A0A096MTM8_PAPAN Loading...

Tumor protein 63 (p63)

Acts as a sequence specific DNA binding transcriptional activator or repressor. The isoforms contain a varying set of transactivation and auto-regulating transactivation inhibiting domains thus showing an isoform specific activity. May be required in conjunction with TP73/p73 for initiation of p53/TP53 dependent apoptosis in response to genotoxic insults and the presence of activated oncogenes.

AlphaFold DB (F7FN64), UniProt , Accession A0A096MTM8, Species PAPAN (Papio anubis, Olive baboon), Gene TP63, Length 680 aa.

Structure Viewer

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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	30.1	Very low	30.7	Very low	246 Å²	246	155.7 Å²	155.7	100%	1.212	84%	0.835	S	S	*	*				0	156.7	0	-78.2	170.7	166.2	0	0	108.4
2	N	31.5	Very low	30.2	Very low	145 Å²	145	158.4 Å²	158.4	78%	0.775	84%	0.838	S	S	*	*			trans	-34.6	154.8	165	-60.9	9	0	0	0	114.2
3	F	36	Very low	29.5	Very low	183 Å²	183	163.9 Å²	163.9	80%	0.803	84%	0.843	S	S	*	*			cis	-171.2	146.5	-14.7	-132.1	-88.2	0	0	0	105
4	E	27.5	Very low	29.3	Very low	190 Å²	190	159.3 Å²	159.3	89%	0.888	83%	0.831	S	S	*	*			trans	-156.8	151.8	165.2	-133.9	163.1	-156.8	0	0	114.4
5	T	38.3	Very low	29.5	Very low	123 Å²	123	156.9 Å²	156.9	76%	0.755	83%	0.829	S	S	*	*			trans	-152.4	136.9	-179.8	-52.5	0	0	0	0	109.9
6	S	30	Very low	29.4	Very low	100 Å²	100	155.8 Å²	155.8	70%	0.699	82%	0.823	S	S	*	*			trans	-172.6	161.9	-178.5	-88.9	0	0	0	0	110.2
7	R	32.1	Very low	29.7	Very low	219 Å²	219	152.8 Å²	152.8	83%	0.826	82%	0.815	S	S	*	*			cis	-173.7	152.4	-22.2	-110	-179.7	179.7	-162.8	1.7	106.8
8	C	26.6	Very low	29.4	Very low	125 Å²	125	155.6 Å²	155.6	85%	0.845	81%	0.814	S	S	*	*			trans	62.8	173.2	161.6	-66.2	0	0	0	0	117.1
9	A	28.8	Very low	29.2	Very low	83 Å²	83	154.6 Å²	154.6	69%	0.686	81%	0.808	S	S	*	*			cis	-174.5	175.3	-37.9	0	0	0	0	0	109.4
10	T	28.5	Very low	28.9	Very low	142 Å²	142	153.7 Å²	153.7	87%	0.871	80%	0.8	S	S	*	*			trans	140.1	150.6	138.2	-53.6	0	0	0	0	114.3
11	L	27.8	Very low	28.6	Very low	157 Å²	157	155.2 Å²	155.2	82%	0.822	80%	0.795	S	S	*	*			trans	-98.9	158.5	-178.2	-69.8	148.6	0	0	0	112.5
12	Q	24.7	Very low	28.3	Very low	188 Å²	188	151.3 Å²	151.3	88%	0.879	77%	0.772	S	S	*	*				-178.4	124.9	123.5	-104.4	176.2	-43.5	0	0	116.7
13	Y	21.4	Very low	28	Very low	230 Å²	230	151 Å²	151	90%	0.902	78%	0.775	S	S	*	*			trans	59	154.6	133.4	-132	-108.1	0	0	0	124.1
14	C	26.1	Very low	27.5	Very low	99 Å²	99	150.8 Å²	150.8	67%	0.669	78%	0.776	S	S	*	*			trans	-108.8	172.5	-175.7	-146.6	0	0	0	0	111.4
15	P	32.7	Very low	27.4	Very low	123 Å²	123	148.4 Å²	148.4	80%	0.799	78%	0.775	S	S	*	*				-151.9	172.7	75.4	41	-21.2	0	0	0	117.8
16	D	28.6	Very low	27.2	Very low	139 Å²	139	148.7 Å²	148.7	74%	0.743	78%	0.779	S	S	*	*			trans	-79.3	161.8	169.7	-143.7	-39.8	0	0	0	112.1
17	P	33.5	Very low	26.9	Very low	105 Å²	105	148.8 Å²	148.8	68%	0.682	79%	0.786	S	S	*	*				-160.8	153.4	96.7	40.8	-20.2	0	0	0	120.8
18	Y	24.5	Very low	26.6	Very low	203 Å²	203	146 Å²	146	80%	0.796	78%	0.782	S	S	*	*			trans	90.6	127.6	130.6	-95.6	-138.1	0	0	0	125
19	I	26.5	Very low	26.5	Very low	138 Å²	138	149 Å²	149	71%	0.708	78%	0.781	S	S	*	*			trans	75.1	142.8	140.3	-76.7	-177	0	0	0	120.3
20	Q	22.7	Very low	26.3	Very low	136 Å²	136	150 Å²	150	64%	0.636	78%	0.782	S	S	*	*			cis	-172.1	146.6	-27.6	-153.9	-174	29.8	0	0	112.2
21	R	22.8	Very low	26.1	Very low	185 Å²	185	155.4 Å²	155.4	70%	0.698	79%	0.787	S	S	*	*			trans	78.3	138.7	145.6	-99.4	169.1	-179.3	-179.9	-1.1	124.6
22	F	23.7	Very low	26	Very low	165 Å²	165	156.1 Å²	156.1	72%	0.724	78%	0.783	S	S	*	*			trans	66.9	109.6	144.3	-70.4	-52.7	0	0	0	123.8
23	V	25.3	Very low	26.1	Very low	139 Å²	139	154 Å²	154	84%	0.842	77%	0.774	S	S	*	*			trans	-148.7	112.1	130.3	-170.4	0	0	0	0	104.7
24	E	25.4	Very low	26.2	Very low	178 Å²	178	149.1 Å²	149.1	83%	0.832	77%	0.773	S	S	*	*				63.6	125.6	76.9	-74.1	-165.4	152.1	0	0	116.7
25	T	24.7	Very low	26.2	Very low	140 Å²	140	154.4 Å²	154.4	86%	0.859	78%	0.78	S	S	*	*			trans	-100.6	163.8	-177.1	23.7	0	0	0	0	112.3
26	P	34.6	Very low	25.9	Very low	129 Å²	129	158.4 Å²	158.4	84%	0.838	78%	0.781	S	S	*	*			trans	-92.7	164	-146.7	35.5	-38.7	0	0	0	116.6
27	A	23.8	Very low	25.8	Very low	102 Å²	102	163 Å²	163	84%	0.843	79%	0.788	S	S	*	*			trans	-126.7	116.8	169.7	0	0	0	0	0	112.9
28	H	25.5	Very low	25.3	Very low	161 Å²	161	162.8 Å²	162.8	75%	0.745	79%	0.789	S	S	*	*			trans	-10	167.4	157.2	-139.1	-107.2	0	0	0	122.7
29	F	24.7	Very low	25.5	Very low	188 Å²	188	160.1 Å²	160.1	83%	0.825	79%	0.794	S	S	*	*			trans	75.4	156.8	174	-58.5	-86.5	0	0	0	117.1
30	S	23.9	Very low	25.4	Very low	103 Å²	103	162.2 Å²	162.2	72%	0.72	80%	0.803	S	S	*	*			cis	-169.9	147.7	-31.7	-176.4	0	0	0	0	108.7
31	W	25	Very low	25.6	Very low	255 Å²	255	161.6 Å²	161.6	97%	0.966	81%	0.814	S	S	*	*			trans	-87.2	126.8	-179.2	-77.6	88.5	0	0	0	113
32	K	26.2	Very low	25.8	Very low	172 Å²	172	161.5 Å²	161.5	75%	0.748	82%	0.821	S	S	*	*			trans	-153.8	131.9	159.3	-129.3	175.5	179	-85.8	0	112.2
33	E	26.6	Very low	25.8	Very low	144 Å²	144	158.3 Å²	158.3	67%	0.673	82%	0.82	S	S	*	*			trans	47.3	118.5	156.5	-70.7	163.2	104.8	0	0	120.8
34	S	24.2	Very low	25.8	Very low	128 Å²	128	158.8 Å²	158.8	90%	0.895	82%	0.823	S	S	*	*			trans	-152.8	114.9	145.1	-80.1	0	0	0	0	110.4
35	Y	24.9	Very low	25.9	Very low	209 Å²	209	159.2 Å²	159.2	82%	0.82	83%	0.825	S	S	*	*			trans	-107.8	160.9	176.8	-107.1	-91.5	0	0	0	110.6
36	Y	26	Very low	26	Very low	207 Å²	207	158.1 Å²	158.1	81%	0.812	82%	0.818	S	S	*	*			trans	67.9	107.7	165.5	-73.8	-71.7	0	0	0	121.5
37	R	26.7	Very low	25.6	Very low	236 Å²	236	158.8 Å²	158.8	89%	0.891	82%	0.815	S	S	*	*				-164.4	119.3	121.5	-101.7	172.3	-177.1	-113.7	0.2	107.7
38	S	24.1	Very low	25.9	Very low	101 Å²	101	162.8 Å²	162.8	71%	0.706	82%	0.816	S	S	*	*				58.3	118.8	83.9	-54	0	0	0	0	112.1
39	T	28.3	Very low	26.1	Very low	146 Å²	146	164.7 Å²	164.7	90%	0.896	82%	0.822	S	S	*	*				-142.9	171.5	62.1	43.1	0	0	0	0	115.4
40	M	24.6	Very low	26.6	Very low	182 Å²	182	163.4 Å²	163.4	90%	0.897	82%	0.823	S	S	*	*			trans	-104	157.7	-179	-55.2	176.2	78.2	0	0	113.3
41	S	26.1	Very low	27.3	Very low	123 Å²	123	161.6 Å²	161.6	86%	0.86	81%	0.811	S	S	*	*			trans	-144.8	159.1	147.5	58.8	0	0	0	0	111.3
42	Q	27.1	Very low	28.3	Very low	184 Å²	184	154 Å²	154	86%	0.86	79%	0.794	S	S	*	*			trans	-98.4	163	-168.7	-68.4	170.7	5.2	0	0	111.3
43	S	24.8	Very low	29	Very low	98 Å²	98	151.7 Å²	151.7	69%	0.685	79%	0.786	S	S	*	*			cis	-177.5	139.3	-18.4	53	0	0	0	0	110.1
44	T	25.5	Very low	30.2	Very low	148 Å²	148	148.5 Å²	148.5	91%	0.908	78%	0.776	S	S	*	*			trans	-160.1	132.2	152.2	24	0	0	0	0	110.8
45	Q	27.5	Very low	31.4	Very low	188 Å²	188	149.7 Å²	149.7	88%	0.879	77%	0.765	S	S	*	*			trans	-85.7	161.3	168.9	-57.4	166.9	-11.7	0	0	108.4
46	T	25.7	Very low	32.2	Very low	116 Å²	116	145.6 Å²	145.6	71%	0.712	75%	0.754	S	S	*	*			cis	-144.5	176.2	25	51.8	0	0	0	0	108.9
47	N	27.6	Very low	32.9	Very low	144 Å²	144	142.8 Å²	142.8	77%	0.77	75%	0.748	S	S	*	*			cis	-137.6	149.5	8.7	-104.1	-45	0	0	0	109.3
48	E	29.1	Very low	34	Very low	186 Å²	186	136 Å²	136	87%	0.869	73%	0.728	S	S	*	*			trans	-95.5	136.2	174.5	-66	-179.7	148.9	0	0	111.7
49	F	30.6	Very low	35.1	Very low	200 Å²	200	137.2 Å²	137.2	88%	0.877	72%	0.717	S	S	*	*			trans	-146.5	156	157.2	-94.7	-82.7	0	0	0	107.7
50	L	34.5	Very low	35.5	Very low	161 Å²	161	135.1 Å²	135.1	84%	0.843	70%	0.7	S	S	*	*	S	Bend	trans	75.7	115.4	-165.6	-48.5	175.6	0	0	0	112.7
51	S	38.5	Very low	36.3	Very low	66 Å²	66	134.8 Å²	134.8	46%	0.462	69%	0.694	S	S	.	*			trans	-99.6	162.9	-177.4	67.9	0	0	0	0	112.2	E53 V54	S51-E53 WeakPolarHBondContact CB-OE2 3.43Å; S51-E53 PolarHBondContact O-N 3.08Å; S51-E53 VanDerWaalsContact O-N 3.16Å; S51-E53 PolarHBondContact OG-OE2 3.36Å; S51-V54 PolarHBondContact O-N 3.49Å
52	P	45.1	Very low	36.8	Very low	94 Å²	94	134.1 Å²	134.1	61%	0.61	68%	0.681	S	S	*	*	H	α-helix	trans	-59.2	-28.9	-172.8	-26.1	36.3	0	0	0	115.1	V54 F55 Q56	P52-V54 PolarHBondContact O-N 3.35Å; P52-F55 WeakPolarHBondContact O-CB 3.45Å; P52-F55 PolarHBondContact O-N 3.33Å; P52-Q56 PolarHBondContact O-N 2.98Å
53	E	42.6	Very low	37.4	Very low	125 Å²	125	131.9 Å²	131.9	58%	0.584	67%	0.67	S	S	*	*	H	α-helix	trans	-60.1	-31	-177	-59.6	78.3	-170.8	0	0	112.5	S51 F55 Q56 H57	S51-E53 WeakPolarHBondContact CB-OE2 3.43Å; S51-E53 PolarHBondContact O-N 3.08Å; S51-E53 VanDerWaalsContact O-N 3.16Å; S51-E53 PolarHBondContact OG-OE2 3.36Å; E53-F55 VanDerWaalsContact C-N 3.33Å; E53-Q56 PolarHBondContact O-N 3.13Å; E53-H57 PolarHBondContact O-N 3.03Å; E53-H57 VanDerWaalsContact O-N 3.13Å
54	V	51.7	Low	37.7	Very low	76 Å²	76	134.9 Å²	134.9	46%	0.461	67%	0.674	S	S	.	*	H	α-helix	trans	-65.5	-38.2	176.5	-176.7	0	0	0	0	111	S51 P52 H57 I58	S51-V54 PolarHBondContact O-N 3.49Å; P52-V54 PolarHBondContact O-N 3.35Å; V54-H57 PolarHBondContact O-N 3.46Å; V54-I58 HydrophobicContact CG1-CD1 4.32Å; V54-I58 WeakPolarHBondContact O-CG1 3.27Å; V54-I58 PolarHBondContact O-N 3.34Å
55	F	49.1	Very low	38.1	Very low	153 Å²	153	134 Å²	134	67%	0.671	67%	0.67	S	S	*	*	H	α-helix	trans	-71.7	-37.2	-179.7	-132.4	-84.2	0	0	0	111.5	P52 E53 I58 W59	P52-F55 WeakPolarHBondContact O-CB 3.45Å; P52-F55 PolarHBondContact O-N 3.33Å; E53-F55 VanDerWaalsContact C-N 3.33Å; F55-I58 PolarHBondContact O-N 2.97Å; F55-W59 PolarHBondContact O-N 3.25Å
56	Q	41.4	Very low	38.2	Very low	124 Å²	124	132.6 Å²	132.6	58%	0.579	67%	0.667	S	S	*	*	H	α-helix	trans	-59.6	-46.7	173.1	-137.1	73.5	62.5	0	0	111.3	P52 E53 I58 W59 D60	P52-Q56 PolarHBondContact O-N 2.98Å; E53-Q56 PolarHBondContact O-N 3.13Å; Q56-I58 VanDerWaalsContact C-N 3.29Å; Q56-I58 PolarHBondContact O-N 3.19Å; Q56-W59 WeakPolarHBondContact O-CB 3.34Å; Q56-W59 PolarHBondContact O-N 3.47Å; Q56-D60 PolarHBondContact O-N 2.91Å; Q56-D60 VanDerWaalsContact O-N 3.09Å
57	H	40.6	Very low	38.2	Very low	148 Å²	148	132.9 Å²	132.9	69%	0.685	67%	0.673	S	S	*	*	H	α-helix	trans	-65.9	-27.6	-179.1	-124.2	53.1	0	0	0	114.2	E53 V54	E53-H57 PolarHBondContact O-N 3.03Å; E53-H57 VanDerWaalsContact O-N 3.13Å; V54-H57 PolarHBondContact O-N 3.46Å
58	I	49.4	Very low	38.2	Very low	93 Å²	93	131.7 Å²	131.7	48%	0.477	68%	0.676	S	S	.	*	H	α-helix	trans	-73.4	-35.2	173.1	-67.9	165.3	0	0	0	110.5	V54 F55 Q56 L62	V54-I58 HydrophobicContact CG1-CD1 4.32Å; V54-I58 WeakPolarHBondContact O-CG1 3.27Å; V54-I58 PolarHBondContact O-N 3.34Å; F55-I58 PolarHBondContact O-N 2.97Å; Q56-I58 VanDerWaalsContact C-N 3.29Å; Q56-I58 PolarHBondContact O-N 3.19Å; I58-L62 HydrophobicContact CG2-CD1 4.48Å
59	W	46.4	Very low	38.1	Very low	127 Å²	127	129.2 Å²	129.2	48%	0.481	67%	0.673	S	S	.	*	H	α-helix	trans	-70.6	-46.7	-179.7	-152.7	-89.7	0	0	0	112.3	F55 Q56 F61 L62 E63	F55-W59 PolarHBondContact O-N 3.25Å; Q56-W59 WeakPolarHBondContact O-CB 3.34Å; Q56-W59 PolarHBondContact O-N 3.47Å; W59-F61 PolarHBondContact O-N 3.47Å; W59-F61 VanDerWaalsContact O-N 3.07Å; W59-L62 PolarHBondContact O-N 2.94Å; W59-E63 PolarHBondContact NE1-OE1 3.43Å
60	D	38.4	Very low	37.9	Very low	101 Å²	101	128.1 Å²	128.1	54%	0.54	67%	0.67	S	S	.	*	H	α-helix	trans	-58.1	-24	176.8	-69.1	-15.5	0	0	0	113.2	Q56	Q56-D60 PolarHBondContact O-N 2.91Å; Q56-D60 VanDerWaalsContact O-N 3.09Å
61	F	40.5	Very low	37.6	Very low	175 Å²	175	126 Å²	126	77%	0.768	67%	0.667	S	S	*	*	T	Hydrogen-bonded Turn	trans	-80.5	-18.1	177.9	-161.8	-93.9	0	0	0	113.4	W59	W59-F61 PolarHBondContact O-N 3.47Å; W59-F61 VanDerWaalsContact O-N 3.07Å
62	L	37.7	Very low	37	Very low	110 Å²	110	130.1 Å²	130.1	58%	0.576	68%	0.681	S	S	*	*	T	Hydrogen-bonded Turn	trans	-95.2	-17.1	-175	-69.6	169.4	0	0	0	113.9	I58 W59 Q64	I58-L62 HydrophobicContact CG2-CD1 4.48Å; W59-L62 PolarHBondContact O-N 2.94Å; L62-Q64 PolarHBondContact O-N 3.42Å
63	E	39.3	Very low	36	Very low	137 Å²	137	132.4 Å²	132.4	64%	0.64	69%	0.689	S	S	*	*			trans	-89.9	12.8	-173.7	-63.3	-166.4	169.5	0	0	114.9	W59 P65	W59-E63 PolarHBondContact NE1-OE1 3.43Å; E63-P65 WeakPolarHBondContact O-CD 3.29Å
64	Q	31.6	Very low	35.1	Very low	161 Å²	161	132.9 Å²	132.9	75%	0.752	70%	0.695	S	S	*	*			trans	-88.8	116.3	175	-64.5	-165.6	18.9	0	0	112.1	L62	L62-Q64 PolarHBondContact O-N 3.42Å
65	P	32.8	Very low	33.8	Very low	129 Å²	129	136.7 Å²	136.7	84%	0.838	71%	0.712	S	S	*	*			trans	-83.2	144.9	-172.4	32.8	-35.7	0	0	0	113.4	E63	E63-P65 WeakPolarHBondContact O-CD 3.29Å
66	I	29	Very low	32.7	Very low	158 Å²	158	137.6 Å²	137.6	81%	0.81	72%	0.716	S	S	*	*			trans	-122.4	119.1	173.8	-56.7	177.2	0	0	0	109.7
67	C	27	Very low	32	Very low	123 Å²	123	138.1 Å²	138.1	83%	0.831	73%	0.727	S	S	*	*			trans	58.7	129.3	172.2	-71.2	0	0	0	0	118.6
68	S	26.9	Very low	31.4	Very low	119 Å²	119	138.6 Å²	138.6	83%	0.832	74%	0.735	S	S	*	*			trans	-80.7	132.6	171.9	55.3	0	0	0	0	112.3
69	V	27	Very low	30.5	Very low	134 Å²	134	142.5 Å²	142.5	81%	0.812	75%	0.751	S	S	*	*			trans	-127.3	126.2	161.2	-178	0	0	0	0	107.2
70	Q	27	Very low	29.9	Very low	177 Å²	177	142.6 Å²	142.6	83%	0.827	77%	0.768	S	S	*	*	P	Polyproline II helix	trans	-79.6	137.8	173.9	-74.2	-174.8	-24.1	0	0	110.1
71	P	28.4	Very low	29.6	Very low	117 Å²	117	143.2 Å²	143.2	76%	0.76	78%	0.781	S	S	*	*	P	Polyproline II helix	trans	-71.1	152.7	171.7	31.5	-34.5	0	0	0	110.9
72	I	25.9	Very low	29.5	Very low	151 Å²	151	144.6 Å²	144.6	77%	0.774	79%	0.79	S	S	*	*	P	Polyproline II helix	trans	-94.3	118.9	170.1	-61.7	174.1	0	0	0	107.4
73	D	22.9	Very low	29.3	Very low	143 Å²	143	147.3 Å²	147.3	77%	0.765	81%	0.805	S	S	*	*	P	Polyproline II helix	trans	-68.5	133.3	173.2	-80.8	-43.9	0	0	0	111.3
74	L	25.1	Very low	29.4	Very low	135 Å²	135	143 Å²	143	71%	0.707	80%	0.797	S	S	*	*			trans	-118.4	99.6	172	-68.4	176.9	0	0	0	108.6	F76	L74-F76 HydrophobicContact CB-CE2 4.41Å; L74-F76 VanDerWaalsContact O-CD2 3.31Å; L74-F76 WeakPolarHBondContact O-CD2 3.13Å; L74-F76 PolarHBondContact O-N 3.44Å
75	N	23.6	Very low	30.1	Very low	156 Å²	156	139.8 Å²	139.8	83%	0.834	80%	0.798	S	S	*	*			trans	-68.9	125.6	174.5	-73.5	-56	0	0	0	110.3
76	F	25.8	Very low	30.5	Very low	172 Å²	172	138.8 Å²	138.8	75%	0.754	79%	0.789	S	S	*	*			trans	-95.2	135.2	167.5	-68.5	-94.1	0	0	0	109	L74	L74-F76 HydrophobicContact CB-CE2 4.41Å; L74-F76 VanDerWaalsContact O-CD2 3.31Å; L74-F76 WeakPolarHBondContact O-CD2 3.13Å; L74-F76 PolarHBondContact O-N 3.44Å
77	V	27.5	Very low	31	Very low	134 Å²	134	136.3 Å²	136.3	81%	0.812	78%	0.778	S	S	*	*			trans	-111.6	114.1	171.4	178	0	0	0	0	106.8
78	D	27.8	Very low	31.6	Very low	158 Å²	158	136.6 Å²	136.6	85%	0.845	77%	0.765	S	S	*	*			trans	-82.2	121.7	172.4	-73.2	-42.7	0	0	0	109.9
79	E	29.1	Very low	32.2	Very low	176 Å²	176	135.8 Å²	135.8	82%	0.822	75%	0.75	S	S	*	*			trans	-104.8	132.9	159	-93.1	-137.1	117.4	0	0	109.7	S81	E79-S81 PolarHBondContact O-N 2.99Å
80	P	33.8	Very low	32.7	Very low	128 Å²	128	134.6 Å²	134.6	83%	0.831	74%	0.736	S	S	*	*			trans	-81	118.7	176.1	31.9	-31.7	0	0	0	110.7
81	S	32.6	Very low	33.1	Very low	115 Å²	115	131.6 Å²	131.6	80%	0.804	72%	0.724	S	S	*	*			trans	-128.5	119.3	167.1	54.6	0	0	0	0	110.6	E79	E79-S81 PolarHBondContact O-N 2.99Å
82	E	38.7	Very low	33.6	Very low	204 Å²	204	128.6 Å²	128.6	95%	0.953	71%	0.706	S	S	*	*			trans	-78.8	122.1	169.6	-60.2	-179.9	116	0	0	109.5
83	D	34.5	Very low	34	Very low	167 Å²	167	127 Å²	127	89%	0.893	70%	0.697	S	S	*	*				-171.5	176.1	126.9	-155.4	-4.9	0	0	0	109.5
84	G	40.1	Very low	34.7	Very low	46 Å²	46	124.1 Å²	124.1	47%	0.474	68%	0.681	S	S	.	*			trans	-68.1	175.4	-172.3	0	0	0	0	0	117.2	T86	G84-T86 PolarHBondContact O-N 3.48Å; G84-T86 PolarHBondContact O-OG1 3.14Å
85	A	45.7	Very low	35.1	Very low	94 Å²	94	122 Å²	122	78%	0.777	68%	0.677	S	S	*	*			trans	-59.1	102.8	-170.7	0	0	0	0	0	113.6
86	T	41.2	Very low	35.8	Very low	107 Å²	107	119.6 Å²	119.6	66%	0.656	66%	0.663	S	S	*	*			trans	-130.3	142.4	177.3	52.2	0	0	0	0	110.9	G84 K88	G84-T86 PolarHBondContact O-N 3.48Å; G84-T86 PolarHBondContact O-OG1 3.14Å; T86-K88 PolarHBondContact O-N 3.43Å; T86-K88 VanDerWaalsContact O-N 3.09Å
87	N	40.3	Very low	36.1	Very low	106 Å²	106	119.6 Å²	119.6	57%	0.567	66%	0.658	S	S	*	*			trans	-79.3	90.3	177.3	-75.5	-78.5	0	0	0	109.9	I89	N87-I89 PolarHBondContact O-N 2.94Å
88	K	40.1	Very low	36.5	Very low	130 Å²	130	120.2 Å²	120.2	57%	0.565	65%	0.654	S	S	*	*			trans	-72.2	127.3	173.9	-161.5	-170.3	-173.9	-161.3	0	110.3	T86 E90 T649	T86-K88 PolarHBondContact O-N 3.43Å; T86-K88 VanDerWaalsContact O-N 3.09Å; K88-E90 VanDerWaalsContact CE-OE2 3.3Å; K88-E90 WeakPolarHBondContact CE-OE2 3.44Å; K88-E90 IonicContact NZ-OE2 2.66Å; K88-E90 PolarHBondContact NZ-OE2 3.38Å; K88-T649 PolarHBondContact O-N 3.36Å
89	I	38.5	Very low	36.8	Very low	101 Å²	101	120 Å²	120	52%	0.518	65%	0.648	S	S	.	*	E	Extended strand (participates in β ladder)	trans	-111.9	130.3	167.1	-64.2	172.9	0	0	0	107.2	N87 I91 L646 Q648	N87-I89 PolarHBondContact O-N 2.94Å; I89-I91 HydrophobicContact CG2-CG1 4.41Å; I89-L646 HydrophobicContact CG2-CD1 3.53Å; I89-Q648 HydrophobicContact CG1-CG 4.36Å
90	E	37.7	Very low	36.9	Very low	109 Å²	109	118.6 Å²	118.6	51%	0.509	65%	0.646	S	S	.	*	E	Extended strand (participates in β ladder)	trans	-126.5	137.7	179.9	-160.2	162.1	161.7	0	0	110.2	K88 R647	K88-E90 VanDerWaalsContact CE-OE2 3.3Å; K88-E90 WeakPolarHBondContact CE-OE2 3.44Å; K88-E90 IonicContact NZ-OE2 2.66Å; K88-E90 PolarHBondContact NZ-OE2 3.38Å; E90-R647 PolarHBondContact N-O 3.27Å; E90-R647 PolarHBondContact O-N 3.13Å
91	I	36.8	Very low	36.7	Very low	114 Å²	114	118.1 Å²	118.1	59%	0.585	65%	0.645	S	S	*	*	E	Extended strand (participates in β ladder)	trans	-130.1	110.9	-174.3	-57.3	174.7	0	0	0	107.6	I89 L646	I89-I91 HydrophobicContact CG2-CG1 4.41Å; I91-L646 HydrophobicContact CD1-CD1 4.31Å; I91-L646 HydrophobicContact CG1-CD1 3.82Å
92	S	37.6	Very low	36.6	Very low	55 Å²	55	119.8 Å²	119.8	39%	0.385	65%	0.646	S	S	.	*	E	Extended strand (participates in β ladder)	trans	-95.2	152.4	167.9	73.2	0	0	0	0	110.9	T645	S92-T645 PolarHBondContact N-O 3.17Å; S92-T645 PolarHBondContact O-N 3.22Å
93	M	34.3	Very low	36.2	Very low	116 Å²	116	117.8 Å²	117.8	57%	0.571	64%	0.64	S	S	*	*	E	Extended strand (participates in β ladder)	trans	-132.3	110	179.3	-178.3	-172.4	73.4	0	0	109.1	V642 F644	M93-V642 HydrophobicContact CG-CG1 3.63Å; M93-V642 HydrophobicContact SD-CG1 4.15Å; M93-F644 HydrophobicContact CG-CE1 4.28Å; M93-F644 HydrophobicContact SD-CE1 4.49Å
94	D	38.4	Very low	35.9	Very low	83 Å²	83	116 Å²	116	44%	0.444	64%	0.641	S	S	.	*	E	Extended strand (participates in β ladder)	trans	-108	127.6	177.4	-59.2	-61.1	0	0	0	109.6	R643	D94-R643 PolarHBondContact N-O 3.34Å; D94-R643 VanDerWaalsContact N-O 3.12Å; D94-R643 PolarHBondContact O-N 3.37Å
95	C	33.6	Very low	35.4	Very low	92 Å²	92	120.1 Å²	120.1	62%	0.622	65%	0.652	S	S	*	*	E	Extended strand (participates in β ladder)	trans	-103.7	119.2	178.4	-64.3	0	0	0	0	109.8
96	I	38.3	Very low	34.9	Very low	104 Å²	104	121.2 Å²	121.2	53%	0.533	65%	0.651	S	S	.	*	E	Extended strand (participates in β ladder)	trans	-117.4	123.9	177	-56.6	177.9	0	0	0	108.7	M98 A641	I96-M98 HydrophobicContact CG2-CG 4.33Å; I96-A641 PolarHBondContact N-O 3.18Å; I96-A641 VanDerWaalsContact N-O 3.12Å; I96-A641 PolarHBondContact O-N 3.5Å
97	R	32.3	Very low	34.1	Very low	173 Å²	173	124.5 Å²	124.5	65%	0.653	66%	0.661	S	S	*	*	E	Extended strand (participates in β ladder)	trans	-109.1	121.4	174.8	174.4	173.3	-79.9	-163.3	-8.1	108.9	V638 D640	R97-V638 HydrophobicContact CG-CG1 4.37Å; R97-D640 IonicContact CZ-OD1 3.65Å; R97-D640 IonicContact CZ-OD2 2.83Å; R97-D640 IonicContact NE-OD1 3.72Å; R97-D640 PolarHBondContact NE-OD1 3.3Å; R97-D640 IonicContact NE-OD2 3.32Å; R97-D640 IonicContact NH2-OD1 2.74Å; R97-D640 PolarHBondContact NH2-OD1 3.03Å; R97-D640 IonicContact NH2-OD2 3.37Å; R97-D640 PolarHBondContact NH2-OD2 2.94Å
98	M	35.5	Very low	33.4	Very low	147 Å²	147	130.1 Å²	130.1	72%	0.724	68%	0.675	S	S	*	*			trans	-107.1	147.7	172	-57.8	-161.4	-54	0	0	109.9	I96	I96-M98 HydrophobicContact CG2-CG 4.33Å
99	Q	33.5	Very low	33.3	Very low	154 Å²	154	128.5 Å²	128.5	72%	0.72	68%	0.678	S	S	*	*			trans	-135.5	125	-178.7	-175.6	168.4	12.1	0	0	108.6
100	D	32	Very low	32.6	Very low	145 Å²	145	130.6 Å²	130.6	78%	0.775	69%	0.685	S	S	*	*			trans	-69.4	157.9	173.5	-78.2	-50.1	0	0	0	110.8
101	S	28.8	Very low	32	Very low	118 Å²	118	134.6 Å²	134.6	83%	0.825	70%	0.697	S	S	*	*			trans	-154	98	177.8	-74.2	0	0	0	0	110.3
102	D	30	Very low	31.5	Very low	151 Å²	151	134.4 Å²	134.4	81%	0.807	70%	0.701	S	S	*	*			trans	-97.5	129.4	-177.9	-110.8	-29.1	0	0	0	112.7
103	L	31.6	Very low	30.9	Very low	161 Å²	161	139.4 Å²	139.4	84%	0.843	72%	0.724	S	S	*	*			trans	50.5	99.9	149.3	-64.3	167.3	0	0	0	120.1
104	S	27.4	Very low	30.5	Very low	129 Å²	129	141.4 Å²	141.4	90%	0.902	74%	0.736	S	S	*	*				-148.9	139.4	128	53.6	0	0	0	0	111.6
105	D	29.1	Very low	29.9	Very low	134 Å²	134	140 Å²	140	72%	0.717	74%	0.74	S	S	*	*			trans	-134.9	137.3	175.5	178.4	38.5	0	0	0	106.6	M107	D105-M107 PolarHBondContact OD1-N 3.27Å; D105-M107 VanDerWaalsContact OD1-N 3.1Å
106	P	36.2	Very low	29.5	Very low	116 Å²	116	143.6 Å²	143.6	75%	0.753	75%	0.753	S	S	*	*				-151.8	123.2	100.1	34.6	-15	0	0	0	115.3
107	M	23.9	Very low	28.9	Very low	176 Å²	176	145.9 Å²	145.9	87%	0.867	77%	0.765	S	S	*	*			trans	-161.3	115.8	138.9	-119.5	172.6	63.8	0	0	117	D105	D105-M107 PolarHBondContact OD1-N 3.27Å; D105-M107 VanDerWaalsContact OD1-N 3.1Å
108	W	25.5	Very low	28.7	Very low	225 Å²	225	144.7 Å²	144.7	85%	0.852	77%	0.772	S	S	*	*			trans	-92.3	172.3	155	-98.9	64.8	0	0	0	109.5
109	P	38.3	Very low	28.2	Very low	96 Å²	96	143 Å²	143	62%	0.623	78%	0.775	S	S	*	*			cis	-139.9	-165	19	33.2	-8.9	0	0	0	116.3
110	Q	23.8	Very low	28	Very low	145 Å²	145	143.5 Å²	143.5	68%	0.678	78%	0.779	S	S	*	*			trans	87.9	126.4	165	-44.2	180	14.1	0	0	114.6
111	Y	25.1	Very low	27.9	Very low	192 Å²	192	141.4 Å²	141.4	75%	0.753	77%	0.768	S	S	*	*			cis	-139.3	150.5	32.9	-114.6	-94.5	0	0	0	115.6
112	T	27	Very low	28.1	Very low	111 Å²	111	142.5 Å²	142.5	68%	0.681	76%	0.76	S	S	*	*			trans	25.3	118.6	157	49.6	0	0	0	0	121.5
113	N	24.6	Very low	27.9	Very low	159 Å²	159	142.2 Å²	142.2	85%	0.85	75%	0.754	S	S	*	*			trans	-109.4	136.4	151.1	-172.5	-15	0	0	0	108.5
114	L	26	Very low	28	Very low	159 Å²	159	141.5 Å²	141.5	83%	0.832	75%	0.749	S	S	*	*			trans	-157.8	116.5	178.3	-115.4	142.1	0	0	0	110.7
115	G	26.6	Very low	28.1	Very low	52 Å²	52	142.3 Å²	142.3	54%	0.536	74%	0.739	S	S	.	*			trans	-101.6	-163	165.2	0	0	0	0	0	111.7
116	L	25.1	Very low	28.1	Very low	169 Å²	169	142.7 Å²	142.7	89%	0.885	74%	0.741	S	S	*	*			trans	78.6	143.5	-173.4	-51.2	174.7	0	0	0	112.9
117	L	24.3	Very low	27.7	Very low	152 Å²	152	140.4 Å²	140.4	80%	0.796	74%	0.738	S	S	*	*			cis	-152.8	175.8	7.6	-128.5	164.7	0	0	0	112.2
118	N	29.3	Very low	27.8	Very low	147 Å²	147	138.5 Å²	138.5	79%	0.786	74%	0.742	S	S	*	*			trans	-86.9	161.7	-176.4	-76.3	-29.9	0	0	0	115.3
119	S	24.5	Very low	28	Very low	113 Å²	113	133.2 Å²	133.2	79%	0.79	74%	0.739	S	S	*	*			trans	-173.3	152.5	155.9	-81.8	0	0	0	0	108.4
120	M	29.7	Very low	27.4	Very low	164 Å²	164	133.8 Å²	133.8	81%	0.808	75%	0.746	S	S	*	*			cis	-168.3	165.6	-12.1	-121.7	-170.6	157.9	0	0	107
121	D	29.9	Very low	27.7	Very low	101 Å²	101	133.3 Å²	133.3	54%	0.54	75%	0.753	S	S	.	*			cis	-159.8	165.9	-3.8	-166.8	-159.5	0	0	0	110.5
122	Q	31.5	Very low	27.9	Very low	140 Å²	140	129.6 Å²	129.6	65%	0.654	76%	0.755	S	S	*	*			trans	64.2	151.4	159.1	-83.1	173.9	81.9	0	0	119.4
123	Q	27.5	Very low	28.7	Very low	146 Å²	146	129.3 Å²	129.3	68%	0.682	76%	0.755	S	S	*	*			cis	-156.8	136.6	17.2	-141.5	169.8	42.7	0	0	113.6
124	I	34	Very low	28.9	Very low	145 Å²	145	132.8 Å²	132.8	74%	0.744	76%	0.758	S	S	*	*			trans	60.7	140.8	146.8	-76.3	176.1	0	0	0	119.2
125	Q	28.9	Very low	29	Very low	146 Å²	146	131.7 Å²	131.7	68%	0.682	75%	0.753	S	S	*	*			cis	-159	172.5	-1.8	-129.3	-173.7	22.3	0	0	111.9
126	N	28.4	Very low	29.3	Very low	143 Å²	143	134.6 Å²	134.6	77%	0.765	76%	0.761	S	S	*	*			trans	54.5	139.8	155.4	-61.5	-10.8	0	0	0	121.2
127	G	27.8	Very low	29.7	Very low	68 Å²	68	133.3 Å²	133.3	70%	0.701	76%	0.755	S	S	*	*			cis	169.8	138.6	-9.1	0	0	0	0	0	115.9
128	S	27.1	Very low	30.3	Very low	135 Å²	135	135.4 Å²	135.4	94%	0.944	76%	0.76	S	S	*	*			trans	74.9	151.9	158.1	-59	0	0	0	0	121.2
129	S	27.9	Very low	30.4	Very low	114 Å²	114	132.4 Å²	132.4	80%	0.797	76%	0.756	S	S	*	*			trans	-147.2	163	-166.3	55.3	0	0	0	0	113.3
130	S	26.8	Very low	30.8	Very low	109 Å²	109	135.8 Å²	135.8	76%	0.762	76%	0.759	S	S	*	*			trans	-166.1	108.6	163.4	-82.9	0	0	0	0	108.5
131	T	28.9	Very low	31.1	Very low	134 Å²	134	135.8 Å²	135.8	82%	0.822	76%	0.762	S	S	*	*				73.4	121.1	79.9	60	0	0	0	0	115.8
132	S	29.5	Very low	31	Very low	114 Å²	114	136.4 Å²	136.4	80%	0.797	77%	0.774	S	S	*	*			trans	-74.2	-163.3	177.9	-30	0	0	0	0	113
133	P	44.5	Very low	31.4	Very low	106 Å²	106	136.9 Å²	136.9	69%	0.688	79%	0.786	S	S	*	*			cis	-135.3	-179.8	-10.9	41	-24.6	0	0	0	114.8
134	Y	28.9	Very low	31.7	Very low	232 Å²	232	135.9 Å²	135.9	91%	0.91	79%	0.79	S	S	*	*				-168.3	-178.8	123.3	-119.1	-87.1	0	0	0	111.4
135	N	28.3	Very low	31.7	Very low	135 Å²	135	132.9 Å²	132.9	72%	0.722	79%	0.787	S	S	*	*			trans	-127.3	168.7	-156.1	-172.2	40.3	0	0	0	114.5
136	T	31.7	Very low	32.1	Very low	114 Å²	114	131.5 Å²	131.5	70%	0.699	79%	0.791	S	S	*	*			trans	120.2	127.1	150.6	-42.8	0	0	0	0	115.3
137	D	35.3	Very low	32.3	Very low	142 Å²	142	129.1 Å²	129.1	76%	0.759	79%	0.786	S	S	*	*			trans	-63.5	148.5	172	-58.1	-100.5	0	0	0	113.9
138	H	35.5	Very low	32.9	Very low	196 Å²	196	132.1 Å²	132.1	91%	0.907	79%	0.793	S	S	*	*			trans	-159.9	152.4	136.6	-107.7	-72.7	0	0	0	110.5
139	A	32.8	Very low	33.8	Very low	84 Å²	84	135.5 Å²	135.5	69%	0.694	79%	0.786	S	S	*	*			trans	-102.9	170.1	-174.3	0	0	0	0	0	113.7
140	Q	31.7	Very low	34.3	Very low	184 Å²	184	134 Å²	134	86%	0.86	78%	0.781	S	S	*	*			trans	85.4	130.6	167.2	-54.3	-175.9	-13.7	0	0	118.4
141	N	35.2	Very low	34.9	Very low	164 Å²	164	136.3 Å²	136.3	88%	0.877	78%	0.779	S	S	*	*			trans	40.8	102.9	155.9	-65.2	-5.4	0	0	0	119.8
142	S	29.1	Very low	35.3	Very low	113 Å²	113	135.6 Å²	135.6	79%	0.79	78%	0.777	S	S	*	*			trans	-129.3	139.7	141.4	60.4	0	0	0	0	110.2
143	V	39.6	Very low	35.6	Very low	150 Å²	150	135.3 Å²	135.3	91%	0.909	78%	0.775	S	S	*	*			trans	-90.8	111	177.6	175.1	0	0	0	0	108.3
144	T	34.8	Very low	35.1	Very low	125 Å²	125	135.1 Å²	135.1	77%	0.767	78%	0.776	S	S	*	*	P	Polyproline II helix	trans	-91.5	124.4	175.8	-52.7	0	0	0	0	110.1
145	A	32.6	Very low	35.5	Very low	82 Å²	82	130.9 Å²	130.9	68%	0.678	78%	0.775	S	S	*	*	P	Polyproline II helix	trans	-67.3	143.8	177.1	0	0	0	0	0	111.7
146	P	38.7	Very low	36.1	Very low	118 Å²	118	132 Å²	132	77%	0.766	77%	0.774	S	S	*	*	P	Polyproline II helix	trans	-70.9	135.2	179.5	28.9	-34.3	0	0	0	111.5
147	S	32.2	Very low	36.4	Very low	93 Å²	93	133.6 Å²	133.6	65%	0.65	78%	0.778	S	S	*	*	P	Polyproline II helix	trans	-65.8	141.6	169.6	-69.2	0	0	0	0	110.6	Y149 A150	S147-Y149 PolarHBondContact O-N 3.33Å; S147-A150 PolarHBondContact O-N 2.92Å
148	P	40.3	Very low	36.5	Very low	130 Å²	130	131 Å²	131	84%	0.844	78%	0.776	S	S	*	*	T	Hydrogen-bonded Turn	trans	-74.2	24.2	-170.2	32.3	-38.4	0	0	0	115
149	Y	45.4	Very low	36.8	Very low	207 Å²	207	129.2 Å²	129.2	81%	0.812	77%	0.772	S	S	*	*	T	Hydrogen-bonded Turn	trans	-130.7	5.4	179.3	-101.7	-87.2	0	0	0	113.9	S147 Q151	S147-Y149 PolarHBondContact O-N 3.33Å; Y149-Q151 PolarHBondContact O-N 3.44Å; Y149-Q151 VanDerWaalsContact O-N 3.12Å
150	A	38.5	Very low	37.1	Very low	82 Å²	82	130.2 Å²	130.2	68%	0.678	77%	0.774	S	S	*	*			trans	-63.1	113.5	168.4	0	0	0	0	0	109.7	S147	S147-A150 PolarHBondContact O-N 2.92Å
151	Q	39.4	Very low	38.1	Very low	158 Å²	158	125.5 Å²	125.5	74%	0.738	76%	0.759	S	S	*	*			trans	-58.2	144.8	166.6	-65.9	-68	-79.3	0	0	109	Y149 S153	Y149-Q151 PolarHBondContact O-N 3.44Å; Y149-Q151 VanDerWaalsContact O-N 3.12Å; Q151-S153 PolarHBondContact O-N 2.94Å
152	P	37.5	Very low	39.2	Very low	119 Å²	119	121.8 Å²	121.8	77%	0.773	75%	0.746	S	S	*	*			trans	-63.2	114.5	178.7	26	-33.3	0	0	0	109.7	S154	P152-S154 PolarHBondContact O-N 3.32Å
153	S	35.4	Very low	41.1	Very low	108 Å²	108	121.3 Å²	121.3	76%	0.755	74%	0.741	S	S	*	*			trans	-56.3	113.1	171.2	-59.8	0	0	0	0	108.9	Q151 T155	Q151-S153 PolarHBondContact O-N 2.94Å; S153-T155 PolarHBondContact O-N 2.88Å; S153-T155 PolarHBondContact O-OG1 3.34Å
154	S	34.6	Very low	42.8	Very low	101 Å²	101	117.3 Å²	117.3	71%	0.706	72%	0.723	S	S	*	*			trans	-68.4	94.3	177.1	173.1	0	0	0	0	109.5	P152 F156	P152-S154 PolarHBondContact O-N 3.32Å; S154-F156 PolarHBondContact O-N 3.33Å
155	T	37.8	Very low	45.2	Very low	144 Å²	144	115.7 Å²	115.7	88%	0.883	71%	0.709	S	S	*	*			trans	-72.9	47.1	171.6	-29.8	0	0	0	0	111.7	S153	S153-T155 PolarHBondContact O-N 2.88Å; S153-T155 PolarHBondContact O-OG1 3.34Å
156	F	39.2	Very low	47.8	Very low	159 Å²	159	113 Å²	113	70%	0.697	68%	0.684	S	S	*	*	S	Bend	trans	-109.3	107.2	167.1	-162.3	-83.6	0	0	0	105.6	S154 A158	S154-F156 PolarHBondContact O-N 3.33Å; F156-A158 PolarHBondContact O-N 3Å
157	D	38.8	Very low	50.3	Low	147 Å²	147	109.7 Å²	109.7	79%	0.786	66%	0.664	S	S	*	*			trans	-59.2	102.4	172.8	-80.5	-57.2	0	0	0	108.3	L159	D157-L159 PolarHBondContact O-N 3.47Å
158	A	37.6	Very low	53.1	Low	87 Å²	87	109.5 Å²	109.5	72%	0.719	66%	0.656	S	S	*	*			trans	-78.7	65.7	-169.9	0	0	0	0	0	111.1	F156 S160	F156-A158 PolarHBondContact O-N 3Å; A158-S160 PolarHBondContact O-N 3.4Å
159	L	42	Very low	55.6	Low	158 Å²	158	107.5 Å²	107.5	83%	0.827	64%	0.641	S	S	*	*			trans	-59.5	76.8	149.2	-67.1	177.1	0	0	0	107.6	D157 P161	D157-L159 PolarHBondContact O-N 3.47Å; L159-P161 WeakPolarHBondContact O-CD 3.46Å
160	S	38	Very low	58.1	Low	105 Å²	105	100.2 Å²	100.2	73%	0.734	62%	0.616	S	S	*	*			trans	-56.1	112.5	179.1	179.2	0	0	0	0	107.5	A158 S162	A158-S160 PolarHBondContact O-N 3.4Å; S160-S162 PolarHBondContact O-N 2.91Å
161	P	53.2	Low	60.9	Low	86 Å²	86	101.2 Å²	101.2	56%	0.558	60%	0.603	S	S	*	*	P	Polyproline II helix	trans	-63.9	126.4	-165.8	23.6	-33.6	0	0	0	109.8	L159 I280	L159-P161 WeakPolarHBondContact O-CD 3.46Å; P161-I280 HydrophobicContact CB-CD1 3.85Å
162	S	59.1	Low	63.6	Low	85 Å²	85	96.3 Å²	96.3	59%	0.594	59%	0.585	S	S	*	*	P	Polyproline II helix	trans	-47.9	131.5	174.9	-70.1	0	0	0	0	110	S160 A164	S160-S162 PolarHBondContact O-N 2.91Å; S162-A164 PolarHBondContact O-N 2.95Å; S162-A164 VanDerWaalsContact O-N 3.12Å
163	P	68.3	Low	66.4	Low	104 Å²	104	91.6 Å²	91.6	68%	0.675	56%	0.558	S	S	*	*	P	Polyproline II helix	trans	-53.1	122.5	-174.5	-30	35.8	0	0	0	112.2	I165	P163-I165 CarbonylContact O-C 3.53Å; P163-I165 VanDerWaalsContact O-C 3.28Å; P163-I165 PolarHBondContact O-N 3.31Å
164	A	75.6	Confident	69.3	Low	66 Å²	66	90.6 Å²	90.6	55%	0.545	55%	0.549	S	S	.	.	S	Bend	trans	-56.7	-22.3	-172.9	0	0	0	0	0	113.8	S162 T281 R283	S162-A164 PolarHBondContact O-N 2.95Å; S162-A164 VanDerWaalsContact O-N 3.12Å; A164-T281 HydrophobicContact CB-CG2 4.23Å; A164-R283 PolarHBondContact O-NE 2.91Å; A164-R283 VanDerWaalsContact O-NE 3.15Å; A164-R283 PolarHBondContact O-NH2 2.98Å
165	I	85.6	Confident	72.2	Confident	91 Å²	91	86.9 Å²	86.9	47%	0.467	52%	0.521	S	S	.	.	S	Bend	trans	-109.9	110.8	164.7	-58.7	174.2	0	0	0	107.5	P163 V237 T238	P163-I165 CarbonylContact O-C 3.53Å; P163-I165 VanDerWaalsContact O-C 3.28Å; P163-I165 PolarHBondContact O-N 3.31Å; I165-V237 HydrophobicContact CD1-CG1 4.02Å; I165-V237 HydrophobicContact CG1-CG1 4.29Å; I165-V237 HydrophobicContact CG2-CG1 4.1Å; I165-V237 HydrophobicContact CG2-CG2 4Å; I165-T238 HydrophobicContact CD1-CG2 4.15Å; I165-T238 HydrophobicContact CG1-CG2 4.18Å
166	P	87.7	Confident	75	Confident	24 Å²	24	82.4 Å²	82.4	16%	0.156	50%	0.495	C	S	.	.			trans	-71.6	145.3	177.7	30.1	-35.7	0	0	0	111.1	N168 M228 V230 I324	P166-N168 PolarHBondContact O-N 3.43Å; P166-M228 HydrophobicContact CB-CE 3.63Å; P166-M228 HydrophobicContact CG-CE 3.75Å; P166-V230 HydrophobicContact CG-CG1 3.79Å; P166-I324 HydrophobicContact CB-CD1 4.06Å; P166-I324 HydrophobicContact CG-CD1 3.93Å
167	S	89.6	Confident	77.8	Confident	50 Å²	50	74.8 Å²	74.8	35%	0.35	46%	0.462	S	S	.	.			trans	-65	131.2	175.7	173.8	0	0	0	0	111.1	T169 R337	S167-T169 PolarHBondContact OG-N 3.04Å; S167-T169 PolarHBondContact OG-OG1 3.46Å; S167-R337 WeakPolarHBondContact O-CD 3.49Å; S167-R337 PolarHBondContact O-NE 2.95Å; S167-R337 PolarHBondContact OG-NH1 3.37Å
168	N	91.6	Very high	80.6	Confident	88 Å²	88	70.6 Å²	70.6	47%	0.471	44%	0.439	S	S	.	.			trans	-100.9	16.5	173.7	64.4	-5.2	0	0	0	112.7	P166 L322 C339	P166-N168 PolarHBondContact O-N 3.43Å; N168-L322 HydrophobicContact CB-CD1 3.83Å; N168-C339 VanDerWaalsContact C-SG 3.54Å; N168-C339 PolarHBondContact O-SG 3.01Å; N168-C339 VanDerWaalsContact O-SG 3.41Å
169	T	93.9	Very high	83.4	Confident	88 Å²	88	67.1 Å²	67.1	54%	0.54	41%	0.409	S	S	.	.	S	Bend	trans	-88.7	126.1	179.5	-43.3	0	0	0	0	109.9	S167 Y171 R337	S167-T169 PolarHBondContact OG-N 3.04Å; S167-T169 PolarHBondContact OG-OG1 3.46Å; T169-Y171 PolarHBondContact O-N 2.97Å; T169-R337 WeakPolarHBondContact O-CD 3.37Å; T169-R337 PolarHBondContact O-NH1 3.39Å
170	D	96.4	Very high	86	Confident	54 Å²	54	60.9 Å²	60.9	29%	0.289	38%	0.379	S	S	.	.			trans	-55.6	132.5	171	-75.9	-20.1	0	0	0	110	K199 R338 C339	D170-K199 IonicContact OD2-NZ 3.06Å; D170-K199 PolarHBondContact OD2-NZ 3.14Å; D170-R338 WeakPolarHBondContact OD1-CA 3.46Å; D170-C339 PolarHBondContact OD1-N 3.34Å
171	Y	97.5	Very high	88.7	Confident	103 Å²	103	57.1 Å²	57.1	40%	0.404	35%	0.349	S	S	.	.	B	Isolated β-bridge	trans	-143.3	99.7	-179.7	170.2	-114	0	0	0	108.4	T169 G173 G336 R337	T169-Y171 PolarHBondContact O-N 2.97Å; Y171-G173 VanDerWaalsContact CZ-CA 3.42Å; Y171-G173 PolarHBondContact O-N 3.13Å; Y171-G336 CarbonylContact O-C 3.51Å; Y171-G336 WeakPolarHBondContact O-CA 3.37Å; Y171-R337 CarbonylContact C-O 3.53Å; Y171-R337 PolarHBondContact N-O 3.39Å; Y171-R337 PolarHBondContact O-N 2.58Å
172	P	96.9	Very high	90.5	Very high	55 Å²	55	58.7 Å²	58.7	36%	0.357	35%	0.349	S	S	.	.			trans	-62.4	-31.1	179.3	-20.9	31.7	0	0	0	112.6	S176 F177	P172-S176 CarbonylContact O-C 3.55Å; P172-S176 PolarHBondContact O-N 3.3Å; P172-F177 WeakPolarHBondContact O-CB 3.42Å; P172-F177 PolarHBondContact O-N 3.2Å
173	G	96.3	Very high	91.7	Very high	20 Å²	20	64 Å²	64	21%	0.206	37%	0.365	C	S	.	.	T	Hydrogen-bonded Turn	trans	62.3	-173.9	-179.3	0	0	0	0	0	114.4	Y171 H175 S176 L335	Y171-G173 VanDerWaalsContact CZ-CA 3.42Å; Y171-G173 PolarHBondContact O-N 3.13Å; G173-H175 PolarHBondContact O-N 3.45Å; G173-H175 VanDerWaalsContact O-N 3.15Å; G173-S176 PolarHBondContact O-N 2.81Å; G173-S176 VanDerWaalsContact O-N 3.17Å; G173-L335 WeakPolarHBondContact CA-O 3.36Å
174	P	96	Very high	92.6	Very high	87 Å²	87	60.1 Å²	60.1	57%	0.565	34%	0.339	S	S	*	.	T	Hydrogen-bonded Turn	trans	-62.7	-19.6	-175.5	22.8	-33.5	0	0	0	114.5	L335	P174-L335 WeakPolarHBondContact CD-O 3.45Å
175	H	95.4	Very high	93.1	Very high	24 Å²	24	60.7 Å²	60.7	11%	0.111	34%	0.339	C	S	.	.	T	Hydrogen-bonded Turn	trans	-98.3	5.6	-179.6	-59.7	-78.6	0	0	0	114.1	G173 F177 V215 M216 T217 P218 L327	G173-H175 PolarHBondContact O-N 3.45Å; G173-H175 VanDerWaalsContact O-N 3.15Å; H175-F177 PolarHBondContact O-N 3.48Å; H175-V215 HydrophobicContact CB-CG1 3.69Å; H175-M216 PolarHBondContact O-N 3.31Å; H175-T217 WeakPolarHBondContact CA-OG1 3.41Å; H175-T217 PolarHBondContact ND1-O 2.98Å; H175-T217 PolarHBondContact ND1-OG1 3.12Å; H175-P218 PolarHBondContact CE1-O 3.22Å; H175-P218 PolarHBondContact ND1-O 3.15Å; H175-L327 HydrophobicContact CB-CD2 4.22Å
176	S	96.4	Very high	93.3	Very high	49 Å²	49	60 Å²	60	34%	0.343	34%	0.339	S	S	.	.	T	Hydrogen-bonded Turn	trans	50.6	42.5	-175	-54.3	0	0	0	0	113	P172 G173 D178 M216	P172-S176 CarbonylContact O-C 3.55Å; P172-S176 PolarHBondContact O-N 3.3Å; G173-S176 PolarHBondContact O-N 2.81Å; G173-S176 VanDerWaalsContact O-N 3.17Å; S176-D178 PolarHBondContact O-N 3.31Å; S176-M216 WeakPolarHBondContact OG-CE 3.25Å
177	F	97.9	Very high	93.5	Very high	0 Å²	0	60.7 Å²	60.7	0%	0	35%	0.348	C	S	.	.			trans	-53.6	129.3	-179	-179.5	-107.3	0	0	0	111.7	P172 H175 V179 I213 K214 V215 I225 V325 L327 R338	P172-F177 WeakPolarHBondContact O-CB 3.42Å; P172-F177 PolarHBondContact O-N 3.2Å; H175-F177 PolarHBondContact O-N 3.48Å; F177-V179 HydrophobicContact CE1-CG2 3.99Å; F177-V179 HydrophobicContact CZ-CG2 3.9Å; F177-I213 HydrophobicContact CD2-CG2 4.46Å; F177-I213 HydrophobicContact CE2-CG2 3.69Å; F177-I213 HydrophobicContact CZ-CG2 4.49Å; F177-K214 WeakPolarHBondContact CA-O 3.42Å; F177-V215 HydrophobicContact CD2-CG2 4.23Å; F177-I225 HydrophobicContact CE2-CD1 3.85Å; F177-I225 HydrophobicContact CZ-CD1 4.45Å; F177-V325 HydrophobicContact CZ-CG1 3.98Å; F177-L327 HydrophobicContact CD2-CB 3.58Å; F177-L327 HydrophobicContact CD2-CD2 4.01Å; F177-L327 HydrophobicContact CD2-CG 4.36Å; F177-L327 HydrophobicContact CE2-CB 3.69Å; F177-L327 HydrophobicContact CG-CB 4.04Å; F177-L327 HydrophobicContact CZ-CB 4.26Å; F177-R338 HydrophobicContact CD1-CG 3.94Å; F177-R338 HydrophobicContact CE1-CB 4.27Å; F177-R338 HydrophobicContact CE1-CG 4.02Å; F177-R338 PolarHBondContact O-NE 3.08Å; F177-R338 PolarHBondContact O-NH2 2.96Å
178	D	97.3	Very high	93.5	Very high	58 Å²	58	67.8 Å²	67.8	31%	0.31	37%	0.372	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-143.8	160.9	175	-161.4	33	0	0	0	112.8	S176 K214 R338	S176-D178 PolarHBondContact O-N 3.31Å; D178-K214 HydrophobicContact CB-CB 4.26Å; D178-K214 PolarHBondContact N-O 3.29Å; D178-K214 PolarHBondContact O-N 3.36Å; D178-R338 IonicContact OD1-CZ 2.64Å; D178-R338 IonicContact OD1-NE 3.27Å; D178-R338 PolarHBondContact OD1-NE 3.49Å; D178-R338 VanDerWaalsContact OD1-NE 3.17Å; D178-R338 IonicContact OD1-NH1 2.68Å; D178-R338 IonicContact OD1-NH2 3.54Å; D178-R338 PolarHBondContact OD1-NH2 3.12Å
179	V	97.5	Very high	93.5	Very high	14 Å²	14	68.5 Å²	68.5	9%	0.085	38%	0.384	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-129.3	109.2	-177.6	175.1	0	0	0	0	109.1	F177 F181 I211 Q212 I213 V325 R338 F340	F177-V179 HydrophobicContact CE1-CG2 3.99Å; F177-V179 HydrophobicContact CZ-CG2 3.9Å; V179-F181 HydrophobicContact CG1-CE2 4.19Å; V179-F181 HydrophobicContact CG1-CZ 4.29Å; V179-I211 HydrophobicContact CG1-CG2 3.37Å; V179-Q212 WeakPolarHBondContact CA-O 3.08Å; V179-I213 HydrophobicContact CG2-CD1 4.2Å; V179-V325 HydrophobicContact CG2-CB 4.23Å; V179-V325 HydrophobicContact CG2-CG1 4.27Å; V179-R338 HydrophobicContact CB-CB 4.08Å; V179-R338 HydrophobicContact CB-CG 4.33Å; V179-R338 HydrophobicContact CG2-CB 3.8Å; V179-R338 HydrophobicContact CG2-CG 4.06Å; V179-F340 HydrophobicContact CG1-CD1 4.5Å; V179-F340 HydrophobicContact CG1-CE1 4.27Å
180	S	95.8	Very high	93.5	Very high	27 Å²	27	65 Å²	65	19%	0.189	36%	0.364	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-108.7	164.4	179.3	64.8	0	0	0	0	112.5	Q212	S180-Q212 PolarHBondContact N-O 3.42Å; S180-Q212 WeakPolarHBondContact O-CB 3.31Å; S180-Q212 PolarHBondContact O-N 3Å; S180-Q212 WeakPolarHBondContact OG-CB 3.31Å; S180-Q212 PolarHBondContact OG-OE1 2.92Å
181	F	95.4	Very high	93.5	Very high	26 Å²	26	64.9 Å²	64.9	11%	0.114	37%	0.365	C	S	.	.			trans	-130.3	133.1	-179.9	-61.3	-96	0	0	0	108	V179 Y194 L201 I211 F340	V179-F181 HydrophobicContact CG1-CE2 4.19Å; V179-F181 HydrophobicContact CG1-CZ 4.29Å; F181-Y194 HydrophobicContact CB-CD1 3.96Å; F181-Y194 HydrophobicContact CB-CG 3.84Å; F181-Y194 HydrophobicContact CD1-CD2 4.06Å; F181-Y194 HydrophobicContact CD1-CG 4.13Å; F181-Y194 AromaticContact CD2-CD1 3.55Å; F181-Y194 HydrophobicContact CD2-CD1 3.55Å; F181-Y194 AromaticContact CD2-CD2 3.52Å; F181-Y194 HydrophobicContact CD2-CD2 3.52Å; F181-Y194 AromaticContact CD2-CE1 3.61Å; F181-Y194 HydrophobicContact CD2-CE1 3.61Å; F181-Y194 AromaticContact CD2-CE2 3.61Å; F181-Y194 HydrophobicContact CD2-CE2 3.61Å; F181-Y194 AromaticContact CD2-CG 3.5Å; F181-Y194 HydrophobicContact CD2-CG 3.5Å; F181-Y194 VanDerWaalsContact CD2-CG 3.5Å; F181-Y194 AromaticContact CD2-CZ 3.63Å; F181-Y194 HydrophobicContact CE1-CD2 4.07Å; F181-Y194 HydrophobicContact CE1-CE2 4.5Å; F181-Y194 HydrophobicContact CE2-CD1 4.29Å; F181-Y194 AromaticContact CE2-CD2 3.56Å; F181-Y194 HydrophobicContact CE2-CD2 3.56Å; F181-Y194 HydrophobicContact CE2-CE1 4.05Å; F181-Y194 AromaticContact CE2-CE2 3.3Å; F181-Y194 HydrophobicContact CE2-CE2 3.3Å; F181-Y194 HydrophobicContact CE2-CG 4.05Å; F181-Y194 AromaticContact CE2-CZ 3.55Å; F181-Y194 AromaticContact CG-CD1 3.9Å; F181-Y194 HydrophobicContact CG-CD1 3.9Å; F181-Y194 AromaticContact CG-CD2 3.79Å; F181-Y194 HydrophobicContact CG-CD2 3.79Å; F181-Y194 HydrophobicContact CG-CE1 4.41Å; F181-Y194 HydrophobicContact CG-CE2 4.34Å; F181-Y194 AromaticContact CG-CG 3.54Å; F181-Y194 HydrophobicContact CG-CG 3.54Å; F181-Y194 AromaticContact CZ-CD2 3.84Å; F181-Y194 HydrophobicContact CZ-CD2 3.84Å; F181-Y194 AromaticContact CZ-CE2 3.8Å; F181-Y194 HydrophobicContact CZ-CE2 3.8Å; F181-L201 HydrophobicContact CD1-CD1 4.21Å; F181-L201 HydrophobicContact CE1-CB 4.47Å; F181-L201 HydrophobicContact CE1-CD1 4.03Å; F181-L201 HydrophobicContact CE1-CD2 4.24Å; F181-L201 HydrophobicContact CE1-CG 4.48Å; F181-I211 HydrophobicContact CD1-CG1 4.27Å; F181-I211 HydrophobicContact CE1-CD1 3.8Å; F181-I211 HydrophobicContact CE1-CG1 3.77Å; F181-I211 HydrophobicContact CE1-CG2 4.22Å; F181-I211 HydrophobicContact CZ-CD1 4.34Å; F181-I211 HydrophobicContact CZ-CG2 4.38Å; F181-F340 HydrophobicContact CE1-CE2 4.49Å; F181-F340 HydrophobicContact CE1-CZ 4.45Å; F181-F340 HydrophobicContact CE2-CD1 4.42Å; F181-F340 AromaticContact CZ-CD1 3.9Å; F181-F340 HydrophobicContact CZ-CD1 3.9Å; F181-F340 HydrophobicContact CZ-CD2 4.05Å; F181-F340 AromaticContact CZ-CE1 3.88Å; F181-F340 HydrophobicContact CZ-CE1 3.88Å; F181-F340 HydrophobicContact CZ-CE2 4.03Å; F181-F340 AromaticContact CZ-CG 4Å; F181-F340 HydrophobicContact CZ-CG 4Å; F181-F340 AromaticContact CZ-CZ 3.95Å; F181-F340 HydrophobicContact CZ-CZ 3.95Å
182	Q	90.7	Very high	93.5	Very high	119 Å²	119	61.6 Å²	61.6	56%	0.556	35%	0.352	S	S	*	.			trans	-60.4	145.1	174.8	-178.1	177.3	-2.3	0	0	110.3	S184 W192	Q182-S184 PolarHBondContact O-N 3.02Å; Q182-S184 VanDerWaalsContact O-N 3.12Å; Q182-S184 PolarHBondContact O-OG 3.07Å; Q182-W192 HydrophobicContact CB-CH2 4.14Å; Q182-W192 VanDerWaalsContact O-CH2 3.28Å; Q182-W192 WeakPolarHBondContact O-CH2 3.42Å
183	Q	84.5	Confident	93.5	Very high	198 Å²	198	59 Å²	59	93%	0.925	34%	0.335	S	S	*	.			trans	-62	119.2	-178.8	-168.4	168.7	11.6	0	0	110.4
184	S	85.9	Confident	93.6	Very high	21 Å²	21	59.8 Å²	59.8	15%	0.147	33%	0.332	C	S	.	.			trans	-117.9	137.8	-166.6	35.8	0	0	0	0	111.7	Q182 W192 T193 Y194	Q182-S184 PolarHBondContact O-N 3.02Å; Q182-S184 VanDerWaalsContact O-N 3.12Å; Q182-S184 PolarHBondContact O-OG 3.07Å; S184-W192 VanDerWaalsContact CB-CZ3 3.49Å; S184-W192 WeakPolarHBondContact OG-CZ3 3.44Å; S184-T193 WeakPolarHBondContact OG-CA 3.31Å; S184-T193 PolarHBondContact OG-OG1 3.46Å; S184-Y194 PolarHBondContact OG-N 3.24Å
185	S	87.1	Confident	93.6	Very high	78 Å²	78	55.7 Å²	55.7	55%	0.545	31%	0.306	S	S	.	.			trans	-64.5	149.8	176.6	-177	0	0	0	0	112	A187 A190	S185-A187 WeakPolarHBondContact OG-CB 3.48Å; S185-A187 PolarHBondContact OG-N 3.01Å; S185-A190 VanDerWaalsContact O-CB 3.23Å; S185-A190 WeakPolarHBondContact O-CB 3.4Å
186	T	90.2	Very high	93.5	Very high	76 Å²	76	59.7 Å²	59.7	47%	0.466	33%	0.332	S	S	.	.			trans	-100.1	15.3	171.6	61	0	0	0	0	112.7	G349	T186-G349 WeakPolarHBondContact O-CA 3.37Å
187	A	91.9	Very high	93.2	Very high	40 Å²	40	61.8 Å²	61.8	33%	0.331	34%	0.336	S	S	.	.	S	Bend	trans	-62.7	159.8	177.2	0	0	0	0	0	112.8	S185 S189 A190	S185-A187 WeakPolarHBondContact OG-CB 3.48Å; S185-A187 PolarHBondContact OG-N 3.01Å; A187-S189 PolarHBondContact O-N 3.16Å; A187-S189 VanDerWaalsContact O-N 3.16Å; A187-A190 VanDerWaalsContact O-CB 3.31Å; A187-A190 WeakPolarHBondContact O-CB 3.47Å; A187-A190 PolarHBondContact O-N 3.39Å
188	K	88.1	Confident	93	Very high	198 Å²	198	63.1 Å²	63.1	86%	0.861	34%	0.343	S	S	*	.	T	Hydrogen-bonded Turn	trans	-59.1	-27.2	178	-175.7	-179.2	170.4	-172.5	0	113.1
189	S	91.5	Very high	92.9	Very high	103 Å²	103	65.7 Å²	65.7	72%	0.72	35%	0.352	S	S	*	.	T	Hydrogen-bonded Turn	trans	-83.9	-7.4	177.8	46.8	0	0	0	0	114.5	A187 T191	A187-S189 PolarHBondContact O-N 3.16Å; A187-S189 VanDerWaalsContact O-N 3.16Å; S189-T191 PolarHBondContact O-N 3.27Å
190	A	94.2	Very high	92.9	Very high	14 Å²	14	65.9 Å²	65.9	12%	0.116	35%	0.351	C	S	.	.			trans	-68.2	114.3	-179.2	0	0	0	0	0	111.1	S185 A187 W192 P348	S185-A190 VanDerWaalsContact O-CB 3.23Å; S185-A190 WeakPolarHBondContact O-CB 3.4Å; A187-A190 VanDerWaalsContact O-CB 3.31Å; A187-A190 WeakPolarHBondContact O-CB 3.47Å; A187-A190 PolarHBondContact O-N 3.39Å; A190-W192 PolarHBondContact O-N 3.33Å; A190-P348 WeakPolarHBondContact O-CD 3.24Å; A190-P348 WeakPolarHBondContact O-CG 3.4Å
191	T	96.3	Very high	93.1	Very high	52 Å²	52	64.6 Å²	64.6	32%	0.319	34%	0.342	S	S	.	.	S	Bend	trans	-69.4	-23.6	176.8	53.5	0	0	0	0	112.4	S189 C203 Q204 K207	S189-T191 PolarHBondContact O-N 3.27Å; T191-C203 CarbonylContact O-C 3.43Å; T191-C203 WeakPolarHBondContact O-CA 3.41Å; T191-Q204 PolarHBondContact O-N 3.25Å; T191-K207 HydrophobicContact CG2-CG 4.26Å
192	W	97.5	Very high	93.2	Very high	34 Å²	34	63.3 Å²	63.3	13%	0.129	34%	0.337	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-150.8	157.7	171.4	64.7	-87.6	0	0	0	111.2	Q182 S184 A190 L201 Y202 C203 P210	Q182-W192 HydrophobicContact CB-CH2 4.14Å; Q182-W192 VanDerWaalsContact O-CH2 3.28Å; Q182-W192 WeakPolarHBondContact O-CH2 3.42Å; S184-W192 VanDerWaalsContact CB-CZ3 3.49Å; S184-W192 WeakPolarHBondContact OG-CZ3 3.44Å; A190-W192 PolarHBondContact O-N 3.33Å; W192-L201 HydrophobicContact CE3-CD1 4.34Å; W192-Y202 CarbonylContact C-O 3.57Å; W192-Y202 WeakPolarHBondContact CA-O 3.41Å; W192-C203 HydrophobicContact CB-CB 4.07Å; W192-P210 HydrophobicContact CH2-CG 4.25Å; W192-P210 HydrophobicContact CZ2-CG 3.56Å
193	T	97.6	Very high	93.6	Very high	0 Å²	0	57.7 Å²	57.7	0%	0	31%	0.31	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-155.3	146.8	167.7	-175.6	0	0	0	0	110.6	S184 Y202 P348 R352	S184-T193 WeakPolarHBondContact OG-CA 3.31Å; S184-T193 PolarHBondContact OG-OG1 3.46Å; T193-Y202 PolarHBondContact N-O 3.04Å; T193-Y202 PolarHBondContact O-N 2.85Å; T193-P348 HydrophobicContact CG2-CB 3.95Å; T193-R352 HydrophobicContact CG2-CB 3.95Å; T193-R352 HydrophobicContact CG2-CG 4.35Å; T193-R352 PolarHBondContact OG1-NH1 3.29Å
194	Y	97.8	Very high	94.2	Very high	38 Å²	38	50.5 Å²	50.5	15%	0.149	28%	0.277	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-111.4	129.6	177.2	-176.6	-106.2	0	0	0	111.6	F181 S184 T196 K199 K200 L201 F340 R352	F181-Y194 HydrophobicContact CB-CD1 3.96Å; F181-Y194 HydrophobicContact CB-CG 3.84Å; F181-Y194 HydrophobicContact CD1-CD2 4.06Å; F181-Y194 HydrophobicContact CD1-CG 4.13Å; F181-Y194 AromaticContact CD2-CD1 3.55Å; F181-Y194 HydrophobicContact CD2-CD1 3.55Å; F181-Y194 AromaticContact CD2-CD2 3.52Å; F181-Y194 HydrophobicContact CD2-CD2 3.52Å; F181-Y194 AromaticContact CD2-CE1 3.61Å; F181-Y194 HydrophobicContact CD2-CE1 3.61Å; F181-Y194 AromaticContact CD2-CE2 3.61Å; F181-Y194 HydrophobicContact CD2-CE2 3.61Å; F181-Y194 AromaticContact CD2-CG 3.5Å; F181-Y194 HydrophobicContact CD2-CG 3.5Å; F181-Y194 VanDerWaalsContact CD2-CG 3.5Å; F181-Y194 AromaticContact CD2-CZ 3.63Å; F181-Y194 HydrophobicContact CE1-CD2 4.07Å; F181-Y194 HydrophobicContact CE1-CE2 4.5Å; F181-Y194 HydrophobicContact CE2-CD1 4.29Å; F181-Y194 AromaticContact CE2-CD2 3.56Å; F181-Y194 HydrophobicContact CE2-CD2 3.56Å; F181-Y194 HydrophobicContact CE2-CE1 4.05Å; F181-Y194 AromaticContact CE2-CE2 3.3Å; F181-Y194 HydrophobicContact CE2-CE2 3.3Å; F181-Y194 HydrophobicContact CE2-CG 4.05Å; F181-Y194 AromaticContact CE2-CZ 3.55Å; F181-Y194 AromaticContact CG-CD1 3.9Å; F181-Y194 HydrophobicContact CG-CD1 3.9Å; F181-Y194 AromaticContact CG-CD2 3.79Å; F181-Y194 HydrophobicContact CG-CD2 3.79Å; F181-Y194 HydrophobicContact CG-CE1 4.41Å; F181-Y194 HydrophobicContact CG-CE2 4.34Å; F181-Y194 AromaticContact CG-CG 3.54Å; F181-Y194 HydrophobicContact CG-CG 3.54Å; F181-Y194 AromaticContact CZ-CD2 3.84Å; F181-Y194 HydrophobicContact CZ-CD2 3.84Å; F181-Y194 AromaticContact CZ-CE2 3.8Å; F181-Y194 HydrophobicContact CZ-CE2 3.8Å; S184-Y194 PolarHBondContact OG-N 3.24Å; Y194-T196 HydrophobicContact CD1-CG2 4.13Å; Y194-T196 HydrophobicContact CE1-CG2 4.03Å; Y194-K199 WeakPolarHBondContact OH-CA 3.34Å; Y194-K200 VanDerWaalsContact CD2-C 3.46Å; Y194-K200 WeakPolarHBondContact CD2-O 3.47Å; Y194-L201 HydrophobicContact CD2-CB 4.17Å; Y194-F340 HydrophobicContact CE2-CB 4.38Å; Y194-R352 VanDerWaalsContact O-CZ 3.29Å; Y194-R352 PolarHBondContact O-NH1 2.68Å
195	S	96.4	Very high	94.7	Very high	0 Å²	0	51 Å²	51	0%	0	28%	0.278	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-95.4	117	170.3	-178.6	0	0	0	0	110.1	L198 K199 K200 E356	S195-L198 WeakPolarHBondContact OG-CG 3.43Å; S195-L198 PolarHBondContact OG-N 3.09Å; S195-K199 WeakPolarHBondContact O-CA 3.32Å; S195-K199 PolarHBondContact O-N 3.25Å; S195-K199 VanDerWaalsContact O-N 3.1Å; S195-K200 PolarHBondContact N-O 2.96Å; S195-K200 PolarHBondContact O-N 3.24Å; S195-E356 VanDerWaalsContact CB-OE1 3.24Å; S195-E356 WeakPolarHBondContact CB-OE1 3.15Å; S195-E356 PolarHBondContact OG-OE1 2.69Å
196	T	93.2	Very high	95	Very high	109 Å²	109	48.3 Å²	48.3	67%	0.669	26%	0.26	S	S	*	.	T	Hydrogen-bonded Turn	trans	-69.5	-42.2	173.7	45.2	0	0	0	0	111.7	Y194 L198 K199	Y194-T196 HydrophobicContact CD1-CG2 4.13Å; Y194-T196 HydrophobicContact CE1-CG2 4.03Å; T196-L198 VanDerWaalsContact C-N 3.25Å; T196-L198 PolarHBondContact O-N 3.06Å; T196-K199 PolarHBondContact O-N 3.24Å
197	E	91.7	Very high	95.2	Very high	92 Å²	92	49.8 Å²	49.8	43%	0.43	26%	0.26	S	S	.	.	T	Hydrogen-bonded Turn	trans	-55.1	-40.3	175.8	-175.4	-179.8	176.8	0	0	111.9
198	L	93.6	Very high	95.4	Very high	29 Å²	29	50 Å²	50	15%	0.152	26%	0.258	C	S	.	.	T	Hydrogen-bonded Turn	trans	-97.3	-3.2	-176.5	-55.7	-175.4	0	0	0	114.3	S195 T196 K200 Y202 D355 E356 I359	S195-L198 WeakPolarHBondContact OG-CG 3.43Å; S195-L198 PolarHBondContact OG-N 3.09Å; T196-L198 VanDerWaalsContact C-N 3.25Å; T196-L198 PolarHBondContact O-N 3.06Å; L198-K200 VanDerWaalsContact C-N 3.25Å; L198-K200 HydrophobicContact CB-CB 3.75Å; L198-K200 PolarHBondContact O-N 3.05Å; L198-Y202 WeakPolarHBondContact CD1-OH 3.48Å; L198-D355 HydrophobicContact CD1-CB 3.73Å; L198-E356 HydrophobicContact CD1-CG 3.75Å; L198-E356 HydrophobicContact CG-CG 4.08Å; L198-I359 HydrophobicContact CD2-CB 4.48Å; L198-I359 HydrophobicContact CD2-CD1 3.36Å; L198-I359 HydrophobicContact CD2-CG1 4.48Å
199	K	94.9	Very high	95.8	Very high	111 Å²	111	40.7 Å²	40.7	48%	0.483	22%	0.217	S	C	.	.	T	Hydrogen-bonded Turn	trans	43.3	49.9	-165.1	-67.3	-170.7	171.3	-169.3	0	112.5	D170 Y194 S195 T196 E341	D170-K199 IonicContact OD2-NZ 3.06Å; D170-K199 PolarHBondContact OD2-NZ 3.14Å; Y194-K199 WeakPolarHBondContact OH-CA 3.34Å; S195-K199 WeakPolarHBondContact O-CA 3.32Å; S195-K199 PolarHBondContact O-N 3.25Å; S195-K199 VanDerWaalsContact O-N 3.1Å; T196-K199 PolarHBondContact O-N 3.24Å; K199-E341 PolarHBondContact O-N 3.16Å
200	K	97.6	Very high	96	Very high	18 Å²	18	37 Å²	37	8%	0.078	19%	0.19	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-138.7	124.4	-163.4	-173.8	166.6	171.1	175.2	0	114.4	Y194 S195 L198 Y202 E341 D355	Y194-K200 VanDerWaalsContact CD2-C 3.46Å; Y194-K200 WeakPolarHBondContact CD2-O 3.47Å; S195-K200 PolarHBondContact N-O 2.96Å; S195-K200 PolarHBondContact O-N 3.24Å; L198-K200 VanDerWaalsContact C-N 3.25Å; L198-K200 HydrophobicContact CB-CB 3.75Å; L198-K200 PolarHBondContact O-N 3.05Å; K200-Y202 HydrophobicContact CB-CE2 3.96Å; K200-Y202 HydrophobicContact CD-CE1 4.43Å; K200-Y202 HydrophobicContact CD-CE2 3.91Å; K200-Y202 VanDerWaalsContact CD-OH 3.24Å; K200-Y202 WeakPolarHBondContact CD-OH 3.39Å; K200-Y202 VanDerWaalsContact CE-CZ 3.49Å; K200-Y202 VanDerWaalsContact CE-OH 3.27Å; K200-Y202 WeakPolarHBondContact CE-OH 3.36Å; K200-Y202 HydrophobicContact CG-CD2 4.23Å; K200-Y202 HydrophobicContact CG-CE2 3.58Å; K200-E341 CarbonylContact C-O 3.57Å; K200-E341 VanDerWaalsContact CA-O 3.29Å; K200-E341 WeakPolarHBondContact CA-O 3.02Å; K200-E341 HydrophobicContact CB-CB 4.17Å; K200-E341 HydrophobicContact CD-CB 4.12Å; K200-E341 HydrophobicContact CD-CG 3.92Å; K200-E341 WeakPolarHBondContact CD-OE1 3.35Å; K200-E341 WeakPolarHBondContact CE-OE1 3.27Å; K200-E341 HydrophobicContact CG-CB 3.9Å; K200-E341 HydrophobicContact CG-CG 4.07Å; K200-E341 IonicContact NZ-OE1 3.83Å; K200-E341 PolarHBondContact NZ-OE1 3.43Å; K200-D355 IonicContact NZ-OD2 3.21Å; K200-D355 PolarHBondContact NZ-OD2 3.45Å
201	L	98.4	Very high	96.2	Very high	0 Å²	0	36.3 Å²	36.3	0%	0	19%	0.185	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-85.3	133.1	171.9	-178.5	64.6	0	0	0	110.8	F181 W192 Y194 I211 F306 F340 E341 A342 R343	F181-L201 HydrophobicContact CD1-CD1 4.21Å; F181-L201 HydrophobicContact CE1-CB 4.47Å; F181-L201 HydrophobicContact CE1-CD1 4.03Å; F181-L201 HydrophobicContact CE1-CD2 4.24Å; F181-L201 HydrophobicContact CE1-CG 4.48Å; W192-L201 HydrophobicContact CE3-CD1 4.34Å; Y194-L201 HydrophobicContact CD2-CB 4.17Å; L201-I211 HydrophobicContact CD2-CD1 4.39Å; L201-F306 HydrophobicContact CD2-CE2 3.75Å; L201-F306 HydrophobicContact CD2-CZ 4.02Å; L201-F340 HydrophobicContact CB-CD2 3.99Å; L201-F340 HydrophobicContact CB-CE2 3.97Å; L201-F340 HydrophobicContact CD2-CE2 3.89Å; L201-E341 PolarHBondContact N-O 2.89Å; L201-A342 CarbonylContact O-C 3.55Å; L201-A342 WeakPolarHBondContact O-CA 3.24Å; L201-R343 PolarHBondContact O-N 3.42Å
202	Y	98.4	Very high	96.3	Very high	0 Å²	0	34.9 Å²	34.9	0%	0	18%	0.175	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-117.1	127.7	169.1	-60.8	-104.9	0	0	0	107.6	W192 T193 L198 K200 R343 D351 R352 D355	W192-Y202 CarbonylContact C-O 3.57Å; W192-Y202 WeakPolarHBondContact CA-O 3.41Å; T193-Y202 PolarHBondContact N-O 3.04Å; T193-Y202 PolarHBondContact O-N 2.85Å; L198-Y202 WeakPolarHBondContact CD1-OH 3.48Å; K200-Y202 HydrophobicContact CB-CE2 3.96Å; K200-Y202 HydrophobicContact CD-CE1 4.43Å; K200-Y202 HydrophobicContact CD-CE2 3.91Å; K200-Y202 VanDerWaalsContact CD-OH 3.24Å; K200-Y202 WeakPolarHBondContact CD-OH 3.39Å; K200-Y202 VanDerWaalsContact CE-CZ 3.49Å; K200-Y202 VanDerWaalsContact CE-OH 3.27Å; K200-Y202 WeakPolarHBondContact CE-OH 3.36Å; K200-Y202 HydrophobicContact CG-CD2 4.23Å; K200-Y202 HydrophobicContact CG-CE2 3.58Å; Y202-R343 WeakPolarHBondContact CA-O 3.43Å; Y202-R343 HydrophobicContact CD1-CB 4.11Å; Y202-R343 HydrophobicContact CD1-CG 4.2Å; Y202-R343 HydrophobicContact CE1-CB 4.37Å; Y202-R343 HydrophobicContact CE1-CG 4.43Å; Y202-D351 HydrophobicContact CD1-CB 3.92Å; Y202-D351 VanDerWaalsContact CE1-C 3.46Å; Y202-D351 HydrophobicContact CE1-CB 4.15Å; Y202-D351 WeakPolarHBondContact CE1-O 3.41Å; Y202-R352 HydrophobicContact CD1-CB 4.17Å; Y202-R352 HydrophobicContact CD2-CB 3.75Å; Y202-R352 HydrophobicContact CD2-CG 4.13Å; Y202-R352 HydrophobicContact CE1-CB 4.22Å; Y202-R352 HydrophobicContact CE2-CB 3.83Å; Y202-R352 HydrophobicContact CE2-CG 3.98Å; Y202-R352 HydrophobicContact CG-CB 3.95Å; Y202-D355 WeakPolarHBondContact CE1-OD2 3.43Å; Y202-D355 WeakPolarHBondContact OH-CB 3.41Å; Y202-D355 VanDerWaalsContact OH-CG 3.3Å; Y202-D355 PolarHBondContact OH-OD2 3.1Å
203	C	98.1	Very high	96.3	Very high	0 Å²	0	33.4 Å²	33.4	0%	0	17%	0.169	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-147.2	155.2	-175.6	52.7	0	0	0	0	112.2	T191 W192 C209 R343 I344 C345	T191-C203 CarbonylContact O-C 3.43Å; T191-C203 WeakPolarHBondContact O-CA 3.41Å; W192-C203 HydrophobicContact CB-CB 4.07Å; C203-C209 WeakPolarHBondContact CB-SG 3.38Å; C203-R343 PolarHBondContact N-O 2.82Å; C203-R343 VanDerWaalsContact N-O 3.17Å; C203-I344 CarbonylContact O-C 3.57Å; C203-I344 VanDerWaalsContact O-CA 3.26Å; C203-I344 WeakPolarHBondContact O-CA 3.29Å; C203-C345 PolarHBondContact O-N 2.96Å; C203-C345 VanDerWaalsContact O-O 3.09Å
204	Q	97.8	Very high	96.2	Very high	47 Å²	47	36.3 Å²	36.3	22%	0.22	18%	0.182	C	C	.	.			trans	-81.6	149.6	170.6	-72.9	-179	-21.3	0	0	111	T191 A206 K207 C345 A346 P348	T191-Q204 PolarHBondContact O-N 3.25Å; Q204-A206 PolarHBondContact O-N 3.37Å; Q204-K207 HydrophobicContact CB-CB 4.14Å; Q204-K207 HydrophobicContact CB-CG 3.75Å; Q204-K207 PolarHBondContact O-N 3.46Å; Q204-C345 WeakPolarHBondContact CA-O 3.33Å; Q204-A346 PolarHBondContact NE2-O 3.27Å; Q204-P348 HydrophobicContact CG-CG 3.93Å
205	I	95.9	Very high	96.2	Very high	32 Å²	32	35.5 Å²	35.5	16%	0.164	18%	0.181	C	C	.	.	T	Hydrogen-bonded Turn	trans	-56.2	136.5	174.6	-173.5	174.1	0	0	0	111.2	K207 H247 F306 I344	I205-K207 PolarHBondContact O-N 2.97Å; I205-H247 VanDerWaalsContact CD1-NE2 3.33Å; I205-H247 WeakPolarHBondContact CD1-NE2 3.48Å; I205-F306 WeakPolarHBondContact CA-O 3.39Å; I205-I344 HydrophobicContact CB-CG2 4.02Å
206	A	94.2	Very high	96	Very high	21 Å²	21	42.4 Å²	42.4	17%	0.174	22%	0.215	C	C	.	.	T	Hydrogen-bonded Turn	trans	57.1	6.2	179	0	0	0	0	0	116.5	Q204 F253 N305 F306 M307	Q204-A206 PolarHBondContact O-N 3.37Å; A206-F253 HydrophobicContact CB-CD1 3.53Å; A206-F253 HydrophobicContact CB-CE1 3.59Å; A206-N305 PolarHBondContact O-ND2 2.96Å; A206-F306 PolarHBondContact N-O 2.77Å; A206-M307 HydrophobicContact CB-CE 3.73Å; A206-M307 HydrophobicContact CB-SD 4.05Å
207	K	95.2	Very high	96	Very high	107 Å²	107	40.2 Å²	40.2	47%	0.465	20%	0.202	S	C	.	.			trans	-88.1	140.4	175.4	-63.5	-53	-175.9	-173.8	0	111.8	T191 Q204 I205 C209	T191-K207 HydrophobicContact CG2-CG 4.26Å; Q204-K207 HydrophobicContact CB-CB 4.14Å; Q204-K207 HydrophobicContact CB-CG 3.75Å; Q204-K207 PolarHBondContact O-N 3.46Å; I205-K207 PolarHBondContact O-N 2.97Å; K207-C209 PolarHBondContact O-N 3.29Å; K207-C209 PolarHBondContact O-SG 2.92Å; K207-C209 VanDerWaalsContact O-SG 3.34Å
208	T	95.4	Very high	96.1	Very high	46 Å²	46	41.2 Å²	41.2	28%	0.282	22%	0.216	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-61.1	124.6	179.5	-31.6	0	0	0	0	110.8	E268 L303 N305	T208-E268 WeakPolarHBondContact CB-OE2 3.5Å; T208-E268 HydrophobicContact CG2-CB 4.42Å; T208-E268 WeakPolarHBondContact CG2-OE2 3.38Å; T208-E268 PolarHBondContact OG1-OE2 3.41Å; T208-L303 HydrophobicContact CG2-CB 3.76Å; T208-L303 HydrophobicContact CG2-CD1 4.23Å; T208-L303 HydrophobicContact CG2-CD2 4.14Å; T208-L303 HydrophobicContact CG2-CG 4.26Å; T208-N305 PolarHBondContact N-ND2 2.81Å
209	C	96.6	Very high	96.1	Very high	1 Å²	1	40.8 Å²	40.8	1%	0.007	22%	0.215	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-118.8	103.4	177.4	-59.8	0	0	0	0	108.1	C203 K207 I211 Y304 F306	C203-C209 WeakPolarHBondContact CB-SG 3.38Å; K207-C209 PolarHBondContact O-N 3.29Å; K207-C209 PolarHBondContact O-SG 2.92Å; K207-C209 VanDerWaalsContact O-SG 3.34Å; C209-I211 PolarHBondContact O-N 2.97Å; C209-Y304 WeakPolarHBondContact CA-O 3.29Å; C209-Y304 VanDerWaalsContact CB-O 3.28Å; C209-Y304 WeakPolarHBondContact CB-O 3.47Å; C209-Y304 PolarHBondContact N-O 3.43Å; C209-Y304 PolarHBondContact O-N 2.62Å; C209-F306 HydrophobicContact CB-CE2 4.24Å
210	P	96.5	Very high	96.2	Very high	25 Å²	25	38.8 Å²	38.8	16%	0.162	21%	0.213	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-70.5	121.7	175.6	28.8	-32.5	0	0	0	109.9	W192 T301 L303	W192-P210 HydrophobicContact CH2-CG 4.25Å; W192-P210 HydrophobicContact CZ2-CG 3.56Å; P210-T301 HydrophobicContact CB-CG2 3.6Å; P210-L303 HydrophobicContact CB-CD2 3.88Å
211	I	97.7	Very high	96	Very high	1 Å²	1	47.5 Å²	47.5	1%	0.005	25%	0.254	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-116.8	127.2	175.8	-57.8	-169.5	0	0	0	108	V179 F181 L201 C209 I213 T301 V302 Y304 F340	V179-I211 HydrophobicContact CG1-CG2 3.37Å; F181-I211 HydrophobicContact CD1-CG1 4.27Å; F181-I211 HydrophobicContact CE1-CD1 3.8Å; F181-I211 HydrophobicContact CE1-CG1 3.77Å; F181-I211 HydrophobicContact CE1-CG2 4.22Å; F181-I211 HydrophobicContact CZ-CD1 4.34Å; F181-I211 HydrophobicContact CZ-CG2 4.38Å; L201-I211 HydrophobicContact CD2-CD1 4.39Å; C209-I211 PolarHBondContact O-N 2.97Å; I211-I213 HydrophobicContact CG2-CD1 4.47Å; I211-T301 WeakPolarHBondContact O-CA 3.43Å; I211-V302 PolarHBondContact N-O 3.22Å; I211-V302 PolarHBondContact O-N 2.88Å; I211-Y304 HydrophobicContact CB-CD2 3.89Å; I211-Y304 HydrophobicContact CB-CE2 4.12Å; I211-Y304 HydrophobicContact CD1-CD2 3.66Å; I211-Y304 HydrophobicContact CD1-CE2 4.26Å; I211-Y304 HydrophobicContact CD1-CG 4.43Å; I211-Y304 HydrophobicContact CG1-CD2 3.84Å; I211-Y304 HydrophobicContact CG1-CE2 4.49Å; I211-F340 HydrophobicContact CD1-CE1 4.34Å; I211-F340 HydrophobicContact CD1-CE2 4.47Å; I211-F340 HydrophobicContact CD1-CZ 3.68Å
212	Q	97.3	Very high	95.8	Very high	22 Å²	22	49.5 Å²	49.5	10%	0.103	28%	0.275	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-92	123.8	-176.4	-60.6	170.7	-33.6	0	0	109.3	V179 S180 F299	V179-Q212 WeakPolarHBondContact CA-O 3.08Å; S180-Q212 PolarHBondContact N-O 3.42Å; S180-Q212 WeakPolarHBondContact O-CB 3.31Å; S180-Q212 PolarHBondContact O-N 3Å; S180-Q212 WeakPolarHBondContact OG-CB 3.31Å; S180-Q212 PolarHBondContact OG-OE1 2.92Å; Q212-F299 HydrophobicContact CB-CB 4.11Å; Q212-F299 HydrophobicContact CB-CD2 3.87Å; Q212-F299 HydrophobicContact CB-CG 4.04Å; Q212-F299 HydrophobicContact CG-CD2 3.61Å; Q212-F299 HydrophobicContact CG-CE2 3.85Å; Q212-F299 HydrophobicContact CG-CG 4.15Å; Q212-F299 VanDerWaalsContact NE2-CE2 3.31Å; Q212-F299 VanDerWaalsContact NE2-CZ 3.26Å
213	I	97.8	Very high	95.7	Very high	3 Å²	3	49.7 Å²	49.7	2%	0.015	28%	0.277	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-96.6	119.4	175.8	-53.3	-56.6	0	0	0	108.1	F177 V179 I211 V215 I225 F299 T300 V302 V325	F177-I213 HydrophobicContact CD2-CG2 4.46Å; F177-I213 HydrophobicContact CE2-CG2 3.69Å; F177-I213 HydrophobicContact CZ-CG2 4.49Å; V179-I213 HydrophobicContact CG2-CD1 4.2Å; I211-I213 HydrophobicContact CG2-CD1 4.47Å; I213-V215 HydrophobicContact CG2-CG2 4.26Å; I213-I225 HydrophobicContact CD1-CG2 4.08Å; I213-I225 HydrophobicContact CG1-CG2 4.42Å; I213-I225 HydrophobicContact CG2-CD1 3.81Å; I213-I225 HydrophobicContact CG2-CG1 4.23Å; I213-F299 VanDerWaalsContact O-CA 3.29Å; I213-F299 WeakPolarHBondContact O-CA 3.36Å; I213-F299 WeakPolarHBondContact O-CB 3.48Å; I213-T300 PolarHBondContact N-O 3.11Å; I213-T300 PolarHBondContact O-N 2.89Å; I213-V302 HydrophobicContact CG1-CG2 3.92Å; I213-V325 HydrophobicContact CD1-CG1 4.36Å
214	K	96.7	Very high	95.7	Very high	60 Å²	60	50.9 Å²	50.9	26%	0.261	28%	0.284	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-110.3	134.2	178.4	-78.2	-169.4	165.9	-148.9	0	110.7	F177 D178 E298 F299	F177-K214 WeakPolarHBondContact CA-O 3.42Å; D178-K214 HydrophobicContact CB-CB 4.26Å; D178-K214 PolarHBondContact N-O 3.29Å; D178-K214 PolarHBondContact O-N 3.36Å; K214-E298 IonicContact NZ-OE2 3.21Å; K214-E298 PolarHBondContact NZ-OE2 3.33Å; K214-F299 HydrophobicContact CG-CB 3.79Å
215	V	96.1	Very high	95.7	Very high	21 Å²	21	48.9 Å²	48.9	13%	0.127	27%	0.274	C	S	.	.			trans	-144.6	124.2	-179.2	-169.3	0	0	0	0	107.7	H175 F177 I213 T217 Y290 L327	H175-V215 HydrophobicContact CB-CG1 3.69Å; F177-V215 HydrophobicContact CD2-CG2 4.23Å; I213-V215 HydrophobicContact CG2-CG2 4.26Å; V215-T217 VanDerWaalsContact CG1-O 3.25Å; V215-T217 WeakPolarHBondContact CG1-O 3.25Å; V215-Y290 HydrophobicContact CB-CE2 4.34Å; V215-Y290 HydrophobicContact CG2-CD2 4.42Å; V215-Y290 HydrophobicContact CG2-CE2 3.55Å; V215-L327 HydrophobicContact CG1-CD2 4.43Å
216	M	93.7	Very high	95.8	Very high	146 Å²	146	49.6 Å²	49.6	72%	0.719	28%	0.275	S	S	*	.	S	Bend	trans	-87.6	-27.8	-172	-167.8	168.3	74.3	0	0	113.3	H175 S176	H175-M216 PolarHBondContact O-N 3.31Å; S176-M216 WeakPolarHBondContact OG-CE 3.25Å
217	T	93.1	Very high	96	Very high	63 Å²	63	48.7 Å²	48.7	39%	0.387	27%	0.267	S	S	.	.	S	Bend	trans	-128.2	132.1	173.5	57.5	0	0	0	0	109.2	H175 V215	H175-T217 WeakPolarHBondContact CA-OG1 3.41Å; H175-T217 PolarHBondContact ND1-O 2.98Å; H175-T217 PolarHBondContact ND1-OG1 3.12Å; V215-T217 VanDerWaalsContact CG1-O 3.25Å; V215-T217 WeakPolarHBondContact CG1-O 3.25Å
218	P	92.6	Very high	96.1	Very high	113 Å²	113	44.9 Å²	44.9	73%	0.734	25%	0.252	S	S	*	.	P	Polyproline II helix	trans	-53.1	134.9	-176.1	-29.4	35.9	0	0	0	113.2	H175	H175-P218 PolarHBondContact CE1-O 3.22Å; H175-P218 PolarHBondContact ND1-O 3.15Å
219	P	95.4	Very high	96.2	Very high	19 Å²	19	43 Å²	43	12%	0.123	24%	0.241	C	C	.	.	P	Polyproline II helix	trans	-77.1	166.5	176.9	34.1	-34.2	0	0	0	111.4	A223 Y290 L327 L335	P219-A223 HydrophobicContact CB-CB 3.82Å; P219-A223 HydrophobicContact CG-CB 3.93Å; P219-Y290 HydrophobicContact CG-CD1 3.36Å; P219-Y290 HydrophobicContact CG-CE1 3.49Å; P219-Y290 VanDerWaalsContact CG-CE1 3.49Å; P219-Y290 HydrophobicContact CG-CG 3.92Å; P219-L327 HydrophobicContact CB-CD1 4.32Å; P219-L327 HydrophobicContact CB-CD2 4.25Å; P219-L327 HydrophobicContact CG-CD1 4.31Å; P219-L335 HydrophobicContact CB-CD1 4.29Å
220	P	94.9	Very high	96.2	Very high	69 Å²	69	43.2 Å²	43.2	45%	0.448	24%	0.241	S	C	.	.	P	Polyproline II helix	trans	-52.7	147.6	172	-26	35.3	0	0	0	112.9	G222 A223 L335	P220-G222 PolarHBondContact O-N 3.34Å; P220-A223 VanDerWaalsContact O-CB 3.29Å; P220-A223 WeakPolarHBondContact O-CB 3.27Å; P220-A223 PolarHBondContact O-N 2.92Å; P220-A223 VanDerWaalsContact O-N 3.11Å; P220-L335 HydrophobicContact CG-CD1 4.34Å
221	Q	93.8	Very high	96.3	Very high	201 Å²	201	42.2 Å²	42.2	94%	0.939	24%	0.235	S	C	*	.	T	Hydrogen-bonded Turn	trans	-59.1	134	-179.9	-172.7	179.5	5.3	0	0	111.2
222	G	94	Very high	96.2	Very high	43 Å²	43	46.8 Å²	46.8	44%	0.443	25%	0.254	S	S	.	.	T	Hydrogen-bonded Turn	trans	80.6	13.5	-176.1	0	0	0	0	0	114.5	P220	P220-G222 PolarHBondContact O-N 3.34Å
223	A	97.1	Very high	96	Very high	4 Å²	4	50.2 Å²	50.2	3%	0.033	27%	0.269	C	S	.	.			trans	-59.1	154.6	164.9	0	0	0	0	0	112	P219 P220 Y290 L327 E328	P219-A223 HydrophobicContact CB-CB 3.82Å; P219-A223 HydrophobicContact CG-CB 3.93Å; P220-A223 VanDerWaalsContact O-CB 3.29Å; P220-A223 WeakPolarHBondContact O-CB 3.27Å; P220-A223 PolarHBondContact O-N 2.92Å; P220-A223 VanDerWaalsContact O-N 3.11Å; A223-Y290 WeakPolarHBondContact O-CB 3.4Å; A223-Y290 PolarHBondContact O-N 2.92Å; A223-L327 HydrophobicContact CB-CD1 4.13Å; A223-E328 CarbonylContact C-O 3.56Å; A223-E328 WeakPolarHBondContact CA-O 3.48Å; A223-E328 WeakPolarHBondContact CB-O 3.32Å
224	V	97.6	Very high	95.7	Very high	25 Å²	25	54.2 Å²	54.2	15%	0.152	30%	0.303	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-134.8	151.1	-175.6	-62.4	0	0	0	0	111.4	L287 V288 L327 E328	V224-L287 HydrophobicContact CG2-CD2 4.24Å; V224-V288 CarbonylContact C-O 3.58Å; V224-V288 WeakPolarHBondContact CA-O 3.47Å; V224-L327 WeakPolarHBondContact O-CA 3.36Å; V224-E328 HydrophobicContact CG2-CB 3.89Å; V224-E328 PolarHBondContact N-O 3.26Å; V224-E328 PolarHBondContact O-N 2.92Å
225	I	98.2	Very high	95.6	Very high	4 Å²	4	57.2 Å²	57.2	2%	0.021	32%	0.318	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-101.3	112.8	170	-56.6	-55.9	0	0	0	108.5	F177 I213 L287 V288 Y290 V325 T326 L327	F177-I225 HydrophobicContact CE2-CD1 3.85Å; F177-I225 HydrophobicContact CZ-CD1 4.45Å; I213-I225 HydrophobicContact CD1-CG2 4.08Å; I213-I225 HydrophobicContact CG1-CG2 4.42Å; I213-I225 HydrophobicContact CG2-CD1 3.81Å; I213-I225 HydrophobicContact CG2-CG1 4.23Å; I225-L287 CarbonylContact O-C 3.6Å; I225-L287 WeakPolarHBondContact O-CA 3.4Å; I225-V288 PolarHBondContact N-O 3.18Å; I225-V288 PolarHBondContact O-N 2.82Å; I225-Y290 HydrophobicContact CD1-CD2 4.09Å; I225-Y290 HydrophobicContact CG1-CD2 4.28Å; I225-V325 HydrophobicContact CG2-CG1 3.74Å; I225-T326 CarbonylContact C-O 3.55Å; I225-T326 WeakPolarHBondContact CA-O 3.28Å; I225-L327 HydrophobicContact CD1-CB 4.15Å; I225-L327 HydrophobicContact CD1-CD1 3.6Å; I225-L327 HydrophobicContact CD1-CG 4.48Å
226	R	97.8	Very high	95.4	Very high	48 Å²	48	57.8 Å²	57.8	18%	0.181	32%	0.319	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-99.6	135.3	174.2	-175.8	-166.7	-56.6	-87	-2	110.1	S285 V286 L287 V325 T326 E328	R226-S285 PolarHBondContact NH1-OG 3.37Å; R226-S285 VanDerWaalsContact NH1-OG 3.09Å; R226-V286 CarbonylContact C-O 3.55Å; R226-V286 WeakPolarHBondContact CA-O 3.3Å; R226-L287 HydrophobicContact CB-CG 4.38Å; R226-L287 HydrophobicContact CG-CG 4.32Å; R226-V325 CarbonylContact O-C 3.52Å; R226-V325 VanDerWaalsContact O-CA 3.28Å; R226-V325 WeakPolarHBondContact O-CA 3.43Å; R226-T326 PolarHBondContact N-O 2.79Å; R226-T326 PolarHBondContact O-N 3.04Å; R226-E328 WeakPolarHBondContact CD-OE1 3.42Å; R226-E328 IonicContact CZ-OE2 3.71Å; R226-E328 VanDerWaalsContact NE-CD 3.3Å; R226-E328 IonicContact NE-OE1 3.92Å; R226-E328 PolarHBondContact NE-OE1 3.34Å; R226-E328 IonicContact NE-OE2 3.21Å; R226-E328 PolarHBondContact NE-OE2 3.31Å; R226-E328 IonicContact NH2-OE2 2.71Å; R226-E328 PolarHBondContact NH2-OE2 3.25Å
227	A	98.3	Very high	95.3	Very high	1 Å²	1	52.1 Å²	52.1	1%	0.008	29%	0.292	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-116.2	128.8	167.4	0	0	0	0	0	110.6	I265 S285 V286 Y304 I323 I324	A227-I265 HydrophobicContact CB-CD1 4.21Å; A227-S285 WeakPolarHBondContact O-CA 3.38Å; A227-S285 WeakPolarHBondContact O-CB 3.4Å; A227-V286 HydrophobicContact CB-CG1 4.12Å; A227-V286 PolarHBondContact N-O 3.31Å; A227-V286 PolarHBondContact O-N 2.86Å; A227-Y304 HydrophobicContact CB-CE1 3.76Å; A227-I323 HydrophobicContact CB-CG2 4.46Å; A227-I324 WeakPolarHBondContact CA-O 3.36Å
228	M	97.6	Very high	95.2	Very high	27 Å²	27	53.9 Å²	53.9	13%	0.133	30%	0.303	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-135.9	126.3	-177.9	177.4	171.8	51	0	0	111.3	P166 V230 R283 I324	P166-M228 HydrophobicContact CB-CE 3.63Å; P166-M228 HydrophobicContact CG-CE 3.75Å; M228-V230 HydrophobicContact CG-CG1 4.37Å; M228-R283 HydrophobicContact SD-CB 4.05Å; M228-I324 HydrophobicContact CE-CD1 4.36Å; M228-I324 PolarHBondContact N-O 3.01Å; M228-I324 PolarHBondContact O-N 2.63Å
229	P	97.7	Very high	95.3	Very high	8 Å²	8	52.1 Å²	52.1	5%	0.052	29%	0.285	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-86.3	136.4	174.7	33.3	-28.3	0	0	0	111.8	V241 L264 I265 Q284 I321 L322 I323	P229-V241 HydrophobicContact CB-CB 4.01Å; P229-V241 HydrophobicContact CB-CG1 4.11Å; P229-V241 HydrophobicContact CB-CG2 4.35Å; P229-V241 HydrophobicContact CG-CB 4.08Å; P229-V241 HydrophobicContact CG-CG1 4.39Å; P229-L264 HydrophobicContact CB-CD2 4.18Å; P229-L264 HydrophobicContact CG-CB 4.49Å; P229-L264 HydrophobicContact CG-CD2 4.4Å; P229-I265 HydrophobicContact CB-CD1 4.15Å; P229-I265 HydrophobicContact CG-CD1 4.03Å; P229-I265 HydrophobicContact CG-CG1 4.18Å; P229-Q284 VanDerWaalsContact CD-O 3.28Å; P229-Q284 WeakPolarHBondContact CD-O 3.28Å; P229-I321 HydrophobicContact CB-CD1 4.4Å; P229-L322 WeakPolarHBondContact CA-O 3.42Å; P229-I323 HydrophobicContact CB-CD1 4.01Å
230	V	97.1	Very high	95.2	Very high	4 Å²	4	53 Å²	53	2%	0.024	29%	0.29	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-136.1	151.2	173.5	-58.7	0	0	0	0	110.9	P166 M228 K232 I321 L322 I324	P166-V230 HydrophobicContact CG-CG1 3.79Å; M228-V230 HydrophobicContact CG-CG1 4.37Å; V230-K232 PolarHBondContact O-N 3.47Å; V230-I321 CarbonylContact O-C 3.58Å; V230-I321 WeakPolarHBondContact O-CA 3.33Å; V230-I321 WeakPolarHBondContact O-CB 3.24Å; V230-L322 HydrophobicContact CG2-CB 4Å; V230-L322 PolarHBondContact N-O 2.66Å; V230-L322 PolarHBondContact O-N 3.04Å; V230-I324 HydrophobicContact CG1-CD1 4.01Å; V230-I324 HydrophobicContact CG2-CD1 3.79Å; V230-I324 HydrophobicContact CG2-CG1 4.15Å
231	Y	97.5	Very high	95.2	Very high	5 Å²	5	49.8 Å²	49.8	2%	0.02	27%	0.269	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-69.2	132.2	173.3	-67.6	-69.9	0	0	0	111.2	K233 H236 E239 V241 M316 R319 I321	Y231-K233 VanDerWaalsContact C-N 3.29Å; Y231-K233 PolarHBondContact O-N 2.81Å; Y231-H236 HydrophobicContact CD2-CB 4.05Å; Y231-H236 WeakPolarHBondContact CD2-O 3.25Å; Y231-H236 HydrophobicContact CG-CB 3.89Å; Y231-E239 HydrophobicContact CD2-CB 3.84Å; Y231-E239 HydrophobicContact CE2-CB 3.7Å; Y231-V241 HydrophobicContact CD1-CG2 4.15Å; Y231-V241 HydrophobicContact CD2-CG2 3.74Å; Y231-V241 HydrophobicContact CE1-CG2 4.11Å; Y231-V241 HydrophobicContact CE2-CB 4.44Å; Y231-V241 HydrophobicContact CE2-CG2 3.72Å; Y231-V241 HydrophobicContact CG-CG2 3.97Å; Y231-M316 HydrophobicContact CE1-CG 4.37Å; Y231-R319 HydrophobicContact CD1-CB 3.7Å; Y231-R319 HydrophobicContact CE1-CB 3.78Å; Y231-R319 PolarHBondContact OH-NH2 2.84Å; Y231-R319 VanDerWaalsContact OH-NH2 3.08Å; Y231-I321 HydrophobicContact CD1-CG2 3.76Å; Y231-I321 HydrophobicContact CE1-CG2 4.03Å
232	K	95.6	Very high	95.2	Very high	96 Å²	96	43.5 Å²	43.5	42%	0.417	24%	0.239	S	C	.	.	S	Bend	trans	-68.5	-26.1	-176.7	-178.8	169.2	176.7	166.6	0	113.2	V230 P320 L322 E341	V230-K232 PolarHBondContact O-N 3.47Å; K232-P320 HydrophobicContact CB-CB 4.25Å; K232-P320 HydrophobicContact CB-CG 4.23Å; K232-P320 WeakPolarHBondContact CB-O 3.36Å; K232-P320 PolarHBondContact N-O 2.92Å; K232-L322 HydrophobicContact CB-CD2 4.39Å; K232-L322 HydrophobicContact CB-CG 3.94Å; K232-L322 HydrophobicContact CD-CD2 3.85Å; K232-L322 HydrophobicContact CD-CG 4.32Å; K232-L322 HydrophobicContact CG-CD1 4.33Å; K232-L322 HydrophobicContact CG-CD2 4.07Å; K232-L322 HydrophobicContact CG-CG 3.99Å; K232-E341 HydrophobicContact CD-CG 4.32Å; K232-E341 WeakPolarHBondContact CD-OE2 3.33Å; K232-E341 WeakPolarHBondContact CE-OE2 3.37Å; K232-E341 IonicContact NZ-OE2 2.95Å; K232-E341 PolarHBondContact NZ-OE2 3.42Å
233	K	94.1	Very high	95.2	Very high	94 Å²	94	41.6 Å²	41.6	41%	0.409	22%	0.218	S	C	.	.	S	Bend	trans	-86.7	134.5	179.4	-70.9	-161.9	176.6	-166.5	0	111.5	Y231 E235 H236 V237 P320	Y231-K233 VanDerWaalsContact C-N 3.29Å; Y231-K233 PolarHBondContact O-N 2.81Å; K233-E235 HydrophobicContact CB-CG 4Å; K233-E235 HydrophobicContact CD-CG 3.93Å; K233-E235 WeakPolarHBondContact CD-OE1 3.46Å; K233-E235 VanDerWaalsContact CD-OE2 3.32Å; K233-E235 WeakPolarHBondContact CD-OE2 3.49Å; K233-E235 WeakPolarHBondContact CE-OE1 3.37Å; K233-E235 IonicContact NZ-OE1 3.28Å; K233-E235 PolarHBondContact NZ-OE1 3.15Å; K233-E235 IonicContact NZ-OE2 2.71Å; K233-E235 PolarHBondContact NZ-OE2 3.17Å; K233-E235 PolarHBondContact O-N 3.16Å; K233-H236 PolarHBondContact O-N 3.03Å; K233-V237 PolarHBondContact O-N 3.05Å; K233-V237 VanDerWaalsContact O-N 3.13Å; K233-P320 HydrophobicContact CG-CG 4.49Å
234	A	90.7	Very high	95.1	Very high	88 Å²	88	41.6 Å²	41.6	73%	0.727	22%	0.218	S	C	*	.	G	3₁₀ helix	trans	-54.4	-37.4	174.4	0	0	0	0	0	113.4	H236 V237	A234-H236 PolarHBondContact O-N 3.1Å; A234-V237 PolarHBondContact O-N 2.85Å
235	E	94.1	Very high	95	Very high	123 Å²	123	43.4 Å²	43.4	58%	0.575	23%	0.23	S	C	*	.	G	3₁₀ helix	trans	-59.8	-15.1	178.1	81.1	-160.3	-157.6	0	0	114.2	K233	K233-E235 HydrophobicContact CB-CG 4Å; K233-E235 HydrophobicContact CD-CG 3.93Å; K233-E235 WeakPolarHBondContact CD-OE1 3.46Å; K233-E235 VanDerWaalsContact CD-OE2 3.32Å; K233-E235 WeakPolarHBondContact CD-OE2 3.49Å; K233-E235 WeakPolarHBondContact CE-OE1 3.37Å; K233-E235 IonicContact NZ-OE1 3.28Å; K233-E235 PolarHBondContact NZ-OE1 3.15Å; K233-E235 IonicContact NZ-OE2 2.71Å; K233-E235 PolarHBondContact NZ-OE2 3.17Å; K233-E235 PolarHBondContact O-N 3.16Å
236	H	93.3	Very high	94.7	Very high	33 Å²	33	49.8 Å²	49.8	15%	0.153	26%	0.264	C	S	.	.	G	3₁₀ helix	trans	-128.5	1.9	-179.1	-58.7	124.6	0	0	0	113.3	Y231 K233 A234 T238 E239 R319	Y231-H236 HydrophobicContact CD2-CB 4.05Å; Y231-H236 WeakPolarHBondContact CD2-O 3.25Å; Y231-H236 HydrophobicContact CG-CB 3.89Å; K233-H236 PolarHBondContact O-N 3.03Å; A234-H236 PolarHBondContact O-N 3.1Å; H236-T238 PolarHBondContact O-N 2.64Å; H236-T238 VanDerWaalsContact O-N 3.16Å; H236-E239 IonicContact CD2-OE1 2.89Å; H236-E239 PolarHBondContact CD2-OE1 2.89Å; H236-E239 VanDerWaalsContact CD2-OE1 3.28Å; H236-E239 WeakPolarHBondContact O-CB 3.25Å; H236-E239 PolarHBondContact O-N 3.42Å; H236-R319 PolarHBondContact CD2-NH1 3.1Å; H236-R319 WeakPolarHBondContact CE1-CD 3.47Å; H236-R319 WeakPolarHBondContact ND1-CD 3.42Å; H236-R319 WeakPolarHBondContact NE2-CD 3.46Å; H236-R319 PolarHBondContact NE2-NH1 3.34Å
237	V	91.1	Very high	94.5	Very high	26 Å²	26	49.2 Å²	49.2	16%	0.158	26%	0.263	C	S	.	.	T	Hydrogen-bonded Turn	trans	-66.5	-23.9	-167.5	76.4	0	0	0	0	113.2	I165 K233 A234 R283	I165-V237 HydrophobicContact CD1-CG1 4.02Å; I165-V237 HydrophobicContact CG1-CG1 4.29Å; I165-V237 HydrophobicContact CG2-CG1 4.1Å; I165-V237 HydrophobicContact CG2-CG2 4Å; K233-V237 PolarHBondContact O-N 3.05Å; K233-V237 VanDerWaalsContact O-N 3.13Å; A234-V237 PolarHBondContact O-N 2.85Å; V237-R283 PolarHBondContact O-NH1 3.07Å; V237-R283 PolarHBondContact O-NH2 2.68Å
238	T	91	Very high	94.2	Very high	101 Å²	101	52.1 Å²	52.1	62%	0.62	28%	0.277	S	S	*	.	T	Hydrogen-bonded Turn	trans	-78.3	-17.3	174	49.2	0	0	0	0	113.6	I165 H236	I165-T238 HydrophobicContact CD1-CG2 4.15Å; I165-T238 HydrophobicContact CG1-CG2 4.18Å; H236-T238 PolarHBondContact O-N 2.64Å; H236-T238 VanDerWaalsContact O-N 3.16Å
239	E	93.7	Very high	93.8	Very high	76 Å²	76	57.8 Å²	57.8	36%	0.355	31%	0.307	S	S	.	.	S	Bend	trans	-74.9	147.5	173.5	-69.6	-177.4	-130	0	0	111.4	Y231 H236 R319	Y231-E239 HydrophobicContact CD2-CB 3.84Å; Y231-E239 HydrophobicContact CE2-CB 3.7Å; H236-E239 IonicContact CD2-OE1 2.89Å; H236-E239 PolarHBondContact CD2-OE1 2.89Å; H236-E239 VanDerWaalsContact CD2-OE1 3.28Å; H236-E239 WeakPolarHBondContact O-CB 3.25Å; H236-E239 PolarHBondContact O-N 3.42Å; E239-R319 IonicContact OE1-CZ 2.7Å; E239-R319 IonicContact OE1-NH1 2.78Å; E239-R319 PolarHBondContact OE1-NH1 2.83Å; E239-R319 IonicContact OE2-CZ 3.17Å; E239-R319 IonicContact OE2-NH1 2.64Å; E239-R319 PolarHBondContact OE2-NH1 2.9Å; E239-R319 IonicContact OE2-NH2 2.7Å; E239-R319 PolarHBondContact OE2-NH2 3.17Å
240	V	94	Very high	93.2	Very high	37 Å²	37	59 Å²	59	22%	0.224	32%	0.316	C	S	.	.			trans	-79.9	135.3	170.7	-175.9	0	0	0	0	109.9	K242 T281 G282 R283	V240-K242 HydrophobicContact CB-CG 4.23Å; V240-K242 HydrophobicContact CG1-CD 4.29Å; V240-K242 HydrophobicContact CG1-CG 3.63Å; V240-K242 PolarHBondContact O-N 3.42Å; V240-T281 WeakPolarHBondContact CG2-O 3.3Å; V240-G282 VanDerWaalsContact CG1-O 3.25Å; V240-G282 WeakPolarHBondContact CG1-O 3.03Å; V240-G282 WeakPolarHBondContact CG2-O 3.41Å; V240-R283 HydrophobicContact CG2-CG 4.44Å
241	V	95.9	Very high	92.2	Very high	2 Å²	2	67.4 Å²	67.4	1%	0.012	35%	0.347	C	S	.	.			trans	-82.7	93.6	170.9	-173.8	0	0	0	0	109.4	P229 Y231 L264 M316 I321	P229-V241 HydrophobicContact CB-CB 4.01Å; P229-V241 HydrophobicContact CB-CG1 4.11Å; P229-V241 HydrophobicContact CB-CG2 4.35Å; P229-V241 HydrophobicContact CG-CB 4.08Å; P229-V241 HydrophobicContact CG-CG1 4.39Å; Y231-V241 HydrophobicContact CD1-CG2 4.15Å; Y231-V241 HydrophobicContact CD2-CG2 3.74Å; Y231-V241 HydrophobicContact CE1-CG2 4.11Å; Y231-V241 HydrophobicContact CE2-CB 4.44Å; Y231-V241 HydrophobicContact CE2-CG2 3.72Å; Y231-V241 HydrophobicContact CG-CG2 3.97Å; V241-L264 HydrophobicContact CG1-CD2 3.52Å; V241-M316 HydrophobicContact CG1-CG 3.89Å; V241-I321 HydrophobicContact CG1-CG2 3.98Å; V241-I321 HydrophobicContact CG2-CG2 3.94Å
242	K	92.3	Very high	91	Very high	68 Å²	68	74.6 Å²	74.6	30%	0.296	38%	0.381	S	S	.	.	P	Polyproline II helix	trans	-101.3	164.2	171.9	-56.7	-157.3	175.7	-158.5	0	111.5	V240 E277	V240-K242 HydrophobicContact CB-CG 4.23Å; V240-K242 HydrophobicContact CG1-CD 4.29Å; V240-K242 HydrophobicContact CG1-CG 3.63Å; V240-K242 PolarHBondContact O-N 3.42Å; K242-E277 VanDerWaalsContact NZ-CD 3.3Å; K242-E277 IonicContact NZ-OE1 3.31Å; K242-E277 PolarHBondContact NZ-OE1 3.1Å; K242-E277 IonicContact NZ-OE2 2.86Å; K242-E277 PolarHBondContact NZ-OE2 3.32Å
243	R	95.2	Very high	89.8	Confident	4 Å²	4	72.3 Å²	72.3	2%	0.015	37%	0.371	C	S	.	.	P	Polyproline II helix	trans	-63.8	166.4	168.1	-63.7	171.8	86.1	-170.6	5.3	110	H247 E248 N254 P261 S262 H263 M307 C308	R243-H247 PolarHBondContact NH1-O 3.12Å; R243-H247 PolarHBondContact NH2-O 3.19Å; R243-E248 HydrophobicContact CB-CB 4.45Å; R243-N254 PolarHBondContact NH1-ND2 3.11Å; R243-N254 PolarHBondContact NH1-OD1 3.33Å; R243-P261 WeakPolarHBondContact CD-O 3.48Å; R243-P261 PolarHBondContact NH1-O 3.45Å; R243-S262 WeakPolarHBondContact CG-O 3.3Å; R243-S262 PolarHBondContact N-O 3.05Å; R243-H263 WeakPolarHBondContact CD-O 3.37Å; R243-M307 PolarHBondContact NE-O 3.35Å; R243-M307 PolarHBondContact NH2-O 3.02Å; R243-M307 VanDerWaalsContact NH2-O 3.08Å; R243-C308 HydrophobicContact CB-CB 4.14Å; R243-C308 HydrophobicContact CG-CB 4.04Å
244	C	95.3	Very high	89	Confident	4 Å²	4	69.2 Å²	69.2	3%	0.027	36%	0.359	C	S	.	.	P	Polyproline II helix	trans	-81.3	152.9	167	68	0	0	0	0	111.2	N246 H247 E248 C312 V313	C244-N246 PolarHBondContact O-N 2.89Å; C244-N246 VanDerWaalsContact O-N 3.1Å; C244-H247 PolarHBondContact O-N 3.31Å; C244-H247 PolarHBondContact SG-ND1 3.46Å; C244-E248 PolarHBondContact O-N 3.41Å; C244-C312 HydrophobicContact CB-CB 3.97Å; C244-V313 WeakPolarHBondContact CB-O 3.26Å
245	P	93.7	Very high	87.8	Confident	62 Å²	62	72.3 Å²	72.3	40%	0.403	36%	0.358	S	S	.	.	H	α-helix	trans	-50.4	-39.4	-179.5	-31.2	36.1	0	0	0	114.1	H247 E248 L249 G314	P245-H247 VanDerWaalsContact C-N 3.31Å; P245-H247 PolarHBondContact O-N 3.48Å; P245-E248 PolarHBondContact O-N 2.87Å; P245-L249 WeakPolarHBondContact O-CB 3.4Å; P245-L249 VanDerWaalsContact O-CG 3.3Å; P245-L249 WeakPolarHBondContact O-CG 3.19Å; P245-L249 PolarHBondContact O-N 2.78Å; P245-G314 WeakPolarHBondContact CD-O 3.35Å
246	N	92.8	Very high	86.3	Confident	138 Å²	138	70.2 Å²	70.2	74%	0.738	37%	0.37	S	S	*	.	H	α-helix	trans	-62.6	-34.7	179.9	-60.9	16.3	0	0	0	113.3	C244 S250	C244-N246 PolarHBondContact O-N 2.89Å; C244-N246 VanDerWaalsContact O-N 3.1Å; N246-S250 WeakPolarHBondContact O-CB 3.17Å; N246-S250 PolarHBondContact O-N 2.86Å
247	H	92.8	Very high	85.1	Confident	36 Å²	36	73.8 Å²	73.8	17%	0.167	39%	0.386	C	S	.	.	H	α-helix	trans	-86.2	-33.3	176.4	-75.1	124.9	0	0	0	111.9	I205 R243 C244 P245 N254 C308 C312	I205-H247 VanDerWaalsContact CD1-NE2 3.33Å; I205-H247 WeakPolarHBondContact CD1-NE2 3.48Å; R243-H247 PolarHBondContact NH1-O 3.12Å; R243-H247 PolarHBondContact NH2-O 3.19Å; C244-H247 PolarHBondContact O-N 3.31Å; C244-H247 PolarHBondContact SG-ND1 3.46Å; P245-H247 VanDerWaalsContact C-N 3.31Å; P245-H247 PolarHBondContact O-N 3.48Å; H247-N254 PolarHBondContact O-ND2 3.33Å; H247-C308 PolarHBondContact ND1-SG 3.22Å; H247-C312 PolarHBondContact CE1-SG 3.13Å
248	E	92.4	Very high	84.3	Confident	63 Å²	63	79 Å²	79	29%	0.294	41%	0.412	S	S	.	.	H	α-helix	trans	-63.6	-41.1	175.3	-177.9	165.5	-162	0	0	112	R243 C244 P245 N254 P261 S262	R243-E248 HydrophobicContact CB-CB 4.45Å; C244-E248 PolarHBondContact O-N 3.41Å; P245-E248 PolarHBondContact O-N 2.87Å; E248-N254 PolarHBondContact O-ND2 3.25Å; E248-P261 HydrophobicContact CG-CB 4.17Å; E248-S262 WeakPolarHBondContact OE1-CA 3.23Å; E248-S262 WeakPolarHBondContact OE1-CB 3.29Å
249	L	89.3	Confident	84.1	Confident	145 Å²	145	74.6 Å²	74.6	76%	0.759	39%	0.385	S	S	*	.	S	Bend	trans	-84.9	-13.6	178.9	-63	171.7	0	0	0	114.5	P245 R251	P245-L249 WeakPolarHBondContact O-CB 3.4Å; P245-L249 VanDerWaalsContact O-CG 3.3Å; P245-L249 WeakPolarHBondContact O-CG 3.19Å; P245-L249 PolarHBondContact O-N 2.78Å; L249-R251 PolarHBondContact O-N 3.21Å
250	S	85.6	Confident	84	Confident	34 Å²	34	73 Å²	73	24%	0.238	38%	0.382	C	S	.	.			trans	-70.7	127.9	-178.6	178.3	0	0	0	0	111.8	N246 E252 N254	N246-S250 WeakPolarHBondContact O-CB 3.17Å; N246-S250 PolarHBondContact O-N 2.86Å; S250-E252 PolarHBondContact OG-N 2.76Å; S250-N254 PolarHBondContact O-ND2 3.44Å
251	R	75.8	Confident	83.8	Confident	181 Å²	181	74.3 Å²	74.3	68%	0.683	39%	0.391	S	S	*	.	G	3₁₀ helix	trans	-68.7	-35.3	177.4	-64.7	-170.7	-179.6	-159.2	1.4	112.8	L249 F253 N254 E255	L249-R251 PolarHBondContact O-N 3.21Å; R251-F253 PolarHBondContact O-N 3.33Å; R251-N254 PolarHBondContact O-N 2.91Å; R251-E255 PolarHBondContact O-N 3.3Å
252	E	72.4	Confident	83.6	Confident	155 Å²	155	75 Å²	75	72%	0.724	40%	0.396	S	S	*	.	G	3₁₀ helix	trans	-48.2	-34.1	-178.6	-175.2	-174.8	-167.6	0	0	113.9	S250	S250-E252 PolarHBondContact OG-N 2.76Å
253	F	70.1	Confident	83.7	Confident	49 Å²	49	72.1 Å²	72.1	22%	0.215	38%	0.384	C	S	.	.	G	3₁₀ helix	trans	-112.1	12.5	-177.5	-61.3	-67.9	0	0	0	113.9	A206 R251 R266 M307	A206-F253 HydrophobicContact CB-CD1 3.53Å; A206-F253 HydrophobicContact CB-CE1 3.59Å; R251-F253 PolarHBondContact O-N 3.33Å; F253-R266 PolarHBondContact O-NH1 2.89Å; F253-M307 HydrophobicContact CB-CE 3.94Å; F253-M307 HydrophobicContact CD1-CE 4.29Å; F253-M307 HydrophobicContact CG-CE 4.48Å
254	N	77.2	Confident	83.7	Confident	29 Å²	29	72 Å²	72	16%	0.155	38%	0.383	C	S	.	.	T	Hydrogen-bonded Turn	trans	-132.8	-20	-174.9	-72.6	-45.5	0	0	0	113.9	R243 H247 E248 S250 R251 Q257 R266	R243-N254 PolarHBondContact NH1-ND2 3.11Å; R243-N254 PolarHBondContact NH1-OD1 3.33Å; H247-N254 PolarHBondContact O-ND2 3.33Å; E248-N254 PolarHBondContact O-ND2 3.25Å; S250-N254 PolarHBondContact O-ND2 3.44Å; R251-N254 PolarHBondContact O-N 2.91Å; N254-Q257 PolarHBondContact O-N 3.18Å; N254-R266 PolarHBondContact OD1-NH2 3.35Å
255	E	66.2	Low	83.8	Confident	152 Å²	152	72 Å²	72	71%	0.71	38%	0.383	S	S	*	.	T	Hydrogen-bonded Turn	trans	-66.9	134.1	-177.9	-166.7	156.3	-165.5	0	0	112.4	R251 Q257	R251-E255 PolarHBondContact O-N 3.3Å; E255-Q257 PolarHBondContact O-N 3.15Å
256	G	63	Low	83.9	Confident	79 Å²	79	69.3 Å²	69.3	81%	0.814	37%	0.365	S	S	*	.	T	Hydrogen-bonded Turn	trans	68.6	10.3	-178.7	0	0	0	0	0	116.3
257	Q	67	Low	84	Confident	108 Å²	108	63.3 Å²	63.3	51%	0.505	33%	0.333	S	S	.	.			trans	-98.6	136.4	-175.6	-62.6	-62.8	-64.7	0	0	112.9	N254 E255 A259	N254-Q257 PolarHBondContact O-N 3.18Å; E255-Q257 PolarHBondContact O-N 3.15Å; Q257-A259 PolarHBondContact O-N 2.78Å
258	I	75.4	Confident	84	Confident	137 Å²	137	65.6 Å²	65.6	70%	0.703	34%	0.344	S	S	*	.	S	Bend	trans	-69.8	-24.5	172.4	-61.9	168.8	0	0	0	111.4
259	A	86.5	Confident	83.7	Confident	7 Å²	7	66.6 Å²	66.6	6%	0.058	37%	0.371	C	S	.	.	S	Bend	trans	-76.9	135	-174.6	0	0	0	0	0	113	Q257 R266 Y275	Q257-A259 PolarHBondContact O-N 2.78Å; A259-R266 VanDerWaalsContact CB-CD 3.41Å; A259-R266 HydrophobicContact CB-CG 3.7Å; A259-R266 VanDerWaalsContact CB-NE 3.26Å; A259-R266 PolarHBondContact O-NH2 3.18Å; A259-Y275 HydrophobicContact CB-CD1 4.01Å; A259-Y275 HydrophobicContact CB-CD2 4.14Å; A259-Y275 HydrophobicContact CB-CE1 3.54Å; A259-Y275 HydrophobicContact CB-CE2 3.69Å; A259-Y275 HydrophobicContact CB-CG 4.3Å
260	P	90.2	Very high	83.6	Confident	42 Å²	42	61.4 Å²	61.4	27%	0.273	34%	0.344	S	S	.	.			trans	-54.2	145.2	176.5	-27	34.6	0	0	0	113.3	S262 H263 R266	P260-S262 PolarHBondContact O-N 2.85Å; P260-H263 PolarHBondContact O-N 3.3Å; P260-R266 PolarHBondContact O-NH2 3.13Å
261	P	91.2	Very high	83.7	Confident	65 Å²	65	64.1 Å²	64.1	42%	0.422	36%	0.363	S	S	.	.	T	Hydrogen-bonded Turn	trans	-58.2	-29	178.9	-28.2	36.4	0	0	0	114.5	R243 E248	R243-P261 WeakPolarHBondContact CD-O 3.48Å; R243-P261 PolarHBondContact NH1-O 3.45Å; E248-P261 HydrophobicContact CG-CB 4.17Å
262	S	90.9	Very high	84.4	Confident	18 Å²	18	61 Å²	61	13%	0.126	36%	0.356	C	S	.	.	T	Hydrogen-bonded Turn	trans	-76.7	-28.4	-176.6	55.7	0	0	0	0	114.7	R243 E248 P260 L264 Q284	R243-S262 WeakPolarHBondContact CG-O 3.3Å; R243-S262 PolarHBondContact N-O 3.05Å; E248-S262 WeakPolarHBondContact OE1-CA 3.23Å; E248-S262 WeakPolarHBondContact OE1-CB 3.29Å; P260-S262 PolarHBondContact O-N 2.85Å; S262-L264 PolarHBondContact O-N 2.79Å; S262-Q284 VanDerWaalsContact CB-NE2 3.35Å; S262-Q284 PolarHBondContact O-OE1 3.41Å; S262-Q284 PolarHBondContact OG-NE2 3.11Å
263	H	93.9	Very high	85.5	Confident	6 Å²	6	54.1 Å²	54.1	3%	0.028	33%	0.325	C	S	.	.			trans	-67.1	124.3	-171.5	-87.3	-123.9	0	0	0	113.1	R243 P260 Y275 Q284 S285	R243-H263 WeakPolarHBondContact CD-O 3.37Å; P260-H263 PolarHBondContact O-N 3.3Å; H263-Y275 HydrophobicContact CB-CD1 4.39Å; H263-Y275 AromaticContact ND1-CD1 3.63Å; H263-Q284 VanDerWaalsContact CD2-CD 3.46Å; H263-S285 PolarHBondContact CE1-O 2.84Å; H263-S285 VanDerWaalsContact CE1-O 3.27Å
264	L	96.8	Very high	86.7	Confident	2 Å²	2	57.7 Å²	57.7	1%	0.01	34%	0.343	C	S	.	.	S	Bend	trans	-68	-40.7	176.4	176.5	62.2	0	0	0	113.1	P229 V241 S262 F306 M307 C308 M316 I321	P229-L264 HydrophobicContact CB-CD2 4.18Å; P229-L264 HydrophobicContact CG-CB 4.49Å; P229-L264 HydrophobicContact CG-CD2 4.4Å; V241-L264 HydrophobicContact CG1-CD2 3.52Å; S262-L264 PolarHBondContact O-N 2.79Å; L264-F306 WeakPolarHBondContact O-CA 3.32Å; L264-M307 PolarHBondContact O-N 2.63Å; L264-C308 HydrophobicContact CD1-CB 3.73Å; L264-M316 HydrophobicContact CD1-CE 3.69Å; L264-M316 HydrophobicContact CD2-CE 3.85Å; L264-M316 HydrophobicContact CD2-SD 4.08Å; L264-M316 HydrophobicContact CG-CE 4.47Å; L264-I321 HydrophobicContact CD2-CD1 3.79Å
265	I	97.1	Very high	87.6	Confident	5 Å²	5	58.3 Å²	58.3	3%	0.026	34%	0.343	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-100.4	132.9	-177.7	-49.2	179.5	0	0	0	108.8	A227 P229 V286 Y304 F306 I323	A227-I265 HydrophobicContact CB-CD1 4.21Å; P229-I265 HydrophobicContact CB-CD1 4.15Å; P229-I265 HydrophobicContact CG-CD1 4.03Å; P229-I265 HydrophobicContact CG-CG1 4.18Å; I265-V286 HydrophobicContact CB-CG1 4.26Å; I265-V286 HydrophobicContact CG2-CG1 3.86Å; I265-Y304 HydrophobicContact CG2-CD1 3.61Å; I265-Y304 HydrophobicContact CG2-CE1 4.21Å; I265-Y304 HydrophobicContact CG2-CG 4.46Å; I265-F306 HydrophobicContact CD1-CE1 4.35Å; I265-F306 HydrophobicContact CG1-CD1 4.23Å; I265-F306 HydrophobicContact CG1-CE1 4.06Å; I265-I323 HydrophobicContact CD1-CD1 4.06Å; I265-I323 HydrophobicContact CD1-CG2 4.05Å
266	R	95.1	Very high	88.9	Confident	4 Å²	4	53.6 Å²	53.6	2%	0.015	33%	0.325	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-127	162.5	170.3	-65.2	-172.2	178.6	171	-0.3	111.4	F253 N254 A259 P260 Y275 Y304 N305 M307	F253-R266 PolarHBondContact O-NH1 2.89Å; N254-R266 PolarHBondContact OD1-NH2 3.35Å; A259-R266 VanDerWaalsContact CB-CD 3.41Å; A259-R266 HydrophobicContact CB-CG 3.7Å; A259-R266 VanDerWaalsContact CB-NE 3.26Å; A259-R266 PolarHBondContact O-NH2 3.18Å; P260-R266 PolarHBondContact O-NH2 3.13Å; R266-Y275 HydrophobicContact CB-CE1 4.44Å; R266-Y275 HydrophobicContact CG-CE1 4.14Å; R266-Y304 CarbonylContact O-C 3.47Å; R266-Y304 VanDerWaalsContact O-CA 3.3Å; R266-Y304 WeakPolarHBondContact O-CA 3.42Å; R266-N305 HydrophobicContact CB-CB 4.5Å; R266-N305 PolarHBondContact N-O 3.37Å; R266-N305 PolarHBondContact O-N 2.76Å; R266-M307 HydrophobicContact CB-CG 4.31Å; R266-M307 HydrophobicContact CB-SD 4.46Å; R266-M307 HydrophobicContact CG-CG 3.74Å; R266-M307 HydrophobicContact CG-SD 4.39Å
267	V	95.7	Very high	90.5	Very high	12 Å²	12	53.8 Å²	53.8	7%	0.073	30%	0.304	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-118.5	131	177.2	176.4	0	0	0	0	108.8	N270 A273 Y275 V286 V288 V302 L303 Y304	V267-N270 HydrophobicContact CG1-CB 3.96Å; V267-A273 HydrophobicContact CB-CB 3.85Å; V267-A273 HydrophobicContact CG1-CB 4.12Å; V267-A273 HydrophobicContact CG2-CB 4.38Å; V267-Y275 PolarHBondContact N-OH 3.18Å; V267-V286 HydrophobicContact CG2-CG1 4Å; V267-V286 HydrophobicContact CG2-CG2 3.74Å; V267-V288 HydrophobicContact CB-CG2 4.35Å; V267-V288 HydrophobicContact CG1-CG2 4Å; V267-V288 HydrophobicContact CG2-CG2 3.67Å; V267-V302 HydrophobicContact CG1-CG1 4.08Å; V267-V302 HydrophobicContact CG2-CG1 4.33Å; V267-L303 CarbonylContact C-O 3.54Å; V267-L303 VanDerWaalsContact CA-O 3.29Å; V267-L303 WeakPolarHBondContact CA-O 3.41Å; V267-Y304 HydrophobicContact CG2-CD1 3.73Å; V267-Y304 HydrophobicContact CG2-CE1 3.62Å
268	E	91.7	Very high	91.7	Very high	85 Å²	85	50.4 Å²	50.4	40%	0.397	29%	0.29	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-101.3	147.6	178.4	-172.9	176.3	157.9	0	0	110.1	T208 N270 L303 N305	T208-E268 WeakPolarHBondContact CB-OE2 3.5Å; T208-E268 HydrophobicContact CG2-CB 4.42Å; T208-E268 WeakPolarHBondContact CG2-OE2 3.38Å; T208-E268 PolarHBondContact OG1-OE2 3.41Å; E268-N270 PolarHBondContact O-N 3.27Å; E268-N270 VanDerWaalsContact O-N 3.11Å; E268-L303 HydrophobicContact CB-CB 4.07Å; E268-L303 PolarHBondContact N-O 3.49Å; E268-N305 WeakPolarHBondContact CB-OD1 3.42Å; E268-N305 PolarHBondContact OE2-ND2 3.25Å; E268-N305 PolarHBondContact OE2-OD1 3.15Å
269	G	86.4	Confident	92.4	Very high	84 Å²	84	50.1 Å²	50.1	87%	0.866	30%	0.297	S	S	*	.	S	Bend	trans	73.6	-7.6	175.6	0	0	0	0	0	117.1
270	N	87.5	Confident	92.5	Very high	35 Å²	35	55.7 Å²	55.7	19%	0.187	32%	0.324	C	S	.	.			trans	-117.3	110.9	177.6	-166.1	-63.1	0	0	0	111.7	V267 E268 H272 A273 V288 E291	V267-N270 HydrophobicContact CG1-CB 3.96Å; E268-N270 PolarHBondContact O-N 3.27Å; E268-N270 VanDerWaalsContact O-N 3.11Å; N270-H272 VanDerWaalsContact C-N 3.28Å; N270-H272 PolarHBondContact O-N 2.95Å; N270-H272 WeakPolarHBondContact OD1-CA 3.35Å; N270-H272 WeakPolarHBondContact OD1-CB 3.11Å; N270-H272 PolarHBondContact OD1-N 3.27Å; N270-A273 WeakPolarHBondContact O-CB 3.46Å; N270-A273 PolarHBondContact O-N 3.4Å; N270-A273 PolarHBondContact OD1-N 2.92Å; N270-V288 HydrophobicContact CB-CG1 4.44Å; N270-E291 PolarHBondContact ND2-OE1 3.38Å
271	S	87.9	Confident	92.5	Very high	91 Å²	91	55 Å²	55	64%	0.636	32%	0.319	S	S	*	.	T	Hydrogen-bonded Turn	trans	-74.7	-12.3	179.2	49.6	0	0	0	0	114.2
272	H	90.9	Very high	92.6	Very high	117 Å²	117	52.7 Å²	52.7	54%	0.542	31%	0.308	S	S	.	.	T	Hydrogen-bonded Turn	trans	-92.5	5.3	176.9	-52.2	142.1	0	0	0	112.8	N270 Q274 P289	N270-H272 VanDerWaalsContact C-N 3.28Å; N270-H272 PolarHBondContact O-N 2.95Å; N270-H272 WeakPolarHBondContact OD1-CA 3.35Å; N270-H272 WeakPolarHBondContact OD1-CB 3.11Å; N270-H272 PolarHBondContact OD1-N 3.27Å; H272-Q274 PolarHBondContact O-N 3.37Å; H272-P289 HydrophobicContact CB-CG 3.75Å
273	A	95.1	Very high	92.7	Very high	9 Å²	9	52.5 Å²	52.5	7%	0.074	31%	0.305	C	S	.	.	P	Polyproline II helix	trans	-65.7	117.6	176.4	0	0	0	0	0	111.5	V267 N270 Y275 V286 L287 V288	V267-A273 HydrophobicContact CB-CB 3.85Å; V267-A273 HydrophobicContact CG1-CB 4.12Å; V267-A273 HydrophobicContact CG2-CB 4.38Å; N270-A273 WeakPolarHBondContact O-CB 3.46Å; N270-A273 PolarHBondContact O-N 3.4Å; N270-A273 PolarHBondContact OD1-N 2.92Å; A273-Y275 HydrophobicContact CB-CE2 4.22Å; A273-V286 HydrophobicContact CB-CG2 4.29Å; A273-L287 CarbonylContact C-O 3.45Å; A273-L287 WeakPolarHBondContact CA-O 3.16Å; A273-V288 HydrophobicContact CB-CG2 4.45Å
274	Q	95.3	Very high	92.8	Very high	124 Å²	124	52.5 Å²	52.5	58%	0.579	31%	0.305	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-101	129.6	-178.2	-63.7	-178.5	1.6	0	0	110.9	H272 V286 L287	H272-Q274 PolarHBondContact O-N 3.37Å; Q274-V286 CarbonylContact O-C 3.54Å; Q274-V286 WeakPolarHBondContact O-CA 3.35Å; Q274-L287 HydrophobicContact CB-CB 4.41Å; Q274-L287 PolarHBondContact N-O 2.93Å; Q274-L287 PolarHBondContact O-N 3.17Å
275	Y	95.8	Very high	92.8	Very high	43 Å²	43	52.8 Å²	52.8	17%	0.169	31%	0.306	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-102.3	116.4	-179.3	-65.3	-88.9	0	0	0	109.3	A259 H263 R266 V267 A273 V286	A259-Y275 HydrophobicContact CB-CD1 4.01Å; A259-Y275 HydrophobicContact CB-CD2 4.14Å; A259-Y275 HydrophobicContact CB-CE1 3.54Å; A259-Y275 HydrophobicContact CB-CE2 3.69Å; A259-Y275 HydrophobicContact CB-CG 4.3Å; H263-Y275 HydrophobicContact CB-CD1 4.39Å; H263-Y275 AromaticContact ND1-CD1 3.63Å; R266-Y275 HydrophobicContact CB-CE1 4.44Å; R266-Y275 HydrophobicContact CG-CE1 4.14Å; V267-Y275 PolarHBondContact N-OH 3.18Å; A273-Y275 HydrophobicContact CB-CE2 4.22Å; Y275-V286 HydrophobicContact CD1-CB 4.07Å; Y275-V286 HydrophobicContact CD1-CG2 3.9Å; Y275-V286 HydrophobicContact CE1-CB 3.97Å; Y275-V286 HydrophobicContact CE1-CG2 3.56Å; Y275-V286 HydrophobicContact CE2-CG2 4.34Å; Y275-V286 HydrophobicContact CG-CG2 4.42Å
276	V	94.3	Very high	92.8	Very high	53 Å²	53	52.5 Å²	52.5	32%	0.321	31%	0.305	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-125.2	124	-172.7	174.3	0	0	0	0	110.2	S285 L287	V276-S285 PolarHBondContact N-O 3.12Å; V276-S285 PolarHBondContact O-N 3.12Å; V276-S285 PolarHBondContact O-OG 3.33Å; V276-L287 HydrophobicContact CB-CD1 3.81Å; V276-L287 HydrophobicContact CG2-CD1 3.5Å
277	E	95.1	Very high	92.9	Very high	82 Å²	82	53.2 Å²	53.2	38%	0.383	31%	0.309	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-97.7	126.1	163	-170.1	160.6	161.5	0	0	108.8	K242 G282 R283 Q284	K242-E277 VanDerWaalsContact NZ-CD 3.3Å; K242-E277 IonicContact NZ-OE1 3.31Å; K242-E277 PolarHBondContact NZ-OE1 3.1Å; K242-E277 IonicContact NZ-OE2 2.86Å; K242-E277 PolarHBondContact NZ-OE2 3.32Å; E277-G282 WeakPolarHBondContact CG-O 3.32Å; E277-R283 WeakPolarHBondContact CA-O 3.48Å; E277-Q284 HydrophobicContact CB-CG 4.15Å; E277-Q284 HydrophobicContact CG-CG 3.88Å; E277-Q284 WeakPolarHBondContact OE2-CG 3.33Å; E277-Q284 PolarHBondContact OE2-NE2 3.41Å
278	D	92.1	Very high	93	Very high	37 Å²	37	53 Å²	53	20%	0.198	31%	0.307	C	S	.	.			trans	-63.5	122.4	176.3	173.6	-24.2	0	0	0	109.9	I280 T281 G282 R283	D278-I280 PolarHBondContact O-N 3.44Å; D278-I280 WeakPolarHBondContact OD1-CA 3.31Å; D278-I280 WeakPolarHBondContact OD1-CB 3.5Å; D278-I280 PolarHBondContact OD1-N 2.95Å; D278-T281 WeakPolarHBondContact CB-OG1 3.35Å; D278-T281 PolarHBondContact OD1-N 2.59Å; D278-T281 WeakPolarHBondContact OD2-CB 3.46Å; D278-T281 VanDerWaalsContact OD2-CG2 3.3Å; D278-T281 WeakPolarHBondContact OD2-CG2 3.47Å; D278-T281 PolarHBondContact OD2-OG1 2.7Å; D278-G282 VanDerWaalsContact O-CA 3.24Å; D278-G282 WeakPolarHBondContact O-CA 3.41Å; D278-G282 PolarHBondContact O-N 3.43Å; D278-R283 HydrophobicContact CB-CB 4.31Å; D278-R283 PolarHBondContact N-O 2.88Å
279	P	90.1	Very high	93.2	Very high	131 Å²	131	51.2 Å²	51.2	85%	0.851	30%	0.303	S	S	*	.	T	Hydrogen-bonded Turn	trans	-71.5	-13.7	-174.1	29.9	-36.1	0	0	0	114.1
280	I	88.5	Confident	93.6	Very high	124 Å²	124	48.9 Å²	48.9	64%	0.636	27%	0.269	S	S	*	.	T	Hydrogen-bonded Turn	trans	-98.2	-44.3	178.2	-56.1	178	0	0	0	110.2	P161 D278	P161-I280 HydrophobicContact CB-CD1 3.85Å; D278-I280 PolarHBondContact O-N 3.44Å; D278-I280 WeakPolarHBondContact OD1-CA 3.31Å; D278-I280 WeakPolarHBondContact OD1-CB 3.5Å; D278-I280 PolarHBondContact OD1-N 2.95Å
281	T	90.9	Very high	94	Very high	27 Å²	27	51.7 Å²	51.7	17%	0.166	28%	0.281	C	S	.	.	T	Hydrogen-bonded Turn	trans	-101.7	-9.9	-172.6	74.1	0	0	0	0	114.6	A164 V240 D278 R283	A164-T281 HydrophobicContact CB-CG2 4.23Å; V240-T281 WeakPolarHBondContact CG2-O 3.3Å; D278-T281 WeakPolarHBondContact CB-OG1 3.35Å; D278-T281 PolarHBondContact OD1-N 2.59Å; D278-T281 WeakPolarHBondContact OD2-CB 3.46Å; D278-T281 VanDerWaalsContact OD2-CG2 3.3Å; D278-T281 WeakPolarHBondContact OD2-CG2 3.47Å; D278-T281 PolarHBondContact OD2-OG1 2.7Å; T281-R283 PolarHBondContact O-N 2.98Å; T281-R283 VanDerWaalsContact O-N 3.16Å; T281-R283 VanDerWaalsContact OG1-CB 3.31Å; T281-R283 WeakPolarHBondContact OG1-CB 3.31Å; T281-R283 WeakPolarHBondContact OG1-CD 3.45Å; T281-R283 WeakPolarHBondContact OG1-CG 3.19Å; T281-R283 PolarHBondContact OG1-N 2.86Å
282	G	92.6	Very high	94.2	Very high	18 Å²	18	51.9 Å²	51.9	19%	0.186	28%	0.28	C	S	.	.			trans	64.7	8.8	-172.4	0	0	0	0	0	113.9	V240 E277 D278 Q284	V240-G282 VanDerWaalsContact CG1-O 3.25Å; V240-G282 WeakPolarHBondContact CG1-O 3.03Å; V240-G282 WeakPolarHBondContact CG2-O 3.41Å; E277-G282 WeakPolarHBondContact CG-O 3.32Å; D278-G282 VanDerWaalsContact O-CA 3.24Å; D278-G282 WeakPolarHBondContact O-CA 3.41Å; D278-G282 PolarHBondContact O-N 3.43Å; G282-Q284 PolarHBondContact O-N 2.91Å
283	R	94.6	Very high	94.3	Very high	14 Å²	14	48.4 Å²	48.4	5%	0.053	27%	0.268	C	S	.	.			trans	-73.8	124.9	-176.6	-71.4	178.9	-169.6	-71.4	2.7	110.8	A164 M228 V237 V240 E277 D278 T281	A164-R283 PolarHBondContact O-NE 2.91Å; A164-R283 VanDerWaalsContact O-NE 3.15Å; A164-R283 PolarHBondContact O-NH2 2.98Å; M228-R283 HydrophobicContact SD-CB 4.05Å; V237-R283 PolarHBondContact O-NH1 3.07Å; V237-R283 PolarHBondContact O-NH2 2.68Å; V240-R283 HydrophobicContact CG2-CG 4.44Å; E277-R283 WeakPolarHBondContact CA-O 3.48Å; D278-R283 HydrophobicContact CB-CB 4.31Å; D278-R283 PolarHBondContact N-O 2.88Å; T281-R283 PolarHBondContact O-N 2.98Å; T281-R283 VanDerWaalsContact O-N 3.16Å; T281-R283 VanDerWaalsContact OG1-CB 3.31Å; T281-R283 WeakPolarHBondContact OG1-CB 3.31Å; T281-R283 WeakPolarHBondContact OG1-CD 3.45Å; T281-R283 WeakPolarHBondContact OG1-CG 3.19Å; T281-R283 PolarHBondContact OG1-N 2.86Å
284	Q	95.9	Very high	94.1	Very high	6 Å²	6	55.6 Å²	55.6	3%	0.028	30%	0.3	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-89.2	129.7	179.9	-68.3	-179	-16.5	0	0	110.7	P229 S262 H263 E277 G282	P229-Q284 VanDerWaalsContact CD-O 3.28Å; P229-Q284 WeakPolarHBondContact CD-O 3.28Å; S262-Q284 VanDerWaalsContact CB-NE2 3.35Å; S262-Q284 PolarHBondContact O-OE1 3.41Å; S262-Q284 PolarHBondContact OG-NE2 3.11Å; H263-Q284 VanDerWaalsContact CD2-CD 3.46Å; E277-Q284 HydrophobicContact CB-CG 4.15Å; E277-Q284 HydrophobicContact CG-CG 3.88Å; E277-Q284 WeakPolarHBondContact OE2-CG 3.33Å; E277-Q284 PolarHBondContact OE2-NE2 3.41Å; G282-Q284 PolarHBondContact O-N 2.91Å
285	S	96.8	Very high	93.9	Very high	7 Å²	7	57.3 Å²	57.3	5%	0.049	32%	0.318	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-137.4	157.6	176.7	65.5	0	0	0	0	110.9	R226 A227 H263 V276	R226-S285 PolarHBondContact NH1-OG 3.37Å; R226-S285 VanDerWaalsContact NH1-OG 3.09Å; A227-S285 WeakPolarHBondContact O-CA 3.38Å; A227-S285 WeakPolarHBondContact O-CB 3.4Å; H263-S285 PolarHBondContact CE1-O 2.84Å; H263-S285 VanDerWaalsContact CE1-O 3.27Å; V276-S285 PolarHBondContact N-O 3.12Å; V276-S285 PolarHBondContact O-N 3.12Å; V276-S285 PolarHBondContact O-OG 3.33Å
286	V	97.1	Very high	93.6	Very high	0 Å²	0	59.2 Å²	59.2	0%	0	35%	0.351	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-118.2	133.4	169.8	62.4	0	0	0	0	109.1	R226 A227 I265 V267 A273 Q274 Y275 Y304	R226-V286 CarbonylContact C-O 3.55Å; R226-V286 WeakPolarHBondContact CA-O 3.3Å; A227-V286 HydrophobicContact CB-CG1 4.12Å; A227-V286 PolarHBondContact N-O 3.31Å; A227-V286 PolarHBondContact O-N 2.86Å; I265-V286 HydrophobicContact CB-CG1 4.26Å; I265-V286 HydrophobicContact CG2-CG1 3.86Å; V267-V286 HydrophobicContact CG2-CG1 4Å; V267-V286 HydrophobicContact CG2-CG2 3.74Å; A273-V286 HydrophobicContact CB-CG2 4.29Å; Q274-V286 CarbonylContact O-C 3.54Å; Q274-V286 WeakPolarHBondContact O-CA 3.35Å; Y275-V286 HydrophobicContact CD1-CB 4.07Å; Y275-V286 HydrophobicContact CD1-CG2 3.9Å; Y275-V286 HydrophobicContact CE1-CB 3.97Å; Y275-V286 HydrophobicContact CE1-CG2 3.56Å; Y275-V286 HydrophobicContact CE2-CG2 4.34Å; Y275-V286 HydrophobicContact CG-CG2 4.42Å; V286-Y304 HydrophobicContact CG1-CE1 4.07Å
287	L	97	Very high	93.5	Very high	19 Å²	19	59.7 Å²	59.7	10%	0.099	36%	0.355	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-107.9	141	176	-56.5	76.5	0	0	0	108.8	V224 I225 R226 A273 Q274 V276	V224-L287 HydrophobicContact CG2-CD2 4.24Å; I225-L287 CarbonylContact O-C 3.6Å; I225-L287 WeakPolarHBondContact O-CA 3.4Å; R226-L287 HydrophobicContact CB-CG 4.38Å; R226-L287 HydrophobicContact CG-CG 4.32Å; A273-L287 CarbonylContact C-O 3.45Å; A273-L287 WeakPolarHBondContact CA-O 3.16Å; Q274-L287 HydrophobicContact CB-CB 4.41Å; Q274-L287 PolarHBondContact N-O 2.93Å; Q274-L287 PolarHBondContact O-N 3.17Å; V276-L287 HydrophobicContact CB-CD1 3.81Å; V276-L287 HydrophobicContact CG2-CD1 3.5Å
288	V	96.9	Very high	93.3	Very high	6 Å²	6	62.3 Å²	62.3	4%	0.036	37%	0.367	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-126.6	136.7	170.6	-171.9	0	0	0	0	107.3	V224 I225 V267 N270 A273 Y290 V302	V224-V288 CarbonylContact C-O 3.58Å; V224-V288 WeakPolarHBondContact CA-O 3.47Å; I225-V288 PolarHBondContact N-O 3.18Å; I225-V288 PolarHBondContact O-N 2.82Å; V267-V288 HydrophobicContact CB-CG2 4.35Å; V267-V288 HydrophobicContact CG1-CG2 4Å; V267-V288 HydrophobicContact CG2-CG2 3.67Å; N270-V288 HydrophobicContact CB-CG1 4.44Å; A273-V288 HydrophobicContact CB-CG2 4.45Å; V288-Y290 PolarHBondContact O-N 2.7Å; V288-V302 HydrophobicContact CG2-CG1 4.1Å
289	P	96.3	Very high	93.5	Very high	48 Å²	48	63.4 Å²	63.4	31%	0.312	37%	0.37	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-53.2	139.2	170.6	-25.6	35.4	0	0	0	111.2	H272 E291	H272-P289 HydrophobicContact CB-CG 3.75Å; P289-E291 PolarHBondContact O-N 2.89Å
290	Y	96	Very high	93.7	Very high	35 Å²	35	58.4 Å²	58.4	14%	0.137	34%	0.337	C	S	.	.			trans	-73.6	111.5	171.1	175.2	-95.7	0	0	0	109.5	V215 P219 A223 I225 V288 P292 L327	V215-Y290 HydrophobicContact CB-CE2 4.34Å; V215-Y290 HydrophobicContact CG2-CD2 4.42Å; V215-Y290 HydrophobicContact CG2-CE2 3.55Å; P219-Y290 HydrophobicContact CG-CD1 3.36Å; P219-Y290 HydrophobicContact CG-CE1 3.49Å; P219-Y290 VanDerWaalsContact CG-CE1 3.49Å; P219-Y290 HydrophobicContact CG-CG 3.92Å; A223-Y290 WeakPolarHBondContact O-CB 3.4Å; A223-Y290 PolarHBondContact O-N 2.92Å; I225-Y290 HydrophobicContact CD1-CD2 4.09Å; I225-Y290 HydrophobicContact CG1-CD2 4.28Å; V288-Y290 PolarHBondContact O-N 2.7Å; Y290-P292 HydrophobicContact CE1-CB 4.45Å; Y290-P292 HydrophobicContact CE1-CG 4.15Å; Y290-L327 HydrophobicContact CD2-CD1 4.38Å; Y290-L327 HydrophobicContact CG-CD1 4.49Å
291	E	93.9	Very high	94.1	Very high	94 Å²	94	55.4 Å²	55.4	44%	0.439	32%	0.324	S	S	.	.	P	Polyproline II helix	trans	-97.4	128	169.9	-69.3	169.5	-156.3	0	0	108.3	N270 P289 T300	N270-E291 PolarHBondContact ND2-OE1 3.38Å; P289-E291 PolarHBondContact O-N 2.89Å; E291-T300 HydrophobicContact CB-CG2 4.34Å; E291-T300 WeakPolarHBondContact O-CB 3.31Å; E291-T300 WeakPolarHBondContact O-CG2 3.39Å; E291-T300 PolarHBondContact O-OG1 3.2Å
292	P	92.7	Very high	94.4	Very high	95 Å²	95	54.7 Å²	54.7	62%	0.617	32%	0.32	S	S	*	.	P	Polyproline II helix	trans	-58.7	152.4	174.9	-24.6	34.4	0	0	0	112.7	Y290	Y290-P292 HydrophobicContact CE1-CB 4.45Å; Y290-P292 HydrophobicContact CE1-CG 4.15Å
293	P	93.9	Very high	94.6	Very high	45 Å²	45	56.6 Å²	56.6	29%	0.292	33%	0.326	S	S	.	.	P	Polyproline II helix	trans	-61	148.7	175.9	26.4	-35.2	0	0	0	111.4	T300	P293-T300 WeakPolarHBondContact CA-OG1 3.39Å
294	Q	90.4	Very high	94.7	Very high	160 Å²	160	56.1 Å²	56.1	75%	0.748	32%	0.324	S	S	*	.	P	Polyproline II helix	trans	-68.9	152.1	176.8	-65	-177.1	-1.9	0	0	110.6	G296 T297	Q294-G296 PolarHBondContact O-N 2.64Å; Q294-T297 PolarHBondContact N-OG1 3.31Å; Q294-T297 VanDerWaalsContact N-OG1 3.1Å; Q294-T297 PolarHBondContact O-N 3.08Å; Q294-T297 PolarHBondContact O-OG1 3.09Å
295	V	90.7	Very high	94.8	Very high	159 Å²	159	56.5 Å²	56.5	96%	0.964	33%	0.326	S	S	*	.	T	Hydrogen-bonded Turn	trans	-55.9	123.3	-180	-178.6	0	0	0	0	110
296	G	89.8	Confident	94.8	Very high	84 Å²	84	56.2 Å²	56.2	87%	0.866	32%	0.324	S	S	*	.	T	Hydrogen-bonded Turn	trans	91.5	3.6	-174	0	0	0	0	0	115.3	Q294	Q294-G296 PolarHBondContact O-N 2.64Å
297	T	92.3	Very high	94.7	Very high	63 Å²	63	56.8 Å²	56.8	39%	0.387	33%	0.327	S	S	.	.			trans	-120.3	151.2	173	69.4	0	0	0	0	111.8	Q294	Q294-T297 PolarHBondContact N-OG1 3.31Å; Q294-T297 VanDerWaalsContact N-OG1 3.1Å; Q294-T297 PolarHBondContact O-N 3.08Å; Q294-T297 PolarHBondContact O-OG1 3.09Å
298	E	91.8	Very high	94.7	Very high	137 Å²	137	55.9 Å²	55.9	64%	0.64	32%	0.322	S	S	*	.	S	Bend	trans	-96.1	-2.6	178.1	-53	-178.5	132.9	0	0	113.5	K214	K214-E298 IonicContact NZ-OE2 3.21Å; K214-E298 PolarHBondContact NZ-OE2 3.33Å
299	F	95.1	Very high	94.7	Very high	59 Å²	59	57.1 Å²	57.1	26%	0.259	33%	0.328	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-150.6	147.5	-166.8	57	-95.1	0	0	0	112.4	Q212 I213 K214	Q212-F299 HydrophobicContact CB-CB 4.11Å; Q212-F299 HydrophobicContact CB-CD2 3.87Å; Q212-F299 HydrophobicContact CB-CG 4.04Å; Q212-F299 HydrophobicContact CG-CD2 3.61Å; Q212-F299 HydrophobicContact CG-CE2 3.85Å; Q212-F299 HydrophobicContact CG-CG 4.15Å; Q212-F299 VanDerWaalsContact NE2-CE2 3.31Å; Q212-F299 VanDerWaalsContact NE2-CZ 3.26Å; I213-F299 VanDerWaalsContact O-CA 3.29Å; I213-F299 WeakPolarHBondContact O-CA 3.36Å; I213-F299 WeakPolarHBondContact O-CB 3.48Å; K214-F299 HydrophobicContact CG-CB 3.79Å
300	T	95.4	Very high	94.8	Very high	26 Å²	26	55.6 Å²	55.6	16%	0.16	32%	0.319	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-97.8	133.5	169.1	-55.7	0	0	0	0	108.4	I213 E291 P293	I213-T300 PolarHBondContact N-O 3.11Å; I213-T300 PolarHBondContact O-N 2.89Å; E291-T300 HydrophobicContact CB-CG2 4.34Å; E291-T300 WeakPolarHBondContact O-CB 3.31Å; E291-T300 WeakPolarHBondContact O-CG2 3.39Å; E291-T300 PolarHBondContact O-OG1 3.2Å; P293-T300 WeakPolarHBondContact CA-OG1 3.39Å
301	T	96.1	Very high	94.8	Very high	61 Å²	61	57.1 Å²	57.1	37%	0.374	34%	0.335	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-100.1	122.1	-178.7	-57.2	0	0	0	0	110.6	P210 I211 L303	P210-T301 HydrophobicContact CB-CG2 3.6Å; I211-T301 WeakPolarHBondContact O-CA 3.43Å; T301-L303 HydrophobicContact CG2-CD2 4.14Å
302	V	97.3	Very high	94.9	Very high	12 Å²	12	53.6 Å²	53.6	7%	0.073	32%	0.32	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-101.7	129.4	171.5	-175.2	0	0	0	0	108.8	I211 I213 V267 V288 Y304	I211-V302 PolarHBondContact N-O 3.22Å; I211-V302 PolarHBondContact O-N 2.88Å; I213-V302 HydrophobicContact CG1-CG2 3.92Å; V267-V302 HydrophobicContact CG1-CG1 4.08Å; V267-V302 HydrophobicContact CG2-CG1 4.33Å; V288-V302 HydrophobicContact CG2-CG1 4.1Å; V302-Y304 HydrophobicContact CB-CD2 4.17Å; V302-Y304 HydrophobicContact CB-CE2 3.61Å; V302-Y304 HydrophobicContact CG1-CD1 4.37Å; V302-Y304 HydrophobicContact CG1-CD2 3.95Å; V302-Y304 HydrophobicContact CG1-CE1 3.91Å; V302-Y304 HydrophobicContact CG1-CE2 3.46Å; V302-Y304 VanDerWaalsContact CG1-CE2 3.46Å; V302-Y304 HydrophobicContact CG1-CG 4.4Å; V302-Y304 VanDerWaalsContact CG1-CZ 3.44Å
303	L	96.9	Very high	95	Very high	59 Å²	59	54.6 Å²	54.6	31%	0.309	33%	0.325	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-91.5	107.7	-178.8	-58	-178.3	0	0	0	109.2	T208 P210 V267 E268 T301	T208-L303 HydrophobicContact CG2-CB 3.76Å; T208-L303 HydrophobicContact CG2-CD1 4.23Å; T208-L303 HydrophobicContact CG2-CD2 4.14Å; T208-L303 HydrophobicContact CG2-CG 4.26Å; P210-L303 HydrophobicContact CB-CD2 3.88Å; V267-L303 CarbonylContact C-O 3.54Å; V267-L303 VanDerWaalsContact CA-O 3.29Å; V267-L303 WeakPolarHBondContact CA-O 3.41Å; E268-L303 HydrophobicContact CB-CB 4.07Å; E268-L303 PolarHBondContact N-O 3.49Å; T301-L303 HydrophobicContact CG2-CD2 4.14Å
304	Y	97.6	Very high	94.8	Very high	3 Å²	3	55.1 Å²	55.1	1%	0.012	34%	0.338	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-106.8	141.9	-178.3	-69.8	-76.7	0	0	0	112.8	C209 I211 A227 I265 R266 V267 V286 V302	C209-Y304 WeakPolarHBondContact CA-O 3.29Å; C209-Y304 VanDerWaalsContact CB-O 3.28Å; C209-Y304 WeakPolarHBondContact CB-O 3.47Å; C209-Y304 PolarHBondContact N-O 3.43Å; C209-Y304 PolarHBondContact O-N 2.62Å; I211-Y304 HydrophobicContact CB-CD2 3.89Å; I211-Y304 HydrophobicContact CB-CE2 4.12Å; I211-Y304 HydrophobicContact CD1-CD2 3.66Å; I211-Y304 HydrophobicContact CD1-CE2 4.26Å; I211-Y304 HydrophobicContact CD1-CG 4.43Å; I211-Y304 HydrophobicContact CG1-CD2 3.84Å; I211-Y304 HydrophobicContact CG1-CE2 4.49Å; A227-Y304 HydrophobicContact CB-CE1 3.76Å; I265-Y304 HydrophobicContact CG2-CD1 3.61Å; I265-Y304 HydrophobicContact CG2-CE1 4.21Å; I265-Y304 HydrophobicContact CG2-CG 4.46Å; R266-Y304 CarbonylContact O-C 3.47Å; R266-Y304 VanDerWaalsContact O-CA 3.3Å; R266-Y304 WeakPolarHBondContact O-CA 3.42Å; V267-Y304 HydrophobicContact CG2-CD1 3.73Å; V267-Y304 HydrophobicContact CG2-CE1 3.62Å; V286-Y304 HydrophobicContact CG1-CE1 4.07Å; V302-Y304 HydrophobicContact CB-CD2 4.17Å; V302-Y304 HydrophobicContact CB-CE2 3.61Å; V302-Y304 HydrophobicContact CG1-CD1 4.37Å; V302-Y304 HydrophobicContact CG1-CD2 3.95Å; V302-Y304 HydrophobicContact CG1-CE1 3.91Å; V302-Y304 HydrophobicContact CG1-CE2 3.46Å; V302-Y304 VanDerWaalsContact CG1-CE2 3.46Å; V302-Y304 HydrophobicContact CG1-CG 4.4Å; V302-Y304 VanDerWaalsContact CG1-CZ 3.44Å
305	N	96.1	Very high	94.9	Very high	14 Å²	14	48 Å²	48	8%	0.075	31%	0.307	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-125.9	131.1	179.4	-56.6	52.3	0	0	0	108.8	A206 T208 R266 E268 M307	A206-N305 PolarHBondContact O-ND2 2.96Å; T208-N305 PolarHBondContact N-ND2 2.81Å; R266-N305 HydrophobicContact CB-CB 4.5Å; R266-N305 PolarHBondContact N-O 3.37Å; R266-N305 PolarHBondContact O-N 2.76Å; E268-N305 WeakPolarHBondContact CB-OD1 3.42Å; E268-N305 PolarHBondContact OE2-ND2 3.25Å; E268-N305 PolarHBondContact OE2-OD1 3.15Å; N305-M307 HydrophobicContact CB-SD 3.88Å
306	F	97.3	Very high	95.1	Very high	1 Å²	1	40.4 Å²	40.4	0%	0.004	26%	0.261	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-106.6	114.4	-175.9	-62.6	-91	0	0	0	111.1	L201 I205 A206 C209 L264 I265 C308 I323 I344	L201-F306 HydrophobicContact CD2-CE2 3.75Å; L201-F306 HydrophobicContact CD2-CZ 4.02Å; I205-F306 WeakPolarHBondContact CA-O 3.39Å; A206-F306 PolarHBondContact N-O 2.77Å; C209-F306 HydrophobicContact CB-CE2 4.24Å; L264-F306 WeakPolarHBondContact O-CA 3.32Å; I265-F306 HydrophobicContact CD1-CE1 4.35Å; I265-F306 HydrophobicContact CG1-CD1 4.23Å; I265-F306 HydrophobicContact CG1-CE1 4.06Å; F306-C308 PolarHBondContact O-N 3.03Å; F306-I323 HydrophobicContact CE1-CD1 3.81Å; F306-I323 HydrophobicContact CE1-CG1 4.07Å; F306-I323 HydrophobicContact CZ-CG1 4.45Å; F306-I344 HydrophobicContact CB-CD1 4.23Å; F306-I344 HydrophobicContact CB-CG1 3.49Å; F306-I344 VanDerWaalsContact CB-CG1 3.49Å; F306-I344 HydrophobicContact CB-CG2 4.49Å; F306-I344 HydrophobicContact CD1-CD1 4.34Å; F306-I344 HydrophobicContact CD1-CG1 4.48Å; F306-I344 HydrophobicContact CG-CD1 4.43Å; F306-I344 HydrophobicContact CG-CG1 4.11Å
307	M	95.9	Very high	95.4	Very high	12 Å²	12	40.2 Å²	40.2	6%	0.059	24%	0.24	C	C	.	.			trans	-95.4	14.3	-157	-52.6	-52.7	-64.7	0	0	115.4	A206 R243 F253 L264 R266 N305	A206-M307 HydrophobicContact CB-CE 3.73Å; A206-M307 HydrophobicContact CB-SD 4.05Å; R243-M307 PolarHBondContact NE-O 3.35Å; R243-M307 PolarHBondContact NH2-O 3.02Å; R243-M307 VanDerWaalsContact NH2-O 3.08Å; F253-M307 HydrophobicContact CB-CE 3.94Å; F253-M307 HydrophobicContact CD1-CE 4.29Å; F253-M307 HydrophobicContact CG-CE 4.48Å; L264-M307 PolarHBondContact O-N 2.63Å; R266-M307 HydrophobicContact CB-CG 4.31Å; R266-M307 HydrophobicContact CB-SD 4.46Å; R266-M307 HydrophobicContact CG-CG 3.74Å; R266-M307 HydrophobicContact CG-SD 4.39Å; N305-M307 HydrophobicContact CB-SD 3.88Å
308	C	96.7	Very high	95.6	Very high	0 Å²	0	47 Å²	47	0%	0	26%	0.259	C	S	.	.	S	Bend	trans	-153.8	139.8	174.6	-173.7	0	0	0	0	110.4	R243 H247 L264 F306 C312 M316 I344	R243-C308 HydrophobicContact CB-CB 4.14Å; R243-C308 HydrophobicContact CG-CB 4.04Å; H247-C308 PolarHBondContact ND1-SG 3.22Å; L264-C308 HydrophobicContact CD1-CB 3.73Å; F306-C308 PolarHBondContact O-N 3.03Å; C308-C312 VanDerWaalsContact SG-CB 3.52Å; C308-C312 VanDerWaalsContact SG-SG 3.64Å; C308-M316 HydrophobicContact CB-CE 4.2Å; C308-M316 WeakPolarHBondContact O-CE 3.4Å; C308-I344 WeakPolarHBondContact O-CB 3.46Å; C308-I344 WeakPolarHBondContact O-CG2 3.15Å
309	N	97.4	Very high	95.8	Very high	32 Å²	32	42.7 Å²	42.7	17%	0.171	24%	0.237	C	C	.	.			trans	-67.8	143.7	173.6	-71.5	-68.6	0	0	0	111	S311 C312	N309-S311 PolarHBondContact O-N 2.78Å; N309-S311 VanDerWaalsContact O-N 3.13Å; N309-C312 WeakPolarHBondContact O-CB 3.33Å; N309-C312 PolarHBondContact O-N 3.22Å; N309-C312 VanDerWaalsContact O-N 3.13Å; N309-C312 PolarHBondContact O-SG 3.09Å
310	S	97.4	Very high	95.9	Very high	16 Å²	16	42 Å²	42	11%	0.112	24%	0.238	C	C	.	.	T	Hydrogen-bonded Turn	trans	-62.8	-21.1	178	-61.5	0	0	0	0	112.7	R318 I344	S310-R318 VanDerWaalsContact O-CA 3.22Å; S310-R318 WeakPolarHBondContact O-CA 3.41Å; S310-R318 PolarHBondContact O-N 2.88Å; S310-I344 PolarHBondContact N-O 3.24Å; S310-I344 PolarHBondContact OG-N 3.16Å
311	S	96.8	Very high	96	Very high	67 Å²	67	40.7 Å²	40.7	47%	0.469	23%	0.23	S	C	.	.	T	Hydrogen-bonded Turn	trans	-81.6	-5.2	177.7	53.6	0	0	0	0	115.4	N309 V313	N309-S311 PolarHBondContact O-N 2.78Å; N309-S311 VanDerWaalsContact O-N 3.13Å; S311-V313 PolarHBondContact O-N 3Å
312	C	96.2	Very high	96.1	Very high	20 Å²	20	38.7 Å²	38.7	14%	0.135	22%	0.217	C	C	.	.			trans	-70.2	121.7	-173.1	-73.3	0	0	0	0	113.7	C244 H247 C308 N309 G315 N317	C244-C312 HydrophobicContact CB-CB 3.97Å; H247-C312 PolarHBondContact CE1-SG 3.13Å; C308-C312 VanDerWaalsContact SG-CB 3.52Å; C308-C312 VanDerWaalsContact SG-SG 3.64Å; N309-C312 WeakPolarHBondContact O-CB 3.33Å; N309-C312 PolarHBondContact O-N 3.22Å; N309-C312 VanDerWaalsContact O-N 3.13Å; N309-C312 PolarHBondContact O-SG 3.09Å; C312-G315 PolarHBondContact O-N 3.38Å; C312-N317 VanDerWaalsContact O-CA 3.25Å; C312-N317 WeakPolarHBondContact O-CA 3.24Å; C312-N317 PolarHBondContact O-N 2.87Å
313	V	94.7	Very high	96.2	Very high	117 Å²	117	38.2 Å²	38.2	71%	0.709	21%	0.214	S	C	*	.	T	Hydrogen-bonded Turn	trans	-60.6	143.5	166.8	-175.7	0	0	0	0	109.4	C244 S311 G315	C244-V313 WeakPolarHBondContact CB-O 3.26Å; S311-V313 PolarHBondContact O-N 3Å; V313-G315 PolarHBondContact O-N 2.85Å
314	G	89.5	Confident	96.2	Very high	56 Å²	56	35.6 Å²	35.6	58%	0.577	20%	0.2	S	C	*	.	T	Hydrogen-bonded Turn	trans	74.5	1.9	-175.8	0	0	0	0	0	115.1	P245	P245-G314 WeakPolarHBondContact CD-O 3.35Å
315	G	91.9	Very high	96.2	Very high	9 Å²	9	35.5 Å²	35.5	9%	0.093	20%	0.2	C	C	.	.	T	Hydrogen-bonded Turn	trans	-130.3	-124.9	169.7	0	0	0	0	0	110	C312 V313 N317	C312-G315 PolarHBondContact O-N 3.38Å; V313-G315 PolarHBondContact O-N 2.85Å; G315-N317 PolarHBondContact O-N 3.47Å; G315-N317 VanDerWaalsContact O-N 3.14Å
316	M	95.8	Very high	96.3	Very high	0 Å²	0	35.1 Å²	35.1	0%	0	20%	0.198	C	C	.	.	T	Hydrogen-bonded Turn	trans	-54.1	-31.9	177	-79.2	179.8	-87.1	0	0	114.6	Y231 V241 L264 C308 R318 R319 I321 I344	Y231-M316 HydrophobicContact CE1-CG 4.37Å; V241-M316 HydrophobicContact CG1-CG 3.89Å; L264-M316 HydrophobicContact CD1-CE 3.69Å; L264-M316 HydrophobicContact CD2-CE 3.85Å; L264-M316 HydrophobicContact CD2-SD 4.08Å; L264-M316 HydrophobicContact CG-CE 4.47Å; C308-M316 HydrophobicContact CB-CE 4.2Å; C308-M316 WeakPolarHBondContact O-CE 3.4Å; M316-R318 PolarHBondContact O-N 2.88Å; M316-R319 WeakPolarHBondContact O-CB 3.4Å; M316-R319 VanDerWaalsContact O-CG 3.29Å; M316-R319 WeakPolarHBondContact O-CG 3.25Å; M316-R319 PolarHBondContact O-N 2.87Å; M316-R319 PolarHBondContact O-NE 3.47Å; M316-I321 HydrophobicContact CG-CG2 4.11Å; M316-I321 HydrophobicContact SD-CD1 3.73Å; M316-I321 HydrophobicContact SD-CG1 4.17Å; M316-I321 HydrophobicContact SD-CG2 4.01Å; M316-I344 HydrophobicContact CE-CD1 4.1Å; M316-I344 HydrophobicContact SD-CD1 4.33Å
317	N	95.9	Very high	96.4	Very high	80 Å²	80	35 Å²	35	43%	0.428	20%	0.198	S	C	.	.	T	Hydrogen-bonded Turn	trans	47.9	49.8	175.8	-163.7	25.9	0	0	0	114.9	C312 G315 R319	C312-N317 VanDerWaalsContact O-CA 3.25Å; C312-N317 WeakPolarHBondContact O-CA 3.24Å; C312-N317 PolarHBondContact O-N 2.87Å; G315-N317 PolarHBondContact O-N 3.47Å; G315-N317 VanDerWaalsContact O-N 3.14Å; N317-R319 PolarHBondContact O-N 2.79Å; N317-R319 VanDerWaalsContact O-N 3.15Å
318	R	95.5	Very high	96.5	Very high	206 Å²	206	35 Å²	35	78%	0.777	20%	0.198	S	C	*	.	T	Hydrogen-bonded Turn	trans	63.7	7	-177	-54	179.9	-177.3	-152.4	1.4	115.5	S310 M316	S310-R318 VanDerWaalsContact O-CA 3.22Å; S310-R318 WeakPolarHBondContact O-CA 3.41Å; S310-R318 PolarHBondContact O-N 2.88Å; M316-R318 PolarHBondContact O-N 2.88Å
319	R	96.8	Very high	96.4	Very high	46 Å²	46	35.8 Å²	35.8	17%	0.174	20%	0.202	C	C	.	.			trans	-77.7	128	175.9	-55.8	-178.6	-76	-178.4	8.8	109.3	Y231 H236 E239 M316 N317	Y231-R319 HydrophobicContact CD1-CB 3.7Å; Y231-R319 HydrophobicContact CE1-CB 3.78Å; Y231-R319 PolarHBondContact OH-NH2 2.84Å; Y231-R319 VanDerWaalsContact OH-NH2 3.08Å; H236-R319 PolarHBondContact CD2-NH1 3.1Å; H236-R319 WeakPolarHBondContact CE1-CD 3.47Å; H236-R319 WeakPolarHBondContact ND1-CD 3.42Å; H236-R319 WeakPolarHBondContact NE2-CD 3.46Å; H236-R319 PolarHBondContact NE2-NH1 3.34Å; E239-R319 IonicContact OE1-CZ 2.7Å; E239-R319 IonicContact OE1-NH1 2.78Å; E239-R319 PolarHBondContact OE1-NH1 2.83Å; E239-R319 IonicContact OE2-CZ 3.17Å; E239-R319 IonicContact OE2-NH1 2.64Å; E239-R319 PolarHBondContact OE2-NH1 2.9Å; E239-R319 IonicContact OE2-NH2 2.7Å; E239-R319 PolarHBondContact OE2-NH2 3.17Å; M316-R319 WeakPolarHBondContact O-CB 3.4Å; M316-R319 VanDerWaalsContact O-CG 3.29Å; M316-R319 WeakPolarHBondContact O-CG 3.25Å; M316-R319 PolarHBondContact O-N 2.87Å; M316-R319 PolarHBondContact O-NE 3.47Å; N317-R319 PolarHBondContact O-N 2.79Å; N317-R319 VanDerWaalsContact O-N 3.15Å
320	P	96.9	Very high	96.1	Very high	44 Å²	44	44.6 Å²	44.6	29%	0.286	23%	0.233	S	C	.	.			trans	-68.9	144.3	-179	27.4	-33.6	0	0	0	111	K232 K233	K232-P320 HydrophobicContact CB-CB 4.25Å; K232-P320 HydrophobicContact CB-CG 4.23Å; K232-P320 WeakPolarHBondContact CB-O 3.36Å; K232-P320 PolarHBondContact N-O 2.92Å; K233-P320 HydrophobicContact CG-CG 4.49Å
321	I	98.1	Very high	95.7	Very high	0 Å²	0	50.9 Å²	50.9	0%	0	27%	0.266	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-118.4	147.1	179	62.2	165.9	0	0	0	111.5	P229 V230 Y231 V241 L264 M316 I323 E341 A342 I344	P229-I321 HydrophobicContact CB-CD1 4.4Å; V230-I321 CarbonylContact O-C 3.58Å; V230-I321 WeakPolarHBondContact O-CA 3.33Å; V230-I321 WeakPolarHBondContact O-CB 3.24Å; Y231-I321 HydrophobicContact CD1-CG2 3.76Å; Y231-I321 HydrophobicContact CE1-CG2 4.03Å; V241-I321 HydrophobicContact CG1-CG2 3.98Å; V241-I321 HydrophobicContact CG2-CG2 3.94Å; L264-I321 HydrophobicContact CD2-CD1 3.79Å; M316-I321 HydrophobicContact CG-CG2 4.11Å; M316-I321 HydrophobicContact SD-CD1 3.73Å; M316-I321 HydrophobicContact SD-CG1 4.17Å; M316-I321 HydrophobicContact SD-CG2 4.01Å; I321-I323 HydrophobicContact CD1-CD1 3.82Å; I321-E341 WeakPolarHBondContact O-CA 3.46Å; I321-E341 WeakPolarHBondContact O-CG 3.41Å; I321-A342 HydrophobicContact CD1-CB 4.27Å; I321-A342 HydrophobicContact CG1-CB 4.19Å; I321-A342 WeakPolarHBondContact CG1-O 3.38Å; I321-A342 PolarHBondContact O-N 2.88Å; I321-I344 HydrophobicContact CD1-CD1 4.19Å
322	L	97.8	Very high	95.3	Very high	18 Å²	18	49.4 Å²	49.4	9%	0.094	26%	0.261	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-96.7	142.4	160.7	-62	175.9	0	0	0	108.6	N168 P229 V230 K232 F340 E341	N168-L322 HydrophobicContact CB-CD1 3.83Å; P229-L322 WeakPolarHBondContact CA-O 3.42Å; V230-L322 HydrophobicContact CG2-CB 4Å; V230-L322 PolarHBondContact N-O 2.66Å; V230-L322 PolarHBondContact O-N 3.04Å; K232-L322 HydrophobicContact CB-CD2 4.39Å; K232-L322 HydrophobicContact CB-CG 3.94Å; K232-L322 HydrophobicContact CD-CD2 3.85Å; K232-L322 HydrophobicContact CD-CG 4.32Å; K232-L322 HydrophobicContact CG-CD1 4.33Å; K232-L322 HydrophobicContact CG-CD2 4.07Å; K232-L322 HydrophobicContact CG-CG 3.99Å; L322-F340 CarbonylContact C-O 3.55Å; L322-F340 VanDerWaalsContact CA-O 3.31Å; L322-F340 WeakPolarHBondContact CA-O 3.42Å; L322-E341 HydrophobicContact CD2-CB 4.16Å
323	I	98.3	Very high	95.2	Very high	3 Å²	3	54.7 Å²	54.7	2%	0.015	28%	0.283	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-96.4	118.9	161	-47.8	-54.7	0	0	0	106.4	A227 P229 I265 F306 I321 V325 C339 F340 A342	A227-I323 HydrophobicContact CB-CG2 4.46Å; P229-I323 HydrophobicContact CB-CD1 4.01Å; I265-I323 HydrophobicContact CD1-CD1 4.06Å; I265-I323 HydrophobicContact CD1-CG2 4.05Å; F306-I323 HydrophobicContact CE1-CD1 3.81Å; F306-I323 HydrophobicContact CE1-CG1 4.07Å; F306-I323 HydrophobicContact CZ-CG1 4.45Å; I321-I323 HydrophobicContact CD1-CD1 3.82Å; I323-V325 HydrophobicContact CG2-CG2 4.08Å; I323-C339 WeakPolarHBondContact O-CA 3.39Å; I323-F340 HydrophobicContact CB-CD1 4.49Å; I323-F340 HydrophobicContact CB-CD2 4.24Å; I323-F340 HydrophobicContact CB-CE1 4.01Å; I323-F340 HydrophobicContact CB-CE2 3.73Å; I323-F340 HydrophobicContact CB-CZ 3.6Å; I323-F340 HydrophobicContact CG1-CD2 4.23Å; I323-F340 HydrophobicContact CG1-CE2 3.59Å; I323-F340 HydrophobicContact CG1-CZ 3.89Å; I323-F340 HydrophobicContact CG2-CE1 4.21Å; I323-F340 HydrophobicContact CG2-CE2 4.43Å; I323-F340 HydrophobicContact CG2-CZ 3.85Å; I323-F340 PolarHBondContact N-O 2.82Å; I323-F340 PolarHBondContact O-N 3.25Å; I323-A342 HydrophobicContact CD1-CB 3.97Å; I323-A342 HydrophobicContact CG1-CB 3.69Å
324	I	97.8	Very high	95.3	Very high	3 Å²	3	51.5 Å²	51.5	2%	0.015	26%	0.264	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-90.6	119.5	169.1	-60.3	172.7	0	0	0	106.2	P166 A227 M228 V230 T326 R337	P166-I324 HydrophobicContact CB-CD1 4.06Å; P166-I324 HydrophobicContact CG-CD1 3.93Å; A227-I324 WeakPolarHBondContact CA-O 3.36Å; M228-I324 HydrophobicContact CE-CD1 4.36Å; M228-I324 PolarHBondContact N-O 3.01Å; M228-I324 PolarHBondContact O-N 2.63Å; V230-I324 HydrophobicContact CG1-CD1 4.01Å; V230-I324 HydrophobicContact CG2-CD1 3.79Å; V230-I324 HydrophobicContact CG2-CG1 4.15Å; I324-T326 HydrophobicContact CG2-CG2 4.21Å; I324-R337 HydrophobicContact CG2-CG 3.81Å
325	V	98.3	Very high	95.7	Very high	1 Å²	1	49.6 Å²	49.6	1%	0.006	24%	0.241	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-108.5	127.3	170.1	-169.8	0	0	0	0	108.2	F177 V179 I213 I225 R226 I323 R337 R338 F340	F177-V325 HydrophobicContact CZ-CG1 3.98Å; V179-V325 HydrophobicContact CG2-CB 4.23Å; V179-V325 HydrophobicContact CG2-CG1 4.27Å; I213-V325 HydrophobicContact CD1-CG1 4.36Å; I225-V325 HydrophobicContact CG2-CG1 3.74Å; R226-V325 CarbonylContact O-C 3.52Å; R226-V325 VanDerWaalsContact O-CA 3.28Å; R226-V325 WeakPolarHBondContact O-CA 3.43Å; I323-V325 HydrophobicContact CG2-CG2 4.08Å; V325-R337 CarbonylContact O-C 3.53Å; V325-R337 VanDerWaalsContact O-CA 3.32Å; V325-R337 WeakPolarHBondContact O-CA 3.33Å; V325-R338 PolarHBondContact N-O 2.99Å; V325-R338 PolarHBondContact O-N 3.05Å; V325-F340 HydrophobicContact CG2-CE1 3.76Å
326	T	98.1	Very high	95.9	Very high	6 Å²	6	49.2 Å²	49.2	4%	0.037	24%	0.236	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-122.9	139.7	178.7	34.9	0	0	0	0	111.4	I225 R226 I324 E328 V334 G336 R337	I225-T326 CarbonylContact C-O 3.55Å; I225-T326 WeakPolarHBondContact CA-O 3.28Å; R226-T326 PolarHBondContact N-O 2.79Å; R226-T326 PolarHBondContact O-N 3.04Å; I324-T326 HydrophobicContact CG2-CG2 4.21Å; T326-E328 VanDerWaalsContact CB-OE1 3.3Å; T326-E328 WeakPolarHBondContact CB-OE1 3.07Å; T326-E328 PolarHBondContact OG1-OE1 3.33Å; T326-V334 HydrophobicContact CG2-CG1 3.76Å; T326-V334 HydrophobicContact CG2-CG2 4.21Å; T326-G336 CarbonylContact C-O 3.28Å; T326-G336 VanDerWaalsContact CA-O 3.23Å; T326-G336 WeakPolarHBondContact CA-O 3.19Å; T326-R337 HydrophobicContact CG2-CB 3.88Å; T326-R337 HydrophobicContact CG2-CG 3.7Å
327	L	98.2	Very high	96.1	Very high	0 Å²	0	51.2 Å²	51.2	0%	0	24%	0.244	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-90.6	124.2	160	174.2	68.6	0	0	0	106.8	H175 F177 V215 P219 A223 V224 I225 Y290 L335 G336	H175-L327 HydrophobicContact CB-CD2 4.22Å; F177-L327 HydrophobicContact CD2-CB 3.58Å; F177-L327 HydrophobicContact CD2-CD2 4.01Å; F177-L327 HydrophobicContact CD2-CG 4.36Å; F177-L327 HydrophobicContact CE2-CB 3.69Å; F177-L327 HydrophobicContact CG-CB 4.04Å; F177-L327 HydrophobicContact CZ-CB 4.26Å; V215-L327 HydrophobicContact CG1-CD2 4.43Å; P219-L327 HydrophobicContact CB-CD1 4.32Å; P219-L327 HydrophobicContact CB-CD2 4.25Å; P219-L327 HydrophobicContact CG-CD1 4.31Å; A223-L327 HydrophobicContact CB-CD1 4.13Å; V224-L327 WeakPolarHBondContact O-CA 3.36Å; I225-L327 HydrophobicContact CD1-CB 4.15Å; I225-L327 HydrophobicContact CD1-CD1 3.6Å; I225-L327 HydrophobicContact CD1-CG 4.48Å; Y290-L327 HydrophobicContact CD2-CD1 4.38Å; Y290-L327 HydrophobicContact CG-CD1 4.49Å; L327-L335 HydrophobicContact CD2-CB 4.1Å; L327-L335 HydrophobicContact CG-CB 4.03Å; L327-L335 HydrophobicContact CG-CD1 4.38Å; L327-L335 PolarHBondContact O-N 2.84Å; L327-G336 PolarHBondContact N-O 3.02Å; L327-G336 PolarHBondContact O-N 3.44Å; L327-G336 VanDerWaalsContact O-N 3.15Å
328	E	97.5	Very high	96.1	Very high	11 Å²	11	49.8 Å²	49.8	5%	0.051	23%	0.233	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-129.2	152.5	-175.2	-74.5	164.7	-146.8	0	0	111.3	A223 V224 R226 T326 Q333 V334	A223-E328 CarbonylContact C-O 3.56Å; A223-E328 WeakPolarHBondContact CA-O 3.48Å; A223-E328 WeakPolarHBondContact CB-O 3.32Å; V224-E328 HydrophobicContact CG2-CB 3.89Å; V224-E328 PolarHBondContact N-O 3.26Å; V224-E328 PolarHBondContact O-N 2.92Å; R226-E328 WeakPolarHBondContact CD-OE1 3.42Å; R226-E328 IonicContact CZ-OE2 3.71Å; R226-E328 VanDerWaalsContact NE-CD 3.3Å; R226-E328 IonicContact NE-OE1 3.92Å; R226-E328 PolarHBondContact NE-OE1 3.34Å; R226-E328 IonicContact NE-OE2 3.21Å; R226-E328 PolarHBondContact NE-OE2 3.31Å; R226-E328 IonicContact NH2-OE2 2.71Å; R226-E328 PolarHBondContact NH2-OE2 3.25Å; T326-E328 VanDerWaalsContact CB-OE1 3.3Å; T326-E328 WeakPolarHBondContact CB-OE1 3.07Å; T326-E328 PolarHBondContact OG1-OE1 3.33Å; E328-Q333 CarbonylContact C-O 3.52Å; E328-Q333 VanDerWaalsContact CA-O 3.24Å; E328-Q333 WeakPolarHBondContact CA-O 3.45Å; E328-V334 HydrophobicContact CG-CG2 3.97Å
329	T	95.8	Very high	96.2	Very high	16 Å²	16	40.8 Å²	40.8	10%	0.098	20%	0.201	C	C	.	.			trans	-68.1	166.6	161.5	67.9	0	0	0	0	110.4	D331 G332 Q333 L335	T329-D331 PolarHBondContact O-N 3.1Å; T329-D331 VanDerWaalsContact O-N 3.12Å; T329-D331 PolarHBondContact OG1-N 2.98Å; T329-G332 PolarHBondContact O-N 2.76Å; T329-Q333 HydrophobicContact CG2-CB 3.99Å; T329-Q333 PolarHBondContact N-O 3.1Å; T329-Q333 WeakPolarHBondContact OG1-CB 3.24Å; T329-Q333 PolarHBondContact OG1-N 2.77Å; T329-Q333 VanDerWaalsContact OG1-N 3.11Å; T329-L335 HydrophobicContact CG2-CD1 3.92Å; T329-L335 HydrophobicContact CG2-CD2 3.94Å; T329-L335 HydrophobicContact CG2-CG 3.96Å
330	R	89.9	Confident	96.3	Very high	218 Å²	218	38.9 Å²	38.9	82%	0.823	19%	0.194	S	C	*	.	T	Hydrogen-bonded Turn	trans	-53.4	-30.6	171.4	-170.9	178.8	-178.8	-171.7	-0.3	113	G332	R330-G332 VanDerWaalsContact C-N 3.31Å
331	D	89.3	Confident	96.3	Very high	148 Å²	148	38 Å²	38	79%	0.791	19%	0.186	S	C	*	.	T	Hydrogen-bonded Turn	trans	-88.6	6	-178.2	-36.5	-71.4	0	0	0	113	T329	T329-D331 PolarHBondContact O-N 3.1Å; T329-D331 VanDerWaalsContact O-N 3.12Å; T329-D331 PolarHBondContact OG1-N 2.98Å
332	G	89.1	Confident	96.3	Very high	35 Å²	35	38.1 Å²	38.1	36%	0.361	19%	0.187	S	C	.	.			trans	84.1	8.9	176.6	0	0	0	0	0	115.6	T329 R330 V334	T329-G332 PolarHBondContact O-N 2.76Å; R330-G332 VanDerWaalsContact C-N 3.31Å; G332-V334 PolarHBondContact O-N 3.2Å
333	Q	94.2	Very high	96.3	Very high	132 Å²	132	40.6 Å²	40.6	62%	0.617	20%	0.195	S	C	*	.			trans	-72	119.6	175.5	-172.2	-173.6	30.6	0	0	110	E328 T329 L335	E328-Q333 CarbonylContact C-O 3.52Å; E328-Q333 VanDerWaalsContact CA-O 3.24Å; E328-Q333 WeakPolarHBondContact CA-O 3.45Å; T329-Q333 HydrophobicContact CG2-CB 3.99Å; T329-Q333 PolarHBondContact N-O 3.1Å; T329-Q333 WeakPolarHBondContact OG1-CB 3.24Å; T329-Q333 PolarHBondContact OG1-N 2.77Å; T329-Q333 VanDerWaalsContact OG1-N 3.11Å; Q333-L335 PolarHBondContact O-N 2.87Å
334	V	96.6	Very high	96.3	Very high	49 Å²	49	40.5 Å²	40.5	30%	0.297	20%	0.195	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-71.3	110.4	179.7	-179.2	0	0	0	0	110.9	T326 E328 G332 G336 R337	T326-V334 HydrophobicContact CG2-CG1 3.76Å; T326-V334 HydrophobicContact CG2-CG2 4.21Å; E328-V334 HydrophobicContact CG-CG2 3.97Å; G332-V334 PolarHBondContact O-N 3.2Å; V334-G336 WeakPolarHBondContact CG1-O 3.46Å; V334-R337 HydrophobicContact CG1-CB 4.5Å
335	L	97.2	Very high	96.3	Very high	17 Å²	17	40.9 Å²	40.9	9%	0.089	20%	0.197	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-87.5	-19.2	174.2	-60.5	177.5	0	0	0	112.8	G173 P174 P219 P220 L327 T329 Q333	G173-L335 WeakPolarHBondContact CA-O 3.36Å; P174-L335 WeakPolarHBondContact CD-O 3.45Å; P219-L335 HydrophobicContact CB-CD1 4.29Å; P220-L335 HydrophobicContact CG-CD1 4.34Å; L327-L335 HydrophobicContact CD2-CB 4.1Å; L327-L335 HydrophobicContact CG-CB 4.03Å; L327-L335 HydrophobicContact CG-CD1 4.38Å; L327-L335 PolarHBondContact O-N 2.84Å; T329-L335 HydrophobicContact CG2-CD1 3.92Å; T329-L335 HydrophobicContact CG2-CD2 3.94Å; T329-L335 HydrophobicContact CG2-CG 3.96Å; Q333-L335 PolarHBondContact O-N 2.87Å
336	G	97.8	Very high	96.2	Very high	0 Å²	0	44 Å²	44	0%	0	22%	0.223	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-169.4	155.2	177.7	0	0	0	0	0	112.2	Y171 T326 L327 V334	Y171-G336 CarbonylContact O-C 3.51Å; Y171-G336 WeakPolarHBondContact O-CA 3.37Å; T326-G336 CarbonylContact C-O 3.28Å; T326-G336 VanDerWaalsContact CA-O 3.23Å; T326-G336 WeakPolarHBondContact CA-O 3.19Å; L327-G336 PolarHBondContact N-O 3.02Å; L327-G336 PolarHBondContact O-N 3.44Å; L327-G336 VanDerWaalsContact O-N 3.15Å; V334-G336 WeakPolarHBondContact CG1-O 3.46Å
337	R	98.2	Very high	96.2	Very high	43 Å²	43	45.4 Å²	45.4	16%	0.162	23%	0.233	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-145.5	136.9	178.7	-169.9	-179.5	-52.7	106.5	2.3	111.9	S167 T169 Y171 I324 V325 T326 V334	S167-R337 WeakPolarHBondContact O-CD 3.49Å; S167-R337 PolarHBondContact O-NE 2.95Å; S167-R337 PolarHBondContact OG-NH1 3.37Å; T169-R337 WeakPolarHBondContact O-CD 3.37Å; T169-R337 PolarHBondContact O-NH1 3.39Å; Y171-R337 CarbonylContact C-O 3.53Å; Y171-R337 PolarHBondContact N-O 3.39Å; Y171-R337 PolarHBondContact O-N 2.58Å; I324-R337 HydrophobicContact CG2-CG 3.81Å; V325-R337 CarbonylContact O-C 3.53Å; V325-R337 VanDerWaalsContact O-CA 3.32Å; V325-R337 WeakPolarHBondContact O-CA 3.33Å; T326-R337 HydrophobicContact CG2-CB 3.88Å; T326-R337 HydrophobicContact CG2-CG 3.7Å; V334-R337 HydrophobicContact CG1-CB 4.5Å
338	R	97.9	Very high	96.1	Very high	50 Å²	50	45.5 Å²	45.5	19%	0.189	23%	0.233	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-132.7	144.6	165.1	-65.6	-61	177	146.2	16.5	111.3	D170 F177 D178 V179 V325	D170-R338 WeakPolarHBondContact OD1-CA 3.46Å; F177-R338 HydrophobicContact CD1-CG 3.94Å; F177-R338 HydrophobicContact CE1-CB 4.27Å; F177-R338 HydrophobicContact CE1-CG 4.02Å; F177-R338 PolarHBondContact O-NE 3.08Å; F177-R338 PolarHBondContact O-NH2 2.96Å; D178-R338 IonicContact OD1-CZ 2.64Å; D178-R338 IonicContact OD1-NE 3.27Å; D178-R338 PolarHBondContact OD1-NE 3.49Å; D178-R338 VanDerWaalsContact OD1-NE 3.17Å; D178-R338 IonicContact OD1-NH1 2.68Å; D178-R338 IonicContact OD1-NH2 3.54Å; D178-R338 PolarHBondContact OD1-NH2 3.12Å; V179-R338 HydrophobicContact CB-CB 4.08Å; V179-R338 HydrophobicContact CB-CG 4.33Å; V179-R338 HydrophobicContact CG2-CB 3.8Å; V179-R338 HydrophobicContact CG2-CG 4.06Å; V325-R338 PolarHBondContact N-O 2.99Å; V325-R338 PolarHBondContact O-N 3.05Å
339	C	97	Very high	96.1	Very high	17 Å²	17	45.2 Å²	45.2	12%	0.115	23%	0.233	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-127.4	129.7	-177.4	-55.5	0	0	0	0	111.3	N168 D170 I323	N168-C339 VanDerWaalsContact C-SG 3.54Å; N168-C339 PolarHBondContact O-SG 3.01Å; N168-C339 VanDerWaalsContact O-SG 3.41Å; D170-C339 PolarHBondContact OD1-N 3.34Å; I323-C339 WeakPolarHBondContact O-CA 3.39Å
340	F	97.6	Very high	96.1	Very high	6 Å²	6	52 Å²	52	3%	0.026	26%	0.257	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-133.4	152.2	174.4	60.8	-93	0	0	0	111.4	V179 F181 Y194 L201 I211 L322 I323 V325	V179-F340 HydrophobicContact CG1-CD1 4.5Å; V179-F340 HydrophobicContact CG1-CE1 4.27Å; F181-F340 HydrophobicContact CE1-CE2 4.49Å; F181-F340 HydrophobicContact CE1-CZ 4.45Å; F181-F340 HydrophobicContact CE2-CD1 4.42Å; F181-F340 AromaticContact CZ-CD1 3.9Å; F181-F340 HydrophobicContact CZ-CD1 3.9Å; F181-F340 HydrophobicContact CZ-CD2 4.05Å; F181-F340 AromaticContact CZ-CE1 3.88Å; F181-F340 HydrophobicContact CZ-CE1 3.88Å; F181-F340 HydrophobicContact CZ-CE2 4.03Å; F181-F340 AromaticContact CZ-CG 4Å; F181-F340 HydrophobicContact CZ-CG 4Å; F181-F340 AromaticContact CZ-CZ 3.95Å; F181-F340 HydrophobicContact CZ-CZ 3.95Å; Y194-F340 HydrophobicContact CE2-CB 4.38Å; L201-F340 HydrophobicContact CB-CD2 3.99Å; L201-F340 HydrophobicContact CB-CE2 3.97Å; L201-F340 HydrophobicContact CD2-CE2 3.89Å; I211-F340 HydrophobicContact CD1-CE1 4.34Å; I211-F340 HydrophobicContact CD1-CE2 4.47Å; I211-F340 HydrophobicContact CD1-CZ 3.68Å; L322-F340 CarbonylContact C-O 3.55Å; L322-F340 VanDerWaalsContact CA-O 3.31Å; L322-F340 WeakPolarHBondContact CA-O 3.42Å; I323-F340 HydrophobicContact CB-CD1 4.49Å; I323-F340 HydrophobicContact CB-CD2 4.24Å; I323-F340 HydrophobicContact CB-CE1 4.01Å; I323-F340 HydrophobicContact CB-CE2 3.73Å; I323-F340 HydrophobicContact CB-CZ 3.6Å; I323-F340 HydrophobicContact CG1-CD2 4.23Å; I323-F340 HydrophobicContact CG1-CE2 3.59Å; I323-F340 HydrophobicContact CG1-CZ 3.89Å; I323-F340 HydrophobicContact CG2-CE1 4.21Å; I323-F340 HydrophobicContact CG2-CE2 4.43Å; I323-F340 HydrophobicContact CG2-CZ 3.85Å; I323-F340 PolarHBondContact N-O 2.82Å; I323-F340 PolarHBondContact O-N 3.25Å; V325-F340 HydrophobicContact CG2-CE1 3.76Å
341	E	97.8	Very high	96.5	Very high	26 Å²	26	42.3 Å²	42.3	12%	0.121	22%	0.222	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-78.3	142.2	173.7	-173.9	176	138.5	0	0	110.3	K199 K200 L201 K232 I321 L322	K199-E341 PolarHBondContact O-N 3.16Å; K200-E341 CarbonylContact C-O 3.57Å; K200-E341 VanDerWaalsContact CA-O 3.29Å; K200-E341 WeakPolarHBondContact CA-O 3.02Å; K200-E341 HydrophobicContact CB-CB 4.17Å; K200-E341 HydrophobicContact CD-CB 4.12Å; K200-E341 HydrophobicContact CD-CG 3.92Å; K200-E341 WeakPolarHBondContact CD-OE1 3.35Å; K200-E341 WeakPolarHBondContact CE-OE1 3.27Å; K200-E341 HydrophobicContact CG-CB 3.9Å; K200-E341 HydrophobicContact CG-CG 4.07Å; K200-E341 IonicContact NZ-OE1 3.83Å; K200-E341 PolarHBondContact NZ-OE1 3.43Å; L201-E341 PolarHBondContact N-O 2.89Å; K232-E341 HydrophobicContact CD-CG 4.32Å; K232-E341 WeakPolarHBondContact CD-OE2 3.33Å; K232-E341 WeakPolarHBondContact CE-OE2 3.37Å; K232-E341 IonicContact NZ-OE2 2.95Å; K232-E341 PolarHBondContact NZ-OE2 3.42Å; I321-E341 WeakPolarHBondContact O-CA 3.46Å; I321-E341 WeakPolarHBondContact O-CG 3.41Å; L322-E341 HydrophobicContact CD2-CB 4.16Å
342	A	98.3	Very high	96.8	Very high	2 Å²	2	37 Å²	37	2%	0.017	19%	0.191	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-123.7	137.9	175.3	0	0	0	0	0	112.4	L201 I321 I323 I344	L201-A342 CarbonylContact O-C 3.55Å; L201-A342 WeakPolarHBondContact O-CA 3.24Å; I321-A342 HydrophobicContact CD1-CB 4.27Å; I321-A342 HydrophobicContact CG1-CB 4.19Å; I321-A342 WeakPolarHBondContact CG1-O 3.38Å; I321-A342 PolarHBondContact O-N 2.88Å; I323-A342 HydrophobicContact CD1-CB 3.97Å; I323-A342 HydrophobicContact CG1-CB 3.69Å; A342-I344 HydrophobicContact CB-CD1 4.43Å
343	R	97.9	Very high	97.1	Very high	69 Å²	69	41.2 Å²	41.2	26%	0.26	20%	0.199	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-131.6	102.3	177.3	177.4	168.5	168.7	167.8	1.1	110.6	L201 Y202 C203 C345 D351 D355	L201-R343 PolarHBondContact O-N 3.42Å; Y202-R343 WeakPolarHBondContact CA-O 3.43Å; Y202-R343 HydrophobicContact CD1-CB 4.11Å; Y202-R343 HydrophobicContact CD1-CG 4.2Å; Y202-R343 HydrophobicContact CE1-CB 4.37Å; Y202-R343 HydrophobicContact CE1-CG 4.43Å; C203-R343 PolarHBondContact N-O 2.82Å; C203-R343 VanDerWaalsContact N-O 3.17Å; R343-C345 HydrophobicContact CG-CB 4.29Å; R343-C345 PolarHBondContact O-N 2.94Å; R343-D351 IonicContact CZ-OD2 3.28Å; R343-D351 VanDerWaalsContact CZ-OD2 3.28Å; R343-D351 IonicContact NE-OD2 2.63Å; R343-D351 PolarHBondContact NE-OD2 3.28Å; R343-D351 VanDerWaalsContact NE-OD2 3.13Å; R343-D351 VanDerWaalsContact NH2-CG 3.3Å; R343-D351 IonicContact NH2-OD2 2.68Å; R343-D351 PolarHBondContact NH2-OD2 3.07Å; R343-D355 IonicContact CZ-OD1 2.74Å; R343-D355 IonicContact CZ-OD2 3.78Å; R343-D355 IonicContact NH1-OD1 3Å; R343-D355 PolarHBondContact NH1-OD1 2.74Å; R343-D355 IonicContact NH1-OD2 2.63Å; R343-D355 PolarHBondContact NH1-OD2 3.34Å
344	I	98.4	Very high	97.2	Very high	2 Å²	2	37.5 Å²	37.5	1%	0.01	19%	0.191	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-83.6	113.6	178.3	-53	65.8	0	0	0	107.8	C203 I205 F306 C308 S310 M316 I321 A342	C203-I344 CarbonylContact O-C 3.57Å; C203-I344 VanDerWaalsContact O-CA 3.26Å; C203-I344 WeakPolarHBondContact O-CA 3.29Å; I205-I344 HydrophobicContact CB-CG2 4.02Å; F306-I344 HydrophobicContact CB-CD1 4.23Å; F306-I344 HydrophobicContact CB-CG1 3.49Å; F306-I344 VanDerWaalsContact CB-CG1 3.49Å; F306-I344 HydrophobicContact CB-CG2 4.49Å; F306-I344 HydrophobicContact CD1-CD1 4.34Å; F306-I344 HydrophobicContact CD1-CG1 4.48Å; F306-I344 HydrophobicContact CG-CD1 4.43Å; F306-I344 HydrophobicContact CG-CG1 4.11Å; C308-I344 WeakPolarHBondContact O-CB 3.46Å; C308-I344 WeakPolarHBondContact O-CG2 3.15Å; S310-I344 PolarHBondContact N-O 3.24Å; S310-I344 PolarHBondContact OG-N 3.16Å; M316-I344 HydrophobicContact CE-CD1 4.1Å; M316-I344 HydrophobicContact SD-CD1 4.33Å; I321-I344 HydrophobicContact CD1-CD1 4.19Å; A342-I344 HydrophobicContact CB-CD1 4.43Å
345	C	97.6	Very high	97.1	Very high	10 Å²	10	36.9 Å²	36.9	7%	0.068	19%	0.186	C	C	.	.			trans	-152.9	154.1	-169	63.4	0	0	0	0	112.5	C203 Q204 R343 C347	C203-C345 PolarHBondContact O-N 2.96Å; C203-C345 VanDerWaalsContact O-O 3.09Å; Q204-C345 WeakPolarHBondContact CA-O 3.33Å; R343-C345 HydrophobicContact CG-CB 4.29Å; R343-C345 PolarHBondContact O-N 2.94Å; C345-C347 VanDerWaalsContact C-N 3.29Å; C345-C347 PolarHBondContact O-N 3.01Å
346	A	96.7	Very high	97.1	Very high	67 Å²	67	37 Å²	37	55%	0.554	19%	0.186	S	C	*	.	S	Bend	trans	-68.8	-21	-176	0	0	0	0	0	114.8	Q204	Q204-A346 PolarHBondContact NE2-O 3.27Å
347	C	96.3	Very high	96.9	Very high	36 Å²	36	39.2 Å²	39.2	24%	0.243	20%	0.198	C	C	.	.			trans	-135.8	72.7	-175	-57.5	0	0	0	0	112.1	C345 G349 R350 D351	C345-C347 VanDerWaalsContact C-N 3.29Å; C345-C347 PolarHBondContact O-N 3.01Å; C347-G349 PolarHBondContact O-N 2.83Å; C347-R350 HydrophobicContact CB-CB 3.98Å; C347-R350 PolarHBondContact O-N 2.63Å; C347-R350 VanDerWaalsContact O-N 3.12Å; C347-D351 PolarHBondContact O-N 2.81Å
348	P	97.4	Very high	96.7	Very high	1 Å²	1	39.6 Å²	39.6	1%	0.006	21%	0.207	C	C	.	.	H	α-helix	trans	-49.6	-52	-173.6	-32	38.2	0	0	0	114.9	A190 T193 Q204 R350 D351 R352	A190-P348 WeakPolarHBondContact O-CD 3.24Å; A190-P348 WeakPolarHBondContact O-CG 3.4Å; T193-P348 HydrophobicContact CG2-CB 3.95Å; Q204-P348 HydrophobicContact CG-CG 3.93Å; P348-R350 VanDerWaalsContact C-N 3.31Å; P348-R350 PolarHBondContact O-N 2.9Å; P348-D351 PolarHBondContact O-N 2.84Å; P348-R352 VanDerWaalsContact O-CB 3.25Å; P348-R352 WeakPolarHBondContact O-CB 3.43Å; P348-R352 PolarHBondContact O-N 3.21Å
349	G	96.8	Very high	96.3	Very high	5 Å²	5	40.1 Å²	40.1	5%	0.052	21%	0.213	C	C	.	.	H	α-helix	trans	-62.1	-32.6	-179.1	0	0	0	0	0	114.8	T186 C347 K353	T186-G349 WeakPolarHBondContact O-CA 3.37Å; C347-G349 PolarHBondContact O-N 2.83Å; G349-K353 WeakPolarHBondContact O-CB 3.24Å; G349-K353 PolarHBondContact O-N 2.83Å
350	R	96.8	Very high	96	Very high	159 Å²	159	45 Å²	45	60%	0.6	23%	0.229	S	C	*	.	H	α-helix	trans	-71.8	-50	175.3	-179	-160.6	67.8	-168.8	-1.6	110.9	C347 P348 R352 K353 A354	C347-R350 HydrophobicContact CB-CB 3.98Å; C347-R350 PolarHBondContact O-N 2.63Å; C347-R350 VanDerWaalsContact O-N 3.12Å; P348-R350 VanDerWaalsContact C-N 3.31Å; P348-R350 PolarHBondContact O-N 2.9Å; R350-R352 VanDerWaalsContact C-N 3.31Å; R350-R352 PolarHBondContact O-N 3.02Å; R350-K353 PolarHBondContact O-N 2.81Å; R350-A354 WeakPolarHBondContact O-CB 3.32Å; R350-A354 PolarHBondContact O-N 3.36Å
351	D	96.9	Very high	95.6	Very high	14 Å²	14	51.5 Å²	51.5	8%	0.075	26%	0.257	C	S	.	.	H	α-helix	trans	-67.8	-34.4	-176.2	-80.4	33.4	0	0	0	111.3	Y202 R343 C347 P348 D355	Y202-D351 HydrophobicContact CD1-CB 3.92Å; Y202-D351 VanDerWaalsContact CE1-C 3.46Å; Y202-D351 HydrophobicContact CE1-CB 4.15Å; Y202-D351 WeakPolarHBondContact CE1-O 3.41Å; R343-D351 IonicContact CZ-OD2 3.28Å; R343-D351 VanDerWaalsContact CZ-OD2 3.28Å; R343-D351 IonicContact NE-OD2 2.63Å; R343-D351 PolarHBondContact NE-OD2 3.28Å; R343-D351 VanDerWaalsContact NE-OD2 3.13Å; R343-D351 VanDerWaalsContact NH2-CG 3.3Å; R343-D351 IonicContact NH2-OD2 2.68Å; R343-D351 PolarHBondContact NH2-OD2 3.07Å; C347-D351 PolarHBondContact O-N 2.81Å; P348-D351 PolarHBondContact O-N 2.84Å; D351-D355 PolarHBondContact O-N 2.86Å; D351-D355 VanDerWaalsContact O-N 3.15Å
352	R	96.6	Very high	94.7	Very high	38 Å²	38	55.5 Å²	55.5	14%	0.143	28%	0.276	C	S	.	.	H	α-helix	trans	-58.1	-59.2	168.2	176.3	178.5	166.7	178.5	6	111.5	T193 Y194 Y202 P348 R350 A354 D355 E356	T193-R352 HydrophobicContact CG2-CB 3.95Å; T193-R352 HydrophobicContact CG2-CG 4.35Å; T193-R352 PolarHBondContact OG1-NH1 3.29Å; Y194-R352 VanDerWaalsContact O-CZ 3.29Å; Y194-R352 PolarHBondContact O-NH1 2.68Å; Y202-R352 HydrophobicContact CD1-CB 4.17Å; Y202-R352 HydrophobicContact CD2-CB 3.75Å; Y202-R352 HydrophobicContact CD2-CG 4.13Å; Y202-R352 HydrophobicContact CE1-CB 4.22Å; Y202-R352 HydrophobicContact CE2-CB 3.83Å; Y202-R352 HydrophobicContact CE2-CG 3.98Å; Y202-R352 HydrophobicContact CG-CB 3.95Å; P348-R352 VanDerWaalsContact O-CB 3.25Å; P348-R352 WeakPolarHBondContact O-CB 3.43Å; P348-R352 PolarHBondContact O-N 3.21Å; R350-R352 VanDerWaalsContact C-N 3.31Å; R350-R352 PolarHBondContact O-N 3.02Å; R352-A354 PolarHBondContact O-N 2.92Å; R352-D355 PolarHBondContact O-N 2.89Å; R352-D355 VanDerWaalsContact O-N 3.13Å; R352-E356 HydrophobicContact CG-CG 4.35Å; R352-E356 IonicContact CZ-OE1 3.13Å; R352-E356 IonicContact NE-OE1 3.46Å; R352-E356 PolarHBondContact NE-OE1 2.87Å; R352-E356 IonicContact NE-OE2 3.79Å; R352-E356 PolarHBondContact NE-OE2 3.37Å; R352-E356 IonicContact NH2-OE1 2.71Å; R352-E356 PolarHBondContact NH2-OE1 3.34Å; R352-E356 WeakPolarHBondContact O-CG 3.4Å; R352-E356 PolarHBondContact O-N 2.92Å
353	K	95.2	Very high	93.7	Very high	122 Å²	122	61.3 Å²	61.3	53%	0.53	30%	0.303	S	S	.	.	H	α-helix	trans	-58.6	-37.2	-178.2	-178.5	172.8	179.4	175.4	0	112.2	G349 R350 D357	G349-K353 WeakPolarHBondContact O-CB 3.24Å; G349-K353 PolarHBondContact O-N 2.83Å; R350-K353 PolarHBondContact O-N 2.81Å; K353-D357 WeakPolarHBondContact O-CB 3.17Å; K353-D357 VanDerWaalsContact O-CG 3.25Å; K353-D357 PolarHBondContact O-N 3.29Å
354	A	95.9	Very high	92.4	Very high	55 Å²	55	62.7 Å²	62.7	46%	0.455	32%	0.319	S	S	.	.	H	α-helix	trans	-66.7	-39.1	178.3	0	0	0	0	0	113.1	R350 R352 S358	R350-A354 WeakPolarHBondContact O-CB 3.32Å; R350-A354 PolarHBondContact O-N 3.36Å; R352-A354 PolarHBondContact O-N 2.92Å; A354-S358 WeakPolarHBondContact O-CB 3.45Å; A354-S358 PolarHBondContact O-N 3.25Å; A354-S358 VanDerWaalsContact O-N 3.14Å
355	D	95.6	Very high	90.6	Very high	35 Å²	35	64.7 Å²	64.7	19%	0.187	33%	0.333	C	S	.	.	H	α-helix	trans	-72	-41.4	175.8	-71.7	-0.9	0	0	0	111.2	L198 K200 Y202 R343 D351 R352 S358 I359	L198-D355 HydrophobicContact CD1-CB 3.73Å; K200-D355 IonicContact NZ-OD2 3.21Å; K200-D355 PolarHBondContact NZ-OD2 3.45Å; Y202-D355 WeakPolarHBondContact CE1-OD2 3.43Å; Y202-D355 WeakPolarHBondContact OH-CB 3.41Å; Y202-D355 VanDerWaalsContact OH-CG 3.3Å; Y202-D355 PolarHBondContact OH-OD2 3.1Å; R343-D355 IonicContact CZ-OD1 2.74Å; R343-D355 IonicContact CZ-OD2 3.78Å; R343-D355 IonicContact NH1-OD1 3Å; R343-D355 PolarHBondContact NH1-OD1 2.74Å; R343-D355 IonicContact NH1-OD2 2.63Å; R343-D355 PolarHBondContact NH1-OD2 3.34Å; D351-D355 PolarHBondContact O-N 2.86Å; D351-D355 VanDerWaalsContact O-N 3.15Å; R352-D355 PolarHBondContact O-N 2.89Å; R352-D355 VanDerWaalsContact O-N 3.13Å; D355-S358 VanDerWaalsContact O-CB 3.32Å; D355-S358 WeakPolarHBondContact O-CB 3.37Å; D355-S358 PolarHBondContact O-N 3.19Å; D355-I359 PolarHBondContact O-N 2.94Å
356	E	95.4	Very high	88.5	Confident	21 Å²	21	68.6 Å²	68.6	10%	0.098	35%	0.353	C	S	.	.	H	α-helix	trans	-62.8	-46.8	174.8	-70.5	172.7	160	0	0	111.3	S195 L198 R352 S358 I359 R360	S195-E356 VanDerWaalsContact CB-OE1 3.24Å; S195-E356 WeakPolarHBondContact CB-OE1 3.15Å; S195-E356 PolarHBondContact OG-OE1 2.69Å; L198-E356 HydrophobicContact CD1-CG 3.75Å; L198-E356 HydrophobicContact CG-CG 4.08Å; R352-E356 HydrophobicContact CG-CG 4.35Å; R352-E356 IonicContact CZ-OE1 3.13Å; R352-E356 IonicContact NE-OE1 3.46Å; R352-E356 PolarHBondContact NE-OE1 2.87Å; R352-E356 IonicContact NE-OE2 3.79Å; R352-E356 PolarHBondContact NE-OE2 3.37Å; R352-E356 IonicContact NH2-OE1 2.71Å; R352-E356 PolarHBondContact NH2-OE1 3.34Å; R352-E356 WeakPolarHBondContact O-CG 3.4Å; R352-E356 PolarHBondContact O-N 2.92Å; E356-S358 PolarHBondContact O-N 3.14Å; E356-I359 PolarHBondContact O-N 3.37Å; E356-R360 WeakPolarHBondContact O-CG 3.46Å; E356-R360 PolarHBondContact O-N 2.75Å; E356-R360 VanDerWaalsContact O-N 3.12Å
357	D	94.8	Very high	86.4	Confident	45 Å²	45	69.9 Å²	69.9	24%	0.241	36%	0.358	C	S	.	.	H	α-helix	trans	-62.2	-26.4	174	-78	-14.2	0	0	0	112.8	K353 R360 K361	K353-D357 WeakPolarHBondContact O-CB 3.17Å; K353-D357 VanDerWaalsContact O-CG 3.25Å; K353-D357 PolarHBondContact O-N 3.29Å; D357-R360 IonicContact OD1-CZ 3.33Å; D357-R360 IonicContact OD1-NE 2.7Å; D357-R360 IonicContact OD1-NH2 2.74Å; D357-R360 PolarHBondContact OD1-NH2 3.18Å; D357-K361 WeakPolarHBondContact O-CB 3.37Å; D357-K361 VanDerWaalsContact O-CD 3.24Å; D357-K361 WeakPolarHBondContact O-CD 3.19Å; D357-K361 WeakPolarHBondContact O-CG 3.29Å; D357-K361 PolarHBondContact O-N 3.32Å
358	S	93.1	Very high	84.3	Confident	52 Å²	52	72.9 Å²	72.9	36%	0.364	38%	0.375	S	S	.	.	H	α-helix	trans	-72.4	-45.7	177.1	-171.8	0	0	0	0	111.7	A354 D355 E356 K361 Q362	A354-S358 WeakPolarHBondContact O-CB 3.45Å; A354-S358 PolarHBondContact O-N 3.25Å; A354-S358 VanDerWaalsContact O-N 3.14Å; D355-S358 VanDerWaalsContact O-CB 3.32Å; D355-S358 WeakPolarHBondContact O-CB 3.37Å; D355-S358 PolarHBondContact O-N 3.19Å; E356-S358 PolarHBondContact O-N 3.14Å; S358-K361 PolarHBondContact O-N 2.84Å; S358-Q362 WeakPolarHBondContact O-CG 3.22Å; S358-Q362 PolarHBondContact O-N 2.9Å; S358-Q362 PolarHBondContact OG-NE2 3.21Å
359	I	90.3	Very high	82	Confident	61 Å²	61	79.2 Å²	79.2	31%	0.313	40%	0.403	S	S	.	.	H	α-helix	trans	-70.2	-41.4	-179.1	-86.3	161.8	0	0	0	111.9	L198 D355 E356 K361 Q362 Q363	L198-I359 HydrophobicContact CD2-CB 4.48Å; L198-I359 HydrophobicContact CD2-CD1 3.36Å; L198-I359 HydrophobicContact CD2-CG1 4.48Å; D355-I359 PolarHBondContact O-N 2.94Å; E356-I359 PolarHBondContact O-N 3.37Å; I359-K361 VanDerWaalsContact C-N 3.29Å; I359-K361 PolarHBondContact O-N 2.98Å; I359-Q362 PolarHBondContact O-N 3.49Å; I359-Q362 VanDerWaalsContact O-N 3.08Å; I359-Q363 WeakPolarHBondContact O-CG 3.28Å; I359-Q363 PolarHBondContact O-N 2.66Å
360	R	89.9	Confident	79.6	Confident	120 Å²	120	87 Å²	87	45%	0.453	44%	0.443	S	S	.	.	H	α-helix	trans	-60.5	-37.5	173.6	-64.6	-172.5	-62.6	-169.7	0.6	112.3	E356 D357 V364	E356-R360 WeakPolarHBondContact O-CG 3.46Å; E356-R360 PolarHBondContact O-N 2.75Å; E356-R360 VanDerWaalsContact O-N 3.12Å; D357-R360 IonicContact OD1-CZ 3.33Å; D357-R360 IonicContact OD1-NE 2.7Å; D357-R360 IonicContact OD1-NH2 2.74Å; D357-R360 PolarHBondContact OD1-NH2 3.18Å; R360-V364 WeakPolarHBondContact O-CG2 3.48Å; R360-V364 PolarHBondContact O-N 2.87Å
361	K	88.9	Confident	77.3	Confident	142 Å²	142	82.1 Å²	82.1	62%	0.617	44%	0.443	S	S	*	.	H	α-helix	trans	-68.2	-37.3	173	-75.3	168.4	-169	163.1	0	112.8	D357 S358 I359 V364 S365	D357-K361 WeakPolarHBondContact O-CB 3.37Å; D357-K361 VanDerWaalsContact O-CD 3.24Å; D357-K361 WeakPolarHBondContact O-CD 3.19Å; D357-K361 WeakPolarHBondContact O-CG 3.29Å; D357-K361 PolarHBondContact O-N 3.32Å; S358-K361 PolarHBondContact O-N 2.84Å; I359-K361 VanDerWaalsContact C-N 3.29Å; I359-K361 PolarHBondContact O-N 2.98Å; K361-V364 PolarHBondContact O-N 2.62Å; K361-S365 VanDerWaalsContact O-CB 3.26Å; K361-S365 WeakPolarHBondContact O-CB 3.3Å; K361-S365 PolarHBondContact O-N 2.98Å; K361-S365 PolarHBondContact O-OG 2.89Å
362	Q	79.8	Confident	74.6	Confident	110 Å²	110	88.1 Å²	88.1	51%	0.514	48%	0.475	S	S	.	.	H	α-helix	trans	-63.2	-48.1	177.1	-74.1	170.7	41.5	0	0	111.2	S358 I359 V364 S365 D366	S358-Q362 WeakPolarHBondContact O-CG 3.22Å; S358-Q362 PolarHBondContact O-N 2.9Å; S358-Q362 PolarHBondContact OG-NE2 3.21Å; I359-Q362 PolarHBondContact O-N 3.49Å; I359-Q362 VanDerWaalsContact O-N 3.08Å; Q362-V364 PolarHBondContact O-N 3.12Å; Q362-S365 PolarHBondContact O-N 2.71Å; Q362-S365 PolarHBondContact O-OG 3.23Å; Q362-D366 PolarHBondContact O-N 3.25Å
363	Q	76.9	Confident	72.5	Confident	124 Å²	124	90.4 Å²	90.4	58%	0.579	51%	0.51	S	S	*	.	H	α-helix	trans	-55	-46.1	176.3	-69.9	167.2	-10.9	0	0	112.5	I359 S365 S367	I359-Q363 WeakPolarHBondContact O-CG 3.28Å; I359-Q363 PolarHBondContact O-N 2.66Å; Q363-S365 VanDerWaalsContact C-N 3.34Å; Q363-S365 PolarHBondContact O-N 2.7Å; Q363-S367 PolarHBondContact O-OG 2.84Å
364	V	71.9	Confident	70.3	Confident	98 Å²	98	89.3 Å²	89.3	59%	0.594	51%	0.513	S	S	*	.	H	α-helix	trans	-70.3	-28.4	176.9	175.4	0	0	0	0	112.8	R360 K361 Q362 S367 T368	R360-V364 WeakPolarHBondContact O-CG2 3.48Å; R360-V364 PolarHBondContact O-N 2.87Å; K361-V364 PolarHBondContact O-N 2.62Å; Q362-V364 PolarHBondContact O-N 3.12Å; V364-S367 PolarHBondContact O-OG 3.28Å; V364-S367 VanDerWaalsContact O-OG 3.09Å; V364-T368 PolarHBondContact O-OG1 2.71Å
365	S	60.1	Low	67.9	Low	43 Å²	43	95.9 Å²	95.9	30%	0.301	53%	0.532	S	S	.	.	H	α-helix	trans	-79.6	-21.6	-177.3	78.8	0	0	0	0	114.8	K361 Q362 Q363 K369	K361-S365 VanDerWaalsContact O-CB 3.26Å; K361-S365 WeakPolarHBondContact O-CB 3.3Å; K361-S365 PolarHBondContact O-N 2.98Å; K361-S365 PolarHBondContact O-OG 2.89Å; Q362-S365 PolarHBondContact O-N 2.71Å; Q362-S365 PolarHBondContact O-OG 3.23Å; Q363-S365 VanDerWaalsContact C-N 3.34Å; Q363-S365 PolarHBondContact O-N 2.7Å; S365-K369 WeakPolarHBondContact O-CD 3.4Å; S365-K369 WeakPolarHBondContact O-CE 3.29Å; S365-K369 WeakPolarHBondContact O-CG 3.46Å; S365-K369 PolarHBondContact O-NZ 3.08Å
366	D	52.4	Low	65.5	Low	92 Å²	92	105.2 Å²	105.2	49%	0.492	57%	0.565	S	S	.	*	H	α-helix	trans	-86	-28.4	176.9	-91	7.7	0	0	0	111.9	Q362 K369	Q362-D366 PolarHBondContact O-N 3.25Å; D366-K369 IonicContact OD1-NZ 2.66Å; D366-K369 PolarHBondContact OD1-NZ 3.41Å
367	S	53.4	Low	62.9	Low	94 Å²	94	110.4 Å²	110.4	66%	0.657	60%	0.6	S	S	*	*	H	α-helix	trans	-73.7	-20.2	174	46	0	0	0	0	114.1	Q363 V364	Q363-S367 PolarHBondContact O-OG 2.84Å; V364-S367 PolarHBondContact O-OG 3.28Å; V364-S367 VanDerWaalsContact O-OG 3.09Å
368	T	52.9	Low	59.9	Low	100 Å²	100	114.9 Å²	114.9	61%	0.613	62%	0.618	S	S	*	*	T	Hydrogen-bonded Turn	trans	-92.7	-7.6	177.6	26.5	0	0	0	0	115.5	V364 N370	V364-T368 PolarHBondContact O-OG1 2.71Å; T368-N370 VanDerWaalsContact C-N 3.31Å; T368-N370 PolarHBondContact O-N 3.27Å
369	K	47.8	Very low	57.1	Low	134 Å²	134	123 Å²	123	58%	0.583	64%	0.64	S	S	*	*	T	Hydrogen-bonded Turn	trans	-79	-3.1	-173.4	-81	168.3	-163.1	149.5	0	116.2	S365 D366	S365-K369 WeakPolarHBondContact O-CD 3.4Å; S365-K369 WeakPolarHBondContact O-CE 3.29Å; S365-K369 WeakPolarHBondContact O-CG 3.46Å; S365-K369 PolarHBondContact O-NZ 3.08Å; D366-K369 IonicContact OD1-NZ 2.66Å; D366-K369 PolarHBondContact OD1-NZ 3.41Å
370	N	45.8	Very low	54.4	Low	168 Å²	168	125.9 Å²	125.9	90%	0.898	65%	0.653	S	S	*	*	T	Hydrogen-bonded Turn	trans	-98.9	16.9	176.7	-70.3	-21.3	0	0	0	113.3	T368	T368-N370 VanDerWaalsContact C-N 3.31Å; T368-N370 PolarHBondContact O-N 3.27Å
371	G	48.8	Very low	51.4	Low	57 Å²	57	126.2 Å²	126.2	59%	0.588	66%	0.663	S	S	*	*	S	Bend	trans	-123.6	134.5	178.4	0	0	0	0	0	113.7
372	D	41.6	Very low	48.7	Very low	140 Å²	140	123.7 Å²	123.7	75%	0.749	66%	0.66	S	S	*	*			trans	47.1	108.1	175.3	-165	-0.6	0	0	0	118	T374	D372-T374 WeakPolarHBondContact OD1-CB 3.42Å; D372-T374 PolarHBondContact OD1-N 3.15Å; D372-T374 VanDerWaalsContact OD1-N 3.08Å; D372-T374 PolarHBondContact OD1-OG1 2.96Å
373	G	52.1	Low	46.6	Very low	86 Å²	86	126.9 Å²	126.9	89%	0.887	67%	0.674	S	S	*	*			trans	-105.6	65.3	170.1	0	0	0	0	0	113.7
374	T	48.9	Very low	44.2	Very low	98 Å²	98	124.4 Å²	124.4	60%	0.601	68%	0.682	S	S	*	*			trans	-127	135.2	177	-32.2	0	0	0	0	114.3	D372	D372-T374 WeakPolarHBondContact OD1-CB 3.42Å; D372-T374 PolarHBondContact OD1-N 3.15Å; D372-T374 VanDerWaalsContact OD1-N 3.08Å; D372-T374 PolarHBondContact OD1-OG1 2.96Å
375	K	44.8	Very low	42.4	Very low	194 Å²	194	127.6 Å²	127.6	84%	0.843	69%	0.694	S	S	*	*			trans	69.6	91.5	169.7	-49.8	-173.9	-175.4	171.1	0	118
376	R	45.7	Very low	40.9	Very low	231 Å²	231	134 Å²	134	87%	0.872	72%	0.719	S	S	*	*			trans	-90.9	150.1	147	-53.7	-177.8	-167.8	172.4	4.5	110.1
377	P	39.8	Very low	39.7	Very low	130 Å²	130	138.2 Å²	138.2	84%	0.844	74%	0.738	S	S	*	*			trans	-89.8	157.7	136.9	33.1	-29.6	0	0	0	110.6
378	F	31.8	Very low	38.6	Very low	139 Å²	139	140 Å²	140	61%	0.61	75%	0.745	S	S	*	*			trans	-135.9	134.3	-163.5	157.5	-83	0	0	0	112.6	Q380	F378-Q380 HydrophobicContact CE1-CG 3.76Å; F378-Q380 HydrophobicContact CE2-CG 4.13Å; F378-Q380 HydrophobicContact CZ-CG 3.43Å; F378-Q380 VanDerWaalsContact CZ-CG 3.43Å
379	R	35.2	Very low	37.4	Very low	221 Å²	221	140.5 Å²	140.5	83%	0.834	75%	0.753	S	S	*	*			trans	-154.8	126.2	139.7	-67.4	-154.1	178.6	-134	-2.6	106.5
380	Q	34.3	Very low	36.8	Very low	123 Å²	123	141.4 Å²	141.4	58%	0.575	76%	0.762	S	S	*	*				61.8	136	74.1	-84.3	176.6	-28.9	0	0	114	F378	F378-Q380 HydrophobicContact CE1-CG 3.76Å; F378-Q380 HydrophobicContact CE2-CG 4.13Å; F378-Q380 HydrophobicContact CZ-CG 3.43Å; F378-Q380 VanDerWaalsContact CZ-CG 3.43Å
381	N	27.2	Very low	36.2	Very low	127 Å²	127	142.8 Å²	142.8	68%	0.679	76%	0.76	S	S	*	*			cis	-172.1	164.8	-11	-121.8	33.9	0	0	0	106.8
382	T	31	Very low	35.4	Very low	88 Å²	88	149.4 Å²	149.4	54%	0.54	77%	0.773	S	S	.	*			cis	-157.6	-179.2	-19.9	14.1	0	0	0	0	105.1
383	H	36.4	Very low	35.1	Very low	178 Å²	178	154.5 Å²	154.5	82%	0.824	78%	0.781	S	S	*	*			cis	-143.8	177.5	20.5	-67	-98.8	0	0	0	108.3
384	G	26	Very low	34.5	Very low	71 Å²	71	160.3 Å²	160.3	73%	0.732	78%	0.777	S	S	*	*			cis	141	74.4	-8	0	0	0	0	0	114.4
385	I	33.2	Very low	33.9	Very low	166 Å²	166	159.2 Å²	159.2	85%	0.851	77%	0.773	S	S	*	*			trans	-128.1	134.3	160.5	-63.5	-179.3	0	0	0	107.8
386	Q	29.2	Very low	33.8	Very low	178 Å²	178	155.8 Å²	155.8	83%	0.832	77%	0.771	S	S	*	*			trans	-96.5	141.5	178.1	-65.4	179.6	-7.2	0	0	110.9
387	M	28.4	Very low	34	Very low	179 Å²	179	151.9 Å²	151.9	88%	0.882	77%	0.767	S	S	*	*			trans	-135.4	132.1	158.8	-83.9	-65.2	168.6	0	0	109.3	S389	M387-S389 PolarHBondContact O-N 3.28Å; M387-S389 VanDerWaalsContact O-N 3.13Å
388	T	28.6	Very low	34.9	Very low	131 Å²	131	152.3 Å²	152.3	80%	0.804	76%	0.762	S	S	*	*			trans	-78.9	95.5	-173.5	47.9	0	0	0	0	111.2	I390	T388-I390 PolarHBondContact O-N 3Å; T388-I390 VanDerWaalsContact O-N 3.16Å
389	S	29.6	Very low	37.4	Very low	111 Å²	111	152.9 Å²	152.9	78%	0.776	77%	0.767	S	S	*	*			trans	-68.7	110	172.7	-174.9	0	0	0	0	110.9	M387 K391	M387-S389 PolarHBondContact O-N 3.28Å; M387-S389 VanDerWaalsContact O-N 3.13Å; S389-K391 PolarHBondContact O-N 2.9Å
390	I	35.3	Very low	39.5	Very low	153 Å²	153	148.6 Å²	148.6	79%	0.785	76%	0.76	S	S	*	*			trans	-65.7	112.6	169.7	-62.2	172.9	0	0	0	107.5	T388 K392	T388-I390 PolarHBondContact O-N 3Å; T388-I390 VanDerWaalsContact O-N 3.16Å; I390-K392 PolarHBondContact O-N 3.35Å
391	K	32	Very low	41.9	Very low	198 Å²	198	149.3 Å²	149.3	86%	0.861	77%	0.767	S	S	*	*			trans	-64.1	93.1	174.1	-71.2	-174.3	177.9	-177.3	0	110	S389 R393	S389-K391 PolarHBondContact O-N 2.9Å; K391-R393 PolarHBondContact O-N 3.46Å
392	K	32.8	Very low	44.8	Very low	195 Å²	195	152.8 Å²	152.8	85%	0.848	77%	0.772	S	S	*	*			trans	-59.1	110.7	158	-85.9	-165.3	174.3	-173.3	0	107.6	I390 R394	I390-K392 PolarHBondContact O-N 3.35Å; K392-R394 PolarHBondContact O-N 2.92Å; K392-R394 VanDerWaalsContact O-N 3.1Å
393	R	34.2	Very low	47.7	Very low	247 Å²	247	155 Å²	155	93%	0.932	78%	0.78	S	S	*	*			trans	-59.5	108.2	172.9	-164.1	-179.7	-164	173.9	3.1	107.1	K391	K391-R393 PolarHBondContact O-N 3.46Å
394	R	39.6	Very low	50.2	Low	208 Å²	208	152.5 Å²	152.5	79%	0.785	78%	0.779	S	S	*	*			trans	-60.2	146.5	168.3	-76.6	-175.8	174.8	164.7	-2.8	108.3	K392	K392-R394 PolarHBondContact O-N 2.92Å; K392-R394 VanDerWaalsContact O-N 3.1Å
395	S	35.8	Very low	53.5	Low	76 Å²	76	151.4 Å²	151.4	53%	0.531	76%	0.758	S	S	.	*			trans	-57.3	145.5	164.2	29.1	0	0	0	0	109.7	D397	S395-D397 VanDerWaalsContact C-N 3.25Å; S395-D397 PolarHBondContact O-N 3.44Å
396	P	43.3	Very low	56.1	Low	121 Å²	121	154.8 Å²	154.8	79%	0.786	76%	0.76	S	S	*	*	T	Hydrogen-bonded Turn	trans	-81	-2	178.9	34.6	-36.2	0	0	0	113.7
397	D	50.5	Low	59.1	Low	149 Å²	149	148.8 Å²	148.8	80%	0.797	75%	0.746	S	S	*	*	T	Hydrogen-bonded Turn	trans	-83.1	-8.9	-167.3	-102.5	6.4	0	0	0	115.6	S395 E399	S395-D397 VanDerWaalsContact C-N 3.25Å; S395-D397 PolarHBondContact O-N 3.44Å; D397-E399 PolarHBondContact O-N 2.94Å
398	D	59.3	Low	61.9	Low	139 Å²	139	149.6 Å²	149.6	74%	0.743	74%	0.739	S	S	*	*			trans	-80.1	30.5	178.9	-66.1	-53.3	0	0	0	112.9	L400	D398-L400 PolarHBondContact O-N 2.77Å
399	E	82.6	Confident	64.9	Low	151 Å²	151	151.1 Å²	151.1	71%	0.706	74%	0.737	S	S	*	*			trans	-83.9	102.1	179	-171.8	167.7	-170.9	0	0	111.5	D397 L401	D397-E399 PolarHBondContact O-N 2.94Å; E399-L401 HydrophobicContact CG-CD2 3.99Å; E399-L401 HydrophobicContact CG-CG 4.34Å; E399-L401 PolarHBondContact O-N 2.96Å
400	L	79.3	Confident	67.8	Low	131 Å²	131	149.3 Å²	149.3	69%	0.686	72%	0.721	S	S	*	*			trans	-76.3	95.1	-179.5	-170.1	75.5	0	0	0	111.9	D398 Y402	D398-L400 PolarHBondContact O-N 2.77Å; L400-Y402 HydrophobicContact CD2-CE2 4.25Å
401	L	86.6	Confident	70.6	Confident	139 Å²	139	148 Å²	148	73%	0.728	71%	0.707	S	S	*	*			trans	-86.5	140.8	174.7	-59.5	178	0	0	0	112.1	E399	E399-L401 HydrophobicContact CG-CD2 3.99Å; E399-L401 HydrophobicContact CG-CG 4.34Å; E399-L401 PolarHBondContact O-N 2.96Å
402	Y	87.7	Confident	73.5	Confident	200 Å²	200	142.5 Å²	142.5	78%	0.784	69%	0.685	S	S	*	*			trans	-106.3	120.8	178.1	-68.5	-85.7	0	0	0	111.4	L400	L400-Y402 HydrophobicContact CD2-CE2 4.25Å
403	L	91.6	Very high	76.5	Confident	134 Å²	134	137.9 Å²	137.9	70%	0.702	67%	0.668	S	S	*	*			trans	-101.6	112	173.8	-176	66.5	0	0	0	110.5	V405 L414	L403-V405 HydrophobicContact CD2-CG2 4.32Å; L403-V405 HydrophobicContact CG-CG2 4.24Å; L403-V405 PolarHBondContact O-N 2.87Å; L403-L414 HydrophobicContact CD2-CD1 4.3Å
404	P	89.1	Confident	79.3	Confident	125 Å²	125	129.4 Å²	129.4	81%	0.812	64%	0.641	S	S	*	*			trans	-76.8	114.7	175.9	29.6	-32.8	0	0	0	111
405	V	94	Very high	81.8	Confident	49 Å²	49	121.9 Å²	121.9	30%	0.297	62%	0.616	S	S	.	*			trans	-105.6	142.3	179.9	-174.6	0	0	0	0	110.8	L403 T410 L414	L403-V405 HydrophobicContact CD2-CG2 4.32Å; L403-V405 HydrophobicContact CG-CG2 4.24Å; L403-V405 PolarHBondContact O-N 2.87Å; V405-T410 HydrophobicContact CG1-CG2 3.91Å; V405-L414 HydrophobicContact CG1-CD1 4.05Å; V405-L414 HydrophobicContact CG2-CD1 3.64Å
406	R	89.1	Confident	84.5	Confident	237 Å²	237	124.9 Å²	124.9	89%	0.894	62%	0.619	S	S	*	*			trans	-110.4	145.4	167.1	-78.8	-177.5	171.3	161.3	-2.2	109.7
407	G	91.4	Very high	86.8	Confident	51 Å²	51	123 Å²	123	53%	0.526	60%	0.601	S	S	.	*	S	Bend	trans	86.6	134.9	-174.5	0	0	0	0	0	112.2	Y411	G407-Y411 WeakPolarHBondContact O-CB 3.48Å; G407-Y411 PolarHBondContact O-N 3.34Å
408	R	88.1	Confident	88.9	Confident	196 Å²	196	120.7 Å²	120.7	74%	0.74	58%	0.584	S	S	*	*	H	α-helix	trans	-69.2	-48	179.9	174.1	175.5	-73.1	151.7	-3	111.3	T410 Y411 E412	R408-T410 VanDerWaalsContact C-N 3.34Å; R408-T410 PolarHBondContact O-N 2.9Å; R408-Y411 WeakPolarHBondContact O-CB 3.18Å; R408-Y411 PolarHBondContact O-N 2.7Å; R408-Y411 VanDerWaalsContact O-N 3.12Å; R408-E412 VanDerWaalsContact CD-OE1 3.25Å; R408-E412 WeakPolarHBondContact CD-OE1 3.28Å; R408-E412 HydrophobicContact CG-CG 4.32Å; R408-E412 WeakPolarHBondContact CG-OE1 3.39Å; R408-E412 WeakPolarHBondContact O-CG 3.38Å; R408-E412 PolarHBondContact O-N 3.13Å
409	E	91.8	Very high	90.3	Very high	164 Å²	164	118.9 Å²	118.9	77%	0.766	57%	0.571	S	S	*	*	H	α-helix	trans	-59.6	-43.6	-179.6	-66.8	158.9	-161.9	0	0	111.7	Y411 E412 M413	E409-Y411 PolarHBondContact O-N 2.78Å; E409-E412 PolarHBondContact O-N 3.17Å; E409-M413 WeakPolarHBondContact O-CB 3.4Å; E409-M413 PolarHBondContact O-N 3.45Å
410	T	89	Confident	90.5	Very high	72 Å²	72	114.6 Å²	114.6	44%	0.442	56%	0.558	S	S	.	*	H	α-helix	trans	-62.4	-40.8	174.9	-42.2	0	0	0	0	112	V405 R408 L414	V405-T410 HydrophobicContact CG1-CG2 3.91Å; R408-T410 VanDerWaalsContact C-N 3.34Å; R408-T410 PolarHBondContact O-N 2.9Å; T410-L414 HydrophobicContact CG2-CD1 4.21Å; T410-L414 WeakPolarHBondContact O-CB 3.22Å; T410-L414 VanDerWaalsContact O-CG 3.3Å; T410-L414 WeakPolarHBondContact O-CG 3.45Å; T410-L414 PolarHBondContact O-N 3.11Å
411	Y	95.1	Very high	90.8	Very high	125 Å²	125	112.8 Å²	112.8	49%	0.49	55%	0.549	S	S	.	.	H	α-helix	trans	-64.6	-45.9	174.1	169.1	-92.9	0	0	0	111.8	G407 R408 E409 M413 L414 L415	G407-Y411 WeakPolarHBondContact O-CB 3.48Å; G407-Y411 PolarHBondContact O-N 3.34Å; R408-Y411 WeakPolarHBondContact O-CB 3.18Å; R408-Y411 PolarHBondContact O-N 2.7Å; R408-Y411 VanDerWaalsContact O-N 3.12Å; E409-Y411 PolarHBondContact O-N 2.78Å; Y411-M413 VanDerWaalsContact C-N 3.35Å; Y411-M413 PolarHBondContact O-N 2.87Å; Y411-L414 PolarHBondContact O-N 3.34Å; Y411-L415 HydrophobicContact CE1-CD2 3.97Å; Y411-L415 VanDerWaalsContact O-CB 3.27Å; Y411-L415 WeakPolarHBondContact O-CB 3.23Å; Y411-L415 PolarHBondContact O-N 3.41Å
412	E	92.8	Very high	90.7	Very high	83 Å²	83	110 Å²	110	39%	0.388	53%	0.532	S	S	.	.	H	α-helix	trans	-66.5	-34.9	179.8	-72.2	175.9	-159.3	0	0	112.6	R408 E409 K416	R408-E412 VanDerWaalsContact CD-OE1 3.25Å; R408-E412 WeakPolarHBondContact CD-OE1 3.28Å; R408-E412 HydrophobicContact CG-CG 4.32Å; R408-E412 WeakPolarHBondContact CG-OE1 3.39Å; R408-E412 WeakPolarHBondContact O-CG 3.38Å; R408-E412 PolarHBondContact O-N 3.13Å; E409-E412 PolarHBondContact O-N 3.17Å; E412-K416 WeakPolarHBondContact O-CD 3.41Å; E412-K416 VanDerWaalsContact O-CG 3.25Å; E412-K416 WeakPolarHBondContact O-CG 3.14Å; E412-K416 PolarHBondContact O-N 3.48Å; E412-K416 VanDerWaalsContact O-N 3.1Å
413	M	94.8	Very high	90.6	Very high	99 Å²	99	105.9 Å²	105.9	49%	0.488	52%	0.523	S	S	.	.	H	α-helix	trans	-65	-49.7	172	-175.4	-174.6	-70.4	0	0	111.4	E409 Y411 L415 K416 I417	E409-M413 WeakPolarHBondContact O-CB 3.4Å; E409-M413 PolarHBondContact O-N 3.45Å; Y411-M413 VanDerWaalsContact C-N 3.35Å; Y411-M413 PolarHBondContact O-N 2.87Å; M413-L415 VanDerWaalsContact C-N 3.31Å; M413-L415 PolarHBondContact O-N 2.71Å; M413-K416 PolarHBondContact O-N 2.87Å; M413-I417 HydrophobicContact CG-CD1 4.19Å; M413-I417 WeakPolarHBondContact O-CG1 3.44Å; M413-I417 PolarHBondContact O-N 3.15Å
414	L	93.8	Very high	90	Very high	69 Å²	69	104.5 Å²	104.5	36%	0.361	51%	0.514	S	S	.	.	H	α-helix	trans	-66.2	-32.3	179.2	-71.4	170.2	0	0	0	112.5	L403 V405 T410 Y411 I417 K418	L403-L414 HydrophobicContact CD2-CD1 4.3Å; V405-L414 HydrophobicContact CG1-CD1 4.05Å; V405-L414 HydrophobicContact CG2-CD1 3.64Å; T410-L414 HydrophobicContact CG2-CD1 4.21Å; T410-L414 WeakPolarHBondContact O-CB 3.22Å; T410-L414 VanDerWaalsContact O-CG 3.3Å; T410-L414 WeakPolarHBondContact O-CG 3.45Å; T410-L414 PolarHBondContact O-N 3.11Å; Y411-L414 PolarHBondContact O-N 3.34Å; L414-I417 PolarHBondContact O-N 2.87Å; L414-K418 WeakPolarHBondContact O-CB 3.37Å; L414-K418 PolarHBondContact O-N 3.18Å
415	L	92.4	Very high	89.4	Confident	50 Å²	50	105.9 Å²	105.9	26%	0.262	51%	0.51	S	S	.	.	H	α-helix	trans	-65.4	-47.8	173.6	-177.8	62.1	0	0	0	111.4	Y411 M413 I417 K418 E419	Y411-L415 HydrophobicContact CE1-CD2 3.97Å; Y411-L415 VanDerWaalsContact O-CB 3.27Å; Y411-L415 WeakPolarHBondContact O-CB 3.23Å; Y411-L415 PolarHBondContact O-N 3.41Å; M413-L415 VanDerWaalsContact C-N 3.31Å; M413-L415 PolarHBondContact O-N 2.71Å; L415-I417 VanDerWaalsContact C-N 3.29Å; L415-I417 PolarHBondContact O-N 2.82Å; L415-K418 HydrophobicContact CD1-CD 4.49Å; L415-K418 WeakPolarHBondContact O-CB 3.46Å; L415-K418 PolarHBondContact O-N 3.13Å; L415-E419 HydrophobicContact CD1-CG 4.21Å; L415-E419 HydrophobicContact CG-CG 4.47Å; L415-E419 WeakPolarHBondContact O-CG 3.25Å; L415-E419 PolarHBondContact O-N 3.24Å
416	K	92.4	Very high	88.6	Confident	138 Å²	138	112.2 Å²	112.2	60%	0.6	53%	0.53	S	S	*	.	H	α-helix	trans	-59.1	-40.1	174.9	-71.3	163.7	-173.7	170.2	0	112	E412 M413 S420	E412-K416 WeakPolarHBondContact O-CD 3.41Å; E412-K416 VanDerWaalsContact O-CG 3.25Å; E412-K416 WeakPolarHBondContact O-CG 3.14Å; E412-K416 PolarHBondContact O-N 3.48Å; E412-K416 VanDerWaalsContact O-N 3.1Å; M413-K416 PolarHBondContact O-N 2.87Å; K416-S420 WeakPolarHBondContact O-CB 3.16Å; K416-S420 PolarHBondContact O-N 3.18Å; K416-S420 PolarHBondContact O-OG 3.33Å; K416-S420 VanDerWaalsContact O-OG 3.11Å
417	I	92.5	Very high	88.1	Confident	81 Å²	81	104.3 Å²	104.3	42%	0.415	51%	0.505	S	S	.	.	H	α-helix	trans	-62.2	-51.1	174	-67.3	165.4	0	0	0	110.3	M413 L414 L415 E419 S420 L421	M413-I417 HydrophobicContact CG-CD1 4.19Å; M413-I417 WeakPolarHBondContact O-CG1 3.44Å; M413-I417 PolarHBondContact O-N 3.15Å; L414-I417 PolarHBondContact O-N 2.87Å; L415-I417 VanDerWaalsContact C-N 3.29Å; L415-I417 PolarHBondContact O-N 2.82Å; I417-E419 PolarHBondContact O-N 3.33Å; I417-S420 PolarHBondContact O-N 3.39Å; I417-S420 PolarHBondContact O-OG 3.18Å; I417-L421 HydrophobicContact CG2-CD1 4.02Å; I417-L421 HydrophobicContact CG2-CG 4.4Å; I417-L421 WeakPolarHBondContact O-CG 3.46Å; I417-L421 PolarHBondContact O-N 3.33Å
418	K	92.8	Very high	87.6	Confident	101 Å²	101	105.1 Å²	105.1	44%	0.439	50%	0.5	S	S	.	.	H	α-helix	trans	-52.6	-53.7	175.6	175.9	-167.6	172.2	-72.3	0	111.9	L414 L415 S420 L421 E422	L414-K418 WeakPolarHBondContact O-CB 3.37Å; L414-K418 PolarHBondContact O-N 3.18Å; L415-K418 HydrophobicContact CD1-CD 4.49Å; L415-K418 WeakPolarHBondContact O-CB 3.46Å; L415-K418 PolarHBondContact O-N 3.13Å; K418-S420 VanDerWaalsContact C-N 3.34Å; K418-S420 PolarHBondContact O-N 2.95Å; K418-L421 PolarHBondContact O-N 2.74Å; K418-E422 WeakPolarHBondContact CE-OE1 3.34Å; K418-E422 IonicContact NZ-OE1 2.98Å; K418-E422 PolarHBondContact NZ-OE1 2.97Å; K418-E422 IonicContact NZ-OE2 2.75Å; K418-E422 PolarHBondContact NZ-OE2 3.12Å; K418-E422 WeakPolarHBondContact O-CG 3.06Å; K418-E422 PolarHBondContact O-N 2.74Å
419	E	89.5	Confident	86.8	Confident	101 Å²	101	103.6 Å²	103.6	47%	0.472	50%	0.502	S	S	.	.	H	α-helix	trans	-64.5	-37.1	-175.4	-70	173.2	161.4	0	0	111.9	L415 I417 L423	L415-E419 HydrophobicContact CD1-CG 4.21Å; L415-E419 HydrophobicContact CG-CG 4.47Å; L415-E419 WeakPolarHBondContact O-CG 3.25Å; L415-E419 PolarHBondContact O-N 3.24Å; I417-E419 PolarHBondContact O-N 3.33Å; E419-L423 WeakPolarHBondContact O-CB 3.34Å; E419-L423 PolarHBondContact O-N 3.18Å
420	S	86.9	Confident	86.3	Confident	61 Å²	61	102.1 Å²	102.1	43%	0.427	50%	0.495	S	S	.	.	H	α-helix	trans	-68.3	-39.3	173.8	66.4	0	0	0	0	113.1	K416 I417 K418 L423 M424	K416-S420 WeakPolarHBondContact O-CB 3.16Å; K416-S420 PolarHBondContact O-N 3.18Å; K416-S420 PolarHBondContact O-OG 3.33Å; K416-S420 VanDerWaalsContact O-OG 3.11Å; I417-S420 PolarHBondContact O-N 3.39Å; I417-S420 PolarHBondContact O-OG 3.18Å; K418-S420 VanDerWaalsContact C-N 3.34Å; K418-S420 PolarHBondContact O-N 2.95Å; S420-L423 PolarHBondContact O-N 3.12Å; S420-M424 WeakPolarHBondContact O-CG 3.4Å; S420-M424 PolarHBondContact O-N 3.26Å
421	L	86	Confident	85.8	Confident	93 Å²	93	100.6 Å²	100.6	49%	0.487	49%	0.485	S	S	.	.	H	α-helix	trans	-65.2	-40.5	175.7	-69.5	177	0	0	0	111.7	I417 K418 M424	I417-L421 HydrophobicContact CG2-CD1 4.02Å; I417-L421 HydrophobicContact CG2-CG 4.4Å; I417-L421 WeakPolarHBondContact O-CG 3.46Å; I417-L421 PolarHBondContact O-N 3.33Å; K418-L421 PolarHBondContact O-N 2.74Å; L421-M424 HydrophobicContact CD2-CE 3.71Å
422	E	85	Confident	85.2	Confident	82 Å²	82	97.4 Å²	97.4	38%	0.383	48%	0.476	S	S	.	.	H	α-helix	trans	-62.7	-45.7	171.8	-72.8	170.2	144.4	0	0	111.1	K418 M424 Q425 Y426	K418-E422 WeakPolarHBondContact CE-OE1 3.34Å; K418-E422 IonicContact NZ-OE1 2.98Å; K418-E422 PolarHBondContact NZ-OE1 2.97Å; K418-E422 IonicContact NZ-OE2 2.75Å; K418-E422 PolarHBondContact NZ-OE2 3.12Å; K418-E422 WeakPolarHBondContact O-CG 3.06Å; K418-E422 PolarHBondContact O-N 2.74Å; E422-M424 VanDerWaalsContact C-N 3.33Å; E422-M424 PolarHBondContact O-N 3.49Å; E422-Q425 WeakPolarHBondContact O-CB 3.38Å; E422-Q425 PolarHBondContact O-N 3.14Å; E422-Q425 VanDerWaalsContact O-N 3.14Å; E422-Y426 WeakPolarHBondContact O-CD2 3.21Å; E422-Y426 VanDerWaalsContact O-CE2 3.31Å; E422-Y426 WeakPolarHBondContact O-CE2 3.38Å
423	L	83.9	Confident	84.7	Confident	112 Å²	112	97.7 Å²	97.7	59%	0.586	48%	0.477	S	S	*	.	H	α-helix	trans	-60.7	-38.5	178.7	-176	61.7	0	0	0	112.7	E419 S420 Q425 Y426	E419-L423 WeakPolarHBondContact O-CB 3.34Å; E419-L423 PolarHBondContact O-N 3.18Å; S420-L423 PolarHBondContact O-N 3.12Å; L423-Q425 PolarHBondContact O-N 3.31Å; L423-Y426 PolarHBondContact O-N 3.31Å; L423-Y426 VanDerWaalsContact O-N 3.1Å
424	M	79.3	Confident	84.1	Confident	105 Å²	105	97.1 Å²	97.1	52%	0.517	48%	0.479	S	S	.	.	H	α-helix	trans	-59.8	-29.2	176.8	-73.5	-160.1	-47.2	0	0	113.4	S420 L421 E422 Y426 L427	S420-M424 WeakPolarHBondContact O-CG 3.4Å; S420-M424 PolarHBondContact O-N 3.26Å; L421-M424 HydrophobicContact CD2-CE 3.71Å; E422-M424 VanDerWaalsContact C-N 3.33Å; E422-M424 PolarHBondContact O-N 3.49Å; M424-Y426 PolarHBondContact O-N 3.38Å; M424-L427 HydrophobicContact CG-CD1 4.47Å; M424-L427 PolarHBondContact O-N 3.34Å
425	Q	76	Confident	83.4	Confident	155 Å²	155	100.7 Å²	100.7	72%	0.724	49%	0.489	S	S	*	.	T	Hydrogen-bonded Turn	trans	-66.5	-20.4	178.6	-60.4	-175.3	4.4	0	0	113	E422 L423	E422-Q425 WeakPolarHBondContact O-CB 3.38Å; E422-Q425 PolarHBondContact O-N 3.14Å; E422-Q425 VanDerWaalsContact O-N 3.14Å; L423-Q425 PolarHBondContact O-N 3.31Å
426	Y	78.9	Confident	83	Confident	182 Å²	182	104.6 Å²	104.6	71%	0.714	50%	0.5	S	S	*	.	T	Hydrogen-bonded Turn	trans	-98.1	-2.7	179.3	-57	-77.2	0	0	0	113.6	E422 L423 M424	E422-Y426 WeakPolarHBondContact O-CD2 3.21Å; E422-Y426 VanDerWaalsContact O-CE2 3.31Å; E422-Y426 WeakPolarHBondContact O-CE2 3.38Å; L423-Y426 PolarHBondContact O-N 3.31Å; L423-Y426 VanDerWaalsContact O-N 3.1Å; M424-Y426 PolarHBondContact O-N 3.38Å
427	L	78.9	Confident	82.6	Confident	71 Å²	71	103.1 Å²	103.1	37%	0.372	50%	0.496	S	S	.	.	S	Bend	trans	-77.6	136.3	178.9	-68.2	178.8	0	0	0	111.7	M424 Q429 I432	M424-L427 HydrophobicContact CG-CD1 4.47Å; M424-L427 PolarHBondContact O-N 3.34Å; L427-Q429 PolarHBondContact O-N 3.5Å; L427-I432 HydrophobicContact CB-CD1 4.16Å; L427-I432 HydrophobicContact CB-CG1 4.02Å
428	P	79.9	Confident	82.2	Confident	67 Å²	67	104 Å²	104	44%	0.435	50%	0.498	S	S	.	.			trans	-59.6	137.6	173.9	-24.1	34.6	0	0	0	112.2	H430 T431 I432	P428-H430 VanDerWaalsContact C-N 3.25Å; P428-H430 PolarHBondContact O-N 2.87Å; P428-H430 VanDerWaalsContact O-N 3.15Å; P428-T431 VanDerWaalsContact O-CB 3.31Å; P428-T431 WeakPolarHBondContact O-CB 3.47Å; P428-T431 PolarHBondContact O-N 3.17Å; P428-T431 PolarHBondContact O-OG1 2.75Å; P428-I432 PolarHBondContact O-N 2.89Å
429	Q	71.8	Confident	81.6	Confident	165 Å²	165	105.7 Å²	105.7	77%	0.771	51%	0.507	S	S	*	.	H	α-helix	trans	-55.2	-37.2	-176.4	-71.4	-178.8	-21.2	0	0	113.6	L427 T431 I432 E433	L427-Q429 PolarHBondContact O-N 3.5Å; Q429-T431 VanDerWaalsContact C-N 3.26Å; Q429-T431 PolarHBondContact O-N 3.45Å; Q429-I432 PolarHBondContact O-N 2.76Å; Q429-E433 PolarHBondContact O-N 3.49Å
430	H	81.1	Confident	81.3	Confident	133 Å²	133	107.2 Å²	107.2	62%	0.616	51%	0.514	S	S	*	.	H	α-helix	trans	-60.1	-36.9	177.1	77.8	-94.1	0	0	0	112.1	P428 E433 T434	P428-H430 VanDerWaalsContact C-N 3.25Å; P428-H430 PolarHBondContact O-N 2.87Å; P428-H430 VanDerWaalsContact O-N 3.15Å; H430-E433 PolarHBondContact O-N 3.4Å; H430-T434 PolarHBondContact O-N 2.83Å; H430-T434 PolarHBondContact O-OG1 2.93Å
431	T	78.4	Confident	81	Confident	39 Å²	39	110.3 Å²	110.3	24%	0.239	52%	0.522	C	S	.	.	H	α-helix	trans	-69	-42	179	-39.7	0	0	0	0	110.6	P428 Q429 E433 T434 Y435	P428-T431 VanDerWaalsContact O-CB 3.31Å; P428-T431 WeakPolarHBondContact O-CB 3.47Å; P428-T431 PolarHBondContact O-N 3.17Å; P428-T431 PolarHBondContact O-OG1 2.75Å; Q429-T431 VanDerWaalsContact C-N 3.26Å; Q429-T431 PolarHBondContact O-N 3.45Å; T431-E433 VanDerWaalsContact C-N 3.35Å; T431-T434 PolarHBondContact O-N 3.13Å; T431-Y435 HydrophobicContact CG2-CD2 4.18Å; T431-Y435 HydrophobicContact CG2-CE2 4Å; T431-Y435 VanDerWaalsContact O-CD2 3.31Å; T431-Y435 WeakPolarHBondContact O-CD2 3.26Å; T431-Y435 PolarHBondContact O-N 3.13Å
432	I	81.3	Confident	80.7	Confident	59 Å²	59	112.3 Å²	112.3	30%	0.303	53%	0.529	S	S	.	.	H	α-helix	trans	-61.4	-43.6	175.2	-59	171.9	0	0	0	110.5	L427 P428 Q429 Y435 R436	L427-I432 HydrophobicContact CB-CD1 4.16Å; L427-I432 HydrophobicContact CB-CG1 4.02Å; P428-I432 PolarHBondContact O-N 2.89Å; Q429-I432 PolarHBondContact O-N 2.76Å; I432-Y435 PolarHBondContact O-N 2.86Å; I432-R436 PolarHBondContact O-N 3.22Å
433	E	82.9	Confident	80.4	Confident	89 Å²	89	114.3 Å²	114.3	42%	0.416	54%	0.538	S	S	.	.	H	α-helix	trans	-67.2	-36.8	177.9	-137.7	71.3	-101.6	0	0	112.2	Q429 H430 T431 R436 Q437	Q429-E433 PolarHBondContact O-N 3.49Å; H430-E433 PolarHBondContact O-N 3.4Å; T431-E433 VanDerWaalsContact C-N 3.35Å; E433-R436 PolarHBondContact O-N 3.47Å; E433-R436 VanDerWaalsContact OE1-CD 3.25Å; E433-R436 WeakPolarHBondContact OE1-CD 3.46Å; E433-R436 IonicContact OE1-CZ 3.97Å; E433-R436 IonicContact OE1-NH1 3.04Å; E433-R436 PolarHBondContact OE1-NH1 3.36Å; E433-Q437 WeakPolarHBondContact O-CG 3.47Å; E433-Q437 PolarHBondContact O-N 2.81Å
434	T	83.4	Confident	79.9	Confident	86 Å²	86	115.9 Å²	115.9	53%	0.528	54%	0.543	S	S	.	.	H	α-helix	trans	-62.9	-45.4	173.3	-58.4	0	0	0	0	111.8	H430 T431 R436 Q437 Q438	H430-T434 PolarHBondContact O-N 2.83Å; H430-T434 PolarHBondContact O-OG1 2.93Å; T431-T434 PolarHBondContact O-N 3.13Å; T434-R436 VanDerWaalsContact C-N 3.35Å; T434-R436 PolarHBondContact O-N 2.78Å; T434-Q437 PolarHBondContact O-N 3.43Å; T434-Q438 PolarHBondContact O-N 3.12Å
435	Y	77.1	Confident	79.6	Confident	144 Å²	144	116.6 Å²	116.6	57%	0.565	55%	0.545	S	S	*	.	H	α-helix	trans	-63.4	-38.3	175.5	-83.7	-66.3	0	0	0	112.5	T431 I432 Q438 Q439	T431-Y435 HydrophobicContact CG2-CD2 4.18Å; T431-Y435 HydrophobicContact CG2-CE2 4Å; T431-Y435 VanDerWaalsContact O-CD2 3.31Å; T431-Y435 WeakPolarHBondContact O-CD2 3.26Å; T431-Y435 PolarHBondContact O-N 3.13Å; I432-Y435 PolarHBondContact O-N 2.86Å; Y435-Q438 PolarHBondContact O-N 3.31Å; Y435-Q439 PolarHBondContact O-N 3.31Å
436	R	84.4	Confident	79.3	Confident	133 Å²	133	114 Å²	114	50%	0.502	54%	0.535	S	S	.	.	H	α-helix	trans	-61.4	-45.7	172.1	-82.5	177.7	171.5	165	-0.4	112.7	I432 E433 T434 Q438 Q439 Q440	I432-R436 PolarHBondContact O-N 3.22Å; E433-R436 PolarHBondContact O-N 3.47Å; E433-R436 VanDerWaalsContact OE1-CD 3.25Å; E433-R436 WeakPolarHBondContact OE1-CD 3.46Å; E433-R436 IonicContact OE1-CZ 3.97Å; E433-R436 IonicContact OE1-NH1 3.04Å; E433-R436 PolarHBondContact OE1-NH1 3.36Å; T434-R436 VanDerWaalsContact C-N 3.35Å; T434-R436 PolarHBondContact O-N 2.78Å; R436-Q438 VanDerWaalsContact C-N 3.3Å; R436-Q438 PolarHBondContact O-N 2.64Å; R436-Q439 PolarHBondContact O-N 3.29Å; R436-Q440 WeakPolarHBondContact O-CG 3.49Å; R436-Q440 PolarHBondContact O-N 2.78Å
437	Q	83.6	Confident	78.7	Confident	106 Å²	106	109.7 Å²	109.7	50%	0.495	52%	0.524	S	S	.	.	H	α-helix	trans	-62.4	-39	176.4	-72.7	-178	22.4	0	0	111.4	E433 T434 Q440 Q441	E433-Q437 WeakPolarHBondContact O-CG 3.47Å; E433-Q437 PolarHBondContact O-N 2.81Å; T434-Q437 PolarHBondContact O-N 3.43Å; Q437-Q440 PolarHBondContact O-N 3.06Å; Q437-Q441 WeakPolarHBondContact O-CB 3.31Å; Q437-Q441 VanDerWaalsContact O-CG 3.27Å; Q437-Q441 WeakPolarHBondContact O-CG 3.3Å; Q437-Q441 PolarHBondContact O-N 3.29Å
438	Q	85.1	Confident	77.8	Confident	101 Å²	101	113 Å²	113	47%	0.472	54%	0.537	S	S	.	.	H	α-helix	trans	-63.7	-43.2	176.2	-166.3	176.6	35.3	0	0	112.2	T434 Y435 R436 Q441 Q442	T434-Q438 PolarHBondContact O-N 3.12Å; Y435-Q438 PolarHBondContact O-N 3.31Å; R436-Q438 VanDerWaalsContact C-N 3.3Å; R436-Q438 PolarHBondContact O-N 2.64Å; Q438-Q441 PolarHBondContact O-N 3.03Å; Q438-Q442 PolarHBondContact O-N 3.01Å
439	Q	80.7	Confident	76.6	Confident	135 Å²	135	116.5 Å²	116.5	63%	0.631	55%	0.546	S	S	*	.	H	α-helix	trans	-63.7	-42.8	173.5	-74	-177.2	-10.1	0	0	112.2	Y435 R436 Q441 Q442 H443	Y435-Q439 PolarHBondContact O-N 3.31Å; R436-Q439 PolarHBondContact O-N 3.29Å; Q439-Q441 VanDerWaalsContact C-N 3.35Å; Q439-Q441 PolarHBondContact O-N 3.16Å; Q439-Q442 PolarHBondContact O-N 2.66Å; Q439-H443 WeakPolarHBondContact O-CB 3.25Å; Q439-H443 PolarHBondContact O-N 3.3Å
440	Q	82.1	Confident	75.7	Confident	133 Å²	133	115.2 Å²	115.2	62%	0.621	54%	0.54	S	S	*	.	H	α-helix	trans	-63.5	-38.6	176.4	-73.3	177.7	1.8	0	0	112.3	R436 Q437 H443 Q444	R436-Q440 WeakPolarHBondContact O-CG 3.49Å; R436-Q440 PolarHBondContact O-N 2.78Å; Q437-Q440 PolarHBondContact O-N 3.06Å; Q440-H443 PolarHBondContact O-N 3.45Å; Q440-Q444 WeakPolarHBondContact O-CB 3.46Å; Q440-Q444 PolarHBondContact O-N 3.18Å
441	Q	81.7	Confident	74.1	Confident	127 Å²	127	114.4 Å²	114.4	59%	0.593	54%	0.544	S	S	*	.	H	α-helix	trans	-65.3	-44.5	174.2	-73.6	172.7	21.2	0	0	111.9	Q437 Q438 Q439 H443 Q444 H445	Q437-Q441 WeakPolarHBondContact O-CB 3.31Å; Q437-Q441 VanDerWaalsContact O-CG 3.27Å; Q437-Q441 WeakPolarHBondContact O-CG 3.3Å; Q437-Q441 PolarHBondContact O-N 3.29Å; Q438-Q441 PolarHBondContact O-N 3.03Å; Q439-Q441 VanDerWaalsContact C-N 3.35Å; Q439-Q441 PolarHBondContact O-N 3.16Å; Q441-H443 VanDerWaalsContact C-N 3.35Å; Q441-H443 PolarHBondContact O-N 3.18Å; Q441-Q444 PolarHBondContact O-N 2.95Å; Q441-H445 VanDerWaalsContact O-CB 3.29Å; Q441-H445 WeakPolarHBondContact O-CB 3.38Å; Q441-H445 PolarHBondContact O-N 3.43Å
442	Q	79.4	Confident	72.6	Confident	135 Å²	135	117.1 Å²	117.1	63%	0.631	57%	0.565	S	S	*	*	H	α-helix	trans	-60.1	-44.1	173.8	-76.3	-173.1	-7.5	0	0	111.9	Q438 Q439 H445 L446	Q438-Q442 PolarHBondContact O-N 3.01Å; Q439-Q442 PolarHBondContact O-N 2.66Å; Q442-H445 PolarHBondContact O-N 3.43Å; Q442-L446 WeakPolarHBondContact O-CB 3.18Å; Q442-L446 PolarHBondContact O-N 2.87Å
443	H	77.9	Confident	70.9	Confident	123 Å²	123	120.9 Å²	120.9	57%	0.569	58%	0.584	S	S	*	*	H	α-helix	trans	-64	-45.5	178.7	-162.1	78.7	0	0	0	111.6	Q439 Q440 Q441 H445 L446 L447	Q439-H443 WeakPolarHBondContact O-CB 3.25Å; Q439-H443 PolarHBondContact O-N 3.3Å; Q440-H443 PolarHBondContact O-N 3.45Å; Q441-H443 VanDerWaalsContact C-N 3.35Å; Q441-H443 PolarHBondContact O-N 3.18Å; H443-H445 VanDerWaalsContact C-N 3.35Å; H443-H445 PolarHBondContact O-N 3.12Å; H443-L446 WeakPolarHBondContact O-CB 3.4Å; H443-L446 PolarHBondContact O-N 3.3Å; H443-L446 VanDerWaalsContact O-N 3.14Å; H443-L447 WeakPolarHBondContact O-CD1 3.19Å; H443-L447 PolarHBondContact O-N 3.33Å
444	Q	73.7	Confident	69	Low	146 Å²	146	125.9 Å²	125.9	68%	0.682	61%	0.607	S	S	*	*	H	α-helix	trans	-62.3	-40.3	176.6	-170.9	172.2	100.6	0	0	112.3	Q440 Q441 L446 L447 Q448	Q440-Q444 WeakPolarHBondContact O-CB 3.46Å; Q440-Q444 PolarHBondContact O-N 3.18Å; Q441-Q444 PolarHBondContact O-N 2.95Å; Q444-L446 VanDerWaalsContact C-N 3.32Å; Q444-L446 PolarHBondContact O-N 2.97Å; Q444-L447 PolarHBondContact O-N 2.97Å; Q444-Q448 WeakPolarHBondContact O-CB 3.44Å; Q444-Q448 PolarHBondContact O-N 2.85Å
445	H	72.8	Confident	66.7	Low	120 Å²	120	127 Å²	127	56%	0.556	62%	0.619	S	S	*	*	H	α-helix	trans	-66.5	-31.6	174.7	-173.4	-95.4	0	0	0	112.6	Q441 Q442 H443 K449	Q441-H445 VanDerWaalsContact O-CB 3.29Å; Q441-H445 WeakPolarHBondContact O-CB 3.38Å; Q441-H445 PolarHBondContact O-N 3.43Å; Q442-H445 PolarHBondContact O-N 3.43Å; H443-H445 VanDerWaalsContact C-N 3.35Å; H443-H445 PolarHBondContact O-N 3.12Å; H445-K449 PolarHBondContact O-N 2.75Å
446	L	70.3	Confident	64.8	Low	101 Å²	101	129.6 Å²	129.6	53%	0.529	64%	0.636	S	S	.	*	H	α-helix	trans	-70.7	-44.8	174.4	-168.3	68.4	0	0	0	112	Q442 H443 Q444 Q448 K449 Q450	Q442-L446 WeakPolarHBondContact O-CB 3.18Å; Q442-L446 PolarHBondContact O-N 2.87Å; H443-L446 WeakPolarHBondContact O-CB 3.4Å; H443-L446 PolarHBondContact O-N 3.3Å; H443-L446 VanDerWaalsContact O-N 3.14Å; Q444-L446 VanDerWaalsContact C-N 3.32Å; Q444-L446 PolarHBondContact O-N 2.97Å; L446-Q448 PolarHBondContact O-N 3.49Å; L446-K449 WeakPolarHBondContact O-CB 3.33Å; L446-K449 PolarHBondContact O-N 3.22Å; L446-Q450 PolarHBondContact O-N 2.92Å
447	L	66	Low	62.5	Low	91 Å²	91	128.4 Å²	128.4	48%	0.476	65%	0.649	S	S	.	*	H	α-helix	trans	-61.3	-43.1	174.7	-88.1	80.7	0	0	0	111.6	H443 Q444 K449 Q450 T451	H443-L447 WeakPolarHBondContact O-CD1 3.19Å; H443-L447 PolarHBondContact O-N 3.33Å; Q444-L447 PolarHBondContact O-N 2.97Å; L447-K449 PolarHBondContact O-N 2.98Å; L447-Q450 PolarHBondContact O-N 3.1Å; L447-T451 PolarHBondContact O-N 3.46Å; L447-T451 PolarHBondContact O-OG1 3.26Å
448	Q	60.9	Low	59.9	Low	139 Å²	139	129 Å²	129	65%	0.65	67%	0.665	S	S	*	*	H	α-helix	trans	-63.5	-28.6	-178.5	-165.1	167.4	65.5	0	0	112.7	Q444 L446 T451	Q444-Q448 WeakPolarHBondContact O-CB 3.44Å; Q444-Q448 PolarHBondContact O-N 2.85Å; L446-Q448 PolarHBondContact O-N 3.49Å; Q448-T451 PolarHBondContact O-OG1 3.5Å
449	K	54.5	Low	57.4	Low	142 Å²	142	135.1 Å²	135.1	62%	0.617	69%	0.685	S	S	*	*	H	α-helix	trans	-66.9	-35.4	169.8	-99.9	-174	173.1	-175.5	0	113.5	H445 L446 L447 S452	H445-K449 PolarHBondContact O-N 2.75Å; L446-K449 WeakPolarHBondContact O-CB 3.33Å; L446-K449 PolarHBondContact O-N 3.22Å; L447-K449 PolarHBondContact O-N 2.98Å; K449-S452 WeakPolarHBondContact O-CB 3.3Å; K449-S452 PolarHBondContact O-N 3.37Å
450	Q	52.5	Low	55	Low	137 Å²	137	132 Å²	132	64%	0.64	69%	0.689	S	S	*	*	H	α-helix	trans	-71.1	-38.7	-179	-68.9	-173.7	-10.4	0	0	112.4	L446 L447 S452 I453	L446-Q450 PolarHBondContact O-N 2.92Å; L447-Q450 PolarHBondContact O-N 3.1Å; Q450-S452 PolarHBondContact O-N 3.47Å; Q450-S452 VanDerWaalsContact O-N 3.08Å; Q450-I453 PolarHBondContact O-N 2.77Å
451	T	47.5	Very low	52.4	Low	117 Å²	117	133.1 Å²	133.1	72%	0.718	70%	0.699	S	S	*	*	T	Hydrogen-bonded Turn	trans	-62.5	-14.2	174.7	33.8	0	0	0	0	114.4	L447 Q448	L447-T451 PolarHBondContact O-N 3.46Å; L447-T451 PolarHBondContact O-OG1 3.26Å; Q448-T451 PolarHBondContact O-OG1 3.5Å
452	S	46	Very low	49.9	Very low	96 Å²	96	131.7 Å²	131.7	67%	0.671	70%	0.703	S	S	*	*	T	Hydrogen-bonded Turn	trans	-81.9	-7.5	177.6	-168.3	0	0	0	0	114.4	K449 Q450	K449-S452 WeakPolarHBondContact O-CB 3.3Å; K449-S452 PolarHBondContact O-N 3.37Å; Q450-S452 PolarHBondContact O-N 3.47Å; Q450-S452 VanDerWaalsContact O-N 3.08Å
453	I	46.4	Very low	47.5	Very low	138 Å²	138	130.8 Å²	130.8	71%	0.708	71%	0.712	S	S	*	*	T	Hydrogen-bonded Turn	trans	-109.4	-15.7	-167	-65.4	175.3	0	0	0	113.2	Q450 S455	Q450-I453 PolarHBondContact O-N 2.77Å; I453-S455 PolarHBondContact O-N 3.39Å; I453-S455 VanDerWaalsContact O-N 3.13Å
454	Q	43.5	Very low	46.4	Very low	193 Å²	193	130.5 Å²	130.5	90%	0.902	72%	0.721	S	S	*	*			trans	-86.8	72.8	175.1	-82.8	-164.1	-12.2	0	0	113.8
455	S	35.5	Very low	45.3	Very low	111 Å²	111	128.3 Å²	128.3	78%	0.776	72%	0.72	S	S	*	*			trans	-154.1	68.6	157.9	63.6	0	0	0	0	111.5	I453	I453-S455 PolarHBondContact O-N 3.39Å; I453-S455 VanDerWaalsContact O-N 3.13Å
456	Q	35.6	Very low	43.4	Very low	197 Å²	197	129.7 Å²	129.7	92%	0.921	73%	0.73	S	S	*	*			trans	-74.9	146.7	173.3	-122.7	-178.9	5.5	0	0	111.4
457	S	36.7	Very low	41.5	Very low	109 Å²	109	130.7 Å²	130.7	76%	0.762	74%	0.736	S	S	*	*			trans	-72.4	141.5	-171	53.1	0	0	0	0	114.2
458	S	28.8	Very low	39.9	Very low	119 Å²	119	135.1 Å²	135.1	83%	0.832	75%	0.751	S	S	*	*			trans	-121.1	151.2	158.4	-168.1	0	0	0	0	110.3
459	Y	32.1	Very low	38.6	Very low	229 Å²	229	136.1 Å²	136.1	90%	0.898	76%	0.758	S	S	*	*			trans	-88.5	149.4	-176.3	-71.7	-103.2	0	0	0	111.9
460	G	30.5	Very low	37.5	Very low	70 Å²	70	136 Å²	136	72%	0.722	76%	0.764	S	S	*	*			trans	130.9	111.9	150.6	0	0	0	0	0	118
461	N	28.7	Very low	36.6	Very low	156 Å²	156	134.9 Å²	134.9	83%	0.834	77%	0.772	S	S	*	*			trans	34.6	129.1	141.3	-72.6	10.4	0	0	0	123.6
462	S	28.9	Very low	35.9	Very low	96 Å²	96	137.4 Å²	137.4	67%	0.671	78%	0.777	S	S	*	*			trans	64.5	93.3	132.5	69.1	0	0	0	0	121.9
463	S	29.5	Very low	35.4	Very low	116 Å²	116	139.4 Å²	139.4	81%	0.811	78%	0.78	S	S	*	*				65.6	-179.6	121.9	-34.3	0	0	0	0	117.8
464	P	53.9	Low	34.6	Very low	117 Å²	117	142.4 Å²	142.4	76%	0.76	79%	0.788	S	S	*	*			trans	-114.1	-160.3	-135.9	33	-7.1	0	0	0	110.6
465	P	51.8	Low	34.3	Very low	101 Å²	101	141 Å²	141	66%	0.656	79%	0.786	S	S	*	*			cis	-151.5	178.5	11.6	47.6	-28	0	0	0	119.4
466	L	32.2	Very low	34.5	Very low	148 Å²	148	141.9 Å²	141.9	78%	0.775	79%	0.789	S	S	*	*			trans	63.5	150.7	148.5	-70.3	157.7	0	0	0	118.2
467	N	30.3	Very low	34.8	Very low	123 Å²	123	137.9 Å²	137.9	66%	0.658	78%	0.783	S	S	*	*			cis	-159.3	164.7	10.2	-146.7	-23.9	0	0	0	113.1
468	K	33.1	Very low	34.5	Very low	183 Å²	183	138.6 Å²	138.6	80%	0.796	78%	0.783	S	S	*	*			trans	69.9	143.2	166.1	-59	175.6	-177.9	177.5	0	116.4
469	M	32.8	Very low	34.6	Very low	160 Å²	160	137 Å²	137	79%	0.788	77%	0.771	S	S	*	*			cis	-146.4	153.8	3.2	-164.8	154.4	167.9	0	0	113.2
470	N	31.1	Very low	34.5	Very low	139 Å²	139	134 Å²	134	74%	0.743	77%	0.766	S	S	*	*			trans	-11.9	150.2	164.2	-45.1	-5.2	0	0	0	118
471	S	33.3	Very low	34.6	Very low	115 Å²	115	137.7 Å²	137.7	80%	0.804	77%	0.768	S	S	*	*			cis	-161.4	166.3	37.7	-173.5	0	0	0	0	114.3
472	M	33.8	Very low	34.6	Very low	170 Å²	170	137.9 Å²	137.9	84%	0.837	77%	0.767	S	S	*	*			trans	-65.8	146.8	161.1	-73.7	-175.9	-178	0	0	111.1
473	N	34.9	Very low	34.7	Very low	137 Å²	137	140.1 Å²	140.1	73%	0.733	77%	0.772	S	S	*	*			cis	93.6	101.4	31.4	-176.1	7.1	0	0	0	113.8
474	K	30.7	Very low	35.4	Very low	201 Å²	201	140.2 Å²	140.2	87%	0.874	77%	0.77	S	S	*	*			trans	172.4	154.3	137.9	-98	170.4	-176.6	-177.1	0	116.1
475	L	35.5	Very low	34.3	Very low	163 Å²	163	142.1 Å²	142.1	85%	0.853	77%	0.768	S	S	*	*			trans	-76.9	169.9	166.3	-65.3	148.8	0	0	0	111.6
476	P	41.3	Very low	33.4	Very low	131 Å²	131	146.4 Å²	146.4	85%	0.851	78%	0.78	S	S	*	*				-145.7	-168	91.2	38.4	-20	0	0	0	115.3
477	S	40.4	Very low	33.3	Very low	113 Å²	113	148.5 Å²	148.5	79%	0.79	78%	0.777	S	S	*	*			trans	-128.6	-166.5	-170.5	-178	0	0	0	0	111.6
478	V	31.7	Very low	33.2	Very low	124 Å²	124	149.6 Å²	149.6	75%	0.752	78%	0.783	S	S	*	*			trans	112	136.9	152.5	-179.7	0	0	0	0	119.1
479	S	31.1	Very low	32.9	Very low	85 Å²	85	145 Å²	145	59%	0.594	78%	0.779	S	S	*	*			trans	75.7	160.5	155.9	-84.4	0	0	0	0	121.6
480	Q	30	Very low	32.6	Very low	167 Å²	167	145.6 Å²	145.6	78%	0.78	79%	0.785	S	S	*	*			cis	-168.6	159.4	-31.2	-113.2	167	-2.7	0	0	110.5
481	L	32.1	Very low	32.8	Very low	147 Å²	147	144.8 Å²	144.8	77%	0.77	79%	0.785	S	S	*	*			trans	17.3	147.9	156.5	-93.4	76.7	0	0	0	124.8
482	I	28.6	Very low	33.4	Very low	160 Å²	160	144.1 Å²	144.1	82%	0.821	78%	0.778	S	S	*	*			trans	97.9	143.6	144.8	-74.7	160.6	0	0	0	121
483	N	30.3	Very low	33.1	Very low	142 Å²	142	142.2 Å²	142.2	76%	0.759	78%	0.776	S	S	*	*			trans	-75	168	-176.8	-136	-8.6	0	0	0	112.4
484	P	43.7	Very low	32.8	Very low	118 Å²	118	142 Å²	142	77%	0.766	78%	0.78	S	S	*	*				-154.3	-168.5	67.4	43	-21.6	0	0	0	117
485	Q	30.8	Very low	33	Very low	157 Å²	157	139.9 Å²	139.9	73%	0.734	78%	0.776	S	S	*	*			trans	-62.8	154.5	177.6	-60.4	178.1	-16.6	0	0	115.6
486	Q	33.8	Very low	33.3	Very low	192 Å²	192	137.1 Å²	137.1	90%	0.897	77%	0.768	S	S	*	*			trans	-131.7	160.7	150.4	-87.1	-72.5	-10	0	0	109.2
487	R	29.8	Very low	32.7	Very low	192 Å²	192	137.5 Å²	137.5	73%	0.725	76%	0.763	S	S	*	*			trans	-151.3	142.4	-149.7	-160	-173	-169.1	165.7	3.4	113.8
488	N	27.9	Very low	32.1	Very low	146 Å²	146	135.1 Å²	135.1	78%	0.781	76%	0.757	S	S	*	*			trans	61.9	177	165.5	-66.7	-5	0	0	0	116.8
489	A	27.6	Very low	32.2	Very low	86 Å²	86	137.4 Å²	137.4	71%	0.711	76%	0.761	S	S	*	*				178.7	140.6	-51.3	0	0	0	0	0	107.8
490	L	27	Very low	32	Very low	173 Å²	173	137.1 Å²	137.1	91%	0.906	77%	0.771	S	S	*	*			trans	-159.5	136.2	166.5	-105.5	172.7	0	0	0	113.1
491	T	35.6	Very low	31.9	Very low	122 Å²	122	133.6 Å²	133.6	75%	0.748	77%	0.771	S	S	*	*			trans	-121.2	-163.2	162.7	53.4	0	0	0	0	106.2
492	P	45.4	Very low	31.7	Very low	101 Å²	101	134.4 Å²	134.4	66%	0.656	78%	0.776	S	S	*	*			cis	-146	-164.8	9	33.3	-5.9	0	0	0	117.3
493	T	27.5	Very low	32	Very low	130 Å²	130	133.6 Å²	133.6	80%	0.798	77%	0.772	S	S	*	*			trans	76	152.3	162.3	74.4	0	0	0	0	118
494	T	27.9	Very low	32.6	Very low	132 Å²	132	132.6 Å²	132.6	81%	0.81	77%	0.773	S	S	*	*			cis	-134.7	166.6	9.3	45	0	0	0	0	112.7
495	I	34.5	Very low	31.9	Very low	156 Å²	156	134.9 Å²	134.9	80%	0.8	78%	0.776	S	S	*	*			trans	-126	164.7	166.3	-24.9	177.3	0	0	0	108
496	P	42.9	Very low	31.8	Very low	106 Å²	106	136.1 Å²	136.1	69%	0.688	78%	0.784	S	S	*	*				-150.3	158.7	90.7	37.9	-19.6	0	0	0	117.3
497	D	27.3	Very low	31.5	Very low	139 Å²	139	130.4 Å²	130.4	74%	0.743	78%	0.776	S	S	*	*			trans	44.3	153	150.2	-57.1	-47.7	0	0	0	122.3
498	G	29.7	Very low	31.4	Very low	63 Å²	63	126.4 Å²	126.4	65%	0.649	77%	0.773	S	S	*	*			cis	128.9	143.2	8.6	0	0	0	0	0	110
499	M	32.8	Very low	31.5	Very low	171 Å²	171	126.7 Å²	126.7	84%	0.842	77%	0.769	S	S	*	*			cis	-132.2	-165.7	0.6	-77.9	80.3	-170	0	0	108.3
500	G	27.2	Very low	31.6	Very low	79 Å²	79	131.2 Å²	131.2	81%	0.814	78%	0.778	S	S	*	*			cis	-167.7	-131.2	15.4	0	0	0	0	0	113.7
501	A	28.1	Very low	32.3	Very low	93 Å²	93	128.4 Å²	128.4	77%	0.769	77%	0.77	S	S	*	*			trans	-129.2	159.3	-161.9	0	0	0	0	0	116.6
502	N	28.6	Very low	32.1	Very low	164 Å²	164	131.6 Å²	131.6	88%	0.877	78%	0.779	S	S	*	*				-170.6	157.9	122.8	-98.7	-24.6	0	0	0	114.5
503	I	33.7	Very low	31.2	Very low	144 Å²	144	131.9 Å²	131.9	74%	0.738	79%	0.789	S	S	*	*			trans	-121.8	162.5	167.3	-23.4	177.9	0	0	0	107.4
504	P	43.4	Very low	31.2	Very low	121 Å²	121	128.7 Å²	128.7	79%	0.786	78%	0.783	S	S	*	*				-137.5	150.6	92.5	31.3	-14.4	0	0	0	113.1
505	M	29.2	Very low	31.2	Very low	166 Å²	166	130 Å²	130	82%	0.818	79%	0.785	S	S	*	*			cis	75.1	93.9	48.9	-122.7	-57.3	175.1	0	0	114.1
506	M	28.8	Very low	31.1	Very low	183 Å²	183	130.3 Å²	130.3	90%	0.901	79%	0.785	S	S	*	*			trans	-155.8	139.3	143	-137	-176.4	-164.9	0	0	110.6
507	G	26.9	Very low	30.5	Very low	71 Å²	71	132.3 Å²	132.3	73%	0.732	79%	0.79	S	S	*	*			trans	-164.2	123.8	172	0	0	0	0	0	109.1
508	T	27.5	Very low	30.5	Very low	109 Å²	109	129 Å²	129	67%	0.669	79%	0.788	S	S	*	*			trans	-139.7	141.3	-176	-38.6	0	0	0	0	110.6
509	H	29.3	Very low	30.5	Very low	152 Å²	152	134.6 Å²	134.6	70%	0.704	80%	0.802	S	S	*	*			trans	-75.4	165.3	175.3	45.8	-96	0	0	0	112.3
510	M	31	Very low	30.4	Very low	181 Å²	181	131.9 Å²	131.9	89%	0.892	80%	0.8	S	S	*	*			trans	-137.3	136.9	153.7	-83.8	-63.6	175.4	0	0	109.5
511	P	40.8	Very low	31.3	Very low	113 Å²	113	133.9 Å²	133.9	73%	0.734	80%	0.799	S	S	*	*			trans	-93.9	171.7	-177.9	37.6	-36	0	0	0	113.5
512	M	31.8	Very low	31.4	Very low	189 Å²	189	135 Å²	135	93%	0.931	80%	0.797	S	S	*	*			trans	-108.4	132.1	166.4	-79.9	-79.9	-166.4	0	0	110.1
513	A	26.5	Very low	31.5	Very low	107 Å²	107	136.5 Å²	136.5	88%	0.884	80%	0.798	S	S	*	*			trans	179.2	154.1	152.4	0	0	0	0	0	112.3
514	G	28.5	Very low	31.2	Very low	64 Å²	64	133.9 Å²	133.9	66%	0.66	80%	0.798	S	S	*	*			trans	99.9	91.9	137.4	0	0	0	0	0	120
515	D	26.9	Very low	30.5	Very low	159 Å²	159	136 Å²	136	85%	0.85	80%	0.802	S	S	*	*				53.7	110.3	122.9	-53.3	-29.6	0	0	0	123.2
516	M	32.2	Very low	31.1	Very low	163 Å²	163	133.6 Å²	133.6	80%	0.803	80%	0.798	S	S	*	*				54	147.2	115.8	-99.5	-64.8	176.8	0	0	124.3
517	N	29.8	Very low	32.2	Very low	148 Å²	148	130 Å²	130	79%	0.791	79%	0.789	S	S	*	*			trans	70.4	102.1	159.8	-68.3	-44.5	0	0	0	120.6
518	G	27.3	Very low	33.1	Very low	69 Å²	69	131.7 Å²	131.7	71%	0.711	79%	0.787	S	S	*	*				120.1	147.7	96.1	0	0	0	0	0	120.4
519	L	30.7	Very low	33.2	Very low	180 Å²	180	134.2 Å²	134.2	94%	0.942	80%	0.795	S	S	*	*			trans	76.8	109.6	156.5	-51.6	-179.7	0	0	0	120.2
520	S	29.7	Very low	33.1	Very low	114 Å²	114	132.8 Å²	132.8	80%	0.797	80%	0.802	S	S	*	*			trans	-89	157.6	153.6	-46.1	0	0	0	0	110.5
521	P	45.7	Very low	33.1	Very low	121 Å²	121	132.1 Å²	132.1	79%	0.786	80%	0.799	S	S	*	*				-148.2	175.1	100.9	26.9	-5.8	0	0	0	113.6
522	T	30.3	Very low	32.9	Very low	118 Å²	118	132 Å²	132	72%	0.724	80%	0.798	S	S	*	*			cis	163.4	124.2	-19.4	-77.2	0	0	0	0	105.9
523	Q	30.4	Very low	32.7	Very low	195 Å²	195	128.1 Å²	128.1	91%	0.911	79%	0.79	S	S	*	*			trans	164.3	145.4	158.1	-97	167.8	76.1	0	0	109.2
524	A	28.5	Very low	32.7	Very low	88 Å²	88	129 Å²	129	73%	0.727	78%	0.784	S	S	*	*			cis	-156.8	169	-12.5	0	0	0	0	0	111.2
525	L	28.8	Very low	32.9	Very low	165 Å²	165	131 Å²	131	86%	0.864	79%	0.788	S	S	*	*			trans	-142.1	176.6	175.2	-84.7	169.4	0	0	0	107.1
526	P	42.3	Very low	33.2	Very low	116 Å²	116	132.1 Å²	132.1	75%	0.753	79%	0.788	S	S	*	*			cis	-134.1	-117.1	17.8	26.7	2.5	0	0	0	116.7
527	P	50.5	Low	33.2	Very low	109 Å²	109	130.2 Å²	130.2	71%	0.708	79%	0.79	S	S	*	*				-127.2	-152.3	-112	46.7	-27.6	0	0	0	113.2
528	P	47.1	Very low	33.3	Very low	105 Å²	105	129.7 Å²	129.7	68%	0.682	79%	0.792	S	S	*	*			cis	-140.9	159.8	-5	37.9	-16.9	0	0	0	120.2
529	L	28.9	Very low	33.8	Very low	162 Å²	162	131.7 Å²	131.7	85%	0.848	79%	0.792	S	S	*	*			trans	57.4	122.3	140.7	-67.5	169.2	0	0	0	123.9
530	S	27.3	Very low	34	Very low	122 Å²	122	128.2 Å²	128.2	85%	0.853	78%	0.78	S	S	*	*				-166.4	161.4	113.8	51	0	0	0	0	112.2
531	M	32	Very low	34.3	Very low	168 Å²	168	128 Å²	128	83%	0.828	78%	0.776	S	S	*	*			trans	-117.3	158.2	-173.8	-81.2	-76.4	-79.7	0	0	109.7
532	P	35.4	Very low	34.1	Very low	109 Å²	109	128.2 Å²	128.2	71%	0.708	78%	0.778	S	S	*	*				-154.9	169.4	51.7	43.4	-22.9	0	0	0	119.9
533	S	26.9	Very low	34.2	Very low	109 Å²	109	132.4 Å²	132.4	76%	0.762	78%	0.782	S	S	*	*			trans	58.3	147.3	148.2	-62.3	0	0	0	0	120.7
534	T	28.3	Very low	34.9	Very low	124 Å²	124	128.6 Å²	128.6	76%	0.761	77%	0.774	S	S	*	*			cis	-130.1	169.5	2	52.6	0	0	0	0	111.3
535	S	31.3	Very low	36.2	Very low	107 Å²	107	128.3 Å²	128.3	75%	0.748	76%	0.763	S	S	*	*			trans	-127.4	127.3	-179.7	56.5	0	0	0	0	113.2
536	H	33.1	Very low	37.9	Very low	183 Å²	183	125.9 Å²	125.9	85%	0.847	75%	0.751	S	S	*	*			trans	-129.4	71.6	171.4	-71.9	-65.8	0	0	0	111.5
537	C	32.3	Very low	39.8	Very low	123 Å²	123	122.2 Å²	122.2	83%	0.831	73%	0.728	S	S	*	*			trans	-117.6	112.1	161.8	-62.4	0	0	0	0	107.8
538	T	32.6	Very low	41.6	Very low	136 Å²	136	118.8 Å²	118.8	83%	0.834	71%	0.707	S	S	*	*	P	Polyproline II helix	trans	-65.3	133.4	167.5	29	0	0	0	0	109.1
539	P	36.6	Very low	43.6	Very low	111 Å²	111	113.9 Å²	113.9	72%	0.721	67%	0.674	S	S	*	*	P	Polyproline II helix	trans	-63.9	152.4	170.7	28.8	-34.2	0	0	0	109.9
540	P	35.6	Very low	46.4	Very low	107 Å²	107	110.1 Å²	110.1	70%	0.695	66%	0.658	S	S	*	*	P	Polyproline II helix	trans	-60.9	150.1	172.7	27.7	-34.6	0	0	0	110.5
541	P	36.9	Very low	49.3	Very low	110 Å²	110	105.6 Å²	105.6	71%	0.714	63%	0.627	S	S	*	*	P	Polyproline II helix	trans	-60.5	149.6	174.2	27.8	-35	0	0	0	110.4	Y543	P541-Y543 PolarHBondContact O-N 3.27Å
542	P	41.2	Very low	52.1	Low	126 Å²	126	98 Å²	98	82%	0.818	59%	0.589	S	S	*	*	P	Polyproline II helix	trans	-60.1	136.9	176.2	26.3	-34	0	0	0	110.2
543	Y	33.1	Very low	54.7	Low	206 Å²	206	92.8 Å²	92.8	81%	0.808	56%	0.555	S	S	*	*	P	Polyproline II helix	trans	-56.7	148.5	172.1	-74.2	-95.3	0	0	0	110.4	P541 T545	P541-Y543 PolarHBondContact O-N 3.27Å; Y543-T545 PolarHBondContact O-N 3.08Å; Y543-T545 VanDerWaalsContact O-N 3.15Å
544	P	43.2	Very low	57.7	Low	114 Å²	114	90.2 Å²	90.2	74%	0.74	54%	0.54	S	S	*	.	P	Polyproline II helix	trans	-56.1	123.4	170.5	25.9	-34	0	0	0	108.8	D546	P544-D546 PolarHBondContact O-N 2.71Å
545	T	57.6	Low	60.5	Low	83 Å²	83	90.4 Å²	90.4	51%	0.509	53%	0.527	S	S	.	.			trans	-74.3	110.4	-179.2	51.9	0	0	0	0	109.5	Y543 C547	Y543-T545 PolarHBondContact O-N 3.08Å; Y543-T545 VanDerWaalsContact O-N 3.15Å; T545-C547 PolarHBondContact O-N 2.83Å; T545-C547 VanDerWaalsContact O-N 3.17Å
546	D	64.8	Low	63.1	Low	114 Å²	114	88 Å²	88	61%	0.61	51%	0.506	S	S	*	.			trans	-51	122.9	176.1	-65	-54	0	0	0	110.9	P544 S548 S551	P544-D546 PolarHBondContact O-N 2.71Å; D546-S548 PolarHBondContact O-N 2.95Å; D546-S548 VanDerWaalsContact O-N 3.17Å; D546-S551 WeakPolarHBondContact CB-OG 3.48Å; D546-S551 PolarHBondContact O-OG 3.33Å
547	C	80.6	Confident	65.7	Low	38 Å²	38	82.2 Å²	82.2	26%	0.257	50%	0.495	S	S	.	.			trans	-80.6	15.8	-177.5	-61.6	0	0	0	0	113.6	T545 T572 I573 Y574	T545-C547 PolarHBondContact O-N 2.83Å; T545-C547 VanDerWaalsContact O-N 3.17Å; C547-T572 CarbonylContact O-C 3.47Å; C547-T572 WeakPolarHBondContact O-CA 3.32Å; C547-I573 HydrophobicContact CB-CG2 3.98Å; C547-I573 PolarHBondContact O-N 3.47Å; C547-Y574 HydrophobicContact CB-CD2 4.46Å; C547-Y574 HydrophobicContact CB-CE2 3.73Å; C547-Y574 PolarHBondContact SG-OH 2.96Å; C547-Y574 VanDerWaalsContact SG-OH 3.36Å
548	S	89	Confident	68.4	Low	38 Å²	38	76.6 Å²	76.6	27%	0.266	46%	0.457	S	S	.	.	B	Isolated β-bridge	trans	-73.3	152.9	174.8	84.9	0	0	0	0	111.4	D546 V550 S551 F552 T571	D546-S548 PolarHBondContact O-N 2.95Å; D546-S548 VanDerWaalsContact O-N 3.17Å; S548-V550 PolarHBondContact O-N 2.95Å; S548-V550 PolarHBondContact OG-N 3.42Å; S548-S551 PolarHBondContact N-OG 3.41Å; S548-S551 PolarHBondContact O-OG 3.23Å; S548-S551 VanDerWaalsContact O-OG 3.05Å; S548-S551 PolarHBondContact OG-N 3.5Å; S548-S551 PolarHBondContact OG-OG 3.12Å; S548-F552 WeakPolarHBondContact O-CB 3.41Å; S548-F552 PolarHBondContact O-N 2.98Å; S548-T571 WeakPolarHBondContact CA-O 3.43Å
549	I	89.4	Confident	71	Confident	1 Å²	1	73.3 Å²	73.3	1%	0.005	44%	0.44	C	S	.	.	H	α-helix	trans	-66.2	-28.5	172.7	-70.4	179.1	0	0	0	111	F552 L553 L562 F565 L570 T571 I576	I549-F552 PolarHBondContact O-N 3.5Å; I549-L553 HydrophobicContact CG2-CD1 3.6Å; I549-L553 HydrophobicContact CG2-CG 3.92Å; I549-L553 WeakPolarHBondContact O-CB 3.46Å; I549-L553 VanDerWaalsContact O-CG 3.3Å; I549-L553 WeakPolarHBondContact O-CG 3.33Å; I549-L553 PolarHBondContact O-N 3.09Å; I549-L562 HydrophobicContact CG2-CD1 4.02Å; I549-F565 HydrophobicContact CD1-CB 4.05Å; I549-F565 HydrophobicContact CD1-CD1 3.99Å; I549-F565 HydrophobicContact CD1-CG 4.17Å; I549-F565 HydrophobicContact CG2-CB 3.94Å; I549-F565 HydrophobicContact CG2-CD1 4.5Å; I549-F565 HydrophobicContact CG2-CD2 3.97Å; I549-F565 HydrophobicContact CG2-CG 3.88Å; I549-L570 HydrophobicContact CD1-CB 3.82Å; I549-T571 PolarHBondContact N-O 3.44Å; I549-I576 HydrophobicContact CD1-CD1 3.96Å; I549-I576 HydrophobicContact CD1-CG1 4.36Å; I549-I576 HydrophobicContact CD1-CG2 4.21Å; I549-I576 HydrophobicContact CG1-CD1 4.13Å
550	V	88.1	Confident	73.5	Confident	84 Å²	84	71.8 Å²	71.8	51%	0.509	43%	0.432	S	S	.	.	H	α-helix	trans	-61.5	-54.8	176.2	-171.2	0	0	0	0	111.2	S548 F552 A554 L562	S548-V550 PolarHBondContact O-N 2.95Å; S548-V550 PolarHBondContact OG-N 3.42Å; V550-F552 VanDerWaalsContact C-N 3.31Å; V550-F552 PolarHBondContact O-N 2.97Å; V550-A554 VanDerWaalsContact O-CB 3.25Å; V550-A554 WeakPolarHBondContact O-CB 3.25Å; V550-A554 PolarHBondContact O-N 3.41Å; V550-L562 HydrophobicContact CG1-CD2 4.37Å; V550-L562 HydrophobicContact CG2-CD1 3.84Å; V550-L562 HydrophobicContact CG2-CD2 3.97Å
551	S	88.1	Confident	76	Confident	27 Å²	27	66.7 Å²	66.7	19%	0.189	40%	0.399	C	S	.	.	H	α-helix	trans	-70.4	-24.2	178.8	50.5	0	0	0	0	113.3	D546 S548 R555	D546-S551 WeakPolarHBondContact CB-OG 3.48Å; D546-S551 PolarHBondContact O-OG 3.33Å; S548-S551 PolarHBondContact N-OG 3.41Å; S548-S551 PolarHBondContact O-OG 3.23Å; S548-S551 VanDerWaalsContact O-OG 3.05Å; S548-S551 PolarHBondContact OG-N 3.5Å; S548-S551 PolarHBondContact OG-OG 3.12Å; S551-R555 WeakPolarHBondContact O-CG 3.3Å; S551-R555 PolarHBondContact O-N 3.03Å; S551-R555 PolarHBondContact O-NE 2.66Å
552	F	90.3	Very high	78.5	Confident	7 Å²	7	63.4 Å²	63.4	3%	0.031	38%	0.375	C	S	.	.	H	α-helix	trans	-71.6	-55.5	170.3	173.4	-120.3	0	0	0	111.8	S548 I549 V550 A554 R555 L556 I573 I576 I597 I601	S548-F552 WeakPolarHBondContact O-CB 3.41Å; S548-F552 PolarHBondContact O-N 2.98Å; I549-F552 PolarHBondContact O-N 3.5Å; V550-F552 VanDerWaalsContact C-N 3.31Å; V550-F552 PolarHBondContact O-N 2.97Å; F552-A554 VanDerWaalsContact C-N 3.29Å; F552-A554 PolarHBondContact O-N 2.7Å; F552-R555 WeakPolarHBondContact O-CB 3.41Å; F552-R555 PolarHBondContact O-N 2.9Å; F552-R555 VanDerWaalsContact O-N 3.12Å; F552-L556 HydrophobicContact CD2-CD1 4.27Å; F552-L556 HydrophobicContact CE1-CD1 3.93Å; F552-L556 HydrophobicContact CE2-CD1 3.67Å; F552-L556 HydrophobicContact CE2-CG 4.24Å; F552-L556 HydrophobicContact CZ-CD1 3.47Å; F552-L556 VanDerWaalsContact CZ-CD1 3.47Å; F552-L556 HydrophobicContact CZ-CG 4.49Å; F552-L556 PolarHBondContact O-N 3.35Å; F552-I573 HydrophobicContact CB-CD1 4.23Å; F552-I573 HydrophobicContact CD1-CD1 4.13Å; F552-I573 HydrophobicContact CD1-CG1 4.36Å; F552-I573 HydrophobicContact CD2-CD1 3.38Å; F552-I573 HydrophobicContact CD2-CG1 4.42Å; F552-I573 HydrophobicContact CE1-CD1 4.33Å; F552-I573 HydrophobicContact CE2-CD1 3.61Å; F552-I573 HydrophobicContact CG-CD1 3.66Å; F552-I573 HydrophobicContact CG-CG1 4.29Å; F552-I573 HydrophobicContact CZ-CD1 4.08Å; F552-I576 HydrophobicContact CD1-CD1 4.26Å; F552-I576 HydrophobicContact CE1-CD1 4.04Å; F552-I597 HydrophobicContact CE1-CG2 4.33Å; F552-I601 HydrophobicContact CE1-CG1 4.08Å; F552-I601 HydrophobicContact CZ-CG1 3.84Å
553	L	90.1	Very high	80.7	Confident	0 Å²	0	62.6 Å²	62.6	0%	0	36%	0.364	C	S	.	.	H	α-helix	trans	-63.1	-35.5	180	-68.6	176.7	0	0	0	112.2	I549 R555 L556 G557 C558 C561 L562 F565 I597	I549-L553 HydrophobicContact CG2-CD1 3.6Å; I549-L553 HydrophobicContact CG2-CG 3.92Å; I549-L553 WeakPolarHBondContact O-CB 3.46Å; I549-L553 VanDerWaalsContact O-CG 3.3Å; I549-L553 WeakPolarHBondContact O-CG 3.33Å; I549-L553 PolarHBondContact O-N 3.09Å; L553-R555 PolarHBondContact O-N 3.41Å; L553-L556 CarbonylContact O-C 3.53Å; L553-L556 PolarHBondContact O-N 3.45Å; L553-L556 VanDerWaalsContact O-N 3.15Å; L553-G557 PolarHBondContact O-N 2.99Å; L553-G557 VanDerWaalsContact O-N 3.09Å; L553-C558 HydrophobicContact CB-CB 4.49Å; L553-C558 HydrophobicContact CD2-CB 3.92Å; L553-C558 PolarHBondContact O-N 2.93Å; L553-C561 HydrophobicContact CD1-CB 4.41Å; L553-L562 HydrophobicContact CD1-CB 4.11Å; L553-L562 HydrophobicContact CD1-CD1 4.26Å; L553-F565 HydrophobicContact CD1-CD2 3.84Å; L553-F565 HydrophobicContact CD1-CE2 3.96Å; L553-F565 HydrophobicContact CD2-CE2 4.12Å; L553-I597 HydrophobicContact CD2-CD1 3.77Å; L553-I597 HydrophobicContact CD2-CG1 3.79Å
554	A	88.7	Confident	83.4	Confident	55 Å²	55	56.9 Å²	56.9	46%	0.455	34%	0.341	S	S	.	.	H	α-helix	trans	-60.6	-42.1	173.4	0	0	0	0	0	112.6	V550 F552 L556 G557 S559	V550-A554 VanDerWaalsContact O-CB 3.25Å; V550-A554 WeakPolarHBondContact O-CB 3.25Å; V550-A554 PolarHBondContact O-N 3.41Å; F552-A554 VanDerWaalsContact C-N 3.29Å; F552-A554 PolarHBondContact O-N 2.7Å; A554-L556 PolarHBondContact O-N 3.46Å; A554-G557 PolarHBondContact O-N 3.49Å; A554-S559 WeakPolarHBondContact CA-OG 3.5Å
555	R	87.3	Confident	85.7	Confident	129 Å²	129	51.4 Å²	51.4	49%	0.487	31%	0.306	S	S	.	.	H	α-helix	trans	-65.1	-27.1	174.9	-77.3	-179.6	-71.4	162.9	-6.2	113.2	S551 F552 L553	S551-R555 WeakPolarHBondContact O-CG 3.3Å; S551-R555 PolarHBondContact O-N 3.03Å; S551-R555 PolarHBondContact O-NE 2.66Å; F552-R555 WeakPolarHBondContact O-CB 3.41Å; F552-R555 PolarHBondContact O-N 2.9Å; F552-R555 VanDerWaalsContact O-N 3.12Å; L553-R555 PolarHBondContact O-N 3.41Å
556	L	87.4	Confident	87.1	Confident	57 Å²	57	50.4 Å²	50.4	30%	0.298	30%	0.3	S	S	.	.	T	Hydrogen-bonded Turn	trans	-91.1	0.8	176.4	-61.2	-178.6	0	0	0	113.9	F552 L553 A554 C558 I597	F552-L556 HydrophobicContact CD2-CD1 4.27Å; F552-L556 HydrophobicContact CE1-CD1 3.93Å; F552-L556 HydrophobicContact CE2-CD1 3.67Å; F552-L556 HydrophobicContact CE2-CG 4.24Å; F552-L556 HydrophobicContact CZ-CD1 3.47Å; F552-L556 VanDerWaalsContact CZ-CD1 3.47Å; F552-L556 HydrophobicContact CZ-CG 4.49Å; F552-L556 PolarHBondContact O-N 3.35Å; L553-L556 CarbonylContact O-C 3.53Å; L553-L556 PolarHBondContact O-N 3.45Å; L553-L556 VanDerWaalsContact O-N 3.15Å; A554-L556 PolarHBondContact O-N 3.46Å; L556-C558 HydrophobicContact CB-CB 4.23Å; L556-C558 PolarHBondContact O-N 3.1Å; L556-C558 PolarHBondContact O-SG 3.01Å; L556-I597 HydrophobicContact CD1-CG1 4.42Å
557	G	86.8	Confident	88.1	Confident	61 Å²	61	50.2 Å²	50.2	63%	0.629	30%	0.303	S	S	*	.	T	Hydrogen-bonded Turn	trans	65	13.1	-172	0	0	0	0	0	114.3	L553 A554	L553-G557 PolarHBondContact O-N 2.99Å; L553-G557 VanDerWaalsContact O-N 3.09Å; A554-G557 PolarHBondContact O-N 3.49Å
558	C	88.3	Confident	88.2	Confident	4 Å²	4	54.5 Å²	54.5	3%	0.027	32%	0.319	C	S	.	.			trans	-101.8	24	-173	-65.2	0	0	0	0	112.8	L553 L556 S560 C561 F593 I597	L553-C558 HydrophobicContact CB-CB 4.49Å; L553-C558 HydrophobicContact CD2-CB 3.92Å; L553-C558 PolarHBondContact O-N 2.93Å; L556-C558 HydrophobicContact CB-CB 4.23Å; L556-C558 PolarHBondContact O-N 3.1Å; L556-C558 PolarHBondContact O-SG 3.01Å; C558-S560 PolarHBondContact O-N 3.31Å; C558-S560 VanDerWaalsContact O-N 3.1Å; C558-C561 WeakPolarHBondContact O-CB 3.36Å; C558-C561 PolarHBondContact O-N 3.14Å; C558-F593 HydrophobicContact CB-CD1 4.47Å; C558-I597 HydrophobicContact CB-CD1 4.21Å; C558-I597 HydrophobicContact CB-CG1 4.1Å
559	S	88.7	Confident	87.8	Confident	67 Å²	67	54.9 Å²	54.9	47%	0.469	33%	0.329	S	S	.	.	G	3₁₀ helix	trans	-56.1	-29.3	-175.1	-50.9	0	0	0	0	114	A554 C561 L562	A554-S559 WeakPolarHBondContact CA-OG 3.5Å; S559-C561 PolarHBondContact O-N 3.15Å; S559-C561 VanDerWaalsContact O-N 3.14Å; S559-L562 WeakPolarHBondContact O-CB 3.3Å; S559-L562 PolarHBondContact O-N 3.29Å; S559-L562 VanDerWaalsContact O-N 3.15Å
560	S	88.8	Confident	87.8	Confident	79 Å²	79	55.6 Å²	55.6	55%	0.552	33%	0.333	S	S	*	.	G	3₁₀ helix	trans	-64.3	-9.2	173.5	52.4	0	0	0	0	114.4	C558	C558-S560 PolarHBondContact O-N 3.31Å; C558-S560 VanDerWaalsContact O-N 3.1Å
561	C	87.8	Confident	87.7	Confident	1 Å²	1	55.3 Å²	55.3	1%	0.007	33%	0.331	C	S	.	.	G	3₁₀ helix	trans	-94.5	-0.9	175.3	-63.4	0	0	0	0	113.8	L553 C558 S559 D563 Y564 F565 F593 I597	L553-C561 HydrophobicContact CD1-CB 4.41Å; C558-C561 WeakPolarHBondContact O-CB 3.36Å; C558-C561 PolarHBondContact O-N 3.14Å; S559-C561 PolarHBondContact O-N 3.15Å; S559-C561 VanDerWaalsContact O-N 3.14Å; C561-D563 VanDerWaalsContact C-N 3.31Å; C561-D563 PolarHBondContact O-N 3.49Å; C561-Y564 HydrophobicContact CB-CD2 4.31Å; C561-Y564 WeakPolarHBondContact O-CD2 3.36Å; C561-Y564 PolarHBondContact O-N 3.24Å; C561-F565 HydrophobicContact CB-CE2 4.44Å; C561-F565 VanDerWaalsContact O-CD2 3.3Å; C561-F565 WeakPolarHBondContact O-CD2 3.34Å; C561-F593 VanDerWaalsContact SG-CB 3.55Å; C561-F593 WeakPolarHBondContact SG-CD2 3.36Å; C561-F593 VanDerWaalsContact SG-CG 3.5Å; C561-I597 HydrophobicContact CB-CD1 4Å
562	L	89.5	Confident	87.7	Confident	40 Å²	40	56.5 Å²	56.5	21%	0.209	34%	0.337	C	S	.	.	H	α-helix	trans	-56.8	-42.3	-173.7	179.2	60.4	0	0	0	113	I549 V550 L553 S559 Y564 F565 T566	I549-L562 HydrophobicContact CG2-CD1 4.02Å; V550-L562 HydrophobicContact CG1-CD2 4.37Å; V550-L562 HydrophobicContact CG2-CD1 3.84Å; V550-L562 HydrophobicContact CG2-CD2 3.97Å; L553-L562 HydrophobicContact CD1-CB 4.11Å; L553-L562 HydrophobicContact CD1-CD1 4.26Å; S559-L562 WeakPolarHBondContact O-CB 3.3Å; S559-L562 PolarHBondContact O-N 3.29Å; S559-L562 VanDerWaalsContact O-N 3.15Å; L562-Y564 VanDerWaalsContact C-N 3.26Å; L562-Y564 PolarHBondContact O-N 3.39Å; L562-F565 WeakPolarHBondContact O-CB 3.35Å; L562-F565 PolarHBondContact O-N 3.39Å; L562-T566 HydrophobicContact CD1-CG2 3.77Å; L562-T566 HydrophobicContact CG-CG2 3.97Å; L562-T566 PolarHBondContact O-N 3.05Å; L562-T566 PolarHBondContact O-OG1 3.01Å
563	D	87.6	Confident	87.6	Confident	109 Å²	109	56.2 Å²	56.2	58%	0.583	34%	0.336	S	S	*	.	H	α-helix	trans	-64.1	-28.5	-174.1	-60.1	-33.6	0	0	0	113.4	C561 F565 T566 T567	C561-D563 VanDerWaalsContact C-N 3.31Å; C561-D563 PolarHBondContact O-N 3.49Å; D563-F565 VanDerWaalsContact C-N 3.25Å; D563-F565 PolarHBondContact O-N 2.96Å; D563-T566 WeakPolarHBondContact CA-OG1 3.33Å; D563-T566 PolarHBondContact O-OG1 3.35Å; D563-T567 WeakPolarHBondContact O-CB 3.44Å; D563-T567 PolarHBondContact O-N 3.45Å; D563-T567 PolarHBondContact O-OG1 2.98Å
564	Y	89.8	Confident	87.4	Confident	86 Å²	86	61.4 Å²	61.4	34%	0.337	36%	0.357	S	S	.	.	H	α-helix	trans	-67.2	-27	175.4	-60.1	-80.6	0	0	0	112.6	C561 L562 L587 K588 I589	C561-Y564 HydrophobicContact CB-CD2 4.31Å; C561-Y564 WeakPolarHBondContact O-CD2 3.36Å; C561-Y564 PolarHBondContact O-N 3.24Å; L562-Y564 VanDerWaalsContact C-N 3.26Å; L562-Y564 PolarHBondContact O-N 3.39Å; Y564-L587 WeakPolarHBondContact CD1-O 3.38Å; Y564-K588 HydrophobicContact CD1-CB 4.34Å; Y564-K588 HydrophobicContact CE1-CB 4.27Å; Y564-K588 WeakPolarHBondContact CE1-O 3.43Å; Y564-I589 HydrophobicContact CD2-CG1 4.26Å; Y564-I589 HydrophobicContact CG-CG1 4.03Å
565	F	90.4	Very high	87.2	Confident	0 Å²	0	62.9 Å²	62.9	0%	0	35%	0.354	C	S	.	.	H	α-helix	trans	-86.6	-49.8	175.9	-65.3	-82.4	0	0	0	111.3	I549 L553 C561 L562 D563 T567 Q568 G569 L570 I576 L584 L587 I589 I597	I549-F565 HydrophobicContact CD1-CB 4.05Å; I549-F565 HydrophobicContact CD1-CD1 3.99Å; I549-F565 HydrophobicContact CD1-CG 4.17Å; I549-F565 HydrophobicContact CG2-CB 3.94Å; I549-F565 HydrophobicContact CG2-CD1 4.5Å; I549-F565 HydrophobicContact CG2-CD2 3.97Å; I549-F565 HydrophobicContact CG2-CG 3.88Å; L553-F565 HydrophobicContact CD1-CD2 3.84Å; L553-F565 HydrophobicContact CD1-CE2 3.96Å; L553-F565 HydrophobicContact CD2-CE2 4.12Å; C561-F565 HydrophobicContact CB-CE2 4.44Å; C561-F565 VanDerWaalsContact O-CD2 3.3Å; C561-F565 WeakPolarHBondContact O-CD2 3.34Å; L562-F565 WeakPolarHBondContact O-CB 3.35Å; L562-F565 PolarHBondContact O-N 3.39Å; D563-F565 VanDerWaalsContact C-N 3.25Å; D563-F565 PolarHBondContact O-N 2.96Å; F565-T567 VanDerWaalsContact C-N 3.3Å; F565-T567 PolarHBondContact O-N 3.02Å; F565-Q568 CarbonylContact O-C 3.59Å; F565-Q568 PolarHBondContact O-N 3.36Å; F565-G569 PolarHBondContact O-N 2.99Å; F565-L570 CarbonylContact C-O 3.5Å; F565-L570 HydrophobicContact CB-CB 4Å; F565-L570 HydrophobicContact CD1-CB 4.32Å; F565-L570 HydrophobicContact CD1-CD1 3.95Å; F565-L570 WeakPolarHBondContact O-CB 3.44Å; F565-L570 PolarHBondContact O-N 2.87Å; F565-I576 HydrophobicContact CD1-CD1 4.38Å; F565-I576 HydrophobicContact CD1-CG2 4.02Å; F565-I576 HydrophobicContact CE1-CD1 3.92Å; F565-I576 HydrophobicContact CE1-CG2 3.99Å; F565-I576 HydrophobicContact CZ-CD1 4.49Å; F565-L584 HydrophobicContact CE1-CD2 4.15Å; F565-L584 HydrophobicContact CZ-CD2 4.02Å; F565-L587 HydrophobicContact CD1-CD1 3.78Å; F565-L587 HydrophobicContact CE1-CD1 3.53Å; F565-L587 HydrophobicContact CZ-CD1 4.19Å; F565-I589 HydrophobicContact CE1-CD1 4.15Å; F565-I589 HydrophobicContact CE2-CD1 3.69Å; F565-I589 HydrophobicContact CZ-CD1 3.4Å; F565-I597 HydrophobicContact CE2-CD1 4.32Å; F565-I597 HydrophobicContact CZ-CD1 4.46Å; F565-I597 HydrophobicContact CZ-CG2 4.08Å
566	T	86.9	Confident	87.2	Confident	62 Å²	62	56.8 Å²	56.8	38%	0.38	33%	0.331	S	S	.	.	H	α-helix	trans	-65.5	-32.3	-176.2	56.6	0	0	0	0	112.5	L562 D563 Q568 G569	L562-T566 HydrophobicContact CD1-CG2 3.77Å; L562-T566 HydrophobicContact CG-CG2 3.97Å; L562-T566 PolarHBondContact O-N 3.05Å; L562-T566 PolarHBondContact O-OG1 3.01Å; D563-T566 WeakPolarHBondContact CA-OG1 3.33Å; D563-T566 PolarHBondContact O-OG1 3.35Å; T566-Q568 PolarHBondContact O-N 3.43Å; T566-G569 PolarHBondContact O-N 3.07Å
567	T	86.6	Confident	87	Confident	109 Å²	109	56.1 Å²	56.1	67%	0.669	33%	0.326	S	S	*	.	T	Hydrogen-bonded Turn	trans	-60.9	-25.1	172.6	-59.2	0	0	0	0	112.8	D563 F565	D563-T567 WeakPolarHBondContact O-CB 3.44Å; D563-T567 PolarHBondContact O-N 3.45Å; D563-T567 PolarHBondContact O-OG1 2.98Å; F565-T567 VanDerWaalsContact C-N 3.3Å; F565-T567 PolarHBondContact O-N 3.02Å
568	Q	82.2	Confident	86.9	Confident	128 Å²	128	60.2 Å²	60.2	60%	0.598	33%	0.329	S	S	*	.	T	Hydrogen-bonded Turn	trans	-98.9	11.6	175.4	-57.9	-62.4	-17.6	0	0	112.8	F565 T566 L570 L587	F565-Q568 CarbonylContact O-C 3.59Å; F565-Q568 PolarHBondContact O-N 3.36Å; T566-Q568 PolarHBondContact O-N 3.43Å; Q568-L570 HydrophobicContact CB-CD1 4.1Å; Q568-L570 HydrophobicContact CB-CG 4.08Å; Q568-L570 PolarHBondContact O-N 3.04Å; Q568-L587 HydrophobicContact CB-CD2 4.49Å; Q568-L587 HydrophobicContact CG-CD2 3.76Å
569	G	81.6	Confident	86.8	Confident	46 Å²	46	63 Å²	63	47%	0.474	34%	0.34	S	S	.	.	T	Hydrogen-bonded Turn	trans	71.5	4.4	-175.8	0	0	0	0	0	114.9	F565 T566 T571	F565-G569 PolarHBondContact O-N 2.99Å; T566-G569 PolarHBondContact O-N 3.07Å; G569-T571 PolarHBondContact O-N 3.05Å
570	L	88.2	Confident	86.8	Confident	16 Å²	16	61.8 Å²	61.8	8%	0.084	33%	0.331	C	S	.	.			trans	-74.6	118.5	177.9	-55.4	169.3	0	0	0	108.4	I549 F565 Q568 Q575 I576 Y579 L587	I549-L570 HydrophobicContact CD1-CB 3.82Å; F565-L570 CarbonylContact C-O 3.5Å; F565-L570 HydrophobicContact CB-CB 4Å; F565-L570 HydrophobicContact CD1-CB 4.32Å; F565-L570 HydrophobicContact CD1-CD1 3.95Å; F565-L570 WeakPolarHBondContact O-CB 3.44Å; F565-L570 PolarHBondContact O-N 2.87Å; Q568-L570 HydrophobicContact CB-CD1 4.1Å; Q568-L570 HydrophobicContact CB-CG 4.08Å; Q568-L570 PolarHBondContact O-N 3.04Å; L570-Q575 HydrophobicContact CD2-CB 3.86Å; L570-I576 HydrophobicContact CD1-CG2 3.98Å; L570-I576 HydrophobicContact CD2-CG2 4.38Å; L570-Y579 HydrophobicContact CD1-CE2 4.22Å; L570-L587 HydrophobicContact CD1-CD1 4.22Å; L570-L587 HydrophobicContact CD1-CD2 4.23Å
571	T	86.2	Confident	86.7	Confident	78 Å²	78	61 Å²	61	48%	0.479	32%	0.319	S	S	.	.			trans	-131.9	-19.9	-172	46	0	0	0	0	113.3	S548 I549 G569 Q575	S548-T571 WeakPolarHBondContact CA-O 3.43Å; I549-T571 PolarHBondContact N-O 3.44Å; G569-T571 PolarHBondContact O-N 3.05Å; T571-Q575 PolarHBondContact OG1-OE1 2.64Å
572	T	88.3	Confident	86.7	Confident	52 Å²	52	67.1 Å²	67.1	32%	0.319	35%	0.352	S	S	.	.	B	Isolated β-bridge	trans	-126.8	147.2	-178.7	61.9	0	0	0	0	111.7	C547 Y574 Q575	C547-T572 CarbonylContact O-C 3.47Å; C547-T572 WeakPolarHBondContact O-CA 3.32Å; T572-Y574 PolarHBondContact O-N 3.17Å; T572-Q575 WeakPolarHBondContact O-CB 3.34Å; T572-Q575 PolarHBondContact O-N 3.17Å; T572-Q575 VanDerWaalsContact O-N 3.11Å; T572-Q575 PolarHBondContact O-OE1 3.23Å; T572-Q575 VanDerWaalsContact OG1-CD 3.3Å; T572-Q575 WeakPolarHBondContact OG1-CG 3.21Å; T572-Q575 PolarHBondContact OG1-OE1 3.43Å
573	I	88.3	Confident	86.6	Confident	1 Å²	1	68.3 Å²	68.3	1%	0.005	36%	0.358	C	S	.	.	G	3₁₀ helix	trans	-62.3	-30.4	-174.8	-164.5	169.8	0	0	0	113.1	C547 F552 Q575 I576 E577 H604	C547-I573 HydrophobicContact CB-CG2 3.98Å; C547-I573 PolarHBondContact O-N 3.47Å; F552-I573 HydrophobicContact CB-CD1 4.23Å; F552-I573 HydrophobicContact CD1-CD1 4.13Å; F552-I573 HydrophobicContact CD1-CG1 4.36Å; F552-I573 HydrophobicContact CD2-CD1 3.38Å; F552-I573 HydrophobicContact CD2-CG1 4.42Å; F552-I573 HydrophobicContact CE1-CD1 4.33Å; F552-I573 HydrophobicContact CE2-CD1 3.61Å; F552-I573 HydrophobicContact CG-CD1 3.66Å; F552-I573 HydrophobicContact CG-CG1 4.29Å; F552-I573 HydrophobicContact CZ-CD1 4.08Å; I573-Q575 PolarHBondContact O-N 3.36Å; I573-I576 HydrophobicContact CG1-CG1 4.33Å; I573-I576 CarbonylContact O-C 3.54Å; I573-I576 WeakPolarHBondContact O-CG1 3.18Å; I573-I576 PolarHBondContact O-N 3.15Å; I573-E577 PolarHBondContact O-N 3.18Å; I573-E577 VanDerWaalsContact O-N 3.11Å; I573-H604 HydrophobicContact CD1-CB 3.99Å
574	Y	85.6	Confident	86.7	Confident	109 Å²	109	63.1 Å²	63.1	43%	0.427	33%	0.331	S	S	.	.	G	3₁₀ helix	trans	-60.8	-30.4	176.7	-56.3	-64.3	0	0	0	112.8	C547 T572 I576 E577	C547-Y574 HydrophobicContact CB-CD2 4.46Å; C547-Y574 HydrophobicContact CB-CE2 3.73Å; C547-Y574 PolarHBondContact SG-OH 2.96Å; C547-Y574 VanDerWaalsContact SG-OH 3.36Å; T572-Y574 PolarHBondContact O-N 3.17Å; Y574-I576 PolarHBondContact O-N 2.86Å; Y574-E577 PolarHBondContact O-N 3.5Å
575	Q	85.5	Confident	86.6	Confident	87 Å²	87	60.5 Å²	60.5	41%	0.407	33%	0.327	S	S	.	.	G	3₁₀ helix	trans	-70.7	-16.9	176.9	-65.1	164.9	-50.4	0	0	112.9	L570 T571 T572 I573 Y579	L570-Q575 HydrophobicContact CD2-CB 3.86Å; T571-Q575 PolarHBondContact OG1-OE1 2.64Å; T572-Q575 WeakPolarHBondContact O-CB 3.34Å; T572-Q575 PolarHBondContact O-N 3.17Å; T572-Q575 VanDerWaalsContact O-N 3.11Å; T572-Q575 PolarHBondContact O-OE1 3.23Å; T572-Q575 VanDerWaalsContact OG1-CD 3.3Å; T572-Q575 WeakPolarHBondContact OG1-CG 3.21Å; T572-Q575 PolarHBondContact OG1-OE1 3.43Å; I573-Q575 PolarHBondContact O-N 3.36Å; Q575-Y579 VanDerWaalsContact O-CE1 3.28Å; Q575-Y579 WeakPolarHBondContact O-CE1 3.5Å
576	I	86.8	Confident	86.5	Confident	0 Å²	0	64.7 Å²	64.7	0%	0	36%	0.356	C	S	.	.	G	3₁₀ helix	trans	-115.9	6.8	178.9	61.9	172.8	0	0	0	113.3	I549 F552 F565 L570 I573 Y574 H578 Y579 I601	I549-I576 HydrophobicContact CD1-CD1 3.96Å; I549-I576 HydrophobicContact CD1-CG1 4.36Å; I549-I576 HydrophobicContact CD1-CG2 4.21Å; I549-I576 HydrophobicContact CG1-CD1 4.13Å; F552-I576 HydrophobicContact CD1-CD1 4.26Å; F552-I576 HydrophobicContact CE1-CD1 4.04Å; F565-I576 HydrophobicContact CD1-CD1 4.38Å; F565-I576 HydrophobicContact CD1-CG2 4.02Å; F565-I576 HydrophobicContact CE1-CD1 3.92Å; F565-I576 HydrophobicContact CE1-CG2 3.99Å; F565-I576 HydrophobicContact CZ-CD1 4.49Å; L570-I576 HydrophobicContact CD1-CG2 3.98Å; L570-I576 HydrophobicContact CD2-CG2 4.38Å; I573-I576 HydrophobicContact CG1-CG1 4.33Å; I573-I576 CarbonylContact O-C 3.54Å; I573-I576 WeakPolarHBondContact O-CG1 3.18Å; I573-I576 PolarHBondContact O-N 3.15Å; Y574-I576 PolarHBondContact O-N 2.86Å; I576-H578 PolarHBondContact O-N 3.24Å; I576-H578 VanDerWaalsContact O-N 3.08Å; I576-Y579 HydrophobicContact CB-CD1 4.08Å; I576-Y579 HydrophobicContact CB-CE1 4.45Å; I576-Y579 HydrophobicContact CB-CG 4.12Å; I576-Y579 HydrophobicContact CG2-CD1 4.21Å; I576-Y579 HydrophobicContact CG2-CD2 4.31Å; I576-Y579 HydrophobicContact CG2-CE1 4.13Å; I576-Y579 HydrophobicContact CG2-CE2 4.25Å; I576-Y579 HydrophobicContact CG2-CG 4.29Å; I576-Y579 WeakPolarHBondContact O-CB 3.28Å; I576-Y579 PolarHBondContact O-N 3.01Å; I576-I601 HydrophobicContact CB-CD1 4.41Å; I576-I601 HydrophobicContact CD1-CD1 4.11Å; I576-I601 HydrophobicContact CD1-CG1 4.3Å; I576-I601 HydrophobicContact CG1-CD1 4.3Å; I576-I601 HydrophobicContact CG1-CG1 4.45Å; I576-I601 WeakPolarHBondContact O-CG2 3.5Å
577	E	83.6	Confident	86.4	Confident	43 Å²	43	62.5 Å²	62.5	20%	0.201	34%	0.342	C	S	.	.	T	Hydrogen-bonded Turn	trans	-62.3	-20.2	-175.3	-174.7	165.1	-166.3	0	0	114	I573 Y574 R605	I573-E577 PolarHBondContact O-N 3.18Å; I573-E577 VanDerWaalsContact O-N 3.11Å; Y574-E577 PolarHBondContact O-N 3.5Å; E577-R605 HydrophobicContact CG-CG 3.72Å; E577-R605 WeakPolarHBondContact O-CD 3.33Å; E577-R605 PolarHBondContact O-NH1 3.33Å
578	H	83.4	Confident	86.5	Confident	148 Å²	148	65.3 Å²	65.3	69%	0.685	35%	0.345	S	S	*	.	T	Hydrogen-bonded Turn	trans	-111.5	9.2	178.3	-60.7	-18.7	0	0	0	113.7	I576 S580 R605	I576-H578 PolarHBondContact O-N 3.24Å; I576-H578 VanDerWaalsContact O-N 3.08Å; H578-S580 PolarHBondContact O-N 3.11Å; H578-R605 PolarHBondContact ND1-NH1 3.44Å
579	Y	88	Confident	86.9	Confident	63 Å²	63	59.2 Å²	59.2	25%	0.247	32%	0.316	C	S	.	.			trans	-70.9	128.1	-179	-84.4	44.9	0	0	0	111.5	L570 Q575 I576 D583 L584 L587	L570-Y579 HydrophobicContact CD1-CE2 4.22Å; Q575-Y579 VanDerWaalsContact O-CE1 3.28Å; Q575-Y579 WeakPolarHBondContact O-CE1 3.5Å; I576-Y579 HydrophobicContact CB-CD1 4.08Å; I576-Y579 HydrophobicContact CB-CE1 4.45Å; I576-Y579 HydrophobicContact CB-CG 4.12Å; I576-Y579 HydrophobicContact CG2-CD1 4.21Å; I576-Y579 HydrophobicContact CG2-CD2 4.31Å; I576-Y579 HydrophobicContact CG2-CE1 4.13Å; I576-Y579 HydrophobicContact CG2-CE2 4.25Å; I576-Y579 HydrophobicContact CG2-CG 4.29Å; I576-Y579 WeakPolarHBondContact O-CB 3.28Å; I576-Y579 PolarHBondContact O-N 3.01Å; Y579-D583 HydrophobicContact CD2-CB 3.54Å; Y579-D583 HydrophobicContact CE2-CB 4.14Å; Y579-D583 HydrophobicContact CG-CB 3.86Å; Y579-L584 HydrophobicContact CD2-CD2 4.29Å; Y579-L587 HydrophobicContact CD2-CD1 4.18Å; Y579-L587 HydrophobicContact CE2-CD1 3.82Å; Y579-L587 HydrophobicContact CE2-CG 4.2Å
580	S	88.1	Confident	87.3	Confident	41 Å²	41	59 Å²	59	29%	0.287	31%	0.307	S	S	.	.			trans	-79.7	174	170.2	70.7	0	0	0	0	112.1	H578 D582 D583 L584	H578-S580 PolarHBondContact O-N 3.11Å; S580-D582 PolarHBondContact O-N 3.19Å; S580-D582 PolarHBondContact OG-N 3.09Å; S580-D583 VanDerWaalsContact CB-OD2 3.26Å; S580-D583 WeakPolarHBondContact CB-OD2 3.3Å; S580-D583 PolarHBondContact N-OD2 3.27Å; S580-D583 PolarHBondContact O-N 2.88Å; S580-D583 VanDerWaalsContact OG-CG 3.27Å; S580-D583 PolarHBondContact OG-N 2.84Å; S580-D583 VanDerWaalsContact OG-N 3.11Å; S580-D583 PolarHBondContact OG-OD2 3.19Å; S580-L584 WeakPolarHBondContact O-CG 3.36Å; S580-L584 PolarHBondContact O-N 3.18Å; S580-L584 VanDerWaalsContact O-N 3.14Å
581	M	85.9	Confident	87.1	Confident	63 Å²	63	65.4 Å²	65.4	31%	0.31	34%	0.336	S	S	.	.	H	α-helix	trans	-60.8	-30.7	169.9	-79.3	-70.4	-69.6	0	0	112.4	A585 R594 H595 W598	M581-A585 PolarHBondContact O-N 3.09Å; M581-R594 HydrophobicContact CE-CB 3.96Å; M581-R594 HydrophobicContact SD-CB 4.19Å; M581-H595 HydrophobicContact CE-CB 4.48Å; M581-W598 HydrophobicContact CG-CB 4.27Å; M581-W598 HydrophobicContact CG-CD2 3.88Å; M581-W598 HydrophobicContact CG-CE3 4.38Å; M581-W598 HydrophobicContact CG-CG 3.8Å; M581-W598 HydrophobicContact SD-CB 3.53Å; M581-W598 VanDerWaalsContact SD-CB 3.53Å; M581-W598 HydrophobicContact SD-CD2 4.13Å; M581-W598 HydrophobicContact SD-CE3 4.43Å; M581-W598 HydrophobicContact SD-CG 3.74Å
582	D	87.7	Confident	87.2	Confident	129 Å²	129	68.9 Å²	68.9	69%	0.69	35%	0.347	S	S	*	.	H	α-helix	trans	-76	-35.9	178.4	-59.6	-62.2	0	0	0	111.8	S580 A585 S586	S580-D582 PolarHBondContact O-N 3.19Å; S580-D582 PolarHBondContact OG-N 3.09Å; D582-A585 CarbonylContact O-C 3.56Å; D582-A585 WeakPolarHBondContact O-CA 3.38Å; D582-A585 WeakPolarHBondContact O-CB 3.48Å; D582-A585 PolarHBondContact O-N 2.98Å; D582-A585 VanDerWaalsContact O-N 3.12Å; D582-S586 PolarHBondContact O-N 3.22Å
583	D	88.9	Confident	87.2	Confident	64 Å²	64	68.6 Å²	68.6	34%	0.342	34%	0.342	S	S	.	.	H	α-helix	trans	-64.3	-42.8	172.7	-59	-60.7	0	0	0	110.8	Y579 S580 A585 S586 L587	Y579-D583 HydrophobicContact CD2-CB 3.54Å; Y579-D583 HydrophobicContact CE2-CB 4.14Å; Y579-D583 HydrophobicContact CG-CB 3.86Å; S580-D583 VanDerWaalsContact CB-OD2 3.26Å; S580-D583 WeakPolarHBondContact CB-OD2 3.3Å; S580-D583 PolarHBondContact N-OD2 3.27Å; S580-D583 PolarHBondContact O-N 2.88Å; S580-D583 VanDerWaalsContact OG-CG 3.27Å; S580-D583 PolarHBondContact OG-N 2.84Å; S580-D583 VanDerWaalsContact OG-N 3.11Å; S580-D583 PolarHBondContact OG-OD2 3.19Å; D583-A585 VanDerWaalsContact C-N 3.25Å; D583-A585 PolarHBondContact O-N 3.36Å; D583-S586 WeakPolarHBondContact O-CB 3.28Å; D583-S586 PolarHBondContact O-N 3.43Å; D583-S586 VanDerWaalsContact O-N 3.1Å; D583-S586 PolarHBondContact O-OG 3.49Å; D583-L587 PolarHBondContact O-N 3.12Å; D583-L587 VanDerWaalsContact O-N 3.08Å
584	L	89	Confident	87.3	Confident	0 Å²	0	71.3 Å²	71.3	0%	0	35%	0.352	C	S	.	.	H	α-helix	trans	-65.9	-26.4	173.1	-64.4	173.7	0	0	0	112.7	F565 Y579 S580 L587 I589 R594 I597 W598 I601	F565-L584 HydrophobicContact CE1-CD2 4.15Å; F565-L584 HydrophobicContact CZ-CD2 4.02Å; Y579-L584 HydrophobicContact CD2-CD2 4.29Å; S580-L584 WeakPolarHBondContact O-CG 3.36Å; S580-L584 PolarHBondContact O-N 3.18Å; S580-L584 VanDerWaalsContact O-N 3.14Å; L584-L587 HydrophobicContact CD2-CD1 4.33Å; L584-I589 HydrophobicContact CB-CD1 4.35Å; L584-I589 HydrophobicContact CD2-CD1 3.79Å; L584-R594 HydrophobicContact CB-CG 4.31Å; L584-I597 HydrophobicContact CD1-CB 4.44Å; L584-I597 HydrophobicContact CD1-CG2 4.03Å; L584-I597 HydrophobicContact CD2-CG2 3.93Å; L584-W598 HydrophobicContact CD1-CB 3.7Å; L584-W598 HydrophobicContact CD1-CG 4.5Å; L584-I601 HydrophobicContact CD1-CD1 4.47Å
585	A	87.2	Confident	87.5	Confident	32 Å²	32	71.8 Å²	71.8	26%	0.264	36%	0.358	S	S	.	.	H	α-helix	trans	-73.2	-37.7	169.5	0	0	0	0	0	112.1	M581 D582 D583 L587 K588	M581-A585 PolarHBondContact O-N 3.09Å; D582-A585 CarbonylContact O-C 3.56Å; D582-A585 WeakPolarHBondContact O-CA 3.38Å; D582-A585 WeakPolarHBondContact O-CB 3.48Å; D582-A585 PolarHBondContact O-N 2.98Å; D582-A585 VanDerWaalsContact O-N 3.12Å; D583-A585 VanDerWaalsContact C-N 3.25Å; D583-A585 PolarHBondContact O-N 3.36Å; A585-L587 VanDerWaalsContact C-N 3.29Å; A585-L587 PolarHBondContact O-N 3.15Å; A585-K588 PolarHBondContact O-N 3.08Å
586	S	87.8	Confident	87.7	Confident	87 Å²	87	69.6 Å²	69.6	61%	0.608	35%	0.354	S	S	*	.	H	α-helix	trans	-62.6	-35.1	175.8	86.1	0	0	0	0	112.5	D582 D583 K588	D582-S586 PolarHBondContact O-N 3.22Å; D583-S586 WeakPolarHBondContact O-CB 3.28Å; D583-S586 PolarHBondContact O-N 3.43Å; D583-S586 VanDerWaalsContact O-N 3.1Å; D583-S586 PolarHBondContact O-OG 3.49Å; S586-K588 PolarHBondContact O-N 3.11Å; S586-K588 VanDerWaalsContact O-N 3.09Å
587	L	86.5	Confident	87.8	Confident	16 Å²	16	69.6 Å²	69.6	8%	0.084	35%	0.354	C	S	.	.	T	Hydrogen-bonded Turn	trans	-66.3	-1.9	171.5	-68.6	-176.2	0	0	0	114.2	Y564 F565 Q568 L570 Y579 D583 L584 A585 I589	Y564-L587 WeakPolarHBondContact CD1-O 3.38Å; F565-L587 HydrophobicContact CD1-CD1 3.78Å; F565-L587 HydrophobicContact CE1-CD1 3.53Å; F565-L587 HydrophobicContact CZ-CD1 4.19Å; Q568-L587 HydrophobicContact CB-CD2 4.49Å; Q568-L587 HydrophobicContact CG-CD2 3.76Å; L570-L587 HydrophobicContact CD1-CD1 4.22Å; L570-L587 HydrophobicContact CD1-CD2 4.23Å; Y579-L587 HydrophobicContact CD2-CD1 4.18Å; Y579-L587 HydrophobicContact CE2-CD1 3.82Å; Y579-L587 HydrophobicContact CE2-CG 4.2Å; D583-L587 PolarHBondContact O-N 3.12Å; D583-L587 VanDerWaalsContact O-N 3.08Å; L584-L587 HydrophobicContact CD2-CD1 4.33Å; A585-L587 VanDerWaalsContact C-N 3.29Å; A585-L587 PolarHBondContact O-N 3.15Å; L587-I589 HydrophobicContact CB-CD1 3.85Å; L587-I589 HydrophobicContact CB-CG1 3.91Å; L587-I589 HydrophobicContact CD1-CD1 3.83Å; L587-I589 PolarHBondContact O-N 3.02Å
588	K	88.8	Confident	88.3	Confident	168 Å²	168	72 Å²	72	73%	0.73	36%	0.361	S	S	*	.	T	Hydrogen-bonded Turn	trans	60.5	17.3	-177.1	-55.2	179	-179.3	174.8	0	115	Y564 A585 S586	Y564-K588 HydrophobicContact CD1-CB 4.34Å; Y564-K588 HydrophobicContact CE1-CB 4.27Å; Y564-K588 WeakPolarHBondContact CE1-O 3.43Å; A585-K588 PolarHBondContact O-N 3.08Å; S586-K588 PolarHBondContact O-N 3.11Å; S586-K588 VanDerWaalsContact O-N 3.09Å
589	I	89.9	Confident	88.6	Confident	0 Å²	0	70 Å²	70	0%	0	35%	0.351	C	S	.	.			trans	-58.5	137.4	174.3	-63.8	166	0	0	0	109	Y564 F565 L584 L587 F593 R594 I597	Y564-I589 HydrophobicContact CD2-CG1 4.26Å; Y564-I589 HydrophobicContact CG-CG1 4.03Å; F565-I589 HydrophobicContact CE1-CD1 4.15Å; F565-I589 HydrophobicContact CE2-CD1 3.69Å; F565-I589 HydrophobicContact CZ-CD1 3.4Å; L584-I589 HydrophobicContact CB-CD1 4.35Å; L584-I589 HydrophobicContact CD2-CD1 3.79Å; L587-I589 HydrophobicContact CB-CD1 3.85Å; L587-I589 HydrophobicContact CB-CG1 3.91Å; L587-I589 HydrophobicContact CD1-CD1 3.83Å; L587-I589 PolarHBondContact O-N 3.02Å; I589-F593 HydrophobicContact CG2-CB 4.14Å; I589-R594 HydrophobicContact CB-CG 4.23Å; I589-R594 HydrophobicContact CG2-CG 4.02Å; I589-R594 VanDerWaalsContact O-CZ 3.26Å; I589-R594 PolarHBondContact O-NE 2.93Å; I589-R594 PolarHBondContact O-NH2 3.44Å; I589-I597 HydrophobicContact CG2-CD1 4.07Å
590	P	89.4	Confident	88.6	Confident	42 Å²	42	67.4 Å²	67.4	27%	0.273	34%	0.343	S	S	.	.			trans	-61.8	138.3	176	-23.5	33.7	0	0	0	112.4	Q592 F593 R594	P590-Q592 VanDerWaalsContact C-N 3.27Å; P590-Q592 HydrophobicContact CB-CG 4.16Å; P590-Q592 PolarHBondContact O-N 3.06Å; P590-F593 HydrophobicContact CB-CD2 3.95Å; P590-F593 HydrophobicContact CB-CE2 4.44Å; P590-F593 HydrophobicContact CG-CD2 4.11Å; P590-F593 HydrophobicContact CG-CE2 4.44Å; P590-F593 PolarHBondContact O-N 3.08Å; P590-R594 PolarHBondContact O-N 3.16Å
591	E	85.1	Confident	88.7	Confident	150 Å²	150	65.7 Å²	65.7	70%	0.701	33%	0.33	S	S	*	.	H	α-helix	trans	-54.2	-40.5	-172.1	-172.4	174.2	174.3	0	0	113.5	F593 R594	E591-F593 PolarHBondContact O-N 3.31Å; E591-R594 PolarHBondContact O-N 3.33Å
592	Q	86.8	Confident	88.7	Confident	152 Å²	152	65.8 Å²	65.8	71%	0.71	33%	0.332	S	S	*	.	H	α-helix	trans	-53.3	-24.3	175.2	70.8	-164.3	38	0	0	114.8	P590	P590-Q592 VanDerWaalsContact C-N 3.27Å; P590-Q592 HydrophobicContact CB-CG 4.16Å; P590-Q592 PolarHBondContact O-N 3.06Å
593	F	89.4	Confident	88.5	Confident	46 Å²	46	62.9 Å²	62.9	20%	0.202	32%	0.316	C	S	.	.	H	α-helix	trans	-103	-24.7	177.7	-59	-61.5	0	0	0	113	C558 C561 I589 P590 E591 H595 A596 I597	C558-F593 HydrophobicContact CB-CD1 4.47Å; C561-F593 VanDerWaalsContact SG-CB 3.55Å; C561-F593 WeakPolarHBondContact SG-CD2 3.36Å; C561-F593 VanDerWaalsContact SG-CG 3.5Å; I589-F593 HydrophobicContact CG2-CB 4.14Å; P590-F593 HydrophobicContact CB-CD2 3.95Å; P590-F593 HydrophobicContact CB-CE2 4.44Å; P590-F593 HydrophobicContact CG-CD2 4.11Å; P590-F593 HydrophobicContact CG-CE2 4.44Å; P590-F593 PolarHBondContact O-N 3.08Å; E591-F593 PolarHBondContact O-N 3.31Å; F593-H595 PolarHBondContact O-N 3.27Å; F593-A596 PolarHBondContact O-N 3.3Å; F593-A596 VanDerWaalsContact O-N 3.16Å; F593-I597 HydrophobicContact CB-CD1 4.13Å; F593-I597 WeakPolarHBondContact O-CG1 3.42Å; F593-I597 PolarHBondContact O-N 3.06Å
594	R	89.9	Confident	88.1	Confident	58 Å²	58	60.9 Å²	60.9	22%	0.219	31%	0.305	C	S	.	.	H	α-helix	trans	-54.6	-48.8	-177.2	-67.1	-178	-163.2	156.8	5.7	112.2	M581 L584 I589 P590 E591 A596 I597 W598	M581-R594 HydrophobicContact CE-CB 3.96Å; M581-R594 HydrophobicContact SD-CB 4.19Å; L584-R594 HydrophobicContact CB-CG 4.31Å; I589-R594 HydrophobicContact CB-CG 4.23Å; I589-R594 HydrophobicContact CG2-CG 4.02Å; I589-R594 VanDerWaalsContact O-CZ 3.26Å; I589-R594 PolarHBondContact O-NE 2.93Å; I589-R594 PolarHBondContact O-NH2 3.44Å; P590-R594 PolarHBondContact O-N 3.16Å; E591-R594 PolarHBondContact O-N 3.33Å; R594-A596 VanDerWaalsContact C-N 3.33Å; R594-A596 PolarHBondContact O-N 2.97Å; R594-I597 PolarHBondContact O-N 2.89Å; R594-W598 VanDerWaalsContact O-CB 3.28Å; R594-W598 WeakPolarHBondContact O-CB 3.39Å; R594-W598 PolarHBondContact O-N 2.99Å
595	H	89.1	Confident	87.7	Confident	119 Å²	119	65.9 Å²	65.9	55%	0.551	32%	0.324	S	S	*	.	H	α-helix	trans	-67.1	-32.9	-177.5	-168.6	-66.1	0	0	0	112.6	M581 F593 K599	M581-H595 HydrophobicContact CE-CB 4.48Å; F593-H595 PolarHBondContact O-N 3.27Å; H595-K599 WeakPolarHBondContact O-CB 3.45Å; H595-K599 PolarHBondContact O-N 3.04Å; H595-K599 VanDerWaalsContact O-N 3.13Å
596	A	90	Very high	86.7	Confident	40 Å²	40	68.8 Å²	68.8	33%	0.331	33%	0.332	S	S	.	.	H	α-helix	trans	-70.2	-44.1	175.3	0	0	0	0	0	111.4	F593 R594 G600	F593-A596 PolarHBondContact O-N 3.3Å; F593-A596 VanDerWaalsContact O-N 3.16Å; R594-A596 VanDerWaalsContact C-N 3.33Å; R594-A596 PolarHBondContact O-N 2.97Å; A596-G600 PolarHBondContact O-N 2.78Å
597	I	90.1	Very high	85.5	Confident	0 Å²	0	71.4 Å²	71.4	0%	0	34%	0.338	C	S	.	.	H	α-helix	trans	-65.3	-49.4	177.7	-67.9	168.6	0	0	0	111	F552 L553 L556 C558 C561 F565 L584 I589 F593 R594 K599 G600 I601	F552-I597 HydrophobicContact CE1-CG2 4.33Å; L553-I597 HydrophobicContact CD2-CD1 3.77Å; L553-I597 HydrophobicContact CD2-CG1 3.79Å; L556-I597 HydrophobicContact CD1-CG1 4.42Å; C558-I597 HydrophobicContact CB-CD1 4.21Å; C558-I597 HydrophobicContact CB-CG1 4.1Å; C561-I597 HydrophobicContact CB-CD1 4Å; F565-I597 HydrophobicContact CE2-CD1 4.32Å; F565-I597 HydrophobicContact CZ-CD1 4.46Å; F565-I597 HydrophobicContact CZ-CG2 4.08Å; L584-I597 HydrophobicContact CD1-CB 4.44Å; L584-I597 HydrophobicContact CD1-CG2 4.03Å; L584-I597 HydrophobicContact CD2-CG2 3.93Å; I589-I597 HydrophobicContact CG2-CD1 4.07Å; F593-I597 HydrophobicContact CB-CD1 4.13Å; F593-I597 WeakPolarHBondContact O-CG1 3.42Å; F593-I597 PolarHBondContact O-N 3.06Å; R594-I597 PolarHBondContact O-N 2.89Å; I597-K599 PolarHBondContact O-N 3.41Å; I597-G600 PolarHBondContact O-N 2.68Å; I597-G600 VanDerWaalsContact O-N 3.11Å; I597-I601 HydrophobicContact CG2-CD1 4.05Å; I597-I601 WeakPolarHBondContact O-CG1 3.46Å; I597-I601 PolarHBondContact O-N 3.37Å
598	W	92.1	Very high	84	Confident	93 Å²	93	75.1 Å²	75.1	35%	0.352	36%	0.355	S	S	.	.	H	α-helix	trans	-58.7	-45.2	178.1	-178.8	70.7	0	0	0	112.1	M581 L584 R594 G600 I601 L602	M581-W598 HydrophobicContact CG-CB 4.27Å; M581-W598 HydrophobicContact CG-CD2 3.88Å; M581-W598 HydrophobicContact CG-CE3 4.38Å; M581-W598 HydrophobicContact CG-CG 3.8Å; M581-W598 HydrophobicContact SD-CB 3.53Å; M581-W598 VanDerWaalsContact SD-CB 3.53Å; M581-W598 HydrophobicContact SD-CD2 4.13Å; M581-W598 HydrophobicContact SD-CE3 4.43Å; M581-W598 HydrophobicContact SD-CG 3.74Å; L584-W598 HydrophobicContact CD1-CB 3.7Å; L584-W598 HydrophobicContact CD1-CG 4.5Å; R594-W598 VanDerWaalsContact O-CB 3.28Å; R594-W598 WeakPolarHBondContact O-CB 3.39Å; R594-W598 PolarHBondContact O-N 2.99Å; W598-G600 VanDerWaalsContact C-N 3.35Å; W598-G600 PolarHBondContact O-N 3.1Å; W598-I601 PolarHBondContact O-N 3.12Å; W598-L602 HydrophobicContact CH2-CD2 4.47Å; W598-L602 PolarHBondContact O-N 2.82Å
599	K	89.9	Confident	81.7	Confident	108 Å²	108	74.3 Å²	74.3	47%	0.47	35%	0.354	S	S	.	.	H	α-helix	trans	-61.3	-43.8	174.1	-168.2	-166.7	172	-159.7	0	111.3	H595 I597 I601 L602 D603	H595-K599 WeakPolarHBondContact O-CB 3.45Å; H595-K599 PolarHBondContact O-N 3.04Å; H595-K599 VanDerWaalsContact O-N 3.13Å; I597-K599 PolarHBondContact O-N 3.41Å; K599-I601 VanDerWaalsContact C-N 3.28Å; K599-I601 PolarHBondContact O-N 3.02Å; K599-L602 WeakPolarHBondContact O-CB 3.26Å; K599-L602 PolarHBondContact O-N 3.33Å; K599-L602 VanDerWaalsContact O-N 3.09Å; K599-D603 VanDerWaalsContact CE-OD2 3.26Å; K599-D603 WeakPolarHBondContact CE-OD2 3.39Å; K599-D603 IonicContact NZ-OD2 3.7Å; K599-D603 WeakPolarHBondContact O-CB 3.49Å; K599-D603 PolarHBondContact O-N 3.42Å
600	G	89.2	Confident	79.1	Confident	7 Å²	7	83 Å²	83	7%	0.072	39%	0.392	C	S	.	.	H	α-helix	trans	-60.7	-33.7	176.8	0	0	0	0	0	114	A596 I597 W598 H604	A596-G600 PolarHBondContact O-N 2.78Å; I597-G600 PolarHBondContact O-N 2.68Å; I597-G600 VanDerWaalsContact O-N 3.11Å; W598-G600 VanDerWaalsContact C-N 3.35Å; W598-G600 PolarHBondContact O-N 3.1Å; G600-H604 WeakPolarHBondContact O-CB 3.33Å; G600-H604 PolarHBondContact O-N 2.84Å
601	I	89	Confident	76.6	Confident	5 Å²	5	85.4 Å²	85.4	3%	0.026	41%	0.41	C	S	.	.	H	α-helix	trans	-67.4	-42.8	172.9	-66.2	163.3	0	0	0	110.3	F552 I576 L584 I597 W598 K599 H604 R605	F552-I601 HydrophobicContact CE1-CG1 4.08Å; F552-I601 HydrophobicContact CZ-CG1 3.84Å; I576-I601 HydrophobicContact CB-CD1 4.41Å; I576-I601 HydrophobicContact CD1-CD1 4.11Å; I576-I601 HydrophobicContact CD1-CG1 4.3Å; I576-I601 HydrophobicContact CG1-CD1 4.3Å; I576-I601 HydrophobicContact CG1-CG1 4.45Å; I576-I601 WeakPolarHBondContact O-CG2 3.5Å; L584-I601 HydrophobicContact CD1-CD1 4.47Å; I597-I601 HydrophobicContact CG2-CD1 4.05Å; I597-I601 WeakPolarHBondContact O-CG1 3.46Å; I597-I601 PolarHBondContact O-N 3.37Å; W598-I601 PolarHBondContact O-N 3.12Å; K599-I601 VanDerWaalsContact C-N 3.28Å; K599-I601 PolarHBondContact O-N 3.02Å; I601-H604 PolarHBondContact O-N 3.06Å; I601-R605 WeakPolarHBondContact O-CG 3.47Å; I601-R605 PolarHBondContact O-N 3.11Å
602	L	86.2	Confident	73.9	Confident	66 Å²	66	82.6 Å²	82.6	35%	0.346	41%	0.406	S	S	.	.	H	α-helix	trans	-66.4	-44.3	177.9	-172.8	64.2	0	0	0	112.4	W598 K599 H604 R605 Q606	W598-L602 HydrophobicContact CH2-CD2 4.47Å; W598-L602 PolarHBondContact O-N 2.82Å; K599-L602 WeakPolarHBondContact O-CB 3.26Å; K599-L602 PolarHBondContact O-N 3.33Å; K599-L602 VanDerWaalsContact O-N 3.09Å; L602-H604 VanDerWaalsContact C-N 3.3Å; L602-H604 PolarHBondContact O-N 3.47Å; L602-R605 PolarHBondContact O-N 2.95Å; L602-Q606 PolarHBondContact O-N 3.14Å
603	D	84.6	Confident	71.2	Confident	67 Å²	67	81.7 Å²	81.7	36%	0.358	41%	0.414	S	S	.	.	H	α-helix	trans	-63.2	-37	176.7	-68	-14	0	0	0	110.7	K599 Q606 L607	K599-D603 VanDerWaalsContact CE-OD2 3.26Å; K599-D603 WeakPolarHBondContact CE-OD2 3.39Å; K599-D603 IonicContact NZ-OD2 3.7Å; K599-D603 WeakPolarHBondContact O-CB 3.49Å; K599-D603 PolarHBondContact O-N 3.42Å; D603-Q606 PolarHBondContact O-N 3.11Å; D603-L607 WeakPolarHBondContact O-CG 3.26Å; D603-L607 PolarHBondContact O-N 3.34Å
604	H	79.5	Confident	68.4	Low	23 Å²	23	85 Å²	85	11%	0.106	44%	0.442	C	S	.	.	H	α-helix	trans	-63.5	-38.5	174.1	-176.3	-97.3	0	0	0	113	I573 G600 I601 L602	I573-H604 HydrophobicContact CD1-CB 3.99Å; G600-H604 WeakPolarHBondContact O-CB 3.33Å; G600-H604 PolarHBondContact O-N 2.84Å; I601-H604 PolarHBondContact O-N 3.06Å; L602-H604 VanDerWaalsContact C-N 3.3Å; L602-H604 PolarHBondContact O-N 3.47Å
605	R	80.9	Confident	65.5	Low	105 Å²	105	90.4 Å²	90.4	40%	0.396	47%	0.47	S	S	.	.	H	α-helix	trans	-65.9	-43.6	176.9	-72.8	167.7	64.8	154.8	-4.5	112.4	E577 H578 I601 L602 L607 H608 E609	E577-R605 HydrophobicContact CG-CG 3.72Å; E577-R605 WeakPolarHBondContact O-CD 3.33Å; E577-R605 PolarHBondContact O-NH1 3.33Å; H578-R605 PolarHBondContact ND1-NH1 3.44Å; I601-R605 WeakPolarHBondContact O-CG 3.47Å; I601-R605 PolarHBondContact O-N 3.11Å; L602-R605 PolarHBondContact O-N 2.95Å; R605-L607 VanDerWaalsContact C-N 3.29Å; R605-L607 PolarHBondContact O-N 2.79Å; R605-H608 WeakPolarHBondContact O-CA 3.49Å; R605-H608 WeakPolarHBondContact O-CB 3.48Å; R605-H608 PolarHBondContact O-N 2.58Å; R605-E609 PolarHBondContact O-N 3.24Å
606	Q	66.7	Low	62.8	Low	92 Å²	92	92 Å²	92	43%	0.43	48%	0.482	S	S	.	.	H	α-helix	trans	-61.8	-38.2	179.3	-68.5	-174.9	17.4	0	0	111.9	L602 D603 H608 E609 F610	L602-Q606 PolarHBondContact O-N 3.14Å; D603-Q606 PolarHBondContact O-N 3.11Å; Q606-H608 PolarHBondContact O-N 3.21Å; Q606-E609 PolarHBondContact O-N 3.45Å; Q606-E609 VanDerWaalsContact O-N 3.07Å; Q606-F610 VanDerWaalsContact O-CD2 3.29Å; Q606-F610 WeakPolarHBondContact O-CD2 3.29Å
607	L	61.6	Low	60	Low	143 Å²	143	98.1 Å²	98.1	75%	0.749	51%	0.508	S	S	*	.	H	α-helix	trans	-60.3	-24	173.7	-71.1	171.3	0	0	0	113.4	D603 R605	D603-L607 WeakPolarHBondContact O-CG 3.26Å; D603-L607 PolarHBondContact O-N 3.34Å; R605-L607 VanDerWaalsContact C-N 3.29Å; R605-L607 PolarHBondContact O-N 2.79Å
608	H	55.6	Low	57	Low	94 Å²	94	109.6 Å²	109.6	44%	0.435	55%	0.552	S	S	.	*	H	α-helix	trans	-88.7	-11.3	177.7	-122	-64.5	0	0	0	114	R605 Q606	R605-H608 WeakPolarHBondContact O-CA 3.49Å; R605-H608 WeakPolarHBondContact O-CB 3.48Å; R605-H608 PolarHBondContact O-N 2.58Å; Q606-H608 PolarHBondContact O-N 3.21Å
609	E	39.7	Very low	53.8	Low	150 Å²	150	111 Å²	111	70%	0.701	57%	0.571	S	S	*	*	H	α-helix	trans	-94	-26.4	-173.3	-155.1	164.1	-152	0	0	112.7	R605 Q606 S611	R605-E609 PolarHBondContact O-N 3.24Å; Q606-E609 PolarHBondContact O-N 3.45Å; Q606-E609 VanDerWaalsContact O-N 3.07Å; E609-S611 VanDerWaalsContact C-N 3.27Å; E609-S611 PolarHBondContact O-N 3.18Å
610	F	37.1	Very low	51.6	Low	183 Å²	183	111.1 Å²	111.1	80%	0.803	58%	0.582	S	S	*	*	T	Hydrogen-bonded Turn	trans	-74.5	0	-178.7	-78.9	-74	0	0	0	116	Q606	Q606-F610 VanDerWaalsContact O-CD2 3.29Å; Q606-F610 WeakPolarHBondContact O-CD2 3.29Å
611	S	35.5	Very low	48.7	Very low	92 Å²	92	115.9 Å²	115.9	64%	0.643	62%	0.615	S	S	*	*	T	Hydrogen-bonded Turn	trans	-97.5	13	-175.4	67.9	0	0	0	0	115.5	E609	E609-S611 VanDerWaalsContact C-N 3.27Å; E609-S611 PolarHBondContact O-N 3.18Å
612	S	28.9	Very low	45.9	Very low	91 Å²	91	120.6 Å²	120.6	64%	0.636	65%	0.648	S	S	*	*			trans	-127.2	119	-172.2	-62.5	0	0	0	0	112.6
613	P	30.7	Very low	43.1	Very low	133 Å²	133	122 Å²	122	86%	0.864	67%	0.669	S	S	*	*			trans	-72	139	168.4	30.7	-32.8	0	0	0	110.3
614	S	29.3	Very low	40.5	Very low	115 Å²	115	124.5 Å²	124.5	80%	0.804	69%	0.692	S	S	*	*			trans	-84.5	131.8	-170.3	44.7	0	0	0	0	113.5
615	H	30.2	Very low	38.3	Very low	173 Å²	173	129.7 Å²	129.7	80%	0.801	73%	0.725	S	S	*	*			trans	-149	101.5	158.4	-135.1	-91.7	0	0	0	114.3
616	L	31.5	Very low	35.8	Very low	151 Å²	151	131.7 Å²	131.7	79%	0.791	75%	0.749	S	S	*	*			trans	44.2	115.6	152.2	-56.2	-178.8	0	0	0	120.7
617	L	31	Very low	34.2	Very low	170 Å²	170	132.8 Å²	132.8	89%	0.89	77%	0.767	S	S	*	*			trans	-55.7	140.6	168.5	-64.5	151.3	0	0	0	114.2
618	R	27.5	Very low	32.6	Very low	241 Å²	241	132.9 Å²	132.9	91%	0.909	77%	0.773	S	S	*	*			trans	-153.3	126.7	135.5	-151.9	172.6	-169.6	169.7	3.9	113.3
619	T	25.1	Very low	31.3	Very low	123 Å²	123	132.2 Å²	132.2	76%	0.755	79%	0.791	S	S	*	*			trans	-140.8	178.5	169.6	59.9	0	0	0	0	107.1
620	P	44.3	Very low	31	Very low	109 Å²	109	131 Å²	131	71%	0.708	80%	0.8	S	S	*	*			cis	-131.8	-162.8	-1.6	35.9	-14.5	0	0	0	114.1
621	S	28.3	Very low	30.6	Very low	108 Å²	108	127.6 Å²	127.6	76%	0.755	80%	0.799	S	S	*	*			trans	91.4	144.4	152.4	-59.1	0	0	0	0	119.2
622	S	30.6	Very low	30.7	Very low	103 Å²	103	132 Å²	132	72%	0.72	81%	0.809	S	S	*	*			cis	-175.3	147.4	-14.6	49.7	0	0	0	0	112.4
623	A	27.4	Very low	30.8	Very low	96 Å²	96	134.4 Å²	134.4	79%	0.793	82%	0.82	S	S	*	*			trans	64.3	162	163.4	0	0	0	0	0	116.2
624	S	29.6	Very low	31.4	Very low	120 Å²	120	140.6 Å²	140.6	84%	0.839	83%	0.826	S	S	*	*			cis	-147.4	168.6	23.5	-62.9	0	0	0	0	114.1
625	T	33.1	Very low	31.6	Very low	131 Å²	131	138 Å²	138	80%	0.804	82%	0.818	S	S	*	*			trans	-101.2	152.6	174.6	51.4	0	0	0	0	113.1
626	V	29.1	Very low	31.9	Very low	148 Å²	148	137.6 Å²	137.6	90%	0.897	82%	0.816	S	S	*	*			trans	-160	154.4	147.8	-97.5	0	0	0	0	110.7
627	S	32.3	Very low	32.3	Very low	115 Å²	115	140.8 Å²	140.8	80%	0.804	82%	0.818	S	S	*	*			trans	-155.2	128.6	178.6	55.6	0	0	0	0	110.7
628	V	29.1	Very low	32.5	Very low	144 Å²	144	136.5 Å²	136.5	87%	0.873	80%	0.798	S	S	*	*			trans	-148.7	131.1	-178.8	-175.6	0	0	0	0	112.8
629	G	27	Very low	33.2	Very low	80 Å²	80	130.7 Å²	130.7	83%	0.825	78%	0.784	S	S	*	*			trans	89.1	142	136	0	0	0	0	0	119.5
630	S	33.8	Very low	33.8	Very low	126 Å²	126	129.2 Å²	129.2	88%	0.881	77%	0.772	S	S	*	*			trans	-137.1	141.8	170.6	174.3	0	0	0	0	109.7
631	S	27.6	Very low	33.6	Very low	111 Å²	111	126.5 Å²	126.5	78%	0.776	76%	0.758	S	S	*	*			trans	-163.2	141.2	155.6	-169	0	0	0	0	110
632	E	37.8	Very low	34.1	Very low	184 Å²	184	124.8 Å²	124.8	86%	0.86	74%	0.743	S	S	*	*			trans	-79.3	148.2	161.5	-65.5	177.1	95.5	0	0	110.5
633	T	31.8	Very low	34.4	Very low	142 Å²	142	127.7 Å²	127.7	87%	0.871	74%	0.738	S	S	*	*			trans	-145.5	144.5	140	46.5	0	0	0	0	109.4	G635	T633-G635 PolarHBondContact O-N 3.45Å
634	R	43.5	Very low	34.9	Very low	263 Å²	263	130.2 Å²	130.2	99%	0.992	73%	0.731	S	S	*	*			trans	-86.2	97.5	-179	-174.6	177.7	-179.6	180	-0.9	109.6
635	G	33.2	Very low	35.5	Very low	61 Å²	61	127.1 Å²	127.1	63%	0.629	71%	0.708	S	S	*	*			trans	-103.7	134.8	-177.9	0	0	0	0	0	114	T633	T633-G635 PolarHBondContact O-N 3.45Å
636	E	36.4	Very low	35.7	Very low	164 Å²	164	126.7 Å²	126.7	77%	0.766	70%	0.7	S	S	*	*			trans	-69.4	130.3	173.2	-170.4	176.6	174.1	0	0	110.5	V638	E636-V638 PolarHBondContact O-N 3.43Å
637	R	39.9	Very low	36.7	Very low	218 Å²	218	128.2 Å²	128.2	82%	0.823	69%	0.69	S	S	*	*			trans	-98.7	81.6	-172	-67.5	-167	-60.2	-174.7	0.1	112.3	I639	R637-I639 PolarHBondContact O-N 3.46Å
638	V	36.1	Very low	37	Very low	79 Å²	79	128.3 Å²	128.3	48%	0.479	68%	0.677	S	S	.	*			trans	-65.7	121.6	161.9	-178.3	0	0	0	0	108.5	R97 E636	R97-V638 HydrophobicContact CG-CG1 4.37Å; E636-V638 PolarHBondContact O-N 3.43Å
639	I	42.1	Very low	38.3	Very low	119 Å²	119	125.4 Å²	125.4	61%	0.61	66%	0.66	S	S	*	*			trans	-105.3	97.8	175.5	-56.9	177.4	0	0	0	107.9	R637 A641	R637-I639 PolarHBondContact O-N 3.46Å; I639-A641 PolarHBondContact O-N 2.97Å
640	D	36.1	Very low	39.1	Very low	93 Å²	93	126.1 Å²	126.1	50%	0.497	64%	0.644	S	S	.	*	E	Extended strand (participates in β ladder)	trans	-75.9	107.9	166.7	-74.9	-35.4	0	0	0	108.6	R97	R97-D640 IonicContact CZ-OD1 3.65Å; R97-D640 IonicContact CZ-OD2 2.83Å; R97-D640 IonicContact NE-OD1 3.72Å; R97-D640 PolarHBondContact NE-OD1 3.3Å; R97-D640 IonicContact NE-OD2 3.32Å; R97-D640 IonicContact NH2-OD1 2.74Å; R97-D640 PolarHBondContact NH2-OD1 3.03Å; R97-D640 IonicContact NH2-OD2 3.37Å; R97-D640 PolarHBondContact NH2-OD2 2.94Å
641	A	41.9	Very low	39.7	Very low	52 Å²	52	123.3 Å²	123.3	43%	0.43	62%	0.624	S	S	.	*	E	Extended strand (participates in β ladder)	trans	-99.8	123	-178.5	0	0	0	0	0	110.8	I96 I639	I96-A641 PolarHBondContact N-O 3.18Å; I96-A641 VanDerWaalsContact N-O 3.12Å; I96-A641 PolarHBondContact O-N 3.5Å; I639-A641 PolarHBondContact O-N 2.97Å
642	V	37.9	Very low	40.3	Very low	72 Å²	72	126.2 Å²	126.2	44%	0.436	62%	0.623	S	S	.	*	E	Extended strand (participates in β ladder)	trans	-101.6	120.4	176.6	-177.1	0	0	0	0	109.4	M93 F644	M93-V642 HydrophobicContact CG-CG1 3.63Å; M93-V642 HydrophobicContact SD-CG1 4.15Å; V642-F644 HydrophobicContact CB-CE2 4.44Å; V642-F644 HydrophobicContact CG1-CD2 4.46Å; V642-F644 HydrophobicContact CG1-CE1 4.05Å; V642-F644 HydrophobicContact CG1-CE2 3.87Å; V642-F644 HydrophobicContact CG1-CZ 3.64Å
643	R	37.8	Very low	40.6	Very low	164 Å²	164	120.7 Å²	120.7	62%	0.619	60%	0.603	S	S	*	*	E	Extended strand (participates in β ladder)	trans	-99.5	120.5	174.3	-178.6	179.2	175.8	167.6	0.1	109.9	D94	D94-R643 PolarHBondContact N-O 3.34Å; D94-R643 VanDerWaalsContact N-O 3.12Å; D94-R643 PolarHBondContact O-N 3.37Å
644	F	36.6	Very low	41.5	Very low	148 Å²	148	118.5 Å²	118.5	65%	0.649	59%	0.592	S	S	*	*	E	Extended strand (participates in β ladder)	trans	-94.5	130	167.1	-58.2	-78.2	0	0	0	109.6	M93 V642	M93-F644 HydrophobicContact CG-CE1 4.28Å; M93-F644 HydrophobicContact SD-CE1 4.49Å; V642-F644 HydrophobicContact CB-CE2 4.44Å; V642-F644 HydrophobicContact CG1-CD2 4.46Å; V642-F644 HydrophobicContact CG1-CE1 4.05Å; V642-F644 HydrophobicContact CG1-CE2 3.87Å; V642-F644 HydrophobicContact CG1-CZ 3.64Å
645	T	43.3	Very low	41.8	Very low	55 Å²	55	116.4 Å²	116.4	34%	0.337	58%	0.584	S	S	.	*	E	Extended strand (participates in β ladder)	trans	-118.4	112	170.5	-54.7	0	0	0	0	109	S92	S92-T645 PolarHBondContact N-O 3.17Å; S92-T645 PolarHBondContact O-N 3.22Å
646	L	36.7	Very low	42.5	Very low	123 Å²	123	120.2 Å²	120.2	64%	0.644	59%	0.589	S	S	*	*	E	Extended strand (participates in β ladder)	trans	-91.2	122.6	176.1	-177.7	71.5	0	0	0	109.4	I89 I91	I89-L646 HydrophobicContact CG2-CD1 3.53Å; I91-L646 HydrophobicContact CD1-CD1 4.31Å; I91-L646 HydrophobicContact CG1-CD1 3.82Å
647	R	49	Very low	42.9	Very low	180 Å²	180	119.7 Å²	119.7	68%	0.679	59%	0.587	S	S	*	*	E	Extended strand (participates in β ladder)	trans	-117.9	119.4	171.6	-151.9	175	-171.8	-136.7	2	109.5	E90	E90-R647 PolarHBondContact N-O 3.27Å; E90-R647 PolarHBondContact O-N 3.13Å
648	Q	39.4	Very low	43.5	Very low	116 Å²	116	117.6 Å²	117.6	54%	0.542	58%	0.579	S	S	.	*	E	Extended strand (participates in β ladder)	trans	-114.4	121.2	175.6	-178.1	-179.8	5	0	0	108.7	I89 I650	I89-Q648 HydrophobicContact CG1-CG 4.36Å; Q648-I650 HydrophobicContact CG-CG1 4.21Å
649	T	56.8	Low	43.8	Very low	83 Å²	83	120.8 Å²	120.8	51%	0.509	59%	0.594	S	S	.	*			trans	-107.5	126.3	174.5	-57.4	0	0	0	0	108.7	K88	K88-T649 PolarHBondContact O-N 3.36Å
650	I	43.1	Very low	43.8	Very low	96 Å²	96	122.9 Å²	122.9	49%	0.492	61%	0.606	S	S	.	*			trans	-115.7	115.6	176.7	-55.2	175.6	0	0	0	107.6	Q648 F652	Q648-I650 HydrophobicContact CG-CG1 4.21Å; I650-F652 HydrophobicContact CG2-CE2 4.43Å; I650-F652 HydrophobicContact CG2-CZ 4.31Å
651	S	45.8	Very low	43.7	Very low	67 Å²	67	127.4 Å²	127.4	47%	0.469	62%	0.622	S	S	.	*			trans	-96.4	144.7	173.5	44	0	0	0	0	110.6
652	F	41.3	Very low	43.4	Very low	171 Å²	171	132 Å²	132	75%	0.75	64%	0.639	S	S	*	*			trans	-111.3	138.4	175.3	-64.4	-85.7	0	0	0	109.4	I650	I650-F652 HydrophobicContact CG2-CE2 4.43Å; I650-F652 HydrophobicContact CG2-CZ 4.31Å
653	P	43.3	Very low	43.2	Very low	69 Å²	69	137.5 Å²	137.5	45%	0.448	66%	0.657	S	S	.	*			trans	-67.1	157.5	174.4	29.1	-34.8	0	0	0	111.4
654	P	52	Low	43.2	Very low	96 Å²	96	136.2 Å²	136.2	62%	0.623	66%	0.663	S	S	*	*			trans	-59.6	159.4	173.8	26.3	-34	0	0	0	112	D656	P654-D656 PolarHBondContact O-N 2.82Å; P654-D656 VanDerWaalsContact O-N 3.12Å
655	R	49.3	Very low	43.3	Very low	219 Å²	219	136 Å²	136	83%	0.826	67%	0.666	S	S	*	*	G	3₁₀ helix	trans	-70	-14.8	-161.4	-168.7	175	-73.2	-124.8	0.5	114.7	E657	R655-E657 PolarHBondContact O-N 3.09Å
656	D	48.2	Very low	43	Very low	140 Å²	140	139.7 Å²	139.7	75%	0.749	68%	0.683	S	S	*	*	G	3₁₀ helix	trans	-84.2	-7.5	-164.7	-53.5	-55.2	0	0	0	114.8	P654	P654-D656 PolarHBondContact O-N 2.82Å; P654-D656 VanDerWaalsContact O-N 3.12Å
657	E	43.8	Very low	42.8	Very low	154 Å²	154	138.8 Å²	138.8	72%	0.72	69%	0.693	S	S	*	*	G	3₁₀ helix	trans	-92.6	1.9	176.4	-62.6	-171.4	131.3	0	0	114.1	R655 N659	R655-E657 PolarHBondContact O-N 3.09Å; E657-N659 VanDerWaalsContact C-N 3.27Å; E657-N659 PolarHBondContact O-N 3.05Å
658	W	53.9	Low	42.3	Very low	174 Å²	174	141.6 Å²	141.6	66%	0.659	70%	0.704	S	S	*	*			trans	-80.1	43.4	-170.8	-83.8	62	0	0	0	115.7
659	N	40.8	Very low	42.3	Very low	146 Å²	146	146.9 Å²	146.9	78%	0.781	72%	0.719	S	S	*	*			trans	-90.8	-7.5	-170.4	-81.3	-54.5	0	0	0	117.3	E657	E657-N659 VanDerWaalsContact C-N 3.27Å; E657-N659 PolarHBondContact O-N 3.05Å
660	D	43.7	Very low	41.3	Very low	162 Å²	162	150 Å²	150	87%	0.866	73%	0.732	S	S	*	*	S	Bend	trans	-110.6	6.3	-172.7	-99.2	-41.7	0	0	0	116.4	N662	D660-N662 PolarHBondContact O-N 3.19Å
661	F	33.2	Very low	40.8	Very low	188 Å²	188	155.5 Å²	155.5	83%	0.825	75%	0.753	S	S	*	*			trans	-101.1	72.5	173.2	-91.2	-81.8	0	0	0	112.4	F663	F661-F663 PolarHBondContact O-N 3.07Å; F661-F663 VanDerWaalsContact O-N 3.12Å
662	N	35.9	Very low	40.3	Very low	148 Å²	148	160.8 Å²	160.8	79%	0.791	77%	0.77	S	S	*	*			trans	-73.2	99.5	178.1	-171.6	6	0	0	0	112	D660	D660-N662 PolarHBondContact O-N 3.19Å
663	F	33.5	Very low	39.9	Very low	188 Å²	188	161.7 Å²	161.7	83%	0.825	78%	0.777	S	S	*	*			trans	-106	76.4	174.9	-142.8	-77.7	0	0	0	110.2	F661	F661-F663 PolarHBondContact O-N 3.07Å; F661-F663 VanDerWaalsContact O-N 3.12Å
664	D	38.4	Very low	39.3	Very low	137 Å²	137	169.3 Å²	169.3	73%	0.733	80%	0.797	S	S	*	*			trans	-59.3	137.3	-173.8	-170.9	12.3	0	0	0	112.7
665	M	37.9	Very low	38.8	Very low	144 Å²	144	172.3 Å²	172.3	71%	0.709	81%	0.806	S	S	*	*			trans	-150.2	58.2	-165.7	-129	-88.3	74.2	0	0	113.3
666	D	36.6	Very low	38.1	Very low	133 Å²	133	169 Å²	169	71%	0.711	80%	0.797	S	S	*	*			trans	-159.5	127.3	137.8	-125.6	-30.2	0	0	0	116.1
667	A	32.2	Very low	37.7	Very low	103 Å²	103	169.5 Å²	169.5	85%	0.851	80%	0.795	S	S	*	*			trans	-153.6	40.4	177.5	0	0	0	0	0	114.3
668	R	39.5	Very low	37.3	Very low	240 Å²	240	170.4 Å²	170.4	91%	0.906	80%	0.799	S	S	*	*			trans	-98.1	82.6	172.9	-89.4	-168	171.3	-165.2	1.7	113.5
669	R	38.4	Very low	36.4	Very low	226 Å²	226	165.8 Å²	165.8	85%	0.853	81%	0.806	S	S	*	*			trans	-157.4	140	153.1	-122.2	166.7	179.1	167.7	-0.6	114.4
670	N	37.3	Very low	36	Very low	148 Å²	148	172.1 Å²	172.1	79%	0.791	83%	0.831	S	S	*	*			trans	43.1	108.5	161.6	-62.9	-4.7	0	0	0	119.3
671	K	32.3	Very low	35.7	Very low	212 Å²	212	172.7 Å²	172.7	92%	0.922	83%	0.829	S	S	*	*			trans	-139.9	98.3	138.2	-148.8	166.4	-169.7	174.2	0	111.5
672	Q	33.8	Very low	35.8	Very low	178 Å²	178	171.8 Å²	171.8	83%	0.832	83%	0.829	S	S	*	*			trans	-72.7	161.8	162.6	-77	175.4	-44.2	0	0	110.1
673	Q	33.8	Very low	35.8	Very low	190 Å²	190	173.2 Å²	173.2	89%	0.888	83%	0.832	S	S	*	*			trans	-13.8	132.4	165.6	-61.4	166.4	-29.6	0	0	117.3
674	R	31.6	Very low	35.9	Very low	230 Å²	230	172.3 Å²	172.3	87%	0.868	83%	0.832	S	S	*	*				-161.6	147	101.4	-155.2	171.9	-172	-178.6	3.3	111.1
675	I	40	Very low	35.8	Very low	159 Å²	159	174.5 Å²	174.5	82%	0.815	84%	0.838	S	S	*	*			trans	-115.7	128.9	164.6	-63.8	173.6	0	0	0	107.7
676	K	35.4	Very low	35.6	Very low	150 Å²	150	176.5 Å²	176.5	65%	0.652	85%	0.847	S	S	*	*			trans	-163	131	150.8	-100.2	-153.8	154.9	-125.6	0	105.3
677	E	39.9	Very low	35.6	Very low	150 Å²	150	179.6 Å²	179.6	70%	0.701	86%	0.856	S	S	*	*			cis	86.7	125	32.8	-158.6	-172.7	-131	0	0	113.1
678	E	35.1	Very low	35.8	Very low	172 Å²	172	185.5 Å²	185.5	80%	0.804	86%	0.857	S	S	*	*			trans	75.6	132.4	175.3	-47.9	-160.4	112.9	0	0	121.2
679	G	35.2	Very low	35.5	Very low	78 Å²	78	181 Å²	181	80%	0.804	85%	0.853	S	S	*	*			trans	70.7	123.8	140.7	0	0	0	0	0	119.2
680	E	33.2	Very low	35.2	Very low	279 Å²	279	176.9 Å²	176.9	100%	1.304	85%	0.853	S	S	*	*			cis	-130.6	0	20.5	-81.8	179.2	117.5	0	0	113.2

Retrieved 680 of 680 residues in 3206.7 ms (Link to these results)

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