A0A060VZE5_ONCMY Loading...

Peroxisome proliferator-activated receptor delta a

AlphaFold DB , UniProt , Accession A0A060VZE5, Species ONCMY (Oncorhynchus mykiss, Rainbow trout), Gene LOC110494977, Length 533 aa.

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(Predicted Aligned Error values between residue pairs)

Download Structure PDB PAE Table

Site	Residue	pLDDT	pLDDT confidence	pLDDT₁₀	pLDDT10 confidence	SASA	SASA [Å²]	SASA₁₀	SASA10 [Å²]	RSA	RSA unformatted	RSA₁₀	RSA10 unformatted	Surface	Surface10 (not used)	Disorder (not used)	Disorder	Sec. str.	Secondary structure	Isomer	Phi (φ)	Psi (ψ)	Omega (ω)	Chi 1 (χ₁)	Chi 2 (χ₂)	Chi 3 (χ₃)	Chi 4 (χ₄)	Chi 5 (χ₅)	Tau (τ)	Contacts (colored by PAE)	Contact details
1	M	33.9	Very low	35.6	Very low	237 Å²	237	150.1 Å²	150.1	100%	1.167	86%	0.856	S	S	*	*				0	128.7	0	-69.5	175.2	173.8	0	0	107.4
2	E	33.2	Very low	35.5	Very low	190 Å²	190	147.5 Å²	147.5	89%	0.888	85%	0.845	S	S	*	*			trans	-70.6	172.6	176	-63.9	106.3	128.6	0	0	112.4
3	G	32.9	Very low	35.4	Very low	74 Å²	74	153.8 Å²	153.8	76%	0.763	85%	0.847	S	S	*	*			cis	158.7	158.7	-7.4	0	0	0	0	0	111.9
4	T	44.9	Very low	34.9	Very low	141 Å²	141	150.4 Å²	150.4	87%	0.865	84%	0.839	S	S	*	*			trans	-96.4	144.7	-163.2	-28.3	0	0	0	0	113.8
5	R	38.4	Very low	34.6	Very low	244 Å²	244	151 Å²	151	92%	0.921	84%	0.84	S	S	*	*				-175.7	160.2	127.9	-106.8	164.4	176.3	164.6	-0.5	115.4
6	A	35.1	Very low	34.7	Very low	95 Å²	95	150.5 Å²	150.5	79%	0.785	84%	0.835	S	S	*	*			trans	-125.6	161.1	167	0	0	0	0	0	109.6
7	T	32.2	Very low	35.7	Very low	139 Å²	139	148.1 Å²	148.1	85%	0.853	83%	0.828	S	S	*	*			trans	-140.3	137.3	-174.1	-57.9	0	0	0	0	110.4
8	I	32.8	Very low	35.4	Very low	153 Å²	153	153.7 Å²	153.7	79%	0.785	83%	0.834	S	S	*	*			trans	-135.4	120.9	176.1	-67	-176.8	0	0	0	111.4
9	L	31.5	Very low	35.3	Very low	166 Å²	166	157.2 Å²	157.2	87%	0.869	83%	0.834	S	S	*	*			trans	31.4	140.4	146.8	-57.5	172.5	0	0	0	123
10	A	31	Very low	35.2	Very low	81 Å²	81	154.4 Å²	154.4	67%	0.669	82%	0.819	S	S	*	*			trans	-118.7	166.3	149.6	0	0	0	0	0	109.3
11	P	45.4	Very low	35.2	Very low	131 Å²	131	156.6 Å²	156.6	85%	0.851	82%	0.816	S	S	*	*				-142.3	-166.5	113.5	38.7	-24.2	0	0	0	113.8
12	V	34.5	Very low	35.2	Very low	119 Å²	119	153.5 Å²	153.5	72%	0.721	80%	0.796	S	S	*	*			trans	-144.7	149.2	-153.8	165.9	0	0	0	0	113.4
13	R	34.9	Very low	35.1	Very low	230 Å²	230	156.1 Å²	156.1	87%	0.868	80%	0.798	S	S	*	*			trans	76.5	127.7	161.1	-86.3	170.9	-170.8	-169.4	2.9	122.1
14	S	27.9	Very low	35.1	Very low	106 Å²	106	163.5 Å²	163.5	74%	0.741	80%	0.803	S	S	*	*			trans	161.2	150.4	131.5	44.9	0	0	0	0	108.9
15	D	29.9	Very low	34.3	Very low	159 Å²	159	164 Å²	164	85%	0.85	81%	0.805	S	S	*	*			cis	-156.5	160.2	-30.4	-93.7	-46.5	0	0	0	107.6
16	D	36.8	Very low	33.7	Very low	143 Å²	143	155.6 Å²	155.6	77%	0.765	80%	0.795	S	S	*	*			trans	-123.5	135.6	173.4	177.1	39.9	0	0	0	109.6	R18	D16-R18 PolarHBondContact OD1-N 3.48Å
17	P	51	Low	33.4	Very low	110 Å²	110	154.8 Å²	154.8	71%	0.714	80%	0.796	S	S	*	*				-151.2	148.3	110.7	36.3	-19.5	0	0	0	116.2
18	R	30.8	Very low	33.7	Very low	248 Å²	248	154.4 Å²	154.4	94%	0.936	80%	0.795	S	S	*	*			trans	-150.8	162.3	143.9	-112.1	162.9	-138.9	-128.9	3.3	113.8	D16	D16-R18 PolarHBondContact OD1-N 3.48Å
19	R	34.2	Very low	34	Very low	221 Å²	221	153.1 Å²	153.1	83%	0.834	80%	0.795	S	S	*	*			trans	-138.7	143.3	-141	-159.5	-158.5	172.6	161.2	7.2	115.7
20	D	33.6	Very low	33.8	Very low	101 Å²	101	156.7 Å²	156.7	54%	0.54	80%	0.797	S	S	.	*			trans	56.3	114.2	149.1	-87.9	-50.6	0	0	0	123.8
21	R	34	Very low	33.8	Very low	200 Å²	200	162.5 Å²	162.5	76%	0.755	81%	0.807	S	S	*	*				71.3	128.8	120.2	-79.8	178.1	173.4	173.4	-2.4	125.7
22	K	33.6	Very low	32.9	Very low	172 Å²	172	160.1 Å²	160.1	75%	0.748	81%	0.806	S	S	*	*			trans	74.9	112.1	130.5	-73.9	-179.7	174.9	-178.1	0	122
23	R	31.1	Very low	32.5	Very low	245 Å²	245	157.8 Å²	157.8	93%	0.925	81%	0.806	S	S	*	*				175.8	161.3	118	-92	159	-172.5	-125	3	107.1
24	R	32.4	Very low	32.2	Very low	229 Å²	229	153.2 Å²	153.2	86%	0.864	80%	0.803	S	S	*	*			cis	149	158.4	-10.3	-156.5	-174.4	-158.5	-145.6	8.2	104.3
25	V	30.1	Very low	32.1	Very low	152 Å²	152	154.4 Å²	154.4	92%	0.921	81%	0.81	S	S	*	*			trans	76.2	141.8	-175.6	-167.9	0	0	0	0	112.6
26	G	25.9	Very low	32.2	Very low	68 Å²	68	154.5 Å²	154.5	70%	0.701	81%	0.805	S	S	*	*			cis	-165.2	178.7	-2.6	0	0	0	0	0	112.1
27	G	26.8	Very low	31.8	Very low	78 Å²	78	153.5 Å²	153.5	80%	0.804	80%	0.8	S	S	*	*			trans	-84.6	-161.1	-178.5	0	0	0	0	0	114.9
28	P	39.5	Very low	30.8	Very low	130 Å²	130	159.2 Å²	159.2	84%	0.844	81%	0.807	S	S	*	*			cis	-133.9	-175.6	21.3	43.1	-26.9	0	0	0	116.6
29	V	39.3	Very low	30.7	Very low	127 Å²	127	152.6 Å²	152.6	77%	0.77	80%	0.795	S	S	*	*			trans	-120	137.5	176.8	172.4	0	0	0	0	111.4
30	R	28.2	Very low	30.5	Very low	241 Å²	241	146.8 Å²	146.8	91%	0.909	79%	0.794	S	S	*	*			trans	-146.4	136.6	152.7	-64.1	-169.6	176.9	-160.3	-1.5	108.2
31	K	30	Very low	30.4	Very low	202 Å²	202	147.6 Å²	147.6	88%	0.878	81%	0.807	S	S	*	*			cis	100.9	128.5	21.8	-83.2	-159.2	170.3	-172.2	0	115.3
32	G	26.5	Very low	31.1	Very low	81 Å²	81	143.1 Å²	143.1	84%	0.835	80%	0.804	S	S	*	*			trans	116.4	129.2	163.6	0	0	0	0	0	113.7
33	G	25.9	Very low	31	Very low	70 Å²	70	144.7 Å²	144.7	72%	0.722	81%	0.814	S	S	*	*			cis	-121.6	163.6	-17.8	0	0	0	0	0	109.6
34	V	29.7	Very low	31	Very low	134 Å²	134	136.1 Å²	136.1	81%	0.812	80%	0.801	S	S	*	*			cis	71.9	100.7	38.5	-175.5	0	0	0	0	113.6
35	C	25.7	Very low	30.9	Very low	131 Å²	131	134.6 Å²	134.6	89%	0.885	80%	0.804	S	S	*	*			trans	-137.2	138	135.2	-116.4	0	0	0	0	108.5
36	Q	31.3	Very low	30.7	Very low	161 Å²	161	133.5 Å²	133.5	75%	0.752	80%	0.802	S	S	*	*			trans	-106.8	-176.3	171	-55	174.9	-32.3	0	0	107
37	N	28.3	Very low	30.9	Very low	122 Å²	122	137.1 Å²	137.1	65%	0.652	81%	0.811	S	S	*	*			cis	-163.9	163.8	7.4	-145.3	-8.9	0	0	0	109.8
38	R	29.4	Very low	31.2	Very low	230 Å²	230	137.9 Å²	137.9	87%	0.868	80%	0.803	S	S	*	*			trans	151.6	97.6	152.6	-86.3	163.9	-165.8	-122.6	3	109.6
39	T	29.9	Very low	30.7	Very low	110 Å²	110	139 Å²	139	68%	0.675	80%	0.803	S	S	*	*				61.2	102.3	82.2	64.7	0	0	0	0	112.9
40	A	29.8	Very low	30.2	Very low	98 Å²	98	136.2 Å²	136.2	81%	0.81	80%	0.799	S	S	*	*				82.9	143.5	81	0	0	0	0	0	112.4
41	S	31.6	Very low	30.2	Very low	118 Å²	118	132.2 Å²	132.2	83%	0.825	79%	0.791	S	S	*	*			cis	-147.8	176.5	15	-112	0	0	0	0	112.9
42	P	49.1	Very low	30.2	Very low	106 Å²	106	132.7 Å²	132.7	69%	0.688	79%	0.787	S	S	*	*			trans	-111.8	156.8	-172.4	40.3	-32.1	0	0	0	116.4
43	H	31.4	Very low	30.5	Very low	206 Å²	206	136.4 Å²	136.4	95%	0.954	78%	0.783	S	S	*	*			trans	-159.1	153.7	155.9	-79.9	-84.4	0	0	0	107.4
44	G	29.5	Very low	31.2	Very low	64 Å²	64	138.9 Å²	138.9	66%	0.66	79%	0.786	S	S	*	*			cis	-178.8	137.4	-9.3	0	0	0	0	0	112.5
45	E	30.1	Very low	31.2	Very low	197 Å²	197	140.6 Å²	140.6	92%	0.921	79%	0.785	S	S	*	*			trans	60.7	160.9	151.1	-64.4	178.3	134.5	0	0	122.4
46	C	27.1	Very low	31.5	Very low	130 Å²	130	139.7 Å²	139.7	88%	0.878	78%	0.78	S	S	*	*			trans	-125	145.3	178.6	-56.6	0	0	0	0	109.6
47	T	30.4	Very low	31.5	Very low	144 Å²	144	136.9 Å²	136.9	88%	0.883	78%	0.784	S	S	*	*			trans	-134.3	147.1	163.2	51.7	0	0	0	0	110
48	S	32.9	Very low	31.5	Very low	93 Å²	93	138.6 Å²	138.6	65%	0.65	79%	0.793	S	S	*	*			trans	-92.5	-169.5	173.2	58.6	0	0	0	0	111.2
49	D	28.4	Very low	31.7	Very low	155 Å²	155	137.7 Å²	137.7	83%	0.829	80%	0.795	S	S	*	*			trans	75.5	148.3	169.3	-41.6	-10	0	0	0	114
50	G	28.3	Very low	31.6	Very low	67 Å²	67	139 Å²	139	69%	0.691	79%	0.793	S	S	*	*			cis	166	116.7	-8.2	0	0	0	0	0	111.6
51	E	29.3	Very low	31.6	Very low	158 Å²	158	142.8 Å²	142.8	74%	0.738	80%	0.799	S	S	*	*			trans	57.1	133.6	176.4	-55	-172	175.3	0	0	118.9
52	R	28.7	Very low	31.5	Very low	211 Å²	211	145.2 Å²	145.2	80%	0.796	80%	0.795	S	S	*	*				154.1	135.6	93.8	-161.8	162.9	-73.2	-171	-1.1	112.5
53	E	33.8	Very low	31	Very low	160 Å²	160	145.9 Å²	145.9	75%	0.748	80%	0.799	S	S	*	*			trans	-61.9	158.2	168.8	-74.8	-73.2	136.2	0	0	112.5
54	P	39.8	Very low	31	Very low	121 Å²	121	143.6 Å²	143.6	79%	0.786	79%	0.794	S	S	*	*				-139.1	139.1	117.9	36.5	-25.4	0	0	0	115.1
55	E	31.2	Very low	31.7	Very low	170 Å²	170	145.6 Å²	145.6	79%	0.794	80%	0.796	S	S	*	*			trans	-72.9	161.8	169.2	-75.9	-167.7	102.4	0	0	113.9
56	S	31.2	Very low	31.6	Very low	113 Å²	113	143.9 Å²	143.9	79%	0.79	79%	0.792	S	S	*	*			trans	78.9	112.9	149.6	77	0	0	0	0	120.1
57	A	31	Very low	31.7	Very low	101 Å²	101	141.6 Å²	141.6	84%	0.835	78%	0.778	S	S	*	*			trans	-154.8	112.7	136.9	0	0	0	0	0	109.1
58	L	28.7	Very low	31.8	Very low	159 Å²	159	144.3 Å²	144.3	83%	0.832	78%	0.777	S	S	*	*			trans	-71.1	149.1	173.6	-74.3	85.1	0	0	0	110.9
59	K	32.4	Very low	31.5	Very low	211 Å²	211	142.8 Å²	142.8	92%	0.917	78%	0.776	S	S	*	*			trans	-143.3	121.9	142.8	-109.6	171.1	-173.5	176.3	0	110.4
60	E	29.1	Very low	31.5	Very low	136 Å²	136	144.2 Å²	144.2	64%	0.636	78%	0.783	S	S	*	*			trans	-74	145.6	175.9	-61.3	-178.9	97.4	0	0	111.5	K62	E60-K62 WeakPolarHBondContact OE1-CE 3.36Å; E60-K62 IonicContact OE1-NZ 2.7Å; E60-K62 PolarHBondContact OE1-NZ 3.15Å
61	L	28.5	Very low	31.4	Very low	179 Å²	179	144.5 Å²	144.5	94%	0.937	79%	0.786	S	S	*	*			trans	-136.6	120.4	145.6	-79	178	0	0	0	108.4
62	K	30.7	Very low	31.4	Very low	168 Å²	168	144.2 Å²	144.2	73%	0.73	78%	0.782	S	S	*	*			trans	-94.7	149.5	177.1	-82	171.5	172.9	131.6	0	111	E60	E60-K62 WeakPolarHBondContact OE1-CE 3.36Å; E60-K62 IonicContact OE1-NZ 2.7Å; E60-K62 PolarHBondContact OE1-NZ 3.15Å
63	P	39	Very low	31.3	Very low	120 Å²	120	146 Å²	146	78%	0.779	79%	0.789	S	S	*	*			trans	-81.5	165.3	-179.3	35.1	-37	0	0	0	112.6
64	N	29.8	Very low	31.1	Very low	159 Å²	159	142.9 Å²	142.9	85%	0.85	78%	0.778	S	S	*	*			trans	-157.5	166.1	164	-115.4	-10.9	0	0	0	110.9
65	P	44.6	Very low	30.6	Very low	106 Å²	106	142.7 Å²	142.7	69%	0.688	77%	0.774	S	S	*	*				-138.7	-179.6	-126.4	41	-21.5	0	0	0	116.1
66	L	28.4	Very low	30.4	Very low	160 Å²	160	143.8 Å²	143.8	84%	0.838	78%	0.779	S	S	*	*			trans	-153.2	126.1	147.4	-89.8	128	0	0	0	107.3
67	S	30.3	Very low	30.2	Very low	83 Å²	83	141.9 Å²	141.9	58%	0.58	78%	0.777	S	S	*	*				64.4	121.6	60.4	158.2	0	0	0	0	112.5
68	K	31	Very low	30	Very low	200 Å²	200	144.3 Å²	144.3	87%	0.87	77%	0.771	S	S	*	*			cis	-158.1	170	4	-87.4	153.7	-172.4	174.8	0	107
69	G	26.9	Very low	30	Very low	62 Å²	62	147.3 Å²	147.3	64%	0.639	77%	0.772	S	S	*	*			cis	158.8	174.7	-2.3	0	0	0	0	0	111.9
70	L	28.4	Very low	29.6	Very low	185 Å²	185	140.9 Å²	140.9	97%	0.969	77%	0.765	S	S	*	*			trans	64.2	141.7	177.3	-63.5	102.5	0	0	0	117.7
71	G	27.2	Very low	29.6	Very low	73 Å²	73	139.6 Å²	139.6	75%	0.753	78%	0.777	S	S	*	*			cis	-159.2	168.2	2.8	0	0	0	0	0	115.1
72	K	28.1	Very low	29.4	Very low	152 Å²	152	139.9 Å²	139.9	66%	0.661	77%	0.774	S	S	*	*			trans	-73	157.8	177.4	-55.4	162.1	97.5	-75.4	0	111.5	D74	K72-D74 IonicContact NZ-OD1 2.66Å; K72-D74 PolarHBondContact NZ-OD1 3.25Å; K72-D74 IonicContact NZ-OD2 2.67Å; K72-D74 PolarHBondContact NZ-OD2 3.18Å
73	W	27.7	Very low	29.3	Very low	249 Å²	249	138.5 Å²	138.5	94%	0.943	78%	0.78	S	S	*	*			trans	-144.5	158	131.8	-97.6	86	0	0	0	109.5
74	D	28.2	Very low	28.7	Very low	94 Å²	94	138.2 Å²	138.2	50%	0.503	78%	0.78	S	S	.	*			trans	-149.7	155.8	-164.3	-35.1	-99.7	0	0	0	108.2	K72	K72-D74 IonicContact NZ-OD1 2.66Å; K72-D74 PolarHBondContact NZ-OD1 3.25Å; K72-D74 IonicContact NZ-OD2 2.67Å; K72-D74 PolarHBondContact NZ-OD2 3.18Å
75	T	30	Very low	29	Very low	116 Å²	116	136.4 Å²	136.4	71%	0.712	78%	0.777	S	S	*	*			cis	-161	161.2	1.9	-9.3	0	0	0	0	110.3
76	E	27.6	Very low	28.2	Very low	194 Å²	194	140.9 Å²	140.9	91%	0.907	79%	0.789	S	S	*	*			trans	64.7	169.1	158.1	-63.5	169.4	150.2	0	0	119.1
77	G	26	Very low	28.2	Very low	72 Å²	72	137 Å²	137	74%	0.742	79%	0.787	S	S	*	*			trans	139.4	74.5	161.6	0	0	0	0	0	120.7
78	E	28.1	Very low	28	Very low	152 Å²	152	142 Å²	142	71%	0.71	80%	0.801	S	S	*	*			trans	33.1	135.3	145.9	-57	-148.8	72.3	0	0	126.7
79	R	28.2	Very low	27.9	Very low	223 Å²	223	140.4 Å²	140.4	84%	0.842	80%	0.802	S	S	*	*			trans	14.9	134.6	137.3	-66.1	176.8	-90.3	-128.4	1.6	121.6
80	G	24.8	Very low	28	Very low	75 Å²	75	143.3 Å²	143.3	77%	0.773	81%	0.808	S	S	*	*			trans	178.6	113.6	151.4	0	0	0	0	0	118.9
81	A	27.3	Very low	27.9	Very low	109 Å²	109	142.5 Å²	142.5	90%	0.901	80%	0.803	S	S	*	*			trans	63.2	151.7	151	0	0	0	0	0	122.8
82	E	25.7	Very low	27.9	Very low	186 Å²	186	143.9 Å²	143.9	87%	0.869	80%	0.8	S	S	*	*			trans	-90.7	145.6	172.1	-56.7	149.4	98.8	0	0	111.5
83	V	27.3	Very low	27.7	Very low	139 Å²	139	141.2 Å²	141.2	84%	0.842	80%	0.801	S	S	*	*			trans	-148.6	125.3	145.2	-178.5	0	0	0	0	108.9
84	S	27.8	Very low	27.7	Very low	114 Å²	114	138 Å²	138	80%	0.797	79%	0.788	S	S	*	*			trans	-100.3	145.4	161	-59.1	0	0	0	0	109.9
85	P	35.7	Very low	27.6	Very low	120 Å²	120	142 Å²	142	78%	0.779	80%	0.804	S	S	*	*			trans	-119.2	162.7	140	35.1	-28.1	0	0	0	111.6
86	E	28.2	Very low	27.5	Very low	201 Å²	201	143.8 Å²	143.8	94%	0.939	81%	0.806	S	S	*	*			trans	-84.9	171.4	-174.4	-64.1	172.9	117.9	0	0	112.4
87	G	27.5	Very low	27.4	Very low	77 Å²	77	141.5 Å²	141.5	79%	0.794	80%	0.8	S	S	*	*			trans	-79.5	165.2	-163	0	0	0	0	0	116.9
88	E	27.1	Very low	27.6	Very low	188 Å²	188	143 Å²	143	88%	0.879	80%	0.799	S	S	*	*			trans	-124.6	140.5	158.5	-67.9	-169.2	132.3	0	0	109
89	D	29.2	Very low	27.5	Very low	168 Å²	168	144 Å²	144	90%	0.898	80%	0.804	S	S	*	*			trans	-72.8	128.3	177.2	-81.4	-59.8	0	0	0	111.6
90	V	27.7	Very low	27.5	Very low	123 Å²	123	140.9 Å²	140.9	75%	0.745	80%	0.804	S	S	*	*			trans	-115.6	90.4	171.3	-175.3	0	0	0	0	110.3	C92	V90-C92 PolarHBondContact O-N 3.1Å
91	L	26.4	Very low	27.6	Very low	168 Å²	168	146.6 Å²	146.6	88%	0.88	81%	0.811	S	S	*	*			trans	-73.6	83.7	173.5	-170.8	79.2	0	0	0	110.5	S93	L91-S93 PolarHBondContact O-N 3.26Å
92	C	26.7	Very low	27.6	Very low	102 Å²	102	150.5 Å²	150.5	69%	0.689	81%	0.81	S	S	*	*			trans	-70.1	118.5	178.8	-92.1	0	0	0	0	112.7	V90	V90-C92 PolarHBondContact O-N 3.1Å
93	S	24.9	Very low	27.8	Very low	96 Å²	96	151.3 Å²	151.3	67%	0.671	81%	0.811	S	S	*	*			trans	-70.1	148.1	179.6	-165.2	0	0	0	0	113.1	L91 E95	L91-S93 PolarHBondContact O-N 3.26Å; S93-E95 PolarHBondContact O-N 3.29Å
94	W	27	Very low	27.8	Very low	180 Å²	180	153.8 Å²	153.8	68%	0.682	81%	0.813	S	S	*	*			trans	-98.5	65.1	174.2	-74.5	60.1	0	0	0	110.6	V371	W94-V371 HydrophobicContact CH2-CG1 4.39Å; W94-V371 HydrophobicContact CH2-CG2 4.3Å; W94-V371 HydrophobicContact CZ2-CG1 4Å; W94-V371 HydrophobicContact CZ2-CG2 4.02Å
95	E	26.6	Very low	27.7	Very low	178 Å²	178	157.6 Å²	157.6	83%	0.832	82%	0.819	S	S	*	*			trans	-81.2	122.4	174.3	-70	-174.9	125.4	0	0	110.8	S93	S93-E95 PolarHBondContact O-N 3.29Å
96	M	27.3	Very low	27.3	Very low	154 Å²	154	160.4 Å²	160.4	76%	0.759	82%	0.821	S	S	*	*			trans	-94.2	102.1	179.9	-74.9	177.3	50.2	0	0	110.1	S98	M96-S98 PolarHBondContact O-N 3.42Å; M96-S98 PolarHBondContact O-OG 3.32Å
97	D	25.3	Very low	27.2	Very low	147 Å²	147	159.3 Å²	159.3	79%	0.786	81%	0.814	S	S	*	*			trans	-58.7	124.7	176.8	-134.2	-24.1	0	0	0	111
98	S	30.1	Very low	27.2	Very low	103 Å²	103	163.7 Å²	163.7	72%	0.72	81%	0.813	S	S	*	*			trans	-138	96.5	179.4	-63.7	0	0	0	0	107.8	M96	M96-S98 PolarHBondContact O-N 3.42Å; M96-S98 PolarHBondContact O-OG 3.32Å
99	Q	27.7	Very low	27.2	Very low	173 Å²	173	165 Å²	165	81%	0.808	82%	0.816	S	S	*	*			trans	-131.8	140.3	175.6	-64.8	-166	6.9	0	0	110.9
100	D	28.3	Very low	27	Very low	158 Å²	158	160.2 Å²	160.2	85%	0.845	81%	0.806	S	S	*	*			trans	-76	157.8	-173	-64.7	-83.3	0	0	0	113.4
101	Q	26.8	Very low	26.9	Very low	194 Å²	194	160.4 Å²	160.4	91%	0.907	81%	0.813	S	S	*	*			trans	-94.1	97.6	164.4	-74.5	-170.8	-21.3	0	0	110.1
102	E	27.5	Very low	26.9	Very low	192 Å²	192	158.2 Å²	158.2	90%	0.897	81%	0.812	S	S	*	*			trans	-66.8	164.1	160.9	-66.3	-161.5	120.8	0	0	111.3
103	K	28.8	Very low	26.9	Very low	203 Å²	203	160.6 Å²	160.6	88%	0.883	82%	0.818	S	S	*	*			trans	-123.7	132.5	-179.4	-69.8	178.9	177.1	177.5	0	111
104	E	27.2	Very low	27	Very low	191 Å²	191	160.8 Å²	160.8	89%	0.893	82%	0.819	S	S	*	*			trans	-88.5	131	157.5	-64.8	-173.2	118.4	0	0	110.2
105	E	26.6	Very low	27.1	Very low	194 Å²	194	160.7 Å²	160.7	91%	0.907	83%	0.826	S	S	*	*				-179.8	148.5	103.3	-93.2	-158.7	130.8	0	0	110.4
106	E	27.4	Very low	27.2	Very low	178 Å²	178	157.1 Å²	157.1	83%	0.832	82%	0.821	S	S	*	*			trans	-83.2	151	-177.8	-59.5	-172.6	100.7	0	0	113.9
107	K	25.9	Very low	27.1	Very low	179 Å²	179	155.8 Å²	155.8	78%	0.778	82%	0.821	S	S	*	*				-174	140.6	107.5	-102.8	169.6	-177.5	159.4	0	117.3
108	Q	26	Very low	27.2	Very low	168 Å²	168	153.2 Å²	153.2	79%	0.785	82%	0.815	S	S	*	*			trans	61.2	91.5	145.6	-70.3	-179.3	-23.3	0	0	120.4
109	K	27.7	Very low	27.1	Very low	216 Å²	216	155.1 Å²	155.1	94%	0.939	82%	0.817	S	S	*	*				-173	148.1	122.5	-96.6	154	-175	176.5	0	108.7
110	G	24.7	Very low	27.1	Very low	67 Å²	67	152 Å²	152	69%	0.691	81%	0.81	S	S	*	*			cis	144.6	80.6	-5	0	0	0	0	0	112.5
111	S	26.6	Very low	26.9	Very low	127 Å²	127	151.6 Å²	151.6	89%	0.888	81%	0.808	S	S	*	*			trans	65.8	154.4	-177.7	-68.8	0	0	0	0	115.4
112	S	26.8	Very low	27	Very low	122 Å²	122	147.9 Å²	147.9	85%	0.853	80%	0.803	S	S	*	*			cis	-149.9	167.2	-1.2	33.8	0	0	0	0	110.8
113	N	25.4	Very low	27.8	Very low	152 Å²	152	145 Å²	145	81%	0.813	80%	0.801	S	S	*	*			trans	-117.7	141.1	-167	-177.7	23	0	0	0	114.3
114	S	28.3	Very low	27.7	Very low	100 Å²	100	139.4 Å²	139.4	70%	0.699	79%	0.793	S	S	*	*			trans	-164.7	113.7	159	53.9	0	0	0	0	108.1
115	Q	29.1	Very low	28.9	Very low	178 Å²	178	136.3 Å²	136.3	83%	0.832	79%	0.79	S	S	*	*				60.8	132.3	90.7	-70.6	-176.9	-8.4	0	0	113.9
116	S	27	Very low	28.8	Very low	103 Å²	103	133.1 Å²	133.1	72%	0.72	79%	0.789	S	S	*	*			cis	-163.2	167.2	10.9	53	0	0	0	0	114.1
117	T	26.9	Very low	28.9	Very low	126 Å²	126	130.1 Å²	130.1	77%	0.773	79%	0.787	S	S	*	*			trans	5	148.5	147.4	53.3	0	0	0	0	120.3
118	S	27.6	Very low	28.9	Very low	93 Å²	93	126.7 Å²	126.7	65%	0.65	79%	0.786	S	S	*	*			cis	-177.1	169.3	12.1	41.2	0	0	0	0	111.9
119	N	27.2	Very low	28.9	Very low	144 Å²	144	123.1 Å²	123.1	77%	0.77	78%	0.779	S	S	*	*			trans	37.8	146.9	137.5	-61.5	19.1	0	0	0	121.8
120	T	26.6	Very low	28.9	Very low	108 Å²	108	119.2 Å²	119.2	66%	0.663	77%	0.773	S	S	*	*			cis	-167.2	165.1	-2.9	18.1	0	0	0	0	111.1
121	D	25.7	Very low	29	Very low	149 Å²	149	122.4 Å²	122.4	80%	0.797	77%	0.774	S	S	*	*			trans	71.9	152.5	149.7	-58.5	-28.1	0	0	0	124
122	S	28.1	Very low	28.9	Very low	115 Å²	115	123.2 Å²	123.2	80%	0.804	77%	0.768	S	S	*	*			trans	-115.3	-168.3	-177.1	-57	0	0	0	0	109.4
123	P	43.6	Very low	29	Very low	131 Å²	131	121.6 Å²	121.6	85%	0.851	76%	0.756	S	S	*	*			cis	-135.1	-163.2	0.7	41.4	-20.2	0	0	0	115.3
124	A	26.7	Very low	29.2	Very low	87 Å²	87	122.3 Å²	122.3	72%	0.719	76%	0.755	S	S	*	*			trans	-108.9	-152.2	-178.7	0	0	0	0	0	111.3
125	P	53.6	Low	29.1	Very low	126 Å²	126	123.2 Å²	123.2	82%	0.818	76%	0.756	S	S	*	*			cis	-133.8	176.7	-26.6	39.5	-23.2	0	0	0	114.6
126	S	24.5	Very low	29.2	Very low	127 Å²	127	120.2 Å²	120.2	89%	0.888	76%	0.755	S	S	*	*			trans	-162.7	177.4	155.9	65.7	0	0	0	0	112.7
127	S	28.2	Very low	29.4	Very low	114 Å²	114	121 Å²	121	80%	0.797	76%	0.76	S	S	*	*			trans	-151.1	177.7	-176	74.4	0	0	0	0	110.8
128	S	27.9	Very low	29.8	Very low	107 Å²	107	121.3 Å²	121.3	75%	0.748	76%	0.764	S	S	*	*			cis	-152.6	-157.3	8.8	50.8	0	0	0	0	108.1
129	C	25.7	Very low	29.9	Very low	94 Å²	94	121.1 Å²	121.1	64%	0.635	76%	0.763	S	S	*	*			cis	-165	-171.7	7.8	53.8	0	0	0	0	109.8
130	T	27.8	Very low	30.3	Very low	134 Å²	134	123.1 Å²	123.1	82%	0.822	77%	0.773	S	S	*	*			trans	64.8	150.5	164	50.7	0	0	0	0	119
131	D	25.1	Very low	30.8	Very low	134 Å²	134	122.4 Å²	122.4	72%	0.717	77%	0.773	S	S	*	*			cis	-162.1	164.3	-21.4	-170.8	26.4	0	0	0	111.3
132	L	25.6	Very low	31	Very low	144 Å²	144	122.3 Å²	122.3	75%	0.754	77%	0.772	S	S	*	*			trans	13.1	137.2	164.7	-77.5	164.8	0	0	0	121.7
133	S	28.1	Very low	31.5	Very low	88 Å²	88	125.7 Å²	125.7	62%	0.615	78%	0.775	S	S	*	*				178.4	171.5	60.2	62	0	0	0	0	116
134	Q	29.9	Very low	31.2	Very low	166 Å²	166	127.1 Å²	127.1	78%	0.776	78%	0.775	S	S	*	*			trans	83.6	108.5	152.9	-74.6	169.9	93.3	0	0	124.3
135	T	26.8	Very low	31.5	Very low	120 Å²	120	132.8 Å²	132.8	74%	0.736	78%	0.784	S	S	*	*			trans	31.2	136	131.9	61	0	0	0	0	121.5
136	S	30.6	Very low	30.3	Very low	114 Å²	114	135.2 Å²	135.2	80%	0.797	79%	0.789	S	S	*	*				-168.3	169.5	58.3	-58.4	0	0	0	0	113.8
137	S	31.8	Very low	30.5	Very low	120 Å²	120	132.5 Å²	132.5	84%	0.839	78%	0.78	S	S	*	*			trans	-111.9	142.3	179.7	-51.5	0	0	0	0	114.2
138	P	34.3	Very low	30.9	Very low	132 Å²	132	137.1 Å²	137.1	86%	0.857	78%	0.78	S	S	*	*			trans	-84.9	167.9	172.1	34.6	-34.4	0	0	0	113.6
139	S	30.5	Very low	30.9	Very low	90 Å²	90	140.9 Å²	140.9	63%	0.629	79%	0.786	S	S	*	*			trans	-104.2	167.4	-164.5	88.6	0	0	0	0	116.2	S141	S139-S141 VanDerWaalsContact C-N 3.34Å; S139-S141 PolarHBondContact O-N 2.94Å
140	L	34.4	Very low	31.7	Very low	186 Å²	186	144 Å²	144	97%	0.974	79%	0.791	S	S	*	*	T	Hydrogen-bonded Turn	trans	-83.7	18.8	-168.5	-76.5	164.9	0	0	0	116.2
141	S	36.9	Very low	32	Very low	93 Å²	93	140.2 Å²	140.2	65%	0.65	78%	0.779	S	S	*	*	T	Hydrogen-bonded Turn	trans	-94.8	-25.8	-166.2	-58.3	0	0	0	0	116	S139	S139-S141 VanDerWaalsContact C-N 3.34Å; S139-S141 PolarHBondContact O-N 2.94Å
142	D	31.6	Very low	32.6	Very low	147 Å²	147	141 Å²	141	79%	0.786	79%	0.789	S	S	*	*	S	Bend	trans	-105.1	20.6	-156.9	-60.3	-48.9	0	0	0	116.2
143	Q	36.7	Very low	33	Very low	186 Å²	186	137.8 Å²	137.8	87%	0.869	79%	0.791	S	S	*	*	S	Bend	trans	-124.8	27.8	-175.5	-65	-165.7	15.8	0	0	115.8
144	L	38	Very low	33.6	Very low	161 Å²	161	137.9 Å²	137.9	84%	0.843	80%	0.797	S	S	*	*			trans	-134.8	54.5	-179.6	-74.8	178.4	0	0	0	115.5
145	F	32.5	Very low	34.3	Very low	206 Å²	206	132.8 Å²	132.8	90%	0.904	79%	0.789	S	S	*	*			trans	-142.6	147.1	151.8	-95.6	-75.7	0	0	0	111.5
146	L	30.1	Very low	35.6	Very low	177 Å²	177	131.9 Å²	131.9	93%	0.927	78%	0.779	S	S	*	*			trans	66.9	138.8	-169	-45.4	178.8	0	0	0	114.1
147	G	27.1	Very low	37.3	Very low	69 Å²	69	131.8 Å²	131.8	71%	0.711	77%	0.769	S	S	*	*			cis	165	89.6	-10.5	0	0	0	0	0	114.9
148	R	38.3	Very low	39.8	Very low	211 Å²	211	128.6 Å²	128.6	80%	0.796	75%	0.745	S	S	*	*			trans	59.9	111.2	164.4	-175.9	-171.3	178.6	-169.2	-2.2	116.9	E150	R148-E150 IonicContact CZ-OE2 2.98Å; R148-E150 IonicContact NE-OE2 2.81Å; R148-E150 IonicContact NH2-OE2 3.67Å; R148-E150 PolarHBondContact NH2-OE2 3.31Å
149	E	27.6	Very low	42.6	Very low	186 Å²	186	128 Å²	128	87%	0.869	73%	0.73	S	S	*	*			trans	-131.5	140.4	155.7	-94.3	-72.7	86.2	0	0	109.4
150	E	42.5	Very low	45.6	Very low	160 Å²	160	123.8 Å²	123.8	75%	0.748	70%	0.701	S	S	*	*			trans	-97.9	87.7	175.7	-75.3	179.8	76.4	0	0	109.9	R148	R148-E150 IonicContact CZ-OE2 2.98Å; R148-E150 IonicContact NE-OE2 2.81Å; R148-E150 IonicContact NH2-OE2 3.67Å; R148-E150 PolarHBondContact NH2-OE2 3.31Å
151	G	33.4	Very low	48.3	Very low	55 Å²	55	123.1 Å²	123.1	57%	0.567	69%	0.685	S	S	*	*			trans	-133.4	138.7	-171.6	0	0	0	0	0	115.5	G153	G151-G153 PolarHBondContact O-N 3.07Å; G151-G153 VanDerWaalsContact O-N 3.08Å
152	T	38.7	Very low	51.1	Low	149 Å²	149	118.7 Å²	118.7	91%	0.914	65%	0.654	S	S	*	*			trans	38.3	57.9	146.6	51.1	0	0	0	0	117.9	A154	T152-A154 PolarHBondContact O-N 2.98Å
153	G	33.7	Very low	54.1	Low	77 Å²	77	111.9 Å²	111.9	79%	0.794	62%	0.618	S	S	*	*			trans	-60.4	93.5	166.5	0	0	0	0	0	112.2	G151 G155	G151-G153 PolarHBondContact O-N 3.07Å; G151-G153 VanDerWaalsContact O-N 3.08Å; G153-G155 VanDerWaalsContact C-N 3.34Å; G153-G155 PolarHBondContact O-N 3.44Å
154	A	40.4	Very low	56.6	Low	91 Å²	91	104.9 Å²	104.9	75%	0.752	60%	0.596	S	S	*	*			trans	-61.7	91	176.4	0	0	0	0	0	110.3	T152 I156	T152-A154 PolarHBondContact O-N 2.98Å; A154-I156 PolarHBondContact O-N 3.04Å
155	G	43.5	Very low	59.2	Low	59 Å²	59	98.3 Å²	98.3	61%	0.608	56%	0.562	S	S	*	*			trans	-72.5	87.4	-165.1	0	0	0	0	0	113.5	G153 N157	G153-G155 VanDerWaalsContact C-N 3.34Å; G153-G155 PolarHBondContact O-N 3.44Å; G155-N157 PolarHBondContact O-N 3.44Å; G155-N157 VanDerWaalsContact O-N 3.08Å
156	I	54.8	Low	62.1	Low	101 Å²	101	94.2 Å²	94.2	52%	0.518	54%	0.544	S	S	.	.			trans	-43.2	116.9	169.6	-54.1	177	0	0	0	108.5	A154 V158 L246	A154-I156 PolarHBondContact O-N 3.04Å; I156-V158 HydrophobicContact CB-CG2 4.34Å; I156-V158 HydrophobicContact CG2-CG2 3.73Å; I156-V158 PolarHBondContact O-N 2.88Å; I156-L246 HydrophobicContact CG2-CD2 3.46Å; I156-L246 VanDerWaalsContact CG2-CD2 3.46Å
157	N	67.5	Low	65	Low	112 Å²	112	86.6 Å²	86.6	60%	0.599	51%	0.506	S	S	*	.			trans	-84	58.9	-164.9	-163.9	52.7	0	0	0	112.1	G155 K166	G155-N157 PolarHBondContact O-N 3.44Å; G155-N157 VanDerWaalsContact O-N 3.08Å; N157-K166 WeakPolarHBondContact OD1-CD 3.05Å; N157-K166 VanDerWaalsContact OD1-CE 3.25Å; N157-K166 WeakPolarHBondContact OD1-CE 3.03Å; N157-K166 PolarHBondContact OD1-NZ 3.01Å
158	V	84.3	Confident	68	Low	53 Å²	53	86.1 Å²	86.1	32%	0.321	49%	0.492	S	S	.	.			trans	-69.1	139.7	-177.3	-171.8	0	0	0	0	111	I156 A167 H175	I156-V158 HydrophobicContact CB-CG2 4.34Å; I156-V158 HydrophobicContact CG2-CG2 3.73Å; I156-V158 PolarHBondContact O-N 2.88Å; V158-A167 HydrophobicContact CB-CB 4.39Å; V158-A167 HydrophobicContact CG1-CB 4.44Å; V158-A167 VanDerWaalsContact O-CB 3.23Å; V158-A167 WeakPolarHBondContact O-CB 3.36Å; V158-A167 PolarHBondContact O-N 2.87Å; V158-H175 HydrophobicContact CG1-CB 3.96Å
159	E	91.1	Very high	70.2	Confident	119 Å²	119	77.4 Å²	77.4	56%	0.556	47%	0.467	S	S	*	.	B	Isolated β-bridge	trans	-95.4	152.9	179.6	-60.3	-158.2	154.6	0	0	114.3	R161	E159-R161 PolarHBondContact O-N 2.99Å
160	C	95.1	Very high	72.8	Confident	1 Å²	1	72 Å²	72	1%	0.007	44%	0.441	C	S	.	.			trans	-73.5	106.6	171.3	176.3	0	0	0	0	110.6	I162 C163 G164 D165 H175 C177	C160-I162 PolarHBondContact O-N 2.86Å; C160-C163 PolarHBondContact O-N 3.42Å; C160-C163 VanDerWaalsContact SG-SG 3.65Å; C160-G164 PolarHBondContact O-N 3.05Å; C160-D165 WeakPolarHBondContact CB-O 3.43Å; C160-D165 PolarHBondContact N-O 3.09Å; C160-H175 WeakPolarHBondContact CA-O 3.37Å; C160-C177 HydrophobicContact CB-CB 3.93Å; C160-C177 PolarHBondContact SG-N 3.2Å; C160-C177 VanDerWaalsContact SG-N 3.42Å; C160-C177 VanDerWaalsContact SG-SG 3.68Å
161	R	90.8	Very high	75	Confident	173 Å²	173	65.9 Å²	65.9	65%	0.653	41%	0.413	S	S	*	.	T	Hydrogen-bonded Turn	trans	-52.4	-26.6	179.8	-60.4	-72.6	-73.4	168.2	-3.8	113.7	E159 V174 H175 L222	E159-R161 PolarHBondContact O-N 2.99Å; R161-V174 HydrophobicContact CB-CG1 3.94Å; R161-V174 HydrophobicContact CG-CG1 4.14Å; R161-H175 HydrophobicContact CG-CB 4.47Å; R161-H175 PolarHBondContact N-O 3.16Å; R161-H175 VanDerWaalsContact N-O 3.15Å; R161-L222 HydrophobicContact CB-CD1 4.05Å; R161-L222 WeakPolarHBondContact O-CD1 3.45Å
162	I	95.4	Very high	77.5	Confident	0 Å²	0	65.1 Å²	65.1	0%	0	39%	0.393	C	S	.	.	T	Hydrogen-bonded Turn	trans	-72.8	-36.4	178	-58.5	75.7	0	0	0	111.7	C160 V174 A176 C180 I203 K218 L222 M224	C160-I162 PolarHBondContact O-N 2.86Å; I162-V174 HydrophobicContact CD1-CB 4.4Å; I162-V174 HydrophobicContact CD1-CG1 3.83Å; I162-A176 HydrophobicContact CD1-CB 4.21Å; I162-C180 HydrophobicContact CB-CB 4.3Å; I162-C180 HydrophobicContact CG2-CB 4.37Å; I162-I203 HydrophobicContact CG2-CG2 4.29Å; I162-I203 WeakPolarHBondContact O-CG2 3.36Å; I162-K218 WeakPolarHBondContact O-CD 3.24Å; I162-K218 VanDerWaalsContact O-CE 3.27Å; I162-K218 WeakPolarHBondContact O-CE 3.49Å; I162-K218 PolarHBondContact O-NZ 3.28Å; I162-L222 HydrophobicContact CG1-CD1 4.25Å; I162-M224 HydrophobicContact CD1-CE 4.2Å; I162-M224 HydrophobicContact CD1-CG 4.35Å; I162-M224 HydrophobicContact CD1-SD 3.72Å; I162-M224 HydrophobicContact CG1-SD 3.91Å
163	C	94.1	Very high	79.5	Confident	3 Å²	3	59.4 Å²	59.4	2%	0.02	36%	0.364	C	S	.	.	T	Hydrogen-bonded Turn	trans	-149.9	5.8	-168	70.9	0	0	0	0	118.8	C160 D165 I203 Q204 K205 R208	C160-C163 PolarHBondContact O-N 3.42Å; C160-C163 VanDerWaalsContact SG-SG 3.65Å; C163-D165 VanDerWaalsContact C-N 3.25Å; C163-D165 PolarHBondContact O-N 3.12Å; C163-I203 HydrophobicContact CB-CG2 4.07Å; C163-Q204 CarbonylContact O-C 3.59Å; C163-Q204 VanDerWaalsContact O-C 3.24Å; C163-Q204 WeakPolarHBondContact O-CA 3.26Å; C163-K205 PolarHBondContact O-N 3.1Å; C163-R208 HydrophobicContact CB-CB 4.25Å; C163-R208 PolarHBondContact SG-NH1 3.39Å
164	G	89.9	Confident	81.8	Confident	40 Å²	40	56.2 Å²	56.2	41%	0.412	33%	0.329	S	S	.	.	S	Bend	trans	65.9	24.9	179	0	0	0	0	0	114.3	C160	C160-G164 PolarHBondContact O-N 3.05Å
165	D	92.9	Very high	84	Confident	23 Å²	23	53.8 Å²	53.8	12%	0.123	30%	0.302	C	S	.	.	S	Bend	trans	-99.7	154.9	169.1	-163.5	6.6	0	0	0	109.2	C160 C163 A167 C177 K205 R208	C160-D165 WeakPolarHBondContact CB-O 3.43Å; C160-D165 PolarHBondContact N-O 3.09Å; C163-D165 VanDerWaalsContact C-N 3.25Å; C163-D165 PolarHBondContact O-N 3.12Å; D165-A167 PolarHBondContact O-N 3.12Å; D165-C177 HydrophobicContact CB-CB 4.13Å; D165-K205 HydrophobicContact CB-CB 4.35Å; D165-K205 HydrophobicContact CB-CD 4Å; D165-K205 HydrophobicContact CB-CG 4.07Å; D165-K205 WeakPolarHBondContact OD1-CD 3.21Å; D165-K205 WeakPolarHBondContact OD1-CE 3.33Å; D165-K205 IonicContact OD1-NZ 3.22Å; D165-K205 PolarHBondContact OD1-NZ 3.31Å; D165-R208 VanDerWaalsContact CB-NH1 3.31Å; D165-R208 IonicContact OD2-CZ 3.81Å; D165-R208 VanDerWaalsContact OD2-CZ 3.22Å; D165-R208 IonicContact OD2-NH1 2.69Å; D165-R208 PolarHBondContact OD2-NH1 3.06Å; D165-R208 IonicContact OD2-NH2 3.9Å; D165-R208 PolarHBondContact OD2-NH2 2.8Å
166	K	92.3	Very high	86.4	Confident	120 Å²	120	51 Å²	51	52%	0.522	27%	0.273	S	S	.	.	B	Isolated β-bridge	trans	-56.1	127	-176.9	-175.4	170.5	-177.2	165.6	0	110.4	N157 C177	N157-K166 WeakPolarHBondContact OD1-CD 3.05Å; N157-K166 VanDerWaalsContact OD1-CE 3.25Å; N157-K166 WeakPolarHBondContact OD1-CE 3.03Å; N157-K166 PolarHBondContact OD1-NZ 3.01Å; K166-C177 WeakPolarHBondContact O-CB 3.31Å
167	A	91.1	Very high	88.3	Confident	16 Å²	16	46.3 Å²	46.3	13%	0.132	25%	0.249	C	C	.	.	P	Polyproline II helix	trans	-69.8	140.3	175.7	0	0	0	0	0	110	V158 D165 H175 A176	V158-A167 HydrophobicContact CB-CB 4.39Å; V158-A167 HydrophobicContact CG1-CB 4.44Å; V158-A167 VanDerWaalsContact O-CB 3.23Å; V158-A167 WeakPolarHBondContact O-CB 3.36Å; V158-A167 PolarHBondContact O-N 2.87Å; D165-A167 PolarHBondContact O-N 3.12Å; A167-H175 HydrophobicContact CB-CB 4.44Å; A167-A176 CarbonylContact C-O 3.57Å; A167-A176 WeakPolarHBondContact CA-O 3.12Å
168	S	90.8	Very high	89.7	Confident	59 Å²	59	45.7 Å²	45.7	41%	0.413	24%	0.243	S	C	.	.			trans	-95.8	3.3	171.2	54.7	0	0	0	0	112.2	H171 A176 E178	S168-H171 PolarHBondContact OG-NE2 3Å; S168-A176 PolarHBondContact N-O 3.24Å; S168-A176 PolarHBondContact OG-O 2.93Å; S168-E178 VanDerWaalsContact CB-OE1 3.24Å; S168-E178 WeakPolarHBondContact CB-OE1 3.47Å; S168-E178 PolarHBondContact OG-N 3.27Å; S168-E178 PolarHBondContact OG-OE1 3.01Å
169	G	84.7	Confident	90.3	Very high	28 Å²	28	44.7 Å²	44.7	29%	0.289	24%	0.243	S	C	.	.	E	Extended strand (participates in β ladder)	trans	148.1	-167.3	-179.2	0	0	0	0	0	112.6	H171 H175 A176	G169-H171 PolarHBondContact N-NE2 3.35Å; G169-H171 PolarHBondContact O-CD2 3.23Å; G169-H175 WeakPolarHBondContact O-CA 3.34Å; G169-A176 PolarHBondContact O-N 3.41Å
170	F	81.8	Confident	90.6	Very high	73 Å²	73	39 Å²	39	32%	0.32	22%	0.217	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-97.3	112.3	173	-166.6	-104.4	0	0	0	108.4	G173 H175 M234	F170-G173 WeakPolarHBondContact CE2-O 3.38Å; F170-G173 WeakPolarHBondContact CZ-O 3.43Å; F170-H175 AromaticContact CD2-CD2 3.88Å; F170-H175 AromaticContact CD2-CE1 3.93Å; F170-H175 AromaticContact CD2-NE2 3.82Å; F170-M234 HydrophobicContact CB-CE 4.36Å; F170-M234 HydrophobicContact CD2-CE 4.41Å; F170-M234 HydrophobicContact CG-CE 4.43Å
171	H	88.9	Confident	90.6	Very high	32 Å²	32	41.2 Å²	41.2	15%	0.148	23%	0.226	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-127.4	129.6	-172.4	-56.8	-79.4	0	0	0	109.8	S168 G169 G173 V174 A176 E178 K181 M224	S168-H171 PolarHBondContact OG-NE2 3Å; G169-H171 PolarHBondContact N-NE2 3.35Å; G169-H171 PolarHBondContact O-CD2 3.23Å; H171-G173 PolarHBondContact O-N 2.99Å; H171-V174 PolarHBondContact N-O 2.95Å; H171-V174 PolarHBondContact O-N 2.95Å; H171-V174 VanDerWaalsContact O-N 3.1Å; H171-V174 VanDerWaalsContact O-O 3.05Å; H171-A176 HydrophobicContact CB-CB 4.37Å; H171-A176 PolarHBondContact CD2-O 3.16Å; H171-E178 IonicContact CE1-OE1 3.46Å; H171-E178 IonicContact NE2-OE1 3.55Å; H171-K181 HydrophobicContact CB-CB 4.21Å; H171-K181 HydrophobicContact CB-CD 4.49Å; H171-K181 HydrophobicContact CB-CG 3.98Å; H171-K181 VanDerWaalsContact CE1-CE 3.44Å; H171-K181 WeakPolarHBondContact CE1-CE 3.31Å; H171-K181 WeakPolarHBondContact ND1-CD 3.43Å; H171-K181 VanDerWaalsContact ND1-CE 3.27Å; H171-K181 WeakPolarHBondContact ND1-CE 3.24Å; H171-M224 WeakPolarHBondContact O-CE 3.46Å
172	Y	85.5	Confident	90.9	Very high	39 Å²	39	34.1 Å²	34.1	15%	0.153	21%	0.207	C	C	.	.	T	Hydrogen-bonded Turn	trans	56.5	27.3	179.1	-55.3	-75.7	0	0	0	114.2	K181 F184 R185 M224 S225 I229	Y172-K181 HydrophobicContact CE2-CG 3.96Å; Y172-F184 AromaticContact CD1-CD1 3.96Å; Y172-F184 HydrophobicContact CD1-CD1 3.96Å; Y172-F184 AromaticContact CD1-CE1 3.79Å; Y172-F184 HydrophobicContact CD1-CE1 3.79Å; Y172-F184 AromaticContact CD2-CD1 3.72Å; Y172-F184 HydrophobicContact CD2-CD1 3.72Å; Y172-F184 HydrophobicContact CD2-CE1 4.31Å; Y172-F184 HydrophobicContact CE1-CD1 4.4Å; Y172-F184 HydrophobicContact CE1-CE1 4.47Å; Y172-F184 HydrophobicContact CE2-CD1 4.19Å; Y172-F184 AromaticContact CG-CD1 3.61Å; Y172-F184 HydrophobicContact CG-CD1 3.61Å; Y172-F184 AromaticContact CG-CE1 3.71Å; Y172-F184 HydrophobicContact CG-CE1 3.71Å; Y172-R185 HydrophobicContact CE2-CB 4.31Å; Y172-R185 WeakPolarHBondContact OH-CB 3.12Å; Y172-R185 VanDerWaalsContact OH-CD 3.31Å; Y172-R185 WeakPolarHBondContact OH-CD 3.49Å; Y172-R185 WeakPolarHBondContact OH-CG 3.42Å; Y172-M224 HydrophobicContact CD2-CE 4.29Å; Y172-M224 CarbonylContact O-C 3.51Å; Y172-M224 VanDerWaalsContact O-CA 3.3Å; Y172-M224 WeakPolarHBondContact O-CA 3.44Å; Y172-S225 WeakPolarHBondContact CB-O 3.47Å; Y172-S225 PolarHBondContact O-N 2.87Å; Y172-I229 HydrophobicContact CD1-CD1 4.19Å; Y172-I229 HydrophobicContact CD1-CG1 3.73Å; Y172-I229 HydrophobicContact CE1-CD1 3.69Å; Y172-I229 HydrophobicContact CE1-CG1 3.58Å
173	G	80.9	Confident	91	Very high	29 Å²	29	35.3 Å²	35.3	30%	0.299	21%	0.212	S	C	.	.	T	Hydrogen-bonded Turn	trans	93.1	3.3	-177.8	0	0	0	0	0	115.6	F170 H171	F170-G173 WeakPolarHBondContact CE2-O 3.38Å; F170-G173 WeakPolarHBondContact CZ-O 3.43Å; H171-G173 PolarHBondContact O-N 2.99Å
174	V	82.6	Confident	91.1	Very high	9 Å²	9	35.2 Å²	35.2	6%	0.055	21%	0.211	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-140.3	144.2	-176.5	-167.8	0	0	0	0	111.9	R161 I162 H171 A176 L222 M224	R161-V174 HydrophobicContact CB-CG1 3.94Å; R161-V174 HydrophobicContact CG-CG1 4.14Å; I162-V174 HydrophobicContact CD1-CB 4.4Å; I162-V174 HydrophobicContact CD1-CG1 3.83Å; H171-V174 PolarHBondContact N-O 2.95Å; H171-V174 PolarHBondContact O-N 2.95Å; H171-V174 VanDerWaalsContact O-N 3.1Å; H171-V174 VanDerWaalsContact O-O 3.05Å; V174-A176 PolarHBondContact O-N 3.09Å; V174-L222 WeakPolarHBondContact CG2-O 3.16Å; V174-M224 HydrophobicContact CB-CE 4.47Å; V174-M224 HydrophobicContact CB-CG 3.94Å; V174-M224 HydrophobicContact CG2-CB 4.33Å; V174-M224 HydrophobicContact CG2-CG 3.51Å
175	H	85.9	Confident	91.4	Very high	41 Å²	41	40.3 Å²	40.3	19%	0.19	22%	0.218	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-61.5	116.7	167.5	-74.7	-70.4	0	0	0	111	V158 C160 R161 A167 G169 F170	V158-H175 HydrophobicContact CG1-CB 3.96Å; C160-H175 WeakPolarHBondContact CA-O 3.37Å; R161-H175 HydrophobicContact CG-CB 4.47Å; R161-H175 PolarHBondContact N-O 3.16Å; R161-H175 VanDerWaalsContact N-O 3.15Å; A167-H175 HydrophobicContact CB-CB 4.44Å; G169-H175 WeakPolarHBondContact O-CA 3.34Å; F170-H175 AromaticContact CD2-CD2 3.88Å; F170-H175 AromaticContact CD2-CE1 3.93Å; F170-H175 AromaticContact CD2-NE2 3.82Å
176	A	92.9	Very high	91.5	Very high	0 Å²	0	47 Å²	47	0%	0	24%	0.241	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-144.1	152.5	-170.5	0	0	0	0	0	113.5	I162 A167 S168 G169 H171 V174 M224	I162-A176 HydrophobicContact CD1-CB 4.21Å; A167-A176 CarbonylContact C-O 3.57Å; A167-A176 WeakPolarHBondContact CA-O 3.12Å; S168-A176 PolarHBondContact N-O 3.24Å; S168-A176 PolarHBondContact OG-O 2.93Å; G169-A176 PolarHBondContact O-N 3.41Å; H171-A176 HydrophobicContact CB-CB 4.37Å; H171-A176 PolarHBondContact CD2-O 3.16Å; V174-A176 PolarHBondContact O-N 3.09Å; A176-M224 HydrophobicContact CB-CE 3.69Å
177	C	96.4	Very high	91.8	Very high	3 Å²	3	41.3 Å²	41.3	2%	0.02	22%	0.217	C	C	.	.			trans	-84.8	158.7	169.3	66.3	0	0	0	0	110.6	C160 D165 K166 G179 C180 K181 R208	C160-C177 HydrophobicContact CB-CB 3.93Å; C160-C177 PolarHBondContact SG-N 3.2Å; C160-C177 VanDerWaalsContact SG-N 3.42Å; C160-C177 VanDerWaalsContact SG-SG 3.68Å; D165-C177 HydrophobicContact CB-CB 4.13Å; K166-C177 WeakPolarHBondContact O-CB 3.31Å; C177-G179 PolarHBondContact O-N 2.9Å; C177-G179 VanDerWaalsContact O-N 3.1Å; C177-C180 PolarHBondContact O-N 3.17Å; C177-C180 PolarHBondContact SG-N 2.86Å; C177-K181 WeakPolarHBondContact O-CB 3.39Å; C177-K181 PolarHBondContact O-N 2.69Å; C177-R208 PolarHBondContact SG-NH1 3.26Å
178	E	96.3	Very high	91.8	Very high	99 Å²	99	43.4 Å²	43.4	46%	0.463	23%	0.225	S	C	.	.	H	α-helix	trans	-51.5	-35.9	175.2	-68.7	-55.3	116	0	0	112.6	S168 H171 C180 K181 G182	S168-E178 VanDerWaalsContact CB-OE1 3.24Å; S168-E178 WeakPolarHBondContact CB-OE1 3.47Å; S168-E178 PolarHBondContact OG-N 3.27Å; S168-E178 PolarHBondContact OG-OE1 3.01Å; H171-E178 IonicContact CE1-OE1 3.46Å; H171-E178 IonicContact NE2-OE1 3.55Å; E178-C180 PolarHBondContact O-N 2.72Å; E178-K181 VanDerWaalsContact OE1-CD 3.24Å; E178-K181 WeakPolarHBondContact OE1-CD 3.33Å; E178-K181 IonicContact OE1-NZ 2.69Å; E178-K181 PolarHBondContact OE1-NZ 3.46Å; E178-K181 VanDerWaalsContact OE2-CD 3.3Å; E178-K181 WeakPolarHBondContact OE2-CD 3.37Å; E178-K181 WeakPolarHBondContact OE2-CE 3.4Å; E178-K181 IonicContact OE2-NZ 2.72Å; E178-K181 PolarHBondContact OE2-NZ 2.83Å; E178-G182 PolarHBondContact O-N 2.9Å
179	G	97	Very high	91.9	Very high	32 Å²	32	51.1 Å²	51.1	33%	0.33	25%	0.246	S	C	.	.	H	α-helix	trans	-64	-33.3	178.3	0	0	0	0	0	114.4	C177 F183 R215	C177-G179 PolarHBondContact O-N 2.9Å; C177-G179 VanDerWaalsContact O-N 3.1Å; G179-F183 WeakPolarHBondContact O-CB 3.28Å; G179-F183 PolarHBondContact O-N 2.94Å; G179-R215 PolarHBondContact O-NH2 3.1Å
180	C	97.4	Very high	92.4	Very high	0 Å²	0	55.7 Å²	55.7	0%	0	26%	0.261	C	S	.	.	H	α-helix	trans	-91.1	-38.2	177.3	-73.4	0	0	0	0	112.3	I162 C177 E178 G182 F183 F184	I162-C180 HydrophobicContact CB-CB 4.3Å; I162-C180 HydrophobicContact CG2-CB 4.37Å; C177-C180 PolarHBondContact O-N 3.17Å; C177-C180 PolarHBondContact SG-N 2.86Å; E178-C180 PolarHBondContact O-N 2.72Å; C180-G182 PolarHBondContact O-N 3.09Å; C180-F183 PolarHBondContact O-N 2.98Å; C180-F184 WeakPolarHBondContact O-CB 3.41Å; C180-F184 PolarHBondContact O-N 3.11Å
181	K	95.5	Very high	92.9	Very high	46 Å²	46	61 Å²	61	20%	0.2	28%	0.284	C	S	.	.	H	α-helix	trans	-52.3	-51.5	168	172.9	-159	-174.4	-173.9	0	111.7	H171 Y172 C177 E178 R185	H171-K181 HydrophobicContact CB-CB 4.21Å; H171-K181 HydrophobicContact CB-CD 4.49Å; H171-K181 HydrophobicContact CB-CG 3.98Å; H171-K181 VanDerWaalsContact CE1-CE 3.44Å; H171-K181 WeakPolarHBondContact CE1-CE 3.31Å; H171-K181 WeakPolarHBondContact ND1-CD 3.43Å; H171-K181 VanDerWaalsContact ND1-CE 3.27Å; H171-K181 WeakPolarHBondContact ND1-CE 3.24Å; Y172-K181 HydrophobicContact CE2-CG 3.96Å; C177-K181 WeakPolarHBondContact O-CB 3.39Å; C177-K181 PolarHBondContact O-N 2.69Å; E178-K181 VanDerWaalsContact OE1-CD 3.24Å; E178-K181 WeakPolarHBondContact OE1-CD 3.33Å; E178-K181 IonicContact OE1-NZ 2.69Å; E178-K181 PolarHBondContact OE1-NZ 3.46Å; E178-K181 VanDerWaalsContact OE2-CD 3.3Å; E178-K181 WeakPolarHBondContact OE2-CD 3.37Å; E178-K181 WeakPolarHBondContact OE2-CE 3.4Å; E178-K181 IonicContact OE2-NZ 2.72Å; E178-K181 PolarHBondContact OE2-NZ 2.83Å; K181-R185 VanDerWaalsContact O-CB 3.28Å; K181-R185 WeakPolarHBondContact O-CB 3.09Å; K181-R185 PolarHBondContact O-N 3.19Å
182	G	96.3	Very high	93.2	Very high	25 Å²	25	62.3 Å²	62.3	26%	0.258	29%	0.291	S	S	.	.	H	α-helix	trans	-68	-35.3	-179.9	0	0	0	0	0	113.6	E178 C180 R186	E178-G182 PolarHBondContact O-N 2.9Å; C180-G182 PolarHBondContact O-N 3.09Å; G182-R186 WeakPolarHBondContact O-CB 3.44Å; G182-R186 PolarHBondContact O-N 3.07Å; G182-R186 VanDerWaalsContact O-N 3.16Å
183	F	98.1	Very high	93.6	Very high	24 Å²	24	69.4 Å²	69.4	11%	0.105	33%	0.326	C	S	.	.	H	α-helix	trans	-63.7	-57.5	172.8	172	-98.3	0	0	0	111	G179 C180 R185 R186 T187 Y194 Q212 R215 F216	G179-F183 WeakPolarHBondContact O-CB 3.28Å; G179-F183 PolarHBondContact O-N 2.94Å; C180-F183 PolarHBondContact O-N 2.98Å; F183-R185 PolarHBondContact O-N 2.81Å; F183-R186 WeakPolarHBondContact O-CB 3.44Å; F183-R186 PolarHBondContact O-N 3.26Å; F183-T187 PolarHBondContact O-N 3.25Å; F183-T187 PolarHBondContact O-OG1 3.34Å; F183-T187 VanDerWaalsContact O-OG1 3.12Å; F183-Y194 HydrophobicContact CE2-CE2 4.17Å; F183-Y194 AromaticContact CZ-CE2 3.69Å; F183-Y194 HydrophobicContact CZ-CE2 3.69Å; F183-Q212 HydrophobicContact CE2-CB 4.34Å; F183-Q212 HydrophobicContact CE2-CG 4.35Å; F183-Q212 HydrophobicContact CZ-CB 4.38Å; F183-R215 HydrophobicContact CD1-CG 4.07Å; F183-R215 HydrophobicContact CE1-CB 4.11Å; F183-R215 HydrophobicContact CE1-CG 3.8Å; F183-R215 HydrophobicContact CZ-CB 4.22Å; F183-R215 HydrophobicContact CZ-CG 4.27Å; F183-F216 HydrophobicContact CE1-CB 3.82Å; F183-F216 HydrophobicContact CE1-CD2 4.24Å; F183-F216 HydrophobicContact CE1-CG 4.48Å; F183-F216 HydrophobicContact CZ-CB 4.01Å
184	F	96.5	Very high	94.3	Very high	2 Å²	2	70 Å²	70	1%	0.009	32%	0.319	C	S	.	.	H	α-helix	trans	-55.5	-48.3	-179.9	-178	-99.7	0	0	0	111.9	Y172 C180 R186 T187 I188 F216 C219 L220 M224	Y172-F184 AromaticContact CD1-CD1 3.96Å; Y172-F184 HydrophobicContact CD1-CD1 3.96Å; Y172-F184 AromaticContact CD1-CE1 3.79Å; Y172-F184 HydrophobicContact CD1-CE1 3.79Å; Y172-F184 AromaticContact CD2-CD1 3.72Å; Y172-F184 HydrophobicContact CD2-CD1 3.72Å; Y172-F184 HydrophobicContact CD2-CE1 4.31Å; Y172-F184 HydrophobicContact CE1-CD1 4.4Å; Y172-F184 HydrophobicContact CE1-CE1 4.47Å; Y172-F184 HydrophobicContact CE2-CD1 4.19Å; Y172-F184 AromaticContact CG-CD1 3.61Å; Y172-F184 HydrophobicContact CG-CD1 3.61Å; Y172-F184 AromaticContact CG-CE1 3.71Å; Y172-F184 HydrophobicContact CG-CE1 3.71Å; C180-F184 WeakPolarHBondContact O-CB 3.41Å; C180-F184 PolarHBondContact O-N 3.11Å; F184-R186 VanDerWaalsContact C-N 3.27Å; F184-R186 PolarHBondContact O-N 2.93Å; F184-T187 PolarHBondContact O-N 3.35Å; F184-I188 HydrophobicContact CD1-CG1 4.34Å; F184-I188 HydrophobicContact CD2-CG1 4.46Å; F184-I188 HydrophobicContact CE1-CG1 3.97Å; F184-I188 HydrophobicContact CE2-CD1 4.25Å; F184-I188 HydrophobicContact CE2-CG1 4.1Å; F184-I188 HydrophobicContact CZ-CD1 4.15Å; F184-I188 HydrophobicContact CZ-CG1 3.83Å; F184-I188 WeakPolarHBondContact O-CG1 3.27Å; F184-I188 PolarHBondContact O-N 2.85Å; F184-F216 HydrophobicContact CD2-CD2 4.15Å; F184-F216 AromaticContact CD2-CE2 3.75Å; F184-F216 HydrophobicContact CD2-CE2 3.75Å; F184-F216 AromaticContact CE2-CE2 3.85Å; F184-F216 HydrophobicContact CE2-CE2 3.85Å; F184-C219 HydrophobicContact CD2-CB 3.84Å; F184-C219 HydrophobicContact CE2-CB 4.42Å; F184-L220 HydrophobicContact CE2-CD2 4.02Å; F184-M224 HydrophobicContact CB-SD 4.33Å; F184-M224 HydrophobicContact CD1-CB 4.43Å; F184-M224 HydrophobicContact CD2-CB 3.91Å; F184-M224 HydrophobicContact CD2-SD 4.44Å; F184-M224 HydrophobicContact CE1-CB 4.24Å; F184-M224 HydrophobicContact CE2-CB 3.69Å; F184-M224 WeakPolarHBondContact CE2-O 3.39Å; F184-M224 HydrophobicContact CG-CB 4.28Å; F184-M224 HydrophobicContact CG-SD 4.32Å; F184-M224 VanDerWaalsContact CZ-C 3.49Å; F184-M224 HydrophobicContact CZ-CB 3.88Å; F184-M224 WeakPolarHBondContact CZ-O 3.3Å
185	R	94.9	Very high	94.9	Very high	146 Å²	146	78.4 Å²	78.4	55%	0.551	36%	0.358	S	S	*	.	H	α-helix	trans	-56	-38.9	175.6	-173.5	177.6	68.2	175.3	-0.8	112.8	Y172 K181 F183 R189	Y172-R185 HydrophobicContact CE2-CB 4.31Å; Y172-R185 WeakPolarHBondContact OH-CB 3.12Å; Y172-R185 VanDerWaalsContact OH-CD 3.31Å; Y172-R185 WeakPolarHBondContact OH-CD 3.49Å; Y172-R185 WeakPolarHBondContact OH-CG 3.42Å; K181-R185 VanDerWaalsContact O-CB 3.28Å; K181-R185 WeakPolarHBondContact O-CB 3.09Å; K181-R185 PolarHBondContact O-N 3.19Å; F183-R185 PolarHBondContact O-N 2.81Å; R185-R189 WeakPolarHBondContact O-CB 3.44Å; R185-R189 PolarHBondContact O-N 3.44Å
186	R	96.6	Very high	95.3	Very high	163 Å²	163	85 Å²	85	62%	0.615	38%	0.381	S	S	*	.	H	α-helix	trans	-70.7	-47.8	178.3	-172.2	-175.2	-65.6	172	-1.8	111	G182 F183 F184 I188 R189 M190 L192	G182-R186 WeakPolarHBondContact O-CB 3.44Å; G182-R186 PolarHBondContact O-N 3.07Å; G182-R186 VanDerWaalsContact O-N 3.16Å; F183-R186 WeakPolarHBondContact O-CB 3.44Å; F183-R186 PolarHBondContact O-N 3.26Å; F184-R186 VanDerWaalsContact C-N 3.27Å; F184-R186 PolarHBondContact O-N 2.93Å; R186-I188 PolarHBondContact O-N 2.98Å; R186-R189 PolarHBondContact O-N 3.29Å; R186-M190 HydrophobicContact CG-CG 4.47Å; R186-M190 HydrophobicContact CG-SD 3.63Å; R186-M190 WeakPolarHBondContact O-CB 3.44Å; R186-M190 PolarHBondContact O-N 2.85Å; R186-L192 HydrophobicContact CG-CD1 4.21Å
187	T	96.7	Very high	95.3	Very high	2 Å²	2	86.6 Å²	86.6	1%	0.012	39%	0.392	C	S	.	.	H	α-helix	trans	-56.8	-48.1	179.3	-51.1	0	0	0	0	111.3	F183 F184 K191 L192 Y194 F216	F183-T187 PolarHBondContact O-N 3.25Å; F183-T187 PolarHBondContact O-OG1 3.34Å; F183-T187 VanDerWaalsContact O-OG1 3.12Å; F184-T187 PolarHBondContact O-N 3.35Å; T187-K191 WeakPolarHBondContact O-CA 3.43Å; T187-K191 PolarHBondContact O-N 3.38Å; T187-L192 HydrophobicContact CG2-CB 4.2Å; T187-L192 WeakPolarHBondContact CG2-O 3.32Å; T187-L192 PolarHBondContact O-N 2.96Å; T187-Y194 HydrophobicContact CG2-CD2 4.46Å; T187-Y194 HydrophobicContact CG2-CE2 3.55Å; T187-Y194 PolarHBondContact OG1-OH 3.32Å; T187-F216 HydrophobicContact CG2-CD1 3.92Å; T187-F216 HydrophobicContact CG2-CD2 3.65Å; T187-F216 HydrophobicContact CG2-CE1 3.77Å; T187-F216 HydrophobicContact CG2-CE2 3.5Å; T187-F216 HydrophobicContact CG2-CG 3.86Å; T187-F216 HydrophobicContact CG2-CZ 3.57Å
188	I	93.1	Very high	95.1	Very high	59 Å²	59	94.6 Å²	94.6	30%	0.303	43%	0.429	S	S	.	.	H	α-helix	trans	-67	-53.3	177.7	-59.7	-62.9	0	0	0	111.6	F184 R186 M190 K191 F216 H226	F184-I188 HydrophobicContact CD1-CG1 4.34Å; F184-I188 HydrophobicContact CD2-CG1 4.46Å; F184-I188 HydrophobicContact CE1-CG1 3.97Å; F184-I188 HydrophobicContact CE2-CD1 4.25Å; F184-I188 HydrophobicContact CE2-CG1 4.1Å; F184-I188 HydrophobicContact CZ-CD1 4.15Å; F184-I188 HydrophobicContact CZ-CG1 3.83Å; F184-I188 WeakPolarHBondContact O-CG1 3.27Å; F184-I188 PolarHBondContact O-N 2.85Å; R186-I188 PolarHBondContact O-N 2.98Å; I188-M190 VanDerWaalsContact C-N 3.28Å; I188-M190 PolarHBondContact O-N 3.43Å; I188-K191 PolarHBondContact O-N 3.35Å; I188-K191 VanDerWaalsContact O-N 3.15Å; I188-F216 HydrophobicContact CD1-CE2 4.08Å; I188-F216 HydrophobicContact CD1-CZ 3.81Å; I188-F216 HydrophobicContact CG1-CE2 4.5Å; I188-H226 HydrophobicContact CG2-CB 4.34Å
189	R	92.3	Very high	94.5	Very high	222 Å²	222	99.6 Å²	99.6	84%	0.838	44%	0.444	S	S	*	.	H	α-helix	trans	-62.3	-33.3	-174.6	-178.2	175.8	175.8	-178.7	-0.5	113.3	R185 R186	R185-R189 WeakPolarHBondContact O-CB 3.44Å; R185-R189 PolarHBondContact O-N 3.44Å; R186-R189 PolarHBondContact O-N 3.29Å
190	M	94.4	Very high	94	Very high	123 Å²	123	103.9 Å²	103.9	61%	0.606	47%	0.469	S	S	*	.	T	Hydrogen-bonded Turn	trans	-99.9	4.5	-179.4	-61.8	177.5	68.1	0	0	113.2	R186 I188 L192	R186-M190 HydrophobicContact CG-CG 4.47Å; R186-M190 HydrophobicContact CG-SD 3.63Å; R186-M190 WeakPolarHBondContact O-CB 3.44Å; R186-M190 PolarHBondContact O-N 2.85Å; I188-M190 VanDerWaalsContact C-N 3.28Å; I188-M190 PolarHBondContact O-N 3.43Å; M190-L192 VanDerWaalsContact C-N 3.29Å; M190-L192 HydrophobicContact CB-CD1 4.42Å; M190-L192 HydrophobicContact CB-CD2 3.8Å; M190-L192 HydrophobicContact CB-CG 3.83Å; M190-L192 PolarHBondContact O-N 3.28Å
191	K	92.3	Very high	93.8	Very high	186 Å²	186	106.2 Å²	106.2	81%	0.809	48%	0.484	S	S	*	.	T	Hydrogen-bonded Turn	trans	46.2	49.7	-174.8	-59.7	-174.4	179	-175.4	0	112.7	T187 I188 E193	T187-K191 WeakPolarHBondContact O-CA 3.43Å; T187-K191 PolarHBondContact O-N 3.38Å; I188-K191 PolarHBondContact O-N 3.35Å; I188-K191 VanDerWaalsContact O-N 3.15Å; K191-E193 PolarHBondContact O-N 3.44Å
192	L	95.3	Very high	93.6	Very high	58 Å²	58	110.1 Å²	110.1	30%	0.304	50%	0.501	S	S	.	.			trans	-77.8	113.6	-177.7	-56.3	179	0	0	0	110.5	R186 T187 M190 Y194	R186-L192 HydrophobicContact CG-CD1 4.21Å; T187-L192 HydrophobicContact CG2-CB 4.2Å; T187-L192 WeakPolarHBondContact CG2-O 3.32Å; T187-L192 PolarHBondContact O-N 2.96Å; M190-L192 VanDerWaalsContact C-N 3.29Å; M190-L192 HydrophobicContact CB-CD1 4.42Å; M190-L192 HydrophobicContact CB-CD2 3.8Å; M190-L192 HydrophobicContact CB-CG 3.83Å; M190-L192 PolarHBondContact O-N 3.28Å; L192-Y194 HydrophobicContact CB-CE1 4.05Å
193	E	93.9	Very high	93.5	Very high	188 Å²	188	109.4 Å²	109.4	88%	0.879	49%	0.492	S	S	*	.			trans	-84.3	143.9	167.1	-66.2	176.3	-170.8	0	0	109.7	K191	K191-E193 PolarHBondContact O-N 3.44Å
194	Y	96.1	Very high	93.3	Very high	41 Å²	41	112.5 Å²	112.5	16%	0.161	51%	0.507	C	S	.	.			trans	-122.8	137.6	179.3	-59.3	-52.5	0	0	0	109.4	F183 T187 L192 R196 Q212 F216	F183-Y194 HydrophobicContact CE2-CE2 4.17Å; F183-Y194 AromaticContact CZ-CE2 3.69Å; F183-Y194 HydrophobicContact CZ-CE2 3.69Å; T187-Y194 HydrophobicContact CG2-CD2 4.46Å; T187-Y194 HydrophobicContact CG2-CE2 3.55Å; T187-Y194 PolarHBondContact OG1-OH 3.32Å; L192-Y194 HydrophobicContact CB-CE1 4.05Å; Y194-R196 PolarHBondContact O-N 2.82Å; Y194-Q212 HydrophobicContact CD1-CB 3.68Å; Y194-Q212 HydrophobicContact CD2-CB 3.97Å; Y194-Q212 HydrophobicContact CE1-CB 3.8Å; Y194-Q212 HydrophobicContact CE1-CG 4.34Å; Y194-Q212 HydrophobicContact CE2-CB 4.06Å; Y194-Q212 HydrophobicContact CG-CB 3.8Å; Y194-F216 HydrophobicContact CD2-CB 4.02Å; Y194-F216 HydrophobicContact CD2-CD1 4.41Å; Y194-F216 HydrophobicContact CD2-CG 4.44Å; Y194-F216 HydrophobicContact CE2-CB 3.96Å; Y194-F216 HydrophobicContact CE2-CD1 4.49Å; Y194-F216 HydrophobicContact CE2-CG 4.24Å
195	E	94.4	Very high	93.1	Very high	186 Å²	186	118.1 Å²	118.1	87%	0.869	53%	0.531	S	S	*	.			trans	-51.6	133.6	175.4	-173.4	177.4	-163.3	0	0	111.3	C197 Y213	E195-C197 PolarHBondContact O-N 2.85Å; E195-C197 VanDerWaalsContact O-N 3.11Å; E195-Y213 VanDerWaalsContact O-CB 3.26Å; E195-Y213 WeakPolarHBondContact O-CB 3.33Å
196	R	94.1	Very high	92.9	Very high	179 Å²	179	118.4 Å²	118.4	68%	0.675	54%	0.536	S	S	*	.			trans	-67.3	111.5	-174.1	176.7	175.4	172.5	92.8	-4.5	110.3	Y194 Y213	Y194-R196 PolarHBondContact O-N 2.82Å; R196-Y213 HydrophobicContact CB-CE2 4.2Å; R196-Y213 HydrophobicContact CG-CE1 4.37Å; R196-Y213 HydrophobicContact CG-CE2 4.25Å; R196-Y213 PolarHBondContact NH1-OH 3.48Å; R196-Y213 VanDerWaalsContact NH1-OH 3.12Å
197	C	94.6	Very high	92.7	Very high	34 Å²	34	111.6 Å²	111.6	23%	0.23	51%	0.514	C	S	.	.			trans	-87.4	120.1	170.1	-166.1	0	0	0	0	110	E195 R199 Y213	E195-C197 PolarHBondContact O-N 2.85Å; E195-C197 VanDerWaalsContact O-N 3.11Å; C197-R199 VanDerWaalsContact C-N 3.27Å; C197-Y213 HydrophobicContact CB-CD1 3.75Å; C197-Y213 HydrophobicContact CB-CE1 4.49Å; C197-Y213 HydrophobicContact CB-CG 4.35Å; C197-Y213 VanDerWaalsContact N-CD1 3.31Å; C197-Y213 VanDerWaalsContact O-CE1 3.32Å; C197-Y213 WeakPolarHBondContact O-CE1 3.49Å
198	E	90.7	Very high	92.6	Very high	172 Å²	172	113.5 Å²	113.5	80%	0.804	52%	0.521	S	S	*	.			trans	-77.7	-15	174.8	-56	-173.7	139.4	0	0	112.7
199	R	83.4	Confident	92.7	Very high	204 Å²	204	116.7 Å²	116.7	77%	0.77	54%	0.538	S	S	*	.	S	Bend	trans	-85.3	120.7	178.9	-51	178.7	-170.6	-177.8	3.1	109	C197 C201 C214	C197-R199 VanDerWaalsContact C-N 3.27Å; R199-C201 PolarHBondContact O-N 3.49Å; R199-C201 PolarHBondContact O-SG 3.41Å; R199-C214 PolarHBondContact O-SG 3.21Å
200	S	86.9	Confident	92.9	Very high	122 Å²	122	115.1 Å²	115.1	85%	0.853	54%	0.537	S	S	*	.			trans	-69.4	69	176.4	-60.9	0	0	0	0	112.8	K202	S200-K202 PolarHBondContact O-N 2.97Å
201	C	93.3	Very high	93	Very high	48 Å²	48	110.2 Å²	110.2	32%	0.324	52%	0.515	S	S	.	.			trans	-63	124	-172.5	-59.9	0	0	0	0	112.8	R199 I203 C211 C214	R199-C201 PolarHBondContact O-N 3.49Å; R199-C201 PolarHBondContact O-SG 3.41Å; C201-I203 WeakPolarHBondContact O-CD1 3.32Å; C201-I203 WeakPolarHBondContact O-CG1 3.18Å; C201-I203 PolarHBondContact O-N 3Å; C201-C211 HydrophobicContact CB-CB 4.28Å; C201-C214 HydrophobicContact CB-CB 3.86Å
202	K	91.1	Very high	93.3	Very high	128 Å²	128	106.7 Å²	106.7	56%	0.557	50%	0.501	S	S	*	.			trans	-65.6	118.7	174.7	-61.8	-168.9	-177.6	-176.3	0	111.3	S200 S207 D483	S200-K202 PolarHBondContact O-N 2.97Å; K202-S207 PolarHBondContact O-OG 3.41Å; K202-D483 WeakPolarHBondContact CD-OD2 3.35Å; K202-D483 IonicContact NZ-OD1 3.76Å; K202-D483 PolarHBondContact NZ-OD1 3.02Å; K202-D483 IonicContact NZ-OD2 2.72Å; K202-D483 PolarHBondContact NZ-OD2 3.1Å
203	I	95.4	Very high	93.4	Very high	10 Å²	10	105.8 Å²	105.8	5%	0.051	49%	0.494	C	S	.	.			trans	-96.3	106.8	-178.4	-50.9	-58.2	0	0	0	109.8	I162 C163 C201 R208 C214 R215 K218	I162-I203 HydrophobicContact CG2-CG2 4.29Å; I162-I203 WeakPolarHBondContact O-CG2 3.36Å; C163-I203 HydrophobicContact CB-CG2 4.07Å; C201-I203 WeakPolarHBondContact O-CD1 3.32Å; C201-I203 WeakPolarHBondContact O-CG1 3.18Å; C201-I203 PolarHBondContact O-N 3Å; I203-R208 HydrophobicContact CG2-CB 3.89Å; I203-C214 HydrophobicContact CD1-CB 4.06Å; I203-R215 HydrophobicContact CD1-CB 4.13Å; I203-R215 HydrophobicContact CG2-CG 4.2Å; I203-K218 HydrophobicContact CB-CD 3.83Å; I203-K218 HydrophobicContact CG1-CB 4.42Å; I203-K218 HydrophobicContact CG1-CD 4Å; I203-K218 PolarHBondContact O-NZ 2.88Å
204	Q	93.4	Very high	93.5	Very high	90 Å²	90	97.5 Å²	97.5	42%	0.421	46%	0.457	S	S	.	.			trans	-129.5	168.6	-179.6	-64.2	168.5	-14.4	0	0	110	C163 K206 S207 R208 D483	C163-Q204 CarbonylContact O-C 3.59Å; C163-Q204 VanDerWaalsContact O-C 3.24Å; C163-Q204 WeakPolarHBondContact O-CA 3.26Å; Q204-K206 VanDerWaalsContact C-N 3.3Å; Q204-K206 PolarHBondContact O-N 3.38Å; Q204-S207 PolarHBondContact N-OG 3.17Å; Q204-S207 PolarHBondContact O-N 2.89Å; Q204-S207 PolarHBondContact O-OG 3.07Å; Q204-R208 VanDerWaalsContact O-CB 3.3Å; Q204-R208 WeakPolarHBondContact O-CB 3.3Å; Q204-R208 PolarHBondContact O-N 2.56Å; Q204-D483 PolarHBondContact NE2-OD2 2.89Å
205	K	92.1	Very high	93.6	Very high	119 Å²	119	96.1 Å²	96.1	52%	0.517	45%	0.452	S	S	.	.	T	Hydrogen-bonded Turn	trans	-53.1	-41.9	-176.7	-178	170.7	178.5	157.1	0	113.7	C163 D165	C163-K205 PolarHBondContact O-N 3.1Å; D165-K205 HydrophobicContact CB-CB 4.35Å; D165-K205 HydrophobicContact CB-CD 4Å; D165-K205 HydrophobicContact CB-CG 4.07Å; D165-K205 WeakPolarHBondContact OD1-CD 3.21Å; D165-K205 WeakPolarHBondContact OD1-CE 3.33Å; D165-K205 IonicContact OD1-NZ 3.22Å; D165-K205 PolarHBondContact OD1-NZ 3.31Å
206	K	91.3	Very high	93.8	Very high	153 Å²	153	88.8 Å²	88.8	67%	0.665	42%	0.417	S	S	*	.	T	Hydrogen-bonded Turn	trans	-73.8	-40.4	174.7	-62.9	176.4	-177.9	172.3	0	112.8	Q204 E434	Q204-K206 VanDerWaalsContact C-N 3.3Å; Q204-K206 PolarHBondContact O-N 3.38Å; K206-E434 IonicContact NZ-OE1 3.93Å; K206-E434 PolarHBondContact NZ-OE1 3.45Å; K206-E434 IonicContact NZ-OE2 2.87Å; K206-E434 PolarHBondContact NZ-OE2 3.19Å
207	S	92.1	Very high	93.8	Very high	20 Å²	20	84.2 Å²	84.2	14%	0.14	40%	0.403	C	S	.	.	T	Hydrogen-bonded Turn	trans	-91.1	-16.6	-169.4	72.1	0	0	0	0	115.3	K202 Q204 N209 K210	K202-S207 PolarHBondContact O-OG 3.41Å; Q204-S207 PolarHBondContact N-OG 3.17Å; Q204-S207 PolarHBondContact O-N 2.89Å; Q204-S207 PolarHBondContact O-OG 3.07Å; S207-N209 PolarHBondContact O-N 3.33Å; S207-K210 WeakPolarHBondContact O-CB 3.49Å; S207-K210 WeakPolarHBondContact O-CG 3.27Å; S207-K210 PolarHBondContact O-N 3.44Å
208	R	94.9	Very high	93.8	Very high	42 Å²	42	85.6 Å²	85.6	16%	0.158	41%	0.405	C	S	.	.	T	Hydrogen-bonded Turn	trans	-56.7	-14.9	-168.1	65.3	-177.5	-179.3	-162.2	-6.6	116.7	C163 D165 C177 I203 Q204 R215	C163-R208 HydrophobicContact CB-CB 4.25Å; C163-R208 PolarHBondContact SG-NH1 3.39Å; D165-R208 VanDerWaalsContact CB-NH1 3.31Å; D165-R208 IonicContact OD2-CZ 3.81Å; D165-R208 VanDerWaalsContact OD2-CZ 3.22Å; D165-R208 IonicContact OD2-NH1 2.69Å; D165-R208 PolarHBondContact OD2-NH1 3.06Å; D165-R208 IonicContact OD2-NH2 3.9Å; D165-R208 PolarHBondContact OD2-NH2 2.8Å; C177-R208 PolarHBondContact SG-NH1 3.26Å; I203-R208 HydrophobicContact CG2-CB 3.89Å; Q204-R208 VanDerWaalsContact O-CB 3.3Å; Q204-R208 WeakPolarHBondContact O-CB 3.3Å; Q204-R208 PolarHBondContact O-N 2.56Å; R208-R215 VanDerWaalsContact O-CD 3.3Å; R208-R215 WeakPolarHBondContact O-CD 3.46Å; R208-R215 PolarHBondContact O-NH1 3.29Å
209	N	95.5	Very high	93.9	Very high	125 Å²	125	77.4 Å²	77.4	67%	0.668	37%	0.367	S	S	*	.	T	Hydrogen-bonded Turn	trans	-94.9	-8.6	176.4	-66.6	-5.5	0	0	0	113.5	S207 R215	S207-N209 PolarHBondContact O-N 3.33Å; N209-R215 PolarHBondContact OD1-NH1 2.75Å
210	K	96.1	Very high	94.3	Very high	189 Å²	189	71.2 Å²	71.2	82%	0.822	35%	0.348	S	S	*	.	S	Bend	trans	-74.2	-28.9	-174.6	-67.1	-172	176.2	-172.7	0	114.7	S207	S207-K210 WeakPolarHBondContact O-CB 3.49Å; S207-K210 WeakPolarHBondContact O-CG 3.27Å; S207-K210 PolarHBondContact O-N 3.44Å
211	C	97.1	Very high	94.2	Very high	21 Å²	21	72.6 Å²	72.6	14%	0.142	35%	0.346	C	S	.	.			trans	-142	113.8	176.9	-178.5	0	0	0	0	110	C201 C214 R215	C201-C211 HydrophobicContact CB-CB 4.28Å; C211-C214 HydrophobicContact CB-CB 4.31Å; C211-C214 PolarHBondContact SG-N 2.91Å; C211-R215 WeakPolarHBondContact O-CB 3.37Å; C211-R215 PolarHBondContact O-N 2.86Å
212	Q	97.6	Very high	93.7	Very high	111 Å²	111	73.1 Å²	73.1	52%	0.519	35%	0.345	S	S	.	.	H	α-helix	trans	-72.9	-40.8	-178.3	-65.9	170.8	-63.2	0	0	111.7	F183 Y194 R215 F216	F183-Q212 HydrophobicContact CE2-CB 4.34Å; F183-Q212 HydrophobicContact CE2-CG 4.35Å; F183-Q212 HydrophobicContact CZ-CB 4.38Å; Y194-Q212 HydrophobicContact CD1-CB 3.68Å; Y194-Q212 HydrophobicContact CD2-CB 3.97Å; Y194-Q212 HydrophobicContact CE1-CB 3.8Å; Y194-Q212 HydrophobicContact CE1-CG 4.34Å; Y194-Q212 HydrophobicContact CE2-CB 4.06Å; Y194-Q212 HydrophobicContact CG-CB 3.8Å; Q212-R215 PolarHBondContact O-N 3.37Å; Q212-F216 WeakPolarHBondContact O-CB 3.3Å; Q212-F216 PolarHBondContact O-N 3.34Å
213	Y	97.7	Very high	93.2	Very high	40 Å²	40	69.1 Å²	69.1	16%	0.157	34%	0.34	C	S	.	.	H	α-helix	trans	-56.4	-58.2	176.7	176.8	-92.6	0	0	0	111.9	E195 R196 C197 R215 F216 Q217	E195-Y213 VanDerWaalsContact O-CB 3.26Å; E195-Y213 WeakPolarHBondContact O-CB 3.33Å; R196-Y213 HydrophobicContact CB-CE2 4.2Å; R196-Y213 HydrophobicContact CG-CE1 4.37Å; R196-Y213 HydrophobicContact CG-CE2 4.25Å; R196-Y213 PolarHBondContact NH1-OH 3.48Å; R196-Y213 VanDerWaalsContact NH1-OH 3.12Å; C197-Y213 HydrophobicContact CB-CD1 3.75Å; C197-Y213 HydrophobicContact CB-CE1 4.49Å; C197-Y213 HydrophobicContact CB-CG 4.35Å; C197-Y213 VanDerWaalsContact N-CD1 3.31Å; C197-Y213 VanDerWaalsContact O-CE1 3.32Å; C197-Y213 WeakPolarHBondContact O-CE1 3.49Å; Y213-R215 VanDerWaalsContact C-N 3.26Å; Y213-R215 PolarHBondContact O-N 2.69Å; Y213-F216 PolarHBondContact O-N 2.86Å; Y213-F216 VanDerWaalsContact O-N 3.07Å; Y213-Q217 HydrophobicContact CD1-CG 4.13Å; Y213-Q217 HydrophobicContact CD2-CG 4.37Å; Y213-Q217 HydrophobicContact CE1-CG 3.78Å; Y213-Q217 HydrophobicContact CE2-CG 4.04Å; Y213-Q217 HydrophobicContact CG-CG 4.41Å; Y213-Q217 WeakPolarHBondContact O-CG 3.41Å; Y213-Q217 PolarHBondContact O-N 2.92Å
214	C	96.6	Very high	92.9	Very high	14 Å²	14	68.8 Å²	68.8	10%	0.095	34%	0.338	C	S	.	.	H	α-helix	trans	-62.9	-31.7	-178.5	-63.6	0	0	0	0	112.8	R199 C201 I203 C211 K218	R199-C214 PolarHBondContact O-SG 3.21Å; C201-C214 HydrophobicContact CB-CB 3.86Å; I203-C214 HydrophobicContact CD1-CB 4.06Å; C211-C214 HydrophobicContact CB-CB 4.31Å; C211-C214 PolarHBondContact SG-N 2.91Å; C214-K218 WeakPolarHBondContact O-CB 3.34Å; C214-K218 PolarHBondContact O-N 3.34Å
215	R	97.9	Very high	92.4	Very high	12 Å²	12	66.8 Å²	66.8	5%	0.045	33%	0.334	C	S	.	.	H	α-helix	trans	-65.9	-45.8	172.6	-171.9	-168	-168.2	153.1	-11.7	111.8	G179 F183 I203 R208 N209 C211 Q212 Y213 K218 C219	G179-R215 PolarHBondContact O-NH2 3.1Å; F183-R215 HydrophobicContact CD1-CG 4.07Å; F183-R215 HydrophobicContact CE1-CB 4.11Å; F183-R215 HydrophobicContact CE1-CG 3.8Å; F183-R215 HydrophobicContact CZ-CB 4.22Å; F183-R215 HydrophobicContact CZ-CG 4.27Å; I203-R215 HydrophobicContact CD1-CB 4.13Å; I203-R215 HydrophobicContact CG2-CG 4.2Å; R208-R215 VanDerWaalsContact O-CD 3.3Å; R208-R215 WeakPolarHBondContact O-CD 3.46Å; R208-R215 PolarHBondContact O-NH1 3.29Å; N209-R215 PolarHBondContact OD1-NH1 2.75Å; C211-R215 WeakPolarHBondContact O-CB 3.37Å; C211-R215 PolarHBondContact O-N 2.86Å; Q212-R215 PolarHBondContact O-N 3.37Å; Y213-R215 VanDerWaalsContact C-N 3.26Å; Y213-R215 PolarHBondContact O-N 2.69Å; R215-K218 PolarHBondContact O-N 2.86Å; R215-C219 PolarHBondContact O-N 3.48Å; R215-C219 PolarHBondContact O-SG 3.15Å; R215-C219 VanDerWaalsContact O-SG 3.38Å
216	F	97.3	Very high	91.9	Very high	32 Å²	32	65.7 Å²	65.7	14%	0.14	33%	0.331	C	S	.	.	H	α-helix	trans	-69.5	-41.3	-179.6	-173.4	-125.1	0	0	0	112	F183 F184 T187 I188 Y194 Q212 Y213 K218 C219 L220	F183-F216 HydrophobicContact CE1-CB 3.82Å; F183-F216 HydrophobicContact CE1-CD2 4.24Å; F183-F216 HydrophobicContact CE1-CG 4.48Å; F183-F216 HydrophobicContact CZ-CB 4.01Å; F184-F216 HydrophobicContact CD2-CD2 4.15Å; F184-F216 AromaticContact CD2-CE2 3.75Å; F184-F216 HydrophobicContact CD2-CE2 3.75Å; F184-F216 AromaticContact CE2-CE2 3.85Å; F184-F216 HydrophobicContact CE2-CE2 3.85Å; T187-F216 HydrophobicContact CG2-CD1 3.92Å; T187-F216 HydrophobicContact CG2-CD2 3.65Å; T187-F216 HydrophobicContact CG2-CE1 3.77Å; T187-F216 HydrophobicContact CG2-CE2 3.5Å; T187-F216 HydrophobicContact CG2-CG 3.86Å; T187-F216 HydrophobicContact CG2-CZ 3.57Å; I188-F216 HydrophobicContact CD1-CE2 4.08Å; I188-F216 HydrophobicContact CD1-CZ 3.81Å; I188-F216 HydrophobicContact CG1-CE2 4.5Å; Y194-F216 HydrophobicContact CD2-CB 4.02Å; Y194-F216 HydrophobicContact CD2-CD1 4.41Å; Y194-F216 HydrophobicContact CD2-CG 4.44Å; Y194-F216 HydrophobicContact CE2-CB 3.96Å; Y194-F216 HydrophobicContact CE2-CD1 4.49Å; Y194-F216 HydrophobicContact CE2-CG 4.24Å; Q212-F216 WeakPolarHBondContact O-CB 3.3Å; Q212-F216 PolarHBondContact O-N 3.34Å; Y213-F216 PolarHBondContact O-N 2.86Å; Y213-F216 VanDerWaalsContact O-N 3.07Å; F216-K218 VanDerWaalsContact C-N 3.33Å; F216-K218 PolarHBondContact O-N 2.7Å; F216-C219 VanDerWaalsContact O-CB 3.31Å; F216-C219 WeakPolarHBondContact O-CB 3.45Å; F216-C219 PolarHBondContact O-N 3.28Å; F216-C219 VanDerWaalsContact O-N 3.09Å; F216-L220 HydrophobicContact CD1-CD1 4.1Å; F216-L220 HydrophobicContact CE1-CD1 3.76Å; F216-L220 HydrophobicContact CE1-CG 4.45Å; F216-L220 HydrophobicContact CE2-CD2 4.46Å; F216-L220 HydrophobicContact CE2-CG 4.38Å; F216-L220 HydrophobicContact CZ-CD1 3.99Å; F216-L220 HydrophobicContact CZ-CD2 4.26Å; F216-L220 HydrophobicContact CZ-CG 4.25Å; F216-L220 PolarHBondContact O-N 3.42Å
217	Q	95.7	Very high	90.9	Very high	82 Å²	82	63.5 Å²	63.5	38%	0.383	33%	0.326	S	S	.	.	H	α-helix	trans	-58.7	-42.9	171	-67.9	-62.3	-16.9	0	0	111.5	Y213 C219 L220 L221	Y213-Q217 HydrophobicContact CD1-CG 4.13Å; Y213-Q217 HydrophobicContact CD2-CG 4.37Å; Y213-Q217 HydrophobicContact CE1-CG 3.78Å; Y213-Q217 HydrophobicContact CE2-CG 4.04Å; Y213-Q217 HydrophobicContact CG-CG 4.41Å; Y213-Q217 WeakPolarHBondContact O-CG 3.41Å; Y213-Q217 PolarHBondContact O-N 2.92Å; Q217-C219 VanDerWaalsContact C-N 3.34Å; Q217-C219 PolarHBondContact O-N 2.78Å; Q217-L220 PolarHBondContact O-N 2.79Å; Q217-L221 WeakPolarHBondContact O-CB 3.24Å; Q217-L221 PolarHBondContact O-N 2.84Å
218	K	93.9	Very high	89.7	Confident	64 Å²	64	63.7 Å²	63.7	28%	0.278	33%	0.329	S	S	.	.	H	α-helix	trans	-66.6	-30.6	174.3	-167.8	179.7	177.5	-169.7	0	113.2	I162 I203 C214 R215 F216 L222	I162-K218 WeakPolarHBondContact O-CD 3.24Å; I162-K218 VanDerWaalsContact O-CE 3.27Å; I162-K218 WeakPolarHBondContact O-CE 3.49Å; I162-K218 PolarHBondContact O-NZ 3.28Å; I203-K218 HydrophobicContact CB-CD 3.83Å; I203-K218 HydrophobicContact CG1-CB 4.42Å; I203-K218 HydrophobicContact CG1-CD 4Å; I203-K218 PolarHBondContact O-NZ 2.88Å; C214-K218 WeakPolarHBondContact O-CB 3.34Å; C214-K218 PolarHBondContact O-N 3.34Å; R215-K218 PolarHBondContact O-N 2.86Å; F216-K218 VanDerWaalsContact C-N 3.33Å; F216-K218 PolarHBondContact O-N 2.7Å; K218-L222 HydrophobicContact CD-CD1 4.48Å; K218-L222 HydrophobicContact CG-CD1 3.87Å; K218-L222 HydrophobicContact CG-CG 4.36Å; K218-L222 WeakPolarHBondContact O-CB 3.34Å; K218-L222 WeakPolarHBondContact O-CD1 3.48Å; K218-L222 VanDerWaalsContact O-CG 3.27Å; K218-L222 WeakPolarHBondContact O-CG 3.41Å; K218-L222 PolarHBondContact O-N 3.31Å
219	C	93.4	Very high	88	Confident	0 Å²	0	65.8 Å²	65.8	0%	0	34%	0.342	C	S	.	.	H	α-helix	trans	-62.2	-52.5	169.8	-72.4	0	0	0	0	111.1	F184 R215 F216 Q217 L222 M224	F184-C219 HydrophobicContact CD2-CB 3.84Å; F184-C219 HydrophobicContact CE2-CB 4.42Å; R215-C219 PolarHBondContact O-N 3.48Å; R215-C219 PolarHBondContact O-SG 3.15Å; R215-C219 VanDerWaalsContact O-SG 3.38Å; F216-C219 VanDerWaalsContact O-CB 3.31Å; F216-C219 WeakPolarHBondContact O-CB 3.45Å; F216-C219 PolarHBondContact O-N 3.28Å; F216-C219 VanDerWaalsContact O-N 3.09Å; Q217-C219 VanDerWaalsContact C-N 3.34Å; Q217-C219 PolarHBondContact O-N 2.78Å; C219-L222 PolarHBondContact O-N 2.94Å; C219-M224 HydrophobicContact CB-CB 4.1Å; C219-M224 HydrophobicContact CB-CG 4.11Å; C219-M224 HydrophobicContact CB-SD 3.69Å; C219-M224 VanDerWaalsContact O-CB 3.24Å; C219-M224 WeakPolarHBondContact O-CB 3.49Å; C219-M224 WeakPolarHBondContact O-CG 3.29Å; C219-M224 PolarHBondContact O-N 3.23Å
220	L	90	Very high	86.2	Confident	73 Å²	73	70.6 Å²	70.6	38%	0.382	35%	0.351	S	S	.	.	H	α-helix	trans	-63	-47.7	-178.9	-65.8	171.4	0	0	0	112	F184 F216 Q217 L222 G223	F184-L220 HydrophobicContact CE2-CD2 4.02Å; F216-L220 HydrophobicContact CD1-CD1 4.1Å; F216-L220 HydrophobicContact CE1-CD1 3.76Å; F216-L220 HydrophobicContact CE1-CG 4.45Å; F216-L220 HydrophobicContact CE2-CD2 4.46Å; F216-L220 HydrophobicContact CE2-CG 4.38Å; F216-L220 HydrophobicContact CZ-CD1 3.99Å; F216-L220 HydrophobicContact CZ-CD2 4.26Å; F216-L220 HydrophobicContact CZ-CG 4.25Å; F216-L220 PolarHBondContact O-N 3.42Å; Q217-L220 PolarHBondContact O-N 2.79Å; L220-L222 PolarHBondContact O-N 2.85Å; L220-G223 PolarHBondContact O-N 3.21Å
221	L	84.9	Confident	84	Confident	151 Å²	151	69.8 Å²	69.8	79%	0.791	34%	0.344	S	S	*	.	H	α-helix	trans	-59.3	-31.8	179.8	-177	64.6	0	0	0	113.2	Q217 G223	Q217-L221 WeakPolarHBondContact O-CB 3.24Å; Q217-L221 PolarHBondContact O-N 2.84Å; L221-G223 VanDerWaalsContact C-N 3.28Å
222	L	83.7	Confident	81.6	Confident	59 Å²	59	71.5 Å²	71.5	31%	0.309	37%	0.365	S	S	.	.	T	Hydrogen-bonded Turn	trans	-87.2	6.9	176.4	-67.8	175.4	0	0	0	113.5	R161 I162 V174 K218 C219 L220	R161-L222 HydrophobicContact CB-CD1 4.05Å; R161-L222 WeakPolarHBondContact O-CD1 3.45Å; I162-L222 HydrophobicContact CG1-CD1 4.25Å; V174-L222 WeakPolarHBondContact CG2-O 3.16Å; K218-L222 HydrophobicContact CD-CD1 4.48Å; K218-L222 HydrophobicContact CG-CD1 3.87Å; K218-L222 HydrophobicContact CG-CG 4.36Å; K218-L222 WeakPolarHBondContact O-CB 3.34Å; K218-L222 WeakPolarHBondContact O-CD1 3.48Å; K218-L222 VanDerWaalsContact O-CG 3.27Å; K218-L222 WeakPolarHBondContact O-CG 3.41Å; K218-L222 PolarHBondContact O-N 3.31Å; C219-L222 PolarHBondContact O-N 2.94Å; L220-L222 PolarHBondContact O-N 2.85Å
223	G	79.7	Confident	79.7	Confident	44 Å²	44	77.1 Å²	77.1	45%	0.454	38%	0.382	S	S	.	.	T	Hydrogen-bonded Turn	trans	90	15.4	175.7	0	0	0	0	0	115.7	L220 L221 S225	L220-G223 PolarHBondContact O-N 3.21Å; L221-G223 VanDerWaalsContact C-N 3.28Å; G223-S225 PolarHBondContact O-N 2.78Å; G223-S225 VanDerWaalsContact O-N 3.09Å
224	M	89.6	Confident	77.7	Confident	4 Å²	4	77.5 Å²	77.5	2%	0.02	39%	0.385	C	S	.	.			trans	-67.3	111.5	172.8	-63.6	-164.7	105.9	0	0	110	I162 H171 Y172 V174 A176 F184 C219	I162-M224 HydrophobicContact CD1-CE 4.2Å; I162-M224 HydrophobicContact CD1-CG 4.35Å; I162-M224 HydrophobicContact CD1-SD 3.72Å; I162-M224 HydrophobicContact CG1-SD 3.91Å; H171-M224 WeakPolarHBondContact O-CE 3.46Å; Y172-M224 HydrophobicContact CD2-CE 4.29Å; Y172-M224 CarbonylContact O-C 3.51Å; Y172-M224 VanDerWaalsContact O-CA 3.3Å; Y172-M224 WeakPolarHBondContact O-CA 3.44Å; V174-M224 HydrophobicContact CB-CE 4.47Å; V174-M224 HydrophobicContact CB-CG 3.94Å; V174-M224 HydrophobicContact CG2-CB 4.33Å; V174-M224 HydrophobicContact CG2-CG 3.51Å; A176-M224 HydrophobicContact CB-CE 3.69Å; F184-M224 HydrophobicContact CB-SD 4.33Å; F184-M224 HydrophobicContact CD1-CB 4.43Å; F184-M224 HydrophobicContact CD2-CB 3.91Å; F184-M224 HydrophobicContact CD2-SD 4.44Å; F184-M224 HydrophobicContact CE1-CB 4.24Å; F184-M224 HydrophobicContact CE2-CB 3.69Å; F184-M224 WeakPolarHBondContact CE2-O 3.39Å; F184-M224 HydrophobicContact CG-CB 4.28Å; F184-M224 HydrophobicContact CG-SD 4.32Å; F184-M224 VanDerWaalsContact CZ-C 3.49Å; F184-M224 HydrophobicContact CZ-CB 3.88Å; F184-M224 WeakPolarHBondContact CZ-O 3.3Å; C219-M224 HydrophobicContact CB-CB 4.1Å; C219-M224 HydrophobicContact CB-CG 4.11Å; C219-M224 HydrophobicContact CB-SD 3.69Å; C219-M224 VanDerWaalsContact O-CB 3.24Å; C219-M224 WeakPolarHBondContact O-CB 3.49Å; C219-M224 WeakPolarHBondContact O-CG 3.29Å; C219-M224 PolarHBondContact O-N 3.23Å
225	S	84	Confident	76.1	Confident	47 Å²	47	79.9 Å²	79.9	33%	0.329	40%	0.401	S	S	.	.			trans	-123.4	144.3	-179.1	176.4	0	0	0	0	111.7	Y172 G223 D227	Y172-S225 WeakPolarHBondContact CB-O 3.47Å; Y172-S225 PolarHBondContact O-N 2.87Å; G223-S225 PolarHBondContact O-N 2.78Å; G223-S225 VanDerWaalsContact O-N 3.09Å; S225-D227 VanDerWaalsContact C-N 3.3Å; S225-D227 PolarHBondContact OG-N 3.45Å
226	H	81.2	Confident	74.3	Confident	97 Å²	97	83.9 Å²	83.9	45%	0.449	42%	0.42	S	S	.	.	S	Bend	trans	-62.2	-38.2	170.9	177.2	-91.9	0	0	0	111.6	I188 A228 I229	I188-H226 HydrophobicContact CG2-CB 4.34Å; H226-A228 VanDerWaalsContact C-N 3.32Å; H226-A228 PolarHBondContact O-N 3.21Å; H226-I229 WeakPolarHBondContact O-CB 3.3Å; H226-I229 WeakPolarHBondContact O-CD1 3.27Å; H226-I229 WeakPolarHBondContact O-CG1 3.33Å; H226-I229 PolarHBondContact O-N 2.87Å
227	D	70.8	Confident	72.5	Confident	106 Å²	106	85.5 Å²	85.5	57%	0.567	44%	0.44	S	S	*	.	G	3₁₀ helix	trans	-83.1	-16.8	-169.1	-52	-46.9	0	0	0	112.5	S225 I229 R230	S225-D227 VanDerWaalsContact C-N 3.3Å; S225-D227 PolarHBondContact OG-N 3.45Å; D227-I229 PolarHBondContact O-N 3.16Å; D227-I229 VanDerWaalsContact O-N 3.1Å; D227-R230 PolarHBondContact O-N 3.43Å
228	A	65.4	Low	70.8	Confident	24 Å²	24	86.2 Å²	86.2	20%	0.198	44%	0.443	C	S	.	.	G	3₁₀ helix	trans	-62.1	-10.6	168.5	0	0	0	0	0	113.8	H226 R230 Y231	H226-A228 VanDerWaalsContact C-N 3.32Å; H226-A228 PolarHBondContact O-N 3.21Å; A228-R230 PolarHBondContact O-N 3.31Å; A228-Y231 PolarHBondContact O-N 2.77Å
229	I	60.1	Low	69.1	Low	86 Å²	86	87.8 Å²	87.8	44%	0.441	45%	0.45	S	S	.	.	G	3₁₀ helix	trans	-54.7	-32.6	171.1	-65.9	163.9	0	0	0	111.6	Y172 H226 D227 Y231 G232	Y172-I229 HydrophobicContact CD1-CD1 4.19Å; Y172-I229 HydrophobicContact CD1-CG1 3.73Å; Y172-I229 HydrophobicContact CE1-CD1 3.69Å; Y172-I229 HydrophobicContact CE1-CG1 3.58Å; H226-I229 WeakPolarHBondContact O-CB 3.3Å; H226-I229 WeakPolarHBondContact O-CD1 3.27Å; H226-I229 WeakPolarHBondContact O-CG1 3.33Å; H226-I229 PolarHBondContact O-N 2.87Å; D227-I229 PolarHBondContact O-N 3.16Å; D227-I229 VanDerWaalsContact O-N 3.1Å; I229-Y231 PolarHBondContact O-N 2.86Å; I229-Y231 VanDerWaalsContact O-N 3.16Å; I229-G232 PolarHBondContact O-N 3.08Å
230	R	57.2	Low	67.6	Low	226 Å²	226	96 Å²	96	85%	0.853	48%	0.481	S	S	*	.	G	3₁₀ helix	trans	-62.3	-21.7	179	-61.6	-173.3	-173.7	-159.5	3	113.2	D227 A228	D227-R230 PolarHBondContact O-N 3.43Å; A228-R230 PolarHBondContact O-N 3.31Å
231	Y	50.3	Low	66.3	Low	173 Å²	173	100.1 Å²	100.1	68%	0.678	50%	0.496	S	S	*	.	G	3₁₀ helix	trans	-103.5	26.5	175.6	-58.5	-86.1	0	0	0	112.1	A228 I229 R233	A228-Y231 PolarHBondContact O-N 2.77Å; I229-Y231 PolarHBondContact O-N 2.86Å; I229-Y231 VanDerWaalsContact O-N 3.16Å; Y231-R233 CarbonylContact O-C 3.47Å; Y231-R233 PolarHBondContact O-N 3.05Å
232	G	47.8	Very low	64.9	Low	57 Å²	57	96.3 Å²	96.3	59%	0.588	48%	0.476	S	S	*	.			trans	-63.7	6.8	-175.8	0	0	0	0	0	116.9	I229	I229-G232 PolarHBondContact O-N 3.08Å
233	R	57.1	Low	63.7	Low	229 Å²	229	96.7 Å²	96.7	86%	0.864	48%	0.48	S	S	*	.	S	Bend	trans	-125.4	119.7	161.3	-62.7	-177.9	-173.2	176.4	2.6	107.1	Y231	Y231-R233 CarbonylContact O-C 3.47Å; Y231-R233 PolarHBondContact O-N 3.05Å
234	M	54.8	Low	62.5	Low	47 Å²	47	97.2 Å²	97.2	23%	0.232	48%	0.48	C	S	.	.			trans	-53.8	123.8	173.5	-179.7	-176.8	-73.9	0	0	109.4	F170 E236 E238 K239 L242	F170-M234 HydrophobicContact CB-CE 4.36Å; F170-M234 HydrophobicContact CD2-CE 4.41Å; F170-M234 HydrophobicContact CG-CE 4.43Å; M234-E236 PolarHBondContact O-N 2.88Å; M234-E238 HydrophobicContact CG-CB 4.24Å; M234-E238 HydrophobicContact CG-CG 4.39Å; M234-K239 HydrophobicContact CG-CB 4.07Å; M234-K239 VanDerWaalsContact SD-CA 3.57Å; M234-K239 HydrophobicContact SD-CB 3.7Å; M234-K239 HydrophobicContact SD-CG 4.26Å; M234-L242 HydrophobicContact CE-CD1 3.41Å; M234-L242 VanDerWaalsContact CE-CD1 3.41Å; M234-L242 HydrophobicContact SD-CD1 3.62Å
235	P	64.1	Low	60.8	Low	65 Å²	65	98.7 Å²	98.7	42%	0.422	50%	0.496	S	S	.	.			trans	-54.7	138.1	177.2	-26.6	35	0	0	0	111.1	A237 E238 K239	P235-A237 PolarHBondContact O-N 2.76Å; P235-A237 VanDerWaalsContact O-N 3.09Å; P235-E238 HydrophobicContact CB-CB 4.26Å; P235-E238 WeakPolarHBondContact CD-OE2 3.4Å; P235-E238 WeakPolarHBondContact O-CA 3.37Å; P235-E238 WeakPolarHBondContact O-CB 3.38Å; P235-E238 PolarHBondContact O-N 3.03Å; P235-K239 PolarHBondContact O-N 3.45Å
236	E	59.5	Low	59.2	Low	95 Å²	95	101.8 Å²	101.8	44%	0.444	51%	0.509	S	S	.	.	H	α-helix	trans	-61.5	-27.8	-173.3	-162.4	64.7	-156.5	0	0	112.1	M234 K239 R240	M234-E236 PolarHBondContact O-N 2.88Å; E236-K239 WeakPolarHBondContact OE1-CE 3.36Å; E236-K239 IonicContact OE1-NZ 3.65Å; E236-K239 PolarHBondContact OE1-NZ 3.31Å; E236-K239 WeakPolarHBondContact OE2-CD 3.23Å; E236-K239 IonicContact OE2-NZ 3.92Å; E236-K239 PolarHBondContact OE2-NZ 2.91Å; E236-R240 WeakPolarHBondContact O-CB 3.36Å; E236-R240 WeakPolarHBondContact O-CG 3.12Å; E236-R240 PolarHBondContact O-N 2.69Å
237	A	58.5	Low	57.8	Low	67 Å²	67	104.3 Å²	104.3	55%	0.554	53%	0.525	S	S	*	.	H	α-helix	trans	-68.6	-35.1	170.8	0	0	0	0	0	113.5	P235 K241	P235-A237 PolarHBondContact O-N 2.76Å; P235-A237 VanDerWaalsContact O-N 3.09Å; A237-K241 WeakPolarHBondContact O-CB 3.02Å; A237-K241 VanDerWaalsContact O-CG 3.32Å; A237-K241 WeakPolarHBondContact O-CG 3.27Å; A237-K241 PolarHBondContact O-N 2.84Å
238	E	60	Low	56.9	Low	97 Å²	97	102.5 Å²	102.5	45%	0.453	52%	0.524	S	S	.	.	H	α-helix	trans	-76.6	-38.1	176.4	-171.2	168.7	-126.2	0	0	111.2	M234 P235 K241 L242	M234-E238 HydrophobicContact CG-CB 4.24Å; M234-E238 HydrophobicContact CG-CG 4.39Å; P235-E238 HydrophobicContact CB-CB 4.26Å; P235-E238 WeakPolarHBondContact CD-OE2 3.4Å; P235-E238 WeakPolarHBondContact O-CA 3.37Å; P235-E238 WeakPolarHBondContact O-CB 3.38Å; P235-E238 PolarHBondContact O-N 3.03Å; E238-K241 CarbonylContact O-C 3.58Å; E238-K241 WeakPolarHBondContact O-CB 3.49Å; E238-K241 PolarHBondContact O-N 3.2Å; E238-L242 WeakPolarHBondContact O-CB 3.38Å; E238-L242 PolarHBondContact O-N 3.32Å
239	K	60	Low	55.5	Low	97 Å²	97	103.9 Å²	103.9	42%	0.422	54%	0.541	S	S	.	.	H	α-helix	trans	-59.1	-44	168.6	-178.8	-177.3	163.5	-152.4	0	111.9	M234 P235 E236 L242 V243	M234-K239 HydrophobicContact CG-CB 4.07Å; M234-K239 VanDerWaalsContact SD-CA 3.57Å; M234-K239 HydrophobicContact SD-CB 3.7Å; M234-K239 HydrophobicContact SD-CG 4.26Å; P235-K239 PolarHBondContact O-N 3.45Å; E236-K239 WeakPolarHBondContact OE1-CE 3.36Å; E236-K239 IonicContact OE1-NZ 3.65Å; E236-K239 PolarHBondContact OE1-NZ 3.31Å; E236-K239 WeakPolarHBondContact OE2-CD 3.23Å; E236-K239 IonicContact OE2-NZ 3.92Å; E236-K239 PolarHBondContact OE2-NZ 2.91Å; K239-L242 PolarHBondContact O-N 2.92Å; K239-V243 WeakPolarHBondContact O-CG2 3.49Å; K239-V243 PolarHBondContact O-N 2.8Å
240	R	62.2	Low	54.5	Low	171 Å²	171	105.4 Å²	105.4	65%	0.645	55%	0.55	S	S	*	*	H	α-helix	trans	-64.1	-41.5	172.5	-74.3	169.1	-171.5	-174.7	1.5	112	E236 L242 V243 A244	E236-R240 WeakPolarHBondContact O-CB 3.36Å; E236-R240 WeakPolarHBondContact O-CG 3.12Å; E236-R240 PolarHBondContact O-N 2.69Å; R240-L242 VanDerWaalsContact C-N 3.3Å; R240-L242 PolarHBondContact O-N 3.01Å; R240-V243 PolarHBondContact O-N 2.85Å; R240-A244 VanDerWaalsContact O-CB 3.29Å; R240-A244 WeakPolarHBondContact O-CB 3.2Å; R240-A244 PolarHBondContact O-N 3.33Å
241	K	61.5	Low	53.7	Low	161 Å²	161	100.5 Å²	100.5	70%	0.7	55%	0.546	S	S	*	.	H	α-helix	trans	-63.1	-32.6	172.4	-77.4	176.3	177.6	-175	0	113	A237 E238 G245	A237-K241 WeakPolarHBondContact O-CB 3.02Å; A237-K241 VanDerWaalsContact O-CG 3.32Å; A237-K241 WeakPolarHBondContact O-CG 3.27Å; A237-K241 PolarHBondContact O-N 2.84Å; E238-K241 CarbonylContact O-C 3.58Å; E238-K241 WeakPolarHBondContact O-CB 3.49Å; E238-K241 PolarHBondContact O-N 3.2Å; K241-G245 WeakPolarHBondContact O-CA 3.47Å; K241-G245 PolarHBondContact O-N 3.4Å
242	L	55.1	Low	52.8	Low	70 Å²	70	96.1 Å²	96.1	37%	0.366	55%	0.545	S	S	.	.	H	α-helix	trans	-74.7	-40	174.6	-88.1	161.2	0	0	0	112.5	M234 E238 K239 R240 G245 L246	M234-L242 HydrophobicContact CE-CD1 3.41Å; M234-L242 VanDerWaalsContact CE-CD1 3.41Å; M234-L242 HydrophobicContact SD-CD1 3.62Å; E238-L242 WeakPolarHBondContact O-CB 3.38Å; E238-L242 PolarHBondContact O-N 3.32Å; K239-L242 PolarHBondContact O-N 2.92Å; R240-L242 VanDerWaalsContact C-N 3.3Å; R240-L242 PolarHBondContact O-N 3.01Å; L242-G245 CarbonylContact O-C 3.45Å; L242-G245 PolarHBondContact O-N 3.08Å; L242-L246 VanDerWaalsContact O-CD1 3.27Å; L242-L246 WeakPolarHBondContact O-CD1 3.1Å; L242-L246 PolarHBondContact O-N 2.64Å
243	V	58.3	Low	52.5	Low	68 Å²	68	99.1 Å²	99.1	41%	0.412	55%	0.554	S	S	.	*	H	α-helix	trans	-64.6	-46.9	172.6	172.8	0	0	0	0	110.6	K239 R240 G245 L246 L247	K239-V243 WeakPolarHBondContact O-CG2 3.49Å; K239-V243 PolarHBondContact O-N 2.8Å; R240-V243 PolarHBondContact O-N 2.85Å; V243-G245 VanDerWaalsContact C-N 3.3Å; V243-G245 PolarHBondContact O-N 2.87Å; V243-L246 PolarHBondContact O-N 2.86Å; V243-L247 HydrophobicContact CG1-CD1 4.2Å; V243-L247 WeakPolarHBondContact O-CG 3.4Å; V243-L247 PolarHBondContact O-N 2.82Å; V243-L247 VanDerWaalsContact O-N 3.16Å
244	A	55.3	Low	51.4	Low	54 Å²	54	94.5 Å²	94.5	45%	0.446	55%	0.552	S	S	.	*	H	α-helix	trans	-61.6	-38.5	172.6	0	0	0	0	0	112	R240 L246 L247 A248	R240-A244 VanDerWaalsContact O-CB 3.29Å; R240-A244 WeakPolarHBondContact O-CB 3.2Å; R240-A244 PolarHBondContact O-N 3.33Å; A244-L246 VanDerWaalsContact C-N 3.33Å; A244-L246 PolarHBondContact O-N 3.32Å; A244-L247 CarbonylContact O-C 3.54Å; A244-L247 WeakPolarHBondContact O-CA 3.09Å; A244-L247 PolarHBondContact O-N 2.82Å; A244-A248 WeakPolarHBondContact O-CB 3.25Å; A244-A248 PolarHBondContact O-N 2.99Å
245	G	53	Low	50.5	Low	35 Å²	35	97.2 Å²	97.2	36%	0.361	57%	0.571	S	S	.	*	H	α-helix	trans	-67.1	-27.3	175.5	0	0	0	0	0	113.9	K241 L242 V243 L247 G249	K241-G245 WeakPolarHBondContact O-CA 3.47Å; K241-G245 PolarHBondContact O-N 3.4Å; L242-G245 CarbonylContact O-C 3.45Å; L242-G245 PolarHBondContact O-N 3.08Å; V243-G245 VanDerWaalsContact C-N 3.3Å; V243-G245 PolarHBondContact O-N 2.87Å; G245-L247 VanDerWaalsContact C-N 3.34Å; G245-G249 WeakPolarHBondContact O-CA 3.49Å; G245-G249 PolarHBondContact O-N 3Å
246	L	51.1	Low	49.4	Very low	113 Å²	113	100 Å²	100	59%	0.592	58%	0.582	S	S	*	*	H	α-helix	trans	-79.6	-17.5	169.4	-96	72.8	0	0	0	112.9	I156 L242 V243 A244	I156-L246 HydrophobicContact CG2-CD2 3.46Å; I156-L246 VanDerWaalsContact CG2-CD2 3.46Å; L242-L246 VanDerWaalsContact O-CD1 3.27Å; L242-L246 WeakPolarHBondContact O-CD1 3.1Å; L242-L246 PolarHBondContact O-N 2.64Å; V243-L246 PolarHBondContact O-N 2.86Å; A244-L246 VanDerWaalsContact C-N 3.33Å; A244-L246 PolarHBondContact O-N 3.32Å
247	L	52.1	Low	49.2	Very low	150 Å²	150	100.3 Å²	100.3	79%	0.785	59%	0.592	S	S	*	*	H	α-helix	trans	-95	-18	176.4	-66.2	169.3	0	0	0	113.3	V243 A244 G245	V243-L247 HydrophobicContact CG1-CD1 4.2Å; V243-L247 WeakPolarHBondContact O-CG 3.4Å; V243-L247 PolarHBondContact O-N 2.82Å; V243-L247 VanDerWaalsContact O-N 3.16Å; A244-L247 CarbonylContact O-C 3.54Å; A244-L247 WeakPolarHBondContact O-CA 3.09Å; A244-L247 PolarHBondContact O-N 2.82Å; G245-L247 VanDerWaalsContact C-N 3.34Å
248	A	51.6	Low	49.1	Very low	67 Å²	67	102.4 Å²	102.4	55%	0.554	59%	0.594	S	S	*	*	H	α-helix	trans	-126.2	-2.4	-177.7	0	0	0	0	0	114.7	A244 D250 T251	A244-A248 WeakPolarHBondContact O-CB 3.25Å; A244-A248 PolarHBondContact O-N 2.99Å; A248-D250 PolarHBondContact O-N 3.03Å; A248-T251 PolarHBondContact O-OG1 2.89Å
249	G	35.8	Very low	49.1	Very low	53 Å²	53	98.7 Å²	98.7	55%	0.546	58%	0.582	S	S	.	*			trans	-95.7	58.5	-167.3	0	0	0	0	0	116.6	G245	G245-G249 WeakPolarHBondContact O-CA 3.49Å; G245-G249 PolarHBondContact O-N 3Å
250	D	39.7	Very low	49.6	Very low	119 Å²	119	97.8 Å²	97.8	64%	0.636	59%	0.588	S	S	*	*			trans	-122.1	48.4	152.2	-102.1	-31.8	0	0	0	108.3	A248 K263	A248-D250 PolarHBondContact O-N 3.03Å; D250-K263 VanDerWaalsContact CG-NZ 3.3Å; D250-K263 IonicContact OD1-NZ 2.86Å; D250-K263 PolarHBondContact OD1-NZ 3.48Å; D250-K263 VanDerWaalsContact OD1-NZ 3.16Å; D250-K263 IonicContact OD2-NZ 2.7Å; D250-K263 PolarHBondContact OD2-NZ 2.86Å
251	T	40.9	Very low	50.9	Low	123 Å²	123	93.8 Å²	93.8	76%	0.755	58%	0.579	S	S	*	*			trans	-124.8	62.5	-173.8	41.9	0	0	0	0	113.1	A248	A248-T251 PolarHBondContact O-OG1 2.89Å
252	A	31.1	Very low	52.4	Low	80 Å²	80	87.4 Å²	87.4	66%	0.661	55%	0.553	S	S	*	*	S	Bend	trans	-115	123.3	147.5	0	0	0	0	0	107.1	T254	A252-T254 PolarHBondContact O-N 3.39Å
253	P	40.8	Very low	54.2	Low	120 Å²	120	89.3 Å²	89.3	78%	0.779	56%	0.558	S	S	*	*	S	Bend	trans	-79.8	82.7	-163	31	-36.3	0	0	0	113.6
254	T	35.1	Very low	56	Low	133 Å²	133	88 Å²	88	82%	0.816	55%	0.552	S	S	*	*			trans	-117.7	50.3	145.7	56.5	0	0	0	0	109.1	A252 N256	A252-T254 PolarHBondContact O-N 3.39Å; T254-N256 PolarHBondContact O-N 2.97Å
255	T	34.8	Very low	58	Low	104 Å²	104	86.1 Å²	86.1	64%	0.638	53%	0.534	S	S	*	.			trans	-77.3	81.1	-179.7	46.9	0	0	0	0	110.9
256	N	41.9	Very low	60.1	Low	123 Å²	123	85 Å²	85	66%	0.658	52%	0.521	S	S	*	.			trans	-67.7	120.3	154.9	-68.4	-6.5	0	0	0	107	T254 N258 G259	T254-N256 PolarHBondContact O-N 2.97Å; N256-N258 PolarHBondContact O-N 3.16Å; N256-G259 PolarHBondContact O-N 2.64Å
257	P	53.9	Low	62.3	Low	101 Å²	101	86.3 Å²	86.3	66%	0.656	52%	0.523	S	S	*	.	H	α-helix	trans	-58.5	-34.3	-173.8	19.9	-31.2	0	0	0	113	G259 S260	P257-G259 VanDerWaalsContact C-N 3.3Å; P257-G259 PolarHBondContact O-N 3.33Å; P257-S260 PolarHBondContact O-N 2.82Å; P257-S260 PolarHBondContact O-OG 3.28Å
258	N	56.2	Low	64.5	Low	111 Å²	111	84.4 Å²	84.4	59%	0.594	51%	0.505	S	S	*	.	H	α-helix	trans	-60.8	-36.2	175	-53.9	40.9	0	0	0	112.4	N256 S260 D261 L262	N256-N258 PolarHBondContact O-N 3.16Å; N258-S260 VanDerWaalsContact C-N 3.26Å; N258-S260 PolarHBondContact O-N 2.61Å; N258-D261 PolarHBondContact O-N 2.82Å; N258-D261 VanDerWaalsContact O-N 3.07Å; N258-L262 WeakPolarHBondContact O-CG 3.36Å; N258-L262 PolarHBondContact O-N 3.42Å
259	G	60.1	Low	66.7	Low	19 Å²	19	81.2 Å²	81.2	20%	0.196	48%	0.478	C	S	.	.	H	α-helix	trans	-69.6	-20.6	-173.2	0	0	0	0	0	114.4	N256 P257 Q475	N256-G259 PolarHBondContact O-N 2.64Å; P257-G259 VanDerWaalsContact C-N 3.3Å; P257-G259 PolarHBondContact O-N 3.33Å; G259-Q475 PolarHBondContact O-NE2 3.49Å
260	S	71.8	Confident	69.7	Low	79 Å²	79	80.2 Å²	80.2	55%	0.552	46%	0.461	S	S	*	.	H	α-helix	trans	-75.7	-36.9	169.3	19.3	0	0	0	0	112.7	P257 N258 S264	P257-S260 PolarHBondContact O-N 2.82Å; P257-S260 PolarHBondContact O-OG 3.28Å; N258-S260 VanDerWaalsContact C-N 3.26Å; N258-S260 PolarHBondContact O-N 2.61Å; S260-S264 PolarHBondContact O-N 2.73Å
261	D	88.3	Confident	72.5	Confident	87 Å²	87	79 Å²	79	47%	0.465	45%	0.454	S	S	.	.	H	α-helix	trans	-79.3	-38.7	-179.2	-171	34.9	0	0	0	112.5	N258 K263 S264 L265 R268	N258-D261 PolarHBondContact O-N 2.82Å; N258-D261 VanDerWaalsContact O-N 3.07Å; D261-K263 PolarHBondContact O-N 3.4Å; D261-S264 CarbonylContact O-C 3.55Å; D261-S264 VanDerWaalsContact O-CA 3.24Å; D261-S264 WeakPolarHBondContact O-CA 3.36Å; D261-S264 WeakPolarHBondContact O-CB 3.43Å; D261-S264 PolarHBondContact O-N 2.87Å; D261-S264 PolarHBondContact O-OG 2.82Å; D261-S264 PolarHBondContact OD1-OG 3.2Å; D261-L265 PolarHBondContact O-N 3.27Å; D261-R268 IonicContact OD1-NH2 2.71Å; D261-R268 PolarHBondContact OD1-NH2 2.82Å; D261-R268 IonicContact OD2-NH2 2.61Å
262	L	93.7	Very high	75.2	Confident	26 Å²	26	73.6 Å²	73.6	14%	0.136	42%	0.422	C	S	.	.	H	α-helix	trans	-57	-38.2	173	-67	175.9	0	0	0	112	N258 S264 L265 A266 Q471 A472	N258-L262 WeakPolarHBondContact O-CG 3.36Å; N258-L262 PolarHBondContact O-N 3.42Å; L262-S264 VanDerWaalsContact C-N 3.3Å; L262-S264 PolarHBondContact O-N 2.91Å; L262-L265 PolarHBondContact O-N 3.48Å; L262-A266 WeakPolarHBondContact O-CB 3.22Å; L262-A266 PolarHBondContact O-N 2.73Å; L262-Q471 HydrophobicContact CD1-CB 3.92Å; L262-Q471 HydrophobicContact CD2-CB 3.92Å; L262-A472 HydrophobicContact CB-CB 4.27Å; L262-A472 HydrophobicContact CD2-CB 4.11Å
263	K	93.8	Very high	78.4	Confident	110 Å²	110	70 Å²	70	48%	0.478	39%	0.391	S	S	.	.	H	α-helix	trans	-65.3	-30.1	171.1	-171.5	-179.5	-177.7	-178	0	112.6	D250 D261 K267	D250-K263 VanDerWaalsContact CG-NZ 3.3Å; D250-K263 IonicContact OD1-NZ 2.86Å; D250-K263 PolarHBondContact OD1-NZ 3.48Å; D250-K263 VanDerWaalsContact OD1-NZ 3.16Å; D250-K263 IonicContact OD2-NZ 2.7Å; D250-K263 PolarHBondContact OD2-NZ 2.86Å; D261-K263 PolarHBondContact O-N 3.4Å; K263-K267 PolarHBondContact O-N 2.81Å
264	S	95.5	Very high	81.1	Confident	41 Å²	41	67.7 Å²	67.7	29%	0.287	37%	0.372	S	S	.	.	H	α-helix	trans	-72.9	-44.1	172.7	113	0	0	0	0	111.6	S260 D261 L262 K267 R268	S260-S264 PolarHBondContact O-N 2.73Å; D261-S264 CarbonylContact O-C 3.55Å; D261-S264 VanDerWaalsContact O-CA 3.24Å; D261-S264 WeakPolarHBondContact O-CA 3.36Å; D261-S264 WeakPolarHBondContact O-CB 3.43Å; D261-S264 PolarHBondContact O-N 2.87Å; D261-S264 PolarHBondContact O-OG 2.82Å; D261-S264 PolarHBondContact OD1-OG 3.2Å; L262-S264 VanDerWaalsContact C-N 3.3Å; L262-S264 PolarHBondContact O-N 2.91Å; S264-K267 PolarHBondContact O-N 3.44Å; S264-R268 WeakPolarHBondContact O-CG 3.44Å; S264-R268 PolarHBondContact O-N 3.27Å; S264-R268 PolarHBondContact OG-NE 3.18Å; S264-R268 PolarHBondContact OG-NH2 3.02Å
265	L	96.9	Very high	84	Confident	14 Å²	14	69.1 Å²	69.1	7%	0.073	37%	0.367	C	S	.	.	H	α-helix	trans	-63.8	-49.4	178.4	-179.6	59.2	0	0	0	110.9	D261 L262 K267 R268 V269 P360 I469 A472	D261-L265 PolarHBondContact O-N 3.27Å; L262-L265 PolarHBondContact O-N 3.48Å; L265-K267 VanDerWaalsContact C-N 3.25Å; L265-K267 PolarHBondContact O-N 3.35Å; L265-R268 WeakPolarHBondContact O-CB 3.3Å; L265-R268 PolarHBondContact O-N 3.41Å; L265-V269 HydrophobicContact CD1-CG2 4.06Å; L265-V269 HydrophobicContact CG-CG2 4.47Å; L265-V269 WeakPolarHBondContact O-CG2 3.47Å; L265-V269 PolarHBondContact O-N 3.06Å; L265-P360 HydrophobicContact CD1-CB 4.32Å; L265-P360 HydrophobicContact CD1-CG 3.81Å; L265-I469 HydrophobicContact CD1-CD1 4.13Å; L265-I469 HydrophobicContact CD2-CD1 4.1Å; L265-I469 HydrophobicContact CG-CD1 4.14Å; L265-A472 HydrophobicContact CD2-CB 4.26Å; L265-A472 HydrophobicContact CG-CB 4.5Å
266	A	97.8	Very high	86.9	Confident	11 Å²	11	65.4 Å²	65.4	9%	0.091	34%	0.343	C	S	.	.	H	α-helix	trans	-50.9	-44.3	172.7	0	0	0	0	0	112.6	L262 N270 L442	L262-A266 WeakPolarHBondContact O-CB 3.22Å; L262-A266 PolarHBondContact O-N 2.73Å; A266-N270 VanDerWaalsContact O-CB 3.23Å; A266-N270 WeakPolarHBondContact O-CB 3.3Å; A266-N270 PolarHBondContact O-N 2.96Å; A266-L442 HydrophobicContact CB-CD1 3.79Å
267	K	97	Very high	89.4	Confident	142 Å²	142	60 Å²	60	62%	0.617	31%	0.314	S	S	*	.	H	α-helix	trans	-69.6	-38.9	177.4	-171.2	179.8	177.9	-173.6	0	112.7	K263 S264 L265 N271	K263-K267 PolarHBondContact O-N 2.81Å; S264-K267 PolarHBondContact O-N 3.44Å; L265-K267 VanDerWaalsContact C-N 3.25Å; L265-K267 PolarHBondContact O-N 3.35Å; K267-N271 WeakPolarHBondContact O-CB 3.04Å; K267-N271 PolarHBondContact O-N 3.5Å; K267-N271 PolarHBondContact O-ND2 3.28Å
268	R	97.6	Very high	91.1	Very high	109 Å²	109	59.4 Å²	59.4	41%	0.411	31%	0.305	S	S	.	.	H	α-helix	trans	-61.3	-51.6	174.8	-76.8	-179.2	-83.8	164.2	-5.1	111.1	D261 S264 L265 N271 A272	D261-R268 IonicContact OD1-NH2 2.71Å; D261-R268 PolarHBondContact OD1-NH2 2.82Å; D261-R268 IonicContact OD2-NH2 2.61Å; S264-R268 WeakPolarHBondContact O-CG 3.44Å; S264-R268 PolarHBondContact O-N 3.27Å; S264-R268 PolarHBondContact OG-NE 3.18Å; S264-R268 PolarHBondContact OG-NH2 3.02Å; L265-R268 WeakPolarHBondContact O-CB 3.3Å; L265-R268 PolarHBondContact O-N 3.41Å; R268-N271 PolarHBondContact O-N 2.93Å; R268-A272 PolarHBondContact O-N 3.34Å
269	V	98.4	Very high	92.7	Very high	0 Å²	0	55.9 Å²	55.9	0%	0	29%	0.286	C	S	.	.	H	α-helix	trans	-64.2	-44.3	-179.1	177.7	0	0	0	0	111.6	L265 N271 A272 Y273 F355 A441 L442 A445 I469	L265-V269 HydrophobicContact CD1-CG2 4.06Å; L265-V269 HydrophobicContact CG-CG2 4.47Å; L265-V269 WeakPolarHBondContact O-CG2 3.47Å; L265-V269 PolarHBondContact O-N 3.06Å; V269-N271 PolarHBondContact O-N 3.17Å; V269-A272 WeakPolarHBondContact O-CB 3.25Å; V269-A272 PolarHBondContact O-N 3.24Å; V269-Y273 WeakPolarHBondContact O-CB 3.41Å; V269-Y273 PolarHBondContact O-N 2.92Å; V269-F355 HydrophobicContact CG1-CE2 4.15Å; V269-F355 HydrophobicContact CG1-CZ 3.87Å; V269-A441 HydrophobicContact CG1-CB 4.23Å; V269-A441 WeakPolarHBondContact CG1-O 3.43Å; V269-L442 HydrophobicContact CB-CD2 4.28Å; V269-L442 HydrophobicContact CG1-CD2 4.3Å; V269-L442 HydrophobicContact CG2-CD2 4.46Å; V269-A445 HydrophobicContact CG1-CB 3.93Å; V269-I469 HydrophobicContact CG2-CD1 3.73Å
270	N	98.3	Very high	94.4	Very high	32 Å²	32	55.3 Å²	55.3	17%	0.171	28%	0.279	C	S	.	.	H	α-helix	trans	-60.4	-43.7	174	179.9	28.4	0	0	0	112.5	A266 A272 Y273 L274 A441	A266-N270 VanDerWaalsContact O-CB 3.23Å; A266-N270 WeakPolarHBondContact O-CB 3.3Å; A266-N270 PolarHBondContact O-N 2.96Å; N270-A272 VanDerWaalsContact C-N 3.33Å; N270-A272 PolarHBondContact O-N 3.49Å; N270-Y273 PolarHBondContact O-N 3.03Å; N270-L274 WeakPolarHBondContact O-CB 3.15Å; N270-L274 VanDerWaalsContact O-CG 3.29Å; N270-L274 WeakPolarHBondContact O-CG 3.21Å; N270-L274 PolarHBondContact O-N 3.27Å; N270-L274 WeakPolarHBondContact OD1-CD1 3.32Å; N270-A441 HydrophobicContact CB-CB 4.32Å
271	N	98	Very high	95.5	Very high	93 Å²	93	52 Å²	52	50%	0.497	26%	0.255	S	S	.	.	H	α-helix	trans	-62.6	-39.2	176.2	-75	-9.9	0	0	0	112.2	K267 R268 V269 K275	K267-N271 WeakPolarHBondContact O-CB 3.04Å; K267-N271 PolarHBondContact O-N 3.5Å; K267-N271 PolarHBondContact O-ND2 3.28Å; R268-N271 PolarHBondContact O-N 2.93Å; V269-N271 PolarHBondContact O-N 3.17Å; N271-K275 VanDerWaalsContact O-CB 3.29Å; N271-K275 WeakPolarHBondContact O-CB 3.4Å; N271-K275 PolarHBondContact O-N 3.3Å
272	A	98.2	Very high	95.8	Very high	10 Å²	10	56 Å²	56	8%	0.083	27%	0.268	C	S	.	.	H	α-helix	trans	-63.7	-46.6	174.7	0	0	0	0	0	112.2	R268 V269 N270 L274 K275 N276 F355	R268-A272 PolarHBondContact O-N 3.34Å; V269-A272 WeakPolarHBondContact O-CB 3.25Å; V269-A272 PolarHBondContact O-N 3.24Å; N270-A272 VanDerWaalsContact C-N 3.33Å; N270-A272 PolarHBondContact O-N 3.49Å; A272-L274 PolarHBondContact O-N 3.21Å; A272-K275 PolarHBondContact O-N 3.46Å; A272-N276 PolarHBondContact O-N 2.88Å; A272-N276 PolarHBondContact O-ND2 3.26Å; A272-F355 HydrophobicContact CB-CD2 4.07Å; A272-F355 HydrophobicContact CB-CE2 4.1Å
273	Y	98.4	Very high	95.7	Very high	4 Å²	4	59.2 Å²	59.2	2%	0.016	28%	0.281	C	S	.	.	H	α-helix	trans	-57.7	-48.6	176.5	-177.8	-89.2	0	0	0	111.4	V269 N270 K275 L277 F355 M385 D437 A441 V444	V269-Y273 WeakPolarHBondContact O-CB 3.41Å; V269-Y273 PolarHBondContact O-N 2.92Å; N270-Y273 PolarHBondContact O-N 3.03Å; Y273-K275 VanDerWaalsContact C-N 3.29Å; Y273-K275 PolarHBondContact O-N 2.99Å; Y273-L277 HydrophobicContact CD1-CD1 4.05Å; Y273-L277 HydrophobicContact CD2-CD1 3.26Å; Y273-L277 HydrophobicContact CE1-CD1 4Å; Y273-L277 HydrophobicContact CE2-CD1 3.2Å; Y273-L277 HydrophobicContact CG-CD1 3.7Å; Y273-L277 WeakPolarHBondContact O-CB 3.45Å; Y273-L277 PolarHBondContact O-N 3.14Å; Y273-L277 VanDerWaalsContact O-N 3.14Å; Y273-F355 HydrophobicContact CD2-CE2 4.28Å; Y273-F355 HydrophobicContact CD2-CZ 4.27Å; Y273-F355 HydrophobicContact CG-CE2 4.49Å; Y273-M385 HydrophobicContact CE2-CG 4.45Å; Y273-M385 HydrophobicContact CE2-SD 3.9Å; Y273-D437 HydrophobicContact CE1-CB 4.26Å; Y273-A441 VanDerWaalsContact CB-CB 3.46Å; Y273-A441 HydrophobicContact CD1-CB 4.08Å; Y273-A441 HydrophobicContact CD2-CB 3.87Å; Y273-A441 HydrophobicContact CG-CB 3.56Å; Y273-V444 HydrophobicContact CE2-CG2 4.36Å
274	L	96.9	Very high	95.8	Very high	72 Å²	72	54 Å²	54	38%	0.377	26%	0.258	S	S	.	.	H	α-helix	trans	-69.7	-21.1	179	-66.9	175.7	0	0	0	114.3	N270 A272 T280 D437	N270-L274 WeakPolarHBondContact O-CB 3.15Å; N270-L274 VanDerWaalsContact O-CG 3.29Å; N270-L274 WeakPolarHBondContact O-CG 3.21Å; N270-L274 PolarHBondContact O-N 3.27Å; N270-L274 WeakPolarHBondContact OD1-CD1 3.32Å; A272-L274 PolarHBondContact O-N 3.21Å; L274-T280 HydrophobicContact CD2-CG2 3.78Å; L274-D437 HydrophobicContact CD2-CB 4.04Å
275	K	96.6	Very high	95.6	Very high	164 Å²	164	55.3 Å²	55.3	71%	0.713	26%	0.256	S	S	*	.	H	α-helix	trans	-80.5	-47.3	175.6	-179.8	-161.3	168.3	-148.5	0	111.5	N271 A272 Y273	N271-K275 VanDerWaalsContact O-CB 3.29Å; N271-K275 WeakPolarHBondContact O-CB 3.4Å; N271-K275 PolarHBondContact O-N 3.3Å; A272-K275 PolarHBondContact O-N 3.46Å; Y273-K275 VanDerWaalsContact C-N 3.29Å; Y273-K275 PolarHBondContact O-N 2.99Å
276	N	96.2	Very high	95.4	Very high	25 Å²	25	56.2 Å²	56.2	13%	0.134	26%	0.264	C	S	.	.	H	α-helix	trans	-92	-21.2	-166.7	-60.3	-28.3	0	0	0	113.5	A272 E354 F355 S358	A272-N276 PolarHBondContact O-N 2.88Å; A272-N276 PolarHBondContact O-ND2 3.26Å; N276-E354 PolarHBondContact ND2-O 3Å; N276-F355 HydrophobicContact CB-CB 4.38Å; N276-F355 WeakPolarHBondContact ND2-CA 3.41Å; N276-F355 PolarHBondContact ND2-N 2.99Å; N276-S358 PolarHBondContact ND2-OG 3.4Å
277	L	93.9	Very high	95.1	Very high	9 Å²	9	57.3 Å²	57.3	5%	0.047	27%	0.268	C	S	.	.			trans	-97.4	125.1	180	-68.6	159.2	0	0	0	113.3	Y273 E351 M385	Y273-L277 HydrophobicContact CD1-CD1 4.05Å; Y273-L277 HydrophobicContact CD2-CD1 3.26Å; Y273-L277 HydrophobicContact CE1-CD1 4Å; Y273-L277 HydrophobicContact CE2-CD1 3.2Å; Y273-L277 HydrophobicContact CG-CD1 3.7Å; Y273-L277 WeakPolarHBondContact O-CB 3.45Å; Y273-L277 PolarHBondContact O-N 3.14Å; Y273-L277 VanDerWaalsContact O-N 3.14Å; L277-E351 VanDerWaalsContact CA-OE2 3.29Å; L277-E351 WeakPolarHBondContact CA-OE2 3.3Å; L277-E351 HydrophobicContact CD2-CB 3.81Å; L277-M385 HydrophobicContact CD1-SD 3.64Å; L277-M385 HydrophobicContact CD2-CE 4.02Å; L277-M385 HydrophobicContact CD2-SD 3.91Å; L277-M385 HydrophobicContact CG-SD 4.46Å
278	N	89.1	Confident	94.8	Very high	89 Å²	89	52.2 Å²	52.2	48%	0.476	25%	0.247	S	C	.	.	S	Bend	trans	-69	-39.1	-176.1	-86.7	-57.3	0	0	0	113	K283 E351 N399	N278-K283 WeakPolarHBondContact O-CD 3.41Å; N278-K283 PolarHBondContact O-NZ 3.22Å; N278-E351 WeakPolarHBondContact CB-OE1 3.33Å; N278-E351 PolarHBondContact N-OE2 2.85Å; N278-E351 PolarHBondContact ND2-OE1 2.93Å; N278-N399 VanDerWaalsContact CB-OD1 3.31Å; N278-N399 WeakPolarHBondContact CB-OD1 3.46Å
279	M	90.9	Very high	94.4	Very high	38 Å²	38	50.3 Å²	50.3	19%	0.187	25%	0.248	C	C	.	.	S	Bend	trans	-120.1	89.1	-176.4	-174.6	52.4	66.4	0	0	113.4	K283 A284 I287 L389 N399	M279-K283 HydrophobicContact CE-CB 4.33Å; M279-K283 HydrophobicContact SD-CB 3.42Å; M279-K283 WeakPolarHBondContact SD-CB 3.29Å; M279-K283 HydrophobicContact SD-CD 4.44Å; M279-A284 HydrophobicContact CG-CB 4.26Å; M279-A284 HydrophobicContact SD-CB 3.95Å; M279-A284 PolarHBondContact SD-N 2.73Å; M279-A284 VanDerWaalsContact SD-N 3.43Å; M279-I287 HydrophobicContact CE-CD1 3.98Å; M279-L389 HydrophobicContact CB-CD2 4.26Å; M279-L389 HydrophobicContact CG-CD2 3.41Å; M279-L389 VanDerWaalsContact CG-CD2 3.41Å; M279-N399 WeakPolarHBondContact CE-O 3.34Å
280	T	94.8	Very high	93.7	Very high	6 Å²	6	52.7 Å²	52.7	4%	0.037	27%	0.272	C	S	.	.			trans	-74	159.4	175.2	98.5	0	0	0	0	112	L274 K282 K283 A284 D437	L274-T280 HydrophobicContact CD2-CG2 3.78Å; T280-K282 VanDerWaalsContact C-N 3.28Å; T280-K282 PolarHBondContact O-N 3.04Å; T280-K282 PolarHBondContact OG1-N 3.34Å; T280-K283 HydrophobicContact CG2-CD 4.03Å; T280-K283 HydrophobicContact CG2-CG 4.37Å; T280-K283 WeakPolarHBondContact O-CB 3.22Å; T280-K283 PolarHBondContact O-N 2.77Å; T280-K283 PolarHBondContact OG1-N 3.12Å; T280-A284 PolarHBondContact O-N 2.77Å; T280-D437 VanDerWaalsContact CB-OD1 3.3Å; T280-D437 WeakPolarHBondContact CB-OD1 3.21Å; T280-D437 VanDerWaalsContact CB-OD2 3.3Å; T280-D437 WeakPolarHBondContact CB-OD2 3.46Å; T280-D437 PolarHBondContact OG1-OD2 3.31Å
281	K	95.8	Very high	92.7	Very high	11 Å²	11	57.7 Å²	57.7	5%	0.048	29%	0.292	C	S	.	.	H	α-helix	trans	-57.9	-38.5	176.7	-168.3	176.6	-143.1	169.7	0	112.2	A284 R285 S388 L435 D437 L440	K281-A284 PolarHBondContact O-N 3.04Å; K281-R285 HydrophobicContact CG-CG 4.11Å; K281-R285 WeakPolarHBondContact O-CB 3.48Å; K281-R285 WeakPolarHBondContact O-CG 3.3Å; K281-R285 PolarHBondContact O-N 3.17Å; K281-S388 WeakPolarHBondContact CD-OG 3.4Å; K281-S388 WeakPolarHBondContact CE-OG 3.4Å; K281-S388 WeakPolarHBondContact CG-OG 3.45Å; K281-L435 WeakPolarHBondContact CD-O 3.47Å; K281-L435 VanDerWaalsContact CE-O 3.29Å; K281-L435 WeakPolarHBondContact CE-O 3.39Å; K281-L435 PolarHBondContact NZ-O 2.68Å; K281-D437 WeakPolarHBondContact CA-OD1 3.16Å; K281-D437 WeakPolarHBondContact CB-OD1 3.29Å; K281-D437 PolarHBondContact N-OD1 2.94Å; K281-L440 HydrophobicContact CB-CD1 4.37Å; K281-L440 HydrophobicContact CD-CD1 3.84Å
282	K	93.6	Very high	91.3	Very high	170 Å²	170	56.2 Å²	56.2	74%	0.739	29%	0.285	S	S	*	.	H	α-helix	trans	-63.4	-40.5	174.4	-177.3	179.4	177.3	-177	0	112.5	T280 S286 D437	T280-K282 VanDerWaalsContact C-N 3.28Å; T280-K282 PolarHBondContact O-N 3.04Å; T280-K282 PolarHBondContact OG1-N 3.34Å; K282-S286 PolarHBondContact O-N 3.46Å; K282-D437 WeakPolarHBondContact CB-OD2 3.16Å; K282-D437 PolarHBondContact N-OD2 3.27Å
283	K	92.8	Very high	89.2	Confident	94 Å²	94	61.4 Å²	61.4	41%	0.409	32%	0.32	S	S	.	.	H	α-helix	trans	-63.9	-54.7	173	-64.8	175.9	-176.3	164.2	0	110	N278 M279 T280 R285 S286 I287	N278-K283 WeakPolarHBondContact O-CD 3.41Å; N278-K283 PolarHBondContact O-NZ 3.22Å; M279-K283 HydrophobicContact CE-CB 4.33Å; M279-K283 HydrophobicContact SD-CB 3.42Å; M279-K283 WeakPolarHBondContact SD-CB 3.29Å; M279-K283 HydrophobicContact SD-CD 4.44Å; T280-K283 HydrophobicContact CG2-CD 4.03Å; T280-K283 HydrophobicContact CG2-CG 4.37Å; T280-K283 WeakPolarHBondContact O-CB 3.22Å; T280-K283 PolarHBondContact O-N 2.77Å; T280-K283 PolarHBondContact OG1-N 3.12Å; K283-R285 PolarHBondContact O-N 2.85Å; K283-S286 VanDerWaalsContact O-CB 3.25Å; K283-S286 WeakPolarHBondContact O-CB 3.23Å; K283-S286 PolarHBondContact O-N 2.87Å; K283-I287 PolarHBondContact O-N 3.36Å
284	A	94.3	Very high	86.9	Confident	0 Å²	0	66.2 Å²	66.2	0%	0	35%	0.354	C	S	.	.	H	α-helix	trans	-58.1	-43.7	-178.9	0	0	0	0	0	113.4	M279 T280 K281 S286 I287 L288 S388 L389 L396	M279-A284 HydrophobicContact CG-CB 4.26Å; M279-A284 HydrophobicContact SD-CB 3.95Å; M279-A284 PolarHBondContact SD-N 2.73Å; M279-A284 VanDerWaalsContact SD-N 3.43Å; T280-A284 PolarHBondContact O-N 2.77Å; K281-A284 PolarHBondContact O-N 3.04Å; A284-S286 VanDerWaalsContact C-N 3.3Å; A284-S286 PolarHBondContact O-N 2.83Å; A284-I287 PolarHBondContact O-N 3.47Å; A284-L288 WeakPolarHBondContact O-CB 3.11Å; A284-L288 WeakPolarHBondContact O-CG 3.47Å; A284-L288 PolarHBondContact O-N 3.43Å; A284-S388 WeakPolarHBondContact CB-O 3.49Å; A284-L389 HydrophobicContact CB-CD2 3.92Å; A284-L396 HydrophobicContact CB-CD1 3.98Å
285	R	92.8	Very high	84.5	Confident	68 Å²	68	65.6 Å²	65.6	26%	0.257	36%	0.356	S	S	.	.	H	α-helix	trans	-70.9	-21.4	177.4	-67.2	-72.8	178.5	-127.9	-0.4	113.5	K281 K283 T289 P387 M390 N431	K281-R285 HydrophobicContact CG-CG 4.11Å; K281-R285 WeakPolarHBondContact O-CB 3.48Å; K281-R285 WeakPolarHBondContact O-CG 3.3Å; K281-R285 PolarHBondContact O-N 3.17Å; K283-R285 PolarHBondContact O-N 2.85Å; R285-T289 WeakPolarHBondContact O-CG2 3.47Å; R285-T289 PolarHBondContact O-N 3.31Å; R285-T289 PolarHBondContact O-OG1 2.9Å; R285-P387 PolarHBondContact NH2-O 2.94Å; R285-P387 VanDerWaalsContact NH2-O 3.12Å; R285-M390 PolarHBondContact NH1-O 3.33Å; R285-M390 PolarHBondContact NH2-O 3.15Å; R285-N431 PolarHBondContact NH2-ND2 2.89Å; R285-N431 PolarHBondContact NH2-OD1 2.92Å
286	S	91.4	Very high	82	Confident	33 Å²	33	64.5 Å²	64.5	23%	0.231	37%	0.365	C	S	.	.	H	α-helix	trans	-67.5	-48.6	169.5	-167.3	0	0	0	0	110.6	K282 K283 A284 T289 G290 K291	K282-S286 PolarHBondContact O-N 3.46Å; K283-S286 VanDerWaalsContact O-CB 3.25Å; K283-S286 WeakPolarHBondContact O-CB 3.23Å; K283-S286 PolarHBondContact O-N 2.87Å; A284-S286 VanDerWaalsContact C-N 3.3Å; A284-S286 PolarHBondContact O-N 2.83Å; S286-T289 PolarHBondContact O-N 3.32Å; S286-G290 PolarHBondContact O-N 2.72Å; S286-K291 PolarHBondContact O-N 3.09Å; S286-K291 PolarHBondContact OG-O 2.79Å
287	I	91.7	Very high	79.7	Confident	34 Å²	34	67.7 Å²	67.7	17%	0.174	39%	0.386	C	S	.	.	H	α-helix	trans	-63.3	-56.2	177.9	-58.4	171.3	0	0	0	110.3	M279 K283 A284 T289 G290 P302 L396	M279-I287 HydrophobicContact CE-CD1 3.98Å; K283-I287 PolarHBondContact O-N 3.36Å; A284-I287 PolarHBondContact O-N 3.47Å; I287-T289 PolarHBondContact O-N 2.9Å; I287-G290 PolarHBondContact O-N 2.69Å; I287-P302 HydrophobicContact CG2-CG 4.04Å; I287-L396 HydrophobicContact CB-CD1 4.13Å; I287-L396 HydrophobicContact CD1-CD1 4.4Å; I287-L396 HydrophobicContact CG2-CD1 4.16Å; I287-L396 HydrophobicContact CG2-CD2 3.88Å
288	L	91.2	Very high	77.5	Confident	36 Å²	36	71.4 Å²	71.4	19%	0.188	42%	0.418	C	S	.	.	T	Hydrogen-bonded Turn	trans	-62.2	-9.2	-179.1	-71.4	173.8	0	0	0	115	A284 L396 F403	A284-L288 WeakPolarHBondContact O-CB 3.11Å; A284-L288 WeakPolarHBondContact O-CG 3.47Å; A284-L288 PolarHBondContact O-N 3.43Å; L288-L396 HydrophobicContact CD1-CD1 4.24Å; L288-L396 HydrophobicContact CD2-CD1 4.21Å; L288-L396 HydrophobicContact CD2-CD2 4.25Å; L288-L396 HydrophobicContact CD2-CG 3.9Å; L288-L396 HydrophobicContact CG-CD1 3.8Å; L288-L396 HydrophobicContact CG-CG 4.05Å; L288-F403 HydrophobicContact CD2-CD2 3.95Å; L288-F403 HydrophobicContact CD2-CE2 3.68Å
289	T	89.5	Confident	75.8	Confident	69 Å²	69	75 Å²	75	42%	0.423	43%	0.426	S	S	.	.	T	Hydrogen-bonded Turn	trans	-119.6	12.6	174.6	69.9	0	0	0	0	114.3	R285 S286 I287 K291	R285-T289 WeakPolarHBondContact O-CG2 3.47Å; R285-T289 PolarHBondContact O-N 3.31Å; R285-T289 PolarHBondContact O-OG1 2.9Å; S286-T289 PolarHBondContact O-N 3.32Å; I287-T289 PolarHBondContact O-N 2.9Å; T289-K291 VanDerWaalsContact C-N 3.31Å; T289-K291 VanDerWaalsContact CB-NZ 3.35Å; T289-K291 PolarHBondContact O-N 2.62Å; T289-K291 WeakPolarHBondContact OG1-CD 3.3Å; T289-K291 PolarHBondContact OG1-NZ 2.99Å
290	G	83.6	Confident	74.6	Confident	49 Å²	49	77.6 Å²	77.6	51%	0.505	45%	0.446	S	S	.	.	T	Hydrogen-bonded Turn	trans	65.4	28.5	175.5	0	0	0	0	0	114.3	S286 I287	S286-G290 PolarHBondContact O-N 2.72Å; I287-G290 PolarHBondContact O-N 2.69Å
291	K	78	Confident	73.9	Confident	137 Å²	137	85.1 Å²	85.1	60%	0.596	47%	0.474	S	S	*	.			trans	-111	21	-173.3	-70.5	172.6	-158.4	131.3	0	113.6	S286 T289 S293	S286-K291 PolarHBondContact O-N 3.09Å; S286-K291 PolarHBondContact OG-O 2.79Å; T289-K291 VanDerWaalsContact C-N 3.31Å; T289-K291 VanDerWaalsContact CB-NZ 3.35Å; T289-K291 PolarHBondContact O-N 2.62Å; T289-K291 WeakPolarHBondContact OG1-CD 3.3Å; T289-K291 PolarHBondContact OG1-NZ 2.99Å; K291-S293 PolarHBondContact O-N 3.49Å
292	N	67.6	Low	73.7	Confident	63 Å²	63	85.8 Å²	85.8	34%	0.337	48%	0.48	S	S	.	.			trans	-74.8	63.6	179.9	-168.2	21.2	0	0	0	112.2	S294	N292-S294 PolarHBondContact O-N 3.2Å
293	S	53.1	Low	73.7	Confident	118 Å²	118	80.3 Å²	80.3	83%	0.825	46%	0.456	S	S	*	.	T	Hydrogen-bonded Turn	trans	-86.8	22.3	-175.1	69.4	0	0	0	0	113.9	K291	K291-S293 PolarHBondContact O-N 3.49Å
294	S	51.3	Low	73.9	Confident	106 Å²	106	78.8 Å²	78.8	74%	0.741	46%	0.455	S	S	*	.	T	Hydrogen-bonded Turn	trans	-153.6	31.6	-167.9	68.2	0	0	0	0	114.3	N292	N292-S294 PolarHBondContact O-N 3.2Å
295	S	45.8	Very low	74	Confident	58 Å²	58	78.8 Å²	78.8	41%	0.406	46%	0.455	S	S	.	.			trans	-142.2	120.7	174.6	-161.2	0	0	0	0	110	V297	S295-V297 PolarHBondContact O-N 3.48Å; S295-V297 WeakPolarHBondContact OG-CG2 3.18Å
296	P	43.8	Very low	74.1	Confident	141 Å²	141	80.5 Å²	80.5	92%	0.916	47%	0.465	S	S	*	.			trans	-82.2	41.1	-176.6	36.1	-37.3	0	0	0	112.2
297	V	48.9	Very low	74.2	Confident	92 Å²	92	81.6 Å²	81.6	56%	0.558	47%	0.469	S	S	*	.			trans	-84.9	138.4	178.6	177.6	0	0	0	0	108.9	S295 Y299	S295-V297 PolarHBondContact O-N 3.48Å; S295-V297 WeakPolarHBondContact OG-CG2 3.18Å; V297-Y299 PolarHBondContact O-N 2.91Å
298	A	48.3	Very low	74	Confident	88 Å²	88	83.7 Å²	83.7	73%	0.727	48%	0.479	S	S	*	.	S	Bend	trans	-62.2	-5.8	-173.1	0	0	0	0	0	115.8
299	Y	52.1	Low	73.9	Confident	165 Å²	165	87.2 Å²	87.2	65%	0.647	50%	0.498	S	S	*	.			trans	-126.4	106.3	-179.1	-57.6	-73.1	0	0	0	109.6	V297 Y301	V297-Y299 PolarHBondContact O-N 2.91Å; Y299-Y301 PolarHBondContact O-N 3.33Å
300	P	65.7	Low	74.1	Confident	92 Å²	92	84.1 Å²	84.1	60%	0.597	48%	0.479	S	S	*	.	S	Bend	trans	-75.2	-10.3	-176.1	27.9	-33.6	0	0	0	114.1
301	Y	80.5	Confident	74.4	Confident	163 Å²	163	82.1 Å²	82.1	64%	0.639	46%	0.456	S	S	*	.	S	Bend	trans	-136.6	151.5	-179.8	-58.8	-70.1	0	0	0	110	Y299	Y299-Y301 PolarHBondContact O-N 3.33Å
302	P	91.7	Very high	74.8	Confident	25 Å²	25	79.8 Å²	79.8	16%	0.162	45%	0.448	C	S	.	.	P	Polyproline II helix	trans	-65.7	143.7	173.6	28.4	-34.4	0	0	0	110.7	I287 V304 L396 K401 F403	I287-P302 HydrophobicContact CG2-CG 4.04Å; P302-V304 PolarHBondContact O-N 3.45Å; P302-L396 HydrophobicContact CB-CD2 4.15Å; P302-L396 HydrophobicContact CG-CD2 4.06Å; P302-K401 CarbonylContact C-O 3.51Å; P302-K401 VanDerWaalsContact CA-O 3.26Å; P302-K401 WeakPolarHBondContact CA-O 3.3Å; P302-F403 HydrophobicContact CB-CB 4Å; P302-F403 HydrophobicContact CG-CB 3.91Å
303	F	94	Very high	75.8	Confident	56 Å²	56	81.3 Å²	81.3	25%	0.246	45%	0.453	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-65.6	128.8	169.4	-179.4	-85.2	0	0	0	109.6	I305 S310 Q313 A314 L318 V319 K401 G402 F403	F303-I305 HydrophobicContact CD1-CG1 3.96Å; F303-I305 HydrophobicContact CE1-CG1 4.06Å; F303-S310 VanDerWaalsContact CE1-O 3.25Å; F303-S310 WeakPolarHBondContact CE1-O 3.41Å; F303-Q313 HydrophobicContact CE1-CB 4.5Å; F303-Q313 HydrophobicContact CE2-CB 4.5Å; F303-Q313 HydrophobicContact CZ-CB 3.83Å; F303-A314 HydrophobicContact CD1-CB 4.07Å; F303-A314 HydrophobicContact CE1-CB 4Å; F303-L318 HydrophobicContact CD2-CB 4.47Å; F303-L318 HydrophobicContact CD2-CD1 3.81Å; F303-L318 HydrophobicContact CE2-CD1 3.47Å; F303-L318 VanDerWaalsContact CE2-CD1 3.47Å; F303-L318 HydrophobicContact CZ-CD1 4.1Å; F303-V319 HydrophobicContact CB-CG2 3.78Å; F303-V319 HydrophobicContact CD1-CG2 3.88Å; F303-V319 HydrophobicContact CG-CG2 4.09Å; F303-K401 PolarHBondContact N-O 3Å; F303-G402 CarbonylContact O-C 3.49Å; F303-G402 VanDerWaalsContact O-CA 3.3Å; F303-G402 WeakPolarHBondContact O-CA 3.46Å; F303-F403 PolarHBondContact O-N 3.48Å
304	V	96.3	Very high	77.6	Confident	62 Å²	62	75.7 Å²	75.7	38%	0.376	41%	0.414	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-91.1	128.2	-175.2	-176.1	0	0	0	0	110.1	P302 H306 F403 T405	P302-V304 PolarHBondContact O-N 3.45Å; V304-H306 HydrophobicContact CG1-CB 4.49Å; V304-F403 WeakPolarHBondContact CA-O 3.46Å; V304-F403 HydrophobicContact CG1-CD1 4.37Å; V304-T405 HydrophobicContact CG1-CG2 3.87Å
305	I	96.3	Very high	79.2	Confident	0 Å²	0	71 Å²	71	0%	0	38%	0.38	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-107.5	111.4	176	-58.3	168.1	0	0	0	107.3	F303 L311 A314 W320 F403 V404 T405 F408	F303-I305 HydrophobicContact CD1-CG1 3.96Å; F303-I305 HydrophobicContact CE1-CG1 4.06Å; I305-L311 HydrophobicContact CG2-CB 3.97Å; I305-L311 HydrophobicContact CG2-CD1 4.18Å; I305-A314 HydrophobicContact CD1-CB 3.49Å; I305-A314 VanDerWaalsContact CD1-CB 3.49Å; I305-A314 HydrophobicContact CG1-CB 3.79Å; I305-W320 HydrophobicContact CD1-CH2 3.71Å; I305-W320 HydrophobicContact CD1-CZ3 3.83Å; I305-F403 PolarHBondContact N-O 3.16Å; I305-V404 HydrophobicContact CB-CG2 4.26Å; I305-V404 HydrophobicContact CD1-CG2 4.08Å; I305-V404 HydrophobicContact CG2-CG1 4.46Å; I305-V404 WeakPolarHBondContact O-CA 3.41Å; I305-T405 PolarHBondContact O-N 3.37Å; I305-F408 HydrophobicContact CG2-CD1 4.13Å; I305-F408 HydrophobicContact CG2-CE1 3.75Å; I305-F408 HydrophobicContact CG2-CZ 4.3Å
306	H	95.8	Very high	81	Confident	103 Å²	103	74 Å²	74	48%	0.477	39%	0.392	S	S	.	.			trans	-132.7	-6.1	-175.3	56.7	66.4	0	0	0	114.4	V304 S310 T405 F408	V304-H306 HydrophobicContact CG1-CB 4.49Å; H306-S310 PolarHBondContact N-OG 3.24Å; H306-T405 HydrophobicContact CB-CG2 3.86Å; H306-F408 VanDerWaalsContact C-CD2 3.44Å; H306-F408 WeakPolarHBondContact O-CD2 3.47Å
307	D	93.3	Very high	82.7	Confident	57 Å²	57	69.2 Å²	69.2	31%	0.305	37%	0.368	S	S	.	.	S	Bend	trans	-158.6	-174.4	-179.1	55.8	30.2	0	0	0	111.4	D309 S310 L311 F408	D307-D309 PolarHBondContact OD1-N 3.37Å; D307-S310 PolarHBondContact N-OG 3.05Å; D307-S310 PolarHBondContact O-OG 3.34Å; D307-S310 VanDerWaalsContact OD1-CB 3.26Å; D307-S310 WeakPolarHBondContact OD1-CB 3.36Å; D307-S310 PolarHBondContact OD1-N 2.95Å; D307-S310 PolarHBondContact OD1-OG 3.07Å; D307-L311 WeakPolarHBondContact O-CB 3.33Å; D307-L311 PolarHBondContact O-N 3.44Å; D307-L311 VanDerWaalsContact O-N 3.07Å; D307-F408 VanDerWaalsContact CA-CE2 3.47Å; D307-F408 WeakPolarHBondContact O-CE2 3.44Å
308	M	87.1	Confident	84.2	Confident	77 Å²	77	68.6 Å²	68.6	38%	0.379	36%	0.361	S	S	.	.	H	α-helix	trans	-61.5	-43.6	177	-74.6	-101.4	50.1	0	0	113	L311 H312 I333	M308-L311 HydrophobicContact CE-CD2 4.48Å; M308-L311 PolarHBondContact O-N 3.03Å; M308-H312 PolarHBondContact O-N 2.78Å; M308-H312 PolarHBondContact O-ND1 3.07Å; M308-I333 HydrophobicContact CE-CB 3.86Å; M308-I333 HydrophobicContact CE-CD1 3.57Å; M308-I333 HydrophobicContact CE-CG1 3.61Å; M308-I333 HydrophobicContact CG-CD1 3.8Å; M308-I333 HydrophobicContact SD-CB 3.96Å; M308-I333 HydrophobicContact SD-CD1 3.7Å; M308-I333 HydrophobicContact SD-CG1 4.11Å
309	D	89.9	Confident	85.9	Confident	111 Å²	111	64.5 Å²	64.5	59%	0.594	33%	0.326	S	S	*	.	H	α-helix	trans	-73.3	-38.8	-172.5	-64.9	-23.3	0	0	0	111.4	D307 Q313	D307-D309 PolarHBondContact OD1-N 3.37Å; D309-Q313 VanDerWaalsContact C-NE2 3.35Å; D309-Q313 WeakPolarHBondContact O-CB 3.49Å; D309-Q313 VanDerWaalsContact O-CG 3.25Å; D309-Q313 WeakPolarHBondContact O-CG 3.34Å; D309-Q313 PolarHBondContact O-N 3.4Å; D309-Q313 PolarHBondContact O-NE2 3.04Å
310	S	93.4	Very high	87.5	Confident	4 Å²	4	58.4 Å²	58.4	3%	0.028	30%	0.302	C	S	.	.	H	α-helix	trans	-67.5	-36.8	171.5	56	0	0	0	0	111.9	F303 H306 D307 Q313 A314	F303-S310 VanDerWaalsContact CE1-O 3.25Å; F303-S310 WeakPolarHBondContact CE1-O 3.41Å; H306-S310 PolarHBondContact N-OG 3.24Å; D307-S310 PolarHBondContact N-OG 3.05Å; D307-S310 PolarHBondContact O-OG 3.34Å; D307-S310 VanDerWaalsContact OD1-CB 3.26Å; D307-S310 WeakPolarHBondContact OD1-CB 3.36Å; D307-S310 PolarHBondContact OD1-N 2.95Å; D307-S310 PolarHBondContact OD1-OG 3.07Å; S310-Q313 PolarHBondContact O-N 3.45Å; S310-A314 WeakPolarHBondContact O-CB 3.26Å; S310-A314 PolarHBondContact O-N 3.3Å
311	L	90.3	Very high	87.5	Confident	6 Å²	6	60 Å²	60	3%	0.031	31%	0.306	C	S	.	.	H	α-helix	trans	-61.7	-51.1	172.3	179.8	62.3	0	0	0	111.4	I305 D307 M308 Q313 A314 E315 W320 I333 H336 V337 F408	I305-L311 HydrophobicContact CG2-CB 3.97Å; I305-L311 HydrophobicContact CG2-CD1 4.18Å; D307-L311 WeakPolarHBondContact O-CB 3.33Å; D307-L311 PolarHBondContact O-N 3.44Å; D307-L311 VanDerWaalsContact O-N 3.07Å; M308-L311 HydrophobicContact CE-CD2 4.48Å; M308-L311 PolarHBondContact O-N 3.03Å; L311-Q313 VanDerWaalsContact C-N 3.32Å; L311-Q313 PolarHBondContact O-N 3Å; L311-A314 WeakPolarHBondContact O-CB 3.29Å; L311-A314 PolarHBondContact O-N 3.42Å; L311-A314 VanDerWaalsContact O-N 3.08Å; L311-E315 HydrophobicContact CD1-CG 4.24Å; L311-E315 HydrophobicContact CG-CG 4.49Å; L311-E315 WeakPolarHBondContact O-CG 3.43Å; L311-E315 PolarHBondContact O-N 2.78Å; L311-W320 HydrophobicContact CD1-CZ3 4.3Å; L311-I333 HydrophobicContact CD2-CD1 4.41Å; L311-I333 HydrophobicContact CD2-CG1 3.92Å; L311-H336 HydrophobicContact CD2-CB 4.45Å; L311-V337 HydrophobicContact CD2-CG2 3.96Å; L311-F408 HydrophobicContact CB-CZ 4.18Å; L311-F408 HydrophobicContact CD2-CZ 4.12Å
312	H	86.2	Confident	86.4	Confident	88 Å²	88	59.4 Å²	59.4	41%	0.407	31%	0.309	S	S	.	.	H	α-helix	trans	-58.4	-42.2	177.9	-70.7	118.9	0	0	0	112.2	M308 A314 E315 N316	M308-H312 PolarHBondContact O-N 2.78Å; M308-H312 PolarHBondContact O-ND1 3.07Å; H312-A314 VanDerWaalsContact C-N 3.34Å; H312-A314 PolarHBondContact O-N 3.24Å; H312-E315 PolarHBondContact O-N 2.62Å; H312-N316 VanDerWaalsContact O-CB 3.29Å; H312-N316 WeakPolarHBondContact O-CB 3.42Å; H312-N316 VanDerWaalsContact O-CG 3.24Å; H312-N316 PolarHBondContact O-N 3.47Å; H312-N316 PolarHBondContact O-ND2 3.27Å; H312-N316 VanDerWaalsContact O-ND2 3.08Å
313	Q	88.9	Confident	84.6	Confident	96 Å²	96	62.4 Å²	62.4	45%	0.449	32%	0.323	S	S	.	.	H	α-helix	trans	-61.2	-40.1	174.5	-76.7	169.5	78.3	0	0	112.6	F303 D309 S310 L311 N316 L318	F303-Q313 HydrophobicContact CE1-CB 4.5Å; F303-Q313 HydrophobicContact CE2-CB 4.5Å; F303-Q313 HydrophobicContact CZ-CB 3.83Å; D309-Q313 VanDerWaalsContact C-NE2 3.35Å; D309-Q313 WeakPolarHBondContact O-CB 3.49Å; D309-Q313 VanDerWaalsContact O-CG 3.25Å; D309-Q313 WeakPolarHBondContact O-CG 3.34Å; D309-Q313 PolarHBondContact O-N 3.4Å; D309-Q313 PolarHBondContact O-NE2 3.04Å; S310-Q313 PolarHBondContact O-N 3.45Å; L311-Q313 VanDerWaalsContact C-N 3.32Å; L311-Q313 PolarHBondContact O-N 3Å; Q313-N316 PolarHBondContact O-N 2.92Å; Q313-L318 HydrophobicContact CB-CD1 3.98Å; Q313-L318 WeakPolarHBondContact O-CB 3.23Å; Q313-L318 WeakPolarHBondContact O-CG 3.35Å
314	A	89.2	Confident	82.7	Confident	0 Å²	0	62.6 Å²	62.6	0%	0	33%	0.326	C	S	.	.	I	π-helix	trans	-66.6	-39.1	176.7	0	0	0	0	0	112.9	F303 I305 S310 L311 H312 V319 W320	F303-A314 HydrophobicContact CD1-CB 4.07Å; F303-A314 HydrophobicContact CE1-CB 4Å; I305-A314 HydrophobicContact CD1-CB 3.49Å; I305-A314 VanDerWaalsContact CD1-CB 3.49Å; I305-A314 HydrophobicContact CG1-CB 3.79Å; S310-A314 WeakPolarHBondContact O-CB 3.26Å; S310-A314 PolarHBondContact O-N 3.3Å; L311-A314 WeakPolarHBondContact O-CB 3.29Å; L311-A314 PolarHBondContact O-N 3.42Å; L311-A314 VanDerWaalsContact O-N 3.08Å; H312-A314 VanDerWaalsContact C-N 3.34Å; H312-A314 PolarHBondContact O-N 3.24Å; A314-V319 HydrophobicContact CB-CB 3.85Å; A314-V319 HydrophobicContact CB-CG2 3.6Å; A314-V319 PolarHBondContact O-N 2.81Å; A314-V319 VanDerWaalsContact O-N 3.11Å; A314-W320 HydrophobicContact CB-CE3 4.06Å; A314-W320 HydrophobicContact CB-CZ3 3.65Å; A314-W320 PolarHBondContact O-N 2.69Å; A314-W320 VanDerWaalsContact O-N 3.11Å
315	E	85.1	Confident	80.2	Confident	7 Å²	7	67.6 Å²	67.6	3%	0.033	35%	0.351	C	S	.	.	I	π-helix	trans	-70	-33.2	174.6	-62.7	-152.8	94.2	0	0	112.6	L311 H312 G317 W320 L323 H336 R340	L311-E315 HydrophobicContact CD1-CG 4.24Å; L311-E315 HydrophobicContact CG-CG 4.49Å; L311-E315 WeakPolarHBondContact O-CG 3.43Å; L311-E315 PolarHBondContact O-N 2.78Å; H312-E315 PolarHBondContact O-N 2.62Å; E315-G317 PolarHBondContact O-N 2.89Å; E315-W320 HydrophobicContact CG-CE3 4.16Å; E315-W320 HydrophobicContact CG-CZ3 4.27Å; E315-L323 HydrophobicContact CB-CD1 4.11Å; E315-H336 IonicContact OE1-ND1 3.6Å; E315-H336 IonicContact OE2-CE1 3.65Å; E315-H336 IonicContact OE2-CG 2.68Å; E315-H336 IonicContact OE2-ND1 3.51Å; E315-H336 PolarHBondContact OE2-ND1 3.27Å; E315-R340 IonicContact OE1-CZ 3.57Å; E315-R340 IonicContact OE1-NE 3.67Å; E315-R340 PolarHBondContact OE1-NE 2.93Å; E315-R340 IonicContact OE1-NH2 2.83Å; E315-R340 PolarHBondContact OE1-NH2 3.04Å
316	N	83.6	Confident	78	Confident	122 Å²	122	70.3 Å²	70.3	65%	0.652	38%	0.379	S	S	*	.	I	π-helix	trans	-81.1	42.1	177.4	-70.6	-34.3	0	0	0	113.4	H312 Q313	H312-N316 VanDerWaalsContact O-CB 3.29Å; H312-N316 WeakPolarHBondContact O-CB 3.42Å; H312-N316 VanDerWaalsContact O-CG 3.24Å; H312-N316 PolarHBondContact O-N 3.47Å; H312-N316 PolarHBondContact O-ND2 3.27Å; H312-N316 VanDerWaalsContact O-ND2 3.08Å; Q313-N316 PolarHBondContact O-N 2.92Å
317	G	80.4	Confident	75.9	Confident	40 Å²	40	66.4 Å²	66.4	41%	0.412	36%	0.362	S	S	.	.	I	π-helix	trans	95.6	-16.8	169	0	0	0	0	0	117	E315 V319 W320	E315-G317 PolarHBondContact O-N 2.89Å; G317-V319 PolarHBondContact O-N 3.03Å; G317-W320 VanDerWaalsContact CA-O 3.23Å; G317-W320 WeakPolarHBondContact CA-O 3.44Å; G317-W320 PolarHBondContact N-O 3.4Å
318	L	80.8	Confident	73.9	Confident	79 Å²	79	66.1 Å²	66.1	41%	0.414	36%	0.363	S	S	.	.	I	π-helix	trans	-70.3	-31.7	-178.9	-62.8	-172.2	0	0	0	113.2	F303 Q313	F303-L318 HydrophobicContact CD2-CB 4.47Å; F303-L318 HydrophobicContact CD2-CD1 3.81Å; F303-L318 HydrophobicContact CE2-CD1 3.47Å; F303-L318 VanDerWaalsContact CE2-CD1 3.47Å; F303-L318 HydrophobicContact CZ-CD1 4.1Å; Q313-L318 HydrophobicContact CB-CD1 3.98Å; Q313-L318 WeakPolarHBondContact O-CB 3.23Å; Q313-L318 WeakPolarHBondContact O-CG 3.35Å
319	V	84.3	Confident	72.1	Confident	1 Å²	1	67.9 Å²	67.9	1%	0.006	38%	0.381	C	S	.	.	S	Bend	trans	-119.6	-52.8	-179.5	177.6	0	0	0	0	110.5	F303 A314 G317 A398 K401	F303-V319 HydrophobicContact CB-CG2 3.78Å; F303-V319 HydrophobicContact CD1-CG2 3.88Å; F303-V319 HydrophobicContact CG-CG2 4.09Å; A314-V319 HydrophobicContact CB-CB 3.85Å; A314-V319 HydrophobicContact CB-CG2 3.6Å; A314-V319 PolarHBondContact O-N 2.81Å; A314-V319 VanDerWaalsContact O-N 3.11Å; G317-V319 PolarHBondContact O-N 3.03Å; V319-A398 HydrophobicContact CG1-CB 3.41Å; V319-A398 VanDerWaalsContact CG1-CB 3.41Å; V319-K401 HydrophobicContact CG1-CB 4.22Å; V319-K401 WeakPolarHBondContact O-CD 3.35Å; V319-K401 PolarHBondContact O-NZ 3.37Å
320	W	83.9	Confident	70.4	Confident	38 Å²	38	70.6 Å²	70.6	14%	0.144	40%	0.395	C	S	.	.	S	Bend	trans	-102.8	125	177.5	-62.6	-79.8	0	0	0	110.3	I305 L311 A314 E315 G317 Q322 R340 V397	I305-W320 HydrophobicContact CD1-CH2 3.71Å; I305-W320 HydrophobicContact CD1-CZ3 3.83Å; L311-W320 HydrophobicContact CD1-CZ3 4.3Å; A314-W320 HydrophobicContact CB-CE3 4.06Å; A314-W320 HydrophobicContact CB-CZ3 3.65Å; A314-W320 PolarHBondContact O-N 2.69Å; A314-W320 VanDerWaalsContact O-N 3.11Å; E315-W320 HydrophobicContact CG-CE3 4.16Å; E315-W320 HydrophobicContact CG-CZ3 4.27Å; G317-W320 VanDerWaalsContact CA-O 3.23Å; G317-W320 WeakPolarHBondContact CA-O 3.44Å; G317-W320 PolarHBondContact N-O 3.4Å; W320-Q322 PolarHBondContact O-N 3.27Å; W320-Q322 VanDerWaalsContact O-N 3.15Å; W320-R340 HydrophobicContact CZ2-CB 4.41Å; W320-V397 HydrophobicContact CH2-CG2 4.28Å; W320-V397 HydrophobicContact CZ2-CB 4.41Å; W320-V397 HydrophobicContact CZ2-CG2 4.01Å
321	N	66.1	Low	69	Low	126 Å²	126	72.8 Å²	72.8	67%	0.674	40%	0.404	S	S	*	.	S	Bend	trans	-67.9	-14.5	-173.3	-69.2	22.7	0	0	0	114.1	K401	N321-K401 PolarHBondContact OD1-NZ 2.94Å
322	Q	57.5	Low	68.6	Low	149 Å²	149	75 Å²	75	70%	0.696	42%	0.415	S	S	*	.			trans	-144	140.7	-178.5	-73.4	179.1	-25.4	0	0	110.9	W320 I324 R340	W320-Q322 PolarHBondContact O-N 3.27Å; W320-Q322 VanDerWaalsContact O-N 3.15Å; Q322-I324 PolarHBondContact O-N 3.09Å; Q322-R340 PolarHBondContact O-NH1 2.88Å
323	L	53.8	Low	68.5	Low	88 Å²	88	72.2 Å²	72.2	46%	0.461	40%	0.402	S	S	.	.			trans	-65	122.5	147.3	-125.7	75.2	0	0	0	106.3	E315 N325 T327	E315-L323 HydrophobicContact CB-CD1 4.11Å; L323-N325 PolarHBondContact O-N 3.45Å; L323-T327 WeakPolarHBondContact CD2-OG1 3.16Å; L323-T327 HydrophobicContact CG-CG2 4.44Å; L323-T327 WeakPolarHBondContact CG-OG1 3.41Å
324	I	54.4	Low	68.5	Low	60 Å²	60	67.7 Å²	67.7	31%	0.308	38%	0.381	S	S	.	.			trans	-75.9	127.3	-177.5	-58.2	170.7	0	0	0	107.4	Q322 G326 T327 Y339 C343	Q322-I324 PolarHBondContact O-N 3.09Å; I324-G326 PolarHBondContact O-N 2.78Å; I324-T327 PolarHBondContact O-N 2.92Å; I324-T327 PolarHBondContact O-OG1 2.98Å; I324-Y339 HydrophobicContact CB-CE1 4.26Å; I324-Y339 WeakPolarHBondContact CB-OH 3.24Å; I324-Y339 HydrophobicContact CD1-CE1 4.05Å; I324-Y339 VanDerWaalsContact CG2-OH 3.23Å; I324-Y339 WeakPolarHBondContact CG2-OH 3.13Å; I324-C343 HydrophobicContact CD1-CB 4.41Å; I324-C343 VanDerWaalsContact CD1-SG 3.54Å
325	N	43.1	Very low	68.4	Low	168 Å²	168	68.3 Å²	68.3	90%	0.898	39%	0.385	S	S	*	.	T	Hydrogen-bonded Turn	trans	-52	106.2	177.8	-72.6	-6.1	0	0	0	109.9	L323	L323-N325 PolarHBondContact O-N 3.45Å
326	G	51.8	Low	68.4	Low	57 Å²	57	69.6 Å²	69.6	59%	0.588	39%	0.391	S	S	*	.	T	Hydrogen-bonded Turn	trans	124.4	-9.2	-170.3	0	0	0	0	0	115.5	I324 P328	I324-G326 PolarHBondContact O-N 2.78Å; G326-P328 WeakPolarHBondContact O-CD 3.38Å; G326-P328 WeakPolarHBondContact O-CG 3.45Å; G326-P328 VanDerWaalsContact O-N 3.17Å
327	T	51.3	Low	68.7	Low	21 Å²	21	65 Å²	65	13%	0.129	37%	0.367	C	S	.	.			trans	-60.3	111.7	162.5	44.7	0	0	0	0	109	L323 I324 Y339	L323-T327 WeakPolarHBondContact CD2-OG1 3.16Å; L323-T327 HydrophobicContact CG-CG2 4.44Å; L323-T327 WeakPolarHBondContact CG-OG1 3.41Å; I324-T327 PolarHBondContact O-N 2.92Å; I324-T327 PolarHBondContact O-OG1 2.98Å; T327-Y339 HydrophobicContact CG2-CD1 4.04Å; T327-Y339 HydrophobicContact CG2-CE1 3.66Å
328	P	50.7	Low	69.2	Low	50 Å²	50	63.8 Å²	63.8	33%	0.325	35%	0.351	S	S	.	.			trans	-79.5	128.9	-172.6	-14.6	33.1	0	0	0	109.7	G326 K331	G326-P328 WeakPolarHBondContact O-CD 3.38Å; G326-P328 WeakPolarHBondContact O-CG 3.45Å; G326-P328 VanDerWaalsContact O-N 3.17Å; P328-K331 HydrophobicContact CB-CD 3.77Å; P328-K331 HydrophobicContact CB-CG 4.04Å; P328-K331 HydrophobicContact CG-CD 3.75Å
329	P	48.7	Very low	69.5	Low	115 Å²	115	62.8 Å²	62.8	75%	0.747	34%	0.342	S	S	*	.	T	Hydrogen-bonded Turn	trans	-63.6	141.9	178.5	26.7	-33.7	0	0	0	110.7
330	N	54.9	Low	69.7	Low	168 Å²	168	63.4 Å²	63.4	90%	0.898	34%	0.344	S	S	*	.	T	Hydrogen-bonded Turn	trans	66.1	42.6	179.8	-52.1	-24.9	0	0	0	116
331	K	64.4	Low	70	Confident	50 Å²	50	64 Å²	64	22%	0.217	35%	0.353	C	S	.	.			trans	-99.9	159.2	168.1	-71.3	-162.1	174.3	-179.1	0	113.6	P328 V335 E518	P328-K331 HydrophobicContact CB-CD 3.77Å; P328-K331 HydrophobicContact CB-CG 4.04Å; P328-K331 HydrophobicContact CG-CD 3.75Å; K331-V335 HydrophobicContact CB-CB 4.42Å; K331-V335 HydrophobicContact CB-CG1 4.45Å; K331-V335 HydrophobicContact CD-CG1 4.06Å; K331-E518 HydrophobicContact CD-CB 4.19Å; K331-E518 WeakPolarHBondContact CD-OE2 3.43Å; K331-E518 WeakPolarHBondContact CE-OE2 3.44Å; K331-E518 WeakPolarHBondContact CG-OE2 3.27Å; K331-E518 VanDerWaalsContact NZ-CB 3.3Å; K331-E518 PolarHBondContact NZ-O 3.12Å; K331-E518 IonicContact NZ-OE2 3.08Å
332	E	80.9	Confident	71.3	Confident	53 Å²	53	58.6 Å²	58.6	25%	0.248	32%	0.324	C	S	.	.			trans	-66.6	146.2	-179	-170.7	-110	128.7	0	0	112.4	G334 V335 H336 R413 F416	E332-G334 VanDerWaalsContact C-N 3.27Å; E332-G334 PolarHBondContact O-N 2.93Å; E332-G334 VanDerWaalsContact O-N 3.17Å; E332-G334 WeakPolarHBondContact OE1-CA 3.4Å; E332-G334 PolarHBondContact OE1-N 2.82Å; E332-V335 WeakPolarHBondContact O-CA 3.43Å; E332-V335 VanDerWaalsContact O-CB 3.32Å; E332-V335 WeakPolarHBondContact O-CB 3.48Å; E332-V335 PolarHBondContact O-N 3.25Å; E332-H336 PolarHBondContact O-N 3.32Å; E332-R413 IonicContact OE1-NE 2.69Å; E332-R413 IonicContact OE2-CZ 3.7Å; E332-R413 IonicContact OE2-NE 3.21Å; E332-R413 PolarHBondContact OE2-NE 3.33Å; E332-R413 IonicContact OE2-NH2 2.68Å; E332-R413 PolarHBondContact OE2-NH2 3.28Å; E332-F416 WeakPolarHBondContact OE2-CE2 3.28Å
333	I	85.4	Confident	72.8	Confident	29 Å²	29	52.6 Å²	52.6	15%	0.149	30%	0.298	C	S	.	.	H	α-helix	trans	-52.8	-39.8	-174.8	-171.2	177.6	0	0	0	113.7	M308 L311 V335 H336 V337 F408 L412	M308-I333 HydrophobicContact CE-CB 3.86Å; M308-I333 HydrophobicContact CE-CD1 3.57Å; M308-I333 HydrophobicContact CE-CG1 3.61Å; M308-I333 HydrophobicContact CG-CD1 3.8Å; M308-I333 HydrophobicContact SD-CB 3.96Å; M308-I333 HydrophobicContact SD-CD1 3.7Å; M308-I333 HydrophobicContact SD-CG1 4.11Å; L311-I333 HydrophobicContact CD2-CD1 4.41Å; L311-I333 HydrophobicContact CD2-CG1 3.92Å; I333-V335 VanDerWaalsContact C-N 3.26Å; I333-V335 PolarHBondContact O-N 2.81Å; I333-H336 PolarHBondContact O-N 3.42Å; I333-V337 HydrophobicContact CG1-CG2 4.43Å; I333-V337 PolarHBondContact O-N 3.28Å; I333-F408 HydrophobicContact CD1-CE2 3.47Å; I333-F408 VanDerWaalsContact CD1-CE2 3.47Å; I333-F408 HydrophobicContact CD1-CZ 3.53Å; I333-F408 HydrophobicContact CG1-CZ 4.28Å; I333-L412 HydrophobicContact CB-CD2 4.48Å; I333-L412 HydrophobicContact CD1-CD2 3.93Å; I333-L412 HydrophobicContact CG1-CD2 3.89Å; I333-L412 HydrophobicContact CG2-CD2 3.95Å
334	G	87.8	Confident	74.6	Confident	0 Å²	0	50.5 Å²	50.5	0%	0	29%	0.289	C	S	.	.	H	α-helix	trans	-59.3	-36.7	176.5	0	0	0	0	0	113	E332 F338 F416	E332-G334 VanDerWaalsContact C-N 3.27Å; E332-G334 PolarHBondContact O-N 2.93Å; E332-G334 VanDerWaalsContact O-N 3.17Å; E332-G334 WeakPolarHBondContact OE1-CA 3.4Å; E332-G334 PolarHBondContact OE1-N 2.82Å; G334-F338 WeakPolarHBondContact O-CB 3.24Å; G334-F338 PolarHBondContact O-N 3.43Å; G334-F416 VanDerWaalsContact CA-CD2 3.5Å; G334-F416 WeakPolarHBondContact O-CD1 3.46Å; G334-F416 WeakPolarHBondContact O-CE1 3.38Å
335	V	86.8	Confident	76.6	Confident	14 Å²	14	48.7 Å²	48.7	9%	0.085	28%	0.281	C	S	.	.	H	α-helix	trans	-67.2	-42.7	175.8	-177.9	0	0	0	0	111.1	K331 E332 I333 F338 Y339 F416 T519	K331-V335 HydrophobicContact CB-CB 4.42Å; K331-V335 HydrophobicContact CB-CG1 4.45Å; K331-V335 HydrophobicContact CD-CG1 4.06Å; E332-V335 WeakPolarHBondContact O-CA 3.43Å; E332-V335 VanDerWaalsContact O-CB 3.32Å; E332-V335 WeakPolarHBondContact O-CB 3.48Å; E332-V335 PolarHBondContact O-N 3.25Å; I333-V335 VanDerWaalsContact C-N 3.26Å; I333-V335 PolarHBondContact O-N 2.81Å; V335-F338 PolarHBondContact O-N 3.02Å; V335-Y339 VanDerWaalsContact O-CB 3.26Å; V335-Y339 WeakPolarHBondContact O-CB 3.47Å; V335-Y339 PolarHBondContact O-N 2.88Å; V335-F416 HydrophobicContact CG2-CE2 4.24Å; V335-F416 HydrophobicContact CG2-CZ 3.81Å; V335-T519 HydrophobicContact CG1-CG2 4.16Å; V335-T519 HydrophobicContact CG2-CG2 4.06Å
336	H	85.2	Confident	79	Confident	33 Å²	33	41 Å²	41	15%	0.153	24%	0.24	C	C	.	.	H	α-helix	trans	-61.9	-48.3	176	-83.1	-117.3	0	0	0	111.9	L311 E315 E332 I333 F338 Y339 R340	L311-H336 HydrophobicContact CD2-CB 4.45Å; E315-H336 IonicContact OE1-ND1 3.6Å; E315-H336 IonicContact OE2-CE1 3.65Å; E315-H336 IonicContact OE2-CG 2.68Å; E315-H336 IonicContact OE2-ND1 3.51Å; E315-H336 PolarHBondContact OE2-ND1 3.27Å; E332-H336 PolarHBondContact O-N 3.32Å; I333-H336 PolarHBondContact O-N 3.42Å; H336-F338 PolarHBondContact O-N 2.76Å; H336-Y339 PolarHBondContact O-N 2.83Å; H336-R340 PolarHBondContact O-N 2.8Å
337	V	89.6	Confident	81	Confident	27 Å²	27	42.8 Å²	42.8	16%	0.164	23%	0.233	C	C	.	.	H	α-helix	trans	-64.5	-41.6	178.5	176.2	0	0	0	0	111.3	L311 I333 R340 C341 F408 L409 L412	L311-V337 HydrophobicContact CD2-CG2 3.96Å; I333-V337 HydrophobicContact CG1-CG2 4.43Å; I333-V337 PolarHBondContact O-N 3.28Å; V337-R340 PolarHBondContact O-N 3.03Å; V337-C341 WeakPolarHBondContact O-CB 3.27Å; V337-C341 PolarHBondContact O-N 3.05Å; V337-F408 HydrophobicContact CG2-CE1 4.19Å; V337-F408 HydrophobicContact CG2-CZ 4.47Å; V337-L409 HydrophobicContact CG1-CD2 3.8Å; V337-L412 HydrophobicContact CB-CD1 4.14Å; V337-L412 HydrophobicContact CG1-CD1 3.99Å; V337-L412 HydrophobicContact CG2-CD1 4.33Å; V337-L412 HydrophobicContact CG2-CD2 4.22Å
338	F	91.1	Very high	83.1	Confident	14 Å²	14	43.1 Å²	43.1	6%	0.061	24%	0.235	C	C	.	.	H	α-helix	trans	-63	-43	175.6	-178	-116.1	0	0	0	112	G334 V335 H336 C341 Q342 F416 I419 V509 I512 T519 L521	G334-F338 WeakPolarHBondContact O-CB 3.24Å; G334-F338 PolarHBondContact O-N 3.43Å; V335-F338 PolarHBondContact O-N 3.02Å; H336-F338 PolarHBondContact O-N 2.76Å; F338-C341 WeakPolarHBondContact O-CB 3.48Å; F338-C341 PolarHBondContact O-N 3.11Å; F338-Q342 HydrophobicContact CE1-CG 4.42Å; F338-Q342 VanDerWaalsContact CE1-NE2 3.28Å; F338-Q342 HydrophobicContact CZ-CG 4.39Å; F338-Q342 WeakPolarHBondContact O-CG 3.43Å; F338-Q342 PolarHBondContact O-N 2.94Å; F338-F416 HydrophobicContact CB-CD1 3.83Å; F338-F416 HydrophobicContact CB-CE1 3.69Å; F338-F416 HydrophobicContact CD1-CE1 4.25Å; F338-F416 HydrophobicContact CG-CD1 4.28Å; F338-F416 AromaticContact CG-CE1 3.97Å; F338-F416 HydrophobicContact CG-CE1 3.97Å; F338-I419 HydrophobicContact CD2-CD1 3.99Å; F338-I419 HydrophobicContact CE2-CD1 3.87Å; F338-V509 HydrophobicContact CE2-CG2 4.33Å; F338-I512 HydrophobicContact CD1-CG2 4.11Å; F338-I512 HydrophobicContact CD2-CD1 3.91Å; F338-I512 HydrophobicContact CE1-CG2 3.78Å; F338-I512 HydrophobicContact CE2-CD1 3.71Å; F338-I512 HydrophobicContact CZ-CD1 4.15Å; F338-I512 HydrophobicContact CZ-CG2 4.05Å; F338-T519 HydrophobicContact CD1-CG2 4.36Å; F338-L521 HydrophobicContact CE1-CD2 4.22Å; F338-L521 HydrophobicContact CZ-CD2 3.9Å
339	Y	87.9	Confident	85.4	Confident	57 Å²	57	41 Å²	41	22%	0.224	22%	0.222	C	C	.	.	H	α-helix	trans	-61.6	-49.1	176.2	178.8	-104.5	0	0	0	112.1	I324 T327 V335 H336 C341 Q342 C343	I324-Y339 HydrophobicContact CB-CE1 4.26Å; I324-Y339 WeakPolarHBondContact CB-OH 3.24Å; I324-Y339 HydrophobicContact CD1-CE1 4.05Å; I324-Y339 VanDerWaalsContact CG2-OH 3.23Å; I324-Y339 WeakPolarHBondContact CG2-OH 3.13Å; T327-Y339 HydrophobicContact CG2-CD1 4.04Å; T327-Y339 HydrophobicContact CG2-CE1 3.66Å; V335-Y339 VanDerWaalsContact O-CB 3.26Å; V335-Y339 WeakPolarHBondContact O-CB 3.47Å; V335-Y339 PolarHBondContact O-N 2.88Å; H336-Y339 PolarHBondContact O-N 2.83Å; Y339-C341 VanDerWaalsContact C-N 3.27Å; Y339-C341 PolarHBondContact O-N 3.11Å; Y339-Q342 WeakPolarHBondContact O-CB 3.47Å; Y339-Q342 PolarHBondContact O-N 2.99Å; Y339-Q342 VanDerWaalsContact O-N 3.1Å; Y339-C343 PolarHBondContact O-N 3.46Å; Y339-C343 PolarHBondContact O-SG 3.35Å
340	R	87.9	Confident	87.6	Confident	14 Å²	14	43 Å²	43	5%	0.053	21%	0.214	C	C	.	.	H	α-helix	trans	-61.7	-35.4	175.8	-67.2	-65.3	-177.6	171.8	3.7	112.3	E315 W320 Q322 H336 V337 C343 T344	E315-R340 IonicContact OE1-CZ 3.57Å; E315-R340 IonicContact OE1-NE 3.67Å; E315-R340 PolarHBondContact OE1-NE 2.93Å; E315-R340 IonicContact OE1-NH2 2.83Å; E315-R340 PolarHBondContact OE1-NH2 3.04Å; W320-R340 HydrophobicContact CZ2-CB 4.41Å; Q322-R340 PolarHBondContact O-NH1 2.88Å; H336-R340 PolarHBondContact O-N 2.8Å; V337-R340 PolarHBondContact O-N 3.03Å; R340-C343 PolarHBondContact O-N 2.95Å; R340-T344 PolarHBondContact O-N 3.47Å
341	C	91.5	Very high	89.7	Confident	51 Å²	51	36.6 Å²	36.6	35%	0.345	18%	0.179	S	C	.	.	H	α-helix	trans	-62.8	-43.3	172.7	-169.2	0	0	0	0	112.3	V337 F338 Y339 T344 T345	V337-C341 WeakPolarHBondContact O-CB 3.27Å; V337-C341 PolarHBondContact O-N 3.05Å; F338-C341 WeakPolarHBondContact O-CB 3.48Å; F338-C341 PolarHBondContact O-N 3.11Å; Y339-C341 VanDerWaalsContact C-N 3.27Å; Y339-C341 PolarHBondContact O-N 3.11Å; C341-T344 PolarHBondContact O-N 3.27Å; C341-T345 WeakPolarHBondContact O-CB 3.35Å; C341-T345 PolarHBondContact O-N 2.95Å; C341-T345 PolarHBondContact O-OG1 3.21Å
342	Q	92.2	Very high	91.3	Very high	12 Å²	12	34.2 Å²	34.2	6%	0.056	17%	0.168	C	C	.	.	H	α-helix	trans	-60	-45.3	173.9	-71.3	-169	64.1	0	0	112.2	F338 Y339 T344 T345 V346 S520 L521 L525	F338-Q342 HydrophobicContact CE1-CG 4.42Å; F338-Q342 VanDerWaalsContact CE1-NE2 3.28Å; F338-Q342 HydrophobicContact CZ-CG 4.39Å; F338-Q342 WeakPolarHBondContact O-CG 3.43Å; F338-Q342 PolarHBondContact O-N 2.94Å; Y339-Q342 WeakPolarHBondContact O-CB 3.47Å; Y339-Q342 PolarHBondContact O-N 2.99Å; Y339-Q342 VanDerWaalsContact O-N 3.1Å; Q342-T344 PolarHBondContact O-N 2.86Å; Q342-T345 WeakPolarHBondContact O-CB 3.09Å; Q342-T345 PolarHBondContact O-N 2.84Å; Q342-T345 VanDerWaalsContact O-N 3.13Å; Q342-V346 WeakPolarHBondContact O-CG2 3.41Å; Q342-V346 PolarHBondContact O-N 2.84Å; Q342-S520 PolarHBondContact NE2-O 3.35Å; Q342-L521 HydrophobicContact CG-CD2 4.36Å; Q342-L521 VanDerWaalsContact OE1-CA 3.22Å; Q342-L525 HydrophobicContact CB-CD1 3.83Å; Q342-L525 HydrophobicContact CG-CD1 3.88Å
343	C	90.1	Very high	92.1	Very high	23 Å²	23	33.3 Å²	33.3	16%	0.155	17%	0.166	C	C	.	.	H	α-helix	trans	-56.8	-49.9	178	-61.6	0	0	0	0	111.7	I324 Y339 R340 T345 V346 E347	I324-C343 HydrophobicContact CD1-CB 4.41Å; I324-C343 VanDerWaalsContact CD1-SG 3.54Å; Y339-C343 PolarHBondContact O-N 3.46Å; Y339-C343 PolarHBondContact O-SG 3.35Å; R340-C343 PolarHBondContact O-N 2.95Å; C343-T345 VanDerWaalsContact C-N 3.29Å; C343-T345 PolarHBondContact O-N 2.9Å; C343-V346 PolarHBondContact O-N 3.2Å; C343-E347 WeakPolarHBondContact O-CG 3.26Å; C343-E347 PolarHBondContact O-N 2.86Å
344	T	91.6	Very high	92.7	Very high	44 Å²	44	36.1 Å²	36.1	27%	0.27	18%	0.179	S	C	.	.	H	α-helix	trans	-65.6	-31.1	177.1	-63.2	0	0	0	0	112.6	R340 C341 Q342 T348	R340-T344 PolarHBondContact O-N 3.47Å; C341-T344 PolarHBondContact O-N 3.27Å; Q342-T344 PolarHBondContact O-N 2.86Å; T344-T348 WeakPolarHBondContact O-CB 3.4Å; T344-T348 PolarHBondContact O-N 3.11Å; T344-T348 PolarHBondContact O-OG1 3.41Å
345	T	94.7	Very high	93.2	Very high	22 Å²	22	36.1 Å²	36.1	14%	0.135	18%	0.179	C	C	.	.	H	α-helix	trans	-66.7	-43.8	173.1	-57	0	0	0	0	110.8	C341 Q342 C343 T348 V349 I382 L525	C341-T345 WeakPolarHBondContact O-CB 3.35Å; C341-T345 PolarHBondContact O-N 2.95Å; C341-T345 PolarHBondContact O-OG1 3.21Å; Q342-T345 WeakPolarHBondContact O-CB 3.09Å; Q342-T345 PolarHBondContact O-N 2.84Å; Q342-T345 VanDerWaalsContact O-N 3.13Å; C343-T345 VanDerWaalsContact C-N 3.29Å; C343-T345 PolarHBondContact O-N 2.9Å; T345-T348 PolarHBondContact O-N 2.85Å; T345-V349 HydrophobicContact CG2-CG2 4.47Å; T345-V349 VanDerWaalsContact O-CG2 3.31Å; T345-V349 WeakPolarHBondContact O-CG2 3.23Å; T345-V349 PolarHBondContact O-N 2.85Å; T345-I382 HydrophobicContact CG2-CD1 3.94Å; T345-L525 HydrophobicContact CG2-CD1 4.36Å; T345-L525 HydrophobicContact CG2-CD2 3.72Å
346	V	94.8	Very high	93.8	Very high	6 Å²	6	35.5 Å²	35.5	4%	0.036	18%	0.175	C	C	.	.	H	α-helix	trans	-62.7	-42.4	176.6	169.1	0	0	0	0	112.1	Q342 C343 R350 H522 L524 L525	Q342-V346 WeakPolarHBondContact O-CG2 3.41Å; Q342-V346 PolarHBondContact O-N 2.84Å; C343-V346 PolarHBondContact O-N 3.2Å; V346-R350 WeakPolarHBondContact O-CG 3.42Å; V346-R350 PolarHBondContact O-N 3.14Å; V346-H522 HydrophobicContact CG2-CB 3.94Å; V346-H522 WeakPolarHBondContact CG2-ND1 3.48Å; V346-L524 HydrophobicContact CG1-CD2 4.22Å; V346-L525 HydrophobicContact CG2-CD1 4Å; V346-L525 HydrophobicContact CG2-CD2 3.97Å; V346-L525 HydrophobicContact CG2-CG 3.74Å
347	E	93.5	Very high	94.4	Very high	95 Å²	95	37.9 Å²	37.9	44%	0.444	19%	0.185	S	C	.	.	H	α-helix	trans	-58.7	-49.3	171.8	-70.4	165.9	179.5	0	0	110.7	C343 V349 R350 E351	C343-E347 WeakPolarHBondContact O-CG 3.26Å; C343-E347 PolarHBondContact O-N 2.86Å; E347-V349 PolarHBondContact O-N 3.13Å; E347-R350 WeakPolarHBondContact O-CB 3.47Å; E347-R350 PolarHBondContact O-N 2.83Å; E347-R350 VanDerWaalsContact O-N 3.15Å; E347-E351 PolarHBondContact O-N 3.39Å
348	T	95.9	Very high	94.8	Very high	29 Å²	29	38.6 Å²	38.6	18%	0.178	19%	0.191	C	C	.	.	H	α-helix	trans	-67.5	-34.1	-178.3	-46.1	0	0	0	0	112.7	T344 T345 R350 E351 L352 I382 M385	T344-T348 WeakPolarHBondContact O-CB 3.4Å; T344-T348 PolarHBondContact O-N 3.11Å; T344-T348 PolarHBondContact O-OG1 3.41Å; T345-T348 PolarHBondContact O-N 2.85Å; T348-R350 VanDerWaalsContact C-N 3.34Å; T348-E351 PolarHBondContact O-N 3.26Å; T348-L352 HydrophobicContact CG2-CD1 4.33Å; T348-L352 WeakPolarHBondContact O-CB 3.22Å; T348-L352 WeakPolarHBondContact O-CG 3.39Å; T348-L352 PolarHBondContact O-N 3.25Å; T348-I382 HydrophobicContact CG2-CD1 4.32Å; T348-I382 HydrophobicContact CG2-CG1 3.78Å; T348-M385 HydrophobicContact CG2-CE 3.7Å
349	V	97.4	Very high	95.1	Very high	6 Å²	6	38.1 Å²	38.1	4%	0.036	19%	0.189	C	C	.	.	H	α-helix	trans	-61.7	-42.6	172.4	168.1	0	0	0	0	110.5	T345 E347 L352 T353 V378 I382 L524 I528	T345-V349 HydrophobicContact CG2-CG2 4.47Å; T345-V349 VanDerWaalsContact O-CG2 3.31Å; T345-V349 WeakPolarHBondContact O-CG2 3.23Å; T345-V349 PolarHBondContact O-N 2.85Å; E347-V349 PolarHBondContact O-N 3.13Å; V349-L352 PolarHBondContact O-N 2.89Å; V349-T353 PolarHBondContact O-N 3.34Å; V349-T353 PolarHBondContact O-OG1 2.96Å; V349-V378 HydrophobicContact CG2-CB 4.24Å; V349-V378 HydrophobicContact CG2-CG2 4.07Å; V349-I382 HydrophobicContact CG2-CD1 3.94Å; V349-L524 HydrophobicContact CB-CD2 4.33Å; V349-L524 HydrophobicContact CG1-CD2 3.82Å; V349-L524 HydrophobicContact CG1-CG 4.38Å; V349-I528 HydrophobicContact CG1-CD1 4.02Å; V349-I528 HydrophobicContact CG2-CD1 4.12Å
350	R	96.5	Very high	95.4	Very high	157 Å²	157	37.5 Å²	37.5	59%	0.592	19%	0.193	S	C	*	.	H	α-helix	trans	-64	-45.2	176.4	-70.7	169.5	170.4	169.6	-4.3	111.8	V346 E347 T348 L352 T353 E354	V346-R350 WeakPolarHBondContact O-CG 3.42Å; V346-R350 PolarHBondContact O-N 3.14Å; E347-R350 WeakPolarHBondContact O-CB 3.47Å; E347-R350 PolarHBondContact O-N 2.83Å; E347-R350 VanDerWaalsContact O-N 3.15Å; T348-R350 VanDerWaalsContact C-N 3.34Å; R350-L352 VanDerWaalsContact C-N 3.3Å; R350-L352 PolarHBondContact O-N 3.41Å; R350-T353 PolarHBondContact O-N 3.47Å; R350-E354 PolarHBondContact O-N 3.37Å
351	E	97.4	Very high	95.7	Very high	32 Å²	32	37.8 Å²	37.8	15%	0.15	20%	0.2	C	C	.	.	H	α-helix	trans	-60.5	-38.6	174.9	-66.1	-178.1	-162.8	0	0	112	L277 N278 E347 T348 F355	L277-E351 VanDerWaalsContact CA-OE2 3.29Å; L277-E351 WeakPolarHBondContact CA-OE2 3.3Å; L277-E351 HydrophobicContact CD2-CB 3.81Å; N278-E351 WeakPolarHBondContact CB-OE1 3.33Å; N278-E351 PolarHBondContact N-OE2 2.85Å; N278-E351 PolarHBondContact ND2-OE1 2.93Å; E347-E351 PolarHBondContact O-N 3.39Å; T348-E351 PolarHBondContact O-N 3.26Å; E351-F355 WeakPolarHBondContact O-CB 3.3Å; E351-F355 PolarHBondContact O-N 3.14Å
352	L	98.4	Very high	95.9	Very high	0 Å²	0	35.4 Å²	35.4	0%	0	18%	0.184	C	C	.	.	H	α-helix	trans	-70.4	-35.6	176.3	-79.1	172	0	0	0	113.8	T348 V349 R350 F355 A356 V378 A381 I382 M385 V444 I448	T348-L352 HydrophobicContact CG2-CD1 4.33Å; T348-L352 WeakPolarHBondContact O-CB 3.22Å; T348-L352 WeakPolarHBondContact O-CG 3.39Å; T348-L352 PolarHBondContact O-N 3.25Å; V349-L352 PolarHBondContact O-N 2.89Å; R350-L352 VanDerWaalsContact C-N 3.3Å; R350-L352 PolarHBondContact O-N 3.41Å; L352-F355 HydrophobicContact CD2-CD1 4.36Å; L352-F355 WeakPolarHBondContact O-CB 3.37Å; L352-F355 PolarHBondContact O-N 2.78Å; L352-A356 WeakPolarHBondContact O-CB 3.36Å; L352-A356 PolarHBondContact O-N 3.17Å; L352-V378 HydrophobicContact CB-CG1 4.39Å; L352-V378 HydrophobicContact CD1-CB 4.36Å; L352-V378 HydrophobicContact CD1-CG1 4.43Å; L352-A381 HydrophobicContact CD1-CB 3.76Å; L352-A381 HydrophobicContact CD2-CB 4.05Å; L352-I382 HydrophobicContact CD1-CD1 4.34Å; L352-I382 HydrophobicContact CD1-CG1 3.65Å; L352-M385 HydrophobicContact CD1-CE 3.84Å; L352-M385 HydrophobicContact CD2-CE 3.69Å; L352-M385 HydrophobicContact CD2-SD 4.27Å; L352-M385 HydrophobicContact CG-CE 3.86Å; L352-V444 HydrophobicContact CD2-CG1 3.81Å; L352-I448 HydrophobicContact CD2-CD1 4.44Å
353	T	98.2	Very high	96	Very high	34 Å²	34	38.5 Å²	38.5	21%	0.209	20%	0.203	C	C	.	.	H	α-helix	trans	-64	-43.6	174.5	-66.8	0	0	0	0	111.4	V349 R350 F355 A356 K357 L374	V349-T353 PolarHBondContact O-N 3.34Å; V349-T353 PolarHBondContact O-OG1 2.96Å; R350-T353 PolarHBondContact O-N 3.47Å; T353-F355 VanDerWaalsContact C-N 3.34Å; T353-A356 PolarHBondContact O-N 2.75Å; T353-K357 HydrophobicContact CG2-CD 4.48Å; T353-K357 WeakPolarHBondContact O-CG 3.3Å; T353-K357 PolarHBondContact O-N 2.85Å; T353-L374 HydrophobicContact CG2-CD1 4.05Å
354	E	98.3	Very high	95.9	Very high	89 Å²	89	42.7 Å²	42.7	42%	0.416	22%	0.224	S	C	.	.	H	α-helix	trans	-70.9	-30.4	175.7	-62.4	-49.6	123.5	0	0	112.5	N276 R350 K357 S358	N276-E354 PolarHBondContact ND2-O 3Å; R350-E354 PolarHBondContact O-N 3.37Å; E354-K357 WeakPolarHBondContact OE1-CE 3.44Å; E354-K357 IonicContact OE1-NZ 2.81Å; E354-K357 PolarHBondContact OE1-NZ 3.37Å; E354-K357 IonicContact OE2-NZ 3.95Å; E354-S358 WeakPolarHBondContact O-CB 3.37Å; E354-S358 PolarHBondContact O-N 3.2Å; E354-S358 PolarHBondContact O-OG 3.03Å
355	F	98.7	Very high	95.7	Very high	0 Å²	0	41 Å²	41	0%	0	21%	0.213	C	C	.	.	H	α-helix	trans	-62	-48.3	166.1	174.7	-112.5	0	0	0	112.3	V269 A272 Y273 N276 E351 L352 T353 K357 S358 I359 V444 A445 I448	V269-F355 HydrophobicContact CG1-CE2 4.15Å; V269-F355 HydrophobicContact CG1-CZ 3.87Å; A272-F355 HydrophobicContact CB-CD2 4.07Å; A272-F355 HydrophobicContact CB-CE2 4.1Å; Y273-F355 HydrophobicContact CD2-CE2 4.28Å; Y273-F355 HydrophobicContact CD2-CZ 4.27Å; Y273-F355 HydrophobicContact CG-CE2 4.49Å; N276-F355 HydrophobicContact CB-CB 4.38Å; N276-F355 WeakPolarHBondContact ND2-CA 3.41Å; N276-F355 PolarHBondContact ND2-N 2.99Å; E351-F355 WeakPolarHBondContact O-CB 3.3Å; E351-F355 PolarHBondContact O-N 3.14Å; L352-F355 HydrophobicContact CD2-CD1 4.36Å; L352-F355 WeakPolarHBondContact O-CB 3.37Å; L352-F355 PolarHBondContact O-N 2.78Å; T353-F355 VanDerWaalsContact C-N 3.34Å; F355-K357 PolarHBondContact O-N 2.7Å; F355-S358 CarbonylContact O-C 3.57Å; F355-S358 WeakPolarHBondContact O-CA 3.46Å; F355-S358 VanDerWaalsContact O-CB 3.3Å; F355-S358 WeakPolarHBondContact O-CB 3.25Å; F355-S358 PolarHBondContact O-N 2.78Å; F355-I359 HydrophobicContact CD1-CD1 4.46Å; F355-I359 HydrophobicContact CE1-CD1 3.99Å; F355-I359 HydrophobicContact CE1-CG1 4.35Å; F355-I359 HydrophobicContact CZ-CD1 4.28Å; F355-I359 HydrophobicContact CZ-CG1 4.22Å; F355-I359 PolarHBondContact O-N 3.03Å; F355-V444 HydrophobicContact CD1-CG1 4.21Å; F355-V444 HydrophobicContact CE1-CB 4.35Å; F355-V444 HydrophobicContact CE1-CG1 3.85Å; F355-A445 HydrophobicContact CE1-CB 4.31Å; F355-A445 HydrophobicContact CZ-CB 4.15Å; F355-I448 HydrophobicContact CD1-CD1 3.97Å; F355-I448 HydrophobicContact CE1-CD1 4.16Å
356	A	98.6	Very high	95.2	Very high	0 Å²	0	45.1 Å²	45.1	0%	0	23%	0.23	C	C	.	.	H	α-helix	trans	-59.2	-48.6	-179.8	0	0	0	0	0	112	L352 T353 S358 I359 F362 L374 I448	L352-A356 WeakPolarHBondContact O-CB 3.36Å; L352-A356 PolarHBondContact O-N 3.17Å; T353-A356 PolarHBondContact O-N 2.75Å; A356-S358 PolarHBondContact O-N 3.5Å; A356-I359 WeakPolarHBondContact O-CB 3.07Å; A356-I359 PolarHBondContact O-N 3.41Å; A356-F362 HydrophobicContact CB-CD1 4.17Å; A356-F362 HydrophobicContact CB-CD2 4.3Å; A356-F362 HydrophobicContact CB-CE1 3.88Å; A356-F362 HydrophobicContact CB-CE2 4.02Å; A356-F362 HydrophobicContact CB-CG 4.38Å; A356-F362 HydrophobicContact CB-CZ 3.81Å; A356-F362 VanDerWaalsContact O-CB 3.27Å; A356-F362 WeakPolarHBondContact O-CB 3.41Å; A356-F362 WeakPolarHBondContact O-CD1 3.46Å; A356-F362 VanDerWaalsContact O-CG 3.3Å; A356-F362 WeakPolarHBondContact O-CG 3.39Å; A356-L374 HydrophobicContact CB-CD2 3.86Å; A356-I448 HydrophobicContact CB-CD1 4.37Å; A356-I448 HydrophobicContact CB-CG2 4.18Å
357	K	97.6	Very high	94.6	Very high	83 Å²	83	50.1 Å²	50.1	36%	0.361	26%	0.255	S	S	.	.	H	α-helix	trans	-55.8	-21.5	172	-69.6	170.8	179.9	175	0	114.1	T353 E354 F355 V363	T353-K357 HydrophobicContact CG2-CD 4.48Å; T353-K357 WeakPolarHBondContact O-CG 3.3Å; T353-K357 PolarHBondContact O-N 2.85Å; E354-K357 WeakPolarHBondContact OE1-CE 3.44Å; E354-K357 IonicContact OE1-NZ 2.81Å; E354-K357 PolarHBondContact OE1-NZ 3.37Å; E354-K357 IonicContact OE2-NZ 3.95Å; F355-K357 PolarHBondContact O-N 2.7Å; K357-V363 HydrophobicContact CB-CG1 4.12Å; K357-V363 HydrophobicContact CG-CG1 4.38Å; K357-V363 WeakPolarHBondContact O-CG1 3.43Å
358	S	98	Very high	94	Very high	43 Å²	43	50.1 Å²	50.1	30%	0.301	26%	0.258	S	S	.	.	T	Hydrogen-bonded Turn	trans	-93.2	-1.5	178.7	-56	0	0	0	0	113.6	N276 E354 F355 A356	N276-S358 PolarHBondContact ND2-OG 3.4Å; E354-S358 WeakPolarHBondContact O-CB 3.37Å; E354-S358 PolarHBondContact O-N 3.2Å; E354-S358 PolarHBondContact O-OG 3.03Å; F355-S358 CarbonylContact O-C 3.57Å; F355-S358 WeakPolarHBondContact O-CA 3.46Å; F355-S358 VanDerWaalsContact O-CB 3.3Å; F355-S358 WeakPolarHBondContact O-CB 3.25Å; F355-S358 PolarHBondContact O-N 2.78Å; A356-S358 PolarHBondContact O-N 3.5Å
359	I	97.8	Very high	93.7	Very high	3 Å²	3	48.7 Å²	48.7	2%	0.015	25%	0.25	C	C	.	.	S	Bend	trans	-83.4	128.2	173.5	-54	167.6	0	0	0	108.7	F355 A356 G361 F362 A445 L449 I469	F355-I359 HydrophobicContact CD1-CD1 4.46Å; F355-I359 HydrophobicContact CE1-CD1 3.99Å; F355-I359 HydrophobicContact CE1-CG1 4.35Å; F355-I359 HydrophobicContact CZ-CD1 4.28Å; F355-I359 HydrophobicContact CZ-CG1 4.22Å; F355-I359 PolarHBondContact O-N 3.03Å; A356-I359 WeakPolarHBondContact O-CB 3.07Å; A356-I359 PolarHBondContact O-N 3.41Å; I359-G361 PolarHBondContact O-N 2.92Å; I359-F362 HydrophobicContact CB-CB 4.23Å; I359-F362 WeakPolarHBondContact O-CB 3.46Å; I359-F362 PolarHBondContact O-N 3.39Å; I359-F362 VanDerWaalsContact O-N 3.16Å; I359-A445 HydrophobicContact CD1-CB 3.71Å; I359-A445 HydrophobicContact CG1-CB 4.31Å; I359-L449 HydrophobicContact CD1-CD1 4.38Å; I359-L449 HydrophobicContact CG2-CD1 3.85Å; I359-I469 HydrophobicContact CG2-CD1 4.03Å
360	P	95.1	Very high	93.4	Very high	45 Å²	45	49.7 Å²	49.7	29%	0.292	25%	0.254	S	S	.	.	T	Hydrogen-bonded Turn	trans	-55.3	132.7	176.5	-26.4	36.1	0	0	0	112.2	L265 F362 I465	L265-P360 HydrophobicContact CD1-CB 4.32Å; L265-P360 HydrophobicContact CD1-CG 3.81Å; P360-F362 VanDerWaalsContact C-N 3.34Å; P360-F362 PolarHBondContact O-N 2.63Å; P360-I465 WeakPolarHBondContact O-CG2 3.48Å
361	G	93.1	Very high	93.1	Very high	20 Å²	20	44.3 Å²	44.3	21%	0.206	24%	0.239	C	C	.	.	T	Hydrogen-bonded Turn	trans	88.7	-21.8	-177.8	0	0	0	0	0	115.2	I359 D364 I465	I359-G361 PolarHBondContact O-N 2.92Å; G361-D364 VanDerWaalsContact CA-OD2 3.22Å; G361-D364 WeakPolarHBondContact CA-OD2 3.37Å; G361-D364 PolarHBondContact O-N 3.48Å; G361-I465 WeakPolarHBondContact O-CD1 3.43Å
362	F	96.6	Very high	92.8	Very high	1 Å²	1	44 Å²	44	0%	0.004	24%	0.239	C	C	.	.	G	3₁₀ helix	trans	-66.8	-43	-173.6	-179.4	-87.1	0	0	0	112.8	A356 I359 P360 D364 L365 Q370 L373 L374 I448 L449	A356-F362 HydrophobicContact CB-CD1 4.17Å; A356-F362 HydrophobicContact CB-CD2 4.3Å; A356-F362 HydrophobicContact CB-CE1 3.88Å; A356-F362 HydrophobicContact CB-CE2 4.02Å; A356-F362 HydrophobicContact CB-CG 4.38Å; A356-F362 HydrophobicContact CB-CZ 3.81Å; A356-F362 VanDerWaalsContact O-CB 3.27Å; A356-F362 WeakPolarHBondContact O-CB 3.41Å; A356-F362 WeakPolarHBondContact O-CD1 3.46Å; A356-F362 VanDerWaalsContact O-CG 3.3Å; A356-F362 WeakPolarHBondContact O-CG 3.39Å; I359-F362 HydrophobicContact CB-CB 4.23Å; I359-F362 WeakPolarHBondContact O-CB 3.46Å; I359-F362 PolarHBondContact O-N 3.39Å; I359-F362 VanDerWaalsContact O-N 3.16Å; P360-F362 VanDerWaalsContact C-N 3.34Å; P360-F362 PolarHBondContact O-N 2.63Å; F362-D364 PolarHBondContact O-N 3.15Å; F362-L365 HydrophobicContact CD2-CD1 4.23Å; F362-L365 WeakPolarHBondContact O-CB 3.41Å; F362-L365 PolarHBondContact O-N 2.89Å; F362-Q370 HydrophobicContact CD1-CG 4.2Å; F362-Q370 HydrophobicContact CE1-CB 3.83Å; F362-Q370 HydrophobicContact CE1-CG 3.73Å; F362-Q370 HydrophobicContact CZ-CB 3.72Å; F362-Q370 HydrophobicContact CZ-CG 3.93Å; F362-Q370 VanDerWaalsContact O-CD 3.31Å; F362-Q370 WeakPolarHBondContact O-CG 3.49Å; F362-Q370 PolarHBondContact O-NE2 2.98Å; F362-L373 HydrophobicContact CD2-CD1 4.49Å; F362-L373 HydrophobicContact CE2-CB 4.3Å; F362-L373 HydrophobicContact CE2-CD1 4.06Å; F362-L374 HydrophobicContact CZ-CD1 4.18Å; F362-L374 HydrophobicContact CZ-CG 4.13Å; F362-I448 HydrophobicContact CD2-CG2 4.43Å; F362-I448 HydrophobicContact CE2-CG2 3.91Å; F362-L449 HydrophobicContact CD2-CD2 3.96Å
363	V	93.4	Very high	92.7	Very high	77 Å²	77	44 Å²	44	47%	0.467	24%	0.239	S	C	.	.	G	3₁₀ helix	trans	-71.6	-15	179	-64.1	0	0	0	0	113.2	K357 L365 Q370	K357-V363 HydrophobicContact CB-CG1 4.12Å; K357-V363 HydrophobicContact CG-CG1 4.38Å; K357-V363 WeakPolarHBondContact O-CG1 3.43Å; V363-L365 VanDerWaalsContact C-N 3.35Å; V363-Q370 PolarHBondContact O-NE2 3.31Å; V363-Q370 VanDerWaalsContact O-NE2 3.17Å
364	D	88.8	Confident	92.7	Very high	111 Å²	111	43.6 Å²	43.6	59%	0.594	24%	0.235	S	C	*	.	G	3₁₀ helix	trans	-89.1	-3	179	-46.7	-72.2	0	0	0	112.3	G361 F362 Q461	G361-D364 VanDerWaalsContact CA-OD2 3.22Å; G361-D364 WeakPolarHBondContact CA-OD2 3.37Å; G361-D364 PolarHBondContact O-N 3.48Å; F362-D364 PolarHBondContact O-N 3.15Å; D364-Q461 PolarHBondContact O-NE2 3.24Å
365	L	87.4	Confident	92.4	Very high	8 Å²	8	40.9 Å²	40.9	4%	0.042	22%	0.222	C	C	.	.	S	Bend	trans	-77.9	158.5	169	-65.5	168.5	0	0	0	111	F362 V363 Q370 L373 L449 Q461 V462 I465	F362-L365 HydrophobicContact CD2-CD1 4.23Å; F362-L365 WeakPolarHBondContact O-CB 3.41Å; F362-L365 PolarHBondContact O-N 2.89Å; V363-L365 VanDerWaalsContact C-N 3.35Å; L365-Q370 HydrophobicContact CB-CG 3.93Å; L365-Q370 PolarHBondContact O-NE2 3.11Å; L365-L373 HydrophobicContact CD1-CD1 3.6Å; L365-L449 HydrophobicContact CD1-CD2 4.2Å; L365-Q461 HydrophobicContact CD2-CB 4Å; L365-Q461 HydrophobicContact CD2-CG 3.67Å; L365-V462 HydrophobicContact CD1-CG2 4.22Å; L365-V462 HydrophobicContact CD2-CG2 3.83Å; L365-I465 HydrophobicContact CD1-CD1 4.31Å; L365-I465 HydrophobicContact CD2-CD1 4.04Å; L365-I465 HydrophobicContact CG-CD1 4.12Å
366	F	83.1	Confident	92.2	Very high	109 Å²	109	42.4 Å²	42.4	48%	0.478	23%	0.228	S	C	.	.			trans	-57.7	142.7	170.8	-65.7	-61.1	0	0	0	111.8	N368 D369 Q370 M457 N458	F366-N368 VanDerWaalsContact C-N 3.26Å; F366-N368 PolarHBondContact O-N 3.38Å; F366-D369 HydrophobicContact CB-CB 4.36Å; F366-D369 WeakPolarHBondContact O-CA 3.19Å; F366-D369 WeakPolarHBondContact O-CB 3.42Å; F366-D369 PolarHBondContact O-N 3.18Å; F366-Q370 PolarHBondContact O-N 3.45Å; F366-M457 HydrophobicContact CB-CE 3.56Å; F366-M457 HydrophobicContact CD1-CE 4.1Å; F366-M457 HydrophobicContact CD2-CB 4.33Å; F366-M457 HydrophobicContact CD2-CE 3.53Å; F366-M457 HydrophobicContact CE2-CE 4.2Å; F366-M457 HydrophobicContact CG-CE 3.47Å; F366-M457 VanDerWaalsContact CG-CE 3.47Å; F366-N458 HydrophobicContact CD2-CB 3.96Å; F366-N458 HydrophobicContact CE2-CB 3.9Å
367	L	82.7	Confident	92.2	Very high	110 Å²	110	42.4 Å²	42.4	58%	0.576	23%	0.228	S	C	*	.	H	α-helix	trans	-58	-38.2	-177.8	-176.4	61.5	0	0	0	112.6	D369 Q370 V371	L367-D369 VanDerWaalsContact C-N 3.3Å; L367-D369 PolarHBondContact O-N 3.45Å; L367-Q370 PolarHBondContact O-N 3.02Å; L367-V371 WeakPolarHBondContact O-CG2 3.41Å; L367-V371 PolarHBondContact O-N 2.84Å
368	N	81.4	Confident	92.2	Very high	95 Å²	95	38.5 Å²	38.5	51%	0.508	21%	0.211	S	C	.	.	H	α-helix	trans	-62	-37.6	174.4	-66.6	-6.8	0	0	0	112.1	F366 T372 M457	F366-N368 VanDerWaalsContact C-N 3.26Å; F366-N368 PolarHBondContact O-N 3.38Å; N368-T372 VanDerWaalsContact O-CB 3.28Å; N368-T372 WeakPolarHBondContact O-CB 3.31Å; N368-T372 PolarHBondContact O-N 3.01Å; N368-T372 PolarHBondContact O-OG1 2.84Å; N368-M457 HydrophobicContact CB-CE 4.48Å; N368-M457 HydrophobicContact CB-SD 4.48Å
369	D	88.4	Confident	92.2	Very high	0 Å²	0	36.7 Å²	36.7	0%	0	20%	0.198	C	C	.	.	H	α-helix	trans	-71.2	-44.2	176.6	-67.6	-11.6	0	0	0	110.1	F366 L367 V371 T372 L373 L456 M457 N458	F366-D369 HydrophobicContact CB-CB 4.36Å; F366-D369 WeakPolarHBondContact O-CA 3.19Å; F366-D369 WeakPolarHBondContact O-CB 3.42Å; F366-D369 PolarHBondContact O-N 3.18Å; L367-D369 VanDerWaalsContact C-N 3.3Å; L367-D369 PolarHBondContact O-N 3.45Å; D369-V371 VanDerWaalsContact C-N 3.32Å; D369-V371 PolarHBondContact O-N 2.92Å; D369-T372 PolarHBondContact O-N 2.96Å; D369-T372 VanDerWaalsContact O-N 3.15Å; D369-L373 WeakPolarHBondContact O-CB 3.29Å; D369-L373 VanDerWaalsContact O-CG 3.22Å; D369-L373 WeakPolarHBondContact O-CG 3.29Å; D369-L373 PolarHBondContact O-N 3Å; D369-L456 HydrophobicContact CB-CD2 3.91Å; D369-L456 WeakPolarHBondContact OD1-CA 3.35Å; D369-M457 PolarHBondContact OD1-N 2.79Å; D369-N458 PolarHBondContact OD2-N 3.11Å
370	Q	92.6	Very high	92.2	Very high	27 Å²	27	36.6 Å²	36.6	13%	0.126	20%	0.197	C	C	.	.	H	α-helix	trans	-55.9	-44.8	174	-65.7	-177.1	45.8	0	0	112.2	F362 V363 L365 F366 L367 L374	F362-Q370 HydrophobicContact CD1-CG 4.2Å; F362-Q370 HydrophobicContact CE1-CB 3.83Å; F362-Q370 HydrophobicContact CE1-CG 3.73Å; F362-Q370 HydrophobicContact CZ-CB 3.72Å; F362-Q370 HydrophobicContact CZ-CG 3.93Å; F362-Q370 VanDerWaalsContact O-CD 3.31Å; F362-Q370 WeakPolarHBondContact O-CG 3.49Å; F362-Q370 PolarHBondContact O-NE2 2.98Å; V363-Q370 PolarHBondContact O-NE2 3.31Å; V363-Q370 VanDerWaalsContact O-NE2 3.17Å; L365-Q370 HydrophobicContact CB-CG 3.93Å; L365-Q370 PolarHBondContact O-NE2 3.11Å; F366-Q370 PolarHBondContact O-N 3.45Å; L367-Q370 PolarHBondContact O-N 3.02Å; Q370-L374 WeakPolarHBondContact O-CB 3.43Å; Q370-L374 WeakPolarHBondContact O-CG 3.24Å; Q370-L374 PolarHBondContact O-N 3.24Å; Q370-L374 VanDerWaalsContact O-N 3.11Å
371	V	89.4	Confident	92.3	Very high	44 Å²	44	34.4 Å²	34.4	27%	0.267	18%	0.183	S	C	.	.	H	α-helix	trans	-65.6	-42.3	176.1	170.9	0	0	0	0	111.4	W94 L367 D369 L374 K375	W94-V371 HydrophobicContact CH2-CG1 4.39Å; W94-V371 HydrophobicContact CH2-CG2 4.3Å; W94-V371 HydrophobicContact CZ2-CG1 4Å; W94-V371 HydrophobicContact CZ2-CG2 4.02Å; L367-V371 WeakPolarHBondContact O-CG2 3.41Å; L367-V371 PolarHBondContact O-N 2.84Å; D369-V371 VanDerWaalsContact C-N 3.32Å; D369-V371 PolarHBondContact O-N 2.92Å; V371-L374 PolarHBondContact O-N 2.87Å; V371-K375 WeakPolarHBondContact O-CB 3.39Å; V371-K375 PolarHBondContact O-N 3.48Å
372	T	91.8	Very high	92.6	Very high	26 Å²	26	34.2 Å²	34.2	16%	0.16	18%	0.177	C	C	.	.	H	α-helix	trans	-65.6	-45.4	179.3	-61.9	0	0	0	0	112	N368 D369 L374 K375 Y376 R453 P454 L456	N368-T372 VanDerWaalsContact O-CB 3.28Å; N368-T372 WeakPolarHBondContact O-CB 3.31Å; N368-T372 PolarHBondContact O-N 3.01Å; N368-T372 PolarHBondContact O-OG1 2.84Å; D369-T372 PolarHBondContact O-N 2.96Å; D369-T372 VanDerWaalsContact O-N 3.15Å; T372-L374 VanDerWaalsContact C-N 3.33Å; T372-L374 PolarHBondContact O-N 3.18Å; T372-K375 PolarHBondContact O-N 2.95Å; T372-Y376 HydrophobicContact CG2-CD2 4.02Å; T372-Y376 HydrophobicContact CG2-CE2 4.08Å; T372-Y376 WeakPolarHBondContact O-CD2 3.17Å; T372-Y376 PolarHBondContact O-N 2.79Å; T372-Y376 VanDerWaalsContact O-N 3.16Å; T372-R453 HydrophobicContact CG2-CB 4.04Å; T372-P454 WeakPolarHBondContact CG2-O 3.48Å; T372-L456 HydrophobicContact CG2-CD2 3.8Å; T372-L456 HydrophobicContact CG2-CG 4.14Å
373	L	96.3	Very high	92.7	Very high	0 Å²	0	34.9 Å²	34.9	0%	0	18%	0.18	C	C	.	.	H	α-helix	trans	-59.9	-42.1	175.4	-69.5	176.3	0	0	0	111.6	F362 L365 D369 G377 I448 L449 C450 R453 L456 V462	F362-L373 HydrophobicContact CD2-CD1 4.49Å; F362-L373 HydrophobicContact CE2-CB 4.3Å; F362-L373 HydrophobicContact CE2-CD1 4.06Å; L365-L373 HydrophobicContact CD1-CD1 3.6Å; D369-L373 WeakPolarHBondContact O-CB 3.29Å; D369-L373 VanDerWaalsContact O-CG 3.22Å; D369-L373 WeakPolarHBondContact O-CG 3.29Å; D369-L373 PolarHBondContact O-N 3Å; L373-G377 VanDerWaalsContact O-CA 3.28Å; L373-G377 WeakPolarHBondContact O-CA 3.44Å; L373-G377 PolarHBondContact O-N 3.31Å; L373-I448 WeakPolarHBondContact CB-O 3.4Å; L373-I448 WeakPolarHBondContact CD2-O 3.37Å; L373-L449 HydrophobicContact CD1-CD2 4.4Å; L373-C450 WeakPolarHBondContact CD2-O 3.49Å; L373-R453 HydrophobicContact CD2-CG 4.02Å; L373-L456 HydrophobicContact CD2-CD1 4.01Å; L373-L456 HydrophobicContact CD2-CD2 3.87Å; L373-L456 HydrophobicContact CG-CD2 3.94Å; L373-V462 HydrophobicContact CD1-CG1 4.09Å; L373-V462 HydrophobicContact CD1-CG2 4.02Å; L373-V462 HydrophobicContact CD2-CG1 3.76Å; L373-V462 HydrophobicContact CD2-CG2 4.44Å
374	L	96.6	Very high	92.9	Very high	25 Å²	25	31.2 Å²	31.2	13%	0.131	16%	0.158	C	C	.	.	H	α-helix	trans	-66.9	-47.6	174.2	-73.9	168.6	0	0	0	111.6	T353 A356 F362 Q370 V371 T372 Y376 G377 V378 I448	T353-L374 HydrophobicContact CG2-CD1 4.05Å; A356-L374 HydrophobicContact CB-CD2 3.86Å; F362-L374 HydrophobicContact CZ-CD1 4.18Å; F362-L374 HydrophobicContact CZ-CG 4.13Å; Q370-L374 WeakPolarHBondContact O-CB 3.43Å; Q370-L374 WeakPolarHBondContact O-CG 3.24Å; Q370-L374 PolarHBondContact O-N 3.24Å; Q370-L374 VanDerWaalsContact O-N 3.11Å; V371-L374 PolarHBondContact O-N 2.87Å; T372-L374 VanDerWaalsContact C-N 3.33Å; T372-L374 PolarHBondContact O-N 3.18Å; L374-Y376 VanDerWaalsContact C-N 3.34Å; L374-Y376 PolarHBondContact O-N 3.24Å; L374-G377 PolarHBondContact O-N 3.09Å; L374-V378 HydrophobicContact CB-CG1 4.36Å; L374-V378 HydrophobicContact CD2-CG1 3.92Å; L374-V378 VanDerWaalsContact O-CG1 3.3Å; L374-V378 WeakPolarHBondContact O-CG1 3.47Å; L374-V378 VanDerWaalsContact O-CG2 3.3Å; L374-V378 WeakPolarHBondContact O-CG2 3.32Å; L374-V378 PolarHBondContact O-N 3.47Å; L374-I448 HydrophobicContact CD2-CG2 4.49Å
375	K	93.5	Very high	93.4	Very high	31 Å²	31	26.9 Å²	26.9	14%	0.135	13%	0.134	C	C	.	.	H	α-helix	trans	-52.5	-48	-178.5	-179.3	160.3	-179.8	163.1	0	112.4	V371 T372 E527 K530	V371-K375 WeakPolarHBondContact O-CB 3.39Å; V371-K375 PolarHBondContact O-N 3.48Å; T372-K375 PolarHBondContact O-N 2.95Å; K375-E527 WeakPolarHBondContact CE-O 3.42Å; K375-E527 PolarHBondContact NZ-O 3.03Å; K375-E527 IonicContact NZ-OE1 3.32Å; K375-E527 PolarHBondContact NZ-OE1 3.34Å; K375-E527 VanDerWaalsContact NZ-OE1 3.08Å; K375-K530 WeakPolarHBondContact CE-O 3.14Å; K375-K530 PolarHBondContact NZ-O 3.31Å
376	Y	94.8	Very high	93.9	Very high	33 Å²	33	27.7 Å²	27.7	13%	0.129	14%	0.139	C	C	.	.	H	α-helix	trans	-86.7	-28.5	178.4	-65.5	-73.8	0	0	0	114	T372 L374 R453 P454 M532	T372-Y376 HydrophobicContact CG2-CD2 4.02Å; T372-Y376 HydrophobicContact CG2-CE2 4.08Å; T372-Y376 WeakPolarHBondContact O-CD2 3.17Å; T372-Y376 PolarHBondContact O-N 2.79Å; T372-Y376 VanDerWaalsContact O-N 3.16Å; L374-Y376 VanDerWaalsContact C-N 3.34Å; L374-Y376 PolarHBondContact O-N 3.24Å; Y376-R453 HydrophobicContact CD2-CB 3.94Å; Y376-R453 HydrophobicContact CD2-CG 4.36Å; Y376-R453 HydrophobicContact CG-CB 4.44Å; Y376-P454 HydrophobicContact CD2-CG 4.47Å; Y376-P454 HydrophobicContact CE1-CG 4.11Å; Y376-P454 HydrophobicContact CE2-CG 3.75Å; Y376-M532 HydrophobicContact CD1-CG 4.17Å; Y376-M532 HydrophobicContact CE1-CG 4.03Å
377	G	97.3	Very high	94.6	Very high	0 Å²	0	22.6 Å²	22.6	0%	0	12%	0.116	C	C	.	.	H	α-helix	trans	-82.3	-31.5	-174.9	0	0	0	0	0	115.5	L373 L374 H379 E380 A381	L373-G377 VanDerWaalsContact O-CA 3.28Å; L373-G377 WeakPolarHBondContact O-CA 3.44Å; L373-G377 PolarHBondContact O-N 3.31Å; L374-G377 PolarHBondContact O-N 3.09Å; G377-H379 PolarHBondContact O-N 3.37Å; G377-E380 PolarHBondContact O-N 2.8Å; G377-A381 WeakPolarHBondContact O-CB 3.38Å; G377-A381 PolarHBondContact O-N 3.07Å
378	V	97.7	Very high	95.3	Very high	1 Å²	1	17.5 Å²	17.5	1%	0.006	9%	0.09	C	C	.	.	H	α-helix	trans	-65.1	-37.4	-169.3	-69.6	0	0	0	0	114	V349 L352 L374 A381 I382 I528	V349-V378 HydrophobicContact CG2-CB 4.24Å; V349-V378 HydrophobicContact CG2-CG2 4.07Å; L352-V378 HydrophobicContact CB-CG1 4.39Å; L352-V378 HydrophobicContact CD1-CB 4.36Å; L352-V378 HydrophobicContact CD1-CG1 4.43Å; L374-V378 HydrophobicContact CB-CG1 4.36Å; L374-V378 HydrophobicContact CD2-CG1 3.92Å; L374-V378 VanDerWaalsContact O-CG1 3.3Å; L374-V378 WeakPolarHBondContact O-CG1 3.47Å; L374-V378 VanDerWaalsContact O-CG2 3.3Å; L374-V378 WeakPolarHBondContact O-CG2 3.32Å; L374-V378 PolarHBondContact O-N 3.47Å; V378-A381 PolarHBondContact O-N 3.33Å; V378-I382 WeakPolarHBondContact O-CB 3.22Å; V378-I382 WeakPolarHBondContact O-CG1 3.44Å; V378-I382 PolarHBondContact O-N 3.15Å; V378-I528 HydrophobicContact CG2-CD1 4.1Å; V378-I528 HydrophobicContact CG2-CG2 4.22Å
379	H	97.5	Very high	96	Very high	5 Å²	5	14.8 Å²	14.8	2%	0.023	8%	0.076	C	C	.	.	H	α-helix	trans	-71.7	-36.5	178.8	-77.3	111.6	0	0	0	112.4	G377 I382 F383 V502 I528 Y529	G377-H379 PolarHBondContact O-N 3.37Å; H379-I382 PolarHBondContact O-N 3.36Å; H379-F383 WeakPolarHBondContact O-CB 3.48Å; H379-F383 WeakPolarHBondContact O-CG 3.02Å; H379-F383 PolarHBondContact O-N 3Å; H379-V502 HydrophobicContact CB-CG1 3.92Å; H379-V502 HydrophobicContact CB-CG2 3.73Å; H379-I528 VanDerWaalsContact CE1-CG2 3.45Å; H379-I528 WeakPolarHBondContact CE1-CG2 3.46Å; H379-I528 WeakPolarHBondContact ND1-CG2 3.32Å; H379-Y529 PolarHBondContact CD2-OH 3.01Å; H379-Y529 AromaticContact CE1-CE2 3.37Å; H379-Y529 WeakPolarHBondContact CE1-CE2 3.48Å; H379-Y529 AromaticContact CE1-CZ 3.41Å; H379-Y529 VanDerWaalsContact CE1-CZ 3.41Å; H379-Y529 PolarHBondContact CE1-OH 3.47Å; H379-Y529 VanDerWaalsContact CE1-OH 3.31Å; H379-Y529 AromaticContact NE2-CE2 3.48Å; H379-Y529 WeakPolarHBondContact NE2-CE2 3.4Å; H379-Y529 AromaticContact NE2-CZ 3.44Å; H379-Y529 PolarHBondContact NE2-OH 3.49Å
380	E	98.4	Very high	96.4	Very high	0 Å²	0	14.9 Å²	14.9	0%	0	8%	0.076	C	C	.	.	H	α-helix	trans	-62.9	-44.3	171.3	-67.1	177.5	-164.4	0	0	110.7	G377 F383 A384 I447 R453 L498 R499 V502	G377-E380 PolarHBondContact O-N 2.8Å; E380-F383 PolarHBondContact O-N 3.04Å; E380-A384 WeakPolarHBondContact O-CB 3.42Å; E380-A384 PolarHBondContact O-N 3.4Å; E380-I447 HydrophobicContact CB-CG2 3.48Å; E380-I447 VanDerWaalsContact CB-CG2 3.48Å; E380-R453 VanDerWaalsContact CD-NH2 3.33Å; E380-R453 IonicContact OE1-CZ 3.14Å; E380-R453 IonicContact OE1-NH1 3.51Å; E380-R453 PolarHBondContact OE1-NH1 2.8Å; E380-R453 IonicContact OE1-NH2 3.57Å; E380-R453 PolarHBondContact OE1-NH2 3.21Å; E380-R453 IonicContact OE2-CZ 3.29Å; E380-R453 IonicContact OE2-NH1 3.45Å; E380-R453 IonicContact OE2-NH2 2.63Å; E380-R453 PolarHBondContact OE2-NH2 2.6Å; E380-L498 HydrophobicContact CB-CB 4.33Å; E380-L498 HydrophobicContact CG-CB 4.29Å; E380-R499 WeakPolarHBondContact OE1-CG 3.49Å; E380-R499 IonicContact OE1-NE 3.5Å; E380-R499 PolarHBondContact OE1-NE 3.3Å; E380-R499 IonicContact OE2-NE 2.63Å; E380-V502 HydrophobicContact CG-CG2 3.89Å
381	A	98.6	Very high	96.5	Very high	0 Å²	0	16 Å²	16	0%	0	8%	0.082	C	C	.	.	H	α-helix	trans	-62.4	-45.3	176.6	0	0	0	0	0	112.6	L352 G377 V378 F383 A384 M385 V444 I447	L352-A381 HydrophobicContact CD1-CB 3.76Å; L352-A381 HydrophobicContact CD2-CB 4.05Å; G377-A381 WeakPolarHBondContact O-CB 3.38Å; G377-A381 PolarHBondContact O-N 3.07Å; V378-A381 PolarHBondContact O-N 3.33Å; A381-F383 VanDerWaalsContact C-N 3.34Å; A381-F383 PolarHBondContact O-N 3.28Å; A381-A384 PolarHBondContact O-N 3.13Å; A381-M385 WeakPolarHBondContact O-CG 3.45Å; A381-M385 PolarHBondContact O-N 2.82Å; A381-V444 HydrophobicContact CB-CG1 3.8Å; A381-I447 HydrophobicContact CB-CG2 4.25Å
382	I	98.4	Very high	96.7	Very high	16 Å²	16	20.6 Å²	20.6	8%	0.082	10%	0.099	C	C	.	.	H	α-helix	trans	-59.1	-45.8	175.2	-72.1	169.2	0	0	0	110.2	T345 T348 V349 L352 V378 H379 A384 M385 L386	T345-I382 HydrophobicContact CG2-CD1 3.94Å; T348-I382 HydrophobicContact CG2-CD1 4.32Å; T348-I382 HydrophobicContact CG2-CG1 3.78Å; V349-I382 HydrophobicContact CG2-CD1 3.94Å; L352-I382 HydrophobicContact CD1-CD1 4.34Å; L352-I382 HydrophobicContact CD1-CG1 3.65Å; V378-I382 WeakPolarHBondContact O-CB 3.22Å; V378-I382 WeakPolarHBondContact O-CG1 3.44Å; V378-I382 PolarHBondContact O-N 3.15Å; H379-I382 PolarHBondContact O-N 3.36Å; I382-A384 VanDerWaalsContact C-N 3.35Å; I382-A384 PolarHBondContact O-N 3.06Å; I382-M385 PolarHBondContact O-N 3.31Å; I382-L386 VanDerWaalsContact O-CB 3.23Å; I382-L386 WeakPolarHBondContact O-CB 3.39Å; I382-L386 PolarHBondContact O-N 2.92Å
383	F	98.6	Very high	96.9	Very high	15 Å²	15	23.1 Å²	23.1	7%	0.066	11%	0.111	C	C	.	.	H	α-helix	trans	-73.3	-22.6	179.3	-63.8	-17.6	0	0	0	113.8	H379 E380 A381 L386 P387 K423 F426 L498 L501 V502 N505	H379-F383 WeakPolarHBondContact O-CB 3.48Å; H379-F383 WeakPolarHBondContact O-CG 3.02Å; H379-F383 PolarHBondContact O-N 3Å; E380-F383 PolarHBondContact O-N 3.04Å; A381-F383 VanDerWaalsContact C-N 3.34Å; A381-F383 PolarHBondContact O-N 3.28Å; F383-L386 HydrophobicContact CD1-CD2 4.21Å; F383-P387 WeakPolarHBondContact O-CD 3.44Å; F383-K423 HydrophobicContact CD1-CG 4.26Å; F383-K423 HydrophobicContact CE1-CG 4.24Å; F383-F426 WeakPolarHBondContact O-CE1 3.48Å; F383-L498 HydrophobicContact CB-CD2 3.55Å; F383-L501 HydrophobicContact CB-CD2 4.03Å; F383-L501 HydrophobicContact CD2-CB 4.35Å; F383-L501 HydrophobicContact CD2-CD2 3.92Å; F383-L501 HydrophobicContact CD2-CG 3.74Å; F383-L501 HydrophobicContact CE2-CG 4.15Å; F383-L501 HydrophobicContact CG-CD2 4.13Å; F383-L501 HydrophobicContact CG-CG 4.42Å; F383-V502 HydrophobicContact CD2-CG2 3.78Å; F383-V502 HydrophobicContact CE2-CG2 3.91Å; F383-N505 HydrophobicContact CE2-CB 3.91Å; F383-N505 HydrophobicContact CZ-CB 3.93Å
384	A	98.5	Very high	96.9	Very high	0 Å²	0	23.1 Å²	23.1	0%	0	11%	0.111	C	C	.	.	H	α-helix	trans	-71.7	-36.3	167.8	0	0	0	0	0	112.5	E380 A381 I382 F430 F443 V444 I447 L498	E380-A384 WeakPolarHBondContact O-CB 3.42Å; E380-A384 PolarHBondContact O-N 3.4Å; A381-A384 PolarHBondContact O-N 3.13Å; I382-A384 VanDerWaalsContact C-N 3.35Å; I382-A384 PolarHBondContact O-N 3.06Å; A384-F430 HydrophobicContact CB-CZ 4.48Å; A384-F430 VanDerWaalsContact O-CE1 3.23Å; A384-F430 WeakPolarHBondContact O-CE1 3.18Å; A384-F443 HydrophobicContact CB-CD1 4.2Å; A384-F443 HydrophobicContact CB-CE1 4Å; A384-V444 HydrophobicContact CB-CG2 4.38Å; A384-I447 HydrophobicContact CB-CD1 3.87Å; A384-L498 HydrophobicContact CB-CD1 3.97Å; A384-L498 HydrophobicContact CB-CD2 4.47Å
385	M	98.2	Very high	96.9	Very high	19 Å²	19	22.8 Å²	22.8	9%	0.094	11%	0.11	C	C	.	.	H	α-helix	trans	-79.7	-41	178.9	-67.6	-171.2	-58.2	0	0	113.2	Y273 L277 T348 L352 A381 I382 P387 S388 V444	Y273-M385 HydrophobicContact CE2-CG 4.45Å; Y273-M385 HydrophobicContact CE2-SD 3.9Å; L277-M385 HydrophobicContact CD1-SD 3.64Å; L277-M385 HydrophobicContact CD2-CE 4.02Å; L277-M385 HydrophobicContact CD2-SD 3.91Å; L277-M385 HydrophobicContact CG-SD 4.46Å; T348-M385 HydrophobicContact CG2-CE 3.7Å; L352-M385 HydrophobicContact CD1-CE 3.84Å; L352-M385 HydrophobicContact CD2-CE 3.69Å; L352-M385 HydrophobicContact CD2-SD 4.27Å; L352-M385 HydrophobicContact CG-CE 3.86Å; A381-M385 WeakPolarHBondContact O-CG 3.45Å; A381-M385 PolarHBondContact O-N 2.82Å; I382-M385 PolarHBondContact O-N 3.31Å; M385-P387 VanDerWaalsContact C-CD 3.42Å; M385-P387 VanDerWaalsContact O-N 3.17Å; M385-S388 WeakPolarHBondContact O-CB 3.23Å; M385-S388 PolarHBondContact O-N 3.02Å; M385-S388 PolarHBondContact O-OG 3.33Å; M385-S388 VanDerWaalsContact O-OG 3.11Å; M385-V444 HydrophobicContact CG-CG2 3.91Å
386	L	97.7	Very high	97	Very high	26 Å²	26	21.5 Å²	21.5	14%	0.136	10%	0.104	C	C	.	.	G	3₁₀ helix	trans	-48.4	-39.9	-175.1	180	63.6	0	0	0	115.2	I382 F383 S388 L389 M390 L395 M420 K423	I382-L386 VanDerWaalsContact O-CB 3.23Å; I382-L386 WeakPolarHBondContact O-CB 3.39Å; I382-L386 PolarHBondContact O-N 2.92Å; F383-L386 HydrophobicContact CD1-CD2 4.21Å; L386-S388 PolarHBondContact O-N 2.96Å; L386-L389 HydrophobicContact CD1-CD1 4.37Å; L386-L389 WeakPolarHBondContact O-CB 3.32Å; L386-L389 PolarHBondContact O-N 3.46Å; L386-M390 HydrophobicContact CD1-CE 4.08Å; L386-M390 HydrophobicContact CD2-CE 3.85Å; L386-M390 HydrophobicContact CG-CE 3.8Å; L386-M390 HydrophobicContact CG-SD 4.15Å; L386-M390 PolarHBondContact O-N 3.36Å; L386-L395 HydrophobicContact CD1-CD1 3.59Å; L386-L395 HydrophobicContact CD1-CD2 4.21Å; L386-M420 HydrophobicContact CD2-CE 4.48Å; L386-K423 HydrophobicContact CD2-CB 4Å; L386-K423 HydrophobicContact CD2-CG 4.06Å
387	P	98.3	Very high	96.9	Very high	1 Å²	1	21 Å²	21	1%	0.006	11%	0.105	C	C	.	.	G	3₁₀ helix	trans	-53	-26.3	172.4	-31	36.5	0	0	0	115.1	R285 F383 M385 L389 M390 F426 A427 F430 N431	R285-P387 PolarHBondContact NH2-O 2.94Å; R285-P387 VanDerWaalsContact NH2-O 3.12Å; F383-P387 WeakPolarHBondContact O-CD 3.44Å; M385-P387 VanDerWaalsContact C-CD 3.42Å; M385-P387 VanDerWaalsContact O-N 3.17Å; P387-L389 VanDerWaalsContact C-N 3.28Å; P387-L389 PolarHBondContact O-N 3.08Å; P387-M390 PolarHBondContact O-N 3.5Å; P387-F426 HydrophobicContact CG-CD1 3.88Å; P387-F426 HydrophobicContact CG-CE1 3.86Å; P387-A427 HydrophobicContact CB-CB 3.73Å; P387-A427 HydrophobicContact CG-CB 3.86Å; P387-F430 HydrophobicContact CB-CB 4.43Å; P387-F430 HydrophobicContact CB-CD1 3.84Å; P387-F430 HydrophobicContact CG-CB 4.21Å; P387-F430 HydrophobicContact CG-CD1 3.77Å; P387-F430 HydrophobicContact CG-CG 4.27Å; P387-N431 PolarHBondContact O-ND2 3.34Å; P387-N431 PolarHBondContact O-OD1 3.08Å
388	S	97.4	Very high	96.6	Very high	3 Å²	3	21.8 Å²	21.8	2%	0.021	11%	0.111	C	C	.	.	G	3₁₀ helix	trans	-66.7	-29.9	176.2	-60	0	0	0	0	113	K281 A284 M385 L386 L440	K281-S388 WeakPolarHBondContact CD-OG 3.4Å; K281-S388 WeakPolarHBondContact CE-OG 3.4Å; K281-S388 WeakPolarHBondContact CG-OG 3.45Å; A284-S388 WeakPolarHBondContact CB-O 3.49Å; M385-S388 WeakPolarHBondContact O-CB 3.23Å; M385-S388 PolarHBondContact O-N 3.02Å; M385-S388 PolarHBondContact O-OG 3.33Å; M385-S388 VanDerWaalsContact O-OG 3.11Å; L386-S388 PolarHBondContact O-N 2.96Å; S388-L440 WeakPolarHBondContact OG-CD1 3.36Å
389	L	96.4	Very high	96.1	Very high	39 Å²	39	25.8 Å²	25.8	20%	0.204	13%	0.133	C	C	.	.	T	Hydrogen-bonded Turn	trans	-86.9	-13.3	178.9	-50.2	-174.8	0	0	0	112.8	M279 A284 L386 P387 L395 L396	M279-L389 HydrophobicContact CB-CD2 4.26Å; M279-L389 HydrophobicContact CG-CD2 3.41Å; M279-L389 VanDerWaalsContact CG-CD2 3.41Å; A284-L389 HydrophobicContact CB-CD2 3.92Å; L386-L389 HydrophobicContact CD1-CD1 4.37Å; L386-L389 WeakPolarHBondContact O-CB 3.32Å; L386-L389 PolarHBondContact O-N 3.46Å; P387-L389 VanDerWaalsContact C-N 3.28Å; P387-L389 PolarHBondContact O-N 3.08Å; L389-L395 HydrophobicContact CB-CD1 3.54Å; L389-L395 HydrophobicContact CD1-CD1 4.43Å; L389-L396 HydrophobicContact CB-CB 4.37Å; L389-L396 PolarHBondContact O-N 3.47Å
390	M	97.1	Very high	95.8	Very high	1 Å²	1	26 Å²	26	1%	0.005	14%	0.137	C	C	.	.	B	Isolated β-bridge	trans	-99.7	151.4	-173.6	-69.9	-179.8	161.1	0	0	113.7	R285 L386 P387 G394 L395 M420 K423 F424 A427	R285-M390 PolarHBondContact NH1-O 3.33Å; R285-M390 PolarHBondContact NH2-O 3.15Å; L386-M390 HydrophobicContact CD1-CE 4.08Å; L386-M390 HydrophobicContact CD2-CE 3.85Å; L386-M390 HydrophobicContact CG-CE 3.8Å; L386-M390 HydrophobicContact CG-SD 4.15Å; L386-M390 PolarHBondContact O-N 3.36Å; P387-M390 PolarHBondContact O-N 3.5Å; M390-G394 WeakPolarHBondContact CA-O 3.41Å; M390-L395 HydrophobicContact CE-CD1 4.27Å; M390-L395 HydrophobicContact CE-CD2 4.22Å; M390-L395 HydrophobicContact CG-CB 4.29Å; M390-L395 HydrophobicContact CG-CD1 3.74Å; M390-M420 HydrophobicContact CE-CE 3.55Å; M390-K423 HydrophobicContact CE-CB 4.22Å; M390-F424 HydrophobicContact CB-CE1 4.4Å; M390-F424 HydrophobicContact CE-CD1 3.96Å; M390-F424 HydrophobicContact CE-CD2 4.34Å; M390-F424 HydrophobicContact CE-CE1 3.86Å; M390-F424 HydrophobicContact CE-CE2 4.25Å; M390-F424 HydrophobicContact CE-CG 4.2Å; M390-F424 HydrophobicContact CE-CZ 4.01Å; M390-F424 HydrophobicContact CG-CD1 4.25Å; M390-F424 HydrophobicContact CG-CE1 3.98Å; M390-F424 HydrophobicContact SD-CD1 3.72Å; M390-F424 HydrophobicContact SD-CE1 3.94Å; M390-F424 HydrophobicContact SD-CG 4.28Å; M390-A427 HydrophobicContact CB-CB 4.17Å; M390-A427 HydrophobicContact CG-CB 4.48Å; M390-A427 HydrophobicContact SD-CB 3.52Å; M390-A427 VanDerWaalsContact SD-CB 3.52Å
391	N	93.9	Very high	95.4	Very high	50 Å²	50	30.8 Å²	30.8	27%	0.267	16%	0.157	S	C	.	.			trans	-125	-165.7	156.8	69	17.9	0	0	0	109.2	D393 G394	N391-D393 VanDerWaalsContact C-N 3.26Å; N391-D393 PolarHBondContact O-N 3.38Å; N391-D393 WeakPolarHBondContact OD1-CA 3.26Å; N391-D393 WeakPolarHBondContact OD1-CB 3.39Å; N391-D393 PolarHBondContact OD1-N 3.41Å; N391-G394 PolarHBondContact N-O 3.49Å; N391-G394 PolarHBondContact OD1-N 3.11Å; N391-G394 PolarHBondContact OD1-O 3.04Å
392	K	93.9	Very high	95.1	Very high	142 Å²	142	30.8 Å²	30.8	62%	0.617	16%	0.157	S	C	*	.	S	Bend	trans	-69.6	-22.2	178.4	62.7	169.1	-177.9	68.2	0	114.1
393	D	95	Very high	95	Very high	78 Å²	78	31 Å²	31	42%	0.417	16%	0.158	S	C	.	.	S	Bend	trans	-104.4	-16.8	-168	-54.6	-58.7	0	0	0	113.3	N391 F403 T405 R406	N391-D393 VanDerWaalsContact C-N 3.26Å; N391-D393 PolarHBondContact O-N 3.38Å; N391-D393 WeakPolarHBondContact OD1-CA 3.26Å; N391-D393 WeakPolarHBondContact OD1-CB 3.39Å; N391-D393 PolarHBondContact OD1-N 3.41Å; D393-F403 HydrophobicContact CB-CZ 4.45Å; D393-T405 CarbonylContact O-C 3.57Å; D393-T405 WeakPolarHBondContact O-CA 3.46Å; D393-R406 PolarHBondContact O-N 3.15Å
394	G	96.8	Very high	95	Very high	0 Å²	0	31 Å²	31	0%	0	16%	0.159	C	C	.	.	E	Extended strand (participates in β ladder)	trans	168.8	-169.3	-175.8	0	0	0	0	0	115.5	M390 N391 V404	M390-G394 WeakPolarHBondContact CA-O 3.41Å; N391-G394 PolarHBondContact N-O 3.49Å; N391-G394 PolarHBondContact OD1-N 3.11Å; N391-G394 PolarHBondContact OD1-O 3.04Å; G394-V404 CarbonylContact C-O 3.5Å; G394-V404 WeakPolarHBondContact CA-O 3.39Å
395	L	96.9	Very high	94.9	Very high	18 Å²	18	32.2 Å²	32.2	9%	0.094	17%	0.166	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-131.4	131.4	-168.4	167.6	62.2	0	0	0	111	L386 L389 M390 V397 F403 V404 M420 F424	L386-L395 HydrophobicContact CD1-CD1 3.59Å; L386-L395 HydrophobicContact CD1-CD2 4.21Å; L389-L395 HydrophobicContact CB-CD1 3.54Å; L389-L395 HydrophobicContact CD1-CD1 4.43Å; M390-L395 HydrophobicContact CE-CD1 4.27Å; M390-L395 HydrophobicContact CE-CD2 4.22Å; M390-L395 HydrophobicContact CG-CB 4.29Å; M390-L395 HydrophobicContact CG-CD1 3.74Å; L395-V397 HydrophobicContact CD2-CG1 4.4Å; L395-V397 HydrophobicContact CG-CG1 4.22Å; L395-F403 CarbonylContact O-C 3.56Å; L395-F403 WeakPolarHBondContact O-CA 3.48Å; L395-V404 PolarHBondContact N-O 3.11Å; L395-V404 PolarHBondContact O-N 2.73Å; L395-M420 HydrophobicContact CD2-CE 3.73Å; L395-F424 HydrophobicContact CB-CE1 4.48Å; L395-F424 HydrophobicContact CB-CZ 4.15Å
396	L	95.7	Very high	94.9	Very high	4 Å²	4	33.2 Å²	33.2	2%	0.021	17%	0.169	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-70.5	137.7	166.2	-72.3	176.7	0	0	0	111.7	A284 I287 L288 P302 L389 G402 F403	A284-L396 HydrophobicContact CB-CD1 3.98Å; I287-L396 HydrophobicContact CB-CD1 4.13Å; I287-L396 HydrophobicContact CD1-CD1 4.4Å; I287-L396 HydrophobicContact CG2-CD1 4.16Å; I287-L396 HydrophobicContact CG2-CD2 3.88Å; L288-L396 HydrophobicContact CD1-CD1 4.24Å; L288-L396 HydrophobicContact CD2-CD1 4.21Å; L288-L396 HydrophobicContact CD2-CD2 4.25Å; L288-L396 HydrophobicContact CD2-CG 3.9Å; L288-L396 HydrophobicContact CG-CD1 3.8Å; L288-L396 HydrophobicContact CG-CG 4.05Å; P302-L396 HydrophobicContact CB-CD2 4.15Å; P302-L396 HydrophobicContact CG-CD2 4.06Å; L389-L396 HydrophobicContact CB-CB 4.37Å; L389-L396 PolarHBondContact O-N 3.47Å; L396-G402 WeakPolarHBondContact CA-O 3.42Å; L396-F403 HydrophobicContact CD2-CB 4.23Å; L396-F403 HydrophobicContact CD2-CD2 4.02Å; L396-F403 HydrophobicContact CG-CD2 4.35Å
397	V	93.4	Very high	94.9	Very high	24 Å²	24	39.2 Å²	39.2	15%	0.145	20%	0.196	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-130.5	168.8	176.9	-61.7	0	0	0	0	111.2	W320 L395 N399 G400 K401 G402 V404	W320-V397 HydrophobicContact CH2-CG2 4.28Å; W320-V397 HydrophobicContact CZ2-CB 4.41Å; W320-V397 HydrophobicContact CZ2-CG2 4.01Å; L395-V397 HydrophobicContact CD2-CG1 4.4Å; L395-V397 HydrophobicContact CG-CG1 4.22Å; V397-N399 PolarHBondContact O-N 2.99Å; V397-G400 PolarHBondContact O-N 3.46Å; V397-K401 PolarHBondContact O-N 2.74Å; V397-G402 PolarHBondContact N-O 3.04Å; V397-G402 PolarHBondContact O-N 2.94Å; V397-V404 HydrophobicContact CB-CG2 4.44Å; V397-V404 HydrophobicContact CG1-CG2 3.71Å; V397-V404 HydrophobicContact CG2-CG2 3.84Å
398	A	89.6	Confident	94.8	Very high	16 Å²	16	39.4 Å²	39.4	13%	0.132	20%	0.197	C	C	.	.	G	3₁₀ helix	trans	49.4	54.4	174.6	0	0	0	0	0	113.4	V319 G400 K401	V319-A398 HydrophobicContact CG1-CB 3.41Å; V319-A398 VanDerWaalsContact CG1-CB 3.41Å; A398-G400 PolarHBondContact O-N 3.01Å; A398-G400 VanDerWaalsContact O-N 3.14Å; A398-K401 HydrophobicContact CB-CB 4.34Å; A398-K401 WeakPolarHBondContact O-CB 3.25Å; A398-K401 WeakPolarHBondContact O-CG 3.43Å; A398-K401 PolarHBondContact O-N 3.34Å; A398-K401 VanDerWaalsContact O-N 3.13Å
399	N	88.3	Confident	94.8	Very high	85 Å²	85	39.9 Å²	39.9	46%	0.455	20%	0.199	S	C	.	.	G	3₁₀ helix	trans	50.5	37.1	-176	-74.3	-46.6	0	0	0	114.3	N278 M279 V397	N278-N399 VanDerWaalsContact CB-OD1 3.31Å; N278-N399 WeakPolarHBondContact CB-OD1 3.46Å; M279-N399 WeakPolarHBondContact CE-O 3.34Å; V397-N399 PolarHBondContact O-N 2.99Å
400	G	89.9	Confident	94.8	Very high	10 Å²	10	44.3 Å²	44.3	10%	0.103	21%	0.213	C	C	.	.	G	3₁₀ helix	trans	83.4	7.9	174.4	0	0	0	0	0	114.7	V397 A398	V397-G400 PolarHBondContact O-N 3.46Å; A398-G400 PolarHBondContact O-N 3.01Å; A398-G400 VanDerWaalsContact O-N 3.14Å
401	K	90.3	Very high	94.8	Very high	99 Å²	99	48.6 Å²	48.6	43%	0.43	24%	0.243	S	C	.	.	T	Hydrogen-bonded Turn	trans	-70.3	-32.6	169.3	-69.3	180	175.8	-174.5	0	112.8	P302 F303 V319 N321 V397 A398	P302-K401 CarbonylContact C-O 3.51Å; P302-K401 VanDerWaalsContact CA-O 3.26Å; P302-K401 WeakPolarHBondContact CA-O 3.3Å; F303-K401 PolarHBondContact N-O 3Å; V319-K401 HydrophobicContact CG1-CB 4.22Å; V319-K401 WeakPolarHBondContact O-CD 3.35Å; V319-K401 PolarHBondContact O-NZ 3.37Å; N321-K401 PolarHBondContact OD1-NZ 2.94Å; V397-K401 PolarHBondContact O-N 2.74Å; A398-K401 HydrophobicContact CB-CB 4.34Å; A398-K401 WeakPolarHBondContact O-CB 3.25Å; A398-K401 WeakPolarHBondContact O-CG 3.43Å; A398-K401 PolarHBondContact O-N 3.34Å; A398-K401 VanDerWaalsContact O-N 3.13Å
402	G	93.3	Very high	94.8	Very high	0 Å²	0	46.8 Å²	46.8	0%	0	23%	0.233	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-119.1	155.3	-177.8	0	0	0	0	0	112.8	F303 L396 V397	F303-G402 CarbonylContact O-C 3.49Å; F303-G402 VanDerWaalsContact O-CA 3.3Å; F303-G402 WeakPolarHBondContact O-CA 3.46Å; L396-G402 WeakPolarHBondContact CA-O 3.42Å; V397-G402 PolarHBondContact N-O 3.04Å; V397-G402 PolarHBondContact O-N 2.94Å
403	F	96.4	Very high	94.7	Very high	22 Å²	22	45.2 Å²	45.2	10%	0.096	22%	0.223	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-134.4	111.5	171.3	179.8	-96.8	0	0	0	109.7	L288 P302 F303 V304 I305 D393 L395 L396 T405	L288-F403 HydrophobicContact CD2-CD2 3.95Å; L288-F403 HydrophobicContact CD2-CE2 3.68Å; P302-F403 HydrophobicContact CB-CB 4Å; P302-F403 HydrophobicContact CG-CB 3.91Å; F303-F403 PolarHBondContact O-N 3.48Å; V304-F403 WeakPolarHBondContact CA-O 3.46Å; V304-F403 HydrophobicContact CG1-CD1 4.37Å; I305-F403 PolarHBondContact N-O 3.16Å; D393-F403 HydrophobicContact CB-CZ 4.45Å; L395-F403 CarbonylContact O-C 3.56Å; L395-F403 WeakPolarHBondContact O-CA 3.48Å; L396-F403 HydrophobicContact CD2-CB 4.23Å; L396-F403 HydrophobicContact CD2-CD2 4.02Å; L396-F403 HydrophobicContact CG-CD2 4.35Å; F403-T405 HydrophobicContact CE1-CG2 4.46Å
404	V	97.1	Very high	94.6	Very high	14 Å²	14	50 Å²	50	9%	0.085	24%	0.236	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-90.8	127.6	179.8	-170.1	0	0	0	0	109.3	I305 G394 L395 V397 F408 L409	I305-V404 HydrophobicContact CB-CG2 4.26Å; I305-V404 HydrophobicContact CD1-CG2 4.08Å; I305-V404 HydrophobicContact CG2-CG1 4.46Å; I305-V404 WeakPolarHBondContact O-CA 3.41Å; G394-V404 CarbonylContact C-O 3.5Å; G394-V404 WeakPolarHBondContact CA-O 3.39Å; L395-V404 PolarHBondContact N-O 3.11Å; L395-V404 PolarHBondContact O-N 2.73Å; V397-V404 HydrophobicContact CB-CG2 4.44Å; V397-V404 HydrophobicContact CG1-CG2 3.71Å; V397-V404 HydrophobicContact CG2-CG2 3.84Å; V404-F408 HydrophobicContact CG1-CD1 3.69Å; V404-F408 HydrophobicContact CG1-CE1 4.24Å; V404-L409 HydrophobicContact CB-CD1 4.48Å; V404-L409 HydrophobicContact CG1-CD1 3.98Å; V404-L409 HydrophobicContact CG1-CD2 3.96Å; V404-L409 HydrophobicContact CG1-CG 3.75Å
405	T	98	Very high	94.4	Very high	25 Å²	25	50.4 Å²	50.4	15%	0.153	24%	0.238	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-74	146.1	179	73.5	0	0	0	0	111.7	V304 I305 H306 D393 F403 E407 F408 L409	V304-T405 HydrophobicContact CG1-CG2 3.87Å; I305-T405 PolarHBondContact O-N 3.37Å; H306-T405 HydrophobicContact CB-CG2 3.86Å; D393-T405 CarbonylContact O-C 3.57Å; D393-T405 WeakPolarHBondContact O-CA 3.46Å; F403-T405 HydrophobicContact CE1-CG2 4.46Å; T405-E407 VanDerWaalsContact C-N 3.25Å; T405-E407 PolarHBondContact O-N 3.05Å; T405-F408 PolarHBondContact O-N 3.43Å; T405-F408 VanDerWaalsContact OG1-CB 3.22Å; T405-F408 WeakPolarHBondContact OG1-CB 3.23Å; T405-F408 PolarHBondContact OG1-N 3.25Å; T405-L409 WeakPolarHBondContact O-CG 3.43Å; T405-L409 PolarHBondContact O-N 3.22Å
406	R	97.8	Very high	94.3	Very high	40 Å²	40	49.7 Å²	49.7	15%	0.151	23%	0.234	C	C	.	.	H	α-helix	trans	-66	-31.1	175.3	-179.8	174.6	177.9	-173.5	0.2	111.8	D393 R410 E421 F424	D393-R406 PolarHBondContact O-N 3.15Å; R406-R410 WeakPolarHBondContact O-CB 3.44Å; R406-R410 PolarHBondContact O-N 3.13Å; R406-E421 IonicContact CZ-OE1 3.4Å; R406-E421 IonicContact CZ-OE2 2.73Å; R406-E421 IonicContact NE-OE1 3.99Å; R406-E421 PolarHBondContact NE-OE1 3.24Å; R406-E421 IonicContact NE-OE2 3.03Å; R406-E421 PolarHBondContact NE-OE2 3.21Å; R406-E421 IonicContact NH2-OE1 3.17Å; R406-E421 PolarHBondContact NH2-OE1 3.3Å; R406-E421 IonicContact NH2-OE2 3.04Å; R406-E421 PolarHBondContact NH2-OE2 2.72Å; R406-F424 HydrophobicContact CB-CD2 4.43Å; R406-F424 HydrophobicContact CB-CE1 4.21Å; R406-F424 HydrophobicContact CB-CE2 3.95Å; R406-F424 HydrophobicContact CB-CZ 3.83Å; R406-F424 HydrophobicContact CG-CD1 4.44Å; R406-F424 HydrophobicContact CG-CD2 3.75Å; R406-F424 HydrophobicContact CG-CE1 4.42Å; R406-F424 HydrophobicContact CG-CE2 3.72Å; R406-F424 HydrophobicContact CG-CG 4.13Å; R406-F424 HydrophobicContact CG-CZ 4.08Å
407	E	97.6	Very high	94.2	Very high	153 Å²	153	50.6 Å²	50.6	72%	0.715	24%	0.241	S	C	*	.	H	α-helix	trans	-65.2	-47.1	176.2	-174.4	161.7	-153.7	0	0	111.6	T405 L409 R410 S411	T405-E407 VanDerWaalsContact C-N 3.25Å; T405-E407 PolarHBondContact O-N 3.05Å; E407-L409 PolarHBondContact O-N 2.92Å; E407-R410 CarbonylContact O-C 3.59Å; E407-R410 WeakPolarHBondContact O-CB 3.39Å; E407-R410 PolarHBondContact O-N 3.45Å; E407-R410 VanDerWaalsContact O-N 3.1Å; E407-S411 PolarHBondContact O-N 3.46Å
408	F	97.3	Very high	94.3	Very high	5 Å²	5	51.6 Å²	51.6	2%	0.022	24%	0.244	C	C	.	.	H	α-helix	trans	-59.1	-47.4	174.2	174.6	-113.9	0	0	0	112.3	I305 H306 D307 L311 I333 V337 V404 T405 R410 S411 L412	I305-F408 HydrophobicContact CG2-CD1 4.13Å; I305-F408 HydrophobicContact CG2-CE1 3.75Å; I305-F408 HydrophobicContact CG2-CZ 4.3Å; H306-F408 VanDerWaalsContact C-CD2 3.44Å; H306-F408 WeakPolarHBondContact O-CD2 3.47Å; D307-F408 VanDerWaalsContact CA-CE2 3.47Å; D307-F408 WeakPolarHBondContact O-CE2 3.44Å; L311-F408 HydrophobicContact CB-CZ 4.18Å; L311-F408 HydrophobicContact CD2-CZ 4.12Å; I333-F408 HydrophobicContact CD1-CE2 3.47Å; I333-F408 VanDerWaalsContact CD1-CE2 3.47Å; I333-F408 HydrophobicContact CD1-CZ 3.53Å; I333-F408 HydrophobicContact CG1-CZ 4.28Å; V337-F408 HydrophobicContact CG2-CE1 4.19Å; V337-F408 HydrophobicContact CG2-CZ 4.47Å; V404-F408 HydrophobicContact CG1-CD1 3.69Å; V404-F408 HydrophobicContact CG1-CE1 4.24Å; T405-F408 PolarHBondContact O-N 3.43Å; T405-F408 VanDerWaalsContact OG1-CB 3.22Å; T405-F408 WeakPolarHBondContact OG1-CB 3.23Å; T405-F408 PolarHBondContact OG1-N 3.25Å; F408-R410 PolarHBondContact O-N 3.48Å; F408-S411 WeakPolarHBondContact CA-OG 3.42Å; F408-S411 PolarHBondContact O-N 2.94Å; F408-S411 PolarHBondContact O-OG 3.05Å; F408-L412 PolarHBondContact O-N 3.1Å
409	L	97.1	Very high	94.6	Very high	12 Å²	12	51.8 Å²	51.8	6%	0.063	24%	0.242	C	C	.	.	H	α-helix	trans	-59.3	-32.5	175.4	-70	167.8	0	0	0	112.6	V337 V404 T405 E407 L412 S417 M420 F424	V337-L409 HydrophobicContact CG1-CD2 3.8Å; V404-L409 HydrophobicContact CB-CD1 4.48Å; V404-L409 HydrophobicContact CG1-CD1 3.98Å; V404-L409 HydrophobicContact CG1-CD2 3.96Å; V404-L409 HydrophobicContact CG1-CG 3.75Å; T405-L409 WeakPolarHBondContact O-CG 3.43Å; T405-L409 PolarHBondContact O-N 3.22Å; E407-L409 PolarHBondContact O-N 2.92Å; L409-L412 HydrophobicContact CD2-CD1 4.34Å; L409-L412 WeakPolarHBondContact O-CG 3.49Å; L409-S417 WeakPolarHBondContact O-CA 3.3Å; L409-M420 HydrophobicContact CD1-CB 4.41Å; L409-M420 HydrophobicContact CD1-CG 4.23Å; L409-M420 HydrophobicContact CD2-CG 4.29Å; L409-F424 HydrophobicContact CD1-CE2 3.82Å; L409-F424 HydrophobicContact CD1-CZ 4.03Å
410	R	96.6	Very high	94.9	Very high	133 Å²	133	48.9 Å²	48.9	50%	0.502	23%	0.226	S	C	.	.	H	α-helix	trans	-77.7	-28	175.5	-166.2	-174	-68.7	142.5	-8.7	113	R406 E407 F408 L412 S417 E421	R406-R410 WeakPolarHBondContact O-CB 3.44Å; R406-R410 PolarHBondContact O-N 3.13Å; E407-R410 CarbonylContact O-C 3.59Å; E407-R410 WeakPolarHBondContact O-CB 3.39Å; E407-R410 PolarHBondContact O-N 3.45Å; E407-R410 VanDerWaalsContact O-N 3.1Å; F408-R410 PolarHBondContact O-N 3.48Å; R410-L412 VanDerWaalsContact C-N 3.28Å; R410-L412 PolarHBondContact O-N 3.06Å; R410-S417 VanDerWaalsContact O-CB 3.26Å; R410-S417 WeakPolarHBondContact O-CB 3.44Å; R410-E421 IonicContact CZ-OE1 3.57Å; R410-E421 IonicContact NE-OE1 3.52Å; R410-E421 IonicContact NH2-OE1 3.77Å; R410-E421 PolarHBondContact NH2-OE1 3.5Å; R410-E421 IonicContact NH2-OE2 3.8Å
411	S	95.6	Very high	95.2	Very high	90 Å²	90	50.5 Å²	50.5	63%	0.629	23%	0.231	S	C	*	.	H	α-helix	trans	-76.5	-6.4	177.3	65.5	0	0	0	0	115.2	E407 F408	E407-S411 PolarHBondContact O-N 3.46Å; F408-S411 WeakPolarHBondContact CA-OG 3.42Å; F408-S411 PolarHBondContact O-N 2.94Å; F408-S411 PolarHBondContact O-OG 3.05Å
412	L	93.6	Very high	95.6	Very high	12 Å²	12	47.5 Å²	47.5	6%	0.063	22%	0.222	C	C	.	.	S	Bend	trans	-62.2	153.9	174.4	-58.1	176.6	0	0	0	111.6	I333 V337 F408 L409 R410 F416 S417	I333-L412 HydrophobicContact CB-CD2 4.48Å; I333-L412 HydrophobicContact CD1-CD2 3.93Å; I333-L412 HydrophobicContact CG1-CD2 3.89Å; I333-L412 HydrophobicContact CG2-CD2 3.95Å; V337-L412 HydrophobicContact CB-CD1 4.14Å; V337-L412 HydrophobicContact CG1-CD1 3.99Å; V337-L412 HydrophobicContact CG2-CD1 4.33Å; V337-L412 HydrophobicContact CG2-CD2 4.22Å; F408-L412 PolarHBondContact O-N 3.1Å; L409-L412 HydrophobicContact CD2-CD1 4.34Å; L409-L412 WeakPolarHBondContact O-CG 3.49Å; R410-L412 VanDerWaalsContact C-N 3.28Å; R410-L412 PolarHBondContact O-N 3.06Å; L412-F416 HydrophobicContact CB-CB 4.14Å; L412-F416 HydrophobicContact CD1-CB 4.24Å; L412-S417 WeakPolarHBondContact O-CB 3.43Å; L412-S417 PolarHBondContact O-OG 3.3Å
413	R	92.7	Very high	95.8	Very high	109 Å²	109	47.7 Å²	47.7	41%	0.411	22%	0.223	S	C	.	.	P	Polyproline II helix	trans	-60.6	149.7	172.2	-168.1	-173.1	51.2	107.5	-28	110.4	E332 F416 S417 E516	E332-R413 IonicContact OE1-NE 2.69Å; E332-R413 IonicContact OE2-CZ 3.7Å; E332-R413 IonicContact OE2-NE 3.21Å; E332-R413 PolarHBondContact OE2-NE 3.33Å; E332-R413 IonicContact OE2-NH2 2.68Å; E332-R413 PolarHBondContact OE2-NH2 3.28Å; R413-F416 WeakPolarHBondContact O-CA 3.26Å; R413-F416 WeakPolarHBondContact O-CB 3.48Å; R413-F416 PolarHBondContact O-N 3.09Å; R413-S417 PolarHBondContact O-N 3.4Å; R413-E516 IonicContact CZ-OE1 2.76Å; R413-E516 IonicContact CZ-OE2 2.95Å; R413-E516 IonicContact NH1-OE1 3.92Å; R413-E516 PolarHBondContact NH1-OE1 3.01Å; R413-E516 IonicContact NH1-OE2 2.66Å; R413-E516 IonicContact NH2-OE1 3.8Å; R413-E516 PolarHBondContact NH2-OE1 3.09Å; R413-E516 IonicContact NH2-OE2 3.34Å; R413-E516 PolarHBondContact NH2-OE2 3.41Å
414	R	93	Very high	95.9	Very high	180 Å²	180	46.8 Å²	46.8	68%	0.679	22%	0.219	S	C	*	.	T	Hydrogen-bonded Turn	trans	-67.2	140.5	165.3	-72.9	-176.1	173.6	-173.4	-4	110.3	E418	R414-E418 VanDerWaalsContact CD-OE1 3.23Å; R414-E418 WeakPolarHBondContact CD-OE1 3.48Å; R414-E418 HydrophobicContact CG-CG 4.36Å; R414-E418 IonicContact CZ-OE1 2.76Å; R414-E418 IonicContact NE-OE1 3.51Å; R414-E418 PolarHBondContact NE-OE1 3.46Å
415	P	92.9	Very high	95.9	Very high	7 Å²	7	50.8 Å²	50.8	5%	0.045	24%	0.236	C	C	.	.	T	Hydrogen-bonded Turn	cis	-83.5	-9	6.9	32.3	-37.1	0	0	0	116.1	S417 E418 K511 I512 E516	P415-S417 PolarHBondContact O-N 2.94Å; P415-E418 WeakPolarHBondContact O-CB 3.33Å; P415-E418 PolarHBondContact O-N 3.5Å; P415-K511 HydrophobicContact CB-CD 3.91Å; P415-K511 HydrophobicContact CB-CG 4.16Å; P415-I512 HydrophobicContact CB-CG1 4.2Å; P415-I512 HydrophobicContact CG-CB 4.45Å; P415-I512 HydrophobicContact CG-CG1 3.56Å; P415-E516 WeakPolarHBondContact CD-OE1 3.44Å
416	F	93.6	Very high	95.9	Very high	4 Å²	4	50 Å²	50	2%	0.018	23%	0.231	C	C	.	.	G	3₁₀ helix	trans	-60.2	-37.9	-169.3	-58.5	-74.4	0	0	0	115.1	E332 G334 V335 F338 L412 R413 E418 I419 I512 E516 T519	E332-F416 WeakPolarHBondContact OE2-CE2 3.28Å; G334-F416 VanDerWaalsContact CA-CD2 3.5Å; G334-F416 WeakPolarHBondContact O-CD1 3.46Å; G334-F416 WeakPolarHBondContact O-CE1 3.38Å; V335-F416 HydrophobicContact CG2-CE2 4.24Å; V335-F416 HydrophobicContact CG2-CZ 3.81Å; F338-F416 HydrophobicContact CB-CD1 3.83Å; F338-F416 HydrophobicContact CB-CE1 3.69Å; F338-F416 HydrophobicContact CD1-CE1 4.25Å; F338-F416 HydrophobicContact CG-CD1 4.28Å; F338-F416 AromaticContact CG-CE1 3.97Å; F338-F416 HydrophobicContact CG-CE1 3.97Å; L412-F416 HydrophobicContact CB-CB 4.14Å; L412-F416 HydrophobicContact CD1-CB 4.24Å; R413-F416 WeakPolarHBondContact O-CA 3.26Å; R413-F416 WeakPolarHBondContact O-CB 3.48Å; R413-F416 PolarHBondContact O-N 3.09Å; F416-E418 PolarHBondContact O-N 2.76Å; F416-I419 VanDerWaalsContact O-CG2 3.25Å; F416-I419 WeakPolarHBondContact O-CG2 3.24Å; F416-I419 PolarHBondContact O-N 3.06Å; F416-I512 HydrophobicContact CD1-CD1 4.08Å; F416-I512 HydrophobicContact CD1-CG1 4.27Å; F416-I512 HydrophobicContact CE1-CD1 4.2Å; F416-I512 HydrophobicContact CE1-CG1 4.1Å; F416-I512 HydrophobicContact CE1-CG2 3.83Å; F416-I512 HydrophobicContact CZ-CG2 4.26Å; F416-E516 HydrophobicContact CE2-CG 4.07Å; F416-E516 HydrophobicContact CZ-CG 3.79Å; F416-T519 HydrophobicContact CZ-CG2 4.21Å
417	S	94.8	Very high	95.9	Very high	22 Å²	22	48.3 Å²	48.3	15%	0.154	23%	0.225	C	C	.	.	G	3₁₀ helix	trans	-64.2	-17.1	176.8	36.5	0	0	0	0	114.8	L409 R410 L412 R413 P415	L409-S417 WeakPolarHBondContact O-CA 3.3Å; R410-S417 VanDerWaalsContact O-CB 3.26Å; R410-S417 WeakPolarHBondContact O-CB 3.44Å; L412-S417 WeakPolarHBondContact O-CB 3.43Å; L412-S417 PolarHBondContact O-OG 3.3Å; R413-S417 PolarHBondContact O-N 3.4Å; P415-S417 PolarHBondContact O-N 2.94Å
418	E	95.6	Very high	95.8	Very high	46 Å²	46	45.2 Å²	45.2	22%	0.215	22%	0.217	C	C	.	.	G	3₁₀ helix	trans	-81.5	-19.5	179.1	-57.5	169.6	171.3	0	0	111.8	R414 P415 F416 M420 P422 L508 K511	R414-E418 VanDerWaalsContact CD-OE1 3.23Å; R414-E418 WeakPolarHBondContact CD-OE1 3.48Å; R414-E418 HydrophobicContact CG-CG 4.36Å; R414-E418 IonicContact CZ-OE1 2.76Å; R414-E418 IonicContact NE-OE1 3.51Å; R414-E418 PolarHBondContact NE-OE1 3.46Å; P415-E418 WeakPolarHBondContact O-CB 3.33Å; P415-E418 PolarHBondContact O-N 3.5Å; F416-E418 PolarHBondContact O-N 2.76Å; E418-M420 PolarHBondContact O-N 2.81Å; E418-P422 WeakPolarHBondContact O-CD 3.46Å; E418-L508 HydrophobicContact CB-CD1 4.36Å; E418-L508 HydrophobicContact CB-CD2 4.07Å; E418-K511 IonicContact OE1-NZ 3.76Å; E418-K511 PolarHBondContact OE1-NZ 3.34Å; E418-K511 IonicContact OE2-NZ 2.71Å; E418-K511 PolarHBondContact OE2-NZ 2.89Å
419	I	94.6	Very high	95.7	Very high	19 Å²	19	50.3 Å²	50.3	10%	0.097	24%	0.239	C	C	.	.	S	Bend	trans	-71.8	-35.7	-167.4	-153.8	175.6	0	0	0	114.1	F338 F416 K423 V509 I512	F338-I419 HydrophobicContact CD2-CD1 3.99Å; F338-I419 HydrophobicContact CE2-CD1 3.87Å; F416-I419 VanDerWaalsContact O-CG2 3.25Å; F416-I419 WeakPolarHBondContact O-CG2 3.24Å; F416-I419 PolarHBondContact O-N 3.06Å; I419-K423 VanDerWaalsContact O-CD 3.24Å; I419-K423 WeakPolarHBondContact O-CD 3.38Å; I419-K423 WeakPolarHBondContact O-CE 3.33Å; I419-K423 PolarHBondContact O-NZ 3.3Å; I419-V509 HydrophobicContact CD1-CG2 4.47Å; I419-I512 HydrophobicContact CD1-CD1 4.01Å
420	M	96.2	Very high	95.8	Very high	24 Å²	24	49.8 Å²	49.8	12%	0.118	24%	0.236	C	C	.	.	S	Bend	trans	-95.5	-24.8	-172.2	-69.2	-55.4	-62.1	0	0	114.7	L386 M390 L395 L409 E418 K423 F424	L386-M420 HydrophobicContact CD2-CE 4.48Å; M390-M420 HydrophobicContact CE-CE 3.55Å; L395-M420 HydrophobicContact CD2-CE 3.73Å; L409-M420 HydrophobicContact CD1-CB 4.41Å; L409-M420 HydrophobicContact CD1-CG 4.23Å; L409-M420 HydrophobicContact CD2-CG 4.29Å; E418-M420 PolarHBondContact O-N 2.81Å; M420-K423 WeakPolarHBondContact O-CB 3.13Å; M420-K423 PolarHBondContact O-N 2.86Å; M420-F424 HydrophobicContact CB-CD2 4.26Å; M420-F424 HydrophobicContact CB-CE2 4.1Å; M420-F424 WeakPolarHBondContact O-CD2 3.43Å; M420-F424 PolarHBondContact O-N 3.46Å; M420-F424 VanDerWaalsContact O-N 3.11Å
421	E	95.6	Very high	95.7	Very high	45 Å²	45	45.1 Å²	45.1	21%	0.21	22%	0.221	C	C	.	.	H	α-helix	trans	-62.4	-43.2	-170.7	-169	71.1	165.2	0	0	113.6	R406 R410 K423 F424 E425	R406-E421 IonicContact CZ-OE1 3.4Å; R406-E421 IonicContact CZ-OE2 2.73Å; R406-E421 IonicContact NE-OE1 3.99Å; R406-E421 PolarHBondContact NE-OE1 3.24Å; R406-E421 IonicContact NE-OE2 3.03Å; R406-E421 PolarHBondContact NE-OE2 3.21Å; R406-E421 IonicContact NH2-OE1 3.17Å; R406-E421 PolarHBondContact NH2-OE1 3.3Å; R406-E421 IonicContact NH2-OE2 3.04Å; R406-E421 PolarHBondContact NH2-OE2 2.72Å; R410-E421 IonicContact CZ-OE1 3.57Å; R410-E421 IonicContact NE-OE1 3.52Å; R410-E421 IonicContact NH2-OE1 3.77Å; R410-E421 PolarHBondContact NH2-OE1 3.5Å; R410-E421 IonicContact NH2-OE2 3.8Å; E421-K423 PolarHBondContact O-N 3.39Å; E421-F424 PolarHBondContact O-N 3.32Å; E421-F424 VanDerWaalsContact O-N 3.13Å; E421-E425 PolarHBondContact O-N 3.37Å
422	P	97.8	Very high	95.7	Very high	35 Å²	35	44.7 Å²	44.7	23%	0.227	22%	0.223	C	C	.	.	H	α-helix	trans	-60	-31	174.1	-24.7	35.7	0	0	0	113.4	E418 E425 F426 L501	E418-P422 WeakPolarHBondContact O-CD 3.46Å; P422-E425 PolarHBondContact O-N 2.9Å; P422-F426 WeakPolarHBondContact O-CB 3.33Å; P422-F426 PolarHBondContact O-N 2.86Å; P422-L501 HydrophobicContact CB-CD1 3.65Å
423	K	97.9	Very high	95.8	Very high	5 Å²	5	45.5 Å²	45.5	2%	0.022	23%	0.227	C	C	.	.	H	α-helix	trans	-74.3	-35.6	178.9	-69.5	74.8	175.6	177.7	0	110.6	F383 L386 M390 I419 M420 E421 A427 L501 N505	F383-K423 HydrophobicContact CD1-CG 4.26Å; F383-K423 HydrophobicContact CE1-CG 4.24Å; L386-K423 HydrophobicContact CD2-CB 4Å; L386-K423 HydrophobicContact CD2-CG 4.06Å; M390-K423 HydrophobicContact CE-CB 4.22Å; I419-K423 VanDerWaalsContact O-CD 3.24Å; I419-K423 WeakPolarHBondContact O-CD 3.38Å; I419-K423 WeakPolarHBondContact O-CE 3.33Å; I419-K423 PolarHBondContact O-NZ 3.3Å; M420-K423 WeakPolarHBondContact O-CB 3.13Å; M420-K423 PolarHBondContact O-N 2.86Å; E421-K423 PolarHBondContact O-N 3.39Å; K423-A427 WeakPolarHBondContact O-CB 3.09Å; K423-A427 PolarHBondContact O-N 3.36Å; K423-L501 HydrophobicContact CD-CD1 3.91Å; K423-L501 HydrophobicContact CG-CD1 4.19Å; K423-L501 HydrophobicContact CG-CD2 4.29Å; K423-L501 HydrophobicContact CG-CG 4.46Å; K423-N505 VanDerWaalsContact CE-OD1 3.28Å; K423-N505 WeakPolarHBondContact CE-OD1 3.4Å; K423-N505 PolarHBondContact NZ-OD1 3.29Å
424	F	98.1	Very high	96	Very high	2 Å²	2	46.1 Å²	46.1	1%	0.009	24%	0.235	C	C	.	.	H	α-helix	trans	-65.3	-40.8	170.3	-79	-69.2	0	0	0	112.2	M390 L395 R406 L409 M420 E421 A427 V428	M390-F424 HydrophobicContact CB-CE1 4.4Å; M390-F424 HydrophobicContact CE-CD1 3.96Å; M390-F424 HydrophobicContact CE-CD2 4.34Å; M390-F424 HydrophobicContact CE-CE1 3.86Å; M390-F424 HydrophobicContact CE-CE2 4.25Å; M390-F424 HydrophobicContact CE-CG 4.2Å; M390-F424 HydrophobicContact CE-CZ 4.01Å; M390-F424 HydrophobicContact CG-CD1 4.25Å; M390-F424 HydrophobicContact CG-CE1 3.98Å; M390-F424 HydrophobicContact SD-CD1 3.72Å; M390-F424 HydrophobicContact SD-CE1 3.94Å; M390-F424 HydrophobicContact SD-CG 4.28Å; L395-F424 HydrophobicContact CB-CE1 4.48Å; L395-F424 HydrophobicContact CB-CZ 4.15Å; R406-F424 HydrophobicContact CB-CD2 4.43Å; R406-F424 HydrophobicContact CB-CE1 4.21Å; R406-F424 HydrophobicContact CB-CE2 3.95Å; R406-F424 HydrophobicContact CB-CZ 3.83Å; R406-F424 HydrophobicContact CG-CD1 4.44Å; R406-F424 HydrophobicContact CG-CD2 3.75Å; R406-F424 HydrophobicContact CG-CE1 4.42Å; R406-F424 HydrophobicContact CG-CE2 3.72Å; R406-F424 HydrophobicContact CG-CG 4.13Å; R406-F424 HydrophobicContact CG-CZ 4.08Å; L409-F424 HydrophobicContact CD1-CE2 3.82Å; L409-F424 HydrophobicContact CD1-CZ 4.03Å; M420-F424 HydrophobicContact CB-CD2 4.26Å; M420-F424 HydrophobicContact CB-CE2 4.1Å; M420-F424 WeakPolarHBondContact O-CD2 3.43Å; M420-F424 PolarHBondContact O-N 3.46Å; M420-F424 VanDerWaalsContact O-N 3.11Å; E421-F424 PolarHBondContact O-N 3.32Å; E421-F424 VanDerWaalsContact O-N 3.13Å; F424-A427 PolarHBondContact O-N 3.11Å; F424-V428 WeakPolarHBondContact O-CG2 3.19Å; F424-V428 PolarHBondContact O-N 2.88Å
425	E	96.7	Very high	96.2	Very high	98 Å²	98	37.8 Å²	37.8	46%	0.458	20%	0.204	S	C	.	.	H	α-helix	trans	-64.5	-45.2	175.5	-70.1	-162.1	-174.7	0	0	112.8	E421 P422 A427 V428 K429	E421-E425 PolarHBondContact O-N 3.37Å; P422-E425 PolarHBondContact O-N 2.9Å; E425-A427 VanDerWaalsContact C-N 3.33Å; E425-V428 PolarHBondContact O-N 2.96Å; E425-K429 WeakPolarHBondContact O-CG 3.48Å; E425-K429 PolarHBondContact O-N 3.37Å; E425-K429 IonicContact OE2-NZ 2.73Å
426	F	98.2	Very high	96.4	Very high	10 Å²	10	40.2 Å²	40.2	4%	0.044	22%	0.216	C	C	.	.	H	α-helix	trans	-58	-46.4	171.3	178.2	-96.5	0	0	0	110.7	F383 P387 P422 V428 K429 F430 K494 D497 L498 L501	F383-F426 WeakPolarHBondContact O-CE1 3.48Å; P387-F426 HydrophobicContact CG-CD1 3.88Å; P387-F426 HydrophobicContact CG-CE1 3.86Å; P422-F426 WeakPolarHBondContact O-CB 3.33Å; P422-F426 PolarHBondContact O-N 2.86Å; F426-V428 VanDerWaalsContact C-N 3.3Å; F426-V428 PolarHBondContact O-N 3.3Å; F426-K429 PolarHBondContact O-N 2.86Å; F426-K429 VanDerWaalsContact O-N 3.09Å; F426-F430 HydrophobicContact CD1-CB 4.18Å; F426-F430 HydrophobicContact CE1-CB 3.81Å; F426-F430 HydrophobicContact CE1-CD1 4.34Å; F426-F430 AromaticContact CE1-CD2 3.86Å; F426-F430 HydrophobicContact CE1-CD2 3.86Å; F426-F430 AromaticContact CE1-CG 3.77Å; F426-F430 HydrophobicContact CE1-CG 3.77Å; F426-F430 HydrophobicContact CE2-CD2 4.26Å; F426-F430 HydrophobicContact CZ-CB 4.05Å; F426-F430 AromaticContact CZ-CD2 3.46Å; F426-F430 HydrophobicContact CZ-CD2 3.46Å; F426-F430 VanDerWaalsContact CZ-CD2 3.46Å; F426-F430 HydrophobicContact CZ-CE2 4.05Å; F426-F430 AromaticContact CZ-CG 3.86Å; F426-F430 HydrophobicContact CZ-CG 3.86Å; F426-F430 VanDerWaalsContact O-CB 3.27Å; F426-F430 WeakPolarHBondContact O-CB 3.47Å; F426-F430 PolarHBondContact O-N 3.25Å; F426-K494 HydrophobicContact CE2-CB 4.48Å; F426-K494 HydrophobicContact CE2-CD 4.31Å; F426-D497 HydrophobicContact CD2-CB 4.04Å; F426-D497 HydrophobicContact CE2-CB 3.71Å; F426-L498 HydrophobicContact CE1-CD2 3.79Å; F426-L498 HydrophobicContact CE2-CD2 4.11Å; F426-L498 HydrophobicContact CE2-CG 4.11Å; F426-L498 HydrophobicContact CZ-CD1 4.4Å; F426-L498 HydrophobicContact CZ-CD2 3.5Å; F426-L498 VanDerWaalsContact CZ-CD2 3.5Å; F426-L498 HydrophobicContact CZ-CG 3.74Å; F426-L501 HydrophobicContact CB-CD2 3.83Å; F426-L501 HydrophobicContact CD1-CD2 4.09Å; F426-L501 HydrophobicContact CD2-CD2 4.26Å; F426-L501 HydrophobicContact CG-CD2 3.79Å
427	A	98	Very high	96.6	Very high	4 Å²	4	40.6 Å²	40.6	3%	0.033	22%	0.218	C	C	.	.	H	α-helix	trans	-62.2	-32.1	-179	0	0	0	0	0	114	P387 M390 K423 F424 E425 N431	P387-A427 HydrophobicContact CB-CB 3.73Å; P387-A427 HydrophobicContact CG-CB 3.86Å; M390-A427 HydrophobicContact CB-CB 4.17Å; M390-A427 HydrophobicContact CG-CB 4.48Å; M390-A427 HydrophobicContact SD-CB 3.52Å; M390-A427 VanDerWaalsContact SD-CB 3.52Å; K423-A427 WeakPolarHBondContact O-CB 3.09Å; K423-A427 PolarHBondContact O-N 3.36Å; F424-A427 PolarHBondContact O-N 3.11Å; E425-A427 VanDerWaalsContact C-N 3.33Å; A427-N431 VanDerWaalsContact O-CB 3.24Å; A427-N431 WeakPolarHBondContact O-CB 3.41Å; A427-N431 PolarHBondContact O-N 2.98Å; A427-N431 PolarHBondContact O-ND2 2.95Å
428	V	95.7	Very high	96.8	Very high	87 Å²	87	40.6 Å²	40.6	53%	0.527	22%	0.219	S	C	.	.	H	α-helix	trans	-66.4	-48.5	171.7	171	0	0	0	0	110.6	F424 E425 F426 A432	F424-V428 WeakPolarHBondContact O-CG2 3.19Å; F424-V428 PolarHBondContact O-N 2.88Å; E425-V428 PolarHBondContact O-N 2.96Å; F426-V428 VanDerWaalsContact C-N 3.3Å; F426-V428 PolarHBondContact O-N 3.3Å; V428-A432 PolarHBondContact O-N 2.71Å
429	K	95.5	Very high	96.9	Very high	113 Å²	113	38.4 Å²	38.4	49%	0.491	21%	0.208	S	C	.	.	H	α-helix	trans	-63.6	-41	179.1	-64	164	-172.4	164.7	0	111.8	E425 F426	E425-K429 WeakPolarHBondContact O-CG 3.48Å; E425-K429 PolarHBondContact O-N 3.37Å; E425-K429 IonicContact OE2-NZ 2.73Å; F426-K429 PolarHBondContact O-N 2.86Å; F426-K429 VanDerWaalsContact O-N 3.09Å
430	F	98	Very high	97.1	Very high	0 Å²	0	37.5 Å²	37.5	0%	0	20%	0.204	C	C	.	.	H	α-helix	trans	-77.5	-38.8	-175.5	-166.5	-101.3	0	0	0	112.8	A384 P387 F426 A432 L433 L435 L440 F443 L491 K494	A384-F430 HydrophobicContact CB-CZ 4.48Å; A384-F430 VanDerWaalsContact O-CE1 3.23Å; A384-F430 WeakPolarHBondContact O-CE1 3.18Å; P387-F430 HydrophobicContact CB-CB 4.43Å; P387-F430 HydrophobicContact CB-CD1 3.84Å; P387-F430 HydrophobicContact CG-CB 4.21Å; P387-F430 HydrophobicContact CG-CD1 3.77Å; P387-F430 HydrophobicContact CG-CG 4.27Å; F426-F430 HydrophobicContact CD1-CB 4.18Å; F426-F430 HydrophobicContact CE1-CB 3.81Å; F426-F430 HydrophobicContact CE1-CD1 4.34Å; F426-F430 AromaticContact CE1-CD2 3.86Å; F426-F430 HydrophobicContact CE1-CD2 3.86Å; F426-F430 AromaticContact CE1-CG 3.77Å; F426-F430 HydrophobicContact CE1-CG 3.77Å; F426-F430 HydrophobicContact CE2-CD2 4.26Å; F426-F430 HydrophobicContact CZ-CB 4.05Å; F426-F430 AromaticContact CZ-CD2 3.46Å; F426-F430 HydrophobicContact CZ-CD2 3.46Å; F426-F430 VanDerWaalsContact CZ-CD2 3.46Å; F426-F430 HydrophobicContact CZ-CE2 4.05Å; F426-F430 AromaticContact CZ-CG 3.86Å; F426-F430 HydrophobicContact CZ-CG 3.86Å; F426-F430 VanDerWaalsContact O-CB 3.27Å; F426-F430 WeakPolarHBondContact O-CB 3.47Å; F426-F430 PolarHBondContact O-N 3.25Å; F430-A432 PolarHBondContact O-N 3.39Å; F430-L433 HydrophobicContact CD2-CD1 4.18Å; F430-L433 HydrophobicContact CE2-CD1 4.37Å; F430-L433 VanDerWaalsContact O-CB 3.32Å; F430-L433 WeakPolarHBondContact O-CB 3.41Å; F430-L433 WeakPolarHBondContact O-CG 3.41Å; F430-L433 PolarHBondContact O-N 3.18Å; F430-L433 VanDerWaalsContact O-N 3.14Å; F430-L435 HydrophobicContact CE1-CD1 4.29Å; F430-L435 HydrophobicContact CZ-CD1 4Å; F430-L440 HydrophobicContact CE1-CD2 3.8Å; F430-L440 HydrophobicContact CZ-CD2 3.99Å; F430-F443 HydrophobicContact CE2-CD1 4.45Å; F430-F443 AromaticContact CE2-CE1 3.78Å; F430-F443 HydrophobicContact CE2-CE1 3.78Å; F430-F443 HydrophobicContact CE2-CZ 4.46Å; F430-F443 HydrophobicContact CZ-CD1 4.02Å; F430-F443 AromaticContact CZ-CE1 3.75Å; F430-F443 HydrophobicContact CZ-CE1 3.75Å; F430-L491 HydrophobicContact CE2-CD1 3.78Å; F430-L491 HydrophobicContact CZ-CD1 4.13Å; F430-K494 HydrophobicContact CD2-CB 4.16Å; F430-K494 HydrophobicContact CD2-CG 3.98Å; F430-K494 HydrophobicContact CE2-CB 4.06Å; F430-K494 HydrophobicContact CE2-CG 4.24Å
431	N	96.6	Very high	97.2	Very high	36 Å²	36	36.4 Å²	36.4	19%	0.193	20%	0.198	C	C	.	.	H	α-helix	trans	-67.6	-21.8	175.4	-82	-62.7	0	0	0	113.8	R285 P387 A427 L433 E434	R285-N431 PolarHBondContact NH2-ND2 2.89Å; R285-N431 PolarHBondContact NH2-OD1 2.92Å; P387-N431 PolarHBondContact O-ND2 3.34Å; P387-N431 PolarHBondContact O-OD1 3.08Å; A427-N431 VanDerWaalsContact O-CB 3.24Å; A427-N431 WeakPolarHBondContact O-CB 3.41Å; A427-N431 PolarHBondContact O-N 2.98Å; A427-N431 PolarHBondContact O-ND2 2.95Å; N431-L433 PolarHBondContact O-N 3.37Å; N431-E434 PolarHBondContact O-N 3.13Å
432	A	95.1	Very high	97.4	Very high	81 Å²	81	34.3 Å²	34.3	67%	0.669	19%	0.188	S	C	*	.	T	Hydrogen-bonded Turn	trans	-66	-11.9	173.4	0	0	0	0	0	113.5	V428 F430 E434	V428-A432 PolarHBondContact O-N 2.71Å; F430-A432 PolarHBondContact O-N 3.39Å; A432-E434 VanDerWaalsContact C-N 3.25Å
433	L	95.9	Very high	97.4	Very high	28 Å²	28	32.6 Å²	32.6	15%	0.147	18%	0.178	C	C	.	.	T	Hydrogen-bonded Turn	trans	-77.2	-7.5	170.3	-57.6	-179.7	0	0	0	113.2	F430 N431 L435 L487 K490 L491 K494	F430-L433 HydrophobicContact CD2-CD1 4.18Å; F430-L433 HydrophobicContact CE2-CD1 4.37Å; F430-L433 VanDerWaalsContact O-CB 3.32Å; F430-L433 WeakPolarHBondContact O-CB 3.41Å; F430-L433 WeakPolarHBondContact O-CG 3.41Å; F430-L433 PolarHBondContact O-N 3.18Å; F430-L433 VanDerWaalsContact O-N 3.14Å; N431-L433 PolarHBondContact O-N 3.37Å; L433-L435 HydrophobicContact CB-CD1 4.45Å; L433-L435 HydrophobicContact CB-CD2 4.32Å; L433-L435 HydrophobicContact CB-CG 3.93Å; L433-L435 PolarHBondContact O-N 2.99Å; L433-L487 HydrophobicContact CB-CD1 4.05Å; L433-L487 HydrophobicContact CD2-CD1 4.05Å; L433-K490 HydrophobicContact CD2-CB 4.36Å; L433-L491 HydrophobicContact CD1-CD1 4.08Å; L433-K494 HydrophobicContact CD1-CG 4.29Å
434	E	95.7	Very high	97.5	Very high	123 Å²	123	32.4 Å²	32.4	58%	0.575	18%	0.177	S	C	*	.			trans	52.3	11.7	-179.8	-66.1	-142.1	150.9	0	0	117.7	K206 N431 A432	K206-E434 IonicContact NZ-OE1 3.93Å; K206-E434 PolarHBondContact NZ-OE1 3.45Å; K206-E434 IonicContact NZ-OE2 2.87Å; K206-E434 PolarHBondContact NZ-OE2 3.19Å; N431-E434 PolarHBondContact O-N 3.13Å; A432-E434 VanDerWaalsContact C-N 3.25Å
435	L	97.6	Very high	97.5	Very high	5 Å²	5	32.3 Å²	32.3	3%	0.026	18%	0.176	C	C	.	.			trans	-44.9	146	177.3	-54.3	-179.9	0	0	0	114.1	K281 F430 L433 D439 L440 L477 L487 L491	K281-L435 WeakPolarHBondContact CD-O 3.47Å; K281-L435 VanDerWaalsContact CE-O 3.29Å; K281-L435 WeakPolarHBondContact CE-O 3.39Å; K281-L435 PolarHBondContact NZ-O 2.68Å; F430-L435 HydrophobicContact CE1-CD1 4.29Å; F430-L435 HydrophobicContact CZ-CD1 4Å; L433-L435 HydrophobicContact CB-CD1 4.45Å; L433-L435 HydrophobicContact CB-CD2 4.32Å; L433-L435 HydrophobicContact CB-CG 3.93Å; L433-L435 PolarHBondContact O-N 2.99Å; L435-D439 VanDerWaalsContact CA-OD2 3.3Å; L435-D439 WeakPolarHBondContact CA-OD2 3.43Å; L435-D439 HydrophobicContact CB-CB 4.07Å; L435-D439 HydrophobicContact CD2-CB 3.99Å; L435-D439 HydrophobicContact CG-CB 4.48Å; L435-L440 HydrophobicContact CD1-CD2 4.02Å; L435-L477 HydrophobicContact CD2-CD2 4.07Å; L435-L487 HydrophobicContact CD2-CD1 4.15Å; L435-L487 HydrophobicContact CD2-CD2 4.04Å; L435-L487 HydrophobicContact CD2-CG 4.31Å; L435-L491 HydrophobicContact CD1-CD1 3.79Å; L435-L491 HydrophobicContact CD1-CD2 4.04Å; L435-L491 HydrophobicContact CD2-CD2 4.32Å
436	D	97.3	Very high	97.6	Very high	57 Å²	57	27.6 Å²	27.6	31%	0.305	15%	0.154	S	C	.	.			trans	-102.1	-170.2	171.5	73.5	28.6	0	0	0	113.7	S438 D439 L440 N480	D436-S438 WeakPolarHBondContact OD1-CA 3.29Å; D436-S438 WeakPolarHBondContact OD1-CB 3.44Å; D436-S438 PolarHBondContact OD1-N 2.91Å; D436-S438 PolarHBondContact OD1-OG 2.91Å; D436-S438 PolarHBondContact OD2-OG 2.96Å; D436-D439 PolarHBondContact N-OD2 3.34Å; D436-D439 PolarHBondContact OD1-N 3.43Å; D436-D439 VanDerWaalsContact OD1-N 3.09Å; D436-L440 WeakPolarHBondContact O-CB 3.44Å; D436-L440 VanDerWaalsContact O-CG 3.26Å; D436-L440 WeakPolarHBondContact O-CG 3.36Å; D436-L440 PolarHBondContact O-N 3.22Å; D436-N480 PolarHBondContact OD2-ND2 3.14Å
437	D	98.3	Very high	97.6	Very high	12 Å²	12	27.1 Å²	27.1	6%	0.064	15%	0.152	C	C	.	.	H	α-helix	trans	-68.8	-31.1	-179.9	-77.9	-45.7	0	0	0	113.3	Y273 L274 T280 K281 K282 A441	Y273-D437 HydrophobicContact CE1-CB 4.26Å; L274-D437 HydrophobicContact CD2-CB 4.04Å; T280-D437 VanDerWaalsContact CB-OD1 3.3Å; T280-D437 WeakPolarHBondContact CB-OD1 3.21Å; T280-D437 VanDerWaalsContact CB-OD2 3.3Å; T280-D437 WeakPolarHBondContact CB-OD2 3.46Å; T280-D437 PolarHBondContact OG1-OD2 3.31Å; K281-D437 WeakPolarHBondContact CA-OD1 3.16Å; K281-D437 WeakPolarHBondContact CB-OD1 3.29Å; K281-D437 PolarHBondContact N-OD1 2.94Å; K282-D437 WeakPolarHBondContact CB-OD2 3.16Å; K282-D437 PolarHBondContact N-OD2 3.27Å; D437-A441 WeakPolarHBondContact O-CB 3.28Å; D437-A441 PolarHBondContact O-N 2.83Å
438	S	98.1	Very high	97.6	Very high	23 Å²	23	27 Å²	27	16%	0.161	15%	0.151	C	C	.	.	H	α-helix	trans	-75.2	-38.5	177.7	25.3	0	0	0	0	112.7	D436 L440 A441 L442	D436-S438 WeakPolarHBondContact OD1-CA 3.29Å; D436-S438 WeakPolarHBondContact OD1-CB 3.44Å; D436-S438 PolarHBondContact OD1-N 2.91Å; D436-S438 PolarHBondContact OD1-OG 2.91Å; D436-S438 PolarHBondContact OD2-OG 2.96Å; S438-L440 VanDerWaalsContact C-N 3.33Å; S438-A441 PolarHBondContact O-N 3.41Å; S438-L442 PolarHBondContact O-N 3.17Å
439	D	98.4	Very high	97.7	Very high	0 Å²	0	22.8 Å²	22.8	0%	0	13%	0.126	C	C	.	.	H	α-helix	trans	-64.2	-41.8	173.5	-46.2	-45.4	0	0	0	110.7	L435 D436 F443 H476 L477 N480 H481	L435-D439 VanDerWaalsContact CA-OD2 3.3Å; L435-D439 WeakPolarHBondContact CA-OD2 3.43Å; L435-D439 HydrophobicContact CB-CB 4.07Å; L435-D439 HydrophobicContact CD2-CB 3.99Å; L435-D439 HydrophobicContact CG-CB 4.48Å; D436-D439 PolarHBondContact N-OD2 3.34Å; D436-D439 PolarHBondContact OD1-N 3.43Å; D436-D439 VanDerWaalsContact OD1-N 3.09Å; D439-F443 WeakPolarHBondContact O-CB 3.27Å; D439-F443 PolarHBondContact O-N 3.41Å; D439-F443 VanDerWaalsContact O-N 3.11Å; D439-H476 IonicContact OD1-CD2 3.14Å; D439-H476 PolarHBondContact OD1-CD2 2.81Å; D439-H476 IonicContact OD1-NE2 3.89Å; D439-H476 PolarHBondContact OD1-NE2 3.27Å; D439-L477 HydrophobicContact CB-CD2 3.93Å; D439-N480 PolarHBondContact OD1-ND2 3.29Å; D439-N480 PolarHBondContact OD2-ND2 3.41Å; D439-H481 VanDerWaalsContact CG-NE2 3.34Å; D439-H481 IonicContact OD1-CD2 2.64Å; D439-H481 IonicContact OD1-NE2 2.64Å; D439-H481 PolarHBondContact OD1-NE2 3.13Å; D439-H481 IonicContact OD2-CD2 3.4Å; D439-H481 IonicContact OD2-CE1 2.69Å; D439-H481 IonicContact OD2-NE2 3.16Å; D439-H481 PolarHBondContact OD2-NE2 2.87Å
440	L	98.6	Very high	97.7	Very high	0 Å²	0	17.8 Å²	17.8	0%	0	10%	0.104	C	C	.	.	H	α-helix	trans	-67.3	-37.8	178.3	-73.6	178.6	0	0	0	112.8	K281 S388 F430 L435 D436 S438 L442 F443 V444	K281-L440 HydrophobicContact CB-CD1 4.37Å; K281-L440 HydrophobicContact CD-CD1 3.84Å; S388-L440 WeakPolarHBondContact OG-CD1 3.36Å; F430-L440 HydrophobicContact CE1-CD2 3.8Å; F430-L440 HydrophobicContact CZ-CD2 3.99Å; L435-L440 HydrophobicContact CD1-CD2 4.02Å; D436-L440 WeakPolarHBondContact O-CB 3.44Å; D436-L440 VanDerWaalsContact O-CG 3.26Å; D436-L440 WeakPolarHBondContact O-CG 3.36Å; D436-L440 PolarHBondContact O-N 3.22Å; S438-L440 VanDerWaalsContact C-N 3.33Å; L440-L442 VanDerWaalsContact C-N 3.32Å; L440-L442 PolarHBondContact O-N 3.2Å; L440-F443 PolarHBondContact O-N 3.15Å; L440-V444 WeakPolarHBondContact O-CB 3.42Å; L440-V444 VanDerWaalsContact O-CG2 3.3Å; L440-V444 WeakPolarHBondContact O-CG2 3.31Å; L440-V444 PolarHBondContact O-N 3.49Å
441	A	98.7	Very high	97.5	Very high	0 Å²	0	18 Å²	18	0%	0	11%	0.107	C	C	.	.	H	α-helix	trans	-56.7	-46	178	0	0	0	0	0	112.2	V269 N270 Y273 D437 S438 A445	V269-A441 HydrophobicContact CG1-CB 4.23Å; V269-A441 WeakPolarHBondContact CG1-O 3.43Å; N270-A441 HydrophobicContact CB-CB 4.32Å; Y273-A441 VanDerWaalsContact CB-CB 3.46Å; Y273-A441 HydrophobicContact CD1-CB 4.08Å; Y273-A441 HydrophobicContact CD2-CB 3.87Å; Y273-A441 HydrophobicContact CG-CB 3.56Å; D437-A441 WeakPolarHBondContact O-CB 3.28Å; D437-A441 PolarHBondContact O-N 2.83Å; S438-A441 PolarHBondContact O-N 3.41Å; A441-A445 WeakPolarHBondContact O-CB 3.3Å; A441-A445 PolarHBondContact O-N 3.04Å; A441-A445 VanDerWaalsContact O-N 3.11Å
442	L	98.8	Very high	97.2	Very high	1 Å²	1	20.7 Å²	20.7	1%	0.005	12%	0.121	C	C	.	.	H	α-helix	trans	-70.6	-40	177.2	-78.2	164.3	0	0	0	112.4	A266 V269 S438 L440 A445 A446 I469 A472 L473 H476	A266-L442 HydrophobicContact CB-CD1 3.79Å; V269-L442 HydrophobicContact CB-CD2 4.28Å; V269-L442 HydrophobicContact CG1-CD2 4.3Å; V269-L442 HydrophobicContact CG2-CD2 4.46Å; S438-L442 PolarHBondContact O-N 3.17Å; L440-L442 VanDerWaalsContact C-N 3.32Å; L440-L442 PolarHBondContact O-N 3.2Å; L442-A445 PolarHBondContact O-N 3.04Å; L442-A446 PolarHBondContact O-N 3.44Å; L442-I469 HydrophobicContact CD2-CD1 4.44Å; L442-I469 HydrophobicContact CD2-CG2 4.12Å; L442-I469 WeakPolarHBondContact O-CG2 3.45Å; L442-A472 HydrophobicContact CD2-CB 4.03Å; L442-L473 HydrophobicContact CB-CB 4.12Å; L442-L473 HydrophobicContact CB-CD1 3.72Å; L442-L473 HydrophobicContact CB-CG 4.41Å; L442-H476 HydrophobicContact CD1-CB 3.88Å
443	F	98.8	Very high	97	Very high	0 Å²	0	17.4 Å²	17.4	0%	0	9%	0.092	C	C	.	.	H	α-helix	trans	-66.2	-40.2	177.6	-175.7	-122	0	0	0	112.9	A384 F430 D439 L440 A446 I447 L473 L491 K494 M495 L498	A384-F443 HydrophobicContact CB-CD1 4.2Å; A384-F443 HydrophobicContact CB-CE1 4Å; F430-F443 HydrophobicContact CE2-CD1 4.45Å; F430-F443 AromaticContact CE2-CE1 3.78Å; F430-F443 HydrophobicContact CE2-CE1 3.78Å; F430-F443 HydrophobicContact CE2-CZ 4.46Å; F430-F443 HydrophobicContact CZ-CD1 4.02Å; F430-F443 AromaticContact CZ-CE1 3.75Å; F430-F443 HydrophobicContact CZ-CE1 3.75Å; D439-F443 WeakPolarHBondContact O-CB 3.27Å; D439-F443 PolarHBondContact O-N 3.41Å; D439-F443 VanDerWaalsContact O-N 3.11Å; L440-F443 PolarHBondContact O-N 3.15Å; F443-A446 PolarHBondContact O-N 3.2Å; F443-I447 HydrophobicContact CD1-CD1 3.86Å; F443-I447 HydrophobicContact CE1-CD1 3.56Å; F443-I447 HydrophobicContact CE2-CD1 4.27Å; F443-I447 HydrophobicContact CG-CD1 4.35Å; F443-I447 HydrophobicContact CZ-CD1 3.79Å; F443-I447 HydrophobicContact CZ-CG1 4.42Å; F443-I447 WeakPolarHBondContact O-CG1 3.39Å; F443-I447 PolarHBondContact O-N 3.3Å; F443-L473 HydrophobicContact CB-CD2 4.37Å; F443-L473 HydrophobicContact CD2-CD2 4.3Å; F443-L491 HydrophobicContact CB-CD2 4.17Å; F443-L491 HydrophobicContact CD1-CD1 3.81Å; F443-L491 HydrophobicContact CD1-CG 4.4Å; F443-L491 HydrophobicContact CD2-CD1 3.85Å; F443-L491 HydrophobicContact CD2-CD2 3.9Å; F443-L491 HydrophobicContact CD2-CG 3.56Å; F443-L491 HydrophobicContact CE1-CD1 3.65Å; F443-L491 HydrophobicContact CE1-CG 4.44Å; F443-L491 HydrophobicContact CE2-CD1 3.7Å; F443-L491 HydrophobicContact CE2-CD2 4.46Å; F443-L491 HydrophobicContact CE2-CG 3.63Å; F443-L491 WeakPolarHBondContact CE2-O 3.46Å; F443-L491 HydrophobicContact CG-CD1 3.9Å; F443-L491 HydrophobicContact CG-CD2 3.99Å; F443-L491 HydrophobicContact CG-CG 3.97Å; F443-L491 HydrophobicContact CZ-CD1 3.59Å; F443-L491 HydrophobicContact CZ-CG 4.08Å; F443-K494 HydrophobicContact CZ-CB 4.29Å; F443-M495 HydrophobicContact CE2-CG 3.71Å; F443-M495 HydrophobicContact CE2-SD 4.23Å; F443-M495 HydrophobicContact CZ-CG 3.94Å; F443-L498 HydrophobicContact CE1-CD1 4.06Å; F443-L498 HydrophobicContact CZ-CD1 4.13Å
444	V	98.8	Very high	96.6	Very high	0 Å²	0	19.8 Å²	19.8	0%	0	11%	0.109	C	C	.	.	H	α-helix	trans	-68.5	-37.4	175.9	172.8	0	0	0	0	111.2	Y273 L352 F355 A381 A384 M385 L440 I447 I448	Y273-V444 HydrophobicContact CE2-CG2 4.36Å; L352-V444 HydrophobicContact CD2-CG1 3.81Å; F355-V444 HydrophobicContact CD1-CG1 4.21Å; F355-V444 HydrophobicContact CE1-CB 4.35Å; F355-V444 HydrophobicContact CE1-CG1 3.85Å; A381-V444 HydrophobicContact CB-CG1 3.8Å; A384-V444 HydrophobicContact CB-CG2 4.38Å; M385-V444 HydrophobicContact CG-CG2 3.91Å; L440-V444 WeakPolarHBondContact O-CB 3.42Å; L440-V444 VanDerWaalsContact O-CG2 3.3Å; L440-V444 WeakPolarHBondContact O-CG2 3.31Å; L440-V444 PolarHBondContact O-N 3.49Å; V444-I447 PolarHBondContact O-N 2.69Å; V444-I448 HydrophobicContact CG1-CD1 4.08Å; V444-I448 WeakPolarHBondContact O-CG1 3.47Å; V444-I448 PolarHBondContact O-N 3.19Å; V444-I448 VanDerWaalsContact O-N 3.13Å
445	A	98.8	Very high	96.1	Very high	0 Å²	0	17 Å²	17	0%	0	11%	0.114	C	C	.	.	H	α-helix	trans	-60.3	-45.4	171.1	0	0	0	0	0	112	V269 F355 I359 A441 L442 I447 I448 L449 I469	V269-A445 HydrophobicContact CG1-CB 3.93Å; F355-A445 HydrophobicContact CE1-CB 4.31Å; F355-A445 HydrophobicContact CZ-CB 4.15Å; I359-A445 HydrophobicContact CD1-CB 3.71Å; I359-A445 HydrophobicContact CG1-CB 4.31Å; A441-A445 WeakPolarHBondContact O-CB 3.3Å; A441-A445 PolarHBondContact O-N 3.04Å; A441-A445 VanDerWaalsContact O-N 3.11Å; L442-A445 PolarHBondContact O-N 3.04Å; A445-I447 VanDerWaalsContact C-N 3.3Å; A445-I447 PolarHBondContact O-N 2.77Å; A445-I448 PolarHBondContact O-N 3.32Å; A445-L449 WeakPolarHBondContact O-CB 3.39Å; A445-L449 PolarHBondContact O-N 3.26Å; A445-I469 HydrophobicContact CB-CD1 4.32Å; A445-I469 HydrophobicContact CB-CG2 3.9Å
446	A	98.7	Very high	95.5	Very high	0 Å²	0	17.7 Å²	17.7	0%	0	12%	0.117	C	C	.	.	H	α-helix	trans	-65.4	-28.6	177.4	0	0	0	0	0	113.8	L442 F443 Q466 I469 L470	L442-A446 PolarHBondContact O-N 3.44Å; F443-A446 PolarHBondContact O-N 3.2Å; A446-Q466 PolarHBondContact O-NE2 3.3Å; A446-I469 HydrophobicContact CB-CG2 4Å; A446-L470 HydrophobicContact CB-CD2 3.79Å; A446-L470 HydrophobicContact CB-CG 4.34Å
447	I	98.6	Very high	94.8	Very high	0 Å²	0	20.2 Å²	20.2	0%	0	13%	0.128	C	C	.	.	H	α-helix	trans	-70.8	-42.4	173.8	-77.8	165.1	0	0	0	111.7	E380 A381 A384 F443 V444 A445 R453 M495 L498	E380-I447 HydrophobicContact CB-CG2 3.48Å; E380-I447 VanDerWaalsContact CB-CG2 3.48Å; A381-I447 HydrophobicContact CB-CG2 4.25Å; A384-I447 HydrophobicContact CB-CD1 3.87Å; F443-I447 HydrophobicContact CD1-CD1 3.86Å; F443-I447 HydrophobicContact CE1-CD1 3.56Å; F443-I447 HydrophobicContact CE2-CD1 4.27Å; F443-I447 HydrophobicContact CG-CD1 4.35Å; F443-I447 HydrophobicContact CZ-CD1 3.79Å; F443-I447 HydrophobicContact CZ-CG1 4.42Å; F443-I447 WeakPolarHBondContact O-CG1 3.39Å; F443-I447 PolarHBondContact O-N 3.3Å; V444-I447 PolarHBondContact O-N 2.69Å; A445-I447 VanDerWaalsContact C-N 3.3Å; A445-I447 PolarHBondContact O-N 2.77Å; I447-R453 PolarHBondContact O-NH2 2.69Å; I447-M495 HydrophobicContact CG1-CE 4.26Å; I447-M495 HydrophobicContact CG1-CG 4.37Å; I447-L498 HydrophobicContact CD1-CD1 3.68Å
448	I	98.5	Very high	94.2	Very high	0 Å²	0	22 Å²	22	0%	0	14%	0.138	C	C	.	.	H	α-helix	trans	-67.4	-49.3	179.7	-66.8	164.4	0	0	0	109.7	L352 F355 A356 F362 L373 L374 V444 A445 C450	L352-I448 HydrophobicContact CD2-CD1 4.44Å; F355-I448 HydrophobicContact CD1-CD1 3.97Å; F355-I448 HydrophobicContact CE1-CD1 4.16Å; A356-I448 HydrophobicContact CB-CD1 4.37Å; A356-I448 HydrophobicContact CB-CG2 4.18Å; F362-I448 HydrophobicContact CD2-CG2 4.43Å; F362-I448 HydrophobicContact CE2-CG2 3.91Å; L373-I448 WeakPolarHBondContact CB-O 3.4Å; L373-I448 WeakPolarHBondContact CD2-O 3.37Å; L374-I448 HydrophobicContact CD2-CG2 4.49Å; V444-I448 HydrophobicContact CG1-CD1 4.08Å; V444-I448 WeakPolarHBondContact O-CG1 3.47Å; V444-I448 PolarHBondContact O-N 3.19Å; V444-I448 VanDerWaalsContact O-N 3.13Å; A445-I448 PolarHBondContact O-N 3.32Å; I448-C450 PolarHBondContact O-N 3.19Å
449	L	98	Very high	93.9	Very high	0 Å²	0	24.2 Å²	24.2	0%	0	15%	0.147	C	C	.	.	T	Hydrogen-bonded Turn	trans	-78.3	41.6	-177.6	-71.6	161.4	0	0	0	113.9	I359 F362 L365 L373 A445 V462 I465 Q466 I469	I359-L449 HydrophobicContact CD1-CD1 4.38Å; I359-L449 HydrophobicContact CG2-CD1 3.85Å; F362-L449 HydrophobicContact CD2-CD2 3.96Å; L365-L449 HydrophobicContact CD1-CD2 4.2Å; L373-L449 HydrophobicContact CD1-CD2 4.4Å; A445-L449 WeakPolarHBondContact O-CB 3.39Å; A445-L449 PolarHBondContact O-N 3.26Å; L449-V462 WeakPolarHBondContact O-CG1 3.22Å; L449-I465 HydrophobicContact CD1-CB 4.43Å; L449-I465 HydrophobicContact CD1-CG2 3.58Å; L449-I465 HydrophobicContact CD2-CB 4.25Å; L449-I465 HydrophobicContact CD2-CD1 4.48Å; L449-I465 HydrophobicContact CD2-CG2 3.98Å; L449-I465 HydrophobicContact CG-CG2 4.41Å; L449-Q466 HydrophobicContact CB-CB 4.35Å; L449-Q466 HydrophobicContact CB-CG 4.38Å; L449-Q466 WeakPolarHBondContact O-CB 3.39Å; L449-Q466 WeakPolarHBondContact O-CG 3.37Å; L449-Q466 PolarHBondContact O-NE2 3.17Å; L449-Q466 PolarHBondContact O-OE1 2.86Å; L449-I469 HydrophobicContact CD1-CG1 4Å
450	C	95.5	Very high	93.6	Very high	7 Å²	7	31.2 Å²	31.2	5%	0.047	18%	0.178	C	C	.	.			trans	-89	120.8	-175.9	-145.1	0	0	0	0	112.4	L373 I448 D452 R453 Q466 R499	L373-C450 WeakPolarHBondContact CD2-O 3.49Å; I448-C450 PolarHBondContact O-N 3.19Å; C450-D452 PolarHBondContact O-N 3.25Å; C450-D452 VanDerWaalsContact O-N 3.16Å; C450-D452 PolarHBondContact SG-OD1 3.17Å; C450-R453 WeakPolarHBondContact O-CG 3.11Å; C450-Q466 PolarHBondContact SG-NE2 3.06Å; C450-R499 PolarHBondContact SG-NH2 2.94Å
451	G	92.9	Very high	93.3	Very high	6 Å²	6	33.5 Å²	33.5	6%	0.062	19%	0.188	C	C	.	.	T	Hydrogen-bonded Turn	trans	-65.7	-13.3	-177.9	0	0	0	0	0	115.6	R453 L456	G451-R453 PolarHBondContact O-N 3.28Å; G451-L456 WeakPolarHBondContact O-CD1 3.34Å
452	D	90.5	Very high	93.1	Very high	91 Å²	91	33.5 Å²	33.5	49%	0.487	19%	0.188	S	C	.	.	T	Hydrogen-bonded Turn	trans	-92.5	16.8	-176.5	66.8	-5.3	0	0	0	114.8	C450 R499	C450-D452 PolarHBondContact O-N 3.25Å; C450-D452 VanDerWaalsContact O-N 3.16Å; C450-D452 PolarHBondContact SG-OD1 3.17Å; D452-R499 VanDerWaalsContact CG-NH2 3.26Å; D452-R499 IonicContact OD1-CZ 3.38Å; D452-R499 IonicContact OD1-NH1 2.78Å; D452-R499 IonicContact OD1-NH2 3.17Å; D452-R499 PolarHBondContact OD1-NH2 2.89Å; D452-R499 IonicContact OD2-CZ 2.7Å; D452-R499 IonicContact OD2-NH1 2.75Å; D452-R499 PolarHBondContact OD2-NH1 2.87Å; D452-R499 IonicContact OD2-NH2 3.52Å; D452-R499 PolarHBondContact OD2-NH2 3.37Å
453	R	91.3	Very high	92.9	Very high	12 Å²	12	37.7 Å²	37.7	5%	0.045	21%	0.208	C	C	.	.			trans	-76.3	135.3	173.2	-51.4	-38.6	-174	167.9	-7.3	110.7	T372 L373 Y376 E380 I447 C450 G451 L456	T372-R453 HydrophobicContact CG2-CB 4.04Å; L373-R453 HydrophobicContact CD2-CG 4.02Å; Y376-R453 HydrophobicContact CD2-CB 3.94Å; Y376-R453 HydrophobicContact CD2-CG 4.36Å; Y376-R453 HydrophobicContact CG-CB 4.44Å; E380-R453 VanDerWaalsContact CD-NH2 3.33Å; E380-R453 IonicContact OE1-CZ 3.14Å; E380-R453 IonicContact OE1-NH1 3.51Å; E380-R453 PolarHBondContact OE1-NH1 2.8Å; E380-R453 IonicContact OE1-NH2 3.57Å; E380-R453 PolarHBondContact OE1-NH2 3.21Å; E380-R453 IonicContact OE2-CZ 3.29Å; E380-R453 IonicContact OE2-NH1 3.45Å; E380-R453 IonicContact OE2-NH2 2.63Å; E380-R453 PolarHBondContact OE2-NH2 2.6Å; I447-R453 PolarHBondContact O-NH2 2.69Å; C450-R453 WeakPolarHBondContact O-CG 3.11Å; G451-R453 PolarHBondContact O-N 3.28Å; R453-L456 HydrophobicContact CB-CD1 3.88Å; R453-L456 HydrophobicContact CB-CG 4.04Å; R453-L456 HydrophobicContact CG-CD1 4.44Å; R453-L456 WeakPolarHBondContact O-CG 3.36Å
454	P	86.7	Confident	92.8	Very high	79 Å²	79	43.9 Å²	43.9	51%	0.513	24%	0.237	S	C	.	.	T	Hydrogen-bonded Turn	trans	-70	137.8	177.2	30.2	-34.8	0	0	0	110.7	T372 Y376	T372-P454 WeakPolarHBondContact CG2-O 3.48Å; Y376-P454 HydrophobicContact CD2-CG 4.47Å; Y376-P454 HydrophobicContact CE1-CG 4.11Å; Y376-P454 HydrophobicContact CE2-CG 3.75Å
455	G	85.6	Confident	92.7	Very high	65 Å²	65	45 Å²	45	67%	0.67	24%	0.242	S	C	*	.	T	Hydrogen-bonded Turn	trans	94.3	-0.6	178.6	0	0	0	0	0	115.9
456	L	85.4	Confident	92.7	Very high	18 Å²	18	46 Å²	46	9%	0.094	25%	0.247	C	C	.	.			trans	-65.8	134.8	175	-67.3	174.1	0	0	0	112.2	D369 T372 L373 G451 R453 I459 V462	D369-L456 HydrophobicContact CB-CD2 3.91Å; D369-L456 WeakPolarHBondContact OD1-CA 3.35Å; T372-L456 HydrophobicContact CG2-CD2 3.8Å; T372-L456 HydrophobicContact CG2-CG 4.14Å; L373-L456 HydrophobicContact CD2-CD1 4.01Å; L373-L456 HydrophobicContact CD2-CD2 3.87Å; L373-L456 HydrophobicContact CG-CD2 3.94Å; G451-L456 WeakPolarHBondContact O-CD1 3.34Å; R453-L456 HydrophobicContact CB-CD1 3.88Å; R453-L456 HydrophobicContact CB-CG 4.04Å; R453-L456 HydrophobicContact CG-CD1 4.44Å; R453-L456 WeakPolarHBondContact O-CG 3.36Å; L456-I459 HydrophobicContact CB-CG1 3.76Å; L456-I459 HydrophobicContact CD1-CG1 4.46Å; L456-V462 HydrophobicContact CD1-CG2 4.48Å
457	M	81.9	Confident	92.6	Very high	110 Å²	110	50.3 Å²	50.3	54%	0.542	27%	0.27	S	S	.	.	S	Bend	trans	-86.7	-45.9	178.1	-51.9	-164.8	-47	0	0	111.9	F366 N368 D369	F366-M457 HydrophobicContact CB-CE 3.56Å; F366-M457 HydrophobicContact CD1-CE 4.1Å; F366-M457 HydrophobicContact CD2-CB 4.33Å; F366-M457 HydrophobicContact CD2-CE 3.53Å; F366-M457 HydrophobicContact CE2-CE 4.2Å; F366-M457 HydrophobicContact CG-CE 3.47Å; F366-M457 VanDerWaalsContact CG-CE 3.47Å; N368-M457 HydrophobicContact CB-CE 4.48Å; N368-M457 HydrophobicContact CB-SD 4.48Å; D369-M457 PolarHBondContact OD1-N 2.79Å
458	N	84.9	Confident	92.6	Very high	49 Å²	49	52.8 Å²	52.8	26%	0.262	29%	0.288	S	S	.	.			trans	-115.4	63.6	-179.2	-163.1	3.9	0	0	0	113.1	F366 D369 K460 Q461 V462	F366-N458 HydrophobicContact CD2-CB 3.96Å; F366-N458 HydrophobicContact CE2-CB 3.9Å; D369-N458 PolarHBondContact OD2-N 3.11Å; N458-K460 PolarHBondContact O-N 3.38Å; N458-K460 VanDerWaalsContact O-N 3.13Å; N458-Q461 HydrophobicContact CB-CB 4.34Å; N458-Q461 VanDerWaalsContact ND2-CB 3.28Å; N458-Q461 WeakPolarHBondContact ND2-CB 3.25Å; N458-Q461 PolarHBondContact ND2-OE1 2.96Å; N458-Q461 PolarHBondContact O-N 3.15Å; N458-Q461 VanDerWaalsContact O-N 3.1Å; N458-V462 PolarHBondContact O-N 3.35Å
459	I	93.1	Very high	92.6	Very high	71 Å²	71	52.9 Å²	52.9	36%	0.364	29%	0.288	S	S	.	.	H	α-helix	trans	-46.3	-43.9	178.1	-64.5	168.4	0	0	0	111.9	L456 Q461 V462 E463	L456-I459 HydrophobicContact CB-CG1 3.76Å; L456-I459 HydrophobicContact CD1-CG1 4.46Å; I459-Q461 PolarHBondContact O-N 2.73Å; I459-V462 WeakPolarHBondContact O-CB 3.37Å; I459-V462 PolarHBondContact O-N 3.13Å; I459-V462 VanDerWaalsContact O-N 3.14Å; I459-E463 HydrophobicContact CG2-CG 4.09Å; I459-E463 WeakPolarHBondContact O-CG 3.04Å; I459-E463 PolarHBondContact O-N 3.36Å
460	K	90.5	Very high	92.6	Very high	147 Å²	147	54.2 Å²	54.2	64%	0.639	30%	0.295	S	S	*	.	H	α-helix	trans	-59.2	-45.7	-178.7	-66.1	-176.2	178.9	-178.5	0	113.3	N458 V462 E463 E464	N458-K460 PolarHBondContact O-N 3.38Å; N458-K460 VanDerWaalsContact O-N 3.13Å; K460-V462 VanDerWaalsContact C-N 3.28Å; K460-V462 PolarHBondContact O-N 2.9Å; K460-E463 PolarHBondContact O-N 3.18Å; K460-E464 WeakPolarHBondContact O-CB 3.49Å; K460-E464 VanDerWaalsContact O-CG 3.29Å; K460-E464 WeakPolarHBondContact O-CG 3.42Å; K460-E464 PolarHBondContact O-N 2.95Å
461	Q	92.3	Very high	92.7	Very high	47 Å²	47	58.7 Å²	58.7	22%	0.22	32%	0.315	C	S	.	.	H	α-helix	trans	-67.5	-32.4	179.5	-171.7	-173.5	-4.6	0	0	111.1	D364 L365 N458 I459 I465	D364-Q461 PolarHBondContact O-NE2 3.24Å; L365-Q461 HydrophobicContact CD2-CB 4Å; L365-Q461 HydrophobicContact CD2-CG 3.67Å; N458-Q461 HydrophobicContact CB-CB 4.34Å; N458-Q461 VanDerWaalsContact ND2-CB 3.28Å; N458-Q461 WeakPolarHBondContact ND2-CB 3.25Å; N458-Q461 PolarHBondContact ND2-OE1 2.96Å; N458-Q461 PolarHBondContact O-N 3.15Å; N458-Q461 VanDerWaalsContact O-N 3.1Å; I459-Q461 PolarHBondContact O-N 2.73Å; Q461-I465 HydrophobicContact CG-CD1 4.49Å; Q461-I465 VanDerWaalsContact O-CD1 3.28Å; Q461-I465 WeakPolarHBondContact O-CD1 3.3Å; Q461-I465 WeakPolarHBondContact O-CG1 3.45Å; Q461-I465 PolarHBondContact O-N 2.76Å
462	V	95.3	Very high	92.9	Very high	0 Å²	0	58.4 Å²	58.4	0%	0	31%	0.313	C	S	.	.	H	α-helix	trans	-64.8	-49.4	171.2	-179.9	0	0	0	0	110.6	L365 L373 L449 L456 N458 I459 K460 I465 Q466	L365-V462 HydrophobicContact CD1-CG2 4.22Å; L365-V462 HydrophobicContact CD2-CG2 3.83Å; L373-V462 HydrophobicContact CD1-CG1 4.09Å; L373-V462 HydrophobicContact CD1-CG2 4.02Å; L373-V462 HydrophobicContact CD2-CG1 3.76Å; L373-V462 HydrophobicContact CD2-CG2 4.44Å; L449-V462 WeakPolarHBondContact O-CG1 3.22Å; L456-V462 HydrophobicContact CD1-CG2 4.48Å; N458-V462 PolarHBondContact O-N 3.35Å; I459-V462 WeakPolarHBondContact O-CB 3.37Å; I459-V462 PolarHBondContact O-N 3.13Å; I459-V462 VanDerWaalsContact O-N 3.14Å; K460-V462 VanDerWaalsContact C-N 3.28Å; K460-V462 PolarHBondContact O-N 2.9Å; V462-I465 PolarHBondContact O-N 3.22Å; V462-Q466 WeakPolarHBondContact O-CB 3.16Å; V462-Q466 PolarHBondContact O-N 2.66Å
463	E	95.8	Very high	93.3	Very high	90 Å²	90	54.1 Å²	54.1	42%	0.421	29%	0.289	S	S	.	.	H	α-helix	trans	-62.2	-41.8	-179.9	-70.6	176.1	148.9	0	0	112.3	I459 K460 I465 Q466 D467	I459-E463 HydrophobicContact CG2-CG 4.09Å; I459-E463 WeakPolarHBondContact O-CG 3.04Å; I459-E463 PolarHBondContact O-N 3.36Å; K460-E463 PolarHBondContact O-N 3.18Å; E463-I465 VanDerWaalsContact C-N 3.32Å; E463-I465 PolarHBondContact O-N 2.87Å; E463-Q466 WeakPolarHBondContact O-CB 3.45Å; E463-Q466 PolarHBondContact O-N 3.2Å; E463-Q466 VanDerWaalsContact O-N 3.11Å; E463-D467 WeakPolarHBondContact O-CB 3.46Å; E463-D467 PolarHBondContact O-N 3.46Å
464	E	96.2	Very high	93.6	Very high	129 Å²	129	56.1 Å²	56.1	60%	0.603	30%	0.301	S	S	*	.	H	α-helix	trans	-60.2	-38.6	176.5	-75.8	169.3	-168.1	0	0	112.7	K460 S468	K460-E464 WeakPolarHBondContact O-CB 3.49Å; K460-E464 VanDerWaalsContact O-CG 3.29Å; K460-E464 WeakPolarHBondContact O-CG 3.42Å; K460-E464 PolarHBondContact O-N 2.95Å; E464-S468 PolarHBondContact O-N 3.5Å; E464-S468 PolarHBondContact O-OG 2.98Å
465	I	96.6	Very high	94	Very high	23 Å²	23	56 Å²	56	12%	0.118	29%	0.294	C	S	.	.	H	α-helix	trans	-73.8	-39.8	173.9	-54.7	160.4	0	0	0	109.8	P360 G361 L365 L449 Q461 V462 E463 S468 I469	P360-I465 WeakPolarHBondContact O-CG2 3.48Å; G361-I465 WeakPolarHBondContact O-CD1 3.43Å; L365-I465 HydrophobicContact CD1-CD1 4.31Å; L365-I465 HydrophobicContact CD2-CD1 4.04Å; L365-I465 HydrophobicContact CG-CD1 4.12Å; L449-I465 HydrophobicContact CD1-CB 4.43Å; L449-I465 HydrophobicContact CD1-CG2 3.58Å; L449-I465 HydrophobicContact CD2-CB 4.25Å; L449-I465 HydrophobicContact CD2-CD1 4.48Å; L449-I465 HydrophobicContact CD2-CG2 3.98Å; L449-I465 HydrophobicContact CG-CG2 4.41Å; Q461-I465 HydrophobicContact CG-CD1 4.49Å; Q461-I465 VanDerWaalsContact O-CD1 3.28Å; Q461-I465 WeakPolarHBondContact O-CD1 3.3Å; Q461-I465 WeakPolarHBondContact O-CG1 3.45Å; Q461-I465 PolarHBondContact O-N 2.76Å; V462-I465 PolarHBondContact O-N 3.22Å; E463-I465 VanDerWaalsContact C-N 3.32Å; E463-I465 PolarHBondContact O-N 2.87Å; I465-S468 WeakPolarHBondContact O-CB 3.48Å; I465-S468 PolarHBondContact O-N 3.01Å; I465-I469 WeakPolarHBondContact O-CG1 3.45Å; I465-I469 PolarHBondContact O-N 3.33Å
466	Q	98.1	Very high	94.6	Very high	22 Å²	22	55.1 Å²	55.1	10%	0.103	27%	0.272	C	S	.	.	H	α-helix	trans	-61	-48.5	178.1	-158.5	-178.2	17.3	0	0	111.8	A446 L449 C450 V462 E463 S468 I469 L470	A446-Q466 PolarHBondContact O-NE2 3.3Å; L449-Q466 HydrophobicContact CB-CB 4.35Å; L449-Q466 HydrophobicContact CB-CG 4.38Å; L449-Q466 WeakPolarHBondContact O-CB 3.39Å; L449-Q466 WeakPolarHBondContact O-CG 3.37Å; L449-Q466 PolarHBondContact O-NE2 3.17Å; L449-Q466 PolarHBondContact O-OE1 2.86Å; C450-Q466 PolarHBondContact SG-NE2 3.06Å; V462-Q466 WeakPolarHBondContact O-CB 3.16Å; V462-Q466 PolarHBondContact O-N 2.66Å; E463-Q466 WeakPolarHBondContact O-CB 3.45Å; E463-Q466 PolarHBondContact O-N 3.2Å; E463-Q466 VanDerWaalsContact O-N 3.11Å; Q466-S468 VanDerWaalsContact C-N 3.28Å; Q466-S468 PolarHBondContact O-N 3.32Å; Q466-I469 CarbonylContact O-C 3.24Å; Q466-I469 WeakPolarHBondContact O-CB 3.38Å; Q466-I469 PolarHBondContact O-N 2.87Å; Q466-I469 VanDerWaalsContact O-N 3.09Å; Q466-L470 HydrophobicContact CG-CD1 4.03Å; Q466-L470 HydrophobicContact CG-CG 4.33Å; Q466-L470 WeakPolarHBondContact O-CB 3.37Å; Q466-L470 VanDerWaalsContact O-CG 3.32Å; Q466-L470 WeakPolarHBondContact O-CG 3.49Å; Q466-L470 PolarHBondContact O-N 3.5Å
467	D	97.7	Very high	95.1	Very high	91 Å²	91	54.5 Å²	54.5	49%	0.487	27%	0.269	S	S	.	.	H	α-helix	trans	-59.1	-40.2	177.5	-93.1	-7.1	0	0	0	111.5	E463 I469 L470 Q471	E463-D467 WeakPolarHBondContact O-CB 3.46Å; E463-D467 PolarHBondContact O-N 3.46Å; D467-I469 VanDerWaalsContact C-N 3.33Å; D467-I469 PolarHBondContact O-N 2.72Å; D467-L470 PolarHBondContact O-N 3.19Å; D467-Q471 WeakPolarHBondContact O-CB 3.3Å; D467-Q471 VanDerWaalsContact O-CG 3.22Å; D467-Q471 WeakPolarHBondContact O-CG 3.28Å; D467-Q471 PolarHBondContact O-N 3.35Å; D467-Q471 PolarHBondContact O-NE2 3.16Å
468	S	97.3	Very high	95.6	Very high	52 Å²	52	53.1 Å²	53.1	36%	0.364	26%	0.263	S	S	.	.	H	α-helix	trans	-62.3	-40.6	175.5	-60.3	0	0	0	0	111.9	E464 I465 Q466 A472	E464-S468 PolarHBondContact O-N 3.5Å; E464-S468 PolarHBondContact O-OG 2.98Å; I465-S468 WeakPolarHBondContact O-CB 3.48Å; I465-S468 PolarHBondContact O-N 3.01Å; Q466-S468 VanDerWaalsContact C-N 3.28Å; Q466-S468 PolarHBondContact O-N 3.32Å; S468-A472 WeakPolarHBondContact O-CB 3.3Å; S468-A472 PolarHBondContact O-N 2.89Å
469	I	98.4	Very high	96	Very high	1 Å²	1	53.7 Å²	53.7	1%	0.005	28%	0.281	C	S	.	.	H	α-helix	trans	-71.1	-38.9	175.3	-65.5	-72	0	0	0	111.5	L265 V269 I359 L442 A445 A446 L449 I465 Q466 D467 A472 L473	L265-I469 HydrophobicContact CD1-CD1 4.13Å; L265-I469 HydrophobicContact CD2-CD1 4.1Å; L265-I469 HydrophobicContact CG-CD1 4.14Å; V269-I469 HydrophobicContact CG2-CD1 3.73Å; I359-I469 HydrophobicContact CG2-CD1 4.03Å; L442-I469 HydrophobicContact CD2-CD1 4.44Å; L442-I469 HydrophobicContact CD2-CG2 4.12Å; L442-I469 WeakPolarHBondContact O-CG2 3.45Å; A445-I469 HydrophobicContact CB-CD1 4.32Å; A445-I469 HydrophobicContact CB-CG2 3.9Å; A446-I469 HydrophobicContact CB-CG2 4Å; L449-I469 HydrophobicContact CD1-CG1 4Å; I465-I469 WeakPolarHBondContact O-CG1 3.45Å; I465-I469 PolarHBondContact O-N 3.33Å; Q466-I469 CarbonylContact O-C 3.24Å; Q466-I469 WeakPolarHBondContact O-CB 3.38Å; Q466-I469 PolarHBondContact O-N 2.87Å; Q466-I469 VanDerWaalsContact O-N 3.09Å; D467-I469 VanDerWaalsContact C-N 3.33Å; D467-I469 PolarHBondContact O-N 2.72Å; I469-A472 PolarHBondContact O-N 3.34Å; I469-L473 WeakPolarHBondContact O-CB 3.22Å; I469-L473 PolarHBondContact O-N 3.29Å
470	L	98.2	Very high	96	Very high	29 Å²	29	53.7 Å²	53.7	15%	0.152	28%	0.282	C	S	.	.	H	α-helix	trans	-69.2	-40.4	179.4	-73.8	174.7	0	0	0	112.3	A446 Q466 D467 A472 L473 D474 F488 L492	A446-L470 HydrophobicContact CB-CD2 3.79Å; A446-L470 HydrophobicContact CB-CG 4.34Å; Q466-L470 HydrophobicContact CG-CD1 4.03Å; Q466-L470 HydrophobicContact CG-CG 4.33Å; Q466-L470 WeakPolarHBondContact O-CB 3.37Å; Q466-L470 VanDerWaalsContact O-CG 3.32Å; Q466-L470 WeakPolarHBondContact O-CG 3.49Å; Q466-L470 PolarHBondContact O-N 3.5Å; D467-L470 PolarHBondContact O-N 3.19Å; L470-A472 VanDerWaalsContact C-N 3.34Å; L470-L473 HydrophobicContact CD2-CD2 4.41Å; L470-L473 WeakPolarHBondContact O-CB 3.39Å; L470-L473 PolarHBondContact O-N 2.98Å; L470-D474 PolarHBondContact O-N 3.33Å; L470-F488 HydrophobicContact CB-CZ 4.44Å; L470-F488 HydrophobicContact CD2-CE2 4.22Å; L470-F488 HydrophobicContact CD2-CZ 4.41Å; L470-L492 HydrophobicContact CD2-CD2 3.8Å
471	Q	97.9	Very high	96.1	Very high	100 Å²	100	48.1 Å²	48.1	47%	0.467	26%	0.258	S	S	.	.	H	α-helix	trans	-61.9	-41.6	171.2	-72.3	171.3	56	0	0	111.4	L262 D467 L473 Q475	L262-Q471 HydrophobicContact CD1-CB 3.92Å; L262-Q471 HydrophobicContact CD2-CB 3.92Å; D467-Q471 WeakPolarHBondContact O-CB 3.3Å; D467-Q471 VanDerWaalsContact O-CG 3.22Å; D467-Q471 WeakPolarHBondContact O-CG 3.28Å; D467-Q471 PolarHBondContact O-N 3.35Å; D467-Q471 PolarHBondContact O-NE2 3.16Å; Q471-L473 VanDerWaalsContact C-N 3.34Å; Q471-Q475 WeakPolarHBondContact O-CB 3.45Å; Q471-Q475 PolarHBondContact O-N 3.45Å; Q471-Q475 VanDerWaalsContact O-N 3.15Å
472	A	98.1	Very high	95.8	Very high	1 Å²	1	48.8 Å²	48.8	1%	0.008	27%	0.271	C	S	.	.	H	α-helix	trans	-65.6	-36.2	173.9	0	0	0	0	0	112.1	L262 L265 L442 S468 I469 L470 H476	L262-A472 HydrophobicContact CB-CB 4.27Å; L262-A472 HydrophobicContact CD2-CB 4.11Å; L265-A472 HydrophobicContact CD2-CB 4.26Å; L265-A472 HydrophobicContact CG-CB 4.5Å; L442-A472 HydrophobicContact CD2-CB 4.03Å; S468-A472 WeakPolarHBondContact O-CB 3.3Å; S468-A472 PolarHBondContact O-N 2.89Å; I469-A472 PolarHBondContact O-N 3.34Å; L470-A472 VanDerWaalsContact C-N 3.34Å; A472-H476 WeakPolarHBondContact O-CB 3.36Å; A472-H476 PolarHBondContact O-N 2.94Å
473	L	98.3	Very high	95.4	Very high	0 Å²	0	52.6 Å²	52.6	0%	0	29%	0.292	C	S	.	.	H	α-helix	trans	-65.6	-49	176.2	-179.8	59.5	0	0	0	112.1	L442 F443 I469 L470 Q471 H476 L477 F488 L491	L442-L473 HydrophobicContact CB-CB 4.12Å; L442-L473 HydrophobicContact CB-CD1 3.72Å; L442-L473 HydrophobicContact CB-CG 4.41Å; F443-L473 HydrophobicContact CB-CD2 4.37Å; F443-L473 HydrophobicContact CD2-CD2 4.3Å; I469-L473 WeakPolarHBondContact O-CB 3.22Å; I469-L473 PolarHBondContact O-N 3.29Å; L470-L473 HydrophobicContact CD2-CD2 4.41Å; L470-L473 WeakPolarHBondContact O-CB 3.39Å; L470-L473 PolarHBondContact O-N 2.98Å; Q471-L473 VanDerWaalsContact C-N 3.34Å; L473-H476 PolarHBondContact O-N 3.45Å; L473-L477 HydrophobicContact CD1-CD1 3.83Å; L473-L477 HydrophobicContact CD1-CD2 4.38Å; L473-L477 HydrophobicContact CD1-CG 3.88Å; L473-L477 HydrophobicContact CG-CD1 3.93Å; L473-L477 HydrophobicContact CG-CG 4.37Å; L473-L477 WeakPolarHBondContact O-CB 3.38Å; L473-L477 VanDerWaalsContact O-CG 3.23Å; L473-L477 WeakPolarHBondContact O-CG 3.5Å; L473-L477 PolarHBondContact O-N 2.96Å; L473-F488 HydrophobicContact CB-CE2 4.3Å; L473-F488 HydrophobicContact CD2-CD2 4.24Å; L473-F488 HydrophobicContact CD2-CE2 4.07Å; L473-F488 HydrophobicContact CG-CD2 4.08Å; L473-F488 HydrophobicContact CG-CE2 4.13Å; L473-L491 HydrophobicContact CD1-CD2 4.41Å; L473-L491 HydrophobicContact CD2-CD2 4.35Å
474	D	97.4	Very high	95.1	Very high	55 Å²	55	51.2 Å²	51.2	29%	0.294	29%	0.292	S	S	.	.	H	α-helix	trans	-63.3	-47.5	178.9	-171.7	46.7	0	0	0	111.6	L470 H476 L477 L478 F488	L470-D474 PolarHBondContact O-N 3.33Å; D474-H476 VanDerWaalsContact C-N 3.31Å; D474-H476 PolarHBondContact O-N 2.86Å; D474-L477 PolarHBondContact O-N 2.95Å; D474-L478 WeakPolarHBondContact O-CB 3.38Å; D474-L478 VanDerWaalsContact O-CG 3.3Å; D474-L478 WeakPolarHBondContact O-CG 3.28Å; D474-L478 PolarHBondContact O-N 2.85Å; D474-F488 HydrophobicContact CB-CB 4.43Å; D474-F488 HydrophobicContact CB-CD1 3.89Å; D474-F488 HydrophobicContact CB-CD2 3.89Å; D474-F488 HydrophobicContact CB-CE1 4.02Å; D474-F488 HydrophobicContact CB-CE2 4Å; D474-F488 HydrophobicContact CB-CG 3.82Å; D474-F488 HydrophobicContact CB-CZ 4.07Å; D474-F488 WeakPolarHBondContact OD1-CB 3.39Å; D474-F488 WeakPolarHBondContact OD1-CD1 3.38Å; D474-F488 WeakPolarHBondContact OD1-CG 3.39Å
475	Q	95.7	Very high	94.6	Very high	77 Å²	77	51.5 Å²	51.5	36%	0.36	29%	0.293	S	S	.	.	H	α-helix	trans	-59.5	-40.9	175.9	-172.1	-174	-13	0	0	112	G259 Q471 G479	G259-Q475 PolarHBondContact O-NE2 3.49Å; Q471-Q475 WeakPolarHBondContact O-CB 3.45Å; Q471-Q475 PolarHBondContact O-N 3.45Å; Q471-Q475 VanDerWaalsContact O-N 3.15Å; Q475-G479 PolarHBondContact O-N 2.81Å
476	H	96.6	Very high	94.4	Very high	46 Å²	46	58.5 Å²	58.5	21%	0.213	32%	0.319	C	S	.	.	H	α-helix	trans	-67	-45.4	177.4	-179	78	0	0	0	111.8	D439 L442 A472 L473 D474 L478 G479 N480	D439-H476 IonicContact OD1-CD2 3.14Å; D439-H476 PolarHBondContact OD1-CD2 2.81Å; D439-H476 IonicContact OD1-NE2 3.89Å; D439-H476 PolarHBondContact OD1-NE2 3.27Å; L442-H476 HydrophobicContact CD1-CB 3.88Å; A472-H476 WeakPolarHBondContact O-CB 3.36Å; A472-H476 PolarHBondContact O-N 2.94Å; L473-H476 PolarHBondContact O-N 3.45Å; D474-H476 VanDerWaalsContact C-N 3.31Å; D474-H476 PolarHBondContact O-N 2.86Å; H476-L478 PolarHBondContact O-N 3.29Å; H476-G479 PolarHBondContact O-N 2.82Å; H476-N480 VanDerWaalsContact O-CB 3.3Å; H476-N480 WeakPolarHBondContact O-CB 3.42Å; H476-N480 PolarHBondContact O-N 3.44Å
477	L	96.4	Very high	94.3	Very high	5 Å²	5	58 Å²	58	3%	0.026	32%	0.317	C	S	.	.	H	α-helix	trans	-63.7	-40.5	178	-70.7	173.9	0	0	0	112.1	L435 D439 L473 D474 G479 H481 L487 F488 L491	L435-L477 HydrophobicContact CD2-CD2 4.07Å; D439-L477 HydrophobicContact CB-CD2 3.93Å; L473-L477 HydrophobicContact CD1-CD1 3.83Å; L473-L477 HydrophobicContact CD1-CD2 4.38Å; L473-L477 HydrophobicContact CD1-CG 3.88Å; L473-L477 HydrophobicContact CG-CD1 3.93Å; L473-L477 HydrophobicContact CG-CG 4.37Å; L473-L477 WeakPolarHBondContact O-CB 3.38Å; L473-L477 VanDerWaalsContact O-CG 3.23Å; L473-L477 WeakPolarHBondContact O-CG 3.5Å; L473-L477 PolarHBondContact O-N 2.96Å; D474-L477 PolarHBondContact O-N 2.95Å; L477-G479 VanDerWaalsContact C-N 3.28Å; L477-G479 PolarHBondContact O-N 3.24Å; L477-H481 WeakPolarHBondContact O-CA 3.43Å; L477-H481 WeakPolarHBondContact O-CB 3.4Å; L477-H481 PolarHBondContact O-N 3.1Å; L477-L487 HydrophobicContact CD1-CG 4.44Å; L477-L487 HydrophobicContact CD2-CD2 3.85Å; L477-L487 HydrophobicContact CD2-CG 4.22Å; L477-F488 HydrophobicContact CD1-CB 3.92Å; L477-F488 HydrophobicContact CD1-CD2 4.08Å; L477-L491 HydrophobicContact CD1-CD2 4.07Å
478	L	93.8	Very high	94.3	Very high	80 Å²	80	55.5 Å²	55.5	42%	0.419	30%	0.302	S	S	.	.	H	α-helix	trans	-63.2	-34.5	175.3	-72.1	169.6	0	0	0	112.3	D474 H476	D474-L478 WeakPolarHBondContact O-CB 3.38Å; D474-L478 VanDerWaalsContact O-CG 3.3Å; D474-L478 WeakPolarHBondContact O-CG 3.28Å; D474-L478 PolarHBondContact O-N 2.85Å; H476-L478 PolarHBondContact O-N 3.29Å
479	G	91.8	Very high	94.3	Very high	62 Å²	62	55.8 Å²	55.8	64%	0.639	30%	0.303	S	S	*	.	H	α-helix	trans	-76.2	-45.9	175.3	0	0	0	0	0	114	Q475 H476 L477	Q475-G479 PolarHBondContact O-N 2.81Å; H476-G479 PolarHBondContact O-N 2.82Å; L477-G479 VanDerWaalsContact C-N 3.28Å; L477-G479 PolarHBondContact O-N 3.24Å
480	N	93.1	Very high	94.2	Very high	71 Å²	71	61.5 Å²	61.5	38%	0.38	33%	0.328	S	S	.	.	H	α-helix	trans	-77.4	-36.4	-175.3	-159.6	22.7	0	0	0	111.9	D436 D439 H476	D436-N480 PolarHBondContact OD2-ND2 3.14Å; D439-N480 PolarHBondContact OD1-ND2 3.29Å; D439-N480 PolarHBondContact OD2-ND2 3.41Å; H476-N480 VanDerWaalsContact O-CB 3.3Å; H476-N480 WeakPolarHBondContact O-CB 3.42Å; H476-N480 PolarHBondContact O-N 3.44Å
481	H	93.2	Very high	94.1	Very high	30 Å²	30	60.1 Å²	60.1	14%	0.139	32%	0.32	C	S	.	.	T	Hydrogen-bonded Turn	trans	-119.3	51	-175.8	-57.7	-89.4	0	0	0	112.3	D439 L477 D483 S484 L487	D439-H481 VanDerWaalsContact CG-NE2 3.34Å; D439-H481 IonicContact OD1-CD2 2.64Å; D439-H481 IonicContact OD1-NE2 2.64Å; D439-H481 PolarHBondContact OD1-NE2 3.13Å; D439-H481 IonicContact OD2-CD2 3.4Å; D439-H481 IonicContact OD2-CE1 2.69Å; D439-H481 IonicContact OD2-NE2 3.16Å; D439-H481 PolarHBondContact OD2-NE2 2.87Å; L477-H481 WeakPolarHBondContact O-CA 3.43Å; L477-H481 WeakPolarHBondContact O-CB 3.4Å; L477-H481 PolarHBondContact O-N 3.1Å; H481-D483 PolarHBondContact O-N 3.31Å; H481-S484 PolarHBondContact O-N 3.11Å; H481-L487 HydrophobicContact CB-CD2 3.59Å
482	A	86.7	Confident	94	Very high	61 Å²	61	58 Å²	58	50%	0.504	31%	0.312	S	S	.	.	T	Hydrogen-bonded Turn	trans	-55.5	-11.8	-178.7	0	0	0	0	0	115.9	H485	A482-H485 PolarHBondContact O-CE1 2.71Å
483	D	87.1	Confident	93.9	Very high	80 Å²	80	63.3 Å²	63.3	43%	0.428	34%	0.34	S	S	.	.	T	Hydrogen-bonded Turn	trans	-87.8	-7.1	173.3	-79.3	-8.9	0	0	0	113.9	K202 Q204 H481	K202-D483 WeakPolarHBondContact CD-OD2 3.35Å; K202-D483 IonicContact NZ-OD1 3.76Å; K202-D483 PolarHBondContact NZ-OD1 3.02Å; K202-D483 IonicContact NZ-OD2 2.72Å; K202-D483 PolarHBondContact NZ-OD2 3.1Å; Q204-D483 PolarHBondContact NE2-OD2 2.89Å; H481-D483 PolarHBondContact O-N 3.31Å
484	S	88.6	Confident	93.9	Very high	61 Å²	61	65 Å²	65	43%	0.427	35%	0.348	S	S	.	.			trans	-131.5	53.6	-162.9	-61.2	0	0	0	0	113.1	H481 Y486 L487	H481-S484 PolarHBondContact O-N 3.11Å; S484-Y486 PolarHBondContact O-N 3.4Å; S484-L487 WeakPolarHBondContact O-CB 3.45Å; S484-L487 PolarHBondContact O-N 3.32Å
485	H	85.2	Confident	93.9	Very high	134 Å²	134	63.4 Å²	63.4	62%	0.62	34%	0.339	S	S	*	.	T	Hydrogen-bonded Turn	trans	-50.9	-20.2	-174.2	-53.8	-61	0	0	0	117.1	A482	A482-H485 PolarHBondContact O-CE1 2.71Å
486	Y	93	Very high	93.8	Very high	171 Å²	171	62.8 Å²	62.8	67%	0.671	35%	0.346	S	S	*	.	T	Hydrogen-bonded Turn	trans	-101.3	21.1	176.8	-58.7	-73.3	0	0	0	113.5	S484 K490	S484-Y486 PolarHBondContact O-N 3.4Å; Y486-K490 WeakPolarHBondContact O-CB 3.23Å; Y486-K490 VanDerWaalsContact O-CD 3.3Å; Y486-K490 WeakPolarHBondContact O-CD 3.49Å; Y486-K490 WeakPolarHBondContact O-CG 3.4Å; Y486-K490 PolarHBondContact O-N 2.92Å
487	L	95.8	Very high	93.8	Very high	10 Å²	10	63.1 Å²	63.1	5%	0.052	35%	0.35	C	S	.	.	H	α-helix	trans	-71.8	-44	-177.1	-176.7	55.1	0	0	0	112.4	L433 L435 L477 H481 S484 K490 L491	L433-L487 HydrophobicContact CB-CD1 4.05Å; L433-L487 HydrophobicContact CD2-CD1 4.05Å; L435-L487 HydrophobicContact CD2-CD1 4.15Å; L435-L487 HydrophobicContact CD2-CD2 4.04Å; L435-L487 HydrophobicContact CD2-CG 4.31Å; L477-L487 HydrophobicContact CD1-CG 4.44Å; L477-L487 HydrophobicContact CD2-CD2 3.85Å; L477-L487 HydrophobicContact CD2-CG 4.22Å; H481-L487 HydrophobicContact CB-CD2 3.59Å; S484-L487 WeakPolarHBondContact O-CB 3.45Å; S484-L487 PolarHBondContact O-N 3.32Å; L487-K490 PolarHBondContact O-N 2.9Å; L487-L491 WeakPolarHBondContact O-CB 3.47Å; L487-L491 PolarHBondContact O-N 2.88Å
488	F	97.5	Very high	93.9	Very high	39 Å²	39	62.9 Å²	62.9	17%	0.171	35%	0.349	C	S	.	.	H	α-helix	trans	-55.5	-56.4	177.7	178.9	-115	0	0	0	113.3	L470 L473 D474 L477 K490 L491 L492	L470-F488 HydrophobicContact CB-CZ 4.44Å; L470-F488 HydrophobicContact CD2-CE2 4.22Å; L470-F488 HydrophobicContact CD2-CZ 4.41Å; L473-F488 HydrophobicContact CB-CE2 4.3Å; L473-F488 HydrophobicContact CD2-CD2 4.24Å; L473-F488 HydrophobicContact CD2-CE2 4.07Å; L473-F488 HydrophobicContact CG-CD2 4.08Å; L473-F488 HydrophobicContact CG-CE2 4.13Å; D474-F488 HydrophobicContact CB-CB 4.43Å; D474-F488 HydrophobicContact CB-CD1 3.89Å; D474-F488 HydrophobicContact CB-CD2 3.89Å; D474-F488 HydrophobicContact CB-CE1 4.02Å; D474-F488 HydrophobicContact CB-CE2 4Å; D474-F488 HydrophobicContact CB-CG 3.82Å; D474-F488 HydrophobicContact CB-CZ 4.07Å; D474-F488 WeakPolarHBondContact OD1-CB 3.39Å; D474-F488 WeakPolarHBondContact OD1-CD1 3.38Å; D474-F488 WeakPolarHBondContact OD1-CG 3.39Å; L477-F488 HydrophobicContact CD1-CB 3.92Å; L477-F488 HydrophobicContact CD1-CD2 4.08Å; F488-K490 VanDerWaalsContact C-N 3.29Å; F488-K490 PolarHBondContact O-N 3.19Å; F488-L491 WeakPolarHBondContact O-CA 3.41Å; F488-L491 WeakPolarHBondContact O-CB 3.42Å; F488-L491 PolarHBondContact O-N 2.88Å; F488-L492 HydrophobicContact CD1-CD1 4.3Å; F488-L492 HydrophobicContact CD2-CG 4.47Å; F488-L492 HydrophobicContact CE1-CD1 3.77Å; F488-L492 HydrophobicContact CE1-CG 4.48Å; F488-L492 HydrophobicContact CE2-CD1 4.26Å; F488-L492 HydrophobicContact CE2-CD2 4.05Å; F488-L492 HydrophobicContact CE2-CG 4.21Å; F488-L492 HydrophobicContact CZ-CD1 3.76Å; F488-L492 HydrophobicContact CZ-CD2 4.24Å; F488-L492 HydrophobicContact CZ-CG 4.21Å; F488-L492 PolarHBondContact O-N 2.84Å
489	P	96.7	Very high	94	Very high	59 Å²	59	62.1 Å²	62.1	38%	0.383	34%	0.34	S	S	.	.	H	α-helix	trans	-64.4	-30.4	177.6	24.3	-34.5	0	0	0	113.4	L491 N493	P489-L491 VanDerWaalsContact C-N 3.27Å; P489-L491 PolarHBondContact O-N 2.83Å; P489-N493 VanDerWaalsContact O-CG 3.23Å; P489-N493 PolarHBondContact O-N 3.44Å; P489-N493 VanDerWaalsContact O-N 3.15Å; P489-N493 PolarHBondContact O-OD1 2.63Å
490	K	96.4	Very high	94.3	Very high	121 Å²	121	65.1 Å²	65.1	53%	0.526	34%	0.337	S	S	.	.	H	α-helix	trans	-67.5	-28.7	172.4	-75.1	174.2	-172.8	179.1	0	112.9	L433 Y486 L487 F488	L433-K490 HydrophobicContact CD2-CB 4.36Å; Y486-K490 WeakPolarHBondContact O-CB 3.23Å; Y486-K490 VanDerWaalsContact O-CD 3.3Å; Y486-K490 WeakPolarHBondContact O-CD 3.49Å; Y486-K490 WeakPolarHBondContact O-CG 3.4Å; Y486-K490 PolarHBondContact O-N 2.92Å; L487-K490 PolarHBondContact O-N 2.9Å; F488-K490 VanDerWaalsContact C-N 3.29Å; F488-K490 PolarHBondContact O-N 3.19Å
491	L	97.4	Very high	94.5	Very high	0 Å²	0	62.1 Å²	62.1	0%	0	32%	0.321	C	S	.	.	H	α-helix	trans	-81.7	-40.9	178.1	-176.5	54	0	0	0	111.5	F430 L433 L435 F443 L473 L477 L487 F488 P489 N493 K494	F430-L491 HydrophobicContact CE2-CD1 3.78Å; F430-L491 HydrophobicContact CZ-CD1 4.13Å; L433-L491 HydrophobicContact CD1-CD1 4.08Å; L435-L491 HydrophobicContact CD1-CD1 3.79Å; L435-L491 HydrophobicContact CD1-CD2 4.04Å; L435-L491 HydrophobicContact CD2-CD2 4.32Å; F443-L491 HydrophobicContact CB-CD2 4.17Å; F443-L491 HydrophobicContact CD1-CD1 3.81Å; F443-L491 HydrophobicContact CD1-CG 4.4Å; F443-L491 HydrophobicContact CD2-CD1 3.85Å; F443-L491 HydrophobicContact CD2-CD2 3.9Å; F443-L491 HydrophobicContact CD2-CG 3.56Å; F443-L491 HydrophobicContact CE1-CD1 3.65Å; F443-L491 HydrophobicContact CE1-CG 4.44Å; F443-L491 HydrophobicContact CE2-CD1 3.7Å; F443-L491 HydrophobicContact CE2-CD2 4.46Å; F443-L491 HydrophobicContact CE2-CG 3.63Å; F443-L491 WeakPolarHBondContact CE2-O 3.46Å; F443-L491 HydrophobicContact CG-CD1 3.9Å; F443-L491 HydrophobicContact CG-CD2 3.99Å; F443-L491 HydrophobicContact CG-CG 3.97Å; F443-L491 HydrophobicContact CZ-CD1 3.59Å; F443-L491 HydrophobicContact CZ-CG 4.08Å; L473-L491 HydrophobicContact CD1-CD2 4.41Å; L473-L491 HydrophobicContact CD2-CD2 4.35Å; L477-L491 HydrophobicContact CD1-CD2 4.07Å; L487-L491 WeakPolarHBondContact O-CB 3.47Å; L487-L491 PolarHBondContact O-N 2.88Å; F488-L491 WeakPolarHBondContact O-CA 3.41Å; F488-L491 WeakPolarHBondContact O-CB 3.42Å; F488-L491 PolarHBondContact O-N 2.88Å; P489-L491 VanDerWaalsContact C-N 3.27Å; P489-L491 PolarHBondContact O-N 2.83Å; L491-N493 VanDerWaalsContact C-N 3.28Å; L491-N493 PolarHBondContact O-N 3.29Å; L491-K494 WeakPolarHBondContact O-CA 3.48Å; L491-K494 VanDerWaalsContact O-CB 3.32Å; L491-K494 WeakPolarHBondContact O-CB 3.34Å; L491-K494 PolarHBondContact O-N 3.45Å
492	L	96.2	Very high	94.7	Very high	55 Å²	55	60.7 Å²	60.7	29%	0.288	32%	0.315	S	S	.	.	H	α-helix	trans	-57.8	-41.5	171.4	-64	-174.7	0	0	0	111.9	L470 F488 K494 M495	L470-L492 HydrophobicContact CD2-CD2 3.8Å; F488-L492 HydrophobicContact CD1-CD1 4.3Å; F488-L492 HydrophobicContact CD2-CG 4.47Å; F488-L492 HydrophobicContact CE1-CD1 3.77Å; F488-L492 HydrophobicContact CE1-CG 4.48Å; F488-L492 HydrophobicContact CE2-CD1 4.26Å; F488-L492 HydrophobicContact CE2-CD2 4.05Å; F488-L492 HydrophobicContact CE2-CG 4.21Å; F488-L492 HydrophobicContact CZ-CD1 3.76Å; F488-L492 HydrophobicContact CZ-CD2 4.24Å; F488-L492 HydrophobicContact CZ-CG 4.21Å; F488-L492 PolarHBondContact O-N 2.84Å; L492-K494 PolarHBondContact O-N 2.91Å; L492-M495 HydrophobicContact CD2-SD 4.17Å; L492-M495 WeakPolarHBondContact O-CB 3.45Å; L492-M495 PolarHBondContact O-N 3.17Å
493	N	95.9	Very high	95.1	Very high	112 Å²	112	59.9 Å²	59.9	60%	0.599	30%	0.304	S	S	*	.	H	α-helix	trans	-58.2	-16.2	173.2	-72.5	-7.4	0	0	0	113.7	P489 L491	P489-N493 VanDerWaalsContact O-CG 3.23Å; P489-N493 PolarHBondContact O-N 3.44Å; P489-N493 VanDerWaalsContact O-N 3.15Å; P489-N493 PolarHBondContact O-OD1 2.63Å; L491-N493 VanDerWaalsContact C-N 3.28Å; L491-N493 PolarHBondContact O-N 3.29Å
494	K	97.4	Very high	95.6	Very high	37 Å²	37	59.3 Å²	59.3	16%	0.161	30%	0.298	C	S	.	.	H	α-helix	trans	-83.2	-12.3	173.9	-59.8	-52.9	-179.1	-164.7	0	114.5	F426 F430 L433 F443 L491 L492 A496 D497 L498	F426-K494 HydrophobicContact CE2-CB 4.48Å; F426-K494 HydrophobicContact CE2-CD 4.31Å; F430-K494 HydrophobicContact CD2-CB 4.16Å; F430-K494 HydrophobicContact CD2-CG 3.98Å; F430-K494 HydrophobicContact CE2-CB 4.06Å; F430-K494 HydrophobicContact CE2-CG 4.24Å; L433-K494 HydrophobicContact CD1-CG 4.29Å; F443-K494 HydrophobicContact CZ-CB 4.29Å; L491-K494 WeakPolarHBondContact O-CA 3.48Å; L491-K494 VanDerWaalsContact O-CB 3.32Å; L491-K494 WeakPolarHBondContact O-CB 3.34Å; L491-K494 PolarHBondContact O-N 3.45Å; L492-K494 PolarHBondContact O-N 2.91Å; K494-A496 VanDerWaalsContact C-N 3.3Å; K494-D497 HydrophobicContact CD-CB 4.1Å; K494-D497 VanDerWaalsContact CD-OD2 3.24Å; K494-D497 WeakPolarHBondContact CD-OD2 3.32Å; K494-D497 WeakPolarHBondContact CE-OD2 3.35Å; K494-D497 IonicContact NZ-OD1 3.88Å; K494-D497 IonicContact NZ-OD2 3.73Å; K494-D497 PolarHBondContact NZ-OD2 3.22Å; K494-L498 WeakPolarHBondContact O-CB 3.37Å; K494-L498 WeakPolarHBondContact O-CD1 3.32Å; K494-L498 WeakPolarHBondContact O-CG 3.41Å; K494-L498 PolarHBondContact O-N 2.85Å
495	M	96.6	Very high	95.9	Very high	21 Å²	21	57.1 Å²	57.1	10%	0.103	28%	0.282	C	S	.	.	H	α-helix	trans	-66.8	-35.7	169.4	-59.8	177.3	68.7	0	0	110.9	F443 I447 L492 L498 R499	F443-M495 HydrophobicContact CE2-CG 3.71Å; F443-M495 HydrophobicContact CE2-SD 4.23Å; F443-M495 HydrophobicContact CZ-CG 3.94Å; I447-M495 HydrophobicContact CG1-CE 4.26Å; I447-M495 HydrophobicContact CG1-CG 4.37Å; L492-M495 HydrophobicContact CD2-SD 4.17Å; L492-M495 WeakPolarHBondContact O-CB 3.45Å; L492-M495 PolarHBondContact O-N 3.17Å; M495-L498 PolarHBondContact O-N 2.81Å; M495-R499 WeakPolarHBondContact O-CG 3.49Å; M495-R499 PolarHBondContact O-N 3.46Å; M495-R499 VanDerWaalsContact O-N 3.09Å
496	A	94.6	Very high	96.4	Very high	63 Å²	63	51 Å²	51	52%	0.521	26%	0.255	S	S	.	.	H	α-helix	trans	-67.4	-48.9	172.5	0	0	0	0	0	112.6	K494 L498 R499 Q500	K494-A496 VanDerWaalsContact C-N 3.3Å; A496-L498 PolarHBondContact O-N 3.23Å; A496-R499 PolarHBondContact O-N 3.1Å; A496-Q500 PolarHBondContact O-N 3Å
497	D	97.1	Very high	96.4	Very high	54 Å²	54	48.6 Å²	48.6	29%	0.289	25%	0.251	S	S	.	.	H	α-helix	trans	-53.4	-42.3	172.7	-78.6	31.3	0	0	0	111.6	F426 K494 L501	F426-D497 HydrophobicContact CD2-CB 4.04Å; F426-D497 HydrophobicContact CE2-CB 3.71Å; K494-D497 HydrophobicContact CD-CB 4.1Å; K494-D497 VanDerWaalsContact CD-OD2 3.24Å; K494-D497 WeakPolarHBondContact CD-OD2 3.32Å; K494-D497 WeakPolarHBondContact CE-OD2 3.35Å; K494-D497 IonicContact NZ-OD1 3.88Å; K494-D497 IonicContact NZ-OD2 3.73Å; K494-D497 PolarHBondContact NZ-OD2 3.22Å; D497-L501 WeakPolarHBondContact O-CB 3.26Å; D497-L501 PolarHBondContact O-N 3.48Å
498	L	98.3	Very high	96.3	Very high	0 Å²	0	49.4 Å²	49.4	0%	0	26%	0.255	C	S	.	.	H	α-helix	trans	-66.1	-42.3	-179.3	-76.3	166.5	0	0	0	112.2	E380 F383 A384 F426 F443 I447 K494 M495 A496 L501 V502	E380-L498 HydrophobicContact CB-CB 4.33Å; E380-L498 HydrophobicContact CG-CB 4.29Å; F383-L498 HydrophobicContact CB-CD2 3.55Å; A384-L498 HydrophobicContact CB-CD1 3.97Å; A384-L498 HydrophobicContact CB-CD2 4.47Å; F426-L498 HydrophobicContact CE1-CD2 3.79Å; F426-L498 HydrophobicContact CE2-CD2 4.11Å; F426-L498 HydrophobicContact CE2-CG 4.11Å; F426-L498 HydrophobicContact CZ-CD1 4.4Å; F426-L498 HydrophobicContact CZ-CD2 3.5Å; F426-L498 VanDerWaalsContact CZ-CD2 3.5Å; F426-L498 HydrophobicContact CZ-CG 3.74Å; F443-L498 HydrophobicContact CE1-CD1 4.06Å; F443-L498 HydrophobicContact CZ-CD1 4.13Å; I447-L498 HydrophobicContact CD1-CD1 3.68Å; K494-L498 WeakPolarHBondContact O-CB 3.37Å; K494-L498 WeakPolarHBondContact O-CD1 3.32Å; K494-L498 WeakPolarHBondContact O-CG 3.41Å; K494-L498 PolarHBondContact O-N 2.85Å; M495-L498 PolarHBondContact O-N 2.81Å; A496-L498 PolarHBondContact O-N 3.23Å; L498-L501 CarbonylContact O-C 3.6Å; L498-L501 WeakPolarHBondContact O-CB 3.23Å; L498-L501 PolarHBondContact O-N 2.84Å; L498-V502 WeakPolarHBondContact O-CG2 3.49Å; L498-V502 PolarHBondContact O-N 3.5Å
499	R	96.6	Very high	96.1	Very high	64 Å²	64	47.9 Å²	47.9	24%	0.242	25%	0.249	C	C	.	.	H	α-helix	trans	-59.3	-49.6	176.6	-77.8	162.1	-176.5	-167.5	-8.7	112.1	E380 C450 D452 M495 A496 L501 V502 T503	E380-R499 WeakPolarHBondContact OE1-CG 3.49Å; E380-R499 IonicContact OE1-NE 3.5Å; E380-R499 PolarHBondContact OE1-NE 3.3Å; E380-R499 IonicContact OE2-NE 2.63Å; C450-R499 PolarHBondContact SG-NH2 2.94Å; D452-R499 VanDerWaalsContact CG-NH2 3.26Å; D452-R499 IonicContact OD1-CZ 3.38Å; D452-R499 IonicContact OD1-NH1 2.78Å; D452-R499 IonicContact OD1-NH2 3.17Å; D452-R499 PolarHBondContact OD1-NH2 2.89Å; D452-R499 IonicContact OD2-CZ 2.7Å; D452-R499 IonicContact OD2-NH1 2.75Å; D452-R499 PolarHBondContact OD2-NH1 2.87Å; D452-R499 IonicContact OD2-NH2 3.52Å; D452-R499 PolarHBondContact OD2-NH2 3.37Å; M495-R499 WeakPolarHBondContact O-CG 3.49Å; M495-R499 PolarHBondContact O-N 3.46Å; M495-R499 VanDerWaalsContact O-N 3.09Å; A496-R499 PolarHBondContact O-N 3.1Å; R499-L501 VanDerWaalsContact C-N 3.29Å; R499-L501 PolarHBondContact O-N 2.91Å; R499-V502 PolarHBondContact O-N 3.34Å; R499-V502 VanDerWaalsContact O-N 3.13Å; R499-T503 PolarHBondContact O-N 3.16Å; R499-T503 PolarHBondContact O-OG1 2.68Å
500	Q	96.4	Very high	95.8	Very high	124 Å²	124	49.2 Å²	49.2	58%	0.579	25%	0.25	S	S	*	.	H	α-helix	trans	-56.6	-45.2	174.3	178.6	175.5	-15	0	0	111.2	A496 V502 T503 E504	A496-Q500 PolarHBondContact O-N 3Å; Q500-V502 VanDerWaalsContact C-N 3.29Å; Q500-V502 PolarHBondContact O-N 2.9Å; Q500-T503 PolarHBondContact O-N 3.44Å; Q500-E504 HydrophobicContact CG-CG 4.35Å; Q500-E504 WeakPolarHBondContact CG-OE1 3.45Å; Q500-E504 PolarHBondContact NE2-OE1 2.76Å; Q500-E504 WeakPolarHBondContact O-CB 3.35Å; Q500-E504 WeakPolarHBondContact O-CG 3.28Å; Q500-E504 PolarHBondContact O-N 3.31Å
501	L	97.9	Very high	95.6	Very high	8 Å²	8	47.5 Å²	47.5	4%	0.042	24%	0.243	C	C	.	.	H	α-helix	trans	-64.4	-29.7	179.2	-173.9	62	0	0	0	113.4	F383 P422 K423 F426 D497 L498 R499 N505	F383-L501 HydrophobicContact CB-CD2 4.03Å; F383-L501 HydrophobicContact CD2-CB 4.35Å; F383-L501 HydrophobicContact CD2-CD2 3.92Å; F383-L501 HydrophobicContact CD2-CG 3.74Å; F383-L501 HydrophobicContact CE2-CG 4.15Å; F383-L501 HydrophobicContact CG-CD2 4.13Å; F383-L501 HydrophobicContact CG-CG 4.42Å; P422-L501 HydrophobicContact CB-CD1 3.65Å; K423-L501 HydrophobicContact CD-CD1 3.91Å; K423-L501 HydrophobicContact CG-CD1 4.19Å; K423-L501 HydrophobicContact CG-CD2 4.29Å; K423-L501 HydrophobicContact CG-CG 4.46Å; F426-L501 HydrophobicContact CB-CD2 3.83Å; F426-L501 HydrophobicContact CD1-CD2 4.09Å; F426-L501 HydrophobicContact CD2-CD2 4.26Å; F426-L501 HydrophobicContact CG-CD2 3.79Å; D497-L501 WeakPolarHBondContact O-CB 3.26Å; D497-L501 PolarHBondContact O-N 3.48Å; L498-L501 CarbonylContact O-C 3.6Å; L498-L501 WeakPolarHBondContact O-CB 3.23Å; L498-L501 PolarHBondContact O-N 2.84Å; R499-L501 VanDerWaalsContact C-N 3.29Å; R499-L501 PolarHBondContact O-N 2.91Å; L501-N505 VanDerWaalsContact O-CB 3.3Å; L501-N505 WeakPolarHBondContact O-CB 3.45Å; L501-N505 PolarHBondContact O-N 2.93Å; L501-N505 VanDerWaalsContact O-N 3.11Å
502	V	97.6	Very high	95.2	Very high	1 Å²	1	47.6 Å²	47.6	1%	0.006	24%	0.243	C	C	.	.	H	α-helix	trans	-73.7	-45.7	171.8	174.6	0	0	0	0	111.4	H379 E380 F383 L498 R499 Q500 N505 A506 M532 Y533	H379-V502 HydrophobicContact CB-CG1 3.92Å; H379-V502 HydrophobicContact CB-CG2 3.73Å; E380-V502 HydrophobicContact CG-CG2 3.89Å; F383-V502 HydrophobicContact CD2-CG2 3.78Å; F383-V502 HydrophobicContact CE2-CG2 3.91Å; L498-V502 WeakPolarHBondContact O-CG2 3.49Å; L498-V502 PolarHBondContact O-N 3.5Å; R499-V502 PolarHBondContact O-N 3.34Å; R499-V502 VanDerWaalsContact O-N 3.13Å; Q500-V502 VanDerWaalsContact C-N 3.29Å; Q500-V502 PolarHBondContact O-N 2.9Å; V502-N505 WeakPolarHBondContact O-CB 3.34Å; V502-N505 PolarHBondContact O-N 3.05Å; V502-N505 VanDerWaalsContact O-N 3.15Å; V502-A506 PolarHBondContact O-N 3.29Å; V502-M532 HydrophobicContact CG1-CE 3.88Å; V502-M532 HydrophobicContact CG1-SD 4.49Å; V502-Y533 HydrophobicContact CG1-CE2 4.25Å
503	T	95.7	Very high	94.8	Very high	44 Å²	44	50 Å²	50	27%	0.27	25%	0.251	S	S	.	.	H	α-helix	trans	-59.9	-46.9	175.4	-55.3	0	0	0	0	111.6	R499 Q500 N505 A506 M507	R499-T503 PolarHBondContact O-N 3.16Å; R499-T503 PolarHBondContact O-OG1 2.68Å; Q500-T503 PolarHBondContact O-N 3.44Å; T503-N505 VanDerWaalsContact C-N 3.3Å; T503-N505 PolarHBondContact O-N 2.85Å; T503-A506 PolarHBondContact O-N 3.27Å; T503-M507 HydrophobicContact CG2-CE 3.9Å; T503-M507 WeakPolarHBondContact O-CG 3.36Å; T503-M507 PolarHBondContact O-N 3.19Å
504	E	95.8	Very high	94.3	Very high	68 Å²	68	52.6 Å²	52.6	32%	0.318	26%	0.257	S	S	.	.	H	α-helix	trans	-59.8	-39	174	-73.1	174.8	-171.2	0	0	111.9	Q500 L508	Q500-E504 HydrophobicContact CG-CG 4.35Å; Q500-E504 WeakPolarHBondContact CG-OE1 3.45Å; Q500-E504 PolarHBondContact NE2-OE1 2.76Å; Q500-E504 WeakPolarHBondContact O-CB 3.35Å; Q500-E504 WeakPolarHBondContact O-CG 3.28Å; Q500-E504 PolarHBondContact O-N 3.31Å; E504-L508 WeakPolarHBondContact O-CG 3.41Å; E504-L508 PolarHBondContact O-N 2.73Å; E504-L508 VanDerWaalsContact O-N 3.1Å
505	N	95.9	Very high	93.8	Very high	14 Å²	14	54.6 Å²	54.6	8%	0.075	27%	0.273	C	S	.	.	H	α-helix	trans	-66.3	-42.9	175.5	-164.2	75.9	0	0	0	112.4	F383 K423 L501 V502 T503 M507 L508 V509 Y529	F383-N505 HydrophobicContact CE2-CB 3.91Å; F383-N505 HydrophobicContact CZ-CB 3.93Å; K423-N505 VanDerWaalsContact CE-OD1 3.28Å; K423-N505 WeakPolarHBondContact CE-OD1 3.4Å; K423-N505 PolarHBondContact NZ-OD1 3.29Å; L501-N505 VanDerWaalsContact O-CB 3.3Å; L501-N505 WeakPolarHBondContact O-CB 3.45Å; L501-N505 PolarHBondContact O-N 2.93Å; L501-N505 VanDerWaalsContact O-N 3.11Å; V502-N505 WeakPolarHBondContact O-CB 3.34Å; V502-N505 PolarHBondContact O-N 3.05Å; V502-N505 VanDerWaalsContact O-N 3.15Å; T503-N505 VanDerWaalsContact C-N 3.3Å; T503-N505 PolarHBondContact O-N 2.85Å; N505-M507 VanDerWaalsContact C-N 3.34Å; N505-M507 PolarHBondContact O-N 3.26Å; N505-L508 PolarHBondContact O-N 3.15Å; N505-V509 WeakPolarHBondContact O-CG2 3.27Å; N505-V509 PolarHBondContact O-N 2.94Å; N505-Y529 PolarHBondContact ND2-OH 3.28Å
506	A	94.7	Very high	93.2	Very high	6 Å²	6	54.8 Å²	54.8	5%	0.05	27%	0.273	C	S	.	.	H	α-helix	trans	-60.8	-43.4	177.2	0	0	0	0	0	111.3	V502 T503 L508 V509 Q510 Y529 M532	V502-A506 PolarHBondContact O-N 3.29Å; T503-A506 PolarHBondContact O-N 3.27Å; A506-L508 PolarHBondContact O-N 2.94Å; A506-V509 PolarHBondContact O-N 2.93Å; A506-Q510 WeakPolarHBondContact O-CB 3.08Å; A506-Q510 WeakPolarHBondContact O-CG 3.43Å; A506-Q510 PolarHBondContact O-N 2.97Å; A506-Y529 HydrophobicContact CB-CD1 4.1Å; A506-Y529 HydrophobicContact CB-CE1 3.9Å; A506-M532 HydrophobicContact CB-CE 3.82Å
507	M	93.8	Very high	92	Very high	120 Å²	120	57.8 Å²	57.8	59%	0.591	29%	0.29	S	S	*	.	H	α-helix	trans	-60.4	-42.4	174.3	-69.6	179.3	178.7	0	0	112.5	T503 N505 Q510 K511	T503-M507 HydrophobicContact CG2-CE 3.9Å; T503-M507 WeakPolarHBondContact O-CG 3.36Å; T503-M507 PolarHBondContact O-N 3.19Å; N505-M507 VanDerWaalsContact C-N 3.34Å; N505-M507 PolarHBondContact O-N 3.26Å; M507-Q510 PolarHBondContact O-N 2.84Å; M507-K511 WeakPolarHBondContact O-CB 3.23Å; M507-K511 PolarHBondContact O-N 3.26Å
508	L	93.6	Very high	90.6	Very high	28 Å²	28	60 Å²	60	15%	0.147	30%	0.299	C	S	.	.	H	α-helix	trans	-69.3	-37	176.6	-70.3	174.2	0	0	0	112.8	E418 E504 N505 A506 K511 I512	E418-L508 HydrophobicContact CB-CD1 4.36Å; E418-L508 HydrophobicContact CB-CD2 4.07Å; E504-L508 WeakPolarHBondContact O-CG 3.41Å; E504-L508 PolarHBondContact O-N 2.73Å; E504-L508 VanDerWaalsContact O-N 3.1Å; N505-L508 PolarHBondContact O-N 3.15Å; A506-L508 PolarHBondContact O-N 2.94Å; L508-K511 HydrophobicContact CD2-CD 4.19Å; L508-K511 WeakPolarHBondContact O-CB 3.36Å; L508-K511 PolarHBondContact O-N 3.24Å; L508-I512 WeakPolarHBondContact O-CG1 3.37Å; L508-I512 PolarHBondContact O-N 3.35Å
509	V	92.9	Very high	89.5	Confident	7 Å²	7	60.7 Å²	60.7	4%	0.042	30%	0.303	C	S	.	.	H	α-helix	trans	-65.3	-42.3	172.7	168.7	0	0	0	0	111.1	F338 I419 N505 A506 K511 I512 K513 L521	F338-V509 HydrophobicContact CE2-CG2 4.33Å; I419-V509 HydrophobicContact CD1-CG2 4.47Å; N505-V509 WeakPolarHBondContact O-CG2 3.27Å; N505-V509 PolarHBondContact O-N 2.94Å; A506-V509 PolarHBondContact O-N 2.93Å; V509-K511 VanDerWaalsContact C-N 3.33Å; V509-K511 PolarHBondContact O-N 3.25Å; V509-I512 PolarHBondContact O-N 3.49Å; V509-K513 WeakPolarHBondContact O-CG 3.35Å; V509-K513 PolarHBondContact O-N 2.68Å; V509-L521 HydrophobicContact CG1-CD1 3.9Å; V509-L521 HydrophobicContact CG1-CD2 4.06Å; V509-L521 HydrophobicContact CG1-CG 4.43Å
510	Q	90.7	Very high	88.8	Confident	87 Å²	87	62 Å²	62	41%	0.407	32%	0.322	S	S	.	.	H	α-helix	trans	-63.3	-38.1	172.6	-72.9	-172	22.6	0	0	112.2	A506 M507 K513 K514	A506-Q510 WeakPolarHBondContact O-CB 3.08Å; A506-Q510 WeakPolarHBondContact O-CG 3.43Å; A506-Q510 PolarHBondContact O-N 2.97Å; M507-Q510 PolarHBondContact O-N 2.84Å; Q510-K513 PolarHBondContact O-N 3.34Å; Q510-K514 WeakPolarHBondContact O-CB 3.41Å; Q510-K514 VanDerWaalsContact O-CG 3.27Å; Q510-K514 WeakPolarHBondContact O-CG 3.44Å; Q510-K514 PolarHBondContact O-N 3.43Å; Q510-K514 VanDerWaalsContact O-N 3.09Å
511	K	91.7	Very high	88.3	Confident	85 Å²	85	56.4 Å²	56.4	37%	0.37	30%	0.296	S	S	.	.	H	α-helix	trans	-61.4	-49	175.3	-175.3	-178.7	-179.4	-176.9	0	110.9	P415 E418 M507 L508 V509 K514 T515	P415-K511 HydrophobicContact CB-CD 3.91Å; P415-K511 HydrophobicContact CB-CG 4.16Å; E418-K511 IonicContact OE1-NZ 3.76Å; E418-K511 PolarHBondContact OE1-NZ 3.34Å; E418-K511 IonicContact OE2-NZ 2.71Å; E418-K511 PolarHBondContact OE2-NZ 2.89Å; M507-K511 WeakPolarHBondContact O-CB 3.23Å; M507-K511 PolarHBondContact O-N 3.26Å; L508-K511 HydrophobicContact CD2-CD 4.19Å; L508-K511 WeakPolarHBondContact O-CB 3.36Å; L508-K511 PolarHBondContact O-N 3.24Å; V509-K511 VanDerWaalsContact C-N 3.33Å; V509-K511 PolarHBondContact O-N 3.25Å; K511-K514 PolarHBondContact O-N 3.46Å; K511-K514 VanDerWaalsContact O-N 3.12Å; K511-T515 PolarHBondContact O-N 2.83Å; K511-T515 PolarHBondContact O-OG1 2.86Å
512	I	90.2	Very high	87.9	Confident	1 Å²	1	59.6 Å²	59.6	1%	0.005	31%	0.311	C	S	.	.	H	α-helix	trans	-55	-53.1	173.9	-70.6	159.7	0	0	0	110.6	F338 P415 F416 I419 L508 V509 K514 T515 E516 T519	F338-I512 HydrophobicContact CD1-CG2 4.11Å; F338-I512 HydrophobicContact CD2-CD1 3.91Å; F338-I512 HydrophobicContact CE1-CG2 3.78Å; F338-I512 HydrophobicContact CE2-CD1 3.71Å; F338-I512 HydrophobicContact CZ-CD1 4.15Å; F338-I512 HydrophobicContact CZ-CG2 4.05Å; P415-I512 HydrophobicContact CB-CG1 4.2Å; P415-I512 HydrophobicContact CG-CB 4.45Å; P415-I512 HydrophobicContact CG-CG1 3.56Å; F416-I512 HydrophobicContact CD1-CD1 4.08Å; F416-I512 HydrophobicContact CD1-CG1 4.27Å; F416-I512 HydrophobicContact CE1-CD1 4.2Å; F416-I512 HydrophobicContact CE1-CG1 4.1Å; F416-I512 HydrophobicContact CE1-CG2 3.83Å; F416-I512 HydrophobicContact CZ-CG2 4.26Å; I419-I512 HydrophobicContact CD1-CD1 4.01Å; L508-I512 WeakPolarHBondContact O-CG1 3.37Å; L508-I512 PolarHBondContact O-N 3.35Å; V509-I512 PolarHBondContact O-N 3.49Å; I512-K514 PolarHBondContact O-N 3.3Å; I512-K514 VanDerWaalsContact O-N 3.09Å; I512-T515 PolarHBondContact O-N 3.44Å; I512-E516 HydrophobicContact CG2-CG 4.3Å; I512-E516 WeakPolarHBondContact O-CB 3.48Å; I512-E516 WeakPolarHBondContact O-CG 3.33Å; I512-E516 PolarHBondContact O-N 3.27Å; I512-T519 HydrophobicContact CG2-CG2 3.88Å; I512-T519 WeakPolarHBondContact CG2-OG1 3.43Å
513	K	86.9	Confident	87.6	Confident	107 Å²	107	63.9 Å²	63.9	47%	0.465	34%	0.339	S	S	.	.	H	α-helix	trans	-58.6	-24.4	178.3	-72.3	-178.2	72.9	179.3	0	114.3	V509 Q510 L521	V509-K513 WeakPolarHBondContact O-CG 3.35Å; V509-K513 PolarHBondContact O-N 2.68Å; Q510-K513 PolarHBondContact O-N 3.34Å; K513-L521 HydrophobicContact CD-CD1 3.81Å; K513-L521 HydrophobicContact CD-CG 4.02Å; K513-L521 HydrophobicContact CG-CG 4.43Å
514	K	87.1	Confident	87.3	Confident	166 Å²	166	64.5 Å²	64.5	72%	0.722	34%	0.34	S	S	*	.	H	α-helix	trans	-91.3	-32.4	-179.2	-74.8	170.3	-179.2	170.2	0	113.1	Q510 K511 I512	Q510-K514 WeakPolarHBondContact O-CB 3.41Å; Q510-K514 VanDerWaalsContact O-CG 3.27Å; Q510-K514 WeakPolarHBondContact O-CG 3.44Å; Q510-K514 PolarHBondContact O-N 3.43Å; Q510-K514 VanDerWaalsContact O-N 3.09Å; K511-K514 PolarHBondContact O-N 3.46Å; K511-K514 VanDerWaalsContact O-N 3.12Å; I512-K514 PolarHBondContact O-N 3.3Å; I512-K514 VanDerWaalsContact O-N 3.09Å
515	T	86.3	Confident	87.1	Confident	79 Å²	79	61.5 Å²	61.5	49%	0.485	33%	0.326	S	S	.	.	H	α-helix	trans	-92.9	-27.9	178.8	63.1	0	0	0	0	113.2	K511 I512	K511-T515 PolarHBondContact O-N 2.83Å; K511-T515 PolarHBondContact O-OG1 2.86Å; I512-T515 PolarHBondContact O-N 3.44Å
516	E	82.9	Confident	86.9	Confident	25 Å²	25	65.1 Å²	65.1	12%	0.117	34%	0.342	C	S	.	.			trans	-114.2	85.7	-171.7	-43.4	-54.4	148.9	0	0	110.1	R413 P415 F416 I512 E518 T519	R413-E516 IonicContact CZ-OE1 2.76Å; R413-E516 IonicContact CZ-OE2 2.95Å; R413-E516 IonicContact NH1-OE1 3.92Å; R413-E516 PolarHBondContact NH1-OE1 3.01Å; R413-E516 IonicContact NH1-OE2 2.66Å; R413-E516 IonicContact NH2-OE1 3.8Å; R413-E516 PolarHBondContact NH2-OE1 3.09Å; R413-E516 IonicContact NH2-OE2 3.34Å; R413-E516 PolarHBondContact NH2-OE2 3.41Å; P415-E516 WeakPolarHBondContact CD-OE1 3.44Å; F416-E516 HydrophobicContact CE2-CG 4.07Å; F416-E516 HydrophobicContact CZ-CG 3.79Å; I512-E516 HydrophobicContact CG2-CG 4.3Å; I512-E516 WeakPolarHBondContact O-CB 3.48Å; I512-E516 WeakPolarHBondContact O-CG 3.33Å; I512-E516 PolarHBondContact O-N 3.27Å; E516-E518 PolarHBondContact O-N 2.97Å; E516-T519 HydrophobicContact CB-CG2 3.59Å; E516-T519 HydrophobicContact CG-CG2 4.39Å; E516-T519 PolarHBondContact O-N 3.45Å; E516-T519 PolarHBondContact O-OG1 2.99Å
517	S	70.9	Confident	86.6	Confident	125 Å²	125	68.9 Å²	68.9	87%	0.874	36%	0.359	S	S	*	.	T	Hydrogen-bonded Turn	trans	-51.6	-21.9	177.2	54.5	0	0	0	0	114
518	E	67.8	Low	86.5	Confident	102 Å²	102	63.8 Å²	63.8	48%	0.477	33%	0.334	S	S	.	.	T	Hydrogen-bonded Turn	trans	-85	-2.5	-179.7	-78.8	-168.2	174	0	0	115.3	K331 E516	K331-E518 HydrophobicContact CD-CB 4.19Å; K331-E518 WeakPolarHBondContact CD-OE2 3.43Å; K331-E518 WeakPolarHBondContact CE-OE2 3.44Å; K331-E518 WeakPolarHBondContact CG-OE2 3.27Å; K331-E518 VanDerWaalsContact NZ-CB 3.3Å; K331-E518 PolarHBondContact NZ-O 3.12Å; K331-E518 IonicContact NZ-OE2 3.08Å; E516-E518 PolarHBondContact O-N 2.97Å
519	T	74.6	Confident	86.3	Confident	14 Å²	14	64.1 Å²	64.1	9%	0.086	33%	0.333	C	S	.	.			trans	-102.7	93.5	-176	60.4	0	0	0	0	113.1	V335 F338 F416 I512 E516	V335-T519 HydrophobicContact CG1-CG2 4.16Å; V335-T519 HydrophobicContact CG2-CG2 4.06Å; F338-T519 HydrophobicContact CD1-CG2 4.36Å; F416-T519 HydrophobicContact CZ-CG2 4.21Å; I512-T519 HydrophobicContact CG2-CG2 3.88Å; I512-T519 WeakPolarHBondContact CG2-OG1 3.43Å; E516-T519 HydrophobicContact CB-CG2 3.59Å; E516-T519 HydrophobicContact CG-CG2 4.39Å; E516-T519 PolarHBondContact O-N 3.45Å; E516-T519 PolarHBondContact O-OG1 2.99Å
520	S	81.1	Confident	85.9	Confident	91 Å²	91	68.6 Å²	68.6	64%	0.636	35%	0.352	S	S	*	.	P	Polyproline II helix	trans	-74.5	143.7	163.2	52.8	0	0	0	0	110.8	Q342	Q342-S520 PolarHBondContact NE2-O 3.35Å
521	L	87	Confident	85.2	Confident	7 Å²	7	70.2 Å²	70.2	4%	0.037	36%	0.364	C	S	.	.	P	Polyproline II helix	trans	-87	144.7	163.1	-79.8	-173.7	0	0	0	109.6	F338 Q342 V509 K513 Q526 Y529	F338-L521 HydrophobicContact CE1-CD2 4.22Å; F338-L521 HydrophobicContact CZ-CD2 3.9Å; Q342-L521 HydrophobicContact CG-CD2 4.36Å; Q342-L521 VanDerWaalsContact OE1-CA 3.22Å; V509-L521 HydrophobicContact CG1-CD1 3.9Å; V509-L521 HydrophobicContact CG1-CD2 4.06Å; V509-L521 HydrophobicContact CG1-CG 4.43Å; K513-L521 HydrophobicContact CD-CD1 3.81Å; K513-L521 HydrophobicContact CD-CG 4.02Å; K513-L521 HydrophobicContact CG-CG 4.43Å; L521-Q526 HydrophobicContact CB-CG 3.52Å; L521-Q526 HydrophobicContact CD1-CG 4.45Å; L521-Q526 PolarHBondContact O-NE2 2.91Å; L521-Y529 HydrophobicContact CD1-CD2 4.21Å
522	H	89.8	Confident	84.2	Confident	75 Å²	75	66.4 Å²	66.4	35%	0.347	35%	0.348	S	S	.	.	P	Polyproline II helix	trans	-59.4	137.5	169.2	-179.4	-84.1	0	0	0	110.5	V346 L524 L525 Q526	V346-H522 HydrophobicContact CG2-CB 3.94Å; V346-H522 WeakPolarHBondContact CG2-ND1 3.48Å; H522-L524 PolarHBondContact ND1-N 3.32Å; H522-L524 PolarHBondContact O-N 3.09Å; H522-L525 HydrophobicContact CB-CD1 4.36Å; H522-L525 HydrophobicContact CB-CG 4.28Å; H522-L525 WeakPolarHBondContact O-CA 3.41Å; H522-L525 WeakPolarHBondContact O-CB 3.35Å; H522-L525 PolarHBondContact O-N 2.93Å; H522-Q526 PolarHBondContact O-N 3.12Å
523	P	89.9	Confident	82.6	Confident	91 Å²	91	74.3 Å²	74.3	59%	0.591	38%	0.378	S	S	*	.	H	α-helix	trans	-52.3	-43.9	-172.3	-30.7	36.3	0	0	0	115.2	L525 Q526 E527	P523-L525 VanDerWaalsContact C-N 3.26Å; P523-L525 PolarHBondContact O-N 2.76Å; P523-Q526 WeakPolarHBondContact O-CA 3.21Å; P523-Q526 WeakPolarHBondContact O-CB 3.05Å; P523-Q526 PolarHBondContact O-N 3.43Å; P523-E527 PolarHBondContact O-N 3.4Å; P523-E527 VanDerWaalsContact O-N 3.08Å
524	L	89.6	Confident	82.4	Confident	57 Å²	57	72.7 Å²	72.7	30%	0.298	37%	0.374	S	S	.	.	H	α-helix	trans	-57.8	-37.7	174.8	-178.7	61.7	0	0	0	112.9	V346 V349 H522 I528	V346-L524 HydrophobicContact CG1-CD2 4.22Å; V349-L524 HydrophobicContact CB-CD2 4.33Å; V349-L524 HydrophobicContact CG1-CD2 3.82Å; V349-L524 HydrophobicContact CG1-CG 4.38Å; H522-L524 PolarHBondContact ND1-N 3.32Å; H522-L524 PolarHBondContact O-N 3.09Å; L524-I528 HydrophobicContact CD1-CD1 4.34Å; L524-I528 HydrophobicContact CG-CD1 4.14Å; L524-I528 WeakPolarHBondContact O-CD1 3.39Å; L524-I528 VanDerWaalsContact O-CG1 3.27Å; L524-I528 WeakPolarHBondContact O-CG1 3.14Å; L524-I528 PolarHBondContact O-N 3.02Å
525	L	92.3	Very high	82.1	Confident	5 Å²	5	67.7 Å²	67.7	3%	0.026	36%	0.356	C	S	.	.	H	α-helix	trans	-74.7	-33.3	175.9	-55.8	-176.2	0	0	0	110.9	Q342 T345 V346 H522 P523 E527 I528 Y529	Q342-L525 HydrophobicContact CB-CD1 3.83Å; Q342-L525 HydrophobicContact CG-CD1 3.88Å; T345-L525 HydrophobicContact CG2-CD1 4.36Å; T345-L525 HydrophobicContact CG2-CD2 3.72Å; V346-L525 HydrophobicContact CG2-CD1 4Å; V346-L525 HydrophobicContact CG2-CD2 3.97Å; V346-L525 HydrophobicContact CG2-CG 3.74Å; H522-L525 HydrophobicContact CB-CD1 4.36Å; H522-L525 HydrophobicContact CB-CG 4.28Å; H522-L525 WeakPolarHBondContact O-CA 3.41Å; H522-L525 WeakPolarHBondContact O-CB 3.35Å; H522-L525 PolarHBondContact O-N 2.93Å; P523-L525 VanDerWaalsContact C-N 3.26Å; P523-L525 PolarHBondContact O-N 2.76Å; L525-E527 PolarHBondContact O-N 2.94Å; L525-I528 HydrophobicContact CD2-CD1 4.42Å; L525-I528 PolarHBondContact O-N 2.78Å; L525-Y529 HydrophobicContact CB-CD2 4.35Å; L525-Y529 WeakPolarHBondContact O-CB 3.09Å; L525-Y529 VanDerWaalsContact O-CD2 3.23Å; L525-Y529 WeakPolarHBondContact O-CD2 3.34Å; L525-Y529 PolarHBondContact O-N 2.83Å
526	Q	91	Very high	81.9	Confident	89 Å²	89	67.1 Å²	67.1	42%	0.416	35%	0.348	S	S	.	.	H	α-helix	trans	-57.2	-50	173.4	-64.8	-170.2	41.5	0	0	111.1	L521 H522 P523 I528 Y529 K530	L521-Q526 HydrophobicContact CB-CG 3.52Å; L521-Q526 HydrophobicContact CD1-CG 4.45Å; L521-Q526 PolarHBondContact O-NE2 2.91Å; H522-Q526 PolarHBondContact O-N 3.12Å; P523-Q526 WeakPolarHBondContact O-CA 3.21Å; P523-Q526 WeakPolarHBondContact O-CB 3.05Å; P523-Q526 PolarHBondContact O-N 3.43Å; Q526-I528 VanDerWaalsContact C-N 3.33Å; Q526-I528 PolarHBondContact O-N 3.08Å; Q526-Y529 PolarHBondContact O-N 3.08Å; Q526-K530 WeakPolarHBondContact O-CB 3.48Å; Q526-K530 PolarHBondContact O-N 3.02Å
527	E	89.3	Confident	81.8	Confident	85 Å²	85	69.6 Å²	69.6	40%	0.397	36%	0.362	S	S	.	.	H	α-helix	trans	-68.2	-30.7	-179.4	-173.1	51.1	-125.8	0	0	112.9	K375 P523 L525 K530	K375-E527 WeakPolarHBondContact CE-O 3.42Å; K375-E527 PolarHBondContact NZ-O 3.03Å; K375-E527 IonicContact NZ-OE1 3.32Å; K375-E527 PolarHBondContact NZ-OE1 3.34Å; K375-E527 VanDerWaalsContact NZ-OE1 3.08Å; P523-E527 PolarHBondContact O-N 3.4Å; P523-E527 VanDerWaalsContact O-N 3.08Å; L525-E527 PolarHBondContact O-N 2.94Å; E527-K530 IonicContact OE1-NZ 3.47Å; E527-K530 PolarHBondContact OE1-NZ 2.93Å; E527-K530 WeakPolarHBondContact OE2-CD 3.17Å; E527-K530 IonicContact OE2-NZ 3.01Å; E527-K530 PolarHBondContact OE2-NZ 2.8Å
528	I	91.3	Very high	82.5	Confident	13 Å²	13	66.1 Å²	66.1	7%	0.067	33%	0.33	C	S	.	.	H	α-helix	trans	-68.7	-43.9	172.6	-66.5	162.6	0	0	0	111.5	V349 V378 H379 L524 L525 Q526 M532	V349-I528 HydrophobicContact CG1-CD1 4.02Å; V349-I528 HydrophobicContact CG2-CD1 4.12Å; V378-I528 HydrophobicContact CG2-CD1 4.1Å; V378-I528 HydrophobicContact CG2-CG2 4.22Å; H379-I528 VanDerWaalsContact CE1-CG2 3.45Å; H379-I528 WeakPolarHBondContact CE1-CG2 3.46Å; H379-I528 WeakPolarHBondContact ND1-CG2 3.32Å; L524-I528 HydrophobicContact CD1-CD1 4.34Å; L524-I528 HydrophobicContact CG-CD1 4.14Å; L524-I528 WeakPolarHBondContact O-CD1 3.39Å; L524-I528 VanDerWaalsContact O-CG1 3.27Å; L524-I528 WeakPolarHBondContact O-CG1 3.14Å; L524-I528 PolarHBondContact O-N 3.02Å; L525-I528 HydrophobicContact CD2-CD1 4.42Å; L525-I528 PolarHBondContact O-N 2.78Å; Q526-I528 VanDerWaalsContact C-N 3.33Å; Q526-I528 PolarHBondContact O-N 3.08Å; I528-M532 HydrophobicContact CG2-SD 4.42Å; I528-M532 WeakPolarHBondContact O-CB 3.49Å
529	Y	88.6	Confident	83.5	Confident	35 Å²	35	63.7 Å²	63.7	14%	0.137	32%	0.32	C	S	.	.	H	α-helix	trans	-79	-17	179.3	-81.9	-73.7	0	0	0	114.2	H379 N505 A506 L521 L525 Q526 M532	H379-Y529 PolarHBondContact CD2-OH 3.01Å; H379-Y529 AromaticContact CE1-CE2 3.37Å; H379-Y529 WeakPolarHBondContact CE1-CE2 3.48Å; H379-Y529 AromaticContact CE1-CZ 3.41Å; H379-Y529 VanDerWaalsContact CE1-CZ 3.41Å; H379-Y529 PolarHBondContact CE1-OH 3.47Å; H379-Y529 VanDerWaalsContact CE1-OH 3.31Å; H379-Y529 AromaticContact NE2-CE2 3.48Å; H379-Y529 WeakPolarHBondContact NE2-CE2 3.4Å; H379-Y529 AromaticContact NE2-CZ 3.44Å; H379-Y529 PolarHBondContact NE2-OH 3.49Å; N505-Y529 PolarHBondContact ND2-OH 3.28Å; A506-Y529 HydrophobicContact CB-CD1 4.1Å; A506-Y529 HydrophobicContact CB-CE1 3.9Å; L521-Y529 HydrophobicContact CD1-CD2 4.21Å; L525-Y529 HydrophobicContact CB-CD2 4.35Å; L525-Y529 WeakPolarHBondContact O-CB 3.09Å; L525-Y529 VanDerWaalsContact O-CD2 3.23Å; L525-Y529 WeakPolarHBondContact O-CD2 3.34Å; L525-Y529 PolarHBondContact O-N 2.83Å; Q526-Y529 PolarHBondContact O-N 3.08Å; Y529-M532 HydrophobicContact CD1-CE 3.54Å; Y529-M532 HydrophobicContact CE1-CE 3.55Å; Y529-M532 PolarHBondContact O-N 2.7Å
530	K	85.1	Confident	84.1	Confident	101 Å²	101	67.3 Å²	67.3	44%	0.439	34%	0.337	S	S	.	.	T	Hydrogen-bonded Turn	trans	-68.6	128.4	178.2	178.4	-158.1	166.1	-161.4	0	109.3	K375 Q526 E527 M532	K375-K530 WeakPolarHBondContact CE-O 3.14Å; K375-K530 PolarHBondContact NZ-O 3.31Å; Q526-K530 WeakPolarHBondContact O-CB 3.48Å; Q526-K530 PolarHBondContact O-N 3.02Å; E527-K530 IonicContact OE1-NZ 3.47Å; E527-K530 PolarHBondContact OE1-NZ 2.93Å; E527-K530 WeakPolarHBondContact OE2-CD 3.17Å; E527-K530 IonicContact OE2-NZ 3.01Å; E527-K530 PolarHBondContact OE2-NZ 2.8Å; K530-M532 PolarHBondContact O-N 2.67Å; K530-M532 VanDerWaalsContact O-N 3.12Å
531	D	76.9	Confident	84.3	Confident	121 Å²	121	65.5 Å²	65.5	65%	0.647	31%	0.314	S	S	*	.	T	Hydrogen-bonded Turn	trans	58.8	18.7	-177.9	-39.3	-40.3	0	0	0	113.8	Y533	D531-Y533 PolarHBondContact O-N 2.66Å
532	M	70.7	Confident	84.1	Confident	6 Å²	6	70.3 Å²	70.3	3%	0.03	34%	0.337	C	S	.	.			trans	-92.3	87.5	179.8	-164.2	-171	78.6	0	0	110.6	Y376 V502 A506 I528 Y529 K530	Y376-M532 HydrophobicContact CD1-CG 4.17Å; Y376-M532 HydrophobicContact CE1-CG 4.03Å; V502-M532 HydrophobicContact CG1-CE 3.88Å; V502-M532 HydrophobicContact CG1-SD 4.49Å; A506-M532 HydrophobicContact CB-CE 3.82Å; I528-M532 HydrophobicContact CG2-SD 4.42Å; I528-M532 WeakPolarHBondContact O-CB 3.49Å; Y529-M532 HydrophobicContact CD1-CE 3.54Å; Y529-M532 HydrophobicContact CE1-CE 3.55Å; Y529-M532 PolarHBondContact O-N 2.7Å; K530-M532 PolarHBondContact O-N 2.67Å; K530-M532 VanDerWaalsContact O-N 3.12Å
533	Y	54.9	Low	83.6	Confident	166 Å²	166	69.9 Å²	69.9	65%	0.651	34%	0.336	S	S	*	.			trans	76.1	0	-174.1	-46.2	-73.2	0	0	0	115.4	V502 D531	V502-Y533 HydrophobicContact CG1-CE2 4.25Å; D531-Y533 PolarHBondContact O-N 2.66Å

Retrieved 533 of 533 residues in 1263.3 ms (Link to these results)

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