A0A087XGI9_POEFO Loading...

Rho GTPase activating protein 40

GTPase activator for the Rho-type GTPases by converting them to an inactive GDP-bound state.

AlphaFold DB , UniProt , Accession A0A087XGI9, Species POEFO (Poecilia formosa, Amazon molly), Gene n/a, Length 682 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	40.9	Very low	30.6	Very low	248 Å²	248	169.1 Å²	169.1	100%	1.222	89%	0.891	S	S	*	*				0	113	0	-58.2	-164.8	-89.5	0	0	107
2	G	30.2	Very low	30.3	Very low	86 Å²	86	169.8 Å²	169.8	89%	0.887	89%	0.89	S	S	*	*			cis	93.4	107.7	8.4	0	0	0	0	0	111.7
3	G	27.4	Very low	30.2	Very low	84 Å²	84	166.9 Å²	166.9	87%	0.866	87%	0.869	S	S	*	*			trans	150.7	111.9	174.9	0	0	0	0	0	113.7
4	R	32.4	Very low	30.2	Very low	243 Å²	243	163.9 Å²	163.9	92%	0.917	87%	0.865	S	S	*	*			trans	-108.9	143.2	165.3	-70.2	172.9	171.8	168.4	-4.3	108
5	E	33	Very low	30	Very low	188 Å²	188	166.7 Å²	166.7	88%	0.879	87%	0.867	S	S	*	*			trans	-166.2	115.8	148.9	-108.9	156.7	-162	0	0	107
6	K	29.9	Very low	29.8	Very low	191 Å²	191	167.4 Å²	167.4	83%	0.83	87%	0.867	S	S	*	*				60.9	102.8	66.1	-83.9	-161.4	171.4	-169.1	0	114.5
7	V	31.4	Very low	29.7	Very low	152 Å²	152	168.9 Å²	168.9	92%	0.921	87%	0.869	S	S	*	*			trans	-132.7	145	147.3	-179.7	0	0	0	0	107.6
8	E	27.8	Very low	29.5	Very low	173 Å²	173	170.2 Å²	170.2	81%	0.808	87%	0.867	S	S	*	*			trans	-92.6	148.2	-161	-58	174.3	127.9	0	0	113.7
9	L	29.2	Very low	29.4	Very low	179 Å²	179	166.9 Å²	166.9	94%	0.937	86%	0.861	S	S	*	*			trans	-113.1	99.5	163.5	-93.4	163.5	0	0	0	108.9	R11	L9-R11 PolarHBondContact O-N 3.47Å
10	S	27.6	Very low	29.4	Very low	106 Å²	106	167.5 Å²	167.5	74%	0.741	86%	0.86	S	S	*	*			trans	-75	110.3	-178.3	48.8	0	0	0	0	111.7	M12	S10-M12 PolarHBondContact O-N 3.26Å; S10-M12 VanDerWaalsContact O-N 3.16Å
11	R	27	Very low	29.3	Very low	210 Å²	210	169 Å²	169	79%	0.792	86%	0.86	S	S	*	*			trans	-76	96.3	172.4	177.7	175.6	167.4	163.3	-5.1	109.8	L9 E13	L9-R11 PolarHBondContact O-N 3.47Å; R11-E13 HydrophobicContact CG-CG 4.35Å; R11-E13 IonicContact CZ-OE1 3.89Å; R11-E13 IonicContact NE-OE1 3.85Å; R11-E13 PolarHBondContact NE-OE1 2.9Å; R11-E13 IonicContact NH2-OE1 2.76Å; R11-E13 PolarHBondContact NH2-OE1 2.95Å
12	M	27.3	Very low	28.7	Very low	178 Å²	178	168.2 Å²	168.2	88%	0.877	84%	0.844	S	S	*	*			trans	-83	112.1	168.8	-82.2	-162.7	168.6	0	0	111.3	S10	S10-M12 PolarHBondContact O-N 3.26Å; S10-M12 VanDerWaalsContact O-N 3.16Å
13	E	28	Very low	28.6	Very low	132 Å²	132	172.3 Å²	172.3	62%	0.617	84%	0.844	S	S	*	*			trans	-96.8	123.3	167.3	-69.1	-178.2	172.6	0	0	110.3	R11 K15	R11-E13 HydrophobicContact CG-CG 4.35Å; R11-E13 IonicContact CZ-OE1 3.89Å; R11-E13 IonicContact NE-OE1 3.85Å; R11-E13 PolarHBondContact NE-OE1 2.9Å; R11-E13 IonicContact NH2-OE1 2.76Å; R11-E13 PolarHBondContact NH2-OE1 2.95Å; E13-K15 PolarHBondContact O-N 3.32Å
14	P	31	Very low	28.5	Very low	125 Å²	125	175 Å²	175	81%	0.812	84%	0.839	S	S	*	*			trans	-77.9	114.8	169.9	-10.8	27.4	0	0	0	110.5	M16	P14-M16 PolarHBondContact O-N 3.23Å
15	K	26.8	Very low	28.4	Very low	206 Å²	206	169.5 Å²	169.5	90%	0.896	83%	0.833	S	S	*	*			trans	-63.7	129.1	170.4	-65.5	171.1	179	173	0	110.1	E13	E13-K15 PolarHBondContact O-N 3.32Å
16	M	27.5	Very low	28.1	Very low	177 Å²	177	170 Å²	170	87%	0.872	83%	0.832	S	S	*	*			trans	-107.8	129.8	160.2	-78	-162.9	175.7	0	0	110.5	P14	P14-M16 PolarHBondContact O-N 3.23Å
17	H	27	Very low	28	Very low	193 Å²	193	169.7 Å²	169.7	89%	0.894	83%	0.831	S	S	*	*			trans	-70.7	126.1	176.5	-83.6	-75.8	0	0	0	111.3
18	F	26.9	Very low	27.8	Very low	193 Å²	193	169.1 Å²	169.1	85%	0.846	82%	0.822	S	S	*	*			trans	-85.6	115.9	162.6	-82.1	-89.8	0	0	0	110.1	H20	F18-H20 PolarHBondContact O-N 3.39Å
19	S	27.8	Very low	27.7	Very low	107 Å²	107	172.4 Å²	172.4	75%	0.748	83%	0.827	S	S	*	*			trans	-81.3	104.8	170.5	45.4	0	0	0	0	110.5	F21	S19-F21 PolarHBondContact O-N 3.37Å
20	H	28.5	Very low	27.6	Very low	179 Å²	179	170.5 Å²	170.5	83%	0.829	82%	0.817	S	S	*	*	P	Polyproline II helix	trans	-65.7	116.5	170.1	-80.6	-93.5	0	0	0	110.8	F18	F18-H20 PolarHBondContact O-N 3.39Å
21	F	27.1	Very low	27.5	Very low	200 Å²	200	172 Å²	172	88%	0.877	82%	0.817	S	S	*	*	P	Polyproline II helix	trans	-101.5	132.7	159.3	-98.7	-87.5	0	0	0	110.8	S19	S19-F21 PolarHBondContact O-N 3.37Å
22	R	28	Very low	27.5	Very low	231 Å²	231	170 Å²	170	87%	0.872	82%	0.816	S	S	*	*	P	Polyproline II helix	trans	-78.4	136.2	-169.7	-66.2	178.4	175	-177.7	-2.3	111.9	N24	R22-N24 PolarHBondContact O-N 3.16Å
23	L	28.1	Very low	27.6	Very low	172 Å²	172	168.4 Å²	168.4	90%	0.901	81%	0.811	S	S	*	*	P	Polyproline II helix	trans	-72.3	116.5	161.1	-77.2	156.1	0	0	0	109
24	N	27.1	Very low	28.3	Very low	139 Å²	139	166.8 Å²	166.8	74%	0.743	81%	0.812	S	S	*	*			trans	-93.3	110	168.6	-96	0.9	0	0	0	110.3	R22	R22-N24 PolarHBondContact O-N 3.16Å
25	T	29.1	Very low	28.1	Very low	129 Å²	129	167 Å²	167	79%	0.791	81%	0.811	S	S	*	*			trans	-70.5	133.9	164.8	46.2	0	0	0	0	111.2
26	F	26.2	Very low	28.1	Very low	199 Å²	199	161.9 Å²	161.9	87%	0.873	80%	0.8	S	S	*	*			trans	-131.3	138.8	154.9	-91.5	-84.1	0	0	0	109.7
27	K	28.8	Very low	28	Very low	184 Å²	184	162.1 Å²	162.1	80%	0.8	80%	0.799	S	S	*	*			trans	-142.9	137.2	-173.9	-138.5	-169	-177.3	-179.6	0	109.5
28	L	27.8	Very low	28.1	Very low	140 Å²	140	161.4 Å²	161.4	73%	0.733	79%	0.793	S	S	*	*			trans	69.3	138.6	163.9	-57.3	161.8	0	0	0	115.6
29	R	24.2	Very low	28.2	Very low	241 Å²	241	162.7 Å²	162.7	91%	0.909	80%	0.799	S	S	*	*			cis	-145.4	171.3	46.8	-80.4	-179.3	173.4	164.8	-1	114.7
30	L	27.4	Very low	28.2	Very low	140 Å²	140	168.4 Å²	168.4	73%	0.733	80%	0.804	S	S	*	*			trans	-71.3	159.7	167.2	-55.6	81.3	0	0	0	110.5
31	D	26.2	Very low	28.1	Very low	138 Å²	138	167.6 Å²	167.6	74%	0.738	80%	0.802	S	S	*	*				-169.7	155.3	100.5	-113	-43.5	0	0	0	117
32	H	27.7	Very low	28.2	Very low	168 Å²	168	166 Å²	166	78%	0.778	80%	0.795	S	S	*	*			trans	64.4	117.5	151.2	-80.3	42.8	0	0	0	123.4
33	N	29.3	Very low	28.2	Very low	143 Å²	143	164.5 Å²	164.5	77%	0.765	80%	0.795	S	S	*	*			trans	-76	159.2	153.2	-155.8	2	0	0	0	109
34	P	41.7	Very low	28.2	Very low	99 Å²	99	162.4 Å²	162.4	64%	0.643	79%	0.789	S	S	*	*				-154.8	152.5	102.4	37.7	-19.6	0	0	0	118
35	T	27.9	Very low	28.3	Very low	129 Å²	129	161 Å²	161	79%	0.791	79%	0.791	S	S	*	*			trans	62.4	165.2	145.8	53.4	0	0	0	0	121.3
36	C	25.1	Very low	28.2	Very low	98 Å²	98	160.1 Å²	160.1	66%	0.662	79%	0.789	S	S	*	*			cis	177.7	121.9	-42.9	-179.5	0	0	0	0	108
37	E	26.7	Very low	28.4	Very low	183 Å²	183	159.9 Å²	159.9	86%	0.855	79%	0.788	S	S	*	*			trans	-176.1	113.5	150.1	-105.1	-176.2	178.2	0	0	108.6
38	K	28.7	Very low	28.5	Very low	177 Å²	177	160.1 Å²	160.1	77%	0.77	79%	0.789	S	S	*	*				59.2	104.1	77.4	-68.7	-179.7	-178.8	166.7	0	115.6
39	K	28.2	Very low	28.6	Very low	221 Å²	221	163.4 Å²	163.4	96%	0.961	80%	0.797	S	S	*	*				-153.2	157.8	119.6	-110.1	162.9	-170.7	171.2	0	111.7
40	R	27.8	Very low	29	Very low	227 Å²	227	156 Å²	156	86%	0.857	79%	0.787	S	S	*	*			trans	-154.7	136.2	-156.8	166.9	-162.8	-174.4	-165.7	7	109
41	M	27.6	Very low	29	Very low	162 Å²	162	160.8 Å²	160.8	80%	0.798	80%	0.796	S	S	*	*			trans	-162.3	114.5	149.6	-82.7	-118.4	-177.7	0	0	108.1
42	K	29.2	Very low	29.4	Very low	165 Å²	165	161.4 Å²	161.4	72%	0.717	80%	0.799	S	S	*	*				73.4	108	94.4	-75.8	-174.8	176.7	178.6	0	112.8
43	K	28.2	Very low	30.1	Very low	201 Å²	201	159.6 Å²	159.6	87%	0.874	80%	0.802	S	S	*	*				67.6	126	80.4	-79.2	-167.5	173.2	-173.6	0	112.6
44	T	26.9	Very low	30.3	Very low	127 Å²	127	158.1 Å²	158.1	78%	0.779	80%	0.803	S	S	*	*				-156.9	128.8	82	35	0	0	0	0	112.9
45	S	29.7	Very low	30.7	Very low	111 Å²	111	158.6 Å²	158.6	78%	0.776	81%	0.806	S	S	*	*				54.6	137.8	99.9	67	0	0	0	0	117.1
46	S	28.1	Very low	30.8	Very low	109 Å²	109	158.4 Å²	158.4	76%	0.762	81%	0.805	S	S	*	*			cis	-156.2	146.3	38.6	46	0	0	0	0	113.3
47	K	30	Very low	31	Very low	195 Å²	195	162 Å²	162	85%	0.848	81%	0.812	S	S	*	*				58.6	127.7	74.8	-103.3	-178.7	-176.9	179.9	0	113.9
48	K	29.4	Very low	31	Very low	188 Å²	188	161.2 Å²	161.2	82%	0.817	81%	0.811	S	S	*	*			cis	-155.7	150.5	41.5	-79.7	170.6	179.3	172.8	0	111.3
49	K	30.2	Very low	30.9	Very low	209 Å²	209	158.2 Å²	158.2	91%	0.909	81%	0.812	S	S	*	*				48.5	142.7	89.7	-81.4	-164.8	171.2	-170.3	0	116.6
50	A	32.2	Very low	31	Very low	85 Å²	85	154.5 Å²	154.5	70%	0.702	81%	0.807	S	S	*	*			cis	-179.3	172.8	-9.3	0	0	0	0	0	112.3
51	R	29.1	Very low	31.1	Very low	242 Å²	242	151 Å²	151	91%	0.913	80%	0.801	S	S	*	*			trans	95.8	136.1	155.9	-75.3	-178.3	166.3	166.6	-6.3	122.3
52	D	33.3	Very low	31.8	Very low	151 Å²	151	148.1 Å²	148.1	81%	0.807	79%	0.794	S	S	*	*			trans	-77.1	173.7	164.3	-38.3	-80.9	0	0	0	112.7
53	P	43.1	Very low	31.8	Very low	129 Å²	129	151.2 Å²	151.2	84%	0.838	80%	0.802	S	S	*	*				-148.2	173.1	82.5	39.3	-20.6	0	0	0	117.5
54	S	33.4	Very low	31.7	Very low	113 Å²	113	145.2 Å²	145.2	79%	0.79	79%	0.789	S	S	*	*			trans	-85.6	-178.9	164.7	-134.4	0	0	0	0	110.9
55	P	50.8	Low	31.9	Very low	109 Å²	109	144.4 Å²	144.4	71%	0.708	79%	0.789	S	S	*	*			cis	-155.2	-155.7	47.4	39.6	-13.1	0	0	0	117.4
56	T	29.3	Very low	32.6	Very low	124 Å²	124	144.4 Å²	144.4	76%	0.761	79%	0.786	S	S	*	*			trans	90.4	147.7	155.4	-33.4	0	0	0	0	118.7
57	E	28.5	Very low	32.7	Very low	173 Å²	173	147.3 Å²	147.3	81%	0.808	79%	0.788	S	S	*	*				-169.5	177.9	-52	-132.4	177.9	-174.7	0	0	111.2
58	M	26.6	Very low	32.6	Very low	168 Å²	168	144.2 Å²	144.2	83%	0.828	78%	0.78	S	S	*	*			trans	78	128.2	172.6	-50.3	-158.7	-65.6	0	0	117.7
59	S	28.1	Very low	32.5	Very low	114 Å²	114	144.4 Å²	144.4	80%	0.797	78%	0.784	S	S	*	*			cis	78	135.9	43.4	-55	0	0	0	0	112.6
60	V	29.1	Very low	32.4	Very low	143 Å²	143	138.9 Å²	138.9	87%	0.867	78%	0.777	S	S	*	*			cis	-151.3	163.5	31.5	-173.8	0	0	0	0	112
61	E	30.3	Very low	32.1	Very low	154 Å²	154	139.8 Å²	139.8	72%	0.72	79%	0.785	S	S	*	*			trans	-72.4	-165.5	167.1	-84	-162.7	-109	0	0	114.1
62	P	42.6	Very low	32	Very low	101 Å²	101	133.1 Å²	133.1	66%	0.656	78%	0.782	S	S	*	*			cis	-145.3	160.9	6.3	41.7	-20.8	0	0	0	121.2
63	W	28.3	Very low	31.8	Very low	230 Å²	230	134.4 Å²	134.4	87%	0.871	78%	0.783	S	S	*	*			trans	61.2	152.5	138.3	-70	44.9	0	0	0	121
64	A	27.5	Very low	31.1	Very low	74 Å²	74	137.2 Å²	137.2	61%	0.612	78%	0.784	S	S	*	*			cis	-160.9	147.4	4.9	0	0	0	0	0	114.6
65	S	30.7	Very low	30.9	Very low	110 Å²	110	136.3 Å²	136.3	77%	0.769	78%	0.784	S	S	*	*				66	164.4	128.7	-63.1	0	0	0	0	124.1
66	P	44.7	Very low	29.8	Very low	112 Å²	112	142.8 Å²	142.8	73%	0.727	79%	0.794	S	S	*	*			cis	-139.6	170.5	-34.8	37.2	-20.7	0	0	0	115.1
67	Q	29.2	Very low	29.6	Very low	170 Å²	170	142 Å²	142	79%	0.794	79%	0.793	S	S	*	*				-161.7	129.3	125.4	-111.8	-173.5	-66.7	0	0	114.6
68	D	28.6	Very low	29.5	Very low	130 Å²	130	142.8 Å²	142.8	70%	0.695	79%	0.794	S	S	*	*			trans	64.1	90.5	147.9	-53.1	-18.8	0	0	0	122.2
69	Q	27.6	Very low	29.6	Very low	191 Å²	191	142.9 Å²	142.9	89%	0.893	80%	0.798	S	S	*	*			trans	-64.2	169.2	136.7	-57	170.7	-11.3	0	0	109.1
70	A	27.3	Very low	29.5	Very low	93 Å²	93	142.6 Å²	142.6	77%	0.769	80%	0.796	S	S	*	*			cis	-161.9	159.7	26.7	0	0	0	0	0	111.9
71	A	26.6	Very low	29.5	Very low	104 Å²	104	141.3 Å²	141.3	86%	0.86	79%	0.791	S	S	*	*				167.2	89.9	122.4	0	0	0	0	0	110.6
72	A	27.4	Very low	29.4	Very low	102 Å²	102	140.1 Å²	140.1	84%	0.843	80%	0.796	S	S	*	*			trans	-143.2	100.5	165.8	0	0	0	0	0	109.6
73	E	28.6	Very low	28.7	Very low	179 Å²	179	139.5 Å²	139.5	84%	0.836	80%	0.8	S	S	*	*			trans	-136.7	113.3	162.2	-74.6	-158.5	147.4	0	0	109.7
74	H	26.8	Very low	28.8	Very low	187 Å²	187	137.5 Å²	137.5	87%	0.866	80%	0.8	S	S	*	*				-173.4	93.8	120.7	-96.9	33.8	0	0	0	108.1
75	A	29.4	Very low	29	Very low	94 Å²	94	142.7 Å²	142.7	78%	0.777	81%	0.812	S	S	*	*			trans	-84.7	145.4	175.1	0	0	0	0	0	111
76	R	27.5	Very low	29	Very low	246 Å²	246	146.3 Å²	146.3	93%	0.928	82%	0.816	S	S	*	*				177.4	134.1	120.5	-96.7	163.2	-175.5	-161.2	2.1	114.5
77	S	25.3	Very low	28.6	Very low	106 Å²	106	146.5 Å²	146.5	74%	0.741	81%	0.807	S	S	*	*			trans	68.1	107.2	143.5	-161.5	0	0	0	0	120.1
78	K	26.3	Very low	28.9	Very low	191 Å²	191	144.8 Å²	144.8	83%	0.83	80%	0.799	S	S	*	*				-173.7	136	102.4	-97.9	164.8	-175.5	176	0	112.2
79	N	28.7	Very low	29.6	Very low	169 Å²	169	143 Å²	143	90%	0.904	80%	0.795	S	S	*	*			trans	-80.2	131.2	169.7	-76.8	-20.1	0	0	0	110.7
80	S	26.7	Very low	30.8	Very low	109 Å²	109	138.1 Å²	138.1	76%	0.762	78%	0.775	S	S	*	*			trans	-150.3	144	161.2	-70.9	0	0	0	0	108.2
81	P	29.8	Very low	32.5	Very low	116 Å²	116	139.8 Å²	139.8	75%	0.753	77%	0.765	S	S	*	*	P	Polyproline II helix	trans	-66.4	154.1	176.4	29.8	-34.9	0	0	0	110.6	A83	P81-A83 PolarHBondContact O-N 2.8Å; P81-A83 VanDerWaalsContact O-N 3.1Å
82	P	28.7	Very low	34.2	Very low	129 Å²	129	138 Å²	138	84%	0.838	74%	0.741	S	S	*	*	P	Polyproline II helix	trans	-64.6	117.2	-176.9	26.6	-33.6	0	0	0	110	Q84	P82-Q84 PolarHBondContact O-N 3.16Å
83	A	27.4	Very low	36.2	Very low	88 Å²	88	133.5 Å²	133.5	73%	0.727	70%	0.703	S	S	*	*	P	Polyproline II helix	trans	-60.8	135.5	162	0	0	0	0	0	107.8	P81 E85	P81-A83 PolarHBondContact O-N 2.8Å; P81-A83 VanDerWaalsContact O-N 3.1Å; A83-E85 PolarHBondContact O-N 2.73Å; A83-E85 VanDerWaalsContact O-N 3.12Å
84	Q	30	Very low	38.5	Very low	187 Å²	187	126.1 Å²	126.1	87%	0.874	67%	0.669	S	S	*	*	P	Polyproline II helix	trans	-56.8	120.7	167.2	-67.1	174.3	-62.5	0	0	107.6	P82 Q86	P82-Q84 PolarHBondContact O-N 3.16Å; Q84-Q86 PolarHBondContact O-N 2.99Å
85	E	31.1	Very low	40.9	Very low	183 Å²	183	122.6 Å²	122.6	86%	0.855	65%	0.653	S	S	*	*			trans	-59.4	107.3	167.7	-70.1	-171.4	138.1	0	0	107.3	A83 E87	A83-E85 PolarHBondContact O-N 2.73Å; A83-E85 VanDerWaalsContact O-N 3.12Å; E85-E87 PolarHBondContact O-N 3.36Å
86	Q	32.3	Very low	43.3	Very low	186 Å²	186	119.2 Å²	119.2	87%	0.869	62%	0.624	S	S	*	*			trans	-69.6	88.9	166	-74.8	-178.4	-41.1	0	0	106.7	Q84 Q88	Q84-Q86 PolarHBondContact O-N 2.99Å; Q86-Q88 PolarHBondContact O-N 3.27Å; Q86-Q88 VanDerWaalsContact O-N 3.12Å
87	E	35.7	Very low	45.8	Very low	116 Å²	116	107.8 Å²	107.8	54%	0.542	58%	0.581	S	S	.	*			trans	-47.9	122	169.5	-68.8	-171.4	128	0	0	108.5	E85	E85-E87 PolarHBondContact O-N 3.36Å
88	Q	35.1	Very low	48.4	Very low	134 Å²	134	106.8 Å²	106.8	63%	0.626	56%	0.561	S	S	*	*			trans	-56.2	130	-176.4	-71.8	179.2	-25.4	0	0	109	Q86 D90 K91	Q86-Q88 PolarHBondContact O-N 3.27Å; Q86-Q88 VanDerWaalsContact O-N 3.12Å; Q88-D90 PolarHBondContact O-N 2.91Å; Q88-K91 WeakPolarHBondContact O-CB 3.48Å; Q88-K91 PolarHBondContact O-N 2.67Å
89	P	42.8	Very low	50.9	Low	92 Å²	92	101 Å²	101	60%	0.597	54%	0.544	S	S	*	.	H	α-helix	trans	-58.5	-22.2	-173.5	21.3	-32.9	0	0	0	113.3	C93	P89-C93 WeakPolarHBondContact O-CB 3.09Å; P89-C93 PolarHBondContact O-N 3.02Å
90	D	54.4	Low	53.6	Low	90 Å²	90	93.5 Å²	93.5	48%	0.481	50%	0.504	S	S	.	.	H	α-helix	trans	-69	-31.3	175.3	-61	-32.4	0	0	0	113.5	Q88 C93 L94	Q88-D90 PolarHBondContact O-N 2.91Å; D90-C93 PolarHBondContact O-N 3.16Å; D90-L94 WeakPolarHBondContact O-CG 3.38Å; D90-L94 PolarHBondContact O-N 2.6Å
91	K	61	Low	56.1	Low	127 Å²	127	89.7 Å²	89.7	55%	0.552	48%	0.476	S	S	*	.	H	α-helix	trans	-64.3	-55.1	174.6	-85.3	-168.5	172.8	-172.8	0	111.1	Q88 C93 L94 E95	Q88-K91 WeakPolarHBondContact O-CB 3.48Å; Q88-K91 PolarHBondContact O-N 2.67Å; K91-C93 PolarHBondContact O-N 3.31Å; K91-L94 PolarHBondContact O-N 3.4Å; K91-E95 PolarHBondContact O-N 3.47Å
92	L	62.8	Low	58.4	Low	67 Å²	67	87.1 Å²	87.1	35%	0.351	45%	0.454	S	S	.	.	H	α-helix	trans	-59.4	-30.2	179.1	-66.4	171.3	0	0	0	112.1	S96	L92-S96 WeakPolarHBondContact O-CB 3.4Å; L92-S96 PolarHBondContact O-N 2.96Å; L92-S96 VanDerWaalsContact O-N 3.1Å; L92-S96 PolarHBondContact O-OG 3.22Å
93	C	70.1	Confident	60.8	Low	7 Å²	7	82.9 Å²	82.9	5%	0.047	43%	0.426	C	S	.	.	H	α-helix	trans	-69.3	-46.4	174.4	-163.8	0	0	0	0	112.3	P89 D90 K91 S96 F97 W488 T492	P89-C93 WeakPolarHBondContact O-CB 3.09Å; P89-C93 PolarHBondContact O-N 3.02Å; D90-C93 PolarHBondContact O-N 3.16Å; K91-C93 PolarHBondContact O-N 3.31Å; C93-S96 WeakPolarHBondContact O-CB 3.15Å; C93-S96 PolarHBondContact O-N 3.38Å; C93-F97 PolarHBondContact O-N 3.18Å; C93-F97 VanDerWaalsContact O-N 3.1Å; C93-W488 PolarHBondContact SG-NE1 3.14Å; C93-W488 VanDerWaalsContact SG-NE1 3.42Å; C93-T492 VanDerWaalsContact O-CG2 3.3Å; C93-T492 WeakPolarHBondContact O-CG2 3.36Å; C93-T492 WeakPolarHBondContact SG-CB 3.24Å; C93-T492 VanDerWaalsContact SG-CG2 3.59Å; C93-T492 PolarHBondContact SG-OG1 2.93Å
94	L	76.4	Confident	63.2	Low	25 Å²	25	79.4 Å²	79.4	13%	0.131	40%	0.395	C	S	.	.	H	α-helix	trans	-65.2	-39.4	175.8	-74.7	166	0	0	0	112.1	D90 K91 S96 F97 W98 K514 A517 E518	D90-L94 WeakPolarHBondContact O-CG 3.38Å; D90-L94 PolarHBondContact O-N 2.6Å; K91-L94 PolarHBondContact O-N 3.4Å; L94-S96 VanDerWaalsContact C-N 3.28Å; L94-S96 PolarHBondContact O-N 3.5Å; L94-F97 VanDerWaalsContact O-CB 3.3Å; L94-F97 WeakPolarHBondContact O-CB 3.1Å; L94-F97 PolarHBondContact O-N 3.24Å; L94-F97 VanDerWaalsContact O-N 3.14Å; L94-W98 PolarHBondContact O-N 2.96Å; L94-K514 HydrophobicContact CD1-CG 4.37Å; L94-A517 HydrophobicContact CD2-CB 3.88Å; L94-E518 HydrophobicContact CD2-CG 4.3Å
95	E	77.6	Confident	65.3	Low	113 Å²	113	78.5 Å²	78.5	53%	0.528	38%	0.383	S	S	.	.	H	α-helix	trans	-61.5	-37.8	172.6	-72.4	177.4	-175.7	0	0	112.1	K91 F97 W98 S99	K91-E95 PolarHBondContact O-N 3.47Å; E95-F97 VanDerWaalsContact C-N 3.31Å; E95-F97 PolarHBondContact O-N 3.18Å; E95-W98 PolarHBondContact O-N 3.28Å; E95-S99 VanDerWaalsContact O-CB 3.3Å; E95-S99 WeakPolarHBondContact O-CB 3.36Å; E95-S99 PolarHBondContact O-N 2.85Å
96	S	79.6	Confident	67	Low	23 Å²	23	76.8 Å²	76.8	16%	0.161	38%	0.375	C	S	.	.	H	α-helix	trans	-64.4	-34	174.4	-57.1	0	0	0	0	112.4	L92 C93 L94 E100	L92-S96 WeakPolarHBondContact O-CB 3.4Å; L92-S96 PolarHBondContact O-N 2.96Å; L92-S96 VanDerWaalsContact O-N 3.1Å; L92-S96 PolarHBondContact O-OG 3.22Å; C93-S96 WeakPolarHBondContact O-CB 3.15Å; C93-S96 PolarHBondContact O-N 3.38Å; L94-S96 VanDerWaalsContact C-N 3.28Å; L94-S96 PolarHBondContact O-N 3.5Å; S96-E100 PolarHBondContact O-N 2.95Å
97	F	80.6	Confident	68.2	Low	6 Å²	6	70.1 Å²	70.1	3%	0.026	36%	0.356	C	S	.	.	H	α-helix	trans	-62.9	-53.8	170.9	-175.8	-91	0	0	0	110.9	C93 L94 E95 S99 E100 V101 T492 P496 A517	C93-F97 PolarHBondContact O-N 3.18Å; C93-F97 VanDerWaalsContact O-N 3.1Å; L94-F97 VanDerWaalsContact O-CB 3.3Å; L94-F97 WeakPolarHBondContact O-CB 3.1Å; L94-F97 PolarHBondContact O-N 3.24Å; L94-F97 VanDerWaalsContact O-N 3.14Å; E95-F97 VanDerWaalsContact C-N 3.31Å; E95-F97 PolarHBondContact O-N 3.18Å; F97-S99 PolarHBondContact O-N 2.68Å; F97-E100 WeakPolarHBondContact O-CB 3.28Å; F97-E100 PolarHBondContact O-N 3.27Å; F97-E100 VanDerWaalsContact O-N 3.11Å; F97-V101 HydrophobicContact CD1-CG2 3.74Å; F97-V101 HydrophobicContact CE1-CG2 3.46Å; F97-V101 VanDerWaalsContact CE1-CG2 3.46Å; F97-V101 HydrophobicContact CG-CG2 4.46Å; F97-V101 HydrophobicContact CZ-CG2 3.98Å; F97-V101 WeakPolarHBondContact O-CG2 3.42Å; F97-V101 PolarHBondContact O-N 3.14Å; F97-T492 HydrophobicContact CB-CG2 3.66Å; F97-T492 HydrophobicContact CD2-CG2 4.11Å; F97-T492 WeakPolarHBondContact CD2-O 3.27Å; F97-T492 HydrophobicContact CG-CG2 4.35Å; F97-P496 HydrophobicContact CD2-CG 3.51Å; F97-P496 HydrophobicContact CE2-CG 3.51Å; F97-P496 HydrophobicContact CG-CG 4.17Å; F97-P496 HydrophobicContact CZ-CG 4.17Å; F97-A517 HydrophobicContact CB-CB 4.36Å; F97-A517 HydrophobicContact CD1-CB 3.53Å; F97-A517 HydrophobicContact CD2-CB 3.76Å; F97-A517 HydrophobicContact CE1-CB 3.58Å; F97-A517 HydrophobicContact CE2-CB 3.82Å; F97-A517 HydrophobicContact CG-CB 3.63Å; F97-A517 HydrophobicContact CZ-CB 3.74Å
98	W	80.3	Confident	69.1	Low	84 Å²	84	67 Å²	67	32%	0.318	35%	0.347	S	S	.	.	H	α-helix	trans	-66.7	-35.7	-176	-68.3	114.2	0	0	0	113.2	L94 E95 E100 V101 E102 E513	L94-W98 PolarHBondContact O-N 2.96Å; E95-W98 PolarHBondContact O-N 3.28Å; W98-E100 VanDerWaalsContact C-N 3.29Å; W98-E100 PolarHBondContact O-N 3.22Å; W98-V101 HydrophobicContact CE3-CB 4.12Å; W98-V101 HydrophobicContact CE3-CG1 4.2Å; W98-V101 HydrophobicContact CE3-CG2 4.32Å; W98-V101 HydrophobicContact CZ3-CB 4.45Å; W98-V101 HydrophobicContact CZ3-CG1 4.15Å; W98-V101 HydrophobicContact CZ3-CG2 4.45Å; W98-V101 PolarHBondContact O-N 3.24Å; W98-E102 VanDerWaalsContact O-CB 3.28Å; W98-E102 WeakPolarHBondContact O-CB 3.39Å; W98-E102 PolarHBondContact O-N 2.91Å; W98-E513 HydrophobicContact CH2-CB 3.57Å; W98-E513 HydrophobicContact CH2-CG 3.92Å; W98-E513 HydrophobicContact CZ2-CB 3.56Å; W98-E513 HydrophobicContact CZ2-CG 4.38Å; W98-E513 WeakPolarHBondContact CZ2-O 3.5Å
99	S	77.1	Confident	69.7	Low	69 Å²	69	64 Å²	64	48%	0.483	35%	0.351	S	S	.	.	H	α-helix	trans	-60.6	-39.2	171.7	-174.4	0	0	0	0	111.8	E95 F97 T103	E95-S99 VanDerWaalsContact O-CB 3.3Å; E95-S99 WeakPolarHBondContact O-CB 3.36Å; E95-S99 PolarHBondContact O-N 2.85Å; F97-S99 PolarHBondContact O-N 2.68Å; S99-T103 WeakPolarHBondContact O-CB 3.44Å; S99-T103 PolarHBondContact O-N 3.47Å; S99-T103 PolarHBondContact O-OG1 3.37Å
100	E	85.1	Confident	69.4	Low	12 Å²	12	69.2 Å²	69.2	6%	0.056	37%	0.368	C	S	.	.	H	α-helix	trans	-70.4	-46.2	174.1	-168.6	69.9	-148.1	0	0	111.3	S96 F97 W98 E102 T103 I104 K416 R420 P496 N497	S96-E100 PolarHBondContact O-N 2.95Å; F97-E100 WeakPolarHBondContact O-CB 3.28Å; F97-E100 PolarHBondContact O-N 3.27Å; F97-E100 VanDerWaalsContact O-N 3.11Å; W98-E100 VanDerWaalsContact C-N 3.29Å; W98-E100 PolarHBondContact O-N 3.22Å; E100-E102 VanDerWaalsContact C-N 3.29Å; E100-E102 PolarHBondContact O-N 3.35Å; E100-T103 CarbonylContact O-C 3.56Å; E100-T103 WeakPolarHBondContact O-CA 3.32Å; E100-T103 WeakPolarHBondContact O-CB 3.28Å; E100-T103 PolarHBondContact O-N 3.46Å; E100-T103 VanDerWaalsContact O-N 3.09Å; E100-I104 HydrophobicContact CG-CD1 4.49Å; E100-I104 VanDerWaalsContact O-CG1 3.27Å; E100-I104 WeakPolarHBondContact O-CG1 3.36Å; E100-I104 PolarHBondContact O-N 3.15Å; E100-K416 WeakPolarHBondContact OE2-CE 3.43Å; E100-K416 IonicContact OE2-NZ 3.83Å; E100-K416 PolarHBondContact OE2-NZ 3.31Å; E100-R420 IonicContact OE1-NH1 3.27Å; E100-R420 PolarHBondContact OE1-NH1 3.01Å; E100-P496 HydrophobicContact CB-CB 4.37Å; E100-P496 HydrophobicContact CB-CG 4.26Å; E100-P496 HydrophobicContact CG-CB 3.91Å; E100-P496 HydrophobicContact CG-CG 4.23Å; E100-N497 VanDerWaalsContact CG-ND2 3.3Å; E100-N497 WeakPolarHBondContact CG-ND2 2.73Å; E100-N497 PolarHBondContact OE1-ND2 2.85Å; E100-N497 PolarHBondContact OE1-OD1 2.98Å
101	V	80.3	Confident	68.8	Low	29 Å²	29	68.2 Å²	68.2	18%	0.176	37%	0.372	C	S	.	.	H	α-helix	trans	-56.9	-42	175.8	174.9	0	0	0	0	111.7	F97 W98 I104 R105 P496 L500	F97-V101 HydrophobicContact CD1-CG2 3.74Å; F97-V101 HydrophobicContact CE1-CG2 3.46Å; F97-V101 VanDerWaalsContact CE1-CG2 3.46Å; F97-V101 HydrophobicContact CG-CG2 4.46Å; F97-V101 HydrophobicContact CZ-CG2 3.98Å; F97-V101 WeakPolarHBondContact O-CG2 3.42Å; F97-V101 PolarHBondContact O-N 3.14Å; W98-V101 HydrophobicContact CE3-CB 4.12Å; W98-V101 HydrophobicContact CE3-CG1 4.2Å; W98-V101 HydrophobicContact CE3-CG2 4.32Å; W98-V101 HydrophobicContact CZ3-CB 4.45Å; W98-V101 HydrophobicContact CZ3-CG1 4.15Å; W98-V101 HydrophobicContact CZ3-CG2 4.45Å; W98-V101 PolarHBondContact O-N 3.24Å; V101-I104 WeakPolarHBondContact O-CB 3.31Å; V101-I104 PolarHBondContact O-N 2.87Å; V101-R105 PolarHBondContact O-N 3.28Å; V101-P496 HydrophobicContact CG2-CB 4.34Å; V101-P496 HydrophobicContact CG2-CG 4.21Å; V101-L500 HydrophobicContact CG1-CD1 4.42Å; V101-L500 HydrophobicContact CG2-CD1 3.68Å
102	E	78.5	Confident	67.5	Low	63 Å²	63	69.5 Å²	69.5	29%	0.294	39%	0.385	S	S	.	.	H	α-helix	trans	-68.3	-38.5	176.8	-176.6	57.8	-165.6	0	0	111.6	W98 E100 I104 R105 Q106	W98-E102 VanDerWaalsContact O-CB 3.28Å; W98-E102 WeakPolarHBondContact O-CB 3.39Å; W98-E102 PolarHBondContact O-N 2.91Å; E100-E102 VanDerWaalsContact C-N 3.29Å; E100-E102 PolarHBondContact O-N 3.35Å; E102-I104 VanDerWaalsContact C-N 3.26Å; E102-I104 PolarHBondContact O-N 2.68Å; E102-R105 VanDerWaalsContact CD-NH2 3.29Å; E102-R105 PolarHBondContact O-N 3.32Å; E102-R105 IonicContact OE1-CZ 2.68Å; E102-R105 IonicContact OE1-NE 3.73Å; E102-R105 IonicContact OE1-NH2 3.01Å; E102-R105 PolarHBondContact OE1-NH2 2.9Å; E102-R105 IonicContact OE2-CZ 3.2Å; E102-R105 IonicContact OE2-NE 2.9Å; E102-R105 PolarHBondContact OE2-NE 3.45Å; E102-R105 IonicContact OE2-NH2 3.25Å; E102-R105 PolarHBondContact OE2-NH2 3.05Å; E102-Q106 HydrophobicContact CG-CG 4.41Å; E102-Q106 WeakPolarHBondContact O-CB 3.28Å; E102-Q106 WeakPolarHBondContact O-CG 3.47Å; E102-Q106 PolarHBondContact O-N 3.41Å; E102-Q106 PolarHBondContact OE1-NE2 2.81Å
103	T	77.9	Confident	66.5	Low	40 Å²	40	72.6 Å²	72.6	25%	0.245	40%	0.401	C	S	.	.	H	α-helix	trans	-61.1	-34.7	170.7	-59	0	0	0	0	111.9	S99 E100 G107	S99-T103 WeakPolarHBondContact O-CB 3.44Å; S99-T103 PolarHBondContact O-N 3.47Å; S99-T103 PolarHBondContact O-OG1 3.37Å; E100-T103 CarbonylContact O-C 3.56Å; E100-T103 WeakPolarHBondContact O-CA 3.32Å; E100-T103 WeakPolarHBondContact O-CB 3.28Å; E100-T103 PolarHBondContact O-N 3.46Å; E100-T103 VanDerWaalsContact O-N 3.09Å; T103-G107 PolarHBondContact O-N 2.92Å
104	I	77.6	Confident	64.7	Low	14 Å²	14	77.8 Å²	77.8	7%	0.072	43%	0.429	C	S	.	.	H	α-helix	trans	-67.4	-47.5	173.5	-64.1	174.4	0	0	0	110.2	E100 V101 E102 G107 C108 P496 L500	E100-I104 HydrophobicContact CG-CD1 4.49Å; E100-I104 VanDerWaalsContact O-CG1 3.27Å; E100-I104 WeakPolarHBondContact O-CG1 3.36Å; E100-I104 PolarHBondContact O-N 3.15Å; V101-I104 WeakPolarHBondContact O-CB 3.31Å; V101-I104 PolarHBondContact O-N 2.87Å; E102-I104 VanDerWaalsContact C-N 3.26Å; E102-I104 PolarHBondContact O-N 2.68Å; I104-G107 CarbonylContact O-C 3.13Å; I104-G107 WeakPolarHBondContact O-CA 3.43Å; I104-G107 PolarHBondContact O-N 2.76Å; I104-G107 VanDerWaalsContact O-N 3.14Å; I104-C108 PolarHBondContact O-N 3.1Å; I104-C108 PolarHBondContact O-SG 2.96Å; I104-P496 HydrophobicContact CD1-CB 3.65Å; I104-L500 HydrophobicContact CD1-CB 4.32Å; I104-L500 HydrophobicContact CD1-CD1 4.43Å
105	R	74.1	Confident	62.8	Low	168 Å²	168	82 Å²	82	63%	0.634	46%	0.457	S	S	*	.	H	α-helix	trans	-62.5	-48.4	-178.4	-167.3	170.2	69.4	129.5	5.1	111.9	V101 E102 G107 C108	V101-R105 PolarHBondContact O-N 3.28Å; E102-R105 VanDerWaalsContact CD-NH2 3.29Å; E102-R105 PolarHBondContact O-N 3.32Å; E102-R105 IonicContact OE1-CZ 2.68Å; E102-R105 IonicContact OE1-NE 3.73Å; E102-R105 IonicContact OE1-NH2 3.01Å; E102-R105 PolarHBondContact OE1-NH2 2.9Å; E102-R105 IonicContact OE2-CZ 3.2Å; E102-R105 IonicContact OE2-NE 2.9Å; E102-R105 PolarHBondContact OE2-NE 3.45Å; E102-R105 IonicContact OE2-NH2 3.25Å; E102-R105 PolarHBondContact OE2-NH2 3.05Å; R105-G107 PolarHBondContact O-N 3.16Å; R105-C108 WeakPolarHBondContact O-CB 3.22Å; R105-C108 PolarHBondContact O-N 3.01Å
106	Q	67.7	Low	60.8	Low	147 Å²	147	81.7 Å²	81.7	69%	0.687	46%	0.463	S	S	*	.	H	α-helix	trans	-64.9	-21.2	175.2	-66.2	176.8	9.4	0	0	113.2	E102	E102-Q106 HydrophobicContact CG-CG 4.41Å; E102-Q106 WeakPolarHBondContact O-CB 3.28Å; E102-Q106 WeakPolarHBondContact O-CG 3.47Å; E102-Q106 PolarHBondContact O-N 3.41Å; E102-Q106 PolarHBondContact OE1-NE2 2.81Å
107	G	57.1	Low	58.9	Low	46 Å²	46	90.3 Å²	90.3	47%	0.474	49%	0.492	S	S	.	.	T	Hydrogen-bonded Turn	trans	-86.2	0.2	172.2	0	0	0	0	0	114.7	T103 I104 R105 K502	T103-G107 PolarHBondContact O-N 2.92Å; I104-G107 CarbonylContact O-C 3.13Å; I104-G107 WeakPolarHBondContact O-CA 3.43Å; I104-G107 PolarHBondContact O-N 2.76Å; I104-G107 VanDerWaalsContact O-N 3.14Å; R105-G107 PolarHBondContact O-N 3.16Å; G107-K502 PolarHBondContact O-NZ 3.46Å
108	C	54.1	Low	57	Low	52 Å²	52	99.6 Å²	99.6	35%	0.351	53%	0.527	S	S	.	.			trans	-105.1	112.5	172.4	-70.1	0	0	0	0	110	I104 R105 K502	I104-C108 PolarHBondContact O-N 3.1Å; I104-C108 PolarHBondContact O-SG 2.96Å; R105-C108 WeakPolarHBondContact O-CB 3.22Å; R105-C108 PolarHBondContact O-N 3.01Å; C108-K502 WeakPolarHBondContact SG-CD 3.33Å; C108-K502 WeakPolarHBondContact SG-CE 3.38Å; C108-K502 PolarHBondContact SG-NZ 3.05Å; C108-K502 VanDerWaalsContact SG-NZ 3.38Å
109	G	47.9	Very low	54.7	Low	69 Å²	69	103.8 Å²	103.8	71%	0.711	56%	0.556	S	S	*	*			trans	-64.8	147	149	0	0	0	0	0	108.7	A111	G109-A111 PolarHBondContact O-N 3.3Å; G109-A111 VanDerWaalsContact O-N 3.15Å
110	E	37.1	Very low	53.5	Low	203 Å²	203	102.6 Å²	102.6	95%	0.949	55%	0.548	S	S	*	.			trans	-56.6	121.9	177.4	-72	-156.5	142.9	0	0	110.4
111	A	41	Very low	51.9	Low	68 Å²	68	110.2 Å²	110.2	56%	0.562	58%	0.576	S	S	*	*			trans	-102.1	99.6	169.5	0	0	0	0	0	106.7	G109 L113	G109-A111 PolarHBondContact O-N 3.3Å; G109-A111 VanDerWaalsContact O-N 3.15Å; A111-L113 PolarHBondContact O-N 3.38Å
112	D	34.5	Very low	50.5	Low	155 Å²	155	115.6 Å²	115.6	83%	0.829	60%	0.599	S	S	*	*			trans	-55.9	118	178.6	-166.9	9.5	0	0	0	110.3
113	L	41.7	Very low	49.2	Very low	131 Å²	131	115.2 Å²	115.2	69%	0.686	60%	0.603	S	S	*	*			trans	-109.4	90.2	178.1	-74.9	177.8	0	0	0	108.1	A111 P115	A111-L113 PolarHBondContact O-N 3.38Å; L113-P115 VanDerWaalsContact O-CD 3.26Å; L113-P115 WeakPolarHBondContact O-CD 3.46Å; L113-P115 VanDerWaalsContact O-N 3.15Å
114	D	32.6	Very low	48.7	Very low	117 Å²	117	116.9 Å²	116.9	63%	0.626	61%	0.608	S	S	*	*			trans	-49.2	114.1	178.9	-176.1	-9.6	0	0	0	111.8	T116	D114-T116 VanDerWaalsContact C-N 3.25Å; D114-T116 VanDerWaalsContact CG-OG1 3.32Å; D114-T116 PolarHBondContact O-N 2.54Å; D114-T116 VanDerWaalsContact OD1-CB 3.3Å; D114-T116 WeakPolarHBondContact OD1-CB 3.5Å; D114-T116 WeakPolarHBondContact OD1-CG2 3Å; D114-T116 PolarHBondContact OD1-N 3.37Å; D114-T116 PolarHBondContact OD1-OG1 3.24Å; D114-T116 PolarHBondContact OD2-OG1 3.1Å
115	P	36.8	Very low	48.5	Very low	112 Å²	112	120.5 Å²	120.5	73%	0.727	63%	0.625	S	S	*	*			trans	-78.7	0.3	-176.3	-12.5	28.6	0	0	0	114.6	L113 R117	L113-P115 VanDerWaalsContact O-CD 3.26Å; L113-P115 WeakPolarHBondContact O-CD 3.46Å; L113-P115 VanDerWaalsContact O-N 3.15Å; P115-R117 PolarHBondContact O-N 3.12Å; P115-R117 VanDerWaalsContact O-N 3.1Å
116	T	34.5	Very low	48.7	Very low	108 Å²	108	113.1 Å²	113.1	66%	0.663	60%	0.601	S	S	*	*			trans	-89.9	50.8	-159.7	64.6	0	0	0	0	116.2	D114	D114-T116 VanDerWaalsContact C-N 3.25Å; D114-T116 VanDerWaalsContact CG-OG1 3.32Å; D114-T116 PolarHBondContact O-N 2.54Å; D114-T116 VanDerWaalsContact OD1-CB 3.3Å; D114-T116 WeakPolarHBondContact OD1-CB 3.5Å; D114-T116 WeakPolarHBondContact OD1-CG2 3Å; D114-T116 PolarHBondContact OD1-N 3.37Å; D114-T116 PolarHBondContact OD1-OG1 3.24Å; D114-T116 PolarHBondContact OD2-OG1 3.1Å
117	R	40.8	Very low	49.5	Very low	204 Å²	204	110.1 Å²	110.1	77%	0.77	59%	0.587	S	S	*	*			trans	-134.9	88.4	163	-75.9	-163.9	173.9	-156	-2.7	113.2	P115	P115-R117 PolarHBondContact O-N 3.12Å; P115-R117 VanDerWaalsContact O-N 3.1Å
118	R	40.4	Very low	50.7	Low	200 Å²	200	110.3 Å²	110.3	76%	0.755	58%	0.575	S	S	*	*			trans	-95.5	-25.6	178.1	-136.4	175.6	-73.4	-154.6	1.6	114.2
119	D	32.7	Very low	52.3	Low	173 Å²	173	108.6 Å²	108.6	93%	0.925	56%	0.562	S	S	*	*	T	Hydrogen-bonded Turn	trans	-90.8	-3	-173.9	-63.7	-35.4	0	0	0	115.8
120	S	50.5	Low	54.2	Low	44 Å²	44	109.6 Å²	109.6	31%	0.308	55%	0.548	S	S	.	.	T	Hydrogen-bonded Turn	trans	-95.9	-7.6	-176.6	58.9	0	0	0	0	115.6	Q122 S123 E124	S120-Q122 VanDerWaalsContact C-N 3.27Å; S120-Q122 PolarHBondContact O-N 3.13Å; S120-Q122 VanDerWaalsContact O-N 3.11Å; S120-S123 PolarHBondContact O-N 2.93Å; S120-S123 VanDerWaalsContact O-N 3.13Å; S120-E124 PolarHBondContact O-N 2.78Å
121	R	51.9	Low	56.7	Low	172 Å²	172	104.6 Å²	104.6	65%	0.649	53%	0.525	S	S	*	.	H	α-helix	trans	-57.3	-32.6	-167.4	-68	-179	175.5	-176	-2.3	114.8	E125	R121-E125 PolarHBondContact O-N 2.97Å
122	Q	50.4	Low	59.1	Low	141 Å²	141	101.8 Å²	101.8	66%	0.659	50%	0.5	S	S	*	.	H	α-helix	trans	-81.4	-25.1	-177.9	-64.3	-177.4	12.2	0	0	113.8	S120 E124	S120-Q122 VanDerWaalsContact C-N 3.27Å; S120-Q122 PolarHBondContact O-N 3.13Å; S120-Q122 VanDerWaalsContact O-N 3.11Å; Q122-E124 VanDerWaalsContact C-N 3.33Å
123	S	52.8	Low	61.8	Low	55 Å²	55	94.4 Å²	94.4	39%	0.385	46%	0.46	S	S	.	.	H	α-helix	trans	-74	-32.1	170.1	-170.1	0	0	0	0	110.8	S120 E127	S120-S123 PolarHBondContact O-N 2.93Å; S120-S123 VanDerWaalsContact O-N 3.13Å; S123-E127 PolarHBondContact O-N 2.83Å
124	E	67.3	Low	64	Low	75 Å²	75	90.3 Å²	90.3	35%	0.35	45%	0.445	S	S	.	.	H	α-helix	trans	-68.8	-38.4	-179.8	-156.4	-172.9	161.3	0	0	112.5	S120 Q122 G126 E127 Q128	S120-E124 PolarHBondContact O-N 2.78Å; Q122-E124 VanDerWaalsContact C-N 3.33Å; E124-G126 PolarHBondContact O-N 3.26Å; E124-E127 PolarHBondContact O-N 2.97Å; E124-Q128 WeakPolarHBondContact O-CB 3.37Å; E124-Q128 VanDerWaalsContact O-CG 3.28Å; E124-Q128 WeakPolarHBondContact O-CG 3.49Å; E124-Q128 PolarHBondContact O-N 2.79Å; E124-Q128 PolarHBondContact OE1-NE2 3.13Å
125	E	72.3	Confident	66.8	Low	91 Å²	91	87.4 Å²	87.4	43%	0.425	43%	0.43	S	S	.	.	H	α-helix	trans	-59.7	-44.9	178.2	-172.9	175.8	-174.5	0	0	112.3	R121 E127 Q128 E129	R121-E125 PolarHBondContact O-N 2.97Å; E125-E127 PolarHBondContact O-N 2.98Å; E125-Q128 PolarHBondContact O-N 2.92Å; E125-E129 WeakPolarHBondContact O-CG 3.48Å; E125-E129 PolarHBondContact O-N 2.67Å
126	G	79.3	Confident	69.3	Low	12 Å²	12	82.3 Å²	82.3	12%	0.124	40%	0.397	C	S	.	.	H	α-helix	trans	-61.8	-40.3	175.8	0	0	0	0	0	113.4	E124 E130	E124-G126 PolarHBondContact O-N 3.26Å; G126-E130 WeakPolarHBondContact O-CB 3.2Å; G126-E130 PolarHBondContact O-N 2.82Å
127	E	83.9	Confident	71.7	Confident	84 Å²	84	78.3 Å²	78.3	39%	0.393	38%	0.378	S	S	.	.	H	α-helix	trans	-69.1	-34.3	175.4	-69	171.8	-155.8	0	0	112.6	S123 E124 E125 Q131 K322	S123-E127 PolarHBondContact O-N 2.83Å; E124-E127 PolarHBondContact O-N 2.97Å; E125-E127 PolarHBondContact O-N 2.98Å; E127-Q131 WeakPolarHBondContact O-CB 3.28Å; E127-Q131 PolarHBondContact O-N 3.07Å; E127-K322 IonicContact OE2-NZ 2.62Å
128	Q	82.9	Confident	73.9	Confident	51 Å²	51	68.9 Å²	68.9	24%	0.238	34%	0.342	C	S	.	.	H	α-helix	trans	-67.9	-40.8	177	-74.6	176	18.5	0	0	111.7	E124 E125 W132	E124-Q128 WeakPolarHBondContact O-CB 3.37Å; E124-Q128 VanDerWaalsContact O-CG 3.28Å; E124-Q128 WeakPolarHBondContact O-CG 3.49Å; E124-Q128 PolarHBondContact O-N 2.79Å; E124-Q128 PolarHBondContact OE1-NE2 3.13Å; E125-Q128 PolarHBondContact O-N 2.92Å; Q128-W132 WeakPolarHBondContact O-CB 3.13Å; Q128-W132 PolarHBondContact O-N 2.85Å
129	E	87.8	Confident	76	Confident	15 Å²	15	62.2 Å²	62.2	7%	0.07	33%	0.326	C	S	.	.	H	α-helix	trans	-71.3	-37.1	175.8	-65.9	-64.6	174.8	0	0	112.2	E125 W132 L133 R169	E125-E129 WeakPolarHBondContact O-CG 3.48Å; E125-E129 PolarHBondContact O-N 2.67Å; E129-W132 PolarHBondContact O-N 2.88Å; E129-L133 WeakPolarHBondContact O-CG 3.31Å; E129-L133 PolarHBondContact O-N 3.47Å; E129-R169 VanDerWaalsContact OE1-CD 3.31Å; E129-R169 WeakPolarHBondContact OE1-CD 3.38Å; E129-R169 IonicContact OE1-CZ 2.77Å; E129-R169 IonicContact OE1-NE 3.34Å; E129-R169 IonicContact OE1-NH1 3.98Å; E129-R169 PolarHBondContact OE1-NH1 2.81Å; E129-R169 WeakPolarHBondContact OE2-CB 3.49Å; E129-R169 WeakPolarHBondContact OE2-CD 3.28Å
130	E	87.9	Confident	78.3	Confident	90 Å²	90	56.6 Å²	56.6	42%	0.421	30%	0.298	S	S	.	.	H	α-helix	trans	-60.7	-45.8	171.5	-176.6	163	-160.9	0	0	112	G126 W132 L133 A134 I142 Y173	G126-E130 WeakPolarHBondContact O-CB 3.2Å; G126-E130 PolarHBondContact O-N 2.82Å; E130-W132 VanDerWaalsContact C-N 3.33Å; E130-W132 PolarHBondContact O-N 3.3Å; E130-L133 PolarHBondContact O-N 3.4Å; E130-A134 PolarHBondContact O-N 3.39Å; E130-I142 HydrophobicContact CG-CD1 3.88Å; E130-Y173 HydrophobicContact CB-CD2 3.97Å; E130-Y173 HydrophobicContact CB-CE2 3.78Å; E130-Y173 HydrophobicContact CG-CE2 4.13Å
131	Q	88.4	Confident	79.7	Confident	98 Å²	98	55.4 Å²	55.4	46%	0.458	29%	0.288	S	S	.	.	H	α-helix	trans	-63	-39.5	174.6	-174	63.4	57	0	0	111.5	E127 A134 D135	E127-Q131 WeakPolarHBondContact O-CB 3.28Å; E127-Q131 PolarHBondContact O-N 3.07Å; Q131-A134 WeakPolarHBondContact O-CB 3.47Å; Q131-A134 PolarHBondContact O-N 3.12Å; Q131-D135 PolarHBondContact NE2-OD1 3.25Å; Q131-D135 PolarHBondContact O-N 3.44Å
132	W	91.4	Very high	81	Confident	10 Å²	10	48.5 Å²	48.5	4%	0.038	26%	0.264	C	S	.	.	H	α-helix	trans	-61.7	-44.1	176.1	-174.7	96.2	0	0	0	112.1	Q128 E129 E130 A134 D135 A136 L138 V166 R169 I305 T308	Q128-W132 WeakPolarHBondContact O-CB 3.13Å; Q128-W132 PolarHBondContact O-N 2.85Å; E129-W132 PolarHBondContact O-N 2.88Å; E130-W132 VanDerWaalsContact C-N 3.33Å; E130-W132 PolarHBondContact O-N 3.3Å; W132-A134 VanDerWaalsContact C-N 3.32Å; W132-A134 PolarHBondContact O-N 2.99Å; W132-D135 PolarHBondContact O-N 2.87Å; W132-A136 HydrophobicContact CE3-CB 4.43Å; W132-A136 HydrophobicContact CH2-CB 4.45Å; W132-A136 HydrophobicContact CZ3-CB 4.32Å; W132-A136 VanDerWaalsContact O-CB 3.26Å; W132-A136 WeakPolarHBondContact O-CB 3.27Å; W132-A136 PolarHBondContact O-N 3.1Å; W132-L138 HydrophobicContact CZ3-CD1 4.28Å; W132-V166 HydrophobicContact CH2-CG2 3.94Å; W132-V166 HydrophobicContact CZ3-CG2 4.39Å; W132-R169 HydrophobicContact CD2-CB 4.47Å; W132-R169 HydrophobicContact CD2-CG 4.19Å; W132-R169 HydrophobicContact CE3-CB 3.82Å; W132-R169 HydrophobicContact CE3-CG 3.96Å; W132-R169 HydrophobicContact CH2-CB 4.4Å; W132-R169 HydrophobicContact CH2-CG 4.04Å; W132-R169 HydrophobicContact CZ2-CG 4.24Å; W132-R169 HydrophobicContact CZ3-CB 3.78Å; W132-R169 HydrophobicContact CZ3-CG 3.89Å; W132-I305 HydrophobicContact CH2-CG1 4.2Å; W132-I305 HydrophobicContact CZ2-CG1 4.4Å; W132-T308 HydrophobicContact CZ2-CG2 3.87Å; W132-T308 WeakPolarHBondContact CZ2-OG1 3.28Å; W132-T308 PolarHBondContact NE1-OG1 3.07Å
133	L	90.6	Very high	82.2	Confident	0 Å²	0	44.3 Å²	44.3	0%	0	25%	0.25	C	S	.	.	H	α-helix	trans	-62.3	-39.6	174.7	-69.8	165.6	0	0	0	111.4	E129 E130 G137 L138 S139 I142 L170 Y173	E129-L133 WeakPolarHBondContact O-CG 3.31Å; E129-L133 PolarHBondContact O-N 3.47Å; E130-L133 PolarHBondContact O-N 3.4Å; L133-G137 PolarHBondContact O-N 2.68Å; L133-L138 HydrophobicContact CB-CB 4.5Å; L133-L138 HydrophobicContact CD2-CB 3.99Å; L133-L138 HydrophobicContact CD2-CD1 4.39Å; L133-L138 CarbonylContact O-C 3.4Å; L133-L138 WeakPolarHBondContact O-CA 3.44Å; L133-L138 PolarHBondContact O-N 3.03Å; L133-S139 PolarHBondContact O-N 3.46Å; L133-I142 HydrophobicContact CD1-CG2 3.64Å; L133-L170 HydrophobicContact CD1-CD1 4.28Å; L133-Y173 HydrophobicContact CD1-CG 4.32Å
134	A	89.6	Confident	82.6	Confident	44 Å²	44	49.7 Å²	49.7	36%	0.364	27%	0.27	S	S	.	.	H	α-helix	trans	-63.5	-47	174.2	0	0	0	0	0	112.6	E130 Q131 W132 A136 G137	E130-A134 PolarHBondContact O-N 3.39Å; Q131-A134 WeakPolarHBondContact O-CB 3.47Å; Q131-A134 PolarHBondContact O-N 3.12Å; W132-A134 VanDerWaalsContact C-N 3.32Å; W132-A134 PolarHBondContact O-N 2.99Å; A134-A136 VanDerWaalsContact C-N 3.34Å; A134-A136 PolarHBondContact O-N 3.32Å; A134-G137 PolarHBondContact O-N 3.1Å
135	D	89.8	Confident	82.1	Confident	56 Å²	56	53.6 Å²	53.6	30%	0.299	29%	0.293	S	S	.	.	H	α-helix	trans	-65.9	-35.8	-179.3	-60.2	-33.7	0	0	0	112.2	Q131 W132 G137 Q301 L304 R320	Q131-D135 PolarHBondContact NE2-OD1 3.25Å; Q131-D135 PolarHBondContact O-N 3.44Å; W132-D135 PolarHBondContact O-N 2.87Å; D135-G137 PolarHBondContact O-N 2.9Å; D135-Q301 WeakPolarHBondContact O-CG 3.45Å; D135-L304 HydrophobicContact CB-CD2 3.62Å; D135-R320 IonicContact OD2-CZ 2.7Å; D135-R320 IonicContact OD2-NH1 3.58Å; D135-R320 PolarHBondContact OD2-NH1 2.84Å; D135-R320 IonicContact OD2-NH2 2.88Å; D135-R320 PolarHBondContact OD2-NH2 3.48Å
136	A	89.6	Confident	81.2	Confident	5 Å²	5	50.1 Å²	50.1	4%	0.041	28%	0.278	C	S	.	.	T	Hydrogen-bonded Turn	trans	-72.8	-6.7	173.7	0	0	0	0	0	113.5	W132 A134 L138 Q301 L304 I305	W132-A136 HydrophobicContact CE3-CB 4.43Å; W132-A136 HydrophobicContact CH2-CB 4.45Å; W132-A136 HydrophobicContact CZ3-CB 4.32Å; W132-A136 VanDerWaalsContact O-CB 3.26Å; W132-A136 WeakPolarHBondContact O-CB 3.27Å; W132-A136 PolarHBondContact O-N 3.1Å; A134-A136 VanDerWaalsContact C-N 3.34Å; A134-A136 PolarHBondContact O-N 3.32Å; A136-L138 VanDerWaalsContact C-N 3.33Å; A136-L138 HydrophobicContact CB-CB 4.47Å; A136-L138 HydrophobicContact CB-CD1 3.92Å; A136-L138 HydrophobicContact CB-CG 3.96Å; A136-Q301 WeakPolarHBondContact O-CB 3.49Å; A136-L304 HydrophobicContact CB-CD2 4.18Å; A136-I305 HydrophobicContact CB-CD1 4.4Å; A136-I305 HydrophobicContact CB-CG1 4.11Å
137	G	86.3	Confident	80.3	Confident	25 Å²	25	55.9 Å²	55.9	26%	0.258	30%	0.302	S	S	.	.	T	Hydrogen-bonded Turn	trans	76.4	19.7	-176.3	0	0	0	0	0	114.4	L133 A134 D135	L133-G137 PolarHBondContact O-N 2.68Å; A134-G137 PolarHBondContact O-N 3.1Å; D135-G137 PolarHBondContact O-N 2.9Å
138	L	87	Confident	79.1	Confident	6 Å²	6	57.5 Å²	57.5	3%	0.031	31%	0.314	C	S	.	.			trans	-109.1	16.4	-174	-59.2	179.1	0	0	0	112.8	W132 L133 A136 T140 L141 L154 V166 I305	W132-L138 HydrophobicContact CZ3-CD1 4.28Å; L133-L138 HydrophobicContact CB-CB 4.5Å; L133-L138 HydrophobicContact CD2-CB 3.99Å; L133-L138 HydrophobicContact CD2-CD1 4.39Å; L133-L138 CarbonylContact O-C 3.4Å; L133-L138 WeakPolarHBondContact O-CA 3.44Å; L133-L138 PolarHBondContact O-N 3.03Å; A136-L138 VanDerWaalsContact C-N 3.33Å; A136-L138 HydrophobicContact CB-CB 4.47Å; A136-L138 HydrophobicContact CB-CD1 3.92Å; A136-L138 HydrophobicContact CB-CG 3.96Å; L138-T140 PolarHBondContact O-N 3.2Å; L138-T140 VanDerWaalsContact O-N 3.16Å; L138-L141 HydrophobicContact CB-CD1 3.9Å; L138-L141 HydrophobicContact CB-CG 4.06Å; L138-L141 HydrophobicContact CD1-CD1 4.24Å; L138-L141 HydrophobicContact CD2-CD1 4.25Å; L138-L141 HydrophobicContact CG-CD1 4.36Å; L138-L141 VanDerWaalsContact O-CB 3.28Å; L138-L141 WeakPolarHBondContact O-CB 3.44Å; L138-L141 WeakPolarHBondContact O-CG 3.47Å; L138-L141 PolarHBondContact O-N 2.92Å; L138-L154 HydrophobicContact CD2-CD1 4.24Å; L138-V166 HydrophobicContact CD1-CB 4.38Å; L138-V166 HydrophobicContact CD1-CG1 3.7Å; L138-V166 HydrophobicContact CD1-CG2 3.7Å; L138-I305 HydrophobicContact CD1-CD1 4.08Å
139	S	84.3	Confident	78	Confident	60 Å²	60	59.5 Å²	59.5	42%	0.42	33%	0.329	S	S	.	.	G	3₁₀ helix	trans	-59.4	-23.6	175.3	53.5	0	0	0	0	113.3	L133 L141 I142 S143	L133-S139 PolarHBondContact O-N 3.46Å; S139-L141 PolarHBondContact O-N 3.36Å; S139-I142 WeakPolarHBondContact O-CG1 3.2Å; S139-I142 PolarHBondContact O-N 2.83Å; S139-S143 PolarHBondContact O-N 2.87Å
140	T	80.3	Confident	76.6	Confident	54 Å²	54	60.9 Å²	60.9	33%	0.331	34%	0.337	S	S	.	.	G	3₁₀ helix	trans	-68.6	-13.9	171.3	55.6	0	0	0	0	113.6	L138 I142 S146	L138-T140 PolarHBondContact O-N 3.2Å; L138-T140 VanDerWaalsContact O-N 3.16Å; T140-I142 VanDerWaalsContact C-N 3.34Å; T140-S146 WeakPolarHBondContact O-CB 3.3Å; T140-S146 PolarHBondContact O-OG 3.39Å
141	L	78.9	Confident	75.5	Confident	20 Å²	20	58.8 Å²	58.8	11%	0.105	33%	0.326	C	S	.	.	G	3₁₀ helix	trans	-74.3	-26.1	174.2	-59.5	-172.4	0	0	0	112.6	L138 S139 K151 V166	L138-L141 HydrophobicContact CB-CD1 3.9Å; L138-L141 HydrophobicContact CB-CG 4.06Å; L138-L141 HydrophobicContact CD1-CD1 4.24Å; L138-L141 HydrophobicContact CD2-CD1 4.25Å; L138-L141 HydrophobicContact CG-CD1 4.36Å; L138-L141 VanDerWaalsContact O-CB 3.28Å; L138-L141 WeakPolarHBondContact O-CB 3.44Å; L138-L141 WeakPolarHBondContact O-CG 3.47Å; L138-L141 PolarHBondContact O-N 2.92Å; S139-L141 PolarHBondContact O-N 3.36Å; L141-K151 HydrophobicContact CD2-CB 3.72Å; L141-K151 HydrophobicContact CD2-CD 4.41Å; L141-K151 HydrophobicContact CD2-CG 3.75Å; L141-V166 HydrophobicContact CD1-CG1 3.9Å
142	I	79.3	Confident	74.4	Confident	26 Å²	26	57 Å²	57	13%	0.133	33%	0.328	C	S	.	.	T	Hydrogen-bonded Turn	trans	-104.8	-12.1	-175.5	57.8	169.5	0	0	0	114.1	E130 L133 S139 T140 L170 Y173	E130-I142 HydrophobicContact CG-CD1 3.88Å; L133-I142 HydrophobicContact CD1-CG2 3.64Å; S139-I142 WeakPolarHBondContact O-CG1 3.2Å; S139-I142 PolarHBondContact O-N 2.83Å; T140-I142 VanDerWaalsContact C-N 3.34Å; I142-L170 HydrophobicContact CG2-CD1 3.65Å; I142-Y173 HydrophobicContact CB-CD1 4.49Å; I142-Y173 HydrophobicContact CB-CE1 3.78Å; I142-Y173 HydrophobicContact CD1-CE1 4.45Å; I142-Y173 HydrophobicContact CD1-CE2 4.43Å; I142-Y173 HydrophobicContact CG2-CD1 3.58Å; I142-Y173 HydrophobicContact CG2-CE1 3.36Å; I142-Y173 HydrophobicContact CG2-CG 4.44Å
143	S	75.6	Confident	73.3	Confident	53 Å²	53	58.1 Å²	58.1	37%	0.371	34%	0.336	S	S	.	.			trans	-72.6	133.9	171.9	176.1	0	0	0	0	110.8	S139 D145 S146	S139-S143 PolarHBondContact O-N 2.87Å; S143-D145 VanDerWaalsContact C-N 3.3Å; S143-D145 PolarHBondContact O-N 3.27Å; S143-S146 WeakPolarHBondContact O-CB 3.2Å
144	E	62.2	Low	72.3	Confident	169 Å²	169	60 Å²	60	79%	0.79	35%	0.346	S	S	*	.	T	Hydrogen-bonded Turn	trans	-74	-21.7	-177.1	-58.9	-172.5	158	0	0	112.5	S146	E144-S146 VanDerWaalsContact C-N 3.3Å; E144-S146 PolarHBondContact O-N 3.27Å
145	D	56.4	Low	71.7	Confident	156 Å²	156	60.5 Å²	60.5	83%	0.834	34%	0.343	S	S	*	.	T	Hydrogen-bonded Turn	trans	-86	6.8	-179.5	-55.1	-51.1	0	0	0	114.1	S143	S143-D145 VanDerWaalsContact C-N 3.3Å; S143-D145 PolarHBondContact O-N 3.27Å
146	S	54.8	Low	71.2	Confident	18 Å²	18	61.5 Å²	61.5	13%	0.126	35%	0.354	C	S	.	.			trans	-91.1	115.6	-169.6	-177.7	0	0	0	0	112.6	T140 S143 E144 D148 K151	T140-S146 WeakPolarHBondContact O-CB 3.3Å; T140-S146 PolarHBondContact O-OG 3.39Å; S143-S146 WeakPolarHBondContact O-CB 3.2Å; E144-S146 VanDerWaalsContact C-N 3.3Å; E144-S146 PolarHBondContact O-N 3.27Å; S146-D148 PolarHBondContact O-N 2.79Å; S146-K151 WeakPolarHBondContact O-CE 3.41Å; S146-K151 PolarHBondContact O-NZ 2.93Å; S146-K151 WeakPolarHBondContact OG-CE 3.48Å
147	E	59.1	Low	71.1	Confident	133 Å²	133	61.4 Å²	61.4	62%	0.621	35%	0.353	S	S	*	.			trans	-54.5	128	173.9	-66.1	179.3	-165.1	0	0	111	V149 D150	E147-V149 PolarHBondContact O-N 3.15Å; E147-D150 PolarHBondContact O-N 3.43Å
148	D	59.5	Low	71.4	Confident	119 Å²	119	61.1 Å²	61.1	64%	0.636	35%	0.345	S	S	*	.	H	α-helix	trans	-60	-20.5	-178.1	-69.6	-36.7	0	0	0	113.6	S146 K151 A152	S146-D148 PolarHBondContact O-N 2.79Å; D148-K151 PolarHBondContact O-N 2.81Å; D148-K151 IonicContact OD1-NZ 3.83Å; D148-K151 PolarHBondContact OD1-NZ 3.5Å; D148-A152 PolarHBondContact O-N 3.24Å
149	V	58.7	Low	71.7	Confident	93 Å²	93	62.5 Å²	62.5	56%	0.564	35%	0.354	S	S	*	.	H	α-helix	trans	-59.6	-44	172.2	-177.5	0	0	0	0	111.5	E147 K151 A152 V153	E147-V149 PolarHBondContact O-N 3.15Å; V149-K151 VanDerWaalsContact C-N 3.32Å; V149-K151 PolarHBondContact O-N 2.88Å; V149-A152 PolarHBondContact O-N 3.02Å; V149-V153 HydrophobicContact CG1-CG2 4.36Å; V149-V153 WeakPolarHBondContact O-CB 3.48Å; V149-V153 VanDerWaalsContact O-CG2 3.24Å; V149-V153 WeakPolarHBondContact O-CG2 3.46Å; V149-V153 PolarHBondContact O-N 3.32Å
150	D	59.6	Low	72	Confident	43 Å²	43	68.6 Å²	68.6	23%	0.23	37%	0.368	C	S	.	.	H	α-helix	trans	-68.7	-34.1	-179	-91.1	4.7	0	0	0	111.5	E147 L154 R555	E147-D150 PolarHBondContact O-N 3.43Å; D150-L154 WeakPolarHBondContact O-CG 3.47Å; D150-L154 PolarHBondContact O-N 3.11Å; D150-R555 IonicContact OD1-CZ 2.75Å; D150-R555 IonicContact OD1-NE 3.37Å; D150-R555 IonicContact OD1-NH1 2.71Å; D150-R555 PolarHBondContact OD1-NH1 2.97Å; D150-R555 IonicContact OD2-NH1 3.78Å; D150-R555 PolarHBondContact OD2-NH1 3.46Å
151	K	63.8	Low	72.7	Confident	46 Å²	46	66.4 Å²	66.4	20%	0.2	35%	0.354	C	S	.	.	H	α-helix	trans	-65	-48.6	174.2	-50.3	-180	-168.7	147.1	0	110.6	L141 S146 D148 V149 V153 L154 L155	L141-K151 HydrophobicContact CD2-CB 3.72Å; L141-K151 HydrophobicContact CD2-CD 4.41Å; L141-K151 HydrophobicContact CD2-CG 3.75Å; S146-K151 WeakPolarHBondContact O-CE 3.41Å; S146-K151 PolarHBondContact O-NZ 2.93Å; S146-K151 WeakPolarHBondContact OG-CE 3.48Å; D148-K151 PolarHBondContact O-N 2.81Å; D148-K151 IonicContact OD1-NZ 3.83Å; D148-K151 PolarHBondContact OD1-NZ 3.5Å; V149-K151 VanDerWaalsContact C-N 3.32Å; V149-K151 PolarHBondContact O-N 2.88Å; K151-V153 PolarHBondContact O-N 2.94Å; K151-L154 PolarHBondContact O-N 2.9Å; K151-L155 WeakPolarHBondContact O-CG 3.5Å; K151-L155 PolarHBondContact O-N 2.77Å; K151-L155 VanDerWaalsContact O-N 3.09Å
152	A	66.2	Low	73.4	Confident	61 Å²	61	65.4 Å²	65.4	50%	0.504	35%	0.349	S	S	.	.	H	α-helix	trans	-62.5	-41.4	176.8	0	0	0	0	0	112.4	D148 V149 S156	D148-A152 PolarHBondContact O-N 3.24Å; V149-A152 PolarHBondContact O-N 3.02Å; A152-S156 VanDerWaalsContact O-CB 3.27Å; A152-S156 WeakPolarHBondContact O-CB 3.19Å; A152-S156 PolarHBondContact O-N 3.39Å
153	V	67.3	Low	74.1	Confident	34 Å²	34	65.5 Å²	65.5	21%	0.206	35%	0.354	C	S	.	.	H	α-helix	trans	-62.8	-46.4	177.8	166.2	0	0	0	0	111.5	V149 K151 S156 T157 N551	V149-V153 HydrophobicContact CG1-CG2 4.36Å; V149-V153 WeakPolarHBondContact O-CB 3.48Å; V149-V153 VanDerWaalsContact O-CG2 3.24Å; V149-V153 WeakPolarHBondContact O-CG2 3.46Å; V149-V153 PolarHBondContact O-N 3.32Å; K151-V153 PolarHBondContact O-N 2.94Å; V153-S156 PolarHBondContact O-N 3.15Å; V153-S156 PolarHBondContact O-OG 2.94Å; V153-T157 WeakPolarHBondContact O-CG2 3.09Å; V153-N551 HydrophobicContact CG1-CB 3.77Å
154	L	69.8	Low	74.8	Confident	39 Å²	39	66.7 Å²	66.7	20%	0.204	35%	0.353	C	S	.	.	H	α-helix	trans	-61	-52	177.1	-74.5	167.7	0	0	0	111.4	L138 D150 K151 S156 T157 L548	L138-L154 HydrophobicContact CD2-CD1 4.24Å; D150-L154 WeakPolarHBondContact O-CG 3.47Å; D150-L154 PolarHBondContact O-N 3.11Å; K151-L154 PolarHBondContact O-N 2.9Å; L154-S156 VanDerWaalsContact C-N 3.29Å; L154-S156 PolarHBondContact O-N 3.4Å; L154-T157 PolarHBondContact O-N 3.41Å; L154-T157 PolarHBondContact O-OG1 3.29Å; L154-L548 HydrophobicContact CD2-CD2 3.9Å
155	L	76.4	Confident	76.2	Confident	55 Å²	55	58.6 Å²	58.6	29%	0.288	32%	0.316	S	S	.	.	H	α-helix	trans	-62.2	-34.5	179.8	-66.9	173.3	0	0	0	112.5	K151 T157 L158 V166	K151-L155 WeakPolarHBondContact O-CG 3.5Å; K151-L155 PolarHBondContact O-N 2.77Å; K151-L155 VanDerWaalsContact O-N 3.09Å; L155-T157 PolarHBondContact O-N 2.85Å; L155-T157 VanDerWaalsContact O-N 3.11Å; L155-L158 HydrophobicContact CD2-CD1 4.12Å; L155-L158 PolarHBondContact O-N 3.09Å; L155-V166 HydrophobicContact CD2-CB 4.44Å; L155-V166 HydrophobicContact CD2-CG1 3.99Å
156	S	80.9	Confident	77.9	Confident	77 Å²	77	51.2 Å²	51.2	54%	0.538	28%	0.276	S	S	.	.	T	Hydrogen-bonded Turn	trans	-62.6	-17.1	175.2	78.7	0	0	0	0	114	A152 V153 L154	A152-S156 VanDerWaalsContact O-CB 3.27Å; A152-S156 WeakPolarHBondContact O-CB 3.19Å; A152-S156 PolarHBondContact O-N 3.39Å; V153-S156 PolarHBondContact O-N 3.15Å; V153-S156 PolarHBondContact O-OG 2.94Å; L154-S156 VanDerWaalsContact C-N 3.29Å; L154-S156 PolarHBondContact O-N 3.4Å
157	T	86.1	Confident	79.6	Confident	2 Å²	2	54.4 Å²	54.4	1%	0.012	29%	0.289	C	S	.	.	T	Hydrogen-bonded Turn	trans	-89.2	-13.8	176.1	72.3	0	0	0	0	114.2	V153 L154 L155 Q544 R547 L548	V153-T157 WeakPolarHBondContact O-CG2 3.09Å; L154-T157 PolarHBondContact O-N 3.41Å; L154-T157 PolarHBondContact O-OG1 3.29Å; L155-T157 PolarHBondContact O-N 2.85Å; L155-T157 VanDerWaalsContact O-N 3.11Å; T157-Q544 PolarHBondContact O-NE2 3.43Å; T157-R547 HydrophobicContact CG2-CB 4.49Å; T157-R547 HydrophobicContact CG2-CG 3.8Å; T157-R547 PolarHBondContact O-NH2 3.39Å; T157-L548 HydrophobicContact CG2-CD2 3.75Å; T157-L548 HydrophobicContact CG2-CG 4.18Å; T157-L548 WeakPolarHBondContact OG1-CD2 3.47Å
158	L	92.3	Very high	81.1	Confident	19 Å²	19	52.7 Å²	52.7	10%	0.099	28%	0.277	C	S	.	.	S	Bend	trans	-84.9	156.2	178.6	-58.4	-177.2	0	0	0	110.7	L155 Q162 A163 V166 L302 I305	L155-L158 HydrophobicContact CD2-CD1 4.12Å; L155-L158 PolarHBondContact O-N 3.09Å; L158-Q162 HydrophobicContact CB-CB 3.88Å; L158-A163 HydrophobicContact CB-CB 4.32Å; L158-V166 HydrophobicContact CD1-CG2 3.72Å; L158-L302 HydrophobicContact CD2-CD2 3.75Å; L158-I305 HydrophobicContact CD1-CD1 4.29Å; L158-I305 HydrophobicContact CD1-CG2 4.33Å; L158-I305 HydrophobicContact CD2-CD1 3.96Å; L158-I305 HydrophobicContact CD2-CG2 4.36Å
159	T	93.4	Very high	82.5	Confident	36 Å²	36	50 Å²	50	22%	0.221	26%	0.258	C	S	.	.			trans	-73.1	170.3	165.5	79.5	0	0	0	0	110.2	T161 Q162 A163 A245 E248	T159-T161 PolarHBondContact O-N 2.92Å; T159-Q162 PolarHBondContact O-N 3.46Å; T159-Q162 WeakPolarHBondContact OG1-CG 3.45Å; T159-Q162 PolarHBondContact OG1-N 2.99Å; T159-A163 WeakPolarHBondContact O-CB 3.39Å; T159-A163 PolarHBondContact O-N 3.24Å; T159-A245 HydrophobicContact CG2-CB 3.64Å; T159-E248 WeakPolarHBondContact CB-OE1 3.42Å; T159-E248 HydrophobicContact CG2-CG 4Å; T159-E248 WeakPolarHBondContact OG1-CG 3.39Å; T159-E248 PolarHBondContact OG1-OE1 2.85Å
160	R	92.4	Very high	83.9	Confident	187 Å²	187	47.1 Å²	47.1	71%	0.706	24%	0.239	S	C	*	.	H	α-helix	trans	-57.8	-49.5	-179.9	177.4	178.2	168.5	158.5	4.2	111.2	Q162 A163 E164 E248	R160-Q162 VanDerWaalsContact C-N 3.35Å; R160-Q162 PolarHBondContact O-N 2.72Å; R160-A163 PolarHBondContact O-N 2.9Å; R160-E164 HydrophobicContact CG-CG 4.49Å; R160-E164 IonicContact CZ-OE1 3.01Å; R160-E164 IonicContact NE-OE1 2.74Å; R160-E164 PolarHBondContact NE-OE1 3.39Å; R160-E164 IonicContact NH2-OE1 2.75Å; R160-E164 PolarHBondContact NH2-OE1 3.1Å; R160-E164 WeakPolarHBondContact O-CG 3.48Å; R160-E164 PolarHBondContact O-N 2.84Å; R160-E248 PolarHBondContact N-OE1 2.82Å
161	T	93.8	Very high	85.3	Confident	8 Å²	8	48.3 Å²	48.3	5%	0.049	25%	0.245	C	C	.	.	H	α-helix	trans	-72.1	-29.7	-176.6	-58.8	0	0	0	0	112.7	T159 A165 C247 E248 V251 A309 L313	T159-T161 PolarHBondContact O-N 2.92Å; T161-A165 PolarHBondContact O-N 2.82Å; T161-C247 HydrophobicContact CG2-CB 4.18Å; T161-E248 PolarHBondContact N-OE1 2.95Å; T161-E248 PolarHBondContact OG1-OE1 2.99Å; T161-V251 HydrophobicContact CG2-CG2 4.21Å; T161-A309 HydrophobicContact CG2-CB 4.4Å; T161-L313 HydrophobicContact CG2-CD1 3.89Å; T161-L313 HydrophobicContact CG2-CD2 4.21Å; T161-L313 HydrophobicContact CG2-CG 4.15Å
162	Q	94.9	Very high	86.4	Confident	0 Å²	0	47.9 Å²	47.9	0%	0	25%	0.248	C	C	.	.	H	α-helix	trans	-64.4	-44.7	169.1	-71.6	176.9	-10.6	0	0	112	L158 T159 R160 A165 V166 I305 D306	L158-Q162 HydrophobicContact CB-CB 3.88Å; T159-Q162 PolarHBondContact O-N 3.46Å; T159-Q162 WeakPolarHBondContact OG1-CG 3.45Å; T159-Q162 PolarHBondContact OG1-N 2.99Å; R160-Q162 VanDerWaalsContact C-N 3.35Å; R160-Q162 PolarHBondContact O-N 2.72Å; Q162-A165 PolarHBondContact O-N 3.13Å; Q162-V166 WeakPolarHBondContact O-CG2 3.41Å; Q162-V166 PolarHBondContact O-N 3.07Å; Q162-I305 HydrophobicContact CB-CG2 3.75Å; Q162-I305 HydrophobicContact CG-CG2 4.1Å; Q162-D306 PolarHBondContact NE2-OD1 2.94Å
163	A	92.3	Very high	87.4	Confident	28 Å²	28	45.9 Å²	45.9	23%	0.231	23%	0.228	C	C	.	.	H	α-helix	trans	-66.5	-40	177.5	0	0	0	0	0	112.2	L158 T159 R160 A165 V166 Q167	L158-A163 HydrophobicContact CB-CB 4.32Å; T159-A163 WeakPolarHBondContact O-CB 3.39Å; T159-A163 PolarHBondContact O-N 3.24Å; R160-A163 PolarHBondContact O-N 2.9Å; A163-A165 VanDerWaalsContact C-N 3.28Å; A163-A165 PolarHBondContact O-N 3.32Å; A163-V166 PolarHBondContact O-N 3.18Å; A163-Q167 WeakPolarHBondContact O-CB 3.29Å; A163-Q167 PolarHBondContact O-N 3.23Å
164	E	91.4	Very high	88.3	Confident	77 Å²	77	45.9 Å²	45.9	36%	0.36	23%	0.228	S	C	.	.	H	α-helix	trans	-60.6	-36.3	172.8	-73.7	169.4	173.5	0	0	111.7	R160 R168	R160-E164 HydrophobicContact CG-CG 4.49Å; R160-E164 IonicContact CZ-OE1 3.01Å; R160-E164 IonicContact NE-OE1 2.74Å; R160-E164 PolarHBondContact NE-OE1 3.39Å; R160-E164 IonicContact NH2-OE1 2.75Å; R160-E164 PolarHBondContact NH2-OE1 3.1Å; R160-E164 WeakPolarHBondContact O-CG 3.48Å; R160-E164 PolarHBondContact O-N 2.84Å; E164-R168 WeakPolarHBondContact O-CG 3.45Å; E164-R168 PolarHBondContact O-N 2.73Å; E164-R168 VanDerWaalsContact O-N 3.13Å; E164-R168 PolarHBondContact O-NE 3.48Å
165	A	91.7	Very high	89.1	Confident	0 Å²	0	48.3 Å²	48.3	0%	0	24%	0.241	C	C	.	.	H	α-helix	trans	-68.3	-46	173.6	0	0	0	0	0	112.9	T161 Q162 A163 Q167 R168 R169 A309	T161-A165 PolarHBondContact O-N 2.82Å; Q162-A165 PolarHBondContact O-N 3.13Å; A163-A165 VanDerWaalsContact C-N 3.28Å; A163-A165 PolarHBondContact O-N 3.32Å; A165-Q167 VanDerWaalsContact C-N 3.31Å; A165-Q167 PolarHBondContact O-N 2.94Å; A165-R168 PolarHBondContact O-N 2.93Å; A165-R169 WeakPolarHBondContact O-CG 3.44Å; A165-R169 PolarHBondContact O-N 3.33Å; A165-A309 HydrophobicContact CB-CB 3.63Å
166	V	91.8	Very high	89.5	Confident	1 Å²	1	46.4 Å²	46.4	1%	0.006	23%	0.232	C	C	.	.	H	α-helix	trans	-57.3	-44.9	173.8	170.5	0	0	0	0	111.2	W132 L138 L141 L155 L158 Q162 A163 R168 R169 L170 I305	W132-V166 HydrophobicContact CH2-CG2 3.94Å; W132-V166 HydrophobicContact CZ3-CG2 4.39Å; L138-V166 HydrophobicContact CD1-CB 4.38Å; L138-V166 HydrophobicContact CD1-CG1 3.7Å; L138-V166 HydrophobicContact CD1-CG2 3.7Å; L141-V166 HydrophobicContact CD1-CG1 3.9Å; L155-V166 HydrophobicContact CD2-CB 4.44Å; L155-V166 HydrophobicContact CD2-CG1 3.99Å; L158-V166 HydrophobicContact CD1-CG2 3.72Å; Q162-V166 WeakPolarHBondContact O-CG2 3.41Å; Q162-V166 PolarHBondContact O-N 3.07Å; A163-V166 PolarHBondContact O-N 3.18Å; V166-R168 PolarHBondContact O-N 3.26Å; V166-R169 PolarHBondContact O-N 3.2Å; V166-L170 PolarHBondContact O-N 2.92Å; V166-I305 HydrophobicContact CG2-CD1 4.28Å; V166-I305 HydrophobicContact CG2-CG1 4.22Å; V166-I305 HydrophobicContact CG2-CG2 3.85Å
167	Q	89.9	Confident	89.4	Confident	84 Å²	84	46.8 Å²	46.8	39%	0.393	22%	0.222	S	C	.	.	H	α-helix	trans	-61.7	-45.1	-180	-172.6	61	50.8	0	0	111.5	A163 A165 R169 L170 D171	A163-Q167 WeakPolarHBondContact O-CB 3.29Å; A163-Q167 PolarHBondContact O-N 3.23Å; A165-Q167 VanDerWaalsContact C-N 3.31Å; A165-Q167 PolarHBondContact O-N 2.94Å; Q167-R169 VanDerWaalsContact C-N 3.31Å; Q167-R169 PolarHBondContact O-N 2.83Å; Q167-L170 PolarHBondContact O-N 3.47Å; Q167-D171 PolarHBondContact NE2-OD1 2.88Å; Q167-D171 WeakPolarHBondContact O-CB 3.34Å; Q167-D171 PolarHBondContact O-N 3.42Å
168	R	90.2	Very high	89.1	Confident	97 Å²	97	55.2 Å²	55.2	37%	0.366	25%	0.253	S	S	.	.	H	α-helix	trans	-60.3	-38.3	177.6	-75.5	-176.5	-75.4	92.7	-5.4	112.8	E164 A165 V166 S172 D312	E164-R168 WeakPolarHBondContact O-CG 3.45Å; E164-R168 PolarHBondContact O-N 2.73Å; E164-R168 VanDerWaalsContact O-N 3.13Å; E164-R168 PolarHBondContact O-NE 3.48Å; A165-R168 PolarHBondContact O-N 2.93Å; V166-R168 PolarHBondContact O-N 3.26Å; R168-S172 PolarHBondContact O-N 2.68Å; R168-S172 PolarHBondContact O-OG 2.94Å; R168-D312 IonicContact CZ-OD2 2.79Å; R168-D312 IonicContact NH1-OD1 3.94Å; R168-D312 PolarHBondContact NH1-OD1 2.92Å; R168-D312 IonicContact NH1-OD2 3.21Å; R168-D312 PolarHBondContact NH1-OD2 2.86Å; R168-D312 IonicContact NH2-OD2 3.46Å; R168-D312 PolarHBondContact NH2-OD2 2.79Å
169	R	89.7	Confident	88.4	Confident	64 Å²	64	60.7 Å²	60.7	24%	0.242	28%	0.276	C	S	.	.	H	α-helix	trans	-68	-41.9	175.8	-61.1	-68.7	158.7	-167.2	-1.7	111.7	E129 W132 A165 V166 Q167 S172 Y173 T308 D312	E129-R169 VanDerWaalsContact OE1-CD 3.31Å; E129-R169 WeakPolarHBondContact OE1-CD 3.38Å; E129-R169 IonicContact OE1-CZ 2.77Å; E129-R169 IonicContact OE1-NE 3.34Å; E129-R169 IonicContact OE1-NH1 3.98Å; E129-R169 PolarHBondContact OE1-NH1 2.81Å; E129-R169 WeakPolarHBondContact OE2-CB 3.49Å; E129-R169 WeakPolarHBondContact OE2-CD 3.28Å; W132-R169 HydrophobicContact CD2-CB 4.47Å; W132-R169 HydrophobicContact CD2-CG 4.19Å; W132-R169 HydrophobicContact CE3-CB 3.82Å; W132-R169 HydrophobicContact CE3-CG 3.96Å; W132-R169 HydrophobicContact CH2-CB 4.4Å; W132-R169 HydrophobicContact CH2-CG 4.04Å; W132-R169 HydrophobicContact CZ2-CG 4.24Å; W132-R169 HydrophobicContact CZ3-CB 3.78Å; W132-R169 HydrophobicContact CZ3-CG 3.89Å; A165-R169 WeakPolarHBondContact O-CG 3.44Å; A165-R169 PolarHBondContact O-N 3.33Å; V166-R169 PolarHBondContact O-N 3.2Å; Q167-R169 VanDerWaalsContact C-N 3.31Å; Q167-R169 PolarHBondContact O-N 2.83Å; R169-S172 PolarHBondContact O-N 3.17Å; R169-Y173 PolarHBondContact O-N 3Å; R169-T308 HydrophobicContact CG-CG2 4.43Å; R169-D312 IonicContact CZ-OD1 2.86Å; R169-D312 IonicContact NH2-OD1 3.77Å; R169-D312 PolarHBondContact NH2-OD1 3.24Å
170	L	88.1	Confident	87.5	Confident	31 Å²	31	65.9 Å²	65.9	16%	0.162	30%	0.296	C	S	.	.	H	α-helix	trans	-63.8	-41.5	174.1	-175.9	62.7	0	0	0	112.3	L133 I142 V166 Q167 Y173 T174	L133-L170 HydrophobicContact CD1-CD1 4.28Å; I142-L170 HydrophobicContact CG2-CD1 3.65Å; V166-L170 PolarHBondContact O-N 2.92Å; Q167-L170 PolarHBondContact O-N 3.47Å; L170-Y173 HydrophobicContact CD1-CD1 4.46Å; L170-Y173 PolarHBondContact O-N 3.48Å; L170-T174 HydrophobicContact CD1-CG2 4.44Å; L170-T174 WeakPolarHBondContact O-CG2 3.33Å; L170-T174 PolarHBondContact O-N 3.42Å; L170-T174 PolarHBondContact O-OG1 3.04Å
171	D	88.1	Confident	86.3	Confident	68 Å²	68	62.9 Å²	62.9	36%	0.364	29%	0.294	S	S	.	.	H	α-helix	trans	-62.4	-46.9	176.1	-68	-22	0	0	0	110.8	Q167 Y173 T174 L175	Q167-D171 PolarHBondContact NE2-OD1 2.88Å; Q167-D171 WeakPolarHBondContact O-CB 3.34Å; Q167-D171 PolarHBondContact O-N 3.42Å; D171-Y173 PolarHBondContact O-N 3.34Å; D171-T174 PolarHBondContact O-N 3.3Å; D171-T174 PolarHBondContact O-OG1 3.26Å; D171-T174 VanDerWaalsContact O-OG1 3.05Å; D171-L175 WeakPolarHBondContact O-CB 3.42Å; D171-L175 VanDerWaalsContact O-CG 3.25Å; D171-L175 WeakPolarHBondContact O-CG 3.34Å; D171-L175 PolarHBondContact O-N 3.29Å
172	S	87.6	Confident	85.2	Confident	38 Å²	38	70.5 Å²	70.5	27%	0.266	33%	0.326	S	S	.	.	H	α-helix	trans	-56.8	-46.9	173.2	-68.7	0	0	0	0	112.5	R168 R169 L175 S176	R168-S172 PolarHBondContact O-N 2.68Å; R168-S172 PolarHBondContact O-OG 2.94Å; R169-S172 PolarHBondContact O-N 3.17Å; S172-L175 PolarHBondContact O-N 2.96Å; S172-S176 WeakPolarHBondContact O-CB 3.45Å; S172-S176 PolarHBondContact O-N 3.39Å; S172-S176 PolarHBondContact O-OG 3.14Å
173	Y	87.2	Confident	83.2	Confident	18 Å²	18	77.9 Å²	77.9	7%	0.071	37%	0.365	C	S	.	.	H	α-helix	trans	-59.1	-49.2	175.2	169.6	-97.9	0	0	0	112	E130 L133 I142 R169 L170 D171 L175 S176 R177	E130-Y173 HydrophobicContact CB-CD2 3.97Å; E130-Y173 HydrophobicContact CB-CE2 3.78Å; E130-Y173 HydrophobicContact CG-CE2 4.13Å; L133-Y173 HydrophobicContact CD1-CG 4.32Å; I142-Y173 HydrophobicContact CB-CD1 4.49Å; I142-Y173 HydrophobicContact CB-CE1 3.78Å; I142-Y173 HydrophobicContact CD1-CE1 4.45Å; I142-Y173 HydrophobicContact CD1-CE2 4.43Å; I142-Y173 HydrophobicContact CG2-CD1 3.58Å; I142-Y173 HydrophobicContact CG2-CE1 3.36Å; I142-Y173 HydrophobicContact CG2-CG 4.44Å; R169-Y173 PolarHBondContact O-N 3Å; L170-Y173 HydrophobicContact CD1-CD1 4.46Å; L170-Y173 PolarHBondContact O-N 3.48Å; D171-Y173 PolarHBondContact O-N 3.34Å; Y173-L175 PolarHBondContact O-N 2.96Å; Y173-S176 PolarHBondContact O-N 3.25Å; Y173-R177 WeakPolarHBondContact O-CB 3.34Å; Y173-R177 PolarHBondContact O-N 2.89Å; Y173-R177 PolarHBondContact OH-NH1 3.29Å
174	T	86.1	Confident	81.3	Confident	35 Å²	35	81.6 Å²	81.6	22%	0.215	39%	0.387	C	S	.	.	H	α-helix	trans	-67.3	-34.8	-178.8	63.4	0	0	0	0	112.8	L170 D171 R177 R178	L170-T174 HydrophobicContact CD1-CG2 4.44Å; L170-T174 WeakPolarHBondContact O-CG2 3.33Å; L170-T174 PolarHBondContact O-N 3.42Å; L170-T174 PolarHBondContact O-OG1 3.04Å; D171-T174 PolarHBondContact O-N 3.3Å; D171-T174 PolarHBondContact O-OG1 3.26Å; D171-T174 VanDerWaalsContact O-OG1 3.05Å; T174-R177 PolarHBondContact O-N 3.29Å; T174-R178 WeakPolarHBondContact O-CB 3.37Å; T174-R178 VanDerWaalsContact O-CG 3.23Å; T174-R178 WeakPolarHBondContact O-CG 3.39Å; T174-R178 PolarHBondContact O-N 3.47Å
175	L	86.4	Confident	79.4	Confident	89 Å²	89	83.9 Å²	83.9	47%	0.466	41%	0.408	S	S	.	.	H	α-helix	trans	-64.4	-46	173.4	-74	170	0	0	0	111.4	D171 S172 Y173 R178 K179	D171-L175 WeakPolarHBondContact O-CB 3.42Å; D171-L175 VanDerWaalsContact O-CG 3.25Å; D171-L175 WeakPolarHBondContact O-CG 3.34Å; D171-L175 PolarHBondContact O-N 3.29Å; S172-L175 PolarHBondContact O-N 2.96Å; Y173-L175 PolarHBondContact O-N 2.96Å; L175-R178 PolarHBondContact O-N 3.48Å; L175-K179 WeakPolarHBondContact O-CG 3.45Å; L175-K179 PolarHBondContact O-N 2.98Å
176	S	84.3	Confident	77.6	Confident	15 Å²	15	94.3 Å²	94.3	11%	0.105	45%	0.447	C	S	.	.	H	α-helix	trans	-62.7	-41.7	175.5	-68.6	0	0	0	0	111.8	S172 Y173 K179 K180	S172-S176 WeakPolarHBondContact O-CB 3.45Å; S172-S176 PolarHBondContact O-N 3.39Å; S172-S176 PolarHBondContact O-OG 3.14Å; Y173-S176 PolarHBondContact O-N 3.25Å; S176-K179 PolarHBondContact O-N 3.34Å; S176-K180 WeakPolarHBondContact O-CB 3.39Å; S176-K180 PolarHBondContact O-N 3.3Å
177	R	80.4	Confident	75.9	Confident	86 Å²	86	97.9 Å²	97.9	33%	0.325	47%	0.467	S	S	.	.	H	α-helix	trans	-63.8	-43.6	174.9	-163.7	168.3	82.1	178.6	12.7	112.4	Y173 T174 K179 K180 N181	Y173-R177 WeakPolarHBondContact O-CB 3.34Å; Y173-R177 PolarHBondContact O-N 2.89Å; Y173-R177 PolarHBondContact OH-NH1 3.29Å; T174-R177 PolarHBondContact O-N 3.29Å; R177-K179 VanDerWaalsContact C-N 3.35Å; R177-K179 PolarHBondContact O-N 3.39Å; R177-K180 PolarHBondContact O-N 2.86Å; R177-N181 WeakPolarHBondContact O-CB 3.47Å; R177-N181 VanDerWaalsContact O-CG 3.3Å; R177-N181 PolarHBondContact O-N 2.87Å; R177-N181 PolarHBondContact O-OD1 2.92Å
178	R	80	Confident	74.3	Confident	179 Å²	179	99.2 Å²	99.2	68%	0.675	48%	0.48	S	S	*	.	H	α-helix	trans	-63.2	-37.3	174.9	-75.9	172	-178.1	176.4	3.7	112.6	T174 L175 K182	T174-R178 WeakPolarHBondContact O-CB 3.37Å; T174-R178 VanDerWaalsContact O-CG 3.23Å; T174-R178 WeakPolarHBondContact O-CG 3.39Å; T174-R178 PolarHBondContact O-N 3.47Å; L175-R178 PolarHBondContact O-N 3.48Å; R178-K182 PolarHBondContact O-N 3.12Å
179	K	76.6	Confident	72.7	Confident	133 Å²	133	103.8 Å²	103.8	58%	0.578	50%	0.498	S	S	*	.	H	α-helix	trans	-68	-45.1	174.4	-72.7	171.7	-177	175.1	0	111.5	L175 S176 R177 N181 K182	L175-K179 WeakPolarHBondContact O-CG 3.45Å; L175-K179 PolarHBondContact O-N 2.98Å; S176-K179 PolarHBondContact O-N 3.34Å; R177-K179 VanDerWaalsContact C-N 3.35Å; R177-K179 PolarHBondContact O-N 3.39Å; K179-N181 VanDerWaalsContact C-N 3.33Å; K179-N181 PolarHBondContact O-N 2.99Å; K179-K182 WeakPolarHBondContact O-CB 3.35Å; K179-K182 PolarHBondContact O-N 2.99Å; K179-K182 VanDerWaalsContact O-N 3.15Å
180	K	74	Confident	71.1	Confident	146 Å²	146	107 Å²	107	64%	0.635	52%	0.519	S	S	*	.	H	α-helix	trans	-62	-36.9	177.1	-171.9	174.5	-178.2	171.4	0	112.9	S176 R177 K182	S176-K180 WeakPolarHBondContact O-CB 3.39Å; S176-K180 PolarHBondContact O-N 3.3Å; R177-K180 PolarHBondContact O-N 2.86Å; K180-K182 VanDerWaalsContact C-N 3.28Å; K180-K182 PolarHBondContact O-N 2.97Å
181	N	67.8	Low	69.7	Low	123 Å²	123	110.7 Å²	110.7	66%	0.658	54%	0.538	S	S	*	.	T	Hydrogen-bonded Turn	trans	-82	-1.8	178.2	-67.6	5.7	0	0	0	113.5	R177 K179 L183	R177-N181 WeakPolarHBondContact O-CB 3.47Å; R177-N181 VanDerWaalsContact O-CG 3.3Å; R177-N181 PolarHBondContact O-N 2.87Å; R177-N181 PolarHBondContact O-OD1 2.92Å; K179-N181 VanDerWaalsContact C-N 3.33Å; K179-N181 PolarHBondContact O-N 2.99Å; N181-L183 PolarHBondContact O-N 2.88Å
182	K	70.8	Confident	67.8	Low	169 Å²	169	115.6 Å²	115.6	74%	0.735	56%	0.556	S	S	*	*	S	Bend	trans	-82.2	114.2	176.6	-150.7	176	-172.9	-176.1	0	108.3	R178 K179 K180	R178-K182 PolarHBondContact O-N 3.12Å; K179-K182 WeakPolarHBondContact O-CB 3.35Å; K179-K182 PolarHBondContact O-N 2.99Å; K179-K182 VanDerWaalsContact O-N 3.15Å; K180-K182 VanDerWaalsContact C-N 3.28Å; K180-K182 PolarHBondContact O-N 2.97Å
183	L	52.3	Low	65.5	Low	155 Å²	155	118.9 Å²	118.9	81%	0.812	58%	0.58	S	S	*	*	P	Polyproline II helix	trans	-51.4	140.7	173.9	-73.4	164.2	0	0	0	110	N181	N181-L183 PolarHBondContact O-N 2.88Å
184	P	52.8	Low	63.1	Low	106 Å²	106	123.4 Å²	123.4	69%	0.688	61%	0.614	S	S	*	*	P	Polyproline II helix	trans	-57.4	144.3	173.2	25.6	-33.5	0	0	0	109.3	R186	P184-R186 PolarHBondContact O-N 3.32Å
185	P	51.8	Low	61.4	Low	125 Å²	125	127.2 Å²	127.2	81%	0.812	64%	0.639	S	S	*	*	P	Polyproline II helix	trans	-57.7	126.2	173	25.8	-32.8	0	0	0	108.3	D187	P185-D187 PolarHBondContact O-N 3.16Å
186	R	53.6	Low	58.9	Low	218 Å²	218	130.7 Å²	130.7	82%	0.823	66%	0.657	S	S	*	*	P	Polyproline II helix	trans	-58.5	133.7	174.9	-65.3	-175	178.1	-162.2	-1.3	108.4	P184 V188	P184-R186 PolarHBondContact O-N 3.32Å; R186-V188 PolarHBondContact O-N 3.38Å
187	D	56.1	Low	56.5	Low	77 Å²	77	134.4 Å²	134.4	41%	0.412	69%	0.688	S	S	.	*	P	Polyproline II helix	trans	-63.9	136	172.4	-168.1	-27	0	0	0	107.7	P185 R189 D190	P185-D187 PolarHBondContact O-N 3.16Å; D187-R189 PolarHBondContact O-N 3.34Å; D187-R189 VanDerWaalsContact O-N 3.13Å; D187-R189 WeakPolarHBondContact OD1-CB 3.47Å; D187-R189 VanDerWaalsContact OD1-CG 3.31Å; D187-R189 WeakPolarHBondContact OD1-CG 3.29Å; D187-R189 PolarHBondContact OD1-N 3.46Å; D187-D190 WeakPolarHBondContact O-CB 3.32Å; D187-D190 PolarHBondContact O-N 2.69Å
188	V	56	Low	54.3	Low	112 Å²	112	139.5 Å²	139.5	68%	0.679	72%	0.716	S	S	*	*	G	3₁₀ helix	trans	-60.8	-22.6	177.8	-135.3	0	0	0	0	111.2	R186 D190 I191	R186-V188 PolarHBondContact O-N 3.38Å; V188-D190 VanDerWaalsContact C-N 3.28Å; V188-D190 PolarHBondContact O-N 2.79Å; V188-I191 PolarHBondContact O-N 2.87Å
189	R	56.8	Low	51.9	Low	193 Å²	193	135.2 Å²	135.2	73%	0.728	72%	0.719	S	S	*	*	G	3₁₀ helix	trans	-65.1	-26.1	174.2	-63.9	172.9	-177.2	-168.2	0.5	113.5	D187 I191	D187-R189 PolarHBondContact O-N 3.34Å; D187-R189 VanDerWaalsContact O-N 3.13Å; D187-R189 WeakPolarHBondContact OD1-CB 3.47Å; D187-R189 VanDerWaalsContact OD1-CG 3.31Å; D187-R189 WeakPolarHBondContact OD1-CG 3.29Å; D187-R189 PolarHBondContact OD1-N 3.46Å; R189-I191 PolarHBondContact O-N 3.29Å
190	D	56.8	Low	49.6	Very low	130 Å²	130	137.3 Å²	137.3	70%	0.695	74%	0.735	S	S	*	*	G	3₁₀ helix	trans	-76.5	-3.3	179.5	-63.5	-28.9	0	0	0	113.3	D187 V188	D187-D190 WeakPolarHBondContact O-CB 3.32Å; D187-D190 PolarHBondContact O-N 2.69Å; V188-D190 VanDerWaalsContact C-N 3.28Å; V188-D190 PolarHBondContact O-N 2.79Å
191	I	57.8	Low	47.6	Very low	110 Å²	110	137.9 Å²	137.9	56%	0.564	75%	0.745	S	S	*	*	G	3₁₀ helix	trans	-99.9	-23.6	179.3	-55.6	180	0	0	0	111.7	V188 R189	V188-I191 PolarHBondContact O-N 2.87Å; R189-I191 PolarHBondContact O-N 3.29Å
192	F	48.1	Very low	46.2	Very low	170 Å²	170	137.8 Å²	137.8	75%	0.746	75%	0.75	S	S	*	*			trans	-133.5	95.6	-173.6	-65.5	-74.7	0	0	0	113
193	S	40.4	Very low	44.1	Very low	108 Å²	108	138 Å²	138	76%	0.755	75%	0.754	S	S	*	*			trans	-138.5	125.1	162.6	-68.2	0	0	0	0	105.8
194	S	35.7	Very low	43	Very low	113 Å²	113	136.5 Å²	136.5	79%	0.79	76%	0.756	S	S	*	*			cis	-146.4	-148.1	17.3	-60.4	0	0	0	0	111.7
195	P	50.5	Low	41.8	Very low	114 Å²	114	139.2 Å²	139.2	74%	0.74	76%	0.76	S	S	*	*				-99.9	168	-119.4	40.1	-26.8	0	0	0	115.2
196	I	35.5	Very low	40.6	Very low	163 Å²	163	140.4 Å²	140.4	84%	0.836	76%	0.76	S	S	*	*			trans	175.1	139.5	132.3	-93	156	0	0	0	113.1
197	A	32	Very low	39.4	Very low	93 Å²	93	133.8 Å²	133.8	77%	0.769	75%	0.746	S	S	*	*			trans	54.3	136	155	0	0	0	0	0	124.5
198	Q	36.1	Very low	38.1	Very low	192 Å²	192	138.9 Å²	138.9	90%	0.897	77%	0.765	S	S	*	*			trans	-57.8	149.3	167	-58.9	150.1	-21.4	0	0	114.7
199	A	28.1	Very low	36.7	Very low	90 Å²	90	139.8 Å²	139.8	74%	0.744	77%	0.766	S	S	*	*				-173.6	118.6	127.8	0	0	0	0	0	114
200	L	29.4	Very low	35.3	Very low	177 Å²	177	138 Å²	138	93%	0.927	77%	0.77	S	S	*	*			trans	56.2	147.8	140.1	-66	162.6	0	0	0	124
201	L	30.8	Very low	34.5	Very low	158 Å²	158	137 Å²	137	83%	0.827	77%	0.77	S	S	*	*			trans	-75.1	177.1	179.9	-78.7	169.9	0	0	0	113.1
202	P	38.4	Very low	33.4	Very low	120 Å²	120	140.4 Å²	140.4	78%	0.779	78%	0.784	S	S	*	*			cis	-146.4	-169.1	28.3	43.5	-21.1	0	0	0	119.4
203	E	28	Very low	32.4	Very low	175 Å²	175	142.5 Å²	142.5	82%	0.818	79%	0.793	S	S	*	*			trans	-57.5	158.4	-171.1	-51.6	170.7	127.4	0	0	117.5
204	S	27.7	Very low	31.8	Very low	122 Å²	122	142.2 Å²	142.2	85%	0.853	79%	0.791	S	S	*	*			trans	-150.9	142.2	137.5	51.4	0	0	0	0	111.7
205	Q	27.3	Very low	31.5	Very low	164 Å²	164	145.3 Å²	145.3	77%	0.766	80%	0.795	S	S	*	*			trans	-88.1	148	179.4	-58.1	169.2	-13	0	0	110.3
206	N	27.6	Very low	30.3	Very low	150 Å²	150	144.1 Å²	144.1	80%	0.802	80%	0.795	S	S	*	*				-173	147.6	113.5	-105.7	-57.5	0	0	0	117.6
207	S	27.3	Very low	30.1	Very low	78 Å²	78	141.7 Å²	141.7	55%	0.545	79%	0.792	S	S	.	*			trans	-54.5	152.7	172.3	54.3	0	0	0	0	117.9
208	K	29.3	Very low	29.8	Very low	185 Å²	185	144.1 Å²	144.1	80%	0.804	80%	0.797	S	S	*	*				171.8	108.8	106.8	-91.2	170.5	-173.8	179.1	0	115.6
209	D	27.1	Very low	29.3	Very low	130 Å²	130	139.6 Å²	139.6	70%	0.695	79%	0.793	S	S	*	*				38.1	113.3	124.6	-57.2	-35.6	0	0	0	123.5
210	L	26.8	Very low	29.4	Very low	155 Å²	155	144.6 Å²	144.6	81%	0.812	80%	0.798	S	S	*	*				57.9	167.6	113.1	-74.8	158.7	0	0	0	121.5
211	P	40.2	Very low	29.3	Very low	109 Å²	109	144.8 Å²	144.8	71%	0.708	80%	0.796	S	S	*	*			cis	-131.3	170.2	-7.4	31	-10.2	0	0	0	116.8
212	Q	35.2	Very low	29.4	Very low	183 Å²	183	142 Å²	142	86%	0.855	79%	0.787	S	S	*	*			trans	-74	161.6	157.6	-65.5	164.2	-65.4	0	0	112.1
213	K	26.8	Very low	28.8	Very low	213 Å²	213	146.4 Å²	146.4	93%	0.926	80%	0.795	S	S	*	*			trans	-135.7	156.3	157.7	-93.4	-173	176.3	178.7	0	111.5
214	S	27	Very low	28.6	Very low	102 Å²	102	143.3 Å²	143.3	71%	0.713	79%	0.793	S	S	*	*			trans	-138.6	159	-165	74.1	0	0	0	0	114.6
215	M	29.6	Very low	28.5	Very low	178 Å²	178	142.3 Å²	142.3	88%	0.877	79%	0.792	S	S	*	*			trans	73.4	144.8	150.4	-65.8	-150.4	-67.5	0	0	123.8
216	A	26.7	Very low	28.4	Very low	89 Å²	89	140.9 Å²	140.9	74%	0.736	79%	0.794	S	S	*	*			trans	111.8	94.5	134.2	0	0	0	0	0	121.4
217	S	29.7	Very low	28.6	Very low	112 Å²	112	139.2 Å²	139.2	78%	0.783	79%	0.794	S	S	*	*				57	151.3	111.1	-50.4	0	0	0	0	126
218	V	26.7	Very low	28.7	Very low	145 Å²	145	140.6 Å²	140.6	88%	0.879	80%	0.801	S	S	*	*			trans	81.6	140.6	161	-152.7	0	0	0	0	114.7
219	A	25.5	Very low	28.5	Very low	97 Å²	97	140.8 Å²	140.8	80%	0.802	81%	0.805	S	S	*	*			cis	-145.5	178.4	22.4	0	0	0	0	0	115.6
220	K	29.9	Very low	28.7	Very low	194 Å²	194	143.4 Å²	143.4	84%	0.843	81%	0.813	S	S	*	*			trans	-121.6	153.1	171.5	-109.4	-175.3	179.8	178.2	0	110.4
221	M	26.7	Very low	28.7	Very low	182 Å²	182	144.9 Å²	144.9	90%	0.897	82%	0.815	S	S	*	*			trans	-164.8	168.6	146.7	-96	-40.5	129.5	0	0	111
222	P	34.6	Very low	28.3	Very low	99 Å²	99	151.8 Å²	151.8	64%	0.643	83%	0.827	S	S	*	*			trans	-119.5	175.4	-144.6	43.3	-32.4	0	0	0	115.8
223	F	24.5	Very low	28.2	Very low	212 Å²	212	145.9 Å²	145.9	93%	0.93	81%	0.81	S	S	*	*			trans	-128.9	157	161.7	-87	-78.9	0	0	0	112.4
224	S	25.4	Very low	28.6	Very low	111 Å²	111	139.6 Å²	139.6	78%	0.776	80%	0.797	S	S	*	*			trans	-86.9	160.6	-157.9	47	0	0	0	0	115.6
225	A	24.7	Very low	29.7	Very low	101 Å²	101	139.8 Å²	139.8	84%	0.835	80%	0.796	S	S	*	*			trans	-85.2	145.3	175.9	0	0	0	0	0	112.5
226	V	24.6	Very low	31	Very low	133 Å²	133	136.1 Å²	136.1	81%	0.806	78%	0.775	S	S	*	*			trans	-133.6	127.4	163.5	178.9	0	0	0	0	107.9
227	S	32.8	Very low	33.2	Very low	115 Å²	115	136.6 Å²	136.6	80%	0.804	76%	0.762	S	S	*	*			trans	-77.2	144.8	174.6	-63.3	0	0	0	0	111.5
228	P	29.7	Very low	35.6	Very low	108 Å²	108	133.6 Å²	133.6	70%	0.701	74%	0.736	S	S	*	*			trans	-117.2	157.6	144.8	-0.3	21.5	0	0	0	112.5
229	E	25.3	Very low	38.1	Very low	188 Å²	188	131.9 Å²	131.9	88%	0.879	72%	0.717	S	S	*	*			trans	-83.3	173	-167.1	-62.4	166.7	123.4	0	0	114.1	Q231	E229-Q231 PolarHBondContact O-N 3.2Å
230	H	30.5	Very low	40.9	Very low	186 Å²	186	127.3 Å²	127.3	86%	0.861	68%	0.679	S	S	*	*			trans	-71.8	115	-174.8	-62.3	85.2	0	0	0	112.6
231	Q	27.5	Very low	43.6	Very low	185 Å²	185	120.8 Å²	120.8	86%	0.864	65%	0.653	S	S	*	*			trans	-125.3	125.2	156.5	-67.5	-173.3	7.8	0	0	109	E229 A233	E229-Q231 PolarHBondContact O-N 3.2Å; Q231-A233 PolarHBondContact O-N 3.49Å
232	R	32	Very low	46.6	Very low	255 Å²	255	112.3 Å²	112.3	96%	0.962	61%	0.611	S	S	*	*			trans	-66.9	112	174.6	-83.6	178.8	169.5	156.3	-2.4	109.2
233	A	32.4	Very low	49.2	Very low	59 Å²	59	111.7 Å²	111.7	49%	0.488	60%	0.602	S	S	.	*	P	Polyproline II helix	trans	-69.1	142.9	169.4	0	0	0	0	0	110.6	Q231 E269	Q231-A233 PolarHBondContact O-N 3.49Å; A233-E269 WeakPolarHBondContact CB-OE1 3.44Å
234	A	35.4	Very low	52.4	Low	80 Å²	80	105 Å²	105	66%	0.661	58%	0.576	S	S	*	*	P	Polyproline II helix	trans	-67.3	152.3	164.4	0	0	0	0	0	109.6	K236	A234-K236 PolarHBondContact O-N 2.86Å; A234-K236 VanDerWaalsContact O-N 3.13Å
235	P	48.6	Very low	55.7	Low	107 Å²	107	99.9 Å²	99.9	70%	0.695	54%	0.54	S	S	*	.	P	Polyproline II helix	trans	-58	121.6	179.9	24.1	-34.2	0	0	0	110.4	E237	P235-E237 PolarHBondContact O-N 3.36Å
236	K	58.8	Low	59.1	Low	100 Å²	100	95.1 Å²	95.1	44%	0.435	50%	0.5	S	S	.	.	P	Polyproline II helix	trans	-55.8	132.6	177.2	-69.9	173.5	179.9	169.1	0	109.9	A234 P274 R275	A234-K236 PolarHBondContact O-N 2.86Å; A234-K236 VanDerWaalsContact O-N 3.13Å; K236-P274 WeakPolarHBondContact O-CB 3.49Å; K236-R275 PolarHBondContact O-N 3.29Å
237	E	72.4	Confident	62.4	Low	100 Å²	100	88.8 Å²	88.8	47%	0.467	46%	0.462	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-96.2	127.5	170.1	-60.9	-163.8	137	0	0	108.9	P235 R275 I277	P235-E237 PolarHBondContact O-N 3.36Å; E237-R275 WeakPolarHBondContact CA-O 3.4Å; E237-R275 HydrophobicContact CG-CB 4.46Å; E237-R275 IonicContact OE1-NH1 2.93Å; E237-R275 PolarHBondContact OE1-NH1 2.97Å; E237-I277 HydrophobicContact CB-CD1 4.22Å; E237-I277 HydrophobicContact CG-CD1 4.33Å; E237-I277 WeakPolarHBondContact OE2-CD1 3.26Å
238	E	78.8	Confident	65.3	Low	48 Å²	48	85.4 Å²	85.4	22%	0.224	43%	0.433	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-107.5	134.2	177.1	-81.8	-172.8	-148.9	0	0	110.5	R275 V276 I277 R445	E238-R275 PolarHBondContact N-O 3.13Å; E238-V276 HydrophobicContact CB-CG2 4.21Å; E238-V276 CarbonylContact O-C 3.56Å; E238-V276 VanDerWaalsContact O-CA 3.29Å; E238-V276 WeakPolarHBondContact O-CA 3.43Å; E238-I277 PolarHBondContact O-N 2.84Å; E238-R445 PolarHBondContact OE2-N 2.94Å
239	F	79.3	Confident	68.3	Low	109 Å²	109	80.5 Å²	80.5	48%	0.478	40%	0.401	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-95.7	123.8	177.4	-66.6	-83.3	0	0	0	111.5	I277 P279 R445	F239-I277 WeakPolarHBondContact CA-O 3.19Å; F239-I277 HydrophobicContact CD1-CB 4.1Å; F239-I277 HydrophobicContact CD1-CG2 4.18Å; F239-I277 HydrophobicContact CE1-CB 4.12Å; F239-I277 HydrophobicContact CE1-CD1 4.41Å; F239-I277 HydrophobicContact CE1-CG2 4.03Å; F239-P279 HydrophobicContact CD1-CG 4.37Å; F239-R445 VanDerWaalsContact O-CZ 3.24Å; F239-R445 PolarHBondContact O-NE 2.88Å; F239-R445 PolarHBondContact O-NH1 2.81Å
240	L	85	Confident	71.4	Confident	2 Å²	2	71.6 Å²	71.6	1%	0.01	36%	0.36	C	S	.	.			trans	-97.3	109.8	171.5	-151.3	97.1	0	0	0	109.9	T242 Y246 V276 I277 P279 R445 L448 L533	L240-T242 HydrophobicContact CD2-CG2 4.13Å; L240-Y246 HydrophobicContact CD2-CE1 4.46Å; L240-V276 HydrophobicContact CB-CG1 3.97Å; L240-V276 HydrophobicContact CD1-CG1 4.42Å; L240-I277 PolarHBondContact N-O 2.82Å; L240-P279 WeakPolarHBondContact O-CD 3.4Å; L240-R445 HydrophobicContact CD1-CG 4.11Å; L240-L448 HydrophobicContact CD1-CB 3.96Å; L240-L448 HydrophobicContact CD1-CD1 4.37Å; L240-L533 HydrophobicContact CD1-CD2 4.5Å; L240-L533 HydrophobicContact CD2-CD1 3.91Å; L240-L533 HydrophobicContact CD2-CD2 4.11Å; L240-L533 HydrophobicContact CD2-CG 4.2Å
241	I	86.8	Confident	74.3	Confident	57 Å²	57	63.8 Å²	63.8	29%	0.292	33%	0.325	S	S	.	.			trans	-85.3	128.6	175.4	-59.4	176	0	0	0	108.5	I244 Q249 R445	I241-I244 HydrophobicContact CG2-CD1 4.41Å; I241-I244 HydrophobicContact CG2-CG1 4.3Å; I241-Q249 PolarHBondContact O-NE2 2.84Å; I241-R445 VanDerWaalsContact CG1-NH2 3.31Å
242	T	90.1	Very high	77.1	Confident	4 Å²	4	58.5 Å²	58.5	3%	0.025	30%	0.302	C	S	.	.			trans	-113	-5.1	-178	51.9	0	0	0	0	113.7	L240 P538 N539 F540	L240-T242 HydrophobicContact CD2-CG2 4.13Å; T242-P538 HydrophobicContact CG2-CB 4.47Å; T242-N539 PolarHBondContact O-N 3.21Å; T242-N539 PolarHBondContact OG1-ND2 2.89Å; T242-F540 WeakPolarHBondContact O-CD1 3.46Å; T242-F540 PolarHBondContact O-N 3.45Å
243	D	89.1	Confident	79.6	Confident	85 Å²	85	49.7 Å²	49.7	46%	0.455	27%	0.271	S	S	.	.	S	Bend	trans	-83.3	-14.6	179.4	-52.2	-61.8	0	0	0	113.9	N539	D243-N539 VanDerWaalsContact OD1-CB 3.26Å; D243-N539 WeakPolarHBondContact OD1-CB 3.3Å; D243-N539 PolarHBondContact OD1-ND2 2.8Å
244	I	91.6	Very high	82.1	Confident	73 Å²	73	50.1 Å²	50.1	37%	0.374	26%	0.264	S	S	.	.	S	Bend	trans	-115.4	139.6	179.3	-55.8	175.6	0	0	0	108.2	I241 E248 Q249 F540	I241-I244 HydrophobicContact CG2-CD1 4.41Å; I241-I244 HydrophobicContact CG2-CG1 4.3Å; I244-E248 HydrophobicContact CG2-CB 3.99Å; I244-Q249 HydrophobicContact CB-CG 3.98Å; I244-Q249 HydrophobicContact CG2-CG 3.81Å; I244-Q249 PolarHBondContact O-NE2 2.84Å; I244-F540 VanDerWaalsContact O-CD1 3.31Å; I244-F540 WeakPolarHBondContact O-CD1 3.06Å
245	A	94.6	Very high	84.4	Confident	3 Å²	3	52.6 Å²	52.6	3%	0.025	26%	0.26	C	S	.	.			trans	-55.3	141.1	175.4	0	0	0	0	0	112.3	T159 C247 E248 Q249 F540	T159-A245 HydrophobicContact CG2-CB 3.64Å; A245-C247 VanDerWaalsContact C-N 3.31Å; A245-C247 PolarHBondContact O-N 3.06Å; A245-E248 HydrophobicContact CB-CB 4.4Å; A245-E248 HydrophobicContact CB-CG 4.03Å; A245-E248 PolarHBondContact O-N 3.5Å; A245-Q249 WeakPolarHBondContact O-CG 3.44Å; A245-Q249 PolarHBondContact O-N 3.4Å; A245-F540 HydrophobicContact CB-CD2 3.75Å; A245-F540 HydrophobicContact CB-CE2 3.81Å; A245-F540 HydrophobicContact CB-CG 4.23Å; A245-F540 HydrophobicContact CB-CZ 4.35Å
246	Y	95.6	Very high	85.9	Confident	0 Å²	0	53.1 Å²	53.1	0%	0	25%	0.253	C	S	.	.	H	α-helix	trans	-69.9	-30.1	-171.6	-63.1	-38.5	0	0	0	112.5	L240 Q249 A250 D306 H449 N452 L453 P538 F540	L240-Y246 HydrophobicContact CD2-CE1 4.46Å; Y246-Q249 PolarHBondContact O-N 2.77Å; Y246-A250 PolarHBondContact O-N 3.46Å; Y246-D306 WeakPolarHBondContact CB-OD2 3.43Å; Y246-D306 PolarHBondContact N-OD2 2.75Å; Y246-D306 VanDerWaalsContact N-OD2 3.08Å; Y246-H449 HydrophobicContact CD1-CB 4.01Å; Y246-H449 AromaticContact CD1-CD2 3.3Å; Y246-H449 WeakPolarHBondContact CD1-CD2 3.41Å; Y246-H449 AromaticContact CD1-CE1 3.7Å; Y246-H449 AromaticContact CD1-CG 3.4Å; Y246-H449 VanDerWaalsContact CD1-CG 3.4Å; Y246-H449 AromaticContact CD1-ND1 3.64Å; Y246-H449 AromaticContact CD1-NE2 3.55Å; Y246-H449 HydrophobicContact CD2-CB 3.63Å; Y246-H449 AromaticContact CD2-CG 4Å; Y246-H449 HydrophobicContact CE1-CB 4.42Å; Y246-H449 AromaticContact CE1-CD2 3.29Å; Y246-H449 WeakPolarHBondContact CE1-CD2 3.49Å; Y246-H449 AromaticContact CE1-CG 3.84Å; Y246-H449 AromaticContact CE1-NE2 3.68Å; Y246-H449 HydrophobicContact CE2-CB 4.09Å; Y246-H449 HydrophobicContact CG-CB 3.57Å; Y246-H449 AromaticContact CG-CD2 3.86Å; Y246-H449 AromaticContact CG-CG 3.48Å; Y246-H449 VanDerWaalsContact CG-CG 3.48Å; Y246-H449 AromaticContact CG-ND1 3.8Å; Y246-H449 AromaticContact CZ-CD2 3.84Å; Y246-N452 HydrophobicContact CE2-CB 4.36Å; Y246-N452 WeakPolarHBondContact CE2-OD1 3.25Å; Y246-N452 PolarHBondContact OH-OD1 3.39Å; Y246-L453 HydrophobicContact CD2-CD1 3.84Å; Y246-L453 HydrophobicContact CD2-CD2 3.96Å; Y246-L453 HydrophobicContact CD2-CG 3.73Å; Y246-L453 HydrophobicContact CE2-CD2 4.17Å; Y246-L453 HydrophobicContact CE2-CG 4.06Å; Y246-P538 HydrophobicContact CE2-CG 3.91Å; Y246-P538 VanDerWaalsContact OH-CG 3.24Å; Y246-P538 WeakPolarHBondContact OH-CG 3.12Å; Y246-F540 HydrophobicContact CD1-CE1 4.08Å; Y246-F540 HydrophobicContact CD2-CE1 4.1Å; Y246-F540 HydrophobicContact CD2-CZ 4.27Å; Y246-F540 HydrophobicContact CE1-CE1 4.21Å; Y246-F540 HydrophobicContact CE2-CE1 4.23Å; Y246-F540 HydrophobicContact CG-CE1 4.04Å; Y246-F540 HydrophobicContact CG-CZ 4.37Å
247	C	94.4	Very high	86.2	Confident	0 Å²	0	52 Å²	52	0%	0	26%	0.263	C	S	.	.	H	α-helix	trans	-65.3	-43.2	172	66.6	0	0	0	0	112.2	T161 A245 Q249 A250 V251 D306 A309 L310 L313	T161-C247 HydrophobicContact CG2-CB 4.18Å; A245-C247 VanDerWaalsContact C-N 3.31Å; A245-C247 PolarHBondContact O-N 3.06Å; C247-Q249 VanDerWaalsContact C-N 3.31Å; C247-Q249 PolarHBondContact O-N 2.84Å; C247-A250 WeakPolarHBondContact O-CB 3.36Å; C247-A250 PolarHBondContact O-N 2.87Å; C247-A250 VanDerWaalsContact O-N 3.08Å; C247-V251 PolarHBondContact O-N 2.88Å; C247-D306 PolarHBondContact SG-OD1 2.85Å; C247-A309 HydrophobicContact CB-CB 3.77Å; C247-L310 HydrophobicContact CB-CB 4.48Å; C247-L313 HydrophobicContact CB-CD1 3.85Å; C247-L313 VanDerWaalsContact O-CD1 3.23Å; C247-L313 WeakPolarHBondContact O-CD1 3.49Å
248	E	94.3	Very high	85.5	Confident	44 Å²	44	53.5 Å²	53.5	21%	0.206	27%	0.274	C	S	.	.	H	α-helix	trans	-62.6	-38.1	175.7	-62.7	-68.7	161.5	0	0	111.5	T159 R160 T161 I244 A245 V251 I252	T159-E248 WeakPolarHBondContact CB-OE1 3.42Å; T159-E248 HydrophobicContact CG2-CG 4Å; T159-E248 WeakPolarHBondContact OG1-CG 3.39Å; T159-E248 PolarHBondContact OG1-OE1 2.85Å; R160-E248 PolarHBondContact N-OE1 2.82Å; T161-E248 PolarHBondContact N-OE1 2.95Å; T161-E248 PolarHBondContact OG1-OE1 2.99Å; I244-E248 HydrophobicContact CG2-CB 3.99Å; A245-E248 HydrophobicContact CB-CB 4.4Å; A245-E248 HydrophobicContact CB-CG 4.03Å; A245-E248 PolarHBondContact O-N 3.5Å; E248-V251 PolarHBondContact O-N 2.88Å; E248-I252 WeakPolarHBondContact O-CG1 3.5Å; E248-I252 PolarHBondContact O-N 2.94Å
249	Q	92.6	Very high	84	Confident	6 Å²	6	58.5 Å²	58.5	3%	0.028	30%	0.296	C	S	.	.	H	α-helix	trans	-62	-42.2	172.5	-65.4	-177.3	48.6	0	0	111.7	I241 I244 A245 Y246 C247 I252 F253 H449	I241-Q249 PolarHBondContact O-NE2 2.84Å; I244-Q249 HydrophobicContact CB-CG 3.98Å; I244-Q249 HydrophobicContact CG2-CG 3.81Å; I244-Q249 PolarHBondContact O-NE2 2.84Å; A245-Q249 WeakPolarHBondContact O-CG 3.44Å; A245-Q249 PolarHBondContact O-N 3.4Å; Y246-Q249 PolarHBondContact O-N 2.77Å; C247-Q249 VanDerWaalsContact C-N 3.31Å; C247-Q249 PolarHBondContact O-N 2.84Å; Q249-I252 WeakPolarHBondContact O-CB 3.44Å; Q249-I252 PolarHBondContact O-N 3.08Å; Q249-F253 HydrophobicContact CB-CE2 4.42Å; Q249-F253 WeakPolarHBondContact O-CD2 3.48Å; Q249-F253 PolarHBondContact O-N 3.08Å; Q249-H449 PolarHBondContact OE1-CE1 3.39Å; Q249-H449 PolarHBondContact OE1-NE2 3.02Å
250	A	89.9	Confident	82.1	Confident	1 Å²	1	59.6 Å²	59.6	1%	0.008	31%	0.314	C	S	.	.	H	α-helix	trans	-63.3	-39.9	175.6	0	0	0	0	0	112.2	Y246 C247 I252 F253 I254 L310 L313	Y246-A250 PolarHBondContact O-N 3.46Å; C247-A250 WeakPolarHBondContact O-CB 3.36Å; C247-A250 PolarHBondContact O-N 2.87Å; C247-A250 VanDerWaalsContact O-N 3.08Å; A250-I252 VanDerWaalsContact C-N 3.31Å; A250-I252 PolarHBondContact O-N 3.31Å; A250-F253 PolarHBondContact O-N 3.41Å; A250-I254 VanDerWaalsContact O-CG1 3.29Å; A250-I254 WeakPolarHBondContact O-CG1 3.45Å; A250-I254 PolarHBondContact O-N 3.48Å; A250-L310 HydrophobicContact CB-CD1 3.54Å; A250-L313 HydrophobicContact CB-CD1 4.01Å
251	V	90.4	Very high	80.2	Confident	22 Å²	22	66.5 Å²	66.5	13%	0.133	35%	0.349	C	S	.	.	H	α-helix	trans	-58.6	-41.7	172.2	173.2	0	0	0	0	111.7	T161 C247 E248 K255 L313	T161-V251 HydrophobicContact CG2-CG2 4.21Å; C247-V251 PolarHBondContact O-N 2.88Å; E248-V251 PolarHBondContact O-N 2.88Å; V251-K255 HydrophobicContact CG1-CD 3.99Å; V251-K255 WeakPolarHBondContact O-CB 3.46Å; V251-K255 VanDerWaalsContact O-CG 3.29Å; V251-K255 WeakPolarHBondContact O-CG 3.39Å; V251-K255 PolarHBondContact O-N 3.35Å; V251-K255 VanDerWaalsContact O-N 3.07Å; V251-L313 HydrophobicContact CG2-CD1 3.73Å; V251-L313 HydrophobicContact CG2-CD2 3.69Å; V251-L313 HydrophobicContact CG2-CG 4.37Å
252	I	87.4	Confident	77.6	Confident	74 Å²	74	71.4 Å²	71.4	38%	0.379	38%	0.377	S	S	.	.	H	α-helix	trans	-63.6	-46.4	176.2	-67.3	162.8	0	0	0	110.6	E248 Q249 A250 K255 Q256	E248-I252 WeakPolarHBondContact O-CG1 3.5Å; E248-I252 PolarHBondContact O-N 2.94Å; Q249-I252 WeakPolarHBondContact O-CB 3.44Å; Q249-I252 PolarHBondContact O-N 3.08Å; A250-I252 VanDerWaalsContact C-N 3.31Å; A250-I252 PolarHBondContact O-N 3.31Å; I252-K255 PolarHBondContact O-N 3.13Å; I252-Q256 HydrophobicContact CG2-CG 4.42Å; I252-Q256 WeakPolarHBondContact O-CB 3.3Å; I252-Q256 VanDerWaalsContact O-CG 3.32Å; I252-Q256 WeakPolarHBondContact O-CG 3.33Å; I252-Q256 PolarHBondContact O-N 3.48Å
253	F	85.1	Confident	74.8	Confident	69 Å²	69	78.6 Å²	78.6	30%	0.303	42%	0.415	S	S	.	.	H	α-helix	trans	-61.8	-45.5	178.1	-75.2	-60.2	0	0	0	112.9	Q249 A250 K255 Q256 A257	Q249-F253 HydrophobicContact CB-CE2 4.42Å; Q249-F253 WeakPolarHBondContact O-CD2 3.48Å; Q249-F253 PolarHBondContact O-N 3.08Å; A250-F253 PolarHBondContact O-N 3.41Å; F253-K255 VanDerWaalsContact C-N 3.32Å; F253-K255 PolarHBondContact O-N 3.16Å; F253-Q256 PolarHBondContact O-N 3.46Å; F253-Q256 VanDerWaalsContact O-N 3.16Å; F253-A257 WeakPolarHBondContact O-CB 3.29Å; F253-A257 PolarHBondContact O-N 3.32Å
254	I	84.7	Confident	72.1	Confident	68 Å²	68	81.6 Å²	81.6	35%	0.349	43%	0.429	S	S	.	.	H	α-helix	trans	-60.7	-42.3	177.5	-67.1	163.2	0	0	0	110.5	A250 Q256 A257 N258 L313	A250-I254 VanDerWaalsContact O-CG1 3.29Å; A250-I254 WeakPolarHBondContact O-CG1 3.45Å; A250-I254 PolarHBondContact O-N 3.48Å; I254-Q256 PolarHBondContact O-N 3.43Å; I254-A257 PolarHBondContact O-N 3.25Å; I254-N258 PolarHBondContact O-N 3.21Å; I254-N258 PolarHBondContact O-ND2 3.01Å; I254-L313 HydrophobicContact CD1-CB 4.5Å
255	K	83.2	Confident	69.3	Low	133 Å²	133	83.2 Å²	83.2	58%	0.578	45%	0.445	S	S	*	.	H	α-helix	trans	-65.8	-35	175.6	-73.7	171.8	-179.4	171.8	0	113.2	V251 I252 F253	V251-K255 HydrophobicContact CG1-CD 3.99Å; V251-K255 WeakPolarHBondContact O-CB 3.46Å; V251-K255 VanDerWaalsContact O-CG 3.29Å; V251-K255 WeakPolarHBondContact O-CG 3.39Å; V251-K255 PolarHBondContact O-N 3.35Å; V251-K255 VanDerWaalsContact O-N 3.07Å; I252-K255 PolarHBondContact O-N 3.13Å; F253-K255 VanDerWaalsContact C-N 3.32Å; F253-K255 PolarHBondContact O-N 3.16Å
256	Q	79.1	Confident	66.4	Low	117 Å²	117	91.3 Å²	91.3	55%	0.547	48%	0.476	S	S	.	.	H	α-helix	trans	-73.8	-36.9	177.4	-74.5	174.5	-8.8	0	0	112.4	I252 F253 I254 N258 F259	I252-Q256 HydrophobicContact CG2-CG 4.42Å; I252-Q256 WeakPolarHBondContact O-CB 3.3Å; I252-Q256 VanDerWaalsContact O-CG 3.32Å; I252-Q256 WeakPolarHBondContact O-CG 3.33Å; I252-Q256 PolarHBondContact O-N 3.48Å; F253-Q256 PolarHBondContact O-N 3.46Å; F253-Q256 VanDerWaalsContact O-N 3.16Å; I254-Q256 PolarHBondContact O-N 3.43Å; Q256-N258 PolarHBondContact O-N 3.01Å; Q256-F259 PolarHBondContact O-N 2.89Å; Q256-F259 VanDerWaalsContact O-N 3.14Å
257	A	65.5	Low	63.3	Low	78 Å²	78	100.3 Å²	100.3	65%	0.645	51%	0.51	S	S	*	.	H	α-helix	trans	-63.7	-20.4	177.1	0	0	0	0	0	113.7	F253 I254 F259	F253-A257 WeakPolarHBondContact O-CB 3.29Å; F253-A257 PolarHBondContact O-N 3.32Å; I254-A257 PolarHBondContact O-N 3.25Å; A257-F259 PolarHBondContact O-N 3.04Å
258	N	59.1	Low	60.5	Low	131 Å²	131	109.9 Å²	109.9	70%	0.701	55%	0.551	S	S	*	*	T	Hydrogen-bonded Turn	trans	-78	-0.4	175.7	-68.2	-20	0	0	0	114	I254 Q256	I254-N258 PolarHBondContact O-N 3.21Å; I254-N258 PolarHBondContact O-ND2 3.01Å; Q256-N258 PolarHBondContact O-N 3.01Å
259	F	46.5	Very low	57.6	Low	153 Å²	153	112.7 Å²	112.7	67%	0.671	56%	0.564	S	S	*	*	S	Bend	trans	-97.3	136.8	169.3	-73.2	-90.1	0	0	0	110.7	Q256 A257 L261	Q256-F259 PolarHBondContact O-N 2.89Å; Q256-F259 VanDerWaalsContact O-N 3.14Å; A257-F259 PolarHBondContact O-N 3.04Å; F259-L261 PolarHBondContact O-N 2.95Å
260	P	40.2	Very low	54.9	Low	132 Å²	132	119.4 Å²	119.4	86%	0.857	60%	0.6	S	S	*	*			trans	-73.8	88.7	-177.8	30.4	-35.1	0	0	0	111.5
261	L	44	Very low	53.2	Low	146 Å²	146	122.2 Å²	122.2	76%	0.764	63%	0.63	S	S	*	*			trans	-84.7	142.8	157.8	-115.2	73.8	0	0	0	109.6	F259 N263	F259-L261 PolarHBondContact O-N 2.95Å; L261-N263 PolarHBondContact O-N 3.19Å
262	N	32.3	Very low	52	Low	161 Å²	161	126.6 Å²	126.6	86%	0.861	66%	0.657	S	S	*	*			trans	-60.3	105.7	170.7	-91	-18.6	0	0	0	109.5	I264	N262-I264 PolarHBondContact O-N 3.2Å
263	N	31.7	Very low	51.5	Low	155 Å²	155	124.5 Å²	124.5	83%	0.829	65%	0.646	S	S	*	*			trans	-65.8	95.5	175.6	-82.1	-26.9	0	0	0	110.1	L261 P265	L261-N263 PolarHBondContact O-N 3.19Å; N263-P265 WeakPolarHBondContact O-CD 3.49Å
264	I	32.3	Very low	51.3	Low	147 Å²	147	122.4 Å²	122.4	75%	0.754	64%	0.64	S	S	*	*			trans	-62.8	121.1	162.3	-60.2	172.6	0	0	0	106.4	N262 Y266	N262-I264 PolarHBondContact O-N 3.2Å; I264-Y266 PolarHBondContact O-N 3.25Å; I264-Y266 VanDerWaalsContact O-N 3.12Å
265	P	32.6	Very low	51	Low	108 Å²	108	126.7 Å²	126.7	70%	0.701	65%	0.651	S	S	*	*			trans	-63.1	119.6	-177.8	23.8	-32.8	0	0	0	110.2	N263 R267	N263-P265 WeakPolarHBondContact O-CD 3.49Å; P265-R267 PolarHBondContact O-N 3.42Å
266	Y	34.3	Very low	51	Low	173 Å²	173	121.6 Å²	121.6	68%	0.678	63%	0.631	S	S	*	*			trans	-59.6	103.4	170.8	-103.8	-88	0	0	0	109.5	I264	I264-Y266 PolarHBondContact O-N 3.25Å; I264-Y266 VanDerWaalsContact O-N 3.12Å
267	R	30.6	Very low	50.8	Low	189 Å²	189	118.1 Å²	118.1	71%	0.713	62%	0.616	S	S	*	*			trans	-72.3	141.8	163.8	-70.7	-167.5	174.1	-166.6	1.7	108.9	P265 E269	P265-R267 PolarHBondContact O-N 3.42Å; R267-E269 PolarHBondContact O-N 3.43Å
268	K	35.8	Very low	51.3	Low	200 Å²	200	116.2 Å²	116.2	87%	0.87	60%	0.598	S	S	*	*			trans	-63	96.3	162.3	-86	-174.2	169.4	-173.8	0	107.6
269	E	32.9	Very low	52.1	Low	103 Å²	103	112.5 Å²	112.5	48%	0.481	58%	0.581	S	S	.	*			trans	-83.8	117.8	173.3	-73.5	-175.4	127.8	0	0	110.8	A233 R267 G271	A233-E269 WeakPolarHBondContact CB-OE1 3.44Å; R267-E269 PolarHBondContact O-N 3.43Å; E269-G271 PolarHBondContact O-N 2.86Å; E269-G271 VanDerWaalsContact O-N 3.14Å
270	D	35.7	Very low	53.2	Low	147 Å²	147	113.2 Å²	113.2	79%	0.786	58%	0.584	S	S	*	*	S	Bend	trans	29.9	64	152.2	-65.3	-8.1	0	0	0	119.2	T272	D270-T272 VanDerWaalsContact O-CB 3.28Å; D270-T272 WeakPolarHBondContact O-CB 3.49Å; D270-T272 PolarHBondContact O-N 2.84Å; D270-T272 PolarHBondContact O-OG1 2.86Å
271	G	53.3	Low	55.1	Low	61 Å²	61	108.6 Å²	108.6	63%	0.629	55%	0.554	S	S	*	*	S	Bend	trans	60.5	-4.2	148.2	0	0	0	0	0	118.9	E269 R525	E269-G271 PolarHBondContact O-N 2.86Å; E269-G271 VanDerWaalsContact O-N 3.14Å; G271-R525 PolarHBondContact O-NH2 3.04Å
272	T	64.9	Low	57.1	Low	113 Å²	113	106.8 Å²	106.8	69%	0.693	54%	0.537	S	S	*	.			trans	-122.1	113	-161.6	-49.7	0	0	0	0	108.1	D270	D270-T272 VanDerWaalsContact O-CB 3.28Å; D270-T272 WeakPolarHBondContact O-CB 3.49Å; D270-T272 PolarHBondContact O-N 2.84Å; D270-T272 PolarHBondContact O-OG1 2.86Å
273	L	78.3	Confident	59.7	Low	30 Å²	30	101.6 Å²	101.6	16%	0.157	51%	0.509	C	S	.	.			trans	-62	139.1	178.4	-69.8	171.4	0	0	0	110.1	L487 R525 L526 R529 Y530	L273-L487 HydrophobicContact CD1-CD2 4.3Å; L273-R525 HydrophobicContact CD1-CB 4.06Å; L273-L526 HydrophobicContact CD1-CD2 4.01Å; L273-L526 HydrophobicContact CD2-CD2 3.89Å; L273-R529 HydrophobicContact CB-CG 4.21Å; L273-R529 HydrophobicContact CD1-CB 3.7Å; L273-R529 HydrophobicContact CD1-CG 3.88Å; L273-Y530 HydrophobicContact CB-CE2 4.39Å; L273-Y530 HydrophobicContact CD1-CE2 4.08Å
274	P	80.4	Confident	62.3	Low	26 Å²	26	94.4 Å²	94.4	17%	0.169	47%	0.472	C	S	.	.			trans	-61.5	168.9	-176.4	25.7	-34.8	0	0	0	112.1	K236 V276 L444 Y530	K236-P274 WeakPolarHBondContact O-CB 3.49Å; P274-V276 PolarHBondContact O-N 2.67Å; P274-L444 HydrophobicContact CG-CD2 3.22Å; P274-Y530 PolarHBondContact O-OH 2.9Å
275	R	79.4	Confident	65.1	Low	157 Å²	157	89.8 Å²	89.8	59%	0.592	45%	0.45	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-87.2	115.1	173.2	-170.5	-175.2	-174.7	-167.2	4.5	108.9	K236 E237 E238 I277	K236-R275 PolarHBondContact O-N 3.29Å; E237-R275 WeakPolarHBondContact CA-O 3.4Å; E237-R275 HydrophobicContact CG-CB 4.46Å; E237-R275 IonicContact OE1-NH1 2.93Å; E237-R275 PolarHBondContact OE1-NH1 2.97Å; E238-R275 PolarHBondContact N-O 3.13Å; R275-I277 HydrophobicContact CG-CG1 4.47Å
276	V	81.4	Confident	67.9	Low	26 Å²	26	85 Å²	85	16%	0.158	42%	0.419	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-89.7	127.5	174	-179.3	0	0	0	0	109.3	E238 L240 P274 L448 Y530 L533	E238-V276 HydrophobicContact CB-CG2 4.21Å; E238-V276 CarbonylContact O-C 3.56Å; E238-V276 VanDerWaalsContact O-CA 3.29Å; E238-V276 WeakPolarHBondContact O-CA 3.43Å; L240-V276 HydrophobicContact CB-CG1 3.97Å; L240-V276 HydrophobicContact CD1-CG1 4.42Å; P274-V276 PolarHBondContact O-N 2.67Å; V276-L448 HydrophobicContact CB-CD1 4.45Å; V276-L448 HydrophobicContact CG1-CD1 4.24Å; V276-L448 HydrophobicContact CG2-CD1 3.61Å; V276-Y530 HydrophobicContact CB-CD1 4.25Å; V276-Y530 HydrophobicContact CB-CE1 3.8Å; V276-Y530 HydrophobicContact CG2-CD1 4.15Å; V276-Y530 HydrophobicContact CG2-CE1 3.38Å; V276-L533 HydrophobicContact CB-CD2 4.41Å; V276-L533 HydrophobicContact CG1-CD2 3.72Å
277	I	76.6	Confident	70.7	Confident	44 Å²	44	82.1 Å²	82.1	23%	0.226	41%	0.407	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-113	117	178.4	-60	178.9	0	0	0	107.8	E237 E238 F239 L240 R275 P279	E237-I277 HydrophobicContact CB-CD1 4.22Å; E237-I277 HydrophobicContact CG-CD1 4.33Å; E237-I277 WeakPolarHBondContact OE2-CD1 3.26Å; E238-I277 PolarHBondContact O-N 2.84Å; F239-I277 WeakPolarHBondContact CA-O 3.19Å; F239-I277 HydrophobicContact CD1-CB 4.1Å; F239-I277 HydrophobicContact CD1-CG2 4.18Å; F239-I277 HydrophobicContact CE1-CB 4.12Å; F239-I277 HydrophobicContact CE1-CD1 4.41Å; F239-I277 HydrophobicContact CE1-CG2 4.03Å; L240-I277 PolarHBondContact N-O 2.82Å; R275-I277 HydrophobicContact CG-CG1 4.47Å; I277-P279 WeakPolarHBondContact O-CD 3.44Å
278	C	75.1	Confident	73.7	Confident	39 Å²	39	73.9 Å²	73.9	26%	0.264	38%	0.377	S	S	.	.			trans	-82.2	121.3	163.2	-172.2	0	0	0	0	107.9	K280 L533	C278-K280 PolarHBondContact O-N 3.01Å; C278-L533 HydrophobicContact CB-CD1 4.15Å
279	P	75.3	Confident	76.2	Confident	53 Å²	53	71.1 Å²	71.1	34%	0.344	37%	0.367	S	S	.	.			trans	-55.2	135.6	167.7	-23	35.4	0	0	0	109.7	F239 L240 I277 C281	F239-P279 HydrophobicContact CD1-CG 4.37Å; L240-P279 WeakPolarHBondContact O-CD 3.4Å; I277-P279 WeakPolarHBondContact O-CD 3.44Å; P279-C281 PolarHBondContact O-N 3.22Å
280	K	69.9	Low	79.1	Confident	168 Å²	168	67.2 Å²	67.2	73%	0.73	35%	0.35	S	S	*	.			trans	-77.1	114.6	178	-69.6	-170.3	173.9	-166.1	0	109.5	C278	C278-K280 PolarHBondContact O-N 3.01Å
281	C	80.1	Confident	81.8	Confident	35 Å²	35	61 Å²	61	24%	0.236	32%	0.316	C	S	.	.	B	Isolated β-bridge	trans	-70.2	151.4	168.5	-177.4	0	0	0	0	110.3	P279 L283 G284 N539	P279-C281 PolarHBondContact O-N 3.22Å; C281-L283 PolarHBondContact O-N 2.87Å; C281-G284 PolarHBondContact O-N 3.26Å; C281-N539 WeakPolarHBondContact CB-ND2 3.33Å
282	R	85.3	Confident	83.7	Confident	107 Å²	107	59.1 Å²	59.1	40%	0.404	29%	0.293	S	S	.	.	T	Hydrogen-bonded Turn	trans	-61.3	-23.9	176.4	-68.6	-178.1	62.1	113.4	5.5	112.6	G284 I601 H657 D660	R282-G284 VanDerWaalsContact C-N 3.27Å; R282-G284 PolarHBondContact O-N 2.75Å; R282-I601 PolarHBondContact NH2-O 2.92Å; R282-H657 HydrophobicContact CB-CB 4.5Å; R282-H657 WeakPolarHBondContact O-CB 3.47Å; R282-H657 PolarHBondContact O-N 3.39Å; R282-D660 IonicContact CZ-OD1 2.69Å; R282-D660 IonicContact CZ-OD2 3.11Å; R282-D660 VanDerWaalsContact NE-CG 3.29Å; R282-D660 IonicContact NE-OD1 2.85Å; R282-D660 PolarHBondContact NE-OD1 2.88Å; R282-D660 IonicContact NE-OD2 2.64Å; R282-D660 PolarHBondContact NE-OD2 3.32Å; R282-D660 IonicContact NH2-OD1 3.21Å; R282-D660 IonicContact NH2-OD2 2.73Å; R282-D660 PolarHBondContact NH2-OD2 3.23Å
283	L	86.8	Confident	85	Confident	52 Å²	52	60.5 Å²	60.5	27%	0.272	29%	0.292	S	S	.	.	T	Hydrogen-bonded Turn	trans	-80.7	-1.2	174.4	-63.3	179.2	0	0	0	114	C281 T656 D660 L661	C281-L283 PolarHBondContact O-N 2.87Å; L283-T656 WeakPolarHBondContact O-CB 3.42Å; L283-T656 WeakPolarHBondContact O-CG2 3.36Å; L283-T656 PolarHBondContact O-OG1 3.41Å; L283-D660 HydrophobicContact CD2-CB 4.02Å; L283-L661 HydrophobicContact CD2-CB 4.23Å; L283-L661 HydrophobicContact CD2-CD1 4.27Å
284	G	87.4	Confident	85.6	Confident	5 Å²	5	62.1 Å²	62.1	5%	0.052	31%	0.309	C	S	.	.	B	Isolated β-bridge	trans	87.5	-152.5	-178.9	0	0	0	0	0	113.2	C281 R282	C281-G284 PolarHBondContact O-N 3.26Å; R282-G284 VanDerWaalsContact C-N 3.27Å; R282-G284 PolarHBondContact O-N 2.75Å
285	V	90.3	Very high	86.3	Confident	49 Å²	49	61 Å²	61	30%	0.297	30%	0.302	S	S	.	.			trans	-126.8	115.6	177.6	176.5	0	0	0	0	109.2	T536	V285-T536 HydrophobicContact CG1-CG2 3.51Å
286	T	92.6	Very high	87.1	Confident	8 Å²	8	54 Å²	54	5%	0.049	28%	0.276	C	S	.	.			trans	-83.9	125.3	175.7	-57.2	0	0	0	0	110.4	D290 L291 T536 V537 M542 H650	T286-D290 HydrophobicContact CG2-CB 4.37Å; T286-L291 HydrophobicContact CG2-CD1 3.8Å; T286-L291 HydrophobicContact CG2-CD2 4Å; T286-L291 HydrophobicContact CG2-CG 3.68Å; T286-T536 WeakPolarHBondContact O-CA 3.3Å; T286-V537 HydrophobicContact CG2-CB 4.25Å; T286-V537 HydrophobicContact CG2-CG2 4.41Å; T286-V537 PolarHBondContact O-N 3.31Å; T286-M542 HydrophobicContact CG2-CE 4.19Å; T286-M542 HydrophobicContact CG2-SD 4.01Å; T286-H650 PolarHBondContact OG1-NE2 2.9Å
287	R	92.4	Very high	87.6	Confident	113 Å²	113	59.4 Å²	59.4	43%	0.426	30%	0.297	S	S	.	.	B	Isolated β-bridge	trans	-93.6	158.7	169.7	-50.7	171	176.8	-143.1	-8.5	109.8	Q289 D290	R287-Q289 HydrophobicContact CB-CG 4.02Å; R287-Q289 PolarHBondContact O-N 2.81Å; R287-Q289 VanDerWaalsContact O-N 3.17Å; R287-D290 WeakPolarHBondContact CA-OD2 3.44Å; R287-D290 WeakPolarHBondContact CB-OD2 3.39Å; R287-D290 WeakPolarHBondContact CG-OD2 3.39Å; R287-D290 PolarHBondContact N-OD2 3.04Å; R287-D290 VanDerWaalsContact O-CB 3.31Å; R287-D290 WeakPolarHBondContact O-CB 3.15Å; R287-D290 PolarHBondContact O-N 3.13Å
288	I	92.6	Very high	88.4	Confident	15 Å²	15	59.3 Å²	59.3	8%	0.077	30%	0.295	C	S	.	.	G	3₁₀ helix	trans	-54.8	-36.3	177.4	-70	154.6	0	0	0	113.5	D290 M296 I455 L456 W535 V537	I288-D290 PolarHBondContact O-N 3.24Å; I288-M296 HydrophobicContact CB-CE 4.47Å; I288-M296 HydrophobicContact CG1-CE 4.32Å; I288-M296 HydrophobicContact CG2-CE 3.86Å; I288-M296 HydrophobicContact CG2-SD 4.17Å; I288-I455 HydrophobicContact CD1-CG2 4.36Å; I288-L456 HydrophobicContact CD1-CD2 3.82Å; I288-L456 HydrophobicContact CG1-CD2 3.57Å; I288-W535 HydrophobicContact CD1-CB 4.04Å; I288-W535 HydrophobicContact CD1-CG 3.96Å; I288-W535 WeakPolarHBondContact CD1-O 3.34Å; I288-W535 WeakPolarHBondContact CG1-O 3.31Å; I288-W535 PolarHBondContact N-O 2.88Å; I288-V537 HydrophobicContact CG1-CG2 4.18Å
289	Q	90.2	Very high	89.4	Confident	142 Å²	142	57.4 Å²	57.4	66%	0.664	28%	0.283	S	S	*	.	G	3₁₀ helix	trans	-75.7	-9.2	179.9	64.3	-179.8	64	0	0	113.8	R287	R287-Q289 HydrophobicContact CB-CG 4.02Å; R287-Q289 PolarHBondContact O-N 2.81Å; R287-Q289 VanDerWaalsContact O-N 3.17Å
290	D	92.1	Very high	90.4	Very high	22 Å²	22	59.2 Å²	59.2	12%	0.118	28%	0.283	C	S	.	.	G	3₁₀ helix	trans	-90.2	-5.4	-174.8	-58.5	-23.6	0	0	0	111.7	T286 R287 I288 H650 C651	T286-D290 HydrophobicContact CG2-CB 4.37Å; R287-D290 WeakPolarHBondContact CA-OD2 3.44Å; R287-D290 WeakPolarHBondContact CB-OD2 3.39Å; R287-D290 WeakPolarHBondContact CG-OD2 3.39Å; R287-D290 PolarHBondContact N-OD2 3.04Å; R287-D290 VanDerWaalsContact O-CB 3.31Å; R287-D290 WeakPolarHBondContact O-CB 3.15Å; R287-D290 PolarHBondContact O-N 3.13Å; I288-D290 PolarHBondContact O-N 3.24Å; D290-H650 CarbonylContact O-C 3.59Å; D290-H650 VanDerWaalsContact O-CA 3.27Å; D290-H650 WeakPolarHBondContact O-CA 3.06Å; D290-C651 HydrophobicContact CB-CB 3.9Å; D290-C651 PolarHBondContact O-N 3.41Å
291	L	94	Very high	91.6	Very high	17 Å²	17	53.1 Å²	53.1	9%	0.089	26%	0.257	C	S	.	.	B	Isolated β-bridge	trans	-114.9	148.3	-174.2	-69.2	174.5	0	0	0	113	T286 M296 V299 V537 M542 I647 H650	T286-L291 HydrophobicContact CG2-CD1 3.8Å; T286-L291 HydrophobicContact CG2-CD2 4Å; T286-L291 HydrophobicContact CG2-CG 3.68Å; L291-M296 HydrophobicContact CB-CG 3.79Å; L291-M296 HydrophobicContact CB-SD 4.03Å; L291-M296 HydrophobicContact CD1-SD 3.79Å; L291-V299 HydrophobicContact CD1-CG2 4.06Å; L291-V537 HydrophobicContact CD1-CG1 4.47Å; L291-V537 HydrophobicContact CD1-CG2 4.02Å; L291-M542 HydrophobicContact CD1-SD 3.66Å; L291-M542 HydrophobicContact CD2-CE 3.71Å; L291-M542 HydrophobicContact CD2-SD 3.88Å; L291-M542 HydrophobicContact CG-SD 4.35Å; L291-I647 HydrophobicContact CD2-CD1 4.47Å; L291-H650 HydrophobicContact CD2-CB 3.96Å; L291-H650 VanDerWaalsContact CD2-CD2 3.46Å; L291-H650 WeakPolarHBondContact CD2-CD2 3.41Å
292	S	93	Very high	92.3	Very high	21 Å²	21	51.7 Å²	51.7	15%	0.147	25%	0.247	C	C	.	.			trans	-55.2	147.8	170.6	85.9	0	0	0	0	112.3	A294 D295 M296 E649	S292-A294 PolarHBondContact O-N 2.84Å; S292-A294 VanDerWaalsContact O-N 3.16Å; S292-A294 PolarHBondContact OG-N 3.22Å; S292-D295 PolarHBondContact O-N 3.2Å; S292-D295 VanDerWaalsContact O-N 3.09Å; S292-D295 PolarHBondContact OG-N 3.44Å; S292-D295 PolarHBondContact OG-OD2 3.44Å; S292-M296 PolarHBondContact O-N 3.01Å; S292-E649 PolarHBondContact N-O 3.05Å
293	H	91.5	Very high	92.8	Very high	142 Å²	142	46.6 Å²	46.6	66%	0.657	23%	0.227	S	C	*	.	H	α-helix	trans	-56.3	-32.3	173.6	-69.5	-70.5	0	0	0	112.4	K297 E460	H293-K297 WeakPolarHBondContact O-CB 2.82Å; H293-K297 PolarHBondContact O-N 3.47Å; H293-E460 IonicContact CE1-OE1 3.8Å; H293-E460 IonicContact CE1-OE2 3.32Å; H293-E460 PolarHBondContact CE1-OE2 3.48Å; H293-E460 IonicContact ND1-OE2 2.71Å; H293-E460 PolarHBondContact ND1-OE2 2.91Å
294	A	91.8	Very high	93.2	Very high	64 Å²	64	44.2 Å²	44.2	53%	0.529	22%	0.215	S	C	.	.	H	α-helix	trans	-71.2	-30.7	179.6	0	0	0	0	0	113	S292 K298	S292-A294 PolarHBondContact O-N 2.84Å; S292-A294 VanDerWaalsContact O-N 3.16Å; S292-A294 PolarHBondContact OG-N 3.22Å; A294-K298 PolarHBondContact O-NZ 2.73Å
295	D	94.5	Very high	93.6	Very high	1 Å²	1	44.2 Å²	44.2	1%	0.005	21%	0.214	C	C	.	.	H	α-helix	trans	-85.4	-39.4	173.8	-65	-50.2	0	0	0	111.3	S292 K297 K298 V299 V545 N549 I647 G648	S292-D295 PolarHBondContact O-N 3.2Å; S292-D295 VanDerWaalsContact O-N 3.09Å; S292-D295 PolarHBondContact OG-N 3.44Å; S292-D295 PolarHBondContact OG-OD2 3.44Å; D295-K297 PolarHBondContact O-N 2.76Å; D295-K298 CarbonylContact O-C 3.56Å; D295-K298 WeakPolarHBondContact O-CA 3.44Å; D295-K298 WeakPolarHBondContact O-CB 3.31Å; D295-K298 PolarHBondContact O-N 3.1Å; D295-K298 IonicContact OD1-NZ 2.67Å; D295-K298 PolarHBondContact OD1-NZ 3.2Å; D295-V299 WeakPolarHBondContact O-CG2 3.24Å; D295-V299 PolarHBondContact O-N 3.37Å; D295-V545 HydrophobicContact CB-CG1 4.04Å; D295-N549 PolarHBondContact OD1-ND2 3.08Å; D295-I647 HydrophobicContact CB-CD1 4.3Å; D295-G648 WeakPolarHBondContact OD2-CA 3.36Å; D295-G648 PolarHBondContact OD2-N 3.35Å
296	M	95.2	Very high	93.9	Very high	11 Å²	11	41.9 Å²	41.9	5%	0.054	20%	0.2	C	C	.	.	H	α-helix	trans	-57.6	-32.2	171.1	-81.8	-55.2	-47.8	0	0	112.9	I288 L291 S292 V299 R300 V537	I288-M296 HydrophobicContact CB-CE 4.47Å; I288-M296 HydrophobicContact CG1-CE 4.32Å; I288-M296 HydrophobicContact CG2-CE 3.86Å; I288-M296 HydrophobicContact CG2-SD 4.17Å; L291-M296 HydrophobicContact CB-CG 3.79Å; L291-M296 HydrophobicContact CB-SD 4.03Å; L291-M296 HydrophobicContact CD1-SD 3.79Å; S292-M296 PolarHBondContact O-N 3.01Å; M296-V299 HydrophobicContact CE-CB 4.23Å; M296-V299 HydrophobicContact CE-CG1 4.16Å; M296-V299 PolarHBondContact O-N 3.48Å; M296-V299 HydrophobicContact SD-CB 4.36Å; M296-V299 HydrophobicContact SD-CG2 4.36Å; M296-R300 WeakPolarHBondContact O-CG 3.42Å; M296-R300 PolarHBondContact O-N 3.18Å; M296-V537 HydrophobicContact SD-CG2 4.25Å
297	K	93.3	Very high	94	Very high	139 Å²	139	42 Å²	42	60%	0.604	20%	0.2	S	C	*	.	H	α-helix	trans	-60.6	-43.7	171.1	-173.3	175.9	178.8	-179.6	0	111.7	H293 D295 R300 Q301	H293-K297 WeakPolarHBondContact O-CB 2.82Å; H293-K297 PolarHBondContact O-N 3.47Å; D295-K297 PolarHBondContact O-N 2.76Å; K297-R300 PolarHBondContact O-N 2.96Å; K297-Q301 WeakPolarHBondContact O-CG 3.48Å; K297-Q301 PolarHBondContact O-N 2.86Å; K297-Q301 VanDerWaalsContact O-N 3.1Å
298	K	93.6	Very high	94.1	Very high	42 Å²	42	37.1 Å²	37.1	18%	0.183	18%	0.182	C	C	.	.	H	α-helix	trans	-69.3	-38.5	176.8	-54.8	-175.1	-155.5	80.9	0	111.9	A294 D295 R300 Q301 L302 V545 L548 N549	A294-K298 PolarHBondContact O-NZ 2.73Å; D295-K298 CarbonylContact O-C 3.56Å; D295-K298 WeakPolarHBondContact O-CA 3.44Å; D295-K298 WeakPolarHBondContact O-CB 3.31Å; D295-K298 PolarHBondContact O-N 3.1Å; D295-K298 IonicContact OD1-NZ 2.67Å; D295-K298 PolarHBondContact OD1-NZ 3.2Å; K298-R300 VanDerWaalsContact C-N 3.33Å; K298-R300 PolarHBondContact O-N 3.12Å; K298-Q301 PolarHBondContact O-N 2.9Å; K298-L302 WeakPolarHBondContact O-CB 3.47Å; K298-L302 WeakPolarHBondContact O-CG 3.27Å; K298-L302 PolarHBondContact O-N 3.35Å; K298-V545 HydrophobicContact CB-CG2 3.89Å; K298-V545 HydrophobicContact CD-CG1 4.46Å; K298-L548 HydrophobicContact CD-CB 4.39Å; K298-N549 WeakPolarHBondContact CE-OD1 3.38Å; K298-N549 PolarHBondContact NZ-OD1 3.04Å
299	V	96.2	Very high	94.2	Very high	0 Å²	0	36.4 Å²	36.4	0%	0	18%	0.179	C	C	.	.	H	α-helix	trans	-57.4	-45.8	172.1	175	0	0	0	0	110.7	L291 D295 M296 L302 A303 L456 V537 L541 V545	L291-V299 HydrophobicContact CD1-CG2 4.06Å; D295-V299 WeakPolarHBondContact O-CG2 3.24Å; D295-V299 PolarHBondContact O-N 3.37Å; M296-V299 HydrophobicContact CE-CB 4.23Å; M296-V299 HydrophobicContact CE-CG1 4.16Å; M296-V299 PolarHBondContact O-N 3.48Å; M296-V299 HydrophobicContact SD-CB 4.36Å; M296-V299 HydrophobicContact SD-CG2 4.36Å; V299-L302 PolarHBondContact O-N 3.16Å; V299-A303 WeakPolarHBondContact O-CB 3.15Å; V299-A303 PolarHBondContact O-N 2.83Å; V299-L456 HydrophobicContact CG1-CD1 4.31Å; V299-L456 HydrophobicContact CG1-CD2 4.21Å; V299-V537 HydrophobicContact CG1-CG1 3.79Å; V299-V537 HydrophobicContact CG1-CG2 4.33Å; V299-V537 HydrophobicContact CG2-CG1 4.01Å; V299-L541 HydrophobicContact CG1-CD1 3.99Å; V299-V545 HydrophobicContact CG2-CG2 3.79Å
300	R	95.4	Very high	94.3	Very high	90 Å²	90	29.6 Å²	29.6	34%	0.34	15%	0.147	S	C	.	.	H	α-helix	trans	-62.5	-43.5	177.3	-72.7	177.7	78.9	-158.3	-3.4	112.3	M296 K297 K298 A303 L304 L456 L457	M296-R300 WeakPolarHBondContact O-CG 3.42Å; M296-R300 PolarHBondContact O-N 3.18Å; K297-R300 PolarHBondContact O-N 2.96Å; K298-R300 VanDerWaalsContact C-N 3.33Å; K298-R300 PolarHBondContact O-N 3.12Å; R300-A303 PolarHBondContact O-N 3.12Å; R300-L304 PolarHBondContact O-N 3.39Å; R300-L456 WeakPolarHBondContact CG-O 3.5Å; R300-L457 PolarHBondContact NE-O 2.91Å; R300-L457 VanDerWaalsContact NE-O 3.1Å; R300-L457 PolarHBondContact NH2-O 2.79Å; R300-L457 VanDerWaalsContact O-CD2 3.31Å; R300-L457 WeakPolarHBondContact O-CD2 3.12Å
301	Q	94.3	Very high	94.3	Very high	40 Å²	40	29 Å²	29	19%	0.187	14%	0.144	C	C	.	.	H	α-helix	trans	-59.8	-49.7	176.7	-75.1	169.9	-33	0	0	112.1	D135 A136 K297 K298 L304 I305	D135-Q301 WeakPolarHBondContact O-CG 3.45Å; A136-Q301 WeakPolarHBondContact O-CB 3.49Å; K297-Q301 WeakPolarHBondContact O-CG 3.48Å; K297-Q301 PolarHBondContact O-N 2.86Å; K297-Q301 VanDerWaalsContact O-N 3.1Å; K298-Q301 PolarHBondContact O-N 2.9Å; Q301-L304 WeakPolarHBondContact O-CB 3.47Å; Q301-L304 PolarHBondContact O-N 3.07Å; Q301-I305 WeakPolarHBondContact O-CG1 3.37Å; Q301-I305 PolarHBondContact O-N 2.71Å
302	L	95.5	Very high	94.2	Very high	5 Å²	5	30.2 Å²	30.2	3%	0.026	15%	0.151	C	C	.	.	H	α-helix	trans	-66.9	-37.4	177.5	-68.7	163.9	0	0	0	112.4	L158 K298 V299 L304 I305 D306 L541 Q544 V545 L548	L158-L302 HydrophobicContact CD2-CD2 3.75Å; K298-L302 WeakPolarHBondContact O-CB 3.47Å; K298-L302 WeakPolarHBondContact O-CG 3.27Å; K298-L302 PolarHBondContact O-N 3.35Å; V299-L302 PolarHBondContact O-N 3.16Å; L302-L304 VanDerWaalsContact C-N 3.3Å; L302-L304 PolarHBondContact O-N 3.14Å; L302-I305 PolarHBondContact O-N 3.35Å; L302-D306 PolarHBondContact O-N 2.62Å; L302-L541 HydrophobicContact CB-CD2 3.61Å; L302-Q544 HydrophobicContact CD1-CB 3.53Å; L302-Q544 HydrophobicContact CD2-CB 4.16Å; L302-Q544 HydrophobicContact CG-CB 4.46Å; L302-V545 HydrophobicContact CD1-CG2 3.78Å; L302-L548 HydrophobicContact CD1-CD1 3.96Å; L302-L548 HydrophobicContact CD2-CD1 4.27Å; L302-L548 HydrophobicContact CG-CD1 4.28Å
303	A	96.7	Very high	94.1	Very high	0 Å²	0	31.4 Å²	31.4	0%	0	16%	0.156	C	C	.	.	H	α-helix	trans	-64.6	-32.8	174.6	0	0	0	0	0	112.4	V299 R300 M307 L453 L456 L457 L541	V299-A303 WeakPolarHBondContact O-CB 3.15Å; V299-A303 PolarHBondContact O-N 2.83Å; R300-A303 PolarHBondContact O-N 3.12Å; A303-M307 WeakPolarHBondContact O-CB 3.4Å; A303-M307 PolarHBondContact O-N 3.14Å; A303-L453 HydrophobicContact CB-CD2 3.93Å; A303-L456 HydrophobicContact CB-CB 4.19Å; A303-L456 HydrophobicContact CB-CD1 4.39Å; A303-L457 HydrophobicContact CB-CD2 4.4Å; A303-L457 HydrophobicContact CB-CG 4.4Å; A303-L541 HydrophobicContact CB-CD1 4.19Å
304	L	95.1	Very high	94	Very high	3 Å²	3	26.5 Å²	26.5	2%	0.016	13%	0.134	C	C	.	.	H	α-helix	trans	-65.5	-43.4	175.1	-176.6	58.9	0	0	0	110.8	D135 A136 R300 Q301 L302 M307 T308 Y431 L457	D135-L304 HydrophobicContact CB-CD2 3.62Å; A136-L304 HydrophobicContact CB-CD2 4.18Å; R300-L304 PolarHBondContact O-N 3.39Å; Q301-L304 WeakPolarHBondContact O-CB 3.47Å; Q301-L304 PolarHBondContact O-N 3.07Å; L302-L304 VanDerWaalsContact C-N 3.3Å; L302-L304 PolarHBondContact O-N 3.14Å; L304-M307 HydrophobicContact CD1-CE 3.81Å; L304-T308 WeakPolarHBondContact O-CB 3.33Å; L304-T308 PolarHBondContact O-N 2.94Å; L304-T308 PolarHBondContact O-OG1 3.46Å; L304-Y431 HydrophobicContact CD1-CE1 4.5Å; L304-L457 HydrophobicContact CB-CD2 3.69Å; L304-L457 HydrophobicContact CD1-CD1 4.32Å; L304-L457 HydrophobicContact CD1-CD2 4.21Å
305	I	95.1	Very high	93.8	Very high	4 Å²	4	32 Å²	32	2%	0.021	15%	0.148	C	C	.	.	H	α-helix	trans	-64	-49.3	177.1	-62.6	166.7	0	0	0	110.4	W132 A136 L138 L158 Q162 V166 Q301 L302 M307 T308 A309	W132-I305 HydrophobicContact CH2-CG1 4.2Å; W132-I305 HydrophobicContact CZ2-CG1 4.4Å; A136-I305 HydrophobicContact CB-CD1 4.4Å; A136-I305 HydrophobicContact CB-CG1 4.11Å; L138-I305 HydrophobicContact CD1-CD1 4.08Å; L158-I305 HydrophobicContact CD1-CD1 4.29Å; L158-I305 HydrophobicContact CD1-CG2 4.33Å; L158-I305 HydrophobicContact CD2-CD1 3.96Å; L158-I305 HydrophobicContact CD2-CG2 4.36Å; Q162-I305 HydrophobicContact CB-CG2 3.75Å; Q162-I305 HydrophobicContact CG-CG2 4.1Å; V166-I305 HydrophobicContact CG2-CD1 4.28Å; V166-I305 HydrophobicContact CG2-CG1 4.22Å; V166-I305 HydrophobicContact CG2-CG2 3.85Å; Q301-I305 WeakPolarHBondContact O-CG1 3.37Å; Q301-I305 PolarHBondContact O-N 2.71Å; L302-I305 PolarHBondContact O-N 3.35Å; I305-M307 VanDerWaalsContact C-N 3.35Å; I305-M307 PolarHBondContact O-N 2.84Å; I305-T308 PolarHBondContact O-N 2.81Å; I305-A309 WeakPolarHBondContact O-CB 2.89Å; I305-A309 PolarHBondContact O-N 2.76Å
306	D	96.5	Very high	93.3	Very high	0 Å²	0	33.1 Å²	33.1	0%	0	16%	0.155	C	C	.	.	H	α-helix	trans	-65.5	-36.8	-179.7	-155.3	62	0	0	0	112.4	Q162 Y246 C247 L302 L310 L453 F540	Q162-D306 PolarHBondContact NE2-OD1 2.94Å; Y246-D306 WeakPolarHBondContact CB-OD2 3.43Å; Y246-D306 PolarHBondContact N-OD2 2.75Å; Y246-D306 VanDerWaalsContact N-OD2 3.08Å; C247-D306 PolarHBondContact SG-OD1 2.85Å; L302-D306 PolarHBondContact O-N 2.62Å; D306-L310 VanDerWaalsContact O-CB 3.26Å; D306-L310 WeakPolarHBondContact O-CB 3.48Å; D306-L310 PolarHBondContact O-N 3.3Å; D306-L453 HydrophobicContact CB-CD1 4.14Å; D306-L453 HydrophobicContact CB-CD2 4.24Å; D306-F540 HydrophobicContact CB-CE2 4.38Å; D306-F540 HydrophobicContact CB-CZ 4.42Å; D306-F540 VanDerWaalsContact OD2-CZ 3.29Å; D306-F540 WeakPolarHBondContact OD2-CZ 3.45Å
307	M	95.4	Very high	92	Very high	12 Å²	12	39.1 Å²	39.1	6%	0.059	18%	0.182	C	C	.	.	H	α-helix	trans	-66	-44.8	175.8	-175.1	-79.8	-64.6	0	0	111.1	A303 L304 I305 L310 C311 Y431 T434 M450 L453 L454 L457	A303-M307 WeakPolarHBondContact O-CB 3.4Å; A303-M307 PolarHBondContact O-N 3.14Å; L304-M307 HydrophobicContact CD1-CE 3.81Å; I305-M307 VanDerWaalsContact C-N 3.35Å; I305-M307 PolarHBondContact O-N 2.84Å; M307-L310 PolarHBondContact O-N 2.83Å; M307-C311 PolarHBondContact O-N 2.76Å; M307-C311 PolarHBondContact O-SG 2.78Å; M307-C311 VanDerWaalsContact SD-SG 3.65Å; M307-Y431 HydrophobicContact CE-CE1 4.42Å; M307-T434 HydrophobicContact SD-CG2 3.94Å; M307-M450 HydrophobicContact CG-CE 4.46Å; M307-M450 HydrophobicContact CG-SD 3.65Å; M307-M450 HydrophobicContact SD-SD 4.26Å; M307-L453 HydrophobicContact CB-CB 4.1Å; M307-L453 HydrophobicContact CB-CD1 3.98Å; M307-L453 HydrophobicContact CG-CB 4.44Å; M307-L454 HydrophobicContact CG-CD2 4.27Å; M307-L457 HydrophobicContact CB-CD1 4.18Å; M307-L457 HydrophobicContact CE-CD1 3.94Å; M307-L457 HydrophobicContact CG-CD1 4.16Å
308	T	93.6	Very high	90.8	Very high	9 Å²	9	34.6 Å²	34.6	6%	0.055	17%	0.166	C	C	.	.	H	α-helix	trans	-62.4	-48.5	177	-54.5	0	0	0	0	110.3	W132 R169 L304 I305 L310 C311 D312	W132-T308 HydrophobicContact CZ2-CG2 3.87Å; W132-T308 WeakPolarHBondContact CZ2-OG1 3.28Å; W132-T308 PolarHBondContact NE1-OG1 3.07Å; R169-T308 HydrophobicContact CG-CG2 4.43Å; L304-T308 WeakPolarHBondContact O-CB 3.33Å; L304-T308 PolarHBondContact O-N 2.94Å; L304-T308 PolarHBondContact O-OG1 3.46Å; I305-T308 PolarHBondContact O-N 2.81Å; T308-L310 VanDerWaalsContact C-N 3.3Å; T308-L310 PolarHBondContact O-N 3.49Å; T308-C311 WeakPolarHBondContact O-CB 3.3Å; T308-C311 PolarHBondContact O-N 2.79Å; T308-D312 PolarHBondContact O-N 3Å; T308-D312 VanDerWaalsContact O-OD2 3.1Å
309	A	94.6	Very high	89.4	Confident	0 Å²	0	39.5 Å²	39.5	0%	0	19%	0.188	C	C	.	.	H	α-helix	trans	-58.6	-40	176.1	0	0	0	0	0	112.6	T161 A165 C247 I305 D312 L313	T161-A309 HydrophobicContact CG2-CB 4.4Å; A165-A309 HydrophobicContact CB-CB 3.63Å; C247-A309 HydrophobicContact CB-CB 3.77Å; I305-A309 WeakPolarHBondContact O-CB 2.89Å; I305-A309 PolarHBondContact O-N 2.76Å; A309-D312 PolarHBondContact O-N 3.38Å; A309-L313 VanDerWaalsContact O-CG 3.29Å; A309-L313 WeakPolarHBondContact O-CG 3.32Å; A309-L313 PolarHBondContact O-N 3.41Å; A309-L313 VanDerWaalsContact O-N 3.09Å
310	L	93.6	Very high	87.9	Confident	0 Å²	0	41.7 Å²	41.7	0%	0	20%	0.196	C	C	.	.	H	α-helix	trans	-69.7	-38.3	176.4	-174.9	61.6	0	0	0	112.5	C247 A250 D306 M307 T308 L313 L314 H449 M450 L453	C247-L310 HydrophobicContact CB-CB 4.48Å; A250-L310 HydrophobicContact CB-CD1 3.54Å; D306-L310 VanDerWaalsContact O-CB 3.26Å; D306-L310 WeakPolarHBondContact O-CB 3.48Å; D306-L310 PolarHBondContact O-N 3.3Å; M307-L310 PolarHBondContact O-N 2.83Å; T308-L310 VanDerWaalsContact C-N 3.3Å; T308-L310 PolarHBondContact O-N 3.49Å; L310-L313 PolarHBondContact O-N 3.48Å; L310-L314 HydrophobicContact CD1-CD1 3.81Å; L310-L314 HydrophobicContact CD1-CG 4.14Å; L310-L314 HydrophobicContact CG-CD1 3.92Å; L310-L314 WeakPolarHBondContact O-CB 3.46Å; L310-L314 VanDerWaalsContact O-CG 3.27Å; L310-L314 WeakPolarHBondContact O-CG 3.36Å; L310-L314 PolarHBondContact O-N 3.32Å; L310-L314 VanDerWaalsContact O-N 3.09Å; L310-H449 HydrophobicContact CD2-CB 4.12Å; L310-M450 HydrophobicContact CB-CE 4.08Å; L310-M450 HydrophobicContact CD2-CB 4.33Å; L310-M450 HydrophobicContact CD2-CE 3.81Å; L310-M450 HydrophobicContact CG-CE 3.81Å; L310-L453 HydrophobicContact CD2-CD1 4.4Å
311	C	92.1	Very high	86.4	Confident	8 Å²	8	40.3 Å²	40.3	5%	0.054	19%	0.193	C	C	.	.	H	α-helix	trans	-62.4	-43.3	172	-78.2	0	0	0	0	111.9	M307 T308 L313 L314 E315 L316 M450	M307-C311 PolarHBondContact O-N 2.76Å; M307-C311 PolarHBondContact O-SG 2.78Å; M307-C311 VanDerWaalsContact SD-SG 3.65Å; T308-C311 WeakPolarHBondContact O-CB 3.3Å; T308-C311 PolarHBondContact O-N 2.79Å; C311-L313 PolarHBondContact O-N 2.96Å; C311-L314 PolarHBondContact O-N 3.45Å; C311-E315 PolarHBondContact O-N 3.36Å; C311-E315 VanDerWaalsContact O-N 3.11Å; C311-L316 HydrophobicContact CB-CB 4.23Å; C311-L316 PolarHBondContact O-N 3.17Å; C311-M450 WeakPolarHBondContact SG-CE 3.48Å
312	D	91.6	Very high	84.8	Confident	43 Å²	43	44.6 Å²	44.6	23%	0.23	21%	0.211	C	C	.	.	H	α-helix	trans	-63.8	-40	178.9	-55.1	-45.2	0	0	0	111.6	R168 R169 T308 A309 E315	R168-D312 IonicContact CZ-OD2 2.79Å; R168-D312 IonicContact NH1-OD1 3.94Å; R168-D312 PolarHBondContact NH1-OD1 2.92Å; R168-D312 IonicContact NH1-OD2 3.21Å; R168-D312 PolarHBondContact NH1-OD2 2.86Å; R168-D312 IonicContact NH2-OD2 3.46Å; R168-D312 PolarHBondContact NH2-OD2 2.79Å; R169-D312 IonicContact CZ-OD1 2.86Å; R169-D312 IonicContact NH2-OD1 3.77Å; R169-D312 PolarHBondContact NH2-OD1 3.24Å; T308-D312 PolarHBondContact O-N 3Å; T308-D312 VanDerWaalsContact O-OD2 3.1Å; A309-D312 PolarHBondContact O-N 3.38Å; D312-E315 PolarHBondContact O-N 3.34Å
313	L	91.5	Very high	82.9	Confident	47 Å²	47	48.1 Å²	48.1	25%	0.246	23%	0.233	C	C	.	.	H	α-helix	trans	-69.6	-30.8	176.9	-74.2	171.8	0	0	0	114.3	T161 C247 A250 V251 I254 A309 L310 C311 E315	T161-L313 HydrophobicContact CG2-CD1 3.89Å; T161-L313 HydrophobicContact CG2-CD2 4.21Å; T161-L313 HydrophobicContact CG2-CG 4.15Å; C247-L313 HydrophobicContact CB-CD1 3.85Å; C247-L313 VanDerWaalsContact O-CD1 3.23Å; C247-L313 WeakPolarHBondContact O-CD1 3.49Å; A250-L313 HydrophobicContact CB-CD1 4.01Å; V251-L313 HydrophobicContact CG2-CD1 3.73Å; V251-L313 HydrophobicContact CG2-CD2 3.69Å; V251-L313 HydrophobicContact CG2-CG 4.37Å; I254-L313 HydrophobicContact CD1-CB 4.5Å; A309-L313 VanDerWaalsContact O-CG 3.29Å; A309-L313 WeakPolarHBondContact O-CG 3.32Å; A309-L313 PolarHBondContact O-N 3.41Å; A309-L313 VanDerWaalsContact O-N 3.09Å; L310-L313 PolarHBondContact O-N 3.48Å; C311-L313 PolarHBondContact O-N 2.96Å; L313-E315 VanDerWaalsContact C-N 3.35Å
314	L	88.7	Confident	80.8	Confident	38 Å²	38	50.5 Å²	50.5	20%	0.199	26%	0.257	C	S	.	.	T	Hydrogen-bonded Turn	trans	-96	8.9	-179	-63.3	178.1	0	0	0	112.2	L310 C311 L316 I441	L310-L314 HydrophobicContact CD1-CD1 3.81Å; L310-L314 HydrophobicContact CD1-CG 4.14Å; L310-L314 HydrophobicContact CG-CD1 3.92Å; L310-L314 WeakPolarHBondContact O-CB 3.46Å; L310-L314 VanDerWaalsContact O-CG 3.27Å; L310-L314 WeakPolarHBondContact O-CG 3.36Å; L310-L314 PolarHBondContact O-N 3.32Å; L310-L314 VanDerWaalsContact O-N 3.09Å; C311-L314 PolarHBondContact O-N 3.45Å; L314-L316 HydrophobicContact CB-CD1 4.05Å; L314-L316 HydrophobicContact CB-CG 3.84Å; L314-L316 HydrophobicContact CD1-CD1 4.29Å; L314-L316 PolarHBondContact O-N 3.03Å; L314-L316 VanDerWaalsContact O-N 3.11Å; L314-I441 HydrophobicContact CD1-CD1 3.98Å; L314-I441 HydrophobicContact CD1-CG1 4.15Å; L314-I441 HydrophobicContact CD1-CG2 4.49Å
315	E	86.8	Confident	78.6	Confident	179 Å²	179	60.8 Å²	60.8	84%	0.836	30%	0.302	S	S	*	.	T	Hydrogen-bonded Turn	trans	52	32.1	-178.6	-59.1	-177.6	-179.7	0	0	113.3	C311 D312 L313 E317	C311-E315 PolarHBondContact O-N 3.36Å; C311-E315 VanDerWaalsContact O-N 3.11Å; D312-E315 PolarHBondContact O-N 3.34Å; L313-E315 VanDerWaalsContact C-N 3.35Å; E315-E317 PolarHBondContact O-N 3.34Å
316	L	83.7	Confident	76.8	Confident	26 Å²	26	65.7 Å²	65.7	14%	0.136	32%	0.32	C	S	.	.			trans	-79.9	101	-178.5	-64	177	0	0	0	110.4	C311 L314 V318 A437 I441 M450	C311-L316 HydrophobicContact CB-CB 4.23Å; C311-L316 PolarHBondContact O-N 3.17Å; L314-L316 HydrophobicContact CB-CD1 4.05Å; L314-L316 HydrophobicContact CB-CG 3.84Å; L314-L316 HydrophobicContact CD1-CD1 4.29Å; L314-L316 PolarHBondContact O-N 3.03Å; L314-L316 VanDerWaalsContact O-N 3.11Å; L316-V318 HydrophobicContact CB-CG2 4.3Å; L316-V318 PolarHBondContact O-N 2.81Å; L316-A437 HydrophobicContact CD2-CB 4.48Å; L316-I441 HydrophobicContact CD1-CD1 4.07Å; L316-I441 HydrophobicContact CD1-CG1 4.04Å; L316-I441 HydrophobicContact CD2-CG1 4.45Å; L316-M450 HydrophobicContact CD1-CE 4.11Å
317	E	68.5	Low	74.6	Confident	137 Å²	137	75.8 Å²	75.8	64%	0.64	36%	0.364	S	S	*	.			trans	-61.5	100.2	169.2	-76.5	-164.9	159.5	0	0	111.8	E315 R507	E315-E317 PolarHBondContact O-N 3.34Å; E317-R507 PolarHBondContact O-NH2 2.93Å; E317-R507 IonicContact OE2-NH2 3.53Å; E317-R507 PolarHBondContact OE2-NH2 3.21Å
318	V	67.8	Low	72.6	Confident	43 Å²	43	81.1 Å²	81.1	26%	0.261	39%	0.392	S	S	.	.			trans	-118.3	110.8	176.5	178.7	0	0	0	0	109.2	L316 T434	L316-V318 HydrophobicContact CB-CG2 4.3Å; L316-V318 PolarHBondContact O-N 2.81Å; V318-T434 HydrophobicContact CG1-CG2 4.33Å; V318-T434 WeakPolarHBondContact CG1-OG1 3.46Å; V318-T434 HydrophobicContact CG2-CG2 3.98Å
319	K	63.8	Low	70.8	Confident	146 Å²	146	83.6 Å²	83.6	64%	0.635	41%	0.413	S	S	*	.	P	Polyproline II helix	trans	-90.5	124	169.8	-67.5	176.3	-177.9	170.8	0	109.1	H321	K319-H321 PolarHBondContact O-CE1 2.72Å; K319-H321 PolarHBondContact O-N 3.29Å; K319-H321 PolarHBondContact O-ND1 3.25Å
320	R	66	Low	69.3	Low	46 Å²	46	93.6 Å²	93.6	17%	0.174	46%	0.46	C	S	.	.	P	Polyproline II helix	trans	-66.6	118.3	169.5	-83.6	178.6	140.1	-158.6	-5.3	108.8	D135 E430	D135-R320 IonicContact OD2-CZ 2.7Å; D135-R320 IonicContact OD2-NH1 3.58Å; D135-R320 PolarHBondContact OD2-NH1 2.84Å; D135-R320 IonicContact OD2-NH2 2.88Å; D135-R320 PolarHBondContact OD2-NH2 3.48Å; R320-E430 HydrophobicContact CB-CG 4.46Å; R320-E430 HydrophobicContact CG-CG 3.91Å; R320-E430 IonicContact CZ-OE1 2.67Å; R320-E430 IonicContact NE-OE1 3.6Å; R320-E430 PolarHBondContact NE-OE1 3.23Å; R320-E430 IonicContact NH2-OE1 3.96Å; R320-E430 PolarHBondContact NH2-OE1 2.82Å; R320-E430 IonicContact NH2-OE2 3.36Å
321	H	64.1	Low	68.5	Low	60 Å²	60	95 Å²	95	28%	0.278	47%	0.469	S	S	.	.	P	Polyproline II helix	trans	-97.8	127.9	177.6	-71	68.4	0	0	0	110.1	K319 N433 V504	K319-H321 PolarHBondContact O-CE1 2.72Å; K319-H321 PolarHBondContact O-N 3.29Å; K319-H321 PolarHBondContact O-ND1 3.25Å; H321-N433 PolarHBondContact CE1-ND2 2.85Å; H321-N433 PolarHBondContact ND1-ND2 3.24Å; H321-V504 HydrophobicContact CB-CG1 4.48Å
322	K	60	Low	68.1	Low	130 Å²	130	98 Å²	98	57%	0.565	49%	0.487	S	S	*	.	P	Polyproline II helix	trans	-74.3	139.8	169.8	-71.5	176.8	178.6	170.4	0	109.4	E127 G324	E127-K322 IonicContact OE2-NZ 2.62Å; K322-G324 PolarHBondContact O-N 2.78Å
323	T	54.8	Low	67.9	Low	79 Å²	79	96 Å²	96	49%	0.485	48%	0.477	S	S	.	.	P	Polyproline II helix	trans	-64.5	119.8	171.7	43.3	0	0	0	0	110.3	K325 D424 A429	T323-K325 PolarHBondContact O-N 2.96Å; T323-D424 HydrophobicContact CG2-CB 4.3Å; T323-D424 VanDerWaalsContact CG2-OD1 3.22Å; T323-D424 WeakPolarHBondContact CG2-OD1 3.48Å; T323-A429 HydrophobicContact CG2-CB 3.49Å; T323-A429 VanDerWaalsContact CG2-CB 3.49Å
324	G	54.2	Low	67.8	Low	50 Å²	50	93.9 Å²	93.9	52%	0.515	47%	0.466	S	S	.	.	P	Polyproline II helix	trans	-64.3	126.4	170.4	0	0	0	0	0	110.5	K322 R326	K322-G324 PolarHBondContact O-N 2.78Å; G324-R326 PolarHBondContact O-N 3.44Å; G324-R326 VanDerWaalsContact O-N 3.14Å
325	K	47.8	Very low	67.7	Low	219 Å²	219	92.9 Å²	92.9	95%	0.952	47%	0.465	S	S	*	.			trans	-63.5	115.5	175.6	-69.1	-173.8	-179.4	-178.8	0	109.5	T323	T323-K325 PolarHBondContact O-N 2.96Å
326	R	58	Low	67.8	Low	107 Å²	107	85.1 Å²	85.1	40%	0.404	43%	0.429	S	S	.	.	P	Polyproline II helix	trans	-101.5	152.3	176.4	-73.6	-178.8	163.8	172	-3.6	111.2	G324 I328 K502	G324-R326 PolarHBondContact O-N 3.44Å; G324-R326 VanDerWaalsContact O-N 3.14Å; R326-I328 PolarHBondContact O-N 3.49Å; R326-K502 VanDerWaalsContact NH2-C 3.31Å; R326-K502 PolarHBondContact NH2-O 3Å
327	K	49.5	Very low	68.1	Low	212 Å²	212	85.6 Å²	85.6	92%	0.922	43%	0.434	S	S	*	.	P	Polyproline II helix	trans	-60.6	117.9	163.6	-74.2	-174.7	175.8	-178.9	0	107.9	A329	K327-A329 PolarHBondContact O-N 2.91Å
328	I	55	Low	69.2	Low	124 Å²	124	79.7 Å²	79.7	64%	0.636	41%	0.407	S	S	*	.	P	Polyproline II helix	trans	-65.9	123.9	169.7	-60.9	164.7	0	0	0	106	R326	R326-I328 PolarHBondContact O-N 3.49Å
329	A	55.7	Low	70.3	Confident	61 Å²	61	80.4 Å²	80.4	50%	0.504	41%	0.413	S	S	.	.	P	Polyproline II helix	trans	-71.7	147.1	172.4	0	0	0	0	0	109.4	K327 S331	K327-A329 PolarHBondContact O-N 2.91Å; A329-S331 PolarHBondContact O-N 3.13Å
330	E	61.9	Low	71.5	Confident	211 Å²	211	76.2 Å²	76.2	99%	0.986	40%	0.4	S	S	*	.	S	Bend	trans	-72.8	72.2	174.2	-65.2	-177.8	178	0	0	110.7
331	S	77.7	Confident	72.7	Confident	28 Å²	28	74.2 Å²	74.2	20%	0.196	39%	0.393	C	S	.	.			trans	-126.5	156.9	172.6	177	0	0	0	0	110.6	A329 L333 F334 V336 E393	A329-S331 PolarHBondContact O-N 3.13Å; S331-L333 PolarHBondContact OG-N 3.13Å; S331-F334 WeakPolarHBondContact CB-O 3.43Å; S331-F334 PolarHBondContact OG-N 3.36Å; S331-F334 PolarHBondContact OG-O 3.35Å; S331-F334 VanDerWaalsContact OG-O 3.14Å; S331-V336 WeakPolarHBondContact O-CG2 3.4Å; S331-E393 VanDerWaalsContact OG-CD 3.23Å; S331-E393 PolarHBondContact OG-OE1 2.69Å
332	T	83.5	Confident	74	Confident	71 Å²	71	71.8 Å²	71.8	44%	0.436	38%	0.382	S	S	.	.	S	Bend	trans	-98	-11.8	-178.8	54.9	0	0	0	0	113.1	E393	T332-E393 WeakPolarHBondContact OG1-CA 3.3Å; T332-E393 PolarHBondContact OG1-O 2.96Å
333	L	87	Confident	75.5	Confident	1 Å²	1	70.7 Å²	70.7	1%	0.005	38%	0.379	C	S	.	.	S	Bend	trans	-139.2	-54.5	-173.2	-67	178.3	0	0	0	113.7	S331 F357 L392 E393 F396 Y397	S331-L333 PolarHBondContact OG-N 3.13Å; L333-F357 HydrophobicContact CD1-CD2 4.21Å; L333-F357 HydrophobicContact CD1-CG 4.42Å; L333-F357 HydrophobicContact CD2-CB 3.93Å; L333-F357 HydrophobicContact CD2-CG 4.22Å; L333-L392 HydrophobicContact CD1-CB 3.96Å; L333-E393 HydrophobicContact CB-CG 4.24Å; L333-E393 HydrophobicContact CD1-CG 4.49Å; L333-F396 HydrophobicContact CD1-CB 3.83Å; L333-F396 HydrophobicContact CD1-CD1 4.49Å; L333-F396 HydrophobicContact CD1-CG 4.2Å; L333-F396 HydrophobicContact CD2-CD1 3.94Å; L333-F396 HydrophobicContact CD2-CG 4.45Å; L333-Y397 HydrophobicContact CD2-CD2 4.49Å; L333-Y397 HydrophobicContact CD2-CE2 3.7Å
334	F	89.1	Confident	77.2	Confident	4 Å²	4	69.6 Å²	69.6	2%	0.018	37%	0.372	C	S	.	.	T	Hydrogen-bonded Turn	trans	-93.5	141.5	-177.2	-66.2	-98.5	0	0	0	109.6	S331 V336 F357 Q389 E393 L414 K417 F418	S331-F334 WeakPolarHBondContact CB-O 3.43Å; S331-F334 PolarHBondContact OG-N 3.36Å; S331-F334 PolarHBondContact OG-O 3.35Å; S331-F334 VanDerWaalsContact OG-O 3.14Å; F334-V336 PolarHBondContact O-N 3.29Å; F334-F357 HydrophobicContact CE1-CE1 4.39Å; F334-F357 HydrophobicContact CE2-CE1 4.22Å; F334-F357 HydrophobicContact CE2-CZ 4.03Å; F334-F357 AromaticContact CZ-CE1 3.83Å; F334-F357 HydrophobicContact CZ-CE1 3.83Å; F334-F357 AromaticContact CZ-CZ 3.65Å; F334-F357 HydrophobicContact CZ-CZ 3.65Å; F334-Q389 HydrophobicContact CD2-CG 3.75Å; F334-Q389 HydrophobicContact CE2-CB 4.41Å; F334-Q389 HydrophobicContact CE2-CG 3.85Å; F334-Q389 HydrophobicContact CG-CG 4.34Å; F334-Q389 HydrophobicContact CZ-CG 4.49Å; F334-E393 HydrophobicContact CD2-CG 4.12Å; F334-L414 HydrophobicContact CE1-CD2 4.4Å; F334-L414 HydrophobicContact CZ-CD2 3.89Å; F334-K417 HydrophobicContact CD1-CG 4.5Å; F334-K417 HydrophobicContact CE1-CG 4.48Å; F334-F418 HydrophobicContact CD1-CB 4.3Å; F334-F418 HydrophobicContact CD1-CD2 4.38Å; F334-F418 HydrophobicContact CE1-CB 3.89Å; F334-F418 HydrophobicContact CE1-CD2 4.43Å
335	G	86.7	Confident	79	Confident	17 Å²	17	67.2 Å²	67.2	18%	0.175	35%	0.348	C	S	.	.	T	Hydrogen-bonded Turn	trans	73.2	8	-176.1	0	0	0	0	0	115.2	E421 P423	G335-E421 VanDerWaalsContact CA-O 3.28Å; G335-E421 WeakPolarHBondContact CA-O 3.38Å; G335-P423 WeakPolarHBondContact O-CG 3.45Å
336	V	89.1	Confident	81	Confident	15 Å²	15	61.2 Å²	61.2	9%	0.091	32%	0.323	C	S	.	.			trans	-95.3	139.2	177.6	-173.6	0	0	0	0	109.9	S331 F334 T340 L341 P423	S331-V336 WeakPolarHBondContact O-CG2 3.4Å; F334-V336 PolarHBondContact O-N 3.29Å; V336-T340 HydrophobicContact CG1-CG2 4.16Å; V336-L341 HydrophobicContact CB-CD1 4.29Å; V336-L341 HydrophobicContact CB-CD2 3.83Å; V336-L341 HydrophobicContact CB-CG 3.89Å; V336-L341 HydrophobicContact CG1-CD2 3.79Å; V336-L341 HydrophobicContact CG1-CG 3.78Å; V336-L341 HydrophobicContact CG2-CD2 4.35Å; V336-P423 WeakPolarHBondContact O-CD 3.45Å
337	P	90.5	Very high	82.5	Confident	37 Å²	37	64.3 Å²	64.3	24%	0.24	34%	0.34	C	S	.	.			trans	-58.1	139.9	174.1	-24.3	34.6	0	0	0	112.6	S339 T340 L341 P423	P337-S339 VanDerWaalsContact C-N 3.26Å; P337-S339 PolarHBondContact O-N 3.22Å; P337-T340 PolarHBondContact O-N 3.11Å; P337-T340 VanDerWaalsContact O-N 3.07Å; P337-L341 PolarHBondContact O-N 3.34Å; P337-P423 HydrophobicContact CG-CG 4.2Å
338	L	91	Very high	84.4	Confident	13 Å²	13	59.4 Å²	59.4	7%	0.068	32%	0.322	C	S	.	.	H	α-helix	trans	-60.4	-34.4	-175.3	-171	65	0	0	0	113	L342 P355 L426 P461 N462 T465	L338-L342 WeakPolarHBondContact O-CG 3.3Å; L338-L342 PolarHBondContact O-N 2.85Å; L338-L342 VanDerWaalsContact O-N 3.14Å; L338-P355 HydrophobicContact CD1-CG 3.38Å; L338-L426 HydrophobicContact CD2-CD1 4.17Å; L338-P461 HydrophobicContact CD2-CB 3.86Å; L338-P461 HydrophobicContact CG-CB 4.05Å; L338-N462 HydrophobicContact CD2-CB 4.4Å; L338-T465 HydrophobicContact CD1-CG2 4.32Å; L338-T465 HydrophobicContact CD2-CG2 4.35Å
339	S	90.1	Very high	85.9	Confident	57 Å²	57	60 Å²	60	40%	0.399	32%	0.316	S	S	.	.	H	α-helix	trans	-62.7	-49.1	172.6	47.8	0	0	0	0	112.1	P337 L341 L342 E343	P337-S339 VanDerWaalsContact C-N 3.26Å; P337-S339 PolarHBondContact O-N 3.22Å; S339-L341 VanDerWaalsContact C-N 3.33Å; S339-L341 PolarHBondContact O-N 3.17Å; S339-L342 PolarHBondContact O-N 3.17Å; S339-L342 VanDerWaalsContact O-N 3.12Å; S339-E343 WeakPolarHBondContact O-CG 3.34Å; S339-E343 PolarHBondContact O-N 3.37Å
340	T	90.7	Very high	87.3	Confident	58 Å²	58	61.7 Å²	61.7	36%	0.356	32%	0.322	S	S	.	.	H	α-helix	trans	-63.7	-36.2	-179.4	-51.3	0	0	0	0	112.5	V336 P337 T344	V336-T340 HydrophobicContact CG1-CG2 4.16Å; P337-T340 PolarHBondContact O-N 3.11Å; P337-T340 VanDerWaalsContact O-N 3.07Å; T340-T344 WeakPolarHBondContact O-CB 3.17Å; T340-T344 PolarHBondContact O-N 2.74Å; T340-T344 VanDerWaalsContact O-N 3.16Å; T340-T344 PolarHBondContact O-OG1 3.34Å
341	L	91.1	Very high	88.2	Confident	5 Å²	5	59.2 Å²	59.2	3%	0.026	32%	0.316	C	S	.	.	H	α-helix	trans	-61.7	-50.3	170.8	-70	174.4	0	0	0	110.9	V336 P337 S339 E343 T344 D345 P355 F418	V336-L341 HydrophobicContact CB-CD1 4.29Å; V336-L341 HydrophobicContact CB-CD2 3.83Å; V336-L341 HydrophobicContact CB-CG 3.89Å; V336-L341 HydrophobicContact CG1-CD2 3.79Å; V336-L341 HydrophobicContact CG1-CG 3.78Å; V336-L341 HydrophobicContact CG2-CD2 4.35Å; P337-L341 PolarHBondContact O-N 3.34Å; S339-L341 VanDerWaalsContact C-N 3.33Å; S339-L341 PolarHBondContact O-N 3.17Å; L341-E343 PolarHBondContact O-N 2.91Å; L341-T344 PolarHBondContact O-N 3.39Å; L341-D345 WeakPolarHBondContact O-CB 3.38Å; L341-D345 VanDerWaalsContact O-CG 3.27Å; L341-D345 PolarHBondContact O-N 3.19Å; L341-P355 HydrophobicContact CB-CB 4.48Å; L341-P355 HydrophobicContact CB-CG 4.44Å; L341-F418 HydrophobicContact CD1-CE2 3.91Å; L341-F418 HydrophobicContact CD1-CZ 3.92Å
342	L	91.4	Very high	88.6	Confident	9 Å²	9	58.5 Å²	58.5	5%	0.047	31%	0.31	C	S	.	.	H	α-helix	trans	-63.3	-40.7	178.6	-73.2	178.2	0	0	0	113.3	L338 S339 T344 D345 Q346 T352 I354 P355 P461	L338-L342 WeakPolarHBondContact O-CG 3.3Å; L338-L342 PolarHBondContact O-N 2.85Å; L338-L342 VanDerWaalsContact O-N 3.14Å; S339-L342 PolarHBondContact O-N 3.17Å; S339-L342 VanDerWaalsContact O-N 3.12Å; L342-T344 PolarHBondContact O-N 3.09Å; L342-D345 PolarHBondContact O-N 2.81Å; L342-Q346 VanDerWaalsContact O-CB 3.26Å; L342-Q346 WeakPolarHBondContact O-CB 3.47Å; L342-Q346 WeakPolarHBondContact O-CG 3.4Å; L342-Q346 PolarHBondContact O-N 3.17Å; L342-T352 HydrophobicContact CD2-CG2 4.3Å; L342-I354 VanDerWaalsContact CD2-C 3.45Å; L342-P355 HydrophobicContact CD2-CG 4.18Å; L342-P355 HydrophobicContact CG-CG 4.42Å; L342-P461 HydrophobicContact CD1-CB 3.49Å; L342-P461 VanDerWaalsContact CD1-CB 3.49Å; L342-P461 HydrophobicContact CD1-CG 3.75Å
343	E	90.8	Very high	88.7	Confident	106 Å²	106	57.8 Å²	57.8	50%	0.495	31%	0.308	S	S	.	.	H	α-helix	trans	-61.2	-34.1	175.2	-74.1	166.6	-150	0	0	112.3	S339 L341 K347	S339-E343 WeakPolarHBondContact O-CG 3.34Å; S339-E343 PolarHBondContact O-N 3.37Å; L341-E343 PolarHBondContact O-N 2.91Å; E343-K347 WeakPolarHBondContact O-CD 3.38Å; E343-K347 WeakPolarHBondContact O-CE 3.37Å; E343-K347 WeakPolarHBondContact O-CG 3.28Å
344	T	89.8	Confident	89	Confident	57 Å²	57	59.4 Å²	59.4	35%	0.35	32%	0.316	S	S	.	.	H	α-helix	trans	-74.5	-45.6	175.5	-56.8	0	0	0	0	110.8	T340 L341 L342 Q346 K347	T340-T344 WeakPolarHBondContact O-CB 3.17Å; T340-T344 PolarHBondContact O-N 2.74Å; T340-T344 VanDerWaalsContact O-N 3.16Å; T340-T344 PolarHBondContact O-OG1 3.34Å; L341-T344 PolarHBondContact O-N 3.39Å; L342-T344 PolarHBondContact O-N 3.09Å; T344-Q346 PolarHBondContact O-N 2.99Å; T344-K347 WeakPolarHBondContact O-CB 3.39Å; T344-K347 PolarHBondContact O-N 3.12Å
345	D	91.7	Very high	89.2	Confident	0 Å²	0	59.2 Å²	59.2	0%	0	32%	0.316	C	S	.	.	H	α-helix	trans	-64	-37.4	178.2	-75	-22.4	0	0	0	112.8	L341 L342 K347 I348 R349 T352 P355 L356 Y397	L341-D345 WeakPolarHBondContact O-CB 3.38Å; L341-D345 VanDerWaalsContact O-CG 3.27Å; L341-D345 PolarHBondContact O-N 3.19Å; L342-D345 PolarHBondContact O-N 2.81Å; D345-K347 VanDerWaalsContact C-N 3.28Å; D345-K347 PolarHBondContact O-N 3.47Å; D345-I348 WeakPolarHBondContact O-CB 3.19Å; D345-I348 PolarHBondContact O-N 3.28Å; D345-R349 PolarHBondContact O-N 3.47Å; D345-T352 HydrophobicContact CB-CG2 4.17Å; D345-P355 WeakPolarHBondContact OD2-CA 3.35Å; D345-L356 HydrophobicContact CB-CD1 3.86Å; D345-L356 HydrophobicContact CB-CG 3.78Å; D345-L356 PolarHBondContact OD2-N 3.43Å; D345-Y397 WeakPolarHBondContact OD1-CE1 3.3Å; D345-Y397 PolarHBondContact OD1-OH 3.02Å
346	Q	91.1	Very high	89.5	Confident	93 Å²	93	59.2 Å²	59.2	44%	0.435	31%	0.312	S	S	.	.	H	α-helix	trans	-66.7	-27.7	179.6	-77.8	174.8	7.7	0	0	113	L342 T344 I348 R349 T352	L342-Q346 VanDerWaalsContact O-CB 3.26Å; L342-Q346 WeakPolarHBondContact O-CB 3.47Å; L342-Q346 WeakPolarHBondContact O-CG 3.4Å; L342-Q346 PolarHBondContact O-N 3.17Å; T344-Q346 PolarHBondContact O-N 2.99Å; Q346-I348 VanDerWaalsContact C-N 3.26Å; Q346-I348 PolarHBondContact O-N 2.82Å; Q346-R349 WeakPolarHBondContact CA-O 2.97Å; Q346-R349 CarbonylContact O-C 3.55Å; Q346-T352 PolarHBondContact NE2-O 3.18Å
347	K	89.4	Confident	89.6	Confident	172 Å²	172	58.6 Å²	58.6	75%	0.748	31%	0.308	S	S	*	.	H	α-helix	trans	-67.8	-26.4	171.3	-65.5	164.1	-170.6	169.5	0	112.3	E343 T344 D345	E343-K347 WeakPolarHBondContact O-CD 3.38Å; E343-K347 WeakPolarHBondContact O-CE 3.37Å; E343-K347 WeakPolarHBondContact O-CG 3.28Å; T344-K347 WeakPolarHBondContact O-CB 3.39Å; T344-K347 PolarHBondContact O-N 3.12Å; D345-K347 VanDerWaalsContact C-N 3.28Å; D345-K347 PolarHBondContact O-N 3.47Å
348	I	88.3	Confident	89.8	Confident	108 Å²	108	57 Å²	57	55%	0.554	30%	0.297	S	S	*	.	H	α-helix	trans	-91	-41.6	179.1	-57.1	172.8	0	0	0	110.6	D345 Q346 L356 Y397	D345-I348 WeakPolarHBondContact O-CB 3.19Å; D345-I348 PolarHBondContact O-N 3.28Å; Q346-I348 VanDerWaalsContact C-N 3.26Å; Q346-I348 PolarHBondContact O-N 2.82Å; I348-L356 HydrophobicContact CB-CD1 4.42Å; I348-L356 HydrophobicContact CG2-CD1 4.46Å; I348-Y397 HydrophobicContact CD1-CD1 3.5Å; I348-Y397 HydrophobicContact CD1-CE1 3.78Å
349	R	86.5	Confident	90	Very high	136 Å²	136	60.9 Å²	60.9	51%	0.513	32%	0.315	S	S	.	.	S	Bend	trans	-137.7	105.9	178.8	179.9	-179.1	-67.6	154.8	1.6	109.7	D345 Q346 T352 L356	D345-R349 PolarHBondContact O-N 3.47Å; Q346-R349 WeakPolarHBondContact CA-O 2.97Å; Q346-R349 CarbonylContact O-C 3.55Å; R349-T352 WeakPolarHBondContact CB-OG1 3.15Å; R349-T352 WeakPolarHBondContact CG-OG1 3.42Å; R349-T352 WeakPolarHBondContact O-CB 3.41Å; R349-T352 PolarHBondContact O-OG1 3.21Å; R349-L356 VanDerWaalsContact NH1-CD2 3.31Å
350	P	85	Confident	90.1	Very high	97 Å²	97	60.2 Å²	60.2	63%	0.63	31%	0.308	S	S	*	.	T	Hydrogen-bonded Turn	trans	-61	155.5	177.3	26.5	-34.6	0	0	0	111.2	T352	P350-T352 VanDerWaalsContact C-N 3.25Å; P350-T352 PolarHBondContact O-N 2.96Å
351	N	80.8	Confident	90.3	Very high	160 Å²	160	57.5 Å²	57.5	86%	0.856	29%	0.292	S	S	*	.	T	Hydrogen-bonded Turn	trans	62.6	24	-177.3	-50.4	-22.9	0	0	0	114.7	S353	N351-S353 PolarHBondContact O-N 2.97Å
352	T	86.3	Confident	90.6	Very high	13 Å²	13	57.7 Å²	57.7	8%	0.08	29%	0.293	C	S	.	.			trans	-78.1	118.1	172.8	-62.9	0	0	0	0	110.6	L342 D345 Q346 R349 P350 I354 L356	L342-T352 HydrophobicContact CD2-CG2 4.3Å; D345-T352 HydrophobicContact CB-CG2 4.17Å; Q346-T352 PolarHBondContact NE2-O 3.18Å; R349-T352 WeakPolarHBondContact CB-OG1 3.15Å; R349-T352 WeakPolarHBondContact CG-OG1 3.42Å; R349-T352 WeakPolarHBondContact O-CB 3.41Å; R349-T352 PolarHBondContact O-OG1 3.21Å; P350-T352 VanDerWaalsContact C-N 3.25Å; P350-T352 PolarHBondContact O-N 2.96Å; T352-I354 WeakPolarHBondContact CG2-O 3.28Å; T352-L356 HydrophobicContact CG2-CD2 3.97Å; T352-L356 HydrophobicContact CG2-CG 4.23Å
353	S	86.4	Confident	90.7	Very high	55 Å²	55	58.9 Å²	58.9	39%	0.385	30%	0.302	S	S	.	.			trans	-104.6	-9	-178.7	57.3	0	0	0	0	114.9	N351 S464	N351-S353 PolarHBondContact O-N 2.97Å; S353-S464 VanDerWaalsContact O-CB 3.31Å; S353-S464 WeakPolarHBondContact O-CB 3.5Å
354	I	92.9	Very high	90.9	Very high	35 Å²	35	54.6 Å²	54.6	18%	0.179	28%	0.281	C	S	.	.	S	Bend	trans	-134.8	137	-179.7	-59.6	150.5	0	0	0	106.9	L342 T352 L356 L358 A468	L342-I354 VanDerWaalsContact CD2-C 3.45Å; T352-I354 WeakPolarHBondContact CG2-O 3.28Å; I354-L356 PolarHBondContact O-N 2.95Å; I354-L358 HydrophobicContact CG2-CB 4.46Å; I354-L358 HydrophobicContact CG2-CD2 4.02Å; I354-L358 HydrophobicContact CG2-CG 4.44Å; I354-A468 HydrophobicContact CD1-CB 3.66Å; I354-A468 HydrophobicContact CG1-CB 4.27Å; I354-A468 HydrophobicContact CG2-CB 4.39Å
355	P	93.4	Very high	91.2	Very high	1 Å²	1	51.9 Å²	51.9	1%	0.006	27%	0.265	C	S	.	.			trans	-54.2	136.6	-176.8	-27.4	33.8	0	0	0	112.9	L338 L341 L342 D345 F357 L358 H359	L338-P355 HydrophobicContact CD1-CG 3.38Å; L341-P355 HydrophobicContact CB-CB 4.48Å; L341-P355 HydrophobicContact CB-CG 4.44Å; L342-P355 HydrophobicContact CD2-CG 4.18Å; L342-P355 HydrophobicContact CG-CG 4.42Å; D345-P355 WeakPolarHBondContact OD2-CA 3.35Å; P355-F357 PolarHBondContact O-N 3.02Å; P355-L358 HydrophobicContact CB-CB 4.32Å; P355-L358 PolarHBondContact O-N 2.93Å; P355-H359 PolarHBondContact O-N 3.48Å
356	L	92.4	Very high	91.3	Very high	17 Å²	17	55 Å²	55	9%	0.089	28%	0.279	C	S	.	.	H	α-helix	trans	-59.8	-35.7	-177.5	-67.9	176.9	0	0	0	111.4	D345 I348 R349 T352 I354 T360 F396	D345-L356 HydrophobicContact CB-CD1 3.86Å; D345-L356 HydrophobicContact CB-CG 3.78Å; D345-L356 PolarHBondContact OD2-N 3.43Å; I348-L356 HydrophobicContact CB-CD1 4.42Å; I348-L356 HydrophobicContact CG2-CD1 4.46Å; R349-L356 VanDerWaalsContact NH1-CD2 3.31Å; T352-L356 HydrophobicContact CG2-CD2 3.97Å; T352-L356 HydrophobicContact CG2-CG 4.23Å; I354-L356 PolarHBondContact O-N 2.95Å; L356-T360 VanDerWaalsContact O-CB 3.31Å; L356-T360 WeakPolarHBondContact O-CB 3.31Å; L356-T360 PolarHBondContact O-N 3.34Å; L356-T360 PolarHBondContact O-OG1 2.87Å; L356-F396 HydrophobicContact CB-CE1 4.2Å; L356-F396 HydrophobicContact CB-CZ 4.11Å
357	F	92.9	Very high	91.4	Very high	2 Å²	2	58.2 Å²	58.2	1%	0.009	29%	0.292	C	S	.	.	H	α-helix	trans	-58.9	-53	173.2	171.1	-114.5	0	0	0	111.4	L333 F334 P355 T360 L361 L392 F396 W403 F418	L333-F357 HydrophobicContact CD1-CD2 4.21Å; L333-F357 HydrophobicContact CD1-CG 4.42Å; L333-F357 HydrophobicContact CD2-CB 3.93Å; L333-F357 HydrophobicContact CD2-CG 4.22Å; F334-F357 HydrophobicContact CE1-CE1 4.39Å; F334-F357 HydrophobicContact CE2-CE1 4.22Å; F334-F357 HydrophobicContact CE2-CZ 4.03Å; F334-F357 AromaticContact CZ-CE1 3.83Å; F334-F357 HydrophobicContact CZ-CE1 3.83Å; F334-F357 AromaticContact CZ-CZ 3.65Å; F334-F357 HydrophobicContact CZ-CZ 3.65Å; P355-F357 PolarHBondContact O-N 3.02Å; F357-T360 PolarHBondContact O-N 3.32Å; F357-L361 HydrophobicContact CE1-CD2 4.29Å; F357-L361 HydrophobicContact CZ-CD2 4.01Å; F357-L361 WeakPolarHBondContact O-CB 3.3Å; F357-L361 PolarHBondContact O-N 3.43Å; F357-L392 HydrophobicContact CD2-CD2 4.43Å; F357-L392 HydrophobicContact CE2-CD1 3.78Å; F357-L392 HydrophobicContact CE2-CD2 3.96Å; F357-L392 HydrophobicContact CE2-CG 4.36Å; F357-L392 HydrophobicContact CZ-CD1 4.17Å; F357-F396 HydrophobicContact CB-CD1 4.39Å; F357-F396 HydrophobicContact CB-CE1 3.97Å; F357-F396 HydrophobicContact CB-CE2 4.3Å; F357-F396 HydrophobicContact CB-CZ 3.95Å; F357-F396 HydrophobicContact CD2-CD2 4.1Å; F357-F396 HydrophobicContact CD2-CE2 4.16Å; F357-F396 VanDerWaalsContact N-CZ 3.34Å; F357-W403 HydrophobicContact CE2-CH2 4.29Å; F357-F418 AromaticContact CD1-CD2 3.81Å; F357-F418 HydrophobicContact CD1-CD2 3.81Å; F357-F418 AromaticContact CD1-CE2 3.9Å; F357-F418 HydrophobicContact CD1-CE2 3.9Å; F357-F418 HydrophobicContact CD1-CG 4.36Å; F357-F418 HydrophobicContact CE1-CB 4.24Å; F357-F418 AromaticContact CE1-CD2 3.67Å; F357-F418 HydrophobicContact CE1-CD2 3.67Å; F357-F418 HydrophobicContact CE1-CE2 4.24Å; F357-F418 AromaticContact CE1-CG 3.99Å; F357-F418 HydrophobicContact CE1-CG 3.99Å
358	L	94.4	Very high	91.5	Very high	2 Å²	2	54.2 Å²	54.2	1%	0.01	27%	0.274	C	S	.	.	H	α-helix	trans	-63.6	-45.4	179.6	-177.9	66	0	0	0	111.6	I354 P355 T360 L361 L362 L415 F418 T465	I354-L358 HydrophobicContact CG2-CB 4.46Å; I354-L358 HydrophobicContact CG2-CD2 4.02Å; I354-L358 HydrophobicContact CG2-CG 4.44Å; P355-L358 HydrophobicContact CB-CB 4.32Å; P355-L358 PolarHBondContact O-N 2.93Å; L358-T360 VanDerWaalsContact C-N 3.27Å; L358-T360 PolarHBondContact O-N 3.47Å; L358-L361 PolarHBondContact O-N 3.11Å; L358-L362 HydrophobicContact CD1-CD1 4.18Å; L358-L362 HydrophobicContact CD1-CD2 4.44Å; L358-L362 HydrophobicContact CD1-CG 4.04Å; L358-L362 HydrophobicContact CD2-CD1 4.44Å; L358-L362 HydrophobicContact CG-CD1 3.92Å; L358-L362 HydrophobicContact CG-CG 4.18Å; L358-L362 WeakPolarHBondContact O-CB 3.31Å; L358-L362 VanDerWaalsContact O-CG 3.28Å; L358-L362 WeakPolarHBondContact O-CG 3.27Å; L358-L362 PolarHBondContact O-N 3.39Å; L358-L415 HydrophobicContact CD1-CD1 3.36Å; L358-F418 HydrophobicContact CB-CE1 4.23Å; L358-F418 HydrophobicContact CD1-CD1 4.18Å; L358-F418 HydrophobicContact CD1-CE1 4.38Å; L358-F418 HydrophobicContact CD2-CE1 4.29Å; L358-T465 HydrophobicContact CD2-CG2 3.55Å
359	H	93.8	Very high	91.5	Very high	95 Å²	95	49 Å²	49	44%	0.44	25%	0.248	S	C	.	.	H	α-helix	trans	-57.1	-41.2	175.8	175.8	-77.1	0	0	0	111.8	P355 S363	P355-H359 PolarHBondContact O-N 3.48Å; H359-S363 VanDerWaalsContact O-CB 3.28Å; H359-S363 WeakPolarHBondContact O-CB 3.41Å; H359-S363 PolarHBondContact O-N 2.85Å
360	T	93.4	Very high	91.9	Very high	44 Å²	44	43.4 Å²	43.4	27%	0.27	23%	0.229	S	C	.	.	H	α-helix	trans	-68.5	-43.9	178.2	-54.7	0	0	0	0	111.5	L356 F357 L358 S363 F364 F396 W403	L356-T360 VanDerWaalsContact O-CB 3.31Å; L356-T360 WeakPolarHBondContact O-CB 3.31Å; L356-T360 PolarHBondContact O-N 3.34Å; L356-T360 PolarHBondContact O-OG1 2.87Å; F357-T360 PolarHBondContact O-N 3.32Å; L358-T360 VanDerWaalsContact C-N 3.27Å; L358-T360 PolarHBondContact O-N 3.47Å; T360-S363 PolarHBondContact O-N 3.14Å; T360-F364 WeakPolarHBondContact O-CB 3.48Å; T360-F364 PolarHBondContact O-N 3.32Å; T360-F396 HydrophobicContact CG2-CE2 4.42Å; T360-W403 HydrophobicContact CG2-CZ2 3.82Å
361	L	95.1	Very high	92.2	Very high	0 Å²	0	42.1 Å²	42.1	0%	0	22%	0.217	C	C	.	.	H	α-helix	trans	-62.4	-45.2	177.4	-178.9	62.2	0	0	0	112.2	F357 L358 F364 L365 W403 A411 L414 L415	F357-L361 HydrophobicContact CE1-CD2 4.29Å; F357-L361 HydrophobicContact CZ-CD2 4.01Å; F357-L361 WeakPolarHBondContact O-CB 3.3Å; F357-L361 PolarHBondContact O-N 3.43Å; L358-L361 PolarHBondContact O-N 3.11Å; L361-F364 PolarHBondContact O-N 3.26Å; L361-L365 HydrophobicContact CD1-CD1 4.49Å; L361-L365 HydrophobicContact CG-CD1 4.36Å; L361-L365 WeakPolarHBondContact O-CG 3.16Å; L361-L365 PolarHBondContact O-N 3.3Å; L361-W403 HydrophobicContact CB-CH2 4.13Å; L361-W403 HydrophobicContact CD1-CH2 3.75Å; L361-W403 HydrophobicContact CD1-CZ3 3.64Å; L361-A411 HydrophobicContact CD1-CB 3.83Å; L361-L414 HydrophobicContact CD2-CB 4.47Å; L361-L415 HydrophobicContact CD2-CB 3.86Å; L361-L415 HydrophobicContact CD2-CD1 4.23Å; L361-L415 HydrophobicContact CG-CB 4.48Å
362	L	96.1	Very high	92.8	Very high	9 Å²	9	36.1 Å²	36.1	5%	0.047	19%	0.187	C	C	.	.	H	α-helix	trans	-63.5	-45.9	174	-66.4	177.4	0	0	0	110.8	L358 F364 L365 E366 L415 A468 F472	L358-L362 HydrophobicContact CD1-CD1 4.18Å; L358-L362 HydrophobicContact CD1-CD2 4.44Å; L358-L362 HydrophobicContact CD1-CG 4.04Å; L358-L362 HydrophobicContact CD2-CD1 4.44Å; L358-L362 HydrophobicContact CG-CD1 3.92Å; L358-L362 HydrophobicContact CG-CG 4.18Å; L358-L362 WeakPolarHBondContact O-CB 3.31Å; L358-L362 VanDerWaalsContact O-CG 3.28Å; L358-L362 WeakPolarHBondContact O-CG 3.27Å; L358-L362 PolarHBondContact O-N 3.39Å; L362-F364 VanDerWaalsContact C-N 3.27Å; L362-F364 PolarHBondContact O-N 3.45Å; L362-L365 PolarHBondContact O-N 3.06Å; L362-L365 VanDerWaalsContact O-N 3.16Å; L362-E366 WeakPolarHBondContact O-CB 3.33Å; L362-E366 WeakPolarHBondContact O-CG 3.44Å; L362-E366 PolarHBondContact O-N 2.87Å; L362-L415 HydrophobicContact CD2-CD1 3.88Å; L362-L415 HydrophobicContact CD2-CD2 3.91Å; L362-A468 HydrophobicContact CD1-CB 4.05Å; L362-F472 HydrophobicContact CD2-CB 3.82Å; L362-F472 HydrophobicContact CD2-CD1 3.75Å; L362-F472 HydrophobicContact CD2-CD2 4.36Å; L362-F472 HydrophobicContact CD2-CE1 4.46Å; L362-F472 HydrophobicContact CD2-CG 3.69Å
363	S	94.8	Very high	93	Very high	34 Å²	34	41.8 Å²	41.8	24%	0.238	21%	0.213	C	C	.	.	H	α-helix	trans	-61.4	-34.2	177.2	-169.2	0	0	0	0	113	H359 T360 K367	H359-S363 VanDerWaalsContact O-CB 3.28Å; H359-S363 WeakPolarHBondContact O-CB 3.41Å; H359-S363 PolarHBondContact O-N 2.85Å; T360-S363 PolarHBondContact O-N 3.14Å; S363-K367 WeakPolarHBondContact O-CD 3.48Å; S363-K367 VanDerWaalsContact O-CG 3.28Å; S363-K367 WeakPolarHBondContact O-CG 3.43Å; S363-K367 PolarHBondContact O-N 3.25Å; S363-K367 PolarHBondContact OG-NZ 3.1Å; S363-K367 VanDerWaalsContact OG-NZ 3.16Å
364	F	95.1	Very high	93.2	Very high	16 Å²	16	39.2 Å²	39.2	7%	0.07	19%	0.194	C	C	.	.	H	α-helix	trans	-66.3	-49.4	172.7	172.3	-96.9	0	0	0	111.6	T360 L361 L362 E366 K367 K368 W403 V406 A411	T360-F364 WeakPolarHBondContact O-CB 3.48Å; T360-F364 PolarHBondContact O-N 3.32Å; L361-F364 PolarHBondContact O-N 3.26Å; L362-F364 VanDerWaalsContact C-N 3.27Å; L362-F364 PolarHBondContact O-N 3.45Å; F364-E366 VanDerWaalsContact C-N 3.31Å; F364-E366 PolarHBondContact O-N 3.15Å; F364-K367 PolarHBondContact O-N 2.92Å; F364-K367 VanDerWaalsContact O-N 3.1Å; F364-K368 HydrophobicContact CE2-CB 4.49Å; F364-K368 HydrophobicContact CE2-CD 3.67Å; F364-K368 HydrophobicContact CE2-CG 4.23Å; F364-K368 HydrophobicContact CZ-CB 4.38Å; F364-K368 HydrophobicContact CZ-CD 4.04Å; F364-K368 PolarHBondContact O-N 2.85Å; F364-W403 HydrophobicContact CB-CD2 4.43Å; F364-W403 HydrophobicContact CB-CE3 3.97Å; F364-W403 HydrophobicContact CB-CZ3 4.4Å; F364-W403 HydrophobicContact CD1-CE3 4.02Å; F364-W403 HydrophobicContact CD1-CZ3 4.34Å; F364-W403 HydrophobicContact CD2-CB 3.85Å; F364-W403 HydrophobicContact CD2-CD2 4.43Å; F364-W403 AromaticContact CD2-CE3 3.99Å; F364-W403 HydrophobicContact CD2-CE3 3.99Å; F364-W403 HydrophobicContact CD2-CG 4.42Å; F364-W403 HydrophobicContact CE2-CB 4.16Å; F364-W403 WeakPolarHBondContact CE2-O 3.17Å; F364-W403 HydrophobicContact CG-CD2 4.41Å; F364-W403 AromaticContact CG-CE3 3.7Å; F364-W403 HydrophobicContact CG-CE3 3.7Å; F364-W403 HydrophobicContact CG-CZ3 4.33Å; F364-V406 HydrophobicContact CE1-CB 4.43Å; F364-V406 HydrophobicContact CE1-CG1 4.27Å; F364-V406 HydrophobicContact CZ-CB 4.09Å; F364-V406 HydrophobicContact CZ-CG1 4.41Å; F364-V406 WeakPolarHBondContact CZ-O 3.33Å; F364-A411 HydrophobicContact CD1-CB 3.72Å; F364-A411 HydrophobicContact CE1-CB 3.6Å
365	L	95.4	Very high	93.2	Very high	0 Å²	0	37.5 Å²	37.5	0%	0	19%	0.186	C	C	.	.	I	π-helix	trans	-63.5	-34.6	178	-72.4	169.3	0	0	0	112.4	L361 L362 K367 G369 V370 I375 P408 A411 A412 L415 F472	L361-L365 HydrophobicContact CD1-CD1 4.49Å; L361-L365 HydrophobicContact CG-CD1 4.36Å; L361-L365 WeakPolarHBondContact O-CG 3.16Å; L361-L365 PolarHBondContact O-N 3.3Å; L362-L365 PolarHBondContact O-N 3.06Å; L362-L365 VanDerWaalsContact O-N 3.16Å; L365-K367 VanDerWaalsContact C-N 3.31Å; L365-K367 PolarHBondContact O-N 3.26Å; L365-G369 CarbonylContact O-C 3.44Å; L365-G369 WeakPolarHBondContact O-CA 3.31Å; L365-G369 PolarHBondContact O-N 3.42Å; L365-V370 PolarHBondContact O-N 3.42Å; L365-I375 HydrophobicContact CD2-CD1 4.27Å; L365-P408 WeakPolarHBondContact CD2-O 3.12Å; L365-A411 HydrophobicContact CD2-CB 3.72Å; L365-A411 HydrophobicContact CG-CB 4.15Å; L365-A412 HydrophobicContact CD2-CB 4.38Å; L365-L415 HydrophobicContact CD1-CB 4.27Å; L365-L415 HydrophobicContact CD1-CD2 3.84Å; L365-F472 HydrophobicContact CB-CD2 4.44Å; L365-F472 HydrophobicContact CB-CE2 3.52Å; L365-F472 HydrophobicContact CB-CZ 3.65Å; L365-F472 HydrophobicContact CD1-CE1 4.3Å; L365-F472 HydrophobicContact CD1-CZ 3.96Å; L365-F472 HydrophobicContact CG-CZ 4.34Å
366	E	94.9	Very high	93.1	Very high	66 Å²	66	37.5 Å²	37.5	31%	0.308	19%	0.186	S	C	.	.	I	π-helix	trans	-65.4	-31.2	172.8	-74.7	-173.1	-169.3	0	0	113.4	L362 F364 V370 F472 K475	L362-E366 WeakPolarHBondContact O-CB 3.33Å; L362-E366 WeakPolarHBondContact O-CG 3.44Å; L362-E366 PolarHBondContact O-N 2.87Å; F364-E366 VanDerWaalsContact C-N 3.31Å; F364-E366 PolarHBondContact O-N 3.15Å; E366-V370 VanDerWaalsContact O-CG2 3.28Å; E366-V370 WeakPolarHBondContact O-CG2 3.44Å; E366-F472 HydrophobicContact CG-CD2 3.78Å; E366-F472 HydrophobicContact CG-CE2 4.33Å; E366-K475 HydrophobicContact CG-CD 4.13Å; E366-K475 WeakPolarHBondContact OE1-CD 3.4Å; E366-K475 IonicContact OE1-NZ 2.76Å; E366-K475 PolarHBondContact OE1-NZ 2.78Å; E366-K475 IonicContact OE2-NZ 3.46Å; E366-K475 PolarHBondContact OE2-NZ 3Å
367	K	92.5	Very high	93.1	Very high	161 Å²	161	41.1 Å²	41.1	70%	0.7	20%	0.198	S	C	*	.	I	π-helix	trans	-86	-39.5	-179.3	-72.2	166.3	-175.7	158.8	0	113.6	S363 F364 L365	S363-K367 WeakPolarHBondContact O-CD 3.48Å; S363-K367 VanDerWaalsContact O-CG 3.28Å; S363-K367 WeakPolarHBondContact O-CG 3.43Å; S363-K367 PolarHBondContact O-N 3.25Å; S363-K367 PolarHBondContact OG-NZ 3.1Å; S363-K367 VanDerWaalsContact OG-NZ 3.16Å; F364-K367 PolarHBondContact O-N 2.92Å; F364-K367 VanDerWaalsContact O-N 3.1Å; L365-K367 VanDerWaalsContact C-N 3.31Å; L365-K367 PolarHBondContact O-N 3.26Å
368	K	90.8	Very high	92.9	Very high	87 Å²	87	43.7 Å²	43.7	38%	0.378	21%	0.214	S	C	.	.	I	π-helix	trans	-116.8	-22.8	-174.4	-59.9	-163.7	-171.3	179.8	0	114.7	F364 S372 D404 P408	F364-K368 HydrophobicContact CE2-CB 4.49Å; F364-K368 HydrophobicContact CE2-CD 3.67Å; F364-K368 HydrophobicContact CE2-CG 4.23Å; F364-K368 HydrophobicContact CZ-CB 4.38Å; F364-K368 HydrophobicContact CZ-CD 4.04Å; F364-K368 PolarHBondContact O-N 2.85Å; K368-S372 PolarHBondContact O-OG 2.79Å; K368-S372 VanDerWaalsContact O-OG 3.14Å; K368-D404 IonicContact NZ-OD1 2.82Å; K368-D404 PolarHBondContact NZ-OD1 3.31Å; K368-P408 HydrophobicContact CB-CG 4.33Å
369	G	89.6	Confident	92.5	Very high	0 Å²	0	48.3 Å²	48.3	0%	0	24%	0.244	C	C	.	.	I	π-helix	trans	-96	-35.3	-170.8	0	0	0	0	0	115.9	L365 D371 S372	L365-G369 CarbonylContact O-C 3.44Å; L365-G369 WeakPolarHBondContact O-CA 3.31Å; L365-G369 PolarHBondContact O-N 3.42Å; G369-D371 PolarHBondContact O-N 3.43Å; G369-D371 VanDerWaalsContact O-N 3.13Å; G369-S372 VanDerWaalsContact O-CB 3.28Å; G369-S372 WeakPolarHBondContact O-CB 3.27Å; G369-S372 PolarHBondContact O-N 3.14Å
370	V	93	Very high	92.1	Very high	18 Å²	18	44.2 Å²	44.2	11%	0.109	23%	0.228	C	C	.	.	T	Hydrogen-bonded Turn	trans	-61	-27	-171.2	-68.5	0	0	0	0	115.2	L365 E366 F472 V476 R479 N483	L365-V370 PolarHBondContact O-N 3.42Å; E366-V370 VanDerWaalsContact O-CG2 3.28Å; E366-V370 WeakPolarHBondContact O-CG2 3.44Å; V370-F472 HydrophobicContact CG1-CE2 4.03Å; V370-V476 HydrophobicContact CG1-CG2 4.12Å; V370-R479 HydrophobicContact CB-CG 4.36Å; V370-R479 WeakPolarHBondContact O-CB 3.43Å; V370-N483 WeakPolarHBondContact O-CB 3.2Å; V370-N483 PolarHBondContact O-ND2 2.92Å
371	D	92.2	Very high	91.9	Very high	70 Å²	70	44.6 Å²	44.6	37%	0.374	23%	0.232	S	C	.	.	T	Hydrogen-bonded Turn	trans	-95.7	-4.4	176.5	-81	0.1	0	0	0	112.9	G369 R479 K482	G369-D371 PolarHBondContact O-N 3.43Å; G369-D371 VanDerWaalsContact O-N 3.13Å; D371-R479 WeakPolarHBondContact OD1-CD 3.45Å; D371-R479 IonicContact OD1-NE 3.45Å; D371-K482 HydrophobicContact CB-CD 4.12Å; D371-K482 VanDerWaalsContact OD1-CD 3.32Å; D371-K482 WeakPolarHBondContact OD1-CD 3.38Å; D371-K482 IonicContact OD1-NZ 3.19Å; D371-K482 WeakPolarHBondContact OD2-CD 3.44Å; D371-K482 IonicContact OD2-NZ 3.88Å; D371-K482 PolarHBondContact OD2-NZ 3.22Å
372	S	92.6	Very high	91.6	Very high	34 Å²	34	49.4 Å²	49.4	24%	0.238	26%	0.255	C	S	.	.	S	Bend	trans	-73.9	129.9	-179.5	-66.1	0	0	0	0	111.5	K368 G369 G374 I375 N483	K368-S372 PolarHBondContact O-OG 2.79Å; K368-S372 VanDerWaalsContact O-OG 3.14Å; G369-S372 VanDerWaalsContact O-CB 3.28Å; G369-S372 WeakPolarHBondContact O-CB 3.27Å; G369-S372 PolarHBondContact O-N 3.14Å; S372-G374 PolarHBondContact O-N 3.41Å; S372-I375 PolarHBondContact O-N 2.93Å; S372-N483 WeakPolarHBondContact O-CB 3.3Å
373	E	92.3	Very high	91.3	Very high	132 Å²	132	53.3 Å²	53.3	62%	0.617	28%	0.283	S	S	*	.	T	Hydrogen-bonded Turn	trans	-62.7	129.4	179.3	-174.2	166.5	-173.8	0	0	112.3	I375 N483 R484	E373-I375 VanDerWaalsContact C-N 3.29Å; E373-I375 PolarHBondContact O-N 3.5Å; E373-N483 WeakPolarHBondContact CA-O 3.21Å; E373-R484 HydrophobicContact CG-CB 4.43Å; E373-R484 HydrophobicContact CG-CG 3.99Å; E373-R484 WeakPolarHBondContact OE1-CG 3.34Å
374	G	88.7	Confident	91.2	Very high	0 Å²	0	57 Å²	57	0%	0	29%	0.292	C	S	.	.	T	Hydrogen-bonded Turn	trans	69.2	20.4	179.7	0	0	0	0	0	114.8	S372 R377 V378 N483	S372-G374 PolarHBondContact O-N 3.41Å; G374-R377 WeakPolarHBondContact O-CA 3.47Å; G374-R377 WeakPolarHBondContact O-CB 3.27Å; G374-R377 PolarHBondContact O-N 2.91Å; G374-V378 PolarHBondContact O-N 3.36Å; G374-N483 PolarHBondContact N-O 3.29Å
375	I	93.1	Very high	91	Very high	0 Å²	0	56.5 Å²	56.5	0%	0	29%	0.289	C	S	.	.	T	Hydrogen-bonded Turn	trans	-51	142.1	175.2	-168.6	62.8	0	0	0	111.3	L365 S372 E373 R377 P408 A412 V476 N483 M485	L365-I375 HydrophobicContact CD2-CD1 4.27Å; S372-I375 PolarHBondContact O-N 2.93Å; E373-I375 VanDerWaalsContact C-N 3.29Å; E373-I375 PolarHBondContact O-N 3.5Å; I375-R377 PolarHBondContact O-N 2.96Å; I375-P408 HydrophobicContact CD1-CB 3.88Å; I375-A412 HydrophobicContact CD1-CB 3.9Å; I375-V476 HydrophobicContact CG2-CG1 3.75Å; I375-N483 HydrophobicContact CG2-CB 4.23Å; I375-M485 HydrophobicContact CG2-CG 4.13Å; I375-M485 WeakPolarHBondContact O-CG 3.39Å
376	L	92.3	Very high	90.8	Very high	0 Å²	0	62.8 Å²	62.8	0%	0	32%	0.316	C	S	.	.	T	Hydrogen-bonded Turn	trans	67.7	-34	-168	-53.5	161.3	0	0	0	115.4	A412 L415 K416 F472 L473 V490 I493 M494	L376-A412 HydrophobicContact CD2-CB 4.06Å; L376-L415 HydrophobicContact CD2-CD2 4.46Å; L376-K416 PolarHBondContact O-NZ 2.93Å; L376-F472 HydrophobicContact CD2-CE1 4.47Å; L376-L473 HydrophobicContact CD1-CD2 3.56Å; L376-V490 HydrophobicContact CD1-CG1 4.15Å; L376-I493 HydrophobicContact CB-CG2 4.27Å; L376-M494 HydrophobicContact CD1-SD 4.49Å; L376-M494 HydrophobicContact CD2-SD 4.08Å
377	R	92.1	Very high	90.7	Very high	93 Å²	93	65.1 Å²	65.1	35%	0.351	33%	0.33	S	S	.	.	T	Hydrogen-bonded Turn	trans	-77.9	-49.2	179.9	-172.6	179.3	66.7	-170.8	-0.9	112.8	G374 I375 P379 M485 I493	G374-R377 WeakPolarHBondContact O-CA 3.47Å; G374-R377 WeakPolarHBondContact O-CB 3.27Å; G374-R377 PolarHBondContact O-N 2.91Å; I375-R377 PolarHBondContact O-N 2.96Å; R377-P379 WeakPolarHBondContact O-CD 3.33Å; R377-M485 HydrophobicContact CB-CE 3.86Å; R377-M485 HydrophobicContact CB-SD 3.87Å; R377-I493 HydrophobicContact CB-CD1 3.56Å; R377-I493 HydrophobicContact CG-CD1 3.95Å
378	V	89.3	Confident	90.7	Very high	57 Å²	57	58.6 Å²	58.6	35%	0.345	30%	0.303	S	S	.	.	S	Bend	trans	-70.7	121.7	-177.8	178	0	0	0	0	109.2	G374 N409	G374-V378 PolarHBondContact O-N 3.36Å; V378-N409 WeakPolarHBondContact CG1-ND2 3.23Å
379	P	85.8	Confident	90.8	Very high	98 Å²	98	55.5 Å²	55.5	64%	0.636	29%	0.29	S	S	*	.	P	Polyproline II helix	trans	-68	140.3	179	27.6	-33.9	0	0	0	111.2	R377	R377-P379 WeakPolarHBondContact O-CD 3.33Å
380	G	85	Confident	90.8	Very high	10 Å²	10	61.6 Å²	61.6	10%	0.103	32%	0.318	C	S	.	.	P	Polyproline II helix	trans	-77.6	170	167.7	0	0	0	0	0	112	Q382	G380-Q382 PolarHBondContact O-N 2.79Å
381	S	90.2	Very high	90.8	Very high	52 Å²	52	63.8 Å²	63.8	36%	0.364	33%	0.33	S	S	.	.	P	Polyproline II helix	trans	-75.4	118.1	178.7	169.4	0	0	0	0	110.2	S383 R384 I385 D410	S381-S383 VanDerWaalsContact C-N 3.29Å; S381-S383 PolarHBondContact O-N 3.07Å; S381-S383 PolarHBondContact OG-OG 3.06Å; S381-R384 PolarHBondContact O-N 2.89Å; S381-I385 VanDerWaalsContact O-CG1 3.29Å; S381-I385 WeakPolarHBondContact O-CG1 3.49Å; S381-I385 PolarHBondContact O-N 3.39Å; S381-D410 PolarHBondContact N-OD1 3.47Å
382	Q	88	Confident	90.8	Very high	101 Å²	101	60.4 Å²	60.4	47%	0.472	31%	0.312	S	S	.	.	H	α-helix	trans	-59.4	-35.7	-174.4	-67.5	-66	-13.3	0	0	113.4	G380 K386	G380-Q382 PolarHBondContact O-N 2.79Å; Q382-K386 WeakPolarHBondContact O-CG 3.28Å; Q382-K386 PolarHBondContact O-N 2.66Å; Q382-K386 VanDerWaalsContact O-N 3.1Å
383	S	90.1	Very high	90.7	Very high	90 Å²	90	61.1 Å²	61.1	63%	0.629	31%	0.311	S	S	*	.	H	α-helix	trans	-67.4	-43.3	174.9	52.8	0	0	0	0	111.7	S381 K386 L387	S381-S383 VanDerWaalsContact C-N 3.29Å; S381-S383 PolarHBondContact O-N 3.07Å; S381-S383 PolarHBondContact OG-OG 3.06Å; S383-K386 PolarHBondContact O-N 3.14Å; S383-L387 PolarHBondContact O-N 3.21Å; S383-L387 VanDerWaalsContact O-N 3.09Å
384	R	92.3	Very high	90.6	Very high	113 Å²	113	57.2 Å²	57.2	43%	0.426	30%	0.301	S	S	.	.	H	α-helix	trans	-66.6	-40.8	176.7	-172.9	170.1	57.9	177.8	4.2	112	S381 K386 L387 L388 S407 D410	S381-R384 PolarHBondContact O-N 2.89Å; R384-K386 PolarHBondContact O-N 3.13Å; R384-L387 PolarHBondContact O-N 3.34Å; R384-L388 HydrophobicContact CG-CD1 4.03Å; R384-L388 HydrophobicContact CG-CG 4.34Å; R384-L388 WeakPolarHBondContact O-CB 3.1Å; R384-L388 VanDerWaalsContact O-CG 3.22Å; R384-L388 WeakPolarHBondContact O-CG 3.46Å; R384-L388 PolarHBondContact O-N 3.07Å; R384-S407 PolarHBondContact NH2-OG 3.27Å; R384-D410 IonicContact CZ-OD1 3.57Å; R384-D410 VanDerWaalsContact CZ-OD1 3.27Å; R384-D410 IonicContact CZ-OD2 2.7Å; R384-D410 IonicContact NE-OD1 3.16Å; R384-D410 PolarHBondContact NE-OD1 3.28Å; R384-D410 IonicContact NE-OD2 2.72Å; R384-D410 PolarHBondContact NE-OD2 2.99Å; R384-D410 IonicContact NH1-OD2 3.23Å; R384-D410 IonicContact NH2-OD1 3.5Å; R384-D410 PolarHBondContact NH2-OD1 3.14Å; R384-D410 IonicContact NH2-OD2 3.31Å; R384-D410 PolarHBondContact NH2-OD2 3.23Å
385	I	92.1	Very high	90.6	Very high	4 Å²	4	59 Å²	59	2%	0.021	31%	0.311	C	S	.	.	H	α-helix	trans	-60.4	-43.8	175.1	-67.9	159	0	0	0	110.8	S381 L388 Q389 D410 A413 L414	S381-I385 VanDerWaalsContact O-CG1 3.29Å; S381-I385 WeakPolarHBondContact O-CG1 3.49Å; S381-I385 PolarHBondContact O-N 3.39Å; I385-L388 PolarHBondContact O-N 3.39Å; I385-Q389 PolarHBondContact O-N 2.81Å; I385-D410 HydrophobicContact CG1-CB 3.99Å; I385-A413 HydrophobicContact CD1-CB 3.44Å; I385-A413 VanDerWaalsContact CD1-CB 3.44Å; I385-A413 HydrophobicContact CG1-CB 4.11Å; I385-L414 HydrophobicContact CG2-CD2 3.91Å; I385-L414 HydrophobicContact CG2-CG 4.32Å
386	K	91	Very high	90.4	Very high	132 Å²	132	60.1 Å²	60.1	57%	0.574	32%	0.316	S	S	*	.	H	α-helix	trans	-61	-45.3	175.3	-74.7	175.5	179.6	-176.4	0	112.1	Q382 S383 R384 Q389 Q390	Q382-K386 WeakPolarHBondContact O-CG 3.28Å; Q382-K386 PolarHBondContact O-N 2.66Å; Q382-K386 VanDerWaalsContact O-N 3.1Å; S383-K386 PolarHBondContact O-N 3.14Å; R384-K386 PolarHBondContact O-N 3.13Å; K386-Q389 PolarHBondContact O-N 3.01Å; K386-Q390 WeakPolarHBondContact O-CG 3.29Å; K386-Q390 PolarHBondContact O-N 3.11Å; K386-Q390 VanDerWaalsContact O-N 3.15Å
387	L	92.1	Very high	90.2	Very high	115 Å²	115	63.6 Å²	63.6	60%	0.602	33%	0.33	S	S	*	.	H	α-helix	trans	-65.2	-41.7	177.3	-177	64.3	0	0	0	112.3	S383 R384 Q390 N391	S383-L387 PolarHBondContact O-N 3.21Å; S383-L387 VanDerWaalsContact O-N 3.09Å; R384-L387 PolarHBondContact O-N 3.34Å; L387-Q390 PolarHBondContact O-N 2.77Å; L387-N391 WeakPolarHBondContact O-CB 3.08Å; L387-N391 PolarHBondContact O-N 3.44Å
388	L	92.8	Very high	89.9	Confident	24 Å²	24	67.3 Å²	67.3	13%	0.126	34%	0.344	C	S	.	.	H	α-helix	trans	-63	-40.7	176.3	-73.2	171.1	0	0	0	111.8	R384 I385 N391 L392 F401 V406 D410 L414	R384-L388 HydrophobicContact CG-CD1 4.03Å; R384-L388 HydrophobicContact CG-CG 4.34Å; R384-L388 WeakPolarHBondContact O-CB 3.1Å; R384-L388 VanDerWaalsContact O-CG 3.22Å; R384-L388 WeakPolarHBondContact O-CG 3.46Å; R384-L388 PolarHBondContact O-N 3.07Å; I385-L388 PolarHBondContact O-N 3.39Å; L388-N391 PolarHBondContact O-N 3.04Å; L388-L392 WeakPolarHBondContact O-CB 3.35Å; L388-L392 VanDerWaalsContact O-CG 3.29Å; L388-L392 WeakPolarHBondContact O-CG 3.45Å; L388-L392 PolarHBondContact O-N 3.45Å; L388-F401 HydrophobicContact CD2-CE2 4.26Å; L388-F401 HydrophobicContact CD2-CZ 4.05Å; L388-V406 HydrophobicContact CD1-CG1 4.24Å; L388-V406 HydrophobicContact CD2-CG2 4.05Å; L388-D410 HydrophobicContact CD1-CB 3.65Å; L388-L414 HydrophobicContact CB-CD1 4.14Å; L388-L414 HydrophobicContact CD1-CD1 4.47Å
389	Q	91.8	Very high	89.5	Confident	23 Å²	23	70 Å²	70	11%	0.107	37%	0.365	C	S	.	.	H	α-helix	trans	-59.1	-52.1	173.8	171.7	172.5	4	0	0	111.7	F334 I385 K386 N391 L392 E393 L414	F334-Q389 HydrophobicContact CD2-CG 3.75Å; F334-Q389 HydrophobicContact CE2-CB 4.41Å; F334-Q389 HydrophobicContact CE2-CG 3.85Å; F334-Q389 HydrophobicContact CG-CG 4.34Å; F334-Q389 HydrophobicContact CZ-CG 4.49Å; I385-Q389 PolarHBondContact O-N 2.81Å; K386-Q389 PolarHBondContact O-N 3.01Å; Q389-N391 VanDerWaalsContact C-N 3.27Å; Q389-N391 PolarHBondContact O-N 3.19Å; Q389-L392 WeakPolarHBondContact O-CB 3.39Å; Q389-L392 PolarHBondContact O-N 3.24Å; Q389-L392 VanDerWaalsContact O-N 3.11Å; Q389-E393 HydrophobicContact CG-CG 4.31Å; Q389-E393 PolarHBondContact NE2-OE1 2.86Å; Q389-E393 WeakPolarHBondContact O-CG 3.23Å; Q389-E393 PolarHBondContact O-N 2.86Å; Q389-L414 HydrophobicContact CB-CD2 4.27Å
390	Q	91.3	Very high	89.3	Confident	127 Å²	127	74.6 Å²	74.6	59%	0.593	37%	0.37	S	S	*	.	H	α-helix	trans	-59	-40.1	-180	-71.1	174.7	-19.6	0	0	111.8	K386 L387 A394	K386-Q390 WeakPolarHBondContact O-CG 3.29Å; K386-Q390 PolarHBondContact O-N 3.11Å; K386-Q390 VanDerWaalsContact O-N 3.15Å; L387-Q390 PolarHBondContact O-N 2.77Å; Q390-A394 WeakPolarHBondContact O-CB 3.05Å; Q390-A394 PolarHBondContact O-N 3.09Å; Q390-A394 VanDerWaalsContact O-N 3.15Å
391	N	91.4	Very high	89.4	Confident	64 Å²	64	75.1 Å²	75.1	34%	0.342	37%	0.369	S	S	.	.	H	α-helix	trans	-65.7	-43.3	175.7	-169.2	-3.1	0	0	0	111.7	L387 L388 Q389 A394 N395 F401	L387-N391 WeakPolarHBondContact O-CB 3.08Å; L387-N391 PolarHBondContact O-N 3.44Å; L388-N391 PolarHBondContact O-N 3.04Å; Q389-N391 VanDerWaalsContact C-N 3.27Å; Q389-N391 PolarHBondContact O-N 3.19Å; N391-A394 PolarHBondContact O-N 3.03Å; N391-N395 VanDerWaalsContact O-CB 3.28Å; N391-N395 WeakPolarHBondContact O-CB 3.49Å; N391-N395 PolarHBondContact O-N 3.03Å; N391-N395 PolarHBondContact OD1-ND2 3.47Å; N391-F401 HydrophobicContact CB-CD2 4.31Å; N391-F401 HydrophobicContact CB-CE2 4.19Å
392	L	92.3	Very high	89.3	Confident	0 Å²	0	76.1 Å²	76.1	0%	0	37%	0.371	C	S	.	.	H	α-helix	trans	-60.1	-50.1	175	-77.6	163.7	0	0	0	111.8	L333 F357 L388 Q389 A394 N395 F396 F401 W403 L414	L333-L392 HydrophobicContact CD1-CB 3.96Å; F357-L392 HydrophobicContact CD2-CD2 4.43Å; F357-L392 HydrophobicContact CE2-CD1 3.78Å; F357-L392 HydrophobicContact CE2-CD2 3.96Å; F357-L392 HydrophobicContact CE2-CG 4.36Å; F357-L392 HydrophobicContact CZ-CD1 4.17Å; L388-L392 WeakPolarHBondContact O-CB 3.35Å; L388-L392 VanDerWaalsContact O-CG 3.29Å; L388-L392 WeakPolarHBondContact O-CG 3.45Å; L388-L392 PolarHBondContact O-N 3.45Å; Q389-L392 WeakPolarHBondContact O-CB 3.39Å; Q389-L392 PolarHBondContact O-N 3.24Å; Q389-L392 VanDerWaalsContact O-N 3.11Å; L392-A394 PolarHBondContact O-N 3.4Å; L392-N395 PolarHBondContact O-N 3.24Å; L392-F396 HydrophobicContact CD2-CD2 4.34Å; L392-F396 WeakPolarHBondContact O-CB 3.48Å; L392-F396 PolarHBondContact O-N 2.87Å; L392-F401 HydrophobicContact CD1-CE2 4.48Å; L392-F401 HydrophobicContact CD1-CZ 4.33Å; L392-F401 HydrophobicContact CD2-CB 4.48Å; L392-F401 HydrophobicContact CD2-CD1 3.7Å; L392-F401 HydrophobicContact CD2-CD2 3.71Å; L392-F401 HydrophobicContact CD2-CE1 3.72Å; L392-F401 HydrophobicContact CD2-CE2 3.74Å; L392-F401 HydrophobicContact CD2-CG 3.68Å; L392-F401 HydrophobicContact CD2-CZ 3.74Å; L392-F401 HydrophobicContact CG-CD2 3.89Å; L392-F401 HydrophobicContact CG-CE1 4.32Å; L392-F401 HydrophobicContact CG-CE2 3.59Å; L392-F401 HydrophobicContact CG-CG 4.38Å; L392-F401 HydrophobicContact CG-CZ 3.81Å; L392-W403 HydrophobicContact CD2-CH2 4.2Å; L392-W403 HydrophobicContact CD2-CZ2 3.97Å; L392-L414 HydrophobicContact CD1-CD1 3.9Å
393	E	91	Very high	89.3	Confident	48 Å²	48	73.3 Å²	73.3	22%	0.224	36%	0.356	C	S	.	.	H	α-helix	trans	-58.8	-35.6	180	-71.9	171	160.2	0	0	112.1	S331 T332 L333 F334 Q389	S331-E393 VanDerWaalsContact OG-CD 3.23Å; S331-E393 PolarHBondContact OG-OE1 2.69Å; T332-E393 WeakPolarHBondContact OG1-CA 3.3Å; T332-E393 PolarHBondContact OG1-O 2.96Å; L333-E393 HydrophobicContact CB-CG 4.24Å; L333-E393 HydrophobicContact CD1-CG 4.49Å; F334-E393 HydrophobicContact CD2-CG 4.12Å; Q389-E393 HydrophobicContact CG-CG 4.31Å; Q389-E393 PolarHBondContact NE2-OE1 2.86Å; Q389-E393 WeakPolarHBondContact O-CG 3.23Å; Q389-E393 PolarHBondContact O-N 2.86Å
394	A	89.2	Confident	89.1	Confident	50 Å²	50	74.5 Å²	74.5	41%	0.413	36%	0.355	S	S	.	.	H	α-helix	trans	-82.5	-30	178.5	0	0	0	0	0	115.1	Q390 N391 L392 R398	Q390-A394 WeakPolarHBondContact O-CB 3.05Å; Q390-A394 PolarHBondContact O-N 3.09Å; Q390-A394 VanDerWaalsContact O-N 3.15Å; N391-A394 PolarHBondContact O-N 3.03Å; L392-A394 PolarHBondContact O-N 3.4Å; A394-R398 PolarHBondContact O-NH1 3.43Å
395	N	90.3	Very high	88.8	Confident	38 Å²	38	76.9 Å²	76.9	20%	0.203	37%	0.371	C	S	.	.	H	α-helix	trans	-127	-9.5	-164.1	-67.9	-53.3	0	0	0	116.4	N391 L392 R398 S399 R400	N391-N395 VanDerWaalsContact O-CB 3.28Å; N391-N395 WeakPolarHBondContact O-CB 3.49Å; N391-N395 PolarHBondContact O-N 3.03Å; N391-N395 PolarHBondContact OD1-ND2 3.47Å; L392-N395 PolarHBondContact O-N 3.24Å; N395-R398 PolarHBondContact O-N 1.87Å; N395-S399 PolarHBondContact O-N 2.72Å; N395-R400 HydrophobicContact CB-CB 4.04Å; N395-R400 PolarHBondContact O-N 2.91Å
396	F	89.1	Confident	88.8	Confident	23 Å²	23	77 Å²	77	10%	0.101	37%	0.372	C	S	.	.	T	Hydrogen-bonded Turn	trans	-58.2	-59	-177	177.6	-100.4	0	0	0	112.3	L333 L356 F357 T360 L392 R398 S399	L333-F396 HydrophobicContact CD1-CB 3.83Å; L333-F396 HydrophobicContact CD1-CD1 4.49Å; L333-F396 HydrophobicContact CD1-CG 4.2Å; L333-F396 HydrophobicContact CD2-CD1 3.94Å; L333-F396 HydrophobicContact CD2-CG 4.45Å; L356-F396 HydrophobicContact CB-CE1 4.2Å; L356-F396 HydrophobicContact CB-CZ 4.11Å; F357-F396 HydrophobicContact CB-CD1 4.39Å; F357-F396 HydrophobicContact CB-CE1 3.97Å; F357-F396 HydrophobicContact CB-CE2 4.3Å; F357-F396 HydrophobicContact CB-CZ 3.95Å; F357-F396 HydrophobicContact CD2-CD2 4.1Å; F357-F396 HydrophobicContact CD2-CE2 4.16Å; F357-F396 VanDerWaalsContact N-CZ 3.34Å; T360-F396 HydrophobicContact CG2-CE2 4.42Å; L392-F396 HydrophobicContact CD2-CD2 4.34Å; L392-F396 WeakPolarHBondContact O-CB 3.48Å; L392-F396 PolarHBondContact O-N 2.87Å; F396-R398 PolarHBondContact O-N 3.43Å; F396-S399 PolarHBondContact O-N 3.38Å
397	Y	87.1	Confident	88.9	Confident	73 Å²	73	72.1 Å²	72.1	29%	0.286	35%	0.354	S	S	.	.	T	Hydrogen-bonded Turn	trans	-65.3	-19.8	178.9	-71.9	-65	0	0	0	113.9	L333 D345 I348 S399	L333-Y397 HydrophobicContact CD2-CD2 4.49Å; L333-Y397 HydrophobicContact CD2-CE2 3.7Å; D345-Y397 WeakPolarHBondContact OD1-CE1 3.3Å; D345-Y397 PolarHBondContact OD1-OH 3.02Å; I348-Y397 HydrophobicContact CD1-CD1 3.5Å; I348-Y397 HydrophobicContact CD1-CE1 3.78Å; Y397-S399 VanDerWaalsContact C-N 3.26Å; Y397-S399 PolarHBondContact O-N 3.16Å
398	R	86	Confident	89	Confident	171 Å²	171	68 Å²	68	65%	0.645	33%	0.334	S	S	*	.	T	Hydrogen-bonded Turn	trans	-82.3	-2.3	174.1	-63.8	177.3	175.7	158.2	-5.6	113	A394 N395 F396 R400	A394-R398 PolarHBondContact O-NH1 3.43Å; N395-R398 PolarHBondContact O-N 1.87Å; F396-R398 PolarHBondContact O-N 3.43Å; R398-R400 HydrophobicContact CB-CB 4.5Å; R398-R400 HydrophobicContact CB-CG 4.26Å; R398-R400 PolarHBondContact O-N 3.24Å
399	S	81.6	Confident	89	Confident	114 Å²	114	68.7 Å²	68.7	80%	0.797	34%	0.338	S	S	*	.	T	Hydrogen-bonded Turn	trans	54.7	29.9	-174.3	-57	0	0	0	0	113.8	N395 F396 Y397	N395-S399 PolarHBondContact O-N 2.72Å; F396-S399 PolarHBondContact O-N 3.38Å; Y397-S399 VanDerWaalsContact C-N 3.26Å; Y397-S399 PolarHBondContact O-N 3.16Å
400	R	81.8	Confident	89.1	Confident	195 Å²	195	67.7 Å²	67.7	74%	0.736	33%	0.333	S	S	*	.			trans	-103.4	5.3	-178	-73.3	-175.5	-179.1	-172.4	-1.2	114.1	N395 R398	N395-R400 HydrophobicContact CB-CB 4.04Å; N395-R400 PolarHBondContact O-N 2.91Å; R398-R400 HydrophobicContact CB-CB 4.5Å; R398-R400 HydrophobicContact CB-CG 4.26Å; R398-R400 PolarHBondContact O-N 3.24Å
401	F	87.1	Confident	89.3	Confident	20 Å²	20	61.6 Å²	61.6	9%	0.088	31%	0.305	C	S	.	.			trans	-90.8	121.3	-178.8	-175.7	-91.4	0	0	0	111.3	L388 N391 L392 W403 V406	L388-F401 HydrophobicContact CD2-CE2 4.26Å; L388-F401 HydrophobicContact CD2-CZ 4.05Å; N391-F401 HydrophobicContact CB-CD2 4.31Å; N391-F401 HydrophobicContact CB-CE2 4.19Å; L392-F401 HydrophobicContact CD1-CE2 4.48Å; L392-F401 HydrophobicContact CD1-CZ 4.33Å; L392-F401 HydrophobicContact CD2-CB 4.48Å; L392-F401 HydrophobicContact CD2-CD1 3.7Å; L392-F401 HydrophobicContact CD2-CD2 3.71Å; L392-F401 HydrophobicContact CD2-CE1 3.72Å; L392-F401 HydrophobicContact CD2-CE2 3.74Å; L392-F401 HydrophobicContact CD2-CG 3.68Å; L392-F401 HydrophobicContact CD2-CZ 3.74Å; L392-F401 HydrophobicContact CG-CD2 3.89Å; L392-F401 HydrophobicContact CG-CE1 4.32Å; L392-F401 HydrophobicContact CG-CE2 3.59Å; L392-F401 HydrophobicContact CG-CG 4.38Å; L392-F401 HydrophobicContact CG-CZ 3.81Å; F401-W403 AromaticContact CD1-CD1 3.84Å; F401-W403 AromaticContact CD1-CD2 3.91Å; F401-W403 HydrophobicContact CD1-CD2 3.91Å; F401-W403 AromaticContact CD1-CE2 3.66Å; F401-W403 HydrophobicContact CD1-CG 4.03Å; F401-W403 HydrophobicContact CD1-CZ2 4.15Å; F401-W403 AromaticContact CD1-NE1 3.61Å; F401-W403 AromaticContact CE1-CD2 3.63Å; F401-W403 HydrophobicContact CE1-CD2 3.63Å; F401-W403 AromaticContact CE1-CE2 3.72Å; F401-W403 AromaticContact CE1-CE3 3.88Å; F401-W403 HydrophobicContact CE1-CE3 3.88Å; F401-W403 HydrophobicContact CE1-CG 4.03Å; F401-W403 HydrophobicContact CE1-CH2 4.29Å; F401-W403 HydrophobicContact CE1-CZ2 4.07Å; F401-W403 HydrophobicContact CE1-CZ3 4.19Å; F401-V406 HydrophobicContact CE1-CG2 3.74Å; F401-V406 HydrophobicContact CZ-CG2 3.64Å
402	N	86.1	Confident	89.5	Confident	74 Å²	74	58.6 Å²	58.6	40%	0.396	29%	0.289	S	S	.	.			trans	-86.3	112.8	176.6	-171.9	10.5	0	0	0	111.3	D404 E405	N402-D404 VanDerWaalsContact C-N 3.32Å; N402-D404 WeakPolarHBondContact OD1-CB 3.41Å; N402-D404 PolarHBondContact OD1-N 3.04Å; N402-E405 PolarHBondContact ND2-OE1 3.23Å
403	W	88.5	Confident	89.6	Confident	41 Å²	41	59.5 Å²	59.5	16%	0.155	30%	0.296	C	S	.	.	S	Bend	trans	-76.7	-15.9	175	-71.8	93.8	0	0	0	113.5	F357 T360 L361 F364 L392 F401 E405 V406	F357-W403 HydrophobicContact CE2-CH2 4.29Å; T360-W403 HydrophobicContact CG2-CZ2 3.82Å; L361-W403 HydrophobicContact CB-CH2 4.13Å; L361-W403 HydrophobicContact CD1-CH2 3.75Å; L361-W403 HydrophobicContact CD1-CZ3 3.64Å; F364-W403 HydrophobicContact CB-CD2 4.43Å; F364-W403 HydrophobicContact CB-CE3 3.97Å; F364-W403 HydrophobicContact CB-CZ3 4.4Å; F364-W403 HydrophobicContact CD1-CE3 4.02Å; F364-W403 HydrophobicContact CD1-CZ3 4.34Å; F364-W403 HydrophobicContact CD2-CB 3.85Å; F364-W403 HydrophobicContact CD2-CD2 4.43Å; F364-W403 AromaticContact CD2-CE3 3.99Å; F364-W403 HydrophobicContact CD2-CE3 3.99Å; F364-W403 HydrophobicContact CD2-CG 4.42Å; F364-W403 HydrophobicContact CE2-CB 4.16Å; F364-W403 WeakPolarHBondContact CE2-O 3.17Å; F364-W403 HydrophobicContact CG-CD2 4.41Å; F364-W403 AromaticContact CG-CE3 3.7Å; F364-W403 HydrophobicContact CG-CE3 3.7Å; F364-W403 HydrophobicContact CG-CZ3 4.33Å; L392-W403 HydrophobicContact CD2-CH2 4.2Å; L392-W403 HydrophobicContact CD2-CZ2 3.97Å; F401-W403 AromaticContact CD1-CD1 3.84Å; F401-W403 AromaticContact CD1-CD2 3.91Å; F401-W403 HydrophobicContact CD1-CD2 3.91Å; F401-W403 AromaticContact CD1-CE2 3.66Å; F401-W403 HydrophobicContact CD1-CG 4.03Å; F401-W403 HydrophobicContact CD1-CZ2 4.15Å; F401-W403 AromaticContact CD1-NE1 3.61Å; F401-W403 AromaticContact CE1-CD2 3.63Å; F401-W403 HydrophobicContact CE1-CD2 3.63Å; F401-W403 AromaticContact CE1-CE2 3.72Å; F401-W403 AromaticContact CE1-CE3 3.88Å; F401-W403 HydrophobicContact CE1-CE3 3.88Å; F401-W403 HydrophobicContact CE1-CG 4.03Å; F401-W403 HydrophobicContact CE1-CH2 4.29Å; F401-W403 HydrophobicContact CE1-CZ2 4.07Å; F401-W403 HydrophobicContact CE1-CZ3 4.19Å; W403-E405 VanDerWaalsContact C-N 3.31Å; W403-E405 PolarHBondContact O-N 3.38Å; W403-V406 HydrophobicContact CE3-CG2 4.32Å; W403-V406 PolarHBondContact O-N 2.7Å
404	D	86.4	Confident	89.8	Confident	115 Å²	115	57.2 Å²	57.2	62%	0.615	29%	0.286	S	S	*	.	T	Hydrogen-bonded Turn	trans	-71.7	-24.7	-174	-75.9	-45.6	0	0	0	114.2	K368 N402	K368-D404 IonicContact NZ-OD1 2.82Å; K368-D404 PolarHBondContact NZ-OD1 3.31Å; N402-D404 VanDerWaalsContact C-N 3.32Å; N402-D404 WeakPolarHBondContact OD1-CB 3.41Å; N402-D404 PolarHBondContact OD1-N 3.04Å
405	E	86.3	Confident	90.1	Very high	163 Å²	163	54.9 Å²	54.9	76%	0.762	27%	0.266	S	S	*	.	T	Hydrogen-bonded Turn	trans	-85.8	-10	177.2	-67.6	163.5	-134.6	0	0	113.5	N402 W403	N402-E405 PolarHBondContact ND2-OE1 3.23Å; W403-E405 VanDerWaalsContact C-N 3.31Å; W403-E405 PolarHBondContact O-N 3.38Å
406	V	91.8	Very high	90.3	Very high	8 Å²	8	53.7 Å²	53.7	5%	0.048	26%	0.259	C	S	.	.			trans	-79.8	132	-176.9	-176.4	0	0	0	0	110.1	F364 L388 F401 W403 A411	F364-V406 HydrophobicContact CE1-CB 4.43Å; F364-V406 HydrophobicContact CE1-CG1 4.27Å; F364-V406 HydrophobicContact CZ-CB 4.09Å; F364-V406 HydrophobicContact CZ-CG1 4.41Å; F364-V406 WeakPolarHBondContact CZ-O 3.33Å; L388-V406 HydrophobicContact CD1-CG1 4.24Å; L388-V406 HydrophobicContact CD2-CG2 4.05Å; F401-V406 HydrophobicContact CE1-CG2 3.74Å; F401-V406 HydrophobicContact CZ-CG2 3.64Å; W403-V406 HydrophobicContact CE3-CG2 4.32Å; W403-V406 PolarHBondContact O-N 2.7Å; V406-A411 HydrophobicContact CG1-CB 4.03Å
407	S	92.8	Very high	90.4	Very high	28 Å²	28	54.3 Å²	54.3	20%	0.196	26%	0.262	C	S	.	.			trans	-79.6	144.6	172.6	88.9	0	0	0	0	111	R384 N409 D410 A411	R384-S407 PolarHBondContact NH2-OG 3.27Å; S407-N409 PolarHBondContact O-N 2.72Å; S407-N409 VanDerWaalsContact O-N 3.13Å; S407-D410 VanDerWaalsContact CB-OD2 3.31Å; S407-D410 WeakPolarHBondContact CB-OD2 3.27Å; S407-D410 PolarHBondContact O-N 3.47Å; S407-D410 VanDerWaalsContact O-N 3.12Å; S407-D410 PolarHBondContact OG-N 3.49Å; S407-D410 PolarHBondContact OG-OD2 3.48Å; S407-A411 PolarHBondContact O-N 2.95Å; S407-A411 VanDerWaalsContact O-N 3.1Å
408	P	93.8	Very high	90.7	Very high	28 Å²	28	51 Å²	51	18%	0.182	25%	0.249	C	C	.	.	H	α-helix	trans	-54.9	-32	177.7	-28.6	36.2	0	0	0	114.1	L365 K368 I375 A411 A412	L365-P408 WeakPolarHBondContact CD2-O 3.12Å; K368-P408 HydrophobicContact CB-CG 4.33Å; I375-P408 HydrophobicContact CD1-CB 3.88Å; P408-A411 PolarHBondContact O-N 2.87Å; P408-A412 VanDerWaalsContact O-CB 3.27Å; P408-A412 WeakPolarHBondContact O-CB 3.43Å; P408-A412 PolarHBondContact O-N 3.36Å
409	N	93.4	Very high	91	Very high	40 Å²	40	43.1 Å²	43.1	21%	0.214	22%	0.22	C	C	.	.	H	α-helix	trans	-73.4	-35.3	-179.8	-64.5	-13.2	0	0	0	112.4	V378 S407 A413	V378-N409 WeakPolarHBondContact CG1-ND2 3.23Å; S407-N409 PolarHBondContact O-N 2.72Å; S407-N409 VanDerWaalsContact O-N 3.13Å; N409-A413 WeakPolarHBondContact O-CB 3.38Å; N409-A413 PolarHBondContact O-N 3.15Å
410	D	94.3	Very high	91.4	Very high	1 Å²	1	38.9 Å²	38.9	1%	0.005	19%	0.186	C	C	.	.	H	α-helix	trans	-71.5	-39.5	172.9	-44.2	-61	0	0	0	110.8	S381 R384 I385 L388 S407 A412 A413 L414	S381-D410 PolarHBondContact N-OD1 3.47Å; R384-D410 IonicContact CZ-OD1 3.57Å; R384-D410 VanDerWaalsContact CZ-OD1 3.27Å; R384-D410 IonicContact CZ-OD2 2.7Å; R384-D410 IonicContact NE-OD1 3.16Å; R384-D410 PolarHBondContact NE-OD1 3.28Å; R384-D410 IonicContact NE-OD2 2.72Å; R384-D410 PolarHBondContact NE-OD2 2.99Å; R384-D410 IonicContact NH1-OD2 3.23Å; R384-D410 IonicContact NH2-OD1 3.5Å; R384-D410 PolarHBondContact NH2-OD1 3.14Å; R384-D410 IonicContact NH2-OD2 3.31Å; R384-D410 PolarHBondContact NH2-OD2 3.23Å; I385-D410 HydrophobicContact CG1-CB 3.99Å; L388-D410 HydrophobicContact CD1-CB 3.65Å; S407-D410 VanDerWaalsContact CB-OD2 3.31Å; S407-D410 WeakPolarHBondContact CB-OD2 3.27Å; S407-D410 PolarHBondContact O-N 3.47Å; S407-D410 VanDerWaalsContact O-N 3.12Å; S407-D410 PolarHBondContact OG-N 3.49Å; S407-D410 PolarHBondContact OG-OD2 3.48Å; D410-A412 VanDerWaalsContact C-N 3.33Å; D410-A412 PolarHBondContact O-N 3.47Å; D410-A413 PolarHBondContact O-N 2.91Å; D410-L414 WeakPolarHBondContact O-CG 3.48Å; D410-L414 PolarHBondContact O-N 2.85Å
411	A	95.1	Very high	91.7	Very high	0 Å²	0	32.3 Å²	32.3	0%	0	16%	0.164	C	C	.	.	H	α-helix	trans	-61.8	-40.7	174.4	0	0	0	0	0	111.9	L361 F364 L365 V406 S407 P408 A413 L414 L415	L361-A411 HydrophobicContact CD1-CB 3.83Å; F364-A411 HydrophobicContact CD1-CB 3.72Å; F364-A411 HydrophobicContact CE1-CB 3.6Å; L365-A411 HydrophobicContact CD2-CB 3.72Å; L365-A411 HydrophobicContact CG-CB 4.15Å; V406-A411 HydrophobicContact CG1-CB 4.03Å; S407-A411 PolarHBondContact O-N 2.95Å; S407-A411 VanDerWaalsContact O-N 3.1Å; P408-A411 PolarHBondContact O-N 2.87Å; A411-A413 VanDerWaalsContact C-N 3.35Å; A411-L414 PolarHBondContact O-N 3.42Å; A411-L415 PolarHBondContact O-N 3.09Å
412	A	95.2	Very high	91.7	Very high	1 Å²	1	31.6 Å²	31.6	1%	0.008	16%	0.161	C	C	.	.	H	α-helix	trans	-63.4	-38.4	172.9	0	0	0	0	0	112.3	L365 I375 L376 P408 D410 L415 K416	L365-A412 HydrophobicContact CD2-CB 4.38Å; I375-A412 HydrophobicContact CD1-CB 3.9Å; L376-A412 HydrophobicContact CD2-CB 4.06Å; P408-A412 VanDerWaalsContact O-CB 3.27Å; P408-A412 WeakPolarHBondContact O-CB 3.43Å; P408-A412 PolarHBondContact O-N 3.36Å; D410-A412 VanDerWaalsContact C-N 3.33Å; D410-A412 PolarHBondContact O-N 3.47Å; A412-L415 PolarHBondContact O-N 3.06Å; A412-K416 WeakPolarHBondContact O-CG 3.44Å; A412-K416 PolarHBondContact O-N 2.89Å; A412-K416 VanDerWaalsContact O-N 3.16Å
413	A	94.1	Very high	91.8	Very high	18 Å²	18	30.1 Å²	30.1	15%	0.149	16%	0.156	C	C	.	.	H	α-helix	trans	-68.2	-39.9	174.1	0	0	0	0	0	112.4	I385 N409 D410 A411 L415 K416 K417	I385-A413 HydrophobicContact CD1-CB 3.44Å; I385-A413 VanDerWaalsContact CD1-CB 3.44Å; I385-A413 HydrophobicContact CG1-CB 4.11Å; N409-A413 WeakPolarHBondContact O-CB 3.38Å; N409-A413 PolarHBondContact O-N 3.15Å; D410-A413 PolarHBondContact O-N 2.91Å; A411-A413 VanDerWaalsContact C-N 3.35Å; A413-L415 VanDerWaalsContact C-N 3.32Å; A413-L415 PolarHBondContact O-N 3.23Å; A413-K416 PolarHBondContact O-N 3.2Å; A413-K417 VanDerWaalsContact O-CB 3.24Å; A413-K417 WeakPolarHBondContact O-CB 3.29Å; A413-K417 PolarHBondContact O-N 2.89Å
414	L	94.9	Very high	91.6	Very high	1 Å²	1	30.7 Å²	30.7	1%	0.005	16%	0.161	C	C	.	.	H	α-helix	trans	-62.9	-36.7	173.4	-71.7	166.9	0	0	0	111.9	F334 L361 I385 L388 Q389 L392 D410 A411 K417 F418	F334-L414 HydrophobicContact CE1-CD2 4.4Å; F334-L414 HydrophobicContact CZ-CD2 3.89Å; L361-L414 HydrophobicContact CD2-CB 4.47Å; I385-L414 HydrophobicContact CG2-CD2 3.91Å; I385-L414 HydrophobicContact CG2-CG 4.32Å; L388-L414 HydrophobicContact CB-CD1 4.14Å; L388-L414 HydrophobicContact CD1-CD1 4.47Å; Q389-L414 HydrophobicContact CB-CD2 4.27Å; L392-L414 HydrophobicContact CD1-CD1 3.9Å; D410-L414 WeakPolarHBondContact O-CG 3.48Å; D410-L414 PolarHBondContact O-N 2.85Å; A411-L414 PolarHBondContact O-N 3.42Å; L414-K417 PolarHBondContact O-N 2.92Å; L414-F418 VanDerWaalsContact O-CB 3.31Å; L414-F418 WeakPolarHBondContact O-CB 3.49Å; L414-F418 PolarHBondContact O-N 2.76Å
415	L	95.8	Very high	91.8	Very high	0 Å²	0	25.3 Å²	25.3	0%	0	13%	0.133	C	C	.	.	H	α-helix	trans	-62.6	-51.1	174.9	176.2	63.4	0	0	0	111.5	L358 L361 L362 L365 L376 A411 A412 A413 K417 F418 I419 L469 F472	L358-L415 HydrophobicContact CD1-CD1 3.36Å; L361-L415 HydrophobicContact CD2-CB 3.86Å; L361-L415 HydrophobicContact CD2-CD1 4.23Å; L361-L415 HydrophobicContact CG-CB 4.48Å; L362-L415 HydrophobicContact CD2-CD1 3.88Å; L362-L415 HydrophobicContact CD2-CD2 3.91Å; L365-L415 HydrophobicContact CD1-CB 4.27Å; L365-L415 HydrophobicContact CD1-CD2 3.84Å; L376-L415 HydrophobicContact CD2-CD2 4.46Å; A411-L415 PolarHBondContact O-N 3.09Å; A412-L415 PolarHBondContact O-N 3.06Å; A413-L415 VanDerWaalsContact C-N 3.32Å; A413-L415 PolarHBondContact O-N 3.23Å; L415-K417 VanDerWaalsContact C-N 3.33Å; L415-K417 PolarHBondContact O-N 2.92Å; L415-F418 PolarHBondContact O-N 2.76Å; L415-I419 HydrophobicContact CD1-CD1 4.23Å; L415-I419 HydrophobicContact CG-CD1 4.36Å; L415-I419 WeakPolarHBondContact O-CD1 3.3Å; L415-I419 WeakPolarHBondContact O-CG1 3.3Å; L415-I419 PolarHBondContact O-N 2.77Å; L415-L469 HydrophobicContact CD1-CD1 4.28Å; L415-L469 HydrophobicContact CD2-CD1 4.23Å; L415-L469 HydrophobicContact CG-CD1 4.46Å; L415-F472 HydrophobicContact CD2-CD1 4Å; L415-F472 HydrophobicContact CD2-CE1 3.71Å
416	K	94.2	Very high	92.1	Very high	14 Å²	14	17.7 Å²	17.7	6%	0.061	10%	0.098	C	C	.	.	H	α-helix	trans	-58.3	-45.9	175.9	-70	-173.3	-59.7	179.4	0	111.1	E100 L376 A412 A413 R420 I493 M494 N497	E100-K416 WeakPolarHBondContact OE2-CE 3.43Å; E100-K416 IonicContact OE2-NZ 3.83Å; E100-K416 PolarHBondContact OE2-NZ 3.31Å; L376-K416 PolarHBondContact O-NZ 2.93Å; A412-K416 WeakPolarHBondContact O-CG 3.44Å; A412-K416 PolarHBondContact O-N 2.89Å; A412-K416 VanDerWaalsContact O-N 3.16Å; A413-K416 PolarHBondContact O-N 3.2Å; K416-R420 WeakPolarHBondContact O-CB 3.09Å; K416-R420 PolarHBondContact O-N 2.79Å; K416-I493 HydrophobicContact CD-CG2 4.03Å; K416-M494 HydrophobicContact CD-SD 4.16Å; K416-M494 HydrophobicContact CG-CE 4.37Å; K416-M494 HydrophobicContact CG-SD 3.85Å; K416-N497 PolarHBondContact O-OD1 3.28Å
417	K	91.8	Very high	92.1	Very high	35 Å²	35	17.3 Å²	17.3	15%	0.152	10%	0.095	C	C	.	.	H	α-helix	trans	-61.3	-46.4	178.2	-172.4	173.6	-174.2	179.4	0	112.8	F334 A413 L414 L415 I419 R420 E421	F334-K417 HydrophobicContact CD1-CG 4.5Å; F334-K417 HydrophobicContact CE1-CG 4.48Å; A413-K417 VanDerWaalsContact O-CB 3.24Å; A413-K417 WeakPolarHBondContact O-CB 3.29Å; A413-K417 PolarHBondContact O-N 2.89Å; L414-K417 PolarHBondContact O-N 2.92Å; L415-K417 VanDerWaalsContact C-N 3.33Å; L415-K417 PolarHBondContact O-N 2.92Å; K417-I419 PolarHBondContact O-N 3.2Å; K417-R420 PolarHBondContact O-N 2.82Å; K417-E421 WeakPolarHBondContact CE-OE1 3.32Å; K417-E421 WeakPolarHBondContact CE-OE2 3.45Å; K417-E421 HydrophobicContact CG-CG 4.19Å; K417-E421 IonicContact NZ-OE1 2.68Å; K417-E421 WeakPolarHBondContact O-CB 3.45Å; K417-E421 WeakPolarHBondContact O-CG 3.49Å; K417-E421 PolarHBondContact O-N 3.43Å
418	F	93.4	Very high	91.9	Very high	3 Å²	3	16.5 Å²	16.5	1%	0.013	9%	0.089	C	C	.	.	H	α-helix	trans	-56.9	-49.7	179.8	174.9	-101.1	0	0	0	112	F334 L341 F357 L358 L414 L415 R420 E421 L422	F334-F418 HydrophobicContact CD1-CB 4.3Å; F334-F418 HydrophobicContact CD1-CD2 4.38Å; F334-F418 HydrophobicContact CE1-CB 3.89Å; F334-F418 HydrophobicContact CE1-CD2 4.43Å; L341-F418 HydrophobicContact CD1-CE2 3.91Å; L341-F418 HydrophobicContact CD1-CZ 3.92Å; F357-F418 AromaticContact CD1-CD2 3.81Å; F357-F418 HydrophobicContact CD1-CD2 3.81Å; F357-F418 AromaticContact CD1-CE2 3.9Å; F357-F418 HydrophobicContact CD1-CE2 3.9Å; F357-F418 HydrophobicContact CD1-CG 4.36Å; F357-F418 HydrophobicContact CE1-CB 4.24Å; F357-F418 AromaticContact CE1-CD2 3.67Å; F357-F418 HydrophobicContact CE1-CD2 3.67Å; F357-F418 HydrophobicContact CE1-CE2 4.24Å; F357-F418 AromaticContact CE1-CG 3.99Å; F357-F418 HydrophobicContact CE1-CG 3.99Å; L358-F418 HydrophobicContact CB-CE1 4.23Å; L358-F418 HydrophobicContact CD1-CD1 4.18Å; L358-F418 HydrophobicContact CD1-CE1 4.38Å; L358-F418 HydrophobicContact CD2-CE1 4.29Å; L414-F418 VanDerWaalsContact O-CB 3.31Å; L414-F418 WeakPolarHBondContact O-CB 3.49Å; L414-F418 PolarHBondContact O-N 2.76Å; L415-F418 PolarHBondContact O-N 2.76Å; F418-R420 VanDerWaalsContact C-N 3.3Å; F418-R420 PolarHBondContact O-N 3.06Å; F418-E421 PolarHBondContact O-N 3.32Å; F418-L422 HydrophobicContact CE1-CD2 4.35Å; F418-L422 HydrophobicContact CE2-CD2 4.43Å; F418-L422 HydrophobicContact CZ-CD2 4.08Å; F418-L422 PolarHBondContact O-N 2.71Å
419	I	92.9	Very high	91.5	Very high	6 Å²	6	15.2 Å²	15.2	3%	0.031	8%	0.081	C	C	.	.	H	α-helix	trans	-60.6	-41.9	179.9	-61.8	158.5	0	0	0	111	L415 K417 L426 L469 M494 L498	L415-I419 HydrophobicContact CD1-CD1 4.23Å; L415-I419 HydrophobicContact CG-CD1 4.36Å; L415-I419 WeakPolarHBondContact O-CD1 3.3Å; L415-I419 WeakPolarHBondContact O-CG1 3.3Å; L415-I419 PolarHBondContact O-N 2.77Å; K417-I419 PolarHBondContact O-N 3.2Å; I419-L426 HydrophobicContact CG2-CB 4.33Å; I419-L426 HydrophobicContact CG2-CD2 4.32Å; I419-L469 HydrophobicContact CD1-CD1 3.8Å; I419-L469 HydrophobicContact CD1-CD2 3.54Å; I419-L469 HydrophobicContact CD1-CG 4.3Å; I419-L469 HydrophobicContact CG1-CD2 4.42Å; I419-M494 HydrophobicContact CD1-CE 3.98Å; I419-L498 HydrophobicContact CG2-CD1 4.44Å
420	R	88.7	Confident	91.1	Very high	25 Å²	25	15.6 Å²	15.6	9%	0.094	8%	0.081	C	C	.	.	H	α-helix	trans	-72.4	-30.3	-178.1	177.2	170.9	67.1	-140	16.9	114	E100 K416 K417 F418 N497 H501	E100-R420 IonicContact OE1-NH1 3.27Å; E100-R420 PolarHBondContact OE1-NH1 3.01Å; K416-R420 WeakPolarHBondContact O-CB 3.09Å; K416-R420 PolarHBondContact O-N 2.79Å; K417-R420 PolarHBondContact O-N 2.82Å; F418-R420 VanDerWaalsContact C-N 3.3Å; F418-R420 PolarHBondContact O-N 3.06Å; R420-N497 PolarHBondContact NH1-OD1 3.24Å; R420-H501 PolarHBondContact O-NE2 3.34Å
421	E	88.2	Confident	90.9	Very high	57 Å²	57	16.3 Å²	16.3	27%	0.266	8%	0.084	S	C	.	.	H	α-helix	trans	-90.5	-0.9	-178	-70.9	-175.7	167.2	0	0	113.7	G335 K417 F418	G335-E421 VanDerWaalsContact CA-O 3.28Å; G335-E421 WeakPolarHBondContact CA-O 3.38Å; K417-E421 WeakPolarHBondContact CE-OE1 3.32Å; K417-E421 WeakPolarHBondContact CE-OE2 3.45Å; K417-E421 HydrophobicContact CG-CG 4.19Å; K417-E421 IonicContact NZ-OE1 2.68Å; K417-E421 WeakPolarHBondContact O-CB 3.45Å; K417-E421 WeakPolarHBondContact O-CG 3.49Å; K417-E421 PolarHBondContact O-N 3.43Å; F418-E421 PolarHBondContact O-N 3.32Å
422	L	88.9	Confident	90.5	Very high	6 Å²	6	16.3 Å²	16.3	3%	0.031	8%	0.084	C	C	.	.			trans	-55.2	136.2	169.3	-65.3	175.8	0	0	0	110.8	F418 D424 L426 H501	F418-L422 HydrophobicContact CE1-CD2 4.35Å; F418-L422 HydrophobicContact CE2-CD2 4.43Å; F418-L422 HydrophobicContact CZ-CD2 4.08Å; F418-L422 PolarHBondContact O-N 2.71Å; L422-D424 VanDerWaalsContact CB-O 3.25Å; L422-D424 WeakPolarHBondContact CB-O 3.12Å; L422-D424 PolarHBondContact O-N 3.15Å; L422-L426 HydrophobicContact CD1-CB 4.19Å; L422-L426 HydrophobicContact CD1-CD1 4.5Å; L422-H501 PolarHBondContact O-CE1 3.39Å; L422-H501 VanDerWaalsContact O-CE1 3.24Å; L422-H501 PolarHBondContact O-NE2 3.17Å
423	P	86.2	Confident	90	Very high	43 Å²	43	16.8 Å²	16.8	28%	0.279	9%	0.087	S	C	.	.	S	Bend	trans	-60.6	-40.2	179.6	-29.6	38.2	0	0	0	114.6	G335 V336 P337 H501	G335-P423 WeakPolarHBondContact O-CG 3.45Å; V336-P423 WeakPolarHBondContact O-CD 3.45Å; P337-P423 HydrophobicContact CG-CG 4.2Å; P423-H501 PolarHBondContact O-CE1 2.88Å
424	D	85.9	Confident	89.8	Confident	52 Å²	52	16 Å²	16	28%	0.278	8%	0.08	S	C	.	.	S	Bend	trans	-107.5	134.3	167.2	174.4	57.1	0	0	0	107.7	T323 L422 A429	T323-D424 HydrophobicContact CG2-CB 4.3Å; T323-D424 VanDerWaalsContact CG2-OD1 3.22Å; T323-D424 WeakPolarHBondContact CG2-OD1 3.48Å; L422-D424 VanDerWaalsContact CB-O 3.25Å; L422-D424 WeakPolarHBondContact CB-O 3.12Å; L422-D424 PolarHBondContact O-N 3.15Å; D424-A429 PolarHBondContact OD1-N 2.89Å
425	P	89.8	Confident	89.6	Confident	3 Å²	3	16 Å²	16	2%	0.019	8%	0.08	C	C	.	.			trans	-57	152.4	179.4	18.7	-30.7	0	0	0	112.2	L427 T428 A429 L432 H501	P425-L427 PolarHBondContact O-N 3.16Å; P425-L427 VanDerWaalsContact O-N 3.1Å; P425-T428 WeakPolarHBondContact O-CA 3.27Å; P425-T428 PolarHBondContact O-N 3.43Å; P425-A429 HydrophobicContact CG-CB 4.4Å; P425-L432 HydrophobicContact CB-CD2 4.46Å; P425-L432 HydrophobicContact CG-CD2 4.21Å; P425-H501 HydrophobicContact CB-CB 3.8Å; P425-H501 HydrophobicContact CG-CB 4.17Å
426	L	92.4	Very high	89.1	Confident	3 Å²	3	16 Å²	16	2%	0.016	8%	0.08	C	C	.	.	T	Hydrogen-bonded Turn	trans	-57.2	-31.2	178.5	-175.4	58.4	0	0	0	112.9	L338 I419 L422 T428 N462 T465 L466 L469 L498	L338-L426 HydrophobicContact CD2-CD1 4.17Å; I419-L426 HydrophobicContact CG2-CB 4.33Å; I419-L426 HydrophobicContact CG2-CD2 4.32Å; L422-L426 HydrophobicContact CD1-CB 4.19Å; L422-L426 HydrophobicContact CD1-CD1 4.5Å; L426-T428 VanDerWaalsContact C-N 3.3Å; L426-T428 PolarHBondContact O-N 3.48Å; L426-N462 HydrophobicContact CD1-CB 4.3Å; L426-N462 WeakPolarHBondContact CD1-O 3.39Å; L426-N462 WeakPolarHBondContact O-CB 3.47Å; L426-N462 PolarHBondContact O-ND2 2.96Å; L426-T465 HydrophobicContact CD1-CG2 3.52Å; L426-T465 HydrophobicContact CD2-CG2 4.21Å; L426-L466 HydrophobicContact CD2-CB 4.13Å; L426-L466 HydrophobicContact CD2-CD1 4.01Å; L426-L466 HydrophobicContact CG-CB 4.25Å; L426-L469 HydrophobicContact CD2-CD2 4.14Å; L426-L498 HydrophobicContact CB-CD1 4.06Å; L426-L498 HydrophobicContact CD2-CD1 4.08Å; L426-L498 HydrophobicContact CG-CD1 4.4Å
427	L	91.6	Very high	88.8	Confident	0 Å²	0	15.4 Å²	15.4	0%	0	8%	0.077	C	C	.	.	T	Hydrogen-bonded Turn	trans	-84.7	6.2	174.6	-59.4	-175.8	0	0	0	114.7	P425 L432 F435 L458 L466 L498 F499	P425-L427 PolarHBondContact O-N 3.16Å; P425-L427 VanDerWaalsContact O-N 3.1Å; L427-L432 HydrophobicContact CB-CD1 3.94Å; L427-L432 HydrophobicContact CD1-CD1 4.06Å; L427-L432 HydrophobicContact CG-CD1 4.45Å; L427-F435 HydrophobicContact CB-CD2 3.85Å; L427-F435 HydrophobicContact CB-CE2 3.97Å; L427-F435 HydrophobicContact CD1-CB 4.03Å; L427-F435 HydrophobicContact CD1-CD1 4.21Å; L427-F435 HydrophobicContact CD1-CD2 3.95Å; L427-F435 HydrophobicContact CD1-CE2 4.44Å; L427-F435 HydrophobicContact CD1-CG 3.83Å; L427-F435 HydrophobicContact CD2-CD2 4.34Å; L427-F435 HydrophobicContact CD2-CE1 4.31Å; L427-F435 HydrophobicContact CD2-CE2 4Å; L427-F435 HydrophobicContact CD2-CZ 3.97Å; L427-F435 HydrophobicContact CG-CD2 4.27Å; L427-F435 HydrophobicContact CG-CE2 4.36Å; L427-L458 HydrophobicContact CD2-CD1 4.45Å; L427-L458 WeakPolarHBondContact O-CD2 3.38Å; L427-L466 HydrophobicContact CD2-CD1 4.25Å; L427-L466 HydrophobicContact CD2-CD2 3.64Å; L427-L498 HydrophobicContact CD1-CD1 4.3Å; L427-L498 HydrophobicContact CD1-CD2 3.95Å; L427-L498 HydrophobicContact CD1-CG 3.7Å; L427-L498 HydrophobicContact CD2-CD1 4.18Å; L427-L498 HydrophobicContact CD2-CD2 4.29Å; L427-L498 HydrophobicContact CD2-CG 4.34Å; L427-L498 HydrophobicContact CG-CD1 3.87Å; L427-L498 HydrophobicContact CG-CD2 4.26Å; L427-L498 HydrophobicContact CG-CG 3.85Å; L427-F499 HydrophobicContact CD1-CD1 3.77Å; L427-F499 HydrophobicContact CD1-CE1 3.4Å; L427-F499 VanDerWaalsContact CD1-CE1 3.4Å; L427-F499 HydrophobicContact CD1-CZ 4.33Å
428	T	89.6	Confident	88.7	Confident	11 Å²	11	13.7 Å²	13.7	7%	0.067	7%	0.07	C	C	.	.			trans	60.1	143.1	-170.3	70.2	0	0	0	0	114.7	P425 L426 E430 Y431 L432 L458 P459	P425-T428 WeakPolarHBondContact O-CA 3.27Å; P425-T428 PolarHBondContact O-N 3.43Å; L426-T428 VanDerWaalsContact C-N 3.3Å; L426-T428 PolarHBondContact O-N 3.48Å; T428-E430 PolarHBondContact O-N 3.33Å; T428-Y431 PolarHBondContact O-N 3.05Å; T428-Y431 WeakPolarHBondContact OG1-CD2 3.5Å; T428-L432 WeakPolarHBondContact O-CB 3.38Å; T428-L432 PolarHBondContact O-N 3.45Å; T428-L458 HydrophobicContact CG2-CD2 4.02Å; T428-P459 HydrophobicContact CG2-CG 3.91Å
429	A	85.3	Confident	88.2	Confident	1 Å²	1	14.9 Å²	14.9	1%	0.008	7%	0.074	C	C	.	.	T	Hydrogen-bonded Turn	trans	-60.9	-29.3	-179.7	0	0	0	0	0	113.6	T323 D424 P425 V504	T323-A429 HydrophobicContact CG2-CB 3.49Å; T323-A429 VanDerWaalsContact CG2-CB 3.49Å; D424-A429 PolarHBondContact OD1-N 2.89Å; P425-A429 HydrophobicContact CG-CB 4.4Å; A429-V504 HydrophobicContact CB-CG2 3.53Å
430	E	85.4	Confident	87.8	Confident	48 Å²	48	18.2 Å²	18.2	22%	0.224	9%	0.092	C	C	.	.	T	Hydrogen-bonded Turn	trans	-64.3	-46.4	179.6	-167.8	-167	141.6	0	0	112.5	R320 T428	R320-E430 HydrophobicContact CB-CG 4.46Å; R320-E430 HydrophobicContact CG-CG 3.91Å; R320-E430 IonicContact CZ-OE1 2.67Å; R320-E430 IonicContact NE-OE1 3.6Å; R320-E430 PolarHBondContact NE-OE1 3.23Å; R320-E430 IonicContact NH2-OE1 3.96Å; R320-E430 PolarHBondContact NH2-OE1 2.82Å; R320-E430 IonicContact NH2-OE2 3.36Å; T428-E430 PolarHBondContact O-N 3.33Å
431	Y	88.8	Confident	87.8	Confident	15 Å²	15	17.5 Å²	17.5	6%	0.059	9%	0.09	C	C	.	.	T	Hydrogen-bonded Turn	trans	-98.8	-12.5	-173.7	-56.3	-49	0	0	0	114.4	L304 M307 T428 N433 T434 F435 L454 L457 L458	L304-Y431 HydrophobicContact CD1-CE1 4.5Å; M307-Y431 HydrophobicContact CE-CE1 4.42Å; T428-Y431 PolarHBondContact O-N 3.05Å; T428-Y431 WeakPolarHBondContact OG1-CD2 3.5Å; Y431-N433 PolarHBondContact O-N 3.24Å; Y431-T434 WeakPolarHBondContact O-CA 3.44Å; Y431-T434 WeakPolarHBondContact O-CB 3.48Å; Y431-T434 PolarHBondContact O-N 2.99Å; Y431-T434 PolarHBondContact O-OG1 3.25Å; Y431-F435 WeakPolarHBondContact O-CD2 3.48Å; Y431-F435 PolarHBondContact O-N 2.94Å; Y431-L454 HydrophobicContact CD1-CD2 4.22Å; Y431-L454 HydrophobicContact CG-CD2 4.28Å; Y431-L457 HydrophobicContact CD1-CD1 4.47Å; Y431-L457 HydrophobicContact CD2-CB 4.23Å; Y431-L457 HydrophobicContact CE1-CB 4.42Å; Y431-L457 HydrophobicContact CE1-CD1 3.98Å; Y431-L457 HydrophobicContact CE2-CB 3.68Å; Y431-L458 HydrophobicContact CD2-CD2 4.43Å
432	L	87.4	Confident	87.6	Confident	0 Å²	0	20 Å²	20	0%	0	11%	0.11	C	C	.	.	H	α-helix	trans	-53.2	-40.1	-176.5	-173.3	69.1	0	0	0	113.3	P425 L427 T428 S436 L498 F499 H501 V504	P425-L432 HydrophobicContact CB-CD2 4.46Å; P425-L432 HydrophobicContact CG-CD2 4.21Å; L427-L432 HydrophobicContact CB-CD1 3.94Å; L427-L432 HydrophobicContact CD1-CD1 4.06Å; L427-L432 HydrophobicContact CG-CD1 4.45Å; T428-L432 WeakPolarHBondContact O-CB 3.38Å; T428-L432 PolarHBondContact O-N 3.45Å; L432-S436 WeakPolarHBondContact O-CB 3.42Å; L432-S436 PolarHBondContact O-N 2.9Å; L432-S436 PolarHBondContact O-OG 3.14Å; L432-L498 WeakPolarHBondContact CD1-O 3.48Å; L432-F499 HydrophobicContact CD1-CD1 4.36Å; L432-H501 HydrophobicContact CD2-CB 3.99Å; L432-V504 HydrophobicContact CD2-CB 3.86Å; L432-V504 HydrophobicContact CD2-CG1 4.17Å; L432-V504 HydrophobicContact CD2-CG2 4.05Å
433	N	85.3	Confident	87.5	Confident	12 Å²	12	24 Å²	24	6%	0.064	13%	0.128	C	C	.	.	H	α-helix	trans	-74.8	-30.7	177.6	-82.7	-34.3	0	0	0	112.5	H321 Y431 S436 A437 P505	H321-N433 PolarHBondContact CE1-ND2 2.85Å; H321-N433 PolarHBondContact ND1-ND2 3.24Å; Y431-N433 PolarHBondContact O-N 3.24Å; N433-S436 WeakPolarHBondContact O-CB 3.25Å; N433-S436 PolarHBondContact O-N 3.13Å; N433-A437 WeakPolarHBondContact O-CB 3.24Å; N433-A437 PolarHBondContact O-N 3.46Å; N433-P505 PolarHBondContact ND2-O 3.08Å
434	T	89.2	Confident	87.7	Confident	2 Å²	2	23.2 Å²	23.2	1%	0.012	12%	0.121	C	C	.	.	H	α-helix	trans	-66.6	-47.9	170.4	-33.9	0	0	0	0	111.7	M307 V318 Y431 S436 A437 V438 M450 L454	M307-T434 HydrophobicContact SD-CG2 3.94Å; V318-T434 HydrophobicContact CG1-CG2 4.33Å; V318-T434 WeakPolarHBondContact CG1-OG1 3.46Å; V318-T434 HydrophobicContact CG2-CG2 3.98Å; Y431-T434 WeakPolarHBondContact O-CA 3.44Å; Y431-T434 WeakPolarHBondContact O-CB 3.48Å; Y431-T434 PolarHBondContact O-N 2.99Å; Y431-T434 PolarHBondContact O-OG1 3.25Å; T434-S436 PolarHBondContact O-N 3.16Å; T434-A437 PolarHBondContact O-N 2.97Å; T434-V438 PolarHBondContact O-N 3.18Å; T434-V438 VanDerWaalsContact O-N 3.09Å; T434-M450 HydrophobicContact CG2-SD 4.12Å; T434-L454 HydrophobicContact CG2-CD1 4.09Å; T434-L454 HydrophobicContact CG2-CD2 3.71Å; T434-L454 HydrophobicContact CG2-CG 4.41Å
435	F	90.4	Very high	87.8	Confident	0 Å²	0	22.8 Å²	22.8	0%	0	12%	0.116	C	C	.	.	H	α-helix	trans	-55.4	-37.6	172.4	-85.9	-74.9	0	0	0	111.5	L427 Y431 V438 L451 L454 I455 L458 F499 L527	L427-F435 HydrophobicContact CB-CD2 3.85Å; L427-F435 HydrophobicContact CB-CE2 3.97Å; L427-F435 HydrophobicContact CD1-CB 4.03Å; L427-F435 HydrophobicContact CD1-CD1 4.21Å; L427-F435 HydrophobicContact CD1-CD2 3.95Å; L427-F435 HydrophobicContact CD1-CE2 4.44Å; L427-F435 HydrophobicContact CD1-CG 3.83Å; L427-F435 HydrophobicContact CD2-CD2 4.34Å; L427-F435 HydrophobicContact CD2-CE1 4.31Å; L427-F435 HydrophobicContact CD2-CE2 4Å; L427-F435 HydrophobicContact CD2-CZ 3.97Å; L427-F435 HydrophobicContact CG-CD2 4.27Å; L427-F435 HydrophobicContact CG-CE2 4.36Å; Y431-F435 WeakPolarHBondContact O-CD2 3.48Å; Y431-F435 PolarHBondContact O-N 2.94Å; F435-V438 WeakPolarHBondContact O-CB 3.39Å; F435-L451 HydrophobicContact CD1-CD2 3.71Å; F435-L451 HydrophobicContact CE1-CD2 3.95Å; F435-L454 HydrophobicContact CD1-CB 4.3Å; F435-L454 HydrophobicContact CD1-CD1 3.88Å; F435-L454 HydrophobicContact CD2-CB 4.39Å; F435-L454 HydrophobicContact CD2-CD1 4.28Å; F435-L454 HydrophobicContact CE1-CB 3.71Å; F435-L454 HydrophobicContact CE1-CD1 4.14Å; F435-L454 HydrophobicContact CE2-CB 3.83Å; F435-L454 HydrophobicContact CG-CD1 3.95Å; F435-L454 HydrophobicContact CZ-CB 3.45Å; F435-L454 VanDerWaalsContact CZ-CB 3.45Å; F435-L454 HydrophobicContact CZ-CD1 4.46Å; F435-L454 HydrophobicContact CZ-CG 4.49Å; F435-I455 HydrophobicContact CE1-CD1 4.27Å; F435-I455 HydrophobicContact CZ-CD1 4.13Å; F435-L458 HydrophobicContact CE2-CD2 4.21Å; F435-L458 HydrophobicContact CE2-CG 4.48Å; F435-L458 HydrophobicContact CZ-CD1 4.22Å; F435-L458 HydrophobicContact CZ-CG 4.43Å; F435-F499 HydrophobicContact CB-CE1 4.11Å; F435-L527 HydrophobicContact CE1-CD2 4.43Å
436	S	86.8	Confident	87.9	Confident	0 Å²	0	23.1 Å²	23.1	0%	0	12%	0.117	C	C	.	.	H	α-helix	trans	-66.8	-46.9	173.6	-61.8	0	0	0	0	111.4	L432 N433 T434 V438 R439	L432-S436 WeakPolarHBondContact O-CB 3.42Å; L432-S436 PolarHBondContact O-N 2.9Å; L432-S436 PolarHBondContact O-OG 3.14Å; N433-S436 WeakPolarHBondContact O-CB 3.25Å; N433-S436 PolarHBondContact O-N 3.13Å; T434-S436 PolarHBondContact O-N 3.16Å; S436-V438 PolarHBondContact O-N 2.9Å; S436-R439 WeakPolarHBondContact O-CB 3.48Å; S436-R439 VanDerWaalsContact O-CD 3.3Å; S436-R439 WeakPolarHBondContact O-CD 3.46Å; S436-R439 WeakPolarHBondContact O-CG 3.06Å; S436-R439 PolarHBondContact O-N 2.97Å; S436-R439 PolarHBondContact O-NE 2.76Å
437	A	86.7	Confident	87.9	Confident	1 Å²	1	24.9 Å²	24.9	1%	0.008	13%	0.125	C	C	.	.	H	α-helix	trans	-63.1	-20.3	-179.5	0	0	0	0	0	114.7	L316 N433 T434 R439 D440	L316-A437 HydrophobicContact CD2-CB 4.48Å; N433-A437 WeakPolarHBondContact O-CB 3.24Å; N433-A437 PolarHBondContact O-N 3.46Å; T434-A437 PolarHBondContact O-N 2.97Å; A437-R439 PolarHBondContact O-N 2.87Å; A437-D440 PolarHBondContact O-N 3.28Å
438	V	89.3	Confident	88.1	Confident	0 Å²	0	25 Å²	25	0%	0	13%	0.125	C	C	.	.	G	3₁₀ helix	trans	-50.3	-30.1	170.9	173.8	0	0	0	0	112.5	T434 F435 S436 D440 I441 K447 M450 L451 L454 V523	T434-V438 PolarHBondContact O-N 3.18Å; T434-V438 VanDerWaalsContact O-N 3.09Å; F435-V438 WeakPolarHBondContact O-CB 3.39Å; S436-V438 PolarHBondContact O-N 2.9Å; V438-D440 PolarHBondContact O-N 3.46Å; V438-I441 PolarHBondContact O-N 2.81Å; V438-K447 HydrophobicContact CG1-CB 3.82Å; V438-K447 HydrophobicContact CG1-CD 4.47Å; V438-K447 HydrophobicContact CG1-CG 3.9Å; V438-K447 WeakPolarHBondContact O-CE 3.44Å; V438-M450 HydrophobicContact CG2-CB 4.22Å; V438-M450 HydrophobicContact CG2-CG 3.59Å; V438-L451 HydrophobicContact CB-CD2 4.49Å; V438-L451 HydrophobicContact CG1-CD1 4.14Å; V438-L451 HydrophobicContact CG1-CD2 4.17Å; V438-L451 HydrophobicContact CG1-CG 3.92Å; V438-L451 HydrophobicContact CG2-CD2 3.97Å; V438-L451 HydrophobicContact CG2-CG 4.23Å; V438-L454 HydrophobicContact CG2-CD1 4.02Å; V438-V523 HydrophobicContact CB-CG2 4.24Å; V438-V523 HydrophobicContact CG1-CG2 4.28Å
439	R	84.4	Confident	88.3	Confident	27 Å²	27	24.4 Å²	24.4	10%	0.102	12%	0.122	C	C	.	.	G	3₁₀ helix	trans	-60.5	-29.4	178.1	75	-167.9	48	-129.6	-6.5	113.8	S436 A437 Q516 K519 V523	S436-R439 WeakPolarHBondContact O-CB 3.48Å; S436-R439 VanDerWaalsContact O-CD 3.3Å; S436-R439 WeakPolarHBondContact O-CD 3.46Å; S436-R439 WeakPolarHBondContact O-CG 3.06Å; S436-R439 PolarHBondContact O-N 2.97Å; S436-R439 PolarHBondContact O-NE 2.76Å; A437-R439 PolarHBondContact O-N 2.87Å; R439-Q516 PolarHBondContact NH1-O 2.99Å; R439-Q516 VanDerWaalsContact NH1-O 3.08Å; R439-K519 HydrophobicContact CB-CB 3.95Å; R439-K519 HydrophobicContact CB-CD 4.35Å; R439-K519 HydrophobicContact CB-CG 4.37Å; R439-K519 HydrophobicContact CG-CB 4.22Å; R439-K519 HydrophobicContact CG-CD 3.96Å; R439-K519 HydrophobicContact CG-CG 4.5Å; R439-K519 VanDerWaalsContact NH1-CB 3.25Å; R439-V523 HydrophobicContact CB-CG2 4.09Å
440	D	84.6	Confident	88.8	Confident	77 Å²	77	24.4 Å²	24.4	41%	0.412	12%	0.122	S	C	.	.	G	3₁₀ helix	trans	-91.8	-12.4	-170.7	-58.9	-52.9	0	0	0	112.6	A437 V438 K519	A437-D440 PolarHBondContact O-N 3.28Å; V438-D440 PolarHBondContact O-N 3.46Å; D440-K519 IonicContact OD1-NZ 3.9Å; D440-K519 PolarHBondContact OD1-NZ 3.27Å
441	I	87.4	Confident	89.3	Confident	10 Å²	10	22.1 Å²	22.1	5%	0.051	11%	0.111	C	C	.	.			trans	-60.6	143.7	164.9	-56.1	176.5	0	0	0	108.8	L314 L316 V438 Q446 K447 M450	L314-I441 HydrophobicContact CD1-CD1 3.98Å; L314-I441 HydrophobicContact CD1-CG1 4.15Å; L314-I441 HydrophobicContact CD1-CG2 4.49Å; L316-I441 HydrophobicContact CD1-CD1 4.07Å; L316-I441 HydrophobicContact CD1-CG1 4.04Å; L316-I441 HydrophobicContact CD2-CG1 4.45Å; V438-I441 PolarHBondContact O-N 2.81Å; I441-Q446 HydrophobicContact CG2-CB 3.59Å; I441-K447 HydrophobicContact CB-CG 3.87Å; I441-K447 HydrophobicContact CD1-CG 4.49Å; I441-K447 HydrophobicContact CG2-CG 3.96Å; I441-K447 WeakPolarHBondContact O-CE 3.37Å; I441-K447 PolarHBondContact O-NZ 3.41Å; I441-M450 HydrophobicContact CD1-CB 4.06Å; I441-M450 HydrophobicContact CD1-CG 4.3Å
442	T	85.2	Confident	89.7	Confident	110 Å²	110	21.4 Å²	21.4	68%	0.675	11%	0.108	S	C	*	.			trans	-82.1	-57.8	174.6	59.9	0	0	0	0	111.2
443	E	86.9	Confident	90.2	Very high	88 Å²	88	21.4 Å²	21.4	41%	0.411	11%	0.108	S	C	.	.			trans	-73.9	129.4	-168.7	-56.9	-46.1	112.8	0	0	113.1	R445 Q446 K447	E443-R445 VanDerWaalsContact C-N 3.33Å; E443-R445 PolarHBondContact O-N 2.89Å; E443-Q446 HydrophobicContact CB-CB 4.19Å; E443-Q446 HydrophobicContact CB-CG 4.11Å; E443-Q446 PolarHBondContact O-N 3.22Å; E443-Q446 VanDerWaalsContact O-N 3.15Å; E443-K447 PolarHBondContact O-N 2.88Å
444	L	88.7	Confident	90.7	Very high	27 Å²	27	20.9 Å²	20.9	14%	0.141	11%	0.105	C	C	.	.	H	α-helix	trans	-58.2	-44.8	177.8	174.3	59.5	0	0	0	111.8	P274 Q446 K447 L448 L526	P274-L444 HydrophobicContact CG-CD2 3.22Å; L444-Q446 VanDerWaalsContact C-N 3.3Å; L444-Q446 PolarHBondContact O-N 2.92Å; L444-K447 WeakPolarHBondContact O-CA 3.47Å; L444-K447 WeakPolarHBondContact O-CB 3.01Å; L444-K447 PolarHBondContact O-N 2.97Å; L444-L448 HydrophobicContact CD1-CD1 4.14Å; L444-L448 HydrophobicContact CD1-CD2 4.44Å; L444-L448 HydrophobicContact CD1-CG 4.04Å; L444-L448 HydrophobicContact CG-CD1 4.04Å; L444-L448 HydrophobicContact CG-CG 4.38Å; L444-L448 WeakPolarHBondContact O-CG 3.45Å; L444-L448 PolarHBondContact O-N 2.75Å; L444-L526 HydrophobicContact CD1-CD1 4.09Å; L444-L526 HydrophobicContact CD1-CD2 3.42Å; L444-L526 VanDerWaalsContact CD1-CD2 3.42Å; L444-L526 HydrophobicContact CD1-CG 4.42Å
445	R	89.5	Confident	91.1	Very high	43 Å²	43	20.8 Å²	20.8	16%	0.162	11%	0.105	C	C	.	.	H	α-helix	trans	-54.3	-43.6	175.8	-178.3	171.1	176.3	169.4	-7.8	113	E238 F239 L240 I241 E443 L448 H449	E238-R445 PolarHBondContact OE2-N 2.94Å; F239-R445 VanDerWaalsContact O-CZ 3.24Å; F239-R445 PolarHBondContact O-NE 2.88Å; F239-R445 PolarHBondContact O-NH1 2.81Å; L240-R445 HydrophobicContact CD1-CG 4.11Å; I241-R445 VanDerWaalsContact CG1-NH2 3.31Å; E443-R445 VanDerWaalsContact C-N 3.33Å; E443-R445 PolarHBondContact O-N 2.89Å; R445-L448 PolarHBondContact O-N 3.1Å; R445-H449 WeakPolarHBondContact CG-NE2 3.36Å; R445-H449 PolarHBondContact O-CD2 2.61Å; R445-H449 VanDerWaalsContact O-CD2 3.28Å; R445-H449 VanDerWaalsContact O-CG 3.24Å; R445-H449 PolarHBondContact O-N 2.8Å
446	Q	91.3	Very high	91.4	Very high	11 Å²	11	20.8 Å²	20.8	5%	0.051	11%	0.105	C	C	.	.	H	α-helix	trans	-69.1	-35.6	176.8	-70.3	176.7	-21.1	0	0	112	I441 E443 L444 L448 H449 M450	I441-Q446 HydrophobicContact CG2-CB 3.59Å; E443-Q446 HydrophobicContact CB-CB 4.19Å; E443-Q446 HydrophobicContact CB-CG 4.11Å; E443-Q446 PolarHBondContact O-N 3.22Å; E443-Q446 VanDerWaalsContact O-N 3.15Å; L444-Q446 VanDerWaalsContact C-N 3.3Å; L444-Q446 PolarHBondContact O-N 2.92Å; Q446-L448 VanDerWaalsContact C-N 3.32Å; Q446-L448 PolarHBondContact O-N 2.96Å; Q446-H449 PolarHBondContact O-N 3.1Å; Q446-M450 WeakPolarHBondContact O-CB 3.29Å; Q446-M450 PolarHBondContact O-N 3.02Å
447	K	93	Very high	91.8	Very high	40 Å²	40	21 Å²	21	17%	0.174	11%	0.106	C	C	.	.	H	α-helix	trans	-58.9	-43.4	169.8	-66	178.4	-178.7	175.4	0	111.6	V438 I441 E443 L444 M450 L451 L526	V438-K447 HydrophobicContact CG1-CB 3.82Å; V438-K447 HydrophobicContact CG1-CD 4.47Å; V438-K447 HydrophobicContact CG1-CG 3.9Å; V438-K447 WeakPolarHBondContact O-CE 3.44Å; I441-K447 HydrophobicContact CB-CG 3.87Å; I441-K447 HydrophobicContact CD1-CG 4.49Å; I441-K447 HydrophobicContact CG2-CG 3.96Å; I441-K447 WeakPolarHBondContact O-CE 3.37Å; I441-K447 PolarHBondContact O-NZ 3.41Å; E443-K447 PolarHBondContact O-N 2.88Å; L444-K447 WeakPolarHBondContact O-CA 3.47Å; L444-K447 WeakPolarHBondContact O-CB 3.01Å; L444-K447 PolarHBondContact O-N 2.97Å; K447-M450 PolarHBondContact O-N 2.74Å; K447-L451 WeakPolarHBondContact O-CB 3.43Å; K447-L451 VanDerWaalsContact O-CG 3.24Å; K447-L451 WeakPolarHBondContact O-CG 3.47Å; K447-L451 PolarHBondContact O-N 3.15Å; K447-L526 HydrophobicContact CB-CD1 3.8Å; K447-L526 HydrophobicContact CD-CD1 3.95Å; K447-L526 HydrophobicContact CG-CD1 4.44Å
448	L	94.2	Very high	92.2	Very high	1 Å²	1	20.9 Å²	20.9	1%	0.005	11%	0.105	C	C	.	.	H	α-helix	trans	-70.5	-38.9	-179.9	-64.4	174	0	0	0	112.5	L240 V276 L444 R445 Q446 N452 Y530 L533 L534	L240-L448 HydrophobicContact CD1-CB 3.96Å; L240-L448 HydrophobicContact CD1-CD1 4.37Å; V276-L448 HydrophobicContact CB-CD1 4.45Å; V276-L448 HydrophobicContact CG1-CD1 4.24Å; V276-L448 HydrophobicContact CG2-CD1 3.61Å; L444-L448 HydrophobicContact CD1-CD1 4.14Å; L444-L448 HydrophobicContact CD1-CD2 4.44Å; L444-L448 HydrophobicContact CD1-CG 4.04Å; L444-L448 HydrophobicContact CG-CD1 4.04Å; L444-L448 HydrophobicContact CG-CG 4.38Å; L444-L448 WeakPolarHBondContact O-CG 3.45Å; L444-L448 PolarHBondContact O-N 2.75Å; R445-L448 PolarHBondContact O-N 3.1Å; Q446-L448 VanDerWaalsContact C-N 3.32Å; Q446-L448 PolarHBondContact O-N 2.96Å; L448-N452 VanDerWaalsContact O-CB 3.27Å; L448-N452 WeakPolarHBondContact O-CB 3.45Å; L448-N452 PolarHBondContact O-N 3.44Å; L448-Y530 HydrophobicContact CD1-CD2 4.49Å; L448-Y530 HydrophobicContact CD1-CE2 4.39Å; L448-Y530 HydrophobicContact CD2-CD2 3.47Å; L448-Y530 VanDerWaalsContact CD2-CD2 3.47Å; L448-Y530 HydrophobicContact CD2-CE2 3.98Å; L448-Y530 HydrophobicContact CD2-CG 3.87Å; L448-L533 HydrophobicContact CD1-CD2 4.45Å; L448-L534 HydrophobicContact CD2-CD2 4.5Å
449	H	94.8	Very high	92.4	Very high	0 Å²	0	22.7 Å²	22.7	0%	0	12%	0.117	C	C	.	.	H	α-helix	trans	-55.8	-53.6	169.8	-67	175	0	0	0	110.9	Y246 Q249 L310 R445 Q446 L451 N452 L453	Y246-H449 HydrophobicContact CD1-CB 4.01Å; Y246-H449 AromaticContact CD1-CD2 3.3Å; Y246-H449 WeakPolarHBondContact CD1-CD2 3.41Å; Y246-H449 AromaticContact CD1-CE1 3.7Å; Y246-H449 AromaticContact CD1-CG 3.4Å; Y246-H449 VanDerWaalsContact CD1-CG 3.4Å; Y246-H449 AromaticContact CD1-ND1 3.64Å; Y246-H449 AromaticContact CD1-NE2 3.55Å; Y246-H449 HydrophobicContact CD2-CB 3.63Å; Y246-H449 AromaticContact CD2-CG 4Å; Y246-H449 HydrophobicContact CE1-CB 4.42Å; Y246-H449 AromaticContact CE1-CD2 3.29Å; Y246-H449 WeakPolarHBondContact CE1-CD2 3.49Å; Y246-H449 AromaticContact CE1-CG 3.84Å; Y246-H449 AromaticContact CE1-NE2 3.68Å; Y246-H449 HydrophobicContact CE2-CB 4.09Å; Y246-H449 HydrophobicContact CG-CB 3.57Å; Y246-H449 AromaticContact CG-CD2 3.86Å; Y246-H449 AromaticContact CG-CG 3.48Å; Y246-H449 VanDerWaalsContact CG-CG 3.48Å; Y246-H449 AromaticContact CG-ND1 3.8Å; Y246-H449 AromaticContact CZ-CD2 3.84Å; Q249-H449 PolarHBondContact OE1-CE1 3.39Å; Q249-H449 PolarHBondContact OE1-NE2 3.02Å; L310-H449 HydrophobicContact CD2-CB 4.12Å; R445-H449 WeakPolarHBondContact CG-NE2 3.36Å; R445-H449 PolarHBondContact O-CD2 2.61Å; R445-H449 VanDerWaalsContact O-CD2 3.28Å; R445-H449 VanDerWaalsContact O-CG 3.24Å; R445-H449 PolarHBondContact O-N 2.8Å; Q446-H449 PolarHBondContact O-N 3.1Å; H449-L451 PolarHBondContact O-N 3.49Å; H449-N452 PolarHBondContact O-N 2.83Å; H449-L453 WeakPolarHBondContact O-CG 3.29Å; H449-L453 PolarHBondContact O-N 3.5Å; H449-L453 VanDerWaalsContact O-N 3.08Å
450	M	95.7	Very high	92.7	Very high	0 Å²	0	25.5 Å²	25.5	0%	0	13%	0.131	C	C	.	.	H	α-helix	trans	-60.8	-47.5	-179.5	-176	56.9	74.7	0	0	111.7	M307 L310 C311 L316 T434 V438 I441 Q446 K447 N452 L453 L454	M307-M450 HydrophobicContact CG-CE 4.46Å; M307-M450 HydrophobicContact CG-SD 3.65Å; M307-M450 HydrophobicContact SD-SD 4.26Å; L310-M450 HydrophobicContact CB-CE 4.08Å; L310-M450 HydrophobicContact CD2-CB 4.33Å; L310-M450 HydrophobicContact CD2-CE 3.81Å; L310-M450 HydrophobicContact CG-CE 3.81Å; C311-M450 WeakPolarHBondContact SG-CE 3.48Å; L316-M450 HydrophobicContact CD1-CE 4.11Å; T434-M450 HydrophobicContact CG2-SD 4.12Å; V438-M450 HydrophobicContact CG2-CB 4.22Å; V438-M450 HydrophobicContact CG2-CG 3.59Å; I441-M450 HydrophobicContact CD1-CB 4.06Å; I441-M450 HydrophobicContact CD1-CG 4.3Å; Q446-M450 WeakPolarHBondContact O-CB 3.29Å; Q446-M450 PolarHBondContact O-N 3.02Å; K447-M450 PolarHBondContact O-N 2.74Å; M450-N452 PolarHBondContact O-N 2.81Å; M450-L453 PolarHBondContact O-N 3.01Å; M450-L454 HydrophobicContact CG-CD1 3.91Å; M450-L454 HydrophobicContact CG-CG 4.47Å; M450-L454 WeakPolarHBondContact O-CB 3.48Å; M450-L454 VanDerWaalsContact O-CG 3.23Å; M450-L454 WeakPolarHBondContact O-CG 3.35Å; M450-L454 PolarHBondContact O-N 3.45Å; M450-L454 HydrophobicContact SD-CD1 4.21Å; M450-L454 HydrophobicContact SD-CG 4.26Å
451	L	96.5	Very high	93.1	Very high	0 Å²	0	23.6 Å²	23.6	0%	0	12%	0.123	C	C	.	.	H	α-helix	trans	-62.6	-39.5	177.8	-72	171.7	0	0	0	112.6	F435 V438 K447 H449 L454 I455 V523 L526 L527 L534	F435-L451 HydrophobicContact CD1-CD2 3.71Å; F435-L451 HydrophobicContact CE1-CD2 3.95Å; V438-L451 HydrophobicContact CB-CD2 4.49Å; V438-L451 HydrophobicContact CG1-CD1 4.14Å; V438-L451 HydrophobicContact CG1-CD2 4.17Å; V438-L451 HydrophobicContact CG1-CG 3.92Å; V438-L451 HydrophobicContact CG2-CD2 3.97Å; V438-L451 HydrophobicContact CG2-CG 4.23Å; K447-L451 WeakPolarHBondContact O-CB 3.43Å; K447-L451 VanDerWaalsContact O-CG 3.24Å; K447-L451 WeakPolarHBondContact O-CG 3.47Å; K447-L451 PolarHBondContact O-N 3.15Å; H449-L451 PolarHBondContact O-N 3.49Å; L451-L454 PolarHBondContact O-N 3.22Å; L451-I455 WeakPolarHBondContact O-CB 3.18Å; L451-I455 VanDerWaalsContact O-CG1 3.29Å; L451-I455 WeakPolarHBondContact O-CG1 3.43Å; L451-I455 PolarHBondContact O-N 2.98Å; L451-V523 HydrophobicContact CD2-CG1 3.97Å; L451-L526 HydrophobicContact CD1-CB 3.66Å; L451-L526 HydrophobicContact CD1-CD1 3.86Å; L451-L526 HydrophobicContact CD1-CG 4.42Å; L451-L527 HydrophobicContact CD2-CD2 4.06Å; L451-L534 HydrophobicContact CB-CD1 4.44Å; L451-L534 HydrophobicContact CB-CD2 3.58Å
452	N	97	Very high	93.4	Very high	1 Å²	1	23.8 Å²	23.8	1%	0.005	12%	0.124	C	C	.	.	H	α-helix	trans	-63.9	-45.4	177.5	172.2	-128.9	0	0	0	111.2	Y246 L448 H449 M450 L454 I455 L456 L534 T536 P538	Y246-N452 HydrophobicContact CE2-CB 4.36Å; Y246-N452 WeakPolarHBondContact CE2-OD1 3.25Å; Y246-N452 PolarHBondContact OH-OD1 3.39Å; L448-N452 VanDerWaalsContact O-CB 3.27Å; L448-N452 WeakPolarHBondContact O-CB 3.45Å; L448-N452 PolarHBondContact O-N 3.44Å; H449-N452 PolarHBondContact O-N 2.83Å; M450-N452 PolarHBondContact O-N 2.81Å; N452-L454 PolarHBondContact O-N 3.28Å; N452-I455 PolarHBondContact O-N 3.19Å; N452-L456 WeakPolarHBondContact O-CG 3.05Å; N452-L456 PolarHBondContact O-N 3.2Å; N452-L534 HydrophobicContact CB-CD2 4.06Å; N452-L534 PolarHBondContact ND2-O 2.67Å; N452-T536 PolarHBondContact ND2-O 3.3Å; N452-P538 WeakPolarHBondContact OD1-CG 3.48Å
453	L	97.1	Very high	93.9	Very high	0 Å²	0	19.1 Å²	19.1	0%	0	9%	0.094	C	C	.	.	H	α-helix	trans	-60.7	-44.6	174.8	-64.9	174	0	0	0	112	Y246 A303 D306 M307 L310 H449 M450 I455 L456 L457 L541	Y246-L453 HydrophobicContact CD2-CD1 3.84Å; Y246-L453 HydrophobicContact CD2-CD2 3.96Å; Y246-L453 HydrophobicContact CD2-CG 3.73Å; Y246-L453 HydrophobicContact CE2-CD2 4.17Å; Y246-L453 HydrophobicContact CE2-CG 4.06Å; A303-L453 HydrophobicContact CB-CD2 3.93Å; D306-L453 HydrophobicContact CB-CD1 4.14Å; D306-L453 HydrophobicContact CB-CD2 4.24Å; M307-L453 HydrophobicContact CB-CB 4.1Å; M307-L453 HydrophobicContact CB-CD1 3.98Å; M307-L453 HydrophobicContact CG-CB 4.44Å; L310-L453 HydrophobicContact CD2-CD1 4.4Å; H449-L453 WeakPolarHBondContact O-CG 3.29Å; H449-L453 PolarHBondContact O-N 3.5Å; H449-L453 VanDerWaalsContact O-N 3.08Å; M450-L453 PolarHBondContact O-N 3.01Å; L453-I455 PolarHBondContact O-N 2.99Å; L453-L456 WeakPolarHBondContact O-CB 3.34Å; L453-L456 PolarHBondContact O-N 3.23Å; L453-L457 VanDerWaalsContact O-CG 3.31Å; L453-L457 WeakPolarHBondContact O-CG 3.48Å; L453-L457 PolarHBondContact O-N 3.4Å; L453-L541 HydrophobicContact CD2-CD1 4.49Å
454	L	96.3	Very high	94.2	Very high	0 Å²	0	16.1 Å²	16.1	0%	0	8%	0.083	C	C	.	.	H	α-helix	trans	-62.5	-40.3	177.5	-68.2	168.2	0	0	0	112.4	M307 Y431 T434 F435 V438 M450 L451 N452 L457 L458	M307-L454 HydrophobicContact CG-CD2 4.27Å; Y431-L454 HydrophobicContact CD1-CD2 4.22Å; Y431-L454 HydrophobicContact CG-CD2 4.28Å; T434-L454 HydrophobicContact CG2-CD1 4.09Å; T434-L454 HydrophobicContact CG2-CD2 3.71Å; T434-L454 HydrophobicContact CG2-CG 4.41Å; F435-L454 HydrophobicContact CD1-CB 4.3Å; F435-L454 HydrophobicContact CD1-CD1 3.88Å; F435-L454 HydrophobicContact CD2-CB 4.39Å; F435-L454 HydrophobicContact CD2-CD1 4.28Å; F435-L454 HydrophobicContact CE1-CB 3.71Å; F435-L454 HydrophobicContact CE1-CD1 4.14Å; F435-L454 HydrophobicContact CE2-CB 3.83Å; F435-L454 HydrophobicContact CG-CD1 3.95Å; F435-L454 HydrophobicContact CZ-CB 3.45Å; F435-L454 VanDerWaalsContact CZ-CB 3.45Å; F435-L454 HydrophobicContact CZ-CD1 4.46Å; F435-L454 HydrophobicContact CZ-CG 4.49Å; V438-L454 HydrophobicContact CG2-CD1 4.02Å; M450-L454 HydrophobicContact CG-CD1 3.91Å; M450-L454 HydrophobicContact CG-CG 4.47Å; M450-L454 WeakPolarHBondContact O-CB 3.48Å; M450-L454 VanDerWaalsContact O-CG 3.23Å; M450-L454 WeakPolarHBondContact O-CG 3.35Å; M450-L454 PolarHBondContact O-N 3.45Å; M450-L454 HydrophobicContact SD-CD1 4.21Å; M450-L454 HydrophobicContact SD-CG 4.26Å; L451-L454 PolarHBondContact O-N 3.22Å; N452-L454 PolarHBondContact O-N 3.28Å; L454-L457 PolarHBondContact O-N 3.11Å; L454-L458 PolarHBondContact O-N 3.04Å
455	I	97.3	Very high	94.5	Very high	0 Å²	0	15 Å²	15	0%	0	8%	0.077	C	C	.	.	H	α-helix	trans	-64	-39.7	173.7	-70.6	-56.8	0	0	0	111.6	I288 F435 L451 N452 L453 L457 L458 R463 L466 L527 L534 W535	I288-I455 HydrophobicContact CD1-CG2 4.36Å; F435-I455 HydrophobicContact CE1-CD1 4.27Å; F435-I455 HydrophobicContact CZ-CD1 4.13Å; L451-I455 WeakPolarHBondContact O-CB 3.18Å; L451-I455 VanDerWaalsContact O-CG1 3.29Å; L451-I455 WeakPolarHBondContact O-CG1 3.43Å; L451-I455 PolarHBondContact O-N 2.98Å; N452-I455 PolarHBondContact O-N 3.19Å; L453-I455 PolarHBondContact O-N 2.99Å; I455-L457 VanDerWaalsContact C-N 3.31Å; I455-L457 PolarHBondContact O-N 3.03Å; I455-L458 HydrophobicContact CD1-CD1 3.85Å; I455-L458 PolarHBondContact O-N 3.34Å; I455-R463 HydrophobicContact CG2-CG 4.31Å; I455-R463 WeakPolarHBondContact O-CD 3.32Å; I455-L466 HydrophobicContact CD1-CD2 3.52Å; I455-L527 HydrophobicContact CD1-CD2 4.31Å; I455-L534 HydrophobicContact CG1-CB 4.32Å; I455-L534 WeakPolarHBondContact CG2-O 3.34Å; I455-W535 HydrophobicContact CD1-CH2 3.43Å; I455-W535 VanDerWaalsContact CD1-CH2 3.43Å; I455-W535 HydrophobicContact CD1-CZ2 3.98Å; I455-W535 HydrophobicContact CD1-CZ3 3.9Å; I455-W535 HydrophobicContact CG1-CE3 4.47Å; I455-W535 HydrophobicContact CG1-CH2 3.99Å; I455-W535 HydrophobicContact CG1-CZ3 3.95Å; I455-W535 HydrophobicContact CG2-CD2 3.63Å; I455-W535 HydrophobicContact CG2-CE3 3.83Å; I455-W535 HydrophobicContact CG2-CG 4.17Å; I455-W535 HydrophobicContact CG2-CH2 4.01Å; I455-W535 HydrophobicContact CG2-CZ2 3.83Å; I455-W535 HydrophobicContact CG2-CZ3 4.01Å
456	L	96.5	Very high	94.9	Very high	0 Å²	0	12.9 Å²	12.9	0%	0	7%	0.069	C	C	.	.	H	α-helix	trans	-61.6	-41.4	174.5	-68.5	171.2	0	0	0	111.3	I288 V299 R300 A303 N452 L453 L458 R463 V537 L541	I288-L456 HydrophobicContact CD1-CD2 3.82Å; I288-L456 HydrophobicContact CG1-CD2 3.57Å; V299-L456 HydrophobicContact CG1-CD1 4.31Å; V299-L456 HydrophobicContact CG1-CD2 4.21Å; R300-L456 WeakPolarHBondContact CG-O 3.5Å; A303-L456 HydrophobicContact CB-CB 4.19Å; A303-L456 HydrophobicContact CB-CD1 4.39Å; N452-L456 WeakPolarHBondContact O-CG 3.05Å; N452-L456 PolarHBondContact O-N 3.2Å; L453-L456 WeakPolarHBondContact O-CB 3.34Å; L453-L456 PolarHBondContact O-N 3.23Å; L456-L458 PolarHBondContact O-N 3.46Å; L456-R463 PolarHBondContact O-NH1 3.08Å; L456-V537 HydrophobicContact CD2-CG2 3.99Å; L456-L541 HydrophobicContact CD1-CD1 3.69Å
457	L	95.7	Very high	95.1	Very high	4 Å²	4	14.1 Å²	14.1	2%	0.021	7%	0.074	C	C	.	.	H	α-helix	trans	-65.6	-31.4	-178.9	-73.2	169.7	0	0	0	114.6	R300 A303 L304 M307 Y431 L453 L454 I455	R300-L457 PolarHBondContact NE-O 2.91Å; R300-L457 VanDerWaalsContact NE-O 3.1Å; R300-L457 PolarHBondContact NH2-O 2.79Å; R300-L457 VanDerWaalsContact O-CD2 3.31Å; R300-L457 WeakPolarHBondContact O-CD2 3.12Å; A303-L457 HydrophobicContact CB-CD2 4.4Å; A303-L457 HydrophobicContact CB-CG 4.4Å; L304-L457 HydrophobicContact CB-CD2 3.69Å; L304-L457 HydrophobicContact CD1-CD1 4.32Å; L304-L457 HydrophobicContact CD1-CD2 4.21Å; M307-L457 HydrophobicContact CB-CD1 4.18Å; M307-L457 HydrophobicContact CE-CD1 3.94Å; M307-L457 HydrophobicContact CG-CD1 4.16Å; Y431-L457 HydrophobicContact CD1-CD1 4.47Å; Y431-L457 HydrophobicContact CD2-CB 4.23Å; Y431-L457 HydrophobicContact CE1-CB 4.42Å; Y431-L457 HydrophobicContact CE1-CD1 3.98Å; Y431-L457 HydrophobicContact CE2-CB 3.68Å; L453-L457 VanDerWaalsContact O-CG 3.31Å; L453-L457 WeakPolarHBondContact O-CG 3.48Å; L453-L457 PolarHBondContact O-N 3.4Å; L454-L457 PolarHBondContact O-N 3.11Å; I455-L457 VanDerWaalsContact C-N 3.31Å; I455-L457 PolarHBondContact O-N 3.03Å
458	L	94.9	Very high	95.2	Very high	0 Å²	0	12.9 Å²	12.9	0%	0	7%	0.071	C	C	.	.	S	Bend	trans	-54	142.3	-179.4	-72.5	176.2	0	0	0	112.9	L427 T428 Y431 F435 L454 I455 L456 R463 L466	L427-L458 HydrophobicContact CD2-CD1 4.45Å; L427-L458 WeakPolarHBondContact O-CD2 3.38Å; T428-L458 HydrophobicContact CG2-CD2 4.02Å; Y431-L458 HydrophobicContact CD2-CD2 4.43Å; F435-L458 HydrophobicContact CE2-CD2 4.21Å; F435-L458 HydrophobicContact CE2-CG 4.48Å; F435-L458 HydrophobicContact CZ-CD1 4.22Å; F435-L458 HydrophobicContact CZ-CG 4.43Å; L454-L458 PolarHBondContact O-N 3.04Å; I455-L458 HydrophobicContact CD1-CD1 3.85Å; I455-L458 PolarHBondContact O-N 3.34Å; L456-L458 PolarHBondContact O-N 3.46Å; L458-R463 HydrophobicContact CB-CB 3.95Å; L458-R463 HydrophobicContact CB-CG 4.47Å; L458-R463 PolarHBondContact O-NH1 3.13Å; L458-L466 HydrophobicContact CD1-CD2 3.69Å
459	P	93	Very high	95.4	Very high	38 Å²	38	13 Å²	13	25%	0.247	7%	0.072	C	C	.	.			trans	-54.3	147.4	166.8	-23.7	33.4	0	0	0	111.7	T428 N462 R463	T428-P459 HydrophobicContact CG2-CG 3.91Å; P459-N462 HydrophobicContact CB-CB 4.42Å; P459-N462 WeakPolarHBondContact O-CB 3.42Å; P459-N462 PolarHBondContact O-N 3.23Å; P459-N462 VanDerWaalsContact O-N 3.16Å; P459-R463 VanDerWaalsContact O-CB 3.27Å; P459-R463 WeakPolarHBondContact O-CB 3.49Å; P459-R463 PolarHBondContact O-N 3.46Å
460	E	91.4	Very high	95.5	Very high	85 Å²	85	13 Å²	13	40%	0.397	7%	0.072	S	C	.	.	H	α-helix	trans	-58.1	-41.2	-177.4	-177.7	178	162.6	0	0	114.6	H293 R463 S464	H293-E460 IonicContact CE1-OE1 3.8Å; H293-E460 IonicContact CE1-OE2 3.32Å; H293-E460 PolarHBondContact CE1-OE2 3.48Å; H293-E460 IonicContact ND1-OE2 2.71Å; H293-E460 PolarHBondContact ND1-OE2 2.91Å; E460-R463 PolarHBondContact O-N 3.32Å; E460-S464 VanDerWaalsContact O-CB 3.3Å; E460-S464 WeakPolarHBondContact O-CB 3.08Å; E460-S464 PolarHBondContact O-N 3.44Å; E460-S464 PolarHBondContact O-OG 2.91Å
461	P	92.3	Very high	95.5	Very high	37 Å²	37	16.6 Å²	16.6	24%	0.24	9%	0.089	C	C	.	.	H	α-helix	trans	-52.2	-54.9	169.2	-33	40.3	0	0	0	113.4	L338 L342 R463 S464 T465	L338-P461 HydrophobicContact CD2-CB 3.86Å; L338-P461 HydrophobicContact CG-CB 4.05Å; L342-P461 HydrophobicContact CD1-CB 3.49Å; L342-P461 VanDerWaalsContact CD1-CB 3.49Å; L342-P461 HydrophobicContact CD1-CG 3.75Å; P461-R463 PolarHBondContact O-N 3.39Å; P461-S464 PolarHBondContact O-N 2.9Å; P461-T465 WeakPolarHBondContact O-CB 3.22Å; P461-T465 PolarHBondContact O-N 2.77Å; P461-T465 PolarHBondContact O-OG1 3Å
462	N	94.7	Very high	95.5	Very high	14 Å²	14	16.6 Å²	16.6	8%	0.075	9%	0.089	C	C	.	.	H	α-helix	trans	-61.2	-46.2	-177.8	-67.5	60	0	0	0	110.8	L338 L426 P459 T465 L466	L338-N462 HydrophobicContact CD2-CB 4.4Å; L426-N462 HydrophobicContact CD1-CB 4.3Å; L426-N462 WeakPolarHBondContact CD1-O 3.39Å; L426-N462 WeakPolarHBondContact O-CB 3.47Å; L426-N462 PolarHBondContact O-ND2 2.96Å; P459-N462 HydrophobicContact CB-CB 4.42Å; P459-N462 WeakPolarHBondContact O-CB 3.42Å; P459-N462 PolarHBondContact O-N 3.23Å; P459-N462 VanDerWaalsContact O-N 3.16Å; N462-T465 PolarHBondContact O-N 3.23Å; N462-L466 WeakPolarHBondContact O-CB 3.48Å; N462-L466 PolarHBondContact O-N 2.79Å
463	R	94.9	Very high	95.5	Very high	13 Å²	13	16.6 Å²	16.6	5%	0.049	9%	0.089	C	C	.	.	H	α-helix	trans	-67.8	-39.3	-177.4	-171.3	171.6	66.4	-146.6	-4.5	113.3	I455 L456 L458 P459 E460 P461 K467 W535	I455-R463 HydrophobicContact CG2-CG 4.31Å; I455-R463 WeakPolarHBondContact O-CD 3.32Å; L456-R463 PolarHBondContact O-NH1 3.08Å; L458-R463 HydrophobicContact CB-CB 3.95Å; L458-R463 HydrophobicContact CB-CG 4.47Å; L458-R463 PolarHBondContact O-NH1 3.13Å; P459-R463 VanDerWaalsContact O-CB 3.27Å; P459-R463 WeakPolarHBondContact O-CB 3.49Å; P459-R463 PolarHBondContact O-N 3.46Å; E460-R463 PolarHBondContact O-N 3.32Å; P461-R463 PolarHBondContact O-N 3.39Å; R463-K467 WeakPolarHBondContact O-CB 3.36Å; R463-K467 PolarHBondContact O-N 3.35Å; R463-W535 HydrophobicContact CG-CZ2 4.2Å; R463-W535 WeakPolarHBondContact O-CZ2 3.36Å
464	S	93.8	Very high	95.4	Very high	25 Å²	25	19.1 Å²	19.1	18%	0.175	11%	0.106	C	C	.	.	H	α-helix	trans	-70.3	-42.8	176.3	-55.6	0	0	0	0	111	S353 E460 P461 K467 A468	S353-S464 VanDerWaalsContact O-CB 3.31Å; S353-S464 WeakPolarHBondContact O-CB 3.5Å; E460-S464 VanDerWaalsContact O-CB 3.3Å; E460-S464 WeakPolarHBondContact O-CB 3.08Å; E460-S464 PolarHBondContact O-N 3.44Å; E460-S464 PolarHBondContact O-OG 2.91Å; P461-S464 PolarHBondContact O-N 2.9Å; S464-K467 PolarHBondContact O-N 3.3Å; S464-A468 PolarHBondContact O-N 2.92Å; S464-A468 VanDerWaalsContact O-N 3.08Å
465	T	95.8	Very high	95.3	Very high	2 Å²	2	22.2 Å²	22.2	1%	0.012	12%	0.12	C	C	.	.	H	α-helix	trans	-62.1	-45.2	175.4	-65.2	0	0	0	0	112	L338 L358 L426 P461 N462 A468 L469	L338-T465 HydrophobicContact CD1-CG2 4.32Å; L338-T465 HydrophobicContact CD2-CG2 4.35Å; L358-T465 HydrophobicContact CD2-CG2 3.55Å; L426-T465 HydrophobicContact CD1-CG2 3.52Å; L426-T465 HydrophobicContact CD2-CG2 4.21Å; P461-T465 WeakPolarHBondContact O-CB 3.22Å; P461-T465 PolarHBondContact O-N 2.77Å; P461-T465 PolarHBondContact O-OG1 3Å; N462-T465 PolarHBondContact O-N 3.23Å; T465-A468 PolarHBondContact O-N 3.49Å; T465-L469 PolarHBondContact O-N 3.45Å; T465-L469 VanDerWaalsContact O-N 3.08Å
466	L	96.6	Very high	95.2	Very high	0 Å²	0	22.2 Å²	22.2	0%	0	12%	0.12	C	C	.	.	H	α-helix	trans	-63.5	-41.7	175.5	-179.8	64.2	0	0	0	111.8	L426 L427 I455 L458 N462 L469 L470 L498 W535	L426-L466 HydrophobicContact CD2-CB 4.13Å; L426-L466 HydrophobicContact CD2-CD1 4.01Å; L426-L466 HydrophobicContact CG-CB 4.25Å; L427-L466 HydrophobicContact CD2-CD1 4.25Å; L427-L466 HydrophobicContact CD2-CD2 3.64Å; I455-L466 HydrophobicContact CD1-CD2 3.52Å; L458-L466 HydrophobicContact CD1-CD2 3.69Å; N462-L466 WeakPolarHBondContact O-CB 3.48Å; N462-L466 PolarHBondContact O-N 2.79Å; L466-L469 WeakPolarHBondContact O-CB 3.15Å; L466-L469 PolarHBondContact O-N 2.98Å; L466-L470 HydrophobicContact CD1-CD1 4.03Å; L466-L470 HydrophobicContact CD1-CG 4.1Å; L466-L470 HydrophobicContact CG-CD1 3.87Å; L466-L470 HydrophobicContact CG-CG 4.34Å; L466-L470 VanDerWaalsContact O-CG 3.27Å; L466-L470 WeakPolarHBondContact O-CG 3.25Å; L466-L470 PolarHBondContact O-N 3.43Å; L466-L498 HydrophobicContact CD1-CD1 4.19Å; L466-L498 HydrophobicContact CD1-CD2 4.24Å; L466-W535 HydrophobicContact CB-CZ2 4.46Å; L466-W535 HydrophobicContact CD2-CH2 3.94Å; L466-W535 HydrophobicContact CD2-CZ2 4.26Å; L466-W535 HydrophobicContact CG-CH2 4.04Å; L466-W535 HydrophobicContact CG-CZ2 4.3Å
467	K	95.6	Very high	95.1	Very high	37 Å²	37	23.5 Å²	23.5	16%	0.161	13%	0.128	C	C	.	.	H	α-helix	trans	-59.5	-51.3	176.6	-174.9	167.8	176.3	167.3	0	111.5	R463 S464 L469 L470 E471 W535	R463-K467 WeakPolarHBondContact O-CB 3.36Å; R463-K467 PolarHBondContact O-N 3.35Å; S464-K467 PolarHBondContact O-N 3.3Å; K467-L469 VanDerWaalsContact C-N 3.28Å; K467-L469 PolarHBondContact O-N 3.26Å; K467-L470 PolarHBondContact O-N 3.26Å; K467-L470 VanDerWaalsContact O-N 3.13Å; K467-E471 WeakPolarHBondContact CE-OE1 3.34Å; K467-E471 HydrophobicContact CG-CG 4.28Å; K467-E471 WeakPolarHBondContact O-CB 3.43Å; K467-E471 WeakPolarHBondContact O-CG 3.35Å; K467-E471 PolarHBondContact O-N 3.28Å; K467-W535 HydrophobicContact CB-CZ2 3.81Å; K467-W535 HydrophobicContact CD-CD2 4.31Å; K467-W535 HydrophobicContact CD-CG 4.07Å
468	A	96.1	Very high	95	Very high	13 Å²	13	27.1 Å²	27.1	11%	0.107	15%	0.153	C	C	.	.	H	α-helix	trans	-60.3	-37.4	179.2	0	0	0	0	0	113	I354 L362 S464 T465 F472	I354-A468 HydrophobicContact CD1-CB 3.66Å; I354-A468 HydrophobicContact CG1-CB 4.27Å; I354-A468 HydrophobicContact CG2-CB 4.39Å; L362-A468 HydrophobicContact CD1-CB 4.05Å; S464-A468 PolarHBondContact O-N 2.92Å; S464-A468 VanDerWaalsContact O-N 3.08Å; T465-A468 PolarHBondContact O-N 3.49Å; A468-F472 PolarHBondContact O-N 2.88Å; A468-F472 VanDerWaalsContact O-N 3.13Å
469	L	97.1	Very high	94.9	Very high	3 Å²	3	33 Å²	33	2%	0.016	18%	0.176	C	C	.	.	H	α-helix	trans	-61.5	-52.4	172	174.7	64.2	0	0	0	111.6	L415 I419 L426 T465 L466 K467 E471 F472 L473 M494	L415-L469 HydrophobicContact CD1-CD1 4.28Å; L415-L469 HydrophobicContact CD2-CD1 4.23Å; L415-L469 HydrophobicContact CG-CD1 4.46Å; I419-L469 HydrophobicContact CD1-CD1 3.8Å; I419-L469 HydrophobicContact CD1-CD2 3.54Å; I419-L469 HydrophobicContact CD1-CG 4.3Å; I419-L469 HydrophobicContact CG1-CD2 4.42Å; L426-L469 HydrophobicContact CD2-CD2 4.14Å; T465-L469 PolarHBondContact O-N 3.45Å; T465-L469 VanDerWaalsContact O-N 3.08Å; L466-L469 WeakPolarHBondContact O-CB 3.15Å; L466-L469 PolarHBondContact O-N 2.98Å; K467-L469 VanDerWaalsContact C-N 3.28Å; K467-L469 PolarHBondContact O-N 3.26Å; L469-E471 VanDerWaalsContact C-N 3.32Å; L469-E471 PolarHBondContact O-N 2.93Å; L469-F472 WeakPolarHBondContact O-CB 3.35Å; L469-F472 PolarHBondContact O-N 2.92Å; L469-L473 HydrophobicContact CD1-CD1 4.31Å; L469-L473 HydrophobicContact CD1-CG 4.32Å; L469-L473 HydrophobicContact CG-CD1 4.22Å; L469-L473 WeakPolarHBondContact O-CG 3.37Å; L469-L473 PolarHBondContact O-N 2.75Å; L469-M494 HydrophobicContact CD1-CE 4.18Å
470	L	96.8	Very high	94.9	Very high	0 Å²	0	35.4 Å²	35.4	0%	0	18%	0.184	C	C	.	.	H	α-helix	trans	-65	-36	-177.7	-65.6	171.6	0	0	0	111.8	L466 K467 L473 S474 M524 L527 I528 Q531 W535	L466-L470 HydrophobicContact CD1-CD1 4.03Å; L466-L470 HydrophobicContact CD1-CG 4.1Å; L466-L470 HydrophobicContact CG-CD1 3.87Å; L466-L470 HydrophobicContact CG-CG 4.34Å; L466-L470 VanDerWaalsContact O-CG 3.27Å; L466-L470 WeakPolarHBondContact O-CG 3.25Å; L466-L470 PolarHBondContact O-N 3.43Å; K467-L470 PolarHBondContact O-N 3.26Å; K467-L470 VanDerWaalsContact O-N 3.13Å; L470-L473 HydrophobicContact CD2-CD1 4.5Å; L470-L473 PolarHBondContact O-N 3.11Å; L470-S474 WeakPolarHBondContact O-CB 3.43Å; L470-S474 PolarHBondContact O-N 2.8Å; L470-M524 HydrophobicContact CD2-CE 3.62Å; L470-M524 HydrophobicContact CD2-SD 4.47Å; L470-L527 HydrophobicContact CD1-CB 4.06Å; L470-L527 HydrophobicContact CD2-CB 3.95Å; L470-I528 HydrophobicContact CD2-CG1 3.76Å; L470-Q531 VanDerWaalsContact C-OE1 3.23Å; L470-Q531 VanDerWaalsContact CB-CD 3.43Å; L470-Q531 HydrophobicContact CB-CG 3.98Å; L470-Q531 HydrophobicContact CD1-CG 4.44Å; L470-Q531 PolarHBondContact O-NE2 3.48Å; L470-W535 HydrophobicContact CD1-CH2 3.66Å; L470-W535 HydrophobicContact CD1-CZ3 3.96Å
471	E	95.9	Very high	94.9	Very high	77 Å²	77	41.1 Å²	41.1	36%	0.36	21%	0.207	S	C	.	.	H	α-helix	trans	-61.7	-45.4	174.5	-75.9	176.5	175.1	0	0	111	K467 L469 S474 K475	K467-E471 WeakPolarHBondContact CE-OE1 3.34Å; K467-E471 HydrophobicContact CG-CG 4.28Å; K467-E471 WeakPolarHBondContact O-CB 3.43Å; K467-E471 WeakPolarHBondContact O-CG 3.35Å; K467-E471 PolarHBondContact O-N 3.28Å; L469-E471 VanDerWaalsContact C-N 3.32Å; L469-E471 PolarHBondContact O-N 2.93Å; E471-S474 WeakPolarHBondContact O-CB 3.49Å; E471-S474 PolarHBondContact O-N 3.43Å; E471-K475 WeakPolarHBondContact O-CG 3.33Å; E471-K475 PolarHBondContact O-N 3.27Å
472	F	96.6	Very high	94.9	Very high	0 Å²	0	45.1 Å²	45.1	0%	0	22%	0.22	C	C	.	.	H	α-helix	trans	-60.2	-45.7	173.1	166	-105.2	0	0	0	112.3	L362 L365 E366 V370 L376 L415 A468 L469 S474 K475 V476	L362-F472 HydrophobicContact CD2-CB 3.82Å; L362-F472 HydrophobicContact CD2-CD1 3.75Å; L362-F472 HydrophobicContact CD2-CD2 4.36Å; L362-F472 HydrophobicContact CD2-CE1 4.46Å; L362-F472 HydrophobicContact CD2-CG 3.69Å; L365-F472 HydrophobicContact CB-CD2 4.44Å; L365-F472 HydrophobicContact CB-CE2 3.52Å; L365-F472 HydrophobicContact CB-CZ 3.65Å; L365-F472 HydrophobicContact CD1-CE1 4.3Å; L365-F472 HydrophobicContact CD1-CZ 3.96Å; L365-F472 HydrophobicContact CG-CZ 4.34Å; E366-F472 HydrophobicContact CG-CD2 3.78Å; E366-F472 HydrophobicContact CG-CE2 4.33Å; V370-F472 HydrophobicContact CG1-CE2 4.03Å; L376-F472 HydrophobicContact CD2-CE1 4.47Å; L415-F472 HydrophobicContact CD2-CD1 4Å; L415-F472 HydrophobicContact CD2-CE1 3.71Å; A468-F472 PolarHBondContact O-N 2.88Å; A468-F472 VanDerWaalsContact O-N 3.13Å; L469-F472 WeakPolarHBondContact O-CB 3.35Å; L469-F472 PolarHBondContact O-N 2.92Å; F472-S474 VanDerWaalsContact C-N 3.29Å; F472-S474 PolarHBondContact O-N 3.46Å; F472-K475 WeakPolarHBondContact O-CB 3.22Å; F472-K475 PolarHBondContact O-N 3.07Å; F472-K475 VanDerWaalsContact O-N 3.14Å; F472-V476 HydrophobicContact CD2-CG2 4.42Å; F472-V476 HydrophobicContact CE1-CG2 4.03Å; F472-V476 HydrophobicContact CE2-CG2 3.82Å; F472-V476 HydrophobicContact CZ-CG2 3.59Å; F472-V476 PolarHBondContact O-N 3.03Å
473	L	96.7	Very high	94.8	Very high	0 Å²	0	44.4 Å²	44.4	0%	0	22%	0.217	C	C	.	.	H	α-helix	trans	-63.2	-36.5	177.7	-63.6	178.5	0	0	0	111.8	L376 L469 L470 V476 V477 V490 M494 M524 I528	L376-L473 HydrophobicContact CD1-CD2 3.56Å; L469-L473 HydrophobicContact CD1-CD1 4.31Å; L469-L473 HydrophobicContact CD1-CG 4.32Å; L469-L473 HydrophobicContact CG-CD1 4.22Å; L469-L473 WeakPolarHBondContact O-CG 3.37Å; L469-L473 PolarHBondContact O-N 2.75Å; L470-L473 HydrophobicContact CD2-CD1 4.5Å; L470-L473 PolarHBondContact O-N 3.11Å; L473-V476 PolarHBondContact O-N 3.39Å; L473-V477 WeakPolarHBondContact O-CG2 3.09Å; L473-V477 PolarHBondContact O-N 3.39Å; L473-V490 HydrophobicContact CB-CG1 4.04Å; L473-V490 HydrophobicContact CD2-CG1 3.8Å; L473-V490 HydrophobicContact CG-CG1 4.31Å; L473-M494 HydrophobicContact CD1-CB 4.25Å; L473-M494 HydrophobicContact CD1-CE 4.45Å; L473-M494 HydrophobicContact CD1-CG 3.86Å; L473-M494 HydrophobicContact CD2-CG 3.87Å; L473-M494 HydrophobicContact CD2-SD 4.3Å; L473-M524 HydrophobicContact CD1-CE 3.34Å; L473-I528 HydrophobicContact CB-CD1 4.17Å; L473-I528 HydrophobicContact CB-CG1 4.23Å; L473-I528 HydrophobicContact CD1-CD1 4.09Å; L473-I528 HydrophobicContact CD1-CG1 4.29Å
474	S	95.1	Very high	94.7	Very high	53 Å²	53	51.4 Å²	51.4	37%	0.371	24%	0.243	S	C	.	.	H	α-helix	trans	-63.8	-41.3	172.5	-172.8	0	0	0	0	111.9	L470 E471 F472 V476 V477 S478	L470-S474 WeakPolarHBondContact O-CB 3.43Å; L470-S474 PolarHBondContact O-N 2.8Å; E471-S474 WeakPolarHBondContact O-CB 3.49Å; E471-S474 PolarHBondContact O-N 3.43Å; F472-S474 VanDerWaalsContact C-N 3.29Å; F472-S474 PolarHBondContact O-N 3.46Å; S474-V476 PolarHBondContact O-N 3.31Å; S474-V477 PolarHBondContact O-N 3.15Å; S474-S478 WeakPolarHBondContact O-CB 3.29Å; S474-S478 PolarHBondContact O-N 3Å
475	K	95.2	Very high	94.6	Very high	65 Å²	65	50.2 Å²	50.2	28%	0.283	24%	0.235	S	C	.	.	H	α-helix	trans	-60.5	-42.8	172.3	-69.9	170.6	-175.6	171.2	0	111.9	E366 E471 F472 S478 R479	E366-K475 HydrophobicContact CG-CD 4.13Å; E366-K475 WeakPolarHBondContact OE1-CD 3.4Å; E366-K475 IonicContact OE1-NZ 2.76Å; E366-K475 PolarHBondContact OE1-NZ 2.78Å; E366-K475 IonicContact OE2-NZ 3.46Å; E366-K475 PolarHBondContact OE2-NZ 3Å; E471-K475 WeakPolarHBondContact O-CG 3.33Å; E471-K475 PolarHBondContact O-N 3.27Å; F472-K475 WeakPolarHBondContact O-CB 3.22Å; F472-K475 PolarHBondContact O-N 3.07Å; F472-K475 VanDerWaalsContact O-N 3.14Å; K475-S478 PolarHBondContact O-N 3.32Å; K475-S478 PolarHBondContact O-OG 2.98Å; K475-R479 PolarHBondContact O-N 3.08Å
476	V	95.1	Very high	94.4	Very high	0 Å²	0	52.7 Å²	52.7	0%	0	25%	0.248	C	C	.	.	H	α-helix	trans	-58.8	-50.5	173.9	173.5	0	0	0	0	110.8	V370 I375 F472 L473 S474 S478 R479 N483 M485 V490	V370-V476 HydrophobicContact CG1-CG2 4.12Å; I375-V476 HydrophobicContact CG2-CG1 3.75Å; F472-V476 HydrophobicContact CD2-CG2 4.42Å; F472-V476 HydrophobicContact CE1-CG2 4.03Å; F472-V476 HydrophobicContact CE2-CG2 3.82Å; F472-V476 HydrophobicContact CZ-CG2 3.59Å; F472-V476 PolarHBondContact O-N 3.03Å; L473-V476 PolarHBondContact O-N 3.39Å; S474-V476 PolarHBondContact O-N 3.31Å; V476-S478 VanDerWaalsContact C-N 3.29Å; V476-S478 PolarHBondContact O-N 3.33Å; V476-R479 WeakPolarHBondContact O-CA 3.35Å; V476-R479 PolarHBondContact O-N 3.16Å; V476-N483 PolarHBondContact O-ND2 3.16Å; V476-M485 HydrophobicContact CG1-CB 4.11Å; V476-V490 HydrophobicContact CG1-CG2 4Å
477	V	93.6	Very high	94.1	Very high	28 Å²	28	54 Å²	54	17%	0.17	26%	0.255	C	S	.	.	H	α-helix	trans	-60.5	-37.4	177.7	172.6	0	0	0	0	111.7	L473 S474 R479 E480 L487 V490	L473-V477 WeakPolarHBondContact O-CG2 3.09Å; L473-V477 PolarHBondContact O-N 3.39Å; S474-V477 PolarHBondContact O-N 3.15Å; V477-R479 PolarHBondContact O-N 3.46Å; V477-R479 VanDerWaalsContact O-N 3.07Å; V477-E480 VanDerWaalsContact O-CB 3.3Å; V477-E480 WeakPolarHBondContact O-CB 3.47Å; V477-E480 PolarHBondContact O-N 2.96Å; V477-L487 HydrophobicContact CG1-CB 3.94Å; V477-L487 HydrophobicContact CG2-CB 4.38Å; V477-L487 HydrophobicContact CG2-CD1 4.16Å; V477-V490 HydrophobicContact CG2-CB 4Å; V477-V490 HydrophobicContact CG2-CG1 4.33Å; V477-V490 HydrophobicContact CG2-CG2 3.81Å
478	S	93.6	Very high	93.9	Very high	80 Å²	80	54.7 Å²	54.7	56%	0.559	26%	0.256	S	S	*	.	H	α-helix	trans	-62.1	-16.8	175.6	85.1	0	0	0	0	114.2	S474 K475 V476	S474-S478 WeakPolarHBondContact O-CB 3.29Å; S474-S478 PolarHBondContact O-N 3Å; K475-S478 PolarHBondContact O-N 3.32Å; K475-S478 PolarHBondContact O-OG 2.98Å; V476-S478 VanDerWaalsContact C-N 3.29Å; V476-S478 PolarHBondContact O-N 3.33Å
479	R	93.5	Very high	93.6	Very high	124 Å²	124	54.7 Å²	54.7	47%	0.468	26%	0.257	S	S	.	.	T	Hydrogen-bonded Turn	trans	-104.8	12.5	178.5	-64.3	-62.9	-170.7	-119.4	-1.6	113.3	V370 D371 K475 V476 V477 K481 K482 N483	V370-R479 HydrophobicContact CB-CG 4.36Å; V370-R479 WeakPolarHBondContact O-CB 3.43Å; D371-R479 WeakPolarHBondContact OD1-CD 3.45Å; D371-R479 IonicContact OD1-NE 3.45Å; K475-R479 PolarHBondContact O-N 3.08Å; V476-R479 WeakPolarHBondContact O-CA 3.35Å; V476-R479 PolarHBondContact O-N 3.16Å; V477-R479 PolarHBondContact O-N 3.46Å; V477-R479 VanDerWaalsContact O-N 3.07Å; R479-K481 PolarHBondContact O-N 3.37Å; R479-K482 PolarHBondContact O-N 3.36Å; R479-N483 WeakPolarHBondContact CB-ND2 3.38Å; R479-N483 PolarHBondContact O-N 3.47Å; R479-N483 VanDerWaalsContact O-N 3.1Å; R479-N483 PolarHBondContact O-OD1 2.88Å
480	E	91.9	Very high	93.5	Very high	88 Å²	88	54.6 Å²	54.6	41%	0.411	26%	0.256	S	S	.	.	H	α-helix	trans	-41.3	-43.2	179.4	179.5	179.4	158.6	0	0	113.8	V477 K482 N483 R484 N486	V477-E480 VanDerWaalsContact O-CB 3.3Å; V477-E480 WeakPolarHBondContact O-CB 3.47Å; V477-E480 PolarHBondContact O-N 2.96Å; E480-K482 PolarHBondContact O-N 3.14Å; E480-K482 VanDerWaalsContact O-N 3.12Å; E480-N483 WeakPolarHBondContact CA-OD1 3.42Å; E480-N483 PolarHBondContact N-OD1 3.12Å; E480-R484 VanDerWaalsContact O-CA 3.3Å; E480-R484 WeakPolarHBondContact O-CA 3.38Å; E480-R484 PolarHBondContact O-N 2.85Å; E480-N486 HydrophobicContact CG-CB 3.97Å; E480-N486 VanDerWaalsContact OE1-CB 3.29Å; E480-N486 WeakPolarHBondContact OE1-CB 3.34Å; E480-N486 WeakPolarHBondContact OE2-CA 3.47Å; E480-N486 WeakPolarHBondContact OE2-CB 3.49Å
481	K	91.8	Very high	93.3	Very high	204 Å²	204	54.6 Å²	54.6	89%	0.887	26%	0.256	S	S	*	.	H	α-helix	trans	-58.6	-25.4	-179.8	-65.7	-174.7	178.6	-178	0	114.5	R479	R479-K481 PolarHBondContact O-N 3.37Å
482	K	92.6	Very high	93	Very high	121 Å²	121	51 Å²	51	53%	0.526	24%	0.24	S	C	.	.	H	α-helix	trans	-100.2	-54.8	176.2	-72.4	-179.2	170.4	-177	0	111.4	D371 R479 E480 R484	D371-K482 HydrophobicContact CB-CD 4.12Å; D371-K482 VanDerWaalsContact OD1-CD 3.32Å; D371-K482 WeakPolarHBondContact OD1-CD 3.38Å; D371-K482 IonicContact OD1-NZ 3.19Å; D371-K482 WeakPolarHBondContact OD2-CD 3.44Å; D371-K482 IonicContact OD2-NZ 3.88Å; D371-K482 PolarHBondContact OD2-NZ 3.22Å; R479-K482 PolarHBondContact O-N 3.36Å; E480-K482 PolarHBondContact O-N 3.14Å; E480-K482 VanDerWaalsContact O-N 3.12Å; K482-R484 VanDerWaalsContact C-N 3.34Å; K482-R484 PolarHBondContact O-N 3.34Å
483	N	93.3	Very high	92.8	Very high	0 Å²	0	51.1 Å²	51.1	0%	0	24%	0.24	C	C	.	.	H	α-helix	trans	-82.3	-8	-170.4	64.6	25.2	0	0	0	114.4	V370 S372 E373 G374 I375 V476 R479 E480 M485	V370-N483 WeakPolarHBondContact O-CB 3.2Å; V370-N483 PolarHBondContact O-ND2 2.92Å; S372-N483 WeakPolarHBondContact O-CB 3.3Å; E373-N483 WeakPolarHBondContact CA-O 3.21Å; G374-N483 PolarHBondContact N-O 3.29Å; I375-N483 HydrophobicContact CG2-CB 4.23Å; V476-N483 PolarHBondContact O-ND2 3.16Å; R479-N483 WeakPolarHBondContact CB-ND2 3.38Å; R479-N483 PolarHBondContact O-N 3.47Å; R479-N483 VanDerWaalsContact O-N 3.1Å; R479-N483 PolarHBondContact O-OD1 2.88Å; E480-N483 WeakPolarHBondContact CA-OD1 3.42Å; E480-N483 PolarHBondContact N-OD1 3.12Å; N483-M485 PolarHBondContact O-N 3.45Å; N483-M485 WeakPolarHBondContact OD1-CB 3.41Å; N483-M485 PolarHBondContact OD1-N 3.48Å
484	R	92.3	Very high	92.6	Very high	160 Å²	160	51.2 Å²	51.2	60%	0.604	24%	0.241	S	C	*	.			trans	61.7	18.3	-176.9	-50.9	-59.3	-170.1	160.3	2.7	115	E373 E480 K482	E373-R484 HydrophobicContact CG-CB 4.43Å; E373-R484 HydrophobicContact CG-CG 3.99Å; E373-R484 WeakPolarHBondContact OE1-CG 3.34Å; E480-R484 VanDerWaalsContact O-CA 3.3Å; E480-R484 WeakPolarHBondContact O-CA 3.38Å; E480-R484 PolarHBondContact O-N 2.85Å; K482-R484 VanDerWaalsContact C-N 3.34Å; K482-R484 PolarHBondContact O-N 3.34Å
485	M	91.1	Very high	92.5	Very high	0 Å²	0	48.7 Å²	48.7	0%	0	22%	0.223	C	C	.	.			trans	-106	96.9	-178.5	-64.4	-54.3	-61.8	0	0	111	I375 R377 V476 N483 A489 V490 I493	I375-M485 HydrophobicContact CG2-CG 4.13Å; I375-M485 WeakPolarHBondContact O-CG 3.39Å; R377-M485 HydrophobicContact CB-CE 3.86Å; R377-M485 HydrophobicContact CB-SD 3.87Å; V476-M485 HydrophobicContact CG1-CB 4.11Å; N483-M485 PolarHBondContact O-N 3.45Å; N483-M485 WeakPolarHBondContact OD1-CB 3.41Å; N483-M485 PolarHBondContact OD1-N 3.48Å; M485-A489 HydrophobicContact CE-CB 3.76Å; M485-V490 HydrophobicContact CB-CG2 3.83Å; M485-V490 HydrophobicContact CE-CG2 4.2Å; M485-I493 HydrophobicContact CE-CD1 3.46Å; M485-I493 VanDerWaalsContact CE-CD1 3.46Å
486	N	91.2	Very high	92.1	Very high	53 Å²	53	45.6 Å²	45.6	28%	0.283	21%	0.21	S	C	.	.			trans	-80.1	169.8	176.1	76.1	23.7	0	0	0	112.3	E480 W488 A489 V490	E480-N486 HydrophobicContact CG-CB 3.97Å; E480-N486 VanDerWaalsContact OE1-CB 3.29Å; E480-N486 WeakPolarHBondContact OE1-CB 3.34Å; E480-N486 WeakPolarHBondContact OE2-CA 3.47Å; E480-N486 WeakPolarHBondContact OE2-CB 3.49Å; N486-W488 VanDerWaalsContact C-N 3.26Å; N486-W488 PolarHBondContact O-N 3.41Å; N486-W488 WeakPolarHBondContact OD1-CA 3.41Å; N486-W488 WeakPolarHBondContact OD1-CB 3.34Å; N486-W488 PolarHBondContact OD1-N 3.1Å; N486-A489 PolarHBondContact O-N 2.96Å; N486-A489 PolarHBondContact OD1-N 3.29Å; N486-V490 WeakPolarHBondContact O-CG2 3.42Å; N486-V490 PolarHBondContact O-N 2.88Å
487	L	91.6	Very high	91.9	Very high	29 Å²	29	45.9 Å²	45.9	15%	0.152	21%	0.211	C	C	.	.	H	α-helix	trans	-57.4	-34.8	-178.8	-178.8	58.6	0	0	0	113.6	L273 V477 A491 R525 I528 R529	L273-L487 HydrophobicContact CD1-CD2 4.3Å; V477-L487 HydrophobicContact CG1-CB 3.94Å; V477-L487 HydrophobicContact CG2-CB 4.38Å; V477-L487 HydrophobicContact CG2-CD1 4.16Å; L487-A491 WeakPolarHBondContact O-CB 3.47Å; L487-A491 PolarHBondContact O-N 3.23Å; L487-R525 HydrophobicContact CG-CB 4.46Å; L487-R525 HydrophobicContact CG-CG 4.15Å; L487-I528 HydrophobicContact CD1-CB 3.91Å; L487-I528 HydrophobicContact CD1-CD1 4.3Å; L487-I528 HydrophobicContact CD1-CG2 3.62Å; L487-R529 HydrophobicContact CD2-CB 4.43Å
488	W	90.3	Very high	91.8	Very high	50 Å²	50	44.8 Å²	44.8	19%	0.189	20%	0.204	C	C	.	.	H	α-helix	trans	-67.9	-51.6	176.7	-174.8	-108.4	0	0	0	110.7	C93 N486 V490 A491 T492 E518 A521 D522	C93-W488 PolarHBondContact SG-NE1 3.14Å; C93-W488 VanDerWaalsContact SG-NE1 3.42Å; N486-W488 VanDerWaalsContact C-N 3.26Å; N486-W488 PolarHBondContact O-N 3.41Å; N486-W488 WeakPolarHBondContact OD1-CA 3.41Å; N486-W488 WeakPolarHBondContact OD1-CB 3.34Å; N486-W488 PolarHBondContact OD1-N 3.1Å; W488-V490 PolarHBondContact O-N 3.21Å; W488-A491 PolarHBondContact O-N 3.48Å; W488-T492 WeakPolarHBondContact O-CB 3.35Å; W488-T492 PolarHBondContact O-N 2.87Å; W488-T492 PolarHBondContact O-OG1 3.2Å; W488-E518 HydrophobicContact CH2-CB 4.11Å; W488-E518 HydrophobicContact CH2-CG 4.42Å; W488-E518 HydrophobicContact CZ2-CB 4.35Å; W488-E518 HydrophobicContact CZ2-CG 4.19Å; W488-A521 HydrophobicContact CH2-CB 4.17Å; W488-A521 HydrophobicContact CZ2-CB 4.41Å; W488-A521 HydrophobicContact CZ3-CB 4.41Å; W488-D522 WeakPolarHBondContact CZ3-OD1 3.42Å
489	A	91.1	Very high	91.4	Very high	14 Å²	14	41 Å²	41	12%	0.116	18%	0.178	C	C	.	.	H	α-helix	trans	-58.5	-48.1	179.8	0	0	0	0	0	112.8	M485 N486 A491 T492 I493	M485-A489 HydrophobicContact CE-CB 3.76Å; N486-A489 PolarHBondContact O-N 2.96Å; N486-A489 PolarHBondContact OD1-N 3.29Å; A489-A491 PolarHBondContact O-N 3.37Å; A489-T492 PolarHBondContact O-N 3.21Å; A489-I493 VanDerWaalsContact O-CD1 3.3Å; A489-I493 WeakPolarHBondContact O-CD1 3.48Å; A489-I493 WeakPolarHBondContact O-CG1 3.48Å; A489-I493 PolarHBondContact O-N 3.38Å; A489-I493 VanDerWaalsContact O-N 3.14Å
490	V	93.9	Very high	90.8	Very high	0 Å²	0	36.4 Å²	36.4	0%	0	16%	0.162	C	C	.	.	H	α-helix	trans	-61.9	-44	178.4	176.2	0	0	0	0	111.3	L376 L473 V476 V477 M485 N486 W488 M494 I528	L376-V490 HydrophobicContact CD1-CG1 4.15Å; L473-V490 HydrophobicContact CB-CG1 4.04Å; L473-V490 HydrophobicContact CD2-CG1 3.8Å; L473-V490 HydrophobicContact CG-CG1 4.31Å; V476-V490 HydrophobicContact CG1-CG2 4Å; V477-V490 HydrophobicContact CG2-CB 4Å; V477-V490 HydrophobicContact CG2-CG1 4.33Å; V477-V490 HydrophobicContact CG2-CG2 3.81Å; M485-V490 HydrophobicContact CB-CG2 3.83Å; M485-V490 HydrophobicContact CE-CG2 4.2Å; N486-V490 WeakPolarHBondContact O-CG2 3.42Å; N486-V490 PolarHBondContact O-N 2.88Å; W488-V490 PolarHBondContact O-N 3.21Å; V490-M494 WeakPolarHBondContact O-CB 3.26Å; V490-M494 VanDerWaalsContact O-CG 3.3Å; V490-M494 WeakPolarHBondContact O-CG 3.47Å; V490-M494 PolarHBondContact O-N 3.26Å; V490-M494 VanDerWaalsContact O-N 3.13Å; V490-I528 HydrophobicContact CG1-CD1 4.16Å
491	A	92.8	Very high	90.1	Very high	0 Å²	0	32.9 Å²	32.9	0%	0	15%	0.146	C	C	.	.	H	α-helix	trans	-65.1	-44.3	179.6	0	0	0	0	0	112.5	L487 W488 A489 I493 M494 A495 M524 R525 I528	L487-A491 WeakPolarHBondContact O-CB 3.47Å; L487-A491 PolarHBondContact O-N 3.23Å; W488-A491 PolarHBondContact O-N 3.48Å; A489-A491 PolarHBondContact O-N 3.37Å; A491-I493 PolarHBondContact O-N 2.95Å; A491-M494 PolarHBondContact O-N 3.47Å; A491-A495 VanDerWaalsContact O-CB 3.23Å; A491-A495 WeakPolarHBondContact O-CB 3.16Å; A491-A495 PolarHBondContact O-N 3.26Å; A491-M524 HydrophobicContact CB-CB 3.94Å; A491-M524 HydrophobicContact CB-CG 3.97Å; A491-R525 HydrophobicContact CB-CB 4.37Å; A491-R525 HydrophobicContact CB-CG 3.37Å; A491-I528 HydrophobicContact CB-CD1 4.28Å
492	T	89.9	Confident	88.9	Confident	2 Å²	2	26.9 Å²	26.9	1%	0.012	12%	0.12	C	C	.	.	H	α-helix	trans	-63.6	-38.6	179.7	-61.4	0	0	0	0	112.8	C93 F97 W488 A489 P496 A521	C93-T492 VanDerWaalsContact O-CG2 3.3Å; C93-T492 WeakPolarHBondContact O-CG2 3.36Å; C93-T492 WeakPolarHBondContact SG-CB 3.24Å; C93-T492 VanDerWaalsContact SG-CG2 3.59Å; C93-T492 PolarHBondContact SG-OG1 2.93Å; F97-T492 HydrophobicContact CB-CG2 3.66Å; F97-T492 HydrophobicContact CD2-CG2 4.11Å; F97-T492 WeakPolarHBondContact CD2-O 3.27Å; F97-T492 HydrophobicContact CG-CG2 4.35Å; W488-T492 WeakPolarHBondContact O-CB 3.35Å; W488-T492 PolarHBondContact O-N 2.87Å; W488-T492 PolarHBondContact O-OG1 3.2Å; A489-T492 PolarHBondContact O-N 3.21Å; T492-P496 WeakPolarHBondContact O-CD 3.29Å; T492-A521 VanDerWaalsContact OG1-CB 3.23Å; T492-A521 WeakPolarHBondContact OG1-CB 3.24Å
493	I	91.5	Very high	87.3	Confident	3 Å²	3	22.2 Å²	22.2	2%	0.015	10%	0.104	C	C	.	.	H	α-helix	trans	-72.1	-35.6	177.1	-67.3	158	0	0	0	112	L376 R377 K416 M485 A489 A491 N497	L376-I493 HydrophobicContact CB-CG2 4.27Å; R377-I493 HydrophobicContact CB-CD1 3.56Å; R377-I493 HydrophobicContact CG-CD1 3.95Å; K416-I493 HydrophobicContact CD-CG2 4.03Å; M485-I493 HydrophobicContact CE-CD1 3.46Å; M485-I493 VanDerWaalsContact CE-CD1 3.46Å; A489-I493 VanDerWaalsContact O-CD1 3.3Å; A489-I493 WeakPolarHBondContact O-CD1 3.48Å; A489-I493 WeakPolarHBondContact O-CG1 3.48Å; A489-I493 PolarHBondContact O-N 3.38Å; A489-I493 VanDerWaalsContact O-N 3.14Å; A491-I493 PolarHBondContact O-N 2.95Å; I493-N497 PolarHBondContact O-ND2 2.91Å
494	M	94.1	Very high	85.9	Confident	2 Å²	2	22.6 Å²	22.6	1%	0.01	11%	0.106	C	C	.	.	H	α-helix	trans	-85.7	-24.1	-176.9	-67	-58.5	-55.6	0	0	113.4	L376 K416 I419 L469 L473 V490 A491 N497 L498 M524	L376-M494 HydrophobicContact CD1-SD 4.49Å; L376-M494 HydrophobicContact CD2-SD 4.08Å; K416-M494 HydrophobicContact CD-SD 4.16Å; K416-M494 HydrophobicContact CG-CE 4.37Å; K416-M494 HydrophobicContact CG-SD 3.85Å; I419-M494 HydrophobicContact CD1-CE 3.98Å; L469-M494 HydrophobicContact CD1-CE 4.18Å; L473-M494 HydrophobicContact CD1-CB 4.25Å; L473-M494 HydrophobicContact CD1-CE 4.45Å; L473-M494 HydrophobicContact CD1-CG 3.86Å; L473-M494 HydrophobicContact CD2-CG 3.87Å; L473-M494 HydrophobicContact CD2-SD 4.3Å; V490-M494 WeakPolarHBondContact O-CB 3.26Å; V490-M494 VanDerWaalsContact O-CG 3.3Å; V490-M494 WeakPolarHBondContact O-CG 3.47Å; V490-M494 PolarHBondContact O-N 3.26Å; V490-M494 VanDerWaalsContact O-N 3.13Å; A491-M494 PolarHBondContact O-N 3.47Å; M494-N497 PolarHBondContact O-N 3.45Å; M494-N497 VanDerWaalsContact O-N 3.11Å; M494-L498 PolarHBondContact O-N 2.97Å; M494-M524 HydrophobicContact CB-CE 3.82Å; M494-M524 HydrophobicContact CB-CG 4.41Å
495	A	91.1	Very high	84.5	Confident	0 Å²	0	19.1 Å²	19.1	0%	0	10%	0.104	C	C	.	.	H	α-helix	trans	-57.1	-46.9	179.6	0	0	0	0	0	113.7	A491 N497 L498 F499 A520 M524	A491-A495 VanDerWaalsContact O-CB 3.23Å; A491-A495 WeakPolarHBondContact O-CB 3.16Å; A491-A495 PolarHBondContact O-N 3.26Å; A495-N497 VanDerWaalsContact C-N 3.29Å; A495-N497 PolarHBondContact O-N 3.39Å; A495-L498 PolarHBondContact O-N 2.94Å; A495-F499 HydrophobicContact CB-CD2 3.95Å; A495-F499 HydrophobicContact CB-CE2 4.21Å; A495-F499 WeakPolarHBondContact O-CB 3.34Å; A495-F499 VanDerWaalsContact O-CD2 3.25Å; A495-F499 WeakPolarHBondContact O-CD2 3.41Å; A495-F499 PolarHBondContact O-N 2.9Å; A495-A520 HydrophobicContact CB-CB 3.96Å; A495-M524 HydrophobicContact CB-CB 4.19Å
496	P	88.6	Confident	83.2	Confident	0 Å²	0	19.5 Å²	19.5	0%	0	11%	0.107	C	C	.	.	H	α-helix	trans	-51.5	-46.2	171.1	-29.8	35.5	0	0	0	113.1	F97 E100 V101 I104 T492 L498 L500	F97-P496 HydrophobicContact CD2-CG 3.51Å; F97-P496 HydrophobicContact CE2-CG 3.51Å; F97-P496 HydrophobicContact CG-CG 4.17Å; F97-P496 HydrophobicContact CZ-CG 4.17Å; E100-P496 HydrophobicContact CB-CB 4.37Å; E100-P496 HydrophobicContact CB-CG 4.26Å; E100-P496 HydrophobicContact CG-CB 3.91Å; E100-P496 HydrophobicContact CG-CG 4.23Å; V101-P496 HydrophobicContact CG2-CB 4.34Å; V101-P496 HydrophobicContact CG2-CG 4.21Å; I104-P496 HydrophobicContact CD1-CB 3.65Å; T492-P496 WeakPolarHBondContact O-CD 3.29Å; P496-L498 VanDerWaalsContact C-N 3.26Å; P496-L498 PolarHBondContact O-N 3.24Å; P496-L500 HydrophobicContact CB-CD1 4.11Å; P496-L500 WeakPolarHBondContact O-CA 3.49Å; P496-L500 VanDerWaalsContact O-CB 3.29Å; P496-L500 WeakPolarHBondContact O-CB 2.92Å; P496-L500 PolarHBondContact O-N 3.44Å
497	N	90.5	Very high	81.7	Confident	5 Å²	5	21.7 Å²	21.7	3%	0.027	11%	0.111	C	C	.	.	H	α-helix	trans	-69.7	-20.7	-175.9	-74.8	-70.5	0	0	0	114.2	E100 K416 R420 I493 M494 A495	E100-N497 VanDerWaalsContact CG-ND2 3.3Å; E100-N497 WeakPolarHBondContact CG-ND2 2.73Å; E100-N497 PolarHBondContact OE1-ND2 2.85Å; E100-N497 PolarHBondContact OE1-OD1 2.98Å; K416-N497 PolarHBondContact O-OD1 3.28Å; R420-N497 PolarHBondContact NH1-OD1 3.24Å; I493-N497 PolarHBondContact O-ND2 2.91Å; M494-N497 PolarHBondContact O-N 3.45Å; M494-N497 VanDerWaalsContact O-N 3.11Å; A495-N497 VanDerWaalsContact C-N 3.29Å; A495-N497 PolarHBondContact O-N 3.39Å
498	L	90.9	Very high	80	Confident	6 Å²	6	20.7 Å²	20.7	3%	0.031	11%	0.106	C	C	.	.	H	α-helix	trans	-101.1	-31.8	179.3	-165.7	66.1	0	0	0	113.2	I419 L426 L427 L432 L466 M494 A495 P496 M524 L527	I419-L498 HydrophobicContact CG2-CD1 4.44Å; L426-L498 HydrophobicContact CB-CD1 4.06Å; L426-L498 HydrophobicContact CD2-CD1 4.08Å; L426-L498 HydrophobicContact CG-CD1 4.4Å; L427-L498 HydrophobicContact CD1-CD1 4.3Å; L427-L498 HydrophobicContact CD1-CD2 3.95Å; L427-L498 HydrophobicContact CD1-CG 3.7Å; L427-L498 HydrophobicContact CD2-CD1 4.18Å; L427-L498 HydrophobicContact CD2-CD2 4.29Å; L427-L498 HydrophobicContact CD2-CG 4.34Å; L427-L498 HydrophobicContact CG-CD1 3.87Å; L427-L498 HydrophobicContact CG-CD2 4.26Å; L427-L498 HydrophobicContact CG-CG 3.85Å; L432-L498 WeakPolarHBondContact CD1-O 3.48Å; L466-L498 HydrophobicContact CD1-CD1 4.19Å; L466-L498 HydrophobicContact CD1-CD2 4.24Å; M494-L498 PolarHBondContact O-N 2.97Å; A495-L498 PolarHBondContact O-N 2.94Å; P496-L498 VanDerWaalsContact C-N 3.26Å; P496-L498 PolarHBondContact O-N 3.24Å; L498-M524 HydrophobicContact CD2-CE 4.38Å; L498-M524 HydrophobicContact CD2-SD 3.62Å; L498-L527 HydrophobicContact CD2-CD1 4.03Å
499	F	86.3	Confident	78.4	Confident	0 Å²	0	23 Å²	23	0%	0	13%	0.126	C	C	.	.	H	α-helix	trans	-110.2	-20.7	-172.8	-58.3	-63.5	0	0	0	115.6	L427 L432 F435 A495 H501 S506 L508 A520 V523 M524 L527	L427-F499 HydrophobicContact CD1-CD1 3.77Å; L427-F499 HydrophobicContact CD1-CE1 3.4Å; L427-F499 VanDerWaalsContact CD1-CE1 3.4Å; L427-F499 HydrophobicContact CD1-CZ 4.33Å; L432-F499 HydrophobicContact CD1-CD1 4.36Å; F435-F499 HydrophobicContact CB-CE1 4.11Å; A495-F499 HydrophobicContact CB-CD2 3.95Å; A495-F499 HydrophobicContact CB-CE2 4.21Å; A495-F499 WeakPolarHBondContact O-CB 3.34Å; A495-F499 VanDerWaalsContact O-CD2 3.25Å; A495-F499 WeakPolarHBondContact O-CD2 3.41Å; A495-F499 PolarHBondContact O-N 2.9Å; F499-H501 PolarHBondContact O-N 3.49Å; F499-S506 PolarHBondContact O-OG 3.03Å; F499-S506 VanDerWaalsContact O-OG 3.13Å; F499-L508 HydrophobicContact CB-CD1 3.47Å; F499-L508 VanDerWaalsContact CB-CD1 3.47Å; F499-A520 HydrophobicContact CD2-CB 4.32Å; F499-V523 HydrophobicContact CE1-CG1 4.32Å; F499-V523 HydrophobicContact CE2-CB 4.41Å; F499-V523 HydrophobicContact CZ-CB 4.02Å; F499-V523 HydrophobicContact CZ-CG1 3.74Å; F499-M524 HydrophobicContact CE2-CB 4.19Å; F499-L527 HydrophobicContact CZ-CD1 4.23Å
500	L	79.9	Confident	76.5	Confident	27 Å²	27	28.5 Å²	28.5	14%	0.141	15%	0.153	C	C	.	.			trans	-97.6	80	173.8	-64.4	173.8	0	0	0	109.7	V101 I104 P496 L508	V101-L500 HydrophobicContact CG1-CD1 4.42Å; V101-L500 HydrophobicContact CG2-CD1 3.68Å; I104-L500 HydrophobicContact CD1-CB 4.32Å; I104-L500 HydrophobicContact CD1-CD1 4.43Å; P496-L500 HydrophobicContact CB-CD1 4.11Å; P496-L500 WeakPolarHBondContact O-CA 3.49Å; P496-L500 VanDerWaalsContact O-CB 3.29Å; P496-L500 WeakPolarHBondContact O-CB 2.92Å; P496-L500 PolarHBondContact O-N 3.44Å; L500-L508 HydrophobicContact CD2-CB 3.52Å; L500-L508 HydrophobicContact CD2-CD1 3.56Å; L500-L508 HydrophobicContact CD2-CG 4.17Å; L500-L508 HydrophobicContact CG-CD1 3.82Å
501	H	76.4	Confident	74.4	Confident	15 Å²	15	31.1 Å²	31.1	7%	0.069	18%	0.18	C	C	.	.			trans	-98.9	131.9	176.6	-165.8	-88.6	0	0	0	112.1	R420 L422 P423 P425 L432 F499 A503 V504	R420-H501 PolarHBondContact O-NE2 3.34Å; L422-H501 PolarHBondContact O-CE1 3.39Å; L422-H501 VanDerWaalsContact O-CE1 3.24Å; L422-H501 PolarHBondContact O-NE2 3.17Å; P423-H501 PolarHBondContact O-CE1 2.88Å; P425-H501 HydrophobicContact CB-CB 3.8Å; P425-H501 HydrophobicContact CG-CB 4.17Å; L432-H501 HydrophobicContact CD2-CB 3.99Å; F499-H501 PolarHBondContact O-N 3.49Å; H501-A503 WeakPolarHBondContact CE1-CB 3.34Å; H501-A503 VanDerWaalsContact ND1-CB 3.29Å; H501-A503 WeakPolarHBondContact ND1-CB 3.42Å; H501-A503 PolarHBondContact ND1-N 2.94Å; H501-A503 PolarHBondContact O-N 3.02Å; H501-V504 PolarHBondContact O-N 2.86Å; H501-V504 VanDerWaalsContact O-O 3.09Å
502	K	67.8	Low	72.4	Confident	78 Å²	78	35.6 Å²	35.6	34%	0.339	22%	0.217	S	C	.	.	T	Hydrogen-bonded Turn	trans	-59.2	-20.8	-175.9	-52.6	-176.9	-174.8	-160.3	0	114.1	G107 C108 R326	G107-K502 PolarHBondContact O-NZ 3.46Å; C108-K502 WeakPolarHBondContact SG-CD 3.33Å; C108-K502 WeakPolarHBondContact SG-CE 3.38Å; C108-K502 PolarHBondContact SG-NZ 3.05Å; C108-K502 VanDerWaalsContact SG-NZ 3.38Å; R326-K502 VanDerWaalsContact NH2-C 3.31Å; R326-K502 PolarHBondContact NH2-O 3Å
503	A	59.7	Low	70.9	Confident	23 Å²	23	41.9 Å²	41.9	19%	0.19	25%	0.246	C	C	.	.	T	Hydrogen-bonded Turn	trans	-91	-7.4	-174.8	0	0	0	0	0	114.3	H501	H501-A503 WeakPolarHBondContact CE1-CB 3.34Å; H501-A503 VanDerWaalsContact ND1-CB 3.29Å; H501-A503 WeakPolarHBondContact ND1-CB 3.42Å; H501-A503 PolarHBondContact ND1-N 2.94Å; H501-A503 PolarHBondContact O-N 3.02Å
504	V	63.7	Low	69.2	Low	7 Å²	7	48.4 Å²	48.4	4%	0.042	27%	0.274	C	S	.	.	S	Bend	trans	-132.2	122.4	-176.9	-176.7	0	0	0	0	108.4	H321 A429 L432 H501 S506	H321-V504 HydrophobicContact CB-CG1 4.48Å; A429-V504 HydrophobicContact CB-CG2 3.53Å; L432-V504 HydrophobicContact CD2-CB 3.86Å; L432-V504 HydrophobicContact CD2-CG1 4.17Å; L432-V504 HydrophobicContact CD2-CG2 4.05Å; H501-V504 PolarHBondContact O-N 2.86Å; H501-V504 VanDerWaalsContact O-O 3.09Å; V504-S506 PolarHBondContact O-N 2.85Å
505	P	63.1	Low	67.7	Low	88 Å²	88	50.1 Å²	50.1	57%	0.571	29%	0.293	S	S	*	.			trans	-55.5	111.5	166.7	-23.1	34.4	0	0	0	108.8	N433	N433-P505 PolarHBondContact ND2-O 3.08Å
506	S	62.4	Low	66.5	Low	7 Å²	7	51.3 Å²	51.3	5%	0.049	30%	0.298	C	S	.	.			trans	-89.6	132.8	-172.6	-170.9	0	0	0	0	109.3	F499 V504 L508 T509	F499-S506 PolarHBondContact O-OG 3.03Å; F499-S506 VanDerWaalsContact O-OG 3.13Å; V504-S506 PolarHBondContact O-N 2.85Å; S506-L508 PolarHBondContact O-N 2.78Å; S506-L508 WeakPolarHBondContact OG-CB 3.37Å; S506-L508 WeakPolarHBondContact OG-CG 3.49Å; S506-L508 PolarHBondContact OG-N 3.21Å; S506-T509 PolarHBondContact O-N 3.09Å; S506-T509 PolarHBondContact O-OG1 3.22Å; S506-T509 VanDerWaalsContact O-OG1 3.05Å
507	R	60.5	Low	65.6	Low	99 Å²	99	51.3 Å²	51.3	37%	0.374	30%	0.298	S	S	.	.	T	Hydrogen-bonded Turn	trans	-55.5	-9.2	168.7	-82.5	-172	156.8	-164.7	-3.7	113.7	E317 T509	E317-R507 PolarHBondContact O-NH2 2.93Å; E317-R507 IonicContact OE2-NH2 3.53Å; E317-R507 PolarHBondContact OE2-NH2 3.21Å; R507-T509 VanDerWaalsContact C-N 3.31Å
508	L	56.6	Low	64.8	Low	9 Å²	9	54.1 Å²	54.1	5%	0.047	31%	0.311	C	S	.	.	T	Hydrogen-bonded Turn	trans	-71.7	-12.2	171.8	-69.9	178.5	0	0	0	115.7	F499 L500 S506 Q516 A520	F499-L508 HydrophobicContact CB-CD1 3.47Å; F499-L508 VanDerWaalsContact CB-CD1 3.47Å; L500-L508 HydrophobicContact CD2-CB 3.52Å; L500-L508 HydrophobicContact CD2-CD1 3.56Å; L500-L508 HydrophobicContact CD2-CG 4.17Å; L500-L508 HydrophobicContact CG-CD1 3.82Å; S506-L508 PolarHBondContact O-N 2.78Å; S506-L508 WeakPolarHBondContact OG-CB 3.37Å; S506-L508 WeakPolarHBondContact OG-CG 3.49Å; S506-L508 PolarHBondContact OG-N 3.21Å; L508-Q516 HydrophobicContact CD2-CB 4.24Å; L508-Q516 PolarHBondContact O-NE2 3.39Å; L508-Q516 PolarHBondContact O-OE1 3.18Å; L508-Q516 VanDerWaalsContact O-OE1 3.11Å; L508-A520 HydrophobicContact CD1-CB 4.49Å; L508-A520 HydrophobicContact CD2-CB 3.96Å
509	T	55.7	Low	64.2	Low	99 Å²	99	58 Å²	58	61%	0.607	33%	0.328	S	S	*	.	S	Bend	trans	-99.6	-10.4	177.7	54.4	0	0	0	0	113.7	S506 R507 G511	S506-T509 PolarHBondContact O-N 3.09Å; S506-T509 PolarHBondContact O-OG1 3.22Å; S506-T509 VanDerWaalsContact O-OG1 3.05Å; R507-T509 VanDerWaalsContact C-N 3.31Å; T509-G511 PolarHBondContact O-N 3.07Å
510	D	52	Low	64.1	Low	129 Å²	129	58 Å²	58	69%	0.69	33%	0.328	S	S	*	.	S	Bend	trans	-91.2	94.9	-178.9	-66.2	-26.8	0	0	0	110.7	Q516	D510-Q516 PolarHBondContact O-NE2 3.12Å
511	G	49.6	Very low	64.4	Low	55 Å²	55	56.8 Å²	56.8	57%	0.567	32%	0.321	S	S	*	.	S	Bend	trans	123.3	-179.5	172	0	0	0	0	0	115.8	T509 E513 Q516	T509-G511 PolarHBondContact O-N 3.07Å; G511-E513 PolarHBondContact O-N 2.71Å; G511-Q516 PolarHBondContact O-NE2 3.14Å; G511-Q516 VanDerWaalsContact O-NE2 3.12Å; G511-Q516 PolarHBondContact O-OE1 3.44Å
512	A	49.4	Very low	65	Low	93 Å²	93	59.1 Å²	59.1	77%	0.769	33%	0.334	S	S	*	.			trans	-69.4	124.9	-168.7	0	0	0	0	0	113	K514 G515	A512-K514 PolarHBondContact O-N 3.46Å; A512-K514 VanDerWaalsContact O-N 3.14Å; A512-G515 PolarHBondContact O-N 3.28Å
513	E	58.4	Low	66.1	Low	135 Å²	135	55.5 Å²	55.5	63%	0.631	32%	0.319	S	S	*	.	H	α-helix	trans	-44.5	-50.7	-162.3	-69.2	169.1	167.3	0	0	115.2	W98 G511 G515 Q516	W98-E513 HydrophobicContact CH2-CB 3.57Å; W98-E513 HydrophobicContact CH2-CG 3.92Å; W98-E513 HydrophobicContact CZ2-CB 3.56Å; W98-E513 HydrophobicContact CZ2-CG 4.38Å; W98-E513 WeakPolarHBondContact CZ2-O 3.5Å; G511-E513 PolarHBondContact O-N 2.71Å; E513-G515 VanDerWaalsContact C-N 3.32Å; E513-G515 PolarHBondContact O-N 2.96Å; E513-G515 VanDerWaalsContact O-N 3.16Å; E513-Q516 PolarHBondContact O-N 3.02Å
514	K	55.6	Low	67.8	Low	140 Å²	140	54.4 Å²	54.4	61%	0.609	31%	0.309	S	S	*	.	H	α-helix	trans	-59.9	-34.5	-167.8	-166.6	175.1	-179.8	-178.8	0	114.7	L94 A512	L94-K514 HydrophobicContact CD1-CG 4.37Å; A512-K514 PolarHBondContact O-N 3.46Å; A512-K514 VanDerWaalsContact O-N 3.14Å
515	G	63.2	Low	69.2	Low	38 Å²	38	54.8 Å²	54.8	39%	0.392	31%	0.31	S	S	.	.	H	α-helix	trans	-81.2	-23.2	-174.5	0	0	0	0	0	115	A512 E513 K519	A512-G515 PolarHBondContact O-N 3.28Å; E513-G515 VanDerWaalsContact C-N 3.32Å; E513-G515 PolarHBondContact O-N 2.96Å; E513-G515 VanDerWaalsContact O-N 3.16Å; G515-K519 WeakPolarHBondContact O-CB 3.2Å; G515-K519 WeakPolarHBondContact O-CG 3.31Å; G515-K519 PolarHBondContact O-N 3.46Å
516	Q	67.1	Low	70.6	Confident	25 Å²	25	51 Å²	51	12%	0.117	29%	0.285	C	S	.	.	H	α-helix	trans	-74.3	-35.3	-177	-70.1	155.2	-26.6	0	0	111.9	R439 L508 D510 G511 E513 A520	R439-Q516 PolarHBondContact NH1-O 2.99Å; R439-Q516 VanDerWaalsContact NH1-O 3.08Å; L508-Q516 HydrophobicContact CD2-CB 4.24Å; L508-Q516 PolarHBondContact O-NE2 3.39Å; L508-Q516 PolarHBondContact O-OE1 3.18Å; L508-Q516 VanDerWaalsContact O-OE1 3.11Å; D510-Q516 PolarHBondContact O-NE2 3.12Å; G511-Q516 PolarHBondContact O-NE2 3.14Å; G511-Q516 VanDerWaalsContact O-NE2 3.12Å; G511-Q516 PolarHBondContact O-OE1 3.44Å; E513-Q516 PolarHBondContact O-N 3.02Å; Q516-A520 WeakPolarHBondContact O-CB 3.31Å; Q516-A520 PolarHBondContact O-N 3.37Å
517	A	69	Low	72.2	Confident	0 Å²	0	50.7 Å²	50.7	0%	0	28%	0.283	C	S	.	.	H	α-helix	trans	-61.6	-53.5	177	0	0	0	0	0	111.9	L94 F97 K519 A520 A521	L94-A517 HydrophobicContact CD2-CB 3.88Å; F97-A517 HydrophobicContact CB-CB 4.36Å; F97-A517 HydrophobicContact CD1-CB 3.53Å; F97-A517 HydrophobicContact CD2-CB 3.76Å; F97-A517 HydrophobicContact CE1-CB 3.58Å; F97-A517 HydrophobicContact CE2-CB 3.82Å; F97-A517 HydrophobicContact CG-CB 3.63Å; F97-A517 HydrophobicContact CZ-CB 3.74Å; A517-K519 PolarHBondContact O-N 2.9Å; A517-A520 PolarHBondContact O-N 2.82Å; A517-A520 VanDerWaalsContact O-N 3.13Å; A517-A521 WeakPolarHBondContact O-CB 3.49Å; A517-A521 PolarHBondContact O-N 3.22Å
518	E	74.6	Confident	73.9	Confident	63 Å²	63	46.2 Å²	46.2	29%	0.294	27%	0.266	S	S	.	.	H	α-helix	trans	-56.7	-50.6	177.4	-61.9	-176.5	-172.4	0	0	111	L94 W488 A520 A521 D522	L94-E518 HydrophobicContact CD2-CG 4.3Å; W488-E518 HydrophobicContact CH2-CB 4.11Å; W488-E518 HydrophobicContact CH2-CG 4.42Å; W488-E518 HydrophobicContact CZ2-CB 4.35Å; W488-E518 HydrophobicContact CZ2-CG 4.19Å; E518-A520 VanDerWaalsContact C-N 3.26Å; E518-A520 PolarHBondContact O-N 3.11Å; E518-A521 WeakPolarHBondContact O-CB 3.35Å; E518-A521 PolarHBondContact O-N 3.27Å; E518-D522 PolarHBondContact O-N 3.43Å
519	K	77.1	Confident	75.6	Confident	89 Å²	89	52.4 Å²	52.4	39%	0.387	29%	0.289	S	S	.	.	H	α-helix	trans	-61	-29.3	177.7	-77.4	-172	174.5	-164.7	0	113.8	R439 D440 G515 A517	R439-K519 HydrophobicContact CB-CB 3.95Å; R439-K519 HydrophobicContact CB-CD 4.35Å; R439-K519 HydrophobicContact CB-CG 4.37Å; R439-K519 HydrophobicContact CG-CB 4.22Å; R439-K519 HydrophobicContact CG-CD 3.96Å; R439-K519 HydrophobicContact CG-CG 4.5Å; R439-K519 VanDerWaalsContact NH1-CB 3.25Å; D440-K519 IonicContact OD1-NZ 3.9Å; D440-K519 PolarHBondContact OD1-NZ 3.27Å; G515-K519 WeakPolarHBondContact O-CB 3.2Å; G515-K519 WeakPolarHBondContact O-CG 3.31Å; G515-K519 PolarHBondContact O-N 3.46Å; A517-K519 PolarHBondContact O-N 2.9Å
520	A	83.4	Confident	77.3	Confident	0 Å²	0	48.5 Å²	48.5	0%	0	26%	0.263	C	S	.	.	H	α-helix	trans	-80.1	-40.3	177	0	0	0	0	0	111.9	A495 F499 L508 Q516 A517 E518 D522 V523 M524	A495-A520 HydrophobicContact CB-CB 3.96Å; F499-A520 HydrophobicContact CD2-CB 4.32Å; L508-A520 HydrophobicContact CD1-CB 4.49Å; L508-A520 HydrophobicContact CD2-CB 3.96Å; Q516-A520 WeakPolarHBondContact O-CB 3.31Å; Q516-A520 PolarHBondContact O-N 3.37Å; A517-A520 PolarHBondContact O-N 2.82Å; A517-A520 VanDerWaalsContact O-N 3.13Å; E518-A520 VanDerWaalsContact C-N 3.26Å; E518-A520 PolarHBondContact O-N 3.11Å; A520-D522 VanDerWaalsContact C-N 3.29Å; A520-D522 PolarHBondContact O-N 3Å; A520-V523 PolarHBondContact O-N 3.13Å; A520-M524 PolarHBondContact O-N 2.91Å; A520-M524 VanDerWaalsContact O-N 3.15Å
521	A	87.9	Confident	79.2	Confident	0 Å²	0	43.1 Å²	43.1	0%	0	23%	0.234	C	C	.	.	H	α-helix	trans	-59.5	-41	171.7	0	0	0	0	0	111	W488 T492 A517 E518 V523 M524 R525	W488-A521 HydrophobicContact CH2-CB 4.17Å; W488-A521 HydrophobicContact CZ2-CB 4.41Å; W488-A521 HydrophobicContact CZ3-CB 4.41Å; T492-A521 VanDerWaalsContact OG1-CB 3.23Å; T492-A521 WeakPolarHBondContact OG1-CB 3.24Å; A517-A521 WeakPolarHBondContact O-CB 3.49Å; A517-A521 PolarHBondContact O-N 3.22Å; E518-A521 WeakPolarHBondContact O-CB 3.35Å; E518-A521 PolarHBondContact O-N 3.27Å; A521-V523 PolarHBondContact O-N 3.36Å; A521-M524 CarbonylContact O-C 3.51Å; A521-M524 PolarHBondContact O-N 2.91Å; A521-M524 VanDerWaalsContact O-N 3.16Å; A521-R525 VanDerWaalsContact O-CG 3.27Å; A521-R525 WeakPolarHBondContact O-CG 3.23Å; A521-R525 PolarHBondContact O-N 3.17Å
522	D	87.9	Confident	81	Confident	65 Å²	65	46.8 Å²	46.8	35%	0.348	24%	0.241	S	C	.	.	H	α-helix	trans	-54.6	-52.2	176.3	-82	-30	0	0	0	112.6	W488 E518 A520 M524 R525 L526	W488-D522 WeakPolarHBondContact CZ3-OD1 3.42Å; E518-D522 PolarHBondContact O-N 3.43Å; A520-D522 VanDerWaalsContact C-N 3.29Å; A520-D522 PolarHBondContact O-N 3Å; D522-M524 VanDerWaalsContact C-N 3.3Å; D522-M524 PolarHBondContact O-N 3.22Å; D522-R525 WeakPolarHBondContact O-CB 3.09Å; D522-R525 PolarHBondContact O-N 3.31Å; D522-R525 VanDerWaalsContact O-N 3.15Å; D522-L526 WeakPolarHBondContact O-CG 3.36Å; D522-L526 PolarHBondContact O-N 3.45Å
523	V	91.5	Very high	83	Confident	1 Å²	1	43.4 Å²	43.4	1%	0.006	21%	0.21	C	C	.	.	H	α-helix	trans	-61	-41.8	177.6	-176.8	0	0	0	0	110.8	V438 R439 L451 F499 A520 A521 R525 L526 L527	V438-V523 HydrophobicContact CB-CG2 4.24Å; V438-V523 HydrophobicContact CG1-CG2 4.28Å; R439-V523 HydrophobicContact CB-CG2 4.09Å; L451-V523 HydrophobicContact CD2-CG1 3.97Å; F499-V523 HydrophobicContact CE1-CG1 4.32Å; F499-V523 HydrophobicContact CE2-CB 4.41Å; F499-V523 HydrophobicContact CZ-CB 4.02Å; F499-V523 HydrophobicContact CZ-CG1 3.74Å; A520-V523 PolarHBondContact O-N 3.13Å; A521-V523 PolarHBondContact O-N 3.36Å; V523-R525 VanDerWaalsContact C-N 3.34Å; V523-R525 PolarHBondContact O-N 3.24Å; V523-L526 PolarHBondContact O-N 3.48Å; V523-L527 WeakPolarHBondContact O-CG 3.43Å; V523-L527 PolarHBondContact O-N 3.3Å
524	M	94.1	Very high	84.7	Confident	0 Å²	0	37 Å²	37	0%	0	18%	0.18	C	C	.	.	H	α-helix	trans	-63.5	-36.4	176.5	-168.7	65.9	-167.6	0	0	112.6	L470 L473 A491 M494 A495 L498 F499 A520 A521 D522 L527 I528	L470-M524 HydrophobicContact CD2-CE 3.62Å; L470-M524 HydrophobicContact CD2-SD 4.47Å; L473-M524 HydrophobicContact CD1-CE 3.34Å; A491-M524 HydrophobicContact CB-CB 3.94Å; A491-M524 HydrophobicContact CB-CG 3.97Å; M494-M524 HydrophobicContact CB-CE 3.82Å; M494-M524 HydrophobicContact CB-CG 4.41Å; A495-M524 HydrophobicContact CB-CB 4.19Å; L498-M524 HydrophobicContact CD2-CE 4.38Å; L498-M524 HydrophobicContact CD2-SD 3.62Å; F499-M524 HydrophobicContact CE2-CB 4.19Å; A520-M524 PolarHBondContact O-N 2.91Å; A520-M524 VanDerWaalsContact O-N 3.15Å; A521-M524 CarbonylContact O-C 3.51Å; A521-M524 PolarHBondContact O-N 2.91Å; A521-M524 VanDerWaalsContact O-N 3.16Å; D522-M524 VanDerWaalsContact C-N 3.3Å; D522-M524 PolarHBondContact O-N 3.22Å; M524-L527 PolarHBondContact O-N 2.79Å; M524-L527 HydrophobicContact SD-CD1 4.39Å; M524-I528 HydrophobicContact CE-CD1 3.95Å; M524-I528 HydrophobicContact CE-CG1 4.02Å; M524-I528 HydrophobicContact CG-CD1 4.04Å; M524-I528 VanDerWaalsContact O-CG1 3.3Å; M524-I528 WeakPolarHBondContact O-CG1 3.44Å; M524-I528 PolarHBondContact O-N 3.11Å
525	R	93.3	Very high	86.6	Confident	16 Å²	16	31.1 Å²	31.1	6%	0.06	15%	0.154	C	C	.	.	H	α-helix	trans	-64.3	-41.3	174.1	-70.9	168.2	48.1	98.1	-5.2	111.7	G271 L273 L487 A491 A521 D522 V523 I528 R529	G271-R525 PolarHBondContact O-NH2 3.04Å; L273-R525 HydrophobicContact CD1-CB 4.06Å; L487-R525 HydrophobicContact CG-CB 4.46Å; L487-R525 HydrophobicContact CG-CG 4.15Å; A491-R525 HydrophobicContact CB-CB 4.37Å; A491-R525 HydrophobicContact CB-CG 3.37Å; A521-R525 VanDerWaalsContact O-CG 3.27Å; A521-R525 WeakPolarHBondContact O-CG 3.23Å; A521-R525 PolarHBondContact O-N 3.17Å; D522-R525 WeakPolarHBondContact O-CB 3.09Å; D522-R525 PolarHBondContact O-N 3.31Å; D522-R525 VanDerWaalsContact O-N 3.15Å; V523-R525 VanDerWaalsContact C-N 3.34Å; V523-R525 PolarHBondContact O-N 3.24Å; R525-I528 PolarHBondContact O-N 2.98Å; R525-R529 WeakPolarHBondContact O-CB 3.46Å; R525-R529 PolarHBondContact O-N 3.34Å
526	L	94	Very high	88.1	Confident	9 Å²	9	30 Å²	30	5%	0.047	14%	0.139	C	C	.	.	H	α-helix	trans	-62.5	-46.1	175.5	-62.1	-176.3	0	0	0	111.1	L273 L444 K447 L451 D522 V523 I528 R529 Y530	L273-L526 HydrophobicContact CD1-CD2 4.01Å; L273-L526 HydrophobicContact CD2-CD2 3.89Å; L444-L526 HydrophobicContact CD1-CD1 4.09Å; L444-L526 HydrophobicContact CD1-CD2 3.42Å; L444-L526 VanDerWaalsContact CD1-CD2 3.42Å; L444-L526 HydrophobicContact CD1-CG 4.42Å; K447-L526 HydrophobicContact CB-CD1 3.8Å; K447-L526 HydrophobicContact CD-CD1 3.95Å; K447-L526 HydrophobicContact CG-CD1 4.44Å; L451-L526 HydrophobicContact CD1-CB 3.66Å; L451-L526 HydrophobicContact CD1-CD1 3.86Å; L451-L526 HydrophobicContact CD1-CG 4.42Å; D522-L526 WeakPolarHBondContact O-CG 3.36Å; D522-L526 PolarHBondContact O-N 3.45Å; V523-L526 PolarHBondContact O-N 3.48Å; L526-I528 PolarHBondContact O-N 3.48Å; L526-R529 PolarHBondContact O-N 2.82Å; L526-Y530 HydrophobicContact CB-CD2 4.4Å; L526-Y530 HydrophobicContact CD2-CD2 4.05Å; L526-Y530 HydrophobicContact CD2-CE2 3.65Å; L526-Y530 WeakPolarHBondContact O-CD2 3.16Å; L526-Y530 PolarHBondContact O-N 3.01Å
527	L	95.9	Very high	89.4	Confident	0 Å²	0	28.9 Å²	28.9	0%	0	13%	0.134	C	C	.	.	H	α-helix	trans	-58.1	-46.5	175.5	-70.5	175.7	0	0	0	112.1	F435 L451 I455 L470 L498 F499 V523 M524 Q531 L534	F435-L527 HydrophobicContact CE1-CD2 4.43Å; L451-L527 HydrophobicContact CD2-CD2 4.06Å; I455-L527 HydrophobicContact CD1-CD2 4.31Å; L470-L527 HydrophobicContact CD1-CB 4.06Å; L470-L527 HydrophobicContact CD2-CB 3.95Å; L498-L527 HydrophobicContact CD2-CD1 4.03Å; F499-L527 HydrophobicContact CZ-CD1 4.23Å; V523-L527 WeakPolarHBondContact O-CG 3.43Å; V523-L527 PolarHBondContact O-N 3.3Å; M524-L527 PolarHBondContact O-N 2.79Å; M524-L527 HydrophobicContact SD-CD1 4.39Å; L527-Q531 WeakPolarHBondContact O-CG 3.31Å; L527-L534 HydrophobicContact CD2-CD1 3.96Å
528	I	94.8	Very high	90.7	Very high	4 Å²	4	29 Å²	29	2%	0.021	14%	0.135	C	C	.	.	H	α-helix	trans	-69.4	-38.6	179	-63.9	164.6	0	0	0	111.6	L470 L473 L487 V490 A491 M524 R525 L526 Q531	L470-I528 HydrophobicContact CD2-CG1 3.76Å; L473-I528 HydrophobicContact CB-CD1 4.17Å; L473-I528 HydrophobicContact CB-CG1 4.23Å; L473-I528 HydrophobicContact CD1-CD1 4.09Å; L473-I528 HydrophobicContact CD1-CG1 4.29Å; L487-I528 HydrophobicContact CD1-CB 3.91Å; L487-I528 HydrophobicContact CD1-CD1 4.3Å; L487-I528 HydrophobicContact CD1-CG2 3.62Å; V490-I528 HydrophobicContact CG1-CD1 4.16Å; A491-I528 HydrophobicContact CB-CD1 4.28Å; M524-I528 HydrophobicContact CE-CD1 3.95Å; M524-I528 HydrophobicContact CE-CG1 4.02Å; M524-I528 HydrophobicContact CG-CD1 4.04Å; M524-I528 VanDerWaalsContact O-CG1 3.3Å; M524-I528 WeakPolarHBondContact O-CG1 3.44Å; M524-I528 PolarHBondContact O-N 3.11Å; R525-I528 PolarHBondContact O-N 2.98Å; L526-I528 PolarHBondContact O-N 3.48Å; I528-Q531 PolarHBondContact O-NE2 3.32Å
529	R	92.4	Very high	91.5	Very high	139 Å²	139	26.9 Å²	26.9	53%	0.525	13%	0.125	S	C	.	.	H	α-helix	trans	-78.5	-36.5	-172.7	-179.1	56.4	173.1	161	-3.6	113.9	L273 L487 R525 L526	L273-R529 HydrophobicContact CB-CG 4.21Å; L273-R529 HydrophobicContact CD1-CB 3.7Å; L273-R529 HydrophobicContact CD1-CG 3.88Å; L487-R529 HydrophobicContact CD2-CB 4.43Å; R525-R529 WeakPolarHBondContact O-CB 3.46Å; R525-R529 PolarHBondContact O-N 3.34Å; L526-R529 PolarHBondContact O-N 2.82Å
530	Y	93	Very high	92.4	Very high	17 Å²	17	23.1 Å²	23.1	7%	0.067	11%	0.109	C	C	.	.	S	Bend	trans	-111.8	23.7	-167.7	-59.7	-70	0	0	0	114.1	L273 P274 V276 L448 L526 D532 L533 L534	L273-Y530 HydrophobicContact CB-CE2 4.39Å; L273-Y530 HydrophobicContact CD1-CE2 4.08Å; P274-Y530 PolarHBondContact O-OH 2.9Å; V276-Y530 HydrophobicContact CB-CD1 4.25Å; V276-Y530 HydrophobicContact CB-CE1 3.8Å; V276-Y530 HydrophobicContact CG2-CD1 4.15Å; V276-Y530 HydrophobicContact CG2-CE1 3.38Å; L448-Y530 HydrophobicContact CD1-CD2 4.49Å; L448-Y530 HydrophobicContact CD1-CE2 4.39Å; L448-Y530 HydrophobicContact CD2-CD2 3.47Å; L448-Y530 VanDerWaalsContact CD2-CD2 3.47Å; L448-Y530 HydrophobicContact CD2-CE2 3.98Å; L448-Y530 HydrophobicContact CD2-CG 3.87Å; L526-Y530 HydrophobicContact CB-CD2 4.4Å; L526-Y530 HydrophobicContact CD2-CD2 4.05Å; L526-Y530 HydrophobicContact CD2-CE2 3.65Å; L526-Y530 WeakPolarHBondContact O-CD2 3.16Å; L526-Y530 PolarHBondContact O-N 3.01Å; Y530-D532 VanDerWaalsContact C-N 3.31Å; Y530-D532 PolarHBondContact O-N 3.23Å; Y530-L533 WeakPolarHBondContact O-CB 3.49Å; Y530-L533 PolarHBondContact O-N 2.64Å; Y530-L534 WeakPolarHBondContact O-CG 3.29Å; Y530-L534 PolarHBondContact O-N 3.31Å
531	Q	91.2	Very high	93	Very high	16 Å²	16	23.1 Å²	23.1	8%	0.075	11%	0.109	C	C	.	.	H	α-helix	trans	-48.3	-47.7	-177.7	-61.1	175.5	48.4	0	0	113.7	L470 L527 I528 L533 L534 W535	L470-Q531 VanDerWaalsContact C-OE1 3.23Å; L470-Q531 VanDerWaalsContact CB-CD 3.43Å; L470-Q531 HydrophobicContact CB-CG 3.98Å; L470-Q531 HydrophobicContact CD1-CG 4.44Å; L470-Q531 PolarHBondContact O-NE2 3.48Å; L527-Q531 WeakPolarHBondContact O-CG 3.31Å; I528-Q531 PolarHBondContact O-NE2 3.32Å; Q531-L533 PolarHBondContact O-N 2.69Å; Q531-L534 PolarHBondContact O-N 2.85Å; Q531-W535 PolarHBondContact O-N 2.88Å; Q531-W535 VanDerWaalsContact O-N 3.13Å
532	D	87.8	Confident	93.3	Very high	132 Å²	132	23.7 Å²	23.7	71%	0.706	11%	0.112	S	C	*	.	H	α-helix	trans	-59.1	-32.6	-179.4	-70.2	-43.3	0	0	0	112.9	Y530 T536	Y530-D532 VanDerWaalsContact C-N 3.31Å; Y530-D532 PolarHBondContact O-N 3.23Å; D532-T536 VanDerWaalsContact O-CG2 3.29Å; D532-T536 WeakPolarHBondContact O-CG2 3.4Å
533	L	91.1	Very high	93.6	Very high	23 Å²	23	23.6 Å²	23.6	12%	0.12	12%	0.116	C	C	.	.	H	α-helix	trans	-82.5	-46	178.5	-177.1	67.6	0	0	0	111.2	L240 V276 C278 L448 Y530 Q531 W535 T536	L240-L533 HydrophobicContact CD1-CD2 4.5Å; L240-L533 HydrophobicContact CD2-CD1 3.91Å; L240-L533 HydrophobicContact CD2-CD2 4.11Å; L240-L533 HydrophobicContact CD2-CG 4.2Å; V276-L533 HydrophobicContact CB-CD2 4.41Å; V276-L533 HydrophobicContact CG1-CD2 3.72Å; C278-L533 HydrophobicContact CB-CD1 4.15Å; L448-L533 HydrophobicContact CD1-CD2 4.45Å; Y530-L533 WeakPolarHBondContact O-CB 3.49Å; Y530-L533 PolarHBondContact O-N 2.64Å; Q531-L533 PolarHBondContact O-N 2.69Å; L533-W535 PolarHBondContact O-N 2.73Å; L533-T536 PolarHBondContact O-N 3.27Å; L533-T536 PolarHBondContact O-OG1 2.94Å
534	L	94.5	Very high	93.7	Very high	1 Å²	1	23.7 Å²	23.7	1%	0.005	12%	0.117	C	C	.	.	H	α-helix	trans	-64.4	-24.8	-175.9	-65.8	176.3	0	0	0	113	L448 L451 N452 I455 L527 Y530 Q531	L448-L534 HydrophobicContact CD2-CD2 4.5Å; L451-L534 HydrophobicContact CB-CD1 4.44Å; L451-L534 HydrophobicContact CB-CD2 3.58Å; N452-L534 HydrophobicContact CB-CD2 4.06Å; N452-L534 PolarHBondContact ND2-O 2.67Å; I455-L534 HydrophobicContact CG1-CB 4.32Å; I455-L534 WeakPolarHBondContact CG2-O 3.34Å; L527-L534 HydrophobicContact CD2-CD1 3.96Å; Y530-L534 WeakPolarHBondContact O-CG 3.29Å; Y530-L534 PolarHBondContact O-N 3.31Å; Q531-L534 PolarHBondContact O-N 2.85Å
535	W	94.6	Very high	93.7	Very high	16 Å²	16	23.7 Å²	23.7	6%	0.061	12%	0.117	C	C	.	.	T	Hydrogen-bonded Turn	trans	-93.8	10.6	175.1	-89.2	-105	0	0	0	115	I288 I455 R463 L466 K467 L470 Q531 L533	I288-W535 HydrophobicContact CD1-CB 4.04Å; I288-W535 HydrophobicContact CD1-CG 3.96Å; I288-W535 WeakPolarHBondContact CD1-O 3.34Å; I288-W535 WeakPolarHBondContact CG1-O 3.31Å; I288-W535 PolarHBondContact N-O 2.88Å; I455-W535 HydrophobicContact CD1-CH2 3.43Å; I455-W535 VanDerWaalsContact CD1-CH2 3.43Å; I455-W535 HydrophobicContact CD1-CZ2 3.98Å; I455-W535 HydrophobicContact CD1-CZ3 3.9Å; I455-W535 HydrophobicContact CG1-CE3 4.47Å; I455-W535 HydrophobicContact CG1-CH2 3.99Å; I455-W535 HydrophobicContact CG1-CZ3 3.95Å; I455-W535 HydrophobicContact CG2-CD2 3.63Å; I455-W535 HydrophobicContact CG2-CE3 3.83Å; I455-W535 HydrophobicContact CG2-CG 4.17Å; I455-W535 HydrophobicContact CG2-CH2 4.01Å; I455-W535 HydrophobicContact CG2-CZ2 3.83Å; I455-W535 HydrophobicContact CG2-CZ3 4.01Å; R463-W535 HydrophobicContact CG-CZ2 4.2Å; R463-W535 WeakPolarHBondContact O-CZ2 3.36Å; L466-W535 HydrophobicContact CB-CZ2 4.46Å; L466-W535 HydrophobicContact CD2-CH2 3.94Å; L466-W535 HydrophobicContact CD2-CZ2 4.26Å; L466-W535 HydrophobicContact CG-CH2 4.04Å; L466-W535 HydrophobicContact CG-CZ2 4.3Å; K467-W535 HydrophobicContact CB-CZ2 3.81Å; K467-W535 HydrophobicContact CD-CD2 4.31Å; K467-W535 HydrophobicContact CD-CG 4.07Å; L470-W535 HydrophobicContact CD1-CH2 3.66Å; L470-W535 HydrophobicContact CD1-CZ3 3.96Å; Q531-W535 PolarHBondContact O-N 2.88Å; Q531-W535 VanDerWaalsContact O-N 3.13Å; L533-W535 PolarHBondContact O-N 2.73Å
536	T	94.1	Very high	93.7	Very high	14 Å²	14	23.7 Å²	23.7	9%	0.086	12%	0.117	C	C	.	.	B	Isolated β-bridge	trans	-86.2	153.6	168.4	68	0	0	0	0	112.2	V285 T286 N452 D532 L533	V285-T536 HydrophobicContact CG1-CG2 3.51Å; T286-T536 WeakPolarHBondContact O-CA 3.3Å; N452-T536 PolarHBondContact ND2-O 3.3Å; D532-T536 VanDerWaalsContact O-CG2 3.29Å; D532-T536 WeakPolarHBondContact O-CG2 3.4Å; L533-T536 PolarHBondContact O-N 3.27Å; L533-T536 PolarHBondContact O-OG1 2.94Å
537	V	95.5	Very high	93.5	Very high	2 Å²	2	27.9 Å²	27.9	1%	0.012	13%	0.132	C	C	.	.	P	Polyproline II helix	trans	-95.4	119.3	167.5	-177.2	0	0	0	0	108.1	T286 I288 L291 M296 V299 L456 L541 M542	T286-V537 HydrophobicContact CG2-CB 4.25Å; T286-V537 HydrophobicContact CG2-CG2 4.41Å; T286-V537 PolarHBondContact O-N 3.31Å; I288-V537 HydrophobicContact CG1-CG2 4.18Å; L291-V537 HydrophobicContact CD1-CG1 4.47Å; L291-V537 HydrophobicContact CD1-CG2 4.02Å; M296-V537 HydrophobicContact SD-CG2 4.25Å; V299-V537 HydrophobicContact CG1-CG1 3.79Å; V299-V537 HydrophobicContact CG1-CG2 4.33Å; V299-V537 HydrophobicContact CG2-CG1 4.01Å; L456-V537 HydrophobicContact CD2-CG2 3.99Å; V537-L541 HydrophobicContact CG1-CB 4.11Å; V537-M542 HydrophobicContact CG1-CG 3.98Å; V537-M542 HydrophobicContact CG1-SD 4.21Å
538	P	95.1	Very high	93.2	Very high	1 Å²	1	28.9 Å²	28.9	1%	0.006	14%	0.137	C	C	.	.	P	Polyproline II helix	trans	-58.1	144.4	176.2	-29.6	37.2	0	0	0	113.8	T242 Y246 N452 F540 L541 M542	T242-P538 HydrophobicContact CG2-CB 4.47Å; Y246-P538 HydrophobicContact CE2-CG 3.91Å; Y246-P538 VanDerWaalsContact OH-CG 3.24Å; Y246-P538 WeakPolarHBondContact OH-CG 3.12Å; N452-P538 WeakPolarHBondContact OD1-CG 3.48Å; P538-F540 HydrophobicContact CB-CD1 3.47Å; P538-F540 VanDerWaalsContact CB-CD1 3.47Å; P538-F540 HydrophobicContact CB-CE1 3.44Å; P538-F540 VanDerWaalsContact CB-CE1 3.44Å; P538-F540 HydrophobicContact CB-CG 4.45Å; P538-F540 HydrophobicContact CB-CZ 4.42Å; P538-F540 HydrophobicContact CG-CD1 4.48Å; P538-F540 HydrophobicContact CG-CE1 3.99Å; P538-F540 PolarHBondContact O-N 3.41Å; P538-L541 HydrophobicContact CB-CG 4.5Å; P538-L541 HydrophobicContact CG-CD1 4.46Å; P538-L541 WeakPolarHBondContact O-CB 3.44Å; P538-L541 PolarHBondContact O-N 2.78Å; P538-M542 PolarHBondContact O-N 3.33Å; P538-M542 VanDerWaalsContact O-N 3.11Å
539	N	93.1	Very high	92.9	Very high	19 Å²	19	29.5 Å²	29.5	10%	0.102	14%	0.141	C	C	.	.	H	α-helix	trans	-61.7	-29.9	-178	-58.5	-23.3	0	0	0	112.8	T242 D243 C281 M542 S543	T242-N539 PolarHBondContact O-N 3.21Å; T242-N539 PolarHBondContact OG1-ND2 2.89Å; D243-N539 VanDerWaalsContact OD1-CB 3.26Å; D243-N539 WeakPolarHBondContact OD1-CB 3.3Å; D243-N539 PolarHBondContact OD1-ND2 2.8Å; C281-N539 WeakPolarHBondContact CB-ND2 3.33Å; N539-M542 PolarHBondContact O-N 2.68Å; N539-S543 WeakPolarHBondContact O-CB 3.44Å; N539-S543 PolarHBondContact O-N 3.35Å; N539-S543 PolarHBondContact O-OG 2.79Å
540	F	94.9	Very high	92.7	Very high	11 Å²	11	26.3 Å²	26.3	5%	0.048	13%	0.132	C	C	.	.	H	α-helix	trans	-64	-43.4	173.9	81.2	-96.8	0	0	0	111.5	T242 I244 A245 Y246 D306 P538 S543 Q544	T242-F540 WeakPolarHBondContact O-CD1 3.46Å; T242-F540 PolarHBondContact O-N 3.45Å; I244-F540 VanDerWaalsContact O-CD1 3.31Å; I244-F540 WeakPolarHBondContact O-CD1 3.06Å; A245-F540 HydrophobicContact CB-CD2 3.75Å; A245-F540 HydrophobicContact CB-CE2 3.81Å; A245-F540 HydrophobicContact CB-CG 4.23Å; A245-F540 HydrophobicContact CB-CZ 4.35Å; Y246-F540 HydrophobicContact CD1-CE1 4.08Å; Y246-F540 HydrophobicContact CD2-CE1 4.1Å; Y246-F540 HydrophobicContact CD2-CZ 4.27Å; Y246-F540 HydrophobicContact CE1-CE1 4.21Å; Y246-F540 HydrophobicContact CE2-CE1 4.23Å; Y246-F540 HydrophobicContact CG-CE1 4.04Å; Y246-F540 HydrophobicContact CG-CZ 4.37Å; D306-F540 HydrophobicContact CB-CE2 4.38Å; D306-F540 HydrophobicContact CB-CZ 4.42Å; D306-F540 VanDerWaalsContact OD2-CZ 3.29Å; D306-F540 WeakPolarHBondContact OD2-CZ 3.45Å; P538-F540 HydrophobicContact CB-CD1 3.47Å; P538-F540 VanDerWaalsContact CB-CD1 3.47Å; P538-F540 HydrophobicContact CB-CE1 3.44Å; P538-F540 VanDerWaalsContact CB-CE1 3.44Å; P538-F540 HydrophobicContact CB-CG 4.45Å; P538-F540 HydrophobicContact CB-CZ 4.42Å; P538-F540 HydrophobicContact CG-CD1 4.48Å; P538-F540 HydrophobicContact CG-CE1 3.99Å; P538-F540 PolarHBondContact O-N 3.41Å; F540-S543 WeakPolarHBondContact O-CB 3.2Å; F540-S543 PolarHBondContact O-N 3.47Å; F540-Q544 WeakPolarHBondContact O-CG 3.34Å; F540-Q544 PolarHBondContact O-N 2.94Å
541	L	95.8	Very high	92.2	Very high	0 Å²	0	27.1 Å²	27.1	0%	0	14%	0.137	C	C	.	.	H	α-helix	trans	-63.8	-43.5	175.2	-65.3	-176.4	0	0	0	110.7	V299 L302 A303 L453 L456 V537 P538 S543 Q544 V545	V299-L541 HydrophobicContact CG1-CD1 3.99Å; L302-L541 HydrophobicContact CB-CD2 3.61Å; A303-L541 HydrophobicContact CB-CD1 4.19Å; L453-L541 HydrophobicContact CD2-CD1 4.49Å; L456-L541 HydrophobicContact CD1-CD1 3.69Å; V537-L541 HydrophobicContact CG1-CB 4.11Å; P538-L541 HydrophobicContact CB-CG 4.5Å; P538-L541 HydrophobicContact CG-CD1 4.46Å; P538-L541 WeakPolarHBondContact O-CB 3.44Å; P538-L541 PolarHBondContact O-N 2.78Å; L541-S543 VanDerWaalsContact C-N 3.3Å; L541-S543 PolarHBondContact O-N 2.95Å; L541-Q544 PolarHBondContact O-N 2.92Å; L541-V545 WeakPolarHBondContact O-CG2 3.23Å; L541-V545 PolarHBondContact O-N 3.1Å
542	M	94.4	Very high	91.6	Very high	11 Å²	11	28 Å²	28	5%	0.054	15%	0.145	C	C	.	.	H	α-helix	trans	-57.3	-43.3	174.2	-77.3	-60.1	-75.4	0	0	112.3	T286 L291 V537 P538 N539 Q544 V545 R546 I647	T286-M542 HydrophobicContact CG2-CE 4.19Å; T286-M542 HydrophobicContact CG2-SD 4.01Å; L291-M542 HydrophobicContact CD1-SD 3.66Å; L291-M542 HydrophobicContact CD2-CE 3.71Å; L291-M542 HydrophobicContact CD2-SD 3.88Å; L291-M542 HydrophobicContact CG-SD 4.35Å; V537-M542 HydrophobicContact CG1-CG 3.98Å; V537-M542 HydrophobicContact CG1-SD 4.21Å; P538-M542 PolarHBondContact O-N 3.33Å; P538-M542 VanDerWaalsContact O-N 3.11Å; N539-M542 PolarHBondContact O-N 2.68Å; M542-Q544 PolarHBondContact O-N 2.95Å; M542-V545 PolarHBondContact O-N 2.86Å; M542-R546 WeakPolarHBondContact O-CG 3.5Å; M542-R546 PolarHBondContact O-N 3.3Å; M542-I647 HydrophobicContact CE-CD1 4.42Å
543	S	93.6	Very high	90.8	Very high	63 Å²	63	25.1 Å²	25.1	44%	0.441	13%	0.129	S	C	.	.	H	α-helix	trans	-65.4	-37.9	177.8	-57.3	0	0	0	0	112.3	N539 F540 L541 R547	N539-S543 WeakPolarHBondContact O-CB 3.44Å; N539-S543 PolarHBondContact O-N 3.35Å; N539-S543 PolarHBondContact O-OG 2.79Å; F540-S543 WeakPolarHBondContact O-CB 3.2Å; F540-S543 PolarHBondContact O-N 3.47Å; L541-S543 VanDerWaalsContact C-N 3.3Å; L541-S543 PolarHBondContact O-N 2.95Å; S543-R547 PolarHBondContact O-N 3.09Å
544	Q	94.5	Very high	89.8	Confident	4 Å²	4	31 Å²	31	2%	0.019	15%	0.15	C	C	.	.	H	α-helix	trans	-68.3	-43.4	174.8	-71.8	-177.1	-65.5	0	0	112.1	T157 L302 F540 L541 M542 R546 R547 L548	T157-Q544 PolarHBondContact O-NE2 3.43Å; L302-Q544 HydrophobicContact CD1-CB 3.53Å; L302-Q544 HydrophobicContact CD2-CB 4.16Å; L302-Q544 HydrophobicContact CG-CB 4.46Å; F540-Q544 WeakPolarHBondContact O-CG 3.34Å; F540-Q544 PolarHBondContact O-N 2.94Å; L541-Q544 PolarHBondContact O-N 2.92Å; M542-Q544 PolarHBondContact O-N 2.95Å; Q544-R546 PolarHBondContact O-N 3.47Å; Q544-R547 PolarHBondContact O-N 3.39Å; Q544-L548 WeakPolarHBondContact O-CG 3.42Å; Q544-L548 PolarHBondContact O-N 2.65Å
545	V	93.8	Very high	88.1	Confident	0 Å²	0	35.4 Å²	35.4	0%	0	17%	0.167	C	C	.	.	H	α-helix	trans	-59.3	-46	175.2	169	0	0	0	0	111.3	D295 K298 V299 L302 L541 M542 R547 L548 N549 I647	D295-V545 HydrophobicContact CB-CG1 4.04Å; K298-V545 HydrophobicContact CB-CG2 3.89Å; K298-V545 HydrophobicContact CD-CG1 4.46Å; V299-V545 HydrophobicContact CG2-CG2 3.79Å; L302-V545 HydrophobicContact CD1-CG2 3.78Å; L541-V545 WeakPolarHBondContact O-CG2 3.23Å; L541-V545 PolarHBondContact O-N 3.1Å; M542-V545 PolarHBondContact O-N 2.86Å; V545-R547 VanDerWaalsContact C-N 3.33Å; V545-R547 PolarHBondContact O-N 2.91Å; V545-L548 PolarHBondContact O-N 3.37Å; V545-N549 PolarHBondContact O-N 3.45Å; V545-I647 HydrophobicContact CG1-CD1 4.02Å
546	R	92.8	Very high	86.4	Confident	16 Å²	16	42.5 Å²	42.5	6%	0.06	20%	0.195	C	C	.	.	H	α-helix	trans	-58.1	-44.9	176.5	-72.9	-177.8	-174.3	-83.6	5.4	112.1	M542 Q544 N549 E550 E642 N646	M542-R546 WeakPolarHBondContact O-CG 3.5Å; M542-R546 PolarHBondContact O-N 3.3Å; Q544-R546 PolarHBondContact O-N 3.47Å; R546-N549 PolarHBondContact O-N 3.04Å; R546-E550 WeakPolarHBondContact O-CB 3.36Å; R546-E550 PolarHBondContact O-N 2.94Å; R546-E642 IonicContact CZ-OE1 3.17Å; R546-E642 IonicContact CZ-OE2 2.91Å; R546-E642 IonicContact NH1-OE1 2.77Å; R546-E642 PolarHBondContact NH1-OE1 3.31Å; R546-E642 IonicContact NH1-OE2 2.71Å; R546-E642 IonicContact NH2-OE1 2.81Å; R546-E642 PolarHBondContact NH2-OE1 3.32Å; R546-E642 IonicContact NH2-OE2 3.8Å; R546-E642 PolarHBondContact NH2-OE2 3.11Å; R546-N646 WeakPolarHBondContact CA-O 3.48Å; R546-N646 HydrophobicContact CB-CB 4.35Å; R546-N646 WeakPolarHBondContact CG-OD1 3.49Å; R546-N646 PolarHBondContact NH1-OD1 3.42Å
547	R	91	Very high	84.6	Confident	96 Å²	96	47.8 Å²	47.8	36%	0.362	22%	0.218	S	C	.	.	H	α-helix	trans	-64.7	-39.5	176.8	-176.2	168.2	51.4	-117.3	8.7	113	T157 S543 Q544 V545 E550 N551	T157-R547 HydrophobicContact CG2-CB 4.49Å; T157-R547 HydrophobicContact CG2-CG 3.8Å; T157-R547 PolarHBondContact O-NH2 3.39Å; S543-R547 PolarHBondContact O-N 3.09Å; Q544-R547 PolarHBondContact O-N 3.39Å; V545-R547 VanDerWaalsContact C-N 3.33Å; V545-R547 PolarHBondContact O-N 2.91Å; R547-E550 PolarHBondContact O-N 3.33Å; R547-N551 WeakPolarHBondContact O-CB 3.46Å; R547-N551 PolarHBondContact O-N 3.22Å; R547-N551 PolarHBondContact O-ND2 3.36Å
548	L	88.7	Confident	82.7	Confident	22 Å²	22	54.9 Å²	54.9	12%	0.115	25%	0.249	C	C	.	.	H	α-helix	trans	-63.8	-40.6	174.7	-75	172.6	0	0	0	112.5	L154 T157 K298 L302 Q544 V545 S552	L154-L548 HydrophobicContact CD2-CD2 3.9Å; T157-L548 HydrophobicContact CG2-CD2 3.75Å; T157-L548 HydrophobicContact CG2-CG 4.18Å; T157-L548 WeakPolarHBondContact OG1-CD2 3.47Å; K298-L548 HydrophobicContact CD-CB 4.39Å; L302-L548 HydrophobicContact CD1-CD1 3.96Å; L302-L548 HydrophobicContact CD2-CD1 4.27Å; L302-L548 HydrophobicContact CG-CD1 4.28Å; Q544-L548 WeakPolarHBondContact O-CG 3.42Å; Q544-L548 PolarHBondContact O-N 2.65Å; V545-L548 PolarHBondContact O-N 3.37Å; L548-S552 WeakPolarHBondContact O-CB 3.26Å; L548-S552 PolarHBondContact O-N 3.22Å; L548-S552 VanDerWaalsContact O-N 3.11Å; L548-S552 PolarHBondContact O-OG 2.98Å
549	N	89.8	Confident	80.7	Confident	17 Å²	17	62.1 Å²	62.1	9%	0.091	28%	0.281	C	S	.	.	H	α-helix	trans	-65.8	-46.4	175.4	-74.7	-19.1	0	0	0	111.3	D295 K298 V545 R546 N551 S552 N553 N646	D295-N549 PolarHBondContact OD1-ND2 3.08Å; K298-N549 WeakPolarHBondContact CE-OD1 3.38Å; K298-N549 PolarHBondContact NZ-OD1 3.04Å; V545-N549 PolarHBondContact O-N 3.45Å; R546-N549 PolarHBondContact O-N 3.04Å; N549-N551 PolarHBondContact O-N 3.32Å; N549-S552 PolarHBondContact O-N 2.95Å; N549-S552 VanDerWaalsContact O-N 3.16Å; N549-N553 PolarHBondContact O-N 3.46Å; N549-N646 WeakPolarHBondContact CB-O 3.44Å; N549-N646 PolarHBondContact ND2-O 2.98Å
550	E	87.9	Confident	78.7	Confident	71 Å²	71	66.7 Å²	66.7	33%	0.332	31%	0.305	S	S	.	.	H	α-helix	trans	-59.6	-47.2	177.4	-168.8	-174.2	161.8	0	0	111.9	R546 R547 S552 N553 R554 N646	R546-E550 WeakPolarHBondContact O-CB 3.36Å; R546-E550 PolarHBondContact O-N 2.94Å; R547-E550 PolarHBondContact O-N 3.33Å; E550-S552 PolarHBondContact O-N 3.4Å; E550-N553 PolarHBondContact O-N 3.16Å; E550-R554 WeakPolarHBondContact O-CG 3.45Å; E550-R554 PolarHBondContact O-N 3.14Å; E550-R554 IonicContact OE1-CZ 2.68Å; E550-R554 VanDerWaalsContact OE1-CZ 3.25Å; E550-R554 IonicContact OE1-NE 3.75Å; E550-R554 PolarHBondContact OE1-NE 2.95Å; E550-R554 IonicContact OE1-NH2 3.7Å; E550-R554 PolarHBondContact OE1-NH2 3.07Å; E550-N646 HydrophobicContact CB-CB 4.26Å
551	N	81.9	Confident	76.6	Confident	35 Å²	35	71.6 Å²	71.6	19%	0.187	33%	0.331	C	S	.	.	H	α-helix	trans	-62.5	-30.6	177.1	-72.5	-10.8	0	0	0	112.6	V153 R547 N549 R555	V153-N551 HydrophobicContact CG1-CB 3.77Å; R547-N551 WeakPolarHBondContact O-CB 3.46Å; R547-N551 PolarHBondContact O-N 3.22Å; R547-N551 PolarHBondContact O-ND2 3.36Å; N549-N551 PolarHBondContact O-N 3.32Å; N551-R555 WeakPolarHBondContact O-CG 3.44Å; N551-R555 PolarHBondContact O-N 3.45Å; N551-R555 PolarHBondContact O-NE 2.91Å
552	S	77.8	Confident	74.5	Confident	34 Å²	34	78.6 Å²	78.6	24%	0.238	37%	0.368	C	S	.	.	H	α-helix	trans	-75.2	-42	175.3	-58.5	0	0	0	0	111.7	L548 N549 E550 R555 Y556	L548-S552 WeakPolarHBondContact O-CB 3.26Å; L548-S552 PolarHBondContact O-N 3.22Å; L548-S552 VanDerWaalsContact O-N 3.11Å; L548-S552 PolarHBondContact O-OG 2.98Å; N549-S552 PolarHBondContact O-N 2.95Å; N549-S552 VanDerWaalsContact O-N 3.16Å; E550-S552 PolarHBondContact O-N 3.4Å; S552-R555 WeakPolarHBondContact O-CB 3.26Å; S552-R555 PolarHBondContact O-N 2.99Å; S552-R555 PolarHBondContact OG-NH2 2.89Å; S552-R555 VanDerWaalsContact OG-NH2 3.17Å; S552-Y556 VanDerWaalsContact O-CD2 3.23Å; S552-Y556 WeakPolarHBondContact O-CD2 3.48Å; S552-Y556 PolarHBondContact O-N 3.14Å
553	N	72.6	Confident	72.4	Confident	71 Å²	71	88.9 Å²	88.9	38%	0.38	41%	0.406	S	S	.	.	H	α-helix	trans	-67.2	-38.3	177.4	-75.3	-8.7	0	0	0	112.7	N549 E550 R555 Y556 Q557 G645	N549-N553 PolarHBondContact O-N 3.46Å; E550-N553 PolarHBondContact O-N 3.16Å; N553-R555 VanDerWaalsContact C-N 3.28Å; N553-R555 PolarHBondContact O-N 3Å; N553-Y556 PolarHBondContact O-N 3.33Å; N553-Q557 PolarHBondContact O-N 2.93Å; N553-G645 PolarHBondContact ND2-O 3.41Å
554	R	69.3	Low	70.1	Confident	146 Å²	146	94.5 Å²	94.5	55%	0.551	42%	0.423	S	S	*	.	H	α-helix	trans	-57.8	-38.9	172.3	-73.7	173.7	179.4	-121.4	6.9	112	E550 Q557 F558	E550-R554 WeakPolarHBondContact O-CG 3.45Å; E550-R554 PolarHBondContact O-N 3.14Å; E550-R554 IonicContact OE1-CZ 2.68Å; E550-R554 VanDerWaalsContact OE1-CZ 3.25Å; E550-R554 IonicContact OE1-NE 3.75Å; E550-R554 PolarHBondContact OE1-NE 2.95Å; E550-R554 IonicContact OE1-NH2 3.7Å; E550-R554 PolarHBondContact OE1-NH2 3.07Å; R554-Q557 PolarHBondContact O-N 3.44Å; R554-F558 PolarHBondContact O-N 3.16Å
555	R	59.8	Low	67.5	Low	94 Å²	94	102.2 Å²	102.2	36%	0.355	46%	0.462	S	S	.	.	H	α-helix	trans	-65.2	-42.1	175.8	-73.8	-178.9	-70.6	163.1	2.4	112.5	D150 N551 S552 N553 F558 K559	D150-R555 IonicContact OD1-CZ 2.75Å; D150-R555 IonicContact OD1-NE 3.37Å; D150-R555 IonicContact OD1-NH1 2.71Å; D150-R555 PolarHBondContact OD1-NH1 2.97Å; D150-R555 IonicContact OD2-NH1 3.78Å; D150-R555 PolarHBondContact OD2-NH1 3.46Å; N551-R555 WeakPolarHBondContact O-CG 3.44Å; N551-R555 PolarHBondContact O-N 3.45Å; N551-R555 PolarHBondContact O-NE 2.91Å; S552-R555 WeakPolarHBondContact O-CB 3.26Å; S552-R555 PolarHBondContact O-N 2.99Å; S552-R555 PolarHBondContact OG-NH2 2.89Å; S552-R555 VanDerWaalsContact OG-NH2 3.17Å; N553-R555 VanDerWaalsContact C-N 3.28Å; N553-R555 PolarHBondContact O-N 3Å; R555-F558 PolarHBondContact O-N 3.28Å; R555-K559 WeakPolarHBondContact O-CG 3.44Å; R555-K559 PolarHBondContact O-N 2.99Å; R555-K559 VanDerWaalsContact O-N 3.08Å
556	Y	57.2	Low	64.7	Low	166 Å²	166	110.7 Å²	110.7	65%	0.651	50%	0.502	S	S	*	.	H	α-helix	trans	-63	-41.2	173.5	-74.9	-71.9	0	0	0	112.4	S552 N553 N560	S552-Y556 VanDerWaalsContact O-CD2 3.23Å; S552-Y556 WeakPolarHBondContact O-CD2 3.48Å; S552-Y556 PolarHBondContact O-N 3.14Å; N553-Y556 PolarHBondContact O-N 3.33Å; Y556-N560 PolarHBondContact O-N 3.35Å; Y556-N560 VanDerWaalsContact O-N 3.13Å
557	Q	58	Low	62	Low	124 Å²	124	115.8 Å²	115.8	58%	0.579	54%	0.537	S	S	*	.	H	α-helix	trans	-65.1	-44	176.4	-70.7	-179.7	-3.7	0	0	112	N553 R554 K559 N560 L561	N553-Q557 PolarHBondContact O-N 2.93Å; R554-Q557 PolarHBondContact O-N 3.44Å; Q557-K559 PolarHBondContact O-N 3.08Å; Q557-N560 CarbonylContact O-C 3.58Å; Q557-N560 PolarHBondContact O-N 2.7Å; Q557-N560 VanDerWaalsContact O-N 3.11Å; Q557-L561 HydrophobicContact CB-CD1 4.49Å; Q557-L561 WeakPolarHBondContact O-CD1 3.41Å; Q557-L561 PolarHBondContact O-N 2.88Å
558	F	54.8	Low	59.1	Low	151 Å²	151	118.8 Å²	118.8	66%	0.662	56%	0.56	S	S	*	*	H	α-helix	trans	-62.2	-41.8	177.6	-120.1	-93.1	0	0	0	112.8	R554 R555 N560 L561 L562	R554-F558 PolarHBondContact O-N 3.16Å; R555-F558 PolarHBondContact O-N 3.28Å; F558-N560 PolarHBondContact O-N 3.34Å; F558-L561 PolarHBondContact O-N 3Å; F558-L562 PolarHBondContact O-N 2.61Å; F558-L562 VanDerWaalsContact O-N 3.14Å
559	K	53.6	Low	56.5	Low	153 Å²	153	122.8 Å²	122.8	67%	0.665	59%	0.59	S	S	*	*	H	α-helix	trans	-63.3	-29.2	174.4	-71.6	-175.7	178.3	-172.7	0	112.6	R555 Q557	R555-K559 WeakPolarHBondContact O-CG 3.44Å; R555-K559 PolarHBondContact O-N 2.99Å; R555-K559 VanDerWaalsContact O-N 3.08Å; Q557-K559 PolarHBondContact O-N 3.08Å
560	N	50.5	Low	53.8	Low	116 Å²	116	133.2 Å²	133.2	62%	0.62	63%	0.628	S	S	*	*	H	α-helix	trans	-82.7	-35.7	174.6	-72.9	-12.8	0	0	0	113.5	Y556 Q557 F558 L562 R563 K564	Y556-N560 PolarHBondContact O-N 3.35Å; Y556-N560 VanDerWaalsContact O-N 3.13Å; Q557-N560 CarbonylContact O-C 3.58Å; Q557-N560 PolarHBondContact O-N 2.7Å; Q557-N560 VanDerWaalsContact O-N 3.11Å; F558-N560 PolarHBondContact O-N 3.34Å; N560-L562 VanDerWaalsContact C-N 3.31Å; N560-L562 PolarHBondContact O-N 3.48Å; N560-R563 PolarHBondContact O-N 2.99Å; N560-K564 PolarHBondContact O-N 3.06Å
561	L	49.9	Very low	51.1	Low	113 Å²	113	138.5 Å²	138.5	59%	0.592	65%	0.653	S	S	*	*	H	α-helix	trans	-63.9	-35.5	175.1	-96.7	89.4	0	0	0	112	Q557 F558 R563 K564	Q557-L561 HydrophobicContact CB-CD1 4.49Å; Q557-L561 WeakPolarHBondContact O-CD1 3.41Å; Q557-L561 PolarHBondContact O-N 2.88Å; F558-L561 PolarHBondContact O-N 3Å; L561-R563 PolarHBondContact O-N 3.34Å; L561-K564 CarbonylContact O-C 3.41Å; L561-K564 PolarHBondContact O-N 3.44Å; L561-K564 VanDerWaalsContact O-N 3.07Å
562	L	52	Low	48.8	Very low	148 Å²	148	146 Å²	146	78%	0.775	68%	0.684	S	S	*	*	T	Hydrogen-bonded Turn	trans	-60.1	-9.2	171	-78.7	166.4	0	0	0	113.9	F558 N560	F558-L562 PolarHBondContact O-N 2.61Å; F558-L562 VanDerWaalsContact O-N 3.14Å; N560-L562 VanDerWaalsContact C-N 3.31Å; N560-L562 PolarHBondContact O-N 3.48Å
563	R	50.8	Low	46.9	Very low	227 Å²	227	150.2 Å²	150.2	86%	0.857	71%	0.71	S	S	*	*	T	Hydrogen-bonded Turn	trans	-112.9	-0.6	176.7	-154.3	170.5	179.2	165.8	0.7	114.3	N560 L561	N560-R563 PolarHBondContact O-N 2.99Å; L561-R563 PolarHBondContact O-N 3.34Å
564	K	45.1	Very low	44.8	Very low	180 Å²	180	156.1 Å²	156.1	78%	0.783	74%	0.736	S	S	*	*			trans	-151.7	97.1	172.6	-103.7	-175.6	176	-175.7	0	111.1	N560 L561	N560-K564 PolarHBondContact O-N 3.06Å; L561-K564 CarbonylContact O-C 3.41Å; L561-K564 PolarHBondContact O-N 3.44Å; L561-K564 VanDerWaalsContact O-N 3.07Å
565	I	39.6	Very low	43.5	Very low	167 Å²	167	158.2 Å²	158.2	86%	0.856	75%	0.749	S	S	*	*			trans	-92.1	107.2	161.2	-59.3	175.1	0	0	0	107.5
566	Q	34.6	Very low	42.3	Very low	178 Å²	178	161.3 Å²	161.3	83%	0.832	77%	0.772	S	S	*	*			trans	-141.8	126.2	155.9	-160.4	165.9	17.1	0	0	106.5
567	P	36.9	Very low	41.5	Very low	123 Å²	123	158.6 Å²	158.6	80%	0.799	78%	0.778	S	S	*	*			trans	-78.8	124.6	-177.7	31	-31.7	0	0	0	109.1
568	D	30.4	Very low	40.9	Very low	159 Å²	159	159.5 Å²	159.5	85%	0.85	78%	0.782	S	S	*	*			trans	-111.7	151.4	169.3	-153.4	-6.3	0	0	0	111
569	S	33.1	Very low	40.6	Very low	105 Å²	105	156.2 Å²	156.2	73%	0.734	78%	0.776	S	S	*	*			trans	-72.1	142.7	-160.2	-166.3	0	0	0	0	113.1	E571	S569-E571 PolarHBondContact O-N 2.75Å
570	R	33.3	Very low	40.6	Very low	237 Å²	237	157.3 Å²	157.3	89%	0.894	78%	0.776	S	S	*	*			trans	-98.6	84.2	-175.7	-164.1	-178	-166.4	-178.5	5.5	110.4
571	E	31.5	Very low	41.7	Very low	181 Å²	181	156.8 Å²	156.8	85%	0.846	77%	0.765	S	S	*	*	P	Polyproline II helix	trans	-64.4	143.1	171.7	-68.5	-163.5	150.4	0	0	111.7	S569	S569-E571 PolarHBondContact O-N 2.75Å
572	K	33.6	Very low	43.1	Very low	193 Å²	193	155.3 Å²	155.3	84%	0.839	76%	0.761	S	S	*	*	P	Polyproline II helix	trans	-92.4	137.8	-179.5	-67.2	172.9	179	171	0	109.5
573	P	37.8	Very low	44.6	Very low	122 Å²	122	149.2 Å²	149.2	79%	0.792	73%	0.729	S	S	*	*	P	Polyproline II helix	trans	-76.1	127.2	169.1	30.8	-31.9	0	0	0	110.4
574	E	29.7	Very low	46.2	Very low	196 Å²	196	145.2 Å²	145.2	92%	0.916	72%	0.717	S	S	*	*	P	Polyproline II helix	trans	-69.6	157.3	168.8	-67.2	-165.1	133.5	0	0	111.8
575	K	41.8	Very low	48.2	Very low	189 Å²	189	136.6 Å²	136.6	82%	0.822	68%	0.68	S	S	*	*	P	Polyproline II helix	trans	-98.5	156.5	178.3	-75.8	-177.7	174.4	179.1	0	111.3
576	N	34.9	Very low	50.3	Low	160 Å²	160	132.6 Å²	132.6	86%	0.856	66%	0.658	S	S	*	*			trans	88.1	71.4	162.4	-56.7	-11.9	0	0	0	118.3
577	S	39.5	Very low	52.5	Low	109 Å²	109	124.5 Å²	124.5	76%	0.762	62%	0.621	S	S	*	*	S	Bend	trans	-147.9	160.5	134.5	69.1	0	0	0	0	109.2
578	E	46.2	Very low	53.8	Low	142 Å²	142	119.5 Å²	119.5	66%	0.664	59%	0.591	S	S	*	*			trans	-52.4	136.7	166	-68.4	-174.2	140.8	0	0	109.4	R580	E578-R580 PolarHBondContact O-N 3.45Å; E578-R580 IonicContact OE2-NE 2.76Å
579	P	48.9	Very low	55.1	Low	83 Å²	83	117.8 Å²	117.8	54%	0.539	58%	0.582	S	S	.	*			trans	-77.8	72.7	-175.2	32.2	-35.8	0	0	0	111	R581	P579-R581 HydrophobicContact CB-CG 4.25Å; P579-R581 PolarHBondContact O-N 2.94Å
580	R	52.8	Low	56.3	Low	175 Å²	175	116.2 Å²	116.2	66%	0.66	57%	0.565	S	S	*	*			trans	-69.5	75.2	166.7	-69.7	-179.9	175.1	-155.7	0.1	108.9	E578	E578-R580 PolarHBondContact O-N 3.45Å; E578-R580 IonicContact OE2-NE 2.76Å
581	R	72.6	Confident	57.7	Low	106 Å²	106	106.8 Å²	106.8	40%	0.4	53%	0.534	S	S	.	.			trans	-82.4	119.6	-177.9	-68.3	177.1	179.4	171.3	0.1	109.8	P579 L599 N663	P579-R581 HydrophobicContact CB-CG 4.25Å; P579-R581 PolarHBondContact O-N 2.94Å; R581-L599 WeakPolarHBondContact O-CB 3.4Å; R581-L599 PolarHBondContact O-N 3.25Å; R581-N663 PolarHBondContact NH1-OD1 2.96Å
582	T	79.5	Confident	59.2	Low	81 Å²	81	106.1 Å²	106.1	50%	0.497	54%	0.536	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-90.6	131.2	171.3	-54	0	0	0	0	109.5	E596 F597	T582-E596 HydrophobicContact CG2-CB 3.86Å; T582-E596 HydrophobicContact CG2-CG 4.41Å; T582-F597 WeakPolarHBondContact CA-O 3.44Å
583	I	83.8	Confident	61.1	Low	21 Å²	21	98.5 Å²	98.5	11%	0.108	51%	0.512	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-112.5	141.8	177.3	-66.3	176.6	0	0	0	109.4	I585 E596 F597 L599 Y662 W670	I583-I585 HydrophobicContact CG2-CG1 4.36Å; I583-E596 WeakPolarHBondContact O-CA 3.36Å; I583-F597 PolarHBondContact N-O 3.43Å; I583-F597 PolarHBondContact O-N 3.06Å; I583-L599 HydrophobicContact CD1-CD1 3.37Å; I583-L599 HydrophobicContact CD1-CD2 4.29Å; I583-L599 HydrophobicContact CD1-CG 3.78Å; I583-L599 HydrophobicContact CG1-CD1 4.26Å; I583-L599 HydrophobicContact CG1-CG 4.35Å; I583-Y662 HydrophobicContact CD1-CD2 3.34Å; I583-Y662 HydrophobicContact CD1-CE2 3.86Å; I583-Y662 HydrophobicContact CD1-CG 4.04Å; I583-Y662 HydrophobicContact CG1-CD2 4.22Å; I583-Y662 HydrophobicContact CG1-CE2 4.25Å; I583-W670 HydrophobicContact CD1-CE3 4.19Å; I583-W670 HydrophobicContact CD1-CH2 3.42Å; I583-W670 VanDerWaalsContact CD1-CH2 3.42Å; I583-W670 HydrophobicContact CD1-CZ2 3.92Å; I583-W670 HydrophobicContact CD1-CZ3 3.58Å; I583-W670 HydrophobicContact CG2-CD2 4.27Å; I583-W670 HydrophobicContact CG2-CE3 3.93Å; I583-W670 HydrophobicContact CG2-CZ3 4.29Å
584	K	84.4	Confident	63.2	Low	142 Å²	142	97.2 Å²	97.2	62%	0.617	50%	0.502	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-90.2	122.3	170.3	-69	-178.7	173.8	-175.5	0	109.4	E596	K584-E596 WeakPolarHBondContact CE-OE1 3.34Å; K584-E596 HydrophobicContact CG-CG 4.12Å; K584-E596 IonicContact NZ-OE1 3.8Å
585	I	87.1	Confident	65.8	Low	0 Å²	0	88.1 Å²	88.1	0%	0	46%	0.46	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-110.3	130	179.8	-60.2	148.4	0	0	0	107.7	I583 T594 M595 F597 L608 L640 W670 I672	I583-I585 HydrophobicContact CG2-CG1 4.36Å; I585-T594 CarbonylContact O-C 3.47Å; I585-T594 WeakPolarHBondContact O-CA 3.38Å; I585-M595 HydrophobicContact CB-CB 4.47Å; I585-M595 PolarHBondContact N-O 3.34Å; I585-M595 PolarHBondContact O-N 3.25Å; I585-F597 HydrophobicContact CD1-CB 3.42Å; I585-F597 VanDerWaalsContact CD1-CB 3.42Å; I585-F597 HydrophobicContact CD1-CG 4.23Å; I585-L608 HydrophobicContact CD1-CD1 3.48Å; I585-L608 VanDerWaalsContact CD1-CD1 3.48Å; I585-L608 HydrophobicContact CD1-CD2 4.2Å; I585-L608 HydrophobicContact CD1-CG 3.9Å; I585-L608 HydrophobicContact CG1-CD1 4.39Å; I585-L640 HydrophobicContact CG2-CD1 4.04Å; I585-W670 CarbonylContact C-O 3.55Å; I585-W670 WeakPolarHBondContact CA-O 3.4Å; I585-W670 HydrophobicContact CG1-CB 4.24Å; I585-W670 HydrophobicContact CG1-CE3 4.29Å; I585-W670 HydrophobicContact CG2-CB 4.47Å; I585-I672 HydrophobicContact CG2-CD1 4.09Å; I585-I672 HydrophobicContact CG2-CG1 3.86Å
586	Q	84.4	Confident	67.8	Low	83 Å²	83	84.4 Å²	84.4	39%	0.388	45%	0.446	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-78.6	128.9	173.3	-64.7	171.1	17.9	0	0	109.3	E669 W670 V671 I672	Q586-E669 PolarHBondContact NE2-OE2 3.29Å; Q586-W670 PolarHBondContact N-O 2.89Å; Q586-V671 HydrophobicContact CB-CB 4.49Å; Q586-V671 HydrophobicContact CB-CG1 4.15Å; Q586-V671 HydrophobicContact CB-CG2 4.25Å; Q586-V671 CarbonylContact O-C 3.37Å; Q586-V671 WeakPolarHBondContact O-CA 3.07Å; Q586-I672 PolarHBondContact O-N 3.04Å
587	V	79.6	Confident	70.2	Confident	8 Å²	8	77.3 Å²	77.3	5%	0.048	41%	0.407	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-93.3	104.4	170.9	178.3	0	0	0	0	107.5	V591 G593 M595 F612 F616	V587-V591 HydrophobicContact CG1-CB 4.19Å; V587-V591 WeakPolarHBondContact CG1-O 3.27Å; V587-G593 PolarHBondContact N-O 3.11Å; V587-M595 HydrophobicContact CG2-CB 4.12Å; V587-F612 HydrophobicContact CB-CE2 4.37Å; V587-F612 HydrophobicContact CG1-CD2 4.41Å; V587-F612 HydrophobicContact CG1-CE2 3.45Å; V587-F612 VanDerWaalsContact CG1-CE2 3.45Å; V587-F612 HydrophobicContact CG1-CZ 3.93Å; V587-F612 HydrophobicContact CG2-CD2 4.14Å; V587-F612 HydrophobicContact CG2-CE2 3.95Å; V587-F616 HydrophobicContact CG2-CE2 4.49Å; V587-F616 HydrophobicContact CG2-CZ 4.48Å
588	G	64.5	Low	72.4	Confident	18 Å²	18	76.9 Å²	76.9	19%	0.186	39%	0.393	C	S	.	.			trans	-84.4	157.6	178.2	0	0	0	0	0	113.3	L590 I672	G588-L590 PolarHBondContact O-N 2.7Å; G588-I672 VanDerWaalsContact CA-O 3.31Å; G588-I672 WeakPolarHBondContact CA-O 3.26Å; G588-I672 PolarHBondContact N-O 3.1Å
589	D	58.9	Low	74.2	Confident	122 Å²	122	70.3 Å²	70.3	65%	0.652	36%	0.362	S	S	*	.	S	Bend	trans	58.9	-24.1	168.4	-53.9	-32.7	0	0	0	119.3
590	L	57.6	Low	75.9	Confident	72 Å²	72	70.4 Å²	70.4	38%	0.377	36%	0.358	S	S	.	.	S	Bend	trans	-112.6	-37.2	-172.1	-75.7	163.7	0	0	0	114.1	G588 P636 T674	G588-L590 PolarHBondContact O-N 2.7Å; L590-P636 HydrophobicContact CD1-CB 4.24Å; L590-P636 HydrophobicContact CD1-CG 3.56Å; L590-P636 HydrophobicContact CD2-CG 3.97Å; L590-P636 HydrophobicContact CG-CG 4.44Å; L590-T674 HydrophobicContact CD1-CG2 3.66Å; L590-T674 HydrophobicContact CD2-CG2 4.48Å; L590-T674 HydrophobicContact CG-CG2 4.01Å
591	V	62.8	Low	77.4	Confident	40 Å²	40	66.9 Å²	66.9	24%	0.242	35%	0.351	C	S	.	.	S	Bend	trans	-147.6	115.5	178.5	-177.1	0	0	0	0	107.4	V587 G593 F616	V587-V591 HydrophobicContact CG1-CB 4.19Å; V587-V591 WeakPolarHBondContact CG1-O 3.27Å; V591-G593 PolarHBondContact O-N 3.03Å; V591-F616 HydrophobicContact CB-CD1 4.25Å; V591-F616 HydrophobicContact CG1-CD1 4.05Å; V591-F616 HydrophobicContact CG1-CE1 4.29Å; V591-F616 HydrophobicContact CG2-CB 4.5Å; V591-F616 HydrophobicContact CG2-CD1 4.19Å
592	N	63.3	Low	77.9	Confident	167 Å²	167	66.9 Å²	66.9	89%	0.893	36%	0.36	S	S	*	.	S	Bend	trans	-65	100.6	173.5	-78.4	-0.2	0	0	0	109.5
593	G	73.4	Confident	78.4	Confident	33 Å²	33	63.3 Å²	63.3	34%	0.34	34%	0.338	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-174.7	166.5	-178.6	0	0	0	0	0	113.7	V587 V591	V587-G593 PolarHBondContact N-O 3.11Å; V591-G593 PolarHBondContact O-N 3.03Å
594	T	80.9	Confident	78.7	Confident	95 Å²	95	66.9 Å²	66.9	58%	0.583	35%	0.35	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-111	133.5	173.2	54.4	0	0	0	0	110	I585	I585-T594 CarbonylContact O-C 3.47Å; I585-T594 WeakPolarHBondContact O-CA 3.38Å
595	M	84.4	Confident	79	Confident	4 Å²	4	60.1 Å²	60.1	2%	0.02	32%	0.321	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-103.1	130.1	173.8	178	178.5	167.4	0	0	109.3	I585 V587 F597 Q611 F612 F616	I585-M595 HydrophobicContact CB-CB 4.47Å; I585-M595 PolarHBondContact N-O 3.34Å; I585-M595 PolarHBondContact O-N 3.25Å; V587-M595 HydrophobicContact CG2-CB 4.12Å; M595-F597 HydrophobicContact CE-CD2 4.15Å; M595-Q611 HydrophobicContact CE-CB 3.82Å; M595-Q611 VanDerWaalsContact CE-CD 3.46Å; M595-Q611 HydrophobicContact CE-CG 3.51Å; M595-F612 HydrophobicContact SD-CB 4.04Å; M595-F612 HydrophobicContact SD-CD2 4.4Å; M595-F616 HydrophobicContact CB-CE2 4.11Å; M595-F616 HydrophobicContact CB-CZ 4.33Å; M595-F616 HydrophobicContact CG-CE2 4.14Å; M595-F616 HydrophobicContact SD-CE2 4.01Å
596	E	84.4	Confident	79.1	Confident	112 Å²	112	62 Å²	62	52%	0.523	33%	0.334	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-91.6	132.2	170.8	-68	-166.3	166.3	0	0	110.4	T582 I583 K584	T582-E596 HydrophobicContact CG2-CB 3.86Å; T582-E596 HydrophobicContact CG2-CG 4.41Å; I583-E596 WeakPolarHBondContact O-CA 3.36Å; K584-E596 WeakPolarHBondContact CE-OE1 3.34Å; K584-E596 HydrophobicContact CG-CG 4.12Å; K584-E596 IonicContact NZ-OE1 3.8Å
597	F	85.4	Confident	79.3	Confident	10 Å²	10	61.7 Å²	61.7	4%	0.044	34%	0.335	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-133	128.2	-179.7	-172.9	-91.3	0	0	0	110.7	T582 I583 I585 M595 L599 C603 L608 L658	T582-F597 WeakPolarHBondContact CA-O 3.44Å; I583-F597 PolarHBondContact N-O 3.43Å; I583-F597 PolarHBondContact O-N 3.06Å; I585-F597 HydrophobicContact CD1-CB 3.42Å; I585-F597 VanDerWaalsContact CD1-CB 3.42Å; I585-F597 HydrophobicContact CD1-CG 4.23Å; M595-F597 HydrophobicContact CE-CD2 4.15Å; F597-L599 HydrophobicContact CD1-CD2 4.14Å; F597-L599 HydrophobicContact CE1-CD2 4.19Å; F597-C603 HydrophobicContact CE1-CB 3.99Å; F597-C603 HydrophobicContact CZ-CB 4.28Å; F597-L608 HydrophobicContact CD1-CD1 4.21Å; F597-L608 HydrophobicContact CD2-CB 4.2Å; F597-L608 HydrophobicContact CD2-CG 4.05Å; F597-L608 HydrophobicContact CE1-CB 4.42Å; F597-L608 HydrophobicContact CE2-CB 3.85Å; F597-L608 HydrophobicContact CE2-CG 4.23Å; F597-L608 HydrophobicContact CG-CD1 4.21Å; F597-L608 HydrophobicContact CG-CG 4.23Å; F597-L608 HydrophobicContact CZ-CB 3.97Å; F597-L658 HydrophobicContact CE1-CD1 3.97Å; F597-L658 HydrophobicContact CZ-CD1 4.48Å
598	Q	85.2	Confident	79.8	Confident	100 Å²	100	61.3 Å²	61.3	47%	0.467	33%	0.333	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-88.3	117.9	179.6	-172.4	-172.8	-18.6	0	0	110.1
599	L	85.3	Confident	80.9	Confident	5 Å²	5	61.1 Å²	61.1	3%	0.026	33%	0.327	C	S	.	.			trans	-71.9	139.7	176.7	-70.3	-173	0	0	0	112.6	R581 I583 F597 L658 L659 Y662 W670	R581-L599 WeakPolarHBondContact O-CB 3.4Å; R581-L599 PolarHBondContact O-N 3.25Å; I583-L599 HydrophobicContact CD1-CD1 3.37Å; I583-L599 HydrophobicContact CD1-CD2 4.29Å; I583-L599 HydrophobicContact CD1-CG 3.78Å; I583-L599 HydrophobicContact CG1-CD1 4.26Å; I583-L599 HydrophobicContact CG1-CG 4.35Å; F597-L599 HydrophobicContact CD1-CD2 4.14Å; F597-L599 HydrophobicContact CE1-CD2 4.19Å; L599-L658 HydrophobicContact CD2-CB 3.57Å; L599-L658 HydrophobicContact CD2-CD1 4.46Å; L599-L659 HydrophobicContact CD1-CD1 3.98Å; L599-Y662 HydrophobicContact CD1-CG 4.27Å; L599-W670 HydrophobicContact CD1-CH2 4.24Å; L599-W670 HydrophobicContact CD2-CH2 3.94Å; L599-W670 HydrophobicContact CD2-CZ3 3.97Å
600	N	84	Confident	82.2	Confident	85 Å²	85	57.1 Å²	57.1	46%	0.455	31%	0.311	S	S	.	.			trans	-131.6	169.3	158.8	78.4	51.9	0	0	0	110	N602 C603	N600-N602 PolarHBondContact O-N 3.35Å; N600-N602 VanDerWaalsContact O-N 3.17Å; N600-N602 WeakPolarHBondContact OD1-CA 3.23Å; N600-N602 WeakPolarHBondContact OD1-CB 3.32Å; N600-N602 PolarHBondContact OD1-N 2.88Å; N600-C603 PolarHBondContact N-SG 3.3Å; N600-C603 PolarHBondContact ND2-SG 3.27Å; N600-C603 WeakPolarHBondContact O-CB 3.49Å; N600-C603 PolarHBondContact O-N 3.02Å; N600-C603 PolarHBondContact OD1-N 3.05Å
601	I	82.9	Confident	83.5	Confident	100 Å²	100	56.5 Å²	56.5	51%	0.513	31%	0.306	S	S	.	.	T	Hydrogen-bonded Turn	trans	-63	-20.6	-175	-167.8	166.3	0	0	0	114.9	R282 H657 L659	R282-I601 PolarHBondContact NH2-O 2.92Å; I601-H657 PolarHBondContact O-ND1 3.26Å; I601-H657 VanDerWaalsContact O-ND1 3.12Å; I601-L659 HydrophobicContact CB-CD2 4.21Å; I601-L659 HydrophobicContact CG1-CD2 4.47Å
602	N	84.9	Confident	84.5	Confident	107 Å²	107	54.6 Å²	54.6	57%	0.572	30%	0.295	S	S	*	.	T	Hydrogen-bonded Turn	trans	-104.2	-7.5	-178.3	-64.9	-28.6	0	0	0	113.3	N600 R604	N600-N602 PolarHBondContact O-N 3.35Å; N600-N602 VanDerWaalsContact O-N 3.17Å; N600-N602 WeakPolarHBondContact OD1-CA 3.23Å; N600-N602 WeakPolarHBondContact OD1-CB 3.32Å; N600-N602 PolarHBondContact OD1-N 2.88Å; N602-R604 PolarHBondContact O-N 3.43Å
603	C	88.7	Confident	85.4	Confident	6 Å²	6	49.3 Å²	49.3	4%	0.041	26%	0.262	C	S	.	.			trans	-60.4	119	179.3	-76.8	0	0	0	0	111.4	F597 N600 H657 L658	F597-C603 HydrophobicContact CE1-CB 3.99Å; F597-C603 HydrophobicContact CZ-CB 4.28Å; N600-C603 PolarHBondContact N-SG 3.3Å; N600-C603 PolarHBondContact ND2-SG 3.27Å; N600-C603 WeakPolarHBondContact O-CB 3.49Å; N600-C603 PolarHBondContact O-N 3.02Å; N600-C603 PolarHBondContact OD1-N 3.05Å; C603-H657 WeakPolarHBondContact O-CA 3.49Å; C603-L658 HydrophobicContact CB-CB 4.48Å; C603-L658 HydrophobicContact CB-CD1 4.33Å; C603-L658 PolarHBondContact O-N 2.89Å
604	R	91.5	Very high	85.8	Confident	95 Å²	95	55.6 Å²	55.6	36%	0.358	28%	0.276	S	S	.	.	B	Isolated β-bridge	trans	-102.5	162	172	-61.4	-176.8	-170.8	148.9	17.5	111.7	N602 S606 D607 L608 E655 T656 H657	N602-R604 PolarHBondContact O-N 3.43Å; R604-S606 WeakPolarHBondContact CB-OG 3.5Å; R604-S606 PolarHBondContact O-N 2.86Å; R604-D607 PolarHBondContact N-OD2 2.93Å; R604-D607 WeakPolarHBondContact O-CB 3.38Å; R604-D607 PolarHBondContact O-N 3.17Å; R604-L608 PolarHBondContact O-N 3.22Å; R604-E655 WeakPolarHBondContact CD-OE2 3.46Å; R604-E655 IonicContact CZ-OE2 3.06Å; R604-E655 IonicContact NE-OE2 2.95Å; R604-E655 IonicContact NH1-OE2 3.64Å; R604-E655 PolarHBondContact NH1-OE2 2.75Å; R604-T656 CarbonylContact C-O 3.55Å; R604-T656 VanDerWaalsContact CA-O 3.27Å; R604-T656 WeakPolarHBondContact CA-O 3.29Å; R604-H657 PolarHBondContact NE-NE2 2.71Å
605	T	88.8	Confident	85.6	Confident	1 Å²	1	55.5 Å²	55.5	1%	0.006	27%	0.269	C	S	.	.	H	α-helix	trans	-49.5	-39.8	168.6	-57.4	0	0	0	0	112.1	D607 L608 L609 L640 L652 D653 T656	T605-D607 PolarHBondContact O-N 3.34Å; T605-L608 PolarHBondContact O-N 3.48Å; T605-L609 HydrophobicContact CG2-CD1 3.88Å; T605-L609 HydrophobicContact CG2-CG 4.3Å; T605-L609 WeakPolarHBondContact O-CB 3.37Å; T605-L609 WeakPolarHBondContact O-CG 3.3Å; T605-L609 PolarHBondContact O-N 3.49Å; T605-L640 HydrophobicContact CG2-CB 3.78Å; T605-L640 HydrophobicContact CG2-CD2 4.18Å; T605-L652 HydrophobicContact CG2-CB 4.33Å; T605-D653 WeakPolarHBondContact CB-O 3.01Å; T605-D653 PolarHBondContact OG1-O 3.32Å; T605-T656 PolarHBondContact N-O 2.79Å; T605-T656 PolarHBondContact OG1-O 3.46Å
606	S	89.7	Confident	85	Confident	39 Å²	39	57.3 Å²	57.3	27%	0.273	28%	0.276	S	S	.	.	H	α-helix	trans	-61.6	-37.9	176.9	49.4	0	0	0	0	113.8	R604 A610 T654	R604-S606 WeakPolarHBondContact CB-OG 3.5Å; R604-S606 PolarHBondContact O-N 2.86Å; S606-A610 WeakPolarHBondContact O-CB 3.24Å; S606-A610 PolarHBondContact O-N 3.5Å; S606-T654 VanDerWaalsContact CB-O 3.32Å; S606-T654 WeakPolarHBondContact CB-O 3.44Å; S606-T654 PolarHBondContact N-O 2.92Å; S606-T654 PolarHBondContact OG-O 3.41Å
607	D	89.9	Confident	84.3	Confident	77 Å²	77	53.4 Å²	53.4	41%	0.412	26%	0.259	S	S	.	.	H	α-helix	trans	-67	-45.5	177.3	-60.5	-53	0	0	0	111.6	R604 T605 A610 Q611	R604-D607 PolarHBondContact N-OD2 2.93Å; R604-D607 WeakPolarHBondContact O-CB 3.38Å; R604-D607 PolarHBondContact O-N 3.17Å; T605-D607 PolarHBondContact O-N 3.34Å; D607-A610 PolarHBondContact O-N 3.45Å; D607-Q611 PolarHBondContact O-N 3.47Å
608	L	88.8	Confident	83.1	Confident	0 Å²	0	61.2 Å²	61.2	0%	0	29%	0.288	C	S	.	.	H	α-helix	trans	-62	-48.5	177.4	-179.4	164.5	0	0	0	110.7	I585 F597 R604 T605 A610 Q611 F612 L640 L658 W670 I672	I585-L608 HydrophobicContact CD1-CD1 3.48Å; I585-L608 VanDerWaalsContact CD1-CD1 3.48Å; I585-L608 HydrophobicContact CD1-CD2 4.2Å; I585-L608 HydrophobicContact CD1-CG 3.9Å; I585-L608 HydrophobicContact CG1-CD1 4.39Å; F597-L608 HydrophobicContact CD1-CD1 4.21Å; F597-L608 HydrophobicContact CD2-CB 4.2Å; F597-L608 HydrophobicContact CD2-CG 4.05Å; F597-L608 HydrophobicContact CE1-CB 4.42Å; F597-L608 HydrophobicContact CE2-CB 3.85Å; F597-L608 HydrophobicContact CE2-CG 4.23Å; F597-L608 HydrophobicContact CG-CD1 4.21Å; F597-L608 HydrophobicContact CG-CG 4.23Å; F597-L608 HydrophobicContact CZ-CB 3.97Å; R604-L608 PolarHBondContact O-N 3.22Å; T605-L608 PolarHBondContact O-N 3.48Å; L608-A610 VanDerWaalsContact C-N 3.32Å; L608-A610 PolarHBondContact O-N 3.09Å; L608-Q611 PolarHBondContact O-N 2.95Å; L608-Q611 VanDerWaalsContact O-N 3.15Å; L608-F612 PolarHBondContact O-N 3.34Å; L608-L640 HydrophobicContact CD1-CD1 4.45Å; L608-L640 HydrophobicContact CD1-CD2 3.67Å; L608-L640 HydrophobicContact CD2-CD1 3.99Å; L608-L640 HydrophobicContact CD2-CD2 4.08Å; L608-L640 HydrophobicContact CG-CD2 4.44Å; L608-L658 HydrophobicContact CB-CD1 3.81Å; L608-L658 HydrophobicContact CD1-CD1 3.51Å; L608-L658 HydrophobicContact CG-CD1 4.34Å; L608-W670 HydrophobicContact CD1-CE3 4.37Å; L608-W670 HydrophobicContact CD1-CZ3 4.49Å; L608-I672 HydrophobicContact CD2-CD1 3.87Å; L608-I672 HydrophobicContact CD2-CG1 4.36Å
609	L	87.8	Confident	81.5	Confident	14 Å²	14	58.3 Å²	58.3	7%	0.073	28%	0.279	C	S	.	.	H	α-helix	trans	-61.2	-40.7	174.8	-70.5	174.5	0	0	0	111.3	T605 Q611 F612 Y613 I672	T605-L609 HydrophobicContact CG2-CD1 3.88Å; T605-L609 HydrophobicContact CG2-CG 4.3Å; T605-L609 WeakPolarHBondContact O-CB 3.37Å; T605-L609 WeakPolarHBondContact O-CG 3.3Å; T605-L609 PolarHBondContact O-N 3.49Å; L609-Q611 VanDerWaalsContact C-N 3.28Å; L609-Q611 PolarHBondContact O-N 3.11Å; L609-F612 WeakPolarHBondContact O-CB 3.41Å; L609-F612 PolarHBondContact O-N 3.17Å; L609-Y613 HydrophobicContact CB-CD2 4.44Å; L609-Y613 HydrophobicContact CB-CE2 4.18Å; L609-Y613 WeakPolarHBondContact O-CD2 3.37Å; L609-Y613 PolarHBondContact O-N 3.5Å; L609-I672 HydrophobicContact CD2-CD1 4.48Å; L609-I672 HydrophobicContact CD2-CG1 4.49Å; L609-I672 HydrophobicContact CD2-CG2 4.33Å
610	A	85.8	Confident	79.7	Confident	37 Å²	37	64 Å²	64	31%	0.306	32%	0.316	S	S	.	.	H	α-helix	trans	-66.7	-25.8	176.4	0	0	0	0	0	113.7	S606 D607 L608 R614	S606-A610 WeakPolarHBondContact O-CB 3.24Å; S606-A610 PolarHBondContact O-N 3.5Å; D607-A610 PolarHBondContact O-N 3.45Å; L608-A610 VanDerWaalsContact C-N 3.32Å; L608-A610 PolarHBondContact O-N 3.09Å; A610-R614 WeakPolarHBondContact O-CG 3.33Å; A610-R614 PolarHBondContact O-N 3.22Å; A610-R614 PolarHBondContact O-NE 2.88Å
611	Q	85.3	Confident	77.9	Confident	59 Å²	59	68.4 Å²	68.4	28%	0.276	33%	0.334	S	S	.	.	H	α-helix	trans	-75.6	-44.3	168.9	-175.2	180	-19.3	0	0	111	M595 D607 L608 L609 Y613 R614 Q615	M595-Q611 HydrophobicContact CE-CB 3.82Å; M595-Q611 VanDerWaalsContact CE-CD 3.46Å; M595-Q611 HydrophobicContact CE-CG 3.51Å; D607-Q611 PolarHBondContact O-N 3.47Å; L608-Q611 PolarHBondContact O-N 2.95Å; L608-Q611 VanDerWaalsContact O-N 3.15Å; L609-Q611 VanDerWaalsContact C-N 3.28Å; L609-Q611 PolarHBondContact O-N 3.11Å; Q611-Y613 PolarHBondContact O-N 3.11Å; Q611-R614 WeakPolarHBondContact O-CA 3.41Å; Q611-R614 WeakPolarHBondContact O-CB 3.28Å; Q611-R614 PolarHBondContact O-N 3.48Å; Q611-Q615 HydrophobicContact CG-CG 4.31Å; Q611-Q615 VanDerWaalsContact NE2-NE2 3.17Å; Q611-Q615 PolarHBondContact O-N 3.38Å
612	F	84.8	Confident	76.4	Confident	1 Å²	1	68.6 Å²	68.6	0%	0.004	34%	0.336	C	S	.	.	H	α-helix	trans	-55.7	-50.2	174.7	170.3	-106.5	0	0	0	112.3	V587 M595 L608 L609 R614 Q615 F616 L617 C638 I672	V587-F612 HydrophobicContact CB-CE2 4.37Å; V587-F612 HydrophobicContact CG1-CD2 4.41Å; V587-F612 HydrophobicContact CG1-CE2 3.45Å; V587-F612 VanDerWaalsContact CG1-CE2 3.45Å; V587-F612 HydrophobicContact CG1-CZ 3.93Å; V587-F612 HydrophobicContact CG2-CD2 4.14Å; V587-F612 HydrophobicContact CG2-CE2 3.95Å; M595-F612 HydrophobicContact SD-CB 4.04Å; M595-F612 HydrophobicContact SD-CD2 4.4Å; L608-F612 PolarHBondContact O-N 3.34Å; L609-F612 WeakPolarHBondContact O-CB 3.41Å; L609-F612 PolarHBondContact O-N 3.17Å; F612-R614 PolarHBondContact O-N 3.07Å; F612-Q615 PolarHBondContact O-N 3.46Å; F612-F616 HydrophobicContact CD2-CB 4.11Å; F612-F616 AromaticContact CD2-CD2 3.38Å; F612-F616 HydrophobicContact CD2-CD2 3.38Å; F612-F616 HydrophobicContact CD2-CE2 4.09Å; F612-F616 AromaticContact CD2-CG 3.96Å; F612-F616 HydrophobicContact CD2-CG 3.96Å; F612-F616 HydrophobicContact CE2-CB 3.67Å; F612-F616 AromaticContact CE2-CD2 3.65Å; F612-F616 HydrophobicContact CE2-CD2 3.65Å; F612-F616 HydrophobicContact CE2-CE2 4.48Å; F612-F616 AromaticContact CE2-CG 3.72Å; F612-F616 HydrophobicContact CE2-CG 3.72Å; F612-F616 HydrophobicContact CG-CD2 4.43Å; F612-F616 HydrophobicContact CZ-CB 4.27Å; F612-F616 PolarHBondContact O-N 2.95Å; F612-L617 HydrophobicContact CD1-CD1 4.4Å; F612-L617 HydrophobicContact CE1-CD1 3.69Å; F612-L617 HydrophobicContact CE1-CG 4.45Å; F612-L617 HydrophobicContact CZ-CD1 4.18Å; F612-C638 HydrophobicContact CE1-CB 4.35Å; F612-I672 HydrophobicContact CB-CD1 3.82Å; F612-I672 HydrophobicContact CD1-CD1 4.2Å; F612-I672 HydrophobicContact CD1-CG2 4.18Å; F612-I672 HydrophobicContact CD2-CD1 3.81Å; F612-I672 HydrophobicContact CE1-CG2 4.04Å; F612-I672 HydrophobicContact CG-CD1 3.65Å; F612-I672 HydrophobicContact CZ-CG2 4.35Å
613	Y	82.4	Confident	74.7	Confident	55 Å²	55	66.3 Å²	66.3	22%	0.216	34%	0.338	C	S	.	.	I	π-helix	trans	-59	-31.4	175.7	-74.4	-65.5	0	0	0	112.7	L609 Q611 L617 R618 P636 C638	L609-Y613 HydrophobicContact CB-CD2 4.44Å; L609-Y613 HydrophobicContact CB-CE2 4.18Å; L609-Y613 WeakPolarHBondContact O-CD2 3.37Å; L609-Y613 PolarHBondContact O-N 3.5Å; Q611-Y613 PolarHBondContact O-N 3.11Å; Y613-L617 HydrophobicContact CD1-CB 4.46Å; Y613-L617 HydrophobicContact CD1-CD1 3.41Å; Y613-L617 VanDerWaalsContact CD1-CD1 3.41Å; Y613-L617 HydrophobicContact CE1-CD1 3.69Å; Y613-L617 HydrophobicContact CG-CD1 4.49Å; Y613-R618 WeakPolarHBondContact O-CG 3.37Å; Y613-R618 PolarHBondContact O-N 3Å; Y613-P636 PolarHBondContact OH-O 3.36Å; Y613-C638 PolarHBondContact OH-N 3.25Å
614	R	80.3	Confident	72.8	Confident	165 Å²	165	75.7 Å²	75.7	62%	0.623	38%	0.378	S	S	*	.	I	π-helix	trans	-75.7	-45.2	176.8	-83.6	-177.7	-85.2	-168.5	-3.2	112.6	A610 Q611 F612	A610-R614 WeakPolarHBondContact O-CG 3.33Å; A610-R614 PolarHBondContact O-N 3.22Å; A610-R614 PolarHBondContact O-NE 2.88Å; Q611-R614 WeakPolarHBondContact O-CA 3.41Å; Q611-R614 WeakPolarHBondContact O-CB 3.28Å; Q611-R614 PolarHBondContact O-N 3.48Å; F612-R614 PolarHBondContact O-N 3.07Å
615	Q	76.9	Confident	70.9	Confident	94 Å²	94	72.8 Å²	72.8	44%	0.439	38%	0.377	S	S	.	.	I	π-helix	trans	-75.6	-46.1	-175.7	-72.6	-179.3	-27.5	0	0	113	Q611 F612 S619	Q611-Q615 HydrophobicContact CG-CG 4.31Å; Q611-Q615 VanDerWaalsContact NE2-NE2 3.17Å; Q611-Q615 PolarHBondContact O-N 3.38Å; F612-Q615 PolarHBondContact O-N 3.46Å; Q615-S619 WeakPolarHBondContact O-CB 3.5Å
616	F	72.3	Confident	69	Low	41 Å²	41	81.3 Å²	81.3	18%	0.18	41%	0.414	C	S	.	.	I	π-helix	trans	-101.2	-31.1	-168.6	-67.1	-86.6	0	0	0	114.1	V587 V591 M595 F612	V587-F616 HydrophobicContact CG2-CE2 4.49Å; V587-F616 HydrophobicContact CG2-CZ 4.48Å; V591-F616 HydrophobicContact CB-CD1 4.25Å; V591-F616 HydrophobicContact CG1-CD1 4.05Å; V591-F616 HydrophobicContact CG1-CE1 4.29Å; V591-F616 HydrophobicContact CG2-CB 4.5Å; V591-F616 HydrophobicContact CG2-CD1 4.19Å; M595-F616 HydrophobicContact CB-CE2 4.11Å; M595-F616 HydrophobicContact CB-CZ 4.33Å; M595-F616 HydrophobicContact CG-CE2 4.14Å; M595-F616 HydrophobicContact SD-CE2 4.01Å; F612-F616 HydrophobicContact CD2-CB 4.11Å; F612-F616 AromaticContact CD2-CD2 3.38Å; F612-F616 HydrophobicContact CD2-CD2 3.38Å; F612-F616 HydrophobicContact CD2-CE2 4.09Å; F612-F616 AromaticContact CD2-CG 3.96Å; F612-F616 HydrophobicContact CD2-CG 3.96Å; F612-F616 HydrophobicContact CE2-CB 3.67Å; F612-F616 AromaticContact CE2-CD2 3.65Å; F612-F616 HydrophobicContact CE2-CD2 3.65Å; F612-F616 HydrophobicContact CE2-CE2 4.48Å; F612-F616 AromaticContact CE2-CG 3.72Å; F612-F616 HydrophobicContact CE2-CG 3.72Å; F612-F616 HydrophobicContact CG-CD2 4.43Å; F612-F616 HydrophobicContact CZ-CB 4.27Å; F612-F616 PolarHBondContact O-N 2.95Å
617	L	68.8	Low	66.9	Low	31 Å²	31	86.6 Å²	86.6	16%	0.162	44%	0.437	C	S	.	.	I	π-helix	trans	-106.4	-24.7	-171.5	-69.2	169.2	0	0	0	113.9	F612 Y613 Y635 P636	F612-L617 HydrophobicContact CD1-CD1 4.4Å; F612-L617 HydrophobicContact CE1-CD1 3.69Å; F612-L617 HydrophobicContact CE1-CG 4.45Å; F612-L617 HydrophobicContact CZ-CD1 4.18Å; Y613-L617 HydrophobicContact CD1-CB 4.46Å; Y613-L617 HydrophobicContact CD1-CD1 3.41Å; Y613-L617 VanDerWaalsContact CD1-CD1 3.41Å; Y613-L617 HydrophobicContact CE1-CD1 3.69Å; Y613-L617 HydrophobicContact CG-CD1 4.49Å; L617-Y635 HydrophobicContact CB-CD1 3.72Å; L617-Y635 HydrophobicContact CB-CE1 3.91Å; L617-Y635 HydrophobicContact CD1-CD1 4.47Å; L617-Y635 HydrophobicContact CD2-CD1 4.42Å; L617-Y635 HydrophobicContact CG-CD1 4.43Å; L617-Y635 WeakPolarHBondContact O-CE1 3.48Å; L617-P636 HydrophobicContact CD1-CG 4.31Å; L617-P636 HydrophobicContact CD2-CG 4.48Å
618	R	60.9	Low	65.2	Low	174 Å²	174	89.8 Å²	89.8	66%	0.657	44%	0.443	S	S	*	.	S	Bend	trans	-97.7	-3.7	173.6	-75.3	-173.5	176.7	-146.8	2.4	114.9	Y613 Y635	Y613-R618 WeakPolarHBondContact O-CG 3.37Å; Y613-R618 PolarHBondContact O-N 3Å; R618-Y635 HydrophobicContact CG-CE2 4.38Å
619	S	50.8	Low	63.3	Low	38 Å²	38	102.6 Å²	102.6	27%	0.266	49%	0.491	S	S	.	.			trans	-67.9	135.8	179	-175.5	0	0	0	0	111.2	Q615 E621 N622	Q615-S619 WeakPolarHBondContact O-CB 3.5Å; S619-E621 PolarHBondContact O-N 2.67Å; S619-E621 VanDerWaalsContact O-N 3.16Å; S619-N622 PolarHBondContact O-N 2.89Å
620	P	47.6	Very low	61.4	Low	125 Å²	125	107.9 Å²	107.9	81%	0.812	52%	0.52	S	S	*	.	G	3₁₀ helix	trans	-57.6	-29.7	-176.2	-26.2	35	0	0	0	114.9
621	E	47.1	Very low	59.6	Low	177 Å²	177	108.7 Å²	108.7	83%	0.827	53%	0.532	S	S	*	.	G	3₁₀ helix	trans	-76.1	-24.7	-172.7	-61.5	-176	149.1	0	0	113.7	S619	S619-E621 PolarHBondContact O-N 2.67Å; S619-E621 VanDerWaalsContact O-N 3.16Å
622	N	51.5	Low	57.9	Low	104 Å²	104	108.4 Å²	108.4	56%	0.556	54%	0.536	S	S	*	.	G	3₁₀ helix	trans	-111.9	14.5	-175.5	-74.6	-28.6	0	0	0	113.8	S619 K624	S619-N622 PolarHBondContact O-N 2.89Å; N622-K624 PolarHBondContact O-N 3.33Å
623	G	49.3	Very low	56.5	Low	59 Å²	59	111.6 Å²	111.6	61%	0.608	56%	0.555	S	S	*	*			trans	-69.5	67.4	-168.1	0	0	0	0	0	117.2
624	K	48.7	Very low	55.2	Low	204 Å²	204	109.8 Å²	109.8	89%	0.887	55%	0.554	S	S	*	*			trans	-106.4	43.5	166.6	-72.1	-171.9	-179.9	175.2	0	113.4	N622	N622-K624 PolarHBondContact O-N 3.33Å
625	G	51.3	Low	54.3	Low	33 Å²	33	105.7 Å²	105.7	34%	0.34	54%	0.539	S	S	.	.			trans	-66.7	134	167.5	0	0	0	0	0	111	M627	G625-M627 PolarHBondContact O-N 3.37Å; G625-M627 VanDerWaalsContact O-N 3.16Å
626	K	48.1	Very low	53.8	Low	181 Å²	181	103.3 Å²	103.3	79%	0.787	53%	0.531	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-68.7	115.4	179.3	-75.5	-175.6	178.7	177.4	0	109.9	R628 G634	K626-R628 PolarHBondContact O-N 3.32Å; K626-G634 PolarHBondContact O-N 3Å
627	M	46.8	Very low	54.2	Low	150 Å²	150	104.1 Å²	104.1	74%	0.739	54%	0.537	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-62.7	118.2	172.8	-164.9	104.2	104.2	0	0	109.4	G625	G625-M627 PolarHBondContact O-N 3.37Å; G625-M627 VanDerWaalsContact O-N 3.16Å
628	R	54.5	Low	55	Low	143 Å²	143	102.7 Å²	102.7	54%	0.54	53%	0.53	S	S	.	.			trans	-77.3	157.5	172.8	-67.6	-178.9	174.9	-119.7	-1.1	109.8	K626 N630 G631 S632	K626-R628 PolarHBondContact O-N 3.32Å; R628-N630 WeakPolarHBondContact CB-OD1 3.28Å; R628-N630 PolarHBondContact O-N 2.89Å; R628-G631 PolarHBondContact O-N 3.36Å; R628-S632 WeakPolarHBondContact CB-O 3.27Å; R628-S632 PolarHBondContact N-O 3.45Å
629	R	48.5	Very low	56.4	Low	270 Å²	270	94.6 Å²	94.6	100%	1.019	50%	0.5	S	S	*	.	T	Hydrogen-bonded Turn	trans	-57.6	-14.7	180	-72	-173.8	-175.5	167.7	1.5	114.8
630	N	47.6	Very low	58.3	Low	125 Å²	125	92.8 Å²	92.8	67%	0.668	49%	0.488	S	S	*	.	T	Hydrogen-bonded Turn	trans	-100	14.8	176	65.5	-22.6	0	0	0	113.5	R628 S632	R628-N630 WeakPolarHBondContact CB-OD1 3.28Å; R628-N630 PolarHBondContact O-N 2.89Å; N630-S632 VanDerWaalsContact C-N 3.29Å; N630-S632 PolarHBondContact O-N 3.49Å; N630-S632 PolarHBondContact OD1-OG 3.46Å
631	G	47.3	Very low	60.5	Low	54 Å²	54	87.9 Å²	87.9	56%	0.557	45%	0.453	S	S	*	.	S	Bend	trans	77.2	2.1	177.7	0	0	0	0	0	115.8	R628	R628-G631 PolarHBondContact O-N 3.36Å
632	S	51.3	Low	62.7	Low	53 Å²	53	79.5 Å²	79.5	37%	0.371	41%	0.414	S	S	.	.			trans	-87.7	139.2	176.1	73.6	0	0	0	0	112.6	R628 N630 G634	R628-S632 WeakPolarHBondContact CB-O 3.27Å; R628-S632 PolarHBondContact N-O 3.45Å; N630-S632 VanDerWaalsContact C-N 3.29Å; N630-S632 PolarHBondContact O-N 3.49Å; N630-S632 PolarHBondContact OD1-OG 3.46Å; S632-G634 PolarHBondContact O-N 3.09Å
633	V	54.4	Low	64.6	Low	67 Å²	67	76.5 Å²	76.5	41%	0.406	40%	0.399	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-75.7	115	174.9	-175.2	0	0	0	0	108.9	Y635	V633-Y635 HydrophobicContact CB-CE2 4.35Å; V633-Y635 HydrophobicContact CG1-CD1 4.44Å; V633-Y635 HydrophobicContact CG1-CE1 3.77Å; V633-Y635 HydrophobicContact CG1-CE2 4.15Å
634	G	54.5	Low	66.4	Low	18 Å²	18	75 Å²	75	19%	0.186	38%	0.384	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-86.1	109.7	176.5	0	0	0	0	0	111.9	K626 S632	K626-G634 PolarHBondContact O-N 3Å; S632-G634 PolarHBondContact O-N 3.09Å
635	Y	62.4	Low	68.3	Low	79 Å²	79	66.7 Å²	66.7	31%	0.31	36%	0.356	S	S	.	.			trans	-83.4	150.7	170.4	-61.5	-63.9	0	0	0	111.8	L617 R618 V633	L617-Y635 HydrophobicContact CB-CD1 3.72Å; L617-Y635 HydrophobicContact CB-CE1 3.91Å; L617-Y635 HydrophobicContact CD1-CD1 4.47Å; L617-Y635 HydrophobicContact CD2-CD1 4.42Å; L617-Y635 HydrophobicContact CG-CD1 4.43Å; L617-Y635 WeakPolarHBondContact O-CE1 3.48Å; R618-Y635 HydrophobicContact CG-CE2 4.38Å; V633-Y635 HydrophobicContact CB-CE2 4.35Å; V633-Y635 HydrophobicContact CG1-CD1 4.44Å; V633-Y635 HydrophobicContact CG1-CE1 3.77Å; V633-Y635 HydrophobicContact CG1-CE2 4.15Å
636	P	67.2	Low	70.1	Confident	43 Å²	43	65.9 Å²	65.9	28%	0.279	34%	0.344	S	S	.	.			trans	-64.4	142.3	172.4	27.7	-34.1	0	0	0	110.8	L590 Y613 L617 C638 T674	L590-P636 HydrophobicContact CD1-CB 4.24Å; L590-P636 HydrophobicContact CD1-CG 3.56Å; L590-P636 HydrophobicContact CD2-CG 3.97Å; L590-P636 HydrophobicContact CG-CG 4.44Å; Y613-P636 PolarHBondContact OH-O 3.36Å; L617-P636 HydrophobicContact CD1-CG 4.31Å; L617-P636 HydrophobicContact CD2-CG 4.48Å; P636-C638 PolarHBondContact O-N 3.03Å; P636-C638 VanDerWaalsContact O-N 3.14Å; P636-C638 PolarHBondContact O-SG 3.45Å; P636-C638 VanDerWaalsContact O-SG 3.35Å; P636-T674 HydrophobicContact CB-CG2 4.1Å
637	D	79.1	Confident	72.3	Confident	58 Å²	58	57.6 Å²	57.6	31%	0.31	31%	0.308	S	S	.	.			trans	-78.9	95.4	-179.9	-168.5	-2.6	0	0	0	109.5	K675 R680	D637-K675 WeakPolarHBondContact O-CB 3.45Å; D637-K675 WeakPolarHBondContact O-CG 3.46Å; D637-K675 PolarHBondContact O-N 3.01Å; D637-K675 WeakPolarHBondContact OD1-CE 3.31Å; D637-K675 IonicContact OD1-NZ 3.63Å; D637-K675 PolarHBondContact OD1-NZ 3.44Å; D637-K675 IonicContact OD2-NZ 3.77Å; D637-R680 IonicContact OD2-CZ 2.67Å; D637-R680 IonicContact OD2-NE 3.74Å; D637-R680 IonicContact OD2-NH2 2.6Å; D637-R680 PolarHBondContact OD2-NH2 3.26Å
638	C	86.2	Confident	74.3	Confident	2 Å²	2	52 Å²	52	1%	0.014	29%	0.289	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-93.3	148.6	-177	-53	0	0	0	0	111.3	F612 Y613 P636 I672 K673	F612-C638 HydrophobicContact CE1-CB 4.35Å; Y613-C638 PolarHBondContact OH-N 3.25Å; P636-C638 PolarHBondContact O-N 3.03Å; P636-C638 VanDerWaalsContact O-N 3.14Å; P636-C638 PolarHBondContact O-SG 3.45Å; P636-C638 VanDerWaalsContact O-SG 3.35Å; C638-I672 HydrophobicContact CB-CG2 3.93Å; C638-K673 WeakPolarHBondContact CA-O 3.33Å
639	A	89.8	Confident	76.1	Confident	3 Å²	3	48.3 Å²	48.3	3%	0.025	28%	0.278	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-126.4	156.6	169.9	0	0	0	0	0	110.6	Y641 C651 I672 K673 K675	A639-Y641 HydrophobicContact CB-CD2 4.37Å; A639-Y641 HydrophobicContact CB-CE2 3.74Å; A639-C651 VanDerWaalsContact CB-SG 3.59Å; A639-I672 WeakPolarHBondContact O-CA 3.36Å; A639-K673 PolarHBondContact N-O 3.43Å; A639-K673 PolarHBondContact O-N 3.35Å; A639-K675 HydrophobicContact CB-CD 4.33Å; A639-K675 HydrophobicContact CB-CG 3.7Å
640	L	91.9	Very high	78.2	Confident	0 Å²	0	35.7 Å²	35.7	0%	0	23%	0.231	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-92.8	131.5	170.6	-172.1	66.2	0	0	0	108.6	I585 T605 L608 L652 L658 W670 I672	I585-L640 HydrophobicContact CG2-CD1 4.04Å; T605-L640 HydrophobicContact CG2-CB 3.78Å; T605-L640 HydrophobicContact CG2-CD2 4.18Å; L608-L640 HydrophobicContact CD1-CD1 4.45Å; L608-L640 HydrophobicContact CD1-CD2 3.67Å; L608-L640 HydrophobicContact CD2-CD1 3.99Å; L608-L640 HydrophobicContact CD2-CD2 4.08Å; L608-L640 HydrophobicContact CG-CD2 4.44Å; L640-L652 HydrophobicContact CB-CD1 4.22Å; L640-L652 HydrophobicContact CD2-CD1 3.72Å; L640-L652 HydrophobicContact CG-CD1 3.81Å; L640-L652 WeakPolarHBondContact O-CB 3.49Å; L640-L652 PolarHBondContact O-N 3.47Å; L640-L658 HydrophobicContact CD2-CD2 3.78Å; L640-W670 HydrophobicContact CD1-CB 4.33Å; L640-I672 HydrophobicContact CD1-CG1 3.66Å
641	Y	92.4	Very high	80.4	Confident	23 Å²	23	30.4 Å²	30.4	9%	0.09	20%	0.204	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-114.6	140.4	177.6	-68.7	-103.8	0	0	0	109.6	A639 E649 H650 C651 W670 V671 K673	A639-Y641 HydrophobicContact CB-CD2 4.37Å; A639-Y641 HydrophobicContact CB-CE2 3.74Å; Y641-E649 HydrophobicContact CD1-CG 3.83Å; Y641-H650 CarbonylContact C-O 3.54Å; Y641-H650 VanDerWaalsContact CA-O 3.31Å; Y641-H650 WeakPolarHBondContact CA-O 3.44Å; Y641-C651 HydrophobicContact CD1-CB 3.91Å; Y641-C651 HydrophobicContact CE1-CB 3.55Å; Y641-W670 CarbonylContact O-C 3.51Å; Y641-W670 WeakPolarHBondContact O-CA 3.42Å; Y641-V671 WeakPolarHBondContact CB-O 3.23Å; Y641-V671 PolarHBondContact N-O 3.37Å; Y641-V671 PolarHBondContact O-N 2.95Å; Y641-K673 HydrophobicContact CD2-CB 3.84Å; Y641-K673 HydrophobicContact CD2-CD 4.02Å; Y641-K673 HydrophobicContact CD2-CG 3.85Å; Y641-K673 HydrophobicContact CE2-CB 3.68Å; Y641-K673 HydrophobicContact CE2-CD 4.26Å; Y641-K673 HydrophobicContact CE2-CG 4.17Å; Y641-K673 HydrophobicContact CG-CD 4.26Å; Y641-K673 HydrophobicContact CG-CG 4.49Å
642	E	93.4	Very high	82.6	Confident	0 Å²	0	28.3 Å²	28.3	0%	0	18%	0.179	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-99.4	126.1	166.3	179.6	-162.9	-174.5	0	0	107.9	R546 I647 E649 H650 L652 L661 N665	R546-E642 IonicContact CZ-OE1 3.17Å; R546-E642 IonicContact CZ-OE2 2.91Å; R546-E642 IonicContact NH1-OE1 2.77Å; R546-E642 PolarHBondContact NH1-OE1 3.31Å; R546-E642 IonicContact NH1-OE2 2.71Å; R546-E642 IonicContact NH2-OE1 2.81Å; R546-E642 PolarHBondContact NH2-OE1 3.32Å; R546-E642 IonicContact NH2-OE2 3.8Å; R546-E642 PolarHBondContact NH2-OE2 3.11Å; E642-I647 HydrophobicContact CB-CG2 4.45Å; E642-I647 HydrophobicContact CG-CG2 3.78Å; E642-E649 CarbonylContact O-C 3.57Å; E642-E649 WeakPolarHBondContact O-CA 3.29Å; E642-H650 HydrophobicContact CB-CB 4.46Å; E642-H650 PolarHBondContact N-O 2.77Å; E642-H650 PolarHBondContact O-N 3.21Å; E642-H650 IonicContact OE2-ND1 2.97Å; E642-H650 PolarHBondContact OE2-ND1 2.92Å; E642-L652 HydrophobicContact CB-CD1 4.47Å; E642-L652 HydrophobicContact CB-CD2 4.08Å; E642-L652 HydrophobicContact CB-CG 4.44Å; E642-L661 WeakPolarHBondContact OE2-CD1 3.4Å; E642-N665 WeakPolarHBondContact OE1-CB 2.93Å; E642-N665 PolarHBondContact OE1-ND2 3.44Å
643	V	91.3	Very high	84.5	Confident	41 Å²	41	27.7 Å²	27.7	25%	0.248	17%	0.172	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-131.3	130.8	-173.2	-174.8	0	0	0	0	109.7	G648 E649 G668 E669 V671	V643-G648 WeakPolarHBondContact CA-O 3.29Å; V643-E649 HydrophobicContact CG2-CG 4.27Å; V643-G668 CarbonylContact O-C 3.59Å; V643-G668 WeakPolarHBondContact O-CA 3.31Å; V643-E669 PolarHBondContact N-O 3.33Å; V643-E669 PolarHBondContact O-N 3.13Å; V643-V671 HydrophobicContact CG2-CG2 4.02Å
644	G	87.4	Confident	86.2	Confident	29 Å²	29	27.7 Å²	27.7	30%	0.299	17%	0.172	S	C	.	.	S	Bend	trans	76.3	-167.7	178.2	0	0	0	0	0	115.5	N646 I647 G648 N665	G644-N646 PolarHBondContact O-N 3.2Å; G644-I647 CarbonylContact C-O 3.59Å; G644-I647 WeakPolarHBondContact CA-O 3.34Å; G644-I647 PolarHBondContact N-O 3.48Å; G644-I647 VanDerWaalsContact N-O 3.11Å; G644-I647 PolarHBondContact O-N 2.98Å; G644-G648 PolarHBondContact N-O 3.18Å; G644-N665 PolarHBondContact O-ND2 3.47Å
645	G	88.3	Confident	87.9	Confident	29 Å²	29	29.7 Å²	29.7	30%	0.299	18%	0.177	S	C	.	.	T	Hydrogen-bonded Turn	trans	71.5	-110.9	-172.1	0	0	0	0	0	111.6	N553 N665 G667	N553-G645 PolarHBondContact ND2-O 3.41Å; G645-N665 WeakPolarHBondContact CA-OD1 3.47Å; G645-G667 VanDerWaalsContact CA-O 3.25Å; G645-G667 WeakPolarHBondContact CA-O 3.37Å; G645-G667 PolarHBondContact N-O 3.28Å
646	N	90.6	Very high	89.3	Confident	16 Å²	16	26 Å²	26	9%	0.086	16%	0.162	C	C	.	.	T	Hydrogen-bonded Turn	trans	-103.7	10.8	173.6	71.9	20.4	0	0	0	114.3	R546 N549 E550 G644 S664 N665	R546-N646 WeakPolarHBondContact CA-O 3.48Å; R546-N646 HydrophobicContact CB-CB 4.35Å; R546-N646 WeakPolarHBondContact CG-OD1 3.49Å; R546-N646 PolarHBondContact NH1-OD1 3.42Å; N549-N646 WeakPolarHBondContact CB-O 3.44Å; N549-N646 PolarHBondContact ND2-O 2.98Å; E550-N646 HydrophobicContact CB-CB 4.26Å; G644-N646 PolarHBondContact O-N 3.2Å; N646-S664 PolarHBondContact ND2-O 2.95Å; N646-N665 PolarHBondContact N-OD1 3.35Å; N646-N665 WeakPolarHBondContact OD1-CB 3.44Å; N646-N665 PolarHBondContact OD1-OD1 3.46Å
647	I	92.6	Very high	90.4	Very high	6 Å²	6	25 Å²	25	3%	0.031	15%	0.154	C	C	.	.			trans	-130.2	156.4	169.5	-156.8	62.1	0	0	0	109.7	L291 D295 M542 V545 E642 G644 H650	L291-I647 HydrophobicContact CD2-CD1 4.47Å; D295-I647 HydrophobicContact CB-CD1 4.3Å; M542-I647 HydrophobicContact CE-CD1 4.42Å; V545-I647 HydrophobicContact CG1-CD1 4.02Å; E642-I647 HydrophobicContact CB-CG2 4.45Å; E642-I647 HydrophobicContact CG-CG2 3.78Å; G644-I647 CarbonylContact C-O 3.59Å; G644-I647 WeakPolarHBondContact CA-O 3.34Å; G644-I647 PolarHBondContact N-O 3.48Å; G644-I647 VanDerWaalsContact N-O 3.11Å; G644-I647 PolarHBondContact O-N 2.98Å; I647-H650 HydrophobicContact CG1-CB 3.92Å; I647-H650 HydrophobicContact CG2-CB 4.41Å
648	G	89.9	Confident	91	Very high	33 Å²	33	22.2 Å²	22.2	34%	0.34	14%	0.139	S	C	.	.	S	Bend	trans	-76.7	-70.6	172.4	0	0	0	0	0	110.4	D295 V643 G644	D295-G648 WeakPolarHBondContact OD2-CA 3.36Å; D295-G648 PolarHBondContact OD2-N 3.35Å; V643-G648 WeakPolarHBondContact CA-O 3.29Å; G644-G648 PolarHBondContact N-O 3.18Å
649	E	91.8	Very high	91.1	Very high	65 Å²	65	23.5 Å²	23.5	30%	0.304	15%	0.146	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-148.4	135.6	172	175.3	172.9	-104.3	0	0	109.1	S292 Y641 E642 V643 K673	S292-E649 PolarHBondContact N-O 3.05Å; Y641-E649 HydrophobicContact CD1-CG 3.83Å; E642-E649 CarbonylContact O-C 3.57Å; E642-E649 WeakPolarHBondContact O-CA 3.29Å; V643-E649 HydrophobicContact CG2-CG 4.27Å; E649-K673 IonicContact OE1-NZ 2.83Å; E649-K673 PolarHBondContact OE1-NZ 3.4Å
650	H	93.6	Very high	91.1	Very high	6 Å²	6	25.5 Å²	25.5	3%	0.028	16%	0.156	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-143.8	116.3	-178.3	174.9	-140.1	0	0	0	111.4	T286 D290 L291 Y641 E642 I647	T286-H650 PolarHBondContact OG1-NE2 2.9Å; D290-H650 CarbonylContact O-C 3.59Å; D290-H650 VanDerWaalsContact O-CA 3.27Å; D290-H650 WeakPolarHBondContact O-CA 3.06Å; L291-H650 HydrophobicContact CD2-CB 3.96Å; L291-H650 VanDerWaalsContact CD2-CD2 3.46Å; L291-H650 WeakPolarHBondContact CD2-CD2 3.41Å; Y641-H650 CarbonylContact C-O 3.54Å; Y641-H650 VanDerWaalsContact CA-O 3.31Å; Y641-H650 WeakPolarHBondContact CA-O 3.44Å; E642-H650 HydrophobicContact CB-CB 4.46Å; E642-H650 PolarHBondContact N-O 2.77Å; E642-H650 PolarHBondContact O-N 3.21Å; E642-H650 IonicContact OE2-ND1 2.97Å; E642-H650 PolarHBondContact OE2-ND1 2.92Å; I647-H650 HydrophobicContact CG1-CB 3.92Å; I647-H650 HydrophobicContact CG2-CB 4.41Å
651	C	93.3	Very high	91	Very high	14 Å²	14	25.6 Å²	25.6	10%	0.095	16%	0.157	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-72.6	124.9	169.6	-178.3	0	0	0	0	109.5	D290 A639 Y641	D290-C651 HydrophobicContact CB-CB 3.9Å; D290-C651 PolarHBondContact O-N 3.41Å; A639-C651 VanDerWaalsContact CB-SG 3.59Å; Y641-C651 HydrophobicContact CD1-CB 3.91Å; Y641-C651 HydrophobicContact CE1-CB 3.55Å
652	L	92.7	Very high	90.8	Very high	9 Å²	9	27.8 Å²	27.8	5%	0.047	17%	0.165	C	C	.	.	P	Polyproline II helix	trans	-86.7	144.4	-173.9	-56.8	171.3	0	0	0	111.8	T605 L640 E642 T656 L661	T605-L652 HydrophobicContact CG2-CB 4.33Å; L640-L652 HydrophobicContact CB-CD1 4.22Å; L640-L652 HydrophobicContact CD2-CD1 3.72Å; L640-L652 HydrophobicContact CG-CD1 3.81Å; L640-L652 WeakPolarHBondContact O-CB 3.49Å; L640-L652 PolarHBondContact O-N 3.47Å; E642-L652 HydrophobicContact CB-CD1 4.47Å; E642-L652 HydrophobicContact CB-CD2 4.08Å; E642-L652 HydrophobicContact CB-CG 4.44Å; L652-T656 HydrophobicContact CD2-CG2 4.44Å; L652-L661 HydrophobicContact CD1-CD2 3.37Å; L652-L661 HydrophobicContact CD2-CD1 3.93Å; L652-L661 HydrophobicContact CD2-CD2 3.68Å; L652-L661 HydrophobicContact CD2-CG 4.48Å; L652-L661 HydrophobicContact CG-CD2 4.17Å
653	D	91.5	Very high	90.5	Very high	40 Å²	40	32.2 Å²	32.2	21%	0.214	19%	0.189	C	C	.	.	P	Polyproline II helix	trans	-67.8	152.8	170.1	-179	-103.2	0	0	0	110.5	T605 E655 T656	T605-D653 WeakPolarHBondContact CB-O 3.01Å; T605-D653 PolarHBondContact OG1-O 3.32Å; D653-E655 PolarHBondContact O-N 3.13Å; D653-E655 WeakPolarHBondContact OD1-CB 3.18Å; D653-E655 PolarHBondContact OD1-N 3.01Å; D653-T656 PolarHBondContact N-OG1 3.48Å; D653-T656 WeakPolarHBondContact O-CB 3.42Å; D653-T656 PolarHBondContact O-N 3.42Å; D653-T656 PolarHBondContact O-OG1 3.06Å
654	T	90.1	Very high	90.4	Very high	67 Å²	67	32.3 Å²	32.3	41%	0.411	19%	0.191	S	C	.	.	T	Hydrogen-bonded Turn	trans	-66.7	-22.5	-178.3	53.1	0	0	0	0	113.1	S606	S606-T654 VanDerWaalsContact CB-O 3.32Å; S606-T654 WeakPolarHBondContact CB-O 3.44Å; S606-T654 PolarHBondContact N-O 2.92Å; S606-T654 PolarHBondContact OG-O 3.41Å
655	E	90.4	Very high	90.5	Very high	61 Å²	61	31.1 Å²	31.1	29%	0.285	18%	0.178	S	C	.	.	T	Hydrogen-bonded Turn	trans	-95.7	0.2	177.5	-56.1	-56.4	120.8	0	0	114.1	R604 D653 H657	R604-E655 WeakPolarHBondContact CD-OE2 3.46Å; R604-E655 IonicContact CZ-OE2 3.06Å; R604-E655 IonicContact NE-OE2 2.95Å; R604-E655 IonicContact NH1-OE2 3.64Å; R604-E655 PolarHBondContact NH1-OE2 2.75Å; D653-E655 PolarHBondContact O-N 3.13Å; D653-E655 WeakPolarHBondContact OD1-CB 3.18Å; D653-E655 PolarHBondContact OD1-N 3.01Å; E655-H657 PolarHBondContact O-CD2 3.45Å; E655-H657 PolarHBondContact O-N 2.91Å
656	T	90.9	Very high	90.3	Very high	1 Å²	1	34 Å²	34	1%	0.006	19%	0.192	C	C	.	.			trans	-58.5	124.3	175.4	-60.6	0	0	0	0	110.8	L283 R604 T605 L652 D653 L661	L283-T656 WeakPolarHBondContact O-CB 3.42Å; L283-T656 WeakPolarHBondContact O-CG2 3.36Å; L283-T656 PolarHBondContact O-OG1 3.41Å; R604-T656 CarbonylContact C-O 3.55Å; R604-T656 VanDerWaalsContact CA-O 3.27Å; R604-T656 WeakPolarHBondContact CA-O 3.29Å; T605-T656 PolarHBondContact N-O 2.79Å; T605-T656 PolarHBondContact OG1-O 3.46Å; L652-T656 HydrophobicContact CD2-CG2 4.44Å; D653-T656 PolarHBondContact N-OG1 3.48Å; D653-T656 WeakPolarHBondContact O-CB 3.42Å; D653-T656 PolarHBondContact O-N 3.42Å; D653-T656 PolarHBondContact O-OG1 3.06Å; T656-L661 HydrophobicContact CG2-CB 4.34Å; T656-L661 HydrophobicContact CG2-CD1 4.44Å; T656-L661 HydrophobicContact CG2-CD2 4.39Å
657	H	91.8	Very high	90	Very high	22 Å²	22	35.8 Å²	35.8	10%	0.102	21%	0.213	C	C	.	.	B	Isolated β-bridge	trans	-77.9	119.4	173.6	-80.6	-112.7	0	0	0	110.7	R282 I601 C603 R604 E655 L659 D660 L661	R282-H657 HydrophobicContact CB-CB 4.5Å; R282-H657 WeakPolarHBondContact O-CB 3.47Å; R282-H657 PolarHBondContact O-N 3.39Å; I601-H657 PolarHBondContact O-ND1 3.26Å; I601-H657 VanDerWaalsContact O-ND1 3.12Å; C603-H657 WeakPolarHBondContact O-CA 3.49Å; R604-H657 PolarHBondContact NE-NE2 2.71Å; E655-H657 PolarHBondContact O-CD2 3.45Å; E655-H657 PolarHBondContact O-N 2.91Å; H657-L659 PolarHBondContact O-N 3.36Å; H657-D660 HydrophobicContact CB-CB 4.47Å; H657-D660 WeakPolarHBondContact CB-OD2 3.35Å; H657-D660 IonicContact CG-OD2 2.78Å; H657-D660 PolarHBondContact O-N 2.74Å; H657-L661 PolarHBondContact O-N 3.05Å; H657-L661 VanDerWaalsContact O-N 3.13Å
658	L	90.7	Very high	89.7	Confident	0 Å²	0	36.2 Å²	36.2	0%	0	22%	0.219	C	C	.	.	H	α-helix	trans	-72.2	-30.2	-168.1	-63.9	174.8	0	0	0	113.3	F597 L599 C603 L608 L640 L661 Y662 W670	F597-L658 HydrophobicContact CE1-CD1 3.97Å; F597-L658 HydrophobicContact CZ-CD1 4.48Å; L599-L658 HydrophobicContact CD2-CB 3.57Å; L599-L658 HydrophobicContact CD2-CD1 4.46Å; C603-L658 HydrophobicContact CB-CB 4.48Å; C603-L658 HydrophobicContact CB-CD1 4.33Å; C603-L658 PolarHBondContact O-N 2.89Å; L608-L658 HydrophobicContact CB-CD1 3.81Å; L608-L658 HydrophobicContact CD1-CD1 3.51Å; L608-L658 HydrophobicContact CG-CD1 4.34Å; L640-L658 HydrophobicContact CD2-CD2 3.78Å; L658-L661 HydrophobicContact CD2-CD2 4.49Å; L658-L661 PolarHBondContact O-N 3.44Å; L658-Y662 WeakPolarHBondContact O-CB 3.37Å; L658-Y662 PolarHBondContact O-N 3.05Å; L658-W670 HydrophobicContact CB-CH2 3.77Å; L658-W670 HydrophobicContact CB-CZ3 4.03Å; L658-W670 HydrophobicContact CD1-CZ3 4.4Å; L658-W670 HydrophobicContact CD2-CH2 4.25Å; L658-W670 HydrophobicContact CD2-CZ3 4.13Å; L658-W670 HydrophobicContact CG-CZ3 4.42Å; L658-W670 WeakPolarHBondContact O-CH2 3.34Å
659	L	88.8	Confident	89.7	Confident	29 Å²	29	40 Å²	40	15%	0.152	23%	0.228	C	C	.	.	H	α-helix	trans	-69.2	-38.8	175.9	-177	62.6	0	0	0	112.2	L599 I601 H657 Y662 N663	L599-L659 HydrophobicContact CD1-CD1 3.98Å; I601-L659 HydrophobicContact CB-CD2 4.21Å; I601-L659 HydrophobicContact CG1-CD2 4.47Å; H657-L659 PolarHBondContact O-N 3.36Å; L659-Y662 PolarHBondContact O-N 2.8Å; L659-N663 VanDerWaalsContact O-CG 3.28Å; L659-N663 PolarHBondContact O-N 3.34Å; L659-N663 VanDerWaalsContact O-N 3.09Å; L659-N663 PolarHBondContact O-ND2 3.28Å; L659-N663 VanDerWaalsContact O-ND2 3.15Å
660	D	89.3	Confident	89.7	Confident	45 Å²	45	37.1 Å²	37.1	24%	0.241	21%	0.214	C	C	.	.	H	α-helix	trans	-68.9	-38.7	176.4	-57.1	-70.6	0	0	0	110.9	R282 L283 H657 N663 S664	R282-D660 IonicContact CZ-OD1 2.69Å; R282-D660 IonicContact CZ-OD2 3.11Å; R282-D660 VanDerWaalsContact NE-CG 3.29Å; R282-D660 IonicContact NE-OD1 2.85Å; R282-D660 PolarHBondContact NE-OD1 2.88Å; R282-D660 IonicContact NE-OD2 2.64Å; R282-D660 PolarHBondContact NE-OD2 3.32Å; R282-D660 IonicContact NH2-OD1 3.21Å; R282-D660 IonicContact NH2-OD2 2.73Å; R282-D660 PolarHBondContact NH2-OD2 3.23Å; L283-D660 HydrophobicContact CD2-CB 4.02Å; H657-D660 HydrophobicContact CB-CB 4.47Å; H657-D660 WeakPolarHBondContact CB-OD2 3.35Å; H657-D660 IonicContact CG-OD2 2.78Å; H657-D660 PolarHBondContact O-N 2.74Å; D660-N663 PolarHBondContact O-N 3.43Å; D660-S664 WeakPolarHBondContact O-CB 3.47Å; D660-S664 PolarHBondContact O-N 2.88Å
661	L	89.8	Confident	89.6	Confident	2 Å²	2	37.4 Å²	37.4	1%	0.01	22%	0.217	C	C	.	.	H	α-helix	trans	-59.5	-49.3	172.8	-172.3	72.1	0	0	0	111.9	L283 E642 L652 T656 H657 L658 N663 S664 N665 W670	L283-L661 HydrophobicContact CD2-CB 4.23Å; L283-L661 HydrophobicContact CD2-CD1 4.27Å; E642-L661 WeakPolarHBondContact OE2-CD1 3.4Å; L652-L661 HydrophobicContact CD1-CD2 3.37Å; L652-L661 HydrophobicContact CD2-CD1 3.93Å; L652-L661 HydrophobicContact CD2-CD2 3.68Å; L652-L661 HydrophobicContact CD2-CG 4.48Å; L652-L661 HydrophobicContact CG-CD2 4.17Å; T656-L661 HydrophobicContact CG2-CB 4.34Å; T656-L661 HydrophobicContact CG2-CD1 4.44Å; T656-L661 HydrophobicContact CG2-CD2 4.39Å; H657-L661 PolarHBondContact O-N 3.05Å; H657-L661 VanDerWaalsContact O-N 3.13Å; L658-L661 HydrophobicContact CD2-CD2 4.49Å; L658-L661 PolarHBondContact O-N 3.44Å; L661-N663 VanDerWaalsContact C-N 3.31Å; L661-N663 PolarHBondContact O-N 3.47Å; L661-S664 CarbonylContact O-C 3.58Å; L661-S664 WeakPolarHBondContact O-CA 3.39Å; L661-S664 WeakPolarHBondContact O-CB 3.22Å; L661-S664 PolarHBondContact O-N 3.19Å; L661-N665 PolarHBondContact O-N 2.98Å; L661-W670 HydrophobicContact CB-CZ2 4.45Å; L661-W670 HydrophobicContact CD2-CZ2 3.99Å; L661-W670 HydrophobicContact CG-CZ2 4.38Å
662	Y	88.1	Confident	89.4	Confident	69 Å²	69	36.8 Å²	36.8	27%	0.271	21%	0.212	S	C	.	.	H	α-helix	trans	-58.8	-41.7	177.5	-178.6	-91.4	0	0	0	112.2	I583 L599 L658 L659 S664 N665 P666 W670	I583-Y662 HydrophobicContact CD1-CD2 3.34Å; I583-Y662 HydrophobicContact CD1-CE2 3.86Å; I583-Y662 HydrophobicContact CD1-CG 4.04Å; I583-Y662 HydrophobicContact CG1-CD2 4.22Å; I583-Y662 HydrophobicContact CG1-CE2 4.25Å; L599-Y662 HydrophobicContact CD1-CG 4.27Å; L658-Y662 WeakPolarHBondContact O-CB 3.37Å; L658-Y662 PolarHBondContact O-N 3.05Å; L659-Y662 PolarHBondContact O-N 2.8Å; Y662-S664 VanDerWaalsContact C-N 3.31Å; Y662-S664 PolarHBondContact O-N 2.82Å; Y662-N665 CarbonylContact O-C 3.26Å; Y662-N665 VanDerWaalsContact O-C 3.26Å; Y662-N665 PolarHBondContact O-N 3.45Å; Y662-P666 WeakPolarHBondContact O-CA 3.25Å; Y662-P666 VanDerWaalsContact O-N 3.12Å; Y662-W670 HydrophobicContact CD2-CZ2 4.47Å
663	N	88.9	Confident	89.1	Confident	93 Å²	93	39 Å²	39	50%	0.497	22%	0.222	S	C	.	.	H	α-helix	trans	-69.3	-29.5	176	-66.8	-30.7	0	0	0	112.3	R581 L659 D660 L661	R581-N663 PolarHBondContact NH1-OD1 2.96Å; L659-N663 VanDerWaalsContact O-CG 3.28Å; L659-N663 PolarHBondContact O-N 3.34Å; L659-N663 VanDerWaalsContact O-N 3.09Å; L659-N663 PolarHBondContact O-ND2 3.28Å; L659-N663 VanDerWaalsContact O-ND2 3.15Å; D660-N663 PolarHBondContact O-N 3.43Å; L661-N663 VanDerWaalsContact C-N 3.31Å; L661-N663 PolarHBondContact O-N 3.47Å
664	S	88.4	Confident	88.7	Confident	42 Å²	42	39.6 Å²	39.6	29%	0.294	23%	0.227	S	C	.	.	H	α-helix	trans	-77.4	-25.9	176.3	-171.3	0	0	0	0	113.4	N646 D660 L661 Y662	N646-S664 PolarHBondContact ND2-O 2.95Å; D660-S664 WeakPolarHBondContact O-CB 3.47Å; D660-S664 PolarHBondContact O-N 2.88Å; L661-S664 CarbonylContact O-C 3.58Å; L661-S664 WeakPolarHBondContact O-CA 3.39Å; L661-S664 WeakPolarHBondContact O-CB 3.22Å; L661-S664 PolarHBondContact O-N 3.19Å; Y662-S664 VanDerWaalsContact C-N 3.31Å; Y662-S664 PolarHBondContact O-N 2.82Å
665	N	89.6	Confident	88	Confident	4 Å²	4	40.2 Å²	40.2	2%	0.021	22%	0.224	C	C	.	.			trans	-146.8	79.5	176.4	-172.8	17	0	0	0	112	E642 G644 G645 N646 L661 Y662 G667 G668	E642-N665 WeakPolarHBondContact OE1-CB 2.93Å; E642-N665 PolarHBondContact OE1-ND2 3.44Å; G644-N665 PolarHBondContact O-ND2 3.47Å; G645-N665 WeakPolarHBondContact CA-OD1 3.47Å; N646-N665 PolarHBondContact N-OD1 3.35Å; N646-N665 WeakPolarHBondContact OD1-CB 3.44Å; N646-N665 PolarHBondContact OD1-OD1 3.46Å; L661-N665 PolarHBondContact O-N 2.98Å; Y662-N665 CarbonylContact O-C 3.26Å; Y662-N665 VanDerWaalsContact O-C 3.26Å; Y662-N665 PolarHBondContact O-N 3.45Å; N665-G667 PolarHBondContact O-N 2.91Å; N665-G667 VanDerWaalsContact O-N 3.14Å; N665-G668 WeakPolarHBondContact ND2-CA 3.41Å; N665-G668 PolarHBondContact O-N 3.15Å; N665-G668 PolarHBondContact OD1-N 2.87Å
666	P	84.3	Confident	86.7	Confident	91 Å²	91	42 Å²	42	59%	0.591	24%	0.241	S	C	*	.	T	Hydrogen-bonded Turn	trans	-69.8	-9.9	-177.5	28.4	-36.2	0	0	0	114	Y662	Y662-P666 WeakPolarHBondContact O-CA 3.25Å; Y662-P666 VanDerWaalsContact O-N 3.12Å
667	G	82.8	Confident	84.6	Confident	52 Å²	52	50.2 Å²	50.2	54%	0.536	28%	0.284	S	S	.	.	T	Hydrogen-bonded Turn	trans	-105.4	8.9	177.1	0	0	0	0	0	114.5	G645 N665	G645-G667 VanDerWaalsContact CA-O 3.25Å; G645-G667 WeakPolarHBondContact CA-O 3.37Å; G645-G667 PolarHBondContact N-O 3.28Å; N665-G667 PolarHBondContact O-N 2.91Å; N665-G667 VanDerWaalsContact O-N 3.14Å
668	G	86.9	Confident	82.1	Confident	16 Å²	16	51.9 Å²	51.9	17%	0.165	31%	0.308	C	S	.	.			trans	-87.4	133.3	177.5	0	0	0	0	0	112.4	V643 N665	V643-G668 CarbonylContact O-C 3.59Å; V643-G668 WeakPolarHBondContact O-CA 3.31Å; N665-G668 WeakPolarHBondContact ND2-CA 3.41Å; N665-G668 PolarHBondContact O-N 3.15Å; N665-G668 PolarHBondContact OD1-N 2.87Å
669	E	89.8	Confident	79.4	Confident	111 Å²	111	55.8 Å²	55.8	52%	0.519	35%	0.348	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-81.9	145.8	168.6	-62.5	-169.4	171	0	0	110.4	Q586 V643	Q586-E669 PolarHBondContact NE2-OE2 3.29Å; V643-E669 PolarHBondContact N-O 3.33Å; V643-E669 PolarHBondContact O-N 3.13Å
670	W	92.3	Very high	76.6	Confident	5 Å²	5	62.6 Å²	62.6	2%	0.019	37%	0.371	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-109.5	126.7	179.1	-65.1	-1.2	0	0	0	110.3	I583 I585 Q586 L599 L608 L640 Y641 L658 L661 Y662	I583-W670 HydrophobicContact CD1-CE3 4.19Å; I583-W670 HydrophobicContact CD1-CH2 3.42Å; I583-W670 VanDerWaalsContact CD1-CH2 3.42Å; I583-W670 HydrophobicContact CD1-CZ2 3.92Å; I583-W670 HydrophobicContact CD1-CZ3 3.58Å; I583-W670 HydrophobicContact CG2-CD2 4.27Å; I583-W670 HydrophobicContact CG2-CE3 3.93Å; I583-W670 HydrophobicContact CG2-CZ3 4.29Å; I585-W670 CarbonylContact C-O 3.55Å; I585-W670 WeakPolarHBondContact CA-O 3.4Å; I585-W670 HydrophobicContact CG1-CB 4.24Å; I585-W670 HydrophobicContact CG1-CE3 4.29Å; I585-W670 HydrophobicContact CG2-CB 4.47Å; Q586-W670 PolarHBondContact N-O 2.89Å; L599-W670 HydrophobicContact CD1-CH2 4.24Å; L599-W670 HydrophobicContact CD2-CH2 3.94Å; L599-W670 HydrophobicContact CD2-CZ3 3.97Å; L608-W670 HydrophobicContact CD1-CE3 4.37Å; L608-W670 HydrophobicContact CD1-CZ3 4.49Å; L640-W670 HydrophobicContact CD1-CB 4.33Å; Y641-W670 CarbonylContact O-C 3.51Å; Y641-W670 WeakPolarHBondContact O-CA 3.42Å; L658-W670 HydrophobicContact CB-CH2 3.77Å; L658-W670 HydrophobicContact CB-CZ3 4.03Å; L658-W670 HydrophobicContact CD1-CZ3 4.4Å; L658-W670 HydrophobicContact CD2-CH2 4.25Å; L658-W670 HydrophobicContact CD2-CZ3 4.13Å; L658-W670 HydrophobicContact CG-CZ3 4.42Å; L658-W670 WeakPolarHBondContact O-CH2 3.34Å; L661-W670 HydrophobicContact CB-CZ2 4.45Å; L661-W670 HydrophobicContact CD2-CZ2 3.99Å; L661-W670 HydrophobicContact CG-CZ2 4.38Å; Y662-W670 HydrophobicContact CD2-CZ2 4.47Å
671	V	90.6	Very high	73.8	Confident	12 Å²	12	63.3 Å²	63.3	7%	0.073	39%	0.39	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-130.5	124.7	-172.8	-168.8	0	0	0	0	109.9	Q586 Y641 V643 K673	Q586-V671 HydrophobicContact CB-CB 4.49Å; Q586-V671 HydrophobicContact CB-CG1 4.15Å; Q586-V671 HydrophobicContact CB-CG2 4.25Å; Q586-V671 CarbonylContact O-C 3.37Å; Q586-V671 WeakPolarHBondContact O-CA 3.07Å; Y641-V671 WeakPolarHBondContact CB-O 3.23Å; Y641-V671 PolarHBondContact N-O 3.37Å; Y641-V671 PolarHBondContact O-N 2.95Å; V643-V671 HydrophobicContact CG2-CG2 4.02Å; V671-K673 HydrophobicContact CG1-CD 4.44Å; V671-K673 HydrophobicContact CG1-CG 3.86Å
672	I	89.6	Confident	70.9	Confident	1 Å²	1	74.8 Å²	74.8	1%	0.005	44%	0.443	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-84.6	126.1	168.9	-61.3	174.7	0	0	0	107.9	I585 Q586 G588 L608 L609 F612 C638 A639 L640	I585-I672 HydrophobicContact CG2-CD1 4.09Å; I585-I672 HydrophobicContact CG2-CG1 3.86Å; Q586-I672 PolarHBondContact O-N 3.04Å; G588-I672 VanDerWaalsContact CA-O 3.31Å; G588-I672 WeakPolarHBondContact CA-O 3.26Å; G588-I672 PolarHBondContact N-O 3.1Å; L608-I672 HydrophobicContact CD2-CD1 3.87Å; L608-I672 HydrophobicContact CD2-CG1 4.36Å; L609-I672 HydrophobicContact CD2-CD1 4.48Å; L609-I672 HydrophobicContact CD2-CG1 4.49Å; L609-I672 HydrophobicContact CD2-CG2 4.33Å; F612-I672 HydrophobicContact CB-CD1 3.82Å; F612-I672 HydrophobicContact CD1-CD1 4.2Å; F612-I672 HydrophobicContact CD1-CG2 4.18Å; F612-I672 HydrophobicContact CD2-CD1 3.81Å; F612-I672 HydrophobicContact CE1-CG2 4.04Å; F612-I672 HydrophobicContact CG-CD1 3.65Å; F612-I672 HydrophobicContact CZ-CG2 4.35Å; C638-I672 HydrophobicContact CB-CG2 3.93Å; A639-I672 WeakPolarHBondContact O-CA 3.36Å; L640-I672 HydrophobicContact CD1-CG1 3.66Å
673	K	87.8	Confident	70	Confident	57 Å²	57	75.1 Å²	75.1	25%	0.248	45%	0.452	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-128.6	156.7	175.3	-52.2	-178.3	179.7	-177.4	0	110.3	C638 A639 Y641 E649 V671 K675	C638-K673 WeakPolarHBondContact CA-O 3.33Å; A639-K673 PolarHBondContact N-O 3.43Å; A639-K673 PolarHBondContact O-N 3.35Å; Y641-K673 HydrophobicContact CD2-CB 3.84Å; Y641-K673 HydrophobicContact CD2-CD 4.02Å; Y641-K673 HydrophobicContact CD2-CG 3.85Å; Y641-K673 HydrophobicContact CE2-CB 3.68Å; Y641-K673 HydrophobicContact CE2-CD 4.26Å; Y641-K673 HydrophobicContact CE2-CG 4.17Å; Y641-K673 HydrophobicContact CG-CD 4.26Å; Y641-K673 HydrophobicContact CG-CG 4.49Å; E649-K673 IonicContact OE1-NZ 2.83Å; E649-K673 PolarHBondContact OE1-NZ 3.4Å; V671-K673 HydrophobicContact CG1-CD 4.44Å; V671-K673 HydrophobicContact CG1-CG 3.86Å; K673-K675 PolarHBondContact O-N 3.19Å
674	T	82.9	Confident	69	Low	51 Å²	51	74.2 Å²	74.2	31%	0.313	45%	0.45	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-66.9	132.1	165	55	0	0	0	0	109.1	L590 P636	L590-T674 HydrophobicContact CD1-CG2 3.66Å; L590-T674 HydrophobicContact CD2-CG2 4.48Å; L590-T674 HydrophobicContact CG-CG2 4.01Å; P636-T674 HydrophobicContact CB-CG2 4.1Å
675	K	74.1	Confident	67.9	Low	80 Å²	80	75.9 Å²	75.9	35%	0.348	46%	0.458	S	S	.	.	P	Polyproline II helix	trans	-58.1	134.4	172	-68.2	177.7	-170.3	154.3	0	108.4	D637 A639 K673 N677	D637-K675 WeakPolarHBondContact O-CB 3.45Å; D637-K675 WeakPolarHBondContact O-CG 3.46Å; D637-K675 PolarHBondContact O-N 3.01Å; D637-K675 WeakPolarHBondContact OD1-CE 3.31Å; D637-K675 IonicContact OD1-NZ 3.63Å; D637-K675 PolarHBondContact OD1-NZ 3.44Å; D637-K675 IonicContact OD2-NZ 3.77Å; A639-K675 HydrophobicContact CB-CD 4.33Å; A639-K675 HydrophobicContact CB-CG 3.7Å; K673-K675 PolarHBondContact O-N 3.19Å; K675-N677 PolarHBondContact O-N 3.45Å
676	P	63	Low	66.7	Low	99 Å²	99	80.2 Å²	80.2	64%	0.643	48%	0.484	S	S	*	.	P	Polyproline II helix	trans	-56	145.2	167.9	25.2	-33	0	0	0	108.6	G678	P676-G678 PolarHBondContact O-N 3.13Å
677	N	46.5	Very low	65.6	Low	173 Å²	173	79.5 Å²	79.5	93%	0.925	48%	0.477	S	S	*	.			trans	-71.5	57.9	178.9	-80	-44.7	0	0	0	111.7	K675	K675-N677 PolarHBondContact O-N 3.45Å
678	G	40.7	Very low	64.4	Low	58 Å²	58	81.3 Å²	81.3	60%	0.598	47%	0.474	S	S	*	.			trans	-63.3	134.9	162.2	0	0	0	0	0	109.1	P676 R680	P676-G678 PolarHBondContact O-N 3.13Å; G678-R680 PolarHBondContact O-N 3Å; G678-R680 VanDerWaalsContact O-N 3.13Å
679	G	34.4	Very low	62.8	Low	81 Å²	81	86 Å²	86	84%	0.835	50%	0.496	S	S	*	.			trans	-51.8	116.6	-164.8	0	0	0	0	0	114	G681	G679-G681 VanDerWaalsContact C-N 3.3Å; G679-G681 PolarHBondContact O-N 3.38Å
680	R	29.7	Very low	60.7	Low	172 Å²	172	84.1 Å²	84.1	65%	0.649	49%	0.494	S	S	*	.			trans	-69.4	88.5	165.2	-74.2	-175.7	173.4	-149.1	-0.7	109.7	D637 G678	D637-R680 IonicContact OD2-CZ 2.67Å; D637-R680 IonicContact OD2-NE 3.74Å; D637-R680 IonicContact OD2-NH2 2.6Å; D637-R680 PolarHBondContact OD2-NH2 3.26Å; G678-R680 PolarHBondContact O-N 3Å; G678-R680 VanDerWaalsContact O-N 3.13Å
681	G	30.1	Very low	58.1	Low	61 Å²	61	90.7 Å²	90.7	63%	0.629	53%	0.533	S	S	*	.			trans	-77.1	107.7	146	0	0	0	0	0	108.5	G679	G679-G681 VanDerWaalsContact C-N 3.3Å; G679-G681 PolarHBondContact O-N 3.38Å
682	Q	27.8	Very low	55.1	Low	243 Å²	243	97.8 Å²	97.8	100%	1.136	58%	0.575	S	S	*	*			trans	-93.6	0	154.6	-82.4	-169.8	-30.9	0	0	108.8

Retrieved 682 of 682 residues in 470.2 ms (Link to these results)

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