I104 A105 F247 C248	I102-C185 HydrophobicContact CG2-CB 4.39Å; F103-C185 PolarHBondContact O-N 3.07Å; I104-C185 CarbonylContact C-O 3.57Å; I104-C185 WeakPolarHBondContact CA-O 3.44Å; A105-C185 PolarHBondContact N-O 2.99Å; C185-F247 CarbonylContact C-O 3.48Å; C185-F247 VanDerWaalsContact CA-O 3.22Å; C185-F247 WeakPolarHBondContact CA-O 3.37Å; C185-C248 HydrophobicContact CB-CB 4.2Å; C185-C248 WeakPolarHBondContact CB-SG 3.43Å; C185-C248 WeakPolarHBondContact SG-CB 3.39Å; C185-C248 CovalentContact SG-SG 2.05Å; C185-C248 PolarHBondContact SG-SG 2.64Å
186	H	98.9	Very high	98.6	Very high	1 Å²	1	27 Å²	27	1%	0.005	14%	0.138	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-97	139.7	176.1	171.1	66.5	0	0	0	110.1	K107 M169 E172 F184 D188 G246 F247	K107-H186 WeakPolarHBondContact CE-CE1 3.44Å; K107-H186 PolarHBondContact NZ-CE1 3.17Å; K107-H186 PolarHBondContact NZ-NE2 3.11Å; M169-H186 HydrophobicContact CE-CB 4.36Å; E172-H186 IonicContact OE1-ND1 3.97Å; E172-H186 IonicContact OE2-CE1 3.81Å; E172-H186 IonicContact OE2-CG 2.76Å; E172-H186 IonicContact OE2-ND1 3.57Å; E172-H186 PolarHBondContact OE2-ND1 3.43Å; F184-H186 HydrophobicContact CE1-CB 4.29Å; F184-H186 HydrophobicContact CZ-CB 4.12Å; H186-D188 IonicContact CE1-OD1 2.75Å; H186-D188 IonicContact NE2-OD1 3.94Å; H186-G246 CarbonylContact O-C 3.39Å; H186-G246 WeakPolarHBondContact O-CA 3.41Å; H186-F247 HydrophobicContact CB-CD1 4.19Å; H186-F247 HydrophobicContact CB-CD2 4.32Å; H186-F247 HydrophobicContact CB-CE1 3.7Å; H186-F247 HydrophobicContact CB-CE2 3.84Å; H186-F247 HydrophobicContact CB-CG 4.47Å; H186-F247 HydrophobicContact CB-CZ 3.5Å; H186-F247 AromaticContact CD2-CE1 3.44Å; H186-F247 VanDerWaalsContact CD2-CE1 3.44Å; H186-F247 WeakPolarHBondContact CD2-CE1 3.44Å; H186-F247 AromaticContact CG-CE1 3.8Å; H186-F247 AromaticContact CG-CZ 3.93Å; H186-F247 PolarHBondContact N-O 3.03Å; H186-F247 PolarHBondContact O-N 2.95Å; H186-F247 VanDerWaalsContact O-N 3.12Å
187	V	98.9	Very high	98.6	Very high	4 Å²	4	28.3 Å²	28.3	2%	0.024	15%	0.146	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-145.2	157.3	168.2	-63.1	0	0	0	0	111	I104 A105 V106 K107 W124 N191 V193 T319	I104-V187 HydrophobicContact CG2-CG2 4.16Å; A105-V187 PolarHBondContact O-N 3.08Å; V106-V187 WeakPolarHBondContact CA-O 3.46Å; V106-V187 HydrophobicContact CB-CG2 4.41Å; V106-V187 HydrophobicContact CG2-CG2 3.81Å; K107-V187 PolarHBondContact N-O 2.79Å; W124-V187 HydrophobicContact CH2-CG2 4.36Å; W124-V187 HydrophobicContact CZ2-CG2 4.35Å; V187-N191 HydrophobicContact CB-CB 3.99Å; V187-N191 HydrophobicContact CG1-CB 4.44Å; V187-V193 HydrophobicContact CB-CG2 4.44Å; V187-V193 HydrophobicContact CG1-CG2 3.82Å; V187-V193 HydrophobicContact CG2-CG2 4.15Å; V187-T319 HydrophobicContact CG1-CG2 4.2Å
188	D	98.6	Very high	98.6	Very high	39 Å²	39	27 Å²	27	21%	0.209	14%	0.139	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-90.6	166.7	173.2	-73.4	-31.9	0	0	0	111.8	K107 H186 D190 N191 G244	K107-D188 IonicContact NZ-OD1 2.64Å; H186-D188 IonicContact CE1-OD1 2.75Å; H186-D188 IonicContact NE2-OD1 3.94Å; D188-D190 PolarHBondContact O-N 2.89Å; D188-D190 VanDerWaalsContact O-N 3.12Å; D188-N191 PolarHBondContact N-OD1 3.25Å; D188-N191 WeakPolarHBondContact O-CB 3.41Å; D188-N191 PolarHBondContact O-N 3.49Å; D188-N191 VanDerWaalsContact O-N 3.07Å; D188-G244 WeakPolarHBondContact OD2-CA 2.96Å
189	D	98.5	Very high	98.7	Very high	8 Å²	8	22 Å²	22	4%	0.043	12%	0.118	C	C	.	.	T	Hydrogen-bonded Turn	trans	-71.1	1	-178.6	67	14	0	0	0	115.7	V106 K107 T108 F112 R116 L120	V106-D189 HydrophobicContact CG1-CB 4.44Å; K107-D189 WeakPolarHBondContact O-CB 3.45Å; K107-D189 PolarHBondContact O-N 3.18Å; K107-D189 VanDerWaalsContact O-N 3.15Å; T108-D189 WeakPolarHBondContact CB-OD2 3.47Å; T108-D189 PolarHBondContact OG1-OD2 3.47Å; F112-D189 WeakPolarHBondContact CB-OD2 3.41Å; R116-D189 HydrophobicContact CB-CB 4.37Å; R116-D189 WeakPolarHBondContact CD-OD1 3.34Å; R116-D189 IonicContact CZ-OD1 3.79Å; R116-D189 IonicContact NE-OD1 3.96Å; R116-D189 IonicContact NH1-OD1 3.59Å; R116-D189 PolarHBondContact NH1-OD1 3.36Å; L120-D189 WeakPolarHBondContact CD1-O 3.13Å
190	D	98.3	Very high	98.6	Very high	8 Å²	8	25.2 Å²	25.2	4%	0.043	13%	0.126	C	C	.	.	T	Hydrogen-bonded Turn	trans	-111.8	17.4	169.9	58.4	36.2	0	0	0	113	R116 D188 H302 S321 Y322 F347	R116-D190 IonicContact CZ-OD2 3.75Å; R116-D190 IonicContact NH1-OD2 2.72Å; R116-D190 PolarHBondContact NH1-OD2 2.91Å; D188-D190 PolarHBondContact O-N 2.89Å; D188-D190 VanDerWaalsContact O-N 3.12Å; D190-H302 IonicContact OD1-CE1 3.62Å; D190-H302 IonicContact OD1-ND1 3.76Å; D190-H302 IonicContact OD2-CE1 3.86Å; D190-H302 IonicContact OD2-ND1 4Å; D190-S321 WeakPolarHBondContact O-CA 3.03Å; D190-S321 PolarHBondContact O-OG 3.43Å; D190-S321 PolarHBondContact OD1-OG 2.86Å; D190-Y322 HydrophobicContact CB-CD1 4.1Å; D190-Y322 HydrophobicContact CB-CE1 3.71Å; D190-Y322 WeakPolarHBondContact O-CD1 3.36Å; D190-Y322 PolarHBondContact O-N 3.19Å; D190-F347 VanDerWaalsContact O-CZ 3.28Å; D190-F347 WeakPolarHBondContact O-CZ 3.38Å
191	N	98.8	Very high	98.6	Very high	0 Å²	0	24.2 Å²	24.2	0%	0	11%	0.11	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-100.2	144.5	172.6	-65.9	134.5	0	0	0	113.8	L120 W124 V187 D188 G244 L320 S321 F347	L120-N191 WeakPolarHBondContact CD2-O 3.27Å; W124-N191 PolarHBondContact NE1-O 3.15Å; V187-N191 HydrophobicContact CB-CB 3.99Å; V187-N191 HydrophobicContact CG1-CB 4.44Å; D188-N191 PolarHBondContact N-OD1 3.25Å; D188-N191 WeakPolarHBondContact O-CB 3.41Å; D188-N191 PolarHBondContact O-N 3.49Å; D188-N191 VanDerWaalsContact O-N 3.07Å; N191-G244 PolarHBondContact ND2-O 3.04Å; N191-L320 CarbonylContact C-O 3.52Å; N191-L320 VanDerWaalsContact CA-O 3.23Å; N191-L320 WeakPolarHBondContact CA-O 3.38Å; N191-L320 PolarHBondContact ND2-O 3.32Å; N191-S321 WeakPolarHBondContact ND2-CB 3.45Å; N191-F347 VanDerWaalsContact C-CE2 3.43Å
192	Y	98.8	Very high	98.6	Very high	2 Å²	2	22.3 Å²	22.3	1%	0.008	10%	0.102	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-104.4	131.5	166.1	-171.1	-76.4	0	0	0	109.3	W124 T319 L320 F347 V350 H351 L354	W124-Y192 HydrophobicContact CB-CD1 4.31Å; W124-Y192 HydrophobicContact CB-CD2 4.19Å; W124-Y192 HydrophobicContact CB-CE1 3.91Å; W124-Y192 HydrophobicContact CB-CE2 3.84Å; W124-Y192 HydrophobicContact CB-CG 4.42Å; W124-Y192 AromaticContact CD1-CD2 3.74Å; W124-Y192 AromaticContact CD1-CG 3.94Å; W124-Y192 HydrophobicContact CG-CD2 4.32Å; W124-Y192 HydrophobicContact CG-CE2 4.43Å; W124-Y192 HydrophobicContact CG-CG 4.42Å; Y192-T319 CarbonylContact O-C 3.57Å; Y192-T319 VanDerWaalsContact O-CA 3.23Å; Y192-T319 WeakPolarHBondContact O-CA 3.25Å; Y192-L320 PolarHBondContact N-O 3.37Å; Y192-L320 PolarHBondContact O-N 2.89Å; Y192-F347 VanDerWaalsContact CB-CZ 3.48Å; Y192-F347 HydrophobicContact CD2-CB 3.89Å; Y192-F347 HydrophobicContact CD2-CD1 4.21Å; Y192-F347 HydrophobicContact CD2-CD2 4.02Å; Y192-F347 AromaticContact CD2-CG 3.8Å; Y192-F347 HydrophobicContact CD2-CG 3.8Å; Y192-F347 HydrophobicContact CG-CD1 4.43Å; Y192-F347 HydrophobicContact CG-CG 4.38Å; Y192-V350 HydrophobicContact CD1-CG1 3.99Å; Y192-V350 HydrophobicContact CD2-CG1 4.45Å; Y192-V350 HydrophobicContact CE1-CG1 3.79Å; Y192-V350 HydrophobicContact CE2-CB 4.48Å; Y192-V350 HydrophobicContact CE2-CG1 4.22Å; Y192-V350 HydrophobicContact CG-CG1 4.34Å; Y192-H351 HydrophobicContact CE2-CB 3.96Å; Y192-H351 VanDerWaalsContact OH-CA 3.26Å; Y192-H351 WeakPolarHBondContact OH-CA 3.4Å; Y192-H351 WeakPolarHBondContact OH-CB 3.32Å; Y192-H351 PolarHBondContact OH-ND1 3.37Å; Y192-L354 HydrophobicContact CE1-CD1 3.68Å
193	V	98.9	Very high	98.6	Very high	2 Å²	2	21 Å²	21	1%	0.012	10%	0.098	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-114.3	119.6	-179.6	-169.5	0	0	0	0	111.7	W124 V187 V195 L198 I318 T319	W124-V193 WeakPolarHBondContact CB-O 2.95Å; W124-V193 HydrophobicContact CD2-CB 3.97Å; W124-V193 HydrophobicContact CD2-CG2 4.22Å; W124-V193 HydrophobicContact CE3-CB 3.8Å; W124-V193 HydrophobicContact CE3-CG2 4.22Å; W124-V193 HydrophobicContact CH2-CB 4.29Å; W124-V193 HydrophobicContact CH2-CG2 3.83Å; W124-V193 HydrophobicContact CZ2-CB 4.43Å; W124-V193 HydrophobicContact CZ2-CG2 3.81Å; W124-V193 HydrophobicContact CZ3-CB 3.97Å; W124-V193 HydrophobicContact CZ3-CG2 4.03Å; V187-V193 HydrophobicContact CB-CG2 4.44Å; V187-V193 HydrophobicContact CG1-CG2 3.82Å; V187-V193 HydrophobicContact CG2-CG2 4.15Å; V193-V195 HydrophobicContact CB-CG2 4.33Å; V193-V195 HydrophobicContact CG1-CG2 3.85Å; V193-V195 PolarHBondContact O-N 2.96Å; V193-L198 HydrophobicContact CG1-CD2 4.18Å; V193-I318 WeakPolarHBondContact CA-O 3.47Å; V193-T319 HydrophobicContact CG2-CG2 4.44Å
194	N	98.8	Very high	98.5	Very high	8 Å²	8	25.2 Å²	25.2	4%	0.043	12%	0.118	C	C	.	.			trans	-85.2	86.1	167.9	-175.3	-8.4	0	0	0	109.9	R196 T197 L198 H315 Q317 I318 L354	N194-R196 VanDerWaalsContact C-N 3.26Å; N194-R196 PolarHBondContact O-N 3.17Å; N194-T197 PolarHBondContact ND2-OG1 3.03Å; N194-T197 PolarHBondContact O-N 2.85Å; N194-T197 PolarHBondContact OD1-N 3.4Å; N194-L198 PolarHBondContact O-N 2.9Å; N194-H315 PolarHBondContact ND2-O 3.1Å; N194-Q317 VanDerWaalsContact CB-O 3.24Å; N194-Q317 WeakPolarHBondContact CB-O 3.42Å; N194-Q317 PolarHBondContact ND2-O 3.23Å; N194-I318 PolarHBondContact N-O 3.31Å; N194-L354 HydrophobicContact CB-CD1 4.18Å
195	V	98.6	Very high	98.5	Very high	2 Å²	2	28 Å²	28	1%	0.012	13%	0.129	C	C	.	.	H	α-helix	trans	-63.6	-28.6	-173.3	-178.8	0	0	0	0	113	A99 I104 W124 N128 V193 L198 V199	A99-V195 HydrophobicContact CB-CG1 4Å; I104-V195 HydrophobicContact CD1-CG1 4.44Å; I104-V195 HydrophobicContact CD1-CG2 3.74Å; W124-V195 HydrophobicContact CE3-CG2 4.5Å; N128-V195 HydrophobicContact CB-CG2 4.07Å; N128-V195 WeakPolarHBondContact ND2-CG2 3.5Å; N128-V195 VanDerWaalsContact OD1-CB 3.23Å; N128-V195 WeakPolarHBondContact OD1-CB 3.19Å; N128-V195 WeakPolarHBondContact OD1-CG1 3.43Å; N128-V195 WeakPolarHBondContact OD1-CG2 3.32Å; V193-V195 HydrophobicContact CB-CG2 4.33Å; V193-V195 HydrophobicContact CG1-CG2 3.85Å; V193-V195 PolarHBondContact O-N 2.96Å; V195-L198 WeakPolarHBondContact O-CB 3.34Å; V195-L198 PolarHBondContact O-N 3.17Å; V195-V199 HydrophobicContact CG1-CG2 4.19Å; V195-V199 VanDerWaalsContact O-CG2 3.28Å; V195-V199 WeakPolarHBondContact O-CG2 3.06Å; V195-V199 PolarHBondContact O-N 3.49Å
196	R	97.9	Very high	98.4	Very high	159 Å²	159	29.5 Å²	29.5	60%	0.6	14%	0.138	S	C	*	.	H	α-helix	trans	-62.6	-47.6	174.9	-69.7	-178.7	179	168.1	0.1	111.3	N194 L198 K200	N194-R196 VanDerWaalsContact C-N 3.26Å; N194-R196 PolarHBondContact O-N 3.17Å; R196-L198 VanDerWaalsContact C-N 3.34Å; R196-K200 PolarHBondContact O-N 2.81Å; R196-K200 VanDerWaalsContact O-N 3.11Å
197	T	98.3	Very high	98.4	Very high	27 Å²	27	31.3 Å²	31.3	17%	0.166	15%	0.146	C	C	.	.	H	α-helix	trans	-66.5	-38.4	175.8	-59.5	0	0	0	0	111.2	N194 K200 H201 H315 K316 I318	N194-T197 PolarHBondContact ND2-OG1 3.03Å; N194-T197 PolarHBondContact O-N 2.85Å; N194-T197 PolarHBondContact OD1-N 3.4Å; T197-K200 PolarHBondContact O-N 2.99Å; T197-H201 WeakPolarHBondContact O-CB 3.42Å; T197-H201 PolarHBondContact O-N 3.04Å; T197-H315 PolarHBondContact OG1-O 2.85Å; T197-K316 WeakPolarHBondContact CG2-O 3.37Å; T197-I318 HydrophobicContact CG2-CG1 3.63Å
198	L	98.8	Very high	98.4	Very high	3 Å²	3	35.7 Å²	35.7	2%	0.016	17%	0.174	C	C	.	.	H	α-helix	trans	-58.6	-51.4	175.4	-178.6	61.3	0	0	0	111.9	I102 I104 V193 N194 V195 R196 K200 H201 L202 F299 I318	I102-L198 HydrophobicContact CD1-CD2 4.24Å; I102-L198 HydrophobicContact CD1-CG 4.16Å; I102-L198 HydrophobicContact CG2-CD2 4.22Å; I104-L198 HydrophobicContact CD1-CD2 4.37Å; V193-L198 HydrophobicContact CG1-CD2 4.18Å; N194-L198 PolarHBondContact O-N 2.9Å; V195-L198 WeakPolarHBondContact O-CB 3.34Å; V195-L198 PolarHBondContact O-N 3.17Å; R196-L198 VanDerWaalsContact C-N 3.34Å; L198-K200 VanDerWaalsContact C-N 3.33Å; L198-K200 PolarHBondContact O-N 3Å; L198-H201 PolarHBondContact O-N 2.92Å; L198-L202 HydrophobicContact CD1-CD1 3.82Å; L198-L202 HydrophobicContact CD1-CG 3.97Å; L198-L202 HydrophobicContact CG-CD1 4Å; L198-L202 HydrophobicContact CG-CG 4.41Å; L198-L202 WeakPolarHBondContact O-CG 3.05Å; L198-L202 PolarHBondContact O-N 2.91Å; L198-F299 HydrophobicContact CD1-CZ 4.4Å; L198-I318 HydrophobicContact CB-CG2 4.03Å; L198-I318 HydrophobicContact CD1-CD1 4.47Å; L198-I318 HydrophobicContact CD1-CG2 3.67Å; L198-I318 HydrophobicContact CG-CG2 4.37Å
199	V	98.6	Very high	98.3	Very high	27 Å²	27	38.6 Å²	38.6	16%	0.164	19%	0.186	C	C	.	.	H	α-helix	trans	-56.9	-48.5	177.3	170.2	0	0	0	0	110.3	I97 A99 I102 V195 H201 L202 S203	I97-V199 HydrophobicContact CG1-CG1 4.29Å; I97-V199 WeakPolarHBondContact O-CG1 3.34Å; A99-V199 HydrophobicContact CB-CG2 4.05Å; I102-V199 HydrophobicContact CD1-CB 4.39Å; I102-V199 HydrophobicContact CD1-CG2 3.51Å; V195-V199 HydrophobicContact CG1-CG2 4.19Å; V195-V199 VanDerWaalsContact O-CG2 3.28Å; V195-V199 WeakPolarHBondContact O-CG2 3.06Å; V195-V199 PolarHBondContact O-N 3.49Å; V199-H201 VanDerWaalsContact C-N 3.31Å; V199-H201 PolarHBondContact O-N 3.12Å; V199-L202 PolarHBondContact O-N 2.71Å; V199-S203 WeakPolarHBondContact O-CB 3.36Å; V199-S203 PolarHBondContact O-N 2.87Å
200	K	98	Very high	98.4	Very high	107 Å²	107	40.8 Å²	40.8	47%	0.465	20%	0.198	S	C	.	.	H	α-helix	trans	-57.3	-45.1	177.4	-176	179.7	179.3	-178.8	0	111.5	D90 R196 T197 L198 S203	D90-K200 IonicContact OD1-NZ 2.72Å; D90-K200 VanDerWaalsContact OD2-CE 3.31Å; D90-K200 WeakPolarHBondContact OD2-CE 3.3Å; D90-K200 IonicContact OD2-NZ 2.78Å; D90-K200 PolarHBondContact OD2-NZ 3.03Å; R196-K200 PolarHBondContact O-N 2.81Å; R196-K200 VanDerWaalsContact O-N 3.11Å; T197-K200 PolarHBondContact O-N 2.99Å; L198-K200 VanDerWaalsContact C-N 3.33Å; L198-K200 PolarHBondContact O-N 3Å; K200-S203 PolarHBondContact O-OG 2.85Å
201	H	98.3	Very high	98.4	Very high	23 Å²	23	41.1 Å²	41.1	11%	0.106	20%	0.199	C	C	.	.	H	α-helix	trans	-67.2	-45.4	-179.4	-172.7	50	0	0	0	112.6	T197 L198 V199 S203 Q204 S296 I318	T197-H201 WeakPolarHBondContact O-CB 3.42Å; T197-H201 PolarHBondContact O-N 3.04Å; L198-H201 PolarHBondContact O-N 2.92Å; V199-H201 VanDerWaalsContact C-N 3.31Å; V199-H201 PolarHBondContact O-N 3.12Å; H201-S203 VanDerWaalsContact C-N 3.31Å; H201-S203 PolarHBondContact O-N 3.26Å; H201-Q204 PolarHBondContact ND1-OE1 3.08Å; H201-Q204 WeakPolarHBondContact O-CB 3.48Å; H201-Q204 WeakPolarHBondContact O-CG 3.25Å; H201-Q204 PolarHBondContact O-N 3.02Å; H201-Q204 PolarHBondContact O-OE1 3Å; H201-S296 PolarHBondContact NE2-OG 3.43Å; H201-I318 HydrophobicContact CB-CD1 3.64Å; H201-I318 WeakPolarHBondContact CD2-CD1 3.33Å
202	L	98.6	Very high	98.4	Very high	0 Å²	0	41.1 Å²	41.1	0%	0	20%	0.199	C	C	.	.	H	α-helix	trans	-69.5	-29.1	-179.9	-65.2	-177.9	0	0	0	112.4	I97 I102 W183 L198 V199 Q204 Y205 I213 C248	I97-L202 HydrophobicContact CD1-CB 3.62Å; I102-L202 HydrophobicContact CD1-CD1 3.91Å; I102-L202 HydrophobicContact CG1-CD1 4.23Å; W183-L202 HydrophobicContact CB-CD1 3.92Å; W183-L202 HydrophobicContact CD2-CB 4.29Å; W183-L202 HydrophobicContact CD2-CD1 3.92Å; W183-L202 HydrophobicContact CD2-CD2 4.06Å; W183-L202 HydrophobicContact CD2-CG 4.32Å; W183-L202 HydrophobicContact CE3-CD1 4.27Å; W183-L202 HydrophobicContact CE3-CD2 3.82Å; W183-L202 HydrophobicContact CG-CD1 3.76Å; W183-L202 HydrophobicContact CH2-CD2 4.21Å; W183-L202 HydrophobicContact CZ2-CB 4.39Å; W183-L202 HydrophobicContact CZ2-CD2 4.44Å; W183-L202 HydrophobicContact CZ3-CD2 3.89Å; L198-L202 HydrophobicContact CD1-CD1 3.82Å; L198-L202 HydrophobicContact CD1-CG 3.97Å; L198-L202 HydrophobicContact CG-CD1 4Å; L198-L202 HydrophobicContact CG-CG 4.41Å; L198-L202 WeakPolarHBondContact O-CG 3.05Å; L198-L202 PolarHBondContact O-N 2.91Å; V199-L202 PolarHBondContact O-N 2.71Å; L202-Q204 PolarHBondContact O-N 2.87Å; L202-Y205 PolarHBondContact O-N 2.96Å; L202-Y205 VanDerWaalsContact O-O 3.12Å; L202-I213 HydrophobicContact CD2-CD1 3.81Å; L202-C248 HydrophobicContact CD2-CB 4.18Å
203	S	98.2	Very high	98.4	Very high	16 Å²	16	41 Å²	41	11%	0.112	20%	0.199	C	C	.	.	T	Hydrogen-bonded Turn	trans	-61.9	-14.3	175.4	76.1	0	0	0	0	113.8	P93 A94 E95 V199 K200 H201 Y205	P93-S203 CarbonylContact C-O 3.51Å; A94-S203 PolarHBondContact N-O 3.03Å; E95-S203 PolarHBondContact N-O 3.47Å; E95-S203 WeakPolarHBondContact O-CB 3.49Å; V199-S203 WeakPolarHBondContact O-CB 3.36Å; V199-S203 PolarHBondContact O-N 2.87Å; K200-S203 PolarHBondContact O-OG 2.85Å; H201-S203 VanDerWaalsContact C-N 3.31Å; H201-S203 PolarHBondContact O-N 3.26Å; S203-Y205 PolarHBondContact O-N 2.9Å
204	Q	97.7	Very high	98.4	Very high	87 Å²	87	41 Å²	41	41%	0.407	20%	0.198	S	C	.	.	T	Hydrogen-bonded Turn	trans	-76.5	-6.6	176	-56.3	-178.8	-57.1	0	0	112.9	A94 H201 L202	A94-Q204 VanDerWaalsContact CB-C 3.5Å; A94-Q204 VanDerWaalsContact CB-O 3.27Å; A94-Q204 WeakPolarHBondContact CB-O 3.46Å; H201-Q204 PolarHBondContact ND1-OE1 3.08Å; H201-Q204 WeakPolarHBondContact O-CB 3.48Å; H201-Q204 WeakPolarHBondContact O-CG 3.25Å; H201-Q204 PolarHBondContact O-N 3.02Å; H201-Q204 PolarHBondContact O-OE1 3Å; L202-Q204 PolarHBondContact O-N 2.87Å
205	Y	97.6	Very high	98.3	Very high	62 Å²	62	42.7 Å²	42.7	24%	0.243	21%	0.206	C	C	.	.	S	Bend	trans	-132.9	136.8	-176.6	-53.8	-82	0	0	0	111.2	L202 S203 H207 L211 I213	L202-Y205 PolarHBondContact O-N 2.96Å; L202-Y205 VanDerWaalsContact O-O 3.12Å; S203-Y205 PolarHBondContact O-N 2.9Å; Y205-H207 PolarHBondContact O-N 2.72Å; Y205-L211 HydrophobicContact CD1-CD1 3.66Å; Y205-L211 HydrophobicContact CD1-CG 4.18Å; Y205-L211 HydrophobicContact CE1-CD1 4.01Å; Y205-L211 HydrophobicContact CG-CD1 3.98Å; Y205-L211 HydrophobicContact CG-CG 4.24Å; Y205-I213 HydrophobicContact CD2-CD1 3.99Å; Y205-I213 HydrophobicContact CE2-CD1 4.05Å
206	P	98	Very high	98.2	Very high	35 Å²	35	44.1 Å²	44.1	23%	0.227	22%	0.215	C	C	.	.			trans	-68	127.6	168.6	-18.4	32	0	0	0	111.2	A94 E95 T208 Q209	A94-P206 HydrophobicContact CB-CG 4.45Å; E95-P206 WeakPolarHBondContact OE2-CA 3.21Å; P206-T208 PolarHBondContact O-N 3.08Å; P206-Q209 HydrophobicContact CB-CG 4.22Å; P206-Q209 HydrophobicContact CG-CG 4.41Å; P206-Q209 WeakPolarHBondContact O-CB 3.37Å; P206-Q209 PolarHBondContact O-N 2.97Å
207	H	98.6	Very high	97.9	Very high	38 Å²	38	38.7 Å²	38.7	18%	0.176	20%	0.201	C	C	.	.	T	Hydrogen-bonded Turn	trans	-65.4	-11.2	-178.2	73.5	-76.7	0	0	0	114.9	E95 K182 W183 Y205 S250 R251 G252	E95-H207 IonicContact OE1-CE1 2.87Å; E95-H207 PolarHBondContact OE1-CE1 2.99Å; E95-H207 IonicContact OE1-CG 2.92Å; E95-H207 IonicContact OE1-ND1 3.31Å; E95-H207 PolarHBondContact OE1-ND1 3.01Å; E95-H207 IonicContact OE2-CE1 3.57Å; E95-H207 IonicContact OE2-CG 3.58Å; E95-H207 PolarHBondContact OE2-N 3.2Å; E95-H207 IonicContact OE2-ND1 2.69Å; E95-H207 PolarHBondContact OE2-ND1 3.42Å; K182-H207 HydrophobicContact CB-CB 3.77Å; K182-H207 HydrophobicContact CG-CB 4.44Å; W183-H207 HydrophobicContact CZ2-CB 4.29Å; Y205-H207 PolarHBondContact O-N 2.72Å; H207-S250 WeakPolarHBondContact O-CB 3.48Å; H207-R251 PolarHBondContact O-N 2.69Å; H207-G252 PolarHBondContact O-N 3.36Å
208	T	98.4	Very high	97.6	Very high	97 Å²	97	40.5 Å²	40.5	60%	0.595	21%	0.209	S	C	*	.	T	Hydrogen-bonded Turn	trans	-84.6	-11.8	176.3	59	0	0	0	0	113	P206	P206-T208 PolarHBondContact O-N 3.08Å
209	Q	97.9	Very high	97.3	Very high	99 Å²	99	47.2 Å²	47.2	46%	0.463	25%	0.245	S	C	.	.	S	Bend	trans	-80.6	168.2	174.4	-67.8	-177.2	-2.3	0	0	111.3	P206 L211 S250	P206-Q209 HydrophobicContact CB-CG 4.22Å; P206-Q209 HydrophobicContact CG-CG 4.41Å; P206-Q209 WeakPolarHBondContact O-CB 3.37Å; P206-Q209 PolarHBondContact O-N 2.97Å; Q209-L211 HydrophobicContact CB-CD2 3.6Å; Q209-L211 PolarHBondContact O-N 2.92Å; Q209-S250 WeakPolarHBondContact O-CB 3.34Å; Q209-S250 PolarHBondContact O-OG 3.49Å
210	D	98.6	Very high	97.2	Very high	55 Å²	55	52.6 Å²	52.6	29%	0.294	26%	0.263	S	S	.	.			trans	-88	84.5	-179.7	-66.6	-14.4	0	0	0	111	L253 K256 V291	D210-L253 HydrophobicContact CB-CD1 4.26Å; D210-K256 WeakPolarHBondContact OD1-CE 3.49Å; D210-K256 IonicContact OD1-NZ 2.73Å; D210-K256 PolarHBondContact OD1-NZ 3.12Å; D210-K256 IonicContact OD2-NZ 3.84Å; D210-K256 PolarHBondContact OD2-NZ 2.9Å; D210-V291 HydrophobicContact CB-CG1 3.96Å; D210-V291 HydrophobicContact CB-CG2 3.77Å; D210-V291 VanDerWaalsContact O-CG1 3.3Å; D210-V291 WeakPolarHBondContact O-CG1 3.22Å
211	L	98.7	Very high	97.1	Very high	15 Å²	15	49.6 Å²	49.6	8%	0.079	25%	0.254	C	S	.	.			trans	-115.3	125.1	-176.1	-86.6	-77.7	0	0	0	111.6	W183 Y205 Q209 I213 V249 S250 L253	W183-L211 HydrophobicContact CH2-CB 3.83Å; W183-L211 HydrophobicContact CH2-CG 4.24Å; W183-L211 HydrophobicContact CZ3-CB 3.97Å; Y205-L211 HydrophobicContact CD1-CD1 3.66Å; Y205-L211 HydrophobicContact CD1-CG 4.18Å; Y205-L211 HydrophobicContact CE1-CD1 4.01Å; Y205-L211 HydrophobicContact CG-CD1 3.98Å; Y205-L211 HydrophobicContact CG-CG 4.24Å; Q209-L211 HydrophobicContact CB-CD2 3.6Å; Q209-L211 PolarHBondContact O-N 2.92Å; L211-I213 HydrophobicContact CB-CG1 4.49Å; L211-I213 HydrophobicContact CD1-CD1 4.18Å; L211-I213 HydrophobicContact CD1-CG1 4.14Å; L211-V249 WeakPolarHBondContact O-CA 3.22Å; L211-S250 PolarHBondContact N-OG 2.8Å; L211-S250 PolarHBondContact O-N 2.81Å; L211-S250 PolarHBondContact O-OG 2.92Å; L211-L253 WeakPolarHBondContact O-CD2 3.42Å
212	Y	98.9	Very high	97	Very high	0 Å²	0	50 Å²	50	0%	0	26%	0.257	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-124.4	113.7	167.6	176.8	-148.1	0	0	0	108.4	A241 F247 V249 I281 I285 L293 T294	Y212-A241 HydrophobicContact CE1-CB 4.49Å; Y212-A241 HydrophobicContact CE2-CB 3.87Å; Y212-A241 VanDerWaalsContact OH-CB 3.32Å; Y212-A241 WeakPolarHBondContact OH-CB 3.38Å; Y212-A241 PolarHBondContact OH-N 2.9Å; Y212-F247 HydrophobicContact CD2-CD2 4.48Å; Y212-F247 HydrophobicContact CE2-CB 4.02Å; Y212-F247 AromaticContact CE2-CD2 3.82Å; Y212-F247 HydrophobicContact CE2-CD2 3.82Å; Y212-F247 AromaticContact CE2-CG 3.98Å; Y212-F247 HydrophobicContact CE2-CG 3.98Å; Y212-V249 HydrophobicContact CD2-CG2 3.82Å; Y212-V249 HydrophobicContact CE2-CG2 4.3Å; Y212-I281 HydrophobicContact CE2-CG2 3.92Å; Y212-I285 HydrophobicContact CD1-CB 4.15Å; Y212-I285 HydrophobicContact CD1-CD1 3.8Å; Y212-I285 HydrophobicContact CD1-CG2 3.69Å; Y212-I285 HydrophobicContact CD2-CD1 3.84Å; Y212-I285 HydrophobicContact CE1-CD1 4.15Å; Y212-I285 HydrophobicContact CE2-CD1 4.19Å; Y212-I285 HydrophobicContact CG-CD1 3.62Å; Y212-I285 HydrophobicContact CG-CG2 4.06Å; Y212-L293 HydrophobicContact CD1-CB 4.17Å; Y212-L293 HydrophobicContact CD1-CD1 3.75Å; Y212-L293 HydrophobicContact CD2-CD1 4.35Å; Y212-L293 HydrophobicContact CE1-CB 4.41Å; Y212-L293 HydrophobicContact CE1-CD1 3.82Å; Y212-L293 HydrophobicContact CE2-CD1 4.41Å; Y212-L293 HydrophobicContact CG-CD1 4.05Å; Y212-T294 WeakPolarHBondContact O-CA 3.44Å; Y212-T294 VanDerWaalsContact O-CB 3.3Å; Y212-T294 WeakPolarHBondContact O-CB 3.31Å; Y212-T294 PolarHBondContact O-N 3.05Å
213	I	98.9	Very high	96.9	Very high	0 Å²	0	56.2 Å²	56.2	0%	0	29%	0.286	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-121.7	132	-169.5	-51.8	171.8	0	0	0	109.5	W183 L202 Y205 L211 F247 C248 T294 F299	W183-I213 HydrophobicContact CH2-CD1 4.24Å; W183-I213 HydrophobicContact CZ3-CD1 4.12Å; L202-I213 HydrophobicContact CD2-CD1 3.81Å; Y205-I213 HydrophobicContact CD2-CD1 3.99Å; Y205-I213 HydrophobicContact CE2-CD1 4.05Å; L211-I213 HydrophobicContact CB-CG1 4.49Å; L211-I213 HydrophobicContact CD1-CD1 4.18Å; L211-I213 HydrophobicContact CD1-CG1 4.14Å; I213-F247 CarbonylContact O-C 3.51Å; I213-F247 WeakPolarHBondContact O-CA 3.37Å; I213-F247 WeakPolarHBondContact O-CB 3.5Å; I213-C248 PolarHBondContact N-O 3.22Å; I213-C248 PolarHBondContact O-N 3.26Å; I213-T294 WeakPolarHBondContact CA-O 3.41Å; I213-T294 HydrophobicContact CG1-CG2 4.23Å; I213-F299 HydrophobicContact CG2-CE2 4.05Å
214	G	98.6	Very high	96.7	Very high	0 Å²	0	56.3 Å²	56.3	0%	0	29%	0.287	C	S	.	.	E	Extended strand (participates in β ladder)	trans	172.9	-170.8	174.8	0	0	0	0	0	112.6	T294 R295 S296	G214-T294 PolarHBondContact N-O 2.55Å; G214-T294 VanDerWaalsContact N-O 3.17Å; G214-R295 WeakPolarHBondContact O-CA 3.33Å; G214-S296 PolarHBondContact O-N 3.21Å
215	K	97.9	Very high	96.5	Very high	45 Å²	45	55.3 Å²	55.3	20%	0.196	29%	0.288	C	S	.	.			trans	-94.7	126.3	176.9	-175	153.2	-176	166.5	0	110.6	A241 T242 A245 F299 H300 E304	K215-A241 CarbonylContact O-C 3.38Å; K215-A241 VanDerWaalsContact O-CA 3.23Å; K215-A241 WeakPolarHBondContact O-CA 3.29Å; K215-T242 PolarHBondContact O-N 3.06Å; K215-T242 PolarHBondContact O-OG1 3.26Å; K215-A245 HydrophobicContact CB-CB 4.18Å; K215-F299 HydrophobicContact CB-CB 4.18Å; K215-F299 WeakPolarHBondContact CD-O 3.43Å; K215-H300 PolarHBondContact NZ-ND1 3.39Å; K215-E304 WeakPolarHBondContact CE-OE1 3.48Å; K215-E304 WeakPolarHBondContact CE-OE2 3.23Å; K215-E304 IonicContact NZ-OE1 3.72Å; K215-E304 PolarHBondContact NZ-OE1 2.96Å; K215-E304 IonicContact NZ-OE2 3.52Å; K215-E304 PolarHBondContact NZ-OE2 3.42Å
216	P	96.8	Very high	96.3	Very high	31 Å²	31	53.6 Å²	53.6	20%	0.201	28%	0.282	C	S	.	.	B	Isolated β-bridge	trans	-62.4	138.4	174.9	26.8	-34.4	0	0	0	110.7	W239 F240 L293 R295	P216-W239 HydrophobicContact CB-CE3 3.89Å; P216-W239 HydrophobicContact CB-CZ3 4.18Å; P216-F240 WeakPolarHBondContact CA-O 3.35Å; P216-L293 HydrophobicContact CB-CD2 4.01Å; P216-R295 HydrophobicContact CG-CG 4.24Å
217	S	89.9	Confident	96	Very high	45 Å²	45	56.8 Å²	56.8	32%	0.315	29%	0.289	S	S	.	.	S	Bend	trans	-77.3	-21.7	-178.9	-174.7	0	0	0	0	114.8	F240 T242	S217-F240 PolarHBondContact N-O 2.97Å; S217-T242 WeakPolarHBondContact CA-OG1 3.39Å; S217-T242 VanDerWaalsContact CB-OG1 3.25Å; S217-T242 WeakPolarHBondContact CB-OG1 3.47Å; S217-T242 PolarHBondContact N-OG1 3.43Å
218	L	92.4	Very high	95.2	Very high	65 Å²	65	59.7 Å²	59.7	34%	0.34	31%	0.306	S	S	.	.	S	Bend	trans	-127.2	166.5	-177.1	-63.7	176.7	0	0	0	109	R220 I222 W239 F240	L218-R220 VanDerWaalsContact C-N 3.26Å; L218-R220 WeakPolarHBondContact CB-O 3.36Å; L218-I222 HydrophobicContact CD1-CB 4.05Å; L218-I222 HydrophobicContact CD1-CG1 4.42Å; L218-W239 WeakPolarHBondContact O-CZ3 3.35Å; L218-F240 HydrophobicContact CD1-CE1 4.34Å
219	D	93.5	Very high	94.2	Very high	144 Å²	144	57.1 Å²	57.1	77%	0.77	30%	0.298	S	S	*	.	S	Bend	trans	-82.7	-6	170.6	64.8	-16.4	0	0	0	112.9	W239	D219-W239 WeakPolarHBondContact O-CH2 3.04Å
220	R	95.4	Very high	93.3	Very high	140 Å²	140	59.5 Å²	59.5	53%	0.528	31%	0.314	S	S	.	.	S	Bend	trans	-140.7	161.8	177.6	64.2	-177.8	177.9	125	-3.9	111.2	L218 E223 W239	L218-R220 VanDerWaalsContact C-N 3.26Å; L218-R220 WeakPolarHBondContact CB-O 3.36Å; R220-E223 IonicContact NH1-OE1 2.89Å; R220-E223 PolarHBondContact NH1-OE1 3.02Å; R220-W239 WeakPolarHBondContact O-CZ3 3.46Å
221	P	96.1	Very high	92.2	Very high	44 Å²	44	64.9 Å²	64.9	29%	0.286	34%	0.343	S	S	.	.	P	Polyproline II helix	trans	-56.8	145.1	171	-16.9	29.1	0	0	0	110.7	N237 F238 W239	P221-N237 HydrophobicContact CB-CB 4.48Å; P221-F238 CarbonylContact C-O 3.06Å; P221-F238 VanDerWaalsContact CA-O 3.3Å; P221-F238 WeakPolarHBondContact CA-O 3.45Å; P221-F238 WeakPolarHBondContact CB-O 3.44Å; P221-W239 HydrophobicContact CG-CD2 4.32Å; P221-W239 HydrophobicContact CG-CZ2 3.77Å
222	I	97	Very high	91.6	Very high	32 Å²	32	70.7 Å²	70.7	16%	0.164	37%	0.367	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-69.9	137.8	170.8	-170.5	169.5	0	0	0	109.2	L218 N237 F238 F240 L275	L218-I222 HydrophobicContact CD1-CB 4.05Å; L218-I222 HydrophobicContact CD1-CG1 4.42Å; I222-N237 VanDerWaalsContact O-CA 3.29Å; I222-N237 WeakPolarHBondContact O-CA 3.42Å; I222-F238 HydrophobicContact CG2-CD1 4.31Å; I222-F238 HydrophobicContact CG2-CD2 3.87Å; I222-F238 HydrophobicContact CG2-CE1 4.03Å; I222-F238 HydrophobicContact CG2-CE2 3.55Å; I222-F238 HydrophobicContact CG2-CG 4.24Å; I222-F238 HydrophobicContact CG2-CZ 3.64Å; I222-F238 WeakPolarHBondContact CG2-O 3.15Å; I222-F238 PolarHBondContact N-O 2.85Å; I222-F238 PolarHBondContact O-N 3.35Å; I222-F240 HydrophobicContact CB-CD1 4.35Å; I222-F240 HydrophobicContact CB-CE1 4.05Å; I222-F240 HydrophobicContact CD1-CE1 4.26Å; I222-F240 HydrophobicContact CG2-CD1 3.96Å; I222-F240 HydrophobicContact CG2-CE1 4.13Å; I222-L275 HydrophobicContact CD1-CD1 4.32Å; I222-L275 HydrophobicContact CD1-CD2 4.19Å
223	E	96.4	Very high	91.2	Very high	131 Å²	131	74.9 Å²	74.9	61%	0.612	39%	0.388	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-96.5	121.7	172.2	-66.2	170.3	-158.8	0	0	108.6	R220 N237	R220-E223 IonicContact NH1-OE1 2.89Å; R220-E223 PolarHBondContact NH1-OE1 3.02Å; E223-N237 WeakPolarHBondContact CA-OD1 2.98Å
224	A	94.4	Very high	91	Very high	17 Å²	17	79.7 Å²	79.7	14%	0.14	41%	0.409	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-142.8	179.8	-177.4	0	0	0	0	0	111.8	V236 F238 L275	A224-V236 HydrophobicContact CB-CG2 4.08Å; A224-V236 PolarHBondContact N-O 2.75Å; A224-V236 PolarHBondContact O-N 2.83Å; A224-F238 HydrophobicContact CB-CE1 4.3Å; A224-L275 HydrophobicContact CB-CD1 3.73Å; A224-L275 HydrophobicContact CB-CG 4.49Å
225	T	93.1	Very high	90.8	Very high	67 Å²	67	84.5 Å²	84.5	41%	0.411	44%	0.44	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-131.4	129.8	177.9	45.2	0	0	0	0	111.5	M233 K234	T225-M233 VanDerWaalsContact CB-CE 3.48Å; T225-M233 HydrophobicContact CG2-CE 4.4Å; T225-M233 VanDerWaalsContact OG1-CE 3.26Å; T225-M233 WeakPolarHBondContact OG1-CE 3.1Å; T225-K234 CarbonylContact C-O 3.41Å; T225-K234 WeakPolarHBondContact CA-O 3.39Å
226	E	93.5	Very high	90.7	Very high	26 Å²	26	82.9 Å²	82.9	12%	0.121	43%	0.434	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-89.1	133.3	171.5	178.4	-175.2	-175.1	0	0	110.1	L228 M233 K234 V236 Y283	E226-L228 VanDerWaalsContact CD-CD2 3.49Å; E226-L228 HydrophobicContact CG-CD2 3.96Å; E226-L228 WeakPolarHBondContact OE1-CD2 3.22Å; E226-M233 WeakPolarHBondContact O-CA 3.32Å; E226-K234 HydrophobicContact CB-CB 4.42Å; E226-K234 PolarHBondContact N-O 3.3Å; E226-K234 PolarHBondContact O-N 2.94Å; E226-V236 HydrophobicContact CB-CG1 4.12Å; E226-V236 HydrophobicContact CB-CG2 4.49Å; E226-Y283 PolarHBondContact OE1-OH 2.94Å; E226-Y283 PolarHBondContact OE2-OH 3.08Å; E226-Y283 VanDerWaalsContact OE2-OH 3.06Å
227	R	91	Very high	90.7	Very high	102 Å²	102	86.3 Å²	86.3	39%	0.385	45%	0.451	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-87.9	113.9	172.5	-68.8	166.5	176	-134.5	-6.4	110.6	M233 K272 R274	R227-M233 HydrophobicContact CB-SD 4.28Å; R227-M233 HydrophobicContact CG-CE 3.71Å; R227-M233 HydrophobicContact CG-SD 3.44Å; R227-M233 WeakPolarHBondContact CG-SD 3.47Å; R227-K272 WeakPolarHBondContact CB-O 3.46Å; R227-K272 WeakPolarHBondContact CD-O 3.34Å; R227-K272 WeakPolarHBondContact CG-O 3.3Å; R227-K272 PolarHBondContact N-O 2.79Å; R227-K272 VanDerWaalsContact N-O 3.08Å; R227-R274 VanDerWaalsContact CZ-NE 3.26Å; R227-R274 VanDerWaalsContact NH1-NH2 3.18Å
228	L	82.9	Confident	91.1	Very high	99 Å²	99	84.3 Å²	84.3	52%	0.518	44%	0.436	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-95.3	-1.4	-176.7	-64.7	178.1	0	0	0	114.5	E226 K232 K234	E226-L228 VanDerWaalsContact CD-CD2 3.49Å; E226-L228 HydrophobicContact CG-CD2 3.96Å; E226-L228 WeakPolarHBondContact OE1-CD2 3.22Å; L228-K232 HydrophobicContact CB-CB 4.38Å; L228-K232 PolarHBondContact N-O 2.91Å; L228-K234 HydrophobicContact CD1-CB 3.69Å; L228-K234 HydrophobicContact CD1-CD 4.2Å; L228-K234 HydrophobicContact CG-CB 4.13Å
229	G	76.9	Confident	91.3	Very high	42 Å²	42	83.6 Å²	83.6	43%	0.433	43%	0.429	S	S	.	.	E	Extended strand (participates in β ladder)	trans	95.5	164.2	-168.9	0	0	0	0	0	112.3	N231 K232	G229-N231 VanDerWaalsContact C-N 3.29Å; G229-N231 PolarHBondContact O-N 3.2Å; G229-K232 WeakPolarHBondContact O-CB 3.34Å; G229-K232 PolarHBondContact O-N 3.5Å
230	D	77.6	Confident	91.6	Very high	149 Å²	149	77.4 Å²	77.4	80%	0.797	40%	0.395	S	S	*	.	T	Hydrogen-bonded Turn	trans	51.3	39.4	179	-55.4	-28.2	0	0	0	115.3	K232	D230-K232 PolarHBondContact O-N 3.16Å
231	N	75.8	Confident	91.7	Very high	168 Å²	168	70.7 Å²	70.7	90%	0.898	37%	0.37	S	S	*	.	T	Hydrogen-bonded Turn	trans	55.7	15.2	-173.8	-71	-23	0	0	0	115	G229	G229-N231 VanDerWaalsContact C-N 3.29Å; G229-N231 PolarHBondContact O-N 3.2Å
232	K	87.2	Confident	91.8	Very high	137 Å²	137	69.1 Å²	69.1	60%	0.596	36%	0.36	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-81.9	125.3	174	-65.4	177.8	-177.8	169.4	0	109.7	L228 G229 D230	L228-K232 HydrophobicContact CB-CB 4.38Å; L228-K232 PolarHBondContact N-O 2.91Å; G229-K232 WeakPolarHBondContact O-CB 3.34Å; G229-K232 PolarHBondContact O-N 3.5Å; D230-K232 PolarHBondContact O-N 3.16Å
233	M	90.8	Very high	91.8	Very high	88 Å²	88	67.9 Å²	67.9	43%	0.433	35%	0.354	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-111.6	135.6	176.1	-59.9	-62.7	-74.1	0	0	108.9	T225 E226 R227	T225-M233 VanDerWaalsContact CB-CE 3.48Å; T225-M233 HydrophobicContact CG2-CE 4.4Å; T225-M233 VanDerWaalsContact OG1-CE 3.26Å; T225-M233 WeakPolarHBondContact OG1-CE 3.1Å; E226-M233 WeakPolarHBondContact O-CA 3.32Å; R227-M233 HydrophobicContact CB-SD 4.28Å; R227-M233 HydrophobicContact CG-CE 3.71Å; R227-M233 HydrophobicContact CG-SD 3.44Å; R227-M233 WeakPolarHBondContact CG-SD 3.47Å
234	K	92.9	Very high	91.8	Very high	101 Å²	101	62 Å²	62	44%	0.439	33%	0.33	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-115.1	124.9	174.4	176.9	-174.8	170	-162.8	0	109.3	T225 E226 L228 V236	T225-K234 CarbonylContact C-O 3.41Å; T225-K234 WeakPolarHBondContact CA-O 3.39Å; E226-K234 HydrophobicContact CB-CB 4.42Å; E226-K234 PolarHBondContact N-O 3.3Å; E226-K234 PolarHBondContact O-N 2.94Å; L228-K234 HydrophobicContact CD1-CB 3.69Å; L228-K234 HydrophobicContact CD1-CD 4.2Å; L228-K234 HydrophobicContact CG-CB 4.13Å; K234-V236 HydrophobicContact CG-CG1 4.48Å
235	P	94.6	Very high	91.9	Very high	102 Å²	102	61.2 Å²	61.2	66%	0.662	32%	0.323	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-66.7	139	173.1	28.7	-33.1	0	0	0	110
236	V	95.8	Very high	92.2	Very high	11 Å²	11	58 Å²	58	7%	0.067	30%	0.303	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-138	137.5	178.2	-67.9	0	0	0	0	109.4	A224 E226 K234 F238 Y283	A224-V236 HydrophobicContact CB-CG2 4.08Å; A224-V236 PolarHBondContact N-O 2.75Å; A224-V236 PolarHBondContact O-N 2.83Å; E226-V236 HydrophobicContact CB-CG1 4.12Å; E226-V236 HydrophobicContact CB-CG2 4.49Å; K234-V236 HydrophobicContact CG-CG1 4.48Å; V236-F238 HydrophobicContact CB-CD1 4.41Å; V236-F238 HydrophobicContact CB-CE1 4.5Å; V236-F238 HydrophobicContact CG2-CD1 4.36Å; V236-F238 HydrophobicContact CG2-CE1 3.96Å; V236-Y283 HydrophobicContact CB-CE2 4.44Å; V236-Y283 HydrophobicContact CG1-CE2 4.24Å; V236-Y283 HydrophobicContact CG2-CD2 4.35Å; V236-Y283 HydrophobicContact CG2-CE2 4.2Å
237	N	96.9	Very high	92.5	Very high	103 Å²	103	56.8 Å²	56.8	55%	0.551	30%	0.298	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-130.9	126.2	-178.2	-60.9	-22.9	0	0	0	108.9	P221 I222 E223	P221-N237 HydrophobicContact CB-CB 4.48Å; I222-N237 VanDerWaalsContact O-CA 3.29Å; I222-N237 WeakPolarHBondContact O-CA 3.42Å; E223-N237 WeakPolarHBondContact CA-OD1 2.98Å
238	F	97.9	Very high	92.8	Very high	2 Å²	2	52 Å²	52	1%	0.009	28%	0.28	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-158	158.8	-174.9	53.9	-86	0	0	0	113.1	P221 I222 A224 V236 L275 C279 Y283 E286 S287	P221-F238 CarbonylContact C-O 3.06Å; P221-F238 VanDerWaalsContact CA-O 3.3Å; P221-F238 WeakPolarHBondContact CA-O 3.45Å; P221-F238 WeakPolarHBondContact CB-O 3.44Å; I222-F238 HydrophobicContact CG2-CD1 4.31Å; I222-F238 HydrophobicContact CG2-CD2 3.87Å; I222-F238 HydrophobicContact CG2-CE1 4.03Å; I222-F238 HydrophobicContact CG2-CE2 3.55Å; I222-F238 HydrophobicContact CG2-CG 4.24Å; I222-F238 HydrophobicContact CG2-CZ 3.64Å; I222-F238 WeakPolarHBondContact CG2-O 3.15Å; I222-F238 PolarHBondContact N-O 2.85Å; I222-F238 PolarHBondContact O-N 3.35Å; A224-F238 HydrophobicContact CB-CE1 4.3Å; V236-F238 HydrophobicContact CB-CD1 4.41Å; V236-F238 HydrophobicContact CB-CE1 4.5Å; V236-F238 HydrophobicContact CG2-CD1 4.36Å; V236-F238 HydrophobicContact CG2-CE1 3.96Å; F238-L275 HydrophobicContact CE1-CD1 4.46Å; F238-L275 HydrophobicContact CZ-CD1 3.7Å; F238-C279 WeakPolarHBondContact CE2-O 3.44Å; F238-Y283 HydrophobicContact CD1-CD2 4.24Å; F238-Y283 AromaticContact CE1-CD2 3.81Å; F238-Y283 HydrophobicContact CE1-CD2 3.81Å; F238-Y283 HydrophobicContact CE1-CG 4.42Å; F238-Y283 HydrophobicContact CZ-CD2 4.23Å; F238-Y283 HydrophobicContact CZ-CG 4.4Å; F238-E286 HydrophobicContact CB-CB 3.71Å; F238-S287 WeakPolarHBondContact CB-OG 3.22Å; F238-S287 WeakPolarHBondContact CD1-OG 3.36Å; F238-S287 WeakPolarHBondContact CG-OG 3.37Å
239	W	98.4	Very high	93.6	Very high	50 Å²	50	47.3 Å²	47.3	19%	0.189	26%	0.255	C	S	.	.			trans	-86.1	154.1	166.7	-58	91.3	0	0	0	111.2	P216 L218 D219 R220 P221 E286 L293 R295	P216-W239 HydrophobicContact CB-CE3 3.89Å; P216-W239 HydrophobicContact CB-CZ3 4.18Å; L218-W239 WeakPolarHBondContact O-CZ3 3.35Å; D219-W239 WeakPolarHBondContact O-CH2 3.04Å; R220-W239 WeakPolarHBondContact O-CZ3 3.46Å; P221-W239 HydrophobicContact CG-CD2 4.32Å; P221-W239 HydrophobicContact CG-CZ2 3.77Å; W239-E286 WeakPolarHBondContact CB-OE1 3Å; W239-E286 PolarHBondContact N-OE2 2.78Å; W239-E286 WeakPolarHBondContact O-CG 3.48Å; W239-L293 HydrophobicContact CB-CB 4.17Å; W239-L293 HydrophobicContact CB-CD2 4.16Å; W239-R295 VanDerWaalsContact CD2-NH2 3.34Å; W239-R295 VanDerWaalsContact CZ3-NH2 3.32Å
240	F	98.4	Very high	94.7	Very high	14 Å²	14	45.3 Å²	45.3	6%	0.061	24%	0.235	C	C	.	.			trans	-143.2	148	170	70.2	-79	0	0	0	109.2	P216 S217 L218 I222 D278 C279	P216-F240 WeakPolarHBondContact CA-O 3.35Å; S217-F240 PolarHBondContact N-O 2.97Å; L218-F240 HydrophobicContact CD1-CE1 4.34Å; I222-F240 HydrophobicContact CB-CD1 4.35Å; I222-F240 HydrophobicContact CB-CE1 4.05Å; I222-F240 HydrophobicContact CD1-CE1 4.26Å; I222-F240 HydrophobicContact CG2-CD1 3.96Å; I222-F240 HydrophobicContact CG2-CE1 4.13Å; F240-D278 HydrophobicContact CD2-CB 4.37Å; F240-C279 VanDerWaalsContact CE2-SG 3.52Å; F240-C279 VanDerWaalsContact CZ-SG 3.51Å
241	A	98.4	Very high	95.7	Very high	0 Å²	0	40.6 Å²	40.6	0%	0	21%	0.206	C	C	.	.	B	Isolated β-bridge	trans	-78.6	134.8	172.8	0	0	0	0	0	109.9	Y212 K215 G243 F247 L293	Y212-A241 HydrophobicContact CE1-CB 4.49Å; Y212-A241 HydrophobicContact CE2-CB 3.87Å; Y212-A241 VanDerWaalsContact OH-CB 3.32Å; Y212-A241 WeakPolarHBondContact OH-CB 3.38Å; Y212-A241 PolarHBondContact OH-N 2.9Å; K215-A241 CarbonylContact O-C 3.38Å; K215-A241 VanDerWaalsContact O-CA 3.23Å; K215-A241 WeakPolarHBondContact O-CA 3.29Å; A241-G243 PolarHBondContact O-N 3.49Å; A241-F247 HydrophobicContact CB-CB 3.62Å; A241-F247 HydrophobicContact CB-CG 4.32Å; A241-L293 HydrophobicContact CB-CD1 3.93Å; A241-L293 HydrophobicContact CB-CD2 4.46Å
242	T	97.2	Very high	96.7	Very high	11 Å²	11	33.3 Å²	33.3	7%	0.067	17%	0.17	C	C	.	.			trans	-60.4	119.6	176.9	-46	0	0	0	0	110.6	K215 S217 G244 A245 G246 L303	K215-T242 PolarHBondContact O-N 3.06Å; K215-T242 PolarHBondContact O-OG1 3.26Å; S217-T242 WeakPolarHBondContact CA-OG1 3.39Å; S217-T242 VanDerWaalsContact CB-OG1 3.25Å; S217-T242 WeakPolarHBondContact CB-OG1 3.47Å; S217-T242 PolarHBondContact N-OG1 3.43Å; T242-G244 VanDerWaalsContact C-N 3.35Å; T242-G244 PolarHBondContact O-N 3.38Å; T242-A245 PolarHBondContact O-N 2.73Å; T242-G246 PolarHBondContact O-N 3.43Å; T242-L303 HydrophobicContact CG2-CD1 4.27Å
243	G	96.8	Very high	97.3	Very high	5 Å²	5	26.8 Å²	26.8	5%	0.052	14%	0.141	C	C	.	.	G	3₁₀ helix	trans	-53.6	-49	179.6	0	0	0	0	0	112.9	A241 A245 G246 D278	A241-G243 PolarHBondContact O-N 3.49Å; G243-A245 PolarHBondContact O-N 3.4Å; G243-A245 VanDerWaalsContact O-N 3.17Å; G243-G246 WeakPolarHBondContact O-CA 3.48Å; G243-G246 PolarHBondContact O-N 2.94Å; G243-D278 PolarHBondContact N-OD2 2.73Å
244	G	96.3	Very high	97.7	Very high	9 Å²	9	22.6 Å²	22.6	9%	0.093	12%	0.121	C	C	.	.	G	3₁₀ helix	trans	-73.9	0.9	179.4	0	0	0	0	0	116	D188 N191 T242	D188-G244 WeakPolarHBondContact OD2-CA 2.96Å; N191-G244 PolarHBondContact ND2-O 3.04Å; T242-G244 VanDerWaalsContact C-N 3.35Å; T242-G244 PolarHBondContact O-N 3.38Å
245	A	98.2	Very high	98	Very high	0 Å²	0	21.9 Å²	21.9	0%	0	12%	0.122	C	C	.	.	G	3₁₀ helix	trans	-92.5	-15.5	162.5	0	0	0	0	0	111.5	K215 T242 G243 F299 T319	K215-A245 HydrophobicContact CB-CB 4.18Å; T242-A245 PolarHBondContact O-N 2.73Å; G243-A245 PolarHBondContact O-N 3.4Å; G243-A245 VanDerWaalsContact O-N 3.17Å; A245-F299 HydrophobicContact CB-CB 4.25Å; A245-T319 WeakPolarHBondContact O-CB 3.05Å; A245-T319 WeakPolarHBondContact O-CG2 3.39Å; A245-T319 PolarHBondContact O-OG1 2.9Å
246	G	98.7	Very high	98.2	Very high	0 Å²	0	22 Å²	22	0%	0	11%	0.112	C	C	.	.			trans	76.9	154.6	-164.5	0	0	0	0	0	113.4	H186 T242 G243 F299	H186-G246 CarbonylContact O-C 3.39Å; H186-G246 WeakPolarHBondContact O-CA 3.41Å; T242-G246 PolarHBondContact O-N 3.43Å; G243-G246 WeakPolarHBondContact O-CA 3.48Å; G243-G246 PolarHBondContact O-N 2.94Å; G246-F299 VanDerWaalsContact O-CD1 3.29Å; G246-F299 WeakPolarHBondContact O-CD1 2.98Å
247	F	98.9	Very high	98.3	Very high	0 Å²	0	21.5 Å²	21.5	0%	0	11%	0.109	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-149.3	161.9	176	64.1	-101.3	0	0	0	110.5	M169 F184 C185 H186 Y212 I213 A241 V249 I281	M169-F247 HydrophobicContact CE-CE1 4.39Å; M169-F247 HydrophobicContact CE-CZ 4.08Å; M169-F247 HydrophobicContact SD-CZ 4.32Å; F184-F247 HydrophobicContact CD1-CE2 4.3Å; F184-F247 AromaticContact CE1-CE2 3.9Å; F184-F247 HydrophobicContact CE1-CE2 3.9Å; F184-F247 HydrophobicContact CE1-CZ 4.34Å; C185-F247 CarbonylContact C-O 3.48Å; C185-F247 VanDerWaalsContact CA-O 3.22Å; C185-F247 WeakPolarHBondContact CA-O 3.37Å; H186-F247 HydrophobicContact CB-CD1 4.19Å; H186-F247 HydrophobicContact CB-CD2 4.32Å; H186-F247 HydrophobicContact CB-CE1 3.7Å; H186-F247 HydrophobicContact CB-CE2 3.84Å; H186-F247 HydrophobicContact CB-CG 4.47Å; H186-F247 HydrophobicContact CB-CZ 3.5Å; H186-F247 AromaticContact CD2-CE1 3.44Å; H186-F247 VanDerWaalsContact CD2-CE1 3.44Å; H186-F247 WeakPolarHBondContact CD2-CE1 3.44Å; H186-F247 AromaticContact CG-CE1 3.8Å; H186-F247 AromaticContact CG-CZ 3.93Å; H186-F247 PolarHBondContact N-O 3.03Å; H186-F247 PolarHBondContact O-N 2.95Å; H186-F247 VanDerWaalsContact O-N 3.12Å; Y212-F247 HydrophobicContact CD2-CD2 4.48Å; Y212-F247 HydrophobicContact CE2-CB 4.02Å; Y212-F247 AromaticContact CE2-CD2 3.82Å; Y212-F247 HydrophobicContact CE2-CD2 3.82Å; Y212-F247 AromaticContact CE2-CG 3.98Å; Y212-F247 HydrophobicContact CE2-CG 3.98Å; I213-F247 CarbonylContact O-C 3.51Å; I213-F247 WeakPolarHBondContact O-CA 3.37Å; I213-F247 WeakPolarHBondContact O-CB 3.5Å; A241-F247 HydrophobicContact CB-CB 3.62Å; A241-F247 HydrophobicContact CB-CG 4.32Å; F247-V249 HydrophobicContact CD2-CG2 4.1Å; F247-V249 HydrophobicContact CE2-CG2 4.14Å; F247-I281 HydrophobicContact CE2-CG2 4.06Å; F247-I281 HydrophobicContact CZ-CB 4.45Å; F247-I281 HydrophobicContact CZ-CG1 3.98Å; F247-I281 HydrophobicContact CZ-CG2 4.18Å
248	C	98.9	Very high	98.4	Very high	1 Å²	1	17.9 Å²	17.9	1%	0.007	9%	0.091	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-128.4	144.3	174.1	-59.1	0	0	0	0	112.6	F184 C185 L202 I213	F184-C248 CarbonylContact O-C 3.51Å; F184-C248 WeakPolarHBondContact O-CA 3.19Å; F184-C248 WeakPolarHBondContact O-CB 3.46Å; C185-C248 HydrophobicContact CB-CB 4.2Å; C185-C248 WeakPolarHBondContact CB-SG 3.43Å; C185-C248 WeakPolarHBondContact SG-CB 3.39Å; C185-C248 CovalentContact SG-SG 2.05Å; C185-C248 PolarHBondContact SG-SG 2.64Å; L202-C248 HydrophobicContact CD2-CB 4.18Å; I213-C248 PolarHBondContact N-O 3.22Å; I213-C248 PolarHBondContact O-N 3.26Å
249	V	98.9	Very high	98.4	Very high	1 Å²	1	21.6 Å²	21.6	1%	0.006	12%	0.115	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-126.2	128.6	176.8	-179.8	0	0	0	0	108.3	F184 L211 Y212 F247 L253 A254 M257 I285	F184-V249 HydrophobicContact CB-CB 4.42Å; F184-V249 HydrophobicContact CD1-CB 4.3Å; F184-V249 HydrophobicContact CD1-CG2 4.45Å; F184-V249 PolarHBondContact N-O 2.87Å; F184-V249 PolarHBondContact O-N 3.5Å; L211-V249 WeakPolarHBondContact O-CA 3.22Å; Y212-V249 HydrophobicContact CD2-CG2 3.82Å; Y212-V249 HydrophobicContact CE2-CG2 4.3Å; F247-V249 HydrophobicContact CD2-CG2 4.1Å; F247-V249 HydrophobicContact CE2-CG2 4.14Å; V249-L253 HydrophobicContact CG1-CB 3.96Å; V249-L253 HydrophobicContact CG1-CD2 4.05Å; V249-L253 HydrophobicContact CG1-CG 3.99Å; V249-A254 HydrophobicContact CG1-CB 4.07Å; V249-M257 HydrophobicContact CG1-SD 3.89Å; V249-I285 HydrophobicContact CG2-CD1 4.01Å
250	S	98.9	Very high	98.4	Very high	0 Å²	0	23.2 Å²	23.2	0%	0	12%	0.122	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-65	148.9	172.9	52.7	0	0	0	0	112	H207 Q209 L211 G252 L253 A254	H207-S250 WeakPolarHBondContact O-CB 3.48Å; Q209-S250 WeakPolarHBondContact O-CB 3.34Å; Q209-S250 PolarHBondContact O-OG 3.49Å; L211-S250 PolarHBondContact N-OG 2.8Å; L211-S250 PolarHBondContact O-N 2.81Å; L211-S250 PolarHBondContact O-OG 2.92Å; S250-G252 VanDerWaalsContact C-N 3.27Å; S250-G252 PolarHBondContact O-N 3.39Å; S250-L253 PolarHBondContact O-N 2.98Å; S250-L253 VanDerWaalsContact OG-CB 3.32Å; S250-L253 WeakPolarHBondContact OG-CB 3.31Å; S250-A254 WeakPolarHBondContact O-CB 3.26Å; S250-A254 PolarHBondContact O-N 2.69Å
251	R	98.8	Very high	98.4	Very high	50 Å²	50	22.6 Å²	22.6	19%	0.189	12%	0.119	C	C	.	.	H	α-helix	trans	-58.6	-39.3	177.3	-174.8	177.4	-168.7	69.6	7.9	112.2	F176 I177 G180 K181 K182 H207 L253 A254 L255	F176-R251 HydrophobicContact CZ-CB 4.17Å; F176-R251 HydrophobicContact CZ-CG 4.44Å; I177-R251 PolarHBondContact O-NH2 3.09Å; G180-R251 VanDerWaalsContact C-NH1 3.3Å; K181-R251 WeakPolarHBondContact O-CD 3.11Å; K181-R251 PolarHBondContact O-NH1 3.01Å; K181-R251 VanDerWaalsContact O-NH1 3.11Å; K182-R251 WeakPolarHBondContact O-CB 3.47Å; K182-R251 PolarHBondContact O-N 3.44Å; H207-R251 PolarHBondContact O-N 2.69Å; R251-L253 VanDerWaalsContact C-N 3.35Å; R251-L253 PolarHBondContact O-N 3.13Å; R251-A254 PolarHBondContact O-N 3.29Å; R251-L255 HydrophobicContact CG-CD1 4.06Å; R251-L255 HydrophobicContact CG-CG 4.25Å; R251-L255 WeakPolarHBondContact O-CG 3.35Å; R251-L255 PolarHBondContact O-N 2.83Å
252	G	98.6	Very high	98.3	Very high	14 Å²	14	24 Å²	24	14%	0.144	13%	0.129	C	C	.	.	H	α-helix	trans	-55.5	-49.3	176.9	0	0	0	0	0	112.2	H207 S250	H207-G252 PolarHBondContact O-N 3.36Å; S250-G252 VanDerWaalsContact C-N 3.27Å; S250-G252 PolarHBondContact O-N 3.39Å
253	L	98.9	Very high	98.1	Very high	0 Å²	0	26.4 Å²	26.4	0%	0	16%	0.156	C	C	.	.	H	α-helix	trans	-65.6	-46.9	176.2	-176.3	50.9	0	0	0	112.3	D210 L211 V249 S250 R251 L255 K256 M257 I285 L289 V291	D210-L253 HydrophobicContact CB-CD1 4.26Å; L211-L253 WeakPolarHBondContact O-CD2 3.42Å; V249-L253 HydrophobicContact CG1-CB 3.96Å; V249-L253 HydrophobicContact CG1-CD2 4.05Å; V249-L253 HydrophobicContact CG1-CG 3.99Å; S250-L253 PolarHBondContact O-N 2.98Å; S250-L253 VanDerWaalsContact OG-CB 3.32Å; S250-L253 WeakPolarHBondContact OG-CB 3.31Å; R251-L253 VanDerWaalsContact C-N 3.35Å; R251-L253 PolarHBondContact O-N 3.13Å; L253-L255 VanDerWaalsContact C-N 3.33Å; L253-L255 PolarHBondContact O-N 3.4Å; L253-K256 WeakPolarHBondContact O-CA 3.06Å; L253-K256 WeakPolarHBondContact O-CB 3.45Å; L253-K256 PolarHBondContact O-N 2.92Å; L253-M257 HydrophobicContact CD1-CG 4.48Å; L253-M257 HydrophobicContact CG-CG 4.43Å; L253-M257 HydrophobicContact CG-SD 4.18Å; L253-M257 WeakPolarHBondContact O-CG 3.5Å; L253-M257 PolarHBondContact O-N 3.36Å; L253-I285 HydrophobicContact CD2-CD1 4.08Å; L253-I285 HydrophobicContact CD2-CG1 4.2Å; L253-I285 HydrophobicContact CD2-CG2 3.86Å; L253-I285 HydrophobicContact CG-CG1 4.48Å; L253-L289 HydrophobicContact CD1-CD1 3.85Å; L253-V291 HydrophobicContact CD1-CB 4.32Å; L253-V291 HydrophobicContact CD1-CG1 4.41Å; L253-V291 HydrophobicContact CD1-CG2 3.94Å; L253-V291 HydrophobicContact CD2-CG1 4.03Å
254	A	98.8	Very high	97.7	Very high	0 Å²	0	27.9 Å²	27.9	0%	0	17%	0.171	C	C	.	.	H	α-helix	trans	-57	-47.1	179.8	0	0	0	0	0	110.9	Y173 F176 I177 V249 S250 R251 K256 M257 S258	Y173-A254 HydrophobicContact CE2-CB 4.22Å; Y173-A254 PolarHBondContact OH-O 2.96Å; F176-A254 HydrophobicContact CD1-CB 4.24Å; F176-A254 HydrophobicContact CE1-CB 3.52Å; F176-A254 HydrophobicContact CZ-CB 4.49Å; I177-A254 HydrophobicContact CD1-CB 4.04Å; V249-A254 HydrophobicContact CG1-CB 4.07Å; S250-A254 WeakPolarHBondContact O-CB 3.26Å; S250-A254 PolarHBondContact O-N 2.69Å; R251-A254 PolarHBondContact O-N 3.29Å; A254-K256 PolarHBondContact O-N 3.4Å; A254-M257 WeakPolarHBondContact O-CA 3.2Å; A254-M257 WeakPolarHBondContact O-CB 3.32Å; A254-M257 PolarHBondContact O-N 2.83Å; A254-S258 PolarHBondContact O-N 3.17Å; A254-S258 PolarHBondContact O-OG 2.82Å
255	L	98.8	Very high	97.7	Very high	87 Å²	87	31.9 Å²	31.9	46%	0.455	19%	0.187	S	C	.	.	H	α-helix	trans	-55.8	-32.5	177.3	-70.1	171	0	0	0	113.4	I177 R251 L253 S258	I177-L255 HydrophobicContact CD1-CD2 4.31Å; R251-L255 HydrophobicContact CG-CD1 4.06Å; R251-L255 HydrophobicContact CG-CG 4.25Å; R251-L255 WeakPolarHBondContact O-CG 3.35Å; R251-L255 PolarHBondContact O-N 2.83Å; L253-L255 VanDerWaalsContact C-N 3.33Å; L253-L255 PolarHBondContact O-N 3.4Å; L255-S258 WeakPolarHBondContact O-CB 3.4Å; L255-S258 PolarHBondContact O-OG 3.44Å
256	K	98.8	Very high	97.7	Very high	104 Å²	104	31.9 Å²	31.9	45%	0.452	19%	0.187	S	C	.	.	H	α-helix	trans	-75	-28.5	173.8	-65.1	173.4	178	168.4	0	113.6	D210 L253 A254 S258 P259 W260 L289	D210-K256 WeakPolarHBondContact OD1-CE 3.49Å; D210-K256 IonicContact OD1-NZ 2.73Å; D210-K256 PolarHBondContact OD1-NZ 3.12Å; D210-K256 IonicContact OD2-NZ 3.84Å; D210-K256 PolarHBondContact OD2-NZ 2.9Å; L253-K256 WeakPolarHBondContact O-CA 3.06Å; L253-K256 WeakPolarHBondContact O-CB 3.45Å; L253-K256 PolarHBondContact O-N 2.92Å; A254-K256 PolarHBondContact O-N 3.4Å; K256-S258 VanDerWaalsContact C-N 3.26Å; K256-S258 PolarHBondContact O-N 2.64Å; K256-P259 VanDerWaalsContact O-CD 3.23Å; K256-P259 WeakPolarHBondContact O-CD 3.19Å; K256-W260 WeakPolarHBondContact O-CZ3 3.24Å; K256-L289 HydrophobicContact CB-CD1 4.13Å; K256-L289 HydrophobicContact CB-CD2 4.39Å
257	M	98.8	Very high	97.6	Very high	1 Å²	1	34.6 Å²	34.6	1%	0.005	20%	0.2	C	C	.	.	H	α-helix	trans	-71.6	-19.9	175.2	-64.3	167.9	63	0	0	112.9	Y173 V249 L253 A254 P259 W260 A261 I281 I284 I285 L289	Y173-M257 HydrophobicContact CE2-CB 4.21Å; Y173-M257 HydrophobicContact CE2-CE 4.06Å; Y173-M257 HydrophobicContact CE2-SD 4.36Å; Y173-M257 WeakPolarHBondContact OH-CB 3.47Å; V249-M257 HydrophobicContact CG1-SD 3.89Å; L253-M257 HydrophobicContact CD1-CG 4.48Å; L253-M257 HydrophobicContact CG-CG 4.43Å; L253-M257 HydrophobicContact CG-SD 4.18Å; L253-M257 WeakPolarHBondContact O-CG 3.5Å; L253-M257 PolarHBondContact O-N 3.36Å; A254-M257 WeakPolarHBondContact O-CA 3.2Å; A254-M257 WeakPolarHBondContact O-CB 3.32Å; A254-M257 PolarHBondContact O-N 2.83Å; M257-P259 VanDerWaalsContact C-N 3.34Å; M257-P259 VanDerWaalsContact O-N 3.13Å; M257-W260 PolarHBondContact O-N 2.96Å; M257-A261 HydrophobicContact CB-CB 4.28Å; M257-A261 PolarHBondContact O-N 3.29Å; M257-I281 HydrophobicContact CE-CD1 3.82Å; M257-I281 HydrophobicContact CE-CG2 4.39Å; M257-I284 HydrophobicContact CB-CG2 3.96Å; M257-I284 HydrophobicContact CE-CG2 4.29Å; M257-I284 HydrophobicContact CG-CG2 3.85Å; M257-I285 HydrophobicContact CE-CD1 3.88Å; M257-I285 HydrophobicContact CE-CG1 3.83Å; M257-I285 HydrophobicContact CG-CG1 4.09Å; M257-I285 HydrophobicContact SD-CD1 3.67Å; M257-I285 HydrophobicContact SD-CG1 3.56Å; M257-I285 VanDerWaalsContact SD-CG1 3.56Å; M257-L289 HydrophobicContact CB-CD1 4.39Å; M257-L289 HydrophobicContact CG-CD1 3.62Å
258	S	98.1	Very high	97.4	Very high	27 Å²	27	39.3 Å²	39.3	19%	0.189	23%	0.226	C	C	.	.	H	α-helix	trans	-49	-39.2	-172.9	-65.7	0	0	0	0	116.1	Y173 A254 L255 K256 W260 A261 S262	Y173-S258 PolarHBondContact OH-N 3.18Å; Y173-S258 VanDerWaalsContact OH-N 3.16Å; Y173-S258 PolarHBondContact OH-OG 2.56Å; A254-S258 PolarHBondContact O-N 3.17Å; A254-S258 PolarHBondContact O-OG 2.82Å; L255-S258 WeakPolarHBondContact O-CB 3.4Å; L255-S258 PolarHBondContact O-OG 3.44Å; K256-S258 VanDerWaalsContact C-N 3.26Å; K256-S258 PolarHBondContact O-N 2.64Å; S258-W260 PolarHBondContact O-N 3.35Å; S258-W260 VanDerWaalsContact O-N 3.11Å; S258-A261 PolarHBondContact O-N 3.29Å; S258-S262 WeakPolarHBondContact O-CB 3.5Å; S258-S262 PolarHBondContact O-N 2.97Å
259	P	98.4	Very high	97.3	Very high	79 Å²	79	39.5 Å²	39.5	51%	0.513	23%	0.227	S	C	.	.	H	α-helix	trans	-61	-19.1	176.3	-22.9	34.6	0	0	0	114.9	K256 M257	K256-P259 VanDerWaalsContact O-CD 3.23Å; K256-P259 WeakPolarHBondContact O-CD 3.19Å; M257-P259 VanDerWaalsContact C-N 3.34Å; M257-P259 VanDerWaalsContact O-N 3.13Å
260	W	98.5	Very high	97.2	Very high	85 Å²	85	39.7 Å²	39.7	32%	0.322	23%	0.229	S	C	.	.	H	α-helix	trans	-114.5	-16.2	179.6	-61	-88.6	0	0	0	113.9	K256 M257 S258 H265 F266 T269 I284 V288 L289	K256-W260 WeakPolarHBondContact O-CZ3 3.24Å; M257-W260 PolarHBondContact O-N 2.96Å; S258-W260 PolarHBondContact O-N 3.35Å; S258-W260 VanDerWaalsContact O-N 3.11Å; W260-H265 CarbonylContact O-C 3.41Å; W260-F266 VanDerWaalsContact O-CA 3.27Å; W260-F266 WeakPolarHBondContact O-CA 3.34Å; W260-F266 PolarHBondContact O-N 3.17Å; W260-F266 VanDerWaalsContact O-N 3.12Å; W260-T269 PolarHBondContact O-OG1 3.31Å; W260-I284 HydrophobicContact CB-CD1 3.88Å; W260-I284 HydrophobicContact CB-CG1 3.9Å; W260-I284 HydrophobicContact CB-CG2 4.03Å; W260-I284 HydrophobicContact CE3-CG2 4.48Å; W260-V288 HydrophobicContact CD2-CG1 3.97Å; W260-V288 VanDerWaalsContact CE2-CG1 3.47Å; W260-V288 HydrophobicContact CE3-CG1 4.35Å; W260-V288 HydrophobicContact CH2-CG1 3.86Å; W260-V288 HydrophobicContact CZ2-CG1 3.42Å; W260-V288 VanDerWaalsContact CZ2-CG1 3.42Å; W260-V288 HydrophobicContact CZ3-CG1 4.31Å; W260-L289 HydrophobicContact CH2-CD2 4.24Å; W260-L289 HydrophobicContact CZ3-CD2 3.78Å
261	A	97.9	Very high	97	Very high	0 Å²	0	43 Å²	43	0%	0	24%	0.244	C	C	.	.	H	α-helix	trans	-116.3	-38.7	-173	0	0	0	0	0	113.8	Y173 M257 S258 F266 I284	Y173-A261 HydrophobicContact CD1-CB 3.91Å; Y173-A261 HydrophobicContact CD2-CB 4.08Å; Y173-A261 HydrophobicContact CE1-CB 3.64Å; Y173-A261 HydrophobicContact CE2-CB 3.79Å; Y173-A261 HydrophobicContact CG-CB 4.12Å; M257-A261 HydrophobicContact CB-CB 4.28Å; M257-A261 PolarHBondContact O-N 3.29Å; S258-A261 PolarHBondContact O-N 3.29Å; A261-F266 HydrophobicContact CB-CD2 4.07Å; A261-F266 WeakPolarHBondContact O-CB 3.17Å; A261-F266 PolarHBondContact O-N 3.3Å; A261-I284 HydrophobicContact CB-CD1 4.21Å
262	S	96.9	Very high	96.8	Very high	30 Å²	30	45 Å²	45	21%	0.21	25%	0.254	C	S	.	.	T	Hydrogen-bonded Turn	trans	-82.4	162.6	-173.1	-161.3	0	0	0	0	112.7	D174 S258 G264 H265	D174-S262 WeakPolarHBondContact OD1-CA 3.4Å; D174-S262 WeakPolarHBondContact OD1-CB 3.4Å; D174-S262 PolarHBondContact OD1-OG 3.48Å; S258-S262 WeakPolarHBondContact O-CB 3.5Å; S258-S262 PolarHBondContact O-N 2.97Å; S262-G264 VanDerWaalsContact C-N 3.27Å; S262-G264 PolarHBondContact O-N 2.87Å; S262-H265 VanDerWaalsContact O-CB 3.29Å; S262-H265 WeakPolarHBondContact O-CB 3.47Å; S262-H265 PolarHBondContact O-CD2 2.98Å; S262-H265 PolarHBondContact O-N 3.42Å
263	G	92.6	Very high	96.6	Very high	62 Å²	62	44.7 Å²	44.7	64%	0.639	25%	0.249	S	C	*	.	T	Hydrogen-bonded Turn	trans	62.5	33	165.7	0	0	0	0	0	113.7	D174 H265	D174-G263 PolarHBondContact OD1-N 2.9Å; D174-G263 PolarHBondContact OD2-N 3.49Å; G263-H265 VanDerWaalsContact C-N 3.31Å; G263-H265 PolarHBondContact O-N 3.17Å
264	G	88.3	Confident	96.5	Very high	36 Å²	36	50.1 Å²	50.1	37%	0.371	27%	0.27	S	S	.	.	T	Hydrogen-bonded Turn	trans	82	-1.8	-177.2	0	0	0	0	0	115.2	S262 F266 M267	S262-G264 VanDerWaalsContact C-N 3.27Å; S262-G264 PolarHBondContact O-N 2.87Å; G264-F266 VanDerWaalsContact C-N 3.28Å; G264-F266 PolarHBondContact O-N 3.04Å; G264-M267 PolarHBondContact O-N 3.34Å
265	H	96.7	Very high	96.3	Very high	92 Å²	92	51.4 Å²	51.4	43%	0.426	28%	0.277	S	S	.	.	H	α-helix	trans	-66.6	-27.9	178	-70.1	-69	0	0	0	113.1	W260 S262 G263 M267 N268 T269	W260-H265 CarbonylContact O-C 3.41Å; S262-H265 VanDerWaalsContact O-CB 3.29Å; S262-H265 WeakPolarHBondContact O-CB 3.47Å; S262-H265 PolarHBondContact O-CD2 2.98Å; S262-H265 PolarHBondContact O-N 3.42Å; G263-H265 VanDerWaalsContact C-N 3.31Å; G263-H265 PolarHBondContact O-N 3.17Å; H265-M267 VanDerWaalsContact C-N 3.27Å; H265-M267 PolarHBondContact O-N 2.95Å; H265-N268 WeakPolarHBondContact O-CB 3.23Å; H265-N268 PolarHBondContact O-N 2.83Å; H265-N268 VanDerWaalsContact O-N 3.1Å; H265-T269 PolarHBondContact O-N 3.47Å; H265-T269 PolarHBondContact O-OG1 3.15Å; H265-T269 VanDerWaalsContact O-OG1 3.11Å
266	F	97.9	Very high	96.2	Very high	0 Å²	0	49.6 Å²	49.6	0%	0	27%	0.27	C	S	.	.	H	α-helix	trans	-55.1	-43.2	178.9	-166.1	-94.7	0	0	0	112.5	S166 M169 A170 W260 A261 G264 N268 T269 A270 D277 T280 I281 I284	S166-F266 WeakPolarHBondContact O-CD1 3.29Å; M169-F266 HydrophobicContact CB-CD1 4.48Å; M169-F266 HydrophobicContact CB-CE1 3.87Å; M169-F266 HydrophobicContact CB-CZ 4.16Å; M169-F266 HydrophobicContact CG-CD1 4.45Å; M169-F266 HydrophobicContact CG-CE1 3.7Å; M169-F266 HydrophobicContact CG-CE2 4.05Å; M169-F266 HydrophobicContact CG-CZ 3.45Å; M169-F266 VanDerWaalsContact CG-CZ 3.45Å; A170-F266 HydrophobicContact CB-CB 3.79Å; A170-F266 HydrophobicContact CB-CD1 4.29Å; A170-F266 HydrophobicContact CB-CG 4.3Å; W260-F266 VanDerWaalsContact O-CA 3.27Å; W260-F266 WeakPolarHBondContact O-CA 3.34Å; W260-F266 PolarHBondContact O-N 3.17Å; W260-F266 VanDerWaalsContact O-N 3.12Å; A261-F266 HydrophobicContact CB-CD2 4.07Å; A261-F266 WeakPolarHBondContact O-CB 3.17Å; A261-F266 PolarHBondContact O-N 3.3Å; G264-F266 VanDerWaalsContact C-N 3.28Å; G264-F266 PolarHBondContact O-N 3.04Å; F266-N268 PolarHBondContact O-N 2.89Å; F266-T269 PolarHBondContact O-N 2.92Å; F266-A270 WeakPolarHBondContact O-CB 3.37Å; F266-A270 PolarHBondContact O-N 3.12Å; F266-D277 HydrophobicContact CE1-CB 4.15Å; F266-D277 HydrophobicContact CZ-CB 4.35Å; F266-D277 WeakPolarHBondContact CZ-O 3.23Å; F266-T280 HydrophobicContact CD1-CG2 4.49Å; F266-T280 HydrophobicContact CD2-CG2 4.23Å; F266-T280 HydrophobicContact CE1-CG2 4.04Å; F266-T280 HydrophobicContact CE2-CG2 3.75Å; F266-T280 HydrophobicContact CZ-CG2 3.65Å; F266-I281 HydrophobicContact CE2-CD1 3.58Å; F266-I281 HydrophobicContact CE2-CG1 3.92Å; F266-I281 HydrophobicContact CZ-CD1 4.15Å; F266-I281 HydrophobicContact CZ-CG1 4.04Å; F266-I284 HydrophobicContact CD2-CD1 4.12Å; F266-I284 HydrophobicContact CE2-CD1 4.21Å
267	M	96.9	Very high	96.1	Very high	57 Å²	57	45.1 Å²	45.1	28%	0.281	25%	0.251	S	S	.	.	H	α-helix	trans	-63.8	-41.3	179.3	-71.3	-61.9	-66.3	0	0	112.4	Q163 S166 C167 G264 H265 T269 A270 E271	Q163-M267 HydrophobicContact CB-CE 4.1Å; Q163-M267 WeakPolarHBondContact O-CE 3.49Å; S166-M267 VanDerWaalsContact CB-SD 3.52Å; C167-M267 WeakPolarHBondContact CA-SD 3.48Å; C167-M267 HydrophobicContact CB-CE 4.31Å; C167-M267 HydrophobicContact CB-SD 3.88Å; C167-M267 PolarHBondContact N-SD 3.25Å; G264-M267 PolarHBondContact O-N 3.34Å; H265-M267 VanDerWaalsContact C-N 3.27Å; H265-M267 PolarHBondContact O-N 2.95Å; M267-T269 VanDerWaalsContact C-N 3.32Å; M267-A270 PolarHBondContact O-N 2.85Å; M267-E271 PolarHBondContact O-N 2.94Å
268	N	95.6	Very high	96.1	Very high	99 Å²	99	46.1 Å²	46.1	53%	0.529	26%	0.256	S	S	.	.	H	α-helix	trans	-64.5	-41.5	176.5	-64.9	-31.8	0	0	0	110.7	H265 F266 E271 K272	H265-N268 WeakPolarHBondContact O-CB 3.23Å; H265-N268 PolarHBondContact O-N 2.83Å; H265-N268 VanDerWaalsContact O-N 3.1Å; F266-N268 PolarHBondContact O-N 2.89Å; N268-E271 PolarHBondContact O-N 2.62Å; N268-K272 WeakPolarHBondContact O-CG 3.32Å; N268-K272 PolarHBondContact O-N 3.1Å; N268-K272 VanDerWaalsContact O-N 3.14Å
269	T	96.8	Very high	96.1	Very high	5 Å²	5	45 Å²	45	3%	0.031	25%	0.249	C	C	.	.	H	α-helix	trans	-64.8	-45.7	176.8	-54.8	0	0	0	0	111.5	W260 H265 F266 M267 E271 K272 I273 T280 Y283 I284	W260-T269 PolarHBondContact O-OG1 3.31Å; H265-T269 PolarHBondContact O-N 3.47Å; H265-T269 PolarHBondContact O-OG1 3.15Å; H265-T269 VanDerWaalsContact O-OG1 3.11Å; F266-T269 PolarHBondContact O-N 2.92Å; M267-T269 VanDerWaalsContact C-N 3.32Å; T269-E271 VanDerWaalsContact C-N 3.33Å; T269-E271 PolarHBondContact O-N 3.27Å; T269-K272 WeakPolarHBondContact O-CB 3.14Å; T269-K272 PolarHBondContact O-N 3.03Å; T269-K272 VanDerWaalsContact O-N 3.17Å; T269-I273 PolarHBondContact O-N 3.27Å; T269-T280 HydrophobicContact CG2-CG2 4.01Å; T269-Y283 HydrophobicContact CG2-CD1 3.81Å; T269-Y283 HydrophobicContact CG2-CE1 3.83Å; T269-I284 HydrophobicContact CG2-CD1 4.02Å; T269-I284 HydrophobicContact CG2-CG1 3.76Å
270	A	96.3	Very high	96.1	Very high	6 Å²	6	41.3 Å²	41.3	5%	0.05	22%	0.224	C	C	.	.	H	α-helix	trans	-59.3	-40.9	176.7	0	0	0	0	0	112.3	F266 M267 R274 T280	F266-A270 WeakPolarHBondContact O-CB 3.37Å; F266-A270 PolarHBondContact O-N 3.12Å; M267-A270 PolarHBondContact O-N 2.85Å; A270-R274 WeakPolarHBondContact O-CA 3.49Å; A270-R274 PolarHBondContact O-N 2.94Å; A270-T280 HydrophobicContact CB-CG2 4Å
271	E	94.6	Very high	96.1	Very high	69 Å²	69	37.2 Å²	37.2	32%	0.322	21%	0.209	S	C	.	.	H	α-helix	trans	-71.3	-28.8	178.1	-174.2	55.2	-142.1	0	0	112.9	M267 N268 T269 I273 R274	M267-E271 PolarHBondContact O-N 2.94Å; N268-E271 PolarHBondContact O-N 2.62Å; T269-E271 VanDerWaalsContact C-N 3.33Å; T269-E271 PolarHBondContact O-N 3.27Å; E271-I273 PolarHBondContact O-N 3.17Å; E271-R274 VanDerWaalsContact O-CG 3.22Å; E271-R274 WeakPolarHBondContact O-CG 3.34Å; E271-R274 IonicContact OE1-CZ 3.92Å; E271-R274 VanDerWaalsContact OE1-CZ 3.31Å; E271-R274 IonicContact OE1-NE 3.86Å; E271-R274 PolarHBondContact OE1-NE 3.06Å; E271-R274 IonicContact OE1-NH2 3.16Å; E271-R274 PolarHBondContact OE1-NH2 3.01Å
272	K	94.1	Very high	96.1	Very high	92 Å²	92	37.2 Å²	37.2	40%	0.4	21%	0.209	S	C	.	.	H	α-helix	trans	-63	-40.5	175.8	-77.7	174.8	179.7	-178.5	0	112.9	R227 N268 T269	R227-K272 WeakPolarHBondContact CB-O 3.46Å; R227-K272 WeakPolarHBondContact CD-O 3.34Å; R227-K272 WeakPolarHBondContact CG-O 3.3Å; R227-K272 PolarHBondContact N-O 2.79Å; R227-K272 VanDerWaalsContact N-O 3.08Å; N268-K272 WeakPolarHBondContact O-CG 3.32Å; N268-K272 PolarHBondContact O-N 3.1Å; N268-K272 VanDerWaalsContact O-N 3.14Å; T269-K272 WeakPolarHBondContact O-CB 3.14Å; T269-K272 PolarHBondContact O-N 3.03Å; T269-K272 VanDerWaalsContact O-N 3.17Å
273	I	95.8	Very high	96.2	Very high	8 Å²	8	36.1 Å²	36.1	4%	0.041	20%	0.2	C	C	.	.	H	α-helix	trans	-97.1	-17.8	-178.1	64	-180	0	0	0	112.9	T269 E271 L275 T280 Y283	T269-I273 PolarHBondContact O-N 3.27Å; E271-I273 PolarHBondContact O-N 3.17Å; I273-L275 VanDerWaalsContact C-N 3.29Å; I273-L275 HydrophobicContact CB-CD1 4.44Å; I273-L275 HydrophobicContact CB-CG 4.43Å; I273-L275 HydrophobicContact CD1-CB 4.09Å; I273-L275 HydrophobicContact CD1-CD1 4.12Å; I273-L275 HydrophobicContact CD1-CG 4.4Å; I273-L275 HydrophobicContact CG1-CB 4.07Å; I273-L275 HydrophobicContact CG1-CD1 4.37Å; I273-L275 HydrophobicContact CG1-CG 4.23Å; I273-L275 PolarHBondContact O-N 2.72Å; I273-T280 HydrophobicContact CD1-CG2 4.42Å; I273-Y283 HydrophobicContact CD1-CD1 3.91Å; I273-Y283 HydrophobicContact CD1-CG 3.76Å; I273-Y283 HydrophobicContact CG2-CD1 3.91Å; I273-Y283 HydrophobicContact CG2-CD2 3.9Å; I273-Y283 HydrophobicContact CG2-CE1 3.83Å; I273-Y283 HydrophobicContact CG2-CE2 3.82Å; I273-Y283 HydrophobicContact CG2-CG 3.94Å
274	R	95.3	Very high	96.5	Very high	113 Å²	113	33.2 Å²	33.2	43%	0.426	17%	0.17	S	C	.	.	T	Hydrogen-bonded Turn	trans	54.4	39.1	-177.3	-62.8	-168.9	161.2	-168.5	-4.3	114.7	R162 R227 A270 E271	R162-R274 PolarHBondContact NH1-O 2.86Å; R227-R274 VanDerWaalsContact CZ-NE 3.26Å; R227-R274 VanDerWaalsContact NH1-NH2 3.18Å; A270-R274 WeakPolarHBondContact O-CA 3.49Å; A270-R274 PolarHBondContact O-N 2.94Å; E271-R274 VanDerWaalsContact O-CG 3.22Å; E271-R274 WeakPolarHBondContact O-CG 3.34Å; E271-R274 IonicContact OE1-CZ 3.92Å; E271-R274 VanDerWaalsContact OE1-CZ 3.31Å; E271-R274 IonicContact OE1-NE 3.86Å; E271-R274 PolarHBondContact OE1-NE 3.06Å; E271-R274 IonicContact OE1-NH2 3.16Å; E271-R274 PolarHBondContact OE1-NH2 3.01Å
275	L	95.1	Very high	97	Very high	28 Å²	28	31.5 Å²	31.5	15%	0.147	15%	0.152	C	C	.	.			trans	-109.2	171	175.9	-64.2	176	0	0	0	111.3	I222 A224 F238 I273 C279	I222-L275 HydrophobicContact CD1-CD1 4.32Å; I222-L275 HydrophobicContact CD1-CD2 4.19Å; A224-L275 HydrophobicContact CB-CD1 3.73Å; A224-L275 HydrophobicContact CB-CG 4.49Å; F238-L275 HydrophobicContact CE1-CD1 4.46Å; F238-L275 HydrophobicContact CZ-CD1 3.7Å; I273-L275 VanDerWaalsContact C-N 3.29Å; I273-L275 HydrophobicContact CB-CD1 4.44Å; I273-L275 HydrophobicContact CB-CG 4.43Å; I273-L275 HydrophobicContact CD1-CB 4.09Å; I273-L275 HydrophobicContact CD1-CD1 4.12Å; I273-L275 HydrophobicContact CD1-CG 4.4Å; I273-L275 HydrophobicContact CG1-CB 4.07Å; I273-L275 HydrophobicContact CG1-CD1 4.37Å; I273-L275 HydrophobicContact CG1-CG 4.23Å; I273-L275 PolarHBondContact O-N 2.72Å; L275-C279 HydrophobicContact CB-CB 3.5Å; L275-C279 VanDerWaalsContact CB-CB 3.5Å; L275-C279 HydrophobicContact CD1-CB 3.9Å; L275-C279 HydrophobicContact CG-CB 4.3Å
276	P	96.4	Very high	97.1	Very high	48 Å²	48	28.8 Å²	28.8	31%	0.312	14%	0.14	S	C	.	.			trans	-60.8	172.8	169	-24.3	36.3	0	0	0	113.5	D278 C279 T280	P276-D278 WeakPolarHBondContact CB-OD1 3.47Å; P276-C279 PolarHBondContact O-N 3.04Å; P276-T280 PolarHBondContact O-N 3.29Å; P276-T280 PolarHBondContact O-OG1 2.78Å
277	D	97.8	Very high	97	Very high	11 Å²	11	30.9 Å²	30.9	6%	0.059	16%	0.155	C	C	.	.	H	α-helix	trans	-67.2	-41.7	-175.9	55.5	-37.6	0	0	0	113.1	K107 L165 M169 F266 T280 I281	K107-D277 WeakPolarHBondContact CE-OD2 3.37Å; K107-D277 IonicContact NZ-OD2 2.7Å; K107-D277 PolarHBondContact NZ-OD2 3.27Å; L165-D277 HydrophobicContact CB-CB 4.47Å; M169-D277 HydrophobicContact CB-CB 3.97Å; M169-D277 HydrophobicContact CG-CB 4.27Å; F266-D277 HydrophobicContact CE1-CB 4.15Å; F266-D277 HydrophobicContact CZ-CB 4.35Å; F266-D277 WeakPolarHBondContact CZ-O 3.23Å; D277-T280 WeakPolarHBondContact O-CA 3.4Å; D277-T280 WeakPolarHBondContact O-CB 3.5Å; D277-T280 PolarHBondContact O-N 3.13Å; D277-T280 VanDerWaalsContact O-N 3.08Å; D277-I281 PolarHBondContact O-N 2.72Å
278	D	97.8	Very high	97.1	Very high	22 Å²	22	30.4 Å²	30.4	12%	0.118	16%	0.155	C	C	.	.	H	α-helix	trans	-64	-42.1	174.5	60.9	-9.4	0	0	0	112.6	F240 G243 P276 T280 I281 G282	F240-D278 HydrophobicContact CD2-CB 4.37Å; G243-D278 PolarHBondContact N-OD2 2.73Å; P276-D278 WeakPolarHBondContact CB-OD1 3.47Å; D278-T280 VanDerWaalsContact C-N 3.25Å; D278-T280 PolarHBondContact O-N 2.91Å; D278-I281 WeakPolarHBondContact O-CB 3.4Å; D278-I281 PolarHBondContact O-N 2.92Å; D278-G282 PolarHBondContact O-N 3.15Å
279	C	98.1	Very high	97.2	Very high	4 Å²	4	28.1 Å²	28.1	3%	0.027	14%	0.142	C	C	.	.	H	α-helix	trans	-60.2	-34.9	169.4	-71.2	0	0	0	0	112.3	F238 F240 L275 P276 G282 Y283	F238-C279 WeakPolarHBondContact CE2-O 3.44Å; F240-C279 VanDerWaalsContact CE2-SG 3.52Å; F240-C279 VanDerWaalsContact CZ-SG 3.51Å; L275-C279 HydrophobicContact CB-CB 3.5Å; L275-C279 VanDerWaalsContact CB-CB 3.5Å; L275-C279 HydrophobicContact CD1-CB 3.9Å; L275-C279 HydrophobicContact CG-CB 4.3Å; P276-C279 PolarHBondContact O-N 3.04Å; C279-G282 PolarHBondContact O-N 2.9Å; C279-Y283 VanDerWaalsContact O-CB 3.28Å; C279-Y283 WeakPolarHBondContact O-CB 3.45Å; C279-Y283 PolarHBondContact O-N 2.84Å
280	T	98.5	Very high	97.3	Very high	0 Å²	0	30.7 Å²	30.7	0%	0	17%	0.17	C	C	.	.	H	α-helix	trans	-68.8	-40.1	177.8	-57	0	0	0	0	111.2	F266 T269 A270 I273 P276 D277 D278 Y283 I284	F266-T280 HydrophobicContact CD1-CG2 4.49Å; F266-T280 HydrophobicContact CD2-CG2 4.23Å; F266-T280 HydrophobicContact CE1-CG2 4.04Å; F266-T280 HydrophobicContact CE2-CG2 3.75Å; F266-T280 HydrophobicContact CZ-CG2 3.65Å; T269-T280 HydrophobicContact CG2-CG2 4.01Å; A270-T280 HydrophobicContact CB-CG2 4Å; I273-T280 HydrophobicContact CD1-CG2 4.42Å; P276-T280 PolarHBondContact O-N 3.29Å; P276-T280 PolarHBondContact O-OG1 2.78Å; D277-T280 WeakPolarHBondContact O-CA 3.4Å; D277-T280 WeakPolarHBondContact O-CB 3.5Å; D277-T280 PolarHBondContact O-N 3.13Å; D277-T280 VanDerWaalsContact O-N 3.08Å; D278-T280 VanDerWaalsContact C-N 3.25Å; D278-T280 PolarHBondContact O-N 2.91Å; T280-Y283 PolarHBondContact O-N 2.77Å; T280-I284 HydrophobicContact CG2-CD1 4.21Å; T280-I284 VanDerWaalsContact O-CG1 3.29Å; T280-I284 WeakPolarHBondContact O-CG1 3.39Å; T280-I284 PolarHBondContact O-N 2.98Å
281	I	98.7	Very high	97.4	Very high	0 Å²	0	31 Å²	31	0%	0	17%	0.171	C	C	.	.	H	α-helix	trans	-58.7	-51.3	170.9	-67.1	-74	0	0	0	110.3	M169 Y212 F247 M257 F266 D277 D278 Y283 I284 I285	M169-I281 HydrophobicContact CG-CD1 4.38Å; M169-I281 HydrophobicContact CG-CG1 4.4Å; M169-I281 HydrophobicContact SD-CD1 4.27Å; M169-I281 HydrophobicContact SD-CG1 4.35Å; Y212-I281 HydrophobicContact CE2-CG2 3.92Å; F247-I281 HydrophobicContact CE2-CG2 4.06Å; F247-I281 HydrophobicContact CZ-CB 4.45Å; F247-I281 HydrophobicContact CZ-CG1 3.98Å; F247-I281 HydrophobicContact CZ-CG2 4.18Å; M257-I281 HydrophobicContact CE-CD1 3.82Å; M257-I281 HydrophobicContact CE-CG2 4.39Å; F266-I281 HydrophobicContact CE2-CD1 3.58Å; F266-I281 HydrophobicContact CE2-CG1 3.92Å; F266-I281 HydrophobicContact CZ-CD1 4.15Å; F266-I281 HydrophobicContact CZ-CG1 4.04Å; D277-I281 PolarHBondContact O-N 2.72Å; D278-I281 WeakPolarHBondContact O-CB 3.4Å; D278-I281 PolarHBondContact O-N 2.92Å; I281-Y283 VanDerWaalsContact C-N 3.34Å; I281-Y283 PolarHBondContact O-N 3.16Å; I281-I284 PolarHBondContact O-N 3.13Å; I281-I285 HydrophobicContact CG2-CD1 3.63Å; I281-I285 WeakPolarHBondContact O-CB 3.31Å; I281-I285 WeakPolarHBondContact O-CG1 3.47Å; I281-I285 PolarHBondContact O-N 3.43Å
282	G	98.5	Very high	97.6	Very high	0 Å²	0	32 Å²	32	0%	0	18%	0.184	C	C	.	.	H	α-helix	trans	-60.3	-41.2	178.3	0	0	0	0	0	113.1	D278 C279 I285 E286	D278-G282 PolarHBondContact O-N 3.15Å; C279-G282 PolarHBondContact O-N 2.9Å; G282-I285 PolarHBondContact O-N 3.2Å; G282-E286 WeakPolarHBondContact O-CB 3.47Å; G282-E286 PolarHBondContact O-N 3.12Å
283	Y	98.6	Very high	97.8	Very high	7 Å²	7	28.3 Å²	28.3	3%	0.027	17%	0.168	C	C	.	.	I	π-helix	trans	-60.1	-49.4	176.2	170.3	-103.1	0	0	0	112.1	E226 V236 F238 T269 I273 C279 T280 I281 I285 S287 V288	E226-Y283 PolarHBondContact OE1-OH 2.94Å; E226-Y283 PolarHBondContact OE2-OH 3.08Å; E226-Y283 VanDerWaalsContact OE2-OH 3.06Å; V236-Y283 HydrophobicContact CB-CE2 4.44Å; V236-Y283 HydrophobicContact CG1-CE2 4.24Å; V236-Y283 HydrophobicContact CG2-CD2 4.35Å; V236-Y283 HydrophobicContact CG2-CE2 4.2Å; F238-Y283 HydrophobicContact CD1-CD2 4.24Å; F238-Y283 AromaticContact CE1-CD2 3.81Å; F238-Y283 HydrophobicContact CE1-CD2 3.81Å; F238-Y283 HydrophobicContact CE1-CG 4.42Å; F238-Y283 HydrophobicContact CZ-CD2 4.23Å; F238-Y283 HydrophobicContact CZ-CG 4.4Å; T269-Y283 HydrophobicContact CG2-CD1 3.81Å; T269-Y283 HydrophobicContact CG2-CE1 3.83Å; I273-Y283 HydrophobicContact CD1-CD1 3.91Å; I273-Y283 HydrophobicContact CD1-CG 3.76Å; I273-Y283 HydrophobicContact CG2-CD1 3.91Å; I273-Y283 HydrophobicContact CG2-CD2 3.9Å; I273-Y283 HydrophobicContact CG2-CE1 3.83Å; I273-Y283 HydrophobicContact CG2-CE2 3.82Å; I273-Y283 HydrophobicContact CG2-CG 3.94Å; C279-Y283 VanDerWaalsContact O-CB 3.28Å; C279-Y283 WeakPolarHBondContact O-CB 3.45Å; C279-Y283 PolarHBondContact O-N 2.84Å; T280-Y283 PolarHBondContact O-N 2.77Å; I281-Y283 VanDerWaalsContact C-N 3.34Å; I281-Y283 PolarHBondContact O-N 3.16Å; Y283-I285 VanDerWaalsContact C-N 3.31Å; Y283-I285 PolarHBondContact O-N 3.11Å; Y283-S287 WeakPolarHBondContact O-CA 3.48Å; Y283-S287 VanDerWaalsContact O-CB 3.25Å; Y283-S287 WeakPolarHBondContact O-CB 3.45Å; Y283-S287 PolarHBondContact O-N 3.19Å; Y283-V288 HydrophobicContact CD1-CG2 4.26Å; Y283-V288 HydrophobicContact CE1-CG2 3.67Å; Y283-V288 HydrophobicContact CE2-CG2 4.34Å; Y283-V288 PolarHBondContact O-N 3.04Å; Y283-V288 VanDerWaalsContact O-N 3.15Å
284	I	98.8	Very high	97.9	Very high	0 Å²	0	30 Å²	30	0%	0	18%	0.179	C	C	.	.	I	π-helix	trans	-59.7	-45.6	178.2	-65.1	166.7	0	0	0	109.9	M257 W260 A261 F266 T269 T280 I281 V288 L289	M257-I284 HydrophobicContact CB-CG2 3.96Å; M257-I284 HydrophobicContact CE-CG2 4.29Å; M257-I284 HydrophobicContact CG-CG2 3.85Å; W260-I284 HydrophobicContact CB-CD1 3.88Å; W260-I284 HydrophobicContact CB-CG1 3.9Å; W260-I284 HydrophobicContact CB-CG2 4.03Å; W260-I284 HydrophobicContact CE3-CG2 4.48Å; A261-I284 HydrophobicContact CB-CD1 4.21Å; F266-I284 HydrophobicContact CD2-CD1 4.12Å; F266-I284 HydrophobicContact CE2-CD1 4.21Å; T269-I284 HydrophobicContact CG2-CD1 4.02Å; T269-I284 HydrophobicContact CG2-CG1 3.76Å; T280-I284 HydrophobicContact CG2-CD1 4.21Å; T280-I284 VanDerWaalsContact O-CG1 3.29Å; T280-I284 WeakPolarHBondContact O-CG1 3.39Å; T280-I284 PolarHBondContact O-N 2.98Å; I281-I284 PolarHBondContact O-N 3.13Å; I284-V288 VanDerWaalsContact O-CB 3.31Å; I284-V288 WeakPolarHBondContact O-CB 3.43Å; I284-V288 PolarHBondContact O-N 3.42Å; I284-L289 HydrophobicContact CG2-CD1 4.33Å; I284-L289 WeakPolarHBondContact O-CG 2.95Å; I284-L289 PolarHBondContact O-N 3.24Å
285	I	98.8	Very high	98.1	Very high	0 Å²	0	31.2 Å²	31.2	0%	0	18%	0.183	C	C	.	.	I	π-helix	trans	-74.1	-52.6	-173.2	-67.1	172.7	0	0	0	112	Y212 V249 L253 M257 I281 G282 Y283 L289 G290 V291	Y212-I285 HydrophobicContact CD1-CB 4.15Å; Y212-I285 HydrophobicContact CD1-CD1 3.8Å; Y212-I285 HydrophobicContact CD1-CG2 3.69Å; Y212-I285 HydrophobicContact CD2-CD1 3.84Å; Y212-I285 HydrophobicContact CE1-CD1 4.15Å; Y212-I285 HydrophobicContact CE2-CD1 4.19Å; Y212-I285 HydrophobicContact CG-CD1 3.62Å; Y212-I285 HydrophobicContact CG-CG2 4.06Å; V249-I285 HydrophobicContact CG2-CD1 4.01Å; L253-I285 HydrophobicContact CD2-CD1 4.08Å; L253-I285 HydrophobicContact CD2-CG1 4.2Å; L253-I285 HydrophobicContact CD2-CG2 3.86Å; L253-I285 HydrophobicContact CG-CG1 4.48Å; M257-I285 HydrophobicContact CE-CD1 3.88Å; M257-I285 HydrophobicContact CE-CG1 3.83Å; M257-I285 HydrophobicContact CG-CG1 4.09Å; M257-I285 HydrophobicContact SD-CD1 3.67Å; M257-I285 HydrophobicContact SD-CG1 3.56Å; M257-I285 VanDerWaalsContact SD-CG1 3.56Å; I281-I285 HydrophobicContact CG2-CD1 3.63Å; I281-I285 WeakPolarHBondContact O-CB 3.31Å; I281-I285 WeakPolarHBondContact O-CG1 3.47Å; I281-I285 PolarHBondContact O-N 3.43Å; G282-I285 PolarHBondContact O-N 3.2Å; Y283-I285 VanDerWaalsContact C-N 3.31Å; Y283-I285 PolarHBondContact O-N 3.11Å; I285-L289 CarbonylContact O-C 3.57Å; I285-L289 WeakPolarHBondContact O-CB 3.37Å; I285-L289 PolarHBondContact O-N 3.09Å; I285-G290 PolarHBondContact O-N 3.5Å; I285-G290 VanDerWaalsContact O-N 3.1Å; I285-V291 HydrophobicContact CG2-CB 3.84Å; I285-V291 HydrophobicContact CG2-CG1 4.1Å; I285-V291 WeakPolarHBondContact CG2-O 3.4Å; I285-V291 PolarHBondContact O-N 3.14Å
286	E	98.3	Very high	98.2	Very high	36 Å²	36	30.4 Å²	30.4	17%	0.168	18%	0.18	C	C	.	.	I	π-helix	trans	-83.8	-47.8	-174.1	-73.3	-126.3	167.4	0	0	112.8	F238 W239 G282 G290 V291 P292 L293	F238-E286 HydrophobicContact CB-CB 3.71Å; W239-E286 WeakPolarHBondContact CB-OE1 3Å; W239-E286 PolarHBondContact N-OE2 2.78Å; W239-E286 WeakPolarHBondContact O-CG 3.48Å; G282-E286 WeakPolarHBondContact O-CB 3.47Å; G282-E286 PolarHBondContact O-N 3.12Å; E286-G290 VanDerWaalsContact O-CA 3.31Å; E286-G290 WeakPolarHBondContact O-CA 3.43Å; E286-G290 PolarHBondContact O-N 3.04Å; E286-V291 WeakPolarHBondContact CA-O 3.26Å; E286-V291 WeakPolarHBondContact CG-O 3.32Å; E286-P292 WeakPolarHBondContact OE1-CA 3.37Å; E286-L293 WeakPolarHBondContact OE1-CB 3.48Å; E286-L293 PolarHBondContact OE1-N 3.22Å
287	S	97.5	Very high	98.2	Very high	44 Å²	44	32.5 Å²	32.5	31%	0.308	20%	0.196	S	C	.	.	I	π-helix	trans	-81.7	-36.4	-174	-66.5	0	0	0	0	113.1	F238 Y283	F238-S287 WeakPolarHBondContact CB-OG 3.22Å; F238-S287 WeakPolarHBondContact CD1-OG 3.36Å; F238-S287 WeakPolarHBondContact CG-OG 3.37Å; Y283-S287 WeakPolarHBondContact O-CA 3.48Å; Y283-S287 VanDerWaalsContact O-CB 3.25Å; Y283-S287 WeakPolarHBondContact O-CB 3.45Å; Y283-S287 PolarHBondContact O-N 3.19Å
288	V	97.8	Very high	98.2	Very high	47 Å²	47	34 Å²	34	29%	0.285	20%	0.203	S	C	.	.	I	π-helix	trans	-93.3	-47.7	-176.3	-178.8	0	0	0	0	111.4	W260 Y283 I284	W260-V288 HydrophobicContact CD2-CG1 3.97Å; W260-V288 VanDerWaalsContact CE2-CG1 3.47Å; W260-V288 HydrophobicContact CE3-CG1 4.35Å; W260-V288 HydrophobicContact CH2-CG1 3.86Å; W260-V288 HydrophobicContact CZ2-CG1 3.42Å; W260-V288 VanDerWaalsContact CZ2-CG1 3.42Å; W260-V288 HydrophobicContact CZ3-CG1 4.31Å; Y283-V288 HydrophobicContact CD1-CG2 4.26Å; Y283-V288 HydrophobicContact CE1-CG2 3.67Å; Y283-V288 HydrophobicContact CE2-CG2 4.34Å; Y283-V288 PolarHBondContact O-N 3.04Å; Y283-V288 VanDerWaalsContact O-N 3.15Å; I284-V288 VanDerWaalsContact O-CB 3.31Å; I284-V288 WeakPolarHBondContact O-CB 3.43Å; I284-V288 PolarHBondContact O-N 3.42Å
289	L	98.5	Very high	98.3	Very high	50 Å²	50	33 Å²	33	26%	0.262	20%	0.198	S	C	.	.	S	Bend	trans	-92.1	-13.2	-177.5	-63.2	175.1	0	0	0	114.2	L253 K256 M257 W260 I284 I285 V291	L253-L289 HydrophobicContact CD1-CD1 3.85Å; K256-L289 HydrophobicContact CB-CD1 4.13Å; K256-L289 HydrophobicContact CB-CD2 4.39Å; M257-L289 HydrophobicContact CB-CD1 4.39Å; M257-L289 HydrophobicContact CG-CD1 3.62Å; W260-L289 HydrophobicContact CH2-CD2 4.24Å; W260-L289 HydrophobicContact CZ3-CD2 3.78Å; I284-L289 HydrophobicContact CG2-CD1 4.33Å; I284-L289 WeakPolarHBondContact O-CG 2.95Å; I284-L289 PolarHBondContact O-N 3.24Å; I285-L289 CarbonylContact O-C 3.57Å; I285-L289 WeakPolarHBondContact O-CB 3.37Å; I285-L289 PolarHBondContact O-N 3.09Å; L289-V291 VanDerWaalsContact C-N 3.29Å; L289-V291 HydrophobicContact CB-CG2 4.28Å; L289-V291 PolarHBondContact O-N 3.16Å
290	G	98.3	Very high	98.3	Very high	60 Å²	60	33.5 Å²	33.5	62%	0.619	20%	0.2	S	C	*	.			trans	70.9	21.8	177.8	0	0	0	0	0	114.3	I285 E286	I285-G290 PolarHBondContact O-N 3.5Å; I285-G290 VanDerWaalsContact O-N 3.1Å; E286-G290 VanDerWaalsContact O-CA 3.31Å; E286-G290 WeakPolarHBondContact O-CA 3.43Å; E286-G290 PolarHBondContact O-N 3.04Å
291	V	98.7	Very high	98.2	Very high	13 Å²	13	33.7 Å²	33.7	8%	0.079	20%	0.202	C	C	.	.	P	Polyproline II helix	trans	-97.8	122.6	-178.6	175.8	0	0	0	0	109.1	D210 L253 I285 E286 L289	D210-V291 HydrophobicContact CB-CG1 3.96Å; D210-V291 HydrophobicContact CB-CG2 3.77Å; D210-V291 VanDerWaalsContact O-CG1 3.3Å; D210-V291 WeakPolarHBondContact O-CG1 3.22Å; L253-V291 HydrophobicContact CD1-CB 4.32Å; L253-V291 HydrophobicContact CD1-CG1 4.41Å; L253-V291 HydrophobicContact CD1-CG2 3.94Å; L253-V291 HydrophobicContact CD2-CG1 4.03Å; I285-V291 HydrophobicContact CG2-CB 3.84Å; I285-V291 HydrophobicContact CG2-CG1 4.1Å; I285-V291 WeakPolarHBondContact CG2-O 3.4Å; I285-V291 PolarHBondContact O-N 3.14Å; E286-V291 WeakPolarHBondContact CA-O 3.26Å; E286-V291 WeakPolarHBondContact CG-O 3.32Å; L289-V291 VanDerWaalsContact C-N 3.29Å; L289-V291 HydrophobicContact CB-CG2 4.28Å; L289-V291 PolarHBondContact O-N 3.16Å
292	P	98.3	Very high	97.9	Very high	90 Å²	90	35.5 Å²	35.5	58%	0.584	21%	0.21	S	C	*	.	P	Polyproline II helix	trans	-76.7	148	-176.8	30.7	-35	0	0	0	112.7	E286 T294	E286-P292 WeakPolarHBondContact OE1-CA 3.37Å; P292-T294 PolarHBondContact O-N 3.49Å
293	L	98.6	Very high	97.6	Very high	14 Å²	14	40.1 Å²	40.1	7%	0.073	23%	0.234	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-63.6	116.7	169.1	174.5	62.6	0	0	0	110	Y212 P216 W239 A241 E286 R295	Y212-L293 HydrophobicContact CD1-CB 4.17Å; Y212-L293 HydrophobicContact CD1-CD1 3.75Å; Y212-L293 HydrophobicContact CD2-CD1 4.35Å; Y212-L293 HydrophobicContact CE1-CB 4.41Å; Y212-L293 HydrophobicContact CE1-CD1 3.82Å; Y212-L293 HydrophobicContact CE2-CD1 4.41Å; Y212-L293 HydrophobicContact CG-CD1 4.05Å; P216-L293 HydrophobicContact CB-CD2 4.01Å; W239-L293 HydrophobicContact CB-CB 4.17Å; W239-L293 HydrophobicContact CB-CD2 4.16Å; A241-L293 HydrophobicContact CB-CD1 3.93Å; A241-L293 HydrophobicContact CB-CD2 4.46Å; E286-L293 WeakPolarHBondContact OE1-CB 3.48Å; E286-L293 PolarHBondContact OE1-N 3.22Å; L293-R295 PolarHBondContact O-N 3.03Å; L293-R295 VanDerWaalsContact O-N 3.17Å
294	T	98.4	Very high	97.3	Very high	42 Å²	42	41.9 Å²	41.9	26%	0.258	24%	0.242	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-75.8	100.8	168.5	-58.4	0	0	0	0	108.7	Y212 I213 G214 P292 S296	Y212-T294 WeakPolarHBondContact O-CA 3.44Å; Y212-T294 VanDerWaalsContact O-CB 3.3Å; Y212-T294 WeakPolarHBondContact O-CB 3.31Å; Y212-T294 PolarHBondContact O-N 3.05Å; I213-T294 WeakPolarHBondContact CA-O 3.41Å; I213-T294 HydrophobicContact CG1-CG2 4.23Å; G214-T294 PolarHBondContact N-O 2.55Å; G214-T294 VanDerWaalsContact N-O 3.17Å; P292-T294 PolarHBondContact O-N 3.49Å; T294-S296 PolarHBondContact O-N 2.71Å
295	R	98	Very high	97	Very high	140 Å²	140	45.3 Å²	45.3	53%	0.528	26%	0.261	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-68.5	131.7	-176.7	-58.7	-178.5	-176.1	-155.2	-1	110.9	G214 P216 W239 L293	G214-R295 WeakPolarHBondContact O-CA 3.33Å; P216-R295 HydrophobicContact CG-CG 4.24Å; W239-R295 VanDerWaalsContact CD2-NH2 3.34Å; W239-R295 VanDerWaalsContact CZ3-NH2 3.32Å; L293-R295 PolarHBondContact O-N 3.03Å; L293-R295 VanDerWaalsContact O-N 3.17Å
296	S	97.8	Very high	96.8	Very high	11 Å²	11	45.3 Å²	45.3	8%	0.077	26%	0.261	C	S	.	.			trans	-131.1	128.8	174.8	-178.9	0	0	0	0	111	H201 G214 T294 L298	H201-S296 PolarHBondContact NE2-OG 3.43Å; G214-S296 PolarHBondContact O-N 3.21Å; T294-S296 PolarHBondContact O-N 2.71Å; S296-L298 PolarHBondContact O-N 2.87Å; S296-L298 PolarHBondContact OG-N 2.84Å
297	S	96.7	Very high	96.5	Very high	92 Å²	92	47.9 Å²	47.9	64%	0.643	27%	0.273	S	S	*	.	T	Hydrogen-bonded Turn	trans	-81.7	2.3	175.6	55.9	0	0	0	0	113.3	H300	S297-H300 PolarHBondContact O-CE1 2.68Å; S297-H300 PolarHBondContact O-NE2 3.08Å
298	L	98.3	Very high	96.2	Very high	41 Å²	41	53 Å²	53	22%	0.215	29%	0.292	C	S	.	.	T	Hydrogen-bonded Turn	trans	-88.7	-8	-179.3	-54.8	-179.1	0	0	0	113.1	S296 I318 T319	S296-L298 PolarHBondContact O-N 2.87Å; S296-L298 PolarHBondContact OG-N 2.84Å; L298-I318 HydrophobicContact CB-CB 4.1Å; L298-I318 HydrophobicContact CB-CD1 3.76Å; L298-I318 HydrophobicContact CB-CG1 3.76Å; L298-I318 HydrophobicContact CD1-CD1 3.76Å; L298-I318 HydrophobicContact CD1-CG1 4.09Å; L298-I318 HydrophobicContact CG-CD1 4.42Å; L298-I318 WeakPolarHBondContact O-CA 3.32Å; L298-I318 WeakPolarHBondContact O-CB 3.41Å; L298-I318 PolarHBondContact O-N 3.37Å; L298-T319 PolarHBondContact O-N 2.92Å; L298-T319 VanDerWaalsContact O-N 3.17Å
299	F	98.6	Very high	96	Very high	3 Å²	3	51.3 Å²	51.3	1%	0.013	28%	0.282	C	S	.	.			trans	-101.2	132.9	177.5	-66.5	-100.6	0	0	0	109.5	L198 I213 K215 A245 G246 I318 T319	L198-F299 HydrophobicContact CD1-CZ 4.4Å; I213-F299 HydrophobicContact CG2-CE2 4.05Å; K215-F299 HydrophobicContact CB-CB 4.18Å; K215-F299 WeakPolarHBondContact CD-O 3.43Å; A245-F299 HydrophobicContact CB-CB 4.25Å; G246-F299 VanDerWaalsContact O-CD1 3.29Å; G246-F299 WeakPolarHBondContact O-CD1 2.98Å; F299-I318 HydrophobicContact CD1-CG2 4.26Å; F299-I318 HydrophobicContact CD2-CD1 4.44Å; F299-I318 HydrophobicContact CE1-CG2 3.77Å; F299-I318 HydrophobicContact CE2-CB 4.5Å; F299-I318 HydrophobicContact CE2-CD1 3.74Å; F299-I318 HydrophobicContact CE2-CG2 4.37Å; F299-I318 HydrophobicContact CZ-CB 4.44Å; F299-I318 HydrophobicContact CZ-CD1 3.99Å; F299-I318 HydrophobicContact CZ-CG2 3.83Å; F299-T319 WeakPolarHBondContact CA-OG1 3.42Å; F299-T319 HydrophobicContact CD1-CG2 3.79Å; F299-T319 HydrophobicContact CE1-CG2 4.21Å
300	H	97.9	Very high	95.7	Very high	13 Å²	13	51.9 Å²	51.9	6%	0.06	29%	0.29	C	S	.	.			trans	-134.7	135.8	-174.6	-59.1	-85.2	0	0	0	113.8	K215 S297 E304 L306 Q317 T319 L320	K215-H300 PolarHBondContact NZ-ND1 3.39Å; S297-H300 PolarHBondContact O-CE1 2.68Å; S297-H300 PolarHBondContact O-NE2 3.08Å; H300-E304 WeakPolarHBondContact CA-OE1 3.35Å; H300-E304 VanDerWaalsContact CB-OE1 3.26Å; H300-E304 WeakPolarHBondContact CB-OE1 3.47Å; H300-E304 IonicContact CG-OE1 3.51Å; H300-E304 IonicContact ND1-OE1 3.76Å; H300-E304 PolarHBondContact ND1-OE1 3.13Å; H300-E304 VanDerWaalsContact ND1-OE1 3.16Å; H300-E304 IonicContact ND1-OE2 3.95Å; H300-L306 HydrophobicContact CB-CD2 3.88Å; H300-Q317 PolarHBondContact NE2-OE1 3.04Å; H300-T319 PolarHBondContact CD2-O 3.39Å; H300-T319 VanDerWaalsContact CD2-O 3.22Å; H300-T319 PolarHBondContact N-O 3.49Å; H300-T319 PolarHBondContact N-OG1 3.44Å; H300-L320 HydrophobicContact CB-CD2 4.42Å
301	S	96.4	Very high	95.3	Very high	5 Å²	5	55 Å²	55	4%	0.035	28%	0.283	C	S	.	.			trans	-112.2	157.1	179.5	176.9	0	0	0	0	111.2	L303 E304 L306	S301-L303 PolarHBondContact O-N 3.37Å; S301-L303 PolarHBondContact OG-N 3.08Å; S301-L303 VanDerWaalsContact OG-N 3.15Å; S301-E304 PolarHBondContact N-OE1 3.07Å; S301-E304 VanDerWaalsContact N-OE1 3.13Å; S301-E304 WeakPolarHBondContact O-CG 3.5Å; S301-E304 PolarHBondContact O-N 3.31Å; S301-L306 WeakPolarHBondContact O-CD2 3.26Å
302	H	94.1	Very high	95	Very high	37 Å²	37	58 Å²	58	17%	0.171	30%	0.304	C	S	.	.	T	Hydrogen-bonded Turn	trans	-73.5	2.1	168.6	64.9	-99.9	0	0	0	113.4	D190 E304 L306 S321 N330	D190-H302 IonicContact OD1-CE1 3.62Å; D190-H302 IonicContact OD1-ND1 3.76Å; D190-H302 IonicContact OD2-CE1 3.86Å; D190-H302 IonicContact OD2-ND1 4Å; H302-E304 VanDerWaalsContact C-N 3.32Å; H302-L306 HydrophobicContact CB-CD1 4.34Å; H302-S321 PolarHBondContact N-OG 3.25Å; H302-S321 PolarHBondContact ND1-OG 3.48Å; H302-S321 VanDerWaalsContact ND1-OG 3.08Å; H302-N330 VanDerWaalsContact C-ND2 3.34Å; H302-N330 PolarHBondContact O-ND2 3.39Å
303	L	91.4	Very high	94.8	Very high	98 Å²	98	56.8 Å²	56.8	51%	0.513	29%	0.291	S	S	.	.	T	Hydrogen-bonded Turn	trans	-86.1	-2.4	172.3	-59.2	-179.2	0	0	0	113.5	T242 S301 F325	T242-L303 HydrophobicContact CG2-CD1 4.27Å; S301-L303 PolarHBondContact O-N 3.37Å; S301-L303 PolarHBondContact OG-N 3.08Å; S301-L303 VanDerWaalsContact OG-N 3.15Å; L303-F325 WeakPolarHBondContact O-CE2 3.47Å
304	E	91.6	Very high	94.6	Very high	43 Å²	43	56.2 Å²	56.2	20%	0.201	29%	0.288	C	S	.	.	S	Bend	trans	-117.9	170.1	172.8	58.2	168.5	144.3	0	0	111.4	K215 H300 S301 H302 L306 N330	K215-E304 WeakPolarHBondContact CE-OE1 3.48Å; K215-E304 WeakPolarHBondContact CE-OE2 3.23Å; K215-E304 IonicContact NZ-OE1 3.72Å; K215-E304 PolarHBondContact NZ-OE1 2.96Å; K215-E304 IonicContact NZ-OE2 3.52Å; K215-E304 PolarHBondContact NZ-OE2 3.42Å; H300-E304 WeakPolarHBondContact CA-OE1 3.35Å; H300-E304 VanDerWaalsContact CB-OE1 3.26Å; H300-E304 WeakPolarHBondContact CB-OE1 3.47Å; H300-E304 IonicContact CG-OE1 3.51Å; H300-E304 IonicContact ND1-OE1 3.76Å; H300-E304 PolarHBondContact ND1-OE1 3.13Å; H300-E304 VanDerWaalsContact ND1-OE1 3.16Å; H300-E304 IonicContact ND1-OE2 3.95Å; S301-E304 PolarHBondContact N-OE1 3.07Å; S301-E304 VanDerWaalsContact N-OE1 3.13Å; S301-E304 WeakPolarHBondContact O-CG 3.5Å; S301-E304 PolarHBondContact O-N 3.31Å; H302-E304 VanDerWaalsContact C-N 3.32Å; E304-L306 HydrophobicContact CG-CD2 4.33Å; E304-L306 PolarHBondContact O-N 3.38Å; E304-N330 PolarHBondContact O-ND2 2.89Å
305	N	92.5	Very high	94.4	Very high	72 Å²	72	58.3 Å²	58.3	39%	0.385	30%	0.295	S	S	.	.			trans	-75.7	92.2	179.1	-172.4	-9	0	0	0	111.8	Q307 Q308	N305-Q307 PolarHBondContact O-N 3.15Å; N305-Q307 VanDerWaalsContact O-N 3.1Å; N305-Q307 WeakPolarHBondContact OD1-CB 3.23Å; N305-Q307 PolarHBondContact OD1-N 2.9Å; N305-Q308 HydrophobicContact CB-CG 4.04Å; N305-Q308 WeakPolarHBondContact O-CB 3.26Å; N305-Q308 PolarHBondContact O-N 3.4Å
306	L	94.4	Very high	94.4	Very high	0 Å²	0	56 Å²	56	0%	0	29%	0.288	C	S	.	.	G	3₁₀ helix	trans	-65	-15.2	-178.1	-67.7	173.8	0	0	0	113.7	H300 S301 H302 E304 Q308 V309 S321 N330 I331 I332	H300-L306 HydrophobicContact CB-CD2 3.88Å; S301-L306 WeakPolarHBondContact O-CD2 3.26Å; H302-L306 HydrophobicContact CB-CD1 4.34Å; E304-L306 HydrophobicContact CG-CD2 4.33Å; E304-L306 PolarHBondContact O-N 3.38Å; L306-Q308 PolarHBondContact O-N 3.45Å; L306-V309 HydrophobicContact CD2-CG2 4.48Å; L306-V309 PolarHBondContact O-N 3.15Å; L306-S321 WeakPolarHBondContact CD1-O 3.33Å; L306-N330 WeakPolarHBondContact CB-OD1 3.44Å; L306-N330 PolarHBondContact N-OD1 2.96Å; L306-I331 WeakPolarHBondContact CB-O 3.26Å; L306-I332 HydrophobicContact CB-CG2 4.45Å
307	Q	92.3	Very high	94.4	Very high	90 Å²	90	56.3 Å²	56.3	42%	0.421	29%	0.289	S	S	.	.	G	3₁₀ helix	trans	-70.8	-16.8	172.4	-61.1	-70.7	-51.7	0	0	112.6	N305 V309 I331 S333	N305-Q307 PolarHBondContact O-N 3.15Å; N305-Q307 VanDerWaalsContact O-N 3.1Å; N305-Q307 WeakPolarHBondContact OD1-CB 3.23Å; N305-Q307 PolarHBondContact OD1-N 2.9Å; Q307-V309 VanDerWaalsContact C-N 3.32Å; Q307-I331 PolarHBondContact NE2-O 2.69Å; Q307-S333 PolarHBondContact OE1-OG 3.22Å
308	Q	92.6	Very high	94.5	Very high	152 Å²	152	52 Å²	52	71%	0.71	26%	0.259	S	S	*	.	G	3₁₀ helix	trans	-79.4	-15.7	175.5	-65.1	-178.7	-19.4	0	0	112.9	N305 L306 S310	N305-Q308 HydrophobicContact CB-CG 4.04Å; N305-Q308 WeakPolarHBondContact O-CB 3.26Å; N305-Q308 PolarHBondContact O-N 3.4Å; L306-Q308 PolarHBondContact O-N 3.45Å; Q308-S310 PolarHBondContact O-N 3.1Å; Q308-S310 VanDerWaalsContact O-N 3.14Å
309	V	93.2	Very high	94.5	Very high	12 Å²	12	50.1 Å²	50.1	7%	0.073	25%	0.249	C	C	.	.	S	Bend	trans	-65	116.1	173.5	-177.4	0	0	0	0	108.5	L306 Q307 R311 I314 Q317 L320	L306-V309 HydrophobicContact CD2-CG2 4.48Å; L306-V309 PolarHBondContact O-N 3.15Å; Q307-V309 VanDerWaalsContact C-N 3.32Å; V309-R311 PolarHBondContact O-N 3.34Å; V309-I314 HydrophobicContact CG1-CG1 4.45Å; V309-Q317 HydrophobicContact CG1-CG 3.92Å; V309-L320 HydrophobicContact CG1-CD2 4.35Å
310	S	92.4	Very high	94.5	Very high	61 Å²	61	50.2 Å²	50.2	43%	0.427	25%	0.249	S	C	.	.			trans	-61.7	132.1	-176.6	177.7	0	0	0	0	111.2	Q308 S312 E313 I314	Q308-S310 PolarHBondContact O-N 3.1Å; Q308-S310 VanDerWaalsContact O-N 3.14Å; S310-S312 VanDerWaalsContact C-N 3.29Å; S310-S312 PolarHBondContact O-N 2.82Å; S310-S312 PolarHBondContact OG-OG 2.89Å; S310-E313 PolarHBondContact O-N 2.72Å; S310-I314 PolarHBondContact O-N 3Å
311	R	90.1	Very high	94.5	Very high	125 Å²	125	49.6 Å²	49.6	47%	0.472	25%	0.247	S	C	.	.	G	3₁₀ helix	trans	-56.5	-44.1	-179.4	-53.7	-161.8	172.6	141	1.3	112.4	V309 E313 I314 S333	V309-R311 PolarHBondContact O-N 3.34Å; R311-E313 PolarHBondContact O-N 3.41Å; R311-I314 PolarHBondContact O-N 3.37Å; R311-S333 WeakPolarHBondContact CD-O 3.5Å; R311-S333 WeakPolarHBondContact CG-O 3.08Å; R311-S333 PolarHBondContact NE-O 3.07Å; R311-S333 PolarHBondContact NH2-OG 3Å
312	S	91.1	Very high	94.6	Very high	76 Å²	76	51.2 Å²	51.2	53%	0.531	25%	0.252	S	S	.	.	G	3₁₀ helix	trans	-66.6	-19.3	179.6	65.3	0	0	0	0	112.5	S310 H315	S310-S312 VanDerWaalsContact C-N 3.29Å; S310-S312 PolarHBondContact O-N 2.82Å; S310-S312 PolarHBondContact OG-OG 2.89Å; S312-H315 PolarHBondContact O-CE1 3.38Å; S312-H315 PolarHBondContact O-ND1 3.19Å
313	E	93.6	Very high	94.6	Very high	66 Å²	66	50.3 Å²	50.3	31%	0.308	25%	0.253	S	S	.	.	G	3₁₀ helix	trans	-104	-0.9	-175.1	-57.7	-63.4	107.6	0	0	113	S310 R311 H315 K316 Q317	S310-E313 PolarHBondContact O-N 2.72Å; R311-E313 PolarHBondContact O-N 3.41Å; E313-H315 PolarHBondContact O-N 3.4Å; E313-H315 VanDerWaalsContact O-N 3.16Å; E313-K316 WeakPolarHBondContact O-CB 3.33Å; E313-K316 PolarHBondContact O-N 3.23Å; E313-K316 IonicContact OE1-NZ 2.59Å; E313-K316 PolarHBondContact OE1-NZ 2.95Å; E313-K316 WeakPolarHBondContact OE2-CD 3.45Å; E313-K316 WeakPolarHBondContact OE2-CE 3.28Å; E313-K316 IonicContact OE2-NZ 2.64Å; E313-K316 PolarHBondContact OE2-NZ 3.31Å; E313-Q317 PolarHBondContact O-N 3.14Å; E313-Q317 PolarHBondContact O-NE2 3.26Å
314	I	94.8	Very high	94.4	Very high	2 Å²	2	51.6 Å²	51.6	1%	0.01	26%	0.258	C	S	.	.	G	3₁₀ helix	trans	-51.6	-42.6	-179.9	-74.4	166.8	0	0	0	111.3	V309 S310 R311 K316 Q317 L320 I332 L334 V350 L353	V309-I314 HydrophobicContact CG1-CG1 4.45Å; S310-I314 PolarHBondContact O-N 3Å; R311-I314 PolarHBondContact O-N 3.37Å; I314-K316 PolarHBondContact O-N 3.21Å; I314-K316 VanDerWaalsContact O-N 3.15Å; I314-Q317 PolarHBondContact O-N 2.04Å; I314-Q317 VanDerWaalsContact O-N 3.13Å; I314-L320 HydrophobicContact CG2-CD1 4.11Å; I314-I332 HydrophobicContact CD1-CD1 3.99Å; I314-L334 HydrophobicContact CD1-CB 4.09Å; I314-L334 HydrophobicContact CD1-CD1 3.82Å; I314-L334 HydrophobicContact CD1-CG 4.36Å; I314-V350 HydrophobicContact CG2-CG1 4.38Å; I314-V350 HydrophobicContact CG2-CG2 4.3Å; I314-L353 HydrophobicContact CB-CD2 4.24Å; I314-L353 HydrophobicContact CG2-CD2 3.87Å
315	H	95.3	Very high	93.7	Very high	86 Å²	86	53.4 Å²	53.4	40%	0.398	27%	0.265	S	S	.	.	G	3₁₀ helix	trans	-67.1	-14.4	-179.2	69.6	-80.1	0	0	0	114.6	N194 T197 S312 E313 L354	N194-H315 PolarHBondContact ND2-O 3.1Å; T197-H315 PolarHBondContact OG1-O 2.85Å; S312-H315 PolarHBondContact O-CE1 3.38Å; S312-H315 PolarHBondContact O-ND1 3.19Å; E313-H315 PolarHBondContact O-N 3.4Å; E313-H315 VanDerWaalsContact O-N 3.16Å; H315-L354 HydrophobicContact CB-CD2 3.83Å
316	K	96.9	Very high	93.1	Very high	90 Å²	90	57 Å²	57	39%	0.391	28%	0.28	S	S	.	.	G	3₁₀ helix	trans	-98.6	-6.8	177.6	-64.5	162.7	176.1	173.8	0	113	T197 E313 I314	T197-K316 WeakPolarHBondContact CG2-O 3.37Å; E313-K316 WeakPolarHBondContact O-CB 3.33Å; E313-K316 PolarHBondContact O-N 3.23Å; E313-K316 IonicContact OE1-NZ 2.59Å; E313-K316 PolarHBondContact OE1-NZ 2.95Å; E313-K316 WeakPolarHBondContact OE2-CD 3.45Å; E313-K316 WeakPolarHBondContact OE2-CE 3.28Å; E313-K316 IonicContact OE2-NZ 2.64Å; E313-K316 PolarHBondContact OE2-NZ 3.31Å; I314-K316 PolarHBondContact O-N 3.21Å; I314-K316 VanDerWaalsContact O-N 3.15Å
317	Q	98.3	Very high	92.4	Very high	19 Å²	19	63.2 Å²	63.2	9%	0.089	31%	0.313	C	S	.	.			trans	-77.6	148.4	176.7	-50.4	-44.9	-54	0	0	110	N194 H300 V309 E313 I314 L320	N194-Q317 VanDerWaalsContact CB-O 3.24Å; N194-Q317 WeakPolarHBondContact CB-O 3.42Å; N194-Q317 PolarHBondContact ND2-O 3.23Å; H300-Q317 PolarHBondContact NE2-OE1 3.04Å; V309-Q317 HydrophobicContact CG1-CG 3.92Å; E313-Q317 PolarHBondContact O-N 3.14Å; E313-Q317 PolarHBondContact O-NE2 3.26Å; I314-Q317 PolarHBondContact O-N 2.04Å; I314-Q317 VanDerWaalsContact O-N 3.13Å; Q317-L320 HydrophobicContact CB-CD2 3.99Å; Q317-L320 HydrophobicContact CB-CG 4.43Å; Q317-L320 HydrophobicContact CG-CD2 4.15Å
318	I	98.8	Very high	92.2	Very high	1 Å²	1	66.1 Å²	66.1	1%	0.005	32%	0.324	C	S	.	.	S	Bend	trans	-87.2	-52.5	178.5	-70.2	173.8	0	0	0	109.8	V193 N194 T197 L198 H201 L298 F299	V193-I318 WeakPolarHBondContact CA-O 3.47Å; N194-I318 PolarHBondContact N-O 3.31Å; T197-I318 HydrophobicContact CG2-CG1 3.63Å; L198-I318 HydrophobicContact CB-CG2 4.03Å; L198-I318 HydrophobicContact CD1-CD1 4.47Å; L198-I318 HydrophobicContact CD1-CG2 3.67Å; L198-I318 HydrophobicContact CG-CG2 4.37Å; H201-I318 HydrophobicContact CB-CD1 3.64Å; H201-I318 WeakPolarHBondContact CD2-CD1 3.33Å; L298-I318 HydrophobicContact CB-CB 4.1Å; L298-I318 HydrophobicContact CB-CD1 3.76Å; L298-I318 HydrophobicContact CB-CG1 3.76Å; L298-I318 HydrophobicContact CD1-CD1 3.76Å; L298-I318 HydrophobicContact CD1-CG1 4.09Å; L298-I318 HydrophobicContact CG-CD1 4.42Å; L298-I318 WeakPolarHBondContact O-CA 3.32Å; L298-I318 WeakPolarHBondContact O-CB 3.41Å; L298-I318 PolarHBondContact O-N 3.37Å; F299-I318 HydrophobicContact CD1-CG2 4.26Å; F299-I318 HydrophobicContact CD2-CD1 4.44Å; F299-I318 HydrophobicContact CE1-CG2 3.77Å; F299-I318 HydrophobicContact CE2-CB 4.5Å; F299-I318 HydrophobicContact CE2-CD1 3.74Å; F299-I318 HydrophobicContact CE2-CG2 4.37Å; F299-I318 HydrophobicContact CZ-CB 4.44Å; F299-I318 HydrophobicContact CZ-CD1 3.99Å; F299-I318 HydrophobicContact CZ-CG2 3.83Å
319	T	98.8	Very high	92.1	Very high	2 Å²	2	62.5 Å²	62.5	1%	0.012	32%	0.315	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-121.7	147.3	175.3	64	0	0	0	0	111.1	V187 Y192 V193 A245 L298 F299 H300	V187-T319 HydrophobicContact CG1-CG2 4.2Å; Y192-T319 CarbonylContact O-C 3.57Å; Y192-T319 VanDerWaalsContact O-CA 3.23Å; Y192-T319 WeakPolarHBondContact O-CA 3.25Å; V193-T319 HydrophobicContact CG2-CG2 4.44Å; A245-T319 WeakPolarHBondContact O-CB 3.05Å; A245-T319 WeakPolarHBondContact O-CG2 3.39Å; A245-T319 PolarHBondContact O-OG1 2.9Å; L298-T319 PolarHBondContact O-N 2.92Å; L298-T319 VanDerWaalsContact O-N 3.17Å; F299-T319 WeakPolarHBondContact CA-OG1 3.42Å; F299-T319 HydrophobicContact CD1-CG2 3.79Å; F299-T319 HydrophobicContact CE1-CG2 4.21Å; H300-T319 PolarHBondContact CD2-O 3.39Å; H300-T319 VanDerWaalsContact CD2-O 3.22Å; H300-T319 PolarHBondContact N-O 3.49Å; H300-T319 PolarHBondContact N-OG1 3.44Å
320	L	98.5	Very high	92.2	Very high	5 Å²	5	62.3 Å²	62.3	3%	0.026	31%	0.314	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-127.1	163.3	165.4	-60.8	169.2	0	0	0	107.7	N191 Y192 H300 V309 I314 Q317 I332 F347 V350	N191-L320 CarbonylContact C-O 3.52Å; N191-L320 VanDerWaalsContact CA-O 3.23Å; N191-L320 WeakPolarHBondContact CA-O 3.38Å; N191-L320 PolarHBondContact ND2-O 3.32Å; Y192-L320 PolarHBondContact N-O 3.37Å; Y192-L320 PolarHBondContact O-N 2.89Å; H300-L320 HydrophobicContact CB-CD2 4.42Å; V309-L320 HydrophobicContact CG1-CD2 4.35Å; I314-L320 HydrophobicContact CG2-CD1 4.11Å; Q317-L320 HydrophobicContact CB-CD2 3.99Å; Q317-L320 HydrophobicContact CB-CG 4.43Å; Q317-L320 HydrophobicContact CG-CD2 4.15Å; L320-I332 HydrophobicContact CB-CG2 4.45Å; L320-I332 HydrophobicContact CD1-CD1 4.26Å; L320-I332 HydrophobicContact CD1-CG2 4.25Å; L320-I332 HydrophobicContact CD2-CG2 3.86Å; L320-I332 HydrophobicContact CG-CG2 4.41Å; L320-F347 HydrophobicContact CB-CE1 4.46Å; L320-V350 HydrophobicContact CD1-CG1 4.1Å; L320-V350 HydrophobicContact CD1-CG2 4.03Å
321	S	98	Very high	92.3	Very high	0 Å²	0	60.4 Å²	60.4	0%	0	30%	0.299	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-135.2	174	176.7	-171.1	0	0	0	0	110.2	D190 N191 H302 L306	D190-S321 WeakPolarHBondContact O-CA 3.03Å; D190-S321 PolarHBondContact O-OG 3.43Å; D190-S321 PolarHBondContact OD1-OG 2.86Å; N191-S321 WeakPolarHBondContact ND2-CB 3.45Å; H302-S321 PolarHBondContact N-OG 3.25Å; H302-S321 PolarHBondContact ND1-OG 3.48Å; H302-S321 VanDerWaalsContact ND1-OG 3.08Å; L306-S321 WeakPolarHBondContact CD1-O 3.33Å
322	Y	97.3	Very high	92.5	Very high	39 Å²	39	54.6 Å²	54.6	15%	0.153	28%	0.277	C	S	.	.			trans	-143.7	152.8	165.5	69.2	-82.5	0	0	0	109.3	L119 D190 N330 F347	L119-Y322 HydrophobicContact CD2-CE1 4.46Å; D190-Y322 HydrophobicContact CB-CD1 4.1Å; D190-Y322 HydrophobicContact CB-CE1 3.71Å; D190-Y322 WeakPolarHBondContact O-CD1 3.36Å; D190-Y322 PolarHBondContact O-N 3.19Å; Y322-N330 WeakPolarHBondContact CA-O 3.02Å; Y322-F347 HydrophobicContact CD1-CD1 4.45Å; Y322-F347 HydrophobicContact CD1-CD2 4.18Å; Y322-F347 AromaticContact CD1-CE1 3.91Å; Y322-F347 HydrophobicContact CD1-CE1 3.91Å; Y322-F347 AromaticContact CD1-CE2 3.6Å; Y322-F347 HydrophobicContact CD1-CE2 3.6Å; Y322-F347 AromaticContact CD1-CZ 3.46Å; Y322-F347 HydrophobicContact CD1-CZ 3.46Å; Y322-F347 VanDerWaalsContact CD1-CZ 3.46Å; Y322-F347 HydrophobicContact CE1-CD2 4.11Å; Y322-F347 AromaticContact CE1-CE2 3.63Å; Y322-F347 HydrophobicContact CE1-CE2 3.63Å; Y322-F347 AromaticContact CE1-CZ 3.99Å; Y322-F347 HydrophobicContact CE1-CZ 3.99Å
323	G	94.1	Very high	92.4	Very high	18 Å²	18	52 Å²	52	19%	0.186	26%	0.259	C	S	.	.	E	Extended strand (participates in β ladder)	trans	177.6	-154.6	177.8	0	0	0	0	0	112.6	N330	G323-N330 PolarHBondContact N-O 2.99Å; G323-N330 PolarHBondContact O-N 3.39Å
324	M	88.4	Confident	92.1	Very high	124 Å²	124	49.5 Å²	49.5	61%	0.611	25%	0.247	S	C	*	.	E	Extended strand (participates in β ladder)	trans	-114.1	130.9	174.9	-65.4	-72.5	-78.3	0	0	108.5	K328	M324-K328 CarbonylContact C-O 3.56Å; M324-K328 WeakPolarHBondContact CA-O 3.34Å
325	F	77.6	Confident	91.4	Very high	81 Å²	81	56.6 Å²	56.6	36%	0.355	28%	0.278	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-129.5	123.6	171.9	-170.7	-96.7	0	0	0	108.1	L303 N327 K328 N330	L303-F325 WeakPolarHBondContact O-CE2 3.47Å; F325-N327 VanDerWaalsContact C-N 3.28Å; F325-N327 PolarHBondContact O-N 3.46Å; F325-K328 PolarHBondContact N-O 3.02Å; F325-K328 PolarHBondContact O-N 3.23Å; F325-N330 HydrophobicContact CB-CB 3.64Å
326	E	78.5	Confident	90.5	Very high	149 Å²	149	53.7 Å²	53.7	70%	0.696	27%	0.271	S	S	*	.	T	Hydrogen-bonded Turn	trans	50.6	43.8	-176.5	-60.8	-179.9	166.5	0	0	113.8	K328	E326-K328 PolarHBondContact O-N 3.35Å; E326-K328 VanDerWaalsContact O-N 3.15Å
327	N	80.7	Confident	89.9	Confident	130 Å²	130	50.2 Å²	50.2	70%	0.695	26%	0.26	S	S	*	.	T	Hydrogen-bonded Turn	trans	61.2	14.2	-176.3	-59.8	-39.1	0	0	0	115.5	F325	F325-N327 VanDerWaalsContact C-N 3.28Å; F325-N327 PolarHBondContact O-N 3.46Å
328	K	87	Confident	89.7	Confident	151 Å²	151	50.8 Å²	50.8	66%	0.657	26%	0.262	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-112.3	148.1	172.9	-66	176.2	-176.7	169.6	0	110	M324 F325 E326 N330	M324-K328 CarbonylContact C-O 3.56Å; M324-K328 WeakPolarHBondContact CA-O 3.34Å; F325-K328 PolarHBondContact N-O 3.02Å; F325-K328 PolarHBondContact O-N 3.23Å; E326-K328 PolarHBondContact O-N 3.35Å; E326-K328 VanDerWaalsContact O-N 3.15Å; K328-N330 PolarHBondContact O-N 3.21Å
329	S	90.1	Very high	89.4	Confident	75 Å²	75	53.8 Å²	53.8	52%	0.524	28%	0.281	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-59.1	122.7	170.4	-180	0	0	0	0	109	I331	S329-I331 WeakPolarHBondContact OG-CG2 3.01Å
330	N	95.4	Very high	89	Confident	9 Å²	9	57 Å²	57	5%	0.048	30%	0.301	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-109.1	105.5	175.8	-172.1	20.8	0	0	0	108.5	H302 E304 L306 Y322 G323 F325 K328	H302-N330 VanDerWaalsContact C-ND2 3.34Å; H302-N330 PolarHBondContact O-ND2 3.39Å; E304-N330 PolarHBondContact O-ND2 2.89Å; L306-N330 WeakPolarHBondContact CB-OD1 3.44Å; L306-N330 PolarHBondContact N-OD1 2.96Å; Y322-N330 WeakPolarHBondContact CA-O 3.02Å; G323-N330 PolarHBondContact N-O 2.99Å; G323-N330 PolarHBondContact O-N 3.39Å; F325-N330 HydrophobicContact CB-CB 3.64Å; K328-N330 PolarHBondContact O-N 3.21Å
331	I	94.5	Very high	88.8	Confident	21 Å²	21	64.5 Å²	64.5	11%	0.108	34%	0.336	C	S	.	.			trans	-138.7	165.2	-174.1	55.3	173.9	0	0	0	108.5	L306 Q307 S329 P344 R346	L306-I331 WeakPolarHBondContact CB-O 3.26Å; Q307-I331 PolarHBondContact NE2-O 2.69Å; S329-I331 WeakPolarHBondContact OG-CG2 3.01Å; I331-P344 WeakPolarHBondContact CG2-O 3.45Å; I331-R346 HydrophobicContact CB-CG 4.17Å; I331-R346 HydrophobicContact CD1-CG 3.86Å; I331-R346 HydrophobicContact CG1-CG 4.41Å
332	I	94.1	Very high	88.6	Confident	3 Å²	3	70.3 Å²	70.3	2%	0.015	36%	0.363	C	S	.	.			trans	-68.3	150.9	171.3	58.5	157	0	0	0	111.7	L306 I314 L320 L334 R346 V350	L306-I332 HydrophobicContact CB-CG2 4.45Å; I314-I332 HydrophobicContact CD1-CD1 3.99Å; L320-I332 HydrophobicContact CB-CG2 4.45Å; L320-I332 HydrophobicContact CD1-CD1 4.26Å; L320-I332 HydrophobicContact CD1-CG2 4.25Å; L320-I332 HydrophobicContact CD2-CG2 3.86Å; L320-I332 HydrophobicContact CG-CG2 4.41Å; I332-L334 HydrophobicContact CD1-CB 3.86Å; I332-L334 HydrophobicContact CD1-CD2 4.16Å; I332-L334 HydrophobicContact CG1-CB 4.38Å; I332-L334 PolarHBondContact O-N 2.73Å; I332-L334 VanDerWaalsContact O-N 3.14Å; I332-R346 HydrophobicContact CD1-CB 4.14Å; I332-R346 HydrophobicContact CG1-CB 3.75Å; I332-R346 HydrophobicContact CG1-CG 4.19Å; I332-V350 HydrophobicContact CD1-CG2 3.15Å; I332-V350 HydrophobicContact CG1-CG2 4.37Å
333	S	90.3	Very high	88.5	Confident	21 Å²	21	68.5 Å²	68.5	15%	0.147	36%	0.356	C	S	.	.			trans	-84.8	79.7	176.8	-153.2	0	0	0	0	111.3	Q307 R311	Q307-S333 PolarHBondContact OE1-OG 3.22Å; R311-S333 WeakPolarHBondContact CD-O 3.5Å; R311-S333 WeakPolarHBondContact CG-O 3.08Å; R311-S333 PolarHBondContact NE-O 3.07Å; R311-S333 PolarHBondContact NH2-OG 3Å
334	L	86.6	Confident	88.5	Confident	13 Å²	13	71.5 Å²	71.5	7%	0.068	37%	0.372	C	S	.	.			trans	-119.9	125.3	178.8	-175.6	63.3	0	0	0	111.1	I314 I332 G336 V350 F367	I314-L334 HydrophobicContact CD1-CB 4.09Å; I314-L334 HydrophobicContact CD1-CD1 3.82Å; I314-L334 HydrophobicContact CD1-CG 4.36Å; I332-L334 HydrophobicContact CD1-CB 3.86Å; I332-L334 HydrophobicContact CD1-CD2 4.16Å; I332-L334 HydrophobicContact CG1-CB 4.38Å; I332-L334 PolarHBondContact O-N 2.73Å; I332-L334 VanDerWaalsContact O-N 3.14Å; L334-G336 VanDerWaalsContact C-N 3.3Å; L334-G336 PolarHBondContact O-N 3.46Å; L334-V350 HydrophobicContact CD2-CG2 4.03Å; L334-F367 HydrophobicContact CD1-CD1 4.25Å; L334-F367 HydrophobicContact CD2-CD1 4.38Å
335	K	81.4	Confident	88.9	Confident	152 Å²	152	65.8 Å²	65.8	66%	0.661	34%	0.344	S	S	*	.			trans	-73	95.6	163.6	-75.3	-170.9	177.6	-175.5	0	106
336	G	75.8	Confident	89.8	Confident	24 Å²	24	62.4 Å²	62.4	25%	0.247	33%	0.329	C	S	.	.			trans	-88.9	173.2	-164.3	0	0	0	0	0	114	L334 F338 S349	L334-G336 VanDerWaalsContact C-N 3.3Å; L334-G336 PolarHBondContact O-N 3.46Å; G336-F338 PolarHBondContact O-N 3Å; G336-S349 VanDerWaalsContact CA-CB 3.47Å; G336-S349 VanDerWaalsContact CA-OG 3.29Å; G336-S349 WeakPolarHBondContact CA-OG 3.25Å
337	A	84.1	Confident	90.7	Very high	18 Å²	18	55.3 Å²	55.3	15%	0.149	30%	0.296	C	S	.	.	S	Bend	trans	-63.3	-22.6	169.4	0	0	0	0	0	112.8	S349 C352 P362 V365 F367	A337-S349 PolarHBondContact N-OG 3.47Å; A337-C352 HydrophobicContact CB-CB 4.13Å; A337-P362 HydrophobicContact CB-CG 4.13Å; A337-V365 HydrophobicContact CB-CB 4.35Å; A337-V365 HydrophobicContact CB-CG1 3.88Å; A337-V365 HydrophobicContact CB-CG2 3.66Å; A337-F367 HydrophobicContact CB-CE1 4.23Å; A337-F367 HydrophobicContact CB-CZ 4.18Å
338	F	92.8	Very high	91.5	Very high	31 Å²	31	51.8 Å²	51.8	14%	0.136	28%	0.275	C	S	.	.	S	Bend	trans	-126.6	147.5	-174.1	-59.9	-84.5	0	0	0	111.6	G336 E342 D343 R346 K348 W360 P362	G336-F338 PolarHBondContact O-N 3Å; F338-E342 HydrophobicContact CB-CB 4.42Å; F338-D343 HydrophobicContact CB-CB 3.71Å; F338-D343 HydrophobicContact CG-CB 4.34Å; F338-R346 PolarHBondContact O-NH1 3.28Å; F338-R346 PolarHBondContact O-NH2 3.02Å; F338-K348 HydrophobicContact CD2-CB 3.71Å; F338-K348 HydrophobicContact CE2-CB 3.74Å; F338-W360 HydrophobicContact CE2-CE3 4.31Å; F338-W360 AromaticContact CE2-CZ3 3.91Å; F338-W360 HydrophobicContact CE2-CZ3 3.91Å; F338-W360 AromaticContact CZ-CE3 3.94Å; F338-W360 HydrophobicContact CZ-CE3 3.94Å; F338-W360 HydrophobicContact CZ-CZ3 4.01Å; F338-P362 HydrophobicContact CE1-CG 4.06Å; F338-P362 HydrophobicContact CE2-CG 4.5Å; F338-P362 HydrophobicContact CZ-CG 3.98Å
339	P	92.4	Very high	92	Very high	64 Å²	64	44.6 Å²	44.6	42%	0.416	24%	0.243	S	C	.	.			trans	-62.6	157.7	170	29.5	-35	0	0	0	111.2	E341 E342 D343 R346	P339-E341 WeakPolarHBondContact CB-OE2 3.36Å; P339-E341 PolarHBondContact O-N 3.37Å; P339-E342 HydrophobicContact CG-CB 4.08Å; P339-E342 HydrophobicContact CG-CG 3.86Å; P339-E342 PolarHBondContact O-N 3.09Å; P339-E342 VanDerWaalsContact O-N 3.14Å; P339-D343 PolarHBondContact O-N 3.22Å; P339-R346 PolarHBondContact O-NH2 3.14Å
340	V	91.8	Very high	92.3	Very high	70 Å²	70	41.1 Å²	41.1	42%	0.424	22%	0.219	S	C	.	.	T	Hydrogen-bonded Turn	trans	-60	-33.6	-173.5	176.2	0	0	0	0	111.8	E342 D343 P344	V340-E342 VanDerWaalsContact C-N 3.3Å; V340-E342 PolarHBondContact O-N 2.98Å; V340-D343 CarbonylContact O-C 3.59Å; V340-D343 PolarHBondContact O-N 3.42Å; V340-P344 WeakPolarHBondContact O-CA 3.46Å
341	E	93	Very high	92.4	Very high	161 Å²	161	40.7 Å²	40.7	75%	0.752	22%	0.216	S	C	*	.	T	Hydrogen-bonded Turn	trans	-64.3	-33.3	-179.8	-60.7	70.9	-156.1	0	0	112.3	P339	P339-E341 WeakPolarHBondContact CB-OE2 3.36Å; P339-E341 PolarHBondContact O-N 3.37Å
342	E	94.1	Very high	92.5	Very high	122 Å²	122	39.8 Å²	39.8	57%	0.57	21%	0.212	S	C	*	.	T	Hydrogen-bonded Turn	trans	-92.4	-21.4	-178.9	-70.3	179.4	-157.1	0	0	113.8	F338 P339 V340	F338-E342 HydrophobicContact CB-CB 4.42Å; P339-E342 HydrophobicContact CG-CB 4.08Å; P339-E342 HydrophobicContact CG-CG 3.86Å; P339-E342 PolarHBondContact O-N 3.09Å; P339-E342 VanDerWaalsContact O-N 3.14Å; V340-E342 VanDerWaalsContact C-N 3.3Å; V340-E342 PolarHBondContact O-N 2.98Å
343	D	95.9	Very high	92.5	Very high	2 Å²	2	42 Å²	42	1%	0.011	22%	0.224	C	C	.	.			trans	-139.8	62.2	-178.2	170.9	36.3	0	0	0	110.5	F338 P339 V340 S345 R346 F347 K348 S349	F338-D343 HydrophobicContact CB-CB 3.71Å; F338-D343 HydrophobicContact CG-CB 4.34Å; P339-D343 PolarHBondContact O-N 3.22Å; V340-D343 CarbonylContact O-C 3.59Å; V340-D343 PolarHBondContact O-N 3.42Å; D343-S345 PolarHBondContact O-N 3.38Å; D343-R346 VanDerWaalsContact C-NH2 3.26Å; D343-R346 VanDerWaalsContact CG-CA 3.47Å; D343-R346 PolarHBondContact O-N 3.3Å; D343-R346 PolarHBondContact O-NE 3.31Å; D343-R346 PolarHBondContact O-NH2 3.37Å; D343-R346 VanDerWaalsContact OD1-C 3.23Å; D343-R346 VanDerWaalsContact OD1-CA 3.31Å; D343-R346 WeakPolarHBondContact OD1-CA 3.31Å; D343-R346 PolarHBondContact OD1-N 3.42Å; D343-R346 VanDerWaalsContact OD2-C 3.27Å; D343-R346 VanDerWaalsContact OD2-CA 3.23Å; D343-R346 WeakPolarHBondContact OD2-CA 3.17Å; D343-R346 IonicContact OD2-CZ 3.88Å; D343-R346 IonicContact OD2-NE 3.94Å; D343-R346 IonicContact OD2-NH2 2.69Å; D343-F347 PolarHBondContact OD1-N 2.96Å; D343-K348 HydrophobicContact CB-CB 4.15Å; D343-K348 HydrophobicContact CB-CD 4.35Å; D343-K348 HydrophobicContact CB-CG 4.48Å; D343-K348 PolarHBondContact OD1-N 3.17Å; D343-K348 PolarHBondContact OD2-N 2.74Å; D343-S349 VanDerWaalsContact OD2-CB 3.26Å; D343-S349 WeakPolarHBondContact OD2-CB 2.99Å; D343-S349 PolarHBondContact OD2-N 2.8Å; D343-S349 PolarHBondContact OD2-OG 3.23Å
344	P	95	Very high	92.8	Very high	80 Å²	80	42.2 Å²	42.2	52%	0.519	22%	0.223	S	C	.	.	T	Hydrogen-bonded Turn	trans	-61.5	-23	-169.9	22.9	-34.6	0	0	0	113.9	I331 V340	I331-P344 WeakPolarHBondContact CG2-O 3.45Å; V340-P344 WeakPolarHBondContact O-CA 3.46Å
345	S	96.2	Very high	93.2	Very high	4 Å²	4	41.9 Å²	41.9	3%	0.028	22%	0.221	C	C	.	.	T	Hydrogen-bonded Turn	trans	-83.8	-15.3	173.9	60.5	0	0	0	0	114.3	L119 D343 F347	L119-S345 VanDerWaalsContact CD2-OG 3.27Å; L119-S345 WeakPolarHBondContact CD2-OG 3.23Å; D343-S345 PolarHBondContact O-N 3.38Å; S345-F347 PolarHBondContact O-N 3.1Å; S345-F347 WeakPolarHBondContact OG-CB 3.41Å; S345-F347 PolarHBondContact OG-N 2.65Å
346	R	96.4	Very high	93.8	Very high	10 Å²	10	39.3 Å²	39.3	4%	0.038	22%	0.22	C	C	.	.	S	Bend	trans	68	4.8	-168.3	-49.6	-74	75.9	-165.6	-4.8	114.5	I331 I332 F338 P339 D343 K348 S349 V350	I331-R346 HydrophobicContact CB-CG 4.17Å; I331-R346 HydrophobicContact CD1-CG 3.86Å; I331-R346 HydrophobicContact CG1-CG 4.41Å; I332-R346 HydrophobicContact CD1-CB 4.14Å; I332-R346 HydrophobicContact CG1-CB 3.75Å; I332-R346 HydrophobicContact CG1-CG 4.19Å; F338-R346 PolarHBondContact O-NH1 3.28Å; F338-R346 PolarHBondContact O-NH2 3.02Å; P339-R346 PolarHBondContact O-NH2 3.14Å; D343-R346 VanDerWaalsContact C-NH2 3.26Å; D343-R346 VanDerWaalsContact CG-CA 3.47Å; D343-R346 PolarHBondContact O-N 3.3Å; D343-R346 PolarHBondContact O-NE 3.31Å; D343-R346 PolarHBondContact O-NH2 3.37Å; D343-R346 VanDerWaalsContact OD1-C 3.23Å; D343-R346 VanDerWaalsContact OD1-CA 3.31Å; D343-R346 WeakPolarHBondContact OD1-CA 3.31Å; D343-R346 PolarHBondContact OD1-N 3.42Å; D343-R346 VanDerWaalsContact OD2-C 3.27Å; D343-R346 VanDerWaalsContact OD2-CA 3.23Å; D343-R346 WeakPolarHBondContact OD2-CA 3.17Å; D343-R346 IonicContact OD2-CZ 3.88Å; D343-R346 IonicContact OD2-NE 3.94Å; D343-R346 IonicContact OD2-NH2 2.69Å; R346-K348 PolarHBondContact O-N 2.66Å; R346-S349 WeakPolarHBondContact O-CB 3.37Å; R346-S349 PolarHBondContact O-N 2.8Å; R346-V350 WeakPolarHBondContact O-CG2 3.43Å; R346-V350 PolarHBondContact O-N 3.2Å
347	F	97.8	Very high	94.7	Very high	1 Å²	1	43 Å²	43	0%	0.004	23%	0.234	C	C	.	.	H	α-helix	trans	-68.2	-33.4	-175.9	-77.5	7.6	0	0	0	113.2	L119 L120 D190 N191 Y192 L320 Y322 D343 S345 S349 V350 H351	L119-F347 HydrophobicContact CD1-CB 4.32Å; L119-F347 HydrophobicContact CD2-CB 4.1Å; L119-F347 HydrophobicContact CD2-CD2 3.95Å; L119-F347 HydrophobicContact CD2-CG 4.36Å; L119-F347 HydrophobicContact CG-CB 4.36Å; L119-F347 HydrophobicContact CG-CD2 4.45Å; L120-F347 HydrophobicContact CD2-CD2 3.81Å; L120-F347 HydrophobicContact CD2-CE2 3.8Å; D190-F347 VanDerWaalsContact O-CZ 3.28Å; D190-F347 WeakPolarHBondContact O-CZ 3.38Å; N191-F347 VanDerWaalsContact C-CE2 3.43Å; Y192-F347 VanDerWaalsContact CB-CZ 3.48Å; Y192-F347 HydrophobicContact CD2-CB 3.89Å; Y192-F347 HydrophobicContact CD2-CD1 4.21Å; Y192-F347 HydrophobicContact CD2-CD2 4.02Å; Y192-F347 AromaticContact CD2-CG 3.8Å; Y192-F347 HydrophobicContact CD2-CG 3.8Å; Y192-F347 HydrophobicContact CG-CD1 4.43Å; Y192-F347 HydrophobicContact CG-CG 4.38Å; L320-F347 HydrophobicContact CB-CE1 4.46Å; Y322-F347 HydrophobicContact CD1-CD1 4.45Å; Y322-F347 HydrophobicContact CD1-CD2 4.18Å; Y322-F347 AromaticContact CD1-CE1 3.91Å; Y322-F347 HydrophobicContact CD1-CE1 3.91Å; Y322-F347 AromaticContact CD1-CE2 3.6Å; Y322-F347 HydrophobicContact CD1-CE2 3.6Å; Y322-F347 AromaticContact CD1-CZ 3.46Å; Y322-F347 HydrophobicContact CD1-CZ 3.46Å; Y322-F347 VanDerWaalsContact CD1-CZ 3.46Å; Y322-F347 HydrophobicContact CE1-CD2 4.11Å; Y322-F347 AromaticContact CE1-CE2 3.63Å; Y322-F347 HydrophobicContact CE1-CE2 3.63Å; Y322-F347 AromaticContact CE1-CZ 3.99Å; Y322-F347 HydrophobicContact CE1-CZ 3.99Å; D343-F347 PolarHBondContact OD1-N 2.96Å; S345-F347 PolarHBondContact O-N 3.1Å; S345-F347 WeakPolarHBondContact OG-CB 3.41Å; S345-F347 PolarHBondContact OG-N 2.65Å; F347-S349 VanDerWaalsContact C-N 3.33Å; F347-V350 PolarHBondContact O-N 3.21Å; F347-H351 VanDerWaalsContact O-CB 3.26Å; F347-H351 WeakPolarHBondContact O-CB 3.5Å; F347-H351 PolarHBondContact O-N 3.06Å
348	K	97.4	Very high	95.3	Very high	56 Å²	56	42.6 Å²	42.6	24%	0.243	23%	0.23	C	C	.	.	H	α-helix	trans	-65.8	-42	174	-64.1	-177.8	175.4	176.1	0	110.3	L119 T123 F338 D343 R346 H351 C352 W360	L119-K348 HydrophobicContact CD1-CG 3.86Å; T123-K348 HydrophobicContact CG2-CG 4.28Å; F338-K348 HydrophobicContact CD2-CB 3.71Å; F338-K348 HydrophobicContact CE2-CB 3.74Å; D343-K348 HydrophobicContact CB-CB 4.15Å; D343-K348 HydrophobicContact CB-CD 4.35Å; D343-K348 HydrophobicContact CB-CG 4.48Å; D343-K348 PolarHBondContact OD1-N 3.17Å; D343-K348 PolarHBondContact OD2-N 2.74Å; R346-K348 PolarHBondContact O-N 2.66Å; K348-H351 WeakPolarHBondContact O-CB 3.16Å; K348-H351 PolarHBondContact O-N 2.85Å; K348-C352 PolarHBondContact O-N 2.72Å; K348-C352 PolarHBondContact O-SG 3.27Å; K348-C352 VanDerWaalsContact O-SG 3.37Å; K348-W360 HydrophobicContact CB-CH2 4.26Å; K348-W360 HydrophobicContact CB-CZ3 4.04Å; K348-W360 HydrophobicContact CG-CH2 4.41Å; K348-W360 HydrophobicContact CG-CZ3 4.39Å
349	S	96.7	Very high	95.4	Very high	0 Å²	0	47.5 Å²	47.5	0%	0	26%	0.264	C	S	.	.	H	α-helix	trans	-63.4	-44.9	176.3	-60.4	0	0	0	0	112.4	G336 A337 D343 R346 F347 H351 C352 L353 F367	G336-S349 VanDerWaalsContact CA-CB 3.47Å; G336-S349 VanDerWaalsContact CA-OG 3.29Å; G336-S349 WeakPolarHBondContact CA-OG 3.25Å; A337-S349 PolarHBondContact N-OG 3.47Å; D343-S349 VanDerWaalsContact OD2-CB 3.26Å; D343-S349 WeakPolarHBondContact OD2-CB 2.99Å; D343-S349 PolarHBondContact OD2-N 2.8Å; D343-S349 PolarHBondContact OD2-OG 3.23Å; R346-S349 WeakPolarHBondContact O-CB 3.37Å; R346-S349 PolarHBondContact O-N 2.8Å; F347-S349 VanDerWaalsContact C-N 3.33Å; S349-H351 VanDerWaalsContact C-N 3.28Å; S349-H351 PolarHBondContact O-N 2.68Å; S349-C352 PolarHBondContact O-N 3.21Å; S349-L353 PolarHBondContact O-N 3.49Å; S349-F367 VanDerWaalsContact O-CE1 3.25Å; S349-F367 WeakPolarHBondContact O-CE1 3.36Å
350	V	96.8	Very high	95.6	Very high	1 Å²	1	49.3 Å²	49.3	1%	0.006	26%	0.263	C	S	.	.	H	α-helix	trans	-59.2	-42.8	172	173.2	0	0	0	0	110.8	Y192 I314 L320 I332 L334 R346 F347 C352 L353 L354	Y192-V350 HydrophobicContact CD1-CG1 3.99Å; Y192-V350 HydrophobicContact CD2-CG1 4.45Å; Y192-V350 HydrophobicContact CE1-CG1 3.79Å; Y192-V350 HydrophobicContact CE2-CB 4.48Å; Y192-V350 HydrophobicContact CE2-CG1 4.22Å; Y192-V350 HydrophobicContact CG-CG1 4.34Å; I314-V350 HydrophobicContact CG2-CG1 4.38Å; I314-V350 HydrophobicContact CG2-CG2 4.3Å; L320-V350 HydrophobicContact CD1-CG1 4.1Å; L320-V350 HydrophobicContact CD1-CG2 4.03Å; I332-V350 HydrophobicContact CD1-CG2 3.15Å; I332-V350 HydrophobicContact CG1-CG2 4.37Å; L334-V350 HydrophobicContact CD2-CG2 4.03Å; R346-V350 WeakPolarHBondContact O-CG2 3.43Å; R346-V350 PolarHBondContact O-N 3.2Å; F347-V350 PolarHBondContact O-N 3.21Å; V350-C352 PolarHBondContact O-N 3.43Å; V350-L353 WeakPolarHBondContact O-CB 3.45Å; V350-L353 PolarHBondContact O-N 2.86Å; V350-L354 HydrophobicContact CG1-CD1 3.97Å; V350-L354 HydrophobicContact CG1-CG 4.44Å; V350-L354 WeakPolarHBondContact O-CG 3.27Å; V350-L354 PolarHBondContact O-N 3.46Å
351	H	97.6	Very high	95.8	Very high	0 Å²	0	46.7 Å²	46.7	0%	0	25%	0.248	C	C	.	.	H	α-helix	trans	-62.5	-44.7	179.8	-169.3	84.5	0	0	0	112.1	T123 Y192 F347 K348 S349 L353 L354 Y355 T358 W360	T123-H351 VanDerWaalsContact C-CE1 3.41Å; T123-H351 VanDerWaalsContact C-ND1 3.33Å; T123-H351 HydrophobicContact CG2-CB 4.04Å; T123-H351 PolarHBondContact O-CE1 3.47Å; Y192-H351 HydrophobicContact CE2-CB 3.96Å; Y192-H351 VanDerWaalsContact OH-CA 3.26Å; Y192-H351 WeakPolarHBondContact OH-CA 3.4Å; Y192-H351 WeakPolarHBondContact OH-CB 3.32Å; Y192-H351 PolarHBondContact OH-ND1 3.37Å; F347-H351 VanDerWaalsContact O-CB 3.26Å; F347-H351 WeakPolarHBondContact O-CB 3.5Å; F347-H351 PolarHBondContact O-N 3.06Å; K348-H351 WeakPolarHBondContact O-CB 3.16Å; K348-H351 PolarHBondContact O-N 2.85Å; S349-H351 VanDerWaalsContact C-N 3.28Å; S349-H351 PolarHBondContact O-N 2.68Å; H351-L353 VanDerWaalsContact C-N 3.29Å; H351-L353 PolarHBondContact O-N 3.19Å; H351-L354 PolarHBondContact O-N 2.84Å; H351-Y355 AromaticContact CE1-CD2 3.52Å; H351-Y355 AromaticContact ND1-CD2 3.65Å; H351-Y355 AromaticContact NE2-CD2 3.99Å; H351-Y355 WeakPolarHBondContact O-CA 3.15Å; H351-Y355 PolarHBondContact O-N 2.87Å; H351-T358 PolarHBondContact NE2-OG1 2.94Å; H351-T358 VanDerWaalsContact NE2-OG1 3.11Å; H351-W360 HydrophobicContact CB-CH2 4.14Å; H351-W360 AromaticContact CD2-CH2 3.56Å; H351-W360 AromaticContact CD2-CZ2 3.54Å
352	C	96.5	Very high	95.7	Very high	2 Å²	2	41.3 Å²	41.3	1%	0.014	23%	0.227	C	C	.	.	H	α-helix	trans	-67.7	-28.7	176.6	-64.5	0	0	0	0	113.3	A337 K348 S349 V350 P356 W360 C361 F367	A337-C352 HydrophobicContact CB-CB 4.13Å; K348-C352 PolarHBondContact O-N 2.72Å; K348-C352 PolarHBondContact O-SG 3.27Å; K348-C352 VanDerWaalsContact O-SG 3.37Å; S349-C352 PolarHBondContact O-N 3.21Å; V350-C352 PolarHBondContact O-N 3.43Å; C352-P356 WeakPolarHBondContact O-CA 3.34Å; C352-W360 WeakPolarHBondContact SG-CZ3 3.37Å; C352-C361 WeakPolarHBondContact CA-SG 3.48Å; C352-C361 HydrophobicContact CB-CB 3.77Å; C352-C361 WeakPolarHBondContact CB-SG 3.31Å; C352-C361 VanDerWaalsContact SG-CA 3.51Å; C352-C361 WeakPolarHBondContact SG-CB 3.15Å; C352-C361 CovalentContact SG-SG 2.04Å; C352-C361 PolarHBondContact SG-SG 3.41Å; C352-F367 HydrophobicContact CB-CZ 3.74Å
353	L	94.8	Very high	95.2	Very high	50 Å²	50	41 Å²	41	26%	0.262	24%	0.236	S	C	.	.	H	α-helix	trans	-65	-42.5	170.7	171.2	62.5	0	0	0	111.5	I314 S349 V350 H351 F367	I314-L353 HydrophobicContact CB-CD2 4.24Å; I314-L353 HydrophobicContact CG2-CD2 3.87Å; S349-L353 PolarHBondContact O-N 3.49Å; V350-L353 WeakPolarHBondContact O-CB 3.45Å; V350-L353 PolarHBondContact O-N 2.86Å; H351-L353 VanDerWaalsContact C-N 3.29Å; H351-L353 PolarHBondContact O-N 3.19Å; L353-F367 HydrophobicContact CB-CD1 3.91Å; L353-F367 HydrophobicContact CB-CD2 4.2Å; L353-F367 HydrophobicContact CB-CE1 3.9Å; L353-F367 HydrophobicContact CB-CE2 4.19Å; L353-F367 HydrophobicContact CB-CG 4.06Å; L353-F367 HydrophobicContact CB-CZ 4.04Å; L353-F367 HydrophobicContact CD1-CB 3.75Å; L353-F367 HydrophobicContact CD1-CD1 4.4Å; L353-F367 HydrophobicContact CD1-CD2 3.83Å; L353-F367 HydrophobicContact CD1-CG 3.75Å; L353-F367 HydrophobicContact CG-CG 4.4Å; L353-F367 VanDerWaalsContact N-CZ 3.34Å
354	L	95.6	Very high	94	Very high	26 Å²	26	50.5 Å²	50.5	14%	0.136	28%	0.28	C	S	.	.	H	α-helix	trans	-82.8	-30.9	-176.8	-67.5	178.4	0	0	0	113.8	Y192 N194 H315 V350 H351	Y192-L354 HydrophobicContact CE1-CD1 3.68Å; N194-L354 HydrophobicContact CB-CD1 4.18Å; H315-L354 HydrophobicContact CB-CD2 3.83Å; V350-L354 HydrophobicContact CG1-CD1 3.97Å; V350-L354 HydrophobicContact CG1-CG 4.44Å; V350-L354 WeakPolarHBondContact O-CG 3.27Å; V350-L354 PolarHBondContact O-N 3.46Å; H351-L354 PolarHBondContact O-N 2.84Å
355	Y	95.8	Very high	93	Very high	5 Å²	5	48.6 Å²	48.6	2%	0.02	27%	0.267	C	S	.	.			trans	-136.4	69.2	-174.3	-54.3	-74.3	0	0	0	109.7	R127 H351 D357 T358	R127-Y355 HydrophobicContact CG-CD1 4.44Å; R127-Y355 HydrophobicContact CG-CD2 4.34Å; R127-Y355 HydrophobicContact CG-CE1 4.32Å; R127-Y355 HydrophobicContact CG-CE2 4.26Å; R127-Y355 HydrophobicContact CG-CG 4.43Å; H351-Y355 AromaticContact CE1-CD2 3.52Å; H351-Y355 AromaticContact ND1-CD2 3.65Å; H351-Y355 AromaticContact NE2-CD2 3.99Å; H351-Y355 WeakPolarHBondContact O-CA 3.15Å; H351-Y355 PolarHBondContact O-N 2.87Å; Y355-D357 PolarHBondContact O-N 2.87Å; Y355-D357 VanDerWaalsContact O-N 3.12Å; Y355-T358 WeakPolarHBondContact O-CB 3.29Å; Y355-T358 PolarHBondContact O-N 3.24Å; Y355-T358 VanDerWaalsContact O-N 3.09Å; Y355-T358 PolarHBondContact O-OG1 3.15Å
356	P	94.4	Very high	91.7	Very high	98 Å²	98	52.7 Å²	52.7	64%	0.636	30%	0.301	S	S	*	.	T	Hydrogen-bonded Turn	trans	-65.7	-13.6	-179.2	28.2	-36.2	0	0	0	113	C352 T358	C352-P356 WeakPolarHBondContact O-CA 3.34Å; P356-T358 VanDerWaalsContact C-N 3.26Å
357	D	94.8	Very high	90.5	Very high	103 Å²	103	56.5 Å²	56.5	55%	0.551	32%	0.318	S	S	*	.	T	Hydrogen-bonded Turn	trans	-77.1	-7.9	174.9	65.1	-63.4	0	0	0	113.8	R127 Y355	R127-D357 IonicContact CZ-OD2 3.57Å; R127-D357 IonicContact NH1-OD2 2.71Å; R127-D357 IonicContact NH2-OD1 2.9Å; R127-D357 PolarHBondContact NH2-OD1 3.14Å; R127-D357 IonicContact NH2-OD2 2.55Å; R127-D357 PolarHBondContact NH2-OD2 3.39Å; Y355-D357 PolarHBondContact O-N 2.87Å; Y355-D357 VanDerWaalsContact O-N 3.12Å
358	T	96.4	Very high	90.1	Very high	9 Å²	9	59.3 Å²	59.3	6%	0.055	33%	0.333	C	S	.	.	S	Bend	trans	-64.9	124.3	177.9	-67	0	0	0	0	110.7	H351 Y355 P356 W360 C361	H351-T358 PolarHBondContact NE2-OG1 2.94Å; H351-T358 VanDerWaalsContact NE2-OG1 3.11Å; Y355-T358 WeakPolarHBondContact O-CB 3.29Å; Y355-T358 PolarHBondContact O-N 3.24Å; Y355-T358 VanDerWaalsContact O-N 3.09Å; Y355-T358 PolarHBondContact O-OG1 3.15Å; P356-T358 VanDerWaalsContact C-N 3.26Å; T358-W360 VanDerWaalsContact C-N 3.3Å; T358-W360 HydrophobicContact CG2-CD2 3.78Å; T358-W360 HydrophobicContact CG2-CG 4.05Å; T358-W360 HydrophobicContact CG2-CH2 4.4Å; T358-W360 HydrophobicContact CG2-CZ2 3.62Å; T358-W360 PolarHBondContact O-N 2.87Å; T358-W360 VanDerWaalsContact O-N 3.08Å; T358-C361 VanDerWaalsContact O-CB 3.26Å; T358-C361 WeakPolarHBondContact O-CB 3.34Å; T358-C361 PolarHBondContact O-N 3.24Å
359	P	95	Very high	89.8	Confident	133 Å²	133	59.5 Å²	59.5	86%	0.864	34%	0.338	S	S	*	.	T	Hydrogen-bonded Turn	trans	-59.5	-29.1	-166.1	-29.3	35.2	0	0	0	116.9	C361	P359-C361 VanDerWaalsContact C-N 3.33Å
360	W	95.4	Very high	89.4	Confident	102 Å²	102	62.8 Å²	62.8	39%	0.386	36%	0.357	S	S	.	.	T	Hydrogen-bonded Turn	trans	-87.3	-3.3	179.8	53.2	-105.2	0	0	0	113.1	E122 T123 F338 K348 H351 C352 T358	E122-W360 WeakPolarHBondContact O-CZ2 3.26Å; T123-W360 HydrophobicContact CG2-CH2 4.14Å; T123-W360 HydrophobicContact CG2-CZ2 4.31Å; F338-W360 HydrophobicContact CE2-CE3 4.31Å; F338-W360 AromaticContact CE2-CZ3 3.91Å; F338-W360 HydrophobicContact CE2-CZ3 3.91Å; F338-W360 AromaticContact CZ-CE3 3.94Å; F338-W360 HydrophobicContact CZ-CE3 3.94Å; F338-W360 HydrophobicContact CZ-CZ3 4.01Å; K348-W360 HydrophobicContact CB-CH2 4.26Å; K348-W360 HydrophobicContact CB-CZ3 4.04Å; K348-W360 HydrophobicContact CG-CH2 4.41Å; K348-W360 HydrophobicContact CG-CZ3 4.39Å; H351-W360 HydrophobicContact CB-CH2 4.14Å; H351-W360 AromaticContact CD2-CH2 3.56Å; H351-W360 AromaticContact CD2-CZ2 3.54Å; C352-W360 WeakPolarHBondContact SG-CZ3 3.37Å; T358-W360 VanDerWaalsContact C-N 3.3Å; T358-W360 HydrophobicContact CG2-CD2 3.78Å; T358-W360 HydrophobicContact CG2-CG 4.05Å; T358-W360 HydrophobicContact CG2-CH2 4.4Å; T358-W360 HydrophobicContact CG2-CZ2 3.62Å; T358-W360 PolarHBondContact O-N 2.87Å; T358-W360 VanDerWaalsContact O-N 3.08Å
361	C	95.6	Very high	88.9	Confident	16 Å²	16	66.4 Å²	66.4	11%	0.108	38%	0.377	C	S	.	.	S	Bend	trans	-70.9	133.1	173.9	-72.6	0	0	0	0	110.5	C352 T358 P359	C352-C361 WeakPolarHBondContact CA-SG 3.48Å; C352-C361 HydrophobicContact CB-CB 3.77Å; C352-C361 WeakPolarHBondContact CB-SG 3.31Å; C352-C361 VanDerWaalsContact SG-CA 3.51Å; C352-C361 WeakPolarHBondContact SG-CB 3.15Å; C352-C361 CovalentContact SG-SG 2.04Å; C352-C361 PolarHBondContact SG-SG 3.41Å; T358-C361 VanDerWaalsContact O-CB 3.26Å; T358-C361 WeakPolarHBondContact O-CB 3.34Å; T358-C361 PolarHBondContact O-N 3.24Å; P359-C361 VanDerWaalsContact C-N 3.33Å
362	P	91.7	Very high	88.4	Confident	47 Å²	47	70.6 Å²	70.6	31%	0.305	40%	0.401	S	S	.	.	P	Polyproline II helix	trans	-58.7	141	175	-22.3	31.6	0	0	0	111.3	A337 F338 V365	A337-P362 HydrophobicContact CB-CG 4.13Å; F338-P362 HydrophobicContact CE1-CG 4.06Å; F338-P362 HydrophobicContact CE2-CG 4.5Å; F338-P362 HydrophobicContact CZ-CG 3.98Å; P362-V365 HydrophobicContact CB-CG2 3.79Å; P362-V365 HydrophobicContact CG-CG2 4.32Å; P362-V365 WeakPolarHBondContact O-CG2 3.45Å
363	P	83.9	Confident	87.8	Confident	117 Å²	117	75.1 Å²	75.1	76%	0.76	43%	0.427	S	S	*	.	T	Hydrogen-bonded Turn	trans	-69	148.1	173.6	28.5	-33.2	0	0	0	110.7	V365	P363-V365 PolarHBondContact O-N 3.49Å
364	Q	71.4	Confident	87.4	Confident	201 Å²	201	76.9 Å²	76.9	94%	0.939	44%	0.439	S	S	*	.	T	Hydrogen-bonded Turn	trans	61.1	37.6	171.4	-52.9	176.8	9.6	0	0	115.5	A366	Q364-A366 PolarHBondContact O-N 3.38Å
365	V	74.1	Confident	86.7	Confident	40 Å²	40	80.8 Å²	80.8	24%	0.242	46%	0.462	C	S	.	.			trans	-72	125.3	175	-178.6	0	0	0	0	110.5	A337 P362 P363 F367	A337-V365 HydrophobicContact CB-CB 4.35Å; A337-V365 HydrophobicContact CB-CG1 3.88Å; A337-V365 HydrophobicContact CB-CG2 3.66Å; P362-V365 HydrophobicContact CB-CG2 3.79Å; P362-V365 HydrophobicContact CG-CG2 4.32Å; P362-V365 WeakPolarHBondContact O-CG2 3.45Å; P363-V365 PolarHBondContact O-N 3.49Å; V365-F367 HydrophobicContact CB-CD2 4.22Å; V365-F367 HydrophobicContact CB-CE1 4.41Å; V365-F367 HydrophobicContact CB-CE2 3.62Å; V365-F367 HydrophobicContact CB-CZ 3.74Å; V365-F367 HydrophobicContact CG1-CD1 3.89Å; V365-F367 HydrophobicContact CG1-CD2 3.92Å; V365-F367 HydrophobicContact CG1-CE1 3.53Å; V365-F367 HydrophobicContact CG1-CE2 3.56Å; V365-F367 HydrophobicContact CG1-CG 4.08Å; V365-F367 HydrophobicContact CG1-CZ 3.36Å; V365-F367 HydrophobicContact CG2-CZ 4.42Å
366	A	68	Low	86	Confident	90 Å²	90	87.2 Å²	87.2	74%	0.744	50%	0.499	S	S	*	.			trans	-86.8	113.8	167.8	0	0	0	0	0	109.2	Q364	Q364-A366 PolarHBondContact O-N 3.38Å
367	F	71	Confident	85.2	Confident	90 Å²	90	86.2 Å²	86.2	40%	0.395	49%	0.486	S	S	.	.			trans	-97.2	0	-179.7	-68.8	-75	0	0	0	113.1	L334 A337 S349 C352 L353 V365	L334-F367 HydrophobicContact CD1-CD1 4.25Å; L334-F367 HydrophobicContact CD2-CD1 4.38Å; A337-F367 HydrophobicContact CB-CE1 4.23Å; A337-F367 HydrophobicContact CB-CZ 4.18Å; S349-F367 VanDerWaalsContact O-CE1 3.25Å; S349-F367 WeakPolarHBondContact O-CE1 3.36Å; C352-F367 HydrophobicContact CB-CZ 3.74Å; L353-F367 HydrophobicContact CB-CD1 3.91Å; L353-F367 HydrophobicContact CB-CD2 4.2Å; L353-F367 HydrophobicContact CB-CE1 3.9Å; L353-F367 HydrophobicContact CB-CE2 4.19Å; L353-F367 HydrophobicContact CB-CG 4.06Å; L353-F367 HydrophobicContact CB-CZ 4.04Å; L353-F367 HydrophobicContact CD1-CB 3.75Å; L353-F367 HydrophobicContact CD1-CD1 4.4Å; L353-F367 HydrophobicContact CD1-CD2 3.83Å; L353-F367 HydrophobicContact CD1-CG 3.75Å; L353-F367 HydrophobicContact CG-CG 4.4Å; L353-F367 VanDerWaalsContact N-CZ 3.34Å; V365-F367 HydrophobicContact CB-CD2 4.22Å; V365-F367 HydrophobicContact CB-CE1 4.41Å; V365-F367 HydrophobicContact CB-CE2 3.62Å; V365-F367 HydrophobicContact CB-CZ 3.74Å; V365-F367 HydrophobicContact CG1-CD1 3.89Å; V365-F367 HydrophobicContact CG1-CD2 3.92Å; V365-F367 HydrophobicContact CG1-CE1 3.53Å; V365-F367 HydrophobicContact CG1-CE2 3.56Å; V365-F367 HydrophobicContact CG1-CG 4.08Å; V365-F367 HydrophobicContact CG1-CZ 3.36Å; V365-F367 HydrophobicContact CG2-CZ 4.42Å

Retrieved 367 of 367 residues in 68 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).