A0A5K4F5T4_SCHMA Loading...

EF-hand domain-containing protein

AlphaFold DB , UniProt , Accession A0A5K4F5T4, Species SCHMA (Schistosoma mansoni, Blood fluke), Gene n/a, Length 569 aa.

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(Predicted Aligned Error values between residue pairs)

Download Structure PDB PAE Table

Site	Residue	pLDDT	pLDDT confidence	pLDDT₁₀	pLDDT10 confidence	SASA	SASA [Å²]	SASA₁₀	SASA10 [Å²]	RSA	RSA unformatted	RSA₁₀	RSA10 unformatted	Surface	Surface10 (not used)	Disorder (not used)	Disorder	Sec. str.	Secondary structure	Isomer	Phi (φ)	Psi (ψ)	Omega (ω)	Chi 1 (χ₁)	Chi 2 (χ₂)	Chi 3 (χ₃)	Chi 4 (χ₄)	Chi 5 (χ₅)	Tau (τ)	Contacts (colored by PAE)	Contact details
1	M	33	Very low	34.1	Very low	248 Å²	248	158.5 Å²	158.5	100%	1.222	84%	0.837	S	S	*	*				0	68.2	0	-74.2	-167.6	-86.6	0	0	110.9
2	K	32.4	Very low	33.9	Very low	192 Å²	192	165.5 Å²	165.5	84%	0.835	84%	0.844	S	S	*	*			trans	-123.9	3.3	-176.8	-137.1	176.2	-177.9	-177.3	0	115.5
3	N	38.7	Very low	33.8	Very low	148 Å²	148	158.1 Å²	158.1	79%	0.791	83%	0.834	S	S	*	*	S	Bend	trans	-119.9	20.7	-172.4	-64.9	7	0	0	0	114.9
4	F	36	Very low	33.8	Very low	192 Å²	192	160.4 Å²	160.4	84%	0.842	83%	0.833	S	S	*	*	S	Bend	trans	-106	-13.7	178.5	-133.8	-90	0	0	0	114.7
5	F	34.9	Very low	33.6	Very low	177 Å²	177	159.7 Å²	159.7	78%	0.776	83%	0.831	S	S	*	*	S	Bend	trans	-109.1	2.9	-175.5	-80.8	-77.6	0	0	0	115.4	G7 L8	F5-G7 VanDerWaalsContact C-N 3.34Å; F5-L8 HydrophobicContact CD1-CD1 4.42Å
6	E	34.5	Very low	33.5	Very low	184 Å²	184	157.6 Å²	157.6	86%	0.86	82%	0.821	S	S	*	*	T	Hydrogen-bonded Turn	trans	-85	-5.2	178.8	-131.1	169.2	-166.6	0	0	114
7	G	30.3	Very low	33.5	Very low	71 Å²	71	159.1 Å²	159.1	73%	0.732	83%	0.828	S	S	*	*	T	Hydrogen-bonded Turn	trans	-91.7	-6.6	-178.3	0	0	0	0	0	116.2	F5 G9	F5-G7 VanDerWaalsContact C-N 3.34Å; G7-G9 PolarHBondContact O-N 2.71Å
8	L	32.6	Very low	33.6	Very low	144 Å²	144	153.6 Å²	153.6	75%	0.754	81%	0.805	S	S	*	*	S	Bend	trans	-85.3	75.8	177.9	-69.6	171.7	0	0	0	109.3	F5 K10	F5-L8 HydrophobicContact CD1-CD1 4.42Å; L8-K10 PolarHBondContact O-N 3.38Å
9	G	30.9	Very low	33.3	Very low	68 Å²	68	150.1 Å²	150.1	70%	0.701	81%	0.81	S	S	*	*			trans	-43.8	129.3	177.3	0	0	0	0	0	112.2	G7 S11	G7-G9 PolarHBondContact O-N 2.71Å; G9-S11 PolarHBondContact O-N 3.23Å
10	K	34.2	Very low	33	Very low	204 Å²	204	153 Å²	153	89%	0.887	81%	0.809	S	S	*	*			trans	-30.2	118.2	175.9	-63.4	171.9	-179.5	176.5	0	111.3	L8 R12	L8-K10 PolarHBondContact O-N 3.38Å; K10-R12 PolarHBondContact O-N 2.97Å
11	S	37.5	Very low	32.7	Very low	116 Å²	116	152.8 Å²	152.8	81%	0.811	81%	0.814	S	S	*	*			trans	-49	108.6	172.6	57.2	0	0	0	0	109.4	G9 G13	G9-S11 PolarHBondContact O-N 3.23Å; S11-G13 PolarHBondContact O-N 3.1Å
12	R	31.4	Very low	32.6	Very low	242 Å²	242	146.1 Å²	146.1	91%	0.913	79%	0.792	S	S	*	*	P	Polyproline II helix	trans	-58.6	116.1	167.2	-83.4	179.8	167.7	156.7	-3.2	106.9	K10 K14	K10-R12 PolarHBondContact O-N 2.97Å; R12-K14 PolarHBondContact O-N 3.44Å; R12-K14 VanDerWaalsContact O-N 3.13Å
13	G	32.9	Very low	32.7	Very low	69 Å²	69	143 Å²	143	71%	0.711	79%	0.791	S	S	*	*	P	Polyproline II helix	trans	-48.6	121.2	171.8	0	0	0	0	0	108.5	S11	S11-G13 PolarHBondContact O-N 3.1Å
14	K	34.2	Very low	32.2	Very low	191 Å²	191	143.4 Å²	143.4	83%	0.83	79%	0.792	S	S	*	*	P	Polyproline II helix	trans	-58.5	159.3	157.7	-65	-174.5	175.2	-179.3	0	107.4	R12	R12-K14 PolarHBondContact O-N 3.44Å; R12-K14 VanDerWaalsContact O-N 3.13Å
15	N	30.9	Very low	31.9	Very low	149 Å²	149	142.2 Å²	142.2	80%	0.797	79%	0.794	S	S	*	*			trans	98.1	121.3	-179.4	-43.3	-4.5	0	0	0	109.3
16	D	30.9	Very low	31.6	Very low	126 Å²	126	141.1 Å²	141.1	67%	0.674	80%	0.795	S	S	*	*			cis	-157.7	129.3	31.4	-134.1	-31	0	0	0	109.2	S18	D16-S18 PolarHBondContact O-N 3.38Å; D16-S18 VanDerWaalsContact OD1-CB 3.25Å; D16-S18 WeakPolarHBondContact OD1-CB 3.32Å; D16-S18 PolarHBondContact OD1-N 3.36Å
17	I	34.7	Very low	31.2	Very low	184 Å²	184	141.6 Å²	141.6	94%	0.944	80%	0.795	S	S	*	*			trans	-83.6	15.4	162	-56.3	174.2	0	0	0	109	G19	I17-G19 PolarHBondContact O-N 2.95Å
18	S	34.5	Very low	31.1	Very low	59 Å²	59	144.4 Å²	144.4	41%	0.413	80%	0.8	S	S	.	*	S	Bend	trans	-80.3	103.8	162.5	178.7	0	0	0	0	108	D16 R20	D16-S18 PolarHBondContact O-N 3.38Å; D16-S18 VanDerWaalsContact OD1-CB 3.25Å; D16-S18 WeakPolarHBondContact OD1-CB 3.32Å; D16-S18 PolarHBondContact OD1-N 3.36Å; S18-R20 PolarHBondContact O-N 3.13Å
19	G	28.7	Very low	30.8	Very low	87 Å²	87	142.2 Å²	142.2	90%	0.897	80%	0.797	S	S	*	*			trans	-65.1	62.5	176.1	0	0	0	0	0	113.5	I17	I17-G19 PolarHBondContact O-N 2.95Å
20	R	27.3	Very low	30.5	Very low	208 Å²	208	147.7 Å²	147.7	79%	0.785	80%	0.804	S	S	*	*			trans	-126	110.3	174.6	-80.5	-173.3	161.7	-168.8	-5	109.7	S18 S22	S18-R20 PolarHBondContact O-N 3.13Å; R20-S22 PolarHBondContact O-N 3.23Å
21	T	26.7	Very low	30.4	Very low	150 Å²	150	143 Å²	143	92%	0.92	80%	0.797	S	S	*	*			trans	-53.7	123.6	174.3	45.8	0	0	0	0	110.2
22	S	31.3	Very low	29.8	Very low	108 Å²	108	144.4 Å²	144.4	76%	0.755	80%	0.795	S	S	*	*			trans	-124.9	146.6	169.2	-66.8	0	0	0	0	109.2	R20	R20-S22 PolarHBondContact O-N 3.23Å
23	P	34	Very low	29.5	Very low	125 Å²	125	141.6 Å²	141.6	81%	0.812	79%	0.793	S	S	*	*			trans	-81.7	145.9	-151.1	-2.1	19.3	0	0	0	112.6	N25	P23-N25 PolarHBondContact O-N 2.89Å
24	I	26.7	Very low	29	Very low	158 Å²	158	142.6 Å²	142.6	81%	0.81	79%	0.794	S	S	*	*			trans	-52.5	121.3	171.5	-64.6	157.5	0	0	0	109.2
25	N	29.9	Very low	28.8	Very low	167 Å²	167	141.1 Å²	141.1	89%	0.893	80%	0.796	S	S	*	*			trans	-109.8	125	162.8	-123.3	-35.7	0	0	0	108.8	P23	P23-N25 PolarHBondContact O-N 2.89Å
26	L	28.8	Very low	28.5	Very low	154 Å²	154	142.2 Å²	142.2	81%	0.806	79%	0.793	S	S	*	*	P	Polyproline II helix	trans	-70.2	147.9	-168.8	-77.1	152.6	0	0	0	112.6
27	K	26.5	Very low	28.2	Very low	194 Å²	194	142.8 Å²	142.8	84%	0.843	80%	0.796	S	S	*	*	P	Polyproline II helix	trans	-52.9	149.2	172.9	-71.3	175.3	173.4	178.4	0	112.9
28	P	29.5	Very low	27.7	Very low	129 Å²	129	143 Å²	143	84%	0.838	79%	0.793	S	S	*	*	P	Polyproline II helix	trans	-94.4	135.8	140.3	0.7	19.3	0	0	0	110.3
29	S	26.4	Very low	27.1	Very low	99 Å²	99	147.9 Å²	147.9	69%	0.692	81%	0.81	S	S	*	*	P	Polyproline II helix	trans	-81.7	151.1	-176.3	-28.5	0	0	0	0	113.1
30	E	24.5	Very low	27	Very low	182 Å²	182	150 Å²	150	85%	0.85	81%	0.805	S	S	*	*			trans	28.2	131.5	140.1	-70.7	168	164.8	0	0	121.5
31	S	30.2	Very low	26.7	Very low	106 Å²	106	146.7 Å²	146.7	74%	0.741	80%	0.803	S	S	*	*				175.5	128	103.8	36.6	0	0	0	0	113.3
32	D	26.1	Very low	26.9	Very low	145 Å²	145	149 Å²	149	78%	0.775	80%	0.8	S	S	*	*				57.1	108.3	129.5	-54	-25.4	0	0	0	123.9
33	E	23.9	Very low	26.4	Very low	183 Å²	183	154 Å²	154	86%	0.855	81%	0.809	S	S	*	*				63.1	138.1	104.7	-136.4	174	-154.1	0	0	122.3
34	A	24.2	Very low	26.1	Very low	91 Å²	91	157.2 Å²	157.2	75%	0.752	81%	0.813	S	S	*	*			trans	70.8	135.2	161.3	0	0	0	0	0	116.9
35	N	29.1	Very low	25.8	Very low	160 Å²	160	155.4 Å²	155.4	86%	0.856	81%	0.809	S	S	*	*			cis	-160.6	152.4	39.9	-156	-6	0	0	0	111.1
36	K	24.6	Very low	25.5	Very low	172 Å²	172	156.9 Å²	156.9	75%	0.748	81%	0.808	S	S	*	*			trans	-78.7	170.7	173.2	-78.1	-178.6	170.7	178.7	0	111.7
37	D	23.8	Very low	25.5	Very low	138 Å²	138	154.9 Å²	154.9	74%	0.738	81%	0.807	S	S	*	*			trans	76	110.6	152.7	-56.6	-32.2	0	0	0	117.8
38	Q	25.7	Very low	25.3	Very low	188 Å²	188	153.8 Å²	153.8	88%	0.879	81%	0.809	S	S	*	*				-179.2	131.4	96.2	-93.7	-179.8	16.6	0	0	112.2
39	Q	21.5	Very low	25.3	Very low	162 Å²	162	153.4 Å²	153.4	76%	0.757	81%	0.807	S	S	*	*			trans	-61.3	135.8	165	-178.1	178.8	6.6	0	0	111
40	T	25.8	Very low	25.2	Very low	131 Å²	131	153.7 Å²	153.7	80%	0.804	81%	0.809	S	S	*	*			trans	-148	110.3	152	26.1	0	0	0	0	110.3
41	D	22.4	Very low	25.2	Very low	139 Å²	139	150.5 Å²	150.5	74%	0.743	81%	0.806	S	S	*	*			trans	-64.5	123.8	161.6	-72.4	-65.9	0	0	0	109.9
42	K	29.2	Very low	25.1	Very low	197 Å²	197	154.1 Å²	154.1	86%	0.857	81%	0.811	S	S	*	*			trans	-134.6	108.4	156.3	-79.1	-169	177.8	179.8	0	110	E44	K42-E44 PolarHBondContact O-N 3.2Å
43	K	21.7	Very low	25.1	Very low	214 Å²	214	157.1 Å²	157.1	93%	0.93	82%	0.818	S	S	*	*			trans	-57	119.4	155.1	-83.4	176.9	172.5	175.3	0	108.1
44	E	27.6	Very low	25.2	Very low	192 Å²	192	153.6 Å²	153.6	90%	0.897	81%	0.814	S	S	*	*			trans	-130.6	127.6	154.8	-118.6	174.2	-175.1	0	0	108.7	K42	K42-E44 PolarHBondContact O-N 3.2Å
45	T	20.6	Very low	25.2	Very low	121 Å²	121	158.5 Å²	158.5	74%	0.742	82%	0.821	S	S	*	*			trans	-99.2	155.1	-179.2	27.5	0	0	0	0	108.5
46	K	23.7	Very low	25	Very low	198 Å²	198	159.1 Å²	159.1	86%	0.861	82%	0.818	S	S	*	*			trans	84	126.9	174.6	-53.7	173	177.7	177.4	0	112.5
47	S	27.5	Very low	25.1	Very low	112 Å²	112	155.9 Å²	155.9	78%	0.783	82%	0.817	S	S	*	*			cis	-159.2	145	39.1	-43.5	0	0	0	0	110.2
48	L	23.8	Very low	25.2	Very low	170 Å²	170	156.3 Å²	156.3	89%	0.89	82%	0.82	S	S	*	*	P	Polyproline II helix	trans	-57.4	135.6	169.5	-96.7	79.2	0	0	0	111
49	P	28.1	Very low	25.2	Very low	122 Å²	122	154 Å²	154	79%	0.792	82%	0.819	S	S	*	*	P	Polyproline II helix	trans	-77.8	131.3	163.9	30.7	-28.5	0	0	0	109.6
50	S	25.1	Very low	25.5	Very low	105 Å²	105	157.2 Å²	157.2	73%	0.734	82%	0.824	S	S	*	*	P	Polyproline II helix	trans	-63.3	137.1	-178.7	67.7	0	0	0	0	112	Q52	S50-Q52 PolarHBondContact O-N 2.91Å
51	S	25.5	Very low	25.5	Very low	114 Å²	114	160.7 Å²	160.7	80%	0.797	83%	0.828	S	S	*	*			trans	-48.7	115.5	164.9	51.7	0	0	0	0	112.7
52	Q	27.9	Very low	25.9	Very low	182 Å²	182	161.2 Å²	161.2	85%	0.85	83%	0.831	S	S	*	*			trans	-115.5	105.2	151.9	-96.1	-177.6	-41.6	0	0	108.3	S50 S54	S50-Q52 PolarHBondContact O-N 2.91Å; Q52-S54 PolarHBondContact O-N 3.45Å
53	K	24.6	Very low	25.7	Very low	208 Å²	208	157.7 Å²	157.7	90%	0.904	83%	0.826	S	S	*	*			trans	-55.4	116.2	159.8	-79.5	177.7	171	-177.8	0	107.8
54	S	27.1	Very low	26.1	Very low	110 Å²	110	156.7 Å²	156.7	77%	0.769	82%	0.822	S	S	*	*			trans	-121.6	104.8	150.9	45.4	0	0	0	0	106.7	Q52 E56	Q52-S54 PolarHBondContact O-N 3.45Å; S54-E56 PolarHBondContact O-N 3.22Å
55	E	24.1	Very low	26.2	Very low	194 Å²	194	154.2 Å²	154.2	91%	0.907	81%	0.814	S	S	*	*			trans	-66.5	104.4	161.9	-74.8	171.6	143.6	0	0	106.8
56	E	25.6	Very low	26.5	Very low	172 Å²	172	154.6 Å²	154.6	80%	0.804	82%	0.817	S	S	*	*			trans	-118.3	94.4	163.1	-144.8	171.6	-158.2	0	0	108.2	S54 N58	S54-E56 PolarHBondContact O-N 3.22Å; E56-N58 PolarHBondContact O-N 3.48Å
57	S	25.3	Very low	26.8	Very low	104 Å²	104	152.3 Å²	152.3	73%	0.727	81%	0.813	S	S	*	*			trans	-63.2	89.5	175.6	52.7	0	0	0	0	110.4	T59	S57-T59 PolarHBondContact O-N 2.99Å
58	N	26.9	Very low	26.9	Very low	148 Å²	148	155.3 Å²	155.3	79%	0.791	81%	0.814	S	S	*	*			trans	-83.1	87.7	165.3	-95.5	-45.1	0	0	0	109.8	E56 R60	E56-N58 PolarHBondContact O-N 3.48Å; N58-R60 PolarHBondContact O-N 3.48Å
59	T	25.1	Very low	27.1	Very low	140 Å²	140	156 Å²	156	86%	0.859	81%	0.81	S	S	*	*			trans	-62.2	79	167.8	-10.9	0	0	0	0	110.1	S57	S57-T59 PolarHBondContact O-N 2.99Å
60	R	27.5	Very low	27.1	Very low	228 Å²	228	155.9 Å²	155.9	86%	0.86	81%	0.807	S	S	*	*			trans	-96.8	108.4	166.3	-122.6	179	-174	178.4	2.1	108.6	N58 N62	N58-R60 PolarHBondContact O-N 3.48Å; R60-N62 PolarHBondContact O-N 3.14Å
61	K	26.4	Very low	27.3	Very low	204 Å²	204	158 Å²	158	89%	0.887	81%	0.811	S	S	*	*			trans	-51.2	94.5	170.5	-74.3	174.5	174.9	175.9	0	109.5	T63	K61-T63 PolarHBondContact O-N 2.93Å
62	N	29.5	Very low	27.5	Very low	150 Å²	150	159.8 Å²	159.8	80%	0.802	81%	0.811	S	S	*	*			trans	-80.7	108.6	161.8	-86.4	-9.9	0	0	0	107.4	R60 K64	R60-N62 PolarHBondContact O-N 3.14Å; N62-K64 PolarHBondContact O-N 3.36Å
63	T	26.9	Very low	27.6	Very low	123 Å²	123	155.8 Å²	155.8	76%	0.755	81%	0.809	S	S	*	*			trans	-44.5	114.7	164.6	25.3	0	0	0	0	109.5	K61 D65	K61-T63 PolarHBondContact O-N 2.93Å; T63-D65 PolarHBondContact O-N 3.16Å
64	K	28.5	Very low	27.8	Very low	194 Å²	194	150.5 Å²	150.5	84%	0.843	80%	0.798	S	S	*	*			trans	-76	90.3	176	-169.4	176.1	-175.3	178.2	0	107.2	N62 T66	N62-K64 PolarHBondContact O-N 3.36Å; K64-T66 PolarHBondContact O-N 2.97Å; K64-T66 VanDerWaalsContact O-N 3.15Å
65	D	29.7	Very low	28	Very low	139 Å²	139	152.7 Å²	152.7	74%	0.743	80%	0.801	S	S	*	*			trans	-55.9	118.7	166	-76.7	-34.9	0	0	0	108.1	T63 I67	T63-D65 PolarHBondContact O-N 3.16Å; D65-I67 PolarHBondContact O-N 3.37Å; D65-I67 VanDerWaalsContact O-N 3.08Å
66	T	27.1	Very low	28.4	Very low	129 Å²	129	152.6 Å²	152.6	79%	0.791	80%	0.798	S	S	*	*			trans	-75	99.6	-176.4	-62.3	0	0	0	0	107.2	K64 E68	K64-T66 PolarHBondContact O-N 2.97Å; K64-T66 VanDerWaalsContact O-N 3.15Å; T66-E68 PolarHBondContact O-N 2.93Å; T66-E68 VanDerWaalsContact O-N 3.12Å
67	I	31.3	Very low	28.6	Very low	151 Å²	151	149.8 Å²	149.8	77%	0.774	80%	0.797	S	S	*	*			trans	-68.2	104.7	170.1	-62.3	170.2	0	0	0	106.9	D65 K69	D65-I67 PolarHBondContact O-N 3.37Å; D65-I67 VanDerWaalsContact O-N 3.08Å; I67-K69 PolarHBondContact O-N 3.45Å
68	E	29.1	Very low	28.7	Very low	174 Å²	174	155.7 Å²	155.7	81%	0.813	80%	0.804	S	S	*	*			trans	-57	107.3	165.4	-83.9	-177.7	146.1	0	0	108.8	T66 T70	T66-E68 PolarHBondContact O-N 2.93Å; T66-E68 VanDerWaalsContact O-N 3.12Å; E68-T70 PolarHBondContact O-N 3.48Å; E68-T70 VanDerWaalsContact O-N 3.16Å
69	K	28.3	Very low	28.6	Very low	184 Å²	184	157 Å²	157	80%	0.8	81%	0.805	S	S	*	*			trans	-72.9	100.4	169.1	-80.7	179.8	174	-179.8	0	108.4	I67 N71	I67-K69 PolarHBondContact O-N 3.45Å; K69-N71 PolarHBondContact O-N 2.85Å
70	T	27.7	Very low	28.6	Very low	120 Å²	120	155.5 Å²	155.5	74%	0.736	80%	0.796	S	S	*	*			trans	-70.9	111.4	159.8	33.5	0	0	0	0	108.7	E68 N72	E68-T70 PolarHBondContact O-N 3.48Å; E68-T70 VanDerWaalsContact O-N 3.16Å; T70-N72 PolarHBondContact O-N 3.23Å
71	N	28.4	Very low	28.5	Very low	151 Å²	151	151 Å²	151	81%	0.807	79%	0.787	S	S	*	*			trans	-69.9	89.5	174.5	-69.9	-37	0	0	0	109.4	K69 A73	K69-N71 PolarHBondContact O-N 2.85Å; N71-A73 PolarHBondContact O-N 2.9Å
72	N	31.1	Very low	28.5	Very low	151 Å²	151	150.3 Å²	150.3	81%	0.807	78%	0.784	S	S	*	*			trans	-80.1	102.2	162.3	-78.1	-20.3	0	0	0	108.1	T70 S74	T70-N72 PolarHBondContact O-N 3.23Å; N72-S74 PolarHBondContact O-N 3.35Å; N72-S74 VanDerWaalsContact O-N 3.13Å
73	A	28.4	Very low	28.4	Very low	97 Å²	97	149.3 Å²	149.3	80%	0.802	78%	0.784	S	S	*	*			trans	-60.3	110.4	170.4	0	0	0	0	0	109.2	N71 D75	N71-A73 PolarHBondContact O-N 2.9Å; A73-D75 PolarHBondContact O-N 3.12Å
74	S	30.8	Very low	28.3	Very low	98 Å²	98	151 Å²	151	69%	0.685	79%	0.788	S	S	*	*			trans	-84.7	99	173.3	173.8	0	0	0	0	108.3	N72 K76	N72-S74 PolarHBondContact O-N 3.35Å; N72-S74 VanDerWaalsContact O-N 3.13Å; S74-K76 PolarHBondContact O-N 3.13Å
75	D	30	Very low	28.1	Very low	155 Å²	155	151 Å²	151	83%	0.829	79%	0.791	S	S	*	*			trans	-67.7	106	167.4	-97.6	-36.2	0	0	0	109.4	A73 S77	A73-D75 PolarHBondContact O-N 3.12Å; D75-S77 PolarHBondContact O-N 3Å
76	K	31.9	Very low	27.9	Very low	192 Å²	192	154.1 Å²	154.1	84%	0.835	80%	0.798	S	S	*	*			trans	-90.4	81.9	172.7	-73.2	-179.7	177.3	174.2	0	109.8	S74 R78	S74-K76 PolarHBondContact O-N 3.13Å; K76-R78 PolarHBondContact O-N 2.8Å
77	S	31.8	Very low	27.8	Very low	114 Å²	114	158 Å²	158	80%	0.797	80%	0.804	S	S	*	*			trans	-92.2	86.8	163.2	25.4	0	0	0	0	109.4	D75 E79	D75-S77 PolarHBondContact O-N 3Å; S77-E79 PolarHBondContact O-N 3.08Å
78	R	26.1	Very low	27.4	Very low	227 Å²	227	157.5 Å²	157.5	86%	0.857	81%	0.808	S	S	*	*			trans	-80.1	90.5	171.8	-175	-178.8	-172	172.6	2.4	108.6	K76 V80	K76-R78 PolarHBondContact O-N 2.8Å; R78-V80 HydrophobicContact CG-CG2 4.34Å; R78-V80 PolarHBondContact O-N 2.93Å
79	E	25.6	Very low	27.2	Very low	175 Å²	175	158.3 Å²	158.3	82%	0.818	81%	0.812	S	S	*	*			trans	-80.9	107.4	173.1	-154.4	171.4	-156.6	0	0	109.4	S77 I81	S77-E79 PolarHBondContact O-N 3.08Å; E79-I81 PolarHBondContact O-N 2.9Å
80	V	24.3	Very low	26.8	Very low	110 Å²	110	159 Å²	159	67%	0.667	82%	0.815	S	S	*	*			trans	-82.4	94.7	177.7	177.4	0	0	0	0	107.9	R78 K82	R78-V80 HydrophobicContact CG-CG2 4.34Å; R78-V80 PolarHBondContact O-N 2.93Å; V80-K82 PolarHBondContact O-N 3.14Å
81	I	26.1	Very low	26.6	Very low	133 Å²	133	162.5 Å²	162.5	68%	0.682	82%	0.823	S	S	*	*			trans	-83.6	110.2	170.2	-59.8	174.5	0	0	0	107.6	E79 T83	E79-I81 PolarHBondContact O-N 2.9Å; I81-T83 PolarHBondContact O-N 3Å
82	K	26.4	Very low	26.3	Very low	190 Å²	190	161.3 Å²	161.3	83%	0.826	82%	0.821	S	S	*	*			trans	-71.5	112.3	168.4	-72.4	179.9	176.9	-180	0	108.3	V80	V80-K82 PolarHBondContact O-N 3.14Å
83	T	27.6	Very low	25.8	Very low	128 Å²	128	159.2 Å²	159.2	79%	0.785	82%	0.819	S	S	*	*			trans	-88	105.2	174.1	-38	0	0	0	0	108.3	I81 E85	I81-T83 PolarHBondContact O-N 3Å; T83-E85 PolarHBondContact O-N 2.85Å
84	D	24.3	Very low	25.8	Very low	160 Å²	160	160.8 Å²	160.8	86%	0.856	82%	0.82	S	S	*	*			trans	-71.4	119.3	167.3	-105.3	-40.9	0	0	0	109.1	K86	D84-K86 PolarHBondContact O-N 3.23Å; D84-K86 VanDerWaalsContact O-N 3.11Å
85	E	23.5	Very low	25.3	Very low	194 Å²	194	162 Å²	162	91%	0.907	82%	0.824	S	S	*	*			trans	-64	103.6	173.1	-75.2	-177.1	140.1	0	0	110.1	T83	T83-E85 PolarHBondContact O-N 2.85Å
86	K	26.2	Very low	24.9	Very low	204 Å²	204	161.4 Å²	161.4	89%	0.887	82%	0.821	S	S	*	*			trans	-105.4	108.7	161	-122.6	179.7	-177.7	179.6	0	109.8	D84 T88	D84-K86 PolarHBondContact O-N 3.23Å; D84-K86 VanDerWaalsContact O-N 3.11Å; K86-T88 PolarHBondContact O-N 2.77Å
87	K	25.7	Very low	24.7	Very low	210 Å²	210	158.7 Å²	158.7	91%	0.913	82%	0.82	S	S	*	*			trans	-43.6	126.5	175.3	-88.5	176.8	172.8	175.3	0	112.3	E89	K87-E89 PolarHBondContact O-N 3.26Å
88	T	22	Very low	24.2	Very low	141 Å²	141	159 Å²	159	87%	0.865	82%	0.817	S	S	*	*			trans	-62.5	117.6	166.7	-16.9	0	0	0	0	110	K86	K86-T88 PolarHBondContact O-N 2.77Å
89	E	24.4	Very low	24.2	Very low	191 Å²	191	155.5 Å²	155.5	89%	0.893	82%	0.815	S	S	*	*			trans	-108.4	116.1	160.7	-158	164.6	-153.9	0	0	107.9	K87 Q91	K87-E89 PolarHBondContact O-N 3.26Å; E89-Q91 PolarHBondContact O-N 3.33Å
90	K	21.7	Very low	24.1	Very low	198 Å²	198	156 Å²	156	86%	0.861	82%	0.815	S	S	*	*			trans	-66.6	125.6	179.6	-69.1	174.1	175.4	178.7	0	108.6
91	Q	22.3	Very low	24.3	Very low	193 Å²	193	156.8 Å²	156.8	90%	0.902	82%	0.822	S	S	*	*			trans	-140.5	137.3	152.4	-119	178	9.7	0	0	111.6	E89	E89-Q91 PolarHBondContact O-N 3.33Å
92	T	22.3	Very low	24.1	Very low	126 Å²	126	153.9 Å²	153.9	77%	0.773	82%	0.818	S	S	*	*			trans	-70.4	147.8	-165.2	28.2	0	0	0	0	114.2
93	S	21	Very low	24	Very low	108 Å²	108	152.2 Å²	152.2	76%	0.755	82%	0.818	S	S	*	*			trans	-36.1	138.5	163.6	49.8	0	0	0	0	115.8
94	P	27.1	Very low	23.9	Very low	129 Å²	129	156.1 Å²	156.1	84%	0.838	82%	0.824	S	S	*	*			trans	-110	145.5	144.7	30.8	-17.6	0	0	0	111.5
95	V	21.8	Very low	23.8	Very low	124 Å²	124	152.9 Å²	152.9	75%	0.752	82%	0.82	S	S	*	*			trans	-78.9	151.2	-174.2	157.3	0	0	0	0	112.1
96	D	21.5	Very low	23.9	Very low	143 Å²	143	151.3 Å²	151.3	77%	0.765	82%	0.818	S	S	*	*			trans	22.9	121.9	157.8	-73.5	-44.2	0	0	0	120
97	T	27.1	Very low	23.8	Very low	135 Å²	135	146.9 Å²	146.9	83%	0.828	81%	0.812	S	S	*	*			trans	-145	109.9	138.7	-25.9	0	0	0	0	109.9	D99	T97-D99 PolarHBondContact O-N 2.98Å
98	T	20.9	Very low	23.9	Very low	120 Å²	120	144.5 Å²	144.5	74%	0.736	81%	0.81	S	S	*	*			trans	-52.6	120.4	163.2	-50.6	0	0	0	0	109.9
99	D	27.3	Very low	24	Very low	153 Å²	153	145.9 Å²	145.9	82%	0.818	81%	0.811	S	S	*	*			trans	-144.6	121.5	151.8	-95.6	-37.6	0	0	0	110.7	T97 P101	T97-D99 PolarHBondContact O-N 2.98Å; D99-P101 WeakPolarHBondContact O-CD 3.41Å
100	K	22	Very low	24	Very low	187 Å²	187	145.3 Å²	145.3	81%	0.813	81%	0.808	S	S	*	*			trans	-95.2	113.6	-179.2	178.4	-174.1	-176.6	-177.1	0	107.7
101	P	28.7	Very low	24.1	Very low	125 Å²	125	141.8 Å²	141.8	81%	0.812	80%	0.803	S	S	*	*			trans	-88.7	114.2	163.7	22.4	-10.2	0	0	0	109	D99	D99-P101 WeakPolarHBondContact O-CD 3.41Å
102	A	22.9	Very low	24.4	Very low	72 Å²	72	138.5 Å²	138.5	60%	0.595	80%	0.799	S	S	*	*			trans	-78.8	139.1	168.3	0	0	0	0	0	110.7
103	N	23.1	Very low	24.6	Very low	156 Å²	156	141.5 Å²	141.5	83%	0.834	80%	0.804	S	S	*	*			trans	55.1	118.8	148.9	-64.5	-22.9	0	0	0	119.2
104	K	26.8	Very low	24.9	Very low	209 Å²	209	144.4 Å²	144.4	91%	0.909	81%	0.811	S	S	*	*				-160	132.6	109.2	-103	176.2	-173.8	-172	0	110.8
105	A	21.9	Very low	24.9	Very low	92 Å²	92	147.1 Å²	147.1	76%	0.76	81%	0.81	S	S	*	*			trans	-75.7	132.9	176	0	0	0	0	0	109.9
106	D	25.1	Very low	25.4	Very low	162 Å²	162	146.9 Å²	146.9	87%	0.866	81%	0.811	S	S	*	*			trans	-128.1	108.1	151.9	-85	-43.1	0	0	0	107.2	N108	D106-N108 PolarHBondContact O-N 3.09Å
107	S	24.4	Very low	25.6	Very low	110 Å²	110	146.6 Å²	146.6	77%	0.769	82%	0.815	S	S	*	*			trans	-71	103.5	177.6	51.8	0	0	0	0	110
108	N	27.2	Very low	25.9	Very low	161 Å²	161	143.6 Å²	143.6	86%	0.861	80%	0.799	S	S	*	*			trans	-97.2	96.7	153.9	-84.5	-39.8	0	0	0	107.6	D106 E110	D106-N108 PolarHBondContact O-N 3.09Å; N108-E110 VanDerWaalsContact C-N 3.28Å; N108-E110 PolarHBondContact O-N 3.3Å
109	L	24.8	Very low	26.2	Very low	170 Å²	170	143.1 Å²	143.1	89%	0.89	80%	0.8	S	S	*	*			trans	-74	80.9	175.1	-170.6	78.9	0	0	0	108.4
110	E	24.5	Very low	26.4	Very low	179 Å²	179	141.5 Å²	141.5	84%	0.836	80%	0.796	S	S	*	*			trans	-88	108.8	166.4	-122.5	175.2	179.7	0	0	108.1	N108	N108-E110 VanDerWaalsContact C-N 3.28Å; N108-E110 PolarHBondContact O-N 3.3Å
111	T	23.7	Very low	26.5	Very low	123 Å²	123	142.4 Å²	142.4	76%	0.755	79%	0.794	S	S	*	*			trans	-47	121.8	175.6	25.8	0	0	0	0	111.5	Q113	T111-Q113 PolarHBondContact O-N 3.36Å
112	P	28.8	Very low	26.4	Very low	125 Å²	125	145 Å²	145	81%	0.812	80%	0.8	S	S	*	*			trans	-69.1	114.5	177.6	-12.6	26.8	0	0	0	109.8	D114	P112-D114 PolarHBondContact O-N 3.44Å
113	Q	26.4	Very low	26.7	Very low	189 Å²	189	148.5 Å²	148.5	88%	0.883	81%	0.808	S	S	*	*			trans	-63	124.4	168	-98.2	-170.4	-38.6	0	0	110.2	T111 K115	T111-Q113 PolarHBondContact O-N 3.36Å; Q113-K115 PolarHBondContact O-N 3.03Å; Q113-K115 VanDerWaalsContact O-N 3.16Å
114	D	26.2	Very low	26.8	Very low	169 Å²	169	147.7 Å²	147.7	90%	0.904	80%	0.803	S	S	*	*			trans	-46.1	110	175.2	-72.9	-55	0	0	0	112.9	P112	P112-D114 PolarHBondContact O-N 3.44Å
115	K	28.5	Very low	26.9	Very low	185 Å²	185	149.1 Å²	149.1	80%	0.804	80%	0.803	S	S	*	*			trans	-116.7	136.4	160.3	-85.9	-176.8	177.6	179	0	109	Q113 T117	Q113-K115 PolarHBondContact O-N 3.03Å; Q113-K115 VanDerWaalsContact O-N 3.16Å; K115-T117 PolarHBondContact O-N 3.34Å; K115-T117 PolarHBondContact O-OG1 2.96Å
116	P	30.4	Very low	27.2	Very low	120 Å²	120	149.7 Å²	149.7	78%	0.779	80%	0.797	S	S	*	*			trans	-76.4	98.7	-164.2	29.2	-33.6	0	0	0	112.1
117	T	27.7	Very low	27.4	Very low	137 Å²	137	149.2 Å²	149.2	84%	0.84	79%	0.794	S	S	*	*			trans	-69.6	117.2	169	-43.4	0	0	0	0	110.4	K115	K115-T117 PolarHBondContact O-N 3.34Å; K115-T117 PolarHBondContact O-OG1 2.96Å
118	S	31.8	Very low	27.4	Very low	71 Å²	71	153.6 Å²	153.6	50%	0.497	80%	0.802	S	S	.	*			trans	-173.9	114.6	136.4	69.2	0	0	0	0	110.1	K480	S118-K480 PolarHBondContact O-NZ 3.01Å; S118-K480 PolarHBondContact OG-NZ 3.04Å
119	S	28.7	Very low	27.3	Very low	110 Å²	110	148.6 Å²	148.6	77%	0.769	79%	0.789	S	S	*	*			trans	-85.6	104.1	165	58.1	0	0	0	0	107.8	R121	S119-R121 PolarHBondContact O-N 2.93Å
120	V	30.2	Very low	27.5	Very low	119 Å²	119	146.4 Å²	146.4	72%	0.721	79%	0.785	S	S	*	*			trans	-73.7	113.6	173.4	177.9	0	0	0	0	107.7	L122	V120-L122 PolarHBondContact O-N 2.97Å
121	R	25.5	Very low	27.5	Very low	207 Å²	207	144.6 Å²	144.6	78%	0.781	79%	0.786	S	S	*	*			trans	-53.9	133.1	173.5	-69.7	177.6	175.8	-176.1	-2.7	108.8	S119 I123	S119-R121 PolarHBondContact O-N 2.93Å; R121-I123 PolarHBondContact O-N 3.49Å
122	L	26	Very low	27.8	Very low	180 Å²	180	144.9 Å²	144.9	94%	0.942	79%	0.788	S	S	*	*			trans	-46.8	103.4	165.4	-90.9	124	0	0	0	108.3	V120 D124	V120-L122 PolarHBondContact O-N 2.97Å; L122-D124 PolarHBondContact O-N 3.45Å
123	I	29.1	Very low	27.8	Very low	145 Å²	145	147.5 Å²	147.5	74%	0.744	79%	0.79	S	S	*	*			trans	-68.4	108.7	173	-53.1	172.4	0	0	0	104.6	R121 R125	R121-I123 PolarHBondContact O-N 3.49Å; I123-R125 VanDerWaalsContact C-N 3.34Å; I123-R125 PolarHBondContact O-N 3.24Å
124	D	24.9	Very low	27.8	Very low	138 Å²	138	145.9 Å²	145.9	74%	0.738	79%	0.785	S	S	*	*			trans	-37.4	97.5	164	-116.3	-24.5	0	0	0	108.7	L122 V126	L122-D124 PolarHBondContact O-N 3.45Å; D124-V126 HydrophobicContact CB-CG2 4.17Å; D124-V126 PolarHBondContact O-N 2.96Å
125	R	30	Very low	28	Very low	239 Å²	239	144.4 Å²	144.4	90%	0.902	78%	0.777	S	S	*	*			trans	-70.8	74.8	164.4	-81.7	-175.6	178.2	168.7	1	106.3	I123 N127	I123-R125 VanDerWaalsContact C-N 3.34Å; I123-R125 PolarHBondContact O-N 3.24Å; R125-N127 PolarHBondContact O-N 3.46Å
126	V	27.2	Very low	28.2	Very low	105 Å²	105	143.9 Å²	143.9	64%	0.636	78%	0.778	S	S	*	*			trans	-67.5	90.8	162.6	174.1	0	0	0	0	106.2	D124 Q128	D124-V126 HydrophobicContact CB-CG2 4.17Å; D124-V126 PolarHBondContact O-N 2.96Å; V126-Q128 PolarHBondContact O-N 3.45Å
127	N	28.6	Very low	28.3	Very low	152 Å²	152	146.5 Å²	146.5	81%	0.813	78%	0.777	S	S	*	*			trans	12	84.3	143.6	-61.5	-47.6	0	0	0	114.7	R125	R125-N127 PolarHBondContact O-N 3.46Å
128	Q	24.5	Very low	28.6	Very low	201 Å²	201	145.3 Å²	145.3	94%	0.939	77%	0.765	S	S	*	*			trans	-109	85.5	153.9	-68.1	-165.6	23.6	0	0	107.9	V126	V126-Q128 PolarHBondContact O-N 3.45Å
129	G	25.6	Very low	28.9	Very low	56 Å²	56	146 Å²	146	58%	0.577	77%	0.768	S	S	*	*	S	Bend	trans	-168	132.8	172.9	0	0	0	0	0	109.3	T131	G129-T131 PolarHBondContact O-N 3.31Å
130	P	29.8	Very low	29.2	Very low	124 Å²	124	144.1 Å²	144.1	81%	0.805	76%	0.755	S	S	*	*			trans	-70.7	124.2	-166	26.6	-31	0	0	0	111.5	T132	P130-T132 PolarHBondContact O-N 3.02Å
131	T	25.2	Very low	29.3	Very low	142 Å²	142	142 Å²	142	87%	0.871	75%	0.745	S	S	*	*			trans	-50.3	101.1	179.6	-37.4	0	0	0	0	112.2	G129	G129-T131 PolarHBondContact O-N 3.31Å
132	T	28.5	Very low	29.9	Very low	129 Å²	129	136.1 Å²	136.1	79%	0.791	73%	0.733	S	S	*	*			trans	-129.8	99.1	158.9	28.3	0	0	0	0	109.9	P130	P130-T132 PolarHBondContact O-N 3.02Å
133	Q	29.9	Very low	30.1	Very low	180 Å²	180	132.9 Å²	132.9	84%	0.841	72%	0.716	S	S	*	*			trans	37.7	92.8	151.3	-57.9	-169.8	49.3	0	0	117.8	N135	Q133-N135 PolarHBondContact O-N 3.12Å
134	I	25.4	Very low	30.3	Very low	154 Å²	154	130.9 Å²	130.9	79%	0.79	71%	0.705	S	S	*	*			trans	11	98.7	136.5	-43	172.2	0	0	0	114.3	E136	I134-E136 HydrophobicContact CG2-CG 3.91Å
135	N	31.1	Very low	30.7	Very low	139 Å²	139	129.1 Å²	129.1	74%	0.743	70%	0.696	S	S	*	*			trans	-115.3	100.6	152.7	-155.2	-17.4	0	0	0	106.2	Q133 K137	Q133-N135 PolarHBondContact O-N 3.12Å; N135-K137 PolarHBondContact O-N 2.93Å
136	E	31.5	Very low	31	Very low	173 Å²	173	125 Å²	125	81%	0.808	69%	0.685	S	S	*	*			trans	-64.4	74.7	174.9	-74	-174.9	157	0	0	109.7	I134 N138	I134-E136 HydrophobicContact CG2-CG 3.91Å; E136-N138 VanDerWaalsContact C-N 3.33Å; E136-N138 PolarHBondContact O-N 3.35Å; E136-N138 VanDerWaalsContact O-N 3.1Å
137	K	34.4	Very low	31.2	Very low	175 Å²	175	124.7 Å²	124.7	76%	0.761	68%	0.679	S	S	*	*			trans	-76.9	96.8	160.7	-82.7	-173.5	177.7	178.1	0	107.5	N135	N135-K137 PolarHBondContact O-N 2.93Å
138	N	34.1	Very low	31.5	Very low	112 Å²	112	122 Å²	122	60%	0.599	67%	0.668	S	S	*	*			trans	-22.7	112.7	169.8	-150.2	-22	0	0	0	112.7	E136 S140	E136-N138 VanDerWaalsContact C-N 3.33Å; E136-N138 PolarHBondContact O-N 3.35Å; E136-N138 VanDerWaalsContact O-N 3.1Å; N138-S140 PolarHBondContact O-N 2.98Å; N138-S140 PolarHBondContact OD1-OG 3.38Å
139	P	36.2	Very low	31.7	Very low	87 Å²	87	116.2 Å²	116.2	57%	0.565	65%	0.65	S	S	*	*	T	Hydrogen-bonded Turn	trans	-65.3	-5.8	-174.8	24.6	-33.1	0	0	0	114.1	S141 T142	P139-S141 PolarHBondContact O-N 3.3Å; P139-T142 PolarHBondContact O-N 2.9Å
140	S	36.2	Very low	32	Very low	69 Å²	69	119 Å²	119	48%	0.483	66%	0.658	S	S	.	*	H	α-helix	trans	-58	-28.5	177.3	-61.1	0	0	0	0	113.7	N138 I144	N138-S140 PolarHBondContact O-N 2.98Å; N138-S140 PolarHBondContact OD1-OG 3.38Å; S140-I144 WeakPolarHBondContact O-CG1 3.35Å; S140-I144 PolarHBondContact O-N 2.73Å
141	S	32.4	Very low	32.3	Very low	74 Å²	74	119.9 Å²	119.9	52%	0.517	66%	0.655	S	S	.	*	H	α-helix	trans	-74.5	-29.3	178.7	63.8	0	0	0	0	113.8	P139 N145	P139-S141 PolarHBondContact O-N 3.3Å; S141-N145 PolarHBondContact O-N 3.07Å
142	T	37.7	Very low	32.6	Very low	85 Å²	85	121.6 Å²	121.6	52%	0.521	65%	0.653	S	S	.	*	H	α-helix	trans	-75.4	-36.8	-179.3	-46.6	0	0	0	0	111.5	P139 N145 F146	P139-T142 PolarHBondContact O-N 2.9Å; T142-N145 PolarHBondContact O-N 2.97Å; T142-F146 PolarHBondContact O-N 2.7Å; T142-F146 VanDerWaalsContact O-N 3.09Å
143	L	29.8	Very low	32.8	Very low	111 Å²	111	120.2 Å²	120.2	58%	0.581	64%	0.644	S	S	*	*	H	α-helix	trans	-66.2	-39	176.8	-94.4	159.2	0	0	0	112.6	N145 F146 L147	L143-N145 VanDerWaalsContact C-N 3.35Å; L143-N145 PolarHBondContact O-N 3.45Å; L143-F146 PolarHBondContact O-N 3.04Å; L143-L147 WeakPolarHBondContact O-CG 3.47Å; L143-L147 PolarHBondContact O-N 3.49Å; L143-L147 VanDerWaalsContact O-N 3.1Å
144	I	33.2	Very low	32.7	Very low	103 Å²	103	119.1 Å²	119.1	53%	0.528	64%	0.642	S	S	.	*	H	α-helix	trans	-62.8	-45.1	177	-66.1	169.1	0	0	0	109.9	S140 F146 L147 T148	S140-I144 WeakPolarHBondContact O-CG1 3.35Å; S140-I144 PolarHBondContact O-N 2.73Å; I144-F146 VanDerWaalsContact C-N 3.31Å; I144-F146 PolarHBondContact O-N 3.32Å; I144-L147 PolarHBondContact O-N 3.38Å; I144-T148 HydrophobicContact CG2-CG2 4.42Å; I144-T148 WeakPolarHBondContact O-CG2 3.48Å; I144-T148 PolarHBondContact O-N 3.05Å; I144-T148 PolarHBondContact O-OG1 3.46Å
145	N	32.6	Very low	32.9	Very low	101 Å²	101	120.4 Å²	120.4	54%	0.54	64%	0.643	S	S	.	*	H	α-helix	trans	-63.6	-36.1	177.5	-69.7	-12.7	0	0	0	112.4	S141 T142 L143 L147 S149	S141-N145 PolarHBondContact O-N 3.07Å; T142-N145 PolarHBondContact O-N 2.97Å; L143-N145 VanDerWaalsContact C-N 3.35Å; L143-N145 PolarHBondContact O-N 3.45Å; N145-L147 VanDerWaalsContact C-N 3.35Å; N145-S149 WeakPolarHBondContact O-CB 3.44Å; N145-S149 PolarHBondContact O-N 3.41Å; N145-S149 PolarHBondContact O-OG 3Å
146	F	37	Very low	32.9	Very low	152 Å²	152	119.2 Å²	119.2	67%	0.667	65%	0.645	S	S	*	*	H	α-helix	trans	-66.2	-35.5	176.6	-112.6	-85.3	0	0	0	112.8	T142 L143 I144	T142-F146 PolarHBondContact O-N 2.7Å; T142-F146 VanDerWaalsContact O-N 3.09Å; L143-F146 PolarHBondContact O-N 3.04Å; I144-F146 VanDerWaalsContact C-N 3.31Å; I144-F146 PolarHBondContact O-N 3.32Å
147	L	32.6	Very low	32.7	Very low	99 Å²	99	114.6 Å²	114.6	52%	0.518	64%	0.643	S	S	.	*	H	α-helix	trans	-80.8	-27.1	-179.9	-68.4	173.4	0	0	0	113.4	L143 I144 N145	L143-L147 WeakPolarHBondContact O-CG 3.47Å; L143-L147 PolarHBondContact O-N 3.49Å; L143-L147 VanDerWaalsContact O-N 3.1Å; I144-L147 PolarHBondContact O-N 3.38Å; N145-L147 VanDerWaalsContact C-N 3.35Å
148	T	33.9	Very low	32.3	Very low	96 Å²	96	117.2 Å²	117.2	59%	0.589	65%	0.649	S	S	*	*	H	α-helix	trans	-103.1	-4.9	-176	63.3	0	0	0	0	114.8	I144 P150	I144-T148 HydrophobicContact CG2-CG2 4.42Å; I144-T148 WeakPolarHBondContact O-CG2 3.48Å; I144-T148 PolarHBondContact O-N 3.05Å; I144-T148 PolarHBondContact O-OG1 3.46Å; T148-P150 VanDerWaalsContact O-CD 3.24Å; T148-P150 WeakPolarHBondContact O-CD 3.38Å
149	S	29.7	Very low	32	Very low	79 Å²	79	115.8 Å²	115.8	55%	0.552	65%	0.652	S	S	*	*			trans	-68.1	117.9	178.1	-68.3	0	0	0	0	110	N145 I151	N145-S149 WeakPolarHBondContact O-CB 3.44Å; N145-S149 PolarHBondContact O-N 3.41Å; N145-S149 PolarHBondContact O-OG 3Å; S149-I151 PolarHBondContact O-N 3.37Å
150	P	31.1	Very low	31.7	Very low	116 Å²	116	117.6 Å²	117.6	75%	0.753	66%	0.664	S	S	*	*			trans	-62.4	127.6	172.7	-15.4	29.3	0	0	0	108.5	T148 Q152	T148-P150 VanDerWaalsContact O-CD 3.24Å; T148-P150 WeakPolarHBondContact O-CD 3.38Å; P150-Q152 PolarHBondContact O-N 3.48Å
151	I	36.5	Very low	31.2	Very low	142 Å²	142	118.9 Å²	118.9	73%	0.728	67%	0.673	S	S	*	*			trans	-53	106.7	172.9	-61.2	167.4	0	0	0	106.9	S149 T153	S149-I151 PolarHBondContact O-N 3.37Å; I151-T153 PolarHBondContact O-N 2.95Å
152	Q	31.7	Very low	31.1	Very low	177 Å²	177	121.6 Å²	121.6	83%	0.827	69%	0.689	S	S	*	*			trans	-67.9	91	159.3	-76.7	-175.2	17.1	0	0	105.1	P150 I154	P150-Q152 PolarHBondContact O-N 3.48Å; Q152-I154 VanDerWaalsContact C-N 3.26Å; Q152-I154 PolarHBondContact O-N 3.26Å
153	T	31.3	Very low	30.7	Very low	101 Å²	101	124 Å²	124	62%	0.62	70%	0.704	S	S	*	*			trans	-60.8	98.8	167.8	-42.8	0	0	0	0	105.6	I151 K155	I151-T153 PolarHBondContact O-N 2.95Å; T153-K155 HydrophobicContact CG2-CG 4.21Å; T153-K155 PolarHBondContact O-N 3.26Å
154	I	27.7	Very low	30.6	Very low	156 Å²	156	124.7 Å²	124.7	80%	0.8	71%	0.713	S	S	*	*			trans	-67.1	86.5	168.1	-57.7	174.2	0	0	0	104.5	Q152 S156	Q152-I154 VanDerWaalsContact C-N 3.26Å; Q152-I154 PolarHBondContact O-N 3.26Å; I154-S156 PolarHBondContact O-N 3.47Å
155	K	29.9	Very low	30.3	Very low	182 Å²	182	125.1 Å²	125.1	79%	0.791	72%	0.722	S	S	*	*			trans	-63.5	106.6	169.4	-73.1	-173.1	177.2	-175.9	0	105.8	T153 G157	T153-K155 HydrophobicContact CG2-CG 4.21Å; T153-K155 PolarHBondContact O-N 3.26Å; K155-G157 PolarHBondContact O-N 2.9Å
156	S	31	Very low	30.2	Very low	114 Å²	114	126.3 Å²	126.3	80%	0.797	74%	0.735	S	S	*	*			trans	-47.7	108.7	166.7	178.6	0	0	0	0	108.1	I154 R158	I154-S156 PolarHBondContact O-N 3.47Å; S156-R158 VanDerWaalsContact C-N 3.26Å; S156-R158 PolarHBondContact O-N 3.3Å
157	G	28.4	Very low	29.7	Very low	75 Å²	75	125.5 Å²	125.5	77%	0.773	74%	0.743	S	S	*	*			trans	-72.4	81.4	-177.7	0	0	0	0	0	109.9	K155 A159	K155-G157 PolarHBondContact O-N 2.9Å; G157-A159 PolarHBondContact O-N 3.29Å; G157-A159 VanDerWaalsContact O-N 3.16Å
158	R	26.3	Very low	29.3	Very low	231 Å²	231	129.7 Å²	129.7	87%	0.872	76%	0.76	S	S	*	*			trans	-69.3	106.4	158.3	-172.4	173.9	-175.1	167.8	3.1	106.7	S156 P160	S156-R158 VanDerWaalsContact C-N 3.26Å; S156-R158 PolarHBondContact O-N 3.3Å; R158-P160 WeakPolarHBondContact O-CD 3.42Å
159	A	27.7	Very low	28.9	Very low	81 Å²	81	131.9 Å²	131.9	67%	0.669	77%	0.773	S	S	*	*	P	Polyproline II helix	trans	-50.8	122	175.6	0	0	0	0	0	109.5	G157 S161	G157-A159 PolarHBondContact O-N 3.29Å; G157-A159 VanDerWaalsContact O-N 3.16Å; A159-S161 PolarHBondContact O-N 2.96Å
160	P	28.3	Very low	28.8	Very low	126 Å²	126	137.5 Å²	137.5	82%	0.818	79%	0.788	S	S	*	*	P	Polyproline II helix	trans	-68.7	120.8	178.5	25.6	-30.3	0	0	0	108.8	R158	R158-P160 WeakPolarHBondContact O-CD 3.42Å
161	S	27.3	Very low	29.2	Very low	95 Å²	95	137.7 Å²	137.7	66%	0.664	79%	0.789	S	S	*	*	P	Polyproline II helix	trans	-60.5	141.7	173.8	-54	0	0	0	0	110.4	A159 T163	A159-S161 PolarHBondContact O-N 2.96Å; S161-T163 PolarHBondContact O-N 3.46Å; S161-T163 VanDerWaalsContact O-N 3.12Å; S161-T163 PolarHBondContact O-OG1 3.37Å
162	P	28.7	Very low	28.7	Very low	132 Å²	132	135.6 Å²	135.6	86%	0.857	79%	0.793	S	S	*	*	P	Polyproline II helix	trans	-64.5	116.4	-172.7	25.3	-32	0	0	0	110
163	T	31	Very low	28.5	Very low	135 Å²	135	134.2 Å²	134.2	83%	0.828	79%	0.791	S	S	*	*	P	Polyproline II helix	trans	-93.8	118.6	175.2	-43.1	0	0	0	0	108.1	S161	S161-T163 PolarHBondContact O-N 3.46Å; S161-T163 VanDerWaalsContact O-N 3.12Å; S161-T163 PolarHBondContact O-OG1 3.37Å
164	T	27.5	Very low	28.1	Very low	126 Å²	126	137.6 Å²	137.6	77%	0.773	80%	0.8	S	S	*	*	P	Polyproline II helix	trans	-57.7	136.2	178.3	-34.9	0	0	0	0	110.7
165	P	26.5	Very low	28	Very low	111 Å²	111	135 Å²	135	72%	0.721	79%	0.792	S	S	*	*	P	Polyproline II helix	trans	-68.3	136.8	-170.7	24.8	-33.5	0	0	0	112.6
166	P	29.9	Very low	27.9	Very low	126 Å²	126	135.8 Å²	135.8	82%	0.818	80%	0.795	S	S	*	*	P	Polyproline II helix	trans	-77.4	135.9	-177.4	29.5	-31.4	0	0	0	111.8
167	T	27.4	Very low	27.6	Very low	135 Å²	135	137.6 Å²	137.6	83%	0.828	80%	0.796	S	S	*	*	P	Polyproline II helix	trans	-72.8	128	176.5	-46.6	0	0	0	0	110.5
168	E	23	Very low	27.5	Very low	187 Å²	187	141.9 Å²	141.9	87%	0.874	80%	0.8	S	S	*	*	P	Polyproline II helix	trans	-58.4	135.9	176.3	-66	-178.8	149.4	0	0	111.9
169	T	25.6	Very low	27.3	Very low	142 Å²	142	139.1 Å²	139.1	87%	0.871	80%	0.797	S	S	*	*			trans	-138.5	122.5	155.3	-32.8	0	0	0	0	108.2
170	K	27	Very low	27.3	Very low	197 Å²	197	141.3 Å²	141.3	86%	0.857	80%	0.802	S	S	*	*			trans	-72.9	163.2	-172	-105.7	-177.9	174.4	176.7	0	113
171	P	39.9	Very low	27	Very low	120 Å²	120	142.2 Å²	142.2	78%	0.779	80%	0.8	S	S	*	*			trans	-92	159.1	-156.7	37.5	-35.1	0	0	0	113.6
172	A	27.7	Very low	27.1	Very low	99 Å²	99	147.6 Å²	147.6	82%	0.818	81%	0.812	S	S	*	*			trans	-117.5	144.3	165.6	0	0	0	0	0	110
173	D	26.3	Very low	26.8	Very low	148 Å²	148	151.7 Å²	151.7	79%	0.791	82%	0.816	S	S	*	*			trans	-68.7	137.2	-160.2	-68.3	-58.1	0	0	0	116.7
174	E	24.1	Very low	26.7	Very low	172 Å²	172	150.6 Å²	150.6	80%	0.804	81%	0.814	S	S	*	*				57.2	149.9	112.9	-143.3	-175.7	-161	0	0	122.1
175	V	24.5	Very low	26.7	Very low	102 Å²	102	150.2 Å²	150.2	62%	0.618	82%	0.816	S	S	*	*			trans	99.9	102.6	151.1	-162.1	0	0	0	0	116.3
176	K	28.2	Very low	26.4	Very low	197 Å²	197	154 Å²	154	86%	0.857	82%	0.824	S	S	*	*				170.7	135.2	75.8	-132.4	158.8	-153.8	177.4	0	113.4
177	D	23.4	Very low	26.2	Very low	153 Å²	153	156.1 Å²	156.1	82%	0.818	83%	0.828	S	S	*	*			trans	-60.8	149.5	167.7	-71.3	-58.2	0	0	0	114.3
178	L	26.5	Very low	25.9	Very low	164 Å²	164	159.3 Å²	159.3	86%	0.859	83%	0.83	S	S	*	*			trans	-140.6	98.9	152.6	-151.8	85.9	0	0	0	110
179	E	23.6	Very low	26.2	Very low	173 Å²	173	159.8 Å²	159.8	81%	0.808	83%	0.832	S	S	*	*			trans	-89.3	122.5	175.7	-161.3	178.5	-157.6	0	0	109
180	T	26.5	Very low	26.3	Very low	128 Å²	128	162.4 Å²	162.4	79%	0.785	83%	0.832	S	S	*	*			trans	-127.3	101.3	170.2	40.9	0	0	0	0	111.5
181	N	22.9	Very low	26.1	Very low	144 Å²	144	162.1 Å²	162.1	77%	0.77	83%	0.834	S	S	*	*			trans	-66.2	129	162.9	-88.2	-62.7	0	0	0	111.5
182	K	28.6	Very low	25.4	Very low	209 Å²	209	163.8 Å²	163.8	91%	0.909	84%	0.836	S	S	*	*			trans	-142.9	114.7	154	-90.5	-172.2	179.4	174.7	0	112.2
183	K	23.2	Very low	25.3	Very low	217 Å²	217	167.4 Å²	167.4	94%	0.943	83%	0.833	S	S	*	*			trans	-70.5	140	164	-80	172.6	171.3	173.3	0	110.4
184	S	27.5	Very low	25.5	Very low	113 Å²	113	168 Å²	168	79%	0.79	84%	0.836	S	S	*	*			trans	-143.8	93.8	165.8	48.5	0	0	0	0	107.6
185	S	27.9	Very low	25.5	Very low	117 Å²	117	165.1 Å²	165.1	82%	0.818	84%	0.835	S	S	*	*				67.4	101.9	88.6	-170.3	0	0	0	0	114.1
186	E	21.7	Very low	25.6	Very low	192 Å²	192	169 Å²	169	90%	0.897	84%	0.844	S	S	*	*			trans	-59.4	138.6	169.7	-74.8	169.2	120.4	0	0	112.7
187	L	25	Very low	25.3	Very low	170 Å²	170	167.1 Å²	167.1	89%	0.89	84%	0.843	S	S	*	*			trans	-118.5	113.4	169	-107.2	158.2	0	0	0	109
188	K	21.6	Very low	25.6	Very low	202 Å²	202	166.9 Å²	166.9	88%	0.878	84%	0.837	S	S	*	*			trans	-75.3	121	166.5	-74	-179.2	174.1	177.9	0	108.7
189	E	29.5	Very low	25.4	Very low	197 Å²	197	165.6 Å²	165.6	92%	0.921	84%	0.836	S	S	*	*			trans	-105.8	128.9	169.6	-159.9	169.7	-177.7	0	0	110.6
190	K	26.9	Very low	25.7	Very low	197 Å²	197	164.1 Å²	164.1	86%	0.857	83%	0.834	S	S	*	*			trans	-81.1	141.3	-167.6	-74.6	175.1	172.6	176.1	0	111.7	N192	K190-N192 PolarHBondContact O-N 3.49Å
191	Q	22.3	Very low	25.7	Very low	191 Å²	191	166.2 Å²	166.2	89%	0.893	84%	0.835	S	S	*	*			trans	-50.9	122.8	165.5	-75.6	173.7	-35.7	0	0	111.3
192	N	25.5	Very low	25.8	Very low	155 Å²	155	166.4 Å²	166.4	83%	0.829	83%	0.834	S	S	*	*			trans	-104.5	109.3	165.4	-152	2.3	0	0	0	108.5	K190	K190-N192 PolarHBondContact O-N 3.49Å
193	K	25	Very low	25.6	Very low	175 Å²	175	164 Å²	164	76%	0.761	83%	0.826	S	S	*	*			trans	-75.8	125.9	168.5	-75.2	176	175.6	178.3	0	107.4
194	N	30.2	Very low	25.7	Very low	161 Å²	161	159 Å²	159	86%	0.861	82%	0.818	S	S	*	*			trans	-148.1	105.3	148.5	-100.9	-11.3	0	0	0	109.3
195	S	25.3	Very low	25.7	Very low	111 Å²	111	162.6 Å²	162.6	78%	0.776	82%	0.82	S	S	*	*			trans	-73	134	168.8	-37.5	0	0	0	0	109.1
196	K	26.1	Very low	25.5	Very low	183 Å²	183	165.9 Å²	165.9	80%	0.796	82%	0.819	S	S	*	*			trans	-149.3	105	149.2	-160.2	173.9	-179.1	-173.7	0	108	E198	K196-E198 PolarHBondContact O-N 3.37Å
197	D	23	Very low	25.7	Very low	157 Å²	157	163.2 Å²	163.2	84%	0.84	82%	0.816	S	S	*	*			trans	-64.2	119.8	169.8	-72.5	-57.2	0	0	0	109.1
198	E	28.2	Very low	25.6	Very low	148 Å²	148	162.8 Å²	162.8	69%	0.692	81%	0.809	S	S	*	*			trans	-126.8	102.1	155.5	-85.1	-179.4	-175	0	0	107.3	K196 N200	K196-E198 PolarHBondContact O-N 3.37Å; E198-N200 PolarHBondContact O-N 2.95Å
199	T	23.1	Very low	25.8	Very low	138 Å²	138	158.5 Å²	158.5	85%	0.847	80%	0.804	S	S	*	*			trans	-54.2	110.8	164.6	35.2	0	0	0	0	109.8
200	N	29	Very low	25.5	Very low	142 Å²	142	158.3 Å²	158.3	76%	0.759	80%	0.804	S	S	*	*			trans	-119.8	117.5	159.4	-82.7	-40.2	0	0	0	109.1	E198 I202	E198-N200 PolarHBondContact O-N 2.95Å; N200-I202 PolarHBondContact O-N 3.17Å
201	E	27.1	Very low	25.4	Very low	171 Å²	171	153.8 Å²	153.8	80%	0.799	80%	0.797	S	S	*	*			trans	-57.9	123.2	-178	-161.4	172.3	-176.8	0	0	110.7	H203	E201-H203 PolarHBondContact O-N 2.99Å; E201-H203 VanDerWaalsContact O-N 3.11Å
202	I	25	Very low	25.6	Very low	148 Å²	148	152.3 Å²	152.3	76%	0.759	80%	0.795	S	S	*	*			trans	-78.2	94.1	-177.5	-61.1	168.4	0	0	0	108	N200 S204	N200-I202 PolarHBondContact O-N 3.17Å; I202-S204 PolarHBondContact O-N 2.96Å
203	H	23.9	Very low	25.6	Very low	160 Å²	160	152.6 Å²	152.6	74%	0.741	80%	0.795	S	S	*	*			trans	-83.5	97.3	159.9	-83.1	-35	0	0	0	109.8	E201 K205	E201-H203 PolarHBondContact O-N 2.99Å; E201-H203 VanDerWaalsContact O-N 3.11Å; H203-K205 PolarHBondContact O-N 3.25Å
204	S	26.6	Very low	25.7	Very low	111 Å²	111	151.6 Å²	151.6	78%	0.776	80%	0.798	S	S	*	*			trans	-57.2	89.7	169.8	-56.5	0	0	0	0	111.3	I202	I202-S204 PolarHBondContact O-N 2.96Å
205	K	25.8	Very low	25.6	Very low	189 Å²	189	150.1 Å²	150.1	82%	0.822	79%	0.794	S	S	*	*			trans	-87.1	110.3	161.6	-87.9	-177.4	177.8	176.7	0	109.1	H203 V207	H203-K205 PolarHBondContact O-N 3.25Å; K205-V207 PolarHBondContact O-N 3.36Å
206	K	24.9	Very low	25.6	Very low	186 Å²	186	147.8 Å²	147.8	81%	0.809	79%	0.788	S	S	*	*			trans	-48.9	100.9	166.5	-174	-177.6	-179.3	-162.6	0	109.2	E208	K206-E208 PolarHBondContact O-N 3.4Å
207	V	26	Very low	25.5	Very low	136 Å²	136	148.1 Å²	148.1	82%	0.824	79%	0.792	S	S	*	*			trans	-81	96.4	172.1	177.9	0	0	0	0	107	K205 S209	K205-V207 PolarHBondContact O-N 3.36Å; V207-S209 PolarHBondContact O-N 3.05Å
208	E	22.9	Very low	25.7	Very low	160 Å²	160	150.1 Å²	150.1	75%	0.748	79%	0.793	S	S	*	*			trans	-69	121.1	167.3	-163.4	153.4	-160.6	0	0	107.9	K206 Q210	K206-E208 PolarHBondContact O-N 3.4Å; E208-Q210 PolarHBondContact O-N 3.47Å
209	S	24.9	Very low	25.6	Very low	112 Å²	112	152.2 Å²	152.2	78%	0.783	80%	0.8	S	S	*	*			trans	-67.1	97.9	-175.6	46.5	0	0	0	0	110.9	V207	V207-S209 PolarHBondContact O-N 3.05Å
210	Q	24.4	Very low	25.8	Very low	194 Å²	194	153.5 Å²	153.5	91%	0.907	80%	0.796	S	S	*	*			trans	-89.5	104	160.9	-106.4	178.9	-15.8	0	0	109.1	E208 D212	E208-Q210 PolarHBondContact O-N 3.47Å; Q210-D212 PolarHBondContact O-N 3.39Å
211	S	24.8	Very low	25.6	Very low	102 Å²	102	154.1 Å²	154.1	71%	0.713	80%	0.8	S	S	*	*			trans	-62	117.6	160.3	48	0	0	0	0	109.3
212	D	25.2	Very low	25.6	Very low	160 Å²	160	152.9 Å²	152.9	86%	0.856	80%	0.797	S	S	*	*			trans	-175.8	71.2	149.6	-87.8	-27	0	0	0	108.2	Q210 N214	Q210-D212 PolarHBondContact O-N 3.39Å; D212-N214 PolarHBondContact O-N 3.5Å
213	I	26.7	Very low	25.6	Very low	161 Å²	161	151.3 Å²	151.3	83%	0.826	80%	0.799	S	S	*	*			trans	-89.4	92.5	167.8	-46.9	177.2	0	0	0	106.7	V215	I213-V215 PolarHBondContact O-N 3.49Å
214	N	26.2	Very low	25.7	Very low	154 Å²	154	147.6 Å²	147.6	82%	0.824	79%	0.791	S	S	*	*			trans	-55.3	107.4	164.6	-157.6	-13	0	0	0	107.6	D212 G216	D212-N214 PolarHBondContact O-N 3.5Å; N214-G216 PolarHBondContact O-N 2.89Å
215	V	28.6	Very low	25.7	Very low	129 Å²	129	147.5 Å²	147.5	78%	0.782	79%	0.791	S	S	*	*			trans	-70.6	86.2	179.1	178.8	0	0	0	0	107.5	I213 Q217	I213-V215 PolarHBondContact O-N 3.49Å; V215-Q217 PolarHBondContact O-N 2.74Å
216	G	24.4	Very low	25.6	Very low	62 Å²	62	146.3 Å²	146.3	64%	0.639	79%	0.788	S	S	*	*			trans	-58.3	118.4	170.1	0	0	0	0	0	109.3	N214 K218	N214-G216 PolarHBondContact O-N 2.89Å; G216-K218 PolarHBondContact O-N 3.37Å
217	Q	24.9	Very low	25.7	Very low	191 Å²	191	143 Å²	143	89%	0.893	79%	0.786	S	S	*	*			trans	-51.8	98.4	175.7	-68.9	175.3	-28	0	0	110.3	V215 K219	V215-Q217 PolarHBondContact O-N 2.74Å; Q217-K219 PolarHBondContact O-N 2.79Å
218	K	26.2	Very low	25.7	Very low	198 Å²	198	140.6 Å²	140.6	86%	0.861	78%	0.78	S	S	*	*			trans	-73.6	107.1	167.4	-150	177	-175.6	-175.9	0	106.1	G216 E220	G216-K218 PolarHBondContact O-N 3.37Å; K218-E220 VanDerWaalsContact C-N 3.34Å; K218-E220 PolarHBondContact O-N 3Å
219	K	26.6	Very low	25.9	Very low	192 Å²	192	139 Å²	139	84%	0.835	78%	0.783	S	S	*	*			trans	-57.6	97.5	168.4	-81.9	-179.8	173.4	178.9	0	108	Q217 N221	Q217-K219 PolarHBondContact O-N 2.79Å; K219-N221 PolarHBondContact O-N 3.11Å
220	E	26.8	Very low	26.2	Very low	165 Å²	165	141 Å²	141	77%	0.771	79%	0.785	S	S	*	*			trans	-70.3	108.6	162.6	-77.6	-179	162.1	0	0	107.2	K218 I222	K218-E220 VanDerWaalsContact C-N 3.34Å; K218-E220 PolarHBondContact O-N 3Å; E220-I222 PolarHBondContact O-N 2.88Å
221	N	24.9	Very low	26.3	Very low	156 Å²	156	137.8 Å²	137.8	83%	0.834	78%	0.779	S	S	*	*			trans	-66.9	93.8	162.2	-79.8	-10.4	0	0	0	106.7	K219 S223	K219-N221 PolarHBondContact O-N 3.11Å; N221-S223 PolarHBondContact O-N 2.85Å
222	I	28.9	Very low	26.3	Very low	145 Å²	145	142 Å²	142	74%	0.744	79%	0.785	S	S	*	*			trans	-67.5	100.9	170.7	-53.2	164.1	0	0	0	105.7	E220 S224	E220-I222 PolarHBondContact O-N 2.88Å; I222-S224 PolarHBondContact O-N 3.44Å
223	S	23.1	Very low	26.2	Very low	114 Å²	114	140.7 Å²	140.7	80%	0.797	78%	0.782	S	S	*	*			trans	-64.9	92	164.6	-177.1	0	0	0	0	107	N221 S225	N221-S223 PolarHBondContact O-N 2.85Å; S223-S225 VanDerWaalsContact C-N 3.34Å; S223-S225 PolarHBondContact O-N 2.93Å
224	S	28.1	Very low	26.2	Very low	82 Å²	82	140.5 Å²	140.5	57%	0.573	78%	0.778	S	S	*	*			trans	-64.1	93.7	173.1	176.9	0	0	0	0	108.6	I222 Q226	I222-S224 PolarHBondContact O-N 3.44Å; S224-Q226 PolarHBondContact O-N 3.29Å
225	S	24.8	Very low	26.1	Very low	109 Å²	109	141.5 Å²	141.5	76%	0.762	78%	0.778	S	S	*	*			trans	-72.9	77	159.1	56.7	0	0	0	0	107.6	S223 P227	S223-S225 VanDerWaalsContact C-N 3.34Å; S223-S225 PolarHBondContact O-N 2.93Å; S225-P227 WeakPolarHBondContact O-CD 3.5Å
226	Q	25.3	Very low	25.9	Very low	165 Å²	165	141.9 Å²	141.9	77%	0.771	78%	0.775	S	S	*	*	P	Polyproline II helix	trans	-68.8	123.9	164	-101.4	179.7	-58.3	0	0	107.9	S224 A228	S224-Q226 PolarHBondContact O-N 3.29Å; Q226-A228 PolarHBondContact O-N 3.5Å
227	P	26.1	Very low	25.7	Very low	117 Å²	117	145.5 Å²	145.5	76%	0.76	78%	0.779	S	S	*	*	P	Polyproline II helix	trans	-59.1	136.8	165.7	-15.2	28.6	0	0	0	108.7	S225	S225-P227 WeakPolarHBondContact O-CD 3.5Å
228	A	25.4	Very low	25.8	Very low	84 Å²	84	143.3 Å²	143.3	69%	0.694	77%	0.773	S	S	*	*	P	Polyproline II helix	trans	-51.2	136.2	-179.1	0	0	0	0	0	111.1	Q226 N230	Q226-A228 PolarHBondContact O-N 3.5Å; A228-N230 PolarHBondContact O-N 3.43Å
229	P	27	Very low	25.8	Very low	126 Å²	126	143 Å²	143	82%	0.818	77%	0.772	S	S	*	*	P	Polyproline II helix	trans	-66.1	119.1	-178.6	-9.1	22.8	0	0	0	109.3	T231	P229-T231 PolarHBondContact O-N 3.26Å
230	N	31.1	Very low	25.7	Very low	156 Å²	156	141.3 Å²	141.3	83%	0.834	77%	0.772	S	S	*	*	P	Polyproline II helix	trans	-55.3	123.2	170.7	-72.8	-24.1	0	0	0	109.3	A228 K232	A228-N230 PolarHBondContact O-N 3.43Å; N230-K232 PolarHBondContact O-N 2.9Å
231	T	27.1	Very low	25.7	Very low	126 Å²	126	143 Å²	143	77%	0.773	78%	0.776	S	S	*	*			trans	-14.3	115.6	169.2	38.1	0	0	0	0	115.7	P229 T233	P229-T231 PolarHBondContact O-N 3.26Å; T231-T233 PolarHBondContact O-N 2.95Å; T231-T233 VanDerWaalsContact O-N 3.14Å
232	K	24.1	Very low	25.7	Very low	191 Å²	191	139.1 Å²	139.1	83%	0.83	77%	0.774	S	S	*	*			trans	-49.9	114.1	159.2	-79.5	178.2	173.4	-179	0	109	N230 E234	N230-K232 PolarHBondContact O-N 2.9Å; K232-E234 PolarHBondContact O-N 3.46Å
233	T	24.9	Very low	25.6	Very low	132 Å²	132	142.2 Å²	142.2	81%	0.81	78%	0.782	S	S	*	*			trans	-83.2	97.3	159.1	-53.5	0	0	0	0	105.5	T231 E235	T231-T233 PolarHBondContact O-N 2.95Å; T231-T233 VanDerWaalsContact O-N 3.14Å; T233-E235 PolarHBondContact O-N 2.89Å; T233-E235 VanDerWaalsContact O-N 3.16Å
234	E	25.2	Very low	25.6	Very low	156 Å²	156	144.5 Å²	144.5	73%	0.729	78%	0.783	S	S	*	*			trans	-68.5	106.4	166.1	-82.7	-178.2	165.1	0	0	107.6	K232 L236	K232-E234 PolarHBondContact O-N 3.46Å; E234-L236 PolarHBondContact O-N 3.29Å
235	E	23.9	Very low	25.4	Very low	175 Å²	175	149 Å²	149	82%	0.818	80%	0.795	S	S	*	*			trans	-69.8	80.7	170.7	-163.1	176.1	-164.2	0	0	108.2	T233 L237	T233-E235 PolarHBondContact O-N 2.89Å; T233-E235 VanDerWaalsContact O-N 3.16Å; E235-L237 PolarHBondContact O-N 3.18Å
236	L	25	Very low	25.5	Very low	138 Å²	138	150.6 Å²	150.6	72%	0.723	79%	0.793	S	S	*	*			trans	-70.8	99.3	169.5	-106.3	159.1	0	0	0	108.1	E234 N238	E234-L236 PolarHBondContact O-N 3.29Å; L236-N238 PolarHBondContact O-N 3.39Å
237	L	21.5	Very low	25.4	Very low	138 Å²	138	148.8 Å²	148.8	72%	0.723	79%	0.794	S	S	*	*			trans	-61.8	73.2	179.8	-156.9	104.1	0	0	0	111.8	E235 K239	E235-L237 PolarHBondContact O-N 3.18Å; L237-K239 PolarHBondContact O-N 3.39Å
238	N	25.8	Very low	25.5	Very low	145 Å²	145	152.6 Å²	152.6	78%	0.775	80%	0.799	S	S	*	*			trans	-90.3	102.7	171.9	-82.3	-17.8	0	0	0	110.2	L236 D240	L236-N238 PolarHBondContact O-N 3.39Å; N238-D240 PolarHBondContact O-N 2.88Å
239	K	25.7	Very low	25.6	Very low	192 Å²	192	153.7 Å²	153.7	84%	0.835	80%	0.801	S	S	*	*			trans	-56	99.6	161.4	-69.5	174	177.2	174	0	109	L237	L237-K239 PolarHBondContact O-N 3.39Å
240	D	26.1	Very low	25.4	Very low	155 Å²	155	156.7 Å²	156.7	83%	0.829	80%	0.804	S	S	*	*			trans	-163.3	150.3	137.9	-119.4	-30.7	0	0	0	113.1	N238	N238-D240 PolarHBondContact O-N 2.88Å
241	K	25.6	Very low	25.2	Very low	201 Å²	201	156 Å²	156	87%	0.874	80%	0.8	S	S	*	*			trans	-65	133.9	-166.1	-63.7	169	176.7	176.6	0	113.3
242	G	25.1	Very low	25.2	Very low	75 Å²	75	157.2 Å²	157.2	77%	0.773	80%	0.802	S	S	*	*	S	Bend	trans	111	118	145.3	0	0	0	0	0	117.1
243	K	25.9	Very low	25.3	Very low	210 Å²	210	157.7 Å²	157.7	91%	0.913	80%	0.804	S	S	*	*			trans	64.1	90.8	162.8	-87.9	-176.8	172.1	-175.6	0	117.3	Q245	K243-Q245 PolarHBondContact O-N 3.23Å
244	I	24.8	Very low	25.4	Very low	161 Å²	161	157.9 Å²	157.9	83%	0.826	81%	0.805	S	S	*	*			trans	-77.5	105.1	157.6	-59.9	170.9	0	0	0	107.7	I246	I244-I246 HydrophobicContact CG2-CG1 3.91Å
245	Q	24.1	Very low	25.4	Very low	178 Å²	178	155.8 Å²	155.8	83%	0.832	81%	0.808	S	S	*	*			trans	-92.3	108	168.5	-161.5	169.3	32.8	0	0	107.7	K243 T247	K243-Q245 PolarHBondContact O-N 3.23Å; Q245-T247 PolarHBondContact O-N 2.7Å
246	I	26.6	Very low	25.5	Very low	141 Å²	141	156 Å²	156	72%	0.723	81%	0.808	S	S	*	*			trans	-81.8	96.1	-178.9	-54.5	171.6	0	0	0	108	I244 K248	I244-I246 HydrophobicContact CG2-CG1 3.91Å; I246-K248 PolarHBondContact O-N 3.48Å
247	T	23.4	Very low	25.5	Very low	128 Å²	128	154.8 Å²	154.8	79%	0.785	81%	0.812	S	S	*	*			trans	-75.3	109.4	165.5	35.1	0	0	0	0	109	Q245 S249	Q245-T247 PolarHBondContact O-N 2.7Å; T247-S249 PolarHBondContact O-N 3.04Å
248	K	27	Very low	25.7	Very low	197 Å²	197	156.8 Å²	156.8	86%	0.857	82%	0.817	S	S	*	*			trans	-70	114.7	170.2	-70.7	179.1	177.2	179	0	108.9	I246	I246-K248 PolarHBondContact O-N 3.48Å
249	S	28.1	Very low	25.7	Very low	106 Å²	106	157.4 Å²	157.4	74%	0.741	82%	0.821	S	S	*	*			trans	-70.3	132.5	164	37.5	0	0	0	0	109.8	T247	T247-S249 PolarHBondContact O-N 3.04Å
250	Q	23.5	Very low	25.7	Very low	189 Å²	189	157.7 Å²	157.7	88%	0.883	82%	0.822	S	S	*	*			trans	-86.5	113.2	173.3	-130.1	175.7	-39.2	0	0	106.2
251	D	26.7	Very low	25.8	Very low	142 Å²	142	155.3 Å²	155.3	76%	0.759	82%	0.817	S	S	*	*			trans	-135.3	114.5	168	-87.5	-43	0	0	0	110.8
252	D	26	Very low	25.9	Very low	152 Å²	152	153 Å²	153	81%	0.813	82%	0.815	S	S	*	*			trans	47.3	121.2	149	-68.3	-26.1	0	0	0	123.4	V254	D252-V254 PolarHBondContact O-N 2.96Å
253	K	25.9	Very low	25.9	Very low	201 Å²	201	156.2 Å²	156.2	87%	0.874	81%	0.814	S	S	*	*			trans	-54.5	99	173.2	-64.8	-178.7	175.2	-174.1	0	111.9	S255	K253-S255 PolarHBondContact O-N 3.28Å
254	V	27.1	Very low	25.8	Very low	136 Å²	136	152.8 Å²	152.8	82%	0.824	81%	0.805	S	S	*	*			trans	-77.3	110.9	153.7	-179.8	0	0	0	0	107.1	D252 E256	D252-V254 PolarHBondContact O-N 2.96Å; V254-E256 PolarHBondContact O-N 3.49Å
255	S	24.6	Very low	25.9	Very low	112 Å²	112	150.9 Å²	150.9	78%	0.783	80%	0.8	S	S	*	*			trans	-69.6	91.9	-179.2	-63.1	0	0	0	0	109.6	K253 S257	K253-S255 PolarHBondContact O-N 3.28Å; S255-S257 PolarHBondContact O-N 3.45Å
256	E	27.2	Very low	26	Very low	178 Å²	178	148.4 Å²	148.4	83%	0.832	80%	0.797	S	S	*	*			trans	-68.2	110.4	167.3	-105.3	-179.6	162.9	0	0	109	V254 Q258	V254-E256 PolarHBondContact O-N 3.49Å; E256-Q258 VanDerWaalsContact C-N 3.35Å; E256-Q258 PolarHBondContact O-N 2.96Å
257	S	25.9	Very low	26	Very low	114 Å²	114	150.4 Å²	150.4	80%	0.797	80%	0.801	S	S	*	*			trans	-61.1	95.4	169	51.6	0	0	0	0	109.2	S255 N259	S255-S257 PolarHBondContact O-N 3.45Å; S257-N259 PolarHBondContact O-N 3.19Å
258	Q	25.6	Very low	26	Very low	179 Å²	179	150.3 Å²	150.3	84%	0.836	81%	0.805	S	S	*	*			trans	-64.6	103.7	171	-73.3	-173.4	-31.4	0	0	109.1	E256 K260	E256-Q258 VanDerWaalsContact C-N 3.35Å; E256-Q258 PolarHBondContact O-N 2.96Å; Q258-K260 PolarHBondContact O-N 3.44Å
259	N	25.8	Very low	26	Very low	159 Å²	159	147.5 Å²	147.5	85%	0.85	80%	0.804	S	S	*	*			trans	-53.1	107.2	159	-93.4	-36	0	0	0	107.8	S257 S261	S257-N259 PolarHBondContact O-N 3.19Å; N259-S261 VanDerWaalsContact C-N 3.29Å; N259-S261 PolarHBondContact O-N 3.37Å
260	K	25.6	Very low	26.1	Very low	197 Å²	197	147.1 Å²	147.1	86%	0.857	80%	0.802	S	S	*	*			trans	-61.4	91.9	171.1	-79.8	176.6	175.8	174.5	0	108.4	Q258 N262	Q258-K260 PolarHBondContact O-N 3.44Å; K260-N262 PolarHBondContact O-N 3.46Å
261	S	28	Very low	26.1	Very low	105 Å²	105	147.7 Å²	147.7	73%	0.734	80%	0.804	S	S	*	*			trans	-71.1	121.8	161.6	47.6	0	0	0	0	107.7	N259 N263	N259-S261 VanDerWaalsContact C-N 3.29Å; N259-S261 PolarHBondContact O-N 3.37Å; S261-N263 VanDerWaalsContact C-N 3.33Å; S261-N263 PolarHBondContact O-N 2.7Å
262	N	26.3	Very low	26	Very low	152 Å²	152	148.1 Å²	148.1	81%	0.813	81%	0.805	S	S	*	*			trans	-62.5	95.3	175.7	-70.3	-31.9	0	0	0	108.8	K260 I264	K260-N262 PolarHBondContact O-N 3.46Å; N262-I264 PolarHBondContact O-N 3.08Å
263	N	25.6	Very low	26	Very low	143 Å²	143	146.7 Å²	146.7	77%	0.765	80%	0.804	S	S	*	*			trans	-74.6	92.4	176.4	-158.2	-2.5	0	0	0	107.9	S261 V265	S261-N263 VanDerWaalsContact C-N 3.33Å; S261-N263 PolarHBondContact O-N 2.7Å; N263-V265 PolarHBondContact O-N 3.15Å; N263-V265 VanDerWaalsContact O-N 3.11Å
264	I	24.8	Very low	25.9	Very low	139 Å²	139	144.7 Å²	144.7	71%	0.713	80%	0.801	S	S	*	*			trans	-68.5	105.7	168.3	-64.7	174.1	0	0	0	106.1	N262 T266	N262-I264 PolarHBondContact O-N 3.08Å; I264-T266 VanDerWaalsContact C-N 3.35Å; I264-T266 PolarHBondContact O-N 3.06Å; I264-T266 PolarHBondContact O-OG1 2.96Å
265	V	25.2	Very low	25.8	Very low	120 Å²	120	148.2 Å²	148.2	73%	0.727	81%	0.805	S	S	*	*			trans	-64.3	91.6	174.1	177.1	0	0	0	0	108.8	N263 K267	N263-V265 PolarHBondContact O-N 3.15Å; N263-V265 VanDerWaalsContact O-N 3.11Å; V265-K267 PolarHBondContact O-N 3.25Å
266	T	27	Very low	25.7	Very low	126 Å²	126	151.6 Å²	151.6	77%	0.773	81%	0.806	S	S	*	*			trans	-81	103.5	165.3	-5.1	0	0	0	0	107.8	I264 S268	I264-T266 VanDerWaalsContact C-N 3.35Å; I264-T266 PolarHBondContact O-N 3.06Å; I264-T266 PolarHBondContact O-OG1 2.96Å; T266-S268 PolarHBondContact O-N 3.09Å
267	K	26.2	Very low	25.5	Very low	184 Å²	184	148.8 Å²	148.8	80%	0.8	80%	0.801	S	S	*	*			trans	-55.6	125.3	172.3	-81.3	178.9	174.3	177.5	0	110	V265 V269	V265-K267 PolarHBondContact O-N 3.25Å; K267-V269 PolarHBondContact O-N 3.47Å; K267-V269 VanDerWaalsContact O-N 3.16Å
268	S	24.4	Very low	25.5	Very low	125 Å²	125	152.8 Å²	152.8	87%	0.874	81%	0.807	S	S	*	*			trans	-58.6	109.8	171.8	-46.5	0	0	0	0	110	T266	T266-S268 PolarHBondContact O-N 3.09Å
269	V	27.4	Very low	25.5	Very low	138 Å²	138	153.3 Å²	153.3	84%	0.836	81%	0.807	S	S	*	*			trans	-88.4	119.1	166.9	-179.3	0	0	0	0	107.2	K267	K267-V269 PolarHBondContact O-N 3.47Å; K267-V269 VanDerWaalsContact O-N 3.16Å
270	S	30	Very low	25.6	Very low	99 Å²	99	153.5 Å²	153.5	69%	0.692	81%	0.808	S	S	*	*			trans	-44.4	140.3	178.8	44.2	0	0	0	0	115.1
271	E	22.9	Very low	25.8	Very low	200 Å²	200	153.2 Å²	153.2	94%	0.935	81%	0.807	S	S	*	*			trans	-46.1	130.8	168.9	-73	172	126.5	0	0	112.8
272	I	25.2	Very low	25.8	Very low	152 Å²	152	154.1 Å²	154.1	78%	0.779	81%	0.81	S	S	*	*			trans	-114.6	131.2	160.5	-61.2	175.4	0	0	0	107.1
273	P	25	Very low	26	Very low	121 Å²	121	156.8 Å²	156.8	79%	0.786	81%	0.814	S	S	*	*			trans	-73	137.1	-165.5	-12.9	28.5	0	0	0	113.2	K275	P273-K275 PolarHBondContact O-N 3.11Å
274	I	24.1	Very low	26.3	Very low	159 Å²	159	157.6 Å²	157.6	82%	0.815	82%	0.818	S	S	*	*			trans	-70	104.6	-179.2	-59.8	165.5	0	0	0	109.7
275	K	24.8	Very low	26.5	Very low	210 Å²	210	160.1 Å²	160.1	91%	0.913	83%	0.827	S	S	*	*			trans	-89.3	126.9	155.5	-101.1	-176.5	178.1	-179.8	0	109.4	P273	P273-K275 PolarHBondContact O-N 3.11Å
276	K	23.3	Very low	26.8	Very low	184 Å²	184	159.4 Å²	159.4	80%	0.8	83%	0.828	S	S	*	*			trans	-78.1	136.3	-168.5	-96.6	-178	-179.4	178.3	0	112.9
277	T	22.1	Very low	26.8	Very low	119 Å²	119	162 Å²	162	73%	0.73	83%	0.831	S	S	*	*			trans	64.1	113.8	146.6	3.8	0	0	0	0	118.7
278	E	27	Very low	27	Very low	198 Å²	198	159.6 Å²	159.6	93%	0.925	83%	0.832	S	S	*	*				-154.4	142.1	106.6	-146.5	162.1	-173.5	0	0	110.5
279	K	25.6	Very low	27.2	Very low	190 Å²	190	159 Å²	159	83%	0.826	83%	0.827	S	S	*	*			trans	-84.6	118.5	-165	-69.1	175.9	173.7	177	0	110.4
280	D	28.1	Very low	27.4	Very low	163 Å²	163	161.8 Å²	161.8	87%	0.872	83%	0.828	S	S	*	*			trans	-134.5	128.8	159.1	-103.1	-36.8	0	0	0	112.4
281	K	28.8	Very low	27.3	Very low	191 Å²	191	162.5 Å²	162.5	83%	0.83	83%	0.83	S	S	*	*			trans	-8.3	142.3	-178.3	-92.9	166.2	170	172.1	0	121.1	K283	K281-K283 PolarHBondContact O-N 3.34Å
282	P	28.8	Very low	27.6	Very low	124 Å²	124	162.3 Å²	162.3	81%	0.805	83%	0.83	S	S	*	*			trans	-70.7	120.4	180	31.1	-32.7	0	0	0	111.2	N284	P282-N284 PolarHBondContact O-N 3.05Å
283	K	30.2	Very low	27.9	Very low	208 Å²	208	160.7 Å²	160.7	90%	0.904	83%	0.826	S	S	*	*			trans	-76.4	113.8	167.1	-96.7	176.3	174.4	172.7	0	109.3	K281	K281-K283 PolarHBondContact O-N 3.34Å
284	N	30.5	Very low	28.2	Very low	159 Å²	159	160.3 Å²	160.3	85%	0.85	83%	0.826	S	S	*	*			trans	13.9	104.3	155.2	-68.1	-18.2	0	0	0	116.7	P282 S286	P282-N284 PolarHBondContact O-N 3.05Å; N284-S286 PolarHBondContact O-N 3.27Å
285	E	30	Very low	28.6	Very low	192 Å²	192	161.4 Å²	161.4	90%	0.897	83%	0.828	S	S	*	*			trans	-61.5	118.1	158.6	-82.5	178.5	153.6	0	0	109.4	Q287	E285-Q287 PolarHBondContact O-N 3.16Å
286	S	31.2	Very low	28.8	Very low	106 Å²	106	156 Å²	156	74%	0.741	82%	0.817	S	S	*	*			trans	-49.9	115.6	171.6	177.7	0	0	0	0	110.3	N284 V288	N284-S286 PolarHBondContact O-N 3.27Å; S286-V288 PolarHBondContact O-N 3.12Å
287	Q	27.9	Very low	29	Very low	180 Å²	180	154.4 Å²	154.4	84%	0.841	82%	0.817	S	S	*	*			trans	-62.5	101.7	170.9	-67.6	-175.3	17.9	0	0	108.7	E285 S289	E285-Q287 PolarHBondContact O-N 3.16Å; Q287-S289 PolarHBondContact O-N 3.49Å; Q287-S289 VanDerWaalsContact O-N 3.1Å
288	V	29.4	Very low	29.4	Very low	134 Å²	134	152.9 Å²	152.9	81%	0.812	81%	0.808	S	S	*	*			trans	-64.8	108.2	169.1	177.7	0	0	0	0	107.2	S286 K290	S286-V288 PolarHBondContact O-N 3.12Å; V288-K290 PolarHBondContact O-N 3.01Å
289	S	29.6	Very low	29.6	Very low	111 Å²	111	150.5 Å²	150.5	78%	0.776	80%	0.801	S	S	*	*	P	Polyproline II helix	trans	-58.6	124.4	178.9	-46.4	0	0	0	0	110.1	Q287	Q287-S289 PolarHBondContact O-N 3.49Å; Q287-S289 VanDerWaalsContact O-N 3.1Å
290	K	30.8	Very low	29.8	Very low	198 Å²	198	150.4 Å²	150.4	86%	0.861	80%	0.797	S	S	*	*	P	Polyproline II helix	trans	-65	135.8	172.5	-84.8	177.8	176	176.4	0	109.5	V288 E292	V288-K290 PolarHBondContact O-N 3.01Å; K290-E292 PolarHBondContact O-N 3.35Å
291	P	28.4	Very low	29.9	Very low	113 Å²	113	150.8 Å²	150.8	73%	0.734	80%	0.798	S	S	*	*	P	Polyproline II helix	trans	-67	121.8	175.2	26.9	-30.9	0	0	0	109.3	V293	P291-V293 VanDerWaalsContact C-N 3.34Å; P291-V293 PolarHBondContact O-N 3.42Å
292	E	28.8	Very low	30	Very low	197 Å²	197	146.9 Å²	146.9	92%	0.921	79%	0.79	S	S	*	*			trans	-72.7	89.4	174.6	-141.3	172.7	-167.7	0	0	107.9	K290 S294	K290-E292 PolarHBondContact O-N 3.35Å; E292-S294 PolarHBondContact O-N 3.12Å; E292-S294 VanDerWaalsContact O-N 3.14Å
293	V	32.1	Very low	30	Very low	117 Å²	117	145.6 Å²	145.6	71%	0.709	78%	0.782	S	S	*	*			trans	-73.6	103.9	173.9	179.1	0	0	0	0	107.1	P291 Q295	P291-V293 VanDerWaalsContact C-N 3.34Å; P291-V293 PolarHBondContact O-N 3.42Å; V293-Q295 PolarHBondContact O-N 2.9Å; V293-Q295 VanDerWaalsContact O-N 3.08Å
294	S	30.5	Very low	30.4	Very low	113 Å²	113	141.1 Å²	141.1	79%	0.79	78%	0.777	S	S	*	*			trans	-58.3	109.7	170.7	36.2	0	0	0	0	109.3	E292 S296	E292-S294 PolarHBondContact O-N 3.12Å; E292-S294 VanDerWaalsContact O-N 3.14Å; S294-S296 PolarHBondContact O-N 3.27Å
295	Q	31.9	Very low	30.6	Very low	183 Å²	183	140.7 Å²	140.7	86%	0.855	78%	0.775	S	S	*	*			trans	-66.6	103.7	175.3	-75.5	179.2	-27	0	0	108.8	V293 N297	V293-Q295 PolarHBondContact O-N 2.9Å; V293-Q295 VanDerWaalsContact O-N 3.08Å; Q295-N297 PolarHBondContact O-N 2.97Å; Q295-N297 VanDerWaalsContact O-N 3.09Å
296	S	29.5	Very low	30.6	Very low	97 Å²	97	136.7 Å²	136.7	68%	0.678	76%	0.758	S	S	*	*			trans	-63	110.3	166.1	54.3	0	0	0	0	108.2	S294 T298	S294-S296 PolarHBondContact O-N 3.27Å; S296-T298 PolarHBondContact O-N 2.92Å
297	N	29.1	Very low	30.5	Very low	150 Å²	150	137.1 Å²	137.1	80%	0.802	76%	0.758	S	S	*	*			trans	-75.5	68.2	-177.1	-139.9	-0.4	0	0	0	109.7	Q295 N299	Q295-N297 PolarHBondContact O-N 2.97Å; Q295-N297 VanDerWaalsContact O-N 3.09Å; N297-N299 PolarHBondContact O-N 2.69Å
298	T	29.7	Very low	30.6	Very low	86 Å²	86	135.8 Å²	135.8	53%	0.528	75%	0.752	S	S	.	*			trans	-81.8	97.6	171.7	43.2	0	0	0	0	108.4	S296 Y300	S296-T298 PolarHBondContact O-N 2.92Å; T298-Y300 HydrophobicContact CG2-CE2 4.26Å; T298-Y300 PolarHBondContact O-N 3.36Å; T298-Y300 WeakPolarHBondContact OG1-CE2 3.38Å
299	N	30.7	Very low	30.9	Very low	149 Å²	149	135 Å²	135	80%	0.797	75%	0.749	S	S	*	*			trans	-63.4	81.3	167	-85.7	-36.7	0	0	0	109.5	N297 L301	N297-N299 PolarHBondContact O-N 2.69Å; N299-L301 PolarHBondContact O-N 2.84Å
300	Y	29.9	Very low	31	Very low	187 Å²	187	133.7 Å²	133.7	73%	0.733	73%	0.734	S	S	*	*			trans	-73.8	114.9	162.2	-72.2	-79.4	0	0	0	107.5	T298 V302	T298-Y300 HydrophobicContact CG2-CE2 4.26Å; T298-Y300 PolarHBondContact O-N 3.36Å; T298-Y300 WeakPolarHBondContact OG1-CE2 3.38Å; Y300-V302 VanDerWaalsContact C-N 3.3Å; Y300-V302 PolarHBondContact O-N 2.84Å
301	L	30	Very low	31.7	Very low	172 Å²	172	129.1 Å²	129.1	90%	0.901	72%	0.723	S	S	*	*			trans	-59.8	99.2	160.3	-110.6	85.2	0	0	0	106.5	N299 P303	N299-L301 PolarHBondContact O-N 2.84Å; L301-P303 WeakPolarHBondContact O-CD 3.46Å
302	V	31.3	Very low	32.1	Very low	109 Å²	109	130.9 Å²	130.9	66%	0.661	72%	0.716	S	S	*	*			trans	-73.6	113.6	171.5	179	0	0	0	0	106.8	Y300 S304 I306	Y300-V302 VanDerWaalsContact C-N 3.3Å; Y300-V302 PolarHBondContact O-N 2.84Å; V302-S304 PolarHBondContact O-N 3Å; V302-I306 HydrophobicContact CG1-CD1 4.19Å
303	P	28.6	Very low	32.6	Very low	96 Å²	96	125.8 Å²	125.8	62%	0.623	69%	0.694	S	S	*	*			trans	-65.5	125.1	175.8	-15.7	31.4	0	0	0	108.5	L301 N305	L301-P303 WeakPolarHBondContact O-CD 3.46Å; P303-N305 PolarHBondContact O-N 3.14Å
304	S	39.5	Very low	33.1	Very low	114 Å²	114	128 Å²	128	80%	0.797	70%	0.695	S	S	*	*	T	Hydrogen-bonded Turn	trans	-65.1	7.9	-172.9	36.8	0	0	0	0	115.9	V302	V302-S304 PolarHBondContact O-N 3Å
305	N	33.4	Very low	33.4	Very low	151 Å²	151	128.5 Å²	128.5	81%	0.807	69%	0.688	S	S	*	*	T	Hydrogen-bonded Turn	trans	-116.1	24.9	-176.2	-69.7	-31.3	0	0	0	113.7	P303 P307	P303-N305 PolarHBondContact O-N 3.14Å; N305-P307 WeakPolarHBondContact O-CD 3.41Å
306	I	30.2	Very low	33.6	Very low	107 Å²	107	121.1 Å²	121.1	55%	0.549	66%	0.661	S	S	.	*	S	Bend	trans	-71.1	122.5	162.4	-59	171.4	0	0	0	106.4	V302 Q308	V302-I306 HydrophobicContact CG1-CD1 4.19Å; I306-Q308 PolarHBondContact O-N 3.03Å
307	P	28.5	Very low	34.2	Very low	116 Å²	116	128.4 Å²	128.4	75%	0.753	67%	0.673	S	S	*	*			trans	-56.9	109.9	173	-17.3	28.9	0	0	0	107.6	N305	N305-P307 WeakPolarHBondContact O-CD 3.41Å
308	Q	31.2	Very low	35	Very low	152 Å²	152	128.2 Å²	128.2	71%	0.71	67%	0.673	S	S	*	*			trans	-59.1	129.2	172.6	-73.5	-161.2	-18.3	0	0	107.1	I306 D310	I306-Q308 PolarHBondContact O-N 3.03Å; Q308-D310 PolarHBondContact O-N 3.26Å
309	P	35	Very low	35.3	Very low	116 Å²	116	126.6 Å²	126.6	75%	0.753	67%	0.673	S	S	*	*			trans	-60.2	117.3	179.9	24.1	-31.9	0	0	0	108	T311	P309-T311 VanDerWaalsContact C-N 3.35Å; P309-T311 PolarHBondContact O-N 3.08Å
310	D	32.9	Very low	35.7	Very low	85 Å²	85	122.8 Å²	122.8	46%	0.455	66%	0.655	S	S	.	*			trans	-18.3	87.4	-176	-77.7	-15.7	0	0	0	112.5	Q308 Y312 R323	Q308-D310 PolarHBondContact O-N 3.26Å; D310-Y312 PolarHBondContact O-N 3.4Å; D310-R323 IonicContact OD2-CZ 3.65Å; D310-R323 IonicContact OD2-NH1 3.81Å; D310-R323 PolarHBondContact OD2-NH1 2.98Å; D310-R323 IonicContact OD2-NH2 2.69Å; D310-R323 PolarHBondContact OD2-NH2 3.41Å
311	T	45.8	Very low	35.8	Very low	102 Å²	102	118.1 Å²	118.1	63%	0.626	64%	0.642	S	S	*	*	T	Hydrogen-bonded Turn	trans	-69.3	12.4	-179.3	-4.4	0	0	0	0	112.4	P309	P309-T311 VanDerWaalsContact C-N 3.35Å; P309-T311 PolarHBondContact O-N 3.08Å
312	Y	35.3	Very low	36.1	Very low	149 Å²	149	113.1 Å²	113.1	58%	0.584	62%	0.618	S	S	*	*	T	Hydrogen-bonded Turn	trans	-110.2	11.2	-169.4	-64.9	-66	0	0	0	113.1	D310 R323 S324	D310-Y312 PolarHBondContact O-N 3.4Å; Y312-R323 WeakPolarHBondContact O-CA 3.45Å; Y312-S324 WeakPolarHBondContact CB-OG 3.48Å; Y312-S324 WeakPolarHBondContact CD1-OG 3.28Å; Y312-S324 PolarHBondContact O-N 2.92Å
313	L	39.7	Very low	36.4	Very low	90 Å²	90	114.2 Å²	114.2	47%	0.471	61%	0.61	S	S	.	*	E	Extended strand (participates in β ladder)	trans	-93	104.8	172.4	-60.5	176.7	0	0	0	109.5	I321 R323	L313-I321 HydrophobicContact CB-CG2 3.79Å; L313-I321 HydrophobicContact CD1-CG2 4.47Å; L313-I321 HydrophobicContact CD2-CG2 3.65Å; L313-I321 HydrophobicContact CG-CG2 4.15Å; L313-R323 HydrophobicContact CD2-CG 3.79Å
314	K	42.2	Very low	37.1	Very low	164 Å²	164	113.4 Å²	113.4	71%	0.713	61%	0.607	S	S	*	*	E	Extended strand (participates in β ladder)	trans	-101.2	132.9	168.6	-77.2	-176.7	178.5	177.9	0	109.6	G316 T322	K314-G316 PolarHBondContact O-N 3.17Å; K314-T322 PolarHBondContact N-O 3.28Å; K314-T322 PolarHBondContact O-N 2.94Å
315	L	36.5	Very low	36.9	Very low	123 Å²	123	116 Å²	116	64%	0.644	61%	0.607	S	S	*	*	E	Extended strand (participates in β ladder)	trans	-74.6	108.6	170.1	-165.1	74.3	0	0	0	108.2	I321	L315-I321 HydrophobicContact CD1-CG1 3.98Å
316	G	37.3	Very low	36.7	Very low	28 Å²	28	113 Å²	113	29%	0.289	61%	0.612	S	S	.	*			trans	-68.3	161.2	176.5	0	0	0	0	0	112.2	K314 N318 G319 V320	K314-G316 PolarHBondContact O-N 3.17Å; G316-N318 PolarHBondContact O-N 3.3Å; G316-G319 PolarHBondContact O-N 3.13Å; G316-V320 WeakPolarHBondContact CA-O 3.34Å; G316-V320 PolarHBondContact N-O 2.98Å
317	R	42.3	Very low	36.5	Very low	250 Å²	250	110.5 Å²	110.5	94%	0.943	61%	0.612	S	S	*	*	T	Hydrogen-bonded Turn	trans	-54.3	-18.5	-178.9	-80.4	-174.8	178	176	0.1	114.8
318	N	44.6	Very low	36.7	Very low	147 Å²	147	113.2 Å²	113.2	79%	0.786	62%	0.615	S	S	*	*	T	Hydrogen-bonded Turn	trans	-105.1	16.4	-178.3	-54.8	14.2	0	0	0	112	G316 V320	G316-N318 PolarHBondContact O-N 3.3Å; N318-V320 HydrophobicContact CB-CG2 4.48Å; N318-V320 PolarHBondContact O-N 2.9Å
319	G	37.5	Very low	36.8	Very low	52 Å²	52	111.5 Å²	111.5	54%	0.536	61%	0.609	S	S	.	*	S	Bend	trans	75.7	4.6	-176.5	0	0	0	0	0	114.6	G316	G316-G319 PolarHBondContact O-N 3.13Å
320	V	37.7	Very low	36.6	Very low	68 Å²	68	115.3 Å²	115.3	41%	0.412	61%	0.614	S	S	.	*			trans	-87.3	124.8	-179.6	-177.1	0	0	0	0	110	G316 N318 T322	G316-V320 WeakPolarHBondContact CA-O 3.34Å; G316-V320 PolarHBondContact N-O 2.98Å; N318-V320 HydrophobicContact CB-CG2 4.48Å; N318-V320 PolarHBondContact O-N 2.9Å; V320-T322 HydrophobicContact CG1-CG2 4.42Å; V320-T322 PolarHBondContact O-N 3.32Å
321	I	33.5	Very low	36.5	Very low	90 Å²	90	115.6 Å²	115.6	46%	0.462	62%	0.621	S	S	.	*	E	Extended strand (participates in β ladder)	trans	-77.9	116.8	175.3	-55.6	173.2	0	0	0	108.6	L313 L315	L313-I321 HydrophobicContact CB-CG2 3.79Å; L313-I321 HydrophobicContact CD1-CG2 4.47Å; L313-I321 HydrophobicContact CD2-CG2 3.65Å; L313-I321 HydrophobicContact CG-CG2 4.15Å; L315-I321 HydrophobicContact CD1-CG1 3.98Å
322	T	35	Very low	35.9	Very low	66 Å²	66	120.8 Å²	120.8	41%	0.405	63%	0.63	S	S	.	*	E	Extended strand (participates in β ladder)	trans	-109.6	137	176.5	49.3	0	0	0	0	110.9	K314 V320	K314-T322 PolarHBondContact N-O 3.28Å; K314-T322 PolarHBondContact O-N 2.94Å; V320-T322 HydrophobicContact CG1-CG2 4.42Å; V320-T322 PolarHBondContact O-N 3.32Å
323	R	38.1	Very low	35.4	Very low	132 Å²	132	121.5 Å²	121.5	50%	0.498	64%	0.639	S	S	.	*	E	Extended strand (participates in β ladder)	trans	-79.1	141.3	165.3	-74.1	-176.7	177.1	-124.6	-12.9	108.9	D310 Y312 L313 E325	D310-R323 IonicContact OD2-CZ 3.65Å; D310-R323 IonicContact OD2-NH1 3.81Å; D310-R323 PolarHBondContact OD2-NH1 2.98Å; D310-R323 IonicContact OD2-NH2 2.69Å; D310-R323 PolarHBondContact OD2-NH2 3.41Å; Y312-R323 WeakPolarHBondContact O-CA 3.45Å; L313-R323 HydrophobicContact CD2-CG 3.79Å; R323-E325 PolarHBondContact O-N 3.38Å
324	S	43	Very low	34.9	Very low	79 Å²	79	121 Å²	121	55%	0.552	64%	0.641	S	S	*	*	S	Bend	trans	-69.3	-14.1	-176	46.2	0	0	0	0	115	Y312	Y312-S324 WeakPolarHBondContact CB-OG 3.48Å; Y312-S324 WeakPolarHBondContact CD1-OG 3.28Å; Y312-S324 PolarHBondContact O-N 2.92Å
325	E	34.7	Very low	34.3	Very low	169 Å²	169	123.2 Å²	123.2	79%	0.79	65%	0.651	S	S	*	*	S	Bend	trans	-128.1	112.8	176.5	-68.9	-176.6	173.1	0	0	110.4	R323	R323-E325 PolarHBondContact O-N 3.38Å
326	G	29.2	Very low	33.9	Very low	89 Å²	89	124.1 Å²	124.1	92%	0.918	66%	0.655	S	S	*	*	S	Bend	trans	53.8	74	152.5	0	0	0	0	0	117.6
327	G	27.2	Very low	33.6	Very low	53 Å²	53	129.2 Å²	129.2	55%	0.546	68%	0.681	S	S	.	*			trans	158.8	102.5	162.7	0	0	0	0	0	112.8	L329	G327-L329 PolarHBondContact O-N 3.48Å; G327-L329 VanDerWaalsContact O-N 3.12Å
328	Q	32.4	Very low	33	Very low	174 Å²	174	122.3 Å²	122.3	81%	0.813	67%	0.67	S	S	*	*			trans	-67.1	108.7	171.6	-161.9	174.2	27.9	0	0	107.8	K330	Q328-K330 PolarHBondContact O-N 3.49Å; Q328-K330 VanDerWaalsContact O-N 3.11Å
329	L	32.5	Very low	32.3	Very low	115 Å²	115	123.4 Å²	123.4	60%	0.602	67%	0.671	S	S	*	*	P	Polyproline II helix	trans	-59.5	119.7	168.7	-74.5	171.6	0	0	0	106.8	G327 P331	G327-L329 PolarHBondContact O-N 3.48Å; G327-L329 VanDerWaalsContact O-N 3.12Å; L329-P331 VanDerWaalsContact O-N 3.17Å
330	K	31.4	Very low	32	Very low	197 Å²	197	129.2 Å²	129.2	86%	0.857	68%	0.684	S	S	*	*	P	Polyproline II helix	trans	-53.8	125.5	178.5	-77.3	-173.7	177.5	-179.4	0	107.4	Q328 Y332	Q328-K330 PolarHBondContact O-N 3.49Å; Q328-K330 VanDerWaalsContact O-N 3.11Å; K330-Y332 PolarHBondContact O-N 2.89Å
331	P	31.7	Very low	31.6	Very low	91 Å²	91	134.4 Å²	134.4	59%	0.591	70%	0.703	S	S	*	*	P	Polyproline II helix	trans	-53.2	132.7	175.9	-4	6	0	0	0	108	L329 Q333	L329-P331 VanDerWaalsContact O-N 3.17Å; P331-Q333 VanDerWaalsContact C-N 3.33Å; P331-Q333 PolarHBondContact O-N 2.9Å
332	Y	31.8	Very low	31.4	Very low	211 Å²	211	137.1 Å²	137.1	83%	0.827	72%	0.718	S	S	*	*			trans	-58.8	102.3	171	178.9	-99.9	0	0	0	107.4	K330 P334	K330-Y332 PolarHBondContact O-N 2.89Å; Y332-P334 HydrophobicContact CE1-CG 4.46Å; Y332-P334 WeakPolarHBondContact O-CD 3.45Å
333	Q	26.2	Very low	31.2	Very low	164 Å²	164	139 Å²	139	77%	0.766	73%	0.732	S	S	*	*			trans	-88.4	115.9	170.6	-72.4	-163.6	-34	0	0	106.5	P331 K335	P331-Q333 VanDerWaalsContact C-N 3.33Å; P331-Q333 PolarHBondContact O-N 2.9Å; Q333-K335 PolarHBondContact O-N 3.31Å
334	P	28.9	Very low	31	Very low	80 Å²	80	137.7 Å²	137.7	52%	0.519	74%	0.74	S	S	.	*			trans	-52.3	137.1	167.6	-19.8	30.8	0	0	0	108.2	Y332 I336	Y332-P334 HydrophobicContact CE1-CG 4.46Å; Y332-P334 WeakPolarHBondContact O-CD 3.45Å; P334-I336 VanDerWaalsContact C-N 3.27Å; P334-I336 WeakPolarHBondContact O-CG1 3.43Å; P334-I336 PolarHBondContact O-N 3.45Å
335	K	29.3	Very low	30.2	Very low	210 Å²	210	140.4 Å²	140.4	91%	0.913	75%	0.749	S	S	*	*			trans	-63.6	91.4	172	-83	178.1	177.5	176.8	0	108.3	Q333 T337	Q333-K335 PolarHBondContact O-N 3.31Å; K335-T337 PolarHBondContact O-N 3Å
336	I	27.9	Very low	30	Very low	142 Å²	142	141 Å²	141	73%	0.728	75%	0.749	S	S	*	*			trans	-86	100.2	169.4	-44.7	174.3	0	0	0	105.4	P334 S338	P334-I336 VanDerWaalsContact C-N 3.27Å; P334-I336 WeakPolarHBondContact O-CG1 3.43Å; P334-I336 PolarHBondContact O-N 3.45Å; I336-S338 PolarHBondContact O-N 3.28Å; I336-S338 VanDerWaalsContact O-N 3.15Å
337	T	31.3	Very low	29.9	Very low	135 Å²	135	141.1 Å²	141.1	83%	0.828	74%	0.736	S	S	*	*			trans	-65.7	110.2	163.2	40.9	0	0	0	0	107	K335 E339	K335-T337 PolarHBondContact O-N 3Å; T337-E339 PolarHBondContact O-N 2.84Å
338	S	29.7	Very low	29.9	Very low	104 Å²	104	145.1 Å²	145.1	73%	0.727	74%	0.744	S	S	*	*			trans	-60.1	121.5	177.3	51.4	0	0	0	0	111.1	I336	I336-S338 PolarHBondContact O-N 3.28Å; I336-S338 VanDerWaalsContact O-N 3.15Å
339	E	30.4	Very low	29.7	Very low	171 Å²	171	141.9 Å²	141.9	80%	0.799	74%	0.736	S	S	*	*			trans	-177	150.6	130.9	-97.7	175.1	-154.3	0	0	107.9	T337	T337-E339 PolarHBondContact O-N 2.84Å
340	H	30.7	Very low	29.5	Very low	174 Å²	174	139.7 Å²	139.7	81%	0.806	73%	0.731	S	S	*	*			trans	89	76	-177.4	-56.1	-72.6	0	0	0	117.9	N342	H340-N342 PolarHBondContact O-N 3.11Å
341	H	28.8	Very low	29.9	Very low	177 Å²	177	138.2 Å²	138.2	82%	0.819	73%	0.732	S	S	*	*			trans	-75.3	95.2	148	-86.1	-68.5	0	0	0	109.5
342	N	29.7	Very low	30.2	Very low	146 Å²	146	142.7 Å²	142.7	78%	0.781	74%	0.742	S	S	*	*			trans	-151.5	133.7	151.4	-87.1	-34.1	0	0	0	109.5	H340	H340-N342 PolarHBondContact O-N 3.11Å
343	P	30.8	Very low	30.2	Very low	106 Å²	106	136 Å²	136	69%	0.688	74%	0.737	S	S	*	*			trans	-67.2	157.5	175.3	29.2	-33	0	0	0	111	D345	P343-D345 PolarHBondContact O-N 3.35Å
344	P	32.8	Very low	30.3	Very low	104 Å²	104	132.9 Å²	132.9	68%	0.675	73%	0.729	S	S	*	*			trans	-66.6	119.3	-168.4	25.8	-33.1	0	0	0	111.8	F346	P344-F346 HydrophobicContact CG-CE2 4.45Å; P344-F346 PolarHBondContact O-N 3.02Å
345	D	27.4	Very low	30.3	Very low	137 Å²	137	134.7 Å²	134.7	73%	0.733	74%	0.735	S	S	*	*			trans	-69.5	110	170.8	-86	-25.8	0	0	0	109.6	P343 S347	P343-D345 PolarHBondContact O-N 3.35Å; D345-S347 PolarHBondContact O-N 2.92Å; D345-S347 VanDerWaalsContact O-N 3.16Å
346	F	29.6	Very low	30.1	Very low	181 Å²	181	134.3 Å²	134.3	79%	0.794	73%	0.727	S	S	*	*			trans	-76.9	94.8	168.2	-70.5	-84.4	0	0	0	108.8	P344 L348	P344-F346 HydrophobicContact CG-CE2 4.45Å; P344-F346 PolarHBondContact O-N 3.02Å; F346-L348 PolarHBondContact O-N 3.34Å
347	S	27.4	Very low	30.3	Very low	91 Å²	91	132.4 Å²	132.4	64%	0.636	73%	0.727	S	S	*	*			trans	-85.4	107	166.8	52.8	0	0	0	0	109.3	D345 T349	D345-S347 PolarHBondContact O-N 2.92Å; D345-S347 VanDerWaalsContact O-N 3.16Å; S347-T349 PolarHBondContact O-N 3.44Å
348	L	27.7	Very low	30.1	Very low	137 Å²	137	132 Å²	132	72%	0.717	72%	0.718	S	S	*	*			trans	-80	105.8	166.3	-73.2	168	0	0	0	107.7	F346 S350	F346-L348 PolarHBondContact O-N 3.34Å; L348-S350 PolarHBondContact O-N 3.1Å
349	T	28.5	Very low	29.9	Very low	106 Å²	106	131.1 Å²	131.1	65%	0.65	72%	0.717	S	S	*	*			trans	-69.5	99.8	169.9	50.2	0	0	0	0	108.4	S347	S347-T349 PolarHBondContact O-N 3.44Å
350	S	28.4	Very low	30	Very low	70 Å²	70	128.9 Å²	128.9	49%	0.49	72%	0.716	S	S	.	*			trans	-75.1	132.1	165.2	176.6	0	0	0	0	108.6	L348 K352 G353	L348-S350 PolarHBondContact O-N 3.1Å; S350-K352 PolarHBondContact O-N 2.94Å; S350-G353 PolarHBondContact O-N 3.36Å
351	D	38.9	Very low	29.9	Very low	165 Å²	165	123.1 Å²	123.1	88%	0.882	70%	0.703	S	S	*	*	T	Hydrogen-bonded Turn	trans	-55.7	3.3	-177.4	-76.1	-34.9	0	0	0	116.4
352	K	38.4	Very low	30.1	Very low	185 Å²	185	124 Å²	124	80%	0.804	71%	0.708	S	S	*	*	T	Hydrogen-bonded Turn	trans	-93.7	12	169.9	-67.6	-87.7	179.5	169.9	0	113.2	S350 V354	S350-K352 PolarHBondContact O-N 2.94Å; K352-V354 PolarHBondContact O-N 3.44Å
353	G	30.4	Very low	30.2	Very low	70 Å²	70	126.5 Å²	126.5	72%	0.722	71%	0.712	S	S	*	*	S	Bend	trans	65.7	9.4	168.2	0	0	0	0	0	115.5	S350	S350-G353 PolarHBondContact O-N 3.36Å
354	V	28.6	Very low	30.1	Very low	99 Å²	99	130.4 Å²	130.4	60%	0.6	72%	0.721	S	S	*	*			trans	-99.9	100.1	173.7	-177.6	0	0	0	0	107.6	K352 R356	K352-V354 PolarHBondContact O-N 3.44Å; V354-R356 VanDerWaalsContact C-N 3.27Å; V354-R356 HydrophobicContact CG1-CG 4.36Å; V354-R356 PolarHBondContact O-N 3.25Å
355	N	28.6	Very low	30.2	Very low	119 Å²	119	136.7 Å²	136.7	64%	0.636	73%	0.731	S	S	*	*			trans	-59.5	91.4	167.2	-73.1	-27.4	0	0	0	108.5	S357	N355-S357 PolarHBondContact O-N 3.29Å
356	R	26.1	Very low	30.4	Very low	201 Å²	201	138.8 Å²	138.8	76%	0.758	74%	0.736	S	S	*	*			trans	-77.7	86.2	162.2	-81	-171.7	-85.1	-149.3	-3.5	106.8	V354 I358	V354-R356 VanDerWaalsContact C-N 3.27Å; V354-R356 HydrophobicContact CG1-CG 4.36Å; V354-R356 PolarHBondContact O-N 3.25Å; R356-I358 PolarHBondContact O-N 3.45Å
357	S	30.8	Very low	30.6	Very low	102 Å²	102	139.6 Å²	139.6	71%	0.713	74%	0.739	S	S	*	*			trans	-57.4	108.3	161.3	-55.2	0	0	0	0	106.7	N355 A359	N355-S357 PolarHBondContact O-N 3.29Å; S357-A359 PolarHBondContact O-N 3.42Å
358	I	27.8	Very low	30.5	Very low	127 Å²	127	145.4 Å²	145.4	65%	0.651	75%	0.749	S	S	*	*			trans	-70.1	90.5	169.8	-56.9	173.2	0	0	0	104.4	R356 T360	R356-I358 PolarHBondContact O-N 3.45Å; I358-T360 VanDerWaalsContact C-N 3.26Å; I358-T360 PolarHBondContact O-N 3.22Å
359	A	26.8	Very low	30.7	Very low	85 Å²	85	144.6 Å²	144.6	70%	0.702	75%	0.745	S	S	*	*			trans	-62.8	98.4	168.5	0	0	0	0	0	106.3	S357 G361	S357-A359 PolarHBondContact O-N 3.42Å; A359-G361 PolarHBondContact O-N 3.01Å
360	T	31	Very low	31.1	Very low	125 Å²	125	145.8 Å²	145.8	77%	0.767	74%	0.743	S	S	*	*			trans	-68.2	48.5	159.3	36.7	0	0	0	0	109.6	I358	I358-T360 VanDerWaalsContact C-N 3.26Å; I358-T360 PolarHBondContact O-N 3.22Å
361	G	29	Very low	31.6	Very low	53 Å²	53	146.4 Å²	146.4	55%	0.546	75%	0.748	S	S	.	*			trans	-83.1	131.2	161.7	0	0	0	0	0	107.2	A359 K363	A359-G361 PolarHBondContact O-N 3.01Å; G361-K363 PolarHBondContact O-N 3.43Å
362	Q	32.3	Very low	31.5	Very low	195 Å²	195	146.3 Å²	146.3	91%	0.911	74%	0.742	S	S	*	*	T	Hydrogen-bonded Turn	trans	-59.1	18.2	-168	-80	-175.5	-41.7	0	0	117.7
363	K	33.4	Very low	31.2	Very low	199 Å²	199	145 Å²	145	87%	0.865	73%	0.732	S	S	*	*	T	Hydrogen-bonded Turn	trans	-106	5.1	-170.1	-85.4	-168.6	174.3	-176.1	0	118.1	G361	G361-K363 PolarHBondContact O-N 3.43Å
364	E	28.7	Very low	31.5	Very low	188 Å²	188	146.1 Å²	146.1	88%	0.879	73%	0.729	S	S	*	*			trans	-116.5	31.8	172	-86.5	-170.2	160.1	0	0	114.4	E366	E364-E366 PolarHBondContact O-N 3.26Å
365	R	34.3	Very low	32.1	Very low	236 Å²	236	148.4 Å²	148.4	89%	0.891	74%	0.738	S	S	*	*			trans	-78.7	-3.4	166.2	-85.8	-164.9	176.7	-168.3	1.6	114.4
366	E	30.9	Very low	32.4	Very low	181 Å²	181	148.2 Å²	148.2	85%	0.846	74%	0.736	S	S	*	*	S	Bend	trans	-105.7	76.2	-177.1	-70.3	178.2	177	0	0	111.5	E364	E364-E366 PolarHBondContact O-N 3.26Å
367	K	35.1	Very low	32.8	Very low	197 Å²	197	147.4 Å²	147.4	86%	0.857	74%	0.738	S	S	*	*	S	Bend	trans	-171.2	6.5	148.8	-111.1	171.5	-171.3	-177.3	0	117.2
368	Y	25.2	Very low	33.4	Very low	214 Å²	214	150.2 Å²	150.2	84%	0.839	75%	0.745	S	S	*	*	S	Bend	trans	-99.4	107.4	173.3	-77.6	-84.8	0	0	0	110.4	E370	Y368-E370 PolarHBondContact O-N 3.37Å
369	N	32	Very low	33.7	Very low	119 Å²	119	147.6 Å²	147.6	64%	0.636	73%	0.732	S	S	*	*			trans	-56.7	115.1	-177.3	-163.9	2.9	0	0	0	110.6	S371 Q372	N369-S371 PolarHBondContact O-N 2.97Å; N369-S371 PolarHBondContact OD1-OG 3.02Å; N369-S371 VanDerWaalsContact OD1-OG 3.1Å; N369-Q372 PolarHBondContact O-N 2.89Å
370	E	35.9	Very low	34	Very low	131 Å²	131	147.9 Å²	147.9	61%	0.612	72%	0.722	S	S	*	*	G	3₁₀ helix	trans	-54.4	-18.6	-176.6	-159.5	92	-143	0	0	112.9	Y368 Q372 R373	Y368-E370 PolarHBondContact O-N 3.37Å; E370-Q372 PolarHBondContact O-N 2.92Å; E370-Q372 VanDerWaalsContact O-N 3.15Å; E370-R373 WeakPolarHBondContact O-CB 3.43Å; E370-R373 PolarHBondContact O-N 3.48Å; E370-R373 VanDerWaalsContact O-N 3.16Å; E370-R373 VanDerWaalsContact OE1-CD 3.24Å; E370-R373 WeakPolarHBondContact OE1-CD 3.42Å; E370-R373 IonicContact OE1-CZ 3.45Å; E370-R373 IonicContact OE1-NE 2.91Å; E370-R373 IonicContact OE1-NH1 3.57Å; E370-R373 PolarHBondContact OE1-NH1 3.25Å
371	S	39	Very low	34.3	Very low	84 Å²	84	148 Å²	148	59%	0.587	73%	0.725	S	S	*	*	G	3₁₀ helix	trans	-62.5	-17.4	179.8	-37.3	0	0	0	0	114.9	N369	N369-S371 PolarHBondContact O-N 2.97Å; N369-S371 PolarHBondContact OD1-OG 3.02Å; N369-S371 VanDerWaalsContact OD1-OG 3.1Å
372	Q	37.3	Very low	34.7	Very low	163 Å²	163	150.8 Å²	150.8	76%	0.762	73%	0.734	S	S	*	*	G	3₁₀ helix	trans	-91.2	2.3	177.7	-70.5	-176.2	-21	0	0	113.7	N369 E370 S374	N369-Q372 PolarHBondContact O-N 2.89Å; E370-Q372 PolarHBondContact O-N 2.92Å; E370-Q372 VanDerWaalsContact O-N 3.15Å; Q372-S374 PolarHBondContact O-N 3.23Å
373	R	32.9	Very low	34.7	Very low	157 Å²	157	148.8 Å²	148.8	59%	0.592	72%	0.719	S	S	*	*			trans	-79.8	-5.9	-177.8	-87.8	-178.5	146.1	-176.4	-4.8	115.9	E370 D375 L376	E370-R373 WeakPolarHBondContact O-CB 3.43Å; E370-R373 PolarHBondContact O-N 3.48Å; E370-R373 VanDerWaalsContact O-N 3.16Å; E370-R373 VanDerWaalsContact OE1-CD 3.24Å; E370-R373 WeakPolarHBondContact OE1-CD 3.42Å; E370-R373 IonicContact OE1-CZ 3.45Å; E370-R373 IonicContact OE1-NE 2.91Å; E370-R373 IonicContact OE1-NH1 3.57Å; E370-R373 PolarHBondContact OE1-NH1 3.25Å; R373-D375 VanDerWaalsContact C-N 3.27Å; R373-D375 PolarHBondContact O-N 3.47Å; R373-L376 PolarHBondContact O-N 2.97Å
374	S	35.6	Very low	34.9	Very low	94 Å²	94	141.7 Å²	141.7	66%	0.657	69%	0.693	S	S	*	*	T	Hydrogen-bonded Turn	trans	-58.6	-40	-174.5	-33.6	0	0	0	0	112.5	Q372	Q372-S374 PolarHBondContact O-N 3.23Å
375	D	40.8	Very low	35.7	Very low	147 Å²	147	135.3 Å²	135.3	79%	0.786	67%	0.667	S	S	*	*	T	Hydrogen-bonded Turn	trans	-97.7	-4.1	-172.7	-66	-24	0	0	0	113.9	R373	R373-D375 VanDerWaalsContact C-N 3.27Å; R373-D375 PolarHBondContact O-N 3.47Å
376	L	35.2	Very low	36.4	Very low	115 Å²	115	127.7 Å²	127.7	60%	0.602	64%	0.64	S	S	*	*	T	Hydrogen-bonded Turn	trans	-98.8	-3.9	-178.4	-105.7	78	0	0	0	115	R373 N378 L379	R373-L376 PolarHBondContact O-N 2.97Å; L376-N378 PolarHBondContact O-N 2.9Å; L376-L379 HydrophobicContact CG-CD1 4.26Å; L376-L379 PolarHBondContact O-N 3.37Å
377	K	35.8	Very low	37.2	Very low	183 Å²	183	121 Å²	121	80%	0.796	61%	0.609	S	S	*	*	T	Hydrogen-bonded Turn	trans	-64	-13.8	-174.8	-84.8	-169.6	177.5	-178.6	0	115.5
378	N	43.5	Very low	37.8	Very low	161 Å²	161	115.3 Å²	115.3	86%	0.861	59%	0.593	S	S	*	*	T	Hydrogen-bonded Turn	trans	-110.2	9	179.6	-68.5	-23.4	0	0	0	114.1	L376	L376-N378 PolarHBondContact O-N 2.9Å
379	L	32.1	Very low	38.8	Very low	72 Å²	72	106.1 Å²	106.1	38%	0.377	56%	0.562	S	S	.	*	S	Bend	trans	-105.3	100.1	178.6	-67.7	155.9	0	0	0	107.7	L376 P381 V385	L376-L379 HydrophobicContact CG-CD1 4.26Å; L376-L379 PolarHBondContact O-N 3.37Å; L379-P381 WeakPolarHBondContact O-CD 3.48Å; L379-P381 VanDerWaalsContact O-N 3.14Å; L379-V385 HydrophobicContact CB-CG2 4.2Å; L379-V385 HydrophobicContact CD1-CG2 4.43Å; L379-V385 HydrophobicContact CD2-CB 4.06Å; L379-V385 HydrophobicContact CD2-CG1 3.54Å; L379-V385 HydrophobicContact CD2-CG2 3.42Å; L379-V385 VanDerWaalsContact CD2-CG2 3.42Å; L379-V385 HydrophobicContact CG-CG2 4.2Å
380	D	34.9	Very low	39.8	Very low	91 Å²	91	100.7 Å²	100.7	49%	0.487	53%	0.533	S	S	.	.			trans	-48.4	117.5	167.5	173.8	1.1	0	0	0	108.4	C382 R383	D380-C382 PolarHBondContact O-N 2.95Å; D380-C382 VanDerWaalsContact O-N 3.08Å; D380-C382 WeakPolarHBondContact OD1-CB 3.3Å; D380-C382 PolarHBondContact OD1-N 2.84Å; D380-R383 HydrophobicContact CB-CB 3.75Å; D380-R383 WeakPolarHBondContact O-CB 3.36Å; D380-R383 PolarHBondContact O-N 2.88Å
381	P	36.4	Very low	40.5	Very low	128 Å²	128	98.6 Å²	98.6	83%	0.831	53%	0.526	S	S	*	.	T	Hydrogen-bonded Turn	trans	-60.2	-20.8	-177.4	-5.7	9.8	0	0	0	113.1	L379	L379-P381 WeakPolarHBondContact O-CD 3.48Å; L379-P381 VanDerWaalsContact O-N 3.14Å
382	C	36.5	Very low	41.1	Very low	111 Å²	111	97.3 Å²	97.3	75%	0.75	51%	0.512	S	S	*	.	T	Hydrogen-bonded Turn	trans	-92.4	-7.1	176.4	-61.5	0	0	0	0	113.1	D380 P384	D380-C382 PolarHBondContact O-N 2.95Å; D380-C382 VanDerWaalsContact O-N 3.08Å; D380-C382 WeakPolarHBondContact OD1-CB 3.3Å; D380-C382 PolarHBondContact OD1-N 2.84Å; C382-P384 WeakPolarHBondContact O-CD 3.44Å
383	R	34.3	Very low	41.5	Very low	153 Å²	153	98.4 Å²	98.4	58%	0.577	51%	0.514	S	S	*	.	S	Bend	trans	-93.5	98.5	173.1	-169.3	173.3	-167.3	-108.6	0.4	106.9	D380 V385	D380-R383 HydrophobicContact CB-CB 3.75Å; D380-R383 WeakPolarHBondContact O-CB 3.36Å; D380-R383 PolarHBondContact O-N 2.88Å; R383-V385 PolarHBondContact O-N 3.31Å
384	P	37.2	Very low	42.2	Very low	50 Å²	50	101.2 Å²	101.2	33%	0.325	53%	0.525	S	S	.	.			trans	-58.8	114.5	173.9	25.4	-32.3	0	0	0	107.8	C382 F386 F387 L470	C382-P384 WeakPolarHBondContact O-CD 3.44Å; P384-F386 PolarHBondContact O-N 3.16Å; P384-F386 VanDerWaalsContact O-N 3.1Å; P384-F387 HydrophobicContact CB-CD2 3.25Å; P384-F387 HydrophobicContact CB-CE2 3.27Å; P384-F387 HydrophobicContact CB-CG 3.95Å; P384-F387 HydrophobicContact CB-CZ 3.99Å; P384-F387 HydrophobicContact CG-CB 4.14Å; P384-F387 HydrophobicContact CG-CD1 3.89Å; P384-F387 HydrophobicContact CG-CD2 3.4Å; P384-F387 VanDerWaalsContact CG-CD2 3.4Å; P384-F387 HydrophobicContact CG-CE1 3.91Å; P384-F387 HydrophobicContact CG-CE2 3.49Å; P384-F387 VanDerWaalsContact CG-CE2 3.49Å; P384-F387 HydrophobicContact CG-CG 3.57Å; P384-F387 HydrophobicContact CG-CZ 3.74Å; P384-F387 PolarHBondContact O-N 3.44Å; P384-L470 HydrophobicContact CG-CD1 4.22Å
385	V	45.4	Very low	43.2	Very low	54 Å²	54	100.1 Å²	100.1	33%	0.327	52%	0.517	S	S	.	.	S	Bend	trans	-58.6	-31.8	-164.4	176.6	0	0	0	0	111.1	L379 R383 S388	L379-V385 HydrophobicContact CB-CG2 4.2Å; L379-V385 HydrophobicContact CD1-CG2 4.43Å; L379-V385 HydrophobicContact CD2-CB 4.06Å; L379-V385 HydrophobicContact CD2-CG1 3.54Å; L379-V385 HydrophobicContact CD2-CG2 3.42Å; L379-V385 VanDerWaalsContact CD2-CG2 3.42Å; L379-V385 HydrophobicContact CG-CG2 4.2Å; R383-V385 PolarHBondContact O-N 3.31Å; V385-S388 PolarHBondContact O-OG 3.11Å; V385-S388 VanDerWaalsContact O-OG 3.09Å
386	F	48.6	Very low	44.6	Very low	76 Å²	76	94.1 Å²	94.1	33%	0.333	49%	0.49	S	S	.	.	S	Bend	trans	-96.1	-19.1	-166.8	-64.8	-77.7	0	0	0	114.2	P384 S388 A389 K409 L410 E463	P384-F386 PolarHBondContact O-N 3.16Å; P384-F386 VanDerWaalsContact O-N 3.1Å; F386-S388 PolarHBondContact O-N 3.24Å; F386-A389 WeakPolarHBondContact O-CB 3.46Å; F386-A389 PolarHBondContact O-N 3.19Å; F386-K409 HydrophobicContact CE1-CB 4.15Å; F386-L410 HydrophobicContact CE1-CD2 4.44Å; F386-L410 HydrophobicContact CZ-CD2 4.44Å; F386-E463 WeakPolarHBondContact CA-OE1 3.3Å; F386-E463 WeakPolarHBondContact CB-OE1 3.35Å; F386-E463 WeakPolarHBondContact CB-OE2 3.45Å
387	F	46.6	Very low	46.7	Very low	42 Å²	42	92.9 Å²	92.9	18%	0.184	48%	0.479	C	S	.	.	T	Hydrogen-bonded Turn	trans	-60.6	-22	176.3	-79.3	-132.7	0	0	0	112.7	P384 A389 L392 E463 L466 T467 L470	P384-F387 HydrophobicContact CB-CD2 3.25Å; P384-F387 HydrophobicContact CB-CE2 3.27Å; P384-F387 HydrophobicContact CB-CG 3.95Å; P384-F387 HydrophobicContact CB-CZ 3.99Å; P384-F387 HydrophobicContact CG-CB 4.14Å; P384-F387 HydrophobicContact CG-CD1 3.89Å; P384-F387 HydrophobicContact CG-CD2 3.4Å; P384-F387 VanDerWaalsContact CG-CD2 3.4Å; P384-F387 HydrophobicContact CG-CE1 3.91Å; P384-F387 HydrophobicContact CG-CE2 3.49Å; P384-F387 VanDerWaalsContact CG-CE2 3.49Å; P384-F387 HydrophobicContact CG-CG 3.57Å; P384-F387 HydrophobicContact CG-CZ 3.74Å; P384-F387 PolarHBondContact O-N 3.44Å; F387-A389 PolarHBondContact O-N 3.46Å; F387-L392 HydrophobicContact CD1-CD1 4.42Å; F387-E463 HydrophobicContact CD2-CG 4.14Å; F387-E463 HydrophobicContact CE2-CG 4.09Å; F387-E463 PolarHBondContact N-OE1 3.37Å; F387-L466 HydrophobicContact CE2-CB 4.5Å; F387-L466 HydrophobicContact CZ-CB 4.12Å; F387-T467 HydrophobicContact CD1-CG2 4.13Å; F387-T467 WeakPolarHBondContact CD1-OG1 3.41Å; F387-T467 HydrophobicContact CE1-CG2 3.86Å; F387-T467 WeakPolarHBondContact CE1-OG1 3.23Å; F387-T467 VanDerWaalsContact CZ-CA 3.44Å; F387-T467 WeakPolarHBondContact CZ-OG1 3.46Å; F387-L470 HydrophobicContact CE1-CD1 3.84Å; F387-L470 HydrophobicContact CZ-CD1 3.78Å
388	S	47.6	Very low	48.8	Very low	77 Å²	77	84.3 Å²	84.3	54%	0.538	44%	0.443	S	S	.	.	T	Hydrogen-bonded Turn	trans	-69.5	-19.4	176.1	64.9	0	0	0	0	113.6	V385 F386	V385-S388 PolarHBondContact O-OG 3.11Å; V385-S388 VanDerWaalsContact O-OG 3.09Å; F386-S388 PolarHBondContact O-N 3.24Å
389	A	47.6	Very low	50.7	Low	21 Å²	21	78.7 Å²	78.7	17%	0.174	41%	0.413	C	S	.	.	T	Hydrogen-bonded Turn	trans	-81.5	-36.1	-177.2	0	0	0	0	0	112.5	F386 F387	F386-A389 WeakPolarHBondContact O-CB 3.46Å; F386-A389 PolarHBondContact O-N 3.19Å; F387-A389 PolarHBondContact O-N 3.46Å
390	I	52.5	Low	53.1	Low	5 Å²	5	75.3 Å²	75.3	3%	0.026	40%	0.396	C	S	.	.	S	Bend	trans	-100.5	104.8	175.7	-56	176.7	0	0	0	106.1	L392 A398 I403 C406 L432 M460	I390-L392 HydrophobicContact CG2-CG 4.13Å; I390-L392 PolarHBondContact O-N 3.07Å; I390-A398 HydrophobicContact CG2-CB 3.42Å; I390-A398 VanDerWaalsContact CG2-CB 3.42Å; I390-I403 HydrophobicContact CD1-CG1 4.31Å; I390-C406 HydrophobicContact CD1-CB 4.2Å; I390-C406 HydrophobicContact CG1-CB 4.25Å; I390-L432 HydrophobicContact CG2-CD1 4.38Å; I390-M460 HydrophobicContact CD1-CE 3.74Å; I390-M460 HydrophobicContact CD1-SD 4.48Å
391	D	51	Low	55.3	Low	87 Å²	87	74.1 Å²	74.1	47%	0.465	39%	0.387	S	S	.	.			trans	-66.8	78.5	176	-169.7	21.9	0	0	0	110.3	K393	D391-K393 PolarHBondContact O-N 3.36Å; D391-K393 WeakPolarHBondContact OD1-CB 3.49Å; D391-K393 WeakPolarHBondContact OD1-CD 3.32Å; D391-K393 WeakPolarHBondContact OD1-CG 3.34Å; D391-K393 PolarHBondContact OD1-N 3.2Å
392	L	50.6	Low	57.3	Low	56 Å²	56	70.8 Å²	70.8	29%	0.293	36%	0.362	S	S	.	.	T	Hydrogen-bonded Turn	trans	-64.1	-6.5	176.1	-74.2	143.7	0	0	0	112.1	F387 I390 R394 L432 T467	F387-L392 HydrophobicContact CD1-CD1 4.42Å; I390-L392 HydrophobicContact CG2-CG 4.13Å; I390-L392 PolarHBondContact O-N 3.07Å; L392-R394 PolarHBondContact O-N 2.95Å; L392-L432 HydrophobicContact CD2-CD1 3.33Å; L392-L432 HydrophobicContact CG-CD1 4.41Å; L392-T467 HydrophobicContact CD1-CG2 3.32Å; L392-T467 HydrophobicContact CD2-CG2 3.91Å; L392-T467 HydrophobicContact CG-CG2 4.16Å
393	K	47.1	Very low	59.4	Low	186 Å²	186	65.5 Å²	65.5	81%	0.809	33%	0.327	S	S	*	.	T	Hydrogen-bonded Turn	trans	-58.6	-19.3	-177.5	-70.3	-174.1	177.8	-172.9	0	113.4	D391	D391-K393 PolarHBondContact O-N 3.36Å; D391-K393 WeakPolarHBondContact OD1-CB 3.49Å; D391-K393 WeakPolarHBondContact OD1-CD 3.32Å; D391-K393 WeakPolarHBondContact OD1-CG 3.34Å; D391-K393 PolarHBondContact OD1-N 3.2Å
394	R	47.4	Very low	61.5	Low	217 Å²	217	61.3 Å²	61.3	82%	0.819	31%	0.313	S	S	*	.	S	Bend	trans	-111	-28.9	-164.9	-83.3	-175.5	172.1	-109.2	-2.7	120	L392	L392-R394 PolarHBondContact O-N 2.95Å
395	S	55.9	Low	63.4	Low	70 Å²	70	63 Å²	63	49%	0.49	32%	0.32	S	S	.	.	S	Bend	trans	-172.6	9.7	-179.2	51.6	0	0	0	0	119.4	F397	S395-F397 WeakPolarHBondContact O-CD2 3.36Å; S395-F397 PolarHBondContact O-N 3.47Å; S395-F397 WeakPolarHBondContact OG-CD2 3.36Å
396	G	71.5	Confident	64.8	Low	21 Å²	21	60.4 Å²	60.4	22%	0.216	30%	0.304	C	S	.	.	S	Bend	trans	68.2	10.8	-166.8	0	0	0	0	0	112.4	L432	G396-L432 WeakPolarHBondContact O-CB 3.48Å; G396-L432 PolarHBondContact O-N 2.97Å
397	F	79.1	Confident	66.1	Low	89 Å²	89	56.8 Å²	56.8	39%	0.39	29%	0.288	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-114.2	142.4	166.8	-60.7	-97.8	0	0	0	109.1	S395 M429 I430 N431	S395-F397 WeakPolarHBondContact O-CD2 3.36Å; S395-F397 PolarHBondContact O-N 3.47Å; S395-F397 WeakPolarHBondContact OG-CD2 3.36Å; F397-M429 HydrophobicContact CB-CB 4.45Å; F397-M429 HydrophobicContact CB-CE 3.7Å; F397-M429 HydrophobicContact CB-SD 4.07Å; F397-M429 HydrophobicContact CD1-CB 4.49Å; F397-I430 CarbonylContact C-O 3.59Å; F397-I430 WeakPolarHBondContact CA-O 3.46Å; F397-N431 HydrophobicContact CD1-CB 3.94Å; F397-N431 HydrophobicContact CE1-CB 3.71Å; F397-N431 HydrophobicContact CZ-CB 4.47Å
398	A	79	Confident	67.5	Low	4 Å²	4	58.5 Å²	58.5	3%	0.033	30%	0.299	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-127.2	147.7	173.7	0	0	0	0	0	109.9	I390 I403 M429 I430 L432	I390-A398 HydrophobicContact CG2-CB 3.42Å; I390-A398 VanDerWaalsContact CG2-CB 3.42Å; A398-I403 HydrophobicContact CB-CD1 3.82Å; A398-I403 HydrophobicContact CB-CG1 3.95Å; A398-M429 WeakPolarHBondContact O-CE 3.46Å; A398-I430 PolarHBondContact N-O 3.28Å; A398-I430 PolarHBondContact O-N 3.27Å; A398-L432 HydrophobicContact CB-CD1 4.08Å; A398-L432 HydrophobicContact CB-CD2 3.56Å; A398-L432 HydrophobicContact CB-CG 3.93Å
399	N	82.8	Confident	68.6	Low	43 Å²	43	61.2 Å²	61.2	23%	0.23	30%	0.301	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-73.1	139.2	176.6	-164	-4.1	0	0	0	109.1	E401 D402 I403 G428 M429	N399-E401 PolarHBondContact ND2-OE2 2.92Å; N399-E401 PolarHBondContact O-N 3.11Å; N399-E401 PolarHBondContact OD1-OE2 2.97Å; N399-D402 HydrophobicContact CB-CB 4.36Å; N399-D402 WeakPolarHBondContact CB-OD2 3.46Å; N399-D402 WeakPolarHBondContact O-CB 3.48Å; N399-D402 PolarHBondContact O-N 3.45Å; N399-I403 PolarHBondContact O-N 3.43Å; N399-G428 CarbonylContact C-O 3.52Å; N399-G428 WeakPolarHBondContact CA-O 3.27Å; N399-G428 PolarHBondContact OD1-N 2.84Å; N399-G428 PolarHBondContact OD1-O 3.49Å; N399-G428 VanDerWaalsContact OD1-O 3.04Å; N399-M429 HydrophobicContact CB-CE 4.34Å; N399-M429 VanDerWaalsContact N-CE 3.26Å
400	A	82.2	Confident	69.5	Low	1 Å²	1	62.6 Å²	62.6	1%	0.008	31%	0.306	C	S	.	.	H	α-helix	trans	-55.7	-36.4	177.5	0	0	0	0	0	111.4	D402 I403 E404 L419 K426 G428 I430	A400-D402 VanDerWaalsContact C-N 3.34Å; A400-D402 PolarHBondContact O-N 3.38Å; A400-I403 PolarHBondContact O-N 2.89Å; A400-E404 WeakPolarHBondContact O-CB 3.3Å; A400-E404 PolarHBondContact O-N 3.4Å; A400-L419 HydrophobicContact CB-CD1 4.37Å; A400-K426 VanDerWaalsContact CB-O 3.28Å; A400-K426 WeakPolarHBondContact CB-O 3.35Å; A400-G428 PolarHBondContact N-O 2.99Å; A400-I430 HydrophobicContact CB-CD1 3.71Å; A400-I430 HydrophobicContact CB-CG1 4.3Å
401	E	81.7	Confident	70.2	Confident	65 Å²	65	65.1 Å²	65.1	30%	0.304	33%	0.332	S	S	.	.	H	α-helix	trans	-66.1	-33.2	175.2	-64.6	96.7	-138.7	0	0	113.1	N399 N405 H427	N399-E401 PolarHBondContact ND2-OE2 2.92Å; N399-E401 PolarHBondContact O-N 3.11Å; N399-E401 PolarHBondContact OD1-OE2 2.97Å; E401-N405 WeakPolarHBondContact O-CB 3.43Å; E401-N405 PolarHBondContact O-N 3.49Å; E401-N405 PolarHBondContact O-ND2 3.07Å; E401-N405 VanDerWaalsContact O-ND2 3.09Å; E401-H427 WeakPolarHBondContact OE1-CA 3.48Å; E401-H427 IonicContact OE1-CG 3.11Å; E401-H427 IonicContact OE1-ND1 2.84Å; E401-H427 PolarHBondContact OE1-ND1 3.33Å
402	D	79.8	Confident	71	Confident	59 Å²	59	61.1 Å²	61.1	32%	0.316	31%	0.311	S	S	.	.	H	α-helix	trans	-73.4	-38.3	176.3	-64.8	-32.4	0	0	0	111	N399 A400 N405 C406	N399-D402 HydrophobicContact CB-CB 4.36Å; N399-D402 WeakPolarHBondContact CB-OD2 3.46Å; N399-D402 WeakPolarHBondContact O-CB 3.48Å; N399-D402 PolarHBondContact O-N 3.45Å; A400-D402 VanDerWaalsContact C-N 3.34Å; A400-D402 PolarHBondContact O-N 3.38Å; D402-N405 PolarHBondContact O-N 2.91Å; D402-C406 WeakPolarHBondContact O-CB 3.34Å; D402-C406 PolarHBondContact O-N 3.38Å
403	I	79.1	Confident	71.9	Confident	0 Å²	0	61.2 Å²	61.2	0%	0	32%	0.315	C	S	.	.	H	α-helix	trans	-63.4	-44	172.7	-70.9	161.2	0	0	0	110.3	I390 A398 N399 A400 C406 W407 L419 I430 L432 L435 M460	I390-I403 HydrophobicContact CD1-CG1 4.31Å; A398-I403 HydrophobicContact CB-CD1 3.82Å; A398-I403 HydrophobicContact CB-CG1 3.95Å; N399-I403 PolarHBondContact O-N 3.43Å; A400-I403 PolarHBondContact O-N 2.89Å; I403-C406 WeakPolarHBondContact O-CA 3.41Å; I403-C406 VanDerWaalsContact O-CB 3.31Å; I403-C406 WeakPolarHBondContact O-CB 3.36Å; I403-C406 PolarHBondContact O-N 3.25Å; I403-C406 VanDerWaalsContact O-N 3.12Å; I403-W407 HydrophobicContact CG2-CD2 4.31Å; I403-W407 HydrophobicContact CG2-CZ2 4.3Å; I403-W407 PolarHBondContact O-N 2.86Å; I403-L419 HydrophobicContact CG2-CD1 4.49Å; I403-L419 HydrophobicContact CG2-CD2 4.14Å; I403-I430 HydrophobicContact CD1-CB 3.82Å; I403-I430 HydrophobicContact CD1-CD1 3.75Å; I403-I430 HydrophobicContact CD1-CG1 4.31Å; I403-I430 HydrophobicContact CD1-CG2 4.01Å; I403-L432 HydrophobicContact CD1-CD2 4.35Å; I403-L435 HydrophobicContact CD1-CD2 3.81Å; I403-L435 HydrophobicContact CG1-CD2 4.42Å; I403-L435 HydrophobicContact CG2-CD2 4.49Å; I403-M460 HydrophobicContact CB-CE 4.32Å; I403-M460 HydrophobicContact CG1-CE 4.22Å; I403-M460 HydrophobicContact CG2-CE 3.66Å
404	E	78.6	Confident	73.3	Confident	64 Å²	64	56.7 Å²	56.7	30%	0.299	30%	0.3	S	S	.	.	H	α-helix	trans	-59.6	-48	175.3	178.8	177.7	-177.4	0	0	111.5	A400 C406 W407 N408 V415	A400-E404 WeakPolarHBondContact O-CB 3.3Å; A400-E404 PolarHBondContact O-N 3.4Å; E404-C406 PolarHBondContact O-N 3.32Å; E404-W407 PolarHBondContact O-N 2.93Å; E404-N408 WeakPolarHBondContact CG-ND2 3.22Å; E404-N408 VanDerWaalsContact O-CB 3.28Å; E404-N408 WeakPolarHBondContact O-CB 3.47Å; E404-N408 VanDerWaalsContact O-CG 3.23Å; E404-N408 PolarHBondContact O-N 2.92Å; E404-N408 PolarHBondContact O-ND2 3.42Å; E404-V415 HydrophobicContact CB-CB 4.47Å; E404-V415 HydrophobicContact CB-CG1 3.81Å; E404-V415 HydrophobicContact CG-CB 4.04Å; E404-V415 HydrophobicContact CG-CG1 3.94Å; E404-V415 HydrophobicContact CG-CG2 4.37Å
405	N	77.9	Confident	74.8	Confident	86 Å²	86	46.5 Å²	46.5	46%	0.46	26%	0.262	S	S	.	.	H	α-helix	trans	-59.7	-34.5	174.7	-76.4	-34.3	0	0	0	112.7	E401 D402 K409	E401-N405 WeakPolarHBondContact O-CB 3.43Å; E401-N405 PolarHBondContact O-N 3.49Å; E401-N405 PolarHBondContact O-ND2 3.07Å; E401-N405 VanDerWaalsContact O-ND2 3.09Å; D402-N405 PolarHBondContact O-N 2.91Å; N405-K409 WeakPolarHBondContact O-CD 3.41Å; N405-K409 VanDerWaalsContact O-CG 3.27Å; N405-K409 WeakPolarHBondContact O-CG 3.46Å; N405-K409 PolarHBondContact O-N 3.46Å
406	C	73.9	Confident	75.8	Confident	0 Å²	0	47 Å²	47	0%	0	26%	0.256	C	S	.	.	H	α-helix	trans	-66.9	-51.9	174.9	-176.3	0	0	0	0	111.3	I390 D402 I403 E404 N408 K409 L410 M460	I390-C406 HydrophobicContact CD1-CB 4.2Å; I390-C406 HydrophobicContact CG1-CB 4.25Å; D402-C406 WeakPolarHBondContact O-CB 3.34Å; D402-C406 PolarHBondContact O-N 3.38Å; I403-C406 WeakPolarHBondContact O-CA 3.41Å; I403-C406 VanDerWaalsContact O-CB 3.31Å; I403-C406 WeakPolarHBondContact O-CB 3.36Å; I403-C406 PolarHBondContact O-N 3.25Å; I403-C406 VanDerWaalsContact O-N 3.12Å; E404-C406 PolarHBondContact O-N 3.32Å; C406-N408 PolarHBondContact O-N 3.39Å; C406-K409 WeakPolarHBondContact O-CB 3.19Å; C406-K409 PolarHBondContact O-N 3.12Å; C406-L410 PolarHBondContact O-N 3.4Å; C406-M460 HydrophobicContact CB-CE 4.5Å
407	W	76.5	Confident	76.2	Confident	0 Å²	0	49.9 Å²	49.9	0%	0	27%	0.267	C	S	.	.	H	α-helix	trans	-66.6	-36.6	179.9	-77.6	1.6	0	0	0	113.8	I403 E404 K409 L410 G411 V412 V415 L418 L419 L422 L439 M460	I403-W407 HydrophobicContact CG2-CD2 4.31Å; I403-W407 HydrophobicContact CG2-CZ2 4.3Å; I403-W407 PolarHBondContact O-N 2.86Å; E404-W407 PolarHBondContact O-N 2.93Å; W407-K409 VanDerWaalsContact C-N 3.25Å; W407-K409 PolarHBondContact O-N 3.36Å; W407-L410 CarbonylContact O-C 3.48Å; W407-L410 WeakPolarHBondContact O-CA 3.39Å; W407-L410 WeakPolarHBondContact O-CB 3.39Å; W407-L410 PolarHBondContact O-N 3.23Å; W407-G411 PolarHBondContact O-N 3.44Å; W407-G411 VanDerWaalsContact O-N 3.14Å; W407-V412 HydrophobicContact CB-CB 4.05Å; W407-V412 HydrophobicContact CB-CG2 4.08Å; W407-V412 HydrophobicContact CG-CG2 4.31Å; W407-V412 PolarHBondContact O-N 3.05Å; W407-V412 VanDerWaalsContact O-N 3.07Å; W407-V415 HydrophobicContact CB-CB 4.37Å; W407-V415 HydrophobicContact CB-CG1 4.13Å; W407-V415 HydrophobicContact CB-CG2 3.4Å; W407-V415 VanDerWaalsContact CB-CG2 3.4Å; W407-V415 HydrophobicContact CD2-CG1 3.98Å; W407-V415 HydrophobicContact CD2-CG2 4.5Å; W407-V415 HydrophobicContact CE3-CB 3.85Å; W407-V415 HydrophobicContact CE3-CG1 3.17Å; W407-V415 HydrophobicContact CE3-CG2 4Å; W407-V415 HydrophobicContact CG-CG1 4.41Å; W407-V415 HydrophobicContact CG-CG2 4.35Å; W407-V415 HydrophobicContact CZ3-CG1 3.79Å; W407-L418 HydrophobicContact CD2-CD2 4.33Å; W407-L418 HydrophobicContact CE3-CB 4.34Å; W407-L418 HydrophobicContact CE3-CD2 3.64Å; W407-L418 HydrophobicContact CE3-CG 4.18Å; W407-L418 HydrophobicContact CH2-CD2 3.76Å; W407-L418 HydrophobicContact CH2-CG 3.83Å; W407-L418 HydrophobicContact CZ2-CD2 4.34Å; W407-L418 HydrophobicContact CZ3-CB 3.76Å; W407-L418 HydrophobicContact CZ3-CD2 3.36Å; W407-L418 HydrophobicContact CZ3-CG 3.45Å; W407-L418 VanDerWaalsContact CZ3-CG 3.45Å; W407-L419 HydrophobicContact CH2-CD2 3.64Å; W407-L419 HydrophobicContact CH2-CG 4.16Å; W407-L419 HydrophobicContact CZ3-CD2 3.78Å; W407-L419 HydrophobicContact CZ3-CG 3.75Å; W407-L422 HydrophobicContact CH2-CD1 3.9Å; W407-L439 HydrophobicContact CH2-CD2 4.46Å; W407-L439 HydrophobicContact CZ2-CD2 4.06Å; W407-M460 HydrophobicContact CZ2-CB 4.32Å; W407-M460 HydrophobicContact CZ2-CE 4.31Å; W407-M460 HydrophobicContact CZ2-CG 4Å; W407-M460 PolarHBondContact NE1-SD 3.29Å
408	N	75.8	Confident	76.1	Confident	78 Å²	78	46 Å²	46	42%	0.417	25%	0.25	S	S	.	.	H	α-helix	trans	-60.5	-37.6	173.9	-76.2	-23.5	0	0	0	111.2	E404 C406 L410 G411 V415	E404-N408 WeakPolarHBondContact CG-ND2 3.22Å; E404-N408 VanDerWaalsContact O-CB 3.28Å; E404-N408 WeakPolarHBondContact O-CB 3.47Å; E404-N408 VanDerWaalsContact O-CG 3.23Å; E404-N408 PolarHBondContact O-N 2.92Å; E404-N408 PolarHBondContact O-ND2 3.42Å; C406-N408 PolarHBondContact O-N 3.39Å; N408-L410 VanDerWaalsContact C-N 3.29Å; N408-L410 PolarHBondContact O-N 3.34Å; N408-G411 PolarHBondContact O-N 2.97Å; N408-G411 VanDerWaalsContact O-N 3.16Å; N408-V415 WeakPolarHBondContact OD1-CG2 3.44Å
409	K	71.6	Confident	76.3	Confident	133 Å²	133	45.9 Å²	45.9	58%	0.578	25%	0.249	S	C	*	.	H	α-helix	trans	-69.1	-27	173.5	-71.6	171.2	-176.7	175.8	0	113.1	F386 N405 C406 W407	F386-K409 HydrophobicContact CE1-CB 4.15Å; N405-K409 WeakPolarHBondContact O-CD 3.41Å; N405-K409 VanDerWaalsContact O-CG 3.27Å; N405-K409 WeakPolarHBondContact O-CG 3.46Å; N405-K409 PolarHBondContact O-N 3.46Å; C406-K409 WeakPolarHBondContact O-CB 3.19Å; C406-K409 PolarHBondContact O-N 3.12Å; W407-K409 VanDerWaalsContact C-N 3.25Å; W407-K409 PolarHBondContact O-N 3.36Å
410	L	65.4	Low	76.3	Confident	51 Å²	51	50.1 Å²	50.1	27%	0.267	27%	0.265	S	S	.	.	T	Hydrogen-bonded Turn	trans	-80.5	-3	173.6	-65.5	172.3	0	0	0	112.8	F386 C406 W407 N408 V412	F386-L410 HydrophobicContact CE1-CD2 4.44Å; F386-L410 HydrophobicContact CZ-CD2 4.44Å; C406-L410 PolarHBondContact O-N 3.4Å; W407-L410 CarbonylContact O-C 3.48Å; W407-L410 WeakPolarHBondContact O-CA 3.39Å; W407-L410 WeakPolarHBondContact O-CB 3.39Å; W407-L410 PolarHBondContact O-N 3.23Å; N408-L410 VanDerWaalsContact C-N 3.29Å; N408-L410 PolarHBondContact O-N 3.34Å; L410-V412 VanDerWaalsContact C-N 3.33Å; L410-V412 HydrophobicContact CB-CG2 4.05Å
411	G	68.3	Low	76.2	Confident	57 Å²	57	56.5 Å²	56.5	59%	0.588	29%	0.29	S	S	*	.	T	Hydrogen-bonded Turn	trans	74.5	22.3	-179.3	0	0	0	0	0	113.7	W407 N408 P413	W407-G411 PolarHBondContact O-N 3.44Å; W407-G411 VanDerWaalsContact O-N 3.14Å; N408-G411 PolarHBondContact O-N 2.97Å; N408-G411 VanDerWaalsContact O-N 3.16Å; G411-P413 WeakPolarHBondContact O-CD 3.3Å
412	V	67.6	Low	76.2	Confident	4 Å²	4	54.4 Å²	54.4	2%	0.024	28%	0.281	C	S	.	.			trans	-76.6	116.7	175	-170.3	0	0	0	0	108.4	W407 L410 L418	W407-V412 HydrophobicContact CB-CB 4.05Å; W407-V412 HydrophobicContact CB-CG2 4.08Å; W407-V412 HydrophobicContact CG-CG2 4.31Å; W407-V412 PolarHBondContact O-N 3.05Å; W407-V412 VanDerWaalsContact O-N 3.07Å; L410-V412 VanDerWaalsContact C-N 3.33Å; L410-V412 HydrophobicContact CB-CG2 4.05Å; V412-L418 HydrophobicContact CG1-CD2 3.97Å
413	P	68.7	Low	76.4	Confident	58 Å²	58	54.7 Å²	54.7	38%	0.377	30%	0.298	S	S	.	.	S	Bend	trans	-70.4	144.3	174.1	29.7	-32.4	0	0	0	109.9	G411 V415	G411-P413 WeakPolarHBondContact O-CD 3.3Å; P413-V415 PolarHBondContact O-N 2.78Å
414	D	77.3	Confident	76.8	Confident	90 Å²	90	56.1 Å²	56.1	48%	0.481	30%	0.304	S	S	.	.			trans	57.5	52.3	165.9	-155.8	-6.7	0	0	0	114.8	E416 N417 L418	D414-E416 PolarHBondContact O-N 3Å; D414-N417 PolarHBondContact O-N 3.05Å; D414-N417 VanDerWaalsContact O-N 3.12Å; D414-N417 WeakPolarHBondContact OD1-CB 3.37Å; D414-N417 PolarHBondContact OD1-N 2.96Å; D414-N417 PolarHBondContact OD1-ND2 3.13Å; D414-N417 PolarHBondContact OD2-ND2 2.95Å; D414-L418 PolarHBondContact O-N 3.06Å; D414-L418 VanDerWaalsContact O-N 3.11Å
415	V	77.3	Confident	77.1	Confident	3 Å²	3	56.2 Å²	56.2	2%	0.018	31%	0.31	C	S	.	.	H	α-helix	trans	-50.3	-39.3	176.2	176.5	0	0	0	0	112.1	E404 W407 N408 P413 N417 L418 L419	E404-V415 HydrophobicContact CB-CB 4.47Å; E404-V415 HydrophobicContact CB-CG1 3.81Å; E404-V415 HydrophobicContact CG-CB 4.04Å; E404-V415 HydrophobicContact CG-CG1 3.94Å; E404-V415 HydrophobicContact CG-CG2 4.37Å; W407-V415 HydrophobicContact CB-CB 4.37Å; W407-V415 HydrophobicContact CB-CG1 4.13Å; W407-V415 HydrophobicContact CB-CG2 3.4Å; W407-V415 VanDerWaalsContact CB-CG2 3.4Å; W407-V415 HydrophobicContact CD2-CG1 3.98Å; W407-V415 HydrophobicContact CD2-CG2 4.5Å; W407-V415 HydrophobicContact CE3-CB 3.85Å; W407-V415 HydrophobicContact CE3-CG1 3.17Å; W407-V415 HydrophobicContact CE3-CG2 4Å; W407-V415 HydrophobicContact CG-CG1 4.41Å; W407-V415 HydrophobicContact CG-CG2 4.35Å; W407-V415 HydrophobicContact CZ3-CG1 3.79Å; N408-V415 WeakPolarHBondContact OD1-CG2 3.44Å; P413-V415 PolarHBondContact O-N 2.78Å; V415-N417 VanDerWaalsContact C-N 3.35Å; V415-N417 PolarHBondContact O-N 3.18Å; V415-L418 PolarHBondContact O-N 3.33Å; V415-L418 VanDerWaalsContact O-N 3.16Å; V415-L419 HydrophobicContact CG1-CD1 4.14Å; V415-L419 HydrophobicContact CG1-CG 4.29Å; V415-L419 PolarHBondContact O-N 3.47Å
416	E	78.5	Confident	77.1	Confident	81 Å²	81	55.8 Å²	55.8	38%	0.379	30%	0.304	S	S	.	.	H	α-helix	trans	-59.6	-44.7	-179	-171.4	-175.8	173.9	0	0	111.7	D414 K420 K426	D414-E416 PolarHBondContact O-N 3Å; E416-K420 WeakPolarHBondContact O-CB 3.39Å; E416-K420 PolarHBondContact O-N 2.93Å; E416-K420 VanDerWaalsContact O-N 3.11Å; E416-K426 HydrophobicContact CG-CB 4.37Å; E416-K426 HydrophobicContact CG-CD 3.77Å; E416-K426 HydrophobicContact CG-CG 3.79Å; E416-K426 WeakPolarHBondContact OE1-CD 3.41Å; E416-K426 WeakPolarHBondContact OE1-CE 3.35Å; E416-K426 IonicContact OE1-NZ 3.46Å; E416-K426 PolarHBondContact OE1-NZ 3.3Å
417	N	78.4	Confident	77.4	Confident	81 Å²	81	61.9 Å²	61.9	43%	0.433	33%	0.333	S	S	.	.	H	α-helix	trans	-72	-33.6	175.7	-78.9	-28.5	0	0	0	112.2	D414 V415 K420 Y421	D414-N417 PolarHBondContact O-N 3.05Å; D414-N417 VanDerWaalsContact O-N 3.12Å; D414-N417 WeakPolarHBondContact OD1-CB 3.37Å; D414-N417 PolarHBondContact OD1-N 2.96Å; D414-N417 PolarHBondContact OD1-ND2 3.13Å; D414-N417 PolarHBondContact OD2-ND2 2.95Å; V415-N417 VanDerWaalsContact C-N 3.35Å; V415-N417 PolarHBondContact O-N 3.18Å; N417-K420 PolarHBondContact O-N 2.87Å; N417-Y421 WeakPolarHBondContact O-CB 3.41Å; N417-Y421 PolarHBondContact O-N 2.95Å
418	L	78.3	Confident	77.7	Confident	8 Å²	8	63.4 Å²	63.4	4%	0.042	35%	0.348	C	S	.	.	H	α-helix	trans	-65.2	-45.8	175.2	-179.4	57.3	0	0	0	111.9	W407 V412 D414 V415 K420 Y421 L422 Y448 V453 I457	W407-L418 HydrophobicContact CD2-CD2 4.33Å; W407-L418 HydrophobicContact CE3-CB 4.34Å; W407-L418 HydrophobicContact CE3-CD2 3.64Å; W407-L418 HydrophobicContact CE3-CG 4.18Å; W407-L418 HydrophobicContact CH2-CD2 3.76Å; W407-L418 HydrophobicContact CH2-CG 3.83Å; W407-L418 HydrophobicContact CZ2-CD2 4.34Å; W407-L418 HydrophobicContact CZ3-CB 3.76Å; W407-L418 HydrophobicContact CZ3-CD2 3.36Å; W407-L418 HydrophobicContact CZ3-CG 3.45Å; W407-L418 VanDerWaalsContact CZ3-CG 3.45Å; V412-L418 HydrophobicContact CG1-CD2 3.97Å; D414-L418 PolarHBondContact O-N 3.06Å; D414-L418 VanDerWaalsContact O-N 3.11Å; V415-L418 PolarHBondContact O-N 3.33Å; V415-L418 VanDerWaalsContact O-N 3.16Å; L418-K420 VanDerWaalsContact C-N 3.33Å; L418-K420 PolarHBondContact O-N 3Å; L418-Y421 PolarHBondContact O-N 3.23Å; L418-L422 HydrophobicContact CD1-CD1 4.17Å; L418-L422 HydrophobicContact CD1-CG 4.29Å; L418-L422 HydrophobicContact CG-CD1 4.17Å; L418-L422 VanDerWaalsContact O-CG 3.3Å; L418-L422 WeakPolarHBondContact O-CG 3.38Å; L418-L422 PolarHBondContact O-N 2.91Å; L418-Y448 HydrophobicContact CD1-CE1 3.97Å; L418-Y448 WeakPolarHBondContact CD1-OH 3.5Å; L418-V453 HydrophobicContact CD1-CG1 3.92Å; L418-V453 HydrophobicContact CD2-CG1 4.33Å; L418-I457 HydrophobicContact CD1-CD1 3.84Å; L418-I457 HydrophobicContact CD1-CG1 3.98Å; L418-I457 HydrophobicContact CD2-CG1 3.92Å
419	L	83.4	Confident	78.1	Confident	2 Å²	2	64.9 Å²	64.9	1%	0.01	35%	0.354	C	S	.	.	H	α-helix	trans	-59.9	-44.7	174.6	-75.2	177.1	0	0	0	111.3	A400 I403 W407 V415 Y421 L422 G423 F424 I430 L435	A400-L419 HydrophobicContact CB-CD1 4.37Å; I403-L419 HydrophobicContact CG2-CD1 4.49Å; I403-L419 HydrophobicContact CG2-CD2 4.14Å; W407-L419 HydrophobicContact CH2-CD2 3.64Å; W407-L419 HydrophobicContact CH2-CG 4.16Å; W407-L419 HydrophobicContact CZ3-CD2 3.78Å; W407-L419 HydrophobicContact CZ3-CG 3.75Å; V415-L419 HydrophobicContact CG1-CD1 4.14Å; V415-L419 HydrophobicContact CG1-CG 4.29Å; V415-L419 PolarHBondContact O-N 3.47Å; L419-Y421 VanDerWaalsContact C-N 3.34Å; L419-Y421 PolarHBondContact O-N 2.98Å; L419-L422 CarbonylContact O-C 3.57Å; L419-L422 PolarHBondContact O-N 3.18Å; L419-G423 PolarHBondContact O-N 3.37Å; L419-G423 VanDerWaalsContact O-N 3.17Å; L419-F424 HydrophobicContact CB-CB 4.37Å; L419-F424 HydrophobicContact CD2-CB 4.24Å; L419-F424 PolarHBondContact O-N 3.07Å; L419-I430 HydrophobicContact CD1-CD1 4.13Å; L419-I430 HydrophobicContact CD2-CD1 3.88Å; L419-L435 HydrophobicContact CD2-CD1 4.33Å
420	K	82	Confident	78.7	Confident	131 Å²	131	58.6 Å²	58.6	57%	0.57	33%	0.327	S	S	*	.	H	α-helix	trans	-61.9	-41	177.2	-173.7	-176.6	177.1	-170.7	0	112.1	E416 N417 L418 L422 G423	E416-K420 WeakPolarHBondContact O-CB 3.39Å; E416-K420 PolarHBondContact O-N 2.93Å; E416-K420 VanDerWaalsContact O-N 3.11Å; N417-K420 PolarHBondContact O-N 2.87Å; L418-K420 VanDerWaalsContact C-N 3.33Å; L418-K420 PolarHBondContact O-N 3Å; K420-L422 VanDerWaalsContact C-N 3.34Å; K420-G423 PolarHBondContact O-N 2.88Å; K420-G423 VanDerWaalsContact O-N 3.1Å
421	Y	79.6	Confident	79.7	Confident	135 Å²	135	57.8 Å²	57.8	53%	0.529	32%	0.322	S	S	.	.	H	α-helix	trans	-63.3	-41.6	176.6	178.5	-84.7	0	0	0	111.6	N417 L418 L419 G423 T447 Y448	N417-Y421 WeakPolarHBondContact O-CB 3.41Å; N417-Y421 PolarHBondContact O-N 2.95Å; L418-Y421 PolarHBondContact O-N 3.23Å; L419-Y421 VanDerWaalsContact C-N 3.34Å; L419-Y421 PolarHBondContact O-N 2.98Å; Y421-G423 PolarHBondContact O-N 2.83Å; Y421-T447 PolarHBondContact OH-OG1 3.18Å; Y421-T447 VanDerWaalsContact OH-OG1 3.1Å; Y421-Y448 HydrophobicContact CD1-CE1 4.28Å; Y421-Y448 AromaticContact CD1-CZ 3.71Å; Y421-Y448 WeakPolarHBondContact CD1-OH 3.32Å; Y421-Y448 HydrophobicContact CE1-CE1 4.22Å; Y421-Y448 HydrophobicContact CE1-CE2 4.03Å; Y421-Y448 AromaticContact CE1-CZ 3.49Å; Y421-Y448 VanDerWaalsContact CE1-CZ 3.49Å; Y421-Y448 WeakPolarHBondContact CE1-OH 3.43Å
422	L	82.3	Confident	80.3	Confident	22 Å²	22	55.4 Å²	55.4	12%	0.115	30%	0.296	C	S	.	.	T	Hydrogen-bonded Turn	trans	-71.9	-1.5	175.2	-64.6	171	0	0	0	113.1	W407 L418 L419 K420 F424 L435 A438 L439 A442	W407-L422 HydrophobicContact CH2-CD1 3.9Å; L418-L422 HydrophobicContact CD1-CD1 4.17Å; L418-L422 HydrophobicContact CD1-CG 4.29Å; L418-L422 HydrophobicContact CG-CD1 4.17Å; L418-L422 VanDerWaalsContact O-CG 3.3Å; L418-L422 WeakPolarHBondContact O-CG 3.38Å; L418-L422 PolarHBondContact O-N 2.91Å; L419-L422 CarbonylContact O-C 3.57Å; L419-L422 PolarHBondContact O-N 3.18Å; K420-L422 VanDerWaalsContact C-N 3.34Å; L422-F424 HydrophobicContact CB-CD2 3.66Å; L422-F424 HydrophobicContact CB-CE2 3.96Å; L422-F424 WeakPolarHBondContact O-CD2 3.43Å; L422-F424 VanDerWaalsContact O-CE2 3.27Å; L422-F424 WeakPolarHBondContact O-CE2 3.38Å; L422-L435 HydrophobicContact CD1-CD1 4.19Å; L422-A438 HydrophobicContact CB-CB 4.41Å; L422-A438 HydrophobicContact CD2-CB 4.3Å; L422-L439 HydrophobicContact CD1-CD2 3.58Å; L422-L439 HydrophobicContact CD1-CG 4.29Å; L422-A442 HydrophobicContact CD2-CB 3.76Å
423	G	84.6	Confident	81	Confident	65 Å²	65	60.1 Å²	60.1	67%	0.67	32%	0.321	S	S	*	.	T	Hydrogen-bonded Turn	trans	84.2	15.8	177.8	0	0	0	0	0	114.8	L419 K420 Y421	L419-G423 PolarHBondContact O-N 3.37Å; L419-G423 VanDerWaalsContact O-N 3.17Å; K420-G423 PolarHBondContact O-N 2.88Å; K420-G423 VanDerWaalsContact O-N 3.1Å; Y421-G423 PolarHBondContact O-N 2.83Å
424	F	87.3	Confident	81.8	Confident	30 Å²	30	62.7 Å²	62.7	13%	0.132	33%	0.328	C	S	.	.			trans	-98.3	149.5	-179.4	-67.5	-82.3	0	0	0	112.8	L419 L422 I430 H434 L435 A438	L419-F424 HydrophobicContact CB-CB 4.37Å; L419-F424 HydrophobicContact CD2-CB 4.24Å; L419-F424 PolarHBondContact O-N 3.07Å; L422-F424 HydrophobicContact CB-CD2 3.66Å; L422-F424 HydrophobicContact CB-CE2 3.96Å; L422-F424 WeakPolarHBondContact O-CD2 3.43Å; L422-F424 VanDerWaalsContact O-CE2 3.27Å; L422-F424 WeakPolarHBondContact O-CE2 3.38Å; F424-I430 HydrophobicContact CB-CD1 3.95Å; F424-I430 HydrophobicContact CB-CG1 4.31Å; F424-I430 HydrophobicContact CD1-CB 4.37Å; F424-I430 HydrophobicContact CD1-CG1 4.21Å; F424-I430 HydrophobicContact CD1-CG2 3.5Å; F424-I430 VanDerWaalsContact CD1-CG2 3.5Å; F424-I430 HydrophobicContact CE1-CG2 3.81Å; F424-I430 HydrophobicContact CG-CD1 4.45Å; F424-I430 HydrophobicContact CG-CG2 4.2Å; F424-H434 HydrophobicContact CE1-CB 3.98Å; F424-H434 HydrophobicContact CZ-CB 3.93Å; F424-L435 HydrophobicContact CD2-CD1 3.89Å; F424-L435 HydrophobicContact CE1-CB 4.36Å; F424-L435 HydrophobicContact CE2-CB 4.41Å; F424-L435 HydrophobicContact CE2-CD1 3.81Å; F424-L435 HydrophobicContact CG-CD1 4.48Å; F424-L435 VanDerWaalsContact CZ-CA 3.47Å; F424-L435 HydrophobicContact CZ-CB 4.08Å; F424-L435 HydrophobicContact CZ-CD1 4.32Å; F424-A438 HydrophobicContact CE2-CB 3.6Å; F424-A438 HydrophobicContact CZ-CB 4.12Å
425	P	83.8	Confident	82.2	Confident	66 Å²	66	58.4 Å²	58.4	43%	0.429	31%	0.305	S	S	.	.			trans	-67.8	149.1	174.4	30.4	-35.7	0	0	0	111.1	H427 I430	P425-H427 VanDerWaalsContact C-N 3.29Å; P425-H427 PolarHBondContact O-N 3.11Å; P425-I430 HydrophobicContact CG-CG1 4.32Å
426	K	78	Confident	82.5	Confident	76 Å²	76	59.5 Å²	59.5	33%	0.33	31%	0.312	S	S	.	.	S	Bend	trans	-70.1	-25.9	178	-62.2	172.7	165.6	-158.2	0	113.4	A400 E416	A400-K426 VanDerWaalsContact CB-O 3.28Å; A400-K426 WeakPolarHBondContact CB-O 3.35Å; E416-K426 HydrophobicContact CG-CB 4.37Å; E416-K426 HydrophobicContact CG-CD 3.77Å; E416-K426 HydrophobicContact CG-CG 3.79Å; E416-K426 WeakPolarHBondContact OE1-CD 3.41Å; E416-K426 WeakPolarHBondContact OE1-CE 3.35Å; E416-K426 IonicContact OE1-NZ 3.46Å; E416-K426 PolarHBondContact OE1-NZ 3.3Å
427	H	81.3	Confident	82.8	Confident	129 Å²	129	61 Å²	61	60%	0.597	32%	0.319	S	S	*	.	S	Bend	trans	-134.8	149.4	-177.1	-62.2	-57.3	0	0	0	110.4	E401 P425	E401-H427 WeakPolarHBondContact OE1-CA 3.48Å; E401-H427 IonicContact OE1-CG 3.11Å; E401-H427 IonicContact OE1-ND1 2.84Å; E401-H427 PolarHBondContact OE1-ND1 3.33Å; P425-H427 VanDerWaalsContact C-N 3.29Å; P425-H427 PolarHBondContact O-N 3.11Å
428	G	83.1	Confident	83.2	Confident	31 Å²	31	57.9 Å²	57.9	32%	0.32	31%	0.305	S	S	.	.	S	Bend	trans	92	-163.1	175.5	0	0	0	0	0	114	N399 A400 I430	N399-G428 CarbonylContact C-O 3.52Å; N399-G428 WeakPolarHBondContact CA-O 3.27Å; N399-G428 PolarHBondContact OD1-N 2.84Å; N399-G428 PolarHBondContact OD1-O 3.49Å; N399-G428 VanDerWaalsContact OD1-O 3.04Å; A400-G428 PolarHBondContact N-O 2.99Å; G428-I430 PolarHBondContact O-N 2.9Å
429	M	84.3	Confident	83.5	Confident	110 Å²	110	57.5 Å²	57.5	54%	0.542	30%	0.303	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-82.8	120.8	-167.7	-66.6	-98.5	53.5	0	0	111.8	F397 A398 N399	F397-M429 HydrophobicContact CB-CB 4.45Å; F397-M429 HydrophobicContact CB-CE 3.7Å; F397-M429 HydrophobicContact CB-SD 4.07Å; F397-M429 HydrophobicContact CD1-CB 4.49Å; A398-M429 WeakPolarHBondContact O-CE 3.46Å; N399-M429 HydrophobicContact CB-CE 4.34Å; N399-M429 VanDerWaalsContact N-CE 3.26Å
430	I	84.3	Confident	83.5	Confident	1 Å²	1	61.7 Å²	61.7	1%	0.005	32%	0.322	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-101.1	130.5	173.3	-68.3	174.7	0	0	0	108.7	F397 A398 A400 I403 L419 F424 P425 G428 L432 L435	F397-I430 CarbonylContact C-O 3.59Å; F397-I430 WeakPolarHBondContact CA-O 3.46Å; A398-I430 PolarHBondContact N-O 3.28Å; A398-I430 PolarHBondContact O-N 3.27Å; A400-I430 HydrophobicContact CB-CD1 3.71Å; A400-I430 HydrophobicContact CB-CG1 4.3Å; I403-I430 HydrophobicContact CD1-CB 3.82Å; I403-I430 HydrophobicContact CD1-CD1 3.75Å; I403-I430 HydrophobicContact CD1-CG1 4.31Å; I403-I430 HydrophobicContact CD1-CG2 4.01Å; L419-I430 HydrophobicContact CD1-CD1 4.13Å; L419-I430 HydrophobicContact CD2-CD1 3.88Å; F424-I430 HydrophobicContact CB-CD1 3.95Å; F424-I430 HydrophobicContact CB-CG1 4.31Å; F424-I430 HydrophobicContact CD1-CB 4.37Å; F424-I430 HydrophobicContact CD1-CG1 4.21Å; F424-I430 HydrophobicContact CD1-CG2 3.5Å; F424-I430 VanDerWaalsContact CD1-CG2 3.5Å; F424-I430 HydrophobicContact CE1-CG2 3.81Å; F424-I430 HydrophobicContact CG-CD1 4.45Å; F424-I430 HydrophobicContact CG-CG2 4.2Å; P425-I430 HydrophobicContact CG-CG1 4.32Å; G428-I430 PolarHBondContact O-N 2.9Å; I430-L432 PolarHBondContact O-N 3.3Å; I430-L435 HydrophobicContact CG2-CB 3.98Å; I430-L435 HydrophobicContact CG2-CD2 4.18Å
431	N	85.3	Confident	83.6	Confident	34 Å²	34	60 Å²	60	18%	0.182	32%	0.316	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-71.3	119.4	169.1	-175.8	-22.5	0	0	0	109.2	F397 D433 H434 L435	F397-N431 HydrophobicContact CD1-CB 3.94Å; F397-N431 HydrophobicContact CE1-CB 3.71Å; F397-N431 HydrophobicContact CZ-CB 4.47Å; N431-D433 WeakPolarHBondContact OD1-CB 3.31Å; N431-D433 PolarHBondContact OD1-N 3.48Å; N431-H434 HydrophobicContact CB-CB 4.22Å; N431-H434 PolarHBondContact O-N 3.46Å; N431-L435 PolarHBondContact O-N 2.96Å
432	L	81.4	Confident	83.7	Confident	6 Å²	6	54 Å²	54	3%	0.031	29%	0.294	C	S	.	.	H	α-helix	trans	-70.1	-29.2	-177.4	-68.7	178.4	0	0	0	113.3	I390 L392 G396 A398 I403 I430 L435 T436 L464	I390-L432 HydrophobicContact CG2-CD1 4.38Å; L392-L432 HydrophobicContact CD2-CD1 3.33Å; L392-L432 HydrophobicContact CG-CD1 4.41Å; G396-L432 WeakPolarHBondContact O-CB 3.48Å; G396-L432 PolarHBondContact O-N 2.97Å; A398-L432 HydrophobicContact CB-CD1 4.08Å; A398-L432 HydrophobicContact CB-CD2 3.56Å; A398-L432 HydrophobicContact CB-CG 3.93Å; I403-L432 HydrophobicContact CD1-CD2 4.35Å; I430-L432 PolarHBondContact O-N 3.3Å; L432-L435 HydrophobicContact CD2-CD2 4.17Å; L432-L435 PolarHBondContact O-N 3.38Å; L432-T436 WeakPolarHBondContact O-CB 3.24Å; L432-T436 PolarHBondContact O-N 3.12Å; L432-T436 PolarHBondContact O-OG1 3.46Å; L432-L464 HydrophobicContact CD2-CD2 4.01Å
433	D	81.1	Confident	83.7	Confident	104 Å²	104	54.4 Å²	54.4	56%	0.556	30%	0.296	S	S	*	.	H	α-helix	trans	-67.2	-44.6	177	-62.6	-17.3	0	0	0	109.5	N431 L435 T436 Q437	N431-D433 WeakPolarHBondContact OD1-CB 3.31Å; N431-D433 PolarHBondContact OD1-N 3.48Å; D433-L435 VanDerWaalsContact C-N 3.35Å; D433-T436 PolarHBondContact O-N 3.25Å; D433-Q437 WeakPolarHBondContact O-CB 3.43Å; D433-Q437 PolarHBondContact O-N 2.89Å
434	H	85.5	Confident	83.6	Confident	111 Å²	111	57.4 Å²	57.4	51%	0.514	29%	0.293	S	S	.	.	H	α-helix	trans	-65.6	-39.3	174.9	-65.9	-177	0	0	0	111.4	F424 N431 Q437 A438	F424-H434 HydrophobicContact CE1-CB 3.98Å; F424-H434 HydrophobicContact CZ-CB 3.93Å; N431-H434 HydrophobicContact CB-CB 4.22Å; N431-H434 PolarHBondContact O-N 3.46Å; H434-Q437 PolarHBondContact O-N 2.78Å; H434-A438 WeakPolarHBondContact O-CB 3.28Å; H434-A438 PolarHBondContact O-N 3.07Å
435	L	86	Confident	83.1	Confident	0 Å²	0	62.6 Å²	62.6	0%	0	32%	0.319	C	S	.	.	H	α-helix	trans	-64.1	-46	176.9	-179.5	62.2	0	0	0	111.1	I403 L419 L422 F424 I430 N431 L432 D433 Q437 A438 L439 L464	I403-L435 HydrophobicContact CD1-CD2 3.81Å; I403-L435 HydrophobicContact CG1-CD2 4.42Å; I403-L435 HydrophobicContact CG2-CD2 4.49Å; L419-L435 HydrophobicContact CD2-CD1 4.33Å; L422-L435 HydrophobicContact CD1-CD1 4.19Å; F424-L435 HydrophobicContact CD2-CD1 3.89Å; F424-L435 HydrophobicContact CE1-CB 4.36Å; F424-L435 HydrophobicContact CE2-CB 4.41Å; F424-L435 HydrophobicContact CE2-CD1 3.81Å; F424-L435 HydrophobicContact CG-CD1 4.48Å; F424-L435 VanDerWaalsContact CZ-CA 3.47Å; F424-L435 HydrophobicContact CZ-CB 4.08Å; F424-L435 HydrophobicContact CZ-CD1 4.32Å; I430-L435 HydrophobicContact CG2-CB 3.98Å; I430-L435 HydrophobicContact CG2-CD2 4.18Å; N431-L435 PolarHBondContact O-N 2.96Å; L432-L435 HydrophobicContact CD2-CD2 4.17Å; L432-L435 PolarHBondContact O-N 3.38Å; D433-L435 VanDerWaalsContact C-N 3.35Å; L435-Q437 VanDerWaalsContact C-N 3.3Å; L435-Q437 PolarHBondContact O-N 2.88Å; L435-A438 PolarHBondContact O-N 3.21Å; L435-L439 HydrophobicContact CD1-CD1 4.25Å; L435-L439 HydrophobicContact CD1-CG 4.21Å; L435-L439 HydrophobicContact CG-CD1 3.96Å; L435-L439 HydrophobicContact CG-CG 4.37Å; L435-L439 WeakPolarHBondContact O-CB 3.47Å; L435-L439 WeakPolarHBondContact O-CG 3.35Å; L435-L439 PolarHBondContact O-N 3.1Å; L435-L464 HydrophobicContact CD2-CD1 4.26Å; L435-L464 HydrophobicContact CG-CD1 4.32Å
436	T	83.2	Confident	82.3	Confident	27 Å²	27	64.5 Å²	64.5	17%	0.166	33%	0.326	C	S	.	.	H	α-helix	trans	-57.1	-46.1	175.4	-55.9	0	0	0	0	110.5	L432 D433 L439 H440 L464	L432-T436 WeakPolarHBondContact O-CB 3.24Å; L432-T436 PolarHBondContact O-N 3.12Å; L432-T436 PolarHBondContact O-OG1 3.46Å; D433-T436 PolarHBondContact O-N 3.25Å; T436-L439 PolarHBondContact O-N 2.97Å; T436-H440 WeakPolarHBondContact O-CB 3.48Å; T436-H440 PolarHBondContact O-N 2.84Å; T436-L464 HydrophobicContact CG2-CB 4.48Å; T436-L464 WeakPolarHBondContact OG1-CD1 3.4Å
437	Q	85.4	Confident	81.7	Confident	111 Å²	111	64 Å²	64	52%	0.519	33%	0.329	S	S	.	.	H	α-helix	trans	-61.9	-48.1	177	-176.5	176.3	-7.2	0	0	112	D433 H434 L435 L439 H440 E441	D433-Q437 WeakPolarHBondContact O-CB 3.43Å; D433-Q437 PolarHBondContact O-N 2.89Å; H434-Q437 PolarHBondContact O-N 2.78Å; L435-Q437 VanDerWaalsContact C-N 3.3Å; L435-Q437 PolarHBondContact O-N 2.88Å; Q437-L439 VanDerWaalsContact C-N 3.31Å; Q437-L439 PolarHBondContact O-N 2.83Å; Q437-H440 WeakPolarHBondContact O-CB 3.44Å; Q437-H440 PolarHBondContact O-N 2.91Å; Q437-H440 VanDerWaalsContact O-N 3.11Å; Q437-E441 HydrophobicContact CG-CG 4.49Å; Q437-E441 WeakPolarHBondContact CG-OE1 3.29Å; Q437-E441 PolarHBondContact NE2-OE1 2.61Å; Q437-E441 WeakPolarHBondContact O-CG 3.46Å; Q437-E441 PolarHBondContact O-N 3.29Å
438	A	86.4	Confident	81	Confident	17 Å²	17	59.5 Å²	59.5	14%	0.14	31%	0.307	C	S	.	.	H	α-helix	trans	-62.9	-37.7	178.9	0	0	0	0	0	112.3	L422 F424 H434 L435 H440 A442	L422-A438 HydrophobicContact CB-CB 4.41Å; L422-A438 HydrophobicContact CD2-CB 4.3Å; F424-A438 HydrophobicContact CE2-CB 3.6Å; F424-A438 HydrophobicContact CZ-CB 4.12Å; H434-A438 WeakPolarHBondContact O-CB 3.28Å; H434-A438 PolarHBondContact O-N 3.07Å; L435-A438 PolarHBondContact O-N 3.21Å; A438-H440 VanDerWaalsContact C-N 3.34Å; A438-A442 WeakPolarHBondContact O-CB 3.49Å; A438-A442 PolarHBondContact O-N 3.4Å
439	L	84.4	Confident	80.3	Confident	0 Å²	0	66 Å²	66	0%	0	34%	0.335	C	S	.	.	H	α-helix	trans	-65.6	-38.3	173.7	-69.6	168.6	0	0	0	111.4	W407 L422 L435 T436 Q437 L443 I457 M460 N461 L464	W407-L439 HydrophobicContact CH2-CD2 4.46Å; W407-L439 HydrophobicContact CZ2-CD2 4.06Å; L422-L439 HydrophobicContact CD1-CD2 3.58Å; L422-L439 HydrophobicContact CD1-CG 4.29Å; L435-L439 HydrophobicContact CD1-CD1 4.25Å; L435-L439 HydrophobicContact CD1-CG 4.21Å; L435-L439 HydrophobicContact CG-CD1 3.96Å; L435-L439 HydrophobicContact CG-CG 4.37Å; L435-L439 WeakPolarHBondContact O-CB 3.47Å; L435-L439 WeakPolarHBondContact O-CG 3.35Å; L435-L439 PolarHBondContact O-N 3.1Å; T436-L439 PolarHBondContact O-N 2.97Å; Q437-L439 VanDerWaalsContact C-N 3.31Å; Q437-L439 PolarHBondContact O-N 2.83Å; L439-L443 VanDerWaalsContact O-CG 3.26Å; L439-L443 WeakPolarHBondContact O-CG 3.44Å; L439-L443 PolarHBondContact O-N 3.38Å; L439-L443 VanDerWaalsContact O-N 3.09Å; L439-I457 HydrophobicContact CB-CG2 4.31Å; L439-I457 HydrophobicContact CD2-CB 4.25Å; L439-I457 HydrophobicContact CD2-CG1 4.2Å; L439-I457 HydrophobicContact CD2-CG2 3.73Å; L439-M460 HydrophobicContact CD1-CB 3.99Å; L439-M460 HydrophobicContact CD1-CG 3.6Å; L439-N461 HydrophobicContact CB-CB 4.22Å; L439-L464 HydrophobicContact CD1-CD1 3.84Å
440	H	83.4	Confident	79.6	Confident	90 Å²	90	66.2 Å²	66.2	42%	0.417	33%	0.334	S	S	.	.	H	α-helix	trans	-64.4	-50	175.5	-163.3	88.1	0	0	0	111.4	T436 Q437 A438 A442 L443 E444	T436-H440 WeakPolarHBondContact O-CB 3.48Å; T436-H440 PolarHBondContact O-N 2.84Å; Q437-H440 WeakPolarHBondContact O-CB 3.44Å; Q437-H440 PolarHBondContact O-N 2.91Å; Q437-H440 VanDerWaalsContact O-N 3.11Å; A438-H440 VanDerWaalsContact C-N 3.34Å; H440-A442 VanDerWaalsContact C-N 3.31Å; H440-A442 PolarHBondContact O-N 3.09Å; H440-L443 WeakPolarHBondContact O-CB 3.37Å; H440-L443 PolarHBondContact O-N 3.27Å; H440-E444 IonicContact CD2-OE1 2.73Å; H440-E444 IonicContact NE2-OE1 3.83Å; H440-E444 PolarHBondContact NE2-OE1 3.37Å; H440-E444 PolarHBondContact O-N 3.5Å
441	E	84.9	Confident	79	Confident	96 Å²	96	71.1 Å²	71.1	45%	0.449	37%	0.366	S	S	.	.	H	α-helix	trans	-59.2	-42.2	176.7	-70	174.9	-167	0	0	111.3	Q437 L443 E444 M445	Q437-E441 HydrophobicContact CG-CG 4.49Å; Q437-E441 WeakPolarHBondContact CG-OE1 3.29Å; Q437-E441 PolarHBondContact NE2-OE1 2.61Å; Q437-E441 WeakPolarHBondContact O-CG 3.46Å; Q437-E441 PolarHBondContact O-N 3.29Å; E441-L443 VanDerWaalsContact C-N 3.29Å; E441-L443 PolarHBondContact O-N 3.42Å; E441-E444 PolarHBondContact O-N 3.19Å; E441-M445 VanDerWaalsContact O-CG 3.3Å; E441-M445 WeakPolarHBondContact O-CG 3.26Å; E441-M445 PolarHBondContact O-N 3.35Å
442	A	81.5	Confident	78.2	Confident	8 Å²	8	71.5 Å²	71.5	7%	0.066	37%	0.372	C	S	.	.	H	α-helix	trans	-59.6	-36.3	174.6	0	0	0	0	0	113.2	L422 A438 H440 Y448 I457	L422-A442 HydrophobicContact CD2-CB 3.76Å; A438-A442 WeakPolarHBondContact O-CB 3.49Å; A438-A442 PolarHBondContact O-N 3.4Å; H440-A442 VanDerWaalsContact C-N 3.31Å; H440-A442 PolarHBondContact O-N 3.09Å; A442-Y448 HydrophobicContact CB-CE2 4Å; A442-I457 HydrophobicContact CB-CG2 4.47Å
443	L	82.1	Confident	77.8	Confident	31 Å²	31	72.2 Å²	72.2	16%	0.162	38%	0.376	C	S	.	.	H	α-helix	trans	-75.6	-36.2	176.6	-71	171.2	0	0	0	112.8	L439 H440 E441 N446 L454 I457 R458 N461	L439-L443 VanDerWaalsContact O-CG 3.26Å; L439-L443 WeakPolarHBondContact O-CG 3.44Å; L439-L443 PolarHBondContact O-N 3.38Å; L439-L443 VanDerWaalsContact O-N 3.09Å; H440-L443 WeakPolarHBondContact O-CB 3.37Å; H440-L443 PolarHBondContact O-N 3.27Å; E441-L443 VanDerWaalsContact C-N 3.29Å; E441-L443 PolarHBondContact O-N 3.42Å; L443-N446 PolarHBondContact O-N 3.5Å; L443-N446 PolarHBondContact O-OD1 3.17Å; L443-L454 HydrophobicContact CD2-CD1 3.7Å; L443-I457 HydrophobicContact CD1-CG2 4.09Å; L443-I457 HydrophobicContact CD2-CB 4.28Å; L443-I457 HydrophobicContact CD2-CG2 3.62Å; L443-I457 HydrophobicContact CG-CG2 3.57Å; L443-R458 HydrophobicContact CD1-CG 4.33Å; L443-R458 HydrophobicContact CD2-CG 3.45Å; L443-R458 VanDerWaalsContact CD2-CG 3.45Å; L443-N461 HydrophobicContact CD1-CB 3.91Å; L443-N461 WeakPolarHBondContact CD1-ND2 3.35Å
444	E	82.3	Confident	77.5	Confident	128 Å²	128	68.6 Å²	68.6	60%	0.598	36%	0.356	S	S	*	.	H	α-helix	trans	-65.6	-43	176.8	-72.5	-170.1	154.5	0	0	111.7	H440 E441 N446	H440-E444 IonicContact CD2-OE1 2.73Å; H440-E444 IonicContact NE2-OE1 3.83Å; H440-E444 PolarHBondContact NE2-OE1 3.37Å; H440-E444 PolarHBondContact O-N 3.5Å; E441-E444 PolarHBondContact O-N 3.19Å; E444-N446 PolarHBondContact O-N 3.4Å; E444-N446 PolarHBondContact O-ND2 2.98Å
445	M	77.7	Confident	76.9	Confident	138 Å²	138	65.6 Å²	65.6	68%	0.68	35%	0.351	S	S	*	.	T	Hydrogen-bonded Turn	trans	-72	-13.4	-178.5	-62.7	-59.9	-64.3	0	0	113.1	E441 T447	E441-M445 VanDerWaalsContact O-CG 3.3Å; E441-M445 WeakPolarHBondContact O-CG 3.26Å; E441-M445 PolarHBondContact O-N 3.35Å; M445-T447 HydrophobicContact CB-CG2 3.66Å; M445-T447 PolarHBondContact O-N 3.5Å; M445-T447 VanDerWaalsContact O-N 3.11Å
446	N	66.7	Low	76.2	Confident	107 Å²	107	65.7 Å²	65.7	57%	0.572	35%	0.352	S	S	*	.	T	Hydrogen-bonded Turn	trans	45.8	38.9	-178.1	-68.8	-72.3	0	0	0	113.3	L443 E444 Y448	L443-N446 PolarHBondContact O-N 3.5Å; L443-N446 PolarHBondContact O-OD1 3.17Å; E444-N446 PolarHBondContact O-N 3.4Å; E444-N446 PolarHBondContact O-ND2 2.98Å; N446-Y448 VanDerWaalsContact C-N 3.27Å; N446-Y448 PolarHBondContact O-N 3.19Å
447	T	64.9	Low	75.9	Confident	64 Å²	64	64.4 Å²	64.4	39%	0.393	34%	0.344	S	S	.	.			trans	-80	0.8	-169.7	48.7	0	0	0	0	115.1	Y421 M445	Y421-T447 PolarHBondContact OH-OG1 3.18Å; Y421-T447 VanDerWaalsContact OH-OG1 3.1Å; M445-T447 HydrophobicContact CB-CG2 3.66Å; M445-T447 PolarHBondContact O-N 3.5Å; M445-T447 VanDerWaalsContact O-N 3.11Å
448	Y	67	Low	75.6	Confident	36 Å²	36	65.7 Å²	65.7	14%	0.141	34%	0.344	C	S	.	.			trans	-105.2	110.7	-171.9	-66.1	-90.8	0	0	0	111.3	L418 Y421 A442 N446 E450 V453 I457	L418-Y448 HydrophobicContact CD1-CE1 3.97Å; L418-Y448 WeakPolarHBondContact CD1-OH 3.5Å; Y421-Y448 HydrophobicContact CD1-CE1 4.28Å; Y421-Y448 AromaticContact CD1-CZ 3.71Å; Y421-Y448 WeakPolarHBondContact CD1-OH 3.32Å; Y421-Y448 HydrophobicContact CE1-CE1 4.22Å; Y421-Y448 HydrophobicContact CE1-CE2 4.03Å; Y421-Y448 AromaticContact CE1-CZ 3.49Å; Y421-Y448 VanDerWaalsContact CE1-CZ 3.49Å; Y421-Y448 WeakPolarHBondContact CE1-OH 3.43Å; A442-Y448 HydrophobicContact CB-CE2 4Å; N446-Y448 VanDerWaalsContact C-N 3.27Å; N446-Y448 PolarHBondContact O-N 3.19Å; Y448-E450 PolarHBondContact O-N 3.21Å; Y448-V453 HydrophobicContact CD1-CB 4.12Å; Y448-V453 HydrophobicContact CD1-CG1 3.37Å; Y448-V453 HydrophobicContact CE1-CG1 3.51Å; Y448-V453 HydrophobicContact CG-CG1 4.16Å; Y448-I457 HydrophobicContact CD1-CD1 4.28Å; Y448-I457 HydrophobicContact CD2-CD1 3.68Å; Y448-I457 HydrophobicContact CE1-CD1 3.9Å; Y448-I457 HydrophobicContact CE2-CD1 3.28Å; Y448-I457 HydrophobicContact CG-CD1 4.13Å
449	D	68	Low	75	Confident	167 Å²	167	67.1 Å²	67.1	89%	0.893	35%	0.354	S	S	*	.			trans	-68.9	-26.3	172.8	-65.7	-38.4	0	0	0	111.9	P451	D449-P451 VanDerWaalsContact O-CD 3.32Å; D449-P451 WeakPolarHBondContact O-CD 3.47Å
450	E	70.9	Confident	74.5	Confident	115 Å²	115	67.1 Å²	67.1	54%	0.537	35%	0.354	S	S	.	.			trans	-88	114.2	-174.4	-169.8	148.9	-157.5	0	0	112	Y448 S452 V453 L454	Y448-E450 PolarHBondContact O-N 3.21Å; E450-S452 VanDerWaalsContact C-N 3.27Å; E450-S452 WeakPolarHBondContact CG-OG 3.34Å; E450-S452 PolarHBondContact O-N 3.36Å; E450-V453 HydrophobicContact CB-CB 4.45Å; E450-V453 HydrophobicContact CB-CG2 4.09Å; E450-V453 HydrophobicContact CG-CG2 4.14Å; E450-V453 PolarHBondContact O-N 3.36Å; E450-L454 PolarHBondContact O-N 2.91Å
451	P	71.8	Confident	74.3	Confident	103 Å²	103	64.2 Å²	64.2	67%	0.669	34%	0.341	S	S	*	.	H	α-helix	trans	-62.5	-30.4	-173.3	-25.2	35.4	0	0	0	114.3	D449 A455	D449-P451 VanDerWaalsContact O-CD 3.32Å; D449-P451 WeakPolarHBondContact O-CD 3.47Å; P451-A455 VanDerWaalsContact O-CB 3.27Å; P451-A455 WeakPolarHBondContact O-CB 3.37Å; P451-A455 PolarHBondContact O-N 2.74Å
452	S	68.5	Low	73.9	Confident	43 Å²	43	64.5 Å²	64.5	30%	0.301	35%	0.345	S	S	.	.	H	α-helix	trans	-68.5	-42.2	179.3	54.9	0	0	0	0	111.6	E450 A455 G456	E450-S452 VanDerWaalsContact C-N 3.27Å; E450-S452 WeakPolarHBondContact CG-OG 3.34Å; E450-S452 PolarHBondContact O-N 3.36Å; S452-A455 PolarHBondContact O-N 2.88Å; S452-G456 PolarHBondContact O-N 3.11Å
453	V	71.5	Confident	73.6	Confident	20 Å²	20	65 Å²	65	12%	0.121	35%	0.346	C	S	.	.	H	α-helix	trans	-64.9	-46.3	176.1	-178.3	0	0	0	0	110.1	L418 Y448 E450 A455 G456 I457	L418-V453 HydrophobicContact CD1-CG1 3.92Å; L418-V453 HydrophobicContact CD2-CG1 4.33Å; Y448-V453 HydrophobicContact CD1-CB 4.12Å; Y448-V453 HydrophobicContact CD1-CG1 3.37Å; Y448-V453 HydrophobicContact CE1-CG1 3.51Å; Y448-V453 HydrophobicContact CG-CG1 4.16Å; E450-V453 HydrophobicContact CB-CB 4.45Å; E450-V453 HydrophobicContact CB-CG2 4.09Å; E450-V453 HydrophobicContact CG-CG2 4.14Å; E450-V453 PolarHBondContact O-N 3.36Å; V453-A455 VanDerWaalsContact C-N 3.34Å; V453-A455 PolarHBondContact O-N 3.32Å; V453-G456 PolarHBondContact O-N 2.93Å; V453-G456 VanDerWaalsContact O-N 3.14Å; V453-I457 HydrophobicContact CG1-CD1 4.04Å; V453-I457 WeakPolarHBondContact O-CG1 3.25Å; V453-I457 PolarHBondContact O-N 3.5Å
454	L	75.5	Confident	73.3	Confident	28 Å²	28	64 Å²	64	15%	0.147	34%	0.34	C	S	.	.	H	α-helix	trans	-61.5	-41.3	176.9	-174.7	62.1	0	0	0	112.2	L443 E450 G456 I457 R458	L443-L454 HydrophobicContact CD2-CD1 3.7Å; E450-L454 PolarHBondContact O-N 2.91Å; L454-G456 VanDerWaalsContact C-N 3.31Å; L454-G456 PolarHBondContact O-N 3.39Å; L454-I457 PolarHBondContact O-N 2.96Å; L454-R458 WeakPolarHBondContact O-CB 3.45Å; L454-R458 VanDerWaalsContact O-CG 3.27Å; L454-R458 WeakPolarHBondContact O-CG 3.49Å; L454-R458 PolarHBondContact O-N 3.16Å
455	A	72.4	Confident	72.9	Confident	49 Å²	49	62.5 Å²	62.5	41%	0.405	33%	0.333	S	S	.	.	H	α-helix	trans	-63.2	-38.6	175	0	0	0	0	0	111.9	P451 S452 V453 R458 S459	P451-A455 VanDerWaalsContact O-CB 3.27Å; P451-A455 WeakPolarHBondContact O-CB 3.37Å; P451-A455 PolarHBondContact O-N 2.74Å; S452-A455 PolarHBondContact O-N 2.88Å; V453-A455 VanDerWaalsContact C-N 3.34Å; V453-A455 PolarHBondContact O-N 3.32Å; A455-R458 PolarHBondContact O-N 2.88Å; A455-S459 WeakPolarHBondContact O-CB 2.99Å; A455-S459 PolarHBondContact O-N 2.99Å; A455-S459 PolarHBondContact O-OG 3.48Å
456	G	72	Confident	72.6	Confident	2 Å²	2	59.4 Å²	59.4	2%	0.021	32%	0.319	C	S	.	.	H	α-helix	trans	-61	-52.3	174.2	0	0	0	0	0	113.5	S452 V453 L454 R458 S459 M460	S452-G456 PolarHBondContact O-N 3.11Å; V453-G456 PolarHBondContact O-N 2.93Å; V453-G456 VanDerWaalsContact O-N 3.14Å; L454-G456 VanDerWaalsContact C-N 3.31Å; L454-G456 PolarHBondContact O-N 3.39Å; G456-R458 VanDerWaalsContact C-N 3.31Å; G456-R458 PolarHBondContact O-N 2.95Å; G456-S459 PolarHBondContact O-N 2.84Å; G456-S459 VanDerWaalsContact O-N 3.17Å; G456-M460 PolarHBondContact O-N 3.38Å
457	I	76.6	Confident	72.8	Confident	0 Å²	0	55 Å²	55	0%	0	30%	0.297	C	S	.	.	H	α-helix	trans	-57.6	-45.7	177.3	-65.5	169	0	0	0	110.4	L418 L439 A442 L443 Y448 V453 L454 S459 M460 N461	L418-I457 HydrophobicContact CD1-CD1 3.84Å; L418-I457 HydrophobicContact CD1-CG1 3.98Å; L418-I457 HydrophobicContact CD2-CG1 3.92Å; L439-I457 HydrophobicContact CB-CG2 4.31Å; L439-I457 HydrophobicContact CD2-CB 4.25Å; L439-I457 HydrophobicContact CD2-CG1 4.2Å; L439-I457 HydrophobicContact CD2-CG2 3.73Å; A442-I457 HydrophobicContact CB-CG2 4.47Å; L443-I457 HydrophobicContact CD1-CG2 4.09Å; L443-I457 HydrophobicContact CD2-CB 4.28Å; L443-I457 HydrophobicContact CD2-CG2 3.62Å; L443-I457 HydrophobicContact CG-CG2 3.57Å; Y448-I457 HydrophobicContact CD1-CD1 4.28Å; Y448-I457 HydrophobicContact CD2-CD1 3.68Å; Y448-I457 HydrophobicContact CE1-CD1 3.9Å; Y448-I457 HydrophobicContact CE2-CD1 3.28Å; Y448-I457 HydrophobicContact CG-CD1 4.13Å; V453-I457 HydrophobicContact CG1-CD1 4.04Å; V453-I457 WeakPolarHBondContact O-CG1 3.25Å; V453-I457 PolarHBondContact O-N 3.5Å; L454-I457 PolarHBondContact O-N 2.96Å; I457-S459 VanDerWaalsContact C-N 3.35Å; I457-S459 PolarHBondContact O-N 3.22Å; I457-M460 PolarHBondContact O-N 3.28Å; I457-N461 VanDerWaalsContact O-CB 3.24Å; I457-N461 WeakPolarHBondContact O-CB 3.44Å; I457-N461 PolarHBondContact O-N 3.1Å
458	R	78.8	Confident	73.1	Confident	137 Å²	137	56.5 Å²	56.5	52%	0.517	30%	0.299	S	S	.	.	H	α-helix	trans	-60.5	-44.4	177.2	-74.7	177.5	-179.9	177	0.9	112.1	L443 L454 A455 G456 L462	L443-R458 HydrophobicContact CD1-CG 4.33Å; L443-R458 HydrophobicContact CD2-CG 3.45Å; L443-R458 VanDerWaalsContact CD2-CG 3.45Å; L454-R458 WeakPolarHBondContact O-CB 3.45Å; L454-R458 VanDerWaalsContact O-CG 3.27Å; L454-R458 WeakPolarHBondContact O-CG 3.49Å; L454-R458 PolarHBondContact O-N 3.16Å; A455-R458 PolarHBondContact O-N 2.88Å; G456-R458 VanDerWaalsContact C-N 3.31Å; G456-R458 PolarHBondContact O-N 2.95Å; R458-L462 VanDerWaalsContact O-CB 3.31Å; R458-L462 WeakPolarHBondContact O-CB 3.41Å; R458-L462 PolarHBondContact O-N 3.35Å
459	S	73.3	Confident	73.3	Confident	48 Å²	48	57.9 Å²	57.9	34%	0.336	31%	0.311	S	S	.	.	H	α-helix	trans	-64.6	-44.4	-178.7	-59.5	0	0	0	0	111.1	A455 G456 I457 L462 E463	A455-S459 WeakPolarHBondContact O-CB 2.99Å; A455-S459 PolarHBondContact O-N 2.99Å; A455-S459 PolarHBondContact O-OG 3.48Å; G456-S459 PolarHBondContact O-N 2.84Å; G456-S459 VanDerWaalsContact O-N 3.17Å; I457-S459 VanDerWaalsContact C-N 3.35Å; I457-S459 PolarHBondContact O-N 3.22Å; S459-L462 PolarHBondContact O-N 2.72Å; S459-E463 WeakPolarHBondContact O-CB 3.38Å; S459-E463 PolarHBondContact O-N 3.36Å
460	M	75.1	Confident	73.4	Confident	0 Å²	0	53 Å²	53	0%	0	28%	0.284	C	S	.	.	H	α-helix	trans	-67.3	-44.9	177.3	-170.3	64.9	137.5	0	0	112.8	I390 I403 C406 W407 L439 G456 I457 L462 E463 L464	I390-M460 HydrophobicContact CD1-CE 3.74Å; I390-M460 HydrophobicContact CD1-SD 4.48Å; I403-M460 HydrophobicContact CB-CE 4.32Å; I403-M460 HydrophobicContact CG1-CE 4.22Å; I403-M460 HydrophobicContact CG2-CE 3.66Å; C406-M460 HydrophobicContact CB-CE 4.5Å; W407-M460 HydrophobicContact CZ2-CB 4.32Å; W407-M460 HydrophobicContact CZ2-CE 4.31Å; W407-M460 HydrophobicContact CZ2-CG 4Å; W407-M460 PolarHBondContact NE1-SD 3.29Å; L439-M460 HydrophobicContact CD1-CB 3.99Å; L439-M460 HydrophobicContact CD1-CG 3.6Å; G456-M460 PolarHBondContact O-N 3.38Å; I457-M460 PolarHBondContact O-N 3.28Å; M460-L462 VanDerWaalsContact C-N 3.27Å; M460-L462 PolarHBondContact O-N 3.42Å; M460-E463 PolarHBondContact O-N 3.46Å; M460-E463 VanDerWaalsContact O-N 3.11Å; M460-L464 HydrophobicContact CG-CD1 4.01Å; M460-L464 HydrophobicContact CG-CG 4.32Å; M460-L464 WeakPolarHBondContact O-CG 3.46Å; M460-L464 PolarHBondContact O-N 2.95Å; M460-L464 HydrophobicContact SD-CG 4.48Å
461	N	79.6	Confident	73.4	Confident	28 Å²	28	54.6 Å²	54.6	15%	0.15	29%	0.29	C	S	.	.	H	α-helix	trans	-60.1	-42.4	178.9	-173.4	45	0	0	0	110.7	L439 L443 I457 E463 H465	L439-N461 HydrophobicContact CB-CB 4.22Å; L443-N461 HydrophobicContact CD1-CB 3.91Å; L443-N461 WeakPolarHBondContact CD1-ND2 3.35Å; I457-N461 VanDerWaalsContact O-CB 3.24Å; I457-N461 WeakPolarHBondContact O-CB 3.44Å; I457-N461 PolarHBondContact O-N 3.1Å; N461-E463 VanDerWaalsContact C-N 3.34Å; N461-E463 PolarHBondContact O-N 2.75Å; N461-H465 VanDerWaalsContact O-CB 3.24Å; N461-H465 WeakPolarHBondContact O-CB 3.44Å; N461-H465 PolarHBondContact O-N 3.04Å
462	L	76.6	Confident	73.5	Confident	102 Å²	102	53.7 Å²	53.7	53%	0.534	28%	0.279	S	S	.	.	H	α-helix	trans	-61.6	-42.3	174	-179.3	63.1	0	0	0	111.8	R458 S459 M460 H465 L466	R458-L462 VanDerWaalsContact O-CB 3.31Å; R458-L462 WeakPolarHBondContact O-CB 3.41Å; R458-L462 PolarHBondContact O-N 3.35Å; S459-L462 PolarHBondContact O-N 2.72Å; M460-L462 VanDerWaalsContact C-N 3.27Å; M460-L462 PolarHBondContact O-N 3.42Å; L462-H465 PolarHBondContact O-N 3.36Å; L462-L466 HydrophobicContact CD1-CD1 4.1Å; L462-L466 HydrophobicContact CD1-CG 4.13Å; L462-L466 HydrophobicContact CG-CD1 3.95Å; L462-L466 HydrophobicContact CG-CG 4.38Å; L462-L466 WeakPolarHBondContact O-CB 3.24Å; L462-L466 VanDerWaalsContact O-CG 3.24Å; L462-L466 WeakPolarHBondContact O-CG 3.29Å; L462-L466 PolarHBondContact O-N 3.14Å
463	E	74.3	Confident	73.6	Confident	19 Å²	19	53.9 Å²	53.9	9%	0.089	28%	0.283	C	S	.	.	H	α-helix	trans	-67.1	-45.2	-179.5	-177.3	158.3	177.2	0	0	113	F386 F387 S459 M460 N461 H465 L466 T467	F386-E463 WeakPolarHBondContact CA-OE1 3.3Å; F386-E463 WeakPolarHBondContact CB-OE1 3.35Å; F386-E463 WeakPolarHBondContact CB-OE2 3.45Å; F387-E463 HydrophobicContact CD2-CG 4.14Å; F387-E463 HydrophobicContact CE2-CG 4.09Å; F387-E463 PolarHBondContact N-OE1 3.37Å; S459-E463 WeakPolarHBondContact O-CB 3.38Å; S459-E463 PolarHBondContact O-N 3.36Å; M460-E463 PolarHBondContact O-N 3.46Å; M460-E463 VanDerWaalsContact O-N 3.11Å; N461-E463 VanDerWaalsContact C-N 3.34Å; N461-E463 PolarHBondContact O-N 2.75Å; E463-H465 VanDerWaalsContact C-N 3.32Å; E463-H465 PolarHBondContact O-N 2.85Å; E463-L466 PolarHBondContact O-N 3.12Å; E463-T467 WeakPolarHBondContact O-CB 3.42Å; E463-T467 PolarHBondContact O-N 3.22Å; E463-T467 PolarHBondContact O-OG1 3.41Å
464	L	76.4	Confident	73.6	Confident	9 Å²	9	59.6 Å²	59.6	5%	0.047	30%	0.304	C	S	.	.	H	α-helix	trans	-62.7	-41.3	175.1	-69.3	174.1	0	0	0	111.1	L432 L435 T436 L439 M460 T467 E468	L432-L464 HydrophobicContact CD2-CD2 4.01Å; L435-L464 HydrophobicContact CD2-CD1 4.26Å; L435-L464 HydrophobicContact CG-CD1 4.32Å; T436-L464 HydrophobicContact CG2-CB 4.48Å; T436-L464 WeakPolarHBondContact OG1-CD1 3.4Å; L439-L464 HydrophobicContact CD1-CD1 3.84Å; M460-L464 HydrophobicContact CG-CD1 4.01Å; M460-L464 HydrophobicContact CG-CG 4.32Å; M460-L464 WeakPolarHBondContact O-CG 3.46Å; M460-L464 PolarHBondContact O-N 2.95Å; M460-L464 HydrophobicContact SD-CG 4.48Å; L464-T467 VanDerWaalsContact O-CB 3.3Å; L464-T467 WeakPolarHBondContact O-CB 3.39Å; L464-T467 PolarHBondContact O-N 3.27Å; L464-E468 PolarHBondContact O-N 3.34Å
465	H	74.1	Confident	73.5	Confident	97 Å²	97	60 Å²	60	45%	0.449	31%	0.314	S	S	.	.	H	α-helix	trans	-66	-47.4	177.3	-171.5	70.5	0	0	0	112.6	N461 L462 E463 T467 E468 V469	N461-H465 VanDerWaalsContact O-CB 3.24Å; N461-H465 WeakPolarHBondContact O-CB 3.44Å; N461-H465 PolarHBondContact O-N 3.04Å; L462-H465 PolarHBondContact O-N 3.36Å; E463-H465 VanDerWaalsContact C-N 3.32Å; E463-H465 PolarHBondContact O-N 2.85Å; H465-T467 PolarHBondContact O-N 2.89Å; H465-E468 PolarHBondContact O-N 3.32Å; H465-V469 VanDerWaalsContact O-CG2 3.31Å; H465-V469 WeakPolarHBondContact O-CG2 3.32Å; H465-V469 PolarHBondContact O-N 3.32Å
466	L	71.3	Confident	73.6	Confident	74 Å²	74	64.9 Å²	64.9	39%	0.387	33%	0.326	S	S	.	.	H	α-helix	trans	-59.4	-34.6	174.7	-74.1	173.2	0	0	0	111.3	F387 L462 E463 L470	F387-L466 HydrophobicContact CE2-CB 4.5Å; F387-L466 HydrophobicContact CZ-CB 4.12Å; L462-L466 HydrophobicContact CD1-CD1 4.1Å; L462-L466 HydrophobicContact CD1-CG 4.13Å; L462-L466 HydrophobicContact CG-CD1 3.95Å; L462-L466 HydrophobicContact CG-CG 4.38Å; L462-L466 WeakPolarHBondContact O-CB 3.24Å; L462-L466 VanDerWaalsContact O-CG 3.24Å; L462-L466 WeakPolarHBondContact O-CG 3.29Å; L462-L466 PolarHBondContact O-N 3.14Å; E463-L466 PolarHBondContact O-N 3.12Å; L466-L470 WeakPolarHBondContact O-CB 3.43Å; L466-L470 VanDerWaalsContact O-CG 3.3Å; L466-L470 WeakPolarHBondContact O-CG 3.36Å; L466-L470 PolarHBondContact O-N 2.83Å
467	T	69.5	Low	73.7	Confident	15 Å²	15	70.7 Å²	70.7	9%	0.092	35%	0.353	C	S	.	.	H	α-helix	trans	-62.1	-50.5	175.2	-60.9	0	0	0	0	112.2	F387 L392 E463 L464 H465 V469 L470 K471	F387-T467 HydrophobicContact CD1-CG2 4.13Å; F387-T467 WeakPolarHBondContact CD1-OG1 3.41Å; F387-T467 HydrophobicContact CE1-CG2 3.86Å; F387-T467 WeakPolarHBondContact CE1-OG1 3.23Å; F387-T467 VanDerWaalsContact CZ-CA 3.44Å; F387-T467 WeakPolarHBondContact CZ-OG1 3.46Å; L392-T467 HydrophobicContact CD1-CG2 3.32Å; L392-T467 HydrophobicContact CD2-CG2 3.91Å; L392-T467 HydrophobicContact CG-CG2 4.16Å; E463-T467 WeakPolarHBondContact O-CB 3.42Å; E463-T467 PolarHBondContact O-N 3.22Å; E463-T467 PolarHBondContact O-OG1 3.41Å; L464-T467 VanDerWaalsContact O-CB 3.3Å; L464-T467 WeakPolarHBondContact O-CB 3.39Å; L464-T467 PolarHBondContact O-N 3.27Å; H465-T467 PolarHBondContact O-N 2.89Å; T467-V469 VanDerWaalsContact C-N 3.33Å; T467-V469 PolarHBondContact O-N 3.16Å; T467-L470 PolarHBondContact O-N 3.46Å; T467-K471 VanDerWaalsContact O-CB 3.3Å; T467-K471 WeakPolarHBondContact O-CB 3.43Å; T467-K471 PolarHBondContact O-N 2.89Å
468	E	71.2	Confident	73.5	Confident	95 Å²	95	75.5 Å²	75.5	44%	0.444	38%	0.378	S	S	.	.	H	α-helix	trans	-62.2	-44.1	179.5	-171.4	177.4	-173.6	0	0	111.2	L464 H465 L470 K471 N472	L464-E468 PolarHBondContact O-N 3.34Å; H465-E468 PolarHBondContact O-N 3.32Å; E468-L470 PolarHBondContact O-N 3.06Å; E468-K471 PolarHBondContact O-N 2.92Å; E468-N472 WeakPolarHBondContact O-CB 3.16Å; E468-N472 PolarHBondContact O-N 2.91Å; E468-N472 PolarHBondContact O-ND2 3.05Å
469	V	71.4	Confident	73.4	Confident	64 Å²	64	74.8 Å²	74.8	39%	0.388	38%	0.38	S	S	.	.	H	α-helix	trans	-60.2	-47.1	177.1	172.6	0	0	0	0	111.3	H465 T467 N472 A473	H465-V469 VanDerWaalsContact O-CG2 3.31Å; H465-V469 WeakPolarHBondContact O-CG2 3.32Å; H465-V469 PolarHBondContact O-N 3.32Å; T467-V469 VanDerWaalsContact C-N 3.33Å; T467-V469 PolarHBondContact O-N 3.16Å; V469-N472 PolarHBondContact O-N 3.33Å; V469-A473 WeakPolarHBondContact O-CB 3.04Å; V469-A473 PolarHBondContact O-N 3.25Å
470	L	70.2	Confident	73.7	Confident	65 Å²	65	75.7 Å²	75.7	34%	0.34	38%	0.378	S	S	.	.	H	α-helix	trans	-64.6	-44.3	177.7	-75.5	175.4	0	0	0	111.7	P384 F387 L466 T467 E468 N472 A473 Y474	P384-L470 HydrophobicContact CG-CD1 4.22Å; F387-L470 HydrophobicContact CE1-CD1 3.84Å; F387-L470 HydrophobicContact CZ-CD1 3.78Å; L466-L470 WeakPolarHBondContact O-CB 3.43Å; L466-L470 VanDerWaalsContact O-CG 3.3Å; L466-L470 WeakPolarHBondContact O-CG 3.36Å; L466-L470 PolarHBondContact O-N 2.83Å; T467-L470 PolarHBondContact O-N 3.46Å; E468-L470 PolarHBondContact O-N 3.06Å; L470-N472 VanDerWaalsContact C-N 3.28Å; L470-N472 PolarHBondContact O-N 2.84Å; L470-A473 PolarHBondContact O-N 3.46Å; L470-Y474 HydrophobicContact CB-CD2 4.41Å; L470-Y474 HydrophobicContact CB-CE2 4.45Å; L470-Y474 HydrophobicContact CD2-CE2 4.39Å; L470-Y474 WeakPolarHBondContact O-CD2 3.2Å; L470-Y474 PolarHBondContact O-N 3.42Å
471	K	72	Confident	73.7	Confident	149 Å²	149	82 Å²	82	65%	0.648	41%	0.406	S	S	*	.	H	α-helix	trans	-57	-44.4	175.8	-179.5	-175.1	174.4	-170.7	0	111.1	T467 E468 G475	T467-K471 VanDerWaalsContact O-CB 3.3Å; T467-K471 WeakPolarHBondContact O-CB 3.43Å; T467-K471 PolarHBondContact O-N 2.89Å; E468-K471 PolarHBondContact O-N 2.92Å; K471-G475 PolarHBondContact O-N 3.44Å
472	N	73.9	Confident	73.5	Confident	84 Å²	84	84.6 Å²	84.6	45%	0.449	42%	0.42	S	S	.	.	H	α-helix	trans	-67.8	-39.9	178.4	-71.3	-20	0	0	0	112	E468 V469 L470 G475 K476	E468-N472 WeakPolarHBondContact O-CB 3.16Å; E468-N472 PolarHBondContact O-N 2.91Å; E468-N472 PolarHBondContact O-ND2 3.05Å; V469-N472 PolarHBondContact O-N 3.33Å; L470-N472 VanDerWaalsContact C-N 3.28Å; L470-N472 PolarHBondContact O-N 2.84Å; N472-G475 PolarHBondContact O-N 3.25Å; N472-K476 WeakPolarHBondContact O-CG 3.34Å; N472-K476 PolarHBondContact O-N 3.02Å
473	A	70.3	Confident	73.7	Confident	46 Å²	46	83.7 Å²	83.7	38%	0.38	42%	0.415	S	S	.	.	H	α-helix	trans	-62.6	-51.3	175.5	0	0	0	0	0	111.4	V469 L470 G475 K476 E477	V469-A473 WeakPolarHBondContact O-CB 3.04Å; V469-A473 PolarHBondContact O-N 3.25Å; L470-A473 PolarHBondContact O-N 3.46Å; A473-G475 VanDerWaalsContact C-N 3.32Å; A473-G475 PolarHBondContact O-N 2.96Å; A473-K476 PolarHBondContact O-N 3.24Å; A473-E477 PolarHBondContact O-N 2.91Å
474	Y	71.2	Confident	74	Confident	141 Å²	141	86.7 Å²	86.7	55%	0.553	43%	0.431	S	S	*	.	H	α-helix	trans	-62.2	-38.5	176	-77.8	-64.5	0	0	0	112.2	L470 K476 E477 I478	L470-Y474 HydrophobicContact CB-CD2 4.41Å; L470-Y474 HydrophobicContact CB-CE2 4.45Å; L470-Y474 HydrophobicContact CD2-CE2 4.39Å; L470-Y474 WeakPolarHBondContact O-CD2 3.2Å; L470-Y474 PolarHBondContact O-N 3.42Å; Y474-K476 VanDerWaalsContact C-N 3.35Å; Y474-K476 PolarHBondContact O-N 3.41Å; Y474-E477 PolarHBondContact O-N 3.1Å; Y474-I478 WeakPolarHBondContact O-CB 3.36Å; Y474-I478 VanDerWaalsContact O-CG1 3.23Å; Y474-I478 WeakPolarHBondContact O-CG1 3.45Å; Y474-I478 PolarHBondContact O-N 3.1Å
475	G	73.3	Confident	74.1	Confident	36 Å²	36	89.6 Å²	89.6	37%	0.371	45%	0.446	S	S	.	.	H	α-helix	trans	-57.8	-46.2	175.3	0	0	0	0	0	112.2	K471 N472 A473 I478 E479	K471-G475 PolarHBondContact O-N 3.44Å; N472-G475 PolarHBondContact O-N 3.25Å; A473-G475 VanDerWaalsContact C-N 3.32Å; A473-G475 PolarHBondContact O-N 2.96Å; G475-I478 PolarHBondContact O-N 2.94Å; G475-E479 WeakPolarHBondContact O-CB 3.46Å; G475-E479 PolarHBondContact O-N 3.11Å
476	K	75.6	Confident	74.4	Confident	151 Å²	151	88.6 Å²	88.6	66%	0.657	45%	0.447	S	S	*	.	H	α-helix	trans	-64.6	-39.1	175.6	-71.5	176.1	-179.3	-178.2	0	112.6	N472 A473 Y474 K480	N472-K476 WeakPolarHBondContact O-CG 3.34Å; N472-K476 PolarHBondContact O-N 3.02Å; A473-K476 PolarHBondContact O-N 3.24Å; Y474-K476 VanDerWaalsContact C-N 3.35Å; Y474-K476 PolarHBondContact O-N 3.41Å; K476-K480 WeakPolarHBondContact O-CB 3.1Å; K476-K480 PolarHBondContact O-N 2.83Å
477	E	73.4	Confident	74.8	Confident	125 Å²	125	90.4 Å²	90.4	58%	0.584	45%	0.454	S	S	*	.	H	α-helix	trans	-66.6	-41	176.9	-73.4	-171.1	172	0	0	112.3	A473 Y474 K480 F481	A473-E477 PolarHBondContact O-N 2.91Å; Y474-E477 PolarHBondContact O-N 3.1Å; E477-K480 PolarHBondContact O-N 3.24Å; E477-F481 WeakPolarHBondContact O-CB 3.44Å; E477-F481 PolarHBondContact O-N 2.81Å
478	I	72.7	Confident	75.4	Confident	100 Å²	100	95.1 Å²	95.1	51%	0.513	48%	0.475	S	S	.	.	H	α-helix	trans	-65	-45.6	175.7	-68.2	164.9	0	0	0	110.2	Y474 G475 K480 F481 D482	Y474-I478 WeakPolarHBondContact O-CB 3.36Å; Y474-I478 VanDerWaalsContact O-CG1 3.23Å; Y474-I478 WeakPolarHBondContact O-CG1 3.45Å; Y474-I478 PolarHBondContact O-N 3.1Å; G475-I478 PolarHBondContact O-N 2.94Å; I478-K480 VanDerWaalsContact C-N 3.34Å; I478-K480 PolarHBondContact O-N 3.01Å; I478-F481 WeakPolarHBondContact O-CB 3.37Å; I478-F481 PolarHBondContact O-N 3.03Å; I478-F481 VanDerWaalsContact O-N 3.1Å; I478-D482 PolarHBondContact O-N 3.16Å
479	E	75.7	Confident	75.9	Confident	123 Å²	123	96.2 Å²	96.2	58%	0.575	48%	0.475	S	S	*	.	H	α-helix	trans	-59.7	-44.5	176.6	-176.9	176.5	-161.9	0	0	111.5	G475 F481 D482 I483	G475-E479 WeakPolarHBondContact O-CB 3.46Å; G475-E479 PolarHBondContact O-N 3.11Å; E479-F481 VanDerWaalsContact C-N 3.3Å; E479-F481 PolarHBondContact O-N 2.85Å; E479-D482 PolarHBondContact O-N 2.87Å; E479-I483 HydrophobicContact CG-CD1 4.09Å; E479-I483 VanDerWaalsContact O-CG1 3.3Å; E479-I483 WeakPolarHBondContact O-CG1 3.14Å; E479-I483 PolarHBondContact O-N 2.92Å
480	K	79.3	Confident	76.6	Confident	67 Å²	67	97.6 Å²	97.6	29%	0.291	48%	0.477	S	S	.	.	H	α-helix	trans	-60.5	-40.9	174.3	-172.9	-177.8	-176.3	-177.4	0	111.6	S118 K476 E477 I478 N484	S118-K480 PolarHBondContact O-NZ 3.01Å; S118-K480 PolarHBondContact OG-NZ 3.04Å; K476-K480 WeakPolarHBondContact O-CB 3.1Å; K476-K480 PolarHBondContact O-N 2.83Å; E477-K480 PolarHBondContact O-N 3.24Å; I478-K480 VanDerWaalsContact C-N 3.34Å; I478-K480 PolarHBondContact O-N 3.01Å; K480-N484 WeakPolarHBondContact O-CB 3.17Å; K480-N484 PolarHBondContact O-N 3.42Å; K480-N484 PolarHBondContact O-ND2 3.42Å; K480-N484 VanDerWaalsContact O-ND2 3.1Å
481	F	76.5	Confident	77.4	Confident	131 Å²	131	100.3 Å²	100.3	58%	0.575	49%	0.489	S	S	*	.	H	α-helix	trans	-63.9	-44.6	176.6	-178.4	-95.3	0	0	0	111.7	E477 I478 E479 N484 L485	E477-F481 WeakPolarHBondContact O-CB 3.44Å; E477-F481 PolarHBondContact O-N 2.81Å; I478-F481 WeakPolarHBondContact O-CB 3.37Å; I478-F481 PolarHBondContact O-N 3.03Å; I478-F481 VanDerWaalsContact O-N 3.1Å; E479-F481 VanDerWaalsContact C-N 3.3Å; E479-F481 PolarHBondContact O-N 2.85Å; F481-N484 PolarHBondContact O-N 2.8Å; F481-L485 HydrophobicContact CE1-CD2 4.37Å; F481-L485 WeakPolarHBondContact O-CB 3.3Å; F481-L485 PolarHBondContact O-N 3.18Å
482	D	75.3	Confident	77.8	Confident	84 Å²	84	97 Å²	97	45%	0.449	48%	0.478	S	S	.	.	H	α-helix	trans	-64.7	-40.1	179	-75.9	-18.1	0	0	0	112.1	I478 E479 T486	I478-D482 PolarHBondContact O-N 3.16Å; E479-D482 PolarHBondContact O-N 2.87Å; D482-T486 WeakPolarHBondContact O-CB 3.49Å; D482-T486 PolarHBondContact O-N 3.41Å; D482-T486 PolarHBondContact O-OG1 2.9Å
483	I	80.5	Confident	78.3	Confident	83 Å²	83	97 Å²	97	43%	0.426	48%	0.478	S	S	.	.	H	α-helix	trans	-61.9	-51.5	173.9	-67.9	166	0	0	0	110.1	E479 L485 T486 E487	E479-I483 HydrophobicContact CG-CD1 4.09Å; E479-I483 VanDerWaalsContact O-CG1 3.3Å; E479-I483 WeakPolarHBondContact O-CG1 3.14Å; E479-I483 PolarHBondContact O-N 2.92Å; I483-L485 VanDerWaalsContact C-N 3.32Å; I483-L485 PolarHBondContact O-N 2.99Å; I483-T486 WeakPolarHBondContact O-CB 3.44Å; I483-T486 PolarHBondContact O-N 3.36Å; I483-T486 VanDerWaalsContact O-N 3.11Å; I483-E487 HydrophobicContact CG2-CG 4.43Å; I483-E487 WeakPolarHBondContact O-CG 3.45Å; I483-E487 PolarHBondContact O-N 2.89Å
484	N	79.5	Confident	79.1	Confident	81 Å²	81	101.7 Å²	101.7	43%	0.433	49%	0.485	S	S	.	.	H	α-helix	trans	-59.4	-42.5	179.8	-72.6	-29.5	0	0	0	112	K480 F481 T486 E487 E488	K480-N484 WeakPolarHBondContact O-CB 3.17Å; K480-N484 PolarHBondContact O-N 3.42Å; K480-N484 PolarHBondContact O-ND2 3.42Å; K480-N484 VanDerWaalsContact O-ND2 3.1Å; F481-N484 PolarHBondContact O-N 2.8Å; N484-T486 VanDerWaalsContact C-N 3.31Å; N484-T486 PolarHBondContact O-N 2.99Å; N484-E487 PolarHBondContact O-N 3.31Å; N484-E488 WeakPolarHBondContact O-CB 3.39Å; N484-E488 PolarHBondContact O-N 3.22Å
485	L	79.1	Confident	80	Confident	71 Å²	71	101.2 Å²	101.2	37%	0.372	48%	0.483	S	S	.	.	H	α-helix	trans	-64.6	-38.7	177.8	-173.3	70.6	0	0	0	111.3	F481 I483 R489	F481-L485 HydrophobicContact CE1-CD2 4.37Å; F481-L485 WeakPolarHBondContact O-CB 3.3Å; F481-L485 PolarHBondContact O-N 3.18Å; I483-L485 VanDerWaalsContact C-N 3.32Å; I483-L485 PolarHBondContact O-N 2.99Å; L485-R489 VanDerWaalsContact O-CB 3.24Å; L485-R489 WeakPolarHBondContact O-CB 3.47Å; L485-R489 PolarHBondContact O-N 3.41Å
486	T	80.1	Confident	80.7	Confident	76 Å²	76	105.2 Å²	105.2	47%	0.466	49%	0.491	S	S	.	.	H	α-helix	trans	-65.2	-46.9	176.3	-58.8	0	0	0	0	110.8	D482 I483 N484 E488 R489 E490	D482-T486 WeakPolarHBondContact O-CB 3.49Å; D482-T486 PolarHBondContact O-N 3.41Å; D482-T486 PolarHBondContact O-OG1 2.9Å; I483-T486 WeakPolarHBondContact O-CB 3.44Å; I483-T486 PolarHBondContact O-N 3.36Å; I483-T486 VanDerWaalsContact O-N 3.11Å; N484-T486 VanDerWaalsContact C-N 3.31Å; N484-T486 PolarHBondContact O-N 2.99Å; T486-E488 PolarHBondContact O-N 3.44Å; T486-R489 PolarHBondContact O-N 3.46Å; T486-E490 WeakPolarHBondContact O-CG 3.37Å; T486-E490 PolarHBondContact O-N 3.25Å
487	E	81.2	Confident	81.3	Confident	111 Å²	111	104.3 Å²	104.3	52%	0.519	49%	0.489	S	S	.	.	H	α-helix	trans	-61.2	-43.9	176.7	-72.1	-179.3	-177.9	0	0	112.4	I483 N484 E490 M491	I483-E487 HydrophobicContact CG2-CG 4.43Å; I483-E487 WeakPolarHBondContact O-CG 3.45Å; I483-E487 PolarHBondContact O-N 2.89Å; N484-E487 PolarHBondContact O-N 3.31Å; E487-E490 PolarHBondContact O-N 2.89Å; E487-M491 WeakPolarHBondContact O-CB 3.28Å; E487-M491 PolarHBondContact O-N 3.48Å
488	E	80.3	Confident	82.1	Confident	114 Å²	114	103.5 Å²	103.5	53%	0.533	49%	0.485	S	S	.	.	H	α-helix	trans	-63.2	-44.8	176.7	-172.4	177.8	-174.4	0	0	111	N484 T486 E490 M491 I492	N484-E488 WeakPolarHBondContact O-CB 3.39Å; N484-E488 PolarHBondContact O-N 3.22Å; T486-E488 PolarHBondContact O-N 3.44Å; E488-E490 PolarHBondContact O-N 3.43Å; E488-M491 WeakPolarHBondContact O-CB 3.42Å; E488-M491 PolarHBondContact O-N 2.89Å; E488-I492 HydrophobicContact CG-CD1 4.1Å; E488-I492 VanDerWaalsContact O-CG1 3.29Å; E488-I492 WeakPolarHBondContact O-CG1 3.39Å; E488-I492 PolarHBondContact O-N 3.37Å
489	R	82.7	Confident	83	Confident	118 Å²	118	101.6 Å²	101.6	45%	0.445	47%	0.474	S	S	.	.	H	α-helix	trans	-59.1	-46.6	175.2	179.7	177.8	-179.2	-104.5	3.5	111.5	L485 T486 I492 L493	L485-R489 VanDerWaalsContact O-CB 3.24Å; L485-R489 WeakPolarHBondContact O-CB 3.47Å; L485-R489 PolarHBondContact O-N 3.41Å; T486-R489 PolarHBondContact O-N 3.46Å; R489-I492 PolarHBondContact O-N 3.35Å; R489-L493 HydrophobicContact CG-CD1 4.13Å; R489-L493 WeakPolarHBondContact O-CB 3.36Å; R489-L493 VanDerWaalsContact O-CG 3.29Å; R489-L493 WeakPolarHBondContact O-CG 3.4Å; R489-L493 PolarHBondContact O-N 2.87Å
490	E	86	Confident	83.7	Confident	94 Å²	94	100.8 Å²	100.8	44%	0.439	47%	0.473	S	S	.	.	H	α-helix	trans	-63.4	-41.2	177.5	-76.3	-168.1	175.6	0	0	112.5	T486 E487 E488 I492 L493 R494	T486-E490 WeakPolarHBondContact O-CG 3.37Å; T486-E490 PolarHBondContact O-N 3.25Å; E487-E490 PolarHBondContact O-N 2.89Å; E488-E490 PolarHBondContact O-N 3.43Å; E490-I492 VanDerWaalsContact C-N 3.34Å; E490-I492 PolarHBondContact O-N 3.42Å; E490-L493 PolarHBondContact O-N 2.96Å; E490-R494 WeakPolarHBondContact O-CB 3.47Å; E490-R494 WeakPolarHBondContact O-CG 3.34Å; E490-R494 PolarHBondContact O-N 2.97Å; E490-R494 IonicContact OE2-NH1 2.7Å; E490-R494 PolarHBondContact OE2-NH1 2.81Å; E490-R494 VanDerWaalsContact OE2-NH1 3.11Å
491	M	87.5	Confident	84.2	Confident	122 Å²	122	100.9 Å²	100.9	60%	0.601	48%	0.477	S	S	*	.	H	α-helix	trans	-59.1	-47.1	176.2	-174.1	-163.3	-58.3	0	0	111	E487 E488 L493 R494 Y495	E487-M491 WeakPolarHBondContact O-CB 3.28Å; E487-M491 PolarHBondContact O-N 3.48Å; E488-M491 WeakPolarHBondContact O-CB 3.42Å; E488-M491 PolarHBondContact O-N 2.89Å; M491-L493 VanDerWaalsContact C-N 3.35Å; M491-L493 PolarHBondContact O-N 3.33Å; M491-R494 PolarHBondContact O-N 3.36Å; M491-Y495 PolarHBondContact O-N 2.87Å
492	I	80.4	Confident	84.9	Confident	78 Å²	78	97.7 Å²	97.7	40%	0.4	46%	0.463	S	S	.	.	H	α-helix	trans	-60.7	-45.5	177	-69	167.1	0	0	0	110.5	E488 R489 E490 Y495 F496	E488-I492 HydrophobicContact CG-CD1 4.1Å; E488-I492 VanDerWaalsContact O-CG1 3.29Å; E488-I492 WeakPolarHBondContact O-CG1 3.39Å; E488-I492 PolarHBondContact O-N 3.37Å; R489-I492 PolarHBondContact O-N 3.35Å; E490-I492 VanDerWaalsContact C-N 3.34Å; E490-I492 PolarHBondContact O-N 3.42Å; I492-Y495 PolarHBondContact O-N 3.39Å; I492-F496 HydrophobicContact CG2-CD2 3.62Å; I492-F496 HydrophobicContact CG2-CE2 3.54Å; I492-F496 VanDerWaalsContact O-CD2 3.26Å; I492-F496 WeakPolarHBondContact O-CD2 3.31Å; I492-F496 PolarHBondContact O-N 2.83Å
493	L	83.4	Confident	85.6	Confident	86 Å²	86	98.3 Å²	98.3	45%	0.45	47%	0.466	S	S	.	.	H	α-helix	trans	-63.7	-41.4	178.5	-72.2	174	0	0	0	112.3	R489 E490 M491 Y495 F496 H497	R489-L493 HydrophobicContact CG-CD1 4.13Å; R489-L493 WeakPolarHBondContact O-CB 3.36Å; R489-L493 VanDerWaalsContact O-CG 3.29Å; R489-L493 WeakPolarHBondContact O-CG 3.4Å; R489-L493 PolarHBondContact O-N 2.87Å; E490-L493 PolarHBondContact O-N 2.96Å; M491-L493 VanDerWaalsContact C-N 3.35Å; M491-L493 PolarHBondContact O-N 3.33Å; L493-Y495 VanDerWaalsContact C-N 3.35Å; L493-F496 PolarHBondContact O-N 2.84Å; L493-H497 VanDerWaalsContact O-CB 3.28Å; L493-H497 WeakPolarHBondContact O-CB 3.3Å; L493-H497 PolarHBondContact O-N 3.02Å
494	R	87.6	Confident	86.1	Confident	144 Å²	144	102.3 Å²	102.3	54%	0.543	48%	0.475	S	S	.	.	H	α-helix	trans	-60	-45.3	174.4	-76.9	-170.1	-68.6	-98.5	0.8	111.3	E490 M491 H497 Q498	E490-R494 WeakPolarHBondContact O-CB 3.47Å; E490-R494 WeakPolarHBondContact O-CG 3.34Å; E490-R494 PolarHBondContact O-N 2.97Å; E490-R494 IonicContact OE2-NH1 2.7Å; E490-R494 PolarHBondContact OE2-NH1 2.81Å; E490-R494 VanDerWaalsContact OE2-NH1 3.11Å; M491-R494 PolarHBondContact O-N 3.36Å; R494-H497 PolarHBondContact O-N 3.47Å; R494-Q498 WeakPolarHBondContact O-CB 3.37Å; R494-Q498 PolarHBondContact O-N 2.69Å
495	Y	89.7	Confident	86.7	Confident	130 Å²	130	103.5 Å²	103.5	51%	0.51	48%	0.478	S	S	.	.	H	α-helix	trans	-59.7	-50.8	176.5	175.6	-100	0	0	0	111.8	M491 I492 L493 H497 Q498 Q499	M491-Y495 PolarHBondContact O-N 2.87Å; I492-Y495 PolarHBondContact O-N 3.39Å; L493-Y495 VanDerWaalsContact C-N 3.35Å; Y495-H497 VanDerWaalsContact C-N 3.31Å; Y495-H497 PolarHBondContact O-N 2.81Å; Y495-Q498 PolarHBondContact O-N 2.89Å; Y495-Q499 HydrophobicContact CD1-CG 4.24Å; Y495-Q499 HydrophobicContact CD2-CG 4.42Å; Y495-Q499 HydrophobicContact CE1-CG 3.8Å; Y495-Q499 HydrophobicContact CE2-CG 4.01Å; Y495-Q499 WeakPolarHBondContact O-CG 3.3Å; Y495-Q499 PolarHBondContact O-N 3.47Å
496	F	88.5	Confident	87.4	Confident	120 Å²	120	106.9 Å²	106.9	53%	0.526	49%	0.49	S	S	.	.	H	α-helix	trans	-62.4	-38.8	178	-81.8	-66.2	0	0	0	112.6	I492 L493 Q499 L500	I492-F496 HydrophobicContact CG2-CD2 3.62Å; I492-F496 HydrophobicContact CG2-CE2 3.54Å; I492-F496 VanDerWaalsContact O-CD2 3.26Å; I492-F496 WeakPolarHBondContact O-CD2 3.31Å; I492-F496 PolarHBondContact O-N 2.83Å; L493-F496 PolarHBondContact O-N 2.84Å; F496-Q499 PolarHBondContact O-N 2.83Å; F496-L500 WeakPolarHBondContact O-CB 3.33Å; F496-L500 VanDerWaalsContact O-CG 3.31Å; F496-L500 WeakPolarHBondContact O-CG 3.27Å; F496-L500 PolarHBondContact O-N 3.04Å
497	H	87.4	Confident	88	Confident	133 Å²	133	108.6 Å²	108.6	62%	0.616	49%	0.494	S	S	*	.	H	α-helix	trans	-62	-44.2	176	-169.4	79.9	0	0	0	111.6	L493 R494 Y495 L500 N501	L493-H497 VanDerWaalsContact O-CB 3.28Å; L493-H497 WeakPolarHBondContact O-CB 3.3Å; L493-H497 PolarHBondContact O-N 3.02Å; R494-H497 PolarHBondContact O-N 3.47Å; Y495-H497 VanDerWaalsContact C-N 3.31Å; Y495-H497 PolarHBondContact O-N 2.81Å; H497-L500 PolarHBondContact O-N 2.91Å; H497-N501 WeakPolarHBondContact O-CB 3.2Å; H497-N501 PolarHBondContact O-N 2.95Å
498	Q	91.6	Very high	88.5	Confident	108 Å²	108	109.8 Å²	109.8	51%	0.505	50%	0.5	S	S	.	.	H	α-helix	trans	-60.7	-48.4	174.8	-178.1	179.8	-9.6	0	0	111.5	R494 Y495 L500 N501 E502	R494-Q498 WeakPolarHBondContact O-CB 3.37Å; R494-Q498 PolarHBondContact O-N 2.69Å; Y495-Q498 PolarHBondContact O-N 2.89Å; Q498-L500 VanDerWaalsContact C-N 3.34Å; Q498-L500 PolarHBondContact O-N 3.45Å; Q498-N501 PolarHBondContact O-N 3.01Å; Q498-N501 VanDerWaalsContact O-N 3.11Å; Q498-E502 PolarHBondContact NE2-OE1 2.68Å; Q498-E502 VanDerWaalsContact NE2-OE1 3.12Å; Q498-E502 PolarHBondContact O-N 3.23Å
499	Q	90.8	Very high	89	Confident	59 Å²	59	109.4 Å²	109.4	28%	0.276	50%	0.5	S	S	.	.	H	α-helix	trans	-59.7	-43.5	178.8	-69	-58.7	-51.4	0	0	112	Y495 F496 N501 E502 I503	Y495-Q499 HydrophobicContact CD1-CG 4.24Å; Y495-Q499 HydrophobicContact CD2-CG 4.42Å; Y495-Q499 HydrophobicContact CE1-CG 3.8Å; Y495-Q499 HydrophobicContact CE2-CG 4.01Å; Y495-Q499 WeakPolarHBondContact O-CG 3.3Å; Y495-Q499 PolarHBondContact O-N 3.47Å; F496-Q499 PolarHBondContact O-N 2.83Å; Q499-N501 VanDerWaalsContact C-N 3.31Å; Q499-N501 PolarHBondContact O-N 2.95Å; Q499-E502 PolarHBondContact O-N 2.91Å; Q499-I503 VanDerWaalsContact O-CG1 3.27Å; Q499-I503 WeakPolarHBondContact O-CG1 3.41Å; Q499-I503 PolarHBondContact O-N 3.29Å
500	L	89.8	Confident	89.4	Confident	107 Å²	107	108.4 Å²	108.4	56%	0.56	50%	0.503	S	S	*	.	H	α-helix	trans	-64.4	-36.2	176	-73.3	173.3	0	0	0	112.3	F496 H497 Q498 R504	F496-L500 WeakPolarHBondContact O-CB 3.33Å; F496-L500 VanDerWaalsContact O-CG 3.31Å; F496-L500 WeakPolarHBondContact O-CG 3.27Å; F496-L500 PolarHBondContact O-N 3.04Å; H497-L500 PolarHBondContact O-N 2.91Å; Q498-L500 VanDerWaalsContact C-N 3.34Å; Q498-L500 PolarHBondContact O-N 3.45Å; L500-R504 WeakPolarHBondContact O-CB 3.37Å; L500-R504 PolarHBondContact O-N 3.06Å
501	N	91.4	Very high	89.6	Confident	68 Å²	68	109.3 Å²	109.3	36%	0.364	51%	0.511	S	S	.	.	H	α-helix	trans	-69.7	-41.1	177.1	-162.2	40.8	0	0	0	111.8	H497 Q498 Q499 R504 Q505	H497-N501 WeakPolarHBondContact O-CB 3.2Å; H497-N501 PolarHBondContact O-N 2.95Å; Q498-N501 PolarHBondContact O-N 3.01Å; Q498-N501 VanDerWaalsContact O-N 3.11Å; Q499-N501 VanDerWaalsContact C-N 3.31Å; Q499-N501 PolarHBondContact O-N 2.95Å; N501-R504 WeakPolarHBondContact O-CB 3.12Å; N501-R504 PolarHBondContact O-N 3.03Å; N501-Q505 WeakPolarHBondContact O-CG 3.04Å; N501-Q505 PolarHBondContact O-N 3.39Å
502	E	90.4	Very high	89.7	Confident	64 Å²	64	105 Å²	105	30%	0.299	50%	0.497	S	S	.	.	H	α-helix	trans	-62.3	-43.4	173.9	-73.6	179.3	-156.9	0	0	111.9	Q498 Q499 R504 Q505 K506	Q498-E502 PolarHBondContact NE2-OE1 2.68Å; Q498-E502 VanDerWaalsContact NE2-OE1 3.12Å; Q498-E502 PolarHBondContact O-N 3.23Å; Q499-E502 PolarHBondContact O-N 2.91Å; E502-R504 VanDerWaalsContact C-N 3.31Å; E502-R504 PolarHBondContact O-N 3.29Å; E502-Q505 PolarHBondContact O-N 3.4Å; E502-K506 WeakPolarHBondContact O-CB 3.41Å; E502-K506 WeakPolarHBondContact O-CG 3.48Å; E502-K506 PolarHBondContact O-N 3.28Å
503	I	89.3	Confident	90.2	Very high	97 Å²	97	106.9 Å²	106.9	50%	0.497	51%	0.505	S	S	.	.	H	α-helix	trans	-60.5	-43.9	174.7	-69.6	165.9	0	0	0	110.3	Q499 K506 M507	Q499-I503 VanDerWaalsContact O-CG1 3.27Å; Q499-I503 WeakPolarHBondContact O-CG1 3.41Å; Q499-I503 PolarHBondContact O-N 3.29Å; I503-K506 PolarHBondContact O-N 2.89Å; I503-M507 WeakPolarHBondContact O-CB 3.43Å; I503-M507 PolarHBondContact O-N 3.11Å
504	R	91.1	Very high	90.5	Very high	167 Å²	167	107.7 Å²	107.7	63%	0.63	50%	0.504	S	S	*	.	H	α-helix	trans	-60	-48.2	177.3	-174.2	-172.8	-58.3	-158	1.1	111.7	L500 N501 E502 K506 M507 E508	L500-R504 WeakPolarHBondContact O-CB 3.37Å; L500-R504 PolarHBondContact O-N 3.06Å; N501-R504 WeakPolarHBondContact O-CB 3.12Å; N501-R504 PolarHBondContact O-N 3.03Å; E502-R504 VanDerWaalsContact C-N 3.31Å; E502-R504 PolarHBondContact O-N 3.29Å; R504-K506 PolarHBondContact O-N 3.41Å; R504-M507 PolarHBondContact O-N 3.41Å; R504-E508 PolarHBondContact O-N 3.39Å
505	Q	93	Very high	90.7	Very high	106 Å²	106	105.8 Å²	105.8	50%	0.495	50%	0.502	S	S	.	.	H	α-helix	trans	-61.2	-44.5	177.9	-72.7	178.2	1.5	0	0	111.8	N501 E502 M507 E508 I509	N501-Q505 WeakPolarHBondContact O-CG 3.04Å; N501-Q505 PolarHBondContact O-N 3.39Å; E502-Q505 PolarHBondContact O-N 3.4Å; Q505-M507 VanDerWaalsContact C-N 3.31Å; Q505-M507 PolarHBondContact O-N 3.15Å; Q505-E508 PolarHBondContact O-N 2.87Å; Q505-I509 WeakPolarHBondContact O-CG1 3.41Å; Q505-I509 PolarHBondContact O-N 2.73Å
506	K	93.3	Very high	90.8	Very high	142 Å²	142	104.2 Å²	104.2	62%	0.617	51%	0.505	S	S	*	.	H	α-helix	trans	-60.7	-41.3	175.8	-74.2	173.5	179.6	169.7	0	111.7	E502 I503 R504 L510	E502-K506 WeakPolarHBondContact O-CB 3.41Å; E502-K506 WeakPolarHBondContact O-CG 3.48Å; E502-K506 PolarHBondContact O-N 3.28Å; I503-K506 PolarHBondContact O-N 2.89Å; R504-K506 PolarHBondContact O-N 3.41Å; K506-L510 WeakPolarHBondContact O-CB 3.34Å; K506-L510 PolarHBondContact O-N 3.39Å
507	M	92.1	Very high	90.7	Very high	113 Å²	113	103.1 Å²	103.1	56%	0.557	50%	0.502	S	S	*	.	H	α-helix	trans	-64.9	-42.3	176.4	-178.9	175.4	-85.1	0	0	111.7	I503 R504 Q505 L510 L511	I503-M507 WeakPolarHBondContact O-CB 3.43Å; I503-M507 PolarHBondContact O-N 3.11Å; R504-M507 PolarHBondContact O-N 3.41Å; Q505-M507 VanDerWaalsContact C-N 3.31Å; Q505-M507 PolarHBondContact O-N 3.15Å; M507-L510 PolarHBondContact O-N 3.39Å; M507-L511 HydrophobicContact CG-CD1 4.04Å; M507-L511 HydrophobicContact CG-CG 4.43Å; M507-L511 WeakPolarHBondContact O-CB 3.1Å; M507-L511 VanDerWaalsContact O-CG 3.3Å; M507-L511 WeakPolarHBondContact O-CG 3.13Å; M507-L511 PolarHBondContact O-N 3.46Å
508	E	91.6	Very high	90.8	Very high	136 Å²	136	101.9 Å²	101.9	64%	0.636	50%	0.499	S	S	*	.	H	α-helix	trans	-63.4	-43.3	177.7	-170.5	172.2	-174.9	0	0	111.9	R504 Q505 L511 G512	R504-E508 PolarHBondContact O-N 3.39Å; Q505-E508 PolarHBondContact O-N 2.87Å; E508-L511 PolarHBondContact O-N 3.42Å; E508-G512 PolarHBondContact O-N 2.98Å
509	I	91	Very high	90.7	Very high	106 Å²	106	102.5 Å²	102.5	54%	0.544	50%	0.5	S	S	.	.	H	α-helix	trans	-61	-46.3	174.1	-67	165.6	0	0	0	110.8	Q505 L511 G512 Q513	Q505-I509 WeakPolarHBondContact O-CG1 3.41Å; Q505-I509 PolarHBondContact O-N 2.73Å; I509-L511 PolarHBondContact O-N 2.93Å; I509-G512 PolarHBondContact O-N 3.48Å; I509-Q513 WeakPolarHBondContact O-CG 3.35Å; I509-Q513 PolarHBondContact O-N 2.99Å
510	L	91.8	Very high	90.7	Very high	97 Å²	97	104.2 Å²	104.2	51%	0.508	51%	0.508	S	S	.	.	H	α-helix	trans	-63.8	-41.6	-179.6	-176.3	66.7	0	0	0	111.8	K506 M507 Q513 K514	K506-L510 WeakPolarHBondContact O-CB 3.34Å; K506-L510 PolarHBondContact O-N 3.39Å; M507-L510 PolarHBondContact O-N 3.39Å; L510-Q513 PolarHBondContact O-N 3.49Å; L510-K514 WeakPolarHBondContact O-CG 3.44Å; L510-K514 PolarHBondContact O-N 2.93Å
511	L	89.2	Confident	90.6	Very high	113 Å²	113	103.4 Å²	103.4	59%	0.592	51%	0.507	S	S	*	.	H	α-helix	trans	-62.6	-43.9	175	-74.1	170.6	0	0	0	111.1	M507 E508 I509 Q513 K514 E515	M507-L511 HydrophobicContact CG-CD1 4.04Å; M507-L511 HydrophobicContact CG-CG 4.43Å; M507-L511 WeakPolarHBondContact O-CB 3.1Å; M507-L511 VanDerWaalsContact O-CG 3.3Å; M507-L511 WeakPolarHBondContact O-CG 3.13Å; M507-L511 PolarHBondContact O-N 3.46Å; E508-L511 PolarHBondContact O-N 3.42Å; I509-L511 PolarHBondContact O-N 2.93Å; L511-Q513 PolarHBondContact O-N 2.94Å; L511-K514 PolarHBondContact O-N 3.26Å; L511-E515 PolarHBondContact O-N 3.17Å
512	G	90.9	Very high	90.3	Very high	31 Å²	31	105.6 Å²	105.6	32%	0.32	52%	0.515	S	S	.	.	H	α-helix	trans	-60.3	-43.4	175	0	0	0	0	0	112.8	E508 I509 E515 V516	E508-G512 PolarHBondContact O-N 2.98Å; I509-G512 PolarHBondContact O-N 3.48Å; G512-E515 PolarHBondContact O-N 3.25Å; G512-V516 WeakPolarHBondContact O-CG2 3.48Å; G512-V516 PolarHBondContact O-N 2.75Å; G512-V516 VanDerWaalsContact O-N 3.12Å
513	Q	90.5	Very high	90.2	Very high	118 Å²	118	107.7 Å²	107.7	55%	0.551	53%	0.525	S	S	*	.	H	α-helix	trans	-61.5	-44.2	175	-73.6	175.8	-10	0	0	112	I509 L510 L511 E515 V516 E517	I509-Q513 WeakPolarHBondContact O-CG 3.35Å; I509-Q513 PolarHBondContact O-N 2.99Å; L510-Q513 PolarHBondContact O-N 3.49Å; L511-Q513 PolarHBondContact O-N 2.94Å; Q513-E515 VanDerWaalsContact C-N 3.34Å; Q513-E515 PolarHBondContact O-N 3.18Å; Q513-V516 PolarHBondContact O-N 2.92Å; Q513-E517 PolarHBondContact O-N 3.38Å
514	K	90.8	Very high	90.1	Very high	102 Å²	102	108.8 Å²	108.8	44%	0.443	53%	0.526	S	S	.	.	H	α-helix	trans	-66.3	-35.8	178.4	-73	-71.5	164.3	-159.9	0	112.4	L510 L511 V516 E517 I518	L510-K514 WeakPolarHBondContact O-CG 3.44Å; L510-K514 PolarHBondContact O-N 2.93Å; L511-K514 PolarHBondContact O-N 3.26Å; K514-V516 VanDerWaalsContact C-N 3.35Å; K514-E517 IonicContact NZ-OE1 3.41Å; K514-E517 IonicContact NZ-OE2 3.68Å; K514-E517 PolarHBondContact NZ-OE2 3.11Å; K514-E517 PolarHBondContact O-N 3.45Å; K514-I518 WeakPolarHBondContact O-CB 3.26Å; K514-I518 WeakPolarHBondContact O-CD1 3.24Å; K514-I518 WeakPolarHBondContact O-CG1 3.41Å; K514-I518 PolarHBondContact O-N 3.45Å
515	E	90	Very high	89.8	Confident	105 Å²	105	105.6 Å²	105.6	49%	0.491	52%	0.521	S	S	.	.	H	α-helix	trans	-63.4	-40.9	174.1	-166.3	-173.3	156.3	0	0	111.9	L511 G512 Q513 I518 K519	L511-E515 PolarHBondContact O-N 3.17Å; G512-E515 PolarHBondContact O-N 3.25Å; Q513-E515 VanDerWaalsContact C-N 3.34Å; Q513-E515 PolarHBondContact O-N 3.18Å; E515-I518 PolarHBondContact O-N 3.18Å; E515-K519 WeakPolarHBondContact O-CG 3.24Å; E515-K519 PolarHBondContact O-N 3.1Å; E515-K519 WeakPolarHBondContact OE1-CE 3.4Å; E515-K519 IonicContact OE1-NZ 2.7Å; E515-K519 PolarHBondContact OE1-NZ 2.89Å
516	V	92.1	Very high	89.5	Confident	97 Å²	97	104.3 Å²	104.3	59%	0.588	52%	0.517	S	S	*	.	H	α-helix	trans	-64.4	-46	175.6	173.9	0	0	0	0	111.2	G512 Q513 K514 I518 K519 E520	G512-V516 WeakPolarHBondContact O-CG2 3.48Å; G512-V516 PolarHBondContact O-N 2.75Å; G512-V516 VanDerWaalsContact O-N 3.12Å; Q513-V516 PolarHBondContact O-N 2.92Å; K514-V516 VanDerWaalsContact C-N 3.35Å; V516-I518 VanDerWaalsContact C-N 3.34Å; V516-I518 PolarHBondContact O-N 2.84Å; V516-K519 PolarHBondContact O-N 3.41Å; V516-E520 PolarHBondContact O-N 3Å
517	E	87.2	Confident	89.2	Confident	96 Å²	96	103.6 Å²	103.6	45%	0.449	51%	0.514	S	S	.	.	H	α-helix	trans	-59.6	-43.6	177.5	-171.3	-178.1	172.2	0	0	111.5	Q513 K514 K519 E520 V521	Q513-E517 PolarHBondContact O-N 3.38Å; K514-E517 IonicContact NZ-OE1 3.41Å; K514-E517 IonicContact NZ-OE2 3.68Å; K514-E517 PolarHBondContact NZ-OE2 3.11Å; K514-E517 PolarHBondContact O-N 3.45Å; E517-K519 PolarHBondContact O-N 3.18Å; E517-E520 PolarHBondContact O-N 2.79Å; E517-V521 WeakPolarHBondContact O-CG2 3.15Å; E517-V521 PolarHBondContact O-N 3.41Å
518	I	88.8	Confident	88.7	Confident	108 Å²	108	102.3 Å²	102.3	55%	0.554	51%	0.513	S	S	*	.	H	α-helix	trans	-61.2	-44.5	175.8	-70.8	165.7	0	0	0	110.9	K514 E515 V516 E520 V521 Q522	K514-I518 WeakPolarHBondContact O-CB 3.26Å; K514-I518 WeakPolarHBondContact O-CD1 3.24Å; K514-I518 WeakPolarHBondContact O-CG1 3.41Å; K514-I518 PolarHBondContact O-N 3.45Å; E515-I518 PolarHBondContact O-N 3.18Å; V516-I518 VanDerWaalsContact C-N 3.34Å; V516-I518 PolarHBondContact O-N 2.84Å; I518-E520 VanDerWaalsContact C-N 3.33Å; I518-E520 PolarHBondContact O-N 2.81Å; I518-V521 PolarHBondContact O-N 3.42Å; I518-Q522 WeakPolarHBondContact O-CB 3.36Å; I518-Q522 PolarHBondContact O-N 2.95Å
519	K	90.7	Very high	88.1	Confident	121 Å²	121	99.7 Å²	99.7	53%	0.526	50%	0.503	S	S	.	.	H	α-helix	trans	-62.6	-39	177.2	-75.7	175.2	-174.9	164.4	0	112.2	E515 V516 E517 Q522 Q523	E515-K519 WeakPolarHBondContact O-CG 3.24Å; E515-K519 PolarHBondContact O-N 3.1Å; E515-K519 WeakPolarHBondContact OE1-CE 3.4Å; E515-K519 IonicContact OE1-NZ 2.7Å; E515-K519 PolarHBondContact OE1-NZ 2.89Å; V516-K519 PolarHBondContact O-N 3.41Å; E517-K519 PolarHBondContact O-N 3.18Å; K519-Q522 PolarHBondContact O-N 3.41Å; K519-Q523 WeakPolarHBondContact O-CB 3.3Å; K519-Q523 PolarHBondContact O-N 3.09Å
520	E	90.3	Very high	87.7	Confident	94 Å²	94	101.1 Å²	101.1	44%	0.439	51%	0.507	S	S	.	.	H	α-helix	trans	-66.9	-44.5	177.2	-166.6	-168	154.4	0	0	111.7	V516 E517 I518 Q522 Q523 K524	V516-E520 PolarHBondContact O-N 3Å; E517-E520 PolarHBondContact O-N 2.79Å; I518-E520 VanDerWaalsContact C-N 3.33Å; I518-E520 PolarHBondContact O-N 2.81Å; E520-Q522 VanDerWaalsContact C-N 3.31Å; E520-Q522 PolarHBondContact O-N 3.33Å; E520-Q523 PolarHBondContact O-N 3.03Å; E520-K524 WeakPolarHBondContact O-CG 3Å; E520-K524 PolarHBondContact O-N 3.09Å; E520-K524 VanDerWaalsContact OE1-CE 3.3Å; E520-K524 WeakPolarHBondContact OE1-CE 3.24Å; E520-K524 IonicContact OE1-NZ 2.61Å; E520-K524 PolarHBondContact OE1-NZ 3.45Å
521	V	86.5	Confident	87.2	Confident	90 Å²	90	99 Å²	99	55%	0.545	50%	0.501	S	S	.	.	H	α-helix	trans	-60.7	-43.2	174.9	170.7	0	0	0	0	110.6	E517 I518 Q523 K524 L525	E517-V521 WeakPolarHBondContact O-CG2 3.15Å; E517-V521 PolarHBondContact O-N 3.41Å; I518-V521 PolarHBondContact O-N 3.42Å; V521-Q523 PolarHBondContact O-N 2.61Å; V521-K524 PolarHBondContact O-N 3.41Å; V521-L525 WeakPolarHBondContact O-CB 2.86Å; V521-L525 PolarHBondContact O-N 3.16Å
522	Q	85.4	Confident	86.4	Confident	114 Å²	114	96.9 Å²	96.9	53%	0.533	50%	0.495	S	S	.	.	H	α-helix	trans	-63.1	-42.3	177.5	-168.9	160.8	6	0	0	111.7	I518 K519 E520 K524 L525 D526	I518-Q522 WeakPolarHBondContact O-CB 3.36Å; I518-Q522 PolarHBondContact O-N 2.95Å; K519-Q522 PolarHBondContact O-N 3.41Å; E520-Q522 VanDerWaalsContact C-N 3.31Å; E520-Q522 PolarHBondContact O-N 3.33Å; Q522-K524 PolarHBondContact O-N 3.38Å; Q522-L525 PolarHBondContact O-N 3.23Å; Q522-D526 VanDerWaalsContact O-CG 3.26Å; Q522-D526 PolarHBondContact O-N 2.98Å
523	Q	89.1	Confident	85.7	Confident	109 Å²	109	99.2 Å²	99.2	51%	0.509	50%	0.5	S	S	.	.	H	α-helix	trans	-63.6	-40.1	175.3	-169.1	-174.6	18.6	0	0	112.7	K519 E520 V521 D526 K527	K519-Q523 WeakPolarHBondContact O-CB 3.3Å; K519-Q523 PolarHBondContact O-N 3.09Å; E520-Q523 PolarHBondContact O-N 3.03Å; V521-Q523 PolarHBondContact O-N 2.61Å; Q523-D526 PolarHBondContact O-N 3.06Å; Q523-K527 WeakPolarHBondContact O-CG 3.09Å; Q523-K527 PolarHBondContact O-N 2.9Å
524	K	86.4	Confident	84.8	Confident	119 Å²	119	98.6 Å²	98.6	52%	0.517	50%	0.497	S	S	.	.	H	α-helix	trans	-64.3	-41.3	174.9	-77	172.8	175.7	164.7	0	111.4	E520 V521 Q522 K527 T528	E520-K524 WeakPolarHBondContact O-CG 3Å; E520-K524 PolarHBondContact O-N 3.09Å; E520-K524 VanDerWaalsContact OE1-CE 3.3Å; E520-K524 WeakPolarHBondContact OE1-CE 3.24Å; E520-K524 IonicContact OE1-NZ 2.61Å; E520-K524 PolarHBondContact OE1-NZ 3.45Å; V521-K524 PolarHBondContact O-N 3.41Å; Q522-K524 PolarHBondContact O-N 3.38Å; K524-K527 PolarHBondContact O-N 3.36Å; K524-T528 PolarHBondContact O-N 2.86Å; K524-T528 PolarHBondContact O-OG1 3.48Å
525	L	86.2	Confident	84	Confident	100 Å²	100	98.5 Å²	98.5	52%	0.524	50%	0.5	S	S	.	.	H	α-helix	trans	-62.9	-47.3	176	-177.5	62.3	0	0	0	111.1	V521 Q522 K527 T528 I529	V521-L525 WeakPolarHBondContact O-CB 2.86Å; V521-L525 PolarHBondContact O-N 3.16Å; Q522-L525 PolarHBondContact O-N 3.23Å; L525-K527 VanDerWaalsContact C-N 3.34Å; L525-K527 PolarHBondContact O-N 3.09Å; L525-T528 WeakPolarHBondContact O-CB 3.45Å; L525-T528 PolarHBondContact O-N 2.87Å; L525-T528 VanDerWaalsContact O-N 3.11Å; L525-I529 HydrophobicContact CD1-CD1 4.26Å; L525-I529 HydrophobicContact CD1-CG1 4.44Å; L525-I529 HydrophobicContact CG-CD1 3.95Å; L525-I529 WeakPolarHBondContact O-CG1 3.37Å; L525-I529 PolarHBondContact O-N 3.41Å
526	D	86.2	Confident	82.9	Confident	79 Å²	79	98.1 Å²	98.1	42%	0.422	50%	0.498	S	S	.	.	H	α-helix	trans	-59.9	-42.6	178.3	-70.5	-22.8	0	0	0	111.8	Q522 Q523 T528 I529 Q530	Q522-D526 VanDerWaalsContact O-CG 3.26Å; Q522-D526 PolarHBondContact O-N 2.98Å; Q523-D526 PolarHBondContact O-N 3.06Å; D526-T528 PolarHBondContact O-N 3.39Å; D526-I529 PolarHBondContact O-N 3.25Å; D526-Q530 WeakPolarHBondContact O-CG 3.17Å; D526-Q530 PolarHBondContact O-N 3.46Å
527	K	87.1	Confident	81.9	Confident	127 Å²	127	98.2 Å²	98.2	55%	0.552	50%	0.495	S	S	*	.	H	α-helix	trans	-61.7	-42.5	173.9	-74.5	177.7	179.2	-177.8	0	112.1	Q523 K524 L525 Q530 S531	Q523-K527 WeakPolarHBondContact O-CG 3.09Å; Q523-K527 PolarHBondContact O-N 2.9Å; K524-K527 PolarHBondContact O-N 3.36Å; L525-K527 VanDerWaalsContact C-N 3.34Å; L525-K527 PolarHBondContact O-N 3.09Å; K527-Q530 PolarHBondContact O-N 2.99Å; K527-S531 PolarHBondContact O-N 3.43Å; K527-S531 PolarHBondContact O-OG 3.11Å
528	T	80.7	Confident	81	Confident	87 Å²	87	99 Å²	99	53%	0.534	50%	0.497	S	S	.	.	H	α-helix	trans	-64	-44.3	178.2	-53.7	0	0	0	0	110.7	K524 L525 D526 Q530 S531 S532	K524-T528 PolarHBondContact O-N 2.86Å; K524-T528 PolarHBondContact O-OG1 3.48Å; L525-T528 WeakPolarHBondContact O-CB 3.45Å; L525-T528 PolarHBondContact O-N 2.87Å; L525-T528 VanDerWaalsContact O-N 3.11Å; D526-T528 PolarHBondContact O-N 3.39Å; T528-Q530 PolarHBondContact O-N 3.25Å; T528-S531 WeakPolarHBondContact CA-OG 2.87Å; T528-S531 PolarHBondContact O-N 2.94Å; T528-S531 PolarHBondContact O-OG 2.99Å; T528-S532 WeakPolarHBondContact O-CB 3.5Å; T528-S532 PolarHBondContact O-N 3.39Å
529	I	80.2	Confident	80.2	Confident	81 Å²	81	98.9 Å²	98.9	42%	0.415	50%	0.497	S	S	.	.	H	α-helix	trans	-60.7	-45.6	175.9	-67.8	167.3	0	0	0	110.8	L525 D526 S531 S532 N533	L525-I529 HydrophobicContact CD1-CD1 4.26Å; L525-I529 HydrophobicContact CD1-CG1 4.44Å; L525-I529 HydrophobicContact CG-CD1 3.95Å; L525-I529 WeakPolarHBondContact O-CG1 3.37Å; L525-I529 PolarHBondContact O-N 3.41Å; D526-I529 PolarHBondContact O-N 3.25Å; I529-S531 PolarHBondContact O-N 2.88Å; I529-S532 PolarHBondContact O-N 3.47Å; I529-N533 VanDerWaalsContact O-CG 3.25Å; I529-N533 PolarHBondContact O-N 2.94Å; I529-N533 PolarHBondContact O-ND2 2.87Å
530	Q	81.8	Confident	79.4	Confident	136 Å²	136	98.8 Å²	98.8	64%	0.636	50%	0.497	S	S	*	.	H	α-helix	trans	-59.2	-46.1	176.3	-74.7	176.9	0.1	0	0	111.9	D526 K527 T528 S532 N533 E534	D526-Q530 WeakPolarHBondContact O-CG 3.17Å; D526-Q530 PolarHBondContact O-N 3.46Å; K527-Q530 PolarHBondContact O-N 2.99Å; T528-Q530 PolarHBondContact O-N 3.25Å; Q530-S532 PolarHBondContact O-N 2.97Å; Q530-N533 PolarHBondContact O-N 2.9Å; Q530-E534 PolarHBondContact O-N 2.83Å
531	S	80.3	Confident	78.5	Confident	53 Å²	53	98.7 Å²	98.7	37%	0.371	50%	0.499	S	S	.	.	H	α-helix	trans	-65	-37.5	178.2	67.7	0	0	0	0	113	K527 T528 I529 E534 I535	K527-S531 PolarHBondContact O-N 3.43Å; K527-S531 PolarHBondContact O-OG 3.11Å; T528-S531 WeakPolarHBondContact CA-OG 2.87Å; T528-S531 PolarHBondContact O-N 2.94Å; T528-S531 PolarHBondContact O-OG 2.99Å; I529-S531 PolarHBondContact O-N 2.88Å; S531-E534 PolarHBondContact O-N 3.11Å; S531-I535 VanDerWaalsContact O-CG1 3.32Å; S531-I535 WeakPolarHBondContact O-CG1 3.5Å; S531-I535 PolarHBondContact O-N 3.19Å
532	S	74.4	Confident	77.7	Confident	67 Å²	67	98.3 Å²	98.3	47%	0.469	50%	0.497	S	S	.	.	H	α-helix	trans	-66.3	-41.8	177.6	-171.3	0	0	0	0	111.2	T528 I529 Q530 E534 I535 E536	T528-S532 WeakPolarHBondContact O-CB 3.5Å; T528-S532 PolarHBondContact O-N 3.39Å; I529-S532 PolarHBondContact O-N 3.47Å; Q530-S532 PolarHBondContact O-N 2.97Å; S532-E534 VanDerWaalsContact C-N 3.32Å; S532-E534 PolarHBondContact O-N 3.16Å; S532-I535 PolarHBondContact O-N 3.1Å; S532-E536 PolarHBondContact O-N 2.87Å
533	N	74.6	Confident	77.2	Confident	81 Å²	81	98.3 Å²	98.3	43%	0.433	50%	0.497	S	S	.	.	H	α-helix	trans	-64.7	-37.8	176.2	-68.7	-13.6	0	0	0	111.3	I529 Q530 E536 I537	I529-N533 VanDerWaalsContact O-CG 3.25Å; I529-N533 PolarHBondContact O-N 2.94Å; I529-N533 PolarHBondContact O-ND2 2.87Å; Q530-N533 PolarHBondContact O-N 2.9Å; N533-E536 PolarHBondContact O-N 3.08Å; N533-I537 VanDerWaalsContact O-CG1 3.3Å; N533-I537 WeakPolarHBondContact O-CG1 3.39Å; N533-I537 PolarHBondContact O-N 3.25Å
534	E	72.7	Confident	76.6	Confident	105 Å²	105	99.4 Å²	99.4	49%	0.491	50%	0.5	S	S	.	.	H	α-helix	trans	-66.2	-41	176.5	-163.3	-170.8	151.4	0	0	112.2	Q530 S531 S532 I537 K538	Q530-E534 PolarHBondContact O-N 2.83Å; S531-E534 PolarHBondContact O-N 3.11Å; S532-E534 VanDerWaalsContact C-N 3.32Å; S532-E534 PolarHBondContact O-N 3.16Å; E534-I537 PolarHBondContact O-N 3.41Å; E534-K538 WeakPolarHBondContact O-CG 3.31Å; E534-K538 PolarHBondContact O-N 2.83Å; E534-K538 IonicContact OE1-NZ 2.7Å; E534-K538 PolarHBondContact OE1-NZ 3.26Å
535	I	73.2	Confident	75.7	Confident	99 Å²	99	99 Å²	99	51%	0.508	50%	0.503	S	S	.	.	H	α-helix	trans	-64.6	-41.3	174.4	-67.8	165.6	0	0	0	110.7	S531 S532 I537 K538 N539	S531-I535 VanDerWaalsContact O-CG1 3.32Å; S531-I535 WeakPolarHBondContact O-CG1 3.5Å; S531-I535 PolarHBondContact O-N 3.19Å; S532-I535 PolarHBondContact O-N 3.1Å; I535-I537 VanDerWaalsContact C-N 3.33Å; I535-I537 PolarHBondContact O-N 3.12Å; I535-K538 PolarHBondContact O-N 3.48Å; I535-N539 WeakPolarHBondContact O-CB 3.41Å; I535-N539 PolarHBondContact O-N 2.9Å
536	E	67.9	Low	75	Confident	97 Å²	97	98.8 Å²	98.8	45%	0.453	50%	0.502	S	S	.	.	H	α-helix	trans	-62.2	-40.4	177.4	-163.5	-168	143.1	0	0	111.9	S532 N533 N539 K540	S532-E536 PolarHBondContact O-N 2.87Å; N533-E536 PolarHBondContact O-N 3.08Å; E536-N539 PolarHBondContact O-N 2.96Å; E536-K540 PolarHBondContact O-N 2.89Å; E536-K540 VanDerWaalsContact O-N 3.07Å; E536-K540 IonicContact OE1-NZ 2.73Å; E536-K540 PolarHBondContact OE1-NZ 3.28Å
537	I	69.8	Low	74.5	Confident	100 Å²	100	99.7 Å²	99.7	51%	0.513	50%	0.504	S	S	.	.	H	α-helix	trans	-64.1	-47.5	175.1	-67.4	164.3	0	0	0	110.5	N533 E534 I535 N539 K540 D541	N533-I537 VanDerWaalsContact O-CG1 3.3Å; N533-I537 WeakPolarHBondContact O-CG1 3.39Å; N533-I537 PolarHBondContact O-N 3.25Å; E534-I537 PolarHBondContact O-N 3.41Å; I535-I537 VanDerWaalsContact C-N 3.33Å; I535-I537 PolarHBondContact O-N 3.12Å; I537-N539 VanDerWaalsContact C-N 3.3Å; I537-N539 PolarHBondContact O-N 3.44Å; I537-K540 WeakPolarHBondContact O-CB 3.44Å; I537-K540 PolarHBondContact O-N 3.19Å; I537-K540 VanDerWaalsContact O-N 3.12Å; I537-D541 PolarHBondContact O-N 3.46Å
538	K	69.6	Low	73.9	Confident	113 Å²	113	96.5 Å²	96.5	49%	0.491	50%	0.495	S	S	.	.	H	α-helix	trans	-60	-39.5	177.7	-77.1	170.3	171.4	163.2	0	112.4	E534 I535 D541 V542	E534-K538 WeakPolarHBondContact O-CG 3.31Å; E534-K538 PolarHBondContact O-N 2.83Å; E534-K538 IonicContact OE1-NZ 2.7Å; E534-K538 PolarHBondContact OE1-NZ 3.26Å; I535-K538 PolarHBondContact O-N 3.48Å; K538-D541 PolarHBondContact O-N 3.12Å; K538-V542 WeakPolarHBondContact O-CG2 3.28Å; K538-V542 PolarHBondContact O-N 3.34Å
539	N	70.5	Confident	73.5	Confident	104 Å²	104	97.8 Å²	97.8	56%	0.556	50%	0.495	S	S	*	.	H	α-helix	trans	-65.1	-40.1	175.8	-76.5	-13.5	0	0	0	111.8	I535 E536 I537 D541 V542 E543	I535-N539 WeakPolarHBondContact O-CB 3.41Å; I535-N539 PolarHBondContact O-N 2.9Å; E536-N539 PolarHBondContact O-N 2.96Å; I537-N539 VanDerWaalsContact C-N 3.3Å; I537-N539 PolarHBondContact O-N 3.44Å; N539-D541 VanDerWaalsContact C-N 3.34Å; N539-V542 PolarHBondContact O-N 3.05Å; N539-E543 WeakPolarHBondContact O-CB 3.44Å; N539-E543 PolarHBondContact O-N 3.06Å
540	K	74.7	Confident	73.3	Confident	119 Å²	119	98.7 Å²	98.7	52%	0.517	50%	0.5	S	S	.	.	H	α-helix	trans	-63.1	-38.5	173.3	-78.7	169.6	171.7	156.8	0	112.2	E536 I537 E543 F544	E536-K540 PolarHBondContact O-N 2.89Å; E536-K540 VanDerWaalsContact O-N 3.07Å; E536-K540 IonicContact OE1-NZ 2.73Å; E536-K540 PolarHBondContact OE1-NZ 3.28Å; I537-K540 WeakPolarHBondContact O-CB 3.44Å; I537-K540 PolarHBondContact O-N 3.19Å; I537-K540 VanDerWaalsContact O-N 3.12Å; K540-E543 PolarHBondContact O-N 3.33Å; K540-F544 WeakPolarHBondContact O-CB 3.5Å; K540-F544 PolarHBondContact O-N 3.48Å
541	D	71.7	Confident	73.1	Confident	93 Å²	93	99 Å²	99	50%	0.497	50%	0.5	S	S	.	.	H	α-helix	trans	-66.5	-41.4	176.3	-69.4	-22.1	0	0	0	111.9	I537 K538 N539 F544 L545	I537-D541 PolarHBondContact O-N 3.46Å; K538-D541 PolarHBondContact O-N 3.12Å; N539-D541 VanDerWaalsContact C-N 3.34Å; D541-F544 PolarHBondContact O-N 3.18Å; D541-L545 WeakPolarHBondContact O-CG 3.49Å; D541-L545 PolarHBondContact O-N 3.18Å
542	V	69.4	Low	72.7	Confident	81 Å²	81	102.5 Å²	102.5	49%	0.491	51%	0.508	S	S	.	.	H	α-helix	trans	-64.5	-42.8	175.4	172.2	0	0	0	0	111.1	K538 N539 F544 L545 L546	K538-V542 WeakPolarHBondContact O-CG2 3.28Å; K538-V542 PolarHBondContact O-N 3.34Å; N539-V542 PolarHBondContact O-N 3.05Å; V542-F544 VanDerWaalsContact C-N 3.32Å; V542-F544 PolarHBondContact O-N 2.74Å; V542-L545 PolarHBondContact O-N 3.05Å; V542-L546 HydrophobicContact CG1-CD1 4.15Å; V542-L546 PolarHBondContact O-N 3.18Å
543	E	74.4	Confident	72.7	Confident	115 Å²	115	103.3 Å²	103.3	54%	0.537	51%	0.507	S	S	.	.	H	α-helix	trans	-61.9	-40.4	175.7	-169.5	178.5	177.4	0	0	111.5	N539 K540 L546 Q547	N539-E543 WeakPolarHBondContact O-CB 3.44Å; N539-E543 PolarHBondContact O-N 3.06Å; K540-E543 PolarHBondContact O-N 3.33Å; E543-L546 PolarHBondContact O-N 3.27Å; E543-Q547 WeakPolarHBondContact O-CG 3.27Å; E543-Q547 PolarHBondContact O-N 3.42Å
544	F	76.3	Confident	72.8	Confident	131 Å²	131	104.3 Å²	104.3	58%	0.575	51%	0.513	S	S	*	.	H	α-helix	trans	-64	-41	174.2	179.7	-95.8	0	0	0	112.6	K540 D541 V542 Q547 T548	K540-F544 WeakPolarHBondContact O-CB 3.5Å; K540-F544 PolarHBondContact O-N 3.48Å; D541-F544 PolarHBondContact O-N 3.18Å; V542-F544 VanDerWaalsContact C-N 3.32Å; V542-F544 PolarHBondContact O-N 2.74Å; F544-Q547 PolarHBondContact O-N 3.11Å; F544-T548 WeakPolarHBondContact O-CB 3.39Å; F544-T548 PolarHBondContact O-N 3.1Å; F544-T548 PolarHBondContact O-OG1 3.46Å
545	L	68.2	Low	72.8	Confident	112 Å²	112	104.7 Å²	104.7	59%	0.586	51%	0.513	S	S	*	.	H	α-helix	trans	-64	-44.4	176.3	-77.4	170.4	0	0	0	111.7	D541 V542 Q547 T548 E549	D541-L545 WeakPolarHBondContact O-CG 3.49Å; D541-L545 PolarHBondContact O-N 3.18Å; V542-L545 PolarHBondContact O-N 3.05Å; L545-Q547 PolarHBondContact O-N 3.26Å; L545-T548 WeakPolarHBondContact O-CB 3.3Å; L545-T548 PolarHBondContact O-N 3.41Å; L545-T548 VanDerWaalsContact O-N 3.09Å; L545-E549 PolarHBondContact O-N 3.17Å
546	L	72	Confident	72.7	Confident	95 Å²	95	103.8 Å²	103.8	50%	0.497	51%	0.508	S	S	.	.	H	α-helix	trans	-60.4	-44.9	175.5	-77.1	164.4	0	0	0	111.8	V542 E543 T548 E549 D550	V542-L546 HydrophobicContact CG1-CD1 4.15Å; V542-L546 PolarHBondContact O-N 3.18Å; E543-L546 PolarHBondContact O-N 3.27Å; L546-T548 PolarHBondContact O-N 3.14Å; L546-E549 PolarHBondContact O-N 2.95Å; L546-D550 PolarHBondContact O-N 3.36Å
547	Q	75.2	Confident	72.9	Confident	97 Å²	97	102.7 Å²	102.7	45%	0.453	51%	0.508	S	S	.	.	H	α-helix	trans	-62.8	-30.8	174.6	-74.1	-176.3	7.7	0	0	113	E543 F544 L545 K551	E543-Q547 WeakPolarHBondContact O-CG 3.27Å; E543-Q547 PolarHBondContact O-N 3.42Å; F544-Q547 PolarHBondContact O-N 3.11Å; L545-Q547 PolarHBondContact O-N 3.26Å; Q547-K551 VanDerWaalsContact O-CG 3.28Å; Q547-K551 WeakPolarHBondContact O-CG 3.27Å; Q547-K551 PolarHBondContact O-N 3.5Å
548	T	74.6	Confident	72.9	Confident	60 Å²	60	102.6 Å²	102.6	37%	0.368	51%	0.509	S	S	.	.	H	α-helix	trans	-75.5	-39.7	177.7	-56.7	0	0	0	0	111	F544 L545 L546 K551 F552	F544-T548 WeakPolarHBondContact O-CB 3.39Å; F544-T548 PolarHBondContact O-N 3.1Å; F544-T548 PolarHBondContact O-OG1 3.46Å; L545-T548 WeakPolarHBondContact O-CB 3.3Å; L545-T548 PolarHBondContact O-N 3.41Å; L545-T548 VanDerWaalsContact O-N 3.09Å; L546-T548 PolarHBondContact O-N 3.14Å; T548-K551 PolarHBondContact O-N 2.94Å; T548-F552 WeakPolarHBondContact O-CB 3.34Å; T548-F552 PolarHBondContact O-N 3.01Å
549	E	71	Confident	72.6	Confident	114 Å²	114	101.2 Å²	101.2	53%	0.533	51%	0.506	S	S	.	.	H	α-helix	trans	-62.5	-45.8	174.3	-171.5	173.1	-174	0	0	111.3	L545 L546 K551 F552 L553	L545-E549 PolarHBondContact O-N 3.17Å; L546-E549 PolarHBondContact O-N 2.95Å; E549-K551 VanDerWaalsContact C-N 3.31Å; E549-K551 PolarHBondContact O-N 3.39Å; E549-F552 PolarHBondContact O-N 3.5Å; E549-F552 VanDerWaalsContact O-N 3.08Å; E549-L553 HydrophobicContact CG-CD1 4.07Å; E549-L553 WeakPolarHBondContact O-CB 3.35Å; E549-L553 PolarHBondContact O-N 2.74Å
550	D	77.9	Confident	72.2	Confident	100 Å²	100	99.2 Å²	99.2	54%	0.535	50%	0.501	S	S	.	.	H	α-helix	trans	-60.1	-39.8	175.4	-79.5	-18.6	0	0	0	112.3	L546 N554	L546-D550 PolarHBondContact O-N 3.36Å; D550-N554 WeakPolarHBondContact O-CB 3.31Å; D550-N554 PolarHBondContact O-N 2.67Å; D550-N554 PolarHBondContact O-ND2 3.22Å; D550-N554 VanDerWaalsContact O-ND2 3.14Å
551	K	77.3	Confident	71.5	Confident	143 Å²	143	98 Å²	98	62%	0.622	50%	0.5	S	S	*	.	H	α-helix	trans	-66.3	-39.2	174.1	-76.2	172.3	-174.8	171.5	0	111.9	Q547 T548 E549 F555	Q547-K551 VanDerWaalsContact O-CG 3.28Å; Q547-K551 WeakPolarHBondContact O-CG 3.27Å; Q547-K551 PolarHBondContact O-N 3.5Å; T548-K551 PolarHBondContact O-N 2.94Å; E549-K551 VanDerWaalsContact C-N 3.31Å; E549-K551 PolarHBondContact O-N 3.39Å; K551-F555 WeakPolarHBondContact O-CB 3.46Å; K551-F555 PolarHBondContact O-N 3.07Å
552	F	70.7	Confident	70.7	Confident	126 Å²	126	98.8 Å²	98.8	55%	0.553	50%	0.503	S	S	*	.	H	α-helix	trans	-69.6	-43.1	179.3	-174.4	-105.6	0	0	0	111.9	T548 E549 F555 I556	T548-F552 WeakPolarHBondContact O-CB 3.34Å; T548-F552 PolarHBondContact O-N 3.01Å; E549-F552 PolarHBondContact O-N 3.5Å; E549-F552 VanDerWaalsContact O-N 3.08Å; F552-F555 WeakPolarHBondContact O-CB 3.36Å; F552-F555 PolarHBondContact O-N 3.16Å; F552-F555 VanDerWaalsContact O-N 3.14Å; F552-I556 HydrophobicContact CD1-CD1 3.8Å; F552-I556 HydrophobicContact CD1-CG1 4.45Å; F552-I556 HydrophobicContact CE1-CD1 3.29Å; F552-I556 HydrophobicContact CE1-CG1 4.12Å; F552-I556 HydrophobicContact CZ-CD1 3.78Å; F552-I556 HydrophobicContact CZ-CG1 4.27Å; F552-I556 PolarHBondContact O-N 2.99Å
553	L	75.4	Confident	69.7	Low	85 Å²	85	100.4 Å²	100.4	45%	0.445	51%	0.505	S	S	.	.	H	α-helix	trans	-60.6	-45.6	173.1	-77.4	164.7	0	0	0	110.9	E549 F555 I556 T557	E549-L553 HydrophobicContact CG-CD1 4.07Å; E549-L553 WeakPolarHBondContact O-CB 3.35Å; E549-L553 PolarHBondContact O-N 2.74Å; L553-F555 VanDerWaalsContact C-N 3.28Å; L553-F555 PolarHBondContact O-N 3.14Å; L553-I556 PolarHBondContact O-N 3.36Å; L553-T557 PolarHBondContact O-N 3Å; L553-T557 PolarHBondContact O-OG1 2.93Å
554	N	76.5	Confident	68.6	Low	102 Å²	102	98.9 Å²	98.9	55%	0.545	51%	0.506	S	S	.	.	H	α-helix	trans	-59.8	-38.2	173.3	-82	-35.6	0	0	0	112.6	D550 T557 N558	D550-N554 WeakPolarHBondContact O-CB 3.31Å; D550-N554 PolarHBondContact O-N 2.67Å; D550-N554 PolarHBondContact O-ND2 3.22Å; D550-N554 VanDerWaalsContact O-ND2 3.14Å; N554-T557 PolarHBondContact O-N 3.06Å; N554-N558 WeakPolarHBondContact O-CB 3.43Å; N554-N558 PolarHBondContact O-N 2.83Å; N554-N558 PolarHBondContact O-ND2 2.85Å; N554-N558 VanDerWaalsContact O-ND2 3.12Å
555	F	73	Confident	67.6	Low	113 Å²	113	97.7 Å²	97.7	50%	0.496	51%	0.51	S	S	.	.	H	α-helix	trans	-64.5	-44.7	175.1	176.5	-102	0	0	0	112.3	K551 F552 L553 N558 L559	K551-F555 WeakPolarHBondContact O-CB 3.46Å; K551-F555 PolarHBondContact O-N 3.07Å; F552-F555 WeakPolarHBondContact O-CB 3.36Å; F552-F555 PolarHBondContact O-N 3.16Å; F552-F555 VanDerWaalsContact O-N 3.14Å; L553-F555 VanDerWaalsContact C-N 3.28Å; L553-F555 PolarHBondContact O-N 3.14Å; F555-N558 PolarHBondContact O-N 3.47Å; F555-L559 HydrophobicContact CD1-CD1 3.91Å; F555-L559 HydrophobicContact CD1-CG 4.47Å; F555-L559 HydrophobicContact CE1-CD1 3.3Å; F555-L559 HydrophobicContact CE1-CG 4.06Å; F555-L559 HydrophobicContact CE2-CD1 4.42Å; F555-L559 HydrophobicContact CE2-CG 4.36Å; F555-L559 HydrophobicContact CZ-CD1 3.6Å; F555-L559 HydrophobicContact CZ-CD2 4.25Å; F555-L559 HydrophobicContact CZ-CG 4Å; F555-L559 WeakPolarHBondContact O-CG 3.42Å; F555-L559 PolarHBondContact O-N 2.84Å
556	I	70.6	Confident	66.7	Low	80 Å²	80	96.3 Å²	96.3	41%	0.41	51%	0.509	S	S	.	.	H	α-helix	trans	-61.6	-44.6	175.6	-69.7	176.4	0	0	0	110.8	F552 L553 N558 L559 S560	F552-I556 HydrophobicContact CD1-CD1 3.8Å; F552-I556 HydrophobicContact CD1-CG1 4.45Å; F552-I556 HydrophobicContact CE1-CD1 3.29Å; F552-I556 HydrophobicContact CE1-CG1 4.12Å; F552-I556 HydrophobicContact CZ-CD1 3.78Å; F552-I556 HydrophobicContact CZ-CG1 4.27Å; F552-I556 PolarHBondContact O-N 2.99Å; L553-I556 PolarHBondContact O-N 3.36Å; I556-N558 VanDerWaalsContact C-N 3.34Å; I556-N558 PolarHBondContact O-N 3.19Å; I556-L559 WeakPolarHBondContact O-CB 3.38Å; I556-L559 PolarHBondContact O-N 3.27Å; I556-L559 VanDerWaalsContact O-N 3.16Å; I556-S560 PolarHBondContact O-N 3.05Å
557	T	71.3	Confident	65.4	Low	74 Å²	74	97.2 Å²	97.2	45%	0.454	51%	0.513	S	S	.	.	H	α-helix	trans	-59.4	-46.1	177.9	-53.1	0	0	0	0	110.8	L553 N554 L559 S560 D561	L553-T557 PolarHBondContact O-N 3Å; L553-T557 PolarHBondContact O-OG1 2.93Å; N554-T557 PolarHBondContact O-N 3.06Å; T557-L559 VanDerWaalsContact C-N 3.32Å; T557-L559 PolarHBondContact O-N 3.47Å; T557-S560 WeakPolarHBondContact O-CB 3.27Å; T557-S560 PolarHBondContact O-N 3.17Å; T557-S560 VanDerWaalsContact O-N 3.13Å; T557-D561 PolarHBondContact O-N 3.24Å
558	N	69.6	Low	63.8	Low	97 Å²	97	97.8 Å²	97.8	52%	0.519	52%	0.524	S	S	.	.	H	α-helix	trans	-61.6	-37.3	175.6	-71.7	-30.3	0	0	0	112.9	N554 F555 I556 I562	N554-N558 WeakPolarHBondContact O-CB 3.43Å; N554-N558 PolarHBondContact O-N 2.83Å; N554-N558 PolarHBondContact O-ND2 2.85Å; N554-N558 VanDerWaalsContact O-ND2 3.12Å; F555-N558 PolarHBondContact O-N 3.47Å; I556-N558 VanDerWaalsContact C-N 3.34Å; I556-N558 PolarHBondContact O-N 3.19Å; N558-I562 WeakPolarHBondContact O-CG1 3.32Å; N558-I562 PolarHBondContact O-N 3.01Å
559	L	65.1	Low	62.3	Low	85 Å²	85	104.3 Å²	104.3	45%	0.445	57%	0.567	S	S	.	*	H	α-helix	trans	-68.1	-38.6	173.9	-74.8	178.5	0	0	0	112.2	F555 I556 T557 D561 I562 H563	F555-L559 HydrophobicContact CD1-CD1 3.91Å; F555-L559 HydrophobicContact CD1-CG 4.47Å; F555-L559 HydrophobicContact CE1-CD1 3.3Å; F555-L559 HydrophobicContact CE1-CG 4.06Å; F555-L559 HydrophobicContact CE2-CD1 4.42Å; F555-L559 HydrophobicContact CE2-CG 4.36Å; F555-L559 HydrophobicContact CZ-CD1 3.6Å; F555-L559 HydrophobicContact CZ-CD2 4.25Å; F555-L559 HydrophobicContact CZ-CG 4Å; F555-L559 WeakPolarHBondContact O-CG 3.42Å; F555-L559 PolarHBondContact O-N 2.84Å; I556-L559 WeakPolarHBondContact O-CB 3.38Å; I556-L559 PolarHBondContact O-N 3.27Å; I556-L559 VanDerWaalsContact O-N 3.16Å; T557-L559 VanDerWaalsContact C-N 3.32Å; T557-L559 PolarHBondContact O-N 3.47Å; L559-D561 VanDerWaalsContact C-N 3.29Å; L559-D561 PolarHBondContact O-N 3.22Å; L559-I562 PolarHBondContact O-N 3.38Å; L559-H563 PolarHBondContact O-N 2.7Å
560	S	61.2	Low	61.8	Low	62 Å²	62	103.9 Å²	103.9	43%	0.434	57%	0.569	S	S	.	*	H	α-helix	trans	-61.6	-40.8	176.1	-171.3	0	0	0	0	110.9	I556 T557 I562 H563 C564	I556-S560 PolarHBondContact O-N 3.05Å; T557-S560 WeakPolarHBondContact O-CB 3.27Å; T557-S560 PolarHBondContact O-N 3.17Å; T557-S560 VanDerWaalsContact O-N 3.13Å; S560-I562 VanDerWaalsContact C-N 3.32Å; S560-I562 PolarHBondContact O-N 3.49Å; S560-H563 PolarHBondContact O-N 2.73Å; S560-C564 WeakPolarHBondContact O-CB 3.36Å; S560-C564 PolarHBondContact O-N 3.45Å; S560-C564 PolarHBondContact O-SG 2.91Å
561	D	59.1	Low	61	Low	94 Å²	94	104.1 Å²	104.1	50%	0.503	57%	0.571	S	S	.	*	H	α-helix	trans	-64.1	-36.8	176	-70.2	-19	0	0	0	112	T557 L559 T565	T557-D561 PolarHBondContact O-N 3.24Å; L559-D561 VanDerWaalsContact C-N 3.29Å; L559-D561 PolarHBondContact O-N 3.22Å; D561-T565 WeakPolarHBondContact O-CG2 3.24Å; D561-T565 PolarHBondContact O-N 3.28Å; D561-T565 VanDerWaalsContact O-N 3.13Å; D561-T565 PolarHBondContact O-OG1 3.5Å
562	I	56.9	Low	60.1	Low	109 Å²	109	101.9 Å²	101.9	56%	0.559	57%	0.568	S	S	*	*	H	α-helix	trans	-67.3	-40.8	173.2	-64.9	164.9	0	0	0	111	N558 L559 S560 T565 S566	N558-I562 WeakPolarHBondContact O-CG1 3.32Å; N558-I562 PolarHBondContact O-N 3.01Å; L559-I562 PolarHBondContact O-N 3.38Å; S560-I562 VanDerWaalsContact C-N 3.32Å; S560-I562 PolarHBondContact O-N 3.49Å; I562-T565 WeakPolarHBondContact CA-OG1 3.32Å; I562-T565 PolarHBondContact O-N 3.39Å; I562-T565 PolarHBondContact O-OG1 2.78Å; I562-S566 PolarHBondContact O-N 3.21Å
563	H	47.3	Very low	59.5	Low	114 Å²	114	100.5 Å²	100.5	53%	0.528	57%	0.569	S	S	.	*	H	α-helix	trans	-68.3	-43.1	179.6	-168.6	19.1	0	0	0	111.8	L559 S560 T565 S566 I567	L559-H563 PolarHBondContact O-N 2.7Å; S560-H563 PolarHBondContact O-N 2.73Å; H563-T565 VanDerWaalsContact C-N 3.29Å; H563-T565 PolarHBondContact O-N 3.16Å; H563-S566 PolarHBondContact ND1-OG 3.15Å; H563-S566 PolarHBondContact O-N 3.3Å; H563-S566 VanDerWaalsContact O-N 3.1Å; H563-S566 PolarHBondContact O-OG 2.93Å; H563-I567 WeakPolarHBondContact CE1-CD1 3.45Å; H563-I567 PolarHBondContact O-N 3.1Å
564	C	51.9	Low	58.5	Low	84 Å²	84	101.4 Å²	101.4	57%	0.568	58%	0.576	S	S	*	*	H	α-helix	trans	-62.6	-34	176.8	-76.7	0	0	0	0	112.6	S560 S566	S560-C564 WeakPolarHBondContact O-CB 3.36Å; S560-C564 PolarHBondContact O-N 3.45Å; S560-C564 PolarHBondContact O-SG 2.91Å; C564-S566 VanDerWaalsContact C-N 3.33Å
565	T	54	Low	57.3	Low	106 Å²	106	101.4 Å²	101.4	65%	0.65	58%	0.578	S	S	*	*	H	α-helix	trans	-74.9	-21.8	175.4	48.4	0	0	0	0	113.4	D561 I562 H563	D561-T565 WeakPolarHBondContact O-CG2 3.24Å; D561-T565 PolarHBondContact O-N 3.28Å; D561-T565 VanDerWaalsContact O-N 3.13Å; D561-T565 PolarHBondContact O-OG1 3.5Å; I562-T565 WeakPolarHBondContact CA-OG1 3.32Å; I562-T565 PolarHBondContact O-N 3.39Å; I562-T565 PolarHBondContact O-OG1 2.78Å; H563-T565 VanDerWaalsContact C-N 3.29Å; H563-T565 PolarHBondContact O-N 3.16Å
566	S	50.6	Low	56.1	Low	82 Å²	82	100.6 Å²	100.6	57%	0.573	58%	0.584	S	S	*	*	H	α-helix	trans	-82.8	-16.4	177.1	72.6	0	0	0	0	115	I562 H563 C564	I562-S566 PolarHBondContact O-N 3.21Å; H563-S566 PolarHBondContact ND1-OG 3.15Å; H563-S566 PolarHBondContact O-N 3.3Å; H563-S566 VanDerWaalsContact O-N 3.1Å; H563-S566 PolarHBondContact O-OG 2.93Å; C564-S566 VanDerWaalsContact C-N 3.33Å
567	I	43.8	Very low	55	Low	115 Å²	115	102.2 Å²	102.2	59%	0.59	60%	0.598	S	S	*	*			trans	-111.3	66.6	176.4	-49.8	177	0	0	0	108.9	H563	H563-I567 WeakPolarHBondContact CE1-CD1 3.45Å; H563-I567 PolarHBondContact O-N 3.1Å
568	T	42.1	Very low	53.7	Low	109 Å²	109	104.5 Å²	104.5	67%	0.669	61%	0.61	S	S	*	*			trans	-135.6	106	159.4	2.7	0	0	0	0	106.5
569	P	42.4	Very low	52.2	Low	197 Å²	197	105.2 Å²	105.2	100%	1.279	62%	0.618	S	S	*	*			trans	-68.3	0	-176.2	27.9	-33.8	0	0	0	113.4

Retrieved 569 of 569 residues in 182.9 ms (Link to these results)

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