G4LZ30_SCHMA Loading...

Calcium-binding protein, putative

AlphaFold DB , UniProt , Accession G4LZ30, Species SCHMA (Schistosoma mansoni, Blood fluke), Gene n/a, Length 503 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	25.7	Very low	26.3	Very low	145 Å²	145	138.7 Å²	138.7	71%	0.714	71%	0.71	S	S	*	*				0	167.3	0	-91.5	-165.8	164	0	0	109.4	A187 C188 Q189	M1-A187 CarbonylContact C-O 2.88Å; M1-A187 WeakPolarHBondContact CB-O 3.38Å; M1-A187 CarbonylContact O-C 3.42Å; M1-C188 WeakPolarHBondContact O-CA 2.99Å; M1-C188 WeakPolarHBondContact O-CB 3.38Å; M1-C188 PolarHBondContact O-N 3.42Å; M1-Q189 HydrophobicContact CB-CG 4.36Å; M1-Q189 HydrophobicContact CG-CG 4.34Å; M1-Q189 HydrophobicContact SD-CG 3.78Å; M1-Q189 PolarHBondContact SD-OE1 2.91Å; M1-Q189 VanDerWaalsContact SD-OE1 3.42Å
2	V	20.6	Very low	26.9	Very low	104 Å²	104	135.8 Å²	135.8	63%	0.63	70%	0.697	S	S	*	*			trans	-158.8	109.4	176.1	-104.2	0	0	0	0	112.3	S186 A187	V2-S186 WeakPolarHBondContact CB-OG 3.41Å; V2-S186 VanDerWaalsContact CG1-CB 3.4Å; V2-S186 WeakPolarHBondContact CG1-O 3.1Å; V2-S186 WeakPolarHBondContact CG1-OG 3.32Å; V2-A187 WeakPolarHBondContact CA-O 3.09Å; V2-A187 PolarHBondContact N-O 2.91Å; V2-A187 VanDerWaalsContact N-O 3.11Å
3	T	26	Very low	27.2	Very low	105 Å²	105	128.4 Å²	128.4	64%	0.644	67%	0.674	S	S	*	*			trans	-125.4	131.8	161.4	45.9	0	0	0	0	117.5	S186 A187	T3-S186 VanDerWaalsContact CA-CB 3.42Å; T3-S186 CarbonylContact O-C 3.55Å; T3-S186 WeakPolarHBondContact O-CA 3.38Å; T3-S186 WeakPolarHBondContact O-CB 3.26Å; T3-A187 PolarHBondContact O-N 3.41Å; T3-A187 WeakPolarHBondContact OG1-CB 3.41Å
4	R	22	Very low	27.3	Very low	79 Å²	79	128.9 Å²	128.9	30%	0.298	66%	0.664	S	S	.	*			trans	-100.5	142.8	173.4	-169.1	175.6	-130	154.1	5.9	108.1	Y6 H180 S184 T185	R4-Y6 HydrophobicContact CG-CE2 4.12Å; R4-H180 PolarHBondContact NH2-O 3.11Å; R4-S184 VanDerWaalsContact CZ-OG 3.31Å; R4-S184 VanDerWaalsContact NE-C 3.26Å; R4-S184 VanDerWaalsContact NE-CB 3.29Å; R4-S184 PolarHBondContact NE-O 3.36Å; R4-S184 PolarHBondContact NE-OG 3.47Å; R4-S184 PolarHBondContact NH2-O 3.45Å; R4-S184 PolarHBondContact NH2-OG 3.15Å; R4-T185 HydrophobicContact CB-CG2 3.38Å; R4-T185 WeakPolarHBondContact CD-OG1 3.48Å; R4-T185 HydrophobicContact CG-CG2 4.16Å; R4-T185 VanDerWaalsContact CG-N 3.29Å; R4-T185 PolarHBondContact NE-OG1 3.36Å; R4-T185 VanDerWaalsContact NE-OG1 3.11Å; R4-T185 PolarHBondContact NH1-OG1 3.38Å; R4-T185 PolarHBondContact NH2-OG1 3.21Å
5	T	28.4	Very low	27.2	Very low	138 Å²	138	128.9 Å²	128.9	85%	0.847	66%	0.664	S	S	*	*			trans	-145.6	144.2	160	9.9	0	0	0	0	109.1
6	Y	26.5	Very low	27.2	Very low	187 Å²	187	134.8 Å²	134.8	73%	0.733	68%	0.677	S	S	*	*			trans	-91.8	154.1	-176.1	-65.4	-102.5	0	0	0	109.7	R4	R4-Y6 HydrophobicContact CG-CE2 4.12Å
7	L	25.8	Very low	27.3	Very low	164 Å²	164	137.4 Å²	137.4	86%	0.859	68%	0.683	S	S	*	*			trans	-128.4	115.3	169.6	-118.4	151	0	0	0	107.5
8	E	27.1	Very low	27.2	Very low	177 Å²	177	140 Å²	140	83%	0.827	69%	0.693	S	S	*	*			trans	-72.3	134.4	169	-69.7	178.9	133	0	0	108.7
9	I	26.5	Very low	27.3	Very low	142 Å²	142	137.8 Å²	137.8	73%	0.728	69%	0.69	S	S	*	*			trans	-106.4	108.3	174.2	-58.3	172	0	0	0	106.7
10	N	30.7	Very low	27.2	Very low	155 Å²	155	137.3 Å²	137.3	83%	0.829	69%	0.694	S	S	*	*			trans	-93	134.9	158.1	-74.1	-34.1	0	0	0	107.8
11	N	30.6	Very low	27.2	Very low	130 Å²	130	134.4 Å²	134.4	70%	0.695	69%	0.687	S	S	*	*			trans	-75.1	-176.9	-175.2	-65.4	-46.7	0	0	0	111.6
12	D	33.4	Very low	27.2	Very low	104 Å²	104	137.5 Å²	137.5	56%	0.556	69%	0.692	S	S	*	*			trans	89.8	92.3	163.3	-44.9	-52.3	0	0	0	114.5	Q241	D12-Q241 CarbonylContact C-O 3.51Å; D12-Q241 WeakPolarHBondContact CA-O 3.49Å; D12-Q241 WeakPolarHBondContact CB-O 3.19Å; D12-Q241 PolarHBondContact OD1-N 3.22Å
13	G	30.5	Very low	27.6	Very low	39 Å²	39	141.8 Å²	141.8	40%	0.402	70%	0.702	S	S	.	*			trans	-97.6	150.4	-166.1	0	0	0	0	0	114.6	Q241 N242	G13-Q241 PolarHBondContact N-O 3.46Å; G13-N242 PolarHBondContact N-O 3.46Å; G13-N242 WeakPolarHBondContact O-CB 3.34Å
14	Y	27.9	Very low	27.7	Very low	135 Å²	135	142.6 Å²	142.6	53%	0.529	71%	0.707	S	S	.	*			trans	-157.6	135.6	137.3	-95.8	-38.3	0	0	0	113.4	N242 L244	Y14-N242 HydrophobicContact CD1-CB 4.43Å; Y14-N242 HydrophobicContact CD2-CB 4.2Å; Y14-N242 HydrophobicContact CE1-CB 3.94Å; Y14-N242 HydrophobicContact CE2-CB 3.74Å; Y14-N242 VanDerWaalsContact CE2-CG 3.49Å; Y14-N242 WeakPolarHBondContact CE2-ND2 3.21Å; Y14-L244 HydrophobicContact CD1-CD1 3.74Å; Y14-L244 HydrophobicContact CD1-CG 4.38Å; Y14-L244 HydrophobicContact CE1-CD1 3.58Å; Y14-L244 HydrophobicContact CE1-CG 3.83Å
15	I	27	Very low	28.3	Very low	129 Å²	129	145.1 Å²	145.1	66%	0.662	73%	0.734	S	S	*	*			trans	53.5	109.9	149.3	-50.8	166	0	0	0	116.7	L244	I15-L244 HydrophobicContact CG1-CD1 4.08Å
16	Y	26.3	Very low	28.4	Very low	223 Å²	223	145.6 Å²	145.6	88%	0.875	73%	0.731	S	S	*	*			trans	-123.6	137.2	152.7	-145.5	-101.6	0	0	0	111.8
17	K	28.9	Very low	28.6	Very low	180 Å²	180	141.4 Å²	141.4	78%	0.783	73%	0.729	S	S	*	*	P	Polyproline II helix	trans	-74.8	158.1	175.2	-67.5	171.4	174.1	176.3	0	109.9	P19	K17-P19 WeakPolarHBondContact O-CD 3.1Å
18	Q	26.5	Very low	28.9	Very low	184 Å²	184	141.9 Å²	141.9	86%	0.86	73%	0.727	S	S	*	*	P	Polyproline II helix	trans	-52.9	131	166.3	-77.5	177.1	-48	0	0	110.9
19	P	29.3	Very low	29.2	Very low	98 Å²	98	141.3 Å²	141.3	64%	0.636	73%	0.73	S	S	*	*	P	Polyproline II helix	trans	-81.8	117.5	153.9	30.7	-25.6	0	0	0	108.9	K17 S21	K17-P19 WeakPolarHBondContact O-CD 3.1Å; P19-S21 PolarHBondContact O-N 3.03Å
20	V	23.9	Very low	29.2	Very low	127 Å²	127	142.5 Å²	142.5	77%	0.77	73%	0.73	S	S	*	*	P	Polyproline II helix	trans	-71.8	118	152.1	175.9	0	0	0	0	106.2	Y22	V20-Y22 HydrophobicContact CG1-CE2 4.41Å
21	S	28.4	Very low	29.2	Very low	78 Å²	78	141.9 Å²	141.9	55%	0.545	72%	0.722	S	S	.	*			trans	-146.2	105.8	173.2	59.6	0	0	0	0	111.9	P19	P19-S21 PolarHBondContact O-N 3.03Å
22	Y	25.2	Very low	29.2	Very low	210 Å²	210	146.2 Å²	146.2	82%	0.824	73%	0.729	S	S	*	*			trans	-54.2	136.1	159.6	-58.5	-97	0	0	0	110.2	V20	V20-Y22 HydrophobicContact CG1-CE2 4.41Å
23	F	27.9	Very low	29	Very low	194 Å²	194	148.9 Å²	148.9	85%	0.851	74%	0.738	S	S	*	*			trans	-139.8	119.7	157.9	-92.5	-75.2	0	0	0	111.7
24	T	29.5	Very low	28.9	Very low	122 Å²	122	158.1 Å²	158.1	75%	0.748	76%	0.761	S	S	*	*			trans	-78	154.9	172.9	47.5	0	0	0	0	111.2	N26	T24-N26 PolarHBondContact O-N 3.47Å
25	P	33.7	Very low	28.9	Very low	132 Å²	132	160.4 Å²	160.4	86%	0.857	77%	0.773	S	S	*	*			trans	-71.8	93.8	176	28.7	-33.7	0	0	0	111.9
26	N	31.9	Very low	29	Very low	148 Å²	148	159 Å²	159	79%	0.791	78%	0.775	S	S	*	*			trans	35.3	105.2	145.9	-149	6.2	0	0	0	118.8	T24	T24-N26 PolarHBondContact O-N 3.47Å
27	S	28.8	Very low	29.3	Very low	98 Å²	98	155.2 Å²	155.2	69%	0.685	77%	0.765	S	S	*	*			trans	-68.9	133.2	164	56.8	0	0	0	0	112.5
28	Q	32.3	Very low	29.4	Very low	174 Å²	174	153.7 Å²	153.7	81%	0.813	76%	0.761	S	S	*	*			trans	179.5	84.9	134.3	-100	171.3	32.3	0	0	112.4
29	N	33.3	Very low	29.6	Very low	165 Å²	165	152 Å²	152	88%	0.882	76%	0.757	S	S	*	*			trans	-166.1	72	153	-93.3	-39.8	0	0	0	105.8
30	F	28.2	Very low	29.7	Very low	167 Å²	167	156 Å²	156	73%	0.732	77%	0.772	S	S	*	*				65.8	93.8	82.6	-145.8	-86.6	0	0	0	112.3
31	Q	29.3	Very low	29.9	Very low	143 Å²	143	157.3 Å²	157.3	67%	0.668	77%	0.77	S	S	*	*			trans	57	107.4	158.5	-59	-179.8	-12.3	0	0	118.6
32	R	30.5	Very low	30	Very low	221 Å²	221	161.3 Å²	161.3	83%	0.834	78%	0.78	S	S	*	*				179.2	134.5	102.2	-93.9	157.6	-166.5	-145.1	1.8	111.9
33	Q	28.9	Very low	30.3	Very low	159 Å²	159	155.3 Å²	155.3	74%	0.743	77%	0.769	S	S	*	*			trans	52.1	114.1	142.3	-95.1	169.3	-14	0	0	117.7
34	W	29	Very low	30.3	Very low	233 Å²	233	156.5 Å²	156.5	88%	0.883	77%	0.768	S	S	*	*				-157.9	168.5	55	-100.4	80.2	0	0	0	113.8
35	K	28.6	Very low	30.1	Very low	184 Å²	184	157.7 Å²	157.7	80%	0.8	77%	0.769	S	S	*	*			trans	-98.2	166.4	177.7	-71.9	179.1	173.7	179.8	0	112.5
36	S	29.2	Very low	29.9	Very low	99 Å²	99	159.8 Å²	159.8	69%	0.692	77%	0.772	S	S	*	*			trans	65.4	147.4	162.6	63.9	0	0	0	0	116.1
37	H	32.3	Very low	29.6	Very low	144 Å²	144	159.2 Å²	159.2	67%	0.667	77%	0.769	S	S	*	*			cis	-129.1	136.3	25.8	-95.4	-108.1	0	0	0	112.5
38	Q	31.9	Very low	29.5	Very low	148 Å²	148	166.2 Å²	166.2	69%	0.692	78%	0.78	S	S	*	*				65.9	111.4	103	-66.5	-174.7	-26.3	0	0	117.3
39	N	28.9	Very low	29.2	Very low	148 Å²	148	166.6 Å²	166.6	79%	0.791	78%	0.782	S	S	*	*				47	113.8	121.8	-59.9	-11.5	0	0	0	119.7
40	L	32.5	Very low	29	Very low	182 Å²	182	165.9 Å²	165.9	95%	0.953	78%	0.783	S	S	*	*				-141.9	138.7	129	-107.4	157.1	0	0	0	109.5
41	H	28.3	Very low	29	Very low	155 Å²	155	161.5 Å²	161.5	72%	0.718	77%	0.773	S	S	*	*			trans	-98.9	165.4	-169.9	-146.7	-122.4	0	0	0	109.7
42	E	29.5	Very low	28.7	Very low	162 Å²	162	162.1 Å²	162.1	76%	0.757	78%	0.781	S	S	*	*			trans	66.1	148.3	161.3	-77.5	155.6	-138.5	0	0	117.4
43	S	30.9	Very low	28.5	Very low	84 Å²	84	159.4 Å²	159.4	59%	0.587	78%	0.777	S	S	*	*			cis	-157.6	145	9	-113.5	0	0	0	0	113
44	R	27.9	Very low	28.2	Very low	218 Å²	218	162 Å²	162	82%	0.823	78%	0.782	S	S	*	*			trans	55.8	114.5	140.5	-66.5	177.1	173.4	158.7	0.3	122.4
45	L	26	Very low	28	Very low	147 Å²	147	158.2 Å²	158.2	77%	0.77	78%	0.777	S	S	*	*				57.8	112.4	122.1	-62.8	166.6	0	0	0	120.2
46	L	30.3	Very low	27.7	Very low	177 Å²	177	155.3 Å²	155.3	93%	0.927	78%	0.775	S	S	*	*			trans	-153	120	131.1	-112.2	160.6	0	0	0	111.3
47	N	24.8	Very low	27.4	Very low	136 Å²	136	157.4 Å²	157.4	73%	0.727	78%	0.777	S	S	*	*			trans	-76	147.4	173.1	-74.2	-52.6	0	0	0	111
48	R	27.7	Very low	27.1	Very low	245 Å²	245	155.6 Å²	155.6	93%	0.925	78%	0.778	S	S	*	*				-175.7	145.7	108.3	-105	172.6	167.9	164.1	-4.1	114.8
49	H	25.8	Very low	26.7	Very low	182 Å²	182	155.2 Å²	155.2	84%	0.843	79%	0.786	S	S	*	*			trans	-61.4	148.1	168.3	-65.1	-82.1	0	0	0	112.9
50	V	28.7	Very low	26.6	Very low	149 Å²	149	154.2 Å²	154.2	90%	0.903	79%	0.786	S	S	*	*			trans	-128	139.5	135.8	-179.3	0	0	0	0	107.5
51	S	27.5	Very low	26.2	Very low	75 Å²	75	156.9 Å²	156.9	52%	0.524	78%	0.783	S	S	.	*			trans	-99.1	142.9	-170.1	53.7	0	0	0	0	113	Q53	S51-Q53 PolarHBondContact O-N 3.48Å
52	D	23.3	Very low	26.3	Very low	156 Å²	156	157.4 Å²	157.4	83%	0.834	79%	0.79	S	S	*	*			trans	-60.6	115.3	161.6	-64.3	-46	0	0	0	110.2
53	Q	26	Very low	26.3	Very low	164 Å²	164	156.7 Å²	156.7	77%	0.766	79%	0.792	S	S	*	*			trans	-114	106.4	170.8	-72.2	-167.7	-0.7	0	0	110.3	S51 I55	S51-Q53 PolarHBondContact O-N 3.48Å; Q53-I55 PolarHBondContact O-N 3.29Å
54	Y	23.5	Very low	26.1	Very low	213 Å²	213	159.5 Å²	159.5	84%	0.835	80%	0.8	S	S	*	*			trans	-71.2	111.3	168.2	-74.4	-94.4	0	0	0	110	T56	Y54-T56 PolarHBondContact O-N 3.27Å
55	I	23.6	Very low	26.1	Very low	154 Å²	154	156 Å²	156	79%	0.79	80%	0.798	S	S	*	*			trans	-73.4	113.3	170.6	-62.8	178.3	0	0	0	108.5	Q53	Q53-I55 PolarHBondContact O-N 3.29Å
56	T	23.1	Very low	26.3	Very low	123 Å²	123	154 Å²	154	76%	0.755	80%	0.796	S	S	*	*			trans	-98.2	115.4	176.8	-48.2	0	0	0	0	108.8	Y54	Y54-T56 PolarHBondContact O-N 3.27Å
57	I	23.5	Very low	26.1	Very low	143 Å²	143	154.2 Å²	154.2	73%	0.733	79%	0.792	S	S	*	*			trans	-87.8	122.6	176.6	-57.1	177.1	0	0	0	109.1	T59	I57-T59 PolarHBondContact O-N 3.21Å
58	P	24.7	Very low	26.4	Very low	106 Å²	106	157.3 Å²	157.3	69%	0.688	80%	0.799	S	S	*	*			trans	-79.5	119.3	178.9	30.6	-32.6	0	0	0	111.4	T60	P58-T60 PolarHBondContact O-N 3.43Å
59	T	24.7	Very low	26.3	Very low	141 Å²	141	153.1 Å²	153.1	87%	0.865	80%	0.795	S	S	*	*			trans	-77.8	100.6	169.2	52.7	0	0	0	0	110.5	I57	I57-T59 PolarHBondContact O-N 3.21Å
60	T	27.1	Very low	26.4	Very low	126 Å²	126	151.3 Å²	151.3	77%	0.773	80%	0.796	S	S	*	*			trans	-76.8	129.3	167.6	39.7	0	0	0	0	110.6	P58	P58-T60 PolarHBondContact O-N 3.43Å
61	R	23.9	Very low	26.2	Very low	238 Å²	238	154.3 Å²	154.3	90%	0.898	80%	0.797	S	S	*	*			trans	-68.6	131.6	168.8	-72.7	174.9	171.3	162.2	-4.5	109.4
62	L	29.3	Very low	26.2	Very low	166 Å²	166	154.3 Å²	154.3	87%	0.869	81%	0.809	S	S	*	*			trans	-122.1	127.2	157.2	-81.2	168.3	0	0	0	108.5
63	N	29.5	Very low	26.2	Very low	147 Å²	147	152.8 Å²	152.8	79%	0.786	81%	0.809	S	S	*	*			trans	-77.2	158.3	174.3	-73.3	-23	0	0	0	110.3
64	N	26.5	Very low	26.2	Very low	143 Å²	143	150.5 Å²	150.5	77%	0.765	81%	0.81	S	S	*	*			trans	-23.2	134.2	158.7	-45.1	-16.5	0	0	0	112.8
65	D	28.5	Very low	26.3	Very low	146 Å²	146	148 Å²	148	78%	0.781	81%	0.811	S	S	*	*				-171.9	164	68.8	-96.1	-48.5	0	0	0	114.2
66	S	30.6	Very low	26.3	Very low	104 Å²	104	148 Å²	148	73%	0.727	81%	0.811	S	S	*	*			trans	70.5	98.4	157.5	63.8	0	0	0	0	121.3
67	H	26.2	Very low	26.3	Very low	181 Å²	181	148.4 Å²	148.4	84%	0.838	81%	0.814	S	S	*	*				24	114.1	126.7	-71.6	-72.7	0	0	0	120.5
68	K	30.3	Very low	26.4	Very low	201 Å²	201	149 Å²	149	87%	0.874	82%	0.818	S	S	*	*				176.6	149.1	103.5	-97.6	161.1	-174.3	175.1	0	114.7
69	N	25.5	Very low	26.3	Very low	158 Å²	158	149.3 Å²	149.3	85%	0.845	82%	0.822	S	S	*	*			trans	-51.1	136	176.1	-53.6	-34.6	0	0	0	115.1
70	V	29.3	Very low	26.5	Very low	144 Å²	144	150.3 Å²	150.3	87%	0.873	82%	0.82	S	S	*	*			trans	-143.7	133.7	137.6	-179.2	0	0	0	0	109.1
71	K	23.8	Very low	26.4	Very low	211 Å²	211	151 Å²	151	92%	0.917	82%	0.82	S	S	*	*			trans	-88.8	140.3	167.5	-67.6	177.7	175.7	-179.3	0	109.3
72	G	26.9	Very low	26.7	Very low	75 Å²	75	145.7 Å²	145.7	77%	0.773	81%	0.814	S	S	*	*			trans	178.9	141.1	168.8	0	0	0	0	0	113.7
73	C	24.1	Very low	26.8	Very low	124 Å²	124	145.1 Å²	145.1	84%	0.838	81%	0.811	S	S	*	*			trans	-59.2	165.7	172.1	-52.1	0	0	0	0	111
74	C	26.6	Very low	26.8	Very low	117 Å²	117	144.7 Å²	144.7	79%	0.791	81%	0.809	S	S	*	*				-163.3	167.5	56.6	-69.5	0	0	0	0	113.1
75	N	23.6	Very low	27.2	Very low	160 Å²	160	145.8 Å²	145.8	86%	0.856	82%	0.815	S	S	*	*			trans	-55.1	144.2	172.2	-58.5	-25	0	0	0	112.9
76	I	24.8	Very low	27.3	Very low	154 Å²	154	144.7 Å²	144.7	79%	0.79	81%	0.809	S	S	*	*			trans	-117.9	109.6	165.9	-63	177.3	0	0	0	108.6	L78	I76-L78 HydrophobicContact CG2-CG 4.31Å
77	T	22.6	Very low	27.6	Very low	132 Å²	132	146.8 Å²	146.8	81%	0.81	81%	0.812	S	S	*	*			trans	-87	127.7	168.2	-52.4	0	0	0	0	108.5
78	L	25.1	Very low	27.9	Very low	155 Å²	155	144.2 Å²	144.2	81%	0.812	81%	0.805	S	S	*	*			trans	-110.5	110	172.4	-85.5	163.9	0	0	0	110.3	I76	I76-L78 HydrophobicContact CG2-CG 4.31Å
79	S	23.9	Very low	28.1	Very low	113 Å²	113	141.2 Å²	141.2	79%	0.79	80%	0.798	S	S	*	*			trans	-85.3	138.3	165.9	43.7	0	0	0	0	109.9
80	I	28.6	Very low	28.4	Very low	161 Å²	161	140.2 Å²	140.2	83%	0.826	79%	0.793	S	S	*	*			trans	-105.8	124.6	172.4	-63.1	-179.7	0	0	0	109
81	N	25.6	Very low	28.6	Very low	141 Å²	141	138.5 Å²	138.5	75%	0.754	79%	0.787	S	S	*	*			trans	-88.1	117.6	-176.8	-176.8	17.4	0	0	0	110.1
82	T	29.4	Very low	28.8	Very low	126 Å²	126	136.8 Å²	136.8	77%	0.773	78%	0.782	S	S	*	*			trans	-93.8	110.9	174.8	47.9	0	0	0	0	110.9
83	N	31.5	Very low	29	Very low	154 Å²	154	137.8 Å²	137.8	82%	0.824	78%	0.777	S	S	*	*			trans	-69.4	133.2	178.5	-106.8	-15.4	0	0	0	112.3
84	N	28.7	Very low	29.1	Very low	138 Å²	138	139.1 Å²	139.1	74%	0.738	78%	0.775	S	S	*	*			trans	-61.6	145.4	169.9	-93.5	-31.5	0	0	0	112.3
85	N	35	Very low	29.4	Very low	167 Å²	167	138.5 Å²	138.5	89%	0.893	77%	0.772	S	S	*	*			trans	-152.5	131	131.5	-119.4	-20.4	0	0	0	111.6
86	N	31.6	Very low	29.5	Very low	123 Å²	123	137 Å²	137	66%	0.658	76%	0.764	S	S	*	*			trans	-77.6	150.5	-172.4	-70.2	-36	0	0	0	112.8
87	N	35.8	Very low	29.7	Very low	147 Å²	147	140 Å²	140	79%	0.786	77%	0.767	S	S	*	*				-173.2	105.2	116.1	-93.3	-24.5	0	0	0	113.5
88	N	34.2	Very low	29.9	Very low	128 Å²	128	138.4 Å²	138.4	68%	0.684	76%	0.761	S	S	*	*			trans	29	114.7	130.6	-66.4	-0.5	0	0	0	119.4
89	N	34.1	Very low	29.8	Very low	137 Å²	137	138.4 Å²	138.4	73%	0.733	76%	0.76	S	S	*	*				179	140.8	84.2	-96.7	-33.2	0	0	0	115.8
90	N	31.2	Very low	30	Very low	138 Å²	138	140.9 Å²	140.9	74%	0.738	77%	0.765	S	S	*	*			trans	66.3	122.4	148.4	-74.2	-9.8	0	0	0	124.3
91	S	33.3	Very low	29.8	Very low	108 Å²	108	138.5 Å²	138.5	76%	0.755	76%	0.762	S	S	*	*			trans	75.6	135.5	137.1	69.7	0	0	0	0	118.6
92	H	29.2	Very low	29.8	Very low	174 Å²	174	135.4 Å²	135.4	81%	0.806	76%	0.756	S	S	*	*			cis	-159.2	164	-1.9	-141.9	45.7	0	0	0	111.3
93	C	30.5	Very low	29.8	Very low	97 Å²	97	136.1 Å²	136.1	66%	0.655	76%	0.755	S	S	*	*			trans	67.7	107.9	168.1	-55.5	0	0	0	0	117
94	N	26.4	Very low	29.5	Very low	152 Å²	152	135.3 Å²	135.3	81%	0.813	75%	0.751	S	S	*	*				66.5	129.2	77.8	-71.8	-10	0	0	0	113.3
95	S	33.5	Very low	29.6	Very low	104 Å²	104	137.7 Å²	137.7	73%	0.727	76%	0.757	S	S	*	*			cis	-157.7	130.4	19.8	46.6	0	0	0	0	115.5
96	N	25.4	Very low	29	Very low	128 Å²	128	134.9 Å²	134.9	68%	0.684	75%	0.75	S	S	*	*				36.9	126.1	125.6	-58.8	-20.4	0	0	0	122.4
97	Y	28.8	Very low	28.9	Very low	218 Å²	218	136.9 Å²	136.9	86%	0.855	76%	0.76	S	S	*	*				174.3	100.5	108.8	-90.4	-68.5	0	0	0	109.4
98	S	26.9	Very low	28.3	Very low	97 Å²	97	137.2 Å²	137.2	68%	0.678	76%	0.756	S	S	*	*				66.7	89.3	97.8	-55	0	0	0	0	114.7
99	I	22.9	Very low	28.1	Very low	156 Å²	156	139.6 Å²	139.6	80%	0.8	76%	0.763	S	S	*	*				50.5	111.1	87.4	-55.6	175.9	0	0	0	114.5
100	N	28.1	Very low	27.6	Very low	165 Å²	165	140.4 Å²	140.4	88%	0.882	76%	0.763	S	S	*	*				-160.9	146.8	122.2	-111.3	-21.3	0	0	0	114.3
101	S	23.1	Very low	27.6	Very low	110 Å²	110	142.8 Å²	142.8	77%	0.769	77%	0.766	S	S	*	*			trans	-108.5	152.5	178.7	174	0	0	0	0	109.9
102	A	26.6	Very low	27.4	Very low	76 Å²	76	146 Å²	146	63%	0.628	77%	0.769	S	S	*	*				153.9	151.3	123.2	0	0	0	0	0	115.5
103	N	28.8	Very low	27.3	Very low	141 Å²	141	146.8 Å²	146.8	75%	0.754	77%	0.77	S	S	*	*			trans	78.4	99.1	149.2	-60.6	-23	0	0	0	121.6
104	N	26.1	Very low	27.5	Very low	138 Å²	138	147.3 Å²	147.3	74%	0.738	77%	0.773	S	S	*	*				21	120	114.6	-56.2	-32.6	0	0	0	118
105	H	30	Very low	28.1	Very low	187 Å²	187	144.9 Å²	144.9	87%	0.866	77%	0.765	S	S	*	*				-171.8	155.1	98	-113.5	-90.1	0	0	0	114
106	C	22.9	Very low	28.1	Very low	108 Å²	108	147 Å²	147	73%	0.73	77%	0.767	S	S	*	*			trans	-66.4	144.1	175.2	177.4	0	0	0	0	113.2
107	L	28.7	Very low	28.4	Very low	166 Å²	166	147 Å²	147	87%	0.869	77%	0.768	S	S	*	*			trans	-160.9	134.3	141.3	-110.3	164.6	0	0	0	112.4
108	Q	23.3	Very low	28.4	Very low	153 Å²	153	141.6 Å²	141.6	72%	0.715	76%	0.757	S	S	*	*			trans	-75	146.5	170.7	-61.6	163.8	-43.9	0	0	110.6
109	Q	30.4	Very low	28.6	Very low	179 Å²	179	146.3 Å²	146.3	84%	0.836	76%	0.761	S	S	*	*			trans	-139.6	127.1	142.4	-72.5	-160.9	-4	0	0	111.5
110	H	24.2	Very low	29.1	Very low	154 Å²	154	144.4 Å²	144.4	71%	0.713	75%	0.753	S	S	*	*			trans	-77.6	149.3	167.1	-77.5	-100.3	0	0	0	110.4
111	F	30.5	Very low	29.1	Very low	187 Å²	187	142.2 Å²	142.2	82%	0.82	74%	0.741	S	S	*	*			trans	-136.5	162.3	148.6	-93.6	-75.3	0	0	0	112.2
112	H	28.9	Very low	29.5	Very low	176 Å²	176	142.8 Å²	142.8	82%	0.815	73%	0.734	S	S	*	*			trans	-99.4	155.1	-145.2	-93.5	-110.9	0	0	0	117
113	K	27	Very low	29.7	Very low	191 Å²	191	145.2 Å²	145.2	83%	0.83	74%	0.737	S	S	*	*			trans	-77.1	-168.5	159.3	-109.3	-174.7	179.1	178.3	0	110.7
114	P	35.9	Very low	29.8	Very low	108 Å²	108	143.8 Å²	143.8	70%	0.701	73%	0.729	S	S	*	*			cis	-137.5	-122.9	-38.2	38.9	-17	0	0	0	110.1
115	P	37.3	Very low	30.1	Very low	101 Å²	101	144.7 Å²	144.7	66%	0.656	73%	0.728	S	S	*	*				-126	-152.2	-54	40.8	-22.2	0	0	0	113.5
116	L	34.3	Very low	29.9	Very low	147 Å²	147	145.4 Å²	145.4	77%	0.77	72%	0.723	S	S	*	*			trans	110.6	144.6	162.6	-59.1	168.4	0	0	0	114.4
117	N	31.8	Very low	30.2	Very low	130 Å²	130	146.4 Å²	146.4	70%	0.695	72%	0.721	S	S	*	*			cis	-158.9	139.6	-13.2	-123.3	5.8	0	0	0	112.1
118	V	28.8	Very low	30.1	Very low	103 Å²	103	144 Å²	144	62%	0.624	71%	0.712	S	S	*	*				40.1	133.3	127.6	-169.1	0	0	0	0	122.4
119	Y	31.5	Very low	30.2	Very low	197 Å²	197	141.3 Å²	141.3	77%	0.773	71%	0.711	S	S	*	*				168.2	114.2	122.8	-104	-100.1	0	0	0	108.4
120	N	33.2	Very low	30.1	Very low	116 Å²	116	140.8 Å²	140.8	62%	0.62	71%	0.706	S	S	*	*				74.8	143.8	95.7	-88.7	7.8	0	0	0	115.4
121	N	28	Very low	30.3	Very low	119 Å²	119	140 Å²	140	64%	0.636	70%	0.702	S	S	*	*			cis	-173.5	176.6	-12.4	-146.9	-17.2	0	0	0	110.1
122	I	30.9	Very low	30.1	Very low	122 Å²	122	138.3 Å²	138.3	63%	0.626	70%	0.702	S	S	*	*			trans	80.9	124.5	138.8	-82.3	163.9	0	0	0	122.3
123	N	31.7	Very low	30.2	Very low	127 Å²	127	135.1 Å²	135.1	68%	0.679	70%	0.697	S	S	*	*			trans	76.9	148.3	147.1	-70	3.7	0	0	0	122.2
124	N	29.6	Very low	30.2	Very low	111 Å²	111	131.3 Å²	131.3	59%	0.594	69%	0.694	S	S	*	*			cis	-171.2	165.9	-24.8	-112.7	-13.7	0	0	0	111.2
125	H	33	Very low	29.8	Very low	157 Å²	157	132.2 Å²	132.2	73%	0.727	70%	0.698	S	S	*	*			trans	74.9	154.3	156.2	-59.8	-40.1	0	0	0	120.7
126	R	26.7	Very low	29.1	Very low	201 Å²	201	135.1 Å²	135.1	76%	0.758	71%	0.705	S	S	*	*			cis	-176.8	156.2	-36.5	-147.9	-171.6	163.9	175.8	-4.2	108.5
127	L	28.3	Very low	28.6	Very low	130 Å²	130	137.5 Å²	137.5	68%	0.681	70%	0.704	S	S	*	*			trans	72.2	155.6	156.8	-58.1	174.3	0	0	0	119.7
128	V	26.9	Very low	28.2	Very low	114 Å²	114	140.6 Å²	140.6	69%	0.691	71%	0.711	S	S	*	*			cis	-175.8	127.5	-43.9	124.4	0	0	0	0	110.3
129	S	26.2	Very low	28.1	Very low	98 Å²	98	139.4 Å²	139.4	69%	0.685	72%	0.719	S	S	*	*			trans	62	167.6	153.5	82	0	0	0	0	119.1
130	K	26.4	Very low	27.7	Very low	168 Å²	168	138.5 Å²	138.5	73%	0.73	72%	0.722	S	S	*	*			cis	-165.9	173.4	4.1	-137.3	160.7	161.2	-138.4	0	111.3
131	E	29.3	Very low	27.4	Very low	136 Å²	136	141.3 Å²	141.3	64%	0.636	73%	0.729	S	S	*	*			trans	82	93.7	148.9	-78.3	154.3	-138.2	0	0	123.1
132	N	26.8	Very low	27.3	Very low	153 Å²	153	142.7 Å²	142.7	82%	0.818	74%	0.736	S	S	*	*				82.8	154.5	110.6	-68.5	-2.1	0	0	0	124.1
133	P	31.6	Very low	27.1	Very low	108 Å²	108	147.7 Å²	147.7	70%	0.701	75%	0.747	S	S	*	*			trans	-122.1	173.3	-157	42.8	-29.7	0	0	0	115.8
134	S	26.2	Very low	26.8	Very low	111 Å²	111	146.7 Å²	146.7	78%	0.776	75%	0.749	S	S	*	*			trans	-178.5	141.3	145.2	-86.4	0	0	0	0	117.5
135	T	27.6	Very low	26.6	Very low	128 Å²	128	147.3 Å²	147.3	79%	0.785	76%	0.758	S	S	*	*			trans	56	104.4	142.4	60	0	0	0	0	125
136	M	23	Very low	26.3	Very low	161 Å²	161	144.5 Å²	144.5	79%	0.793	76%	0.755	S	S	*	*				43.8	115.7	120.1	-75.6	-176.9	60.2	0	0	124.9
137	R	23.9	Very low	26.4	Very low	198 Å²	198	142.8 Å²	142.8	75%	0.747	76%	0.76	S	S	*	*				84.1	123.5	120.1	-76.9	-157	-177.3	-166.7	1.1	123.9
138	F	22.4	Very low	26.2	Very low	195 Å²	195	141.2 Å²	141.2	86%	0.855	76%	0.758	S	S	*	*			trans	71.8	115.5	145.1	-84	-103.7	0	0	0	120.3
139	G	25.9	Very low	26.5	Very low	77 Å²	77	141.9 Å²	141.9	79%	0.794	77%	0.765	S	S	*	*			trans	178.7	126.9	167.3	0	0	0	0	0	110.6
140	E	24.4	Very low	26.5	Very low	178 Å²	178	144.6 Å²	144.6	83%	0.832	77%	0.771	S	S	*	*			trans	-78	143.3	-172.8	-50.2	167.1	132.6	0	0	112.6
141	K	26.9	Very low	26.6	Very low	175 Å²	175	140.6 Å²	140.6	76%	0.761	76%	0.764	S	S	*	*				165.7	134.8	114.6	-93.2	170.1	-178.4	167.7	0	116
142	L	26.5	Very low	26.6	Very low	149 Å²	149	141 Å²	141	78%	0.78	77%	0.77	S	S	*	*			trans	74.4	128.3	136.9	-66.1	169	0	0	0	122.4
143	R	25.1	Very low	26.6	Very low	226 Å²	226	138.1 Å²	138.1	85%	0.853	76%	0.759	S	S	*	*			trans	79.7	122.1	151.9	-73.1	-176.8	171.3	-156.8	-2.1	119.6
144	S	25.5	Very low	26.4	Very low	106 Å²	106	136.6 Å²	136.6	74%	0.741	75%	0.745	S	S	*	*			trans	58.1	124.8	144.3	59.7	0	0	0	0	117.3
145	T	25.9	Very low	26.4	Very low	125 Å²	125	137.2 Å²	137.2	77%	0.767	74%	0.739	S	S	*	*			cis	-155.6	166.6	38	41.1	0	0	0	0	112.9
146	S	27.5	Very low	26.4	Very low	97 Å²	97	138.2 Å²	138.2	68%	0.678	73%	0.729	S	S	*	*			trans	5.1	116.2	156.8	50.7	0	0	0	0	118.7
147	L	27.7	Very low	26.5	Very low	165 Å²	165	138.8 Å²	138.8	86%	0.864	73%	0.728	S	S	*	*				72.5	135.6	85.4	-78.7	171.5	0	0	0	115
148	P	25.6	Very low	26.5	Very low	97 Å²	97	135.3 Å²	135.3	63%	0.63	73%	0.729	S	S	*	*			trans	-89.7	151.4	-165.3	36.1	-36	0	0	0	113.7	L150	P148-L150 PolarHBondContact O-N 2.91Å
149	P	31.3	Very low	26.8	Very low	128 Å²	128	131.4 Å²	131.4	83%	0.831	73%	0.726	S	S	*	*			trans	-80	112.8	160	32	-28.5	0	0	0	109.5
150	L	27.4	Very low	26.8	Very low	155 Å²	155	131.3 Å²	131.3	81%	0.812	71%	0.705	S	S	*	*			trans	-90.9	117.1	156.6	-79.6	164.2	0	0	0	106.4	P148 L152	P148-L150 PolarHBondContact O-N 2.91Å; L150-L152 PolarHBondContact O-N 3.44Å
151	S	27.2	Very low	27	Very low	85 Å²	85	132.4 Å²	132.4	59%	0.594	71%	0.707	S	S	*	*			trans	-65.8	121.6	-178.4	36.8	0	0	0	0	111.1
152	L	29.5	Very low	26.9	Very low	145 Å²	145	126.4 Å²	126.4	76%	0.759	69%	0.687	S	S	*	*			trans	-116.6	145.4	167.6	-81.4	163.2	0	0	0	107.1	L150 I154	L150-L152 PolarHBondContact O-N 3.44Å; L152-I154 PolarHBondContact O-N 2.87Å
153	P	28.3	Very low	27	Very low	91 Å²	91	125.8 Å²	125.8	59%	0.591	68%	0.683	S	S	*	*			trans	-67.5	134	-175.8	28	-34.3	0	0	0	110.9	I425	P153-I425 HydrophobicContact CB-CD1 4.21Å
154	I	25.8	Very low	27.1	Very low	77 Å²	77	120.4 Å²	120.4	40%	0.395	67%	0.67	S	S	.	*			trans	-95.4	146.8	179.4	-49.2	175.1	0	0	0	109	L152 Y156 D412	L152-I154 PolarHBondContact O-N 2.87Å; I154-Y156 HydrophobicContact CG2-CD2 3.61Å; I154-Y156 HydrophobicContact CG2-CE2 3.28Å; I154-D412 WeakPolarHBondContact CG2-OD2 3.48Å
155	N	27.9	Very low	27.3	Very low	123 Å²	123	117.2 Å²	117.2	66%	0.658	65%	0.65	S	S	*	*			trans	-156.9	109.3	161.8	-95.1	-33.7	0	0	0	107.2
156	Y	25.8	Very low	27.4	Very low	149 Å²	149	117.9 Å²	117.9	58%	0.584	65%	0.649	S	S	*	*			trans	-77.1	160.3	168.2	-63	-91.3	0	0	0	109.1	I154 D412	I154-Y156 HydrophobicContact CG2-CD2 3.61Å; I154-Y156 HydrophobicContact CG2-CE2 3.28Å; Y156-D412 HydrophobicContact CD2-CB 4.08Å; Y156-D412 WeakPolarHBondContact CD2-OD1 3.49Å; Y156-D412 WeakPolarHBondContact CD2-OD2 3.04Å; Y156-D412 HydrophobicContact CE2-CB 3.59Å; Y156-D412 WeakPolarHBondContact CE2-OD2 3.42Å
157	F	26.5	Very low	27.6	Very low	174 Å²	174	115.6 Å²	115.6	76%	0.763	63%	0.631	S	S	*	*				-160	156	52.9	-107.3	-98	0	0	0	113
158	T	24.5	Very low	27.7	Very low	125 Å²	125	110.3 Å²	110.3	77%	0.767	62%	0.616	S	S	*	*			trans	11.8	152.4	153.4	60	0	0	0	0	122.5
159	S	27.3	Very low	28	Very low	113 Å²	113	115.4 Å²	115.4	79%	0.79	63%	0.631	S	S	*	*			cis	-144.5	137	5.7	96.2	0	0	0	0	109.7
160	Q	25.9	Very low	27.9	Very low	75 Å²	75	112.3 Å²	112.3	35%	0.35	61%	0.61	S	S	.	*			trans	-101.7	126.1	-174.9	-72.1	179.4	-7.6	0	0	113.1	S162 R284 S286 I288	Q160-S162 PolarHBondContact O-N 3.11Å; Q160-R284 VanDerWaalsContact OE1-CZ 3.3Å; Q160-R284 VanDerWaalsContact OE1-NE 3.15Å; Q160-S286 PolarHBondContact OE1-OG 3.02Å; Q160-I288 HydrophobicContact CG-CG1 4.36Å
161	K	28.7	Very low	28	Very low	200 Å²	200	108 Å²	108	87%	0.87	59%	0.593	S	S	*	*			trans	-69.3	95.8	155.3	-76.2	-177.9	177.7	176.8	0	108.5
162	S	26	Very low	28.3	Very low	49 Å²	49	108.7 Å²	108.7	34%	0.343	60%	0.596	S	S	.	*			trans	-88.4	126.1	174.5	59	0	0	0	0	111	Q160	Q160-S162 PolarHBondContact O-N 3.11Å
163	I	28.6	Very low	28.6	Very low	136 Å²	136	105 Å²	105	70%	0.697	58%	0.582	S	S	*	*	E	Extended strand (participates in β ladder)	trans	-94.2	107.3	164.9	-60.6	176.9	0	0	0	106.7	A165	I163-A165 PolarHBondContact O-N 2.9Å
164	I	26.8	Very low	29	Very low	114 Å²	114	103.7 Å²	103.7	59%	0.585	57%	0.57	S	S	*	*	E	Extended strand (participates in β ladder)	trans	-87.6	101.8	173.9	-59	175.5	0	0	0	108	N166	I164-N166 PolarHBondContact O-N 3.38Å
165	A	29	Very low	29.5	Very low	39 Å²	39	103.5 Å²	103.5	32%	0.322	57%	0.572	S	S	.	*	E	Extended strand (participates in β ladder)	trans	-85.6	105.9	170.6	0	0	0	0	0	109.9	I163 T167	I163-A165 PolarHBondContact O-N 2.9Å; A165-T167 VanDerWaalsContact C-N 3.32Å; A165-T167 HydrophobicContact CB-CG2 4.42Å; A165-T167 PolarHBondContact O-N 2.83Å
166	N	28.2	Very low	29.7	Very low	139 Å²	139	102.6 Å²	102.6	74%	0.743	57%	0.567	S	S	*	*			trans	-75.5	83.9	167.9	-90.2	-16	0	0	0	109.8	I164 G168	I164-N166 PolarHBondContact O-N 3.38Å; N166-G168 PolarHBondContact O-N 2.97Å
167	T	32.3	Very low	30.2	Very low	48 Å²	48	100.8 Å²	100.8	29%	0.294	56%	0.564	S	S	.	*			trans	-78	70.9	173.9	52.2	0	0	0	0	111.3	A165 H169 T170	A165-T167 VanDerWaalsContact C-N 3.32Å; A165-T167 HydrophobicContact CB-CG2 4.42Å; A165-T167 PolarHBondContact O-N 2.83Å; T167-H169 PolarHBondContact O-N 3.47Å; T167-T170 WeakPolarHBondContact CB-OG1 3.44Å
168	G	29	Very low	30.4	Very low	55 Å²	55	97.3 Å²	97.3	57%	0.567	55%	0.551	S	S	*	*	T	Hydrogen-bonded Turn	trans	-65.5	118.2	163.3	0	0	0	0	0	109.8	N166 T170	N166-G168 PolarHBondContact O-N 2.97Å; G168-T170 PolarHBondContact O-N 2.96Å
169	H	31.7	Very low	30.8	Very low	204 Å²	204	94.9 Å²	94.9	94%	0.944	54%	0.539	S	S	*	.	T	Hydrogen-bonded Turn	trans	55.3	44	168.4	-53.7	-85.6	0	0	0	116.6	T167	T167-H169 PolarHBondContact O-N 3.47Å
170	T	30.5	Very low	30.9	Very low	62 Å²	62	95.1 Å²	95.1	38%	0.38	53%	0.527	S	S	.	.			trans	-107.4	136.1	172	59.4	0	0	0	0	111.8	T167 G168 L174	T167-T170 WeakPolarHBondContact CB-OG1 3.44Å; G168-T170 PolarHBondContact O-N 2.96Å; T170-L174 HydrophobicContact CG2-CD2 3.66Å
171	S	29.5	Very low	31.4	Very low	64 Å²	64	98.9 Å²	98.9	45%	0.448	54%	0.542	S	S	.	.			trans	-63.6	159.2	-176.4	67.2	0	0	0	0	112.8	S173 L174	S171-S173 PolarHBondContact O-N 2.83Å; S171-S173 PolarHBondContact OG-OG 3.47Å; S171-L174 PolarHBondContact O-N 2.78Å
172	P	32.8	Very low	31.5	Very low	101 Å²	101	97.3 Å²	97.3	66%	0.656	54%	0.536	S	S	*	.	H	α-helix	trans	-55.4	-21.3	173.9	-27.5	35.9	0	0	0	114.7	L174 V175 N176	P172-L174 VanDerWaalsContact C-N 3.3Å; P172-L174 PolarHBondContact O-N 2.73Å; P172-V175 PolarHBondContact O-N 2.85Å; P172-N176 PolarHBondContact O-N 3.26Å
173	S	36.6	Very low	31.7	Very low	68 Å²	68	99.4 Å²	99.4	48%	0.476	55%	0.55	S	S	.	*	H	α-helix	trans	-68.2	-28.2	176.3	76.6	0	0	0	0	112.7	S171 Q177	S171-S173 PolarHBondContact O-N 2.83Å; S171-S173 PolarHBondContact OG-OG 3.47Å; S173-Q177 WeakPolarHBondContact O-CB 3.36Å; S173-Q177 WeakPolarHBondContact O-CG 3.4Å; S173-Q177 PolarHBondContact O-N 3.42Å
174	L	36.3	Very low	31.7	Very low	63 Å²	63	94.9 Å²	94.9	33%	0.33	53%	0.53	S	S	.	.	H	α-helix	trans	-70.9	-37.7	178.1	-161	80.4	0	0	0	111.7	T170 S171 P172 Q177 M178	T170-L174 HydrophobicContact CG2-CD2 3.66Å; S171-L174 PolarHBondContact O-N 2.78Å; P172-L174 VanDerWaalsContact C-N 3.3Å; P172-L174 PolarHBondContact O-N 2.73Å; L174-Q177 PolarHBondContact O-N 2.75Å; L174-M178 WeakPolarHBondContact O-CG 3.34Å; L174-M178 PolarHBondContact O-N 2.9Å
175	V	34.8	Very low	31.7	Very low	73 Å²	73	92.3 Å²	92.3	44%	0.442	52%	0.52	S	S	.	.	H	α-helix	trans	-68.3	-42.6	176.5	-177.8	0	0	0	0	110.5	P172 Q177 M178 C179	P172-V175 PolarHBondContact O-N 2.85Å; V175-Q177 VanDerWaalsContact C-N 3.33Å; V175-Q177 PolarHBondContact O-N 3.42Å; V175-M178 WeakPolarHBondContact O-CB 3.42Å; V175-M178 PolarHBondContact O-N 3.02Å; V175-C179 PolarHBondContact O-N 3.31Å; V175-C179 PolarHBondContact O-SG 2.66Å
176	N	33.2	Very low	31.9	Very low	104 Å²	104	92.2 Å²	92.2	56%	0.556	52%	0.517	S	S	*	.	H	α-helix	trans	-65.2	-34.6	172.4	-79.4	-2.1	0	0	0	112.5	P172 C179 H180	P172-N176 PolarHBondContact O-N 3.26Å; N176-C179 PolarHBondContact O-N 3.45Å; N176-H180 WeakPolarHBondContact O-CB 3.15Å; N176-H180 PolarHBondContact O-CD2 3.02Å; N176-H180 PolarHBondContact O-N 3.31Å
177	Q	36.4	Very low	31.8	Very low	110 Å²	110	88.4 Å²	88.4	51%	0.514	51%	0.505	S	S	.	.	H	α-helix	trans	-65	-36.7	172	-82.8	-177.1	-5.5	0	0	112.8	S173 L174 V175 K181	S173-Q177 WeakPolarHBondContact O-CB 3.36Å; S173-Q177 WeakPolarHBondContact O-CG 3.4Å; S173-Q177 PolarHBondContact O-N 3.42Å; L174-Q177 PolarHBondContact O-N 2.75Å; V175-Q177 VanDerWaalsContact C-N 3.33Å; V175-Q177 PolarHBondContact O-N 3.42Å; Q177-K181 VanDerWaalsContact O-CB 3.31Å; Q177-K181 WeakPolarHBondContact O-CB 3.33Å; Q177-K181 WeakPolarHBondContact O-CG 3.45Å; Q177-K181 PolarHBondContact O-N 2.59Å
178	M	31.2	Very low	31.6	Very low	101 Å²	101	89.3 Å²	89.3	50%	0.498	51%	0.512	S	S	.	.	H	α-helix	trans	-61.5	-53.8	172.2	-70.5	-82.6	-166.1	0	0	110.3	L174 V175 H180 K181 F182	L174-M178 WeakPolarHBondContact O-CG 3.34Å; L174-M178 PolarHBondContact O-N 2.9Å; V175-M178 WeakPolarHBondContact O-CB 3.42Å; V175-M178 PolarHBondContact O-N 3.02Å; M178-H180 VanDerWaalsContact C-N 3.35Å; M178-H180 PolarHBondContact O-N 2.93Å; M178-K181 PolarHBondContact O-N 3.05Å; M178-K181 VanDerWaalsContact O-N 3.15Å; M178-F182 WeakPolarHBondContact O-CD2 2.98Å; M178-F182 PolarHBondContact O-N 3.45Å
179	C	31.2	Very low	31.5	Very low	75 Å²	75	94 Å²	94	51%	0.507	52%	0.52	S	S	.	.	H	α-helix	trans	-59.5	-41.7	179.8	-64.3	0	0	0	0	112.6	V175 N176 F182 S183	V175-C179 PolarHBondContact O-N 3.31Å; V175-C179 PolarHBondContact O-SG 2.66Å; N176-C179 PolarHBondContact O-N 3.45Å; C179-F182 PolarHBondContact O-N 3.21Å; C179-S183 PolarHBondContact O-N 3.01Å
180	H	30.8	Very low	31.5	Very low	117 Å²	117	89.7 Å²	89.7	54%	0.542	50%	0.5	S	S	.	.	H	α-helix	trans	-70.9	-30	176.2	-88.1	-72.9	0	0	0	114.1	R4 N176 M178 F182 S183 S184	R4-H180 PolarHBondContact NH2-O 3.11Å; N176-H180 WeakPolarHBondContact O-CB 3.15Å; N176-H180 PolarHBondContact O-CD2 3.02Å; N176-H180 PolarHBondContact O-N 3.31Å; M178-H180 VanDerWaalsContact C-N 3.35Å; M178-H180 PolarHBondContact O-N 2.93Å; H180-F182 VanDerWaalsContact C-N 3.28Å; H180-F182 PolarHBondContact O-N 2.96Å; H180-S183 PolarHBondContact O-N 2.87Å; H180-S184 PolarHBondContact O-N 3.45Å
181	K	34.8	Very low	31.3	Very low	155 Å²	155	92 Å²	92	67%	0.674	52%	0.518	S	S	*	.	H	α-helix	trans	-68.5	-24.3	176.4	-90.3	-175.2	173.1	-178.5	0	113.5	Q177 M178	Q177-K181 VanDerWaalsContact O-CB 3.31Å; Q177-K181 WeakPolarHBondContact O-CB 3.33Å; Q177-K181 WeakPolarHBondContact O-CG 3.45Å; Q177-K181 PolarHBondContact O-N 2.59Å; M178-K181 PolarHBondContact O-N 3.05Å; M178-K181 VanDerWaalsContact O-N 3.15Å
182	F	31.5	Very low	31.4	Very low	167 Å²	167	91 Å²	91	73%	0.732	52%	0.518	S	S	*	.	H	α-helix	trans	-90.8	-16.4	174.6	-79	-79.3	0	0	0	113.9	M178 C179 H180	M178-F182 WeakPolarHBondContact O-CD2 2.98Å; M178-F182 PolarHBondContact O-N 3.45Å; C179-F182 PolarHBondContact O-N 3.21Å; H180-F182 VanDerWaalsContact C-N 3.28Å; H180-F182 PolarHBondContact O-N 2.96Å
183	S	31	Very low	31.4	Very low	92 Å²	92	88.2 Å²	88.2	64%	0.643	50%	0.503	S	S	*	.	H	α-helix	trans	-95.7	-17.8	-173.2	152.1	0	0	0	0	114.6	C179 H180	C179-S183 PolarHBondContact O-N 3.01Å; H180-S183 PolarHBondContact O-N 2.87Å
184	S	27.5	Very low	31.4	Very low	41 Å²	41	89.4 Å²	89.4	29%	0.287	50%	0.504	S	S	.	.	S	Bend	trans	-167.2	159.6	177.2	46	0	0	0	0	109	R4 H180	R4-S184 VanDerWaalsContact CZ-OG 3.31Å; R4-S184 VanDerWaalsContact NE-C 3.26Å; R4-S184 VanDerWaalsContact NE-CB 3.29Å; R4-S184 PolarHBondContact NE-O 3.36Å; R4-S184 PolarHBondContact NE-OG 3.47Å; R4-S184 PolarHBondContact NH2-O 3.45Å; R4-S184 PolarHBondContact NH2-OG 3.15Å; H180-S184 PolarHBondContact O-N 3.45Å
185	T	28.2	Very low	31.8	Very low	61 Å²	61	96 Å²	96	37%	0.374	53%	0.525	S	S	.	.			trans	58.2	110.5	-152.8	15.5	0	0	0	0	109	R4	R4-T185 HydrophobicContact CB-CG2 3.38Å; R4-T185 WeakPolarHBondContact CD-OG1 3.48Å; R4-T185 HydrophobicContact CG-CG2 4.16Å; R4-T185 VanDerWaalsContact CG-N 3.29Å; R4-T185 PolarHBondContact NE-OG1 3.36Å; R4-T185 VanDerWaalsContact NE-OG1 3.11Å; R4-T185 PolarHBondContact NH1-OG1 3.38Å; R4-T185 PolarHBondContact NH2-OG1 3.21Å
186	S	32.4	Very low	32.1	Very low	37 Å²	37	99.7 Å²	99.7	26%	0.259	54%	0.537	S	S	.	.			cis	176.7	156.7	12.9	7.4	0	0	0	0	112.2	V2 T3 C188	V2-S186 WeakPolarHBondContact CB-OG 3.41Å; V2-S186 VanDerWaalsContact CG1-CB 3.4Å; V2-S186 WeakPolarHBondContact CG1-O 3.1Å; V2-S186 WeakPolarHBondContact CG1-OG 3.32Å; T3-S186 VanDerWaalsContact CA-CB 3.42Å; T3-S186 CarbonylContact O-C 3.55Å; T3-S186 WeakPolarHBondContact O-CA 3.38Å; T3-S186 WeakPolarHBondContact O-CB 3.26Å; S186-C188 PolarHBondContact O-N 3.37Å
187	A	26	Very low	32.9	Very low	58 Å²	58	96.8 Å²	96.8	48%	0.479	52%	0.522	S	S	.	.			trans	-59	110.6	-170.7	0	0	0	0	0	117.7	M1 V2 T3	M1-A187 CarbonylContact C-O 2.88Å; M1-A187 WeakPolarHBondContact CB-O 3.38Å; M1-A187 CarbonylContact O-C 3.42Å; V2-A187 WeakPolarHBondContact CA-O 3.09Å; V2-A187 PolarHBondContact N-O 2.91Å; V2-A187 VanDerWaalsContact N-O 3.11Å; T3-A187 PolarHBondContact O-N 3.41Å; T3-A187 WeakPolarHBondContact OG1-CB 3.41Å
188	C	28.6	Very low	33.4	Very low	67 Å²	67	93.8 Å²	93.8	45%	0.453	51%	0.513	S	S	.	.			trans	-95.8	115.3	170.6	36.4	0	0	0	0	113.1	M1 S186 H190	M1-C188 WeakPolarHBondContact O-CA 2.99Å; M1-C188 WeakPolarHBondContact O-CB 3.38Å; M1-C188 PolarHBondContact O-N 3.42Å; S186-C188 PolarHBondContact O-N 3.37Å; C188-H190 WeakPolarHBondContact CB-NE2 3.31Å; C188-H190 PolarHBondContact O-N 3.1Å; C188-H190 PolarHBondContact O-ND1 2.71Å; C188-H190 PolarHBondContact SG-CE1 3.37Å; C188-H190 PolarHBondContact SG-NE2 3.21Å
189	Q	26	Very low	34.3	Very low	155 Å²	155	96 Å²	96	72%	0.724	52%	0.516	S	S	*	.			trans	-62	93.3	170.6	-75.6	-179.4	-25.8	0	0	111.6	M1	M1-Q189 HydrophobicContact CB-CG 4.36Å; M1-Q189 HydrophobicContact CG-CG 4.34Å; M1-Q189 HydrophobicContact SD-CG 3.78Å; M1-Q189 PolarHBondContact SD-OE1 2.91Å; M1-Q189 VanDerWaalsContact SD-OE1 3.42Å
190	H	32.4	Very low	35.1	Very low	113 Å²	113	97.4 Å²	97.4	52%	0.523	52%	0.517	S	S	.	.			trans	-153.1	108.4	160.4	36.5	52.5	0	0	0	108.5	C188	C188-H190 WeakPolarHBondContact CB-NE2 3.31Å; C188-H190 PolarHBondContact O-N 3.1Å; C188-H190 PolarHBondContact O-ND1 2.71Å; C188-H190 PolarHBondContact SG-CE1 3.37Å; C188-H190 PolarHBondContact SG-NE2 3.21Å
191	S	26.6	Very low	35.7	Very low	110 Å²	110	93.8 Å²	93.8	77%	0.769	51%	0.505	S	S	*	.	S	Bend	trans	-66.7	126.7	178.5	36	0	0	0	0	111.4	R296	S191-R296 PolarHBondContact O-NH1 2.82Å; S191-R296 PolarHBondContact O-NH2 3.49Å
192	G	30.5	Very low	36.6	Very low	42 Å²	42	91 Å²	91	43%	0.433	50%	0.496	S	S	.	.	S	Bend	trans	93.3	43.3	166.9	0	0	0	0	0	117.5	R296	G192-R296 VanDerWaalsContact C-CZ 3.45Å; G192-R296 VanDerWaalsContact C-NH2 3.29Å; G192-R296 PolarHBondContact O-NE 3.49Å; G192-R296 PolarHBondContact O-NH2 3.09Å
193	A	32.8	Very low	37.6	Very low	43 Å²	43	85.4 Å²	85.4	36%	0.355	47%	0.474	S	S	.	.			trans	-127.9	88.9	170.8	0	0	0	0	0	109.3	W195	A193-W195 PolarHBondContact O-N 2.71Å
194	D	37.9	Very low	38.7	Very low	93 Å²	93	84.2 Å²	84.2	50%	0.497	47%	0.465	S	S	.	.			trans	-81.5	114.3	-176.4	-50.6	-42.9	0	0	0	109	E196 Y294	D194-E196 PolarHBondContact O-N 3.05Å; D194-Y294 PolarHBondContact OD2-OH 3.31Å
195	W	43.3	Very low	40	Very low	202 Å²	202	86.8 Å²	86.8	77%	0.765	47%	0.471	S	S	*	.	G	3₁₀ helix	trans	-82.1	-2.7	-178.1	51.7	-89.1	0	0	0	112.5	A193 D197 C198	A193-W195 PolarHBondContact O-N 2.71Å; W195-D197 PolarHBondContact O-N 3.36Å; W195-C198 PolarHBondContact O-N 2.85Å
196	E	42.3	Very low	41.3	Very low	150 Å²	150	86.1 Å²	86.1	70%	0.701	48%	0.476	S	S	*	.	G	3₁₀ helix	trans	-62.4	-30.6	175.8	-55	-170	160.6	0	0	110.8	D194 C198	D194-E196 PolarHBondContact O-N 3.05Å; E196-C198 VanDerWaalsContact C-N 3.29Å; E196-C198 PolarHBondContact O-N 3.31Å
197	D	50.7	Low	42.3	Very low	43 Å²	43	88.8 Å²	88.8	23%	0.23	49%	0.487	C	S	.	.	G	3₁₀ helix	trans	-85.3	43.2	173.2	-73	-36.1	0	0	0	113.5	W195 P289 L290 N291 Y294	W195-D197 PolarHBondContact O-N 3.36Å; D197-P289 CarbonylContact O-C 3.59Å; D197-P289 WeakPolarHBondContact O-CA 3.24Å; D197-L290 HydrophobicContact CB-CB 4.39Å; D197-L290 PolarHBondContact O-N 3.17Å; D197-N291 HydrophobicContact CB-CB 4.08Å; D197-N291 PolarHBondContact OD1-ND2 3Å; D197-N291 PolarHBondContact OD2-ND2 3.43Å; D197-Y294 HydrophobicContact CB-CD2 4.45Å; D197-Y294 HydrophobicContact CB-CE2 3.96Å
198	C	46.5	Very low	43.1	Very low	48 Å²	48	95 Å²	95	32%	0.324	50%	0.503	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-141.9	125.9	177.8	-83.1	0	0	0	0	114.1	W195 E196 I287 I288	W195-C198 PolarHBondContact O-N 2.85Å; E196-C198 VanDerWaalsContact C-N 3.29Å; E196-C198 PolarHBondContact O-N 3.31Å; C198-I287 HydrophobicContact CB-CG2 4.13Å; C198-I288 CarbonylContact C-O 3.56Å; C198-I288 WeakPolarHBondContact CA-O 3.49Å
199	R	49.2	Very low	43.5	Very low	148 Å²	148	93.6 Å²	93.6	56%	0.558	50%	0.5	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-94.6	124.7	169.8	-178.3	177	-178	179.9	1.5	110.8	I288 L290	R199-I288 HydrophobicContact CB-CB 4.41Å; R199-I288 PolarHBondContact N-O 3.43Å; R199-I288 PolarHBondContact O-N 3.46Å; R199-L290 HydrophobicContact CB-CD2 3.98Å; R199-L290 HydrophobicContact CB-CG 4.34Å
200	I	48.6	Very low	44.1	Very low	103 Å²	103	94.7 Å²	94.7	53%	0.528	50%	0.502	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-100.5	126.1	176.6	-53.8	176.4	0	0	0	109.4	L285 S286 I287	I200-L285 HydrophobicContact CG2-CD2 4.41Å; I200-L285 HydrophobicContact CG2-CG 4.46Å; I200-S286 CarbonylContact C-O 3.59Å; I200-S286 WeakPolarHBondContact CA-O 3.3Å; I200-I287 HydrophobicContact CG1-CG1 4.48Å
201	S	44.2	Very low	44.1	Very low	41 Å²	41	98.2 Å²	98.2	29%	0.287	52%	0.519	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-114.9	147.5	169.5	-161.4	0	0	0	0	111	D203 S286	S201-D203 PolarHBondContact OG-OD1 2.92Å; S201-S286 PolarHBondContact N-O 2.94Å; S201-S286 PolarHBondContact O-N 2.67Å
202	I	52.5	Low	44.3	Very low	97 Å²	97	96.6 Å²	96.6	50%	0.497	51%	0.506	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-130.7	107.3	176.8	-51.8	-177.8	0	0	0	108.1	V283 R284 L285	I202-V283 HydrophobicContact CG2-CG1 3.65Å; I202-R284 WeakPolarHBondContact CA-O 3.13Å; I202-L285 HydrophobicContact CD1-CD1 4.12Å; I202-L285 HydrophobicContact CG1-CD1 3.95Å; I202-L285 HydrophobicContact CG1-CG 4.43Å
203	D	51.6	Low	44.3	Very low	50 Å²	50	104 Å²	104	27%	0.267	53%	0.527	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-108.7	122.9	-174	-36.3	-45.2	0	0	0	109.4	S201 F205 V283 R284	S201-D203 PolarHBondContact OG-OD1 2.92Å; D203-F205 HydrophobicContact CB-CE2 3.71Å; D203-F205 HydrophobicContact CB-CZ 3.79Å; D203-F205 WeakPolarHBondContact O-CD2 3.44Å; D203-F205 WeakPolarHBondContact O-CE2 3.43Å; D203-V283 CarbonylContact O-C 3.6Å; D203-V283 WeakPolarHBondContact O-CA 3.42Å; D203-R284 HydrophobicContact CB-CB 4.28Å; D203-R284 PolarHBondContact N-O 3.43Å; D203-R284 PolarHBondContact O-N 3Å; D203-R284 WeakPolarHBondContact OD2-CD 3.33Å
204	C	54.4	Low	44.2	Very low	67 Å²	67	106.5 Å²	106.5	45%	0.453	54%	0.542	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-104.5	121	-176.4	-69	0	0	0	0	111.5	I207 A280	C204-I207 HydrophobicContact CB-CD1 4.09Å; C204-I207 HydrophobicContact CB-CG1 4.38Å; C204-A280 HydrophobicContact CB-CB 4.14Å
205	F	55.9	Low	43.8	Very low	94 Å²	94	105.1 Å²	105.1	41%	0.412	53%	0.534	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-109	150.9	-175.2	-58.2	-90.9	0	0	0	112.5	D203 I207 A280 R281 S282 R284	D203-F205 HydrophobicContact CB-CE2 3.71Å; D203-F205 HydrophobicContact CB-CZ 3.79Å; D203-F205 WeakPolarHBondContact O-CD2 3.44Å; D203-F205 WeakPolarHBondContact O-CE2 3.43Å; F205-I207 VanDerWaalsContact C-N 3.32Å; F205-I207 PolarHBondContact O-N 3.19Å; F205-A280 CarbonylContact O-C 3.58Å; F205-R281 PolarHBondContact O-N 2.96Å; F205-S282 PolarHBondContact N-O 3.22Å; F205-S282 PolarHBondContact O-N 3.2Å; F205-R284 HydrophobicContact CD2-CB 4.49Å; F205-R284 HydrophobicContact CE2-CB 3.59Å; F205-R284 HydrophobicContact CZ-CB 4.36Å
206	G	54.6	Low	43.1	Very low	47 Å²	47	100 Å²	100	49%	0.485	51%	0.514	S	S	.	.	S	Bend	trans	64.2	32.1	172.2	0	0	0	0	0	114.8	K208 R281	G206-K208 PolarHBondContact O-N 2.96Å; G206-R281 PolarHBondContact O-N 3.41Å
207	I	52.7	Low	42.6	Very low	94 Å²	94	95.7 Å²	95.7	48%	0.482	49%	0.494	S	S	.	.			trans	-58.9	119.2	176.9	-57.5	171.4	0	0	0	109.9	C204 F205 L278 C279 A280	C204-I207 HydrophobicContact CB-CD1 4.09Å; C204-I207 HydrophobicContact CB-CG1 4.38Å; F205-I207 VanDerWaalsContact C-N 3.32Å; F205-I207 PolarHBondContact O-N 3.19Å; I207-L278 HydrophobicContact CG2-CD2 3.8Å; I207-C279 WeakPolarHBondContact CA-O 3.34Å; I207-A280 HydrophobicContact CG1-CB 4.22Å
208	K	43.4	Very low	41.7	Very low	187 Å²	187	98.4 Å²	98.4	81%	0.813	51%	0.508	S	S	*	.			trans	-113.6	93.4	172.5	-78.9	-172.3	174.8	-177.9	0	110.9	G206 C279	G206-K208 PolarHBondContact O-N 2.96Å; K208-C279 PolarHBondContact N-O 3.09Å; K208-C279 VanDerWaalsContact N-O 3.14Å
209	G	38.4	Very low	40.8	Very low	38 Å²	38	103 Å²	103	39%	0.392	52%	0.524	S	S	.	.			trans	-119.1	123	171.2	0	0	0	0	0	111.7	H211	G209-H211 PolarHBondContact O-N 2.67Å
210	K	37	Very low	39.8	Very low	178 Å²	178	104.1 Å²	104.1	77%	0.774	53%	0.533	S	S	*	.	T	Hydrogen-bonded Turn	trans	-70.5	126.3	168.4	-67.6	-178	177.7	-178.5	0	108.5	C212	K210-C212 PolarHBondContact O-N 3.41Å
211	H	33.4	Very low	38.9	Very low	187 Å²	187	105.6 Å²	105.6	87%	0.866	54%	0.542	S	S	*	.	T	Hydrogen-bonded Turn	trans	60.4	26.2	173.8	-68.6	-72.9	0	0	0	119	G209 K213	G209-H211 PolarHBondContact O-N 2.67Å; H211-K213 VanDerWaalsContact C-N 3.28Å; H211-K213 PolarHBondContact O-N 2.73Å
212	C	30	Very low	38.3	Very low	76 Å²	76	112.3 Å²	112.3	51%	0.514	57%	0.568	S	S	.	*			trans	-74.7	73	177	-159.8	0	0	0	0	113.3	K210 S214	K210-C212 PolarHBondContact O-N 3.41Å; C212-S214 PolarHBondContact O-N 2.9Å
213	K	31.1	Very low	37.1	Very low	199 Å²	199	112.5 Å²	112.5	87%	0.865	58%	0.578	S	S	*	*			trans	-68.9	107.7	164.4	-76.6	-174.5	176	-177.8	0	108.8	H211 I215	H211-K213 VanDerWaalsContact C-N 3.28Å; H211-K213 PolarHBondContact O-N 2.73Å; K213-I215 PolarHBondContact O-N 3.38Å
214	S	31	Very low	36.1	Very low	95 Å²	95	119.3 Å²	119.3	66%	0.664	60%	0.602	S	S	*	*			trans	-4.8	100.5	173.9	-164.1	0	0	0	0	116.4	C212	C212-S214 PolarHBondContact O-N 2.9Å
215	I	30.1	Very low	35	Very low	64 Å²	64	126 Å²	126	33%	0.328	62%	0.623	S	S	.	*				34	100.9	108.5	-67.1	164.3	0	0	0	113.1	K213 I259	K213-I215 PolarHBondContact O-N 3.38Å; I215-I259 HydrophobicContact CB-CG1 4.42Å; I215-I259 HydrophobicContact CD1-CD1 3.64Å; I215-I259 HydrophobicContact CD1-CG1 3.72Å; I215-I259 HydrophobicContact CG1-CB 4.19Å; I215-I259 HydrophobicContact CG1-CD1 3.95Å; I215-I259 HydrophobicContact CG1-CG1 3.7Å; I215-I259 HydrophobicContact CG1-CG2 3.82Å; I215-I259 HydrophobicContact CG2-CB 4.32Å; I215-I259 HydrophobicContact CG2-CG1 3.94Å
216	R	28	Very low	33.9	Very low	95 Å²	95	127.2 Å²	127.2	36%	0.358	64%	0.643	S	S	.	*	B	Isolated β-bridge	trans	-92.9	164	165.6	-61.7	171.1	-72.1	-160.8	-162.3	105.8	S258 H260 L261 E262 S263	R216-S258 VanDerWaalsContact O-O 3.11Å; R216-H260 CarbonylContact C-O 3.57Å; R216-H260 WeakPolarHBondContact CA-O 3.46Å; R216-H260 WeakPolarHBondContact CB-O 3.45Å; R216-H260 PolarHBondContact N-O 3.39Å; R216-H260 CarbonylContact O-C 3.3Å; R216-H260 PolarHBondContact O-N 3Å; R216-L261 VanDerWaalsContact NH1-CG 3.27Å; R216-L261 PolarHBondContact NH1-O 3.45Å; R216-E262 PolarHBondContact NE-O 2.83Å; R216-E262 VanDerWaalsContact NH1-C 3.31Å; R216-E262 PolarHBondContact NH2-O 3.47Å; R216-S263 PolarHBondContact NH1-OG 3.04Å
217	H	31.7	Very low	32.8	Very low	59 Å²	59	129.6 Å²	129.6	27%	0.273	66%	0.659	S	S	.	*				-176.3	157.6	93.5	-124.4	-125.6	0	0	0	117.8	H260 L261 E262	H217-H260 HydrophobicContact CB-CB 3.7Å; H217-H260 AromaticContact CD2-CG 3.74Å; H217-H260 PolarHBondContact CD2-O 2.93Å; H217-H260 AromaticContact CE1-CD2 3.19Å; H217-H260 PolarHBondContact CE1-CD2 3.38Å; H217-H260 AromaticContact CE1-CE1 3.07Å; H217-H260 PolarHBondContact CE1-CE1 3.33Å; H217-H260 AromaticContact CE1-CG 3.47Å; H217-H260 VanDerWaalsContact CE1-CG 3.47Å; H217-H260 AromaticContact CE1-ND1 3.45Å; H217-H260 PolarHBondContact CE1-ND1 2.87Å; H217-H260 AromaticContact CE1-NE2 2.9Å; H217-H260 PolarHBondContact CE1-NE2 3.43Å; H217-H260 AromaticContact CG-CD2 3.77Å; H217-H260 AromaticContact CG-CG 3.49Å; H217-H260 VanDerWaalsContact CG-CG 3.49Å; H217-H260 WeakPolarHBondContact ND1-CB 3.39Å; H217-H260 AromaticContact ND1-CD2 2.95Å; H217-H260 PolarHBondContact ND1-CD2 3.21Å; H217-H260 AromaticContact ND1-CG 3.1Å; H217-H260 AromaticContact ND1-ND1 3.83Å; H217-H260 AromaticContact ND1-NE2 3.58Å; H217-H260 AromaticContact NE2-ND1 3.87Å; H217-L261 PolarHBondContact CD2-N 3.26Å; H217-L261 VanDerWaalsContact NE2-CA 3.26Å; H217-L261 WeakPolarHBondContact NE2-CA 3.37Å; H217-L261 PolarHBondContact NE2-N 2.97Å; H217-L261 VanDerWaalsContact NE2-N 3.12Å; H217-L261 PolarHBondContact NE2-O 2.82Å; H217-E262 PolarHBondContact CD2-N 3.16Å; H217-E262 VanDerWaalsContact CD2-N 3.31Å; H217-E262 WeakPolarHBondContact NE2-CA 3.42Å; H217-E262 WeakPolarHBondContact NE2-CB 3.47Å; H217-E262 WeakPolarHBondContact NE2-CG 3.32Å; H217-E262 PolarHBondContact NE2-N 3.01Å
218	L	30.5	Very low	31.9	Very low	99 Å²	99	131.1 Å²	131.1	52%	0.518	67%	0.674	S	S	.	*			trans	14.3	132.1	160.2	-64	171.1	0	0	0	120
219	H	27.9	Very low	31.4	Very low	145 Å²	145	131 Å²	131	67%	0.671	68%	0.676	S	S	*	*			cis	117.7	130.7	20.4	-104.6	-81.9	0	0	0	110.6
220	K	29	Very low	31	Very low	171 Å²	171	133.8 Å²	133.8	74%	0.743	69%	0.686	S	S	*	*			trans	71.5	149.6	151.3	-68.2	174.1	177.1	176.5	0	116.3
221	N	29.3	Very low	30.6	Very low	134 Å²	134	135.4 Å²	135.4	72%	0.717	69%	0.689	S	S	*	*			cis	-155.7	172.8	6.9	-119.3	-6.3	0	0	0	113.3
222	H	31	Very low	30.5	Very low	182 Å²	182	133.7 Å²	133.7	84%	0.843	69%	0.686	S	S	*	*			trans	-45.1	157.7	176.2	-75.2	-97	0	0	0	119.5
223	S	28.6	Very low	30.5	Very low	101 Å²	101	134.9 Å²	134.9	71%	0.706	70%	0.695	S	S	*	*			trans	-79.6	135.3	168.2	-88.2	0	0	0	0	115.5
224	Y	29.3	Very low	30.3	Very low	194 Å²	194	130.2 Å²	130.2	76%	0.761	69%	0.687	S	S	*	*			trans	59.1	144	148.7	-68.4	-74.8	0	0	0	123.6
225	K	32.4	Very low	30.2	Very low	207 Å²	207	131.4 Å²	131.4	90%	0.9	69%	0.69	S	S	*	*			trans	-140.6	151	-168.2	-124.3	-166.7	-173.3	-174.6	0	112.2
226	S	32.5	Very low	30.1	Very low	120 Å²	120	135.6 Å²	135.6	84%	0.839	71%	0.708	S	S	*	*			trans	-163.3	157.1	156.1	55	0	0	0	0	108.1
227	A	31.3	Very low	30.1	Very low	97 Å²	97	138.8 Å²	138.8	80%	0.802	73%	0.731	S	S	*	*			cis	-139.9	159.1	-23.5	0	0	0	0	0	108.6
228	P	33.4	Very low	30	Very low	125 Å²	125	138.9 Å²	138.9	81%	0.812	75%	0.748	S	S	*	*			trans	-115.7	154.1	-164.4	39.6	-29.9	0	0	0	116.7
229	Q	33.5	Very low	30	Very low	184 Å²	184	141.2 Å²	141.2	86%	0.86	76%	0.761	S	S	*	*			trans	-153.3	154.1	157.9	-69	-170.9	-11.4	0	0	107.8
230	T	29.3	Very low	30	Very low	98 Å²	98	138 Å²	138	60%	0.601	75%	0.752	S	S	*	*			cis	-163.8	159.4	-26.8	29.2	0	0	0	0	107.2
231	Y	29	Very low	30.2	Very low	211 Å²	211	135.1 Å²	135.1	83%	0.827	74%	0.741	S	S	*	*			trans	69.9	141.3	173.8	-54.7	-71.4	0	0	0	115.4
232	L	31.1	Very low	30.3	Very low	152 Å²	152	132.5 Å²	132.5	80%	0.796	73%	0.727	S	S	*	*			cis	-140.6	157.9	11.5	-94.8	115.3	0	0	0	112.3
233	S	29.9	Very low	30.2	Very low	100 Å²	100	126 Å²	126	70%	0.699	71%	0.71	S	S	*	*			trans	37.8	141.7	147.3	65.1	0	0	0	0	121.8
234	S	27.8	Very low	30.4	Very low	101 Å²	101	126.6 Å²	126.6	71%	0.706	70%	0.704	S	S	*	*			cis	-172.1	154.7	-7.4	-106.8	0	0	0	0	107.9
235	T	28.7	Very low	30.4	Very low	120 Å²	120	122.6 Å²	122.6	74%	0.736	70%	0.696	S	S	*	*			trans	56.3	131.1	161	55.2	0	0	0	0	118.4
236	H	28.4	Very low	30.2	Very low	153 Å²	153	118.7 Å²	118.7	71%	0.708	69%	0.685	S	S	*	*			cis	-157	144.8	4.2	-111.1	-69.3	0	0	0	108.6
237	I	28.2	Very low	30	Very low	161 Å²	161	120.4 Å²	120.4	83%	0.826	68%	0.677	S	S	*	*			trans	53.6	118.9	148.3	-52.7	158.2	0	0	0	117.5
238	G	29.6	Very low	29.8	Very low	61 Å²	61	125.1 Å²	125.1	63%	0.629	68%	0.675	S	S	*	*			cis	175.8	159.1	-3	0	0	0	0	0	112.2
239	N	29.8	Very low	29.4	Very low	148 Å²	148	127.5 Å²	127.5	79%	0.791	68%	0.681	S	S	*	*			trans	61.7	111.1	162	-63.7	10.2	0	0	0	118.1
240	T	28.8	Very low	29	Very low	79 Å²	79	124.2 Å²	124.2	49%	0.485	67%	0.668	S	S	.	*				68.5	132	65.4	66.3	0	0	0	0	112
241	Q	32.3	Very low	28.8	Very low	109 Å²	109	125.1 Å²	125.1	51%	0.509	68%	0.676	S	S	.	*			cis	-178.9	149.1	17.4	-118.7	172.3	35.1	0	0	113.7	D12 G13	D12-Q241 CarbonylContact C-O 3.51Å; D12-Q241 WeakPolarHBondContact CA-O 3.49Å; D12-Q241 WeakPolarHBondContact CB-O 3.19Å; D12-Q241 PolarHBondContact OD1-N 3.22Å; G13-Q241 PolarHBondContact N-O 3.46Å
242	N	31.8	Very low	28.8	Very low	79 Å²	79	122.8 Å²	122.8	42%	0.422	68%	0.677	S	S	.	*			trans	62	157.5	146.4	-51.9	-28.9	0	0	0	120.3	G13 Y14	G13-N242 PolarHBondContact N-O 3.46Å; G13-N242 WeakPolarHBondContact O-CB 3.34Å; Y14-N242 HydrophobicContact CD1-CB 4.43Å; Y14-N242 HydrophobicContact CD2-CB 4.2Å; Y14-N242 HydrophobicContact CE1-CB 3.94Å; Y14-N242 HydrophobicContact CE2-CB 3.74Å; Y14-N242 VanDerWaalsContact CE2-CG 3.49Å; Y14-N242 WeakPolarHBondContact CE2-ND2 3.21Å
243	G	29	Very low	28.7	Very low	47 Å²	47	120.2 Å²	120.2	49%	0.485	67%	0.669	S	S	.	*			cis	151.9	151.3	-3.2	0	0	0	0	0	112.1
244	L	32	Very low	28.5	Very low	113 Å²	113	121.6 Å²	121.6	59%	0.592	67%	0.667	S	S	*	*			trans	86.3	114.3	176.1	-62.3	165.5	0	0	0	119.5	Y14 I15	Y14-L244 HydrophobicContact CD1-CD1 3.74Å; Y14-L244 HydrophobicContact CD1-CG 4.38Å; Y14-L244 HydrophobicContact CE1-CD1 3.58Å; Y14-L244 HydrophobicContact CE1-CG 3.83Å; I15-L244 HydrophobicContact CG1-CD1 4.08Å
245	N	29.8	Very low	28.5	Very low	110 Å²	110	127.6 Å²	127.6	59%	0.588	68%	0.675	S	S	*	*				10.9	122.5	118	-53.1	-12.6	0	0	0	117.6
246	D	29	Very low	28.5	Very low	124 Å²	124	127.2 Å²	127.2	66%	0.663	67%	0.672	S	S	*	*				-173.2	146.7	107.6	-109.1	-5.8	0	0	0	113.4
247	K	28	Very low	28.3	Very low	157 Å²	157	125.4 Å²	125.4	68%	0.683	67%	0.674	S	S	*	*			trans	54.6	120.7	142.9	-65.8	162.9	-174	140.3	0	121.2
248	Y	25.5	Very low	28.4	Very low	195 Å²	195	122.5 Å²	122.5	77%	0.765	67%	0.668	S	S	*	*			trans	35.2	103.9	139.5	-57.6	-80.1	0	0	0	119.3
249	L	26.7	Very low	28.2	Very low	176 Å²	176	123.9 Å²	123.9	92%	0.921	66%	0.66	S	S	*	*			trans	-167.1	131.8	135.1	-106.5	148.2	0	0	0	111.1
250	L	23.5	Very low	28.2	Very low	114 Å²	114	122.2 Å²	122.2	60%	0.597	65%	0.647	S	S	*	*			trans	-59.1	143.9	153.5	-68.8	161.6	0	0	0	107.2
251	P	26.4	Very low	28.2	Very low	117 Å²	117	123.3 Å²	123.3	76%	0.76	65%	0.649	S	S	*	*			cis	-130.5	149.1	48.9	34.4	-18.1	0	0	0	114.8
252	L	27.8	Very low	28.1	Very low	162 Å²	162	124.1 Å²	124.1	85%	0.848	65%	0.653	S	S	*	*			trans	-64.3	129.2	173.7	-79.3	174.7	0	0	0	110.7
253	P	29.5	Very low	27.9	Very low	98 Å²	98	123.7 Å²	123.7	64%	0.636	66%	0.656	S	S	*	*			trans	-79	131.3	-162.8	29.1	-35.6	0	0	0	112.7	R255	P253-R255 VanDerWaalsContact C-N 3.3Å; P253-R255 PolarHBondContact O-N 3.46Å
254	I	26.8	Very low	28.1	Very low	129 Å²	129	131 Å²	131	66%	0.662	68%	0.675	S	S	*	*			trans	-65.2	92.1	161	-58.8	176.2	0	0	0	107.9	T256	I254-T256 PolarHBondContact O-N 3.48Å; I254-T256 VanDerWaalsContact O-N 3.09Å
255	R	27.2	Very low	28.2	Very low	228 Å²	228	135.4 Å²	135.4	86%	0.86	69%	0.689	S	S	*	*			trans	-71.5	100.3	170.1	-79	-170.6	174.2	-162.1	-0.9	109.9	P253	P253-R255 VanDerWaalsContact C-N 3.3Å; P253-R255 PolarHBondContact O-N 3.46Å
256	T	27.8	Very low	28.2	Very low	111 Å²	111	137 Å²	137	68%	0.681	70%	0.697	S	S	*	*			trans	-64.9	151.5	158.7	45.5	0	0	0	0	110.3	I254 S258	I254-T256 PolarHBondContact O-N 3.48Å; I254-T256 VanDerWaalsContact O-N 3.09Å; T256-S258 PolarHBondContact O-N 3.33Å
257	P	25.6	Very low	28.4	Very low	116 Å²	116	138.7 Å²	138.7	75%	0.753	71%	0.706	S	S	*	*			trans	-87.5	119.4	-156.5	31.8	-35.2	0	0	0	114.1	I259	P257-I259 PolarHBondContact O-N 3.36Å
258	S	29.9	Very low	28.7	Very low	100 Å²	100	139.7 Å²	139.7	70%	0.699	71%	0.71	S	S	*	*			trans	-80.1	110.5	171.5	-73.2	0	0	0	0	112.5	R216 T256	R216-S258 VanDerWaalsContact O-O 3.11Å; T256-S258 PolarHBondContact O-N 3.33Å
259	I	24.9	Very low	29.1	Very low	90 Å²	90	137 Å²	137	46%	0.462	71%	0.714	S	S	.	*			trans	-78.7	127.2	162.5	-53.2	-177.5	0	0	0	110.4	I215 P257 L278	I215-I259 HydrophobicContact CB-CG1 4.42Å; I215-I259 HydrophobicContact CD1-CD1 3.64Å; I215-I259 HydrophobicContact CD1-CG1 3.72Å; I215-I259 HydrophobicContact CG1-CB 4.19Å; I215-I259 HydrophobicContact CG1-CD1 3.95Å; I215-I259 HydrophobicContact CG1-CG1 3.7Å; I215-I259 HydrophobicContact CG1-CG2 3.82Å; I215-I259 HydrophobicContact CG2-CB 4.32Å; I215-I259 HydrophobicContact CG2-CG1 3.94Å; P257-I259 PolarHBondContact O-N 3.36Å; I259-L278 HydrophobicContact CD1-CD1 3.6Å
260	H	29.9	Very low	29.2	Very low	112 Å²	112	133.6 Å²	133.6	52%	0.519	71%	0.706	S	S	.	*	B	Isolated β-bridge	trans	-161.4	179.6	157.9	178.6	8.5	0	0	0	107.9	R216 H217	R216-H260 CarbonylContact C-O 3.57Å; R216-H260 WeakPolarHBondContact CA-O 3.46Å; R216-H260 WeakPolarHBondContact CB-O 3.45Å; R216-H260 PolarHBondContact N-O 3.39Å; R216-H260 CarbonylContact O-C 3.3Å; R216-H260 PolarHBondContact O-N 3Å; H217-H260 HydrophobicContact CB-CB 3.7Å; H217-H260 AromaticContact CD2-CG 3.74Å; H217-H260 PolarHBondContact CD2-O 2.93Å; H217-H260 AromaticContact CE1-CD2 3.19Å; H217-H260 PolarHBondContact CE1-CD2 3.38Å; H217-H260 AromaticContact CE1-CE1 3.07Å; H217-H260 PolarHBondContact CE1-CE1 3.33Å; H217-H260 AromaticContact CE1-CG 3.47Å; H217-H260 VanDerWaalsContact CE1-CG 3.47Å; H217-H260 AromaticContact CE1-ND1 3.45Å; H217-H260 PolarHBondContact CE1-ND1 2.87Å; H217-H260 AromaticContact CE1-NE2 2.9Å; H217-H260 PolarHBondContact CE1-NE2 3.43Å; H217-H260 AromaticContact CG-CD2 3.77Å; H217-H260 AromaticContact CG-CG 3.49Å; H217-H260 VanDerWaalsContact CG-CG 3.49Å; H217-H260 WeakPolarHBondContact ND1-CB 3.39Å; H217-H260 AromaticContact ND1-CD2 2.95Å; H217-H260 PolarHBondContact ND1-CD2 3.21Å; H217-H260 AromaticContact ND1-CG 3.1Å; H217-H260 AromaticContact ND1-ND1 3.83Å; H217-H260 AromaticContact ND1-NE2 3.58Å; H217-H260 AromaticContact NE2-ND1 3.87Å
261	L	28.2	Very low	29.7	Very low	102 Å²	102	137.5 Å²	137.5	53%	0.534	72%	0.721	S	S	.	*			trans	-132	88.4	-163.6	-113.9	79.3	0	0	0	116.3	R216 H217 S263	R216-L261 VanDerWaalsContact NH1-CG 3.27Å; R216-L261 PolarHBondContact NH1-O 3.45Å; H217-L261 PolarHBondContact CD2-N 3.26Å; H217-L261 VanDerWaalsContact NE2-CA 3.26Å; H217-L261 WeakPolarHBondContact NE2-CA 3.37Å; H217-L261 PolarHBondContact NE2-N 2.97Å; H217-L261 VanDerWaalsContact NE2-N 3.12Å; H217-L261 PolarHBondContact NE2-O 2.82Å; L261-S263 PolarHBondContact O-N 3.48Å; L261-S263 VanDerWaalsContact O-N 3.13Å
262	E	30.3	Very low	29.8	Very low	127 Å²	127	137 Å²	137	59%	0.593	72%	0.72	S	S	*	*			trans	-54	65.6	164.1	-75.5	-170.3	164.6	0	0	121.9	R216 H217	R216-E262 PolarHBondContact NE-O 2.83Å; R216-E262 VanDerWaalsContact NH1-C 3.31Å; R216-E262 PolarHBondContact NH2-O 3.47Å; H217-E262 PolarHBondContact CD2-N 3.16Å; H217-E262 VanDerWaalsContact CD2-N 3.31Å; H217-E262 WeakPolarHBondContact NE2-CA 3.42Å; H217-E262 WeakPolarHBondContact NE2-CB 3.47Å; H217-E262 WeakPolarHBondContact NE2-CG 3.32Å; H217-E262 PolarHBondContact NE2-N 3.01Å
263	S	27.8	Very low	30	Very low	69 Å²	69	135.8 Å²	135.8	48%	0.483	71%	0.713	S	S	.	*			trans	-112.6	118.1	-174.6	21.9	0	0	0	0	117.1	R216 L261	R216-S263 PolarHBondContact NH1-OG 3.04Å; L261-S263 PolarHBondContact O-N 3.48Å; L261-S263 VanDerWaalsContact O-N 3.13Å
264	K	33	Very low	30.2	Very low	202 Å²	202	141.3 Å²	141.3	88%	0.878	72%	0.721	S	S	*	*			trans	-171.5	145.9	146.2	-90.3	135.6	-174.2	-179.2	0	106.3
265	K	34.4	Very low	30.5	Very low	204 Å²	204	141.5 Å²	141.5	89%	0.887	73%	0.731	S	S	*	*			cis	-116.5	143.7	17.9	-64.8	172.9	177.2	176	0	112.1
266	L	30.5	Very low	30.8	Very low	145 Å²	145	136.4 Å²	136.4	76%	0.759	72%	0.717	S	S	*	*			trans	-72.3	153.3	165.8	-74.1	78.5	0	0	0	109.9
267	N	32.4	Very low	31.5	Very low	159 Å²	159	135.7 Å²	135.7	85%	0.85	72%	0.716	S	S	*	*			trans	-134.9	102.4	131.3	-103.4	-23.9	0	0	0	110.3
268	K	34.7	Very low	32.4	Very low	177 Å²	177	134.3 Å²	134.3	77%	0.77	70%	0.702	S	S	*	*			trans	30.3	102.2	154.7	-61.5	175.7	179.6	177.4	0	118
269	T	33.3	Very low	33	Very low	138 Å²	138	133.4 Å²	133.4	85%	0.847	70%	0.695	S	S	*	*				-166.4	131	110.2	15.3	0	0	0	0	112.1
270	S	29.5	Very low	34.1	Very low	106 Å²	106	130.3 Å²	130.3	74%	0.741	68%	0.682	S	S	*	*			trans	67.7	115.6	155	-57.1	0	0	0	0	122.2
271	Q	34.8	Very low	34.8	Very low	195 Å²	195	134.8 Å²	134.8	91%	0.911	69%	0.694	S	S	*	*			trans	84	128.8	142.9	-62.8	174.5	-0.3	0	0	120.9
272	S	28.5	Very low	35.7	Very low	107 Å²	107	131 Å²	131	75%	0.748	68%	0.677	S	S	*	*			trans	-69.9	155.4	174.1	168.6	0	0	0	0	112.7
273	I	31.4	Very low	36.4	Very low	137 Å²	137	127.3 Å²	127.3	70%	0.703	66%	0.663	S	S	*	*			trans	-167.7	157.6	143.1	-97.8	146.2	0	0	0	112.3	H276	I273-H276 WeakPolarHBondContact CG2-CE1 3.4Å; I273-H276 WeakPolarHBondContact CG2-NE2 3.43Å
274	R	33.4	Very low	37.3	Very low	214 Å²	214	127.5 Å²	127.5	81%	0.808	65%	0.653	S	S	*	*			trans	-74.5	167.8	-169.1	-61.7	177.6	-175.4	-179.6	0.2	114	H276	R274-H276 PolarHBondContact O-N 3.2Å
275	P	32.1	Very low	37.9	Very low	132 Å²	132	121.1 Å²	121.1	86%	0.857	63%	0.628	S	S	*	*			trans	-69	131.3	-170.2	28.9	-35.5	0	0	0	112.2
276	H	35.3	Very low	38.4	Very low	122 Å²	122	111.4 Å²	111.4	57%	0.565	59%	0.586	S	S	*	*			trans	-94.3	109.1	-177.2	-67.1	-43.6	0	0	0	111.8	I273 R274 L278	I273-H276 WeakPolarHBondContact CG2-CE1 3.4Å; I273-H276 WeakPolarHBondContact CG2-NE2 3.43Å; R274-H276 PolarHBondContact O-N 3.2Å; H276-L278 PolarHBondContact O-N 3.22Å
277	S	41.7	Very low	39.4	Very low	95 Å²	95	108.7 Å²	108.7	66%	0.664	57%	0.571	S	S	*	*			trans	-57.1	124.4	167	53.8	0	0	0	0	110.9	C279	S277-C279 PolarHBondContact O-N 3.02Å; S277-C279 VanDerWaalsContact O-N 3.11Å
278	L	43.9	Very low	40.2	Very low	87 Å²	87	104 Å²	104	46%	0.455	55%	0.545	S	S	.	.			trans	-68.5	106.1	167	-75.2	166.7	0	0	0	108.9	I207 I259 H276	I207-L278 HydrophobicContact CG2-CD2 3.8Å; I259-L278 HydrophobicContact CD1-CD1 3.6Å; H276-L278 PolarHBondContact O-N 3.22Å
279	C	42.4	Very low	40.6	Very low	82 Å²	82	98.9 Å²	98.9	55%	0.554	53%	0.53	S	S	*	.			trans	-99.4	108.5	171.9	-170.8	0	0	0	0	108.8	I207 K208 S277	I207-C279 WeakPolarHBondContact CA-O 3.34Å; K208-C279 PolarHBondContact N-O 3.09Å; K208-C279 VanDerWaalsContact N-O 3.14Å; S277-C279 PolarHBondContact O-N 3.02Å; S277-C279 VanDerWaalsContact O-N 3.11Å
280	A	49	Very low	41.2	Very low	24 Å²	24	97.2 Å²	97.2	20%	0.198	52%	0.516	C	S	.	.			trans	-80	146.2	163.9	0	0	0	0	0	109.4	C204 F205 I207 V283	C204-A280 HydrophobicContact CB-CB 4.14Å; F205-A280 CarbonylContact O-C 3.58Å; I207-A280 HydrophobicContact CG1-CB 4.22Å; A280-V283 HydrophobicContact CB-CG2 4.24Å
281	R	44.1	Very low	41.8	Very low	206 Å²	206	93.9 Å²	93.9	78%	0.777	49%	0.49	S	S	*	.	S	Bend	trans	-77.4	-29	175.4	-168.7	177.9	-176.8	-177.7	0.3	112	F205 G206	F205-R281 PolarHBondContact O-N 2.96Å; G206-R281 PolarHBondContact O-N 3.41Å
282	S	48	Very low	41.9	Very low	23 Å²	23	90 Å²	90	16%	0.161	48%	0.481	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-157	161.4	170.9	52.8	0	0	0	0	110.2	F205	F205-S282 PolarHBondContact N-O 3.22Å; F205-S282 PolarHBondContact O-N 3.2Å
283	V	43.4	Very low	42.6	Very low	49 Å²	49	88.8 Å²	88.8	30%	0.297	47%	0.466	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-130	137.3	174.5	-177.4	0	0	0	0	108.2	I202 D203 A280	I202-V283 HydrophobicContact CG2-CG1 3.65Å; D203-V283 CarbonylContact O-C 3.6Å; D203-V283 WeakPolarHBondContact O-CA 3.42Å; A280-V283 HydrophobicContact CB-CG2 4.24Å
284	R	47.8	Very low	42.7	Very low	73 Å²	73	86.4 Å²	86.4	28%	0.275	45%	0.448	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-106.6	124.9	170.9	179.8	-176.3	-179.6	136.5	-3.1	107.6	Q160 I202 D203 F205 S286	Q160-R284 VanDerWaalsContact OE1-CZ 3.3Å; Q160-R284 VanDerWaalsContact OE1-NE 3.15Å; I202-R284 WeakPolarHBondContact CA-O 3.13Å; D203-R284 HydrophobicContact CB-CB 4.28Å; D203-R284 PolarHBondContact N-O 3.43Å; D203-R284 PolarHBondContact O-N 3Å; D203-R284 WeakPolarHBondContact OD2-CD 3.33Å; F205-R284 HydrophobicContact CD2-CB 4.49Å; F205-R284 HydrophobicContact CE2-CB 3.59Å; F205-R284 HydrophobicContact CZ-CB 4.36Å; R284-S286 PolarHBondContact NE-OG 3.14Å
285	L	45.7	Very low	42.7	Very low	69 Å²	69	85.5 Å²	85.5	36%	0.361	45%	0.45	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-101.4	128.7	165.6	-162.2	128.6	0	0	0	107.7	I200 I202 I287	I200-L285 HydrophobicContact CG2-CD2 4.41Å; I200-L285 HydrophobicContact CG2-CG 4.46Å; I202-L285 HydrophobicContact CD1-CD1 4.12Å; I202-L285 HydrophobicContact CG1-CD1 3.95Å; I202-L285 HydrophobicContact CG1-CG 4.43Å; L285-I287 HydrophobicContact CD2-CD1 4.27Å; L285-I287 HydrophobicContact CD2-CG1 3.98Å
286	S	44.9	Very low	42.8	Very low	0 Å²	0	86 Å²	86	0%	0	44%	0.435	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-122.5	120.9	-176	-55.5	0	0	0	0	108.4	Q160 I200 S201 R284	Q160-S286 PolarHBondContact OE1-OG 3.02Å; I200-S286 CarbonylContact C-O 3.59Å; I200-S286 WeakPolarHBondContact CA-O 3.3Å; S201-S286 PolarHBondContact N-O 2.94Å; S201-S286 PolarHBondContact O-N 2.67Å; R284-S286 PolarHBondContact NE-OG 3.14Å
287	I	51.3	Low	42.5	Very low	88 Å²	88	85.5 Å²	85.5	45%	0.451	45%	0.445	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-107.4	120.5	170.4	-54.4	177.8	0	0	0	106.8	C198 I200 L285	C198-I287 HydrophobicContact CB-CG2 4.13Å; I200-I287 HydrophobicContact CG1-CG1 4.48Å; L285-I287 HydrophobicContact CD2-CD1 4.27Å; L285-I287 HydrophobicContact CD2-CG1 3.98Å
288	I	49.9	Very low	42.1	Very low	60 Å²	60	86.7 Å²	86.7	31%	0.308	45%	0.451	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-113.7	111.8	-177.2	-52.1	172.8	0	0	0	107	Q160 C198 R199 L290	Q160-I288 HydrophobicContact CG-CG1 4.36Å; C198-I288 CarbonylContact C-O 3.56Å; C198-I288 WeakPolarHBondContact CA-O 3.49Å; R199-I288 HydrophobicContact CB-CB 4.41Å; R199-I288 PolarHBondContact N-O 3.43Å; R199-I288 PolarHBondContact O-N 3.46Å; I288-L290 PolarHBondContact O-N 3.3Å
289	P	41.5	Very low	41.5	Very low	70 Å²	70	87.5 Å²	87.5	46%	0.455	46%	0.464	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-65.6	131.2	172.5	28.2	-33	0	0	0	109.8	D197	D197-P289 CarbonylContact O-C 3.59Å; D197-P289 WeakPolarHBondContact O-CA 3.24Å
290	L	46.5	Very low	41	Very low	103 Å²	103	92.1 Å²	92.1	54%	0.539	48%	0.482	S	S	.	.	S	Bend	trans	-82	-25.7	176.9	-63.2	172.6	0	0	0	111.6	D197 R199 I288	D197-L290 HydrophobicContact CB-CB 4.39Å; D197-L290 PolarHBondContact O-N 3.17Å; R199-L290 HydrophobicContact CB-CD2 3.98Å; R199-L290 HydrophobicContact CB-CG 4.34Å; I288-L290 PolarHBondContact O-N 3.3Å
291	N	41.5	Very low	40.2	Very low	36 Å²	36	94 Å²	94	19%	0.193	50%	0.503	C	S	.	.	S	Bend	trans	-113.1	129	166	-89.5	-47.4	0	0	0	110.5	D197 I293 Y294 K344	D197-N291 HydrophobicContact CB-CB 4.08Å; D197-N291 PolarHBondContact OD1-ND2 3Å; D197-N291 PolarHBondContact OD2-ND2 3.43Å; N291-I293 PolarHBondContact O-N 3.4Å; N291-Y294 HydrophobicContact CB-CE2 4.46Å; N291-K344 PolarHBondContact OD1-NZ 3.08Å
292	P	38.3	Very low	39.6	Very low	113 Å²	113	94.4 Å²	94.4	73%	0.734	51%	0.505	S	S	*	.	T	Hydrogen-bonded Turn	trans	-73.1	-4.4	-176.1	28.4	-34.9	0	0	0	115.2	Y294	P292-Y294 VanDerWaalsContact C-N 3.27Å; P292-Y294 PolarHBondContact O-N 3.45Å
293	I	42.1	Very low	38.8	Very low	82 Å²	82	103.7 Å²	103.7	42%	0.421	54%	0.536	S	S	.	.	T	Hydrogen-bonded Turn	trans	-70.4	-19.4	-172.9	-58.9	177.3	0	0	0	112.5	N291 K295 V337	N291-I293 PolarHBondContact O-N 3.4Å; I293-K295 VanDerWaalsContact C-N 3.27Å; I293-K295 PolarHBondContact O-N 3.46Å; I293-V337 HydrophobicContact CG2-CG1 4.25Å
294	Y	34.5	Very low	38.2	Very low	86 Å²	86	110.6 Å²	110.6	34%	0.337	56%	0.562	S	S	.	*			trans	-78.9	58.4	-177.3	-65.3	-70.4	0	0	0	115.5	D194 D197 N291 P292	D194-Y294 PolarHBondContact OD2-OH 3.31Å; D197-Y294 HydrophobicContact CB-CD2 4.45Å; D197-Y294 HydrophobicContact CB-CE2 3.96Å; N291-Y294 HydrophobicContact CB-CE2 4.46Å; P292-Y294 VanDerWaalsContact C-N 3.27Å; P292-Y294 PolarHBondContact O-N 3.45Å
295	K	32.8	Very low	37.3	Very low	196 Å²	196	114.8 Å²	114.8	85%	0.852	59%	0.589	S	S	*	*			trans	-103.2	75.5	157.4	-85.5	-177	179.2	169.8	0	110.7	I293 S297	I293-K295 VanDerWaalsContact C-N 3.27Å; I293-K295 PolarHBondContact O-N 3.46Å; K295-S297 PolarHBondContact O-N 3.34Å; K295-S297 VanDerWaalsContact O-N 3.1Å
296	R	33.6	Very low	36.5	Very low	141 Å²	141	116.9 Å²	116.9	53%	0.532	61%	0.608	S	S	.	*			trans	-68.2	104.7	170	-79.4	-178.5	162.4	-123.9	-23.3	111.5	S191 G192	S191-R296 PolarHBondContact O-NH1 2.82Å; S191-R296 PolarHBondContact O-NH2 3.49Å; G192-R296 VanDerWaalsContact C-CZ 3.45Å; G192-R296 VanDerWaalsContact C-NH2 3.29Å; G192-R296 PolarHBondContact O-NE 3.49Å; G192-R296 PolarHBondContact O-NH2 3.09Å
297	S	29.5	Very low	35.7	Very low	112 Å²	112	124.9 Å²	124.9	78%	0.783	65%	0.651	S	S	*	*			trans	-62.4	130.7	159.9	-64.4	0	0	0	0	109.5	K295 S299	K295-S297 PolarHBondContact O-N 3.34Å; K295-S297 VanDerWaalsContact O-N 3.1Å; S297-S299 PolarHBondContact O-N 2.7Å
298	P	33.8	Very low	34.7	Very low	120 Å²	120	126.2 Å²	126.2	78%	0.779	67%	0.665	S	S	*	*			trans	-77.1	128.6	-169.6	-16.7	31.6	0	0	0	114.3
299	S	30.1	Very low	33.7	Very low	105 Å²	105	129.9 Å²	129.9	73%	0.734	69%	0.685	S	S	*	*			trans	44.2	106.8	143.1	62.4	0	0	0	0	119.7	S297	S297-S299 PolarHBondContact O-N 2.7Å
300	L	33.3	Very low	33.4	Very low	179 Å²	179	135.3 Å²	135.3	94%	0.937	70%	0.704	S	S	*	*			trans	-136.1	82.7	145.1	-105.4	166.3	0	0	0	109.9
301	G	31.6	Very low	32.7	Very low	62 Å²	62	137.6 Å²	137.6	64%	0.639	72%	0.717	S	S	*	*			trans	-90.5	151.4	166.4	0	0	0	0	0	110.8
302	R	31.1	Very low	32.1	Very low	215 Å²	215	140.7 Å²	140.7	81%	0.811	74%	0.741	S	S	*	*			trans	75.9	132.6	-175.9	-55.4	178.5	-178.6	-158.2	-2.2	112.4
303	R	31.1	Very low	31.9	Very low	218 Å²	218	143.6 Å²	143.6	82%	0.823	75%	0.745	S	S	*	*			cis	-152.2	152	16.9	-109.5	142.6	-177.7	176.8	-0.9	110.1
304	K	30.4	Very low	31.2	Very low	194 Å²	194	144.3 Å²	144.3	84%	0.843	76%	0.757	S	S	*	*			trans	-60.2	135.2	151.4	-75.3	179.9	170.5	-179.6	0	109
305	L	29.5	Very low	31.1	Very low	161 Å²	161	148 Å²	148	84%	0.843	78%	0.781	S	S	*	*				156.9	150	127.1	-88	157.7	0	0	0	112.9
306	C	29.3	Very low	30.8	Very low	113 Å²	113	149.3 Å²	149.3	76%	0.764	78%	0.781	S	S	*	*			trans	72.8	99.7	164	-55.8	0	0	0	0	118.7
307	L	27.2	Very low	30.7	Very low	169 Å²	169	149.7 Å²	149.7	89%	0.885	80%	0.799	S	S	*	*			trans	-51.3	150.5	132.7	-75.7	152.7	0	0	0	109.3
308	P	32.2	Very low	30.7	Very low	115 Å²	115	147.8 Å²	147.8	75%	0.747	80%	0.797	S	S	*	*				-144.2	162.7	94.4	39.1	-25	0	0	0	115.1
309	N	27.7	Very low	30.5	Very low	138 Å²	138	147.5 Å²	147.5	74%	0.738	80%	0.798	S	S	*	*			trans	-51.1	145.5	152.6	-88.7	-31.4	0	0	0	110.2
310	H	35.4	Very low	30.6	Very low	184 Å²	184	148.1 Å²	148.1	85%	0.852	80%	0.797	S	S	*	*				-176.2	150.2	106.1	-96.5	-69.9	0	0	0	112.5
311	N	31.9	Very low	30.5	Very low	150 Å²	150	151.1 Å²	151.1	80%	0.802	80%	0.796	S	S	*	*			trans	-64.8	158.2	174	-101.4	-21.9	0	0	0	113.2
312	S	29.3	Very low	30.3	Very low	101 Å²	101	155.4 Å²	155.4	71%	0.706	81%	0.805	S	S	*	*			trans	84.2	137.1	147	-63.7	0	0	0	0	121.2
313	Q	33.5	Very low	30.2	Very low	175 Å²	175	151.7 Å²	151.7	82%	0.818	81%	0.806	S	S	*	*			trans	77.2	92.7	151.3	-69.9	171	12.5	0	0	119.7
314	S	28.1	Very low	30.1	Very low	96 Å²	96	145.9 Å²	145.9	67%	0.671	80%	0.796	S	S	*	*				39.8	126.9	121.9	67.2	0	0	0	0	120.4
315	I	32.2	Very low	29.9	Very low	164 Å²	164	148.2 Å²	148.2	84%	0.841	80%	0.8	S	S	*	*				-170.7	156.3	98.8	-94	156.4	0	0	0	110.1
316	R	26	Very low	29.9	Very low	224 Å²	224	147.7 Å²	147.7	85%	0.845	80%	0.796	S	S	*	*			trans	-73.5	150.2	-175.2	-58.7	168.7	175.6	-175.2	-3	112
317	T	32	Very low	29.7	Very low	148 Å²	148	150.6 Å²	150.6	91%	0.908	80%	0.804	S	S	*	*				170	154.6	107.1	36.5	0	0	0	0	111.3
318	G	29.6	Very low	29.8	Very low	73 Å²	73	146.8 Å²	146.8	75%	0.753	79%	0.792	S	S	*	*			trans	114.2	77.8	160.5	0	0	0	0	0	118.5
319	S	29.5	Very low	29.6	Very low	113 Å²	113	150 Å²	150	79%	0.79	80%	0.795	S	S	*	*			trans	32.5	111	136.4	-140.1	0	0	0	0	118.1
320	T	31.9	Very low	29.6	Very low	119 Å²	119	147.2 Å²	147.2	73%	0.73	78%	0.78	S	S	*	*				-173.4	134	61.8	40.4	0	0	0	0	112.9
321	R	30.7	Very low	29.5	Very low	242 Å²	242	145 Å²	145	91%	0.913	77%	0.774	S	S	*	*			trans	47.8	98.9	148.9	-63.1	-177.8	179.5	168.9	0.6	120.4
322	N	28.2	Very low	29.5	Very low	152 Å²	152	146.3 Å²	146.3	81%	0.813	77%	0.767	S	S	*	*			trans	-4.1	131.7	138.1	-52.6	-7.2	0	0	0	115.9
323	T	28.2	Very low	29.7	Very low	137 Å²	137	146.7 Å²	146.7	84%	0.84	76%	0.761	S	S	*	*				-146.2	132.4	72.5	42	0	0	0	0	114.3
324	P	28.6	Very low	29.6	Very low	96 Å²	96	141.5 Å²	141.5	62%	0.623	74%	0.744	S	S	*	*			trans	-84.8	-166.1	166.1	-6.1	26	0	0	0	112.8
325	W	27.3	Very low	30.1	Very low	242 Å²	242	140 Å²	140	92%	0.917	73%	0.726	S	S	*	*			trans	73.5	129.4	178.1	-40.3	91.4	0	0	0	112.8
326	I	28.4	Very low	30.6	Very low	150 Å²	150	134.6 Å²	134.6	77%	0.769	70%	0.701	S	S	*	*			cis	-133.7	134.4	18.7	-69.2	171.3	0	0	0	110.8
327	N	26.6	Very low	31.5	Very low	174 Å²	174	127 Å²	127	93%	0.93	68%	0.679	S	S	*	*			trans	-83.5	111.5	162.6	-76.3	-24.5	0	0	0	109.3
328	S	28.3	Very low	32.1	Very low	89 Å²	89	123.1 Å²	123.1	62%	0.622	65%	0.653	S	S	*	*			trans	-170.6	77.7	155.7	-171.6	0	0	0	0	108.5	D330	S328-D330 PolarHBondContact O-N 3.36Å
329	F	27.4	Very low	33.2	Very low	183 Å²	183	123.3 Å²	123.3	80%	0.803	63%	0.631	S	S	*	*			trans	-80.6	98.3	168.9	-157.6	-90.7	0	0	0	106.9	L331	F329-L331 PolarHBondContact O-N 2.95Å
330	D	29.4	Very low	34.1	Very low	79 Å²	79	120.2 Å²	120.2	42%	0.422	61%	0.605	S	S	.	*			trans	-60.4	115.9	-170.4	-125.1	-43.2	0	0	0	111.3	S328 R332 N333	S328-D330 PolarHBondContact O-N 3.36Å; D330-R332 HydrophobicContact CB-CB 4.49Å; D330-R332 PolarHBondContact O-N 3.43Å; D330-R332 VanDerWaalsContact O-N 3.09Å; D330-R332 IonicContact OD1-NE 2.58Å; D330-N333 PolarHBondContact O-N 2.97Å
331	L	33.1	Very low	35.1	Very low	139 Å²	139	117.2 Å²	117.2	73%	0.728	59%	0.588	S	S	*	*	T	Hydrogen-bonded Turn	trans	-55.7	-27.5	175.2	-95.1	69.1	0	0	0	111.8	F329 N333 C334 Q335	F329-L331 PolarHBondContact O-N 2.95Å; L331-N333 PolarHBondContact O-N 2.82Å; L331-C334 WeakPolarHBondContact O-CB 3.34Å; L331-C334 PolarHBondContact O-N 2.81Å; L331-Q335 PolarHBondContact O-N 3.43Å; L331-Q335 VanDerWaalsContact O-N 3.14Å
332	R	30.8	Very low	36.2	Very low	177 Å²	177	106.4 Å²	106.4	67%	0.668	55%	0.548	S	S	*	.	H	α-helix	trans	-53.5	-35	175.4	-61.4	177.3	-177.6	-164.3	-0.9	112.7	D330 Q335 T336	D330-R332 HydrophobicContact CB-CB 4.49Å; D330-R332 PolarHBondContact O-N 3.43Å; D330-R332 VanDerWaalsContact O-N 3.09Å; D330-R332 IonicContact OD1-NE 2.58Å; R332-Q335 PolarHBondContact O-N 3.42Å; R332-T336 PolarHBondContact O-N 2.9Å; R332-T336 PolarHBondContact O-OG1 3.32Å
333	N	34.7	Very low	37.5	Very low	108 Å²	108	102.2 Å²	102.2	58%	0.578	52%	0.52	S	S	*	.	H	α-helix	trans	-76.7	-19.8	178.2	-84.9	10.6	0	0	0	113.8	D330 L331 T336 V337	D330-N333 PolarHBondContact O-N 2.97Å; L331-N333 PolarHBondContact O-N 2.82Å; N333-T336 WeakPolarHBondContact CA-OG1 3.33Å; N333-T336 PolarHBondContact O-OG1 2.89Å; N333-V337 VanDerWaalsContact O-CG2 3.3Å; N333-V337 WeakPolarHBondContact O-CG2 3.49Å
334	C	31.2	Very low	38.7	Very low	67 Å²	67	100.3 Å²	100.3	45%	0.453	50%	0.5	S	S	.	.	H	α-helix	trans	-78.2	-42.4	169.2	-68	0	0	0	0	110.2	L331 T336 V337 L338	L331-C334 WeakPolarHBondContact O-CB 3.34Å; L331-C334 PolarHBondContact O-N 2.81Å; C334-T336 PolarHBondContact O-N 2.84Å; C334-V337 PolarHBondContact O-N 3.35Å; C334-L338 WeakPolarHBondContact O-CG 3.42Å; C334-L338 PolarHBondContact O-N 3.45Å
335	Q	37.9	Very low	40	Very low	64 Å²	64	99 Å²	99	30%	0.299	49%	0.488	S	S	.	.	H	α-helix	trans	-60.1	-44	175.8	-72.7	177.1	-37	0	0	112.2	L331 R332 V337 L338 R339	L331-Q335 PolarHBondContact O-N 3.43Å; L331-Q335 VanDerWaalsContact O-N 3.14Å; R332-Q335 PolarHBondContact O-N 3.42Å; Q335-V337 PolarHBondContact O-N 3.14Å; Q335-L338 PolarHBondContact O-N 2.96Å; Q335-R339 WeakPolarHBondContact O-CB 3.35Å; Q335-R339 VanDerWaalsContact O-CG 3.24Å; Q335-R339 WeakPolarHBondContact O-CG 3.41Å; Q335-R339 PolarHBondContact O-N 2.96Å
336	T	42.8	Very low	41.6	Very low	51 Å²	51	87.5 Å²	87.5	31%	0.313	45%	0.445	S	S	.	.	H	α-helix	trans	-66.9	-33.4	177.7	51.1	0	0	0	0	113.7	R332 N333 C334 R339 N340	R332-T336 PolarHBondContact O-N 2.9Å; R332-T336 PolarHBondContact O-OG1 3.32Å; N333-T336 WeakPolarHBondContact CA-OG1 3.33Å; N333-T336 PolarHBondContact O-OG1 2.89Å; C334-T336 PolarHBondContact O-N 2.84Å; T336-R339 PolarHBondContact O-N 3.18Å; T336-N340 PolarHBondContact O-N 2.76Å; T336-N340 PolarHBondContact O-ND2 3.15Å
337	V	44.4	Very low	43	Very low	65 Å²	65	83.1 Å²	83.1	39%	0.394	42%	0.422	S	S	.	.	H	α-helix	trans	-69.7	-46	175.1	172.4	0	0	0	0	110.9	I293 N333 C334 Q335 R339 N340 C341	I293-V337 HydrophobicContact CG2-CG1 4.25Å; N333-V337 VanDerWaalsContact O-CG2 3.3Å; N333-V337 WeakPolarHBondContact O-CG2 3.49Å; C334-V337 PolarHBondContact O-N 3.35Å; Q335-V337 PolarHBondContact O-N 3.14Å; V337-R339 VanDerWaalsContact C-N 3.31Å; V337-R339 PolarHBondContact O-N 3.4Å; V337-N340 PolarHBondContact O-N 3.47Å; V337-C341 PolarHBondContact O-N 3.36Å; V337-C341 VanDerWaalsContact O-N 3.08Å
338	L	45.7	Very low	44.2	Very low	66 Å²	66	81 Å²	81	35%	0.346	41%	0.407	S	S	.	.	H	α-helix	trans	-59.4	-42.5	173	-73.6	165.7	0	0	0	111.2	C334 Q335 N340 C341 W342 E475	C334-L338 WeakPolarHBondContact O-CG 3.42Å; C334-L338 PolarHBondContact O-N 3.45Å; Q335-L338 PolarHBondContact O-N 2.96Å; L338-N340 PolarHBondContact O-N 3.07Å; L338-C341 PolarHBondContact O-N 2.78Å; L338-C341 VanDerWaalsContact O-N 3.14Å; L338-W342 PolarHBondContact O-N 2.83Å; L338-E475 HydrophobicContact CD1-CG 4.46Å; L338-E475 WeakPolarHBondContact CD1-OE1 3.25Å
339	R	51.2	Low	45.4	Very low	77 Å²	77	84.1 Å²	84.1	29%	0.291	41%	0.405	S	S	.	.	H	α-helix	trans	-56.6	-50.1	176.7	-77.7	-179.2	-171.8	-164.4	8.5	113.2	Q335 T336 V337 C341 W342 R343 D482	Q335-R339 WeakPolarHBondContact O-CB 3.35Å; Q335-R339 VanDerWaalsContact O-CG 3.24Å; Q335-R339 WeakPolarHBondContact O-CG 3.41Å; Q335-R339 PolarHBondContact O-N 2.96Å; T336-R339 PolarHBondContact O-N 3.18Å; V337-R339 VanDerWaalsContact C-N 3.31Å; V337-R339 PolarHBondContact O-N 3.4Å; R339-C341 VanDerWaalsContact C-N 3.27Å; R339-C341 PolarHBondContact O-N 3.33Å; R339-W342 VanDerWaalsContact CA-NE1 3.33Å; R339-W342 HydrophobicContact CB-CZ2 4.29Å; R339-W342 HydrophobicContact CG-CZ2 4.17Å; R339-W342 PolarHBondContact O-N 3.23Å; R339-R343 VanDerWaalsContact O-CB 3.31Å; R339-R343 WeakPolarHBondContact O-CB 3.35Å; R339-R343 PolarHBondContact O-N 2.78Å; R339-D482 IonicContact CZ-OD2 3.61Å; R339-D482 IonicContact NE-OD2 2.66Å; R339-D482 IonicContact NH2-OD1 3.16Å; R339-D482 IonicContact NH2-OD2 3.95Å; R339-D482 PolarHBondContact NH2-OD2 3.43Å
340	N	50.3	Low	46.5	Very low	47 Å²	47	77.2 Å²	77.2	25%	0.251	38%	0.376	S	S	.	.	H	α-helix	trans	-68.1	-26.4	178.6	-78.5	-74.9	0	0	0	113.1	T336 V337 L338 K344 E503	T336-N340 PolarHBondContact O-N 2.76Å; T336-N340 PolarHBondContact O-ND2 3.15Å; V337-N340 PolarHBondContact O-N 3.47Å; L338-N340 PolarHBondContact O-N 3.07Å; N340-K344 WeakPolarHBondContact O-CG 3.42Å; N340-K344 PolarHBondContact O-N 3.19Å; N340-E503 PolarHBondContact ND2-OXT 3.47Å
341	C	51.9	Low	47.3	Very low	56 Å²	56	75.5 Å²	75.5	38%	0.378	37%	0.372	S	S	.	.	H	α-helix	trans	-74.3	-44.2	174.2	-80.4	0	0	0	0	113.6	V337 L338 R339 N345	V337-C341 PolarHBondContact O-N 3.36Å; V337-C341 VanDerWaalsContact O-N 3.08Å; L338-C341 PolarHBondContact O-N 2.78Å; L338-C341 VanDerWaalsContact O-N 3.14Å; R339-C341 VanDerWaalsContact C-N 3.27Å; R339-C341 PolarHBondContact O-N 3.33Å; C341-N345 PolarHBondContact O-N 3.3Å; C341-N345 PolarHBondContact O-ND2 2.93Å
342	W	54.1	Low	48	Very low	16 Å²	16	75 Å²	75	6%	0.061	36%	0.364	C	S	.	.	H	α-helix	trans	-73.7	-35	176.5	70.8	-112.8	0	0	0	111.6	L338 R339 K344 N345 L346 L471 M479 L499 M500	L338-W342 PolarHBondContact O-N 2.83Å; R339-W342 VanDerWaalsContact CA-NE1 3.33Å; R339-W342 HydrophobicContact CB-CZ2 4.29Å; R339-W342 HydrophobicContact CG-CZ2 4.17Å; R339-W342 PolarHBondContact O-N 3.23Å; W342-K344 VanDerWaalsContact C-N 3.3Å; W342-K344 PolarHBondContact O-N 3.41Å; W342-N345 PolarHBondContact O-N 3.37Å; W342-N345 VanDerWaalsContact O-N 3.15Å; W342-L346 HydrophobicContact CE3-CB 4.34Å; W342-L346 HydrophobicContact CE3-CD2 3.8Å; W342-L346 HydrophobicContact CZ3-CD2 3.77Å; W342-L346 WeakPolarHBondContact O-CB 3.39Å; W342-L346 PolarHBondContact O-N 3.34Å; W342-L471 HydrophobicContact CB-CD1 4.46Å; W342-M479 HydrophobicContact CB-CE 4.34Å; W342-M479 HydrophobicContact CD2-CE 3.52Å; W342-M479 HydrophobicContact CE3-CE 4.25Å; W342-M479 HydrophobicContact CG-CE 3.49Å; W342-M479 VanDerWaalsContact CG-CE 3.49Å; W342-M479 HydrophobicContact CG-SD 4Å; W342-M479 HydrophobicContact CZ2-CE 4.44Å; W342-M479 PolarHBondContact NE1-SD 2.95Å; W342-M479 VanDerWaalsContact NE1-SD 3.36Å; W342-L499 HydrophobicContact CH2-CB 4.49Å; W342-L499 HydrophobicContact CH2-CD1 3.2Å; W342-L499 HydrophobicContact CH2-CD2 4.3Å; W342-L499 HydrophobicContact CH2-CG 3.39Å; W342-L499 WeakPolarHBondContact CH2-O 3.31Å; W342-L499 HydrophobicContact CZ2-CD1 3.34Å; W342-L499 HydrophobicContact CZ2-CG 4.08Å; W342-L499 HydrophobicContact CZ3-CD1 4.1Å; W342-L499 HydrophobicContact CZ3-CD2 4.46Å; W342-L499 HydrophobicContact CZ3-CG 3.94Å; W342-M500 HydrophobicContact CZ3-SD 4.04Å
343	R	55.2	Low	48.5	Very low	63 Å²	63	73.9 Å²	73.9	24%	0.238	36%	0.364	C	S	.	.	H	α-helix	trans	-53.7	-48.4	173.9	178.7	177.1	172	174.6	0.3	110.7	R339 I347 M500 T501 S502	R339-R343 VanDerWaalsContact O-CB 3.31Å; R339-R343 WeakPolarHBondContact O-CB 3.35Å; R339-R343 PolarHBondContact O-N 2.78Å; R343-I347 HydrophobicContact CG-CD1 3.82Å; R343-I347 VanDerWaalsContact O-CB 3.27Å; R343-I347 WeakPolarHBondContact O-CB 3.42Å; R343-I347 WeakPolarHBondContact O-CD1 3.21Å; R343-I347 WeakPolarHBondContact O-CG1 3.24Å; R343-I347 PolarHBondContact O-N 3.01Å; R343-M500 PolarHBondContact NE-O 2.95Å; R343-M500 PolarHBondContact NH2-O 2.89Å; R343-T501 PolarHBondContact NH1-O 3.17Å; R343-S502 PolarHBondContact NH1-O 3.01Å
344	K	54.3	Low	49.3	Very low	97 Å²	97	73 Å²	73	42%	0.422	36%	0.359	S	S	.	.	H	α-helix	trans	-64.6	-42.9	176.9	-71.5	-178.1	-178.7	-174.2	0	113.1	N291 N340 W342 Q348	N291-K344 PolarHBondContact OD1-NZ 3.08Å; N340-K344 WeakPolarHBondContact O-CG 3.42Å; N340-K344 PolarHBondContact O-N 3.19Å; W342-K344 VanDerWaalsContact C-N 3.3Å; W342-K344 PolarHBondContact O-N 3.41Å; K344-Q348 VanDerWaalsContact O-CB 3.27Å; K344-Q348 WeakPolarHBondContact O-CB 3.21Å; K344-Q348 VanDerWaalsContact O-CG 3.23Å; K344-Q348 WeakPolarHBondContact O-CG 3.43Å; K344-Q348 PolarHBondContact O-N 2.58Å
345	N	54.5	Low	50.1	Low	68 Å²	68	75.7 Å²	75.7	36%	0.364	37%	0.368	S	S	.	.	H	α-helix	trans	-69.4	-41.6	179.1	-85.8	-78	0	0	0	113.4	C341 W342 Q348 R349	C341-N345 PolarHBondContact O-N 3.3Å; C341-N345 PolarHBondContact O-ND2 2.93Å; W342-N345 PolarHBondContact O-N 3.37Å; W342-N345 VanDerWaalsContact O-N 3.15Å; N345-Q348 PolarHBondContact O-N 3.09Å; N345-R349 WeakPolarHBondContact O-CB 3.23Å; N345-R349 WeakPolarHBondContact O-CG 3.27Å; N345-R349 PolarHBondContact O-N 3.48Å
346	L	60.8	Low	51	Low	2 Å²	2	77.9 Å²	77.9	1%	0.01	38%	0.382	C	S	.	.	H	α-helix	trans	-61.8	-47.8	176.2	179.2	62.7	0	0	0	109.9	W342 R349 M350 I463 L467 M500	W342-L346 HydrophobicContact CE3-CB 4.34Å; W342-L346 HydrophobicContact CE3-CD2 3.8Å; W342-L346 HydrophobicContact CZ3-CD2 3.77Å; W342-L346 WeakPolarHBondContact O-CB 3.39Å; W342-L346 PolarHBondContact O-N 3.34Å; L346-R349 PolarHBondContact O-N 2.9Å; L346-M350 HydrophobicContact CD1-CE 3.63Å; L346-M350 HydrophobicContact CD1-CG 3.91Å; L346-M350 HydrophobicContact CD1-SD 3.96Å; L346-M350 HydrophobicContact CD2-CE 4.47Å; L346-M350 HydrophobicContact CG-CE 3.88Å; L346-M350 VanDerWaalsContact O-CB 3.28Å; L346-M350 WeakPolarHBondContact O-CB 3.37Å; L346-M350 WeakPolarHBondContact O-CG 3.15Å; L346-M350 PolarHBondContact O-N 2.83Å; L346-I463 HydrophobicContact CD1-CG2 4.1Å; L346-L467 HydrophobicContact CB-CD1 4.22Å; L346-L467 HydrophobicContact CD1-CD1 3.21Å; L346-L467 HydrophobicContact CG-CD1 4.28Å; L346-M500 HydrophobicContact CD2-CE 3.99Å; L346-M500 HydrophobicContact CD2-SD 3.36Å; L346-M500 WeakPolarHBondContact CD2-SD 3.44Å; L346-M500 HydrophobicContact CG-CE 4.03Å; L346-M500 HydrophobicContact CG-SD 4.07Å
347	I	58.8	Low	52.1	Low	57 Å²	57	78.9 Å²	78.9	29%	0.292	38%	0.383	S	S	.	.	H	α-helix	trans	-59.5	-46.8	172.6	-70.8	172.3	0	0	0	111.2	R343 R349 A351 I354 M500	R343-I347 HydrophobicContact CG-CD1 3.82Å; R343-I347 VanDerWaalsContact O-CB 3.27Å; R343-I347 WeakPolarHBondContact O-CB 3.42Å; R343-I347 WeakPolarHBondContact O-CD1 3.21Å; R343-I347 WeakPolarHBondContact O-CG1 3.24Å; R343-I347 PolarHBondContact O-N 3.01Å; I347-R349 VanDerWaalsContact C-N 3.33Å; I347-R349 PolarHBondContact O-N 3.07Å; I347-A351 WeakPolarHBondContact O-CB 3.29Å; I347-A351 PolarHBondContact O-N 3.06Å; I347-A351 VanDerWaalsContact O-N 3.07Å; I347-I354 HydrophobicContact CG2-CD1 3.22Å; I347-M500 HydrophobicContact CD1-CE 4.21Å; I347-M500 HydrophobicContact CG1-CE 3.48Å; I347-M500 VanDerWaalsContact CG1-CE 3.48Å
348	Q	51.9	Low	53.5	Low	131 Å²	131	80.2 Å²	80.2	61%	0.612	39%	0.391	S	S	*	.	H	α-helix	trans	-67.2	-23.4	-179.9	-80.3	178.4	-11	0	0	115.2	K344 N345 A351	K344-Q348 VanDerWaalsContact O-CB 3.27Å; K344-Q348 WeakPolarHBondContact O-CB 3.21Å; K344-Q348 VanDerWaalsContact O-CG 3.23Å; K344-Q348 WeakPolarHBondContact O-CG 3.43Å; K344-Q348 PolarHBondContact O-N 2.58Å; N345-Q348 PolarHBondContact O-N 3.09Å; Q348-A351 WeakPolarHBondContact O-CB 3.47Å
349	R	53.5	Low	55.2	Low	153 Å²	153	79.4 Å²	79.4	58%	0.577	39%	0.386	S	S	*	.	H	α-helix	trans	-108.2	-23.6	-176.8	-66.1	179.9	76	157.6	6.1	113.4	N345 L346 I347 A351 G466 L467	N345-R349 WeakPolarHBondContact O-CB 3.23Å; N345-R349 WeakPolarHBondContact O-CG 3.27Å; N345-R349 PolarHBondContact O-N 3.48Å; L346-R349 PolarHBondContact O-N 2.9Å; I347-R349 VanDerWaalsContact C-N 3.33Å; I347-R349 PolarHBondContact O-N 3.07Å; R349-A351 PolarHBondContact O-N 3.45Å; R349-G466 PolarHBondContact NH2-O 3.19Å; R349-L467 HydrophobicContact CB-CD2 3.31Å; R349-L467 HydrophobicContact CG-CD2 4.01Å; R349-L467 PolarHBondContact NH1-O 3Å
350	M	50.2	Low	56.8	Low	39 Å²	39	81.8 Å²	81.8	19%	0.192	40%	0.401	C	S	.	.	S	Bend	trans	-77.1	-0.6	158.5	-60.4	-145.5	-70	0	0	112.2	L346 F352 A443 L447 F496 M500	L346-M350 HydrophobicContact CD1-CE 3.63Å; L346-M350 HydrophobicContact CD1-CG 3.91Å; L346-M350 HydrophobicContact CD1-SD 3.96Å; L346-M350 HydrophobicContact CD2-CE 4.47Å; L346-M350 HydrophobicContact CG-CE 3.88Å; L346-M350 VanDerWaalsContact O-CB 3.28Å; L346-M350 WeakPolarHBondContact O-CB 3.37Å; L346-M350 WeakPolarHBondContact O-CG 3.15Å; L346-M350 PolarHBondContact O-N 2.83Å; M350-F352 VanDerWaalsContact C-N 3.34Å; M350-F352 PolarHBondContact O-N 2.95Å; M350-A443 HydrophobicContact CE-CB 3.7Å; M350-A443 HydrophobicContact SD-CB 4.13Å; M350-L447 HydrophobicContact CE-CD1 4.22Å; M350-L447 HydrophobicContact SD-CD1 3.96Å; M350-L447 HydrophobicContact SD-CD2 3.92Å; M350-L447 HydrophobicContact SD-CG 4.22Å; M350-F496 HydrophobicContact CE-CE2 4.23Å; M350-F496 HydrophobicContact CE-CZ 3.76Å; M350-M500 HydrophobicContact CE-CE 4.32Å
351	A	47	Very low	58.5	Low	42 Å²	42	86.1 Å²	86.1	35%	0.347	42%	0.419	S	S	.	.			trans	-58.1	89.9	175.3	0	0	0	0	0	112.8	I347 Q348 R349 K353 I354	I347-A351 WeakPolarHBondContact O-CB 3.29Å; I347-A351 PolarHBondContact O-N 3.06Å; I347-A351 VanDerWaalsContact O-N 3.07Å; Q348-A351 WeakPolarHBondContact O-CB 3.47Å; R349-A351 PolarHBondContact O-N 3.45Å; A351-K353 PolarHBondContact O-N 3.3Å; A351-I354 HydrophobicContact CB-CD1 4.13Å; A351-I354 HydrophobicContact CB-CG1 4.02Å
352	F	47.4	Very low	60.2	Low	129 Å²	129	88.5 Å²	88.5	57%	0.566	43%	0.428	S	S	*	.	S	Bend		-32.6	122.2	113.8	-70.2	-84.6	0	0	0	108	M350 I354	M350-F352 VanDerWaalsContact C-N 3.34Å; M350-F352 PolarHBondContact O-N 2.95Å; F352-I354 WeakPolarHBondContact O-CG1 3.4Å; F352-I354 PolarHBondContact O-N 3.25Å
353	K	39.7	Very low	61.8	Low	154 Å²	154	91.6 Å²	91.6	67%	0.67	44%	0.444	S	S	*	.			trans	-41.9	108.9	-173.7	-69	177.9	178.8	177.6	0	109.8	A351 D355	A351-K353 PolarHBondContact O-N 3.3Å; K353-D355 PolarHBondContact O-N 3.06Å
354	I	51.6	Low	63.5	Low	89 Å²	89	90.6 Å²	90.6	46%	0.456	44%	0.444	S	S	.	.			trans	-77.6	75.4	172	-55.9	173.8	0	0	0	103.9	I347 A351 F352 D356	I347-I354 HydrophobicContact CG2-CD1 3.22Å; A351-I354 HydrophobicContact CB-CD1 4.13Å; A351-I354 HydrophobicContact CB-CG1 4.02Å; F352-I354 WeakPolarHBondContact O-CG1 3.4Å; F352-I354 PolarHBondContact O-N 3.25Å; I354-D356 PolarHBondContact O-N 3.46Å
355	D	48.5	Very low	65.3	Low	123 Å²	123	90.4 Å²	90.4	66%	0.658	44%	0.444	S	S	*	.			trans	-59	127.1	170.5	-71.1	-26.9	0	0	0	105.7	K353 F357	K353-D355 PolarHBondContact O-N 3.06Å; D355-F357 PolarHBondContact O-N 2.87Å
356	D	57.4	Low	67	Low	110 Å²	110	90.7 Å²	90.7	59%	0.588	45%	0.447	S	S	*	.			trans	-43.4	117.5	-178.9	-72.4	-41.9	0	0	0	109.5	I354 T358	I354-D356 PolarHBondContact O-N 3.46Å; D356-T358 WeakPolarHBondContact O-CG2 3.38Å; D356-T358 PolarHBondContact O-N 3.06Å; D356-T358 PolarHBondContact O-OG1 2.89Å
357	F	66.8	Low	68.5	Low	73 Å²	73	90.6 Å²	90.6	32%	0.32	45%	0.447	S	S	.	.			trans	-59.5	108.8	-170.5	173.2	-95.1	0	0	0	110	D355 I359 G428 L431 Q432	D355-F357 PolarHBondContact O-N 2.87Å; F357-I359 HydrophobicContact CE1-CG1 3.83Å; F357-I359 HydrophobicContact CZ-CG1 4.19Å; F357-G428 WeakPolarHBondContact CE1-O 3.49Å; F357-L431 HydrophobicContact CE1-CB 4.09Å; F357-L431 HydrophobicContact CE2-CB 4.04Å; F357-L431 HydrophobicContact CZ-CB 3.35Å; F357-L431 HydrophobicContact CZ-CD1 4.15Å; F357-L431 HydrophobicContact CZ-CG 4.43Å; F357-Q432 HydrophobicContact CB-CG 4.25Å; F357-Q432 HydrophobicContact CD1-CB 3.79Å; F357-Q432 HydrophobicContact CD1-CG 4.32Å; F357-Q432 HydrophobicContact CE1-CB 4.19Å; F357-Q432 HydrophobicContact CG-CB 4.01Å; F357-Q432 HydrophobicContact CG-CG 4.19Å
358	T	71.8	Confident	70	Confident	93 Å²	93	92.7 Å²	92.7	57%	0.571	45%	0.454	S	S	*	.			trans	-116.2	123.5	-179.9	43.8	0	0	0	0	109.4	D356 Q360	D356-T358 WeakPolarHBondContact O-CG2 3.38Å; D356-T358 PolarHBondContact O-N 3.06Å; D356-T358 PolarHBondContact O-OG1 2.89Å; T358-Q360 PolarHBondContact O-N 2.87Å; T358-Q360 VanDerWaalsContact O-N 3.09Å
359	I	81.9	Confident	71.9	Confident	48 Å²	48	90.4 Å²	90.4	25%	0.246	45%	0.446	C	S	.	.			trans	-63	115.3	175.3	-51.7	175.6	0	0	0	108	F357 Q363 V364 Y427 L431	F357-I359 HydrophobicContact CE1-CG1 3.83Å; F357-I359 HydrophobicContact CZ-CG1 4.19Å; I359-Q363 HydrophobicContact CG2-CB 3.76Å; I359-V364 HydrophobicContact CB-CG2 4.13Å; I359-V364 HydrophobicContact CG2-CG2 3.63Å; I359-Y427 HydrophobicContact CD1-CD1 4.48Å; I359-Y427 HydrophobicContact CG2-CD1 4.47Å; I359-Y427 HydrophobicContact CG2-CE1 4.18Å; I359-L431 HydrophobicContact CG2-CD1 4.17Å
360	Q	85.2	Confident	73.8	Confident	128 Å²	128	83.4 Å²	83.4	60%	0.598	42%	0.42	S	S	*	.			trans	-59.8	145.2	178.9	-64.8	-63.4	-27.9	0	0	111.1	T358 D362 Q363 V364	T358-Q360 PolarHBondContact O-N 2.87Å; T358-Q360 VanDerWaalsContact O-N 3.09Å; Q360-D362 PolarHBondContact O-N 2.94Å; Q360-D362 VanDerWaalsContact O-N 3.09Å; Q360-Q363 HydrophobicContact CB-CG 4.17Å; Q360-Q363 WeakPolarHBondContact O-CA 3.33Å; Q360-Q363 WeakPolarHBondContact O-CB 3.28Å; Q360-Q363 PolarHBondContact O-N 3.28Å; Q360-V364 PolarHBondContact O-N 2.92Å
361	E	86.4	Confident	75.7	Confident	137 Å²	137	82 Å²	82	64%	0.64	41%	0.413	S	S	*	.	H	α-helix	trans	-58.5	-31.6	-172.8	-157.6	-164.3	-155.9	0	0	112.7	V364 K365	E361-V364 PolarHBondContact O-N 3.49Å; E361-K365 VanDerWaalsContact O-CG 3.32Å; E361-K365 WeakPolarHBondContact O-CG 3.46Å; E361-K365 PolarHBondContact O-N 2.76Å; E361-K365 WeakPolarHBondContact OE2-CE 3.37Å; E361-K365 IonicContact OE2-NZ 2.73Å; E361-K365 PolarHBondContact OE2-NZ 2.84Å
362	D	87.9	Confident	77.8	Confident	106 Å²	106	85.9 Å²	85.9	57%	0.567	42%	0.422	S	S	*	.	H	α-helix	trans	-71.5	-33.7	175.4	-66.2	-25.7	0	0	0	113.1	Q360 V364 K365 V366	Q360-D362 PolarHBondContact O-N 2.94Å; Q360-D362 VanDerWaalsContact O-N 3.09Å; D362-V364 VanDerWaalsContact C-N 3.35Å; D362-K365 WeakPolarHBondContact O-CB 3.47Å; D362-K365 PolarHBondContact O-N 3.46Å; D362-K365 IonicContact OD1-NZ 3.66Å; D362-K365 PolarHBondContact OD1-NZ 2.84Å; D362-V366 WeakPolarHBondContact O-CG2 3.49Å; D362-V366 PolarHBondContact O-N 2.78Å
363	Q	88.1	Confident	79.9	Confident	82 Å²	82	88.3 Å²	88.3	38%	0.383	43%	0.428	S	S	.	.	H	α-helix	trans	-67.6	-38.1	171.2	-58.6	-62.9	-17.5	0	0	110.4	I359 Q360 K365 V366 A367 Y427 L431	I359-Q363 HydrophobicContact CG2-CB 3.76Å; Q360-Q363 HydrophobicContact CB-CG 4.17Å; Q360-Q363 WeakPolarHBondContact O-CA 3.33Å; Q360-Q363 WeakPolarHBondContact O-CB 3.28Å; Q360-Q363 PolarHBondContact O-N 3.28Å; Q363-K365 VanDerWaalsContact C-N 3.34Å; Q363-K365 PolarHBondContact O-N 3.35Å; Q363-V366 PolarHBondContact O-N 2.92Å; Q363-A367 VanDerWaalsContact O-CB 3.28Å; Q363-A367 WeakPolarHBondContact O-CB 3.48Å; Q363-A367 PolarHBondContact O-N 2.94Å; Q363-Y427 HydrophobicContact CB-CE1 4.13Å; Q363-Y427 PolarHBondContact OE1-OH 3.46Å; Q363-L431 HydrophobicContact CB-CD1 4.4Å
364	V	90	Very high	82.3	Confident	42 Å²	42	82.9 Å²	82.9	26%	0.255	40%	0.404	S	S	.	.	H	α-helix	trans	-62.3	-39.6	172.3	-178.3	0	0	0	0	111.5	I359 Q360 E361 D362 K368 F420 L424	I359-V364 HydrophobicContact CB-CG2 4.13Å; I359-V364 HydrophobicContact CG2-CG2 3.63Å; Q360-V364 PolarHBondContact O-N 2.92Å; E361-V364 PolarHBondContact O-N 3.49Å; D362-V364 VanDerWaalsContact C-N 3.35Å; V364-K368 VanDerWaalsContact O-CB 3.25Å; V364-K368 WeakPolarHBondContact O-CB 3.2Å; V364-K368 PolarHBondContact O-N 3.29Å; V364-F420 HydrophobicContact CG1-CZ 4.24Å; V364-L424 HydrophobicContact CG1-CD1 4.28Å; V364-L424 HydrophobicContact CG1-CD2 4.36Å
365	K	91.5	Very high	84.1	Confident	93 Å²	93	79.9 Å²	79.9	40%	0.404	39%	0.389	S	S	.	.	H	α-helix	trans	-62.2	-48.4	174.7	-69.4	162.6	-155.2	156	0	111.3	E361 D362 Q363 K368 D369	E361-K365 VanDerWaalsContact O-CG 3.32Å; E361-K365 WeakPolarHBondContact O-CG 3.46Å; E361-K365 PolarHBondContact O-N 2.76Å; E361-K365 WeakPolarHBondContact OE2-CE 3.37Å; E361-K365 IonicContact OE2-NZ 2.73Å; E361-K365 PolarHBondContact OE2-NZ 2.84Å; D362-K365 WeakPolarHBondContact O-CB 3.47Å; D362-K365 PolarHBondContact O-N 3.46Å; D362-K365 IonicContact OD1-NZ 3.66Å; D362-K365 PolarHBondContact OD1-NZ 2.84Å; Q363-K365 VanDerWaalsContact C-N 3.34Å; Q363-K365 PolarHBondContact O-N 3.35Å; K365-K368 WeakPolarHBondContact O-CB 3.08Å; K365-K368 PolarHBondContact O-N 2.85Å; K365-D369 PolarHBondContact O-N 3.21Å
366	V	91.4	Very high	85.5	Confident	73 Å²	73	82.1 Å²	82.1	44%	0.442	39%	0.393	S	S	.	.	H	α-helix	trans	-63.4	-44.4	178.6	174.8	0	0	0	0	111.4	D362 Q363 K368 D369 V370 L394	D362-V366 WeakPolarHBondContact O-CG2 3.49Å; D362-V366 PolarHBondContact O-N 2.78Å; Q363-V366 PolarHBondContact O-N 2.92Å; V366-K368 VanDerWaalsContact C-N 3.33Å; V366-K368 PolarHBondContact O-N 3.07Å; V366-D369 PolarHBondContact O-N 3.31Å; V366-V370 PolarHBondContact O-N 3.14Å; V366-L394 HydrophobicContact CG1-CD2 3.69Å
367	A	90.7	Very high	86.5	Confident	0 Å²	0	86.1 Å²	86.1	0%	0	40%	0.4	C	S	.	.	H	α-helix	trans	-58.3	-42.8	173.6	0	0	0	0	0	112.1	Q363 V370 F371 F423 L424 Y427	Q363-A367 VanDerWaalsContact O-CB 3.28Å; Q363-A367 WeakPolarHBondContact O-CB 3.48Å; Q363-A367 PolarHBondContact O-N 2.94Å; A367-V370 PolarHBondContact O-N 2.85Å; A367-F371 VanDerWaalsContact O-CB 3.31Å; A367-F371 WeakPolarHBondContact O-CB 3.35Å; A367-F371 PolarHBondContact O-N 3.16Å; A367-F423 HydrophobicContact CB-CE1 4.09Å; A367-L424 HydrophobicContact CB-CD2 3.96Å; A367-Y427 HydrophobicContact CB-CD1 3.83Å; A367-Y427 HydrophobicContact CB-CE1 3.72Å; A367-Y427 HydrophobicContact CB-CG 4.49Å
368	K	91.6	Very high	87.2	Confident	102 Å²	102	85.6 Å²	85.6	44%	0.443	42%	0.415	S	S	.	.	H	α-helix	trans	-65	-38.2	177.3	-169	169.4	-172.8	167.7	0	112.9	V364 K365 V366 K372 F420	V364-K368 VanDerWaalsContact O-CB 3.25Å; V364-K368 WeakPolarHBondContact O-CB 3.2Å; V364-K368 PolarHBondContact O-N 3.29Å; K365-K368 WeakPolarHBondContact O-CB 3.08Å; K365-K368 PolarHBondContact O-N 2.85Å; V366-K368 VanDerWaalsContact C-N 3.33Å; V366-K368 PolarHBondContact O-N 3.07Å; K368-K372 VanDerWaalsContact O-CG 3.29Å; K368-K372 WeakPolarHBondContact O-CG 3.34Å; K368-K372 PolarHBondContact O-N 2.89Å; K368-K372 VanDerWaalsContact O-N 3.12Å; K368-F420 HydrophobicContact CB-CE2 3.84Å; K368-F420 HydrophobicContact CB-CZ 3.66Å; K368-F420 HydrophobicContact CD-CE1 4.48Å; K368-F420 HydrophobicContact CD-CZ 4.34Å; K368-F420 HydrophobicContact CG-CE2 4.19Å; K368-F420 HydrophobicContact CG-CZ 4.02Å
369	D	91.9	Very high	87.8	Confident	83 Å²	83	86.2 Å²	86.2	44%	0.444	41%	0.411	S	S	.	.	H	α-helix	trans	-74.9	-31.5	177.9	-76.6	-12.4	0	0	0	112.7	K365 V366 K372 R373	K365-D369 PolarHBondContact O-N 3.21Å; V366-D369 PolarHBondContact O-N 3.31Å; D369-K372 IonicContact OD1-NZ 3.64Å; D369-K372 PolarHBondContact OD1-NZ 3.07Å; D369-K372 VanDerWaalsContact OD1-NZ 3.17Å; D369-R373 WeakPolarHBondContact O-CG 3.49Å; D369-R373 PolarHBondContact O-N 2.86Å
370	V	92.1	Very high	88	Confident	6 Å²	6	91.3 Å²	91.3	4%	0.036	43%	0.434	C	S	.	.	H	α-helix	trans	-69.5	-46.3	168.5	172.7	0	0	0	0	111.1	V366 A367 K372 R373 F374 A390 A393 L394	V366-V370 PolarHBondContact O-N 3.14Å; A367-V370 PolarHBondContact O-N 2.85Å; V370-K372 VanDerWaalsContact C-N 3.3Å; V370-K372 PolarHBondContact O-N 3.38Å; V370-R373 WeakPolarHBondContact O-CB 3.36Å; V370-R373 PolarHBondContact O-N 3.11Å; V370-F374 HydrophobicContact CG1-CD2 3.94Å; V370-F374 HydrophobicContact CG1-CE2 3.87Å; V370-F374 WeakPolarHBondContact O-CD2 3.43Å; V370-F374 PolarHBondContact O-N 2.82Å; V370-A390 HydrophobicContact CG1-CB 4.17Å; V370-A393 HydrophobicContact CG1-CB 4.02Å; V370-L394 HydrophobicContact CB-CD2 3.97Å; V370-L394 HydrophobicContact CB-CG 4.14Å; V370-L394 HydrophobicContact CG1-CD1 4.49Å; V370-L394 HydrophobicContact CG1-CD2 4.49Å; V370-L394 HydrophobicContact CG1-CG 4.1Å; V370-L394 HydrophobicContact CG2-CD2 3.54Å; V370-L394 HydrophobicContact CG2-CG 3.92Å
371	F	91.5	Very high	88.3	Confident	10 Å²	10	89.8 Å²	89.8	4%	0.044	43%	0.425	C	S	.	.	H	α-helix	trans	-52.7	-47.1	177.8	-174.6	-91.5	0	0	0	112	A367 R373 F374 D375 E380 I382 F420 F423	A367-F371 VanDerWaalsContact O-CB 3.31Å; A367-F371 WeakPolarHBondContact O-CB 3.35Å; A367-F371 PolarHBondContact O-N 3.16Å; F371-R373 VanDerWaalsContact C-N 3.27Å; F371-R373 PolarHBondContact O-N 2.88Å; F371-F374 PolarHBondContact O-N 3.02Å; F371-F374 VanDerWaalsContact O-N 3.1Å; F371-D375 PolarHBondContact O-N 2.86Å; F371-E380 WeakPolarHBondContact CZ-O 3.25Å; F371-I382 HydrophobicContact CD2-CB 4.37Å; F371-I382 HydrophobicContact CD2-CG2 4.24Å; F371-I382 HydrophobicContact CE2-CB 3.95Å; F371-I382 HydrophobicContact CE2-CG2 3.73Å; F371-F420 HydrophobicContact CB-CD2 3.99Å; F371-F420 HydrophobicContact CB-CE2 4.26Å; F371-F420 HydrophobicContact CD1-CB 4.37Å; F371-F420 HydrophobicContact CD1-CD2 4.01Å; F371-F420 AromaticContact CD2-CD2 3.99Å; F371-F420 HydrophobicContact CD2-CD2 3.99Å; F371-F420 HydrophobicContact CE1-CB 4.03Å; F371-F420 HydrophobicContact CE1-CD2 4.49Å; F371-F420 HydrophobicContact CE2-CB 4.29Å; F371-F420 HydrophobicContact CE2-CD2 4.47Å; F371-F420 AromaticContact CG-CD2 3.74Å; F371-F420 HydrophobicContact CG-CD2 3.74Å; F371-F420 HydrophobicContact CG-CE2 4.49Å; F371-F420 HydrophobicContact CZ-CB 3.98Å; F371-F423 HydrophobicContact CB-CD1 4.34Å; F371-F423 HydrophobicContact CB-CE1 4.44Å; F371-F423 HydrophobicContact CD2-CB 3.78Å; F371-F423 AromaticContact CD2-CD1 3.96Å; F371-F423 HydrophobicContact CD2-CD1 3.96Å; F371-F423 HydrophobicContact CD2-CD2 4.27Å; F371-F423 AromaticContact CD2-CG 3.74Å; F371-F423 HydrophobicContact CD2-CG 3.74Å; F371-F423 HydrophobicContact CE2-CB 3.91Å; F371-F423 HydrophobicContact CE2-CG 4.33Å
372	K	90.8	Very high	88.5	Confident	123 Å²	123	83.3 Å²	83.3	54%	0.535	40%	0.395	S	S	.	.	H	α-helix	trans	-60.5	-27.3	174.7	-72.3	168.8	-174.4	164.8	0	114.8	K368 D369 V370 F374	K368-K372 VanDerWaalsContact O-CG 3.29Å; K368-K372 WeakPolarHBondContact O-CG 3.34Å; K368-K372 PolarHBondContact O-N 2.89Å; K368-K372 VanDerWaalsContact O-N 3.12Å; D369-K372 IonicContact OD1-NZ 3.64Å; D369-K372 PolarHBondContact OD1-NZ 3.07Å; D369-K372 VanDerWaalsContact OD1-NZ 3.17Å; V370-K372 VanDerWaalsContact C-N 3.3Å; V370-K372 PolarHBondContact O-N 3.38Å; K372-F374 VanDerWaalsContact C-N 3.32Å
373	R	90.7	Very high	88.6	Confident	180 Å²	180	79.4 Å²	79.4	68%	0.679	38%	0.376	S	S	*	.	H	α-helix	trans	-73.5	-27.1	176.6	-69.5	169.6	-173.7	-172.6	2.5	112.1	D369 V370 F371	D369-R373 WeakPolarHBondContact O-CG 3.49Å; D369-R373 PolarHBondContact O-N 2.86Å; V370-R373 WeakPolarHBondContact O-CB 3.36Å; V370-R373 PolarHBondContact O-N 3.11Å; F371-R373 VanDerWaalsContact C-N 3.27Å; F371-R373 PolarHBondContact O-N 2.88Å
374	F	90.3	Very high	88.6	Confident	39 Å²	39	77.7 Å²	77.7	17%	0.171	37%	0.371	C	S	.	.	H	α-helix	trans	-94.5	-27.2	179	-72.8	-83	0	0	0	113	V370 F371 K372 K376 I382 D386 P389 A390 A393	V370-F374 HydrophobicContact CG1-CD2 3.94Å; V370-F374 HydrophobicContact CG1-CE2 3.87Å; V370-F374 WeakPolarHBondContact O-CD2 3.43Å; V370-F374 PolarHBondContact O-N 2.82Å; F371-F374 PolarHBondContact O-N 3.02Å; F371-F374 VanDerWaalsContact O-N 3.1Å; K372-F374 VanDerWaalsContact C-N 3.32Å; F374-K376 PolarHBondContact O-N 3.36Å; F374-I382 HydrophobicContact CB-CD1 3.46Å; F374-I382 VanDerWaalsContact CB-CD1 3.46Å; F374-I382 HydrophobicContact CB-CG1 3.91Å; F374-I382 HydrophobicContact CG-CD1 4.01Å; F374-D386 HydrophobicContact CD1-CB 4.17Å; F374-P389 HydrophobicContact CD1-CB 4.47Å; F374-P389 HydrophobicContact CE1-CB 3.51Å; F374-P389 HydrophobicContact CZ-CB 3.85Å; F374-A390 HydrophobicContact CD2-CB 3.73Å; F374-A390 VanDerWaalsContact CE2-CA 3.47Å; F374-A390 HydrophobicContact CE2-CB 3.83Å; F374-A390 HydrophobicContact CG-CB 4.2Å; F374-A390 HydrophobicContact CZ-CB 4.36Å; F374-A393 HydrophobicContact CE2-CB 3.9Å; F374-A393 HydrophobicContact CZ-CB 4.24Å
375	D	89.1	Confident	88.5	Confident	26 Å²	26	80.6 Å²	80.6	14%	0.139	39%	0.389	C	S	.	.			trans	-71.3	71	168.1	-175.7	10.5	0	0	0	112.1	F371 R377 G378 Q379 E380	F371-D375 PolarHBondContact O-N 2.86Å; D375-R377 PolarHBondContact O-N 3.5Å; D375-R377 VanDerWaalsContact O-N 3.07Å; D375-R377 PolarHBondContact OD1-N 2.87Å; D375-G378 PolarHBondContact O-N 3.36Å; D375-G378 WeakPolarHBondContact OD1-CA 3.48Å; D375-G378 PolarHBondContact OD1-N 3.43Å; D375-G378 VanDerWaalsContact OD2-CA 3.32Å; D375-G378 WeakPolarHBondContact OD2-CA 3.37Å; D375-Q379 VanDerWaalsContact CG-N 3.34Å; D375-Q379 PolarHBondContact OD1-N 2.81Å; D375-Q379 PolarHBondContact OD2-N 2.78Å; D375-E380 WeakPolarHBondContact OD2-CA 3.31Å; D375-E380 PolarHBondContact OD2-N 2.93Å
376	K	78.8	Confident	88.5	Confident	170 Å²	170	78.3 Å²	78.3	74%	0.739	38%	0.382	S	S	*	.	T	Hydrogen-bonded Turn	trans	-61.7	-13	177.5	-66.5	167	-174.7	157.7	0	113.6	F374	F374-K376 PolarHBondContact O-N 3.36Å
377	R	78.4	Confident	88.4	Confident	195 Å²	195	74.9 Å²	74.9	74%	0.736	36%	0.361	S	S	*	.	T	Hydrogen-bonded Turn	trans	-111.4	-7.1	-173	-63.8	-174	176.2	-163.3	-0.2	113.3	D375 Q379	D375-R377 PolarHBondContact O-N 3.5Å; D375-R377 VanDerWaalsContact O-N 3.07Å; D375-R377 PolarHBondContact OD1-N 2.87Å; R377-Q379 HydrophobicContact CB-CB 4.38Å; R377-Q379 HydrophobicContact CB-CG 3.67Å; R377-Q379 PolarHBondContact O-N 3.09Å
378	G	82	Confident	88.4	Confident	62 Å²	62	75.8 Å²	75.8	64%	0.639	37%	0.37	S	S	*	.	S	Bend	trans	62.1	34.2	-173	0	0	0	0	0	112.3	D375	D375-G378 PolarHBondContact O-N 3.36Å; D375-G378 WeakPolarHBondContact OD1-CA 3.48Å; D375-G378 PolarHBondContact OD1-N 3.43Å; D375-G378 VanDerWaalsContact OD2-CA 3.32Å; D375-G378 WeakPolarHBondContact OD2-CA 3.37Å
379	Q	83.4	Confident	88.4	Confident	106 Å²	106	73 Å²	73	50%	0.495	36%	0.362	S	S	.	.	S	Bend	trans	-92.6	1.4	-176.8	-73	-177.8	-28.6	0	0	113.2	D375 R377 K381	D375-Q379 VanDerWaalsContact CG-N 3.34Å; D375-Q379 PolarHBondContact OD1-N 2.81Å; D375-Q379 PolarHBondContact OD2-N 2.78Å; R377-Q379 HydrophobicContact CB-CB 4.38Å; R377-Q379 HydrophobicContact CB-CG 3.67Å; R377-Q379 PolarHBondContact O-N 3.09Å; Q379-K381 PolarHBondContact O-N 3.2Å
380	E	86.2	Confident	88.4	Confident	155 Å²	155	69 Å²	69	72%	0.724	34%	0.341	S	S	*	.	S	Bend	trans	56.5	26.8	-173.7	-56.3	-168.8	144.8	0	0	113	F371 D375	F371-E380 WeakPolarHBondContact CZ-O 3.25Å; D375-E380 WeakPolarHBondContact OD2-CA 3.31Å; D375-E380 PolarHBondContact OD2-N 2.93Å
381	K	90.6	Very high	88.4	Confident	95 Å²	95	68.9 Å²	68.9	41%	0.413	34%	0.34	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-140.8	146.7	-178.1	-66.9	-168.5	175.4	-154.2	0	111.8	Q379 F417 I418	Q379-K381 PolarHBondContact O-N 3.2Å; K381-F417 HydrophobicContact CB-CB 4.29Å; K381-F417 HydrophobicContact CD-CB 4.02Å; K381-I418 CarbonylContact C-O 3.55Å; K381-I418 VanDerWaalsContact CA-O 3.29Å; K381-I418 WeakPolarHBondContact CA-O 3.3Å
382	I	90.8	Very high	88.4	Confident	1 Å²	1	76.5 Å²	76.5	1%	0.005	37%	0.369	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-115.2	144.2	173.9	-167.9	172.8	0	0	0	110.2	F371 F374 D386 L387 A390 F417 I418 F423	F371-I382 HydrophobicContact CD2-CB 4.37Å; F371-I382 HydrophobicContact CD2-CG2 4.24Å; F371-I382 HydrophobicContact CE2-CB 3.95Å; F371-I382 HydrophobicContact CE2-CG2 3.73Å; F374-I382 HydrophobicContact CB-CD1 3.46Å; F374-I382 VanDerWaalsContact CB-CD1 3.46Å; F374-I382 HydrophobicContact CB-CG1 3.91Å; F374-I382 HydrophobicContact CG-CD1 4.01Å; I382-D386 HydrophobicContact CD1-CB 4.11Å; I382-D386 HydrophobicContact CG1-CB 3.79Å; I382-L387 HydrophobicContact CG2-CD2 3.95Å; I382-A390 HydrophobicContact CD1-CB 3.82Å; I382-F417 CarbonylContact O-C 3.59Å; I382-F417 WeakPolarHBondContact O-CA 3.32Å; I382-I418 HydrophobicContact CG2-CB 4.38Å; I382-I418 PolarHBondContact N-O 3.2Å; I382-I418 PolarHBondContact O-N 3.35Å; I382-F423 HydrophobicContact CG2-CD2 4.44Å
383	S	90.5	Very high	88.4	Confident	25 Å²	25	72.8 Å²	72.8	18%	0.175	36%	0.361	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-66.7	142.2	172	-178.7	0	0	0	0	110.6	T385 D386 L387 G416	S383-T385 PolarHBondContact O-N 3.34Å; S383-T385 PolarHBondContact OG-N 2.86Å; S383-T385 PolarHBondContact OG-OG1 3.13Å; S383-D386 PolarHBondContact O-N 3.32Å; S383-L387 PolarHBondContact O-N 3.25Å; S383-G416 WeakPolarHBondContact CA-O 3.4Å
384	T	88.6	Confident	88.4	Confident	45 Å²	45	65.3 Å²	65.3	28%	0.276	33%	0.334	S	S	.	.	H	α-helix	trans	-55.8	-32.3	171.8	54	0	0	0	0	111.9	D386 L387 A407 G416 I418	T384-D386 VanDerWaalsContact C-N 3.32Å; T384-D386 PolarHBondContact O-N 3.13Å; T384-L387 WeakPolarHBondContact O-CB 3.46Å; T384-L387 PolarHBondContact O-N 3Å; T384-A407 HydrophobicContact CG2-CB 4.11Å; T384-G416 PolarHBondContact N-O 3.42Å; T384-I418 HydrophobicContact CG2-CD1 3.82Å; T384-I418 HydrophobicContact CG2-CG1 4.23Å
385	T	88.6	Confident	88.3	Confident	104 Å²	104	70.7 Å²	70.7	64%	0.638	37%	0.365	S	S	*	.	H	α-helix	trans	-67	-28.9	174.3	63.6	0	0	0	0	113.8	S383 P389	S383-T385 PolarHBondContact O-N 3.34Å; S383-T385 PolarHBondContact OG-N 2.86Å; S383-T385 PolarHBondContact OG-OG1 3.13Å; T385-P389 WeakPolarHBondContact O-CD 3.36Å
386	D	90.2	Very high	88.3	Confident	45 Å²	45	70.6 Å²	70.6	24%	0.241	36%	0.364	C	S	.	.	H	α-helix	trans	-87.2	-8.5	-177.8	-74.1	-31	0	0	0	112.4	F374 I382 S383 T384 G388 P389 A390	F374-D386 HydrophobicContact CD1-CB 4.17Å; I382-D386 HydrophobicContact CD1-CB 4.11Å; I382-D386 HydrophobicContact CG1-CB 3.79Å; S383-D386 PolarHBondContact O-N 3.32Å; T384-D386 VanDerWaalsContact C-N 3.32Å; T384-D386 PolarHBondContact O-N 3.13Å; D386-G388 PolarHBondContact O-N 2.26Å; D386-P389 WeakPolarHBondContact O-CD 3.15Å; D386-A390 WeakPolarHBondContact O-CB 3.35Å; D386-A390 PolarHBondContact O-N 3.3Å
387	L	89.8	Confident	88.7	Confident	0 Å²	0	68.3 Å²	68.3	0%	0	36%	0.364	C	S	.	.	H	α-helix	trans	-57.9	-47.4	172.1	-68.1	179.1	0	0	0	112.2	I382 S383 T384 A390 F391 L403 A407 I418 F423	I382-L387 HydrophobicContact CG2-CD2 3.95Å; S383-L387 PolarHBondContact O-N 3.25Å; T384-L387 WeakPolarHBondContact O-CB 3.46Å; T384-L387 PolarHBondContact O-N 3Å; L387-A390 CarbonylContact O-C 3.51Å; L387-A390 WeakPolarHBondContact O-CA 3.26Å; L387-A390 WeakPolarHBondContact O-CB 3.48Å; L387-A390 PolarHBondContact O-N 3.13Å; L387-F391 HydrophobicContact CD2-CE2 4.47Å; L387-F391 WeakPolarHBondContact O-CD2 3.39Å; L387-F391 PolarHBondContact O-N 3.02Å; L387-L403 HydrophobicContact CB-CD1 4.3Å; L387-L403 HydrophobicContact CB-CD2 4.03Å; L387-L403 HydrophobicContact CB-CG 4.3Å; L387-L403 HydrophobicContact CD1-CD1 4.42Å; L387-A407 HydrophobicContact CD1-CB 3.72Å; L387-I418 HydrophobicContact CD1-CD1 3.88Å; L387-F423 HydrophobicContact CD2-CD2 3.69Å; L387-F423 HydrophobicContact CD2-CE2 4.07Å
388	G	90.9	Very high	89.1	Confident	19 Å²	19	60.6 Å²	60.6	20%	0.196	34%	0.339	C	S	.	.	H	α-helix	trans	-59.5	-44.1	-178.4	0	0	0	0	0	113.3	D386 R392	D386-G388 PolarHBondContact O-N 2.26Å; G388-R392 WeakPolarHBondContact O-CG 3.44Å; G388-R392 PolarHBondContact O-N 3.31Å; G388-R392 PolarHBondContact O-NE 2.81Å
389	P	91.6	Very high	89.5	Confident	44 Å²	44	64.9 Å²	64.9	29%	0.286	34%	0.34	S	S	.	.	H	α-helix	trans	-60.4	-40.2	165	-29.4	37.4	0	0	0	114.9	F374 T385 D386 R392 A393	F374-P389 HydrophobicContact CD1-CB 4.47Å; F374-P389 HydrophobicContact CE1-CB 3.51Å; F374-P389 HydrophobicContact CZ-CB 3.85Å; T385-P389 WeakPolarHBondContact O-CD 3.36Å; D386-P389 WeakPolarHBondContact O-CD 3.15Å; P389-R392 PolarHBondContact O-N 3.12Å; P389-A393 PolarHBondContact O-N 3.07Å
390	A	91.8	Very high	89.7	Confident	0 Å²	0	64.5 Å²	64.5	0%	0	35%	0.347	C	S	.	.	H	α-helix	trans	-67.1	-43.7	-179.2	0	0	0	0	0	113.5	V370 F374 I382 D386 L387 R392 A393 L394 F423	V370-A390 HydrophobicContact CG1-CB 4.17Å; F374-A390 HydrophobicContact CD2-CB 3.73Å; F374-A390 VanDerWaalsContact CE2-CA 3.47Å; F374-A390 HydrophobicContact CE2-CB 3.83Å; F374-A390 HydrophobicContact CG-CB 4.2Å; F374-A390 HydrophobicContact CZ-CB 4.36Å; I382-A390 HydrophobicContact CD1-CB 3.82Å; D386-A390 WeakPolarHBondContact O-CB 3.35Å; D386-A390 PolarHBondContact O-N 3.3Å; L387-A390 CarbonylContact O-C 3.51Å; L387-A390 WeakPolarHBondContact O-CA 3.26Å; L387-A390 WeakPolarHBondContact O-CB 3.48Å; L387-A390 PolarHBondContact O-N 3.13Å; A390-R392 VanDerWaalsContact C-N 3.32Å; A390-R392 PolarHBondContact O-N 3.47Å; A390-A393 WeakPolarHBondContact O-CB 3.27Å; A390-A393 PolarHBondContact O-N 3.47Å; A390-A393 VanDerWaalsContact O-N 3.11Å; A390-L394 PolarHBondContact O-N 2.85Å; A390-L394 VanDerWaalsContact O-N 3.13Å; A390-F423 HydrophobicContact CB-CE2 3.91Å; A390-F423 HydrophobicContact CB-CZ 4.23Å
391	F	91.6	Very high	89.9	Confident	2 Å²	2	62.4 Å²	62.4	1%	0.009	34%	0.34	C	S	.	.	H	α-helix	trans	-62.7	-40.2	173.7	-83.9	-107	0	0	0	111.3	L387 A393 L394 N395 L396 V398 L403 F423 C426 K430	L387-F391 HydrophobicContact CD2-CE2 4.47Å; L387-F391 WeakPolarHBondContact O-CD2 3.39Å; L387-F391 PolarHBondContact O-N 3.02Å; F391-A393 VanDerWaalsContact C-N 3.29Å; F391-A393 PolarHBondContact O-N 2.63Å; F391-L394 CarbonylContact O-C 3.58Å; F391-L394 WeakPolarHBondContact O-CA 3.42Å; F391-L394 WeakPolarHBondContact O-CB 3.27Å; F391-L394 PolarHBondContact O-N 2.77Å; F391-N395 PolarHBondContact O-N 3.03Å; F391-L396 CarbonylContact C-O 3.34Å; F391-L396 VanDerWaalsContact C-O 3.3Å; F391-L396 HydrophobicContact CB-CB 4.39Å; F391-L396 HydrophobicContact CD1-CB 4.09Å; F391-L396 HydrophobicContact CD1-CD1 4.04Å; F391-L396 HydrophobicContact CE1-CD1 4.37Å; F391-L396 PolarHBondContact O-N 2.91Å; F391-V398 HydrophobicContact CD1-CG2 3.63Å; F391-V398 HydrophobicContact CE1-CG2 4.16Å; F391-V398 HydrophobicContact CG-CG2 4.35Å; F391-L403 HydrophobicContact CD2-CD1 4.08Å; F391-L403 HydrophobicContact CE2-CD1 3.92Å; F391-L403 HydrophobicContact CZ-CD1 4.21Å; F391-F423 HydrophobicContact CD2-CE2 4.31Å; F391-F423 AromaticContact CE2-CE2 3.98Å; F391-F423 HydrophobicContact CE2-CE2 3.98Å; F391-C426 HydrophobicContact CE2-CB 4.31Å; F391-C426 HydrophobicContact CZ-CB 3.81Å; F391-K430 HydrophobicContact CE1-CB 3.96Å; F391-K430 HydrophobicContact CE1-CG 4.45Å
392	R	91.9	Very high	89.8	Confident	171 Å²	171	59.8 Å²	59.8	65%	0.645	33%	0.332	S	S	*	.	H	α-helix	trans	-62.3	-33.7	172.3	-77.5	-178.9	-78.9	-163.1	-2.2	113.2	G388 P389 A390 L394 N395	G388-R392 WeakPolarHBondContact O-CG 3.44Å; G388-R392 PolarHBondContact O-N 3.31Å; G388-R392 PolarHBondContact O-NE 2.81Å; P389-R392 PolarHBondContact O-N 3.12Å; A390-R392 VanDerWaalsContact C-N 3.32Å; A390-R392 PolarHBondContact O-N 3.47Å; R392-L394 VanDerWaalsContact C-N 3.26Å; R392-L394 PolarHBondContact O-N 2.79Å; R392-N395 PolarHBondContact O-N 3.26Å; R392-N395 VanDerWaalsContact O-N 3.14Å
393	A	91.1	Very high	89.8	Confident	45 Å²	45	60.4 Å²	60.4	37%	0.372	34%	0.336	S	S	.	.	H	α-helix	trans	-72	-17.7	173.1	0	0	0	0	0	113.8	V370 F374 P389 A390 F391 N395	V370-A393 HydrophobicContact CG1-CB 4.02Å; F374-A393 HydrophobicContact CE2-CB 3.9Å; F374-A393 HydrophobicContact CZ-CB 4.24Å; P389-A393 PolarHBondContact O-N 3.07Å; A390-A393 WeakPolarHBondContact O-CB 3.27Å; A390-A393 PolarHBondContact O-N 3.47Å; A390-A393 VanDerWaalsContact O-N 3.11Å; F391-A393 VanDerWaalsContact C-N 3.29Å; F391-A393 PolarHBondContact O-N 2.63Å; A393-N395 VanDerWaalsContact C-N 3.32Å
394	L	90.2	Very high	89.7	Confident	23 Å²	23	65.5 Å²	65.5	12%	0.12	36%	0.355	C	S	.	.	T	Hydrogen-bonded Turn	trans	-88.9	5.3	169.6	-68.6	164.7	0	0	0	112.9	V366 V370 A390 F391 R392 L396 F423 Y427	V366-L394 HydrophobicContact CG1-CD2 3.69Å; V370-L394 HydrophobicContact CB-CD2 3.97Å; V370-L394 HydrophobicContact CB-CG 4.14Å; V370-L394 HydrophobicContact CG1-CD1 4.49Å; V370-L394 HydrophobicContact CG1-CD2 4.49Å; V370-L394 HydrophobicContact CG1-CG 4.1Å; V370-L394 HydrophobicContact CG2-CD2 3.54Å; V370-L394 HydrophobicContact CG2-CG 3.92Å; A390-L394 PolarHBondContact O-N 2.85Å; A390-L394 VanDerWaalsContact O-N 3.13Å; F391-L394 CarbonylContact O-C 3.58Å; F391-L394 WeakPolarHBondContact O-CA 3.42Å; F391-L394 WeakPolarHBondContact O-CB 3.27Å; F391-L394 PolarHBondContact O-N 2.77Å; R392-L394 VanDerWaalsContact C-N 3.26Å; R392-L394 PolarHBondContact O-N 2.79Å; L394-L396 HydrophobicContact CB-CD1 4.41Å; L394-L396 HydrophobicContact CB-CG 4.24Å; L394-L396 PolarHBondContact O-N 2.83Å; L394-F423 HydrophobicContact CD1-CE1 4.21Å; L394-F423 HydrophobicContact CD1-CZ 3.77Å; L394-Y427 HydrophobicContact CD1-CD2 3.77Å; L394-Y427 HydrophobicContact CD1-CE2 3.75Å; L394-Y427 HydrophobicContact CD2-CE2 4.41Å; L394-Y427 HydrophobicContact CG-CE2 4.47Å
395	N	89.1	Confident	89.8	Confident	152 Å²	152	68.4 Å²	68.4	81%	0.813	37%	0.365	S	S	*	.	T	Hydrogen-bonded Turn	trans	58.9	23.8	-169.5	-57	-39.7	0	0	0	114.5	F391 R392 A393	F391-N395 PolarHBondContact O-N 3.03Å; R392-N395 PolarHBondContact O-N 3.26Å; R392-N395 VanDerWaalsContact O-N 3.14Å; A393-N395 VanDerWaalsContact C-N 3.32Å
396	L	88.7	Confident	89.8	Confident	24 Å²	24	64.9 Å²	64.9	13%	0.126	34%	0.34	C	S	.	.			trans	-98.5	135.2	175	-63.5	-179.4	0	0	0	111.2	F391 L394 Y427 K430	F391-L396 CarbonylContact C-O 3.34Å; F391-L396 VanDerWaalsContact C-O 3.3Å; F391-L396 HydrophobicContact CB-CB 4.39Å; F391-L396 HydrophobicContact CD1-CB 4.09Å; F391-L396 HydrophobicContact CD1-CD1 4.04Å; F391-L396 HydrophobicContact CE1-CD1 4.37Å; F391-L396 PolarHBondContact O-N 2.91Å; L394-L396 HydrophobicContact CB-CD1 4.41Å; L394-L396 HydrophobicContact CB-CG 4.24Å; L394-L396 PolarHBondContact O-N 2.83Å; L396-Y427 HydrophobicContact CD1-CD2 3.7Å; L396-Y427 HydrophobicContact CD1-CE2 3.56Å; L396-K430 HydrophobicContact CB-CG 4.49Å; L396-K430 HydrophobicContact CD1-CB 4.38Å; L396-K430 HydrophobicContact CD1-CG 3.92Å; L396-K430 HydrophobicContact CD2-CG 4.48Å
397	T	85.9	Confident	89.8	Confident	121 Å²	121	62.9 Å²	62.9	74%	0.742	33%	0.33	S	S	*	.			trans	-107.9	116.6	173.6	52	0	0	0	0	110.2
398	V	87.5	Confident	89.7	Confident	33 Å²	33	67.4 Å²	67.4	20%	0.2	35%	0.354	C	S	.	.			trans	-123.8	142.5	177	-170.6	0	0	0	0	107.9	F391 T402 L403 W406 K430	F391-V398 HydrophobicContact CD1-CG2 3.63Å; F391-V398 HydrophobicContact CE1-CG2 4.16Å; F391-V398 HydrophobicContact CG-CG2 4.35Å; V398-T402 WeakPolarHBondContact CG1-OG1 3.21Å; V398-L403 HydrophobicContact CB-CB 4.41Å; V398-L403 HydrophobicContact CG1-CB 3.89Å; V398-L403 HydrophobicContact CG1-CD1 4.49Å; V398-W406 HydrophobicContact CG1-CE3 4.22Å; V398-W406 HydrophobicContact CG1-CH2 4Å; V398-W406 HydrophobicContact CG1-CZ3 3.62Å; V398-W406 HydrophobicContact CG2-CZ3 4.11Å; V398-K430 HydrophobicContact CG2-CD 3.92Å; V398-K430 HydrophobicContact CG2-CG 3.92Å
399	K	90.1	Very high	89.5	Confident	153 Å²	153	70.9 Å²	70.9	67%	0.665	37%	0.365	S	S	*	.			trans	-63.5	143.5	174.2	-70.6	174.8	-178.7	170	0	109.2	D401 T402 L403	K399-D401 PolarHBondContact O-N 3.38Å; K399-T402 HydrophobicContact CB-CG2 4.44Å; K399-T402 PolarHBondContact O-N 3.2Å; K399-T402 PolarHBondContact O-OG1 3.47Å; K399-L403 VanDerWaalsContact O-CB 3.32Å; K399-L403 WeakPolarHBondContact O-CB 3.3Å; K399-L403 PolarHBondContact O-N 2.81Å
400	P	88.5	Confident	89.4	Confident	98 Å²	98	70 Å²	70	64%	0.636	36%	0.359	S	S	*	.	H	α-helix	trans	-61.9	-33.1	-178.5	26.1	-34.2	0	0	0	112	K404	P400-K404 WeakPolarHBondContact O-CB 3.4Å; P400-K404 PolarHBondContact O-N 3.25Å
401	D	90.4	Very high	89.3	Confident	110 Å²	110	70.9 Å²	70.9	59%	0.588	36%	0.364	S	S	*	.	H	α-helix	trans	-70.9	-49.5	-179	-48	-58.2	0	0	0	111.6	K399 L403 K404 E405	K399-D401 PolarHBondContact O-N 3.38Å; D401-L403 VanDerWaalsContact C-N 3.34Å; D401-L403 PolarHBondContact O-N 3.33Å; D401-K404 WeakPolarHBondContact O-CB 3.4Å; D401-K404 PolarHBondContact O-N 2.83Å; D401-K404 VanDerWaalsContact O-N 3.12Å; D401-E405 WeakPolarHBondContact O-CG 3.49Å; D401-E405 PolarHBondContact O-N 3.46Å
402	T	88.7	Confident	88.8	Confident	40 Å²	40	73.3 Å²	73.3	25%	0.245	38%	0.377	C	S	.	.	H	α-helix	trans	-66.8	-34.8	177	61.2	0	0	0	0	112.2	V398 K399 K404 E405 W406	V398-T402 WeakPolarHBondContact CG1-OG1 3.21Å; K399-T402 HydrophobicContact CB-CG2 4.44Å; K399-T402 PolarHBondContact O-N 3.2Å; K399-T402 PolarHBondContact O-OG1 3.47Å; T402-K404 VanDerWaalsContact C-N 3.3Å; T402-K404 PolarHBondContact O-N 2.93Å; T402-E405 PolarHBondContact O-N 2.65Å; T402-W406 VanDerWaalsContact O-CG 3.27Å; T402-W406 PolarHBondContact O-N 3.36Å
403	L	90	Very high	88.4	Confident	14 Å²	14	71.2 Å²	71.2	7%	0.073	38%	0.379	C	S	.	.	H	α-helix	trans	-65.7	-34.6	173.4	-174.3	61.5	0	0	0	112	L387 F391 V398 K399 D401 W406 A407	L387-L403 HydrophobicContact CB-CD1 4.3Å; L387-L403 HydrophobicContact CB-CD2 4.03Å; L387-L403 HydrophobicContact CB-CG 4.3Å; L387-L403 HydrophobicContact CD1-CD1 4.42Å; F391-L403 HydrophobicContact CD2-CD1 4.08Å; F391-L403 HydrophobicContact CE2-CD1 3.92Å; F391-L403 HydrophobicContact CZ-CD1 4.21Å; V398-L403 HydrophobicContact CB-CB 4.41Å; V398-L403 HydrophobicContact CG1-CB 3.89Å; V398-L403 HydrophobicContact CG1-CD1 4.49Å; K399-L403 VanDerWaalsContact O-CB 3.32Å; K399-L403 WeakPolarHBondContact O-CB 3.3Å; K399-L403 PolarHBondContact O-N 2.81Å; D401-L403 VanDerWaalsContact C-N 3.34Å; D401-L403 PolarHBondContact O-N 3.33Å; L403-W406 HydrophobicContact CD1-CE3 4.32Å; L403-A407 WeakPolarHBondContact O-CB 3.43Å; L403-A407 PolarHBondContact O-N 2.93Å
404	K	89.4	Confident	88.1	Confident	132 Å²	132	73.3 Å²	73.3	57%	0.574	40%	0.396	S	S	*	.	H	α-helix	trans	-67.6	-45.9	173.2	-173.7	-167.4	168.8	-161.2	0	110.8	P400 D401 T402 W406 A407 D408	P400-K404 WeakPolarHBondContact O-CB 3.4Å; P400-K404 PolarHBondContact O-N 3.25Å; D401-K404 WeakPolarHBondContact O-CB 3.4Å; D401-K404 PolarHBondContact O-N 2.83Å; D401-K404 VanDerWaalsContact O-N 3.12Å; T402-K404 VanDerWaalsContact C-N 3.3Å; T402-K404 PolarHBondContact O-N 2.93Å; K404-W406 VanDerWaalsContact C-N 3.29Å; K404-W406 PolarHBondContact O-N 2.86Å; K404-A407 CarbonylContact O-C 3.51Å; K404-A407 WeakPolarHBondContact O-CA 3.26Å; K404-A407 WeakPolarHBondContact O-CB 3.43Å; K404-A407 PolarHBondContact O-N 2.74Å; K404-D408 WeakPolarHBondContact CE-OD2 2.94Å; K404-D408 WeakPolarHBondContact O-CB 2.97Å; K404-D408 VanDerWaalsContact O-CG 3.25Å; K404-D408 PolarHBondContact O-N 3.5Å
405	E	89.3	Confident	87.9	Confident	106 Å²	106	75.2 Å²	75.2	50%	0.495	41%	0.408	S	S	.	.	H	α-helix	trans	-57.3	-41.7	175	-69.9	167.7	-173.2	0	0	112.1	D401 T402 D408 Q409	D401-E405 WeakPolarHBondContact O-CG 3.49Å; D401-E405 PolarHBondContact O-N 3.46Å; T402-E405 PolarHBondContact O-N 2.65Å; E405-D408 PolarHBondContact O-N 3.18Å; E405-Q409 WeakPolarHBondContact O-CB 2.76Å; E405-Q409 WeakPolarHBondContact O-CG 3.17Å; E405-Q409 PolarHBondContact O-N 2.87Å
406	W	89.6	Confident	87.8	Confident	30 Å²	30	69.1 Å²	69.1	11%	0.114	38%	0.381	C	S	.	.	H	α-helix	trans	-68.2	-34.5	175.1	-63.5	-10	0	0	0	113	V398 T402 L403 K404 V410 K429 K430	V398-W406 HydrophobicContact CG1-CE3 4.22Å; V398-W406 HydrophobicContact CG1-CH2 4Å; V398-W406 HydrophobicContact CG1-CZ3 3.62Å; V398-W406 HydrophobicContact CG2-CZ3 4.11Å; T402-W406 VanDerWaalsContact O-CG 3.27Å; T402-W406 PolarHBondContact O-N 3.36Å; L403-W406 HydrophobicContact CD1-CE3 4.32Å; K404-W406 VanDerWaalsContact C-N 3.29Å; K404-W406 PolarHBondContact O-N 2.86Å; W406-V410 WeakPolarHBondContact O-CB 3.37Å; W406-V410 VanDerWaalsContact O-CG2 3.3Å; W406-V410 WeakPolarHBondContact O-CG2 3.37Å; W406-V410 PolarHBondContact O-N 3.46Å; W406-K429 HydrophobicContact CD2-CB 4.43Å; W406-K429 HydrophobicContact CD2-CD 4.42Å; W406-K429 HydrophobicContact CG-CD 4.18Å; W406-K429 HydrophobicContact CZ2-CB 4.41Å; W406-K430 HydrophobicContact CH2-CB 4.03Å; W406-K430 HydrophobicContact CH2-CD 4.07Å; W406-K430 HydrophobicContact CZ3-CB 3.84Å; W406-K430 HydrophobicContact CZ3-CD 4.43Å
407	A	89.4	Confident	87.8	Confident	4 Å²	4	72.5 Å²	72.5	3%	0.033	40%	0.395	C	S	.	.	H	α-helix	trans	-66.7	-46.7	173.7	0	0	0	0	0	111.4	T384 L387 L403 K404 Q409 V410 D411 I418	T384-A407 HydrophobicContact CG2-CB 4.11Å; L387-A407 HydrophobicContact CD1-CB 3.72Å; L403-A407 WeakPolarHBondContact O-CB 3.43Å; L403-A407 PolarHBondContact O-N 2.93Å; K404-A407 CarbonylContact O-C 3.51Å; K404-A407 WeakPolarHBondContact O-CA 3.26Å; K404-A407 WeakPolarHBondContact O-CB 3.43Å; K404-A407 PolarHBondContact O-N 2.74Å; A407-Q409 VanDerWaalsContact C-N 3.26Å; A407-Q409 PolarHBondContact O-N 2.8Å; A407-V410 PolarHBondContact O-N 3.47Å; A407-D411 WeakPolarHBondContact O-CB 3.43Å; A407-D411 PolarHBondContact O-N 2.9Å; A407-I418 HydrophobicContact CB-CD1 3.96Å
408	D	88.8	Confident	88	Confident	94 Å²	94	66.9 Å²	66.9	50%	0.503	36%	0.361	S	S	.	.	H	α-helix	trans	-64.3	-29.6	178.5	-65.9	-12.1	0	0	0	111.6	K404 E405 V410	K404-D408 WeakPolarHBondContact CE-OD2 2.94Å; K404-D408 WeakPolarHBondContact O-CB 2.97Å; K404-D408 VanDerWaalsContact O-CG 3.25Å; K404-D408 PolarHBondContact O-N 3.5Å; E405-D408 PolarHBondContact O-N 3.18Å; D408-V410 VanDerWaalsContact C-N 3.31Å
409	Q	86.3	Confident	88.2	Confident	93 Å²	93	67.4 Å²	67.4	44%	0.435	36%	0.362	S	S	.	.	T	Hydrogen-bonded Turn	trans	-76.8	-9.1	173	-76	172.1	23.5	0	0	114.9	E405 A407	E405-Q409 WeakPolarHBondContact O-CB 2.76Å; E405-Q409 WeakPolarHBondContact O-CG 3.17Å; E405-Q409 PolarHBondContact O-N 2.87Å; A407-Q409 VanDerWaalsContact C-N 3.26Å; A407-Q409 PolarHBondContact O-N 2.8Å
410	V	88.1	Confident	88.1	Confident	25 Å²	25	62.1 Å²	62.1	15%	0.152	34%	0.34	C	S	.	.	T	Hydrogen-bonded Turn	trans	-119.7	-31.2	-173.6	166.8	0	0	0	0	111.5	W406 A407 D408 D412 I418 I425	W406-V410 WeakPolarHBondContact O-CB 3.37Å; W406-V410 VanDerWaalsContact O-CG2 3.3Å; W406-V410 WeakPolarHBondContact O-CG2 3.37Å; W406-V410 PolarHBondContact O-N 3.46Å; A407-V410 PolarHBondContact O-N 3.47Å; D408-V410 VanDerWaalsContact C-N 3.31Å; V410-D412 VanDerWaalsContact C-N 3.27Å; V410-D412 PolarHBondContact O-N 3.45Å; V410-I418 HydrophobicContact CB-CD1 4.45Å; V410-I418 HydrophobicContact CG1-CD1 4.2Å; V410-I418 HydrophobicContact CG1-CG1 4.11Å; V410-I418 HydrophobicContact CG1-CG2 3.66Å; V410-I425 HydrophobicContact CG2-CB 4.17Å; V410-I425 HydrophobicContact CG2-CG2 3.78Å
411	D	90.2	Very high	88.1	Confident	19 Å²	19	60.2 Å²	60.2	10%	0.102	32%	0.324	C	S	.	.			trans	-89.8	59.5	169.2	-172.8	28.6	0	0	0	110	A407 D413 A414 T415 G416 I418	A407-D411 WeakPolarHBondContact O-CB 3.43Å; A407-D411 PolarHBondContact O-N 2.9Å; D411-D413 PolarHBondContact O-N 2.89Å; D411-D413 VanDerWaalsContact O-N 3.09Å; D411-A414 WeakPolarHBondContact O-CA 3.33Å; D411-A414 PolarHBondContact O-N 3.34Å; D411-T415 VanDerWaalsContact CG-N 3.26Å; D411-T415 PolarHBondContact OD1-N 3.49Å; D411-T415 PolarHBondContact OD1-OG1 2.9Å; D411-T415 PolarHBondContact OD2-N 2.78Å; D411-G416 WeakPolarHBondContact OD2-CA 3.46Å; D411-G416 PolarHBondContact OD2-N 3.07Å; D411-I418 HydrophobicContact CB-CD1 4.42Å; D411-I418 HydrophobicContact CB-CG1 3.99Å
412	D	81.1	Confident	88	Confident	53 Å²	53	55 Å²	55	28%	0.283	30%	0.297	S	S	.	.	T	Hydrogen-bonded Turn	trans	-56.2	-25.5	178.6	-70.5	-57.2	0	0	0	113	I154 Y156 V410 A414	I154-D412 WeakPolarHBondContact CG2-OD2 3.48Å; Y156-D412 HydrophobicContact CD2-CB 4.08Å; Y156-D412 WeakPolarHBondContact CD2-OD1 3.49Å; Y156-D412 WeakPolarHBondContact CD2-OD2 3.04Å; Y156-D412 HydrophobicContact CE2-CB 3.59Å; Y156-D412 WeakPolarHBondContact CE2-OD2 3.42Å; V410-D412 VanDerWaalsContact C-N 3.27Å; V410-D412 PolarHBondContact O-N 3.45Å; D412-A414 VanDerWaalsContact C-N 3.3Å
413	D	84.2	Confident	88.1	Confident	127 Å²	127	53.1 Å²	53.1	68%	0.679	29%	0.285	S	S	*	.	T	Hydrogen-bonded Turn	trans	-83.2	-1.7	176.2	-72.9	-30.4	0	0	0	113.1	D411 T415	D411-D413 PolarHBondContact O-N 2.89Å; D411-D413 VanDerWaalsContact O-N 3.09Å; D413-T415 VanDerWaalsContact C-N 3.25Å; D413-T415 HydrophobicContact CB-CG2 3.65Å; D413-T415 PolarHBondContact O-N 3.14Å
414	A	84.4	Confident	88.1	Confident	89 Å²	89	54 Å²	54	74%	0.736	29%	0.289	S	S	*	.			trans	49.5	39.3	-178	0	0	0	0	0	114.2	D411 D412	D411-A414 WeakPolarHBondContact O-CA 3.33Å; D411-A414 PolarHBondContact O-N 3.34Å; D412-A414 VanDerWaalsContact C-N 3.3Å
415	T	85.8	Confident	88	Confident	62 Å²	62	49.6 Å²	49.6	38%	0.38	27%	0.272	S	S	.	.			trans	-78.6	-18	-175.2	64.7	0	0	0	0	114.1	D411 D413 F417	D411-T415 VanDerWaalsContact CG-N 3.26Å; D411-T415 PolarHBondContact OD1-N 3.49Å; D411-T415 PolarHBondContact OD1-OG1 2.9Å; D411-T415 PolarHBondContact OD2-N 2.78Å; D413-T415 VanDerWaalsContact C-N 3.25Å; D413-T415 HydrophobicContact CB-CG2 3.65Å; D413-T415 PolarHBondContact O-N 3.14Å; T415-F417 VanDerWaalsContact O-CD2 3.26Å; T415-F417 WeakPolarHBondContact O-CD2 3.16Å; T415-F417 PolarHBondContact OG1-N 2.77Å; T415-F417 VanDerWaalsContact OG1-N 3.08Å; T415-F417 PolarHBondContact OG1-O 3.35Å
416	G	88.2	Confident	87.9	Confident	24 Å²	24	44.5 Å²	44.5	25%	0.247	25%	0.248	C	C	.	.	S	Bend	trans	76.5	6.2	-165.3	0	0	0	0	0	113.8	S383 T384 D411	S383-G416 WeakPolarHBondContact CA-O 3.4Å; T384-G416 PolarHBondContact N-O 3.42Å; D411-G416 WeakPolarHBondContact OD2-CA 3.46Å; D411-G416 PolarHBondContact OD2-N 3.07Å
417	F	89	Confident	87.9	Confident	95 Å²	95	43.4 Å²	43.4	42%	0.417	24%	0.244	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-136.7	125.6	-174	-65.2	-80	0	0	0	113.3	K381 I382 T415	K381-F417 HydrophobicContact CB-CB 4.29Å; K381-F417 HydrophobicContact CD-CB 4.02Å; I382-F417 CarbonylContact O-C 3.59Å; I382-F417 WeakPolarHBondContact O-CA 3.32Å; T415-F417 VanDerWaalsContact O-CD2 3.26Å; T415-F417 WeakPolarHBondContact O-CD2 3.16Å; T415-F417 PolarHBondContact OG1-N 2.77Å; T415-F417 VanDerWaalsContact OG1-N 3.08Å; T415-F417 PolarHBondContact OG1-O 3.35Å
418	I	89.7	Confident	87.9	Confident	3 Å²	3	43.6 Å²	43.6	2%	0.015	25%	0.246	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-107.7	138.6	-178.3	-68.6	164.9	0	0	0	110	K381 I382 T384 L387 A407 V410 D411 G422	K381-I418 CarbonylContact C-O 3.55Å; K381-I418 VanDerWaalsContact CA-O 3.29Å; K381-I418 WeakPolarHBondContact CA-O 3.3Å; I382-I418 HydrophobicContact CG2-CB 4.38Å; I382-I418 PolarHBondContact N-O 3.2Å; I382-I418 PolarHBondContact O-N 3.35Å; T384-I418 HydrophobicContact CG2-CD1 3.82Å; T384-I418 HydrophobicContact CG2-CG1 4.23Å; L387-I418 HydrophobicContact CD1-CD1 3.88Å; A407-I418 HydrophobicContact CB-CD1 3.96Å; V410-I418 HydrophobicContact CB-CD1 4.45Å; V410-I418 HydrophobicContact CG1-CD1 4.2Å; V410-I418 HydrophobicContact CG1-CG1 4.11Å; V410-I418 HydrophobicContact CG1-CG2 3.66Å; D411-I418 HydrophobicContact CB-CD1 4.42Å; D411-I418 HydrophobicContact CB-CG1 3.99Å; I418-G422 VanDerWaalsContact CG2-C 3.44Å
419	D	90.3	Very high	87.7	Confident	44 Å²	44	41.7 Å²	41.7	24%	0.235	23%	0.234	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-79.6	176.5	176	83.5	-27.5	0	0	0	111.8	N421 G422 F423	D419-N421 VanDerWaalsContact C-N 3.25Å; D419-N421 PolarHBondContact O-N 3.01Å; D419-N421 PolarHBondContact OD1-N 2.79Å; D419-N421 PolarHBondContact OD2-ND2 3.49Å; D419-G422 PolarHBondContact O-N 2.88Å; D419-G422 PolarHBondContact OD1-N 3.42Å; D419-F423 PolarHBondContact O-N 3.04Å
420	F	89.6	Confident	87.8	Confident	43 Å²	43	38.1 Å²	38.1	19%	0.189	22%	0.217	C	C	.	.	H	α-helix	trans	-62.6	-31.6	179.3	-178.5	-115.3	0	0	0	113.1	V364 K368 F371 F423 L424	V364-F420 HydrophobicContact CG1-CZ 4.24Å; K368-F420 HydrophobicContact CB-CE2 3.84Å; K368-F420 HydrophobicContact CB-CZ 3.66Å; K368-F420 HydrophobicContact CD-CE1 4.48Å; K368-F420 HydrophobicContact CD-CZ 4.34Å; K368-F420 HydrophobicContact CG-CE2 4.19Å; K368-F420 HydrophobicContact CG-CZ 4.02Å; F371-F420 HydrophobicContact CB-CD2 3.99Å; F371-F420 HydrophobicContact CB-CE2 4.26Å; F371-F420 HydrophobicContact CD1-CB 4.37Å; F371-F420 HydrophobicContact CD1-CD2 4.01Å; F371-F420 AromaticContact CD2-CD2 3.99Å; F371-F420 HydrophobicContact CD2-CD2 3.99Å; F371-F420 HydrophobicContact CE1-CB 4.03Å; F371-F420 HydrophobicContact CE1-CD2 4.49Å; F371-F420 HydrophobicContact CE2-CB 4.29Å; F371-F420 HydrophobicContact CE2-CD2 4.47Å; F371-F420 AromaticContact CG-CD2 3.74Å; F371-F420 HydrophobicContact CG-CD2 3.74Å; F371-F420 HydrophobicContact CG-CE2 4.49Å; F371-F420 HydrophobicContact CZ-CB 3.98Å; F420-F423 PolarHBondContact O-N 3.25Å; F420-L424 HydrophobicContact CD1-CD1 4.08Å; F420-L424 HydrophobicContact CE1-CD1 3.48Å; F420-L424 VanDerWaalsContact CE1-CD1 3.48Å; F420-L424 HydrophobicContact CE1-CG 4.04Å; F420-L424 HydrophobicContact CE2-CD1 4.43Å; F420-L424 HydrophobicContact CE2-CD2 4.27Å; F420-L424 HydrophobicContact CE2-CG 4.08Å; F420-L424 HydrophobicContact CZ-CD1 3.68Å; F420-L424 HydrophobicContact CZ-CD2 3.95Å; F420-L424 HydrophobicContact CZ-CG 3.79Å; F420-L424 WeakPolarHBondContact O-CG 3.31Å; F420-L424 PolarHBondContact O-N 2.8Å
421	N	88.7	Confident	87.7	Confident	57 Å²	57	38.1 Å²	38.1	31%	0.305	22%	0.216	S	C	.	.	H	α-helix	trans	-67.7	-46	177.1	-61.4	-55.7	0	0	0	111.1	D419 F423 L424 I425	D419-N421 VanDerWaalsContact C-N 3.25Å; D419-N421 PolarHBondContact O-N 3.01Å; D419-N421 PolarHBondContact OD1-N 2.79Å; D419-N421 PolarHBondContact OD2-ND2 3.49Å; N421-F423 VanDerWaalsContact C-N 3.33Å; N421-F423 PolarHBondContact O-N 3.47Å; N421-L424 CarbonylContact O-C 3.52Å; N421-L424 WeakPolarHBondContact O-CB 3.19Å; N421-L424 PolarHBondContact O-N 2.88Å; N421-L424 VanDerWaalsContact O-N 3.14Å; N421-I425 WeakPolarHBondContact O-CG1 3.36Å; N421-I425 PolarHBondContact O-N 2.86Å
422	G	88.4	Confident	87.4	Confident	2 Å²	2	41.3 Å²	41.3	2%	0.021	23%	0.23	C	C	.	.	H	α-helix	trans	-63.8	-37.5	175.8	0	0	0	0	0	113	I418 D419 L424 I425 C426	I418-G422 VanDerWaalsContact CG2-C 3.44Å; D419-G422 PolarHBondContact O-N 2.88Å; D419-G422 PolarHBondContact OD1-N 3.42Å; G422-L424 VanDerWaalsContact C-N 3.32Å; G422-L424 PolarHBondContact O-N 2.91Å; G422-I425 WeakPolarHBondContact O-CB 3.17Å; G422-I425 PolarHBondContact O-N 3.46Å; G422-I425 VanDerWaalsContact O-N 3.14Å; G422-C426 PolarHBondContact O-N 2.93Å; G422-C426 VanDerWaalsContact O-N 3.07Å
423	F	90.5	Very high	87.4	Confident	0 Å²	0	41.9 Å²	41.9	0%	0	23%	0.231	C	C	.	.	H	α-helix	trans	-60.3	-42.1	171.2	-176.3	-102.3	0	0	0	111.7	A367 F371 I382 L387 A390 F391 L394 D419 F420 N421 I425 C426 Y427	A367-F423 HydrophobicContact CB-CE1 4.09Å; F371-F423 HydrophobicContact CB-CD1 4.34Å; F371-F423 HydrophobicContact CB-CE1 4.44Å; F371-F423 HydrophobicContact CD2-CB 3.78Å; F371-F423 AromaticContact CD2-CD1 3.96Å; F371-F423 HydrophobicContact CD2-CD1 3.96Å; F371-F423 HydrophobicContact CD2-CD2 4.27Å; F371-F423 AromaticContact CD2-CG 3.74Å; F371-F423 HydrophobicContact CD2-CG 3.74Å; F371-F423 HydrophobicContact CE2-CB 3.91Å; F371-F423 HydrophobicContact CE2-CG 4.33Å; I382-F423 HydrophobicContact CG2-CD2 4.44Å; L387-F423 HydrophobicContact CD2-CD2 3.69Å; L387-F423 HydrophobicContact CD2-CE2 4.07Å; A390-F423 HydrophobicContact CB-CE2 3.91Å; A390-F423 HydrophobicContact CB-CZ 4.23Å; F391-F423 HydrophobicContact CD2-CE2 4.31Å; F391-F423 AromaticContact CE2-CE2 3.98Å; F391-F423 HydrophobicContact CE2-CE2 3.98Å; L394-F423 HydrophobicContact CD1-CE1 4.21Å; L394-F423 HydrophobicContact CD1-CZ 3.77Å; D419-F423 PolarHBondContact O-N 3.04Å; F420-F423 PolarHBondContact O-N 3.25Å; N421-F423 VanDerWaalsContact C-N 3.33Å; N421-F423 PolarHBondContact O-N 3.47Å; F423-I425 VanDerWaalsContact C-N 3.34Å; F423-C426 PolarHBondContact O-N 2.78Å; F423-Y427 VanDerWaalsContact O-CB 3.24Å; F423-Y427 WeakPolarHBondContact O-CB 3.36Å; F423-Y427 PolarHBondContact O-N 2.78Å
424	L	89.7	Confident	87.4	Confident	31 Å²	31	37.3 Å²	37.3	16%	0.162	21%	0.206	C	C	.	.	H	α-helix	trans	-65.6	-31.7	173.6	-74.8	178.4	0	0	0	113.3	V364 A367 F420 N421 G422 Y427 G428	V364-L424 HydrophobicContact CG1-CD1 4.28Å; V364-L424 HydrophobicContact CG1-CD2 4.36Å; A367-L424 HydrophobicContact CB-CD2 3.96Å; F420-L424 HydrophobicContact CD1-CD1 4.08Å; F420-L424 HydrophobicContact CE1-CD1 3.48Å; F420-L424 VanDerWaalsContact CE1-CD1 3.48Å; F420-L424 HydrophobicContact CE1-CG 4.04Å; F420-L424 HydrophobicContact CE2-CD1 4.43Å; F420-L424 HydrophobicContact CE2-CD2 4.27Å; F420-L424 HydrophobicContact CE2-CG 4.08Å; F420-L424 HydrophobicContact CZ-CD1 3.68Å; F420-L424 HydrophobicContact CZ-CD2 3.95Å; F420-L424 HydrophobicContact CZ-CG 3.79Å; F420-L424 WeakPolarHBondContact O-CG 3.31Å; F420-L424 PolarHBondContact O-N 2.8Å; N421-L424 CarbonylContact O-C 3.52Å; N421-L424 WeakPolarHBondContact O-CB 3.19Å; N421-L424 PolarHBondContact O-N 2.88Å; N421-L424 VanDerWaalsContact O-N 3.14Å; G422-L424 VanDerWaalsContact C-N 3.32Å; G422-L424 PolarHBondContact O-N 2.91Å; L424-Y427 HydrophobicContact CD2-CD1 4.27Å; L424-G428 WeakPolarHBondContact O-CA 3.38Å; L424-G428 PolarHBondContact O-N 2.89Å
425	I	87	Confident	87.1	Confident	40 Å²	40	35.9 Å²	35.9	21%	0.205	18%	0.184	C	C	.	.	H	α-helix	trans	-64.8	-50.1	173.9	-68.8	167.8	0	0	0	110.1	P153 V410 N421 G422 F423 Y427 G428 K429	P153-I425 HydrophobicContact CB-CD1 4.21Å; V410-I425 HydrophobicContact CG2-CB 4.17Å; V410-I425 HydrophobicContact CG2-CG2 3.78Å; N421-I425 WeakPolarHBondContact O-CG1 3.36Å; N421-I425 PolarHBondContact O-N 2.86Å; G422-I425 WeakPolarHBondContact O-CB 3.17Å; G422-I425 PolarHBondContact O-N 3.46Å; G422-I425 VanDerWaalsContact O-N 3.14Å; F423-I425 VanDerWaalsContact C-N 3.34Å; I425-Y427 PolarHBondContact O-N 3.24Å; I425-G428 PolarHBondContact O-N 2.76Å; I425-K429 HydrophobicContact CG2-CD 4.47Å; I425-K429 WeakPolarHBondContact O-CG 3.38Å; I425-K429 PolarHBondContact O-N 3.29Å
426	C	88	Confident	86.8	Confident	0 Å²	0	36.4 Å²	36.4	0%	0	19%	0.185	C	C	.	.	H	α-helix	trans	-63.1	-41.3	177.3	-61.9	0	0	0	0	112.1	F391 G422 F423 K429 K430	F391-C426 HydrophobicContact CE2-CB 4.31Å; F391-C426 HydrophobicContact CZ-CB 3.81Å; G422-C426 PolarHBondContact O-N 2.93Å; G422-C426 VanDerWaalsContact O-N 3.07Å; F423-C426 PolarHBondContact O-N 2.78Å; C426-K429 PolarHBondContact O-N 2.95Å; C426-K430 PolarHBondContact O-N 3.42Å; C426-K430 VanDerWaalsContact O-N 3.14Å
427	Y	89.4	Confident	86.5	Confident	6 Å²	6	38 Å²	38	2%	0.024	19%	0.186	C	C	.	.	H	α-helix	trans	-67.1	-40.2	178.1	178.8	-119.5	0	0	0	111.9	I359 Q363 A367 L394 L396 F423 L424 I425 K430 L431	I359-Y427 HydrophobicContact CD1-CD1 4.48Å; I359-Y427 HydrophobicContact CG2-CD1 4.47Å; I359-Y427 HydrophobicContact CG2-CE1 4.18Å; Q363-Y427 HydrophobicContact CB-CE1 4.13Å; Q363-Y427 PolarHBondContact OE1-OH 3.46Å; A367-Y427 HydrophobicContact CB-CD1 3.83Å; A367-Y427 HydrophobicContact CB-CE1 3.72Å; A367-Y427 HydrophobicContact CB-CG 4.49Å; L394-Y427 HydrophobicContact CD1-CD2 3.77Å; L394-Y427 HydrophobicContact CD1-CE2 3.75Å; L394-Y427 HydrophobicContact CD2-CE2 4.41Å; L394-Y427 HydrophobicContact CG-CE2 4.47Å; L396-Y427 HydrophobicContact CD1-CD2 3.7Å; L396-Y427 HydrophobicContact CD1-CE2 3.56Å; F423-Y427 VanDerWaalsContact O-CB 3.24Å; F423-Y427 WeakPolarHBondContact O-CB 3.36Å; F423-Y427 PolarHBondContact O-N 2.78Å; L424-Y427 HydrophobicContact CD2-CD1 4.27Å; I425-Y427 PolarHBondContact O-N 3.24Å; Y427-K430 PolarHBondContact O-N 2.96Å; Y427-L431 HydrophobicContact CD1-CD1 4.02Å; Y427-L431 HydrophobicContact CD2-CG 4.42Å; Y427-L431 HydrophobicContact CE1-CD1 3.53Å; Y427-L431 HydrophobicContact CE1-CG 4.37Å; Y427-L431 HydrophobicContact CE2-CD1 4.12Å; Y427-L431 HydrophobicContact CE2-CD2 4.32Å; Y427-L431 HydrophobicContact CE2-CG 4.11Å; Y427-L431 WeakPolarHBondContact O-CG 3.26Å; Y427-L431 PolarHBondContact O-N 2.87Å
428	G	87.9	Confident	86.2	Confident	8 Å²	8	39 Å²	39	8%	0.082	19%	0.187	C	C	.	.	H	α-helix	trans	-61.4	-46.6	173.3	0	0	0	0	0	112.4	F357 L424 I425 K430 L431 Q432	F357-G428 WeakPolarHBondContact CE1-O 3.49Å; L424-G428 WeakPolarHBondContact O-CA 3.38Å; L424-G428 PolarHBondContact O-N 2.89Å; I425-G428 PolarHBondContact O-N 2.76Å; G428-K430 VanDerWaalsContact C-N 3.3Å; G428-K430 PolarHBondContact O-N 3.13Å; G428-L431 PolarHBondContact O-N 3.31Å; G428-Q432 WeakPolarHBondContact O-CB 3.48Å; G428-Q432 PolarHBondContact O-N 3.03Å
429	K	85.7	Confident	85.7	Confident	55 Å²	55	41.1 Å²	41.1	24%	0.239	20%	0.199	C	C	.	.	H	α-helix	trans	-54.4	-44.9	173.5	-76.1	176.3	-179.1	173	0	111.7	W406 I425 C426 Q432 E433	W406-K429 HydrophobicContact CD2-CB 4.43Å; W406-K429 HydrophobicContact CD2-CD 4.42Å; W406-K429 HydrophobicContact CG-CD 4.18Å; W406-K429 HydrophobicContact CZ2-CB 4.41Å; I425-K429 HydrophobicContact CG2-CD 4.47Å; I425-K429 WeakPolarHBondContact O-CG 3.38Å; I425-K429 PolarHBondContact O-N 3.29Å; C426-K429 PolarHBondContact O-N 2.95Å; K429-Q432 PolarHBondContact O-N 3.36Å; K429-E433 WeakPolarHBondContact O-CB 3.47Å; K429-E433 PolarHBondContact O-N 3.36Å
430	K	88.1	Confident	85.4	Confident	18 Å²	18	39.9 Å²	39.9	8%	0.078	19%	0.192	C	C	.	.	H	α-helix	trans	-67.5	-45.3	178.1	-174.5	48.7	-178.5	157.2	0	113	F391 L396 V398 W406 C426 Y427 G428 Q432 E433 D434	F391-K430 HydrophobicContact CE1-CB 3.96Å; F391-K430 HydrophobicContact CE1-CG 4.45Å; L396-K430 HydrophobicContact CB-CG 4.49Å; L396-K430 HydrophobicContact CD1-CB 4.38Å; L396-K430 HydrophobicContact CD1-CG 3.92Å; L396-K430 HydrophobicContact CD2-CG 4.48Å; V398-K430 HydrophobicContact CG2-CD 3.92Å; V398-K430 HydrophobicContact CG2-CG 3.92Å; W406-K430 HydrophobicContact CH2-CB 4.03Å; W406-K430 HydrophobicContact CH2-CD 4.07Å; W406-K430 HydrophobicContact CZ3-CB 3.84Å; W406-K430 HydrophobicContact CZ3-CD 4.43Å; C426-K430 PolarHBondContact O-N 3.42Å; C426-K430 VanDerWaalsContact O-N 3.14Å; Y427-K430 PolarHBondContact O-N 2.96Å; G428-K430 VanDerWaalsContact C-N 3.3Å; G428-K430 PolarHBondContact O-N 3.13Å; K430-Q432 PolarHBondContact O-N 3.07Å; K430-E433 WeakPolarHBondContact CD-OE2 3.34Å; K430-E433 WeakPolarHBondContact CE-OE2 3.41Å; K430-E433 IonicContact NZ-OE2 2.93Å; K430-E433 PolarHBondContact NZ-OE2 3.31Å; K430-E433 PolarHBondContact O-N 3.47Å; K430-D434 WeakPolarHBondContact CE-OD1 3.41Å; K430-D434 IonicContact NZ-OD1 2.7Å; K430-D434 PolarHBondContact NZ-OD1 2.94Å; K430-D434 IonicContact NZ-OD2 3.17Å; K430-D434 WeakPolarHBondContact O-CB 3.12Å; K430-D434 VanDerWaalsContact O-CG 3.29Å; K430-D434 PolarHBondContact O-N 3.47Å
431	L	86.6	Confident	85.2	Confident	25 Å²	25	42.6 Å²	42.6	13%	0.131	20%	0.201	C	C	.	.	H	α-helix	trans	-63.6	-32.8	178	-72	179.5	0	0	0	112.4	F357 I359 Q363 Y427 G428 Q435	F357-L431 HydrophobicContact CE1-CB 4.09Å; F357-L431 HydrophobicContact CE2-CB 4.04Å; F357-L431 HydrophobicContact CZ-CB 3.35Å; F357-L431 HydrophobicContact CZ-CD1 4.15Å; F357-L431 HydrophobicContact CZ-CG 4.43Å; I359-L431 HydrophobicContact CG2-CD1 4.17Å; Q363-L431 HydrophobicContact CB-CD1 4.4Å; Y427-L431 HydrophobicContact CD1-CD1 4.02Å; Y427-L431 HydrophobicContact CD2-CG 4.42Å; Y427-L431 HydrophobicContact CE1-CD1 3.53Å; Y427-L431 HydrophobicContact CE1-CG 4.37Å; Y427-L431 HydrophobicContact CE2-CD1 4.12Å; Y427-L431 HydrophobicContact CE2-CD2 4.32Å; Y427-L431 HydrophobicContact CE2-CG 4.11Å; Y427-L431 WeakPolarHBondContact O-CG 3.26Å; Y427-L431 PolarHBondContact O-N 2.87Å; G428-L431 PolarHBondContact O-N 3.31Å; L431-Q435 WeakPolarHBondContact O-CB 3.48Å; L431-Q435 PolarHBondContact O-N 3.37Å
432	Q	82.3	Confident	84.8	Confident	85 Å²	85	42.8 Å²	42.8	40%	0.397	20%	0.202	S	C	.	.	H	α-helix	trans	-69.1	-49.5	172.5	-173.4	177.4	-8.4	0	0	111.2	F357 G428 K429 K430 D434 Q435 D436	F357-Q432 HydrophobicContact CB-CG 4.25Å; F357-Q432 HydrophobicContact CD1-CB 3.79Å; F357-Q432 HydrophobicContact CD1-CG 4.32Å; F357-Q432 HydrophobicContact CE1-CB 4.19Å; F357-Q432 HydrophobicContact CG-CB 4.01Å; F357-Q432 HydrophobicContact CG-CG 4.19Å; G428-Q432 WeakPolarHBondContact O-CB 3.48Å; G428-Q432 PolarHBondContact O-N 3.03Å; K429-Q432 PolarHBondContact O-N 3.36Å; K430-Q432 PolarHBondContact O-N 3.07Å; Q432-D434 VanDerWaalsContact C-N 3.28Å; Q432-D434 PolarHBondContact O-N 2.88Å; Q432-Q435 CarbonylContact O-C 3.53Å; Q432-Q435 WeakPolarHBondContact O-CA 3.35Å; Q432-Q435 WeakPolarHBondContact O-CB 3.13Å; Q432-Q435 PolarHBondContact O-N 2.66Å; Q432-D436 VanDerWaalsContact O-CG 3.28Å; Q432-D436 PolarHBondContact O-N 3.09Å
433	E	82.1	Confident	84.4	Confident	65 Å²	65	43 Å²	43	30%	0.304	20%	0.204	S	C	.	.	H	α-helix	trans	-53.6	-44.9	174.5	-178.2	-169.9	-146	0	0	111.6	K429 K430 Q435 E437	K429-E433 WeakPolarHBondContact O-CB 3.47Å; K429-E433 PolarHBondContact O-N 3.36Å; K430-E433 WeakPolarHBondContact CD-OE2 3.34Å; K430-E433 WeakPolarHBondContact CE-OE2 3.41Å; K430-E433 IonicContact NZ-OE2 2.93Å; K430-E433 PolarHBondContact NZ-OE2 3.31Å; K430-E433 PolarHBondContact O-N 3.47Å; E433-Q435 VanDerWaalsContact C-N 3.29Å; E433-Q435 PolarHBondContact O-N 2.71Å; E433-E437 WeakPolarHBondContact O-CB 3.49Å; E433-E437 PolarHBondContact O-N 3.36Å
434	D	83.9	Confident	84.1	Confident	31 Å²	31	43.6 Å²	43.6	17%	0.166	21%	0.206	C	C	.	.	H	α-helix	trans	-67.3	-28.5	176.7	-67.7	-24.8	0	0	0	112.6	K430 Q432 R438	K430-D434 WeakPolarHBondContact CE-OD1 3.41Å; K430-D434 IonicContact NZ-OD1 2.7Å; K430-D434 PolarHBondContact NZ-OD1 2.94Å; K430-D434 IonicContact NZ-OD2 3.17Å; K430-D434 WeakPolarHBondContact O-CB 3.12Å; K430-D434 VanDerWaalsContact O-CG 3.29Å; K430-D434 PolarHBondContact O-N 3.47Å; Q432-D434 VanDerWaalsContact C-N 3.28Å; Q432-D434 PolarHBondContact O-N 2.88Å; D434-R438 VanDerWaalsContact C-NH1 3.34Å; D434-R438 WeakPolarHBondContact O-CG 3.34Å; D434-R438 PolarHBondContact O-N 3.14Å; D434-R438 PolarHBondContact O-NE 3.47Å; D434-R438 PolarHBondContact O-NH1 2.87Å
435	Q	79.3	Confident	83.9	Confident	59 Å²	59	50 Å²	50	28%	0.276	23%	0.228	S	C	.	.	H	α-helix	trans	-76.9	-48.2	176	-178.9	58.1	35.1	0	0	111	L431 Q432 E433 E437 R438 D439	L431-Q435 WeakPolarHBondContact O-CB 3.48Å; L431-Q435 PolarHBondContact O-N 3.37Å; Q432-Q435 CarbonylContact O-C 3.53Å; Q432-Q435 WeakPolarHBondContact O-CA 3.35Å; Q432-Q435 WeakPolarHBondContact O-CB 3.13Å; Q432-Q435 PolarHBondContact O-N 2.66Å; E433-Q435 VanDerWaalsContact C-N 3.29Å; E433-Q435 PolarHBondContact O-N 2.71Å; Q435-E437 VanDerWaalsContact C-N 3.28Å; Q435-E437 PolarHBondContact O-N 3.31Å; Q435-R438 VanDerWaalsContact CA-NH2 3.31Å; Q435-R438 WeakPolarHBondContact O-CA 3.31Å; Q435-R438 WeakPolarHBondContact O-CB 3.49Å; Q435-R438 PolarHBondContact O-N 2.9Å; Q435-R438 VanDerWaalsContact OE1-NE 3.11Å; Q435-D439 PolarHBondContact NE2-OD1 2.91Å; Q435-D439 PolarHBondContact NE2-OD2 3.28Å; Q435-D439 PolarHBondContact O-N 3.27Å
436	D	78.7	Confident	83.6	Confident	73 Å²	73	52.7 Å²	52.7	39%	0.39	25%	0.246	S	C	.	.	H	α-helix	trans	-56.6	-43.2	175.1	-63.7	-17.6	0	0	0	110.1	Q432 R438 D439 L440	Q432-D436 VanDerWaalsContact O-CG 3.28Å; Q432-D436 PolarHBondContact O-N 3.09Å; D436-R438 PolarHBondContact O-N 3.45Å; D436-D439 PolarHBondContact O-N 2.8Å; D436-L440 WeakPolarHBondContact O-CB 3.35Å; D436-L440 WeakPolarHBondContact O-CG 3.49Å; D436-L440 PolarHBondContact O-N 3.36Å
437	E	82.6	Confident	83.2	Confident	59 Å²	59	53.5 Å²	53.5	28%	0.276	25%	0.25	S	S	.	.	H	α-helix	trans	-63.1	-39.4	174.6	-164.2	-163	137.3	0	0	112.7	E433 Q435 R441 Y497	E433-E437 WeakPolarHBondContact O-CB 3.49Å; E433-E437 PolarHBondContact O-N 3.36Å; Q435-E437 VanDerWaalsContact C-N 3.28Å; Q435-E437 PolarHBondContact O-N 3.31Å; E437-R441 WeakPolarHBondContact O-CB 3.4Å; E437-R441 VanDerWaalsContact O-CG 3.31Å; E437-R441 WeakPolarHBondContact O-CG 3.2Å; E437-R441 PolarHBondContact O-N 2.71Å; E437-R441 IonicContact OE1-CZ 2.71Å; E437-R441 IonicContact OE1-NE 3.15Å; E437-R441 PolarHBondContact OE1-NE 2.86Å; E437-R441 IonicContact OE1-NH2 2.67Å; E437-R441 PolarHBondContact OE1-NH2 3.49Å; E437-Y497 HydrophobicContact CG-CE2 4.04Å
438	R	82.3	Confident	83.1	Confident	114 Å²	114	53.8 Å²	53.8	43%	0.43	25%	0.252	S	S	.	.	H	α-helix	trans	-63.6	-47.1	175	-78.6	-176.1	-63.5	-85.8	5.9	111.4	D434 Q435 D436 L440 R441 D442	D434-R438 VanDerWaalsContact C-NH1 3.34Å; D434-R438 WeakPolarHBondContact O-CG 3.34Å; D434-R438 PolarHBondContact O-N 3.14Å; D434-R438 PolarHBondContact O-NE 3.47Å; D434-R438 PolarHBondContact O-NH1 2.87Å; Q435-R438 VanDerWaalsContact CA-NH2 3.31Å; Q435-R438 WeakPolarHBondContact O-CA 3.31Å; Q435-R438 WeakPolarHBondContact O-CB 3.49Å; Q435-R438 PolarHBondContact O-N 2.9Å; Q435-R438 VanDerWaalsContact OE1-NE 3.11Å; D436-R438 PolarHBondContact O-N 3.45Å; R438-L440 VanDerWaalsContact C-N 3.31Å; R438-L440 PolarHBondContact O-N 2.96Å; R438-R441 WeakPolarHBondContact O-CB 3.35Å; R438-R441 PolarHBondContact O-N 2.77Å; R438-R441 VanDerWaalsContact O-N 3.13Å; R438-D442 PolarHBondContact O-N 2.89Å
439	D	78.7	Confident	82.8	Confident	49 Å²	49	59.8 Å²	59.8	26%	0.262	28%	0.276	S	S	.	.	H	α-helix	trans	-66.7	-35.5	-178.4	-65.5	-27.5	0	0	0	111	Q435 D436 D442 A443	Q435-D439 PolarHBondContact NE2-OD1 2.91Å; Q435-D439 PolarHBondContact NE2-OD2 3.28Å; Q435-D439 PolarHBondContact O-N 3.27Å; D436-D439 PolarHBondContact O-N 2.8Å; D439-D442 PolarHBondContact O-N 3.09Å; D439-A443 VanDerWaalsContact O-CB 3.27Å; D439-A443 WeakPolarHBondContact O-CB 3.19Å; D439-A443 PolarHBondContact O-N 3.12Å
440	L	82.8	Confident	82.7	Confident	18 Å²	18	61.8 Å²	61.8	9%	0.094	29%	0.29	C	S	.	.	H	α-helix	trans	-64.8	-40.8	169.7	-70.9	177.8	0	0	0	112.9	D436 R438 F444 F496 Y497 M500 T501	D436-L440 WeakPolarHBondContact O-CB 3.35Å; D436-L440 WeakPolarHBondContact O-CG 3.49Å; D436-L440 PolarHBondContact O-N 3.36Å; R438-L440 VanDerWaalsContact C-N 3.31Å; R438-L440 PolarHBondContact O-N 2.96Å; L440-F444 WeakPolarHBondContact O-CB 3.4Å; L440-F444 PolarHBondContact O-N 2.64Å; L440-F496 HydrophobicContact CB-CE1 4.35Å; L440-F496 HydrophobicContact CD2-CE1 4.04Å; L440-F496 HydrophobicContact CD2-CZ 4.44Å; L440-Y497 HydrophobicContact CD1-CD2 3.94Å; L440-Y497 HydrophobicContact CD1-CE2 4.17Å; L440-M500 HydrophobicContact CD1-CB 3.92Å; L440-M500 HydrophobicContact CD2-CB 3.59Å; L440-M500 HydrophobicContact CD2-CE 3.36Å; L440-M500 HydrophobicContact CD2-CG 3.71Å; L440-M500 HydrophobicContact CD2-SD 4.38Å; L440-M500 HydrophobicContact CG-CB 4.43Å; L440-T501 HydrophobicContact CD1-CG2 4.35Å
441	R	85.5	Confident	82.5	Confident	99 Å²	99	69.6 Å²	69.6	37%	0.374	32%	0.324	S	S	.	.	H	α-helix	trans	-66.2	-39.3	175.5	-75.7	178.1	-174.3	-68.1	0.4	112.4	E437 R438 F444 R445 F493	E437-R441 WeakPolarHBondContact O-CB 3.4Å; E437-R441 VanDerWaalsContact O-CG 3.31Å; E437-R441 WeakPolarHBondContact O-CG 3.2Å; E437-R441 PolarHBondContact O-N 2.71Å; E437-R441 IonicContact OE1-CZ 2.71Å; E437-R441 IonicContact OE1-NE 3.15Å; E437-R441 PolarHBondContact OE1-NE 2.86Å; E437-R441 IonicContact OE1-NH2 2.67Å; E437-R441 PolarHBondContact OE1-NH2 3.49Å; R438-R441 WeakPolarHBondContact O-CB 3.35Å; R438-R441 PolarHBondContact O-N 2.77Å; R438-R441 VanDerWaalsContact O-N 3.13Å; R441-F444 PolarHBondContact O-N 3.43Å; R441-R445 WeakPolarHBondContact O-CD 3.34Å; R441-R445 VanDerWaalsContact O-CG 3.26Å; R441-R445 WeakPolarHBondContact O-CG 3.39Å; R441-R445 PolarHBondContact O-N 2.84Å; R441-F493 HydrophobicContact CB-CE2 4.21Å; R441-F493 HydrophobicContact CG-CD2 4.28Å; R441-F493 HydrophobicContact CG-CE1 4.29Å; R441-F493 HydrophobicContact CG-CE2 3.38Å; R441-F493 HydrophobicContact CG-CZ 3.38Å; R441-F493 VanDerWaalsContact CZ-CE1 3.4Å
442	D	81.2	Confident	82.4	Confident	61 Å²	61	74 Å²	74	33%	0.326	34%	0.338	S	S	.	.	H	α-helix	trans	-74.5	-34.9	177.6	-78	-22.8	0	0	0	112.1	R438 D439 R445 V446	R438-D442 PolarHBondContact O-N 2.89Å; D439-D442 PolarHBondContact O-N 3.09Å; D442-R445 PolarHBondContact O-N 3.05Å; D442-R445 WeakPolarHBondContact OD1-CD 3.33Å; D442-R445 IonicContact OD1-CZ 2.71Å; D442-R445 IonicContact OD1-NE 4Å; D442-R445 IonicContact OD1-NH1 2.77Å; D442-R445 PolarHBondContact OD1-NH1 3.04Å; D442-V446 WeakPolarHBondContact O-CG2 3.05Å; D442-V446 PolarHBondContact O-N 3.44Å
443	A	79.9	Confident	82.6	Confident	7 Å²	7	71.8 Å²	71.8	6%	0.058	34%	0.339	C	S	.	.	H	α-helix	trans	-58.6	-52.1	166.4	0	0	0	0	0	111.3	M350 D439 R445 V446 L447	M350-A443 HydrophobicContact CE-CB 3.7Å; M350-A443 HydrophobicContact SD-CB 4.13Å; D439-A443 VanDerWaalsContact O-CB 3.27Å; D439-A443 WeakPolarHBondContact O-CB 3.19Å; D439-A443 PolarHBondContact O-N 3.12Å; A443-R445 VanDerWaalsContact C-N 3.28Å; A443-R445 PolarHBondContact O-N 2.94Å; A443-V446 WeakPolarHBondContact O-CA 3.42Å; A443-V446 WeakPolarHBondContact O-CB 3.43Å; A443-V446 PolarHBondContact O-N 3.36Å; A443-L447 WeakPolarHBondContact O-CG 3.45Å; A443-L447 PolarHBondContact O-N 2.99Å; A443-L447 VanDerWaalsContact O-N 3.09Å
444	F	84.5	Confident	83	Confident	13 Å²	13	72.6 Å²	72.6	6%	0.057	34%	0.343	C	S	.	.	H	α-helix	trans	-54	-42.9	177.9	-171.7	-85.2	0	0	0	112.4	L440 R441 V446 L447 D448 G453 I455 F493 F496	L440-F444 WeakPolarHBondContact O-CB 3.4Å; L440-F444 PolarHBondContact O-N 2.64Å; R441-F444 PolarHBondContact O-N 3.43Å; F444-V446 VanDerWaalsContact C-N 3.28Å; F444-V446 PolarHBondContact O-N 3.09Å; F444-L447 PolarHBondContact O-N 3.29Å; F444-L447 VanDerWaalsContact O-N 3.14Å; F444-D448 HydrophobicContact CD1-CB 4.46Å; F444-D448 HydrophobicContact CE1-CB 4.22Å; F444-D448 PolarHBondContact O-N 2.81Å; F444-G453 VanDerWaalsContact CZ-O 3.31Å; F444-G453 WeakPolarHBondContact CZ-O 3.44Å; F444-I455 HydrophobicContact CD2-CD1 3.35Å; F444-I455 HydrophobicContact CD2-CG1 4Å; F444-I455 HydrophobicContact CE1-CG1 4.49Å; F444-I455 HydrophobicContact CE2-CD1 3.43Å; F444-I455 VanDerWaalsContact CE2-CD1 3.43Å; F444-I455 HydrophobicContact CE2-CG1 3.66Å; F444-I455 HydrophobicContact CG-CD1 4.07Å; F444-I455 HydrophobicContact CZ-CD1 4.2Å; F444-I455 HydrophobicContact CZ-CG1 3.93Å; F444-F493 HydrophobicContact CB-CD2 4.09Å; F444-F493 HydrophobicContact CB-CE2 4.44Å; F444-F493 HydrophobicContact CD1-CD2 4.35Å; F444-F493 HydrophobicContact CD2-CB 4.47Å; F444-F493 HydrophobicContact CD2-CD2 4.01Å; F444-F493 HydrophobicContact CE1-CB 4.46Å; F444-F493 HydrophobicContact CE2-CB 4.21Å; F444-F493 AromaticContact CG-CD2 3.89Å; F444-F493 HydrophobicContact CG-CD2 3.89Å; F444-F493 HydrophobicContact CZ-CB 4.21Å; F444-F496 HydrophobicContact CB-CD1 4.22Å; F444-F496 HydrophobicContact CB-CE1 4.27Å; F444-F496 HydrophobicContact CD2-CB 3.76Å; F444-F496 AromaticContact CD2-CD1 3.73Å; F444-F496 HydrophobicContact CD2-CD1 3.73Å; F444-F496 HydrophobicContact CD2-CD2 4.46Å; F444-F496 HydrophobicContact CD2-CE1 4.48Å; F444-F496 AromaticContact CD2-CG 3.72Å; F444-F496 HydrophobicContact CD2-CG 3.72Å; F444-F496 HydrophobicContact CE2-CB 3.91Å; F444-F496 HydrophobicContact CE2-CG 4.33Å; F444-F496 HydrophobicContact CG-CD1 4.47Å
445	R	84.6	Confident	83.1	Confident	166 Å²	166	71.2 Å²	71.2	63%	0.626	34%	0.335	S	S	*	.	H	α-helix	trans	-63.9	-26.1	175.5	-74.3	165.1	175.9	170.4	-0.2	114.7	R441 D442 A443	R441-R445 WeakPolarHBondContact O-CD 3.34Å; R441-R445 VanDerWaalsContact O-CG 3.26Å; R441-R445 WeakPolarHBondContact O-CG 3.39Å; R441-R445 PolarHBondContact O-N 2.84Å; D442-R445 PolarHBondContact O-N 3.05Å; D442-R445 WeakPolarHBondContact OD1-CD 3.33Å; D442-R445 IonicContact OD1-CZ 2.71Å; D442-R445 IonicContact OD1-NE 4Å; D442-R445 IonicContact OD1-NH1 2.77Å; D442-R445 PolarHBondContact OD1-NH1 3.04Å; A443-R445 VanDerWaalsContact C-N 3.28Å; A443-R445 PolarHBondContact O-N 2.94Å
446	V	80.7	Confident	83.5	Confident	96 Å²	96	70.8 Å²	70.8	58%	0.582	34%	0.335	S	S	*	.	H	α-helix	trans	-79.5	-32.2	174.3	171.9	0	0	0	0	110.7	D442 A443 F444	D442-V446 WeakPolarHBondContact O-CG2 3.05Å; D442-V446 PolarHBondContact O-N 3.44Å; A443-V446 WeakPolarHBondContact O-CA 3.42Å; A443-V446 WeakPolarHBondContact O-CB 3.43Å; A443-V446 PolarHBondContact O-N 3.36Å; F444-V446 VanDerWaalsContact C-N 3.28Å; F444-V446 PolarHBondContact O-N 3.09Å
447	L	81	Confident	83.9	Confident	16 Å²	16	68 Å²	68	8%	0.084	32%	0.321	C	S	.	.	H	α-helix	trans	-79.2	-39.9	178.6	-54.7	-165.6	0	0	0	112.5	M350 A443 F444 K449 I455 I463 F496	M350-L447 HydrophobicContact CE-CD1 4.22Å; M350-L447 HydrophobicContact SD-CD1 3.96Å; M350-L447 HydrophobicContact SD-CD2 3.92Å; M350-L447 HydrophobicContact SD-CG 4.22Å; A443-L447 WeakPolarHBondContact O-CG 3.45Å; A443-L447 PolarHBondContact O-N 2.99Å; A443-L447 VanDerWaalsContact O-N 3.09Å; F444-L447 PolarHBondContact O-N 3.29Å; F444-L447 VanDerWaalsContact O-N 3.14Å; L447-K449 PolarHBondContact O-N 3.48Å; L447-I455 HydrophobicContact CB-CD1 3.61Å; L447-I455 HydrophobicContact CB-CG1 3.89Å; L447-I455 HydrophobicContact CB-CG2 4.36Å; L447-I455 HydrophobicContact CD1-CD1 3.85Å; L447-I455 HydrophobicContact CG-CD1 4.28Å; L447-I463 HydrophobicContact CB-CD1 4.31Å; L447-I463 HydrophobicContact CD1-CD1 3.74Å; L447-I463 HydrophobicContact CD2-CD1 3.44Å; L447-I463 VanDerWaalsContact CD2-CD1 3.44Å; L447-I463 HydrophobicContact CD2-CG1 4.38Å; L447-I463 HydrophobicContact CG-CD1 3.97Å; L447-F496 HydrophobicContact CD1-CE2 4.23Å
448	D	86.7	Confident	84	Confident	12 Å²	12	70.4 Å²	70.4	6%	0.064	33%	0.331	C	S	.	.			trans	-74.9	73.7	173.8	-179.4	12	0	0	0	111.4	F444 N450 K451 R452 G453 I455	F444-D448 HydrophobicContact CD1-CB 4.46Å; F444-D448 HydrophobicContact CE1-CB 4.22Å; F444-D448 PolarHBondContact O-N 2.81Å; D448-N450 PolarHBondContact O-N 3.07Å; D448-N450 VanDerWaalsContact O-N 3.13Å; D448-N450 PolarHBondContact OD1-N 3.35Å; D448-K451 VanDerWaalsContact CG-CA 3.5Å; D448-K451 PolarHBondContact O-N 2.98Å; D448-K451 VanDerWaalsContact O-N 3.13Å; D448-K451 WeakPolarHBondContact OD1-CA 3.5Å; D448-K451 PolarHBondContact OD1-N 2.96Å; D448-K451 VanDerWaalsContact OD2-C 3.23Å; D448-K451 WeakPolarHBondContact OD2-CA 3.48Å; D448-R452 PolarHBondContact OD1-N 3.34Å; D448-R452 PolarHBondContact OD2-N 3Å; D448-G453 PolarHBondContact OD2-N 3.46Å; D448-I455 HydrophobicContact CB-CG1 4.39Å
449	K	80.6	Confident	84	Confident	135 Å²	135	66.5 Å²	66.5	59%	0.587	32%	0.319	S	S	*	.	T	Hydrogen-bonded Turn	trans	-53.7	-30.7	176.4	-62.9	167.5	-167.5	162.5	0	112.8	L447 D459	L447-K449 PolarHBondContact O-N 3.48Å; K449-D459 WeakPolarHBondContact CD-OD2 3.5Å; K449-D459 WeakPolarHBondContact CE-OD2 3.37Å; K449-D459 IonicContact NZ-OD1 2.64Å; K449-D459 PolarHBondContact NZ-OD1 2.97Å; K449-D459 IonicContact NZ-OD2 2.71Å; K449-D459 PolarHBondContact NZ-OD2 2.8Å
450	N	84.6	Confident	84.2	Confident	97 Å²	97	64.2 Å²	64.2	52%	0.519	31%	0.307	S	S	.	.	T	Hydrogen-bonded Turn	trans	-91.9	-10.5	-174	-63.9	-46.8	0	0	0	113	D448 R452	D448-N450 PolarHBondContact O-N 3.07Å; D448-N450 VanDerWaalsContact O-N 3.13Å; D448-N450 PolarHBondContact OD1-N 3.35Å; N450-R452 VanDerWaalsContact C-N 3.28Å; N450-R452 HydrophobicContact CB-CG 3.9Å; N450-R452 PolarHBondContact O-N 3.28Å
451	K	84.2	Confident	84.2	Confident	182 Å²	182	65.4 Å²	65.4	79%	0.791	31%	0.31	S	S	*	.			trans	55.6	39.3	-176.6	-58.6	180	-178.9	177	0	112.9	D448	D448-K451 VanDerWaalsContact CG-CA 3.5Å; D448-K451 PolarHBondContact O-N 2.98Å; D448-K451 VanDerWaalsContact O-N 3.13Å; D448-K451 WeakPolarHBondContact OD1-CA 3.5Å; D448-K451 PolarHBondContact OD1-N 2.96Å; D448-K451 VanDerWaalsContact OD2-C 3.23Å; D448-K451 WeakPolarHBondContact OD2-CA 3.48Å
452	R	84.7	Confident	84	Confident	116 Å²	116	69.8 Å²	69.8	44%	0.438	33%	0.327	S	S	.	.	S	Bend	trans	-81	-21.2	178	-67.2	-172.5	-61.9	-136.4	2.4	113	D448 N450 E454 D456	D448-R452 PolarHBondContact OD1-N 3.34Å; D448-R452 PolarHBondContact OD2-N 3Å; N450-R452 VanDerWaalsContact C-N 3.28Å; N450-R452 HydrophobicContact CB-CG 3.9Å; N450-R452 PolarHBondContact O-N 3.28Å; R452-E454 HydrophobicContact CB-CB 4.32Å; R452-D456 IonicContact NH2-OD2 3.89Å
453	G	86.3	Confident	83.8	Confident	40 Å²	40	68.5 Å²	68.5	41%	0.412	32%	0.32	S	S	.	.	S	Bend	trans	91.2	8.1	-164.2	0	0	0	0	0	113.3	F444 D448	F444-G453 VanDerWaalsContact CZ-O 3.31Å; F444-G453 WeakPolarHBondContact CZ-O 3.44Å; D448-G453 PolarHBondContact OD2-N 3.46Å
454	E	90.2	Very high	83.5	Confident	82 Å²	82	68.3 Å²	68.3	38%	0.383	32%	0.318	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-145.6	128.3	-167.6	-76.6	163.3	-160.7	0	0	109.6	R452 F490	R452-E454 HydrophobicContact CB-CB 4.32Å; E454-F490 HydrophobicContact CB-CB 4.17Å; E454-F490 HydrophobicContact CG-CB 4.38Å
455	I	86.6	Confident	83.1	Confident	1 Å²	1	71.5 Å²	71.5	1%	0.005	33%	0.332	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-87.9	136.5	173.5	-61.6	166.4	0	0	0	108.8	F444 L447 D448 D459 L460 F490 V491 F496	F444-I455 HydrophobicContact CD2-CD1 3.35Å; F444-I455 HydrophobicContact CD2-CG1 4Å; F444-I455 HydrophobicContact CE1-CG1 4.49Å; F444-I455 HydrophobicContact CE2-CD1 3.43Å; F444-I455 VanDerWaalsContact CE2-CD1 3.43Å; F444-I455 HydrophobicContact CE2-CG1 3.66Å; F444-I455 HydrophobicContact CG-CD1 4.07Å; F444-I455 HydrophobicContact CZ-CD1 4.2Å; F444-I455 HydrophobicContact CZ-CG1 3.93Å; L447-I455 HydrophobicContact CB-CD1 3.61Å; L447-I455 HydrophobicContact CB-CG1 3.89Å; L447-I455 HydrophobicContact CB-CG2 4.36Å; L447-I455 HydrophobicContact CD1-CD1 3.85Å; L447-I455 HydrophobicContact CG-CD1 4.28Å; D448-I455 HydrophobicContact CB-CG1 4.39Å; I455-D459 HydrophobicContact CG2-CB 4.39Å; I455-L460 HydrophobicContact CG2-CB 4.27Å; I455-F490 CarbonylContact O-C 3.57Å; I455-F490 WeakPolarHBondContact O-CA 3.48Å; I455-V491 PolarHBondContact N-O 3.47Å; I455-V491 PolarHBondContact O-N 3.13Å; I455-F496 HydrophobicContact CD1-CD2 4.19Å
456	D	87.4	Confident	82.3	Confident	51 Å²	51	66 Å²	66	27%	0.273	33%	0.326	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-69.7	132.5	173	-162.5	-53.5	0	0	0	110.2	R452 E458 D459 L460	R452-D456 IonicContact NH2-OD2 3.89Å; D456-E458 PolarHBondContact O-N 3.49Å; D456-E458 PolarHBondContact OD1-N 2.91Å; D456-D459 HydrophobicContact CB-CB 4.14Å; D456-D459 WeakPolarHBondContact O-CA 3.45Å; D456-D459 WeakPolarHBondContact O-CB 3.46Å; D456-D459 PolarHBondContact O-N 3.48Å; D456-L460 PolarHBondContact O-N 3.32Å
457	V	86.3	Confident	81.5	Confident	15 Å²	15	62.3 Å²	62.3	9%	0.091	30%	0.303	C	S	.	.	H	α-helix	trans	-55.9	-32.6	177.9	157.6	0	0	0	0	112.1	L460 R461 I480 G489 V491	V457-L460 PolarHBondContact O-N 2.93Å; V457-R461 WeakPolarHBondContact O-CB 3.45Å; V457-R461 PolarHBondContact O-N 3.25Å; V457-I480 HydrophobicContact CB-CG2 4.4Å; V457-I480 HydrophobicContact CG1-CB 4.49Å; V457-I480 HydrophobicContact CG1-CD1 4.04Å; V457-I480 HydrophobicContact CG1-CG1 4.33Å; V457-I480 HydrophobicContact CG1-CG2 3.4Å; V457-I480 VanDerWaalsContact CG1-CG2 3.4Å; V457-I480 HydrophobicContact CG2-CG2 4.08Å; V457-G489 WeakPolarHBondContact CB-O 3.48Å; V457-G489 VanDerWaalsContact CG2-C 3.45Å; V457-G489 VanDerWaalsContact CG2-O 3.26Å; V457-G489 WeakPolarHBondContact CG2-O 3.06Å; V457-G489 PolarHBondContact N-O 3.35Å; V457-V491 HydrophobicContact CG2-CG2 4.13Å
458	E	84.8	Confident	80.5	Confident	108 Å²	108	62.6 Å²	62.6	51%	0.505	31%	0.31	S	S	.	.	H	α-helix	trans	-74.4	-29.4	176.2	-71	-60.9	122	0	0	112.9	D456 R461 W462	D456-E458 PolarHBondContact O-N 3.49Å; D456-E458 PolarHBondContact OD1-N 2.91Å; E458-R461 IonicContact OE1-CZ 2.59Å; E458-R461 IonicContact OE1-NE 3.12Å; E458-R461 PolarHBondContact OE1-NE 3.02Å; E458-R461 IonicContact OE1-NH2 3.79Å; E458-R461 WeakPolarHBondContact OE2-CD 3.5Å; E458-R461 IonicContact OE2-NE 2.71Å; E458-R461 PolarHBondContact OE2-NE 3.43Å; E458-W462 WeakPolarHBondContact O-CB 3.39Å; E458-W462 PolarHBondContact O-N 3.07Å
459	D	82.9	Confident	79.2	Confident	33 Å²	33	70 Å²	70	18%	0.176	35%	0.35	C	S	.	.	H	α-helix	trans	-69.2	-43.1	169.6	-88.5	-23.5	0	0	0	110.9	K449 I455 D456 W462 I463	K449-D459 WeakPolarHBondContact CD-OD2 3.5Å; K449-D459 WeakPolarHBondContact CE-OD2 3.37Å; K449-D459 IonicContact NZ-OD1 2.64Å; K449-D459 PolarHBondContact NZ-OD1 2.97Å; K449-D459 IonicContact NZ-OD2 2.71Å; K449-D459 PolarHBondContact NZ-OD2 2.8Å; I455-D459 HydrophobicContact CG2-CB 4.39Å; D456-D459 HydrophobicContact CB-CB 4.14Å; D456-D459 WeakPolarHBondContact O-CA 3.45Å; D456-D459 WeakPolarHBondContact O-CB 3.46Å; D456-D459 PolarHBondContact O-N 3.48Å; D459-W462 PolarHBondContact O-N 3.14Å; D459-I463 WeakPolarHBondContact O-CD1 3.46Å; D459-I463 WeakPolarHBondContact O-CG1 3.4Å; D459-I463 PolarHBondContact O-N 3.49Å
460	L	82.3	Confident	78.5	Confident	1 Å²	1	70.9 Å²	70.9	1%	0.005	36%	0.36	C	S	.	.	H	α-helix	trans	-60.9	-44.9	173.9	-177	60.5	0	0	0	111.3	I455 D456 V457 W462 I463 L464 T483 V491	I455-L460 HydrophobicContact CG2-CB 4.27Å; D456-L460 PolarHBondContact O-N 3.32Å; V457-L460 PolarHBondContact O-N 2.93Å; L460-W462 VanDerWaalsContact C-N 3.35Å; L460-W462 PolarHBondContact O-N 3.44Å; L460-I463 PolarHBondContact O-N 3.14Å; L460-L464 HydrophobicContact CD1-CD1 4.47Å; L460-L464 HydrophobicContact CD1-CG 4.39Å; L460-L464 HydrophobicContact CG-CD1 4.09Å; L460-L464 HydrophobicContact CG-CG 4.46Å; L460-L464 VanDerWaalsContact O-CG 3.29Å; L460-L464 WeakPolarHBondContact O-CG 3.47Å; L460-L464 PolarHBondContact O-N 2.92Å; L460-T483 HydrophobicContact CD2-CG2 4.49Å; L460-V491 HydrophobicContact CD2-CG2 3.91Å
461	R	83.1	Confident	77.8	Confident	43 Å²	43	67.9 Å²	67.9	16%	0.162	34%	0.344	C	S	.	.	H	α-helix	trans	-55.1	-47.8	173	179.4	-172	-65	-73.3	4	111.8	V457 E458 I463 L464 K465 I476 D477 I480	V457-R461 WeakPolarHBondContact O-CB 3.45Å; V457-R461 PolarHBondContact O-N 3.25Å; E458-R461 IonicContact OE1-CZ 2.59Å; E458-R461 IonicContact OE1-NE 3.12Å; E458-R461 PolarHBondContact OE1-NE 3.02Å; E458-R461 IonicContact OE1-NH2 3.79Å; E458-R461 WeakPolarHBondContact OE2-CD 3.5Å; E458-R461 IonicContact OE2-NE 2.71Å; E458-R461 PolarHBondContact OE2-NE 3.43Å; R461-I463 VanDerWaalsContact C-N 3.31Å; R461-I463 PolarHBondContact O-N 3.31Å; R461-L464 PolarHBondContact O-N 2.97Å; R461-K465 HydrophobicContact CG-CD 4.47Å; R461-K465 WeakPolarHBondContact O-CG 3.41Å; R461-K465 PolarHBondContact O-N 3.3Å; R461-I476 HydrophobicContact CB-CG2 4.43Å; R461-I476 HydrophobicContact CG-CG2 4Å; R461-D477 IonicContact CZ-OD1 4Å; R461-D477 IonicContact NH1-OD1 3.89Å; R461-D477 PolarHBondContact NH1-OD1 2.92Å; R461-D477 IonicContact NH2-OD1 3.06Å; R461-D477 PolarHBondContact NH2-OD1 3.35Å; R461-I480 HydrophobicContact CB-CD1 3.91Å; R461-I480 HydrophobicContact CG-CD1 4.43Å
462	W	80.8	Confident	77.6	Confident	190 Å²	190	62.6 Å²	62.6	72%	0.72	33%	0.327	S	S	*	.	H	α-helix	trans	-60.6	-42.2	179.3	177.5	-97.5	0	0	0	111.8	E458 D459 L460 G466	E458-W462 WeakPolarHBondContact O-CB 3.39Å; E458-W462 PolarHBondContact O-N 3.07Å; D459-W462 PolarHBondContact O-N 3.14Å; L460-W462 VanDerWaalsContact C-N 3.35Å; L460-W462 PolarHBondContact O-N 3.44Å; W462-G466 PolarHBondContact O-N 3.35Å
463	I	76.9	Confident	77.5	Confident	34 Å²	34	63 Å²	63	17%	0.174	33%	0.334	C	S	.	.	H	α-helix	trans	-64	-49.2	176.3	-66.4	155.5	0	0	0	110.2	L346 L447 D459 L460 R461 K465 G466 L467	L346-I463 HydrophobicContact CD1-CG2 4.1Å; L447-I463 HydrophobicContact CB-CD1 4.31Å; L447-I463 HydrophobicContact CD1-CD1 3.74Å; L447-I463 HydrophobicContact CD2-CD1 3.44Å; L447-I463 VanDerWaalsContact CD2-CD1 3.44Å; L447-I463 HydrophobicContact CD2-CG1 4.38Å; L447-I463 HydrophobicContact CG-CD1 3.97Å; D459-I463 WeakPolarHBondContact O-CD1 3.46Å; D459-I463 WeakPolarHBondContact O-CG1 3.4Å; D459-I463 PolarHBondContact O-N 3.49Å; L460-I463 PolarHBondContact O-N 3.14Å; R461-I463 VanDerWaalsContact C-N 3.31Å; R461-I463 PolarHBondContact O-N 3.31Å; I463-K465 PolarHBondContact O-N 2.92Å; I463-G466 PolarHBondContact O-N 2.86Å; I463-L467 HydrophobicContact CG2-CD1 3.51Å; I463-L467 HydrophobicContact CG2-CG 4.29Å; I463-L467 WeakPolarHBondContact O-CD1 3.3Å; I463-L467 WeakPolarHBondContact O-CG 3.39Å; I463-L467 PolarHBondContact O-N 3.35Å; I463-L467 VanDerWaalsContact O-N 3.16Å
464	L	73.9	Confident	77.4	Confident	4 Å²	4	68.7 Å²	68.7	2%	0.021	35%	0.35	C	S	.	.	H	α-helix	trans	-57.3	-45.2	177.7	-70.1	172.3	0	0	0	112.3	L460 R461 G466 L467 I476 M479 I480	L460-L464 HydrophobicContact CD1-CD1 4.47Å; L460-L464 HydrophobicContact CD1-CG 4.39Å; L460-L464 HydrophobicContact CG-CD1 4.09Å; L460-L464 HydrophobicContact CG-CG 4.46Å; L460-L464 VanDerWaalsContact O-CG 3.29Å; L460-L464 WeakPolarHBondContact O-CG 3.47Å; L460-L464 PolarHBondContact O-N 2.92Å; R461-L464 PolarHBondContact O-N 2.97Å; L464-G466 VanDerWaalsContact C-N 3.29Å; L464-G466 PolarHBondContact O-N 2.96Å; L464-L467 PolarHBondContact O-N 3.47Å; L464-I476 HydrophobicContact CB-CD1 4.24Å; L464-I476 HydrophobicContact CB-CG1 4.26Å; L464-I476 HydrophobicContact CB-CG2 4.23Å; L464-I476 HydrophobicContact CD1-CG2 3.98Å; L464-M479 HydrophobicContact CD1-CE 3.83Å; L464-M479 HydrophobicContact CD2-CE 3.45Å; L464-M479 VanDerWaalsContact CD2-CE 3.45Å; L464-M479 HydrophobicContact CG-CE 4.26Å; L464-I480 HydrophobicContact CD1-CG1 4.48Å
465	K	77.1	Confident	76.9	Confident	80 Å²	80	67.3 Å²	67.3	35%	0.348	34%	0.343	S	S	.	.	H	α-helix	trans	-61.7	-32.8	173.5	-72.7	-172.3	-178.4	-174.6	0	113.3	R461 I463 L467 E473 I476	R461-K465 HydrophobicContact CG-CD 4.47Å; R461-K465 WeakPolarHBondContact O-CG 3.41Å; R461-K465 PolarHBondContact O-N 3.3Å; I463-K465 PolarHBondContact O-N 2.92Å; K465-L467 VanDerWaalsContact C-N 3.33Å; K465-E473 IonicContact NZ-OE1 2.83Å; K465-E473 PolarHBondContact NZ-OE1 3.23Å; K465-I476 HydrophobicContact CB-CD1 4.47Å; K465-I476 HydrophobicContact CG-CD1 3.52Å
466	G	68.3	Low	76.7	Confident	49 Å²	49	67.3 Å²	67.3	51%	0.505	34%	0.343	S	S	.	.	H	α-helix	trans	-79.3	-10.6	178	0	0	0	0	0	115.1	R349 W462 I463 L464	R349-G466 PolarHBondContact NH2-O 3.19Å; W462-G466 PolarHBondContact O-N 3.35Å; I463-G466 PolarHBondContact O-N 2.86Å; L464-G466 VanDerWaalsContact C-N 3.29Å; L464-G466 PolarHBondContact O-N 2.96Å
467	L	63.9	Low	76.6	Confident	20 Å²	20	68.1 Å²	68.1	11%	0.105	35%	0.348	C	S	.	.	H	α-helix	trans	-101.8	-31.2	-171.7	-73.2	167.7	0	0	0	114.3	L346 R349 I463 L464 K465	L346-L467 HydrophobicContact CB-CD1 4.22Å; L346-L467 HydrophobicContact CD1-CD1 3.21Å; L346-L467 HydrophobicContact CG-CD1 4.28Å; R349-L467 HydrophobicContact CB-CD2 3.31Å; R349-L467 HydrophobicContact CG-CD2 4.01Å; R349-L467 PolarHBondContact NH1-O 3Å; I463-L467 HydrophobicContact CG2-CD1 3.51Å; I463-L467 HydrophobicContact CG2-CG 4.29Å; I463-L467 WeakPolarHBondContact O-CD1 3.3Å; I463-L467 WeakPolarHBondContact O-CG 3.39Å; I463-L467 PolarHBondContact O-N 3.35Å; I463-L467 VanDerWaalsContact O-N 3.16Å; L464-L467 PolarHBondContact O-N 3.47Å; K465-L467 VanDerWaalsContact C-N 3.33Å
468	G	59.9	Low	76.4	Confident	21 Å²	21	70.2 Å²	70.2	22%	0.216	36%	0.358	C	S	.	.			trans	-138	117.4	178.5	0	0	0	0	0	112	D470 L471	G468-D470 PolarHBondContact O-N 2.93Å; G468-L471 PolarHBondContact O-N 2.7Å
469	D	58.3	Low	76.1	Confident	169 Å²	169	65.9 Å²	65.9	90%	0.904	34%	0.338	S	S	*	.	T	Hydrogen-bonded Turn	trans	-63.8	-15.4	168.7	-66	-40.1	0	0	0	112.2
470	D	65.6	Low	76.1	Confident	152 Å²	152	64.9 Å²	64.9	81%	0.813	33%	0.333	S	S	*	.	T	Hydrogen-bonded Turn	trans	-94	-7.4	-176.4	-64.7	-47.4	0	0	0	114.5	G468	G468-D470 PolarHBondContact O-N 2.93Å
471	L	70.3	Confident	76.2	Confident	35 Å²	35	71.8 Å²	71.8	18%	0.183	36%	0.359	C	S	.	.			trans	-87.1	120	178.1	-69.8	177.9	0	0	0	110.8	W342 G468 I476 M479	W342-L471 HydrophobicContact CB-CD1 4.46Å; G468-L471 PolarHBondContact O-N 2.7Å; L471-I476 HydrophobicContact CB-CD1 4.09Å; L471-I476 HydrophobicContact CB-CG1 4.01Å; L471-I476 HydrophobicContact CD1-CG1 4.41Å; L471-M479 HydrophobicContact CD1-SD 4.35Å; L471-M479 HydrophobicContact CD2-SD 4.43Å
472	T	80.6	Confident	76.2	Confident	70 Å²	70	72.5 Å²	72.5	43%	0.429	37%	0.366	S	S	.	.			trans	-72.4	157.9	172.6	61.4	0	0	0	0	111.7	E474 E475 I476	T472-E474 PolarHBondContact O-N 3.01Å; T472-E475 WeakPolarHBondContact CB-OE2 3.37Å; T472-E475 WeakPolarHBondContact CG2-OE2 3.5Å; T472-E475 PolarHBondContact N-OE2 2.72Å; T472-E475 PolarHBondContact O-N 2.99Å; T472-E475 VanDerWaalsContact OG1-CD 3.24Å; T472-E475 VanDerWaalsContact OG1-CG 3.26Å; T472-E475 WeakPolarHBondContact OG1-CG 3.42Å; T472-E475 PolarHBondContact OG1-N 2.83Å; T472-E475 PolarHBondContact OG1-OE2 3Å; T472-I476 WeakPolarHBondContact O-CG1 3.41Å; T472-I476 PolarHBondContact O-N 3.28Å
473	E	83.1	Confident	76.2	Confident	126 Å²	126	63.7 Å²	63.7	59%	0.589	33%	0.333	S	S	*	.	H	α-helix	trans	-60.9	-34.6	176.8	-58.8	-166.7	136.3	0	0	111.9	K465 I476 D477	K465-E473 IonicContact NZ-OE1 2.83Å; K465-E473 PolarHBondContact NZ-OE1 3.23Å; E473-I476 PolarHBondContact O-N 2.9Å; E473-D477 PolarHBondContact O-N 2.9Å
474	E	83.8	Confident	76.7	Confident	158 Å²	158	63.2 Å²	63.2	74%	0.738	33%	0.331	S	S	*	.	H	α-helix	trans	-63.7	-42.1	174.8	-62.3	177.5	-173.8	0	0	112.1	T472 I476 D477 D478	T472-E474 PolarHBondContact O-N 3.01Å; E474-I476 VanDerWaalsContact C-N 3.35Å; E474-D477 PolarHBondContact O-N 3.08Å; E474-D478 WeakPolarHBondContact O-CB 3.43Å; E474-D478 PolarHBondContact O-N 2.72Å
475	E	80.1	Confident	77.1	Confident	53 Å²	53	67.8 Å²	67.8	25%	0.248	36%	0.359	C	S	.	.	H	α-helix	trans	-68.1	-34.6	175.4	-73.7	161.8	138.1	0	0	112.1	L338 T472 M479	L338-E475 HydrophobicContact CD1-CG 4.46Å; L338-E475 WeakPolarHBondContact CD1-OE1 3.25Å; T472-E475 WeakPolarHBondContact CB-OE2 3.37Å; T472-E475 WeakPolarHBondContact CG2-OE2 3.5Å; T472-E475 PolarHBondContact N-OE2 2.72Å; T472-E475 PolarHBondContact O-N 2.99Å; T472-E475 VanDerWaalsContact OG1-CD 3.24Å; T472-E475 VanDerWaalsContact OG1-CG 3.26Å; T472-E475 WeakPolarHBondContact OG1-CG 3.42Å; T472-E475 PolarHBondContact OG1-N 2.83Å; T472-E475 PolarHBondContact OG1-OE2 3Å; E475-M479 WeakPolarHBondContact O-CB 3.24Å; E475-M479 WeakPolarHBondContact O-CG 3.44Å; E475-M479 PolarHBondContact O-N 2.85Å
476	I	81.4	Confident	77.6	Confident	1 Å²	1	69.6 Å²	69.6	1%	0.005	37%	0.373	C	S	.	.	H	α-helix	trans	-68.8	-41.2	175.1	-66.1	172.4	0	0	0	110.6	R461 L464 K465 L471 T472 E473 E474 M479 I480	R461-I476 HydrophobicContact CB-CG2 4.43Å; R461-I476 HydrophobicContact CG-CG2 4Å; L464-I476 HydrophobicContact CB-CD1 4.24Å; L464-I476 HydrophobicContact CB-CG1 4.26Å; L464-I476 HydrophobicContact CB-CG2 4.23Å; L464-I476 HydrophobicContact CD1-CG2 3.98Å; K465-I476 HydrophobicContact CB-CD1 4.47Å; K465-I476 HydrophobicContact CG-CD1 3.52Å; L471-I476 HydrophobicContact CB-CD1 4.09Å; L471-I476 HydrophobicContact CB-CG1 4.01Å; L471-I476 HydrophobicContact CD1-CG1 4.41Å; T472-I476 WeakPolarHBondContact O-CG1 3.41Å; T472-I476 PolarHBondContact O-N 3.28Å; E473-I476 PolarHBondContact O-N 2.9Å; E474-I476 VanDerWaalsContact C-N 3.35Å; I476-M479 PolarHBondContact O-N 3.4Å; I476-I480 HydrophobicContact CG2-CD1 3.69Å; I476-I480 HydrophobicContact CG2-CG1 4.44Å; I476-I480 WeakPolarHBondContact O-CB 3.42Å; I476-I480 WeakPolarHBondContact O-CD1 3.42Å; I476-I480 VanDerWaalsContact O-CG1 3.24Å; I476-I480 WeakPolarHBondContact O-CG1 3.32Å; I476-I480 PolarHBondContact O-N 3.42Å
477	D	84.8	Confident	78.5	Confident	69 Å²	69	70 Å²	70	37%	0.369	38%	0.378	S	S	.	.	H	α-helix	trans	-61.7	-44.6	173.7	-74.6	-14.9	0	0	0	112	R461 E473 E474 I480 R481	R461-D477 IonicContact CZ-OD1 4Å; R461-D477 IonicContact NH1-OD1 3.89Å; R461-D477 PolarHBondContact NH1-OD1 2.92Å; R461-D477 IonicContact NH2-OD1 3.06Å; R461-D477 PolarHBondContact NH2-OD1 3.35Å; E473-D477 PolarHBondContact O-N 2.9Å; E474-D477 PolarHBondContact O-N 3.08Å; D477-I480 PolarHBondContact O-N 2.95Å; D477-R481 WeakPolarHBondContact O-CB 3.29Å; D477-R481 PolarHBondContact O-N 3.34Å
478	D	83.5	Confident	79.7	Confident	58 Å²	58	71.7 Å²	71.7	31%	0.31	39%	0.391	S	S	.	.	H	α-helix	trans	-61.2	-44.8	175	-89.9	5.8	0	0	0	111.5	E474 R481 D482	E474-D478 WeakPolarHBondContact O-CB 3.43Å; E474-D478 PolarHBondContact O-N 2.72Å; D478-R481 VanDerWaalsContact CG-NH2 3.27Å; D478-R481 PolarHBondContact O-N 3.36Å; D478-R481 IonicContact OD1-CZ 3.94Å; D478-R481 IonicContact OD1-NH1 3.65Å; D478-R481 PolarHBondContact OD1-NH1 3.34Å; D478-R481 IonicContact OD1-NH2 2.67Å; D478-R481 PolarHBondContact OD1-NH2 2.86Å; D478-R481 IonicContact OD2-NH2 3.47Å; D478-D482 WeakPolarHBondContact O-CB 3.5Å; D478-D482 PolarHBondContact O-N 3Å
479	M	77.6	Confident	80.9	Confident	17 Å²	17	72.1 Å²	72.1	8%	0.084	40%	0.395	C	S	.	.	H	α-helix	trans	-63.1	-42.6	176.5	-77.5	173.2	51.4	0	0	113	W342 L464 L471 E475 I476 D482 T483	W342-M479 HydrophobicContact CB-CE 4.34Å; W342-M479 HydrophobicContact CD2-CE 3.52Å; W342-M479 HydrophobicContact CE3-CE 4.25Å; W342-M479 HydrophobicContact CG-CE 3.49Å; W342-M479 VanDerWaalsContact CG-CE 3.49Å; W342-M479 HydrophobicContact CG-SD 4Å; W342-M479 HydrophobicContact CZ2-CE 4.44Å; W342-M479 PolarHBondContact NE1-SD 2.95Å; W342-M479 VanDerWaalsContact NE1-SD 3.36Å; L464-M479 HydrophobicContact CD1-CE 3.83Å; L464-M479 HydrophobicContact CD2-CE 3.45Å; L464-M479 VanDerWaalsContact CD2-CE 3.45Å; L464-M479 HydrophobicContact CG-CE 4.26Å; L471-M479 HydrophobicContact CD1-SD 4.35Å; L471-M479 HydrophobicContact CD2-SD 4.43Å; E475-M479 WeakPolarHBondContact O-CB 3.24Å; E475-M479 WeakPolarHBondContact O-CG 3.44Å; E475-M479 PolarHBondContact O-N 2.85Å; I476-M479 PolarHBondContact O-N 3.4Å; M479-D482 PolarHBondContact O-N 2.97Å; M479-T483 WeakPolarHBondContact O-CB 3.32Å; M479-T483 PolarHBondContact O-N 3.26Å; M479-T483 VanDerWaalsContact O-N 3.09Å; M479-T483 PolarHBondContact O-OG1 3.24Å
480	I	83.4	Confident	82.4	Confident	13 Å²	13	67.3 Å²	67.3	7%	0.067	37%	0.366	C	S	.	.	H	α-helix	trans	-61.2	-50.2	176.7	-76.7	163.3	0	0	0	109.7	V457 R461 L464 I476 D477 D482 T483 D484	V457-I480 HydrophobicContact CB-CG2 4.4Å; V457-I480 HydrophobicContact CG1-CB 4.49Å; V457-I480 HydrophobicContact CG1-CD1 4.04Å; V457-I480 HydrophobicContact CG1-CG1 4.33Å; V457-I480 HydrophobicContact CG1-CG2 3.4Å; V457-I480 VanDerWaalsContact CG1-CG2 3.4Å; V457-I480 HydrophobicContact CG2-CG2 4.08Å; R461-I480 HydrophobicContact CB-CD1 3.91Å; R461-I480 HydrophobicContact CG-CD1 4.43Å; L464-I480 HydrophobicContact CD1-CG1 4.48Å; I476-I480 HydrophobicContact CG2-CD1 3.69Å; I476-I480 HydrophobicContact CG2-CG1 4.44Å; I476-I480 WeakPolarHBondContact O-CB 3.42Å; I476-I480 WeakPolarHBondContact O-CD1 3.42Å; I476-I480 VanDerWaalsContact O-CG1 3.24Å; I476-I480 WeakPolarHBondContact O-CG1 3.32Å; I476-I480 PolarHBondContact O-N 3.42Å; D477-I480 PolarHBondContact O-N 2.95Å; I480-D482 PolarHBondContact O-N 3.18Å; I480-T483 WeakPolarHBondContact O-CA 3.39Å; I480-T483 WeakPolarHBondContact O-CB 3.37Å; I480-T483 PolarHBondContact O-N 3.41Å; I480-D484 WeakPolarHBondContact O-CB 3.37Å; I480-D484 PolarHBondContact O-N 2.76Å
481	R	84.8	Confident	83.5	Confident	145 Å²	145	60 Å²	60	55%	0.547	33%	0.328	S	S	.	.	H	α-helix	trans	-63.9	-27.1	178.7	-171.3	-172.7	66.2	-124	-9.2	113.3	D477 D478 T483	D477-R481 WeakPolarHBondContact O-CB 3.29Å; D477-R481 PolarHBondContact O-N 3.34Å; D478-R481 VanDerWaalsContact CG-NH2 3.27Å; D478-R481 PolarHBondContact O-N 3.36Å; D478-R481 IonicContact OD1-CZ 3.94Å; D478-R481 IonicContact OD1-NH1 3.65Å; D478-R481 PolarHBondContact OD1-NH1 3.34Å; D478-R481 IonicContact OD1-NH2 2.67Å; D478-R481 PolarHBondContact OD1-NH2 2.86Å; D478-R481 IonicContact OD2-NH2 3.47Å; R481-T483 VanDerWaalsContact C-N 3.34Å
482	D	81.7	Confident	84.5	Confident	58 Å²	58	61.4 Å²	61.4	31%	0.31	34%	0.335	S	S	.	.	H	α-helix	trans	-81.6	-13.2	173.7	-72.4	-14.9	0	0	0	113	R339 D478 M479 I480	R339-D482 IonicContact CZ-OD2 3.61Å; R339-D482 IonicContact NE-OD2 2.66Å; R339-D482 IonicContact NH2-OD1 3.16Å; R339-D482 IonicContact NH2-OD2 3.95Å; R339-D482 PolarHBondContact NH2-OD2 3.43Å; D478-D482 WeakPolarHBondContact O-CB 3.5Å; D478-D482 PolarHBondContact O-N 3Å; M479-D482 PolarHBondContact O-N 2.97Å; I480-D482 PolarHBondContact O-N 3.18Å
483	T	82.3	Confident	84.8	Confident	6 Å²	6	59.5 Å²	59.5	4%	0.037	32%	0.321	C	S	.	.	H	α-helix	trans	-96.3	-52.9	179.1	-55.2	0	0	0	0	111.8	L460 M479 I480 R481 T485 V491 E495 L499	L460-T483 HydrophobicContact CD2-CG2 4.49Å; M479-T483 WeakPolarHBondContact O-CB 3.32Å; M479-T483 PolarHBondContact O-N 3.26Å; M479-T483 VanDerWaalsContact O-N 3.09Å; M479-T483 PolarHBondContact O-OG1 3.24Å; I480-T483 WeakPolarHBondContact O-CA 3.39Å; I480-T483 WeakPolarHBondContact O-CB 3.37Å; I480-T483 PolarHBondContact O-N 3.41Å; R481-T483 VanDerWaalsContact C-N 3.34Å; T483-T485 VanDerWaalsContact C-N 3.31Å; T483-T485 PolarHBondContact O-N 2.96Å; T483-V491 HydrophobicContact CG2-CB 4.38Å; T483-V491 HydrophobicContact CG2-CG1 3.6Å; T483-V491 HydrophobicContact CG2-CG2 3.78Å; T483-E495 HydrophobicContact CG2-CB 4.5Å; T483-L499 HydrophobicContact CG2-CB 4.17Å; T483-L499 HydrophobicContact CG2-CD1 4.49Å; T483-L499 HydrophobicContact CG2-CD2 3.77Å; T483-L499 HydrophobicContact CG2-CG 4.35Å; T483-L499 VanDerWaalsContact OG1-CD1 3.31Å; T483-L499 WeakPolarHBondContact OG1-CD1 3.32Å
484	D	86.9	Confident	85	Confident	24 Å²	24	58 Å²	58	13%	0.128	32%	0.317	C	S	.	.			trans	-74.9	83.7	177.4	177.9	2.8	0	0	0	107.8	I480 G487 S488 G489	I480-D484 WeakPolarHBondContact O-CB 3.37Å; I480-D484 PolarHBondContact O-N 2.76Å; D484-G487 WeakPolarHBondContact OD1-CA 3.28Å; D484-G487 PolarHBondContact OD1-N 2.91Å; D484-S488 PolarHBondContact OD1-N 3.37Å; D484-G489 WeakPolarHBondContact OD2-CA 3.42Å; D484-G489 PolarHBondContact OD2-N 3.49Å
485	T	82.5	Confident	85.2	Confident	100 Å²	100	50.9 Å²	50.9	61%	0.613	28%	0.284	S	S	*	.	S	Bend	trans	-82.4	-19	-172.3	58	0	0	0	0	113	T483 E495	T483-T485 VanDerWaalsContact C-N 3.31Å; T483-T485 PolarHBondContact O-N 2.96Å; T485-E495 WeakPolarHBondContact CA-OE1 3.33Å; T485-E495 WeakPolarHBondContact CB-OE1 3.36Å; T485-E495 PolarHBondContact N-OE1 3.45Å; T485-E495 PolarHBondContact OG1-OE1 3.14Å
486	D	87.8	Confident	85.4	Confident	117 Å²	117	48.4 Å²	48.4	63%	0.626	27%	0.272	S	S	*	.	S	Bend	trans	-94.5	-15.1	173.6	78	-7.8	0	0	0	113.7	S488	D486-S488 WeakPolarHBondContact OD1-CB 3.31Å; D486-S488 PolarHBondContact OD1-N 3Å; D486-S488 PolarHBondContact OD1-OG 2.85Å
487	G	85.8	Confident	85.5	Confident	59 Å²	59	51.5 Å²	51.5	61%	0.608	28%	0.284	S	S	*	.			trans	77.1	24.7	179.8	0	0	0	0	0	113	D484 G489	D484-G487 WeakPolarHBondContact OD1-CA 3.28Å; D484-G487 PolarHBondContact OD1-N 2.91Å; G487-G489 VanDerWaalsContact C-N 3.3Å; G487-G489 PolarHBondContact O-N 2.93Å
488	S	88.7	Confident	85.3	Confident	55 Å²	55	53.3 Å²	53.3	39%	0.385	29%	0.289	S	S	.	.			trans	-73	-19.1	-177	60.7	0	0	0	0	113.8	D484 D486 F490	D484-S488 PolarHBondContact OD1-N 3.37Å; D486-S488 WeakPolarHBondContact OD1-CB 3.31Å; D486-S488 PolarHBondContact OD1-N 3Å; D486-S488 PolarHBondContact OD1-OG 2.85Å; S488-F490 WeakPolarHBondContact O-CD2 3.26Å; S488-F490 PolarHBondContact OG-N 3.21Å; S488-F490 PolarHBondContact OG-O 2.81Å; S488-F490 VanDerWaalsContact OG-O 3.07Å
489	G	86.5	Confident	84.9	Confident	30 Å²	30	51.4 Å²	51.4	31%	0.309	28%	0.278	S	S	.	.	S	Bend	trans	76.7	8.9	-168.2	0	0	0	0	0	113.4	V457 D484 G487	V457-G489 WeakPolarHBondContact CB-O 3.48Å; V457-G489 VanDerWaalsContact CG2-C 3.45Å; V457-G489 VanDerWaalsContact CG2-O 3.26Å; V457-G489 WeakPolarHBondContact CG2-O 3.06Å; V457-G489 PolarHBondContact N-O 3.35Å; D484-G489 WeakPolarHBondContact OD2-CA 3.42Å; D484-G489 PolarHBondContact OD2-N 3.49Å; G487-G489 VanDerWaalsContact C-N 3.3Å; G487-G489 PolarHBondContact O-N 2.93Å
490	F	89.4	Confident	84.7	Confident	67 Å²	67	50.8 Å²	50.8	29%	0.294	28%	0.275	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-127.9	157.1	174.4	-61.4	-72.5	0	0	0	109.1	E454 I455 S488	E454-F490 HydrophobicContact CB-CB 4.17Å; E454-F490 HydrophobicContact CG-CB 4.38Å; I455-F490 CarbonylContact O-C 3.57Å; I455-F490 WeakPolarHBondContact O-CA 3.48Å; S488-F490 WeakPolarHBondContact O-CD2 3.26Å; S488-F490 PolarHBondContact OG-N 3.21Å; S488-F490 PolarHBondContact OG-O 2.81Å; S488-F490 VanDerWaalsContact OG-O 3.07Å
491	V	88.4	Confident	84	Confident	0 Å²	0	52.5 Å²	52.5	0%	0	29%	0.286	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-119.1	114.2	176.7	176.8	0	0	0	0	108.5	I455 V457 L460 T483 E495 F496	I455-V491 PolarHBondContact N-O 3.47Å; I455-V491 PolarHBondContact O-N 3.13Å; V457-V491 HydrophobicContact CG2-CG2 4.13Å; L460-V491 HydrophobicContact CD2-CG2 3.91Å; T483-V491 HydrophobicContact CG2-CB 4.38Å; T483-V491 HydrophobicContact CG2-CG1 3.6Å; T483-V491 HydrophobicContact CG2-CG2 3.78Å; V491-E495 HydrophobicContact CG1-CB 3.93Å; V491-F496 HydrophobicContact CG1-CB 3.99Å
492	D	90.6	Very high	82.9	Confident	64 Å²	64	47.9 Å²	47.9	34%	0.342	28%	0.276	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-76.1	174.7	177	86.5	11.5	0	0	0	112	D494 E495 F496	D492-D494 VanDerWaalsContact C-N 3.34Å; D492-D494 PolarHBondContact O-N 3.11Å; D492-D494 WeakPolarHBondContact OD1-CA 3.44Å; D492-D494 WeakPolarHBondContact OD1-CB 3.44Å; D492-D494 PolarHBondContact OD1-N 3.47Å; D492-E495 PolarHBondContact N-OE2 3.28Å; D492-E495 PolarHBondContact OD1-N 2.97Å; D492-F496 VanDerWaalsContact O-CB 3.3Å; D492-F496 WeakPolarHBondContact O-CB 3.42Å; D492-F496 PolarHBondContact O-N 3.12Å
493	F	87.8	Confident	81	Confident	29 Å²	29	54.7 Å²	54.7	13%	0.127	31%	0.307	C	S	.	.	H	α-helix	trans	-65.8	-33.6	179.3	178.7	-95	0	0	0	113.3	R441 F444 Y497	R441-F493 HydrophobicContact CB-CE2 4.21Å; R441-F493 HydrophobicContact CG-CD2 4.28Å; R441-F493 HydrophobicContact CG-CE1 4.29Å; R441-F493 HydrophobicContact CG-CE2 3.38Å; R441-F493 HydrophobicContact CG-CZ 3.38Å; R441-F493 VanDerWaalsContact CZ-CE1 3.4Å; F444-F493 HydrophobicContact CB-CD2 4.09Å; F444-F493 HydrophobicContact CB-CE2 4.44Å; F444-F493 HydrophobicContact CD1-CD2 4.35Å; F444-F493 HydrophobicContact CD2-CB 4.47Å; F444-F493 HydrophobicContact CD2-CD2 4.01Å; F444-F493 HydrophobicContact CE1-CB 4.46Å; F444-F493 HydrophobicContact CE2-CB 4.21Å; F444-F493 AromaticContact CG-CD2 3.89Å; F444-F493 HydrophobicContact CG-CD2 3.89Å; F444-F493 HydrophobicContact CZ-CB 4.21Å; F493-Y497 HydrophobicContact CE1-CD2 4.34Å; F493-Y497 HydrophobicContact CE1-CG 4.48Å; F493-Y497 HydrophobicContact CZ-CD2 4.13Å; F493-Y497 WeakPolarHBondContact O-CB 3.48Å; F493-Y497 PolarHBondContact O-N 3.1Å
494	D	87.5	Confident	81	Confident	96 Å²	96	57.2 Å²	57.2	51%	0.513	32%	0.32	S	S	.	.	H	α-helix	trans	-76.3	-33.6	-177.8	-77.5	-4.8	0	0	0	111.2	D492 K498	D492-D494 VanDerWaalsContact C-N 3.34Å; D492-D494 PolarHBondContact O-N 3.11Å; D492-D494 WeakPolarHBondContact OD1-CA 3.44Å; D492-D494 WeakPolarHBondContact OD1-CB 3.44Å; D492-D494 PolarHBondContact OD1-N 3.47Å; D494-K498 WeakPolarHBondContact O-CB 3.35Å; D494-K498 WeakPolarHBondContact O-CD 3.42Å; D494-K498 WeakPolarHBondContact O-CG 3.44Å; D494-K498 PolarHBondContact O-N 3.38Å
495	E	87.2	Confident	80.7	Confident	8 Å²	8	58.9 Å²	58.9	4%	0.037	33%	0.33	C	S	.	.	H	α-helix	trans	-68.5	-47.4	169.1	-69.5	-172.6	140.5	0	0	111.9	T483 T485 V491 D492 Y497 K498 L499	T483-E495 HydrophobicContact CG2-CB 4.5Å; T485-E495 WeakPolarHBondContact CA-OE1 3.33Å; T485-E495 WeakPolarHBondContact CB-OE1 3.36Å; T485-E495 PolarHBondContact N-OE1 3.45Å; T485-E495 PolarHBondContact OG1-OE1 3.14Å; V491-E495 HydrophobicContact CG1-CB 3.93Å; D492-E495 PolarHBondContact N-OE2 3.28Å; D492-E495 PolarHBondContact OD1-N 2.97Å; E495-Y497 VanDerWaalsContact C-N 3.26Å; E495-Y497 PolarHBondContact O-N 3.38Å; E495-K498 PolarHBondContact O-N 2.91Å; E495-L499 VanDerWaalsContact O-CB 3.25Å; E495-L499 WeakPolarHBondContact O-CB 3.44Å; E495-L499 PolarHBondContact O-N 3.17Å
496	F	83.9	Confident	80.6	Confident	0 Å²	0	56.6 Å²	56.6	0%	0	31%	0.314	C	S	.	.	H	α-helix	trans	-59.3	-38.8	171.9	179.5	-99.4	0	0	0	111.7	M350 L440 F444 L447 I455 V491 D492 L499 M500	M350-F496 HydrophobicContact CE-CE2 4.23Å; M350-F496 HydrophobicContact CE-CZ 3.76Å; L440-F496 HydrophobicContact CB-CE1 4.35Å; L440-F496 HydrophobicContact CD2-CE1 4.04Å; L440-F496 HydrophobicContact CD2-CZ 4.44Å; F444-F496 HydrophobicContact CB-CD1 4.22Å; F444-F496 HydrophobicContact CB-CE1 4.27Å; F444-F496 HydrophobicContact CD2-CB 3.76Å; F444-F496 AromaticContact CD2-CD1 3.73Å; F444-F496 HydrophobicContact CD2-CD1 3.73Å; F444-F496 HydrophobicContact CD2-CD2 4.46Å; F444-F496 HydrophobicContact CD2-CE1 4.48Å; F444-F496 AromaticContact CD2-CG 3.72Å; F444-F496 HydrophobicContact CD2-CG 3.72Å; F444-F496 HydrophobicContact CE2-CB 3.91Å; F444-F496 HydrophobicContact CE2-CG 4.33Å; F444-F496 HydrophobicContact CG-CD1 4.47Å; L447-F496 HydrophobicContact CD1-CE2 4.23Å; I455-F496 HydrophobicContact CD1-CD2 4.19Å; V491-F496 HydrophobicContact CG1-CB 3.99Å; D492-F496 VanDerWaalsContact O-CB 3.3Å; D492-F496 WeakPolarHBondContact O-CB 3.42Å; D492-F496 PolarHBondContact O-N 3.12Å; F496-L499 WeakPolarHBondContact O-CB 3.4Å; F496-M500 HydrophobicContact CD1-CG 4.31Å; F496-M500 HydrophobicContact CD2-CG 4.36Å; F496-M500 HydrophobicContact CE1-CG 3.91Å; F496-M500 HydrophobicContact CE2-CG 3.96Å; F496-M500 HydrophobicContact CE2-SD 4.48Å; F496-M500 HydrophobicContact CZ-CE 4.28Å; F496-M500 HydrophobicContact CZ-CG 3.71Å; F496-M500 HydrophobicContact CZ-SD 4.33Å; F496-M500 VanDerWaalsContact O-CB 3.32Å; F496-M500 WeakPolarHBondContact O-CB 3.36Å; F496-M500 WeakPolarHBondContact O-CG 3.29Å; F496-M500 PolarHBondContact O-N 3Å
497	Y	83.6	Confident	80.1	Confident	67 Å²	67	53.1 Å²	53.1	26%	0.263	30%	0.296	S	S	.	.	H	α-helix	trans	-68	-44.8	175.6	-176.9	-92.4	0	0	0	111.8	E437 L440 F493 E495 L499 M500 T501	E437-Y497 HydrophobicContact CG-CE2 4.04Å; L440-Y497 HydrophobicContact CD1-CD2 3.94Å; L440-Y497 HydrophobicContact CD1-CE2 4.17Å; F493-Y497 HydrophobicContact CE1-CD2 4.34Å; F493-Y497 HydrophobicContact CE1-CG 4.48Å; F493-Y497 HydrophobicContact CZ-CD2 4.13Å; F493-Y497 WeakPolarHBondContact O-CB 3.48Å; F493-Y497 PolarHBondContact O-N 3.1Å; E495-Y497 VanDerWaalsContact C-N 3.26Å; E495-Y497 PolarHBondContact O-N 3.38Å; Y497-L499 VanDerWaalsContact C-N 3.33Å; Y497-L499 PolarHBondContact O-N 3.47Å; Y497-M500 CarbonylContact O-C 3.58Å; Y497-M500 PolarHBondContact O-N 2.9Å; Y497-T501 HydrophobicContact CD1-CG2 4.11Å; Y497-T501 HydrophobicContact CD2-CG2 4.07Å; Y497-T501 HydrophobicContact CE1-CG2 3.75Å; Y497-T501 HydrophobicContact CE2-CG2 3.72Å; Y497-T501 HydrophobicContact CG-CG2 4.26Å; Y497-T501 WeakPolarHBondContact O-CB 3.45Å; Y497-T501 WeakPolarHBondContact O-CG2 3.35Å; Y497-T501 PolarHBondContact O-N 3.32Å; Y497-T501 PolarHBondContact O-OG1 3.26Å
498	K	81.3	Confident	79.8	Confident	106 Å²	106	52.7 Å²	52.7	46%	0.461	28%	0.277	S	S	.	.	H	α-helix	trans	-59.5	-44	173.6	-72.7	160.3	-156.3	151.3	0	111.2	D494 E495 M500 T501 S502	D494-K498 WeakPolarHBondContact O-CB 3.35Å; D494-K498 WeakPolarHBondContact O-CD 3.42Å; D494-K498 WeakPolarHBondContact O-CG 3.44Å; D494-K498 PolarHBondContact O-N 3.38Å; E495-K498 PolarHBondContact O-N 2.91Å; K498-M500 VanDerWaalsContact C-N 3.33Å; K498-M500 PolarHBondContact O-N 2.97Å; K498-T501 PolarHBondContact O-N 3.07Å; K498-S502 WeakPolarHBondContact O-CB 3.36Å; K498-S502 PolarHBondContact O-N 2.85Å; K498-S502 PolarHBondContact O-OG 2.95Å
499	L	75.4	Confident	79.2	Confident	18 Å²	18	52.5 Å²	52.5	9%	0.094	27%	0.269	C	S	.	.	H	α-helix	trans	-54.6	-52.5	174	-179.4	63.6	0	0	0	109.4	W342 T483 E495 F496 Y497 T501 S502	W342-L499 HydrophobicContact CH2-CB 4.49Å; W342-L499 HydrophobicContact CH2-CD1 3.2Å; W342-L499 HydrophobicContact CH2-CD2 4.3Å; W342-L499 HydrophobicContact CH2-CG 3.39Å; W342-L499 WeakPolarHBondContact CH2-O 3.31Å; W342-L499 HydrophobicContact CZ2-CD1 3.34Å; W342-L499 HydrophobicContact CZ2-CG 4.08Å; W342-L499 HydrophobicContact CZ3-CD1 4.1Å; W342-L499 HydrophobicContact CZ3-CD2 4.46Å; W342-L499 HydrophobicContact CZ3-CG 3.94Å; T483-L499 HydrophobicContact CG2-CB 4.17Å; T483-L499 HydrophobicContact CG2-CD1 4.49Å; T483-L499 HydrophobicContact CG2-CD2 3.77Å; T483-L499 HydrophobicContact CG2-CG 4.35Å; T483-L499 VanDerWaalsContact OG1-CD1 3.31Å; T483-L499 WeakPolarHBondContact OG1-CD1 3.32Å; E495-L499 VanDerWaalsContact O-CB 3.25Å; E495-L499 WeakPolarHBondContact O-CB 3.44Å; E495-L499 PolarHBondContact O-N 3.17Å; F496-L499 WeakPolarHBondContact O-CB 3.4Å; Y497-L499 VanDerWaalsContact C-N 3.33Å; Y497-L499 PolarHBondContact O-N 3.47Å; L499-T501 VanDerWaalsContact C-N 3.35Å; L499-T501 PolarHBondContact O-N 2.81Å; L499-S502 PolarHBondContact O-OG 3.4Å
500	M	72.8	Confident	78.7	Confident	4 Å²	4	54.1 Å²	54.1	2%	0.02	27%	0.267	C	S	.	.	H	α-helix	trans	-77.2	-10.4	-176.6	-66.2	-66.7	-84.7	0	0	115.6	W342 R343 L346 I347 M350 L440 F496 Y497 K498	W342-M500 HydrophobicContact CZ3-SD 4.04Å; R343-M500 PolarHBondContact NE-O 2.95Å; R343-M500 PolarHBondContact NH2-O 2.89Å; L346-M500 HydrophobicContact CD2-CE 3.99Å; L346-M500 HydrophobicContact CD2-SD 3.36Å; L346-M500 WeakPolarHBondContact CD2-SD 3.44Å; L346-M500 HydrophobicContact CG-CE 4.03Å; L346-M500 HydrophobicContact CG-SD 4.07Å; I347-M500 HydrophobicContact CD1-CE 4.21Å; I347-M500 HydrophobicContact CG1-CE 3.48Å; I347-M500 VanDerWaalsContact CG1-CE 3.48Å; M350-M500 HydrophobicContact CE-CE 4.32Å; L440-M500 HydrophobicContact CD1-CB 3.92Å; L440-M500 HydrophobicContact CD2-CB 3.59Å; L440-M500 HydrophobicContact CD2-CE 3.36Å; L440-M500 HydrophobicContact CD2-CG 3.71Å; L440-M500 HydrophobicContact CD2-SD 4.38Å; L440-M500 HydrophobicContact CG-CB 4.43Å; F496-M500 HydrophobicContact CD1-CG 4.31Å; F496-M500 HydrophobicContact CD2-CG 4.36Å; F496-M500 HydrophobicContact CE1-CG 3.91Å; F496-M500 HydrophobicContact CE2-CG 3.96Å; F496-M500 HydrophobicContact CE2-SD 4.48Å; F496-M500 HydrophobicContact CZ-CE 4.28Å; F496-M500 HydrophobicContact CZ-CG 3.71Å; F496-M500 HydrophobicContact CZ-SD 4.33Å; F496-M500 VanDerWaalsContact O-CB 3.32Å; F496-M500 WeakPolarHBondContact O-CB 3.36Å; F496-M500 WeakPolarHBondContact O-CG 3.29Å; F496-M500 PolarHBondContact O-N 3Å; Y497-M500 CarbonylContact O-C 3.58Å; Y497-M500 PolarHBondContact O-N 2.9Å; K498-M500 VanDerWaalsContact C-N 3.33Å; K498-M500 PolarHBondContact O-N 2.97Å
501	T	69.5	Low	77.8	Confident	49 Å²	49	53.2 Å²	53.2	30%	0.301	26%	0.264	S	S	.	.	H	α-helix	trans	-118	-20.1	-178.4	57.3	0	0	0	0	115.4	R343 L440 Y497 K498 L499	R343-T501 PolarHBondContact NH1-O 3.17Å; L440-T501 HydrophobicContact CD1-CG2 4.35Å; Y497-T501 HydrophobicContact CD1-CG2 4.11Å; Y497-T501 HydrophobicContact CD2-CG2 4.07Å; Y497-T501 HydrophobicContact CE1-CG2 3.75Å; Y497-T501 HydrophobicContact CE2-CG2 3.72Å; Y497-T501 HydrophobicContact CG-CG2 4.26Å; Y497-T501 WeakPolarHBondContact O-CB 3.45Å; Y497-T501 WeakPolarHBondContact O-CG2 3.35Å; Y497-T501 PolarHBondContact O-N 3.32Å; Y497-T501 PolarHBondContact O-OG1 3.26Å; K498-T501 PolarHBondContact O-N 3.07Å; L499-T501 VanDerWaalsContact C-N 3.35Å; L499-T501 PolarHBondContact O-N 2.81Å
502	S	61.3	Low	76.9	Confident	48 Å²	48	57.6 Å²	57.6	34%	0.336	29%	0.286	S	S	.	.			trans	-61.1	145.2	175.2	56.4	0	0	0	0	112.8	R343 K498 L499	R343-S502 PolarHBondContact NH1-O 3.01Å; K498-S502 WeakPolarHBondContact O-CB 3.36Å; K498-S502 PolarHBondContact O-N 2.85Å; K498-S502 PolarHBondContact O-OG 2.95Å; L499-S502 PolarHBondContact O-OG 3.4Å
503	E	42.6	Very low	75.7	Confident	202 Å²	202	57 Å²	57	94%	0.944	28%	0.281	S	S	*	.			trans	-104.3	0	179.1	-64.5	-167.1	142.6	0	0	112.2	N340	N340-E503 PolarHBondContact ND2-OXT 3.47Å

Retrieved 503 of 503 residues in 108.3 ms (Link to these results)

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