A0A061IF78_CRIGR Loading...

Nuclear RNA export factor 1

Involved in the export of mRNA from the nucleus to the cytoplasm. Involved in the nuclear export of mRNA species bearing retroviral constitutive transport elements (CTE) and in the export of mRNA from the nucleus to the cytoplasm (TAP/NFX1 pathway). The NXF1-NXT1 heterodimer is involved in the export of HSP70 mRNA in conjunction with ALYREF/THOC4 and THOC5 components of the TREX complex. ALYREF/THOC4-bound mRNA is thought to be transferred to the NXF1-NXT1 heterodimer for export. Also involved in nuclear export of m6A-containing mRNAs: interaction between SRSF3 and YTHDC1 facilitates m6A-containing mRNA-binding to both SRSF3 and NXF1, promoting mRNA nuclear export.

AlphaFold DB , UniProt , Accession A0A061IF78, Species CRIGR (Cricetulus griseus, Chinese hamster), Gene Nxf1, Length 618 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	35.2	Very low	34.4	Very low	238 Å²	238	143.5 Å²	143.5	100%	1.172	75%	0.754	S	S	*	*				0	106.4	0	-61.1	169.1	-176.9	0	0	104.4
2	A	36	Very low	34.6	Very low	94 Å²	94	140 Å²	140	78%	0.777	74%	0.737	S	S	*	*				68.6	132.5	68	0	0	0	0	0	110.6
3	D	34	Very low	34.6	Very low	152 Å²	152	137 Å²	137	81%	0.813	72%	0.722	S	S	*	*			cis	-142.2	172	22.8	-149.8	-0.9	0	0	0	115.6
4	E	34.9	Very low	34.6	Very low	146 Å²	146	140.3 Å²	140.3	68%	0.682	72%	0.719	S	S	*	*			trans	-60.7	169.9	160.5	-58.7	-176.1	176	0	0	111.3	K6	E4-K6 IonicContact OE2-NZ 2.6Å; E4-K6 PolarHBondContact OE2-NZ 3.34Å
5	G	31.7	Very low	34.5	Very low	61 Å²	61	138.5 Å²	138.5	63%	0.629	72%	0.717	S	S	*	*			cis	146.3	-178.7	-0.8	0	0	0	0	0	111.4
6	K	34.7	Very low	34.2	Very low	172 Å²	172	137.3 Å²	137.3	75%	0.748	73%	0.725	S	S	*	*			trans	72.2	131.2	179	-57.9	136.3	-168.2	143.7	0	114.6	E4	E4-K6 IonicContact OE2-NZ 2.6Å; E4-K6 PolarHBondContact OE2-NZ 3.34Å
7	S	33.1	Very low	34.1	Very low	98 Å²	98	140.4 Å²	140.4	69%	0.685	73%	0.731	S	S	*	*			cis	95.7	119.5	26.9	179.2	0	0	0	0	114
8	Y	34	Very low	34.9	Very low	216 Å²	216	139.6 Å²	139.6	85%	0.847	74%	0.736	S	S	*	*			trans	-178.9	146.8	149.7	-84.4	-51.7	0	0	0	108.5
9	N	33.8	Very low	34.9	Very low	110 Å²	110	141.3 Å²	141.3	59%	0.588	74%	0.74	S	S	*	*			cis	-169.6	175.1	-16.8	-160.1	26.6	0	0	0	111.8
10	E	34.7	Very low	34.6	Very low	149 Å²	149	147.1 Å²	147.1	70%	0.696	75%	0.751	S	S	*	*			trans	76.3	144.5	153.9	-55.1	-179.6	-156.2	0	0	118.6
11	H	36.2	Very low	34.5	Very low	142 Å²	142	150.8 Å²	150.8	66%	0.657	76%	0.756	S	S	*	*			cis	-174.1	171.1	-15.1	-109.9	-44.7	0	0	0	106.2
12	D	36.7	Very low	34.3	Very low	102 Å²	102	149 Å²	149	55%	0.545	74%	0.742	S	S	.	*			cis	-164.1	-178	-16.6	-129	21.9	0	0	0	103.9	R14	D12-R14 IonicContact OD1-NH2 2.67Å; D12-R14 PolarHBondContact OD1-NH2 3.28Å; D12-R14 IonicContact OD2-CZ 3.65Å; D12-R14 IonicContact OD2-NH1 2.73Å; D12-R14 IonicContact OD2-NH2 3.61Å; D12-R14 PolarHBondContact OD2-NH2 3.13Å
13	D	35	Very low	34.1	Very low	101 Å²	101	154.2 Å²	154.2	54%	0.54	75%	0.746	S	S	.	*			cis	-166.6	175.9	-0.5	-137.8	3.4	0	0	0	110.5
14	R	34.8	Very low	33.8	Very low	183 Å²	183	150.7 Å²	150.7	69%	0.691	75%	0.746	S	S	*	*			cis	-140.9	174.6	-21.6	-157.9	134.8	-103.4	142.8	11.6	109	D12	D12-R14 IonicContact OD1-NH2 2.67Å; D12-R14 PolarHBondContact OD1-NH2 3.28Å; D12-R14 IonicContact OD2-CZ 3.65Å; D12-R14 IonicContact OD2-NH1 2.73Å; D12-R14 IonicContact OD2-NH2 3.61Å; D12-R14 PolarHBondContact OD2-NH2 3.13Å
15	V	33.1	Very low	33.6	Very low	114 Å²	114	156 Å²	156	69%	0.691	76%	0.76	S	S	*	*			trans	-87.7	157.4	-177.8	-156.8	0	0	0	0	113.5
16	S	29.2	Very low	33.5	Very low	119 Å²	119	156.1 Å²	156.1	83%	0.832	76%	0.761	S	S	*	*				-177.2	143.3	125.2	-84.1	0	0	0	0	117
17	F	32.7	Very low	34	Very low	189 Å²	189	153.9 Å²	153.9	83%	0.829	76%	0.764	S	S	*	*			trans	-99.8	178.2	165.8	-77	-96.4	0	0	0	110.9
18	P	48.1	Very low	33.7	Very low	127 Å²	127	157.8 Å²	157.8	83%	0.825	77%	0.769	S	S	*	*				-146.8	161.8	101.4	37.6	-22.4	0	0	0	116.6
19	Q	34.3	Very low	33.7	Very low	172 Å²	172	158.6 Å²	158.6	80%	0.804	77%	0.77	S	S	*	*			trans	-88.5	160.2	170.2	-62.4	179.7	-12.6	0	0	113
20	R	30	Very low	33.3	Very low	257 Å²	257	164.2 Å²	164.2	97%	0.97	78%	0.783	S	S	*	*			trans	-158.1	167.9	134.6	-112.6	166.8	-170.7	-159.1	1.9	113.8
21	R	33.1	Very low	33	Very low	224 Å²	224	165.7 Å²	165.7	85%	0.845	79%	0.787	S	S	*	*			trans	-107	154.4	-160.4	-51.8	167.7	174.6	172.3	-5.3	113.7
22	K	30.1	Very low	32.6	Very low	202 Å²	202	165 Å²	165	88%	0.878	80%	0.797	S	S	*	*				-177.8	130.9	120.3	-102.8	167.1	-177.5	177.8	0	116.8
23	K	31.8	Very low	32.1	Very low	202 Å²	202	164 Å²	164	88%	0.878	81%	0.81	S	S	*	*			trans	30.6	111.2	146.1	-65	-171.1	173.4	-172.7	0	120.8
24	G	28.5	Very low	31.8	Very low	78 Å²	78	169 Å²	169	80%	0.804	83%	0.83	S	S	*	*			trans	-81.5	-163.9	165.3	0	0	0	0	0	116.7
25	R	30.6	Very low	31.5	Very low	259 Å²	259	164 Å²	164	98%	0.977	84%	0.836	S	S	*	*			trans	-153.5	168.3	165.2	-106	-178.1	-175.6	-149	0.2	110.6
26	G	29.6	Very low	31.3	Very low	62 Å²	62	165.5 Å²	165.5	64%	0.639	84%	0.84	S	S	*	*			trans	-81.9	-168.2	-169.6	0	0	0	0	0	117.2
27	P	44.8	Very low	31.3	Very low	125 Å²	125	171.5 Å²	171.5	81%	0.812	85%	0.845	S	S	*	*			trans	-94.4	159.5	-151.9	36.5	-37.7	0	0	0	115.3
28	F	27.7	Very low	31.3	Very low	181 Å²	181	173.5 Å²	173.5	79%	0.794	85%	0.846	S	S	*	*			trans	-122.5	135.6	165.4	-86.9	-83.3	0	0	0	112.8	W30	F28-W30 AromaticContact CD1-NE1 3.99Å
29	R	33.6	Very low	30.4	Very low	232 Å²	232	173.7 Å²	173.7	88%	0.875	85%	0.851	S	S	*	*			trans	-114.4	123.5	-178	172.1	-156.5	-160.1	-166.3	11.6	106.9
30	W	25.9	Very low	30	Very low	229 Å²	229	169.2 Å²	169.2	87%	0.867	85%	0.851	S	S	*	*			trans	-128.9	139.3	173.9	-74.5	110.5	0	0	0	112.4	F28	F28-W30 AromaticContact CD1-NE1 3.99Å
31	K	28.3	Very low	30.1	Very low	180 Å²	180	169.4 Å²	169.4	78%	0.783	85%	0.852	S	S	*	*			trans	-137.8	136.6	-179.1	-145.4	-163.8	-173.1	-167.5	0	106.8
32	C	27.5	Very low	29.7	Very low	128 Å²	128	162.8 Å²	162.8	87%	0.865	85%	0.853	S	S	*	*			trans	57.8	134.4	165.6	-55	0	0	0	0	118.9
33	G	26.1	Very low	29.6	Very low	79 Å²	79	156.7 Å²	156.7	81%	0.814	85%	0.848	S	S	*	*			trans	-156.1	112.1	161.4	0	0	0	0	0	109.1
34	E	29.3	Very low	29.4	Very low	206 Å²	206	152.2 Å²	152.2	96%	0.963	84%	0.842	S	S	*	*			trans	-77.1	144.4	175	-70.1	176.3	89.1	0	0	110.8
35	G	27.2	Very low	29.3	Very low	78 Å²	78	153.7 Å²	153.7	80%	0.804	84%	0.84	S	S	*	*			trans	-142.5	55.5	-172	0	0	0	0	0	113.1	R37	G35-R37 PolarHBondContact O-N 3.41Å
36	N	29.6	Very low	29.3	Very low	147 Å²	147	149.8 Å²	149.8	79%	0.786	84%	0.837	S	S	*	*			trans	-72	111.4	-175.9	-176.3	13.8	0	0	0	112.5
37	R	29.3	Very low	29.1	Very low	245 Å²	245	158.2 Å²	158.2	93%	0.925	85%	0.849	S	S	*	*			trans	-137.2	130	162.8	-73.9	-167.4	174.5	-169.6	-1.2	111.2	G35	G35-R37 PolarHBondContact O-N 3.41Å
38	R	32.6	Very low	28.2	Very low	230 Å²	230	157.7 Å²	157.7	87%	0.868	85%	0.849	S	S	*	*			trans	-93.1	134.7	175.9	-67.4	175.7	172.3	174.1	-3.1	111.2
39	S	29.5	Very low	28.2	Very low	131 Å²	131	153.4 Å²	153.4	92%	0.916	84%	0.841	S	S	*	*			trans	156.1	157.1	131.7	57	0	0	0	0	111.1
40	G	26.3	Very low	27.8	Very low	79 Å²	79	153.5 Å²	153.5	81%	0.814	84%	0.841	S	S	*	*			trans	132.9	96.5	177.9	0	0	0	0	0	113
41	R	30.4	Very low	28	Very low	261 Å²	261	151.6 Å²	151.6	99%	0.985	84%	0.84	S	S	*	*			trans	-85.9	138.5	161.7	-73.3	176.9	171	177.6	-3.4	108.4
42	G	26.1	Very low	28.2	Very low	84 Å²	84	151.9 Å²	151.9	87%	0.866	84%	0.844	S	S	*	*			trans	161	132.1	170.1	0	0	0	0	0	110.4
43	G	26.7	Very low	28.3	Very low	74 Å²	74	155.1 Å²	155.1	76%	0.763	85%	0.846	S	S	*	*			trans	-149	177.6	-179.6	0	0	0	0	0	112.4
44	S	28.5	Very low	28.5	Very low	109 Å²	109	158.9 Å²	158.9	76%	0.762	85%	0.848	S	S	*	*			trans	91.3	105.8	177	-155.7	0	0	0	0	117
45	S	26.1	Very low	28.7	Very low	109 Å²	109	157 Å²	157	76%	0.762	84%	0.844	S	S	*	*				67.1	93.2	129.3	-49.2	0	0	0	0	120
46	I	29.9	Very low	28.9	Very low	177 Å²	177	156.5 Å²	156.5	91%	0.908	84%	0.839	S	S	*	*			trans	-115.1	145.5	141.5	-66.1	-177.4	0	0	0	108.9
47	R	26.6	Very low	29.2	Very low	238 Å²	238	157.6 Å²	157.6	90%	0.898	85%	0.845	S	S	*	*	P	Polyproline II helix	trans	-57.4	138.9	-165.4	-62.9	166.1	176.2	174.9	-4.2	113.8
48	S	25.9	Very low	29.3	Very low	115 Å²	115	152.5 Å²	152.5	80%	0.804	84%	0.841	S	S	*	*	P	Polyproline II helix	trans	-73.7	133.4	158.2	171	0	0	0	0	109.6
49	S	26.7	Very low	29.3	Very low	90 Å²	90	145.9 Å²	145.9	63%	0.629	84%	0.835	S	S	*	*	P	Polyproline II helix	trans	-83.6	116.7	166.7	51	0	0	0	0	109.7
50	R	26.5	Very low	29.5	Very low	234 Å²	234	148.9 Å²	148.9	88%	0.883	84%	0.837	S	S	*	*	P	Polyproline II helix	trans	-69.2	132	157	-82.1	-177.4	170.4	175.3	-5.6	108
51	F	30.2	Very low	29.6	Very low	190 Å²	190	151.7 Å²	151.7	83%	0.833	83%	0.833	S	S	*	*	P	Polyproline II helix	trans	-91	146.6	148.6	-77.4	-90.1	0	0	0	107.3
52	E	31	Very low	29.6	Very low	185 Å²	185	146.4 Å²	146.4	86%	0.864	83%	0.825	S	S	*	*	P	Polyproline II helix	trans	-98.2	138.3	175	-66.5	171.1	142.7	0	0	107.4
53	E	30.8	Very low	29.7	Very low	196 Å²	196	146 Å²	146	92%	0.916	81%	0.813	S	S	*	*	P	Polyproline II helix	trans	-97.5	128.2	170	-70.2	-179.4	137.8	0	0	107.2
54	D	28.5	Very low	30	Very low	159 Å²	159	152.2 Å²	152.2	85%	0.85	82%	0.822	S	S	*	*			trans	-110	95.4	-171	-176.8	36.3	0	0	0	109.1
55	D	34.5	Very low	30.1	Very low	166 Å²	166	154.8 Å²	154.8	89%	0.888	83%	0.827	S	S	*	*			trans	-98.2	102.7	174.2	-87.7	-32.4	0	0	0	109
56	G	30.8	Very low	30.3	Very low	67 Å²	67	152.7 Å²	152.7	69%	0.691	82%	0.823	S	S	*	*			trans	-97.2	110	-179.5	0	0	0	0	0	113.5
57	D	36.2	Very low	30.6	Very low	171 Å²	171	150.9 Å²	150.9	91%	0.914	82%	0.823	S	S	*	*	P	Polyproline II helix	trans	-85	140.1	169.5	-89.9	-40.7	0	0	0	112.1
58	V	32.4	Very low	30.8	Very low	138 Å²	138	151 Å²	151	84%	0.836	82%	0.823	S	S	*	*	P	Polyproline II helix	trans	-97.3	119.2	-177.1	179.1	0	0	0	0	111
59	A	32.4	Very low	31.1	Very low	91 Å²	91	152.8 Å²	152.8	75%	0.752	83%	0.829	S	S	*	*	P	Polyproline II helix	trans	-90.9	133.7	168.9	0	0	0	0	0	111.2
60	M	32.5	Very low	31.3	Very low	193 Å²	193	159.9 Å²	159.9	95%	0.951	84%	0.842	S	S	*	*	P	Polyproline II helix	trans	-66.9	150	170.3	-77.2	-68.9	-144.5	0	0	111.2
61	N	29.9	Very low	31.3	Very low	138 Å²	138	158.7 Å²	158.7	74%	0.738	84%	0.839	S	S	*	*			trans	-134.2	132.8	-174.4	176.7	81.3	0	0	0	110.5
62	D	29.4	Very low	31.4	Very low	151 Å²	151	155.8 Å²	155.8	81%	0.807	83%	0.832	S	S	*	*			trans	176.2	157.5	148.6	-93.3	-13.1	0	0	0	110.2
63	A	29.1	Very low	31.5	Very low	76 Å²	76	151.2 Å²	151.2	63%	0.628	82%	0.819	S	S	*	*			cis	-173.7	125.4	-39.1	0	0	0	0	0	108.8
64	Q	31.3	Very low	31.5	Very low	203 Å²	203	152.6 Å²	152.6	95%	0.949	82%	0.817	S	S	*	*			trans	-165.1	156.2	153.8	-113.2	164.5	27	0	0	112.3
65	D	30.7	Very low	31.7	Very low	163 Å²	163	150.4 Å²	150.4	87%	0.872	81%	0.812	S	S	*	*			trans	-95.1	137.4	-151.4	-85.3	-72.4	0	0	0	118
66	G	30.9	Very low	31.4	Very low	65 Å²	65	150 Å²	150	67%	0.67	81%	0.809	S	S	*	*				69.9	171	121.9	0	0	0	0	0	120.7
67	P	35.6	Very low	31.4	Very low	139 Å²	139	158.5 Å²	158.5	90%	0.903	82%	0.82	S	S	*	*			cis	-106.4	-177.5	2.4	39.8	-31.9	0	0	0	114.7
68	R	32.2	Very low	31.3	Very low	242 Å²	242	156.1 Å²	156.1	91%	0.913	81%	0.814	S	S	*	*			trans	-102.4	141.7	-162.9	-58.6	168.5	174.8	165.9	-3.9	115
69	V	31.2	Very low	31.1	Very low	152 Å²	152	156.4 Å²	156.4	92%	0.921	81%	0.811	S	S	*	*			trans	-134.8	154.3	155.9	-176	0	0	0	0	109.3
70	R	32.3	Very low	30.9	Very low	238 Å²	238	163.9 Å²	163.9	90%	0.898	82%	0.82	S	S	*	*			trans	-99.5	127.6	-163	-61.9	177.5	-178.4	164.2	-0.3	115.2
71	Y	26.4	Very low	30.8	Very low	210 Å²	210	165.4 Å²	165.4	82%	0.824	82%	0.815	S	S	*	*				35.3	111	129.7	-156.2	-93.8	0	0	0	120.2
72	N	31.7	Very low	30.6	Very low	128 Å²	128	162.1 Å²	162.1	68%	0.684	81%	0.814	S	S	*	*				163.5	133.4	109.5	-156.4	27.8	0	0	0	110.9
73	P	33.8	Very low	30.4	Very low	90 Å²	90	161.9 Å²	161.9	58%	0.584	81%	0.813	S	S	*	*			trans	-89.8	159.2	-177.7	34.4	-34.6	0	0	0	115.3
74	Y	29.9	Very low	30.4	Very low	224 Å²	224	164.4 Å²	164.4	88%	0.878	82%	0.821	S	S	*	*			trans	72.7	118.3	173.1	-56.5	-75.7	0	0	0	119.4
75	P	32.1	Very low	30.1	Very low	114 Å²	114	165.3 Å²	165.3	74%	0.74	82%	0.816	S	S	*	*			trans	-121.5	119.5	152	34.1	-21.8	0	0	0	114.1
76	N	29.1	Very low	29.9	Very low	156 Å²	156	165.2 Å²	165.2	83%	0.834	81%	0.81	S	S	*	*			trans	56.3	114.4	135.8	-56.3	-26	0	0	0	122.2
77	R	29.4	Very low	29.7	Very low	246 Å²	246	169.2 Å²	169.2	93%	0.928	82%	0.815	S	S	*	*			trans	-88.4	140.4	137.1	-75.5	-178.7	172	-179.4	-2.4	109.3
78	P	35.5	Very low	29.3	Very low	121 Å²	121	172.5 Å²	172.5	79%	0.786	81%	0.81	S	S	*	*			trans	-85.4	132.4	-176	31.7	-34.3	0	0	0	114.7
79	N	28.4	Very low	29	Very low	145 Å²	145	168 Å²	168	78%	0.775	80%	0.804	S	S	*	*			trans	22.4	129.7	148.3	-73.8	-28.1	0	0	0	121.4
80	R	28.5	Very low	28.8	Very low	248 Å²	248	172 Å²	172	94%	0.936	80%	0.802	S	S	*	*				-134.2	136.7	112.6	-98.8	-176.9	179.9	-179.9	-0.5	110.1
81	R	28.8	Very low	28.8	Very low	224 Å²	224	167.6 Å²	167.6	85%	0.845	80%	0.795	S	S	*	*			trans	-74.2	157.4	172.4	-67.2	-179.9	178.3	171.7	-1.9	110
82	G	25.9	Very low	28.7	Very low	70 Å²	70	166.2 Å²	166.2	72%	0.722	80%	0.796	S	S	*	*			trans	-103.4	156	159.1	0	0	0	0	0	110.4
83	D	26.1	Very low	28.6	Very low	145 Å²	145	166.8 Å²	166.8	78%	0.775	80%	0.798	S	S	*	*			trans	-142.9	146.8	166.4	-91.2	-59.2	0	0	0	107.9
84	T	28.8	Very low	28.3	Very low	130 Å²	130	169.4 Å²	169.4	80%	0.798	81%	0.812	S	S	*	*			trans	-134.4	98.5	-165.1	-54.2	0	0	0	0	111.4
85	W	24.8	Very low	28.2	Very low	222 Å²	222	165 Å²	165	84%	0.841	81%	0.808	S	S	*	*			trans	-139.3	113.4	175.8	-74.5	85.6	0	0	0	113.6
86	H	26.4	Very low	28	Very low	161 Å²	161	170.7 Å²	170.7	75%	0.745	82%	0.815	S	S	*	*			trans	26.1	115.4	145.9	-60.3	-84.6	0	0	0	123.1
87	D	26.8	Very low	27.9	Very low	148 Å²	148	174.8 Å²	174.8	79%	0.791	82%	0.819	S	S	*	*				75.3	158	117.3	-151.3	13.1	0	0	0	122
88	R	27.8	Very low	27.8	Very low	209 Å²	209	170.3 Å²	170.3	79%	0.789	81%	0.813	S	S	*	*			trans	74.9	111.5	172.8	-72.5	-173.9	169.6	-178.3	-3.3	121.2
89	D	26.2	Very low	27.4	Very low	146 Å²	146	176.5 Å²	176.5	78%	0.781	82%	0.821	S	S	*	*				30.1	113.4	127.4	-59.4	-44.7	0	0	0	120.1
90	R	27.1	Very low	27.3	Very low	237 Å²	237	174 Å²	174	89%	0.894	82%	0.82	S	S	*	*				-165.8	147.3	108.4	-106.4	168.9	-175.4	-167.9	0.7	113.8
91	I	30.4	Very low	27.4	Very low	146 Å²	146	167.8 Å²	167.8	75%	0.749	81%	0.812	S	S	*	*			trans	-82	134.9	171.8	-62.1	163.4	0	0	0	108.8	I93	I91-I93 HydrophobicContact CG2-CG1 4.34Å
92	H	26	Very low	27.6	Very low	180 Å²	180	163.2 Å²	163.2	83%	0.833	81%	0.811	S	S	*	*			trans	-135.4	134.6	152.8	-92.9	-77.4	0	0	0	111.6
93	I	29.6	Very low	27.8	Very low	141 Å²	141	169 Å²	169	72%	0.723	82%	0.82	S	S	*	*			trans	-95.1	136.8	179.7	-64.3	163.2	0	0	0	108.3	I91	I91-I93 HydrophobicContact CG2-CG1 4.34Å
94	T	26.8	Very low	28	Very low	145 Å²	145	174.1 Å²	174.1	89%	0.89	83%	0.828	S	S	*	*			trans	-146	140.4	155.7	-3.9	0	0	0	0	112.4
95	V	27.8	Very low	27.8	Very low	131 Å²	131	172 Å²	172	79%	0.794	83%	0.832	S	S	*	*			trans	-86.4	149	-165.6	175.3	0	0	0	0	111.4
96	R	28.4	Very low	27.8	Very low	234 Å²	234	165.3 Å²	165.3	88%	0.883	83%	0.832	S	S	*	*			trans	-64.6	148.1	170.2	-74.7	-179.3	171.6	-179.8	-4.1	111.2
97	R	26.3	Very low	28	Very low	242 Å²	242	162.9 Å²	162.9	91%	0.913	84%	0.839	S	S	*	*			trans	-135	148.6	155.8	-112.8	-177.6	-179.7	176.6	1	110.7
98	D	28.3	Very low	27.9	Very low	152 Å²	152	159.5 Å²	159.5	81%	0.813	84%	0.84	S	S	*	*			trans	-82.7	153.7	-164.7	-52.8	-87.8	0	0	0	114.1
99	R	25.7	Very low	28.1	Very low	250 Å²	250	156.4 Å²	156.4	94%	0.943	85%	0.845	S	S	*	*			trans	-149.5	124.4	148	-104.4	178.5	-177.9	-177.5	-0.4	108.6
100	A	27.8	Very low	28	Very low	93 Å²	93	154.8 Å²	154.8	77%	0.769	85%	0.845	S	S	*	*	P	Polyproline II helix	trans	-90.4	150.4	174.8	0	0	0	0	0	110.9
101	P	29.6	Very low	28.6	Very low	117 Å²	117	153 Å²	153	76%	0.76	85%	0.847	S	S	*	*	P	Polyproline II helix	trans	-77.5	154.5	164.9	33.7	-33.1	0	0	0	111
102	P	33.2	Very low	28.5	Very low	128 Å²	128	153.8 Å²	153.8	83%	0.831	85%	0.852	S	S	*	*	P	Polyproline II helix	trans	-84.8	155.7	-173.8	34.2	-36.3	0	0	0	113.9
103	E	30.7	Very low	28.7	Very low	192 Å²	192	147.7 Å²	147.7	90%	0.897	84%	0.838	S	S	*	*	P	Polyproline II helix	trans	-85.4	147.3	171.2	-60.6	-178	133.3	0	0	112.4
104	R	28.6	Very low	29.1	Very low	253 Å²	253	147.4 Å²	147.4	96%	0.955	84%	0.843	S	S	*	*			trans	-142.5	114.6	145.5	-96.6	-169.9	175.4	-177	-1.5	108.3
105	G	26.7	Very low	29.8	Very low	85 Å²	85	145.9 Å²	145.9	88%	0.876	83%	0.834	S	S	*	*			trans	-86.7	158.3	177.2	0	0	0	0	0	113
106	G	23.4	Very low	31	Very low	81 Å²	81	146.2 Å²	146.2	84%	0.835	82%	0.824	S	S	*	*			trans	-151.6	110.4	164.9	0	0	0	0	0	107.6
107	A	30.4	Very low	33.3	Very low	110 Å²	110	139.3 Å²	139.3	91%	0.909	81%	0.805	S	S	*	*			trans	-89.3	134.6	-172	0	0	0	0	0	111.7
108	G	26	Very low	35.9	Very low	78 Å²	78	128.6 Å²	128.6	80%	0.804	77%	0.765	S	S	*	*			trans	-146.6	118.9	168.5	0	0	0	0	0	108.2
109	T	30.9	Very low	38.6	Very low	144 Å²	144	122.9 Å²	122.9	88%	0.883	73%	0.733	S	S	*	*			trans	-97	127.8	-165.9	48.3	0	0	0	0	113.3
110	S	25.3	Very low	41.6	Very low	112 Å²	112	113.7 Å²	113.7	78%	0.783	70%	0.7	S	S	*	*			trans	-135.4	129.7	143.3	56.7	0	0	0	0	108.9
111	Q	38.6	Very low	44.4	Very low	200 Å²	200	109.2 Å²	109.2	94%	0.935	66%	0.663	S	S	*	*			trans	-76.3	128.1	166.3	-66.2	171.3	-64.9	0	0	107.4
112	D	27.9	Very low	47.2	Very low	161 Å²	161	104.1 Å²	104.1	86%	0.861	63%	0.629	S	S	*	*			trans	-147.3	158.2	168.3	-150.4	-15.5	0	0	0	111	T114	D112-T114 PolarHBondContact O-N 3.41Å
113	G	31.7	Very low	49.8	Very low	53 Å²	53	98 Å²	98	55%	0.546	59%	0.59	S	S	.	*	S	Bend	trans	-68	119.8	-161	0	0	0	0	0	115.1	T115	G113-T115 PolarHBondContact O-N 2.9Å
114	T	36.7	Very low	52.3	Low	135 Å²	135	90 Å²	90	83%	0.828	56%	0.555	S	S	*	*			trans	25.6	77.1	157.4	51.3	0	0	0	0	115.6	D112 K116	D112-T114 PolarHBondContact O-N 3.41Å; T114-K116 PolarHBondContact O-N 2.89Å
115	T	41.9	Very low	54.8	Low	113 Å²	113	85 Å²	85	69%	0.693	54%	0.537	S	S	*	.			trans	-57.3	114.1	170.6	48	0	0	0	0	109.9	G113 N117	G113-T115 PolarHBondContact O-N 2.9Å; T115-N117 PolarHBondContact O-N 2.87Å
116	K	53.8	Low	57.3	Low	137 Å²	137	81 Å²	81	60%	0.596	50%	0.495	S	S	*	.			trans	-66.7	98.3	-177.2	-73.6	175.6	150.6	-155.5	0	110.1	T114 W118 E163	T114-K116 PolarHBondContact O-N 2.89Å; K116-W118 PolarHBondContact O-N 2.98Å; K116-E163 HydrophobicContact CB-CG 4.34Å; K116-E163 HydrophobicContact CD-CG 4.33Å; K116-E163 VanDerWaalsContact CD-OE1 3.26Å; K116-E163 WeakPolarHBondContact CD-OE1 3.36Å; K116-E163 VanDerWaalsContact CE-OE1 3.31Å; K116-E163 WeakPolarHBondContact CE-OE1 3.42Å; K116-E163 IonicContact NZ-OE1 3.33Å; K116-E163 PolarHBondContact NZ-OE1 2.93Å
117	N	75.6	Confident	60.2	Low	90 Å²	90	83 Å²	83	48%	0.481	48%	0.481	S	S	.	.			trans	-80.6	111.8	-175.2	-74.2	-38.3	0	0	0	110.4	T115 F119 E163	T115-N117 PolarHBondContact O-N 2.87Å; N117-F119 HydrophobicContact CB-CE2 3.78Å; N117-F119 HydrophobicContact CB-CZ 4.07Å; N117-F119 WeakPolarHBondContact O-CD2 3.4Å; N117-F119 WeakPolarHBondContact O-CE2 3.47Å; N117-E163 CarbonylContact O-C 3.58Å
118	W	81.4	Confident	62.6	Low	16 Å²	16	83.9 Å²	83.9	6%	0.061	46%	0.464	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-85.9	139.1	-179.1	-71.9	85.9	0	0	0	112.1	K116 I149 F161 E163 S193 P195 P196 V199	K116-W118 PolarHBondContact O-N 2.98Å; W118-I149 HydrophobicContact CH2-CD1 3.71Å; W118-I149 HydrophobicContact CZ3-CD1 3.72Å; W118-I149 HydrophobicContact CZ3-CG2 4.47Å; W118-F161 HydrophobicContact CE3-CB 4.24Å; W118-F161 HydrophobicContact CZ3-CB 4.42Å; W118-E163 HydrophobicContact CD2-CB 4.42Å; W118-E163 HydrophobicContact CD2-CG 4.49Å; W118-E163 HydrophobicContact CE3-CB 4.22Å; W118-E163 HydrophobicContact CH2-CB 3.59Å; W118-E163 HydrophobicContact CH2-CG 3.72Å; W118-E163 HydrophobicContact CZ2-CB 3.79Å; W118-E163 VanDerWaalsContact CZ2-CD 3.41Å; W118-E163 HydrophobicContact CZ2-CG 3.4Å; W118-E163 HydrophobicContact CZ3-CB 3.83Å; W118-E163 HydrophobicContact CZ3-CG 4.38Å; W118-S193 WeakPolarHBondContact CB-O 3.29Å; W118-S193 PolarHBondContact O-N 3.27Å; W118-P195 HydrophobicContact CD2-CB 4.29Å; W118-P195 HydrophobicContact CG-CB 4.15Å; W118-P196 HydrophobicContact CE3-CG 3.87Å; W118-P196 HydrophobicContact CZ3-CG 3.8Å; W118-V199 HydrophobicContact CH2-CB 4.22Å; W118-V199 HydrophobicContact CH2-CG1 3.86Å; W118-V199 HydrophobicContact CH2-CG2 3.81Å; W118-V199 HydrophobicContact CZ2-CB 4.24Å; W118-V199 HydrophobicContact CZ2-CG1 3.6Å; W118-V199 HydrophobicContact CZ2-CG2 4.33Å; W118-V199 HydrophobicContact CZ3-CG2 4.37Å
119	F	85.1	Confident	65.3	Low	33 Å²	33	81.4 Å²	81.4	15%	0.145	43%	0.431	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-125.8	121.1	178.4	-61.8	-87.5	0	0	0	110.5	N117 F161 V162 A165 A168 I190 N191	N117-F119 HydrophobicContact CB-CE2 3.78Å; N117-F119 HydrophobicContact CB-CZ 4.07Å; N117-F119 WeakPolarHBondContact O-CD2 3.4Å; N117-F119 WeakPolarHBondContact O-CE2 3.47Å; F119-F161 WeakPolarHBondContact O-CA 3.38Å; F119-V162 HydrophobicContact CB-CG2 4.01Å; F119-V162 PolarHBondContact N-O 3.02Å; F119-V162 PolarHBondContact O-N 2.98Å; F119-V162 VanDerWaalsContact O-N 3.08Å; F119-A165 VanDerWaalsContact CE2-CA 3.45Å; F119-A165 HydrophobicContact CE2-CB 3.72Å; F119-A165 HydrophobicContact CZ-CB 3.92Å; F119-A168 HydrophobicContact CB-CB 3.82Å; F119-A168 HydrophobicContact CD1-CB 4.03Å; F119-A168 HydrophobicContact CD2-CB 3.53Å; F119-A168 HydrophobicContact CE2-CB 4.1Å; F119-A168 HydrophobicContact CG-CB 3.49Å; F119-A168 VanDerWaalsContact CG-CB 3.49Å; F119-I190 HydrophobicContact CB-CG2 3.91Å; F119-I190 HydrophobicContact CD1-CG2 4.22Å; F119-I190 HydrophobicContact CG-CG2 4.41Å; F119-N191 CarbonylContact C-O 3.59Å; F119-N191 WeakPolarHBondContact CA-O 3.37Å
120	K	87.3	Confident	67.8	Low	56 Å²	56	79.3 Å²	79.3	24%	0.243	41%	0.414	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-82.7	117.5	171.6	-176.4	168.9	-179.9	169.4	0	109.5	F161 N191	K120-F161 HydrophobicContact CB-CD1 3.8Å; K120-F161 HydrophobicContact CB-CE1 3.63Å; K120-F161 HydrophobicContact CD-CE1 3.8Å; K120-F161 HydrophobicContact CD-CZ 3.93Å; K120-F161 HydrophobicContact CG-CD1 4.13Å; K120-F161 HydrophobicContact CG-CE1 3.7Å; K120-F161 HydrophobicContact CG-CZ 4.11Å; K120-N191 PolarHBondContact N-O 2.96Å; K120-N191 PolarHBondContact O-N 2.98Å
121	I	88.4	Confident	70.6	Confident	0 Å²	0	78.7 Å²	78.7	0%	0	40%	0.397	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-97.9	132.7	177.4	-58.4	177.6	0	0	0	108.3	Q159 F160 V162 L171 I188 I189 I190	I121-Q159 VanDerWaalsContact O-CA 3.31Å; I121-Q159 WeakPolarHBondContact O-CA 3.48Å; I121-F160 HydrophobicContact CB-CD1 4.39Å; I121-F160 HydrophobicContact CB-CD2 4.31Å; I121-F160 HydrophobicContact CB-CE1 4.19Å; I121-F160 HydrophobicContact CB-CE2 4.13Å; I121-F160 HydrophobicContact CB-CG 4.46Å; I121-F160 HydrophobicContact CB-CZ 4.07Å; I121-F160 HydrophobicContact CD1-CD2 4.18Å; I121-F160 HydrophobicContact CD1-CE2 3.53Å; I121-F160 HydrophobicContact CD1-CZ 3.92Å; I121-F160 HydrophobicContact CG1-CE2 4.35Å; I121-F160 HydrophobicContact CG2-CD1 4.36Å; I121-F160 HydrophobicContact CG2-CE1 3.75Å; I121-F160 HydrophobicContact CG2-CE2 4.27Å; I121-F160 HydrophobicContact CG2-CZ 3.71Å; I121-F160 PolarHBondContact N-O 3.46Å; I121-F160 PolarHBondContact O-N 2.85Å; I121-F160 VanDerWaalsContact O-N 3.13Å; I121-V162 HydrophobicContact CD1-CG1 3.92Å; I121-V162 HydrophobicContact CD1-CG2 3.83Å; I121-V162 HydrophobicContact CG1-CG2 4.49Å; I121-L171 HydrophobicContact CD1-CB 4.35Å; I121-L171 HydrophobicContact CD1-CD1 3.42Å; I121-L171 VanDerWaalsContact CD1-CD1 3.42Å; I121-L171 HydrophobicContact CD1-CG 4.47Å; I121-I188 HydrophobicContact CG2-CG2 3.69Å; I121-I189 WeakPolarHBondContact CA-O 3.33Å; I121-I190 HydrophobicContact CD1-CD1 4.37Å; I121-I190 HydrophobicContact CG1-CD1 4.24Å; I121-I190 HydrophobicContact CG1-CG1 4.1Å; I121-I190 HydrophobicContact CG1-CG2 4.28Å; I121-I190 HydrophobicContact CG2-CG1 4.43Å
122	T	86.7	Confident	72.8	Confident	9 Å²	9	72.3 Å²	72.3	6%	0.055	38%	0.379	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-134.4	125.7	-176.8	-63.8	0	0	0	0	109.8	P124 R157 Q159 I189	T122-P124 WeakPolarHBondContact O-CD 3.48Å; T122-R157 HydrophobicContact CG2-CB 4.25Å; T122-Q159 HydrophobicContact CG2-CG 4.19Å; T122-I189 PolarHBondContact N-O 2.98Å; T122-I189 PolarHBondContact O-N 2.7Å
123	I	88	Confident	75.6	Confident	0 Å²	0	67.8 Å²	67.8	0%	0	35%	0.35	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-111.4	103.8	179.4	-60.7	171.7	0	0	0	108	Y125 G126 L134 I138 R157 A158 F160 I186 I188	I123-Y125 PolarHBondContact O-N 2.77Å; I123-G126 PolarHBondContact O-N 3.35Å; I123-G126 VanDerWaalsContact O-N 3.08Å; I123-L134 HydrophobicContact CD1-CD1 4.32Å; I123-L134 HydrophobicContact CD1-CD2 3.89Å; I123-L134 HydrophobicContact CD1-CG 4.18Å; I123-I138 HydrophobicContact CD1-CD1 3.55Å; I123-R157 VanDerWaalsContact O-CA 3.3Å; I123-R157 WeakPolarHBondContact O-CA 3.24Å; I123-A158 HydrophobicContact CB-CB 4.29Å; I123-A158 PolarHBondContact N-O 2.85Å; I123-A158 PolarHBondContact O-N 2.87Å; I123-F160 HydrophobicContact CD1-CE1 4.12Å; I123-I186 HydrophobicContact CG2-CG2 3.67Å; I123-I188 HydrophobicContact CG1-CG1 4.44Å
124	P	83.4	Confident	78.1	Confident	25 Å²	25	65.2 Å²	65.2	16%	0.162	32%	0.324	C	S	.	.	T	Hydrogen-bonded Turn	trans	-54.3	136.9	173.1	-25.9	36.2	0	0	0	111.6	T122 G126 S187 I189	T122-P124 WeakPolarHBondContact O-CD 3.48Å; P124-G126 PolarHBondContact O-N 3.19Å; P124-S187 WeakPolarHBondContact CD-O 3.4Å; P124-I189 HydrophobicContact CG-CD1 3.69Å; P124-I189 HydrophobicContact CG-CG1 4.28Å
125	Y	81.1	Confident	80.4	Confident	148 Å²	148	60.1 Å²	60.1	58%	0.58	29%	0.291	S	S	*	.	T	Hydrogen-bonded Turn	trans	59.1	8.1	-175.4	-49.5	-77.5	0	0	0	115.6	I123 K127 K128 T156	I123-Y125 PolarHBondContact O-N 2.77Å; Y125-K127 PolarHBondContact O-N 2.9Å; Y125-K128 WeakPolarHBondContact O-CB 3.46Å; Y125-K128 WeakPolarHBondContact O-CG 3.49Å; Y125-K128 PolarHBondContact O-N 2.78Å; Y125-T156 CarbonylContact C-O 3.31Å; Y125-T156 WeakPolarHBondContact CA-O 3.38Å; Y125-T156 PolarHBondContact N-O 3.29Å
126	G	79.4	Confident	82.4	Confident	0 Å²	0	58 Å²	58	0%	0	28%	0.281	C	S	.	.	G	3₁₀ helix	trans	-57.6	-20.4	-176.5	0	0	0	0	0	115.3	I123 P124 K128 Y129 T156	I123-G126 PolarHBondContact O-N 3.35Å; I123-G126 VanDerWaalsContact O-N 3.08Å; P124-G126 PolarHBondContact O-N 3.19Å; G126-K128 PolarHBondContact O-N 3.47Å; G126-Y129 PolarHBondContact O-N 2.85Å; G126-Y129 VanDerWaalsContact O-N 3.1Å; G126-T156 PolarHBondContact N-O 3.16Å
127	K	84.3	Confident	83.7	Confident	122 Å²	122	54 Å²	54	53%	0.53	27%	0.265	S	S	.	.	G	3₁₀ helix	trans	-66.3	-13.1	173.3	-169.8	176	178.3	175.5	0	113.9	Y125 Y129 Y153 N155 T156	Y125-K127 PolarHBondContact O-N 2.9Å; K127-Y129 PolarHBondContact O-N 2.92Å; K127-Y153 HydrophobicContact CB-CD1 3.85Å; K127-Y153 HydrophobicContact CB-CE1 4.44Å; K127-Y153 HydrophobicContact CB-CG 4.37Å; K127-Y153 HydrophobicContact CG-CD1 4.1Å; K127-Y153 HydrophobicContact CG-CG 4.15Å; K127-N155 WeakPolarHBondContact CD-O 3.29Å; K127-N155 PolarHBondContact NZ-O 3.47Å; K127-T156 WeakPolarHBondContact CB-O 3.23Å; K127-T156 PolarHBondContact N-O 3.24Å; K127-T156 VanDerWaalsContact N-O 3.15Å
128	K	81.5	Confident	84.2	Confident	130 Å²	130	49.8 Å²	49.8	57%	0.565	24%	0.243	S	C	*	.	G	3₁₀ helix	trans	-70.2	-16.9	170.4	-70.8	-171.6	172.4	-167.9	0	113.3	Y125 G126	Y125-K128 WeakPolarHBondContact O-CB 3.46Å; Y125-K128 WeakPolarHBondContact O-CG 3.49Å; Y125-K128 PolarHBondContact O-N 2.78Å; G126-K128 PolarHBondContact O-N 3.47Å
129	Y	81.8	Confident	84.3	Confident	26 Å²	26	52.1 Å²	52.1	10%	0.102	25%	0.254	C	S	.	.	S	Bend	trans	-111	148.2	-171.8	-49.6	-50.8	0	0	0	111.1	G126 K127 W133 L134 Y153 D180 I186	G126-Y129 PolarHBondContact O-N 2.85Å; G126-Y129 VanDerWaalsContact O-N 3.1Å; K127-Y129 PolarHBondContact O-N 2.92Å; Y129-W133 HydrophobicContact CD1-CE3 4.42Å; Y129-W133 AromaticContact CD1-CZ3 3.81Å; Y129-W133 HydrophobicContact CD1-CZ3 3.81Å; Y129-W133 HydrophobicContact CD2-CZ3 4.41Å; Y129-W133 HydrophobicContact CE1-CZ3 4.47Å; Y129-W133 HydrophobicContact CG-CE3 4.25Å; Y129-W133 AromaticContact CG-CZ3 3.8Å; Y129-W133 HydrophobicContact CG-CZ3 3.8Å; Y129-L134 HydrophobicContact CD2-CD1 3.91Å; Y129-L134 HydrophobicContact CD2-CD2 4.45Å; Y129-L134 HydrophobicContact CG-CD1 4.48Å; Y129-Y153 PolarHBondContact O-OH 3.36Å; Y129-D180 HydrophobicContact CE1-CB 4.41Å; Y129-D180 WeakPolarHBondContact CE1-OD1 3.48Å; Y129-D180 PolarHBondContact OH-OD2 3.4Å; Y129-I186 HydrophobicContact CD2-CD1 4.19Å; Y129-I186 HydrophobicContact CE2-CD1 3.77Å; Y129-I186 HydrophobicContact CE2-CG1 4.14Å
130	D	84.9	Confident	84.2	Confident	99 Å²	99	53.9 Å²	53.9	53%	0.529	27%	0.27	S	S	.	.			trans	-65	148.4	170.1	167.8	60	0	0	0	111.2	A132 W133 L134	D130-A132 WeakPolarHBondContact OD2-CA 3.33Å; D130-A132 WeakPolarHBondContact OD2-CB 3.43Å; D130-A132 PolarHBondContact OD2-N 3.42Å; D130-W133 HydrophobicContact CB-CB 4.12Å; D130-W133 PolarHBondContact OD2-N 3.05Å; D130-L134 WeakPolarHBondContact O-CB 3.04Å; D130-L134 PolarHBondContact O-N 2.97Å
131	K	83.8	Confident	83.9	Confident	99 Å²	99	57.2 Å²	57.2	43%	0.43	29%	0.285	S	S	.	.	H	α-helix	trans	-63.6	-47.4	-178.1	175.9	175.3	178.5	179.5	0	111.8	L135 F151 Y153	K131-L135 HydrophobicContact CG-CD1 3.82Å; K131-L135 WeakPolarHBondContact O-CB 3.29Å; K131-L135 VanDerWaalsContact O-CG 3.26Å; K131-L135 WeakPolarHBondContact O-CG 3.39Å; K131-L135 PolarHBondContact O-N 2.6Å; K131-L135 VanDerWaalsContact O-N 3.08Å; K131-F151 HydrophobicContact CB-CE1 4.01Å; K131-F151 HydrophobicContact CB-CZ 4.39Å; K131-F151 HydrophobicContact CD-CD1 3.59Å; K131-F151 HydrophobicContact CD-CE1 3.82Å; K131-F151 HydrophobicContact CD-CG 4.31Å; K131-F151 HydrophobicContact CG-CD1 3.83Å; K131-F151 HydrophobicContact CG-CE1 3.61Å; K131-F151 HydrophobicContact CG-CG 4.46Å; K131-F151 HydrophobicContact CG-CZ 4.04Å; K131-Y153 WeakPolarHBondContact CA-OH 3.36Å; K131-Y153 PolarHBondContact N-OH 3.49Å
132	A	84.1	Confident	83.7	Confident	66 Å²	66	57.8 Å²	57.8	55%	0.545	29%	0.289	S	S	.	.	H	α-helix	trans	-71	-40.9	-177.2	0	0	0	0	0	111	D130 S136	D130-A132 WeakPolarHBondContact OD2-CA 3.33Å; D130-A132 WeakPolarHBondContact OD2-CB 3.43Å; D130-A132 PolarHBondContact OD2-N 3.42Å; A132-S136 VanDerWaalsContact O-CB 3.3Å; A132-S136 WeakPolarHBondContact O-CB 3.34Å; A132-S136 PolarHBondContact O-N 2.85Å; A132-S136 PolarHBondContact O-OG 3.28Å
133	W	87.1	Confident	83.2	Confident	66 Å²	66	62.5 Å²	62.5	25%	0.25	32%	0.322	C	S	.	.	H	α-helix	trans	-61.7	-47.6	173.2	-176.9	82	0	0	0	112.4	Y129 D130 L135 S136 M137 I186	Y129-W133 HydrophobicContact CD1-CE3 4.42Å; Y129-W133 AromaticContact CD1-CZ3 3.81Å; Y129-W133 HydrophobicContact CD1-CZ3 3.81Å; Y129-W133 HydrophobicContact CD2-CZ3 4.41Å; Y129-W133 HydrophobicContact CE1-CZ3 4.47Å; Y129-W133 HydrophobicContact CG-CE3 4.25Å; Y129-W133 AromaticContact CG-CZ3 3.8Å; Y129-W133 HydrophobicContact CG-CZ3 3.8Å; D130-W133 HydrophobicContact CB-CB 4.12Å; D130-W133 PolarHBondContact OD2-N 3.05Å; W133-L135 PolarHBondContact O-N 3.04Å; W133-S136 PolarHBondContact O-N 2.92Å; W133-S136 PolarHBondContact O-OG 3.25Å; W133-S136 VanDerWaalsContact O-OG 3.09Å; W133-M137 HydrophobicContact CD2-CG 3.96Å; W133-M137 HydrophobicContact CE3-CG 4.43Å; W133-M137 HydrophobicContact CG-CG 4.41Å; W133-M137 HydrophobicContact CH2-CG 4.27Å; W133-M137 HydrophobicContact CZ2-CG 3.74Å; W133-M137 HydrophobicContact CZ2-SD 4.45Å; W133-M137 WeakPolarHBondContact O-CB 3.38Å; W133-M137 VanDerWaalsContact O-CG 3.27Å; W133-M137 WeakPolarHBondContact O-CG 3.39Å; W133-M137 PolarHBondContact O-N 3.26Å; W133-I186 HydrophobicContact CH2-CD1 4.26Å; W133-I186 HydrophobicContact CZ3-CD1 4.17Å
134	L	84.1	Confident	82.9	Confident	0 Å²	0	64.4 Å²	64.4	0%	0	33%	0.334	C	S	.	.	H	α-helix	trans	-64	-44.4	-177.8	-175.4	60.3	0	0	0	111.4	I123 Y129 D130 I138 F151 A158 I186	I123-L134 HydrophobicContact CD1-CD1 4.32Å; I123-L134 HydrophobicContact CD1-CD2 3.89Å; I123-L134 HydrophobicContact CD1-CG 4.18Å; Y129-L134 HydrophobicContact CD2-CD1 3.91Å; Y129-L134 HydrophobicContact CD2-CD2 4.45Å; Y129-L134 HydrophobicContact CG-CD1 4.48Å; D130-L134 WeakPolarHBondContact O-CB 3.04Å; D130-L134 PolarHBondContact O-N 2.97Å; L134-I138 HydrophobicContact CD1-CD1 4.19Å; L134-I138 HydrophobicContact CG-CD1 4.06Å; L134-I138 WeakPolarHBondContact O-CD1 3.5Å; L134-I138 WeakPolarHBondContact O-CG1 3.45Å; L134-I138 PolarHBondContact O-N 3.17Å; L134-I138 VanDerWaalsContact O-N 3.09Å; L134-F151 HydrophobicContact CD2-CZ 4.45Å; L134-A158 HydrophobicContact CD2-CB 3.92Å; L134-I186 HydrophobicContact CD1-CD1 4.12Å
135	L	84.9	Confident	82.7	Confident	27 Å²	27	68.4 Å²	68.4	14%	0.141	36%	0.36	C	S	.	.	H	α-helix	trans	-68.8	-42.8	179.7	-69.2	172.1	0	0	0	112.4	K131 W133 I138 Q139 F146 P148 F151 F160	K131-L135 HydrophobicContact CG-CD1 3.82Å; K131-L135 WeakPolarHBondContact O-CB 3.29Å; K131-L135 VanDerWaalsContact O-CG 3.26Å; K131-L135 WeakPolarHBondContact O-CG 3.39Å; K131-L135 PolarHBondContact O-N 2.6Å; K131-L135 VanDerWaalsContact O-N 3.08Å; W133-L135 PolarHBondContact O-N 3.04Å; L135-I138 PolarHBondContact O-N 2.86Å; L135-Q139 WeakPolarHBondContact O-CB 3.36Å; L135-Q139 PolarHBondContact O-N 3.38Å; L135-F146 HydrophobicContact CD2-CE2 4.09Å; L135-F146 HydrophobicContact CD2-CZ 4.22Å; L135-P148 HydrophobicContact CD1-CG 3.81Å; L135-P148 HydrophobicContact CD2-CB 3.86Å; L135-P148 HydrophobicContact CD2-CG 3.8Å; L135-P148 HydrophobicContact CG-CG 4.42Å; L135-F151 HydrophobicContact CD1-CD2 4.18Å; L135-F151 HydrophobicContact CD1-CE2 4.35Å; L135-F151 HydrophobicContact CD2-CD2 3.96Å; L135-F151 HydrophobicContact CD2-CE2 3.95Å; L135-F151 HydrophobicContact CG-CD2 4.33Å; L135-F151 HydrophobicContact CG-CE2 4.14Å; L135-F160 HydrophobicContact CD2-CE1 4.39Å
136	S	82.9	Confident	82.7	Confident	69 Å²	69	62.4 Å²	62.4	48%	0.483	34%	0.337	S	S	.	.	H	α-helix	trans	-65.5	-39.7	176.5	55.1	0	0	0	0	112.5	A132 W133 I138 Q139 S140	A132-S136 VanDerWaalsContact O-CB 3.3Å; A132-S136 WeakPolarHBondContact O-CB 3.34Å; A132-S136 PolarHBondContact O-N 2.85Å; A132-S136 PolarHBondContact O-OG 3.28Å; W133-S136 PolarHBondContact O-N 2.92Å; W133-S136 PolarHBondContact O-OG 3.25Å; W133-S136 VanDerWaalsContact O-OG 3.09Å; S136-I138 PolarHBondContact O-N 3.2Å; S136-Q139 PolarHBondContact O-N 2.65Å; S136-S140 WeakPolarHBondContact O-CB 3.28Å; S136-S140 PolarHBondContact O-N 3.19Å
137	M	82.8	Confident	82.6	Confident	54 Å²	54	68.3 Å²	68.3	27%	0.266	37%	0.368	S	S	.	.	H	α-helix	trans	-62.7	-41.2	173.9	-75	-59.1	-58.2	0	0	112.5	W133 S140 I178	W133-M137 HydrophobicContact CD2-CG 3.96Å; W133-M137 HydrophobicContact CE3-CG 4.43Å; W133-M137 HydrophobicContact CG-CG 4.41Å; W133-M137 HydrophobicContact CH2-CG 4.27Å; W133-M137 HydrophobicContact CZ2-CG 3.74Å; W133-M137 HydrophobicContact CZ2-SD 4.45Å; W133-M137 WeakPolarHBondContact O-CB 3.38Å; W133-M137 VanDerWaalsContact O-CG 3.27Å; W133-M137 WeakPolarHBondContact O-CG 3.39Å; W133-M137 PolarHBondContact O-N 3.26Å; M137-S140 PolarHBondContact O-N 3.08Å; M137-S140 PolarHBondContact O-OG 3.44Å; M137-I178 HydrophobicContact CB-CG2 4.18Å; M137-I178 HydrophobicContact CE-CG2 4.01Å
138	I	84.6	Confident	82.5	Confident	1 Å²	1	64 Å²	64	1%	0.005	35%	0.353	C	S	.	.	H	α-helix	trans	-65.4	-45.5	174.3	-63.8	161.1	0	0	0	110.5	I123 L134 L135 S136 S140 K141 C142 F146 L171 V174 I178 I188	I123-I138 HydrophobicContact CD1-CD1 3.55Å; L134-I138 HydrophobicContact CD1-CD1 4.19Å; L134-I138 HydrophobicContact CG-CD1 4.06Å; L134-I138 WeakPolarHBondContact O-CD1 3.5Å; L134-I138 WeakPolarHBondContact O-CG1 3.45Å; L134-I138 PolarHBondContact O-N 3.17Å; L134-I138 VanDerWaalsContact O-N 3.09Å; L135-I138 PolarHBondContact O-N 2.86Å; S136-I138 PolarHBondContact O-N 3.2Å; I138-S140 VanDerWaalsContact C-N 3.27Å; I138-S140 PolarHBondContact O-N 2.85Å; I138-K141 PolarHBondContact O-N 3.08Å; I138-K141 VanDerWaalsContact O-N 3.11Å; I138-C142 WeakPolarHBondContact O-CB 3.41Å; I138-C142 PolarHBondContact O-N 3.01Å; I138-F146 HydrophobicContact CB-CE1 4.24Å; I138-F146 HydrophobicContact CB-CZ 4.02Å; I138-F146 HydrophobicContact CG2-CE1 3.64Å; I138-F146 HydrophobicContact CG2-CZ 3.59Å; I138-L171 HydrophobicContact CG2-CD2 3.41Å; I138-L171 VanDerWaalsContact CG2-CD2 3.41Å; I138-V174 HydrophobicContact CG2-CG1 4.47Å; I138-I178 HydrophobicContact CB-CD1 4.09Å; I138-I178 HydrophobicContact CG1-CD1 3.42Å; I138-I178 VanDerWaalsContact CG1-CD1 3.42Å; I138-I188 HydrophobicContact CG1-CD1 4.34Å
139	Q	85.1	Confident	82.3	Confident	65 Å²	65	59.6 Å²	59.6	30%	0.304	34%	0.335	S	S	.	.	H	α-helix	trans	-64.1	-31.7	179.5	-170.4	57.6	85.2	0	0	112.7	L135 S136 K141 V144 F146	L135-Q139 WeakPolarHBondContact O-CB 3.36Å; L135-Q139 PolarHBondContact O-N 3.38Å; S136-Q139 PolarHBondContact O-N 2.65Å; Q139-K141 PolarHBondContact O-N 2.81Å; Q139-V144 PolarHBondContact NE2-O 3.47Å; Q139-F146 HydrophobicContact CB-CE1 4.01Å
140	S	83.1	Confident	82	Confident	69 Å²	69	61.8 Å²	61.8	48%	0.483	35%	0.346	S	S	.	.	T	Hydrogen-bonded Turn	trans	-67.8	-12.3	175.7	81.1	0	0	0	0	114.9	S136 M137 I138	S136-S140 WeakPolarHBondContact O-CB 3.28Å; S136-S140 PolarHBondContact O-N 3.19Å; M137-S140 PolarHBondContact O-N 3.08Å; M137-S140 PolarHBondContact O-OG 3.44Å; I138-S140 VanDerWaalsContact C-N 3.27Å; I138-S140 PolarHBondContact O-N 2.85Å
141	K	80.9	Confident	81.9	Confident	126 Å²	126	58.3 Å²	58.3	55%	0.548	33%	0.327	S	S	.	.	T	Hydrogen-bonded Turn	trans	-124.2	-12.6	-179.8	-59.3	-59.8	166.6	-161.6	0	113.9	I138 Q139 V174 I178	I138-K141 PolarHBondContact O-N 3.08Å; I138-K141 VanDerWaalsContact O-N 3.11Å; Q139-K141 PolarHBondContact O-N 2.81Å; K141-V174 HydrophobicContact CB-CG1 3.98Å; K141-V174 HydrophobicContact CB-CG2 4.47Å; K141-V174 WeakPolarHBondContact O-CG2 3.46Å; K141-I178 HydrophobicContact CG-CG1 4.47Å
142	C	83	Confident	81.9	Confident	13 Å²	13	56.6 Å²	56.6	9%	0.088	32%	0.32	C	S	.	.			trans	-77.3	132.8	170.6	-166.8	0	0	0	0	110	I138 V144 F146 L171 V174	I138-C142 WeakPolarHBondContact O-CB 3.41Å; I138-C142 PolarHBondContact O-N 3.01Å; C142-V144 PolarHBondContact O-N 3.46Å; C142-V144 PolarHBondContact SG-O 2.87Å; C142-F146 HydrophobicContact CB-CD1 4.45Å; C142-L171 HydrophobicContact CB-CD2 4.1Å; C142-V174 HydrophobicContact CB-CG2 3.96Å
143	S	76.4	Confident	81.9	Confident	108 Å²	108	57.4 Å²	57.4	76%	0.755	31%	0.309	S	S	*	.	S	Bend	trans	-76	-4.6	176.1	55.4	0	0	0	0	113.9
144	V	82.1	Confident	81.5	Confident	39 Å²	39	58.4 Å²	58.4	24%	0.236	32%	0.317	C	S	.	.	S	Bend	trans	-128.3	135.8	-177	-176.3	0	0	0	0	108.6	Q139 C142 F146 A170	Q139-V144 PolarHBondContact NE2-O 3.47Å; C142-V144 PolarHBondContact O-N 3.46Å; C142-V144 PolarHBondContact SG-O 2.87Å; V144-F146 PolarHBondContact O-N 3.38Å; V144-A170 HydrophobicContact CB-CB 4.09Å; V144-A170 HydrophobicContact CG2-CB 3.67Å
145	P	78.8	Confident	81.5	Confident	110 Å²	110	64.6 Å²	64.6	71%	0.714	35%	0.35	S	S	*	.			trans	-66.8	128.6	169.6	28.2	-33.4	0	0	0	110.2
146	F	80.6	Confident	81.4	Confident	21 Å²	21	66.9 Å²	66.9	9%	0.092	37%	0.365	C	S	.	.			trans	-125.4	140.3	-179.1	75.2	-81.3	0	0	0	112.1	L135 I138 Q139 C142 V144 P148 F160 V162 T167 L171	L135-F146 HydrophobicContact CD2-CE2 4.09Å; L135-F146 HydrophobicContact CD2-CZ 4.22Å; I138-F146 HydrophobicContact CB-CE1 4.24Å; I138-F146 HydrophobicContact CB-CZ 4.02Å; I138-F146 HydrophobicContact CG2-CE1 3.64Å; I138-F146 HydrophobicContact CG2-CZ 3.59Å; Q139-F146 HydrophobicContact CB-CE1 4.01Å; C142-F146 HydrophobicContact CB-CD1 4.45Å; V144-F146 PolarHBondContact O-N 3.38Å; F146-P148 HydrophobicContact CD2-CB 4.41Å; F146-P148 HydrophobicContact CE2-CB 4.11Å; F146-P148 HydrophobicContact CE2-CG 4.42Å; F146-F160 AromaticContact CD2-CE2 3.8Å; F146-F160 HydrophobicContact CD2-CE2 3.8Å; F146-F160 HydrophobicContact CD2-CZ 4.36Å; F146-F160 HydrophobicContact CE2-CD2 4.47Å; F146-F160 AromaticContact CE2-CE2 3.49Å; F146-F160 HydrophobicContact CE2-CE2 3.49Å; F146-F160 VanDerWaalsContact CE2-CE2 3.49Å; F146-F160 AromaticContact CE2-CZ 3.65Å; F146-F160 HydrophobicContact CE2-CZ 3.65Å; F146-F160 HydrophobicContact CZ-CZ 4.37Å; F146-V162 HydrophobicContact CD2-CG1 4.49Å; F146-T167 HydrophobicContact CB-CG2 3.53Å; F146-L171 HydrophobicContact CB-CD1 4.18Å; F146-L171 HydrophobicContact CD1-CD1 4.39Å; F146-L171 HydrophobicContact CD1-CD2 3.86Å; F146-L171 HydrophobicContact CD2-CD1 4.01Å; F146-L171 HydrophobicContact CE1-CD2 3.87Å; F146-L171 HydrophobicContact CG-CD1 3.93Å; F146-L171 HydrophobicContact CG-CD2 4.23Å; F146-L171 HydrophobicContact CZ-CD2 4.22Å
147	N	78.9	Confident	81.6	Confident	124 Å²	124	69.5 Å²	69.5	66%	0.663	36%	0.364	S	S	*	.			trans	-100.1	113.6	172.9	-171.4	12.7	0	0	0	109.8	I149	N147-I149 PolarHBondContact O-N 2.94Å
148	P	81	Confident	81.7	Confident	32 Å²	32	66.9 Å²	66.9	21%	0.208	35%	0.352	C	S	.	.			trans	-79.7	98.5	-176.4	30.5	-34.4	0	0	0	112.3	L135 F146 F160	L135-P148 HydrophobicContact CD1-CG 3.81Å; L135-P148 HydrophobicContact CD2-CB 3.86Å; L135-P148 HydrophobicContact CD2-CG 3.8Å; L135-P148 HydrophobicContact CG-CG 4.42Å; F146-P148 HydrophobicContact CD2-CB 4.41Å; F146-P148 HydrophobicContact CE2-CB 4.11Å; F146-P148 HydrophobicContact CE2-CG 4.42Å; P148-F160 HydrophobicContact CB-CB 4.08Å; P148-F160 HydrophobicContact CB-CD2 3.5Å; P148-F160 HydrophobicContact CB-CE2 3.97Å; P148-F160 HydrophobicContact CB-CG 3.84Å
149	I	77.8	Confident	81.9	Confident	38 Å²	38	67 Å²	67	20%	0.195	35%	0.352	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-76.9	139.9	-178.5	-64.2	169.7	0	0	0	110.7	W118 N147 F151 F160 F161 P196 V199	W118-I149 HydrophobicContact CH2-CD1 3.71Å; W118-I149 HydrophobicContact CZ3-CD1 3.72Å; W118-I149 HydrophobicContact CZ3-CG2 4.47Å; N147-I149 PolarHBondContact O-N 2.94Å; I149-F151 VanDerWaalsContact C-N 3.3Å; I149-F151 PolarHBondContact O-N 2.89Å; I149-F160 WeakPolarHBondContact O-CA 3.46Å; I149-F161 HydrophobicContact CB-CB 4.49Å; I149-F161 PolarHBondContact N-O 3.48Å; I149-F161 PolarHBondContact O-N 3.5Å; I149-P196 HydrophobicContact CG2-CB 4.47Å; I149-P196 HydrophobicContact CG2-CG 4.03Å; I149-V199 HydrophobicContact CG2-CG2 3.91Å
150	E	75.4	Confident	82	Confident	72 Å²	72	64 Å²	64	34%	0.336	34%	0.338	S	S	.	.	E	Extended strand (participates in β ladder)	trans	51.4	40.2	177.5	-149.9	174.8	115.4	0	0	114	H152 F161 P196 R197 S198	E150-H152 PolarHBondContact O-N 3.32Å; E150-H152 PolarHBondContact O-ND1 2.89Å; E150-F161 HydrophobicContact CB-CD2 4.06Å; E150-F161 HydrophobicContact CB-CE2 4.32Å; E150-P196 HydrophobicContact CB-CB 4.36Å; E150-P196 VanDerWaalsContact OE2-CB 3.27Å; E150-P196 WeakPolarHBondContact OE2-CB 3.48Å; E150-R197 PolarHBondContact OE2-N 3.36Å; E150-S198 VanDerWaalsContact OE2-CB 3.27Å; E150-S198 WeakPolarHBondContact OE2-CB 3.48Å; E150-S198 PolarHBondContact OE2-N 3.19Å; E150-S198 PolarHBondContact OE2-OG 3.28Å
151	F	82.3	Confident	82.1	Confident	26 Å²	26	61.6 Å²	61.6	11%	0.114	32%	0.319	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-62.3	119.8	180	-176	-75.2	0	0	0	112.5	K131 L134 L135 I149 Y153 A158 Q159 F160	K131-F151 HydrophobicContact CB-CE1 4.01Å; K131-F151 HydrophobicContact CB-CZ 4.39Å; K131-F151 HydrophobicContact CD-CD1 3.59Å; K131-F151 HydrophobicContact CD-CE1 3.82Å; K131-F151 HydrophobicContact CD-CG 4.31Å; K131-F151 HydrophobicContact CG-CD1 3.83Å; K131-F151 HydrophobicContact CG-CE1 3.61Å; K131-F151 HydrophobicContact CG-CG 4.46Å; K131-F151 HydrophobicContact CG-CZ 4.04Å; L134-F151 HydrophobicContact CD2-CZ 4.45Å; L135-F151 HydrophobicContact CD1-CD2 4.18Å; L135-F151 HydrophobicContact CD1-CE2 4.35Å; L135-F151 HydrophobicContact CD2-CD2 3.96Å; L135-F151 HydrophobicContact CD2-CE2 3.95Å; L135-F151 HydrophobicContact CG-CD2 4.33Å; L135-F151 HydrophobicContact CG-CE2 4.14Å; I149-F151 VanDerWaalsContact C-N 3.3Å; I149-F151 PolarHBondContact O-N 2.89Å; F151-Y153 AromaticContact CE1-CE1 3.97Å; F151-Y153 HydrophobicContact CE1-CE1 3.97Å; F151-Y153 HydrophobicContact CE1-CE2 4.01Å; F151-Y153 AromaticContact CE1-CZ 3.67Å; F151-Y153 HydrophobicContact CZ-CE1 4.03Å; F151-A158 HydrophobicContact CE2-CB 4.29Å; F151-A158 HydrophobicContact CZ-CB 3.92Å; F151-Q159 CarbonylContact C-O 3.43Å; F151-Q159 VanDerWaalsContact CA-O 3.3Å; F151-Q159 WeakPolarHBondContact CA-O 3.22Å; F151-F160 HydrophobicContact CB-CB 4Å; F151-F160 HydrophobicContact CD2-CB 3.89Å; F151-F160 AromaticContact CD2-CD1 3.73Å; F151-F160 HydrophobicContact CD2-CD1 3.73Å; F151-F160 HydrophobicContact CD2-CG 4.09Å; F151-F160 HydrophobicContact CE2-CD1 4.04Å; F151-F160 HydrophobicContact CG-CB 4.35Å
152	H	83.1	Confident	82.3	Confident	62 Å²	62	55.8 Å²	55.8	29%	0.287	29%	0.294	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-144.9	169.5	179.8	63.4	-83.1	0	0	0	112.7	E150 Q159	E150-H152 PolarHBondContact O-N 3.32Å; E150-H152 PolarHBondContact O-ND1 2.89Å; H152-Q159 PolarHBondContact N-O 3.34Å; H152-Q159 PolarHBondContact NE2-OE1 2.89Å; H152-Q159 PolarHBondContact O-N 2.83Å
153	Y	84.8	Confident	81.8	Confident	83 Å²	83	58.5 Å²	58.5	33%	0.325	31%	0.305	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-111.8	110.4	175.8	-64.2	-70.3	0	0	0	111	K127 Y129 K131 F151 R157 A158	K127-Y153 HydrophobicContact CB-CD1 3.85Å; K127-Y153 HydrophobicContact CB-CE1 4.44Å; K127-Y153 HydrophobicContact CB-CG 4.37Å; K127-Y153 HydrophobicContact CG-CD1 4.1Å; K127-Y153 HydrophobicContact CG-CG 4.15Å; Y129-Y153 PolarHBondContact O-OH 3.36Å; K131-Y153 WeakPolarHBondContact CA-OH 3.36Å; K131-Y153 PolarHBondContact N-OH 3.49Å; F151-Y153 AromaticContact CE1-CE1 3.97Å; F151-Y153 HydrophobicContact CE1-CE1 3.97Å; F151-Y153 HydrophobicContact CE1-CE2 4.01Å; F151-Y153 AromaticContact CE1-CZ 3.67Å; F151-Y153 HydrophobicContact CZ-CE1 4.03Å; Y153-R157 CarbonylContact C-O 3.54Å; Y153-R157 WeakPolarHBondContact CA-O 3.33Å; Y153-A158 HydrophobicContact CD1-CB 3.77Å; Y153-A158 HydrophobicContact CE1-CB 3.7Å
154	E	78.4	Confident	82	Confident	87 Å²	87	56.1 Å²	56.1	41%	0.407	28%	0.284	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-101.7	117.8	176.2	-172.6	-174.4	-122.9	0	0	110	T156 R157 Q159	E154-T156 PolarHBondContact O-N 3.03Å; E154-R157 PolarHBondContact N-O 3.22Å; E154-R157 PolarHBondContact O-N 2.87Å; E154-Q159 PolarHBondContact OE2-NE2 2.97Å
155	N	83.9	Confident	81.8	Confident	131 Å²	131	56.1 Å²	56.1	70%	0.701	29%	0.288	S	S	*	.	T	Hydrogen-bonded Turn	trans	54.8	-96.6	-176.2	-65.5	-54.2	0	0	0	113.1	K127	K127-N155 WeakPolarHBondContact CD-O 3.29Å; K127-N155 PolarHBondContact NZ-O 3.47Å
156	T	83.1	Confident	82	Confident	75 Å²	75	55.2 Å²	55.2	46%	0.46	28%	0.281	S	S	.	.	T	Hydrogen-bonded Turn	trans	-110.9	-7	175.9	57.1	0	0	0	0	113.5	Y125 G126 K127 E154	Y125-T156 CarbonylContact C-O 3.31Å; Y125-T156 WeakPolarHBondContact CA-O 3.38Å; Y125-T156 PolarHBondContact N-O 3.29Å; G126-T156 PolarHBondContact N-O 3.16Å; K127-T156 WeakPolarHBondContact CB-O 3.23Å; K127-T156 PolarHBondContact N-O 3.24Å; K127-T156 VanDerWaalsContact N-O 3.15Å; E154-T156 PolarHBondContact O-N 3.03Å
157	R	86.9	Confident	82.1	Confident	123 Å²	123	55 Å²	55	46%	0.464	28%	0.282	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-100.1	148.2	-169.8	-50.8	-176.5	179.3	171.8	-1.5	110.6	T122 I123 Y153 E154 Q159	T122-R157 HydrophobicContact CG2-CB 4.25Å; I123-R157 VanDerWaalsContact O-CA 3.3Å; I123-R157 WeakPolarHBondContact O-CA 3.24Å; Y153-R157 CarbonylContact C-O 3.54Å; Y153-R157 WeakPolarHBondContact CA-O 3.33Å; E154-R157 PolarHBondContact N-O 3.22Å; E154-R157 PolarHBondContact O-N 2.87Å; R157-Q159 HydrophobicContact CB-CG 4.49Å
158	A	86.4	Confident	82.2	Confident	0 Å²	0	49.4 Å²	49.4	0%	0	25%	0.252	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-93.8	141.8	162.2	0	0	0	0	0	109	I123 L134 F151 Y153	I123-A158 HydrophobicContact CB-CB 4.29Å; I123-A158 PolarHBondContact N-O 2.85Å; I123-A158 PolarHBondContact O-N 2.87Å; L134-A158 HydrophobicContact CD2-CB 3.92Å; F151-A158 HydrophobicContact CE2-CB 4.29Å; F151-A158 HydrophobicContact CZ-CB 3.92Å; Y153-A158 HydrophobicContact CD1-CB 3.77Å; Y153-A158 HydrophobicContact CE1-CB 3.7Å
159	Q	88.6	Confident	82.2	Confident	3 Å²	3	51.4 Å²	51.4	1%	0.014	27%	0.267	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-141.2	141.6	-176.6	-61.7	-177.3	13	0	0	110.8	I121 T122 F151 H152 E154 R157	I121-Q159 VanDerWaalsContact O-CA 3.31Å; I121-Q159 WeakPolarHBondContact O-CA 3.48Å; T122-Q159 HydrophobicContact CG2-CG 4.19Å; F151-Q159 CarbonylContact C-O 3.43Å; F151-Q159 VanDerWaalsContact CA-O 3.3Å; F151-Q159 WeakPolarHBondContact CA-O 3.22Å; H152-Q159 PolarHBondContact N-O 3.34Å; H152-Q159 PolarHBondContact NE2-OE1 2.89Å; H152-Q159 PolarHBondContact O-N 2.83Å; E154-Q159 PolarHBondContact OE2-NE2 2.97Å; R157-Q159 HydrophobicContact CB-CG 4.49Å
160	F	87.1	Confident	82.5	Confident	1 Å²	1	50.1 Å²	50.1	0%	0.004	26%	0.262	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-157.5	173.2	173.2	63.4	-86.3	0	0	0	109.7	I121 I123 L135 F146 P148 I149 F151 V162	I121-F160 HydrophobicContact CB-CD1 4.39Å; I121-F160 HydrophobicContact CB-CD2 4.31Å; I121-F160 HydrophobicContact CB-CE1 4.19Å; I121-F160 HydrophobicContact CB-CE2 4.13Å; I121-F160 HydrophobicContact CB-CG 4.46Å; I121-F160 HydrophobicContact CB-CZ 4.07Å; I121-F160 HydrophobicContact CD1-CD2 4.18Å; I121-F160 HydrophobicContact CD1-CE2 3.53Å; I121-F160 HydrophobicContact CD1-CZ 3.92Å; I121-F160 HydrophobicContact CG1-CE2 4.35Å; I121-F160 HydrophobicContact CG2-CD1 4.36Å; I121-F160 HydrophobicContact CG2-CE1 3.75Å; I121-F160 HydrophobicContact CG2-CE2 4.27Å; I121-F160 HydrophobicContact CG2-CZ 3.71Å; I121-F160 PolarHBondContact N-O 3.46Å; I121-F160 PolarHBondContact O-N 2.85Å; I121-F160 VanDerWaalsContact O-N 3.13Å; I123-F160 HydrophobicContact CD1-CE1 4.12Å; L135-F160 HydrophobicContact CD2-CE1 4.39Å; F146-F160 AromaticContact CD2-CE2 3.8Å; F146-F160 HydrophobicContact CD2-CE2 3.8Å; F146-F160 HydrophobicContact CD2-CZ 4.36Å; F146-F160 HydrophobicContact CE2-CD2 4.47Å; F146-F160 AromaticContact CE2-CE2 3.49Å; F146-F160 HydrophobicContact CE2-CE2 3.49Å; F146-F160 VanDerWaalsContact CE2-CE2 3.49Å; F146-F160 AromaticContact CE2-CZ 3.65Å; F146-F160 HydrophobicContact CE2-CZ 3.65Å; F146-F160 HydrophobicContact CZ-CZ 4.37Å; P148-F160 HydrophobicContact CB-CB 4.08Å; P148-F160 HydrophobicContact CB-CD2 3.5Å; P148-F160 HydrophobicContact CB-CE2 3.97Å; P148-F160 HydrophobicContact CB-CG 3.84Å; I149-F160 WeakPolarHBondContact O-CA 3.46Å; F151-F160 HydrophobicContact CB-CB 4Å; F151-F160 HydrophobicContact CD2-CB 3.89Å; F151-F160 AromaticContact CD2-CD1 3.73Å; F151-F160 HydrophobicContact CD2-CD1 3.73Å; F151-F160 HydrophobicContact CD2-CG 4.09Å; F151-F160 HydrophobicContact CE2-CD1 4.04Å; F151-F160 HydrophobicContact CG-CB 4.35Å; F160-V162 HydrophobicContact CD2-CG1 4.46Å; F160-V162 HydrophobicContact CE2-CG1 4.27Å
161	F	84.7	Confident	82.8	Confident	19 Å²	19	46.8 Å²	46.8	8%	0.083	25%	0.246	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-124	155	-177.4	-59.1	-99.8	0	0	0	111.9	W118 F119 K120 I149 E150 P196	W118-F161 HydrophobicContact CE3-CB 4.24Å; W118-F161 HydrophobicContact CZ3-CB 4.42Å; F119-F161 WeakPolarHBondContact O-CA 3.38Å; K120-F161 HydrophobicContact CB-CD1 3.8Å; K120-F161 HydrophobicContact CB-CE1 3.63Å; K120-F161 HydrophobicContact CD-CE1 3.8Å; K120-F161 HydrophobicContact CD-CZ 3.93Å; K120-F161 HydrophobicContact CG-CD1 4.13Å; K120-F161 HydrophobicContact CG-CE1 3.7Å; K120-F161 HydrophobicContact CG-CZ 4.11Å; I149-F161 HydrophobicContact CB-CB 4.49Å; I149-F161 PolarHBondContact N-O 3.48Å; I149-F161 PolarHBondContact O-N 3.5Å; E150-F161 HydrophobicContact CB-CD2 4.06Å; E150-F161 HydrophobicContact CB-CE2 4.32Å; F161-P196 HydrophobicContact CB-CG 3.66Å; F161-P196 HydrophobicContact CD1-CG 4.03Å; F161-P196 HydrophobicContact CD2-CB 4.19Å; F161-P196 HydrophobicContact CD2-CG 3.84Å; F161-P196 HydrophobicContact CE2-CB 4.39Å; F161-P196 HydrophobicContact CE2-CG 4.42Å; F161-P196 HydrophobicContact CG-CB 4.42Å; F161-P196 HydrophobicContact CG-CG 3.61Å
162	V	84.9	Confident	82.8	Confident	4 Å²	4	52.7 Å²	52.7	2%	0.024	27%	0.272	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-133.1	150.8	168.6	-63.7	0	0	0	0	110.4	F119 I121 F146 F160 T167 A168 L171	F119-V162 HydrophobicContact CB-CG2 4.01Å; F119-V162 PolarHBondContact N-O 3.02Å; F119-V162 PolarHBondContact O-N 2.98Å; F119-V162 VanDerWaalsContact O-N 3.08Å; I121-V162 HydrophobicContact CD1-CG1 3.92Å; I121-V162 HydrophobicContact CD1-CG2 3.83Å; I121-V162 HydrophobicContact CG1-CG2 4.49Å; F146-V162 HydrophobicContact CD2-CG1 4.49Å; F160-V162 HydrophobicContact CD2-CG1 4.46Å; F160-V162 HydrophobicContact CE2-CG1 4.27Å; V162-T167 HydrophobicContact CB-CG2 4.24Å; V162-T167 HydrophobicContact CG1-CG2 4.11Å; V162-T167 HydrophobicContact CG2-CG2 4.45Å; V162-A168 HydrophobicContact CG2-CB 4.09Å; V162-L171 HydrophobicContact CG1-CD1 4.14Å
163	E	72.4	Confident	82.8	Confident	70 Å²	70	52.3 Å²	52.3	33%	0.327	28%	0.28	S	S	.	.	S	Bend	trans	-93.6	-4.5	-170.4	-172	165.1	-164.1	0	0	113.8	K116 N117 W118	K116-E163 HydrophobicContact CB-CG 4.34Å; K116-E163 HydrophobicContact CD-CG 4.33Å; K116-E163 VanDerWaalsContact CD-OE1 3.26Å; K116-E163 WeakPolarHBondContact CD-OE1 3.36Å; K116-E163 VanDerWaalsContact CE-OE1 3.31Å; K116-E163 WeakPolarHBondContact CE-OE1 3.42Å; K116-E163 IonicContact NZ-OE1 3.33Å; K116-E163 PolarHBondContact NZ-OE1 2.93Å; N117-E163 CarbonylContact O-C 3.58Å; W118-E163 HydrophobicContact CD2-CB 4.42Å; W118-E163 HydrophobicContact CD2-CG 4.49Å; W118-E163 HydrophobicContact CE3-CB 4.22Å; W118-E163 HydrophobicContact CH2-CB 3.59Å; W118-E163 HydrophobicContact CH2-CG 3.72Å; W118-E163 HydrophobicContact CZ2-CB 3.79Å; W118-E163 VanDerWaalsContact CZ2-CD 3.41Å; W118-E163 HydrophobicContact CZ2-CG 3.4Å; W118-E163 HydrophobicContact CZ3-CB 3.83Å; W118-E163 HydrophobicContact CZ3-CG 4.38Å
164	D	80.7	Confident	82.7	Confident	58 Å²	58	48.4 Å²	48.4	31%	0.31	27%	0.265	S	S	.	.			trans	-133.1	139.3	-169.7	163.6	47.1	0	0	0	113.1	T166 T167 A168	D164-T166 VanDerWaalsContact CG-N 3.31Å; D164-T166 PolarHBondContact OD1-N 2.85Å; D164-T166 WeakPolarHBondContact OD2-CB 3.5Å; D164-T166 PolarHBondContact OD2-N 2.97Å; D164-T166 PolarHBondContact OD2-OG1 2.89Å; D164-T167 VanDerWaalsContact OD2-CB 3.29Å; D164-T167 WeakPolarHBondContact OD2-CB 3.37Å; D164-T167 PolarHBondContact OD2-N 3.47Å; D164-T167 PolarHBondContact OD2-OG1 3.5Å; D164-A168 WeakPolarHBondContact O-CB 3.21Å; D164-A168 PolarHBondContact O-N 3.06Å
165	A	79.3	Confident	82.9	Confident	39 Å²	39	46.5 Å²	46.5	32%	0.322	26%	0.257	S	S	.	.	H	α-helix	trans	-72.3	-30	177.6	0	0	0	0	0	113.9	F119 S169	F119-A165 VanDerWaalsContact CE2-CA 3.45Å; F119-A165 HydrophobicContact CE2-CB 3.72Å; F119-A165 HydrophobicContact CZ-CB 3.92Å; A165-S169 VanDerWaalsContact O-CB 3.29Å; A165-S169 WeakPolarHBondContact O-CB 3.41Å; A165-S169 PolarHBondContact O-N 3.06Å; A165-S169 PolarHBondContact O-OG 3.35Å
166	T	82.3	Confident	82.4	Confident	91 Å²	91	46.6 Å²	46.6	56%	0.558	25%	0.249	S	C	*	.	H	α-helix	trans	-70.4	-43.6	176.9	84.3	0	0	0	0	110.4	D164 S169 A170	D164-T166 VanDerWaalsContact CG-N 3.31Å; D164-T166 PolarHBondContact OD1-N 2.85Å; D164-T166 WeakPolarHBondContact OD2-CB 3.5Å; D164-T166 PolarHBondContact OD2-N 2.97Å; D164-T166 PolarHBondContact OD2-OG1 2.89Å; T166-S169 WeakPolarHBondContact O-CB 3.46Å; T166-S169 PolarHBondContact O-N 3.35Å; T166-A170 PolarHBondContact O-N 2.9Å
167	T	82	Confident	82.2	Confident	18 Å²	18	49.2 Å²	49.2	11%	0.11	25%	0.254	C	S	.	.	H	α-helix	trans	-62	-46.3	173.9	-58.9	0	0	0	0	111.2	F146 V162 D164 S169 A170 L171	F146-T167 HydrophobicContact CB-CG2 3.53Å; V162-T167 HydrophobicContact CB-CG2 4.24Å; V162-T167 HydrophobicContact CG1-CG2 4.11Å; V162-T167 HydrophobicContact CG2-CG2 4.45Å; D164-T167 VanDerWaalsContact OD2-CB 3.29Å; D164-T167 WeakPolarHBondContact OD2-CB 3.37Å; D164-T167 PolarHBondContact OD2-N 3.47Å; D164-T167 PolarHBondContact OD2-OG1 3.5Å; T167-S169 VanDerWaalsContact C-N 3.3Å; T167-S169 PolarHBondContact O-N 2.7Å; T167-A170 PolarHBondContact O-N 2.96Å; T167-L171 HydrophobicContact CG2-CD1 4Å; T167-L171 WeakPolarHBondContact O-CB 3.21Å; T167-L171 WeakPolarHBondContact O-CG 3.38Å; T167-L171 PolarHBondContact O-N 3.42Å
168	A	81.1	Confident	81.9	Confident	5 Å²	5	43.6 Å²	43.6	4%	0.041	23%	0.233	C	C	.	.	H	α-helix	trans	-60.7	-38.2	173.8	0	0	0	0	0	112.3	F119 V162 D164 L171 K172 I190	F119-A168 HydrophobicContact CB-CB 3.82Å; F119-A168 HydrophobicContact CD1-CB 4.03Å; F119-A168 HydrophobicContact CD2-CB 3.53Å; F119-A168 HydrophobicContact CE2-CB 4.1Å; F119-A168 HydrophobicContact CG-CB 3.49Å; F119-A168 VanDerWaalsContact CG-CB 3.49Å; V162-A168 HydrophobicContact CG2-CB 4.09Å; D164-A168 WeakPolarHBondContact O-CB 3.21Å; D164-A168 PolarHBondContact O-N 3.06Å; A168-L171 PolarHBondContact O-N 3.48Å; A168-K172 WeakPolarHBondContact O-CB 3.26Å; A168-K172 PolarHBondContact O-N 3.02Å; A168-I190 HydrophobicContact CB-CG2 4.27Å; A168-I190 VanDerWaalsContact O-CD1 3.23Å; A168-I190 WeakPolarHBondContact O-CD1 3.28Å
169	S	82.1	Confident	81.5	Confident	75 Å²	75	47 Å²	47	52%	0.524	25%	0.248	S	C	.	.	H	α-helix	trans	-69.9	-40.3	177	-60.9	0	0	0	0	112.6	A165 T166 T167 K172 A173	A165-S169 VanDerWaalsContact O-CB 3.29Å; A165-S169 WeakPolarHBondContact O-CB 3.41Å; A165-S169 PolarHBondContact O-N 3.06Å; A165-S169 PolarHBondContact O-OG 3.35Å; T166-S169 WeakPolarHBondContact O-CB 3.46Å; T166-S169 PolarHBondContact O-N 3.35Å; T167-S169 VanDerWaalsContact C-N 3.3Å; T167-S169 PolarHBondContact O-N 2.7Å; S169-K172 WeakPolarHBondContact O-CB 3.4Å; S169-K172 PolarHBondContact O-N 3.18Å; S169-A173 PolarHBondContact O-N 3.34Å; S169-A173 VanDerWaalsContact O-N 3.08Å
170	A	82.4	Confident	80.8	Confident	11 Å²	11	47.7 Å²	47.7	9%	0.091	25%	0.252	C	S	.	.	H	α-helix	trans	-61.2	-45.2	173.1	0	0	0	0	0	111.2	V144 T166 T167 K172 A173 V174	V144-A170 HydrophobicContact CB-CB 4.09Å; V144-A170 HydrophobicContact CG2-CB 3.67Å; T166-A170 PolarHBondContact O-N 2.9Å; T167-A170 PolarHBondContact O-N 2.96Å; A170-K172 VanDerWaalsContact C-N 3.34Å; A170-K172 PolarHBondContact O-N 2.96Å; A170-A173 CarbonylContact O-C 3.59Å; A170-A173 WeakPolarHBondContact O-CA 3.48Å; A170-A173 WeakPolarHBondContact O-CB 3.32Å; A170-A173 PolarHBondContact O-N 3.5Å; A170-V174 PolarHBondContact O-N 2.93Å
171	L	82.4	Confident	80.1	Confident	1 Å²	1	58.2 Å²	58.2	1%	0.005	29%	0.292	C	S	.	.	H	α-helix	trans	-66.9	-33	176.9	-69.3	167.3	0	0	0	112.5	I121 I138 C142 F146 V162 T167 A168 A173 V174 I190	I121-L171 HydrophobicContact CD1-CB 4.35Å; I121-L171 HydrophobicContact CD1-CD1 3.42Å; I121-L171 VanDerWaalsContact CD1-CD1 3.42Å; I121-L171 HydrophobicContact CD1-CG 4.47Å; I138-L171 HydrophobicContact CG2-CD2 3.41Å; I138-L171 VanDerWaalsContact CG2-CD2 3.41Å; C142-L171 HydrophobicContact CB-CD2 4.1Å; F146-L171 HydrophobicContact CB-CD1 4.18Å; F146-L171 HydrophobicContact CD1-CD1 4.39Å; F146-L171 HydrophobicContact CD1-CD2 3.86Å; F146-L171 HydrophobicContact CD2-CD1 4.01Å; F146-L171 HydrophobicContact CE1-CD2 3.87Å; F146-L171 HydrophobicContact CG-CD1 3.93Å; F146-L171 HydrophobicContact CG-CD2 4.23Å; F146-L171 HydrophobicContact CZ-CD2 4.22Å; V162-L171 HydrophobicContact CG1-CD1 4.14Å; T167-L171 HydrophobicContact CG2-CD1 4Å; T167-L171 WeakPolarHBondContact O-CB 3.21Å; T167-L171 WeakPolarHBondContact O-CG 3.38Å; T167-L171 PolarHBondContact O-N 3.42Å; A168-L171 PolarHBondContact O-N 3.48Å; L171-A173 VanDerWaalsContact C-N 3.26Å; L171-A173 PolarHBondContact O-N 3.36Å; L171-V174 WeakPolarHBondContact O-CB 3.2Å; L171-V174 PolarHBondContact O-N 3.23Å; L171-V174 VanDerWaalsContact O-N 3.08Å; L171-I190 HydrophobicContact CB-CD1 3.79Å
172	K	82.5	Confident	79.7	Confident	150 Å²	150	63.5 Å²	63.5	65%	0.652	32%	0.317	S	S	*	.	H	α-helix	trans	-61.2	-36.3	169.8	-167.4	178.2	-179.9	-179.4	0	111.4	A168 S169 A170 V174 N175 I190	A168-K172 WeakPolarHBondContact O-CB 3.26Å; A168-K172 PolarHBondContact O-N 3.02Å; S169-K172 WeakPolarHBondContact O-CB 3.4Å; S169-K172 PolarHBondContact O-N 3.18Å; A170-K172 VanDerWaalsContact C-N 3.34Å; A170-K172 PolarHBondContact O-N 2.96Å; K172-V174 VanDerWaalsContact C-N 3.27Å; K172-V174 PolarHBondContact O-N 3.26Å; K172-N175 VanDerWaalsContact O-CB 3.23Å; K172-N175 WeakPolarHBondContact O-CB 3.19Å; K172-N175 PolarHBondContact O-N 2.92Å; K172-I190 HydrophobicContact CB-CD1 4.07Å
173	A	82.1	Confident	79.2	Confident	54 Å²	54	69 Å²	69	45%	0.446	35%	0.346	S	S	.	.	T	Hydrogen-bonded Turn	trans	-75.4	-7.3	175.3	0	0	0	0	0	114.3	S169 A170 L171 K177	S169-A173 PolarHBondContact O-N 3.34Å; S169-A173 VanDerWaalsContact O-N 3.08Å; A170-A173 CarbonylContact O-C 3.59Å; A170-A173 WeakPolarHBondContact O-CA 3.48Å; A170-A173 WeakPolarHBondContact O-CB 3.32Å; A170-A173 PolarHBondContact O-N 3.5Å; L171-A173 VanDerWaalsContact C-N 3.26Å; L171-A173 PolarHBondContact O-N 3.36Å; A173-K177 VanDerWaalsContact O-CD 3.28Å; A173-K177 WeakPolarHBondContact O-CD 3.37Å; A173-K177 WeakPolarHBondContact O-CE 3.26Å; A173-K177 PolarHBondContact O-NZ 2.95Å
174	V	82.9	Confident	79.4	Confident	2 Å²	2	70 Å²	70	1%	0.012	35%	0.347	C	S	.	.	T	Hydrogen-bonded Turn	trans	-89.4	-17.6	171.8	-178.7	0	0	0	0	112.4	I138 K141 C142 A170 L171 K172 Y176 K177 I178 I188	I138-V174 HydrophobicContact CG2-CG1 4.47Å; K141-V174 HydrophobicContact CB-CG1 3.98Å; K141-V174 HydrophobicContact CB-CG2 4.47Å; K141-V174 WeakPolarHBondContact O-CG2 3.46Å; C142-V174 HydrophobicContact CB-CG2 3.96Å; A170-V174 PolarHBondContact O-N 2.93Å; L171-V174 WeakPolarHBondContact O-CB 3.2Å; L171-V174 PolarHBondContact O-N 3.23Å; L171-V174 VanDerWaalsContact O-N 3.08Å; K172-V174 VanDerWaalsContact C-N 3.27Å; K172-V174 PolarHBondContact O-N 3.26Å; V174-Y176 PolarHBondContact O-N 2.9Å; V174-K177 WeakPolarHBondContact O-CB 3.22Å; V174-K177 PolarHBondContact O-N 3.31Å; V174-I178 HydrophobicContact CG1-CD1 3.73Å; V174-I178 HydrophobicContact CG1-CG1 3.86Å; V174-I188 HydrophobicContact CB-CD1 4.11Å; V174-I188 HydrophobicContact CG1-CD1 3.92Å
175	N	82.3	Confident	79.4	Confident	47 Å²	47	75.3 Å²	75.3	25%	0.251	36%	0.363	S	S	.	.	T	Hydrogen-bonded Turn	trans	-49.8	131.9	179.1	-172.2	21.6	0	0	0	112	K172 K177 S187 I188	K172-N175 VanDerWaalsContact O-CB 3.23Å; K172-N175 WeakPolarHBondContact O-CB 3.19Å; K172-N175 PolarHBondContact O-N 2.92Å; N175-K177 PolarHBondContact O-N 3.49Å; N175-K177 VanDerWaalsContact O-N 3.11Å; N175-S187 WeakPolarHBondContact OD1-CA 3.32Å; N175-I188 HydrophobicContact CB-CB 4.29Å; N175-I188 PolarHBondContact OD1-N 3.16Å
176	Y	75.3	Confident	79.6	Confident	133 Å²	133	73.7 Å²	73.7	52%	0.522	35%	0.349	S	S	.	.	T	Hydrogen-bonded Turn	trans	61.5	0.9	-175.4	-56.6	-64.8	0	0	0	117.6	V174 R185 I186	V174-Y176 PolarHBondContact O-N 2.9Å; Y176-R185 HydrophobicContact CD1-CB 3.97Å; Y176-R185 WeakPolarHBondContact O-CD 3.32Å; Y176-I186 WeakPolarHBondContact CA-O 3.47Å; Y176-I186 PolarHBondContact N-O 3.27Å; Y176-I186 VanDerWaalsContact N-O 3.08Å
177	K	78.9	Confident	79.5	Confident	130 Å²	130	70.5 Å²	70.5	57%	0.565	33%	0.33	S	S	*	.	T	Hydrogen-bonded Turn	trans	-83	-25.7	176.6	-66	-176.7	178.9	162.1	0	113.6	A173 V174 N175 H179	A173-K177 VanDerWaalsContact O-CD 3.28Å; A173-K177 WeakPolarHBondContact O-CD 3.37Å; A173-K177 WeakPolarHBondContact O-CE 3.26Å; A173-K177 PolarHBondContact O-NZ 2.95Å; V174-K177 WeakPolarHBondContact O-CB 3.22Å; V174-K177 PolarHBondContact O-N 3.31Å; N175-K177 PolarHBondContact O-N 3.49Å; N175-K177 VanDerWaalsContact O-N 3.11Å; K177-H179 PolarHBondContact O-ND1 3.04Å; K177-H179 VanDerWaalsContact O-ND1 3.15Å
178	I	79.2	Confident	79.7	Confident	4 Å²	4	70 Å²	70	2%	0.021	33%	0.326	C	S	.	.			trans	-85.8	132.4	178	-49.2	171.4	0	0	0	109.1	M137 I138 K141 V174 R185 I186	M137-I178 HydrophobicContact CB-CG2 4.18Å; M137-I178 HydrophobicContact CE-CG2 4.01Å; I138-I178 HydrophobicContact CB-CD1 4.09Å; I138-I178 HydrophobicContact CG1-CD1 3.42Å; I138-I178 VanDerWaalsContact CG1-CD1 3.42Å; K141-I178 HydrophobicContact CG-CG1 4.47Å; V174-I178 HydrophobicContact CG1-CD1 3.73Å; V174-I178 HydrophobicContact CG1-CG1 3.86Å; I178-R185 WeakPolarHBondContact O-CA 3.2Å; I178-I186 HydrophobicContact CB-CB 4.31Å; I178-I186 HydrophobicContact CB-CD1 4.4Å; I178-I186 HydrophobicContact CB-CG1 4.5Å; I178-I186 HydrophobicContact CG2-CD1 3.85Å; I178-I186 HydrophobicContact CG2-CG1 4.38Å; I178-I186 PolarHBondContact O-N 3.5Å
179	H	79.4	Confident	79.9	Confident	71 Å²	71	73.3 Å²	73.3	33%	0.329	34%	0.343	S	S	.	.	B	Isolated β-bridge	trans	-112.1	137.5	176.9	-63.3	68.8	0	0	0	109.8	K177 N183 R184 R185	K177-H179 PolarHBondContact O-ND1 3.04Å; K177-H179 VanDerWaalsContact O-ND1 3.15Å; H179-N183 PolarHBondContact CD2-OD1 2.91Å; H179-N183 VanDerWaalsContact CD2-OD1 3.29Å; H179-R184 WeakPolarHBondContact CA-O 3.33Å; H179-R185 VanDerWaalsContact NE2-CG 3.32Å; H179-R185 WeakPolarHBondContact NE2-CG 3.28Å; H179-R185 PolarHBondContact NE2-NE 3.02Å
180	D	73.2	Confident	80.1	Confident	18 Å²	18	71.6 Å²	71.6	10%	0.096	33%	0.327	C	S	.	.			trans	-73.1	168.9	174.1	-178.4	18.9	0	0	0	111.3	Y129 E182 N183 R184	Y129-D180 HydrophobicContact CE1-CB 4.41Å; Y129-D180 WeakPolarHBondContact CE1-OD1 3.48Å; Y129-D180 PolarHBondContact OH-OD2 3.4Å; D180-E182 PolarHBondContact O-N 3.32Å; D180-N183 VanDerWaalsContact O-CA 3.31Å; D180-N183 WeakPolarHBondContact O-CA 3.44Å; D180-N183 PolarHBondContact O-N 2.98Å; D180-R184 HydrophobicContact CB-CB 4.1Å; D180-R184 WeakPolarHBondContact CB-O 3.26Å; D180-R184 PolarHBondContact N-O 2.85Å; D180-R184 IonicContact OD2-CZ 3.65Å; D180-R184 VanDerWaalsContact OD2-CZ 3.29Å; D180-R184 IonicContact OD2-NE 2.98Å; D180-R184 PolarHBondContact OD2-NE 3.42Å; D180-R184 VanDerWaalsContact OD2-NE 3.12Å; D180-R184 IonicContact OD2-NH2 3.23Å; D180-R184 PolarHBondContact OD2-NH2 3.36Å
181	R	71.9	Confident	80.2	Confident	223 Å²	223	75.4 Å²	75.4	84%	0.842	35%	0.346	S	S	*	.	T	Hydrogen-bonded Turn	trans	-59.9	-27.2	173.8	-59.8	-176.1	-176.7	-163.6	0.2	112.7	N183	R181-N183 VanDerWaalsContact C-N 3.25Å; R181-N183 PolarHBondContact O-N 3.48Å
182	E	76.6	Confident	80.2	Confident	129 Å²	129	80 Å²	80	60%	0.603	38%	0.379	S	S	*	.	T	Hydrogen-bonded Turn	trans	-88.6	20.5	171.5	-64.2	174.7	-115.9	0	0	112.6	D180 R184	D180-E182 PolarHBondContact O-N 3.32Å; E182-R184 HydrophobicContact CB-CG 4.33Å; E182-R184 PolarHBondContact O-N 2.66Å; E182-R184 IonicContact OE1-CZ 2.79Å; E182-R184 VanDerWaalsContact OE1-CZ 3.31Å; E182-R184 IonicContact OE1-NH1 2.6Å; E182-R184 PolarHBondContact OE1-NH1 2.86Å; E182-R184 IonicContact OE1-NH2 3.66Å; E182-R184 PolarHBondContact OE1-NH2 3.48Å; E182-R184 IonicContact OE2-CZ 2.66Å; E182-R184 IonicContact OE2-NH1 2.67Å; E182-R184 PolarHBondContact OE2-NH1 3.39Å; E182-R184 IonicContact OE2-NH2 2.75Å; E182-R184 PolarHBondContact OE2-NH2 2.93Å
183	N	73.4	Confident	79.9	Confident	121 Å²	121	74.7 Å²	74.7	65%	0.647	36%	0.36	S	S	*	.	S	Bend	trans	54.9	15.2	-176.5	-157.6	20.1	0	0	0	115.8	H179 D180 R181	H179-N183 PolarHBondContact CD2-OD1 2.91Å; H179-N183 VanDerWaalsContact CD2-OD1 3.29Å; D180-N183 VanDerWaalsContact O-CA 3.31Å; D180-N183 WeakPolarHBondContact O-CA 3.44Å; D180-N183 PolarHBondContact O-N 2.98Å; R181-N183 VanDerWaalsContact C-N 3.25Å; R181-N183 PolarHBondContact O-N 3.48Å
184	R	76.5	Confident	79.1	Confident	91 Å²	91	75.7 Å²	75.7	34%	0.343	37%	0.369	S	S	.	.	P	Polyproline II helix	trans	-75.9	133.3	176.9	-62.6	-176.7	-66.2	-127.5	-7.1	110.7	H179 D180 E182 I186	H179-R184 WeakPolarHBondContact CA-O 3.33Å; D180-R184 HydrophobicContact CB-CB 4.1Å; D180-R184 WeakPolarHBondContact CB-O 3.26Å; D180-R184 PolarHBondContact N-O 2.85Å; D180-R184 IonicContact OD2-CZ 3.65Å; D180-R184 VanDerWaalsContact OD2-CZ 3.29Å; D180-R184 IonicContact OD2-NE 2.98Å; D180-R184 PolarHBondContact OD2-NE 3.42Å; D180-R184 VanDerWaalsContact OD2-NE 3.12Å; D180-R184 IonicContact OD2-NH2 3.23Å; D180-R184 PolarHBondContact OD2-NH2 3.36Å; E182-R184 HydrophobicContact CB-CG 4.33Å; E182-R184 PolarHBondContact O-N 2.66Å; E182-R184 IonicContact OE1-CZ 2.79Å; E182-R184 VanDerWaalsContact OE1-CZ 3.31Å; E182-R184 IonicContact OE1-NH1 2.6Å; E182-R184 PolarHBondContact OE1-NH1 2.86Å; E182-R184 IonicContact OE1-NH2 3.66Å; E182-R184 PolarHBondContact OE1-NH2 3.48Å; E182-R184 IonicContact OE2-CZ 2.66Å; E182-R184 IonicContact OE2-NH1 2.67Å; E182-R184 PolarHBondContact OE2-NH1 3.39Å; E182-R184 IonicContact OE2-NH2 2.75Å; E182-R184 PolarHBondContact OE2-NH2 2.93Å; R184-I186 PolarHBondContact O-N 3.5Å
185	R	81.4	Confident	78.3	Confident	168 Å²	168	78.6 Å²	78.6	63%	0.634	39%	0.388	S	S	*	.	B	Isolated β-bridge	trans	-71.9	125	175.3	-68.4	178.1	-177.2	168	3	111	Y176 I178 H179	Y176-R185 HydrophobicContact CD1-CB 3.97Å; Y176-R185 WeakPolarHBondContact O-CD 3.32Å; I178-R185 WeakPolarHBondContact O-CA 3.2Å; H179-R185 VanDerWaalsContact NE2-CG 3.32Å; H179-R185 WeakPolarHBondContact NE2-CG 3.28Å; H179-R185 PolarHBondContact NE2-NE 3.02Å
186	I	83.4	Confident	77.5	Confident	6 Å²	6	76.5 Å²	76.5	3%	0.031	38%	0.377	C	S	.	.	P	Polyproline II helix	trans	-75.7	127.3	175	-56.8	-175.6	0	0	0	108.7	I123 Y129 W133 L134 Y176 I178 R184	I123-I186 HydrophobicContact CG2-CG2 3.67Å; Y129-I186 HydrophobicContact CD2-CD1 4.19Å; Y129-I186 HydrophobicContact CE2-CD1 3.77Å; Y129-I186 HydrophobicContact CE2-CG1 4.14Å; W133-I186 HydrophobicContact CH2-CD1 4.26Å; W133-I186 HydrophobicContact CZ3-CD1 4.17Å; L134-I186 HydrophobicContact CD1-CD1 4.12Å; Y176-I186 WeakPolarHBondContact CA-O 3.47Å; Y176-I186 PolarHBondContact N-O 3.27Å; Y176-I186 VanDerWaalsContact N-O 3.08Å; I178-I186 HydrophobicContact CB-CB 4.31Å; I178-I186 HydrophobicContact CB-CD1 4.4Å; I178-I186 HydrophobicContact CB-CG1 4.5Å; I178-I186 HydrophobicContact CG2-CD1 3.85Å; I178-I186 HydrophobicContact CG2-CG1 4.38Å; I178-I186 PolarHBondContact O-N 3.5Å; R184-I186 PolarHBondContact O-N 3.5Å
187	S	81.2	Confident	76.7	Confident	24 Å²	24	80.2 Å²	80.2	17%	0.168	39%	0.39	C	S	.	.	P	Polyproline II helix	trans	-91.1	140.6	174	46.4	0	0	0	0	111.2	P124 N175	P124-S187 WeakPolarHBondContact CD-O 3.4Å; N175-S187 WeakPolarHBondContact OD1-CA 3.32Å
188	I	86.3	Confident	75.4	Confident	6 Å²	6	77.9 Å²	77.9	3%	0.031	39%	0.39	C	S	.	.			trans	-124.8	110.9	177	-53.9	179.7	0	0	0	107.1	I121 I123 I138 V174 N175 I190	I121-I188 HydrophobicContact CG2-CG2 3.69Å; I123-I188 HydrophobicContact CG1-CG1 4.44Å; I138-I188 HydrophobicContact CG1-CD1 4.34Å; V174-I188 HydrophobicContact CB-CD1 4.11Å; V174-I188 HydrophobicContact CG1-CD1 3.92Å; N175-I188 HydrophobicContact CB-CB 4.29Å; N175-I188 PolarHBondContact OD1-N 3.16Å; I188-I190 HydrophobicContact CG2-CD1 4.25Å; I188-I190 HydrophobicContact CG2-CG1 4.08Å
189	I	84.3	Confident	74.1	Confident	76 Å²	76	80 Å²	80	39%	0.39	40%	0.402	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-99.4	133.7	177.4	-56.5	175.9	0	0	0	107.7	I121 T122 P124	I121-I189 WeakPolarHBondContact CA-O 3.33Å; T122-I189 PolarHBondContact N-O 2.98Å; T122-I189 PolarHBondContact O-N 2.7Å; P124-I189 HydrophobicContact CG-CD1 3.69Å; P124-I189 HydrophobicContact CG-CG1 4.28Å
190	I	86.3	Confident	73	Confident	38 Å²	38	81.5 Å²	81.5	20%	0.195	41%	0.41	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-130.4	122.5	-177.4	-53.2	-171	0	0	0	108.5	F119 I121 A168 L171 K172 I188	F119-I190 HydrophobicContact CB-CG2 3.91Å; F119-I190 HydrophobicContact CD1-CG2 4.22Å; F119-I190 HydrophobicContact CG-CG2 4.41Å; I121-I190 HydrophobicContact CD1-CD1 4.37Å; I121-I190 HydrophobicContact CG1-CD1 4.24Å; I121-I190 HydrophobicContact CG1-CG1 4.1Å; I121-I190 HydrophobicContact CG1-CG2 4.28Å; I121-I190 HydrophobicContact CG2-CG1 4.43Å; A168-I190 HydrophobicContact CB-CG2 4.27Å; A168-I190 VanDerWaalsContact O-CD1 3.23Å; A168-I190 WeakPolarHBondContact O-CD1 3.28Å; L171-I190 HydrophobicContact CB-CD1 3.79Å; K172-I190 HydrophobicContact CB-CD1 4.07Å; I188-I190 HydrophobicContact CG2-CD1 4.25Å; I188-I190 HydrophobicContact CG2-CG1 4.08Å
191	N	84.5	Confident	72.3	Confident	91 Å²	91	88.6 Å²	88.6	49%	0.487	44%	0.44	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-124.3	142.5	178.5	-57.6	-45.1	0	0	0	109	F119 K120	F119-N191 CarbonylContact C-O 3.59Å; F119-N191 WeakPolarHBondContact CA-O 3.37Å; K120-N191 PolarHBondContact N-O 2.96Å; K120-N191 PolarHBondContact O-N 2.98Å
192	S	83	Confident	72	Confident	99 Å²	99	85.6 Å²	85.6	69%	0.692	44%	0.435	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-60.8	144.7	167.1	-47.9	0	0	0	0	110.2
193	S	76.5	Confident	71.9	Confident	38 Å²	38	80.8 Å²	80.8	27%	0.266	41%	0.413	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-143.6	167.8	179.9	69.2	0	0	0	0	112.4	W118	W118-S193 WeakPolarHBondContact CB-O 3.29Å; W118-S193 PolarHBondContact O-N 3.27Å
194	A	65.1	Low	72.3	Confident	75 Å²	75	81.3 Å²	81.3	62%	0.62	41%	0.41	S	S	*	.	P	Polyproline II helix	trans	-62.7	161.7	157.5	0	0	0	0	0	110.6
195	P	65.6	Low	72.7	Confident	63 Å²	63	81.7 Å²	81.7	41%	0.409	42%	0.424	S	S	.	.	P	Polyproline II helix	trans	-55.5	147.4	169.2	20.9	-33.1	0	0	0	112.5	W118	W118-P195 HydrophobicContact CD2-CB 4.29Å; W118-P195 HydrophobicContact CG-CB 4.15Å
196	P	65.1	Low	72.9	Confident	3 Å²	3	79.4 Å²	79.4	2%	0.019	42%	0.421	C	S	.	.	P	Polyproline II helix	trans	-59.1	157.4	174.2	-20	30.2	0	0	0	112.2	W118 I149 E150 F161 S198 V199 Q200	W118-P196 HydrophobicContact CE3-CG 3.87Å; W118-P196 HydrophobicContact CZ3-CG 3.8Å; I149-P196 HydrophobicContact CG2-CB 4.47Å; I149-P196 HydrophobicContact CG2-CG 4.03Å; E150-P196 HydrophobicContact CB-CB 4.36Å; E150-P196 VanDerWaalsContact OE2-CB 3.27Å; E150-P196 WeakPolarHBondContact OE2-CB 3.48Å; F161-P196 HydrophobicContact CB-CG 3.66Å; F161-P196 HydrophobicContact CD1-CG 4.03Å; F161-P196 HydrophobicContact CD2-CB 4.19Å; F161-P196 HydrophobicContact CD2-CG 3.84Å; F161-P196 HydrophobicContact CE2-CB 4.39Å; F161-P196 HydrophobicContact CE2-CG 4.42Å; F161-P196 HydrophobicContact CG-CB 4.42Å; F161-P196 HydrophobicContact CG-CG 3.61Å; P196-S198 VanDerWaalsContact C-N 3.28Å; P196-S198 PolarHBondContact O-N 3.28Å; P196-V199 HydrophobicContact CB-CG2 4.08Å; P196-V199 HydrophobicContact CG-CG2 4Å; P196-V199 PolarHBondContact O-N 2.69Å; P196-Q200 PolarHBondContact O-N 2.92Å
197	R	58.1	Low	72.9	Confident	211 Å²	211	81.6 Å²	81.6	80%	0.796	43%	0.431	S	S	*	.	G	3₁₀ helix	trans	-63.7	-38.1	178.3	-71.7	-178	178.2	173.3	-0.4	111.1	E150 V199 Q200	E150-R197 PolarHBondContact OE2-N 3.36Å; R197-V199 PolarHBondContact O-N 2.79Å; R197-V199 VanDerWaalsContact O-N 3.13Å; R197-Q200 WeakPolarHBondContact O-CB 3.4Å; R197-Q200 PolarHBondContact O-N 3.33Å; R197-Q200 VanDerWaalsContact O-N 3.15Å
198	S	52.5	Low	73.3	Confident	81 Å²	81	82.2 Å²	82.2	57%	0.566	43%	0.434	S	S	*	.	G	3₁₀ helix	trans	-61.7	-12.8	172.4	53.7	0	0	0	0	115.2	E150 P196	E150-S198 VanDerWaalsContact OE2-CB 3.27Å; E150-S198 WeakPolarHBondContact OE2-CB 3.48Å; E150-S198 PolarHBondContact OE2-N 3.19Å; E150-S198 PolarHBondContact OE2-OG 3.28Å; P196-S198 VanDerWaalsContact C-N 3.28Å; P196-S198 PolarHBondContact O-N 3.28Å
199	V	52.6	Low	73.5	Confident	47 Å²	47	87 Å²	87	29%	0.285	46%	0.456	S	S	.	.	G	3₁₀ helix	trans	-110.9	5.7	179.4	-165.7	0	0	0	0	112	W118 I149 P196 R197 K201	W118-V199 HydrophobicContact CH2-CB 4.22Å; W118-V199 HydrophobicContact CH2-CG1 3.86Å; W118-V199 HydrophobicContact CH2-CG2 3.81Å; W118-V199 HydrophobicContact CZ2-CB 4.24Å; W118-V199 HydrophobicContact CZ2-CG1 3.6Å; W118-V199 HydrophobicContact CZ2-CG2 4.33Å; W118-V199 HydrophobicContact CZ3-CG2 4.37Å; I149-V199 HydrophobicContact CG2-CG2 3.91Å; P196-V199 HydrophobicContact CB-CG2 4.08Å; P196-V199 HydrophobicContact CG-CG2 4Å; P196-V199 PolarHBondContact O-N 2.69Å; R197-V199 PolarHBondContact O-N 2.79Å; R197-V199 VanDerWaalsContact O-N 3.13Å; V199-K201 PolarHBondContact O-N 2.89Å
200	Q	56	Low	73.7	Confident	103 Å²	103	86.5 Å²	86.5	48%	0.481	45%	0.452	S	S	.	.	S	Bend	trans	-72.7	79.3	163.2	-63.7	-172.6	-0.7	0	0	108.9	P196 R197 E202 R248	P196-Q200 PolarHBondContact O-N 2.92Å; R197-Q200 WeakPolarHBondContact O-CB 3.4Å; R197-Q200 PolarHBondContact O-N 3.33Å; R197-Q200 VanDerWaalsContact O-N 3.15Å; Q200-E202 PolarHBondContact O-N 2.85Å; Q200-E202 VanDerWaalsContact O-N 3.07Å; Q200-R248 PolarHBondContact O-NH2 3.26Å
201	K	57.7	Low	73.9	Confident	167 Å²	167	84.7 Å²	84.7	73%	0.726	44%	0.443	S	S	*	.			trans	-23.3	104.9	-176.3	-66.9	-179.5	-179.7	176.9	0	113.3	V199 R248	V199-K201 PolarHBondContact O-N 2.89Å; K201-R248 PolarHBondContact O-NH1 3.45Å; K201-R248 PolarHBondContact O-NH2 3.01Å
202	E	66.2	Low	74.3	Confident	161 Å²	161	83.4 Å²	83.4	75%	0.752	43%	0.433	S	S	*	.	P	Polyproline II helix	trans	-63.1	147	162.3	-66.4	174.3	166	0	0	108.3	Q200 K204	Q200-E202 PolarHBondContact O-N 2.85Å; Q200-E202 VanDerWaalsContact O-N 3.07Å; E202-K204 PolarHBondContact O-N 2.99Å
203	L	73.4	Confident	74.7	Confident	27 Å²	27	82.9 Å²	82.9	14%	0.141	42%	0.422	C	S	.	.	P	Polyproline II helix	trans	-67.9	128.3	175	-68.9	171.1	0	0	0	107.6	Q207 V208 L211 I242 C251	L203-Q207 HydrophobicContact CB-CB 4.48Å; L203-Q207 HydrophobicContact CD2-CB 4.33Å; L203-V208 HydrophobicContact CB-CG2 3.86Å; L203-L211 HydrophobicContact CD1-CD2 3.97Å; L203-I242 HydrophobicContact CD2-CG2 3.95Å; L203-C251 HydrophobicContact CD1-CB 4.45Å
204	K	82.9	Confident	75.5	Confident	132 Å²	132	81.1 Å²	81.1	57%	0.574	41%	0.409	S	S	*	.	P	Polyproline II helix	trans	-67.5	156.3	173.3	-57.6	-175.8	171.2	-171.5	0	110.5	E202 E206 Q207 V208	E202-K204 PolarHBondContact O-N 2.99Å; K204-E206 WeakPolarHBondContact CB-OE2 3.34Å; K204-E206 PolarHBondContact O-N 2.89Å; K204-E206 VanDerWaalsContact O-N 3.15Å; K204-Q207 HydrophobicContact CB-CG 4.27Å; K204-Q207 VanDerWaalsContact N-OE1 3.11Å; K204-Q207 WeakPolarHBondContact O-CA 3.43Å; K204-Q207 WeakPolarHBondContact O-CB 3.15Å; K204-Q207 PolarHBondContact O-N 3.14Å; K204-V208 PolarHBondContact O-N 2.9Å
205	P	83.8	Confident	76.9	Confident	100 Å²	100	77.8 Å²	77.8	65%	0.649	38%	0.381	S	S	*	.	H	α-helix	trans	-51.9	-39.2	178	-27.8	36.3	0	0	0	113.9	Q207 V208 E209	P205-Q207 VanDerWaalsContact C-N 3.26Å; P205-Q207 PolarHBondContact O-N 2.86Å; P205-V208 PolarHBondContact O-N 3.35Å; P205-V208 VanDerWaalsContact O-N 3.13Å; P205-E209 PolarHBondContact O-N 2.87Å; P205-E209 VanDerWaalsContact O-N 3.12Å
206	E	85.9	Confident	78.2	Confident	119 Å²	119	78.6 Å²	78.6	56%	0.556	39%	0.388	S	S	*	.	H	α-helix	trans	-66.7	-29.9	178.7	-44.4	85.6	169.8	0	0	112.1	K204 Q210	K204-E206 WeakPolarHBondContact CB-OE2 3.34Å; K204-E206 PolarHBondContact O-N 2.89Å; K204-E206 VanDerWaalsContact O-N 3.15Å; E206-Q210 WeakPolarHBondContact O-CG 3.19Å; E206-Q210 PolarHBondContact O-N 3.38Å
207	Q	85	Confident	79.6	Confident	52 Å²	52	85 Å²	85	24%	0.243	42%	0.416	C	S	.	.	H	α-helix	trans	-79.4	-25.6	175.4	-58.3	-178.6	-64.9	0	0	112.3	L203 K204 P205 L211 I242	L203-Q207 HydrophobicContact CB-CB 4.48Å; L203-Q207 HydrophobicContact CD2-CB 4.33Å; K204-Q207 HydrophobicContact CB-CG 4.27Å; K204-Q207 VanDerWaalsContact N-OE1 3.11Å; K204-Q207 WeakPolarHBondContact O-CA 3.43Å; K204-Q207 WeakPolarHBondContact O-CB 3.15Å; K204-Q207 PolarHBondContact O-N 3.14Å; P205-Q207 VanDerWaalsContact C-N 3.26Å; P205-Q207 PolarHBondContact O-N 2.86Å; Q207-L211 WeakPolarHBondContact O-CB 3.4Å; Q207-L211 PolarHBondContact O-N 2.86Å; Q207-I242 HydrophobicContact CB-CD1 4.13Å; Q207-I242 HydrophobicContact CB-CG1 4.46Å; Q207-I242 HydrophobicContact CB-CG2 4.21Å; Q207-I242 HydrophobicContact CG-CD1 4.23Å; Q207-I242 HydrophobicContact CG-CG1 4.24Å
208	V	88.4	Confident	81.3	Confident	37 Å²	37	77.6 Å²	77.6	22%	0.224	39%	0.388	C	S	.	.	H	α-helix	trans	-71.3	-40.9	173.8	177.8	0	0	0	0	110.4	L203 K204 P205 L211 K212 I258	L203-V208 HydrophobicContact CB-CG2 3.86Å; K204-V208 PolarHBondContact O-N 2.9Å; P205-V208 PolarHBondContact O-N 3.35Å; P205-V208 VanDerWaalsContact O-N 3.13Å; V208-L211 WeakPolarHBondContact O-CB 3.23Å; V208-L211 PolarHBondContact O-N 3.1Å; V208-K212 WeakPolarHBondContact O-CB 2.92Å; V208-K212 PolarHBondContact O-N 3.05Å; V208-I258 HydrophobicContact CG1-CD1 4.06Å; V208-I258 HydrophobicContact CG1-CG1 4.37Å
209	E	89.8	Confident	83.4	Confident	108 Å²	108	76.8 Å²	76.8	51%	0.505	37%	0.373	S	S	.	.	H	α-helix	trans	-65.3	-37.2	173.5	-71.4	-58.6	146.9	0	0	112.7	P205 K212 L213	P205-E209 PolarHBondContact O-N 2.87Å; P205-E209 VanDerWaalsContact O-N 3.12Å; E209-K212 WeakPolarHBondContact O-CB 3.41Å; E209-K212 PolarHBondContact O-N 2.8Å; E209-K212 IonicContact OE2-NZ 2.71Å; E209-L213 PolarHBondContact O-N 2.9Å
210	Q	88.8	Confident	85.4	Confident	65 Å²	65	78 Å²	78	30%	0.304	38%	0.377	S	S	.	.	H	α-helix	trans	-69.1	-39.3	173.8	-66.9	-63.8	-35.4	0	0	112.2	E206 K212 L213 I214 Q240 I242	E206-Q210 WeakPolarHBondContact O-CG 3.19Å; E206-Q210 PolarHBondContact O-N 3.38Å; Q210-K212 VanDerWaalsContact C-N 3.32Å; Q210-K212 PolarHBondContact O-N 2.81Å; Q210-L213 PolarHBondContact O-N 2.83Å; Q210-I214 WeakPolarHBondContact O-CD1 3.47Å; Q210-I214 VanDerWaalsContact O-CG1 3.3Å; Q210-I214 WeakPolarHBondContact O-CG1 3.18Å; Q210-I214 PolarHBondContact O-N 3.45Å; Q210-Q240 VanDerWaalsContact CB-OE1 3.26Å; Q210-I242 HydrophobicContact CB-CD1 3.75Å; Q210-I242 HydrophobicContact CG-CD1 4.43Å
211	L	90.4	Very high	87	Confident	0 Å²	0	75.6 Å²	75.6	0%	0	38%	0.38	C	S	.	.	H	α-helix	trans	-58.6	-44	170.1	173.4	60.4	0	0	0	111.2	L203 Q207 V208 L213 I214 M215 L231 I258	L203-L211 HydrophobicContact CD1-CD2 3.97Å; Q207-L211 WeakPolarHBondContact O-CB 3.4Å; Q207-L211 PolarHBondContact O-N 2.86Å; V208-L211 WeakPolarHBondContact O-CB 3.23Å; V208-L211 PolarHBondContact O-N 3.1Å; L211-L213 PolarHBondContact O-N 2.81Å; L211-I214 PolarHBondContact O-N 2.89Å; L211-M215 HydrophobicContact CD1-CG 4.11Å; L211-M215 HydrophobicContact CD1-SD 4.06Å; L211-M215 HydrophobicContact CG-CG 4.43Å; L211-M215 HydrophobicContact CG-SD 3.9Å; L211-M215 WeakPolarHBondContact O-CB 3.28Å; L211-M215 VanDerWaalsContact O-CG 3.26Å; L211-M215 WeakPolarHBondContact O-CG 3.5Å; L211-M215 PolarHBondContact O-N 2.83Å; L211-L231 HydrophobicContact CD1-CD2 3.91Å; L211-I258 HydrophobicContact CB-CD1 4.42Å; L211-I258 HydrophobicContact CD2-CD1 3.98Å; L211-I258 HydrophobicContact CG-CD1 3.93Å
212	K	92.9	Very high	88.6	Confident	63 Å²	63	71.9 Å²	71.9	27%	0.274	38%	0.376	S	S	.	.	H	α-helix	trans	-61	-41.4	175.4	168.4	171.3	160.9	174.4	0	112.7	V208 E209 Q210 I214 M215 S216 I258 N262	V208-K212 WeakPolarHBondContact O-CB 2.92Å; V208-K212 PolarHBondContact O-N 3.05Å; E209-K212 WeakPolarHBondContact O-CB 3.41Å; E209-K212 PolarHBondContact O-N 2.8Å; E209-K212 IonicContact OE2-NZ 2.71Å; Q210-K212 VanDerWaalsContact C-N 3.32Å; Q210-K212 PolarHBondContact O-N 2.81Å; K212-I214 VanDerWaalsContact C-N 3.34Å; K212-I214 PolarHBondContact O-N 3.4Å; K212-M215 PolarHBondContact O-N 3.37Å; K212-S216 WeakPolarHBondContact O-CB 3.17Å; K212-S216 PolarHBondContact O-N 2.95Å; K212-I258 HydrophobicContact CB-CD1 4.02Å; K212-I258 HydrophobicContact CB-CG1 4.25Å; K212-I258 HydrophobicContact CB-CG2 4.04Å; K212-I258 HydrophobicContact CG-CG2 4.1Å; K212-N262 WeakPolarHBondContact CE-OD1 3.38Å; K212-N262 PolarHBondContact NZ-OD1 2.84Å
213	L	92.6	Very high	89.7	Confident	88 Å²	88	70.2 Å²	70.2	46%	0.461	37%	0.368	S	S	.	.	H	α-helix	trans	-61.9	-40.9	173.5	-179.8	61	0	0	0	112	E209 Q210 L211 S216 K217	E209-L213 PolarHBondContact O-N 2.9Å; Q210-L213 PolarHBondContact O-N 2.83Å; L211-L213 PolarHBondContact O-N 2.81Å; L213-S216 WeakPolarHBondContact O-CB 3.39Å; L213-S216 PolarHBondContact O-N 3.1Å; L213-K217 PolarHBondContact O-N 2.94Å
214	I	93	Very high	90.7	Very high	2 Å²	2	71.6 Å²	71.6	1%	0.01	37%	0.374	C	S	.	.	H	α-helix	trans	-72.7	-36.5	179.8	-67.5	163	0	0	0	111.3	Q210 L211 K212 S216 K217 R218 D236 L237	Q210-I214 WeakPolarHBondContact O-CD1 3.47Å; Q210-I214 VanDerWaalsContact O-CG1 3.3Å; Q210-I214 WeakPolarHBondContact O-CG1 3.18Å; Q210-I214 PolarHBondContact O-N 3.45Å; L211-I214 PolarHBondContact O-N 2.89Å; K212-I214 VanDerWaalsContact C-N 3.34Å; K212-I214 PolarHBondContact O-N 3.4Å; I214-S216 VanDerWaalsContact C-N 3.33Å; I214-K217 PolarHBondContact O-N 3.35Å; I214-R218 WeakPolarHBondContact O-CB 3.5Å; I214-R218 WeakPolarHBondContact O-CG 3.26Å; I214-R218 PolarHBondContact O-N 3.03Å; I214-R218 VanDerWaalsContact O-N 3.11Å; I214-D236 HydrophobicContact CD1-CB 3.62Å; I214-D236 HydrophobicContact CG1-CB 3.9Å; I214-L237 HydrophobicContact CD1-CD2 3.61Å; I214-L237 HydrophobicContact CD1-CG 3.7Å; I214-L237 HydrophobicContact CG2-CG 4.47Å
215	M	93.6	Very high	91.3	Very high	4 Å²	4	66.3 Å²	66.3	2%	0.02	36%	0.355	C	S	.	.	H	α-helix	trans	-62.6	-39.5	169.6	-70.6	173.1	67.5	0	0	111.5	L211 K212 R218 Y219 L226 L228 T255 I258 I259	L211-M215 HydrophobicContact CD1-CG 4.11Å; L211-M215 HydrophobicContact CD1-SD 4.06Å; L211-M215 HydrophobicContact CG-CG 4.43Å; L211-M215 HydrophobicContact CG-SD 3.9Å; L211-M215 WeakPolarHBondContact O-CB 3.28Å; L211-M215 VanDerWaalsContact O-CG 3.26Å; L211-M215 WeakPolarHBondContact O-CG 3.5Å; L211-M215 PolarHBondContact O-N 2.83Å; K212-M215 PolarHBondContact O-N 3.37Å; M215-R218 CarbonylContact O-C 3.53Å; M215-R218 PolarHBondContact O-N 2.94Å; M215-R218 VanDerWaalsContact O-N 3.13Å; M215-Y219 PolarHBondContact O-N 3.41Å; M215-Y219 VanDerWaalsContact O-N 3.11Å; M215-L226 HydrophobicContact CB-CD1 4.29Å; M215-L226 HydrophobicContact CE-CD2 3.92Å; M215-L226 VanDerWaalsContact O-CD1 3.25Å; M215-L226 WeakPolarHBondContact O-CD1 3.45Å; M215-L228 HydrophobicContact CG-CD2 3.9Å; M215-T255 HydrophobicContact CE-CG2 3.72Å; M215-T255 HydrophobicContact SD-CG2 4.06Å; M215-I258 HydrophobicContact CE-CB 3.93Å; M215-I258 HydrophobicContact CE-CG2 3.69Å; M215-I258 HydrophobicContact SD-CB 4.02Å; M215-I258 HydrophobicContact SD-CD1 3.7Å; M215-I258 HydrophobicContact SD-CG1 4.48Å; M215-I258 HydrophobicContact SD-CG2 3.76Å; M215-I259 HydrophobicContact CE-CD1 4.38Å; M215-I259 HydrophobicContact CE-CG1 3.88Å
216	S	94.2	Very high	91.9	Very high	80 Å²	80	61.7 Å²	61.7	56%	0.559	33%	0.325	S	S	*	.	H	α-helix	trans	-63.2	-43.9	174.2	-175.3	0	0	0	0	112.3	K212 L213 I214 R218 Y219	K212-S216 WeakPolarHBondContact O-CB 3.17Å; K212-S216 PolarHBondContact O-N 2.95Å; L213-S216 WeakPolarHBondContact O-CB 3.39Å; L213-S216 PolarHBondContact O-N 3.1Å; I214-S216 VanDerWaalsContact C-N 3.33Å; S216-R218 PolarHBondContact O-N 2.88Å; S216-Y219 PolarHBondContact O-N 3.17Å
217	K	93.8	Very high	92.4	Very high	138 Å²	138	59 Å²	59	60%	0.6	31%	0.314	S	S	*	.	H	α-helix	trans	-59.9	-26.9	171.5	-70.3	-176.3	-178.6	-175.8	0	113.8	L213 I214 D236	L213-K217 PolarHBondContact O-N 2.94Å; I214-K217 PolarHBondContact O-N 3.35Å; K217-D236 IonicContact NZ-OD1 2.69Å; K217-D236 IonicContact NZ-OD2 3.29Å; K217-D236 PolarHBondContact NZ-OD2 2.78Å
218	R	94	Very high	92.9	Very high	56 Å²	56	56.5 Å²	56.5	21%	0.211	30%	0.302	C	S	.	.	T	Hydrogen-bonded Turn	trans	-97.6	9.2	-178.7	-75.7	168.3	162.6	-95.5	2.2	113.4	I214 M215 S216 D227 K229 D234	I214-R218 WeakPolarHBondContact O-CB 3.5Å; I214-R218 WeakPolarHBondContact O-CG 3.26Å; I214-R218 PolarHBondContact O-N 3.03Å; I214-R218 VanDerWaalsContact O-N 3.11Å; M215-R218 CarbonylContact O-C 3.53Å; M215-R218 PolarHBondContact O-N 2.94Å; M215-R218 VanDerWaalsContact O-N 3.13Å; S216-R218 PolarHBondContact O-N 2.88Å; R218-D227 WeakPolarHBondContact CB-O 3.32Å; R218-D227 WeakPolarHBondContact CD-O 3.33Å; R218-D227 PolarHBondContact NH1-O 2.91Å; R218-D227 PolarHBondContact O-N 3.41Å; R218-K229 PolarHBondContact NH1-O 3.41Å; R218-D234 IonicContact CZ-OD2 2.69Å; R218-D234 IonicContact NE-OD2 3.57Å; R218-D234 PolarHBondContact NE-OD2 2.82Å; R218-D234 IonicContact NH2-OD2 2.67Å; R218-D234 PolarHBondContact NH2-OD2 3.32Å
219	Y	95.8	Very high	93.2	Very high	63 Å²	63	59.9 Å²	59.9	25%	0.247	31%	0.314	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-104.5	122	178.7	-179.8	-109.7	0	0	0	111.1	M215 S216 A225 L226 I263 L266	M215-Y219 PolarHBondContact O-N 3.41Å; M215-Y219 VanDerWaalsContact O-N 3.11Å; S216-Y219 PolarHBondContact O-N 3.17Å; Y219-A225 CarbonylContact C-O 3.56Å; Y219-A225 WeakPolarHBondContact CA-O 3.23Å; Y219-A225 WeakPolarHBondContact CD2-O 3.19Å; Y219-L226 HydrophobicContact CD2-CB 4.24Å; Y219-L226 HydrophobicContact CD2-CD1 4.35Å; Y219-I263 HydrophobicContact CD2-CD1 4.03Å; Y219-I263 HydrophobicContact CE1-CG2 4.14Å; Y219-I263 HydrophobicContact CE2-CD1 4.21Å; Y219-I263 HydrophobicContact CE2-CG2 4.26Å; Y219-L266 HydrophobicContact CD2-CD1 4.22Å; Y219-L266 HydrophobicContact CE2-CD1 3.78Å
220	D	94.5	Very high	93.3	Very high	72 Å²	72	55.2 Å²	55.2	39%	0.385	30%	0.295	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-92.8	105.2	169.7	-176.2	-13.9	0	0	0	109.3	S222 Q223 Q224 A225	D220-S222 PolarHBondContact O-N 3.42Å; D220-S222 WeakPolarHBondContact OD1-CA 3.41Å; D220-S222 VanDerWaalsContact OD1-CB 3.27Å; D220-S222 WeakPolarHBondContact OD1-CB 3.34Å; D220-S222 PolarHBondContact OD1-N 3.42Å; D220-S222 PolarHBondContact OD1-OG 3.16Å; D220-S222 PolarHBondContact OD2-OG 3.21Å; D220-Q223 HydrophobicContact CB-CB 4.47Å; D220-Q223 PolarHBondContact O-N 2.97Å; D220-Q223 PolarHBondContact OD1-N 2.95Å; D220-Q223 WeakPolarHBondContact OD2-CG 3.21Å; D220-Q224 WeakPolarHBondContact O-CA 3.39Å; D220-Q224 PolarHBondContact O-N 3.38Å; D220-A225 PolarHBondContact N-O 3.04Å; D220-A225 PolarHBondContact O-N 3.35Å
221	G	90.4	Very high	93.4	Very high	53 Å²	53	52.1 Å²	52.1	55%	0.546	28%	0.28	S	S	.	.	T	Hydrogen-bonded Turn	trans	-68.6	-15.7	177	0	0	0	0	0	114.7
222	S	90.7	Very high	93.3	Very high	90 Å²	90	58.8 Å²	58.8	63%	0.629	31%	0.305	S	S	*	.	T	Hydrogen-bonded Turn	trans	-81.1	-31.4	176.2	79.3	0	0	0	0	112.7	D220	D220-S222 PolarHBondContact O-N 3.42Å; D220-S222 WeakPolarHBondContact OD1-CA 3.41Å; D220-S222 VanDerWaalsContact OD1-CB 3.27Å; D220-S222 WeakPolarHBondContact OD1-CB 3.34Å; D220-S222 PolarHBondContact OD1-N 3.42Å; D220-S222 PolarHBondContact OD1-OG 3.16Å; D220-S222 PolarHBondContact OD2-OG 3.21Å
223	Q	90.3	Very high	93.1	Very high	126 Å²	126	60.1 Å²	60.1	59%	0.589	32%	0.323	S	S	*	.	T	Hydrogen-bonded Turn	trans	-102.2	-3.3	177.7	-58.3	-53.3	-64.4	0	0	113.1	D220 A225	D220-Q223 HydrophobicContact CB-CB 4.47Å; D220-Q223 PolarHBondContact O-N 2.97Å; D220-Q223 PolarHBondContact OD1-N 2.95Å; D220-Q223 WeakPolarHBondContact OD2-CG 3.21Å; Q223-A225 HydrophobicContact CB-CB 3.77Å; Q223-A225 PolarHBondContact O-N 2.74Å
224	Q	93.1	Very high	93	Very high	56 Å²	56	56.6 Å²	56.6	26%	0.262	30%	0.304	S	S	.	.	T	Hydrogen-bonded Turn	trans	45.6	50.9	-167.2	-63.5	-178.1	-60.8	0	0	111.1	D220 E265 L266 L267 S268	D220-Q224 WeakPolarHBondContact O-CA 3.39Å; D220-Q224 PolarHBondContact O-N 3.38Å; Q224-E265 PolarHBondContact NE2-OE2 3.01Å; Q224-L266 WeakPolarHBondContact O-CD1 3.23Å; Q224-L267 HydrophobicContact CB-CB 4.17Å; Q224-L267 HydrophobicContact CB-CD1 4.33Å; Q224-L267 HydrophobicContact CB-CG 3.95Å; Q224-L267 PolarHBondContact O-N 2.67Å; Q224-L267 VanDerWaalsContact OE1-CD1 3.25Å; Q224-S268 PolarHBondContact O-N 2.67Å; Q224-S268 VanDerWaalsContact O-N 3.08Å
225	A	95.3	Very high	92.8	Very high	21 Å²	21	61.2 Å²	61.2	17%	0.174	34%	0.335	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-125	135.4	-168.6	0	0	0	0	0	112.3	Y219 D220 Q223 S268	Y219-A225 CarbonylContact C-O 3.56Å; Y219-A225 WeakPolarHBondContact CA-O 3.23Å; Y219-A225 WeakPolarHBondContact CD2-O 3.19Å; D220-A225 PolarHBondContact N-O 3.04Å; D220-A225 PolarHBondContact O-N 3.35Å; Q223-A225 HydrophobicContact CB-CB 3.77Å; Q223-A225 PolarHBondContact O-N 2.74Å; A225-S268 CarbonylContact C-O 3.59Å; A225-S268 VanDerWaalsContact CA-O 3.32Å; A225-S268 WeakPolarHBondContact CA-O 3.36Å
226	L	97.1	Very high	92.6	Very high	3 Å²	3	63.7 Å²	63.7	2%	0.016	35%	0.348	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-119.1	118.3	-178.6	-177.1	69.8	0	0	0	111.5	M215 Y219 L228 I259 I263 L266 S268 L269 N270	M215-L226 HydrophobicContact CB-CD1 4.29Å; M215-L226 HydrophobicContact CE-CD2 3.92Å; M215-L226 VanDerWaalsContact O-CD1 3.25Å; M215-L226 WeakPolarHBondContact O-CD1 3.45Å; Y219-L226 HydrophobicContact CD2-CB 4.24Å; Y219-L226 HydrophobicContact CD2-CD1 4.35Å; L226-L228 HydrophobicContact CD1-CD2 4.11Å; L226-L228 HydrophobicContact CD2-CD1 3.97Å; L226-L228 HydrophobicContact CD2-CD2 4.01Å; L226-L228 HydrophobicContact CD2-CG 3.98Å; L226-L228 HydrophobicContact CG-CD1 4.5Å; L226-L228 HydrophobicContact CG-CD2 3.84Å; L226-L228 HydrophobicContact CG-CG 3.95Å; L226-I259 HydrophobicContact CD2-CD1 3.9Å; L226-I259 HydrophobicContact CD2-CG1 3.93Å; L226-I263 HydrophobicContact CD1-CD1 4.46Å; L226-I263 HydrophobicContact CD2-CD1 4.14Å; L226-L266 HydrophobicContact CB-CD1 3.7Å; L226-L266 HydrophobicContact CB-CD2 4.29Å; L226-L266 HydrophobicContact CD2-CD2 4.43Å; L226-S268 PolarHBondContact N-O 2.71Å; L226-L269 HydrophobicContact CB-CD1 4.22Å; L226-L269 HydrophobicContact CD2-CD1 3.98Å; L226-L269 HydrophobicContact CG-CD1 4.35Å; L226-N270 PolarHBondContact O-N 2.8Å
227	D	96.5	Very high	92.3	Very high	62 Å²	62	59.9 Å²	59.9	33%	0.332	32%	0.321	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-97.4	94.5	179.2	-169.6	19.7	0	0	0	113.8	R218 K229 N270	R218-D227 WeakPolarHBondContact CB-O 3.32Å; R218-D227 WeakPolarHBondContact CD-O 3.33Å; R218-D227 PolarHBondContact NH1-O 2.91Å; R218-D227 PolarHBondContact O-N 3.41Å; D227-K229 WeakPolarHBondContact OD1-CB 3.22Å; D227-K229 PolarHBondContact OD1-N 3.48Å; D227-N270 WeakPolarHBondContact OD1-CB 3.46Å; D227-N270 VanDerWaalsContact OD1-CG 3.29Å; D227-N270 PolarHBondContact OD1-ND2 3.42Å
228	L	95.1	Very high	92	Very high	0 Å²	0	57.9 Å²	57.9	0%	0	32%	0.32	C	S	.	.			trans	-97.1	20	172.8	-49.7	-176.4	0	0	0	112.6	M215 L226 G230 L231 L246 T255 L269 N270 L271 N274	M215-L228 HydrophobicContact CG-CD2 3.9Å; L226-L228 HydrophobicContact CD1-CD2 4.11Å; L226-L228 HydrophobicContact CD2-CD1 3.97Å; L226-L228 HydrophobicContact CD2-CD2 4.01Å; L226-L228 HydrophobicContact CD2-CG 3.98Å; L226-L228 HydrophobicContact CG-CD1 4.5Å; L226-L228 HydrophobicContact CG-CD2 3.84Å; L226-L228 HydrophobicContact CG-CG 3.95Å; L228-G230 PolarHBondContact O-N 2.88Å; L228-L231 PolarHBondContact O-N 2.88Å; L228-L246 HydrophobicContact CB-CD1 4.28Å; L228-T255 HydrophobicContact CD1-CG2 3.48Å; L228-T255 VanDerWaalsContact CD1-CG2 3.48Å; L228-L269 HydrophobicContact CD1-CD1 4.14Å; L228-L269 HydrophobicContact CG-CD1 4.36Å; L228-N270 CarbonylContact C-O 3.59Å; L228-N270 VanDerWaalsContact CA-O 3.27Å; L228-N270 WeakPolarHBondContact CA-O 3.46Å; L228-N270 WeakPolarHBondContact CB-O 3.4Å; L228-N270 PolarHBondContact N-O 2.65Å; L228-L271 HydrophobicContact CB-CD2 4.19Å; L228-L271 HydrophobicContact CD1-CD2 4.09Å; L228-N274 PolarHBondContact O-ND2 2.84Å; L228-N274 PolarHBondContact O-OD1 3Å
229	K	94.8	Very high	91.5	Very high	108 Å²	108	59.3 Å²	59.3	47%	0.47	34%	0.344	S	S	.	.	T	Hydrogen-bonded Turn	trans	-52.1	122.3	176	173.2	177.9	172.2	-170.9	0	111.8	R218 D227 L231 N270 S272	R218-K229 PolarHBondContact NH1-O 3.41Å; D227-K229 WeakPolarHBondContact OD1-CB 3.22Å; D227-K229 PolarHBondContact OD1-N 3.48Å; K229-L231 VanDerWaalsContact C-N 3.26Å; K229-L231 PolarHBondContact O-N 2.7Å; K229-N270 PolarHBondContact N-O 2.61Å; K229-S272 WeakPolarHBondContact CA-O 3.36Å; K229-S272 WeakPolarHBondContact CG-OG 3.49Å
230	G	92	Very high	90.9	Very high	10 Å²	10	60.2 Å²	60.2	10%	0.103	35%	0.351	C	S	.	.	T	Hydrogen-bonded Turn	trans	54.3	36.7	174.6	0	0	0	0	0	114.4	L228 R232 S233 S272 N274	L228-G230 PolarHBondContact O-N 2.88Å; G230-R232 PolarHBondContact O-N 3.13Å; G230-S233 PolarHBondContact O-N 3.49Å; G230-S233 PolarHBondContact O-OG 3.03Å; G230-S272 PolarHBondContact N-O 3.25Å; G230-N274 WeakPolarHBondContact CA-OD1 3.48Å; G230-N274 PolarHBondContact N-OD1 3.16Å
231	L	92	Very high	90.2	Very high	0 Å²	0	63.5 Å²	63.5	0%	0	37%	0.368	C	S	.	.	G	3₁₀ helix	trans	-46.5	-38.3	-166.5	-175.9	65.9	0	0	0	114.3	L211 L228 K229 S233 D234 L237 A244 L246 N274	L211-L231 HydrophobicContact CD1-CD2 3.91Å; L228-L231 PolarHBondContact O-N 2.88Å; K229-L231 VanDerWaalsContact C-N 3.26Å; K229-L231 PolarHBondContact O-N 2.7Å; L231-S233 PolarHBondContact O-N 2.86Å; L231-S233 VanDerWaalsContact O-N 3.08Å; L231-D234 VanDerWaalsContact O-CB 3.23Å; L231-D234 WeakPolarHBondContact O-CB 3.49Å; L231-D234 PolarHBondContact O-N 3.01Å; L231-L237 HydrophobicContact CD1-CD1 3.73Å; L231-L237 HydrophobicContact CG-CD1 3.72Å; L231-L237 WeakPolarHBondContact O-CD1 3.38Å; L231-A244 HydrophobicContact CD2-CB 4.3Å; L231-L246 HydrophobicContact CB-CD1 4.02Å; L231-L246 HydrophobicContact CB-CG 4.44Å; L231-L246 HydrophobicContact CD2-CD1 3.86Å; L231-L246 HydrophobicContact CD2-CD2 3.92Å; L231-L246 HydrophobicContact CD2-CG 3.85Å; L231-N274 PolarHBondContact N-OD1 3Å
232	R	88.3	Confident	89.8	Confident	139 Å²	139	61.5 Å²	61.5	53%	0.525	35%	0.345	S	S	.	.	G	3₁₀ helix	trans	-57.4	-23.1	177.5	-161.2	-171.1	-167.9	-155	3.2	114.5	G230 D243 V245	G230-R232 PolarHBondContact O-N 3.13Å; R232-D243 IonicContact CZ-OD1 3.68Å; R232-D243 IonicContact CZ-OD2 2.7Å; R232-D243 IonicContact NE-OD1 3.16Å; R232-D243 PolarHBondContact NE-OD1 2.75Å; R232-D243 VanDerWaalsContact NH2-CG 3.28Å; R232-D243 IonicContact NH2-OD1 3.03Å; R232-D243 PolarHBondContact NH2-OD1 2.71Å; R232-D243 IonicContact NH2-OD2 3.55Å; R232-D243 PolarHBondContact NH2-OD2 2.88Å; R232-V245 HydrophobicContact CG-CG2 4.26Å
233	S	88.8	Confident	89.3	Confident	92 Å²	92	60.7 Å²	60.7	64%	0.643	33%	0.334	S	S	*	.	G	3₁₀ helix	trans	-97.2	8.6	-180	59.8	0	0	0	0	114	G230 L231	G230-S233 PolarHBondContact O-N 3.49Å; G230-S233 PolarHBondContact O-OG 3.03Å; L231-S233 PolarHBondContact O-N 2.86Å; L231-S233 VanDerWaalsContact O-N 3.08Å
234	D	90.6	Very high	89	Confident	13 Å²	13	54.8 Å²	54.8	7%	0.07	31%	0.306	C	S	.	.			trans	-64.7	130.4	176.7	-173	-84.2	0	0	0	112.1	R218 L231 D236 L237 V238	R218-D234 IonicContact CZ-OD2 2.69Å; R218-D234 IonicContact NE-OD2 3.57Å; R218-D234 PolarHBondContact NE-OD2 2.82Å; R218-D234 IonicContact NH2-OD2 2.67Å; R218-D234 PolarHBondContact NH2-OD2 3.32Å; L231-D234 VanDerWaalsContact O-CB 3.23Å; L231-D234 WeakPolarHBondContact O-CB 3.49Å; L231-D234 PolarHBondContact O-N 3.01Å; D234-D236 VanDerWaalsContact C-N 3.33Å; D234-D236 PolarHBondContact O-N 2.88Å; D234-D236 WeakPolarHBondContact OD1-CB 3.13Å; D234-D236 PolarHBondContact OD1-N 2.75Å; D234-L237 HydrophobicContact CB-CB 4.18Å; D234-L237 HydrophobicContact CB-CD1 4Å; D234-L237 HydrophobicContact CB-CG 4.2Å; D234-L237 PolarHBondContact O-N 3.39Å; D234-L237 PolarHBondContact OD1-N 2.91Å; D234-V238 WeakPolarHBondContact O-CG2 3.39Å; D234-V238 PolarHBondContact O-N 3.03Å
235	P	89.1	Confident	88.7	Confident	100 Å²	100	53 Å²	53	65%	0.649	30%	0.299	S	S	*	.	H	α-helix	trans	-59.5	-35.6	-178.1	-26.5	35.7	0	0	0	114.9	A239	P235-A239 VanDerWaalsContact O-CB 3.24Å; P235-A239 WeakPolarHBondContact O-CB 3.34Å; P235-A239 PolarHBondContact O-N 2.8Å
236	D	88.7	Confident	88.3	Confident	55 Å²	55	52.1 Å²	52.1	29%	0.294	29%	0.292	S	S	.	.	H	α-helix	trans	-71.8	-42.8	-179.8	-71.1	-25.5	0	0	0	110.4	I214 K217 D234 V238 A239 Q240	I214-D236 HydrophobicContact CD1-CB 3.62Å; I214-D236 HydrophobicContact CG1-CB 3.9Å; K217-D236 IonicContact NZ-OD1 2.69Å; K217-D236 IonicContact NZ-OD2 3.29Å; K217-D236 PolarHBondContact NZ-OD2 2.78Å; D234-D236 VanDerWaalsContact C-N 3.33Å; D234-D236 PolarHBondContact O-N 2.88Å; D234-D236 WeakPolarHBondContact OD1-CB 3.13Å; D234-D236 PolarHBondContact OD1-N 2.75Å; D236-V238 VanDerWaalsContact C-N 3.34Å; D236-V238 PolarHBondContact O-N 3.31Å; D236-A239 PolarHBondContact O-N 3.29Å; D236-Q240 WeakPolarHBondContact O-CB 3.19Å; D236-Q240 WeakPolarHBondContact O-CG 3.48Å; D236-Q240 PolarHBondContact O-N 2.83Å
237	L	86.8	Confident	87.8	Confident	1 Å²	1	54 Å²	54	1%	0.005	30%	0.302	C	S	.	.	H	α-helix	trans	-62	-41.3	175.3	-73.7	174.8	0	0	0	111.8	I214 L231 D234 Q240 N241 I242 A244	I214-L237 HydrophobicContact CD1-CD2 3.61Å; I214-L237 HydrophobicContact CD1-CG 3.7Å; I214-L237 HydrophobicContact CG2-CG 4.47Å; L231-L237 HydrophobicContact CD1-CD1 3.73Å; L231-L237 HydrophobicContact CG-CD1 3.72Å; L231-L237 WeakPolarHBondContact O-CD1 3.38Å; D234-L237 HydrophobicContact CB-CB 4.18Å; D234-L237 HydrophobicContact CB-CD1 4Å; D234-L237 HydrophobicContact CB-CG 4.2Å; D234-L237 PolarHBondContact O-N 3.39Å; D234-L237 PolarHBondContact OD1-N 2.91Å; L237-Q240 PolarHBondContact O-N 2.73Å; L237-N241 PolarHBondContact O-N 2.67Å; L237-N241 VanDerWaalsContact O-N 3.13Å; L237-I242 HydrophobicContact CD2-CB 3.78Å; L237-I242 HydrophobicContact CD2-CD1 4.36Å; L237-I242 HydrophobicContact CD2-CG2 3.75Å; L237-I242 PolarHBondContact O-N 2.85Å; L237-A244 HydrophobicContact CD1-CB 3.84Å; L237-A244 HydrophobicContact CD2-CB 4.32Å
238	V	87.3	Confident	87.3	Confident	95 Å²	95	53.3 Å²	53.3	58%	0.576	29%	0.294	S	S	*	.	H	α-helix	trans	-66.6	-46.1	176.7	172.4	0	0	0	0	111	D234 D236 Q240 N241	D234-V238 WeakPolarHBondContact O-CG2 3.39Å; D234-V238 PolarHBondContact O-N 3.03Å; D236-V238 VanDerWaalsContact C-N 3.34Å; D236-V238 PolarHBondContact O-N 3.31Å; V238-Q240 VanDerWaalsContact C-N 3.27Å; V238-Q240 PolarHBondContact O-N 2.96Å; V238-N241 PolarHBondContact O-N 3.48Å
239	A	85.3	Confident	86.7	Confident	86 Å²	86	60.7 Å²	60.7	71%	0.711	32%	0.322	S	S	*	.	H	α-helix	trans	-61.4	-34.3	178.1	0	0	0	0	0	112.8	P235 D236	P235-A239 VanDerWaalsContact O-CB 3.24Å; P235-A239 WeakPolarHBondContact O-CB 3.34Å; P235-A239 PolarHBondContact O-N 2.8Å; D236-A239 PolarHBondContact O-N 3.29Å
240	Q	82	Confident	86.2	Confident	83 Å²	83	57.3 Å²	57.3	39%	0.388	31%	0.312	S	S	.	.	T	Hydrogen-bonded Turn	trans	-87	0.9	176.1	-63.6	-172.4	23.8	0	0	114.3	Q210 D236 L237 V238 I242	Q210-Q240 VanDerWaalsContact CB-OE1 3.26Å; D236-Q240 WeakPolarHBondContact O-CB 3.19Å; D236-Q240 WeakPolarHBondContact O-CG 3.48Å; D236-Q240 PolarHBondContact O-N 2.83Å; L237-Q240 PolarHBondContact O-N 2.73Å; V238-Q240 VanDerWaalsContact C-N 3.27Å; V238-Q240 PolarHBondContact O-N 2.96Å; Q240-I242 VanDerWaalsContact C-N 3.32Å; Q240-I242 HydrophobicContact CB-CD1 3.85Å; Q240-I242 HydrophobicContact CB-CG1 3.85Å; Q240-I242 PolarHBondContact O-N 3.37Å
241	N	79.1	Confident	86	Confident	141 Å²	141	56.9 Å²	56.9	75%	0.754	31%	0.307	S	S	*	.	T	Hydrogen-bonded Turn	trans	57.8	40.2	-177.7	-162	-1.4	0	0	0	113.2	L237 V238	L237-N241 PolarHBondContact O-N 2.67Å; L237-N241 VanDerWaalsContact O-N 3.13Å; V238-N241 PolarHBondContact O-N 3.48Å
242	I	83.4	Confident	86	Confident	11 Å²	11	57 Å²	57	6%	0.056	31%	0.308	C	S	.	.			trans	-103.8	102	179.5	-55.4	179.9	0	0	0	109.9	L203 Q207 Q210 L237 Q240 A244	L203-I242 HydrophobicContact CD2-CG2 3.95Å; Q207-I242 HydrophobicContact CB-CD1 4.13Å; Q207-I242 HydrophobicContact CB-CG1 4.46Å; Q207-I242 HydrophobicContact CB-CG2 4.21Å; Q207-I242 HydrophobicContact CG-CD1 4.23Å; Q207-I242 HydrophobicContact CG-CG1 4.24Å; Q210-I242 HydrophobicContact CB-CD1 3.75Å; Q210-I242 HydrophobicContact CG-CD1 4.43Å; L237-I242 HydrophobicContact CD2-CB 3.78Å; L237-I242 HydrophobicContact CD2-CD1 4.36Å; L237-I242 HydrophobicContact CD2-CG2 3.75Å; L237-I242 PolarHBondContact O-N 2.85Å; Q240-I242 VanDerWaalsContact C-N 3.32Å; Q240-I242 HydrophobicContact CB-CD1 3.85Å; Q240-I242 HydrophobicContact CB-CG1 3.85Å; Q240-I242 PolarHBondContact O-N 3.37Å; I242-A244 VanDerWaalsContact C-N 3.3Å; I242-A244 PolarHBondContact O-N 3.34Å
243	D	79.2	Confident	86	Confident	73 Å²	73	52.6 Å²	52.6	39%	0.39	30%	0.302	S	S	.	.			trans	-79.8	70.1	180	-166.2	23.7	0	0	0	112.6	R232 V245	R232-D243 IonicContact CZ-OD1 3.68Å; R232-D243 IonicContact CZ-OD2 2.7Å; R232-D243 IonicContact NE-OD1 3.16Å; R232-D243 PolarHBondContact NE-OD1 2.75Å; R232-D243 VanDerWaalsContact NH2-CG 3.28Å; R232-D243 IonicContact NH2-OD1 3.03Å; R232-D243 PolarHBondContact NH2-OD1 2.71Å; R232-D243 IonicContact NH2-OD2 3.55Å; R232-D243 PolarHBondContact NH2-OD2 2.88Å; D243-V245 PolarHBondContact O-N 2.97Å; D243-V245 VanDerWaalsContact O-N 3.09Å; D243-V245 VanDerWaalsContact OD1-CG2 3.27Å; D243-V245 WeakPolarHBondContact OD1-CG2 3.39Å
244	A	84.3	Confident	86.1	Confident	2 Å²	2	49 Å²	49	2%	0.017	28%	0.277	C	S	.	.			trans	-78.2	86	-179.8	0	0	0	0	0	112	L231 L237 I242	L231-A244 HydrophobicContact CD2-CB 4.3Å; L237-A244 HydrophobicContact CD1-CB 3.84Å; L237-A244 HydrophobicContact CD2-CB 4.32Å; I242-A244 VanDerWaalsContact C-N 3.3Å; I242-A244 PolarHBondContact O-N 3.34Å
245	V	87.3	Confident	86.3	Confident	18 Å²	18	48.5 Å²	48.5	11%	0.109	27%	0.274	C	S	.	.			trans	-98.4	102.8	-178.7	-161.8	0	0	0	0	111	R232 D243 N247 R248 C251	R232-V245 HydrophobicContact CG-CG2 4.26Å; D243-V245 PolarHBondContact O-N 2.97Å; D243-V245 VanDerWaalsContact O-N 3.09Å; D243-V245 VanDerWaalsContact OD1-CG2 3.27Å; D243-V245 WeakPolarHBondContact OD1-CG2 3.39Å; V245-N247 VanDerWaalsContact CG1-OD1 3.27Å; V245-N247 WeakPolarHBondContact CG1-OD1 3.34Å; V245-N247 PolarHBondContact O-N 3.06Å; V245-N247 VanDerWaalsContact O-N 3.15Å; V245-R248 HydrophobicContact CB-CG 4.23Å; V245-R248 WeakPolarHBondContact O-CB 3.35Å; V245-R248 PolarHBondContact O-N 3.05Å; V245-R248 VanDerWaalsContact O-N 3.07Å; V245-C251 WeakPolarHBondContact O-CB 3.49Å
246	L	87.8	Confident	86.5	Confident	3 Å²	3	43.9 Å²	43.9	2%	0.016	24%	0.244	C	C	.	.	T	Hydrogen-bonded Turn	trans	-63.3	-19.5	-174	-69.8	178.6	0	0	0	115.1	L228 L231 R248 M252 T255 L271 N274 L276	L228-L246 HydrophobicContact CB-CD1 4.28Å; L231-L246 HydrophobicContact CB-CD1 4.02Å; L231-L246 HydrophobicContact CB-CG 4.44Å; L231-L246 HydrophobicContact CD2-CD1 3.86Å; L231-L246 HydrophobicContact CD2-CD2 3.92Å; L231-L246 HydrophobicContact CD2-CG 3.85Å; L246-R248 PolarHBondContact O-N 2.63Å; L246-R248 VanDerWaalsContact O-N 3.16Å; L246-M252 HydrophobicContact CB-CE 4.19Å; L246-T255 HydrophobicContact CD2-CG2 4.12Å; L246-T255 VanDerWaalsContact CD2-OG1 3.24Å; L246-T255 WeakPolarHBondContact CD2-OG1 3.43Å; L246-L271 HydrophobicContact CD1-CD2 3.82Å; L246-N274 HydrophobicContact CB-CB 4.41Å; L246-N274 HydrophobicContact CD1-CB 4.46Å; L246-L276 HydrophobicContact CB-CD2 4.21Å
247	N	86.1	Confident	86.7	Confident	43 Å²	43	45.7 Å²	45.7	23%	0.23	25%	0.251	C	S	.	.	T	Hydrogen-bonded Turn	trans	-76.6	9.5	173.1	76.5	8.7	0	0	0	114.4	V245 R275 L276 F277	V245-N247 VanDerWaalsContact CG1-OD1 3.27Å; V245-N247 WeakPolarHBondContact CG1-OD1 3.34Å; V245-N247 PolarHBondContact O-N 3.06Å; V245-N247 VanDerWaalsContact O-N 3.15Å; N247-R275 VanDerWaalsContact CB-O 3.29Å; N247-R275 WeakPolarHBondContact CB-O 3.38Å; N247-R275 PolarHBondContact ND2-O 3.22Å; N247-L276 HydrophobicContact CB-CD2 4.06Å; N247-F277 HydrophobicContact CB-CD1 4.14Å; N247-F277 HydrophobicContact CB-CE1 3.86Å
248	R	84.9	Confident	87	Confident	47 Å²	47	46 Å²	46	18%	0.177	25%	0.253	C	S	.	.	S	Bend	trans	-109.4	124.1	172.1	-60.1	173.5	58	-141.4	-15.3	110.3	Q200 K201 V245 L246 S250 C251 M252	Q200-R248 PolarHBondContact O-NH2 3.26Å; K201-R248 PolarHBondContact O-NH1 3.45Å; K201-R248 PolarHBondContact O-NH2 3.01Å; V245-R248 HydrophobicContact CB-CG 4.23Å; V245-R248 WeakPolarHBondContact O-CB 3.35Å; V245-R248 PolarHBondContact O-N 3.05Å; V245-R248 VanDerWaalsContact O-N 3.07Å; L246-R248 PolarHBondContact O-N 2.63Å; L246-R248 VanDerWaalsContact O-N 3.16Å; R248-S250 VanDerWaalsContact C-N 3.26Å; R248-S250 PolarHBondContact NH2-OG 3.2Å; R248-S250 PolarHBondContact O-N 3.2Å; R248-C251 PolarHBondContact O-N 3.24Å; R248-M252 PolarHBondContact O-N 3.44Å
249	R	83.6	Confident	87.3	Confident	154 Å²	154	41.6 Å²	41.6	58%	0.581	23%	0.226	S	C	*	.	H	α-helix	trans	-35.9	-49.3	174.9	-172.7	168.5	-67	-154.9	-8.5	115.6	M252 A253 D280 D281	R249-M252 PolarHBondContact O-N 2.92Å; R249-A253 WeakPolarHBondContact O-CB 3.17Å; R249-A253 PolarHBondContact O-N 2.88Å; R249-D280 IonicContact NH2-OD2 3.2Å; R249-D281 VanDerWaalsContact CA-OD2 3.26Å; R249-D281 WeakPolarHBondContact CA-OD2 3.41Å; R249-D281 HydrophobicContact CB-CB 4.49Å; R249-D281 VanDerWaalsContact CB-OD2 3.3Å; R249-D281 WeakPolarHBondContact CB-OD2 3.31Å; R249-D281 IonicContact CZ-OD1 3.31Å; R249-D281 PolarHBondContact N-OD2 3.42Å; R249-D281 IonicContact NE-OD1 2.64Å; R249-D281 PolarHBondContact NE-OD1 3.11Å; R249-D281 IonicContact NH2-OD1 3.12Å; R249-D281 PolarHBondContact NH2-OD1 2.69Å
250	S	84.1	Confident	87.7	Confident	37 Å²	37	41.7 Å²	41.7	26%	0.259	21%	0.211	S	C	.	.	H	α-helix	trans	-64.4	-41.4	-177.1	52.4	0	0	0	0	112.8	R248 A254	R248-S250 VanDerWaalsContact C-N 3.26Å; R248-S250 PolarHBondContact NH2-OG 3.2Å; R248-S250 PolarHBondContact O-N 3.2Å; S250-A254 WeakPolarHBondContact O-CB 3.32Å; S250-A254 PolarHBondContact O-N 3.37Å; S250-A254 VanDerWaalsContact O-N 3.16Å
251	C	87.8	Confident	88.3	Confident	1 Å²	1	43.3 Å²	43.3	1%	0.007	22%	0.219	C	C	.	.	H	α-helix	trans	-73.3	-40.8	177.9	-60.6	0	0	0	0	111.3	L203 V245 R248 T255	L203-C251 HydrophobicContact CD1-CB 4.45Å; V245-C251 WeakPolarHBondContact O-CB 3.49Å; R248-C251 PolarHBondContact O-N 3.24Å; C251-T255 WeakPolarHBondContact O-CB 3.37Å; C251-T255 PolarHBondContact O-N 2.86Å; C251-T255 PolarHBondContact O-OG1 3.1Å
252	M	91.2	Very high	88.9	Confident	4 Å²	4	39.9 Å²	39.9	2%	0.02	20%	0.201	C	C	.	.	H	α-helix	trans	-63.1	-47.6	174.7	-176.7	56.4	76.5	0	0	111.6	L246 R248 R249 A254 T255 L256 L276 D281 M282	L246-M252 HydrophobicContact CB-CE 4.19Å; R248-M252 PolarHBondContact O-N 3.44Å; R249-M252 PolarHBondContact O-N 2.92Å; M252-A254 PolarHBondContact O-N 3.22Å; M252-T255 WeakPolarHBondContact O-CB 3.45Å; M252-T255 PolarHBondContact O-N 3.43Å; M252-L256 HydrophobicContact CG-CD1 3.77Å; M252-L256 HydrophobicContact CG-CG 4.32Å; M252-L256 WeakPolarHBondContact O-CB 3.29Å; M252-L256 VanDerWaalsContact O-CG 3.26Å; M252-L256 WeakPolarHBondContact O-CG 3.32Å; M252-L256 PolarHBondContact O-N 3.47Å; M252-L256 HydrophobicContact SD-CD1 3.89Å; M252-L256 HydrophobicContact SD-CD2 4.43Å; M252-L256 HydrophobicContact SD-CG 3.94Å; M252-L276 HydrophobicContact CE-CD1 4.38Å; M252-L276 HydrophobicContact CE-CD2 3.93Å; M252-D281 WeakPolarHBondContact CG-O 3.42Å; M252-M282 HydrophobicContact CE-CB 4.17Å; M252-M282 HydrophobicContact CE-SD 4.44Å; M252-M282 HydrophobicContact CG-CB 3.81Å; M252-M282 HydrophobicContact SD-CB 3.77Å
253	A	89.4	Confident	89.4	Confident	46 Å²	46	40.8 Å²	40.8	38%	0.38	21%	0.205	S	C	.	.	H	α-helix	trans	-60.3	-43.7	178.9	0	0	0	0	0	112.5	R249 L256 Q257	R249-A253 WeakPolarHBondContact O-CB 3.17Å; R249-A253 PolarHBondContact O-N 2.88Å; A253-L256 PolarHBondContact O-N 3.39Å; A253-Q257 WeakPolarHBondContact O-CB 3.33Å; A253-Q257 PolarHBondContact O-N 2.66Å
254	A	90.9	Very high	89.9	Confident	16 Å²	16	40.3 Å²	40.3	13%	0.132	21%	0.207	C	C	.	.	H	α-helix	trans	-62.8	-44.3	174.7	0	0	0	0	0	112	S250 M252 L256 Q257 I258	S250-A254 WeakPolarHBondContact O-CB 3.32Å; S250-A254 PolarHBondContact O-N 3.37Å; S250-A254 VanDerWaalsContact O-N 3.16Å; M252-A254 PolarHBondContact O-N 3.22Å; A254-L256 VanDerWaalsContact C-N 3.34Å; A254-L256 PolarHBondContact O-N 3.14Å; A254-Q257 PolarHBondContact O-N 3.16Å; A254-I258 WeakPolarHBondContact O-CG1 3.43Å; A254-I258 PolarHBondContact O-N 2.86Å
255	T	93.3	Very high	90.1	Very high	2 Å²	2	46 Å²	46	1%	0.012	23%	0.233	C	C	.	.	H	α-helix	trans	-59.6	-44.6	176.4	-55.8	0	0	0	0	111.4	M215 L228 L246 C251 M252 I258 I259	M215-T255 HydrophobicContact CE-CG2 3.72Å; M215-T255 HydrophobicContact SD-CG2 4.06Å; L228-T255 HydrophobicContact CD1-CG2 3.48Å; L228-T255 VanDerWaalsContact CD1-CG2 3.48Å; L246-T255 HydrophobicContact CD2-CG2 4.12Å; L246-T255 VanDerWaalsContact CD2-OG1 3.24Å; L246-T255 WeakPolarHBondContact CD2-OG1 3.43Å; C251-T255 WeakPolarHBondContact O-CB 3.37Å; C251-T255 PolarHBondContact O-N 2.86Å; C251-T255 PolarHBondContact O-OG1 3.1Å; M252-T255 WeakPolarHBondContact O-CB 3.45Å; M252-T255 PolarHBondContact O-N 3.43Å; T255-I258 PolarHBondContact O-N 2.86Å; T255-I259 WeakPolarHBondContact O-CG1 3.46Å; T255-I259 PolarHBondContact O-N 2.98Å; T255-I259 VanDerWaalsContact O-N 3.11Å
256	L	93.8	Very high	90.4	Very high	3 Å²	3	45.1 Å²	45.1	2%	0.016	23%	0.227	C	C	.	.	H	α-helix	trans	-70.2	-29.8	178.2	-68	172.5	0	0	0	112.7	M252 A253 A254 I259 E260 M282 I285 K288	M252-L256 HydrophobicContact CG-CD1 3.77Å; M252-L256 HydrophobicContact CG-CG 4.32Å; M252-L256 WeakPolarHBondContact O-CB 3.29Å; M252-L256 VanDerWaalsContact O-CG 3.26Å; M252-L256 WeakPolarHBondContact O-CG 3.32Å; M252-L256 PolarHBondContact O-N 3.47Å; M252-L256 HydrophobicContact SD-CD1 3.89Å; M252-L256 HydrophobicContact SD-CD2 4.43Å; M252-L256 HydrophobicContact SD-CG 3.94Å; A253-L256 PolarHBondContact O-N 3.39Å; A254-L256 VanDerWaalsContact C-N 3.34Å; A254-L256 PolarHBondContact O-N 3.14Å; L256-I259 HydrophobicContact CD2-CD1 4.46Å; L256-E260 PolarHBondContact O-N 2.82Å; L256-E260 VanDerWaalsContact O-N 3.14Å; L256-M282 HydrophobicContact CD1-CB 3.98Å; L256-I285 HydrophobicContact CD2-CB 4.23Å; L256-I285 HydrophobicContact CD2-CD1 3.57Å; L256-I285 HydrophobicContact CD2-CG1 4.43Å; L256-K288 HydrophobicContact CB-CD 3.73Å
257	Q	92.6	Very high	90.8	Very high	94 Å²	94	47.3 Å²	47.3	44%	0.439	24%	0.239	S	C	.	.	H	α-helix	trans	-69.6	-42.2	171.2	-178.3	173.3	-10	0	0	111.8	A253 A254 I259 E260 E261	A253-Q257 WeakPolarHBondContact O-CB 3.33Å; A253-Q257 PolarHBondContact O-N 2.66Å; A254-Q257 PolarHBondContact O-N 3.16Å; Q257-I259 VanDerWaalsContact C-N 3.27Å; Q257-I259 PolarHBondContact O-N 3.1Å; Q257-E260 PolarHBondContact O-N 3.36Å; Q257-E261 HydrophobicContact CG-CG 4.24Å; Q257-E261 WeakPolarHBondContact CG-OE1 3.4Å; Q257-E261 PolarHBondContact NE2-OE1 2.88Å; Q257-E261 WeakPolarHBondContact O-CB 3.43Å; Q257-E261 WeakPolarHBondContact O-CG 3.3Å; Q257-E261 PolarHBondContact O-N 3.17Å
258	I	93.6	Very high	91.3	Very high	8 Å²	8	46.8 Å²	46.8	4%	0.041	24%	0.239	C	C	.	.	H	α-helix	trans	-59.1	-39.5	173.5	-66.2	161.6	0	0	0	110.9	V208 L211 K212 M215 A254 T255 N262	V208-I258 HydrophobicContact CG1-CD1 4.06Å; V208-I258 HydrophobicContact CG1-CG1 4.37Å; L211-I258 HydrophobicContact CB-CD1 4.42Å; L211-I258 HydrophobicContact CD2-CD1 3.98Å; L211-I258 HydrophobicContact CG-CD1 3.93Å; K212-I258 HydrophobicContact CB-CD1 4.02Å; K212-I258 HydrophobicContact CB-CG1 4.25Å; K212-I258 HydrophobicContact CB-CG2 4.04Å; K212-I258 HydrophobicContact CG-CG2 4.1Å; M215-I258 HydrophobicContact CE-CB 3.93Å; M215-I258 HydrophobicContact CE-CG2 3.69Å; M215-I258 HydrophobicContact SD-CB 4.02Å; M215-I258 HydrophobicContact SD-CD1 3.7Å; M215-I258 HydrophobicContact SD-CG1 4.48Å; M215-I258 HydrophobicContact SD-CG2 3.76Å; A254-I258 WeakPolarHBondContact O-CG1 3.43Å; A254-I258 PolarHBondContact O-N 2.86Å; T255-I258 PolarHBondContact O-N 2.86Å; I258-N262 WeakPolarHBondContact O-CB 3.34Å; I258-N262 PolarHBondContact O-N 3.29Å; I258-N262 PolarHBondContact O-ND2 2.97Å
259	I	94.1	Very high	91.9	Very high	1 Å²	1	44.7 Å²	44.7	1%	0.005	23%	0.231	C	C	.	.	H	α-helix	trans	-62.6	-51.7	175.4	-69	166.1	0	0	0	111.2	M215 L226 T255 L256 Q257 E261 N262 I263 L266 L269 A289	M215-I259 HydrophobicContact CE-CD1 4.38Å; M215-I259 HydrophobicContact CE-CG1 3.88Å; L226-I259 HydrophobicContact CD2-CD1 3.9Å; L226-I259 HydrophobicContact CD2-CG1 3.93Å; T255-I259 WeakPolarHBondContact O-CG1 3.46Å; T255-I259 PolarHBondContact O-N 2.98Å; T255-I259 VanDerWaalsContact O-N 3.11Å; L256-I259 HydrophobicContact CD2-CD1 4.46Å; Q257-I259 VanDerWaalsContact C-N 3.27Å; Q257-I259 PolarHBondContact O-N 3.1Å; I259-E261 PolarHBondContact O-N 2.95Å; I259-N262 PolarHBondContact O-N 3.04Å; I259-I263 HydrophobicContact CB-CG1 4.44Å; I259-I263 HydrophobicContact CG1-CD1 4.39Å; I259-I263 HydrophobicContact CG2-CG1 4.35Å; I259-I263 CarbonylContact O-C 3.58Å; I259-I263 WeakPolarHBondContact O-CA 3.48Å; I259-I263 PolarHBondContact O-N 2.83Å; I259-L266 HydrophobicContact CD1-CD2 4.31Å; I259-L266 HydrophobicContact CG2-CD2 4.01Å; I259-L269 HydrophobicContact CD1-CD1 4.43Å; I259-A289 HydrophobicContact CG2-CB 4.12Å
260	E	94.2	Very high	92.5	Very high	88 Å²	88	38.8 Å²	38.8	41%	0.411	21%	0.211	S	C	.	.	H	α-helix	trans	-57.9	-44	179.6	-179	178.1	-130.8	0	0	113	L256 Q257 K288	L256-E260 PolarHBondContact O-N 2.82Å; L256-E260 VanDerWaalsContact O-N 3.14Å; Q257-E260 PolarHBondContact O-N 3.36Å; E260-K288 HydrophobicContact CB-CB 4.04Å; E260-K288 HydrophobicContact CB-CG 4.04Å; E260-K288 HydrophobicContact CG-CG 4.25Å; E260-K288 IonicContact OE1-NZ 3.43Å; E260-K288 IonicContact OE2-NZ 3.41Å; E260-K288 PolarHBondContact OE2-NZ 2.89Å
261	E	92.9	Very high	93.1	Very high	117 Å²	117	37.1 Å²	37.1	55%	0.547	20%	0.199	S	C	.	.	H	α-helix	trans	-78.2	-23	-174.6	-72.6	174.6	-179.5	0	0	114.3	Q257 I259	Q257-E261 HydrophobicContact CG-CG 4.24Å; Q257-E261 WeakPolarHBondContact CG-OE1 3.4Å; Q257-E261 PolarHBondContact NE2-OE1 2.88Å; Q257-E261 WeakPolarHBondContact O-CB 3.43Å; Q257-E261 WeakPolarHBondContact O-CG 3.3Å; Q257-E261 PolarHBondContact O-N 3.17Å; I259-E261 PolarHBondContact O-N 2.95Å
262	N	93.4	Very high	93.5	Very high	69 Å²	69	37.3 Å²	37.3	37%	0.369	20%	0.2	S	C	.	.	H	α-helix	trans	-126	-28.2	-167.9	-54.1	-99.2	0	0	0	113.9	K212 I258 I259	K212-N262 WeakPolarHBondContact CE-OD1 3.38Å; K212-N262 PolarHBondContact NZ-OD1 2.84Å; I258-N262 WeakPolarHBondContact O-CB 3.34Å; I258-N262 PolarHBondContact O-N 3.29Å; I258-N262 PolarHBondContact O-ND2 2.97Å; I259-N262 PolarHBondContact O-N 3.04Å
263	I	92.8	Very high	93.6	Very high	30 Å²	30	40.3 Å²	40.3	15%	0.154	22%	0.216	C	C	.	.			trans	-145.7	56.9	-175.4	49.9	176.7	0	0	0	112.6	Y219 L226 I259 E265 L266	Y219-I263 HydrophobicContact CD2-CD1 4.03Å; Y219-I263 HydrophobicContact CE1-CG2 4.14Å; Y219-I263 HydrophobicContact CE2-CD1 4.21Å; Y219-I263 HydrophobicContact CE2-CG2 4.26Å; L226-I263 HydrophobicContact CD1-CD1 4.46Å; L226-I263 HydrophobicContact CD2-CD1 4.14Å; I259-I263 HydrophobicContact CB-CG1 4.44Å; I259-I263 HydrophobicContact CG1-CD1 4.39Å; I259-I263 HydrophobicContact CG2-CG1 4.35Å; I259-I263 CarbonylContact O-C 3.58Å; I259-I263 WeakPolarHBondContact O-CA 3.48Å; I259-I263 PolarHBondContact O-N 2.83Å; I263-E265 PolarHBondContact O-N 2.98Å; I263-E265 VanDerWaalsContact O-N 3.14Å; I263-L266 HydrophobicContact CD1-CD1 4.38Å; I263-L266 WeakPolarHBondContact O-CB 3.14Å; I263-L266 PolarHBondContact O-N 3.28Å; I263-L266 VanDerWaalsContact O-N 3.17Å
264	P	88.9	Confident	93.8	Very high	64 Å²	64	38.6 Å²	38.6	42%	0.416	20%	0.201	S	C	.	.	T	Hydrogen-bonded Turn	trans	-65.3	-15.4	179.4	28.7	-36.7	0	0	0	114	L266	P264-L266 VanDerWaalsContact C-N 3.29Å; P264-L266 PolarHBondContact O-N 2.86Å
265	E	89.8	Confident	93.9	Very high	121 Å²	121	45.5 Å²	45.5	57%	0.565	22%	0.224	S	C	*	.	T	Hydrogen-bonded Turn	trans	-83.6	3.5	176.5	-58.2	-171.6	157.6	0	0	114.1	Q224 I263 L267	Q224-E265 PolarHBondContact NE2-OE2 3.01Å; I263-E265 PolarHBondContact O-N 2.98Å; I263-E265 VanDerWaalsContact O-N 3.14Å; E265-L267 PolarHBondContact O-N 3.48Å
266	L	93.6	Very high	93.8	Very high	0 Å²	0	45.6 Å²	45.6	0%	0	22%	0.224	C	C	.	.			trans	-50.9	119.9	-177.3	-175.8	70.7	0	0	0	112.9	Y219 Q224 L226 I259 I263 P264 S268 L269 L292	Y219-L266 HydrophobicContact CD2-CD1 4.22Å; Y219-L266 HydrophobicContact CE2-CD1 3.78Å; Q224-L266 WeakPolarHBondContact O-CD1 3.23Å; L226-L266 HydrophobicContact CB-CD1 3.7Å; L226-L266 HydrophobicContact CB-CD2 4.29Å; L226-L266 HydrophobicContact CD2-CD2 4.43Å; I259-L266 HydrophobicContact CD1-CD2 4.31Å; I259-L266 HydrophobicContact CG2-CD2 4.01Å; I263-L266 HydrophobicContact CD1-CD1 4.38Å; I263-L266 WeakPolarHBondContact O-CB 3.14Å; I263-L266 PolarHBondContact O-N 3.28Å; I263-L266 VanDerWaalsContact O-N 3.17Å; P264-L266 VanDerWaalsContact C-N 3.29Å; P264-L266 PolarHBondContact O-N 2.86Å; L266-S268 WeakPolarHBondContact CD1-O 3.41Å; L266-L269 HydrophobicContact CD2-CB 4.18Å; L266-L269 HydrophobicContact CD2-CD1 4.3Å; L266-L292 HydrophobicContact CD2-CD1 4.23Å; L266-L292 HydrophobicContact CG-CD1 4.12Å; L266-L292 WeakPolarHBondContact O-CA 3.38Å; L266-L292 PolarHBondContact O-N 3.4Å
267	L	95.3	Very high	93.7	Very high	48 Å²	48	50.2 Å²	50.2	25%	0.251	24%	0.244	S	C	.	.			trans	-95.1	-30	179.6	-60.3	-172.5	0	0	0	113.1	Q224 E265 N291 K293 T294	Q224-L267 HydrophobicContact CB-CB 4.17Å; Q224-L267 HydrophobicContact CB-CD1 4.33Å; Q224-L267 HydrophobicContact CB-CG 3.95Å; Q224-L267 PolarHBondContact O-N 2.67Å; Q224-L267 VanDerWaalsContact OE1-CD1 3.25Å; E265-L267 PolarHBondContact O-N 3.48Å; L267-N291 HydrophobicContact CD2-CB 4.17Å; L267-N291 WeakPolarHBondContact CD2-O 3.24Å; L267-K293 HydrophobicContact CD2-CD 4.28Å; L267-K293 PolarHBondContact O-N 3.27Å; L267-T294 PolarHBondContact O-N 2.79Å
268	S	96.8	Very high	93.6	Very high	33 Å²	33	50.5 Å²	50.5	23%	0.231	24%	0.244	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-133.8	132.1	-175.5	-175.9	0	0	0	0	113.1	Q224 A225 L226 L266 T294	Q224-S268 PolarHBondContact O-N 2.67Å; Q224-S268 VanDerWaalsContact O-N 3.08Å; A225-S268 CarbonylContact C-O 3.59Å; A225-S268 VanDerWaalsContact CA-O 3.32Å; A225-S268 WeakPolarHBondContact CA-O 3.36Å; L226-S268 PolarHBondContact N-O 2.71Å; L266-S268 WeakPolarHBondContact CD1-O 3.41Å; S268-T294 WeakPolarHBondContact CA-O 3.22Å
269	L	97.3	Very high	93.6	Very high	2 Å²	2	50.1 Å²	50.1	1%	0.01	24%	0.242	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-133.8	120.5	-177	177.7	59.3	0	0	0	111.5	L226 L228 I259 L266 L271 I285 L292 T294 L295 N296	L226-L269 HydrophobicContact CB-CD1 4.22Å; L226-L269 HydrophobicContact CD2-CD1 3.98Å; L226-L269 HydrophobicContact CG-CD1 4.35Å; L228-L269 HydrophobicContact CD1-CD1 4.14Å; L228-L269 HydrophobicContact CG-CD1 4.36Å; I259-L269 HydrophobicContact CD1-CD1 4.43Å; L266-L269 HydrophobicContact CD2-CB 4.18Å; L266-L269 HydrophobicContact CD2-CD1 4.3Å; L269-L271 HydrophobicContact CD1-CG 4.35Å; L269-L271 HydrophobicContact CD2-CD1 3.91Å; L269-L271 HydrophobicContact CD2-CG 4.31Å; L269-L271 HydrophobicContact CG-CD1 4.19Å; L269-L271 HydrophobicContact CG-CG 4.07Å; L269-I285 HydrophobicContact CD2-CD1 4.07Å; L269-L292 HydrophobicContact CB-CD1 3.65Å; L269-L292 HydrophobicContact CB-CD2 4.19Å; L269-L292 HydrophobicContact CD2-CD2 4.36Å; L269-T294 PolarHBondContact N-O 3.5Å; L269-L295 HydrophobicContact CB-CD1 4.3Å; L269-L295 HydrophobicContact CD2-CD1 4.26Å; L269-L295 HydrophobicContact CG-CD1 4.28Å; L269-L295 WeakPolarHBondContact O-CA 3.28Å; L269-N296 PolarHBondContact O-N 3.17Å
270	N	97.1	Very high	93.4	Very high	30 Å²	30	52.4 Å²	52.4	16%	0.16	25%	0.254	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-103.5	115	174.3	-173.7	10	0	0	0	111.5	L226 D227 L228 K229 S272 N296	L226-N270 PolarHBondContact O-N 2.8Å; D227-N270 WeakPolarHBondContact OD1-CB 3.46Å; D227-N270 VanDerWaalsContact OD1-CG 3.29Å; D227-N270 PolarHBondContact OD1-ND2 3.42Å; L228-N270 CarbonylContact C-O 3.59Å; L228-N270 VanDerWaalsContact CA-O 3.27Å; L228-N270 WeakPolarHBondContact CA-O 3.46Å; L228-N270 WeakPolarHBondContact CB-O 3.4Å; L228-N270 PolarHBondContact N-O 2.65Å; K229-N270 PolarHBondContact N-O 2.61Å; N270-S272 WeakPolarHBondContact OD1-CB 3.26Å; N270-S272 PolarHBondContact OD1-N 2.86Å; N270-S272 PolarHBondContact OD1-OG 3.38Å; N270-N296 HydrophobicContact CB-CB 4.34Å
271	L	96.1	Very high	93.1	Very high	3 Å²	3	50.1 Å²	50.1	2%	0.016	25%	0.245	C	C	.	.			trans	-115.8	18.1	176.6	-74.4	168.4	0	0	0	111.8	L228 L246 L269 N274 L276 M282 L295 N296 L297 N300	L228-L271 HydrophobicContact CB-CD2 4.19Å; L228-L271 HydrophobicContact CD1-CD2 4.09Å; L246-L271 HydrophobicContact CD1-CD2 3.82Å; L269-L271 HydrophobicContact CD1-CG 4.35Å; L269-L271 HydrophobicContact CD2-CD1 3.91Å; L269-L271 HydrophobicContact CD2-CG 4.31Å; L269-L271 HydrophobicContact CG-CD1 4.19Å; L269-L271 HydrophobicContact CG-CG 4.07Å; L271-N274 PolarHBondContact O-ND2 2.55Å; L271-L276 HydrophobicContact CB-CD1 4.26Å; L271-M282 HydrophobicContact CD1-CE 3.67Å; L271-M282 HydrophobicContact CD1-SD 4.03Å; L271-L295 HydrophobicContact CD1-CD1 4.26Å; L271-N296 CarbonylContact C-O 3.53Å; L271-N296 WeakPolarHBondContact CA-O 3.38Å; L271-N296 PolarHBondContact N-O 2.77Å; L271-L297 HydrophobicContact CB-CD2 4.01Å; L271-L297 HydrophobicContact CD1-CD2 4.22Å; L271-N300 PolarHBondContact O-ND2 2.86Å
272	S	95.8	Very high	93.1	Very high	4 Å²	4	44.7 Å²	44.7	3%	0.028	22%	0.219	C	C	.	.	T	Hydrogen-bonded Turn	trans	-62.6	152.3	-177.8	62.7	0	0	0	0	113.8	K229 G230 N270 N274 N296 S298	K229-S272 WeakPolarHBondContact CA-O 3.36Å; K229-S272 WeakPolarHBondContact CG-OG 3.49Å; G230-S272 PolarHBondContact N-O 3.25Å; N270-S272 WeakPolarHBondContact OD1-CB 3.26Å; N270-S272 PolarHBondContact OD1-N 2.86Å; N270-S272 PolarHBondContact OD1-OG 3.38Å; S272-N274 PolarHBondContact O-N 2.72Å; S272-N274 PolarHBondContact O-ND2 2.89Å; S272-N296 PolarHBondContact N-O 2.95Å; S272-S298 CarbonylContact C-O 3.59Å; S272-S298 WeakPolarHBondContact CA-O 3.48Å; S272-S298 WeakPolarHBondContact CB-O 3.17Å; S272-S298 WeakPolarHBondContact CB-OG 3.27Å
273	N	94.1	Very high	93	Very high	67 Å²	67	44.1 Å²	44.1	36%	0.358	22%	0.221	S	C	.	.	T	Hydrogen-bonded Turn	trans	61.4	22.4	174	-51.7	-90	0	0	0	115.3	S298 G299	N273-S298 PolarHBondContact N-O 3.03Å; N273-G299 WeakPolarHBondContact CA-O 3.41Å
274	N	93.5	Very high	92.9	Very high	11 Å²	11	44.6 Å²	44.6	6%	0.059	23%	0.227	C	C	.	.	S	Bend	trans	-97	4.8	-177	-77.8	-58.1	0	0	0	114.9	L228 G230 L231 L246 L271 S272 L276 N300	L228-N274 PolarHBondContact O-ND2 2.84Å; L228-N274 PolarHBondContact O-OD1 3Å; G230-N274 WeakPolarHBondContact CA-OD1 3.48Å; G230-N274 PolarHBondContact N-OD1 3.16Å; L231-N274 PolarHBondContact N-OD1 3Å; L246-N274 HydrophobicContact CB-CB 4.41Å; L246-N274 HydrophobicContact CD1-CB 4.46Å; L271-N274 PolarHBondContact O-ND2 2.55Å; S272-N274 PolarHBondContact O-N 2.72Å; S272-N274 PolarHBondContact O-ND2 2.89Å; N274-L276 VanDerWaalsContact C-N 3.26Å; N274-L276 HydrophobicContact CB-CD2 4.43Å; N274-L276 HydrophobicContact CB-CG 4.14Å; N274-L276 PolarHBondContact O-N 2.97Å; N274-N300 WeakPolarHBondContact CA-OD1 3.49Å; N274-N300 PolarHBondContact N-OD1 3.37Å
275	R	91.9	Very high	93.1	Very high	161 Å²	161	41.5 Å²	41.5	61%	0.608	21%	0.207	S	C	*	.			trans	55	39.7	-178.2	-54.3	-173.9	-163.1	-178.1	2.8	113.1	N247 F277 N300 E301	N247-R275 VanDerWaalsContact CB-O 3.29Å; N247-R275 WeakPolarHBondContact CB-O 3.38Å; N247-R275 PolarHBondContact ND2-O 3.22Å; R275-F277 PolarHBondContact O-N 3.48Å; R275-N300 PolarHBondContact N-OD1 3.1Å; R275-E301 HydrophobicContact CB-CG 4.39Å; R275-E301 WeakPolarHBondContact CB-OE1 3.36Å; R275-E301 WeakPolarHBondContact CD-OE1 3.34Å; R275-E301 WeakPolarHBondContact CG-OE1 3.23Å
276	L	92.3	Very high	93.2	Very high	4 Å²	4	38 Å²	38	2%	0.021	19%	0.194	C	C	.	.			trans	-69.8	117.8	171	-56.9	178.6	0	0	0	108.8	L246 N247 M252 L271 N274 L297 N300 E301 L302	L246-L276 HydrophobicContact CB-CD2 4.21Å; N247-L276 HydrophobicContact CB-CD2 4.06Å; M252-L276 HydrophobicContact CE-CD1 4.38Å; M252-L276 HydrophobicContact CE-CD2 3.93Å; L271-L276 HydrophobicContact CB-CD1 4.26Å; N274-L276 VanDerWaalsContact C-N 3.26Å; N274-L276 HydrophobicContact CB-CD2 4.43Å; N274-L276 HydrophobicContact CB-CG 4.14Å; N274-L276 PolarHBondContact O-N 2.97Å; L276-L297 HydrophobicContact CD1-CD2 4.02Å; L276-N300 HydrophobicContact CB-CB 4.17Å; L276-N300 PolarHBondContact N-OD1 2.88Å; L276-E301 CarbonylContact O-C 3.1Å; L276-E301 WeakPolarHBondContact O-CA 3.2Å; L276-E301 PolarHBondContact O-N 3.24Å; L276-L302 WeakPolarHBondContact O-CD2 3.43Å; L276-L302 PolarHBondContact O-N 2.78Å
277	F	90.9	Very high	93.1	Very high	99 Å²	99	45.8 Å²	45.8	43%	0.434	23%	0.23	S	C	.	.			trans	-107.2	0.8	178.7	58.6	-89.6	0	0	0	112.9	N247 R275 E301	N247-F277 HydrophobicContact CB-CD1 4.14Å; N247-F277 HydrophobicContact CB-CE1 3.86Å; R275-F277 PolarHBondContact O-N 3.48Å; F277-E301 HydrophobicContact CB-CB 3.99Å
278	K	91.8	Very high	92.9	Very high	100 Å²	100	45 Å²	45	44%	0.435	22%	0.224	S	C	.	.			trans	-153.3	162.8	173.9	-66.5	-176.2	-178.2	-177.7	0	110.3	D280 E307	K278-D280 VanDerWaalsContact CB-OD1 3.31Å; K278-D280 WeakPolarHBondContact CB-OD1 3.33Å; K278-D280 VanDerWaalsContact CD-OD1 3.24Å; K278-D280 WeakPolarHBondContact CD-OD1 3.46Å; K278-D280 IonicContact NZ-OD2 3.55Å; K278-E307 VanDerWaalsContact CA-OE2 3.27Å; K278-E307 WeakPolarHBondContact CA-OE2 3.24Å
279	L	93.1	Very high	92.7	Very high	0 Å²	0	43.4 Å²	43.4	0%	0	21%	0.213	C	C	.	.	S	Bend	trans	-119.3	5.1	173.2	-56.5	176	0	0	0	113.4	D281 M282 S283 L297 L302 E307 L308 K310 I311	L279-D281 PolarHBondContact O-N 3.47Å; L279-M282 HydrophobicContact CB-CG 4.18Å; L279-M282 HydrophobicContact CD2-CG 4.16Å; L279-M282 HydrophobicContact CD2-SD 3.59Å; L279-M282 VanDerWaalsContact CD2-SD 3.59Å; L279-M282 WeakPolarHBondContact O-CG 3.29Å; L279-M282 PolarHBondContact O-N 3.09Å; L279-S283 PolarHBondContact O-N 3.06Å; L279-L297 HydrophobicContact CD1-CD1 4.06Å; L279-L297 HydrophobicContact CD2-CD1 4.28Å; L279-L297 HydrophobicContact CD2-CD2 4.16Å; L279-L302 HydrophobicContact CD1-CD1 4.06Å; L279-L302 HydrophobicContact CD1-CD2 4.45Å; L279-L302 HydrophobicContact CD2-CD1 4.27Å; L279-L302 HydrophobicContact CD2-CD2 4.03Å; L279-L302 HydrophobicContact CG-CD1 4.31Å; L279-L302 HydrophobicContact CG-CD2 3.9Å; L279-E307 HydrophobicContact CB-CB 4.26Å; L279-E307 HydrophobicContact CD1-CB 3.97Å; L279-E307 HydrophobicContact CG-CB 3.97Å; L279-E307 PolarHBondContact N-OE2 3.3Å; L279-L308 HydrophobicContact CD1-CD2 4.02Å; L279-K310 HydrophobicContact CB-CB 4.2Å; L279-K310 HydrophobicContact CB-CG 4.47Å; L279-I311 HydrophobicContact CD1-CD1 3.88Å; L279-I311 HydrophobicContact CD1-CG1 4.16Å
280	D	89.9	Confident	92.4	Very high	49 Å²	49	46.7 Å²	46.7	26%	0.262	24%	0.235	S	C	.	.	G	3₁₀ helix	trans	-61.5	-43.3	176.5	65.2	-27.4	0	0	0	112.4	R249 K278 M282 S283	R249-D280 IonicContact NH2-OD2 3.2Å; K278-D280 VanDerWaalsContact CB-OD1 3.31Å; K278-D280 WeakPolarHBondContact CB-OD1 3.33Å; K278-D280 VanDerWaalsContact CD-OD1 3.24Å; K278-D280 WeakPolarHBondContact CD-OD1 3.46Å; K278-D280 IonicContact NZ-OD2 3.55Å; D280-M282 PolarHBondContact O-N 2.94Å; D280-S283 WeakPolarHBondContact O-CB 3.47Å; D280-S283 PolarHBondContact O-N 3.11Å; D280-S283 PolarHBondContact O-OG 2.88Å
281	D	88.1	Confident	92.2	Very high	41 Å²	41	49.6 Å²	49.6	22%	0.219	25%	0.25	C	S	.	.	G	3₁₀ helix	trans	-63.6	-15	176.4	-77.5	-6.3	0	0	0	114.5	R249 M252 L279	R249-D281 VanDerWaalsContact CA-OD2 3.26Å; R249-D281 WeakPolarHBondContact CA-OD2 3.41Å; R249-D281 HydrophobicContact CB-CB 4.49Å; R249-D281 VanDerWaalsContact CB-OD2 3.3Å; R249-D281 WeakPolarHBondContact CB-OD2 3.31Å; R249-D281 IonicContact CZ-OD1 3.31Å; R249-D281 PolarHBondContact N-OD2 3.42Å; R249-D281 IonicContact NE-OD1 2.64Å; R249-D281 PolarHBondContact NE-OD1 3.11Å; R249-D281 IonicContact NH2-OD1 3.12Å; R249-D281 PolarHBondContact NH2-OD1 2.69Å; M252-D281 WeakPolarHBondContact CG-O 3.42Å; L279-D281 PolarHBondContact O-N 3.47Å
282	M	92.8	Very high	92.1	Very high	2 Å²	2	49.5 Å²	49.5	1%	0.01	25%	0.25	C	S	.	.	G	3₁₀ helix	trans	-114	7.3	175.9	73.3	174.3	-75.8	0	0	115	M252 L256 L271 L279 D280 S284 I285 L297 I311	M252-M282 HydrophobicContact CE-CB 4.17Å; M252-M282 HydrophobicContact CE-SD 4.44Å; M252-M282 HydrophobicContact CG-CB 3.81Å; M252-M282 HydrophobicContact SD-CB 3.77Å; L256-M282 HydrophobicContact CD1-CB 3.98Å; L271-M282 HydrophobicContact CD1-CE 3.67Å; L271-M282 HydrophobicContact CD1-SD 4.03Å; L279-M282 HydrophobicContact CB-CG 4.18Å; L279-M282 HydrophobicContact CD2-CG 4.16Å; L279-M282 HydrophobicContact CD2-SD 3.59Å; L279-M282 VanDerWaalsContact CD2-SD 3.59Å; L279-M282 WeakPolarHBondContact O-CG 3.29Å; L279-M282 PolarHBondContact O-N 3.09Å; D280-M282 PolarHBondContact O-N 2.94Å; M282-S284 PolarHBondContact O-N 2.87Å; M282-I285 HydrophobicContact CE-CB 4.44Å; M282-I285 HydrophobicContact CE-CG2 4.23Å; M282-I285 WeakPolarHBondContact O-CB 3.34Å; M282-I285 WeakPolarHBondContact O-CG2 3.34Å; M282-I285 PolarHBondContact O-N 3.18Å; M282-L297 HydrophobicContact SD-CD2 4.46Å; M282-I311 HydrophobicContact CE-CG2 4.49Å; M282-I311 HydrophobicContact CG-CG2 4.3Å
283	S	91.2	Very high	92.1	Very high	58 Å²	58	52.9 Å²	52.9	41%	0.406	26%	0.264	S	S	.	.	T	Hydrogen-bonded Turn	trans	-56.2	-23	-178	52.8	0	0	0	0	115.1	L279 D280 I285 K310	L279-S283 PolarHBondContact O-N 3.06Å; D280-S283 WeakPolarHBondContact O-CB 3.47Å; D280-S283 PolarHBondContact O-N 3.11Å; D280-S283 PolarHBondContact O-OG 2.88Å; S283-I285 PolarHBondContact O-N 3.43Å; S283-K310 WeakPolarHBondContact CB-O 3.41Å
284	S	91.6	Very high	92.2	Very high	39 Å²	39	51.2 Å²	51.2	27%	0.273	26%	0.256	S	S	.	.	T	Hydrogen-bonded Turn	trans	-72.1	-8.4	175.1	54.2	0	0	0	0	114.8	M282 V286 Q287 K288	M282-S284 PolarHBondContact O-N 2.87Å; S284-V286 PolarHBondContact O-N 2.87Å; S284-V286 VanDerWaalsContact O-N 3.13Å; S284-Q287 PolarHBondContact O-N 2.87Å; S284-K288 WeakPolarHBondContact O-CG 3.49Å; S284-K288 PolarHBondContact O-N 3.04Å; S284-K288 VanDerWaalsContact O-N 3.14Å
285	I	93.3	Very high	92.4	Very high	0 Å²	0	50.7 Å²	50.7	0%	0	25%	0.254	C	S	.	.	H	α-helix	trans	-52.3	-34.3	174.6	-171.5	66.7	0	0	0	112.5	L256 L269 M282 S283 Q287 K288 A289 L292 I311 L314	L256-I285 HydrophobicContact CD2-CB 4.23Å; L256-I285 HydrophobicContact CD2-CD1 3.57Å; L256-I285 HydrophobicContact CD2-CG1 4.43Å; L269-I285 HydrophobicContact CD2-CD1 4.07Å; M282-I285 HydrophobicContact CE-CB 4.44Å; M282-I285 HydrophobicContact CE-CG2 4.23Å; M282-I285 WeakPolarHBondContact O-CB 3.34Å; M282-I285 WeakPolarHBondContact O-CG2 3.34Å; M282-I285 PolarHBondContact O-N 3.18Å; S283-I285 PolarHBondContact O-N 3.43Å; I285-Q287 PolarHBondContact O-N 3.43Å; I285-K288 PolarHBondContact O-N 3.49Å; I285-A289 HydrophobicContact CD1-CB 3.75Å; I285-A289 HydrophobicContact CG1-CB 4.44Å; I285-A289 PolarHBondContact O-N 3.36Å; I285-L292 HydrophobicContact CG1-CD2 4.3Å; I285-I311 HydrophobicContact CG2-CG2 3.86Å; I285-L314 HydrophobicContact CG1-CD1 4.49Å; I285-L314 HydrophobicContact CG1-CD2 4.37Å; I285-L314 HydrophobicContact CG2-CD1 3.97Å; I285-L314 HydrophobicContact CG2-CD2 4.3Å; I285-L314 HydrophobicContact CG2-CG 4.33Å
286	V	91.8	Very high	92.6	Very high	48 Å²	48	44.4 Å²	44.4	29%	0.291	23%	0.232	S	C	.	.	H	α-helix	trans	-59.1	-31.3	179.5	-178.6	0	0	0	0	112.5	S284 L314	S284-V286 PolarHBondContact O-N 2.87Å; S284-V286 VanDerWaalsContact O-N 3.13Å; V286-L314 HydrophobicContact CG2-CD2 4.31Å; V286-L314 HydrophobicContact CG2-CG 4.18Å
287	Q	90.8	Very high	92.8	Very high	163 Å²	163	44.2 Å²	44.2	76%	0.762	23%	0.231	S	C	*	.	H	α-helix	trans	-92.3	-34.9	177.9	-67.2	175.4	-27.6	0	0	111.9	S284 I285	S284-Q287 PolarHBondContact O-N 2.87Å; I285-Q287 PolarHBondContact O-N 3.43Å
288	K	91.5	Very high	93.1	Very high	30 Å²	30	39.8 Å²	39.8	13%	0.13	21%	0.212	C	C	.	.	H	α-helix	trans	-85.6	-24.3	-171	-69.3	175	163.6	-76.9	0	114.8	L256 E260 S284 I285	L256-K288 HydrophobicContact CB-CD 3.73Å; E260-K288 HydrophobicContact CB-CB 4.04Å; E260-K288 HydrophobicContact CB-CG 4.04Å; E260-K288 HydrophobicContact CG-CG 4.25Å; E260-K288 IonicContact OE1-NZ 3.43Å; E260-K288 IonicContact OE2-NZ 3.41Å; E260-K288 PolarHBondContact OE2-NZ 2.89Å; S284-K288 WeakPolarHBondContact O-CG 3.49Å; S284-K288 PolarHBondContact O-N 3.04Å; S284-K288 VanDerWaalsContact O-N 3.14Å; I285-K288 PolarHBondContact O-N 3.49Å
289	A	92.4	Very high	93.2	Very high	0 Å²	0	36 Å²	36	0%	0	20%	0.202	C	C	.	.			trans	-141.2	67.5	175.2	0	0	0	0	0	109.9	I259 I285 N291 L292	I259-A289 HydrophobicContact CG2-CB 4.12Å; I285-A289 HydrophobicContact CD1-CB 3.75Å; I285-A289 HydrophobicContact CG1-CB 4.44Å; I285-A289 PolarHBondContact O-N 3.36Å; A289-N291 PolarHBondContact O-N 3.41Å; A289-L292 HydrophobicContact CB-CB 4.36Å; A289-L292 WeakPolarHBondContact O-CB 3.33Å; A289-L292 PolarHBondContact O-N 2.64Å
290	P	91.1	Very high	93.3	Very high	72 Å²	72	36.2 Å²	36.2	47%	0.468	20%	0.203	S	C	.	.	T	Hydrogen-bonded Turn	trans	-68.4	-17.5	-172.8	29.5	-36.4	0	0	0	113.7
291	N	91.8	Very high	93.5	Very high	90 Å²	90	37.7 Å²	37.7	48%	0.481	21%	0.209	S	C	.	.	T	Hydrogen-bonded Turn	trans	-89.5	-0.5	179.9	-65	-17.8	0	0	0	113.5	L267 A289 K293	L267-N291 HydrophobicContact CD2-CB 4.17Å; L267-N291 WeakPolarHBondContact CD2-O 3.24Å; A289-N291 PolarHBondContact O-N 3.41Å; N291-K293 PolarHBondContact O-N 3.34Å
292	L	95	Very high	93.8	Very high	2 Å²	2	35.8 Å²	35.8	1%	0.01	20%	0.198	C	C	.	.			trans	-63.4	117.4	-176.1	-169.2	76.4	0	0	0	111.6	L266 L269 I285 A289 L295 L314 L316	L266-L292 HydrophobicContact CD2-CD1 4.23Å; L266-L292 HydrophobicContact CG-CD1 4.12Å; L266-L292 WeakPolarHBondContact O-CA 3.38Å; L266-L292 PolarHBondContact O-N 3.4Å; L269-L292 HydrophobicContact CB-CD1 3.65Å; L269-L292 HydrophobicContact CB-CD2 4.19Å; L269-L292 HydrophobicContact CD2-CD2 4.36Å; I285-L292 HydrophobicContact CG1-CD2 4.3Å; A289-L292 HydrophobicContact CB-CB 4.36Å; A289-L292 WeakPolarHBondContact O-CB 3.33Å; A289-L292 PolarHBondContact O-N 2.64Å; L292-L295 HydrophobicContact CD2-CB 4.44Å; L292-L295 HydrophobicContact CD2-CD1 4.38Å; L292-L314 HydrophobicContact CB-CD2 4.41Å; L292-L314 HydrophobicContact CD2-CD1 4.17Å; L292-L316 HydrophobicContact CD2-CD2 4.45Å; L292-L316 HydrophobicContact CG-CD2 4.42Å
293	K	94.8	Very high	93.8	Very high	74 Å²	74	42.7 Å²	42.7	32%	0.322	23%	0.228	S	C	.	.			trans	-99.1	-35.7	178.9	-74.6	164.5	166.2	-86.5	0	112.7	L267 N291 L316 E317 E318	L267-K293 HydrophobicContact CD2-CD 4.28Å; L267-K293 PolarHBondContact O-N 3.27Å; N291-K293 PolarHBondContact O-N 3.34Å; K293-L316 CarbonylContact O-C 3.34Å; K293-L316 VanDerWaalsContact O-CA 3.31Å; K293-L316 WeakPolarHBondContact O-CA 3.37Å; K293-L316 WeakPolarHBondContact O-CD2 3.48Å; K293-E317 HydrophobicContact CB-CB 4.44Å; K293-E317 WeakPolarHBondContact CD-OE2 3.44Å; K293-E317 HydrophobicContact CG-CG 4.48Å; K293-E317 IonicContact NZ-OE1 3.2Å; K293-E317 PolarHBondContact NZ-OE1 3.41Å; K293-E317 IonicContact NZ-OE2 3.93Å; K293-E317 PolarHBondContact NZ-OE2 2.69Å; K293-E317 PolarHBondContact O-N 3.02Å; K293-E318 PolarHBondContact O-N 3.16Å; K293-E318 VanDerWaalsContact O-N 3.15Å
294	T	96.6	Very high	93.9	Very high	32 Å²	32	42 Å²	42	20%	0.196	22%	0.223	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-120.5	127.3	-173	-59.2	0	0	0	0	111	L267 S268 L269 E318	L267-T294 PolarHBondContact O-N 2.79Å; S268-T294 WeakPolarHBondContact CA-O 3.22Å; L269-T294 PolarHBondContact N-O 3.5Å; T294-E318 WeakPolarHBondContact CA-O 3.45Å; T294-E318 HydrophobicContact CG2-CB 4.07Å; T294-E318 HydrophobicContact CG2-CG 4.15Å
295	L	97.4	Very high	93.8	Very high	0 Å²	0	43 Å²	43	0%	0	22%	0.224	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-133.3	125.3	179.4	178.8	61.3	0	0	0	111	L269 L271 L292 L297 I311 L314 L316 E318 L319 W320	L269-L295 HydrophobicContact CB-CD1 4.3Å; L269-L295 HydrophobicContact CD2-CD1 4.26Å; L269-L295 HydrophobicContact CG-CD1 4.28Å; L269-L295 WeakPolarHBondContact O-CA 3.28Å; L271-L295 HydrophobicContact CD1-CD1 4.26Å; L292-L295 HydrophobicContact CD2-CB 4.44Å; L292-L295 HydrophobicContact CD2-CD1 4.38Å; L295-L297 HydrophobicContact CD1-CG 4.38Å; L295-L297 HydrophobicContact CD2-CD1 3.97Å; L295-L297 HydrophobicContact CD2-CG 4.28Å; L295-L297 HydrophobicContact CG-CD1 4.3Å; L295-L297 HydrophobicContact CG-CG 4.09Å; L295-I311 HydrophobicContact CD2-CD1 3.81Å; L295-L314 HydrophobicContact CD2-CD1 4.13Å; L295-L316 HydrophobicContact CB-CD1 3.91Å; L295-L316 HydrophobicContact CB-CD2 3.83Å; L295-L316 HydrophobicContact CD2-CD1 4.06Å; L295-E318 PolarHBondContact N-O 3Å; L295-L319 HydrophobicContact CB-CD1 4.19Å; L295-L319 HydrophobicContact CD2-CD1 4.3Å; L295-L319 HydrophobicContact CG-CD1 4.27Å; L295-L319 CarbonylContact O-C 3.41Å; L295-L319 WeakPolarHBondContact O-CA 3.42Å; L295-W320 PolarHBondContact O-N 3.03Å
296	N	97.4	Very high	93.8	Very high	29 Å²	29	51 Å²	51	16%	0.155	25%	0.254	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-112.9	113.5	175.5	-173	-22.9	0	0	0	111.4	L269 N270 L271 S272 S298 W320	L269-N296 PolarHBondContact O-N 3.17Å; N270-N296 HydrophobicContact CB-CB 4.34Å; L271-N296 CarbonylContact C-O 3.53Å; L271-N296 WeakPolarHBondContact CA-O 3.38Å; L271-N296 PolarHBondContact N-O 2.77Å; S272-N296 PolarHBondContact N-O 2.95Å; N296-S298 WeakPolarHBondContact OD1-CB 3.49Å; N296-S298 PolarHBondContact OD1-N 3.46Å; N296-S298 PolarHBondContact OD1-OG 3.34Å; N296-W320 HydrophobicContact CB-CB 4.09Å; N296-W320 HydrophobicContact CB-CG 4.27Å
297	L	96.6	Very high	93.9	Very high	0 Å²	0	50.7 Å²	50.7	0%	0	25%	0.249	C	C	.	.			trans	-113.5	14.4	177.7	-68.1	169.1	0	0	0	112	L271 L276 L279 M282 L295 N300 L302 I311 W320 L321 N324	L271-L297 HydrophobicContact CB-CD2 4.01Å; L271-L297 HydrophobicContact CD1-CD2 4.22Å; L276-L297 HydrophobicContact CD1-CD2 4.02Å; L279-L297 HydrophobicContact CD1-CD1 4.06Å; L279-L297 HydrophobicContact CD2-CD1 4.28Å; L279-L297 HydrophobicContact CD2-CD2 4.16Å; M282-L297 HydrophobicContact SD-CD2 4.46Å; L295-L297 HydrophobicContact CD1-CG 4.38Å; L295-L297 HydrophobicContact CD2-CD1 3.97Å; L295-L297 HydrophobicContact CD2-CG 4.28Å; L295-L297 HydrophobicContact CG-CD1 4.3Å; L295-L297 HydrophobicContact CG-CG 4.09Å; L297-N300 WeakPolarHBondContact O-CB 3.42Å; L297-N300 PolarHBondContact O-ND2 2.79Å; L297-L302 HydrophobicContact CD1-CD1 4.45Å; L297-I311 HydrophobicContact CD1-CD1 4.14Å; L297-W320 CarbonylContact C-O 3.56Å; L297-W320 WeakPolarHBondContact CA-O 3.27Å; L297-W320 PolarHBondContact N-O 2.91Å; L297-L321 HydrophobicContact CB-CD2 4.11Å; L297-L321 HydrophobicContact CD1-CD2 4.11Å; L297-N324 PolarHBondContact O-ND2 3.34Å
298	S	96.1	Very high	94	Very high	6 Å²	6	43 Å²	43	4%	0.042	21%	0.213	C	C	.	.	T	Hydrogen-bonded Turn	trans	-61.5	150.9	-175.8	61.8	0	0	0	0	114	S272 N273 N296 N300 W320 D322	S272-S298 CarbonylContact C-O 3.59Å; S272-S298 WeakPolarHBondContact CA-O 3.48Å; S272-S298 WeakPolarHBondContact CB-O 3.17Å; S272-S298 WeakPolarHBondContact CB-OG 3.27Å; N273-S298 PolarHBondContact N-O 3.03Å; N296-S298 WeakPolarHBondContact OD1-CB 3.49Å; N296-S298 PolarHBondContact OD1-N 3.46Å; N296-S298 PolarHBondContact OD1-OG 3.34Å; S298-N300 VanDerWaalsContact C-N 3.29Å; S298-N300 PolarHBondContact O-N 3.39Å; S298-W320 PolarHBondContact N-O 3.39Å; S298-D322 CarbonylContact C-O 3.58Å; S298-D322 WeakPolarHBondContact CA-O 3.23Å; S298-D322 VanDerWaalsContact CB-O 3.24Å; S298-D322 WeakPolarHBondContact CB-O 3.3Å
299	G	93.8	Very high	94.1	Very high	21 Å²	21	43.8 Å²	43.8	22%	0.216	22%	0.219	C	C	.	.	T	Hydrogen-bonded Turn	trans	62.6	31.5	179.3	0	0	0	0	0	114.3	N273 D322	N273-G299 WeakPolarHBondContact CA-O 3.41Å; G299-D322 PolarHBondContact N-O 3.39Å
300	N	95.8	Very high	94.2	Very high	5 Å²	5	48.2 Å²	48.2	3%	0.027	24%	0.238	C	C	.	.	S	Bend	trans	-103.1	-178.5	173.5	-79.6	-63.8	0	0	0	111	L271 N274 R275 L276 L297 S298 L302 N324 P325	L271-N300 PolarHBondContact O-ND2 2.86Å; N274-N300 WeakPolarHBondContact CA-OD1 3.49Å; N274-N300 PolarHBondContact N-OD1 3.37Å; R275-N300 PolarHBondContact N-OD1 3.1Å; L276-N300 HydrophobicContact CB-CB 4.17Å; L276-N300 PolarHBondContact N-OD1 2.88Å; L297-N300 WeakPolarHBondContact O-CB 3.42Å; L297-N300 PolarHBondContact O-ND2 2.79Å; S298-N300 VanDerWaalsContact C-N 3.29Å; S298-N300 PolarHBondContact O-N 3.39Å; N300-L302 HydrophobicContact CB-CG 4.46Å; N300-N324 WeakPolarHBondContact CA-OD1 3.4Å; N300-N324 WeakPolarHBondContact CB-OD1 3.29Å; N300-N324 PolarHBondContact O-OD1 3.23Å; N300-N324 VanDerWaalsContact O-OD1 3.11Å; N300-P325 WeakPolarHBondContact O-CD 3.26Å
301	E	94.3	Very high	94.3	Very high	80 Å²	80	44.8 Å²	44.8	37%	0.374	22%	0.216	S	C	.	.			trans	-104.1	27.2	-173.4	-66.9	-176.7	-150.5	0	0	112.2	R275 L276 F277 K303	R275-E301 HydrophobicContact CB-CG 4.39Å; R275-E301 WeakPolarHBondContact CB-OE1 3.36Å; R275-E301 WeakPolarHBondContact CD-OE1 3.34Å; R275-E301 WeakPolarHBondContact CG-OE1 3.23Å; L276-E301 CarbonylContact O-C 3.1Å; L276-E301 WeakPolarHBondContact O-CA 3.2Å; L276-E301 PolarHBondContact O-N 3.24Å; F277-E301 HydrophobicContact CB-CB 3.99Å; E301-K303 WeakPolarHBondContact O-CG 3.47Å; E301-K303 PolarHBondContact O-N 3.1Å
302	L	93.8	Very high	94.3	Very high	0 Å²	0	45.9 Å²	45.9	0%	0	22%	0.216	C	C	.	.			trans	-70.1	120.4	-179	-57.4	176.1	0	0	0	110.5	L276 L279 L297 N300 E307 N324 P325 M326	L276-L302 WeakPolarHBondContact O-CD2 3.43Å; L276-L302 PolarHBondContact O-N 2.78Å; L279-L302 HydrophobicContact CD1-CD1 4.06Å; L279-L302 HydrophobicContact CD1-CD2 4.45Å; L279-L302 HydrophobicContact CD2-CD1 4.27Å; L279-L302 HydrophobicContact CD2-CD2 4.03Å; L279-L302 HydrophobicContact CG-CD1 4.31Å; L279-L302 HydrophobicContact CG-CD2 3.9Å; L297-L302 HydrophobicContact CD1-CD1 4.45Å; N300-L302 HydrophobicContact CB-CG 4.46Å; L302-E307 HydrophobicContact CD2-CB 4.35Å; L302-E307 HydrophobicContact CD2-CG 4.41Å; L302-N324 HydrophobicContact CB-CB 4.26Å; L302-N324 VanDerWaalsContact CB-OD1 3.28Å; L302-N324 WeakPolarHBondContact CB-OD1 3.48Å; L302-N324 VanDerWaalsContact CG-OD1 3.3Å; L302-N324 WeakPolarHBondContact CG-OD1 3.34Å; L302-N324 PolarHBondContact N-OD1 2.93Å; L302-P325 CarbonylContact O-C 3.58Å; L302-P325 WeakPolarHBondContact O-CD 3.46Å; L302-M326 HydrophobicContact CB-CG 4.45Å; L302-M326 HydrophobicContact CB-SD 4.29Å; L302-M326 WeakPolarHBondContact O-CB 3.32Å; L302-M326 PolarHBondContact O-N 2.87Å
303	K	92.7	Very high	94	Very high	147 Å²	147	48 Å²	48	64%	0.639	24%	0.239	S	C	*	.			trans	-102.1	-5.1	-173.1	-52.8	-170.5	-178.9	-178.9	0	114.6	E301 P325	E301-K303 WeakPolarHBondContact O-CG 3.47Å; E301-K303 PolarHBondContact O-N 3.1Å; K303-P325 HydrophobicContact CG-CB 4.43Å
304	S	92.5	Very high	93.9	Very high	43 Å²	43	44.9 Å²	44.9	30%	0.301	23%	0.226	S	C	.	.			trans	-153.4	139.3	179.4	-176.7	0	0	0	0	111.2	R306 E307	S304-R306 PolarHBondContact O-N 2.82Å; S304-R306 PolarHBondContact OG-N 2.55Å; S304-E307 PolarHBondContact O-N 2.89Å
305	E	91.1	Very high	93.6	Very high	61 Å²	61	50.8 Å²	50.8	29%	0.285	25%	0.248	S	C	.	.	G	3₁₀ helix	trans	-48	-27.2	167.7	70.2	-159	172.2	0	0	114	E307 L308 M326 F330	E305-E307 PolarHBondContact O-N 2.81Å; E305-E307 VanDerWaalsContact O-N 3.14Å; E305-L308 WeakPolarHBondContact O-CB 3.48Å; E305-L308 WeakPolarHBondContact O-CG 3.34Å; E305-L308 PolarHBondContact O-N 2.74Å; E305-M326 HydrophobicContact CB-CE 4.07Å; E305-F330 HydrophobicContact CB-CZ 4.29Å; E305-F330 WeakPolarHBondContact OE2-CE1 3.49Å; E305-F330 WeakPolarHBondContact OE2-CZ 3.26Å
306	R	92.7	Very high	93.5	Very high	168 Å²	168	50.8 Å²	50.8	63%	0.634	25%	0.249	S	C	*	.	G	3₁₀ helix	trans	-69.2	-8.4	-177.9	-62.3	-179.3	-177.7	-172.2	-0.9	114.1	S304 L308	S304-R306 PolarHBondContact O-N 2.82Å; S304-R306 PolarHBondContact OG-N 2.55Å; R306-L308 VanDerWaalsContact C-N 3.32Å
307	E	93.2	Very high	93.3	Very high	41 Å²	41	53 Å²	53	19%	0.192	26%	0.258	C	S	.	.	G	3₁₀ helix	trans	-72.4	-27.9	166	-64.9	-58.6	137.3	0	0	111.2	K278 L279 L302 S304 E305 D309 K310	K278-E307 VanDerWaalsContact CA-OE2 3.27Å; K278-E307 WeakPolarHBondContact CA-OE2 3.24Å; L279-E307 HydrophobicContact CB-CB 4.26Å; L279-E307 HydrophobicContact CD1-CB 3.97Å; L279-E307 HydrophobicContact CG-CB 3.97Å; L279-E307 PolarHBondContact N-OE2 3.3Å; L302-E307 HydrophobicContact CD2-CB 4.35Å; L302-E307 HydrophobicContact CD2-CG 4.41Å; S304-E307 PolarHBondContact O-N 2.89Å; E305-E307 PolarHBondContact O-N 2.81Å; E305-E307 VanDerWaalsContact O-N 3.14Å; E307-D309 VanDerWaalsContact C-N 3.25Å; E307-D309 PolarHBondContact O-N 2.7Å; E307-K310 VanDerWaalsContact O-CB 3.31Å; E307-K310 WeakPolarHBondContact O-CB 3.35Å; E307-K310 VanDerWaalsContact O-CG 3.27Å; E307-K310 WeakPolarHBondContact O-CG 3.36Å; E307-K310 PolarHBondContact O-N 3.02Å
308	L	94.3	Very high	93.3	Very high	2 Å²	2	54.5 Å²	54.5	1%	0.01	27%	0.265	C	S	.	.	G	3₁₀ helix	trans	-67.2	-25.4	176.2	-54.8	178	0	0	0	112.4	L279 E305 R306 K310 I311 K312 L321 M326 V340 R343 F344	L279-L308 HydrophobicContact CD1-CD2 4.02Å; E305-L308 WeakPolarHBondContact O-CB 3.48Å; E305-L308 WeakPolarHBondContact O-CG 3.34Å; E305-L308 PolarHBondContact O-N 2.74Å; R306-L308 VanDerWaalsContact C-N 3.32Å; L308-K310 PolarHBondContact O-N 3.28Å; L308-I311 HydrophobicContact CD2-CD1 4.24Å; L308-I311 WeakPolarHBondContact O-CG1 3.34Å; L308-I311 PolarHBondContact O-N 3.22Å; L308-K312 PolarHBondContact O-N 3.09Å; L308-L321 HydrophobicContact CD1-CD1 3.93Å; L308-L321 HydrophobicContact CD2-CD1 4.47Å; L308-L321 HydrophobicContact CD2-CD2 3.94Å; L308-M326 HydrophobicContact CD1-CE 4.17Å; L308-V340 HydrophobicContact CD1-CG2 4.38Å; L308-R343 HydrophobicContact CB-CB 4.44Å; L308-R343 HydrophobicContact CB-CG 4.1Å; L308-F344 HydrophobicContact CB-CE2 4.22Å; L308-F344 HydrophobicContact CD1-CE2 4.41Å; L308-F344 HydrophobicContact CD2-CE2 4.42Å
309	D	93.6	Very high	93.3	Very high	46 Å²	46	54.2 Å²	54.2	25%	0.246	26%	0.263	C	S	.	.	G	3₁₀ helix	trans	-58.2	-17.3	170.2	-85.8	-65.7	0	0	0	113.6	E307 K312 R343	E307-D309 VanDerWaalsContact C-N 3.25Å; E307-D309 PolarHBondContact O-N 2.7Å; D309-K312 WeakPolarHBondContact OD1-CD 3.22Å; D309-K312 WeakPolarHBondContact OD1-CE 3.24Å; D309-K312 IonicContact OD1-NZ 3.5Å; D309-K312 PolarHBondContact OD1-NZ 2.97Å; D309-R343 VanDerWaalsContact CG-NE 3.26Å; D309-R343 IonicContact OD1-NE 2.69Å; D309-R343 PolarHBondContact OD1-NE 2.76Å; D309-R343 VanDerWaalsContact OD1-NE 3.16Å; D309-R343 IonicContact OD2-CZ 3.73Å; D309-R343 IonicContact OD2-NE 2.65Å; D309-R343 PolarHBondContact OD2-NE 3.03Å; D309-R343 IonicContact OD2-NH2 2.71Å
310	K	93.4	Very high	93.5	Very high	94 Å²	94	56.8 Å²	56.8	41%	0.409	27%	0.266	S	S	.	.	G	3₁₀ helix	trans	-80.3	-18.7	176.2	-49.2	-50.4	172.2	-159.2	0	113.4	L279 S283 E307 L308	L279-K310 HydrophobicContact CB-CB 4.2Å; L279-K310 HydrophobicContact CB-CG 4.47Å; S283-K310 WeakPolarHBondContact CB-O 3.41Å; E307-K310 VanDerWaalsContact O-CB 3.31Å; E307-K310 WeakPolarHBondContact O-CB 3.35Å; E307-K310 VanDerWaalsContact O-CG 3.27Å; E307-K310 WeakPolarHBondContact O-CG 3.36Å; E307-K310 PolarHBondContact O-N 3.02Å; L308-K310 PolarHBondContact O-N 3.28Å
311	I	94.2	Very high	93.5	Very high	0 Å²	0	56.6 Å²	56.6	0%	0	27%	0.265	C	S	.	.	T	Hydrogen-bonded Turn	trans	-127.1	1.9	-173.4	54.9	158.6	0	0	0	114	L279 M282 I285 L295 L297 L308 G313 L314 F344	L279-I311 HydrophobicContact CD1-CD1 3.88Å; L279-I311 HydrophobicContact CD1-CG1 4.16Å; M282-I311 HydrophobicContact CE-CG2 4.49Å; M282-I311 HydrophobicContact CG-CG2 4.3Å; I285-I311 HydrophobicContact CG2-CG2 3.86Å; L295-I311 HydrophobicContact CD2-CD1 3.81Å; L297-I311 HydrophobicContact CD1-CD1 4.14Å; L308-I311 HydrophobicContact CD2-CD1 4.24Å; L308-I311 WeakPolarHBondContact O-CG1 3.34Å; L308-I311 PolarHBondContact O-N 3.22Å; I311-G313 PolarHBondContact O-N 3.28Å; I311-L314 HydrophobicContact CB-CD1 4.27Å; I311-L314 WeakPolarHBondContact O-CG 3.26Å; I311-L314 PolarHBondContact O-N 2.88Å; I311-F344 HydrophobicContact CD1-CZ 4.02Å; I311-F344 HydrophobicContact CG1-CZ 4.04Å
312	K	90.9	Very high	93.4	Very high	112 Å²	112	55.6 Å²	55.6	49%	0.487	26%	0.262	S	S	.	.	T	Hydrogen-bonded Turn	trans	-59	-0.2	178.4	71.3	176	174.5	-169.5	0	117.1	L308 D309 L314 R343	L308-K312 PolarHBondContact O-N 3.09Å; D309-K312 WeakPolarHBondContact OD1-CD 3.22Å; D309-K312 WeakPolarHBondContact OD1-CE 3.24Å; D309-K312 IonicContact OD1-NZ 3.5Å; D309-K312 PolarHBondContact OD1-NZ 2.97Å; K312-L314 VanDerWaalsContact C-N 3.34Å; K312-R343 HydrophobicContact CB-CB 4.12Å
313	G	88.9	Confident	93.3	Very high	46 Å²	46	63.3 Å²	63.3	47%	0.474	29%	0.291	S	S	.	.	T	Hydrogen-bonded Turn	trans	-80.1	-14.9	169.4	0	0	0	0	0	113.6	I311	I311-G313 PolarHBondContact O-N 3.28Å
314	L	92.5	Very high	93.4	Very high	10 Å²	10	56.4 Å²	56.4	5%	0.052	26%	0.262	C	S	.	.	S	Bend	trans	-72.4	139	176.1	-63.2	173.8	0	0	0	111.3	I285 V286 L292 L295 I311 K312 L316 F344	I285-L314 HydrophobicContact CG1-CD1 4.49Å; I285-L314 HydrophobicContact CG1-CD2 4.37Å; I285-L314 HydrophobicContact CG2-CD1 3.97Å; I285-L314 HydrophobicContact CG2-CD2 4.3Å; I285-L314 HydrophobicContact CG2-CG 4.33Å; V286-L314 HydrophobicContact CG2-CD2 4.31Å; V286-L314 HydrophobicContact CG2-CG 4.18Å; L292-L314 HydrophobicContact CB-CD2 4.41Å; L292-L314 HydrophobicContact CD2-CD1 4.17Å; L295-L314 HydrophobicContact CD2-CD1 4.13Å; I311-L314 HydrophobicContact CB-CD1 4.27Å; I311-L314 WeakPolarHBondContact O-CG 3.26Å; I311-L314 PolarHBondContact O-N 2.88Å; K312-L314 VanDerWaalsContact C-N 3.34Å; L314-L316 VanDerWaalsContact C-N 3.29Å; L314-L316 HydrophobicContact CB-CD1 4.48Å; L314-L316 HydrophobicContact CB-CD2 4.14Å; L314-L316 HydrophobicContact CB-CG 3.86Å; L314-L316 HydrophobicContact CD1-CD1 4.5Å; L314-L316 HydrophobicContact CD1-CD2 4.3Å; L314-L316 HydrophobicContact CD1-CG 4.49Å; L314-L316 PolarHBondContact O-N 3.11Å; L314-F344 HydrophobicContact CB-CE1 4.36Å
315	K	91.5	Very high	93.4	Very high	155 Å²	155	57 Å²	57	67%	0.674	26%	0.264	S	S	*	.			trans	-93.6	55.9	178.8	-64.2	173.2	-176.2	168.8	0	110.7
316	L	93.7	Very high	93.4	Very high	1 Å²	1	54.1 Å²	54.1	1%	0.005	25%	0.251	C	S	.	.			trans	-65.5	136.8	-174.3	-61.5	177.5	0	0	0	112.5	L292 K293 L295 L314 L319 F344 K346 L347	L292-L316 HydrophobicContact CD2-CD2 4.45Å; L292-L316 HydrophobicContact CG-CD2 4.42Å; K293-L316 CarbonylContact O-C 3.34Å; K293-L316 VanDerWaalsContact O-CA 3.31Å; K293-L316 WeakPolarHBondContact O-CA 3.37Å; K293-L316 WeakPolarHBondContact O-CD2 3.48Å; L295-L316 HydrophobicContact CB-CD1 3.91Å; L295-L316 HydrophobicContact CB-CD2 3.83Å; L295-L316 HydrophobicContact CD2-CD1 4.06Å; L314-L316 VanDerWaalsContact C-N 3.29Å; L314-L316 HydrophobicContact CB-CD1 4.48Å; L314-L316 HydrophobicContact CB-CD2 4.14Å; L314-L316 HydrophobicContact CB-CG 3.86Å; L314-L316 HydrophobicContact CD1-CD1 4.5Å; L314-L316 HydrophobicContact CD1-CD2 4.3Å; L314-L316 HydrophobicContact CD1-CG 4.49Å; L314-L316 PolarHBondContact O-N 3.11Å; L316-L319 HydrophobicContact CD1-CB 4.44Å; L316-L319 HydrophobicContact CD1-CD1 4.03Å; L316-F344 HydrophobicContact CB-CD1 4.33Å; L316-F344 HydrophobicContact CD1-CD1 3.99Å; L316-F344 HydrophobicContact CD1-CE1 3.73Å; L316-F344 HydrophobicContact CD1-CG 4.48Å; L316-F344 HydrophobicContact CD1-CZ 4.01Å; L316-F344 HydrophobicContact CG-CD1 4.23Å; L316-F344 HydrophobicContact CG-CE1 4.25Å; L316-K346 CarbonylContact O-C 3.59Å; L316-L347 HydrophobicContact CB-CD1 4.07Å; L316-L347 WeakPolarHBondContact O-CA 3.34Å; L316-L347 PolarHBondContact O-N 2.79Å
317	E	93.9	Very high	93.3	Very high	75 Å²	75	47.8 Å²	47.8	35%	0.35	23%	0.232	S	C	.	.	S	Bend	trans	-98.6	-32.9	170.4	-71	167.8	-172.4	0	0	110.5	K293 L348 R349	K293-E317 HydrophobicContact CB-CB 4.44Å; K293-E317 WeakPolarHBondContact CD-OE2 3.44Å; K293-E317 HydrophobicContact CG-CG 4.48Å; K293-E317 IonicContact NZ-OE1 3.2Å; K293-E317 PolarHBondContact NZ-OE1 3.41Å; K293-E317 IonicContact NZ-OE2 3.93Å; K293-E317 PolarHBondContact NZ-OE2 2.69Å; K293-E317 PolarHBondContact O-N 3.02Å; E317-L348 PolarHBondContact O-N 2.87Å; E317-R349 PolarHBondContact O-N 3.48Å
318	E	95.9	Very high	93.1	Very high	32 Å²	32	52.5 Å²	52.5	15%	0.15	26%	0.258	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-134.9	136	177.1	-178.2	167.3	148.9	0	0	112.8	K293 T294 L295 W320 R349	K293-E318 PolarHBondContact O-N 3.16Å; K293-E318 VanDerWaalsContact O-N 3.15Å; T294-E318 WeakPolarHBondContact CA-O 3.45Å; T294-E318 HydrophobicContact CG2-CB 4.07Å; T294-E318 HydrophobicContact CG2-CG 4.15Å; L295-E318 PolarHBondContact N-O 3Å; E318-W320 PolarHBondContact OE1-NE1 3.31Å; E318-R349 WeakPolarHBondContact CA-O 3.42Å; E318-R349 HydrophobicContact CB-CB 4.12Å; E318-R349 HydrophobicContact CG-CB 3.85Å; E318-R349 IonicContact OE1-NH1 2.79Å; E318-R349 WeakPolarHBondContact OE2-CD 3.49Å; E318-R349 IonicContact OE2-CZ 3.22Å; E318-R349 IonicContact OE2-NE 3.63Å; E318-R349 IonicContact OE2-NH1 3.67Å; E318-R349 PolarHBondContact OE2-NH1 3.21Å
319	L	97	Very high	92.9	Very high	0 Å²	0	57.8 Å²	57.8	0%	0	29%	0.287	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-139.1	140.4	-177.6	177.9	62.2	0	0	0	110.7	L295 L316 L321 V340 F344 L347 R349 L350 D351	L295-L319 HydrophobicContact CB-CD1 4.19Å; L295-L319 HydrophobicContact CD2-CD1 4.3Å; L295-L319 HydrophobicContact CG-CD1 4.27Å; L295-L319 CarbonylContact O-C 3.41Å; L295-L319 WeakPolarHBondContact O-CA 3.42Å; L316-L319 HydrophobicContact CD1-CB 4.44Å; L316-L319 HydrophobicContact CD1-CD1 4.03Å; L319-L321 HydrophobicContact CD1-CD2 4.31Å; L319-L321 HydrophobicContact CD1-CG 4.38Å; L319-L321 HydrophobicContact CD2-CD1 4.01Å; L319-L321 HydrophobicContact CD2-CG 4.23Å; L319-L321 HydrophobicContact CG-CD1 4.39Å; L319-L321 HydrophobicContact CG-CG 4.09Å; L319-V340 HydrophobicContact CD2-CG1 3.86Å; L319-F344 HydrophobicContact CD2-CD2 3.79Å; L319-F344 HydrophobicContact CD2-CE2 3.74Å; L319-L347 HydrophobicContact CB-CD1 3.6Å; L319-L347 HydrophobicContact CB-CD2 4.07Å; L319-L347 HydrophobicContact CB-CG 4.5Å; L319-L347 HydrophobicContact CD2-CD2 4.4Å; L319-R349 PolarHBondContact N-O 3.24Å; L319-L350 HydrophobicContact CB-CD1 4.28Å; L319-L350 HydrophobicContact CD2-CD1 4.4Å; L319-L350 HydrophobicContact CG-CD1 4.26Å; L319-L350 CarbonylContact O-C 3.48Å; L319-L350 VanDerWaalsContact O-CA 3.32Å; L319-L350 WeakPolarHBondContact O-CA 3.5Å; L319-D351 PolarHBondContact O-N 2.91Å
320	W	97.1	Very high	92.8	Very high	75 Å²	75	57.4 Å²	57.4	28%	0.284	28%	0.283	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-124.3	126.7	171.9	-58.2	69.3	0	0	0	110.5	L295 N296 L297 S298 E318 D351	L295-W320 PolarHBondContact O-N 3.03Å; N296-W320 HydrophobicContact CB-CB 4.09Å; N296-W320 HydrophobicContact CB-CG 4.27Å; L297-W320 CarbonylContact C-O 3.56Å; L297-W320 WeakPolarHBondContact CA-O 3.27Å; L297-W320 PolarHBondContact N-O 2.91Å; S298-W320 PolarHBondContact N-O 3.39Å; E318-W320 PolarHBondContact OE1-NE1 3.31Å; W320-D351 WeakPolarHBondContact CA-OD1 3.43Å; W320-D351 VanDerWaalsContact CZ3-C 3.47Å
321	L	95.5	Very high	92.5	Very high	0 Å²	0	64.1 Å²	64.1	0%	0	31%	0.306	C	S	.	.			trans	-128.2	-3.9	177.7	-60.8	169	0	0	0	112.6	L297 L308 L319 N324 M326 Y336 V340 L350 D351	L297-L321 HydrophobicContact CB-CD2 4.11Å; L297-L321 HydrophobicContact CD1-CD2 4.11Å; L308-L321 HydrophobicContact CD1-CD1 3.93Å; L308-L321 HydrophobicContact CD2-CD1 4.47Å; L308-L321 HydrophobicContact CD2-CD2 3.94Å; L319-L321 HydrophobicContact CD1-CD2 4.31Å; L319-L321 HydrophobicContact CD1-CG 4.38Å; L319-L321 HydrophobicContact CD2-CD1 4.01Å; L319-L321 HydrophobicContact CD2-CG 4.23Å; L319-L321 HydrophobicContact CG-CD1 4.39Å; L319-L321 HydrophobicContact CG-CG 4.09Å; L321-N324 WeakPolarHBondContact O-CB 3.46Å; L321-N324 PolarHBondContact O-N 3.19Å; L321-N324 PolarHBondContact O-ND2 2.97Å; L321-M326 HydrophobicContact CD1-CE 4.08Å; L321-Y336 WeakPolarHBondContact CB-OH 3.32Å; L321-Y336 HydrophobicContact CD1-CE2 4.28Å; L321-V340 HydrophobicContact CD1-CG2 3.99Å; L321-L350 HydrophobicContact CD1-CD1 4.45Å; L321-D351 PolarHBondContact N-OD1 2.71Å
322	D	93.3	Very high	92.3	Very high	59 Å²	59	68.5 Å²	68.5	32%	0.316	33%	0.329	S	S	.	.	T	Hydrogen-bonded Turn	trans	-36.3	142.2	174	167.4	51.9	0	0	0	113.9	S298 G299 N324 D351	S298-D322 CarbonylContact C-O 3.58Å; S298-D322 WeakPolarHBondContact CA-O 3.23Å; S298-D322 VanDerWaalsContact CB-O 3.24Å; S298-D322 WeakPolarHBondContact CB-O 3.3Å; G299-D322 PolarHBondContact N-O 3.39Å; D322-N324 PolarHBondContact O-N 2.93Å; D322-D351 PolarHBondContact N-OD1 3.33Å
323	R	91.4	Very high	92.1	Very high	162 Å²	162	69.2 Å²	69.2	61%	0.611	33%	0.334	S	S	*	.	T	Hydrogen-bonded Turn	trans	53.8	30.3	-177.1	-71.8	167.5	-70.8	149.1	6.7	114.8
324	N	94.6	Very high	92.1	Very high	3 Å²	3	71 Å²	71	2%	0.016	34%	0.34	C	S	.	.			trans	-97.2	140	161	-78.1	-96.8	0	0	0	110.6	L297 N300 L302 L321 D322 M326 C327	L297-N324 PolarHBondContact O-ND2 3.34Å; N300-N324 WeakPolarHBondContact CA-OD1 3.4Å; N300-N324 WeakPolarHBondContact CB-OD1 3.29Å; N300-N324 PolarHBondContact O-OD1 3.23Å; N300-N324 VanDerWaalsContact O-OD1 3.11Å; L302-N324 HydrophobicContact CB-CB 4.26Å; L302-N324 VanDerWaalsContact CB-OD1 3.28Å; L302-N324 WeakPolarHBondContact CB-OD1 3.48Å; L302-N324 VanDerWaalsContact CG-OD1 3.3Å; L302-N324 WeakPolarHBondContact CG-OD1 3.34Å; L302-N324 PolarHBondContact N-OD1 2.93Å; L321-N324 WeakPolarHBondContact O-CB 3.46Å; L321-N324 PolarHBondContact O-N 3.19Å; L321-N324 PolarHBondContact O-ND2 2.97Å; D322-N324 PolarHBondContact O-N 2.93Å; N324-M326 HydrophobicContact CB-CG 3.88Å; N324-M326 PolarHBondContact O-N 3.34Å; N324-C327 WeakPolarHBondContact O-CB 3.41Å; N324-C327 PolarHBondContact O-N 3.13Å
325	P	92.6	Very high	92	Very high	54 Å²	54	73.9 Å²	73.9	35%	0.351	36%	0.357	S	S	.	.	T	Hydrogen-bonded Turn	trans	-57.9	-13.2	177.8	-26.3	34.2	0	0	0	115.9	N300 L302 K303 C327 N329	N300-P325 WeakPolarHBondContact O-CD 3.26Å; L302-P325 CarbonylContact O-C 3.58Å; L302-P325 WeakPolarHBondContact O-CD 3.46Å; K303-P325 HydrophobicContact CG-CB 4.43Å; P325-C327 VanDerWaalsContact C-N 3.31Å; P325-N329 PolarHBondContact O-ND2 3.49Å
326	M	92	Very high	92	Very high	2 Å²	2	67.6 Å²	67.6	1%	0.01	33%	0.33	C	S	.	.	T	Hydrogen-bonded Turn	trans	-67.1	-31.2	172.4	60.7	171.3	-82.6	0	0	112.8	L302 E305 L308 L321 N324 D328 N329 F330	L302-M326 HydrophobicContact CB-CG 4.45Å; L302-M326 HydrophobicContact CB-SD 4.29Å; L302-M326 WeakPolarHBondContact O-CB 3.32Å; L302-M326 PolarHBondContact O-N 2.87Å; E305-M326 HydrophobicContact CB-CE 4.07Å; L308-M326 HydrophobicContact CD1-CE 4.17Å; L321-M326 HydrophobicContact CD1-CE 4.08Å; N324-M326 HydrophobicContact CB-CG 3.88Å; N324-M326 PolarHBondContact O-N 3.34Å; M326-D328 VanDerWaalsContact C-N 3.31Å; M326-D328 PolarHBondContact O-N 3.34Å; M326-N329 WeakPolarHBondContact CA-ND2 3.47Å; M326-N329 PolarHBondContact O-N 3.27Å; M326-N329 PolarHBondContact O-ND2 3.02Å; M326-N329 VanDerWaalsContact O-ND2 3.07Å; M326-F330 HydrophobicContact CE-CE2 4.22Å; M326-F330 WeakPolarHBondContact O-CD2 3.47Å; M326-F330 WeakPolarHBondContact O-CE2 3.49Å
327	C	89.6	Confident	91.9	Very high	35 Å²	35	69.1 Å²	69.1	24%	0.236	34%	0.338	C	S	.	.	G	3₁₀ helix	trans	-64.9	-35.5	-177.4	-61.4	0	0	0	0	111.9	N324 P325 N329 F330	N324-C327 WeakPolarHBondContact O-CB 3.41Å; N324-C327 PolarHBondContact O-N 3.13Å; P325-C327 VanDerWaalsContact C-N 3.31Å; C327-N329 PolarHBondContact O-N 3.31Å; C327-N329 VanDerWaalsContact O-N 3.13Å; C327-F330 PolarHBondContact O-N 3.22Å
328	D	90.1	Very high	91.7	Very high	139 Å²	139	69.3 Å²	69.3	74%	0.743	35%	0.347	S	S	*	.	G	3₁₀ helix	trans	-65.9	-12.9	179.1	-53.9	-44.8	0	0	0	113.9	M326	M326-D328 VanDerWaalsContact C-N 3.31Å; M326-D328 PolarHBondContact O-N 3.34Å
329	N	89.9	Confident	91.5	Very high	113 Å²	113	68.5 Å²	68.5	60%	0.604	35%	0.346	S	S	*	.	G	3₁₀ helix	trans	-83	-15.3	178.2	-58.9	-72.4	0	0	0	113.3	P325 M326 C327	P325-N329 PolarHBondContact O-ND2 3.49Å; M326-N329 WeakPolarHBondContact CA-ND2 3.47Å; M326-N329 PolarHBondContact O-N 3.27Å; M326-N329 PolarHBondContact O-ND2 3.02Å; M326-N329 VanDerWaalsContact O-ND2 3.07Å; C327-N329 PolarHBondContact O-N 3.31Å; C327-N329 VanDerWaalsContact O-N 3.13Å
330	F	90.1	Very high	91.3	Very high	38 Å²	38	68.5 Å²	68.5	17%	0.167	35%	0.346	C	S	.	.			trans	-88.5	132.8	-178.6	-61.2	-79.7	0	0	0	110.7	E305 M326 C327 T335 Y336 A339	E305-F330 HydrophobicContact CB-CZ 4.29Å; E305-F330 WeakPolarHBondContact OE2-CE1 3.49Å; E305-F330 WeakPolarHBondContact OE2-CZ 3.26Å; M326-F330 HydrophobicContact CE-CE2 4.22Å; M326-F330 WeakPolarHBondContact O-CD2 3.47Å; M326-F330 WeakPolarHBondContact O-CE2 3.49Å; C327-F330 PolarHBondContact O-N 3.22Å; F330-T335 HydrophobicContact CD1-CG2 4.06Å; F330-Y336 AromaticContact CD2-CD2 3.69Å; F330-Y336 HydrophobicContact CD2-CD2 3.69Å; F330-Y336 HydrophobicContact CD2-CG 4.18Å; F330-Y336 AromaticContact CE2-CD2 3.56Å; F330-Y336 HydrophobicContact CE2-CD2 3.56Å; F330-Y336 HydrophobicContact CE2-CE2 4.25Å; F330-Y336 HydrophobicContact CE2-CG 4.45Å; F330-Y336 HydrophobicContact CG-CD2 4.26Å; F330-Y336 HydrophobicContact CG-CG 4.39Å; F330-Y336 HydrophobicContact CZ-CD2 4.03Å; F330-A339 HydrophobicContact CE1-CB 3.81Å; F330-A339 HydrophobicContact CZ-CB 4.17Å
331	R	87.9	Confident	90.9	Very high	235 Å²	235	66.9 Å²	66.9	89%	0.887	34%	0.34	S	S	*	.	S	Bend	trans	-76.3	-37.4	176.5	-64.2	-179.2	-178.2	-178.7	-0.3	112.5
332	D	89.8	Confident	90.7	Very high	93 Å²	93	73.3 Å²	73.3	50%	0.497	37%	0.37	S	S	.	.	S	Bend	trans	-138.2	141.1	-169.7	-54.9	-82.1	0	0	0	110.2	S334 T335 Y336	D332-S334 PolarHBondContact O-N 3.45Å; D332-S334 VanDerWaalsContact O-N 3.16Å; D332-T335 WeakPolarHBondContact O-CB 3.49Å; D332-T335 PolarHBondContact O-N 3.32Å; D332-Y336 PolarHBondContact O-N 2.87Å
333	Q	87.4	Confident	90.7	Very high	126 Å²	126	71.9 Å²	71.9	59%	0.589	36%	0.36	S	S	*	.	H	α-helix	trans	-57.6	-31.1	179.2	-167.6	-175.7	4.9	0	0	112.5	Y336 I337	Q333-Y336 PolarHBondContact O-N 3.08Å; Q333-I337 HydrophobicContact CG-CD1 3.89Å; Q333-I337 HydrophobicContact CG-CG1 4.4Å; Q333-I337 WeakPolarHBondContact O-CB 3.39Å; Q333-I337 VanDerWaalsContact O-CG1 3.26Å; Q333-I337 WeakPolarHBondContact O-CG1 3.48Å; Q333-I337 PolarHBondContact O-N 3.39Å
334	S	87.6	Confident	90.7	Very high	84 Å²	84	64.3 Å²	64.3	59%	0.587	33%	0.332	S	S	*	.	H	α-helix	trans	-62.1	-40.3	174.8	53.3	0	0	0	0	113	D332 S338	D332-S334 PolarHBondContact O-N 3.45Å; D332-S334 VanDerWaalsContact O-N 3.16Å; S334-S338 WeakPolarHBondContact O-CB 3.39Å; S334-S338 PolarHBondContact O-N 2.77Å
335	T	90.9	Very high	90.4	Very high	70 Å²	70	68.3 Å²	68.3	43%	0.429	36%	0.357	S	S	.	.	H	α-helix	trans	-68.8	-42.4	177.6	-56	0	0	0	0	110.4	F330 D332 S338 A339	F330-T335 HydrophobicContact CD1-CG2 4.06Å; D332-T335 WeakPolarHBondContact O-CB 3.49Å; D332-T335 PolarHBondContact O-N 3.32Å; T335-S338 PolarHBondContact O-N 2.92Å; T335-A339 WeakPolarHBondContact O-CB 3.18Å; T335-A339 PolarHBondContact O-N 2.94Å
336	Y	92.5	Very high	90.2	Very high	23 Å²	23	72.5 Å²	72.5	9%	0.09	37%	0.37	C	S	.	.	H	α-helix	trans	-60	-51.3	175.4	172.2	-129.1	0	0	0	112.2	L321 F330 D332 Q333 S338 A339 V340 L350 D351	L321-Y336 WeakPolarHBondContact CB-OH 3.32Å; L321-Y336 HydrophobicContact CD1-CE2 4.28Å; F330-Y336 AromaticContact CD2-CD2 3.69Å; F330-Y336 HydrophobicContact CD2-CD2 3.69Å; F330-Y336 HydrophobicContact CD2-CG 4.18Å; F330-Y336 AromaticContact CE2-CD2 3.56Å; F330-Y336 HydrophobicContact CE2-CD2 3.56Å; F330-Y336 HydrophobicContact CE2-CE2 4.25Å; F330-Y336 HydrophobicContact CE2-CG 4.45Å; F330-Y336 HydrophobicContact CG-CD2 4.26Å; F330-Y336 HydrophobicContact CG-CG 4.39Å; F330-Y336 HydrophobicContact CZ-CD2 4.03Å; D332-Y336 PolarHBondContact O-N 2.87Å; Q333-Y336 PolarHBondContact O-N 3.08Å; Y336-S338 VanDerWaalsContact C-N 3.28Å; Y336-S338 PolarHBondContact O-N 3.05Å; Y336-A339 PolarHBondContact O-N 2.94Å; Y336-V340 HydrophobicContact CD2-CG2 4.02Å; Y336-V340 HydrophobicContact CE2-CG2 3.71Å; Y336-V340 WeakPolarHBondContact O-CG2 3.46Å; Y336-V340 PolarHBondContact O-N 2.93Å; Y336-L350 HydrophobicContact CD1-CD2 4.22Å; Y336-L350 HydrophobicContact CE1-CD2 3.7Å; Y336-L350 HydrophobicContact CE1-CG 4.12Å; Y336-D351 WeakPolarHBondContact CE1-OD2 3.32Å; Y336-D351 PolarHBondContact OH-OD2 3.05Å
337	I	90.7	Very high	90.1	Very high	34 Å²	34	72.4 Å²	72.4	17%	0.174	37%	0.37	C	S	.	.	H	α-helix	trans	-57.8	-41.8	176.5	-70	165.3	0	0	0	111	Q333 R341 L350 L355	Q333-I337 HydrophobicContact CG-CD1 3.89Å; Q333-I337 HydrophobicContact CG-CG1 4.4Å; Q333-I337 WeakPolarHBondContact O-CB 3.39Å; Q333-I337 VanDerWaalsContact O-CG1 3.26Å; Q333-I337 WeakPolarHBondContact O-CG1 3.48Å; Q333-I337 PolarHBondContact O-N 3.39Å; I337-R341 WeakPolarHBondContact O-CB 3.35Å; I337-R341 WeakPolarHBondContact O-CG 3.49Å; I337-R341 PolarHBondContact O-N 3.19Å; I337-L350 HydrophobicContact CG1-CD2 4.28Å; I337-L355 HydrophobicContact CD1-CD2 3.73Å; I337-L355 HydrophobicContact CG1-CD2 3.78Å; I337-L355 HydrophobicContact CG2-CD1 4.34Å; I337-L355 HydrophobicContact CG2-CD2 4.05Å
338	S	89.4	Confident	90.2	Very high	79 Å²	79	74.7 Å²	74.7	55%	0.552	38%	0.379	S	S	*	.	H	α-helix	trans	-64.1	-48.1	178.9	-167.9	0	0	0	0	112.4	S334 T335 Y336 V340 R341 E342	S334-S338 WeakPolarHBondContact O-CB 3.39Å; S334-S338 PolarHBondContact O-N 2.77Å; T335-S338 PolarHBondContact O-N 2.92Å; Y336-S338 VanDerWaalsContact C-N 3.28Å; Y336-S338 PolarHBondContact O-N 3.05Å; S338-V340 VanDerWaalsContact C-N 3.33Å; S338-V340 PolarHBondContact O-N 3.23Å; S338-R341 PolarHBondContact O-N 3.32Å; S338-E342 PolarHBondContact O-N 3.26Å
339	A	91.8	Very high	90.4	Very high	14 Å²	14	72.8 Å²	72.8	12%	0.116	36%	0.361	C	S	.	.	H	α-helix	trans	-62.5	-38.2	179.5	0	0	0	0	0	112.8	F330 T335 Y336 R343	F330-A339 HydrophobicContact CE1-CB 3.81Å; F330-A339 HydrophobicContact CZ-CB 4.17Å; T335-A339 WeakPolarHBondContact O-CB 3.18Å; T335-A339 PolarHBondContact O-N 2.94Å; Y336-A339 PolarHBondContact O-N 2.94Å; A339-R343 PolarHBondContact O-NH1 3.18Å; A339-R343 VanDerWaalsContact O-NH1 3.13Å
340	V	93.1	Very high	90.6	Very high	1 Å²	1	67.6 Å²	67.6	1%	0.006	33%	0.334	C	S	.	.	H	α-helix	trans	-68.6	-43.2	173.9	174.7	0	0	0	0	111.1	L308 L319 L321 Y336 S338 E342 R343 F344 L347 L350	L308-V340 HydrophobicContact CD1-CG2 4.38Å; L319-V340 HydrophobicContact CD2-CG1 3.86Å; L321-V340 HydrophobicContact CD1-CG2 3.99Å; Y336-V340 HydrophobicContact CD2-CG2 4.02Å; Y336-V340 HydrophobicContact CE2-CG2 3.71Å; Y336-V340 WeakPolarHBondContact O-CG2 3.46Å; Y336-V340 PolarHBondContact O-N 2.93Å; S338-V340 VanDerWaalsContact C-N 3.33Å; S338-V340 PolarHBondContact O-N 3.23Å; V340-E342 PolarHBondContact O-N 2.96Å; V340-R343 CarbonylContact O-C 3.47Å; V340-R343 WeakPolarHBondContact O-CA 3.32Å; V340-R343 WeakPolarHBondContact O-CB 3.46Å; V340-R343 PolarHBondContact O-N 3.37Å; V340-F344 HydrophobicContact CG1-CD2 4.17Å; V340-F344 PolarHBondContact O-N 3.4Å; V340-L347 HydrophobicContact CG1-CD2 3.61Å; V340-L350 HydrophobicContact CB-CD2 4.2Å; V340-L350 HydrophobicContact CG1-CD1 4.25Å; V340-L350 HydrophobicContact CG1-CD2 4.15Å; V340-L350 HydrophobicContact CG2-CD2 4.16Å
341	R	89.9	Confident	90.8	Very high	41 Å²	41	67.2 Å²	67.2	16%	0.155	33%	0.333	C	S	.	.	H	α-helix	trans	-71.3	-26.6	-179.4	-80.4	-174.3	153.9	-175.6	-5.1	114.7	I337 S338 R343 F344 P345 L347 L355 P356	I337-R341 WeakPolarHBondContact O-CB 3.35Å; I337-R341 WeakPolarHBondContact O-CG 3.49Å; I337-R341 PolarHBondContact O-N 3.19Å; S338-R341 PolarHBondContact O-N 3.32Å; R341-R343 PolarHBondContact O-N 3.31Å; R341-F344 CarbonylContact O-C 3.42Å; R341-F344 VanDerWaalsContact O-C 3.31Å; R341-F344 PolarHBondContact O-N 3.15Å; R341-P345 WeakPolarHBondContact O-CA 3.31Å; R341-P345 WeakPolarHBondContact O-CD 3.39Å; R341-P345 WeakPolarHBondContact O-CG 3.4Å; R341-P345 VanDerWaalsContact O-N 3.17Å; R341-L347 PolarHBondContact NE-O 2.92Å; R341-L347 PolarHBondContact NH2-O 3.08Å; R341-L355 VanDerWaalsContact NH2-CB 3.26Å; R341-P356 PolarHBondContact NH1-O 2.99Å; R341-P356 PolarHBondContact NH2-O 2.91Å
342	E	90.5	Very high	90.9	Very high	134 Å²	134	57 Å²	57	63%	0.626	30%	0.301	S	S	*	.	T	Hydrogen-bonded Turn	trans	-60.4	-25.8	167.2	-169.1	-153.1	144.6	0	0	111.6	S338 V340	S338-E342 PolarHBondContact O-N 3.26Å; V340-E342 PolarHBondContact O-N 2.96Å
343	R	92.4	Very high	90.9	Very high	30 Å²	30	58.2 Å²	58.2	11%	0.113	30%	0.304	C	S	.	.	T	Hydrogen-bonded Turn	trans	-93.4	-35.3	173.3	-52.3	-51.9	178.6	-82.5	41.8	113.2	L308 D309 K312 A339 V340 R341	L308-R343 HydrophobicContact CB-CB 4.44Å; L308-R343 HydrophobicContact CB-CG 4.1Å; D309-R343 VanDerWaalsContact CG-NE 3.26Å; D309-R343 IonicContact OD1-NE 2.69Å; D309-R343 PolarHBondContact OD1-NE 2.76Å; D309-R343 VanDerWaalsContact OD1-NE 3.16Å; D309-R343 IonicContact OD2-CZ 3.73Å; D309-R343 IonicContact OD2-NE 2.65Å; D309-R343 PolarHBondContact OD2-NE 3.03Å; D309-R343 IonicContact OD2-NH2 2.71Å; K312-R343 HydrophobicContact CB-CB 4.12Å; A339-R343 PolarHBondContact O-NH1 3.18Å; A339-R343 VanDerWaalsContact O-NH1 3.13Å; V340-R343 CarbonylContact O-C 3.47Å; V340-R343 WeakPolarHBondContact O-CA 3.32Å; V340-R343 WeakPolarHBondContact O-CB 3.46Å; V340-R343 PolarHBondContact O-N 3.37Å; R341-R343 PolarHBondContact O-N 3.31Å
344	F	92.6	Very high	91	Very high	3 Å²	3	60.2 Å²	60.2	1%	0.013	31%	0.313	C	S	.	.			trans	-130	79.1	-177.4	-54.1	-73	0	0	0	111.5	L308 I311 L314 L316 L319 V340 R341 K346 L347	L308-F344 HydrophobicContact CB-CE2 4.22Å; L308-F344 HydrophobicContact CD1-CE2 4.41Å; L308-F344 HydrophobicContact CD2-CE2 4.42Å; I311-F344 HydrophobicContact CD1-CZ 4.02Å; I311-F344 HydrophobicContact CG1-CZ 4.04Å; L314-F344 HydrophobicContact CB-CE1 4.36Å; L316-F344 HydrophobicContact CB-CD1 4.33Å; L316-F344 HydrophobicContact CD1-CD1 3.99Å; L316-F344 HydrophobicContact CD1-CE1 3.73Å; L316-F344 HydrophobicContact CD1-CG 4.48Å; L316-F344 HydrophobicContact CD1-CZ 4.01Å; L316-F344 HydrophobicContact CG-CD1 4.23Å; L316-F344 HydrophobicContact CG-CE1 4.25Å; L319-F344 HydrophobicContact CD2-CD2 3.79Å; L319-F344 HydrophobicContact CD2-CE2 3.74Å; V340-F344 HydrophobicContact CG1-CD2 4.17Å; V340-F344 PolarHBondContact O-N 3.4Å; R341-F344 CarbonylContact O-C 3.42Å; R341-F344 VanDerWaalsContact O-C 3.31Å; R341-F344 PolarHBondContact O-N 3.15Å; F344-K346 PolarHBondContact O-N 3.19Å; F344-K346 VanDerWaalsContact O-N 3.17Å; F344-L347 HydrophobicContact CB-CB 4.06Å; F344-L347 VanDerWaalsContact O-CB 3.26Å; F344-L347 WeakPolarHBondContact O-CB 3.49Å; F344-L347 PolarHBondContact O-N 2.92Å; F344-L347 VanDerWaalsContact O-N 3.13Å
345	P	88.6	Confident	91	Very high	86 Å²	86	56.8 Å²	56.8	56%	0.558	29%	0.288	S	S	*	.	T	Hydrogen-bonded Turn	trans	-63.7	-23.9	-175.4	-25.3	35.2	0	0	0	114.5	R341 L347 P358	R341-P345 WeakPolarHBondContact O-CA 3.31Å; R341-P345 WeakPolarHBondContact O-CD 3.39Å; R341-P345 WeakPolarHBondContact O-CG 3.4Å; R341-P345 VanDerWaalsContact O-N 3.17Å; P345-L347 VanDerWaalsContact C-N 3.33Å; P345-P358 VanDerWaalsContact O-CB 3.32Å; P345-P358 WeakPolarHBondContact O-CB 3.27Å; P345-P358 WeakPolarHBondContact O-CG 3.4Å
346	K	87.3	Confident	90.6	Very high	142 Å²	142	57.7 Å²	57.7	62%	0.617	30%	0.295	S	S	*	.	T	Hydrogen-bonded Turn	trans	-86.4	2.8	179	-61.1	-154.5	173.3	-147	0	114.2	L316 F344 L348	L316-K346 CarbonylContact O-C 3.59Å; F344-K346 PolarHBondContact O-N 3.19Å; F344-K346 VanDerWaalsContact O-N 3.17Å; K346-L348 PolarHBondContact O-N 3.2Å
347	L	90.8	Very high	89.8	Confident	0 Å²	0	62.1 Å²	62.1	0%	0	33%	0.326	C	S	.	.			trans	-68.5	119.8	-174.5	-166	74.7	0	0	0	112	L316 L319 V340 R341 F344 P345 R349 L350 L355	L316-L347 HydrophobicContact CB-CD1 4.07Å; L316-L347 WeakPolarHBondContact O-CA 3.34Å; L316-L347 PolarHBondContact O-N 2.79Å; L319-L347 HydrophobicContact CB-CD1 3.6Å; L319-L347 HydrophobicContact CB-CD2 4.07Å; L319-L347 HydrophobicContact CB-CG 4.5Å; L319-L347 HydrophobicContact CD2-CD2 4.4Å; V340-L347 HydrophobicContact CG1-CD2 3.61Å; R341-L347 PolarHBondContact NE-O 2.92Å; R341-L347 PolarHBondContact NH2-O 3.08Å; F344-L347 HydrophobicContact CB-CB 4.06Å; F344-L347 VanDerWaalsContact O-CB 3.26Å; F344-L347 WeakPolarHBondContact O-CB 3.49Å; F344-L347 PolarHBondContact O-N 2.92Å; F344-L347 VanDerWaalsContact O-N 3.13Å; P345-L347 VanDerWaalsContact C-N 3.33Å; L347-R349 WeakPolarHBondContact CD1-O 3.1Å; L347-R349 WeakPolarHBondContact CG-O 3.4Å; L347-L350 HydrophobicContact CD2-CB 4.06Å; L347-L350 HydrophobicContact CD2-CD1 4.23Å; L347-L355 HydrophobicContact CD2-CD1 4.04Å; L347-L355 HydrophobicContact CG-CD1 4.29Å
348	L	91.5	Very high	88.7	Confident	83 Å²	83	62.5 Å²	62.5	44%	0.435	33%	0.331	S	S	.	.			trans	-95.3	-34.8	178.9	-57	-179.3	0	0	0	111.8	E317 K346 L355 P358	E317-L348 PolarHBondContact O-N 2.87Å; K346-L348 PolarHBondContact O-N 3.2Å; L348-L355 WeakPolarHBondContact O-CB 3.14Å; L348-L355 PolarHBondContact O-N 2.7Å; L348-P358 HydrophobicContact CD2-CG 4.38Å
349	R	94.3	Very high	87.6	Confident	99 Å²	99	66.1 Å²	66.1	37%	0.374	34%	0.343	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-129.8	135.3	-177.5	-58.8	-175.8	71.2	-146.6	6.3	112	E317 E318 L319 L347 G352 H353	E317-R349 PolarHBondContact O-N 3.48Å; E318-R349 WeakPolarHBondContact CA-O 3.42Å; E318-R349 HydrophobicContact CB-CB 4.12Å; E318-R349 HydrophobicContact CG-CB 3.85Å; E318-R349 IonicContact OE1-NH1 2.79Å; E318-R349 WeakPolarHBondContact OE2-CD 3.49Å; E318-R349 IonicContact OE2-CZ 3.22Å; E318-R349 IonicContact OE2-NE 3.63Å; E318-R349 IonicContact OE2-NH1 3.67Å; E318-R349 PolarHBondContact OE2-NH1 3.21Å; L319-R349 PolarHBondContact N-O 3.24Å; L347-R349 WeakPolarHBondContact CD1-O 3.1Å; L347-R349 WeakPolarHBondContact CG-O 3.4Å; R349-G352 PolarHBondContact NH2-O 2.96Å; R349-H353 CarbonylContact C-O 3.58Å; R349-H353 VanDerWaalsContact CA-O 3.26Å; R349-H353 WeakPolarHBondContact CA-O 3.37Å
350	L	94.8	Very high	86	Confident	5 Å²	5	69.2 Å²	69.2	3%	0.026	37%	0.369	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-134	124.2	177.8	179.9	58.5	0	0	0	109.7	L319 L321 Y336 I337 V340 L347 G352 H353 L355	L319-L350 HydrophobicContact CB-CD1 4.28Å; L319-L350 HydrophobicContact CD2-CD1 4.4Å; L319-L350 HydrophobicContact CG-CD1 4.26Å; L319-L350 CarbonylContact O-C 3.48Å; L319-L350 VanDerWaalsContact O-CA 3.32Å; L319-L350 WeakPolarHBondContact O-CA 3.5Å; L321-L350 HydrophobicContact CD1-CD1 4.45Å; Y336-L350 HydrophobicContact CD1-CD2 4.22Å; Y336-L350 HydrophobicContact CE1-CD2 3.7Å; Y336-L350 HydrophobicContact CE1-CG 4.12Å; I337-L350 HydrophobicContact CG1-CD2 4.28Å; V340-L350 HydrophobicContact CB-CD2 4.2Å; V340-L350 HydrophobicContact CG1-CD1 4.25Å; V340-L350 HydrophobicContact CG1-CD2 4.15Å; V340-L350 HydrophobicContact CG2-CD2 4.16Å; L347-L350 HydrophobicContact CD2-CB 4.06Å; L347-L350 HydrophobicContact CD2-CD1 4.23Å; L350-G352 PolarHBondContact O-N 3Å; L350-H353 PolarHBondContact N-O 3.5Å; L350-H353 WeakPolarHBondContact O-CB 3.41Å; L350-H353 PolarHBondContact O-N 3.22Å; L350-L355 HydrophobicContact CB-CD1 3.89Å; L350-L355 HydrophobicContact CB-CD2 4.1Å; L350-L355 HydrophobicContact CB-CG 4.14Å
351	D	93.3	Very high	84.4	Confident	29 Å²	29	78 Å²	78	16%	0.155	41%	0.407	C	S	.	.	T	Hydrogen-bonded Turn	trans	53.5	35.9	-178.2	-59.7	-50.6	0	0	0	113	L319 W320 L321 D322 Y336 H353	L319-D351 PolarHBondContact O-N 2.91Å; W320-D351 WeakPolarHBondContact CA-OD1 3.43Å; W320-D351 VanDerWaalsContact CZ3-C 3.47Å; L321-D351 PolarHBondContact N-OD1 2.71Å; D322-D351 PolarHBondContact N-OD1 3.33Å; Y336-D351 WeakPolarHBondContact CE1-OD2 3.32Å; Y336-D351 PolarHBondContact OH-OD2 3.05Å; D351-H353 PolarHBondContact O-CD2 3.14Å; D351-H353 PolarHBondContact O-N 3.17Å
352	G	89.3	Confident	82.7	Confident	20 Å²	20	82.7 Å²	82.7	21%	0.206	44%	0.435	C	S	.	.	T	Hydrogen-bonded Turn	trans	81.7	-16.6	-176.8	0	0	0	0	0	115.2	R349 L350	R349-G352 PolarHBondContact NH2-O 2.96Å; L350-G352 PolarHBondContact O-N 3Å
353	H	89.6	Confident	81.3	Confident	120 Å²	120	82 Å²	82	56%	0.556	44%	0.44	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-80.9	137.6	177.2	-63	-83.3	0	0	0	111.5	R349 L350 D351	R349-H353 CarbonylContact C-O 3.58Å; R349-H353 VanDerWaalsContact CA-O 3.26Å; R349-H353 WeakPolarHBondContact CA-O 3.37Å; L350-H353 PolarHBondContact N-O 3.5Å; L350-H353 WeakPolarHBondContact O-CB 3.41Å; L350-H353 PolarHBondContact O-N 3.22Å; D351-H353 PolarHBondContact O-CD2 3.14Å; D351-H353 PolarHBondContact O-N 3.17Å
354	E	90.3	Very high	79.8	Confident	167 Å²	167	89.3 Å²	89.3	78%	0.78	48%	0.475	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-75.5	136.8	171.8	-170.3	172.2	-173	0	0	110.5
355	L	87.5	Confident	78.9	Confident	13 Å²	13	92.3 Å²	92.3	7%	0.068	50%	0.501	C	S	.	.	P	Polyproline II helix	trans	-100.5	146	-178.4	-61.5	-177.9	0	0	0	110.6	I337 R341 L347 L348 L350	I337-L355 HydrophobicContact CD1-CD2 3.73Å; I337-L355 HydrophobicContact CG1-CD2 3.78Å; I337-L355 HydrophobicContact CG2-CD1 4.34Å; I337-L355 HydrophobicContact CG2-CD2 4.05Å; R341-L355 VanDerWaalsContact NH2-CB 3.26Å; L347-L355 HydrophobicContact CD2-CD1 4.04Å; L347-L355 HydrophobicContact CG-CD1 4.29Å; L348-L355 WeakPolarHBondContact O-CB 3.14Å; L348-L355 PolarHBondContact O-N 2.7Å; L350-L355 HydrophobicContact CB-CD1 3.89Å; L350-L355 HydrophobicContact CB-CD2 4.1Å; L350-L355 HydrophobicContact CB-CG 4.14Å
356	P	82.9	Confident	78.2	Confident	88 Å²	88	94.3 Å²	94.3	57%	0.571	51%	0.513	S	S	*	.	P	Polyproline II helix	trans	-52.3	148.9	174.1	-25.2	33.8	0	0	0	111.8	R341	R341-P356 PolarHBondContact NH1-O 2.99Å; R341-P356 PolarHBondContact NH2-O 2.91Å
357	P	74.7	Confident	78.1	Confident	116 Å²	116	93.9 Å²	93.9	75%	0.753	52%	0.523	S	S	*	.	P	Polyproline II helix	trans	-49.4	135	-176.2	-30.7	36.2	0	0	0	113.6	I359	P357-I359 PolarHBondContact O-N 3.45Å
358	P	69.3	Low	77.8	Confident	43 Å²	43	102 Å²	102	28%	0.279	56%	0.563	S	S	.	*	P	Polyproline II helix	trans	-57.3	137.7	173.9	-25.6	34.8	0	0	0	112.1	P345 L348 A360	P345-P358 VanDerWaalsContact O-CB 3.32Å; P345-P358 WeakPolarHBondContact O-CB 3.27Å; P345-P358 WeakPolarHBondContact O-CG 3.4Å; L348-P358 HydrophobicContact CD2-CG 4.38Å; P358-A360 PolarHBondContact O-N 3.36Å
359	I	65.7	Low	77.8	Confident	155 Å²	155	105.4 Å²	105.4	80%	0.795	58%	0.581	S	S	*	*			trans	-78.2	77.6	174.6	-52	176.9	0	0	0	108.4	P357 F361	P357-I359 PolarHBondContact O-N 3.45Å; I359-F361 HydrophobicContact CG2-CD2 4.45Å; I359-F361 HydrophobicContact CG2-CE2 3.9Å
360	A	58.3	Low	77.7	Confident	79 Å²	79	105.9 Å²	105.9	65%	0.653	60%	0.597	S	S	*	*			trans	-100	110.2	175.9	0	0	0	0	0	110	P358 D362	P358-A360 PolarHBondContact O-N 3.36Å; A360-D362 VanDerWaalsContact C-N 3.33Å; A360-D362 PolarHBondContact O-N 2.96Å
361	F	59.9	Low	77.6	Confident	186 Å²	186	111 Å²	111	82%	0.816	63%	0.63	S	S	*	*			trans	-80.6	86.8	161.4	-66.6	-82.9	0	0	0	107.5	I359 V363	I359-F361 HydrophobicContact CG2-CD2 4.45Å; I359-F361 HydrophobicContact CG2-CE2 3.9Å; F361-V363 PolarHBondContact O-N 3.31Å
362	D	54.1	Low	77.6	Confident	138 Å²	138	115.9 Å²	115.9	74%	0.738	67%	0.665	S	S	*	*			trans	-74.5	95.8	-179.7	-147.4	-8.6	0	0	0	109.4	A360 E364	A360-D362 VanDerWaalsContact C-N 3.33Å; A360-D362 PolarHBondContact O-N 2.96Å; D362-E364 PolarHBondContact O-N 3.17Å
363	V	60.3	Low	77.7	Confident	121 Å²	121	124.1 Å²	124.1	73%	0.733	70%	0.695	S	S	*	*			trans	-79.3	102.8	171.7	179.9	0	0	0	0	106.4	F361 A365	F361-V363 PolarHBondContact O-N 3.31Å; V363-A365 PolarHBondContact O-N 3.13Å
364	E	60.3	Low	77.9	Confident	183 Å²	183	120.7 Å²	120.7	86%	0.855	69%	0.692	S	S	*	*			trans	-63.9	70.4	-179.8	-66.4	-171.4	164.1	0	0	112.5	D362	D362-E364 PolarHBondContact O-N 3.17Å
365	A	73.6	Confident	78.2	Confident	66 Å²	66	115 Å²	115	55%	0.545	67%	0.671	S	S	.	*			trans	-71.8	123.3	171	0	0	0	0	0	108.8	V363 T367	V363-A365 PolarHBondContact O-N 3.13Å; A365-T367 PolarHBondContact O-N 2.56Å
366	P	75.6	Confident	78.6	Confident	127 Å²	127	121.5 Å²	121.5	83%	0.825	70%	0.696	S	S	*	*			trans	-66.4	103.4	-179.9	25.6	-33.4	0	0	0	110.3
367	T	83.4	Confident	79.2	Confident	133 Å²	133	118.4 Å²	118.4	82%	0.816	67%	0.674	S	S	*	*			trans	-83.7	-12	178.8	50.6	0	0	0	0	113.3	A365	A365-T367 PolarHBondContact O-N 2.56Å
368	M	85.8	Confident	80.1	Confident	170 Å²	170	115.3 Å²	115.3	84%	0.837	66%	0.663	S	S	*	*	P	Polyproline II helix	trans	-83.8	119.7	179.6	-64.1	-175.2	71.6	0	0	111.1
369	L	90.9	Very high	81.2	Confident	156 Å²	156	116.8 Å²	116.8	82%	0.817	67%	0.671	S	S	*	*	P	Polyproline II helix	trans	-72.6	152.2	167.7	-62.5	177.2	0	0	0	110.6
370	P	92.8	Very high	82.7	Confident	109 Å²	109	114.6 Å²	114.6	71%	0.708	66%	0.657	S	S	*	*	P	Polyproline II helix	trans	-56.9	145.1	171.2	-24.1	34.5	0	0	0	112	C372	P370-C372 PolarHBondContact O-N 3.28Å
371	P	91.8	Very high	84.3	Confident	111 Å²	111	117.4 Å²	117.4	72%	0.721	66%	0.661	S	S	*	*	P	Polyproline II helix	trans	-67.2	125.4	-178.9	26.9	-34.2	0	0	0	111.3
372	C	92.8	Very high	85.9	Confident	133 Å²	133	109.2 Å²	109.2	90%	0.899	63%	0.626	S	S	*	*	P	Polyproline II helix	trans	-59.5	141.6	172.5	-60.6	0	0	0	0	110.9	P370	P370-C372 PolarHBondContact O-N 3.28Å
373	K	93.1	Very high	87.9	Confident	192 Å²	192	105.8 Å²	105.8	84%	0.835	61%	0.605	S	S	*	*			trans	-117.1	168.7	175.3	-65.6	-177.1	179.7	179.4	0	110.1
374	G	93.1	Very high	89.6	Confident	48 Å²	48	103.2 Å²	103.2	50%	0.495	59%	0.592	S	S	.	*	S	Bend	trans	-78.6	-156.9	159.6	0	0	0	0	0	111.2
375	S	96.1	Very high	91.2	Very high	48 Å²	48	96.9 Å²	96.9	34%	0.336	56%	0.563	S	S	.	*			trans	-50.6	136.4	-173.4	-48.8	0	0	0	0	114.9	F377 V479 V480	S375-F377 VanDerWaalsContact CB-CE2 3.43Å; S375-V479 WeakPolarHBondContact OG-CA 3.42Å; S375-V480 CarbonylContact C-O 3.57Å; S375-V480 WeakPolarHBondContact CA-O 3.43Å; S375-V480 VanDerWaalsContact CB-O 3.23Å; S375-V480 WeakPolarHBondContact CB-O 3.45Å; S375-V480 PolarHBondContact OG-N 3.48Å
376	Y	96.8	Very high	92.3	Very high	149 Å²	149	93.7 Å²	93.7	58%	0.584	54%	0.538	S	S	*	.	B	Isolated β-bridge	trans	-116.3	113.5	172	177.2	-102.5	0	0	0	112.6	V480 D481 I482	Y376-V480 PolarHBondContact N-O 3.12Å; Y376-D481 PolarHBondContact N-OD1 3.5Å; Y376-I482 PolarHBondContact O-N 3.22Å
377	F	95.4	Very high	93.3	Very high	24 Å²	24	90.6 Å²	90.6	11%	0.105	51%	0.514	C	S	.	.			trans	-108.4	-5.8	-179.5	-60.8	-86.7	0	0	0	114.7	S375 T379 L382 K383 V386 L387 V480 I482	S375-F377 VanDerWaalsContact CB-CE2 3.43Å; F377-T379 PolarHBondContact O-N 3.46Å; F377-L382 WeakPolarHBondContact O-CB 3.39Å; F377-K383 HydrophobicContact CB-CB 3.68Å; F377-K383 HydrophobicContact CB-CG 4.44Å; F377-K383 HydrophobicContact CD1-CB 3.94Å; F377-K383 HydrophobicContact CD1-CG 4.23Å; F377-K383 HydrophobicContact CD2-CB 4.01Å; F377-K383 HydrophobicContact CD2-CD 3.63Å; F377-K383 HydrophobicContact CD2-CG 3.81Å; F377-K383 HydrophobicContact CE1-CG 4.37Å; F377-K383 HydrophobicContact CE2-CD 3.9Å; F377-K383 HydrophobicContact CE2-CG 3.97Å; F377-K383 HydrophobicContact CG-CB 3.63Å; F377-K383 HydrophobicContact CG-CD 4.16Å; F377-K383 HydrophobicContact CG-CG 3.93Å; F377-K383 HydrophobicContact CZ-CG 4.24Å; F377-V386 HydrophobicContact CE1-CG1 4.48Å; F377-L387 HydrophobicContact CE1-CD2 4.3Å; F377-L387 HydrophobicContact CE1-CG 4.14Å; F377-L387 HydrophobicContact CZ-CD1 4.28Å; F377-L387 HydrophobicContact CZ-CD2 3.98Å; F377-L387 HydrophobicContact CZ-CG 4.06Å; F377-V480 HydrophobicContact CD1-CG1 4.26Å; F377-V480 HydrophobicContact CE1-CB 3.68Å; F377-V480 HydrophobicContact CE1-CG1 3.66Å; F377-V480 HydrophobicContact CE1-CG2 4.3Å; F377-V480 HydrophobicContact CZ-CB 3.77Å; F377-V480 HydrophobicContact CZ-CG1 4.29Å; F377-V480 HydrophobicContact CZ-CG2 4.24Å; F377-I482 HydrophobicContact CB-CD1 4.33Å; F377-I482 HydrophobicContact CD1-CD1 4.35Å; F377-I482 WeakPolarHBondContact O-CD1 3.38Å
378	G	92.4	Very high	93.9	Very high	51 Å²	51	89.1 Å²	89.1	53%	0.526	50%	0.497	S	S	.	.	S	Bend	trans	68.7	-63	-174	0	0	0	0	0	114.5
379	T	93.9	Very high	94.4	Very high	73 Å²	73	81.7 Å²	81.7	45%	0.448	46%	0.46	S	S	.	.	S	Bend	trans	-126.8	153	179.5	69.2	0	0	0	0	112.3	F377 N381 L382 K383	F377-T379 PolarHBondContact O-N 3.46Å; T379-N381 VanDerWaalsContact C-N 3.26Å; T379-N381 PolarHBondContact O-N 3.27Å; T379-L382 PolarHBondContact O-N 2.88Å; T379-L382 WeakPolarHBondContact OG1-CG 3.49Å; T379-L382 PolarHBondContact OG1-N 2.8Å; T379-K383 PolarHBondContact O-N 2.79Å
380	E	95.2	Very high	94.7	Very high	109 Å²	109	74.3 Å²	74.3	51%	0.509	42%	0.422	S	S	.	.	H	α-helix	trans	-66.1	-27.5	179.1	-167.3	57.3	-140.9	0	0	112.8	K383 S384	E380-K383 PolarHBondContact O-N 2.83Å; E380-K383 IonicContact OE1-NZ 2.78Å; E380-K383 PolarHBondContact OE1-NZ 3.41Å; E380-K383 WeakPolarHBondContact OE2-CD 3.34Å; E380-K383 IonicContact OE2-NZ 3.97Å; E380-K383 PolarHBondContact OE2-NZ 2.92Å; E380-S384 WeakPolarHBondContact O-CB 3.28Å; E380-S384 PolarHBondContact O-N 2.81Å; E380-S384 PolarHBondContact O-OG 3.25Å
381	N	93.3	Very high	94.9	Very high	138 Å²	138	74.3 Å²	74.3	74%	0.738	41%	0.412	S	S	*	.	H	α-helix	trans	-64.7	-45.8	172.1	-65.6	9	0	0	0	111.4	T379 S384 L385	T379-N381 VanDerWaalsContact C-N 3.26Å; T379-N381 PolarHBondContact O-N 3.27Å; N381-S384 PolarHBondContact O-N 2.75Å; N381-L385 WeakPolarHBondContact O-CB 3.47Å; N381-L385 PolarHBondContact O-N 3.35Å
382	L	93.6	Very high	95.1	Very high	14 Å²	14	74 Å²	74	7%	0.073	40%	0.401	C	S	.	.	H	α-helix	trans	-67	-38.8	175.8	-71.6	174	0	0	0	111.9	F377 T379 L385 V386 I482 L490	F377-L382 WeakPolarHBondContact O-CB 3.39Å; T379-L382 PolarHBondContact O-N 2.88Å; T379-L382 WeakPolarHBondContact OG1-CG 3.49Å; T379-L382 PolarHBondContact OG1-N 2.8Å; L382-L385 PolarHBondContact O-N 2.93Å; L382-V386 WeakPolarHBondContact O-CB 3.48Å; L382-V386 VanDerWaalsContact O-CG2 3.32Å; L382-V386 WeakPolarHBondContact O-CG2 3.49Å; L382-V386 PolarHBondContact O-N 3.49Å; L382-I482 HydrophobicContact CB-CD1 3.71Å; L382-I482 HydrophobicContact CD1-CD1 4.01Å; L382-I482 HydrophobicContact CG-CD1 4.35Å; L382-L490 HydrophobicContact CD2-CD1 3.99Å; L382-L490 HydrophobicContact CD2-CD2 4.24Å
383	K	95.6	Very high	95.3	Very high	67 Å²	67	67.9 Å²	67.9	29%	0.291	36%	0.359	S	S	.	.	H	α-helix	trans	-56.3	-50.4	172.5	176.8	160.7	155.3	-98.6	0	111.4	F377 T379 E380 L387	F377-K383 HydrophobicContact CB-CB 3.68Å; F377-K383 HydrophobicContact CB-CG 4.44Å; F377-K383 HydrophobicContact CD1-CB 3.94Å; F377-K383 HydrophobicContact CD1-CG 4.23Å; F377-K383 HydrophobicContact CD2-CB 4.01Å; F377-K383 HydrophobicContact CD2-CD 3.63Å; F377-K383 HydrophobicContact CD2-CG 3.81Å; F377-K383 HydrophobicContact CE1-CG 4.37Å; F377-K383 HydrophobicContact CE2-CD 3.9Å; F377-K383 HydrophobicContact CE2-CG 3.97Å; F377-K383 HydrophobicContact CG-CB 3.63Å; F377-K383 HydrophobicContact CG-CD 4.16Å; F377-K383 HydrophobicContact CG-CG 3.93Å; F377-K383 HydrophobicContact CZ-CG 4.24Å; T379-K383 PolarHBondContact O-N 2.79Å; E380-K383 PolarHBondContact O-N 2.83Å; E380-K383 IonicContact OE1-NZ 2.78Å; E380-K383 PolarHBondContact OE1-NZ 3.41Å; E380-K383 WeakPolarHBondContact OE2-CD 3.34Å; E380-K383 IonicContact OE2-NZ 3.97Å; E380-K383 PolarHBondContact OE2-NZ 2.92Å; K383-L387 HydrophobicContact CG-CD1 3.75Å; K383-L387 VanDerWaalsContact O-CB 3.26Å; K383-L387 WeakPolarHBondContact O-CB 3.43Å; K383-L387 WeakPolarHBondContact O-CG 3.3Å; K383-L387 PolarHBondContact O-N 2.83Å
384	S	95.5	Very high	95.6	Very high	67 Å²	67	58.8 Å²	58.8	47%	0.469	32%	0.319	S	S	.	.	H	α-helix	trans	-61.4	-47.1	178.4	-58	0	0	0	0	111.9	E380 N381 H388	E380-S384 WeakPolarHBondContact O-CB 3.28Å; E380-S384 PolarHBondContact O-N 2.81Å; E380-S384 PolarHBondContact O-OG 3.25Å; N381-S384 PolarHBondContact O-N 2.75Å; S384-H388 VanDerWaalsContact O-CB 3.29Å; S384-H388 WeakPolarHBondContact O-CB 3.36Å; S384-H388 PolarHBondContact O-N 2.94Å
385	L	95.3	Very high	95.8	Very high	49 Å²	49	59.6 Å²	59.6	26%	0.257	32%	0.322	S	S	.	.	H	α-helix	trans	-60.4	-52.6	178.3	173.4	58.9	0	0	0	112.7	N381 L382 H388 F389 S524 L526	N381-L385 WeakPolarHBondContact O-CB 3.47Å; N381-L385 PolarHBondContact O-N 3.35Å; L382-L385 PolarHBondContact O-N 2.93Å; L385-H388 PolarHBondContact O-N 3.34Å; L385-F389 WeakPolarHBondContact O-CB 3.49Å; L385-F389 PolarHBondContact O-N 3.16Å; L385-S524 WeakPolarHBondContact CD1-O 3.33Å; L385-L526 HydrophobicContact CD1-CD1 4.43Å; L385-L526 HydrophobicContact CD1-CG 4.2Å; L385-L526 HydrophobicContact CD2-CD1 4.48Å; L385-L526 HydrophobicContact CD2-CD2 4.22Å; L385-L526 HydrophobicContact CD2-CG 4.4Å; L385-L526 HydrophobicContact CG-CD1 4.15Å; L385-L526 HydrophobicContact CG-CG 4.31Å
386	V	96.3	Very high	95.8	Very high	0 Å²	0	60.1 Å²	60.1	0%	0	32%	0.32	C	S	.	.	H	α-helix	trans	-70.4	-38.9	-175.6	174.8	0	0	0	0	111.1	F377 L382 F389 L390 V480 I482 L490 F492 L526	F377-V386 HydrophobicContact CE1-CG1 4.48Å; L382-V386 WeakPolarHBondContact O-CB 3.48Å; L382-V386 VanDerWaalsContact O-CG2 3.32Å; L382-V386 WeakPolarHBondContact O-CG2 3.49Å; L382-V386 PolarHBondContact O-N 3.49Å; V386-F389 PolarHBondContact O-N 2.91Å; V386-L390 HydrophobicContact CG1-CD1 3.8Å; V386-L390 HydrophobicContact CG1-CG 4.26Å; V386-L390 WeakPolarHBondContact O-CB 3.49Å; V386-L390 WeakPolarHBondContact O-CG 3.16Å; V386-L390 PolarHBondContact O-N 2.87Å; V386-V480 HydrophobicContact CG1-CG1 3.86Å; V386-I482 HydrophobicContact CG2-CD1 4.1Å; V386-L490 HydrophobicContact CG2-CD2 3.78Å; V386-F492 HydrophobicContact CG1-CD2 3.75Å; V386-F492 HydrophobicContact CG1-CE2 3.71Å; V386-F492 HydrophobicContact CG1-CG 4.36Å; V386-F492 HydrophobicContact CG1-CZ 4.3Å; V386-L526 HydrophobicContact CG2-CD1 4.48Å
387	L	96	Very high	95.9	Very high	62 Å²	62	53.3 Å²	53.3	33%	0.325	29%	0.294	S	S	.	.	H	α-helix	trans	-65.3	-40.7	174.9	-70.2	173.9	0	0	0	112	F377 K383 L390 Q391	F377-L387 HydrophobicContact CE1-CD2 4.3Å; F377-L387 HydrophobicContact CE1-CG 4.14Å; F377-L387 HydrophobicContact CZ-CD1 4.28Å; F377-L387 HydrophobicContact CZ-CD2 3.98Å; F377-L387 HydrophobicContact CZ-CG 4.06Å; K383-L387 HydrophobicContact CG-CD1 3.75Å; K383-L387 VanDerWaalsContact O-CB 3.26Å; K383-L387 WeakPolarHBondContact O-CB 3.43Å; K383-L387 WeakPolarHBondContact O-CG 3.3Å; K383-L387 PolarHBondContact O-N 2.83Å; L387-L390 PolarHBondContact O-N 2.75Å; L387-Q391 WeakPolarHBondContact O-CB 3.49Å; L387-Q391 VanDerWaalsContact O-CG 3.28Å; L387-Q391 WeakPolarHBondContact O-CG 3.48Å; L387-Q391 PolarHBondContact O-N 3.04Å
388	H	95.5	Very high	96	Very high	101 Å²	101	54.1 Å²	54.1	47%	0.468	30%	0.299	S	S	.	.	H	α-helix	trans	-64	-45.6	175.7	-173.3	62.2	0	0	0	112.1	S384 L385 L390 Q391 Q392	S384-H388 VanDerWaalsContact O-CB 3.29Å; S384-H388 WeakPolarHBondContact O-CB 3.36Å; S384-H388 PolarHBondContact O-N 2.94Å; L385-H388 PolarHBondContact O-N 3.34Å; H388-L390 PolarHBondContact O-N 3.35Å; H388-Q391 PolarHBondContact O-N 3.26Å; H388-Q392 PolarHBondContact CE1-NE2 3.13Å; H388-Q392 PolarHBondContact NE2-NE2 3.03Å; H388-Q392 PolarHBondContact O-N 3.07Å
389	F	96.4	Very high	96.1	Very high	15 Å²	15	55.5 Å²	55.5	7%	0.066	30%	0.3	C	S	.	.	H	α-helix	trans	-57	-46.2	173	167.8	-93.7	0	0	0	111.8	L385 V386 Q392 Y393 F492 F516 L526 I528	L385-F389 WeakPolarHBondContact O-CB 3.49Å; L385-F389 PolarHBondContact O-N 3.16Å; V386-F389 PolarHBondContact O-N 2.91Å; F389-Q392 PolarHBondContact O-N 2.83Å; F389-Y393 HydrophobicContact CZ-CD2 4.1Å; F389-Y393 HydrophobicContact CZ-CG 4.46Å; F389-Y393 WeakPolarHBondContact O-CB 3.44Å; F389-Y393 PolarHBondContact O-N 2.59Å; F389-F492 HydrophobicContact CD1-CE2 4.28Å; F389-F492 AromaticContact CD1-CZ 3.83Å; F389-F492 HydrophobicContact CD1-CZ 3.83Å; F389-F492 HydrophobicContact CE1-CE2 4.19Å; F389-F492 AromaticContact CE1-CZ 3.67Å; F389-F492 HydrophobicContact CE1-CZ 3.67Å; F389-F516 HydrophobicContact CE1-CD2 4.43Å; F389-F516 HydrophobicContact CE1-CE2 4.41Å; F389-L526 HydrophobicContact CB-CD1 4.17Å; F389-L526 HydrophobicContact CD1-CD1 4.46Å; F389-L526 HydrophobicContact CD2-CB 3.83Å; F389-L526 HydrophobicContact CD2-CD1 4.34Å; F389-L526 HydrophobicContact CE2-CB 4.09Å; F389-L526 HydrophobicContact CG-CB 4.4Å; F389-L526 HydrophobicContact CG-CD1 4.06Å; F389-I528 HydrophobicContact CE2-CD1 4.48Å; F389-I528 HydrophobicContact CE2-CG1 4.3Å; F389-I528 HydrophobicContact CZ-CD1 3.94Å; F389-I528 HydrophobicContact CZ-CG1 3.88Å
390	L	97.6	Very high	95.7	Very high	1 Å²	1	53 Å²	53	1%	0.005	29%	0.289	C	S	.	.	H	α-helix	trans	-66.6	-38.9	-179.8	-71.6	170.8	0	0	0	112.4	V386 L387 H388 Y394 F478 V480 F492 V494 F516	V386-L390 HydrophobicContact CG1-CD1 3.8Å; V386-L390 HydrophobicContact CG1-CG 4.26Å; V386-L390 WeakPolarHBondContact O-CB 3.49Å; V386-L390 WeakPolarHBondContact O-CG 3.16Å; V386-L390 PolarHBondContact O-N 2.87Å; L387-L390 PolarHBondContact O-N 2.75Å; H388-L390 PolarHBondContact O-N 3.35Å; L390-Y394 HydrophobicContact CD2-CD2 4.11Å; L390-Y394 HydrophobicContact CD2-CE2 3.79Å; L390-Y394 WeakPolarHBondContact O-CB 3.4Å; L390-Y394 WeakPolarHBondContact O-CD2 3.49Å; L390-Y394 PolarHBondContact O-N 3.25Å; L390-F478 HydrophobicContact CD1-CD2 4.5Å; L390-V480 HydrophobicContact CD1-CG1 4.42Å; L390-V480 HydrophobicContact CD1-CG2 3.79Å; L390-F492 HydrophobicContact CD2-CE2 4.31Å; L390-V494 HydrophobicContact CD1-CG2 3.84Å; L390-V494 HydrophobicContact CD2-CG2 3.77Å; L390-V494 HydrophobicContact CG-CG2 4.47Å; L390-F516 HydrophobicContact CD2-CE2 4.1Å
391	Q	96.5	Very high	95.7	Very high	108 Å²	108	51.4 Å²	51.4	51%	0.505	28%	0.284	S	S	.	.	H	α-helix	trans	-59.7	-48.9	173.7	-75	170	-6.7	0	0	111.5	L387 H388 A395	L387-Q391 WeakPolarHBondContact O-CB 3.49Å; L387-Q391 VanDerWaalsContact O-CG 3.28Å; L387-Q391 WeakPolarHBondContact O-CG 3.48Å; L387-Q391 PolarHBondContact O-N 3.04Å; H388-Q391 PolarHBondContact O-N 3.26Å; Q391-A395 WeakPolarHBondContact O-CB 3.46Å; Q391-A395 PolarHBondContact O-N 3.43Å
392	Q	96.3	Very high	95.8	Very high	105 Å²	105	45.1 Å²	45.1	49%	0.491	25%	0.25	S	S	.	.	H	α-helix	trans	-64.2	-49.4	177.7	-71.5	178.6	-21.7	0	0	112	H388 F389 Y394 A395 I396	H388-Q392 PolarHBondContact CE1-NE2 3.13Å; H388-Q392 PolarHBondContact NE2-NE2 3.03Å; H388-Q392 PolarHBondContact O-N 3.07Å; F389-Q392 PolarHBondContact O-N 2.83Å; Q392-Y394 PolarHBondContact O-N 2.73Å; Q392-A395 PolarHBondContact O-N 3.02Å; Q392-I396 WeakPolarHBondContact O-CG1 3.43Å; Q392-I396 PolarHBondContact O-N 2.96Å; Q392-I396 VanDerWaalsContact O-N 3.16Å
393	Y	97.9	Very high	96	Very high	4 Å²	4	50 Å²	50	2%	0.016	27%	0.272	C	S	.	.	H	α-helix	trans	-58.5	-50.3	-178.3	-177.9	-82.9	0	0	0	111.2	F389 I396 Y397 L405 Y409 R514 F516 I528	F389-Y393 HydrophobicContact CZ-CD2 4.1Å; F389-Y393 HydrophobicContact CZ-CG 4.46Å; F389-Y393 WeakPolarHBondContact O-CB 3.44Å; F389-Y393 PolarHBondContact O-N 2.59Å; Y393-I396 PolarHBondContact O-N 3.39Å; Y393-Y397 AromaticContact CE1-CD2 3.67Å; Y393-Y397 HydrophobicContact CE1-CD2 3.67Å; Y393-Y397 HydrophobicContact CE1-CE2 4.42Å; Y393-Y397 HydrophobicContact CE1-CG 4.22Å; Y393-Y397 AromaticContact CZ-CD2 3.95Å; Y393-Y397 WeakPolarHBondContact O-CB 3.35Å; Y393-Y397 PolarHBondContact O-N 2.78Å; Y393-L405 HydrophobicContact CD2-CD2 3.79Å; Y393-L405 HydrophobicContact CE2-CD1 4.19Å; Y393-L405 HydrophobicContact CE2-CD2 3.76Å; Y393-L405 HydrophobicContact CE2-CG 4.49Å; Y393-L405 HydrophobicContact CG-CD2 4.28Å; Y393-Y409 AromaticContact CE2-CE2 3.99Å; Y393-Y409 HydrophobicContact CE2-CE2 3.99Å; Y393-Y409 PolarHBondContact OH-OH 2.89Å; Y393-R514 VanDerWaalsContact OH-CZ 3.23Å; Y393-R514 PolarHBondContact OH-NH1 3.13Å; Y393-R514 PolarHBondContact OH-NH2 2.82Å; Y393-F516 HydrophobicContact CD1-CZ 4.23Å; Y393-F516 HydrophobicContact CE1-CE1 4.48Å; Y393-F516 AromaticContact CE1-CZ 3.95Å; Y393-F516 HydrophobicContact CE1-CZ 3.95Å; Y393-F516 HydrophobicContact CE2-CE1 4.2Å; Y393-F516 HydrophobicContact CE2-CZ 4.36Å; Y393-I528 HydrophobicContact CD2-CD1 4.02Å; Y393-I528 HydrophobicContact CE2-CD1 3.65Å
394	Y	98.1	Very high	96	Very high	1 Å²	1	48.8 Å²	48.8	0%	0.004	28%	0.279	C	S	.	.	H	α-helix	trans	-75.9	-29.2	-177.2	-79.4	-78.8	0	0	0	113.6	L390 Q392 I396 Y397 D398 H473 F478 F512 R514	L390-Y394 HydrophobicContact CD2-CD2 4.11Å; L390-Y394 HydrophobicContact CD2-CE2 3.79Å; L390-Y394 WeakPolarHBondContact O-CB 3.4Å; L390-Y394 WeakPolarHBondContact O-CD2 3.49Å; L390-Y394 PolarHBondContact O-N 3.25Å; Q392-Y394 PolarHBondContact O-N 2.73Å; Y394-I396 VanDerWaalsContact C-N 3.31Å; Y394-I396 PolarHBondContact O-N 3.43Å; Y394-Y397 HydrophobicContact CD1-CD1 4.45Å; Y394-Y397 HydrophobicContact CD1-CG 4.4Å; Y394-Y397 PolarHBondContact O-N 2.82Å; Y394-D398 WeakPolarHBondContact O-CB 3.43Å; Y394-D398 PolarHBondContact O-N 2.98Å; Y394-H473 HydrophobicContact CD1-CB 4.12Å; Y394-H473 AromaticContact CD1-CD2 3.64Å; Y394-H473 AromaticContact CD1-CE1 3.73Å; Y394-H473 AromaticContact CD1-CG 3.48Å; Y394-H473 VanDerWaalsContact CD1-CG 3.48Å; Y394-H473 AromaticContact CD1-ND1 3.52Å; Y394-H473 AromaticContact CD1-NE2 3.83Å; Y394-H473 AromaticContact CE1-CD2 3.32Å; Y394-H473 WeakPolarHBondContact CE1-CD2 3.42Å; Y394-H473 AromaticContact CE1-CE1 3.6Å; Y394-H473 AromaticContact CE1-CG 3.7Å; Y394-H473 AromaticContact CE1-ND1 3.83Å; Y394-H473 AromaticContact CE1-NE2 3.29Å; Y394-H473 VanDerWaalsContact CE1-NE2 3.29Å; Y394-H473 WeakPolarHBondContact CE1-NE2 3.11Å; Y394-F478 HydrophobicContact CD1-CZ 4.34Å; Y394-F478 AromaticContact CD2-CE2 3.61Å; Y394-F478 HydrophobicContact CD2-CE2 3.61Å; Y394-F478 HydrophobicContact CD2-CZ 4.01Å; Y394-F478 HydrophobicContact CE1-CZ 4.37Å; Y394-F478 AromaticContact CE2-CE2 3.71Å; Y394-F478 HydrophobicContact CE2-CE2 3.71Å; Y394-F478 HydrophobicContact CE2-CZ 4.04Å; Y394-F478 HydrophobicContact CG-CE2 4.15Å; Y394-F478 HydrophobicContact CG-CZ 4.14Å; Y394-F512 VanDerWaalsContact OH-CE2 3.28Å; Y394-F512 WeakPolarHBondContact OH-CE2 3.42Å; Y394-R514 WeakPolarHBondContact OH-CD 3.34Å
395	A	97.3	Very high	96.1	Very high	66 Å²	66	45.6 Å²	45.6	55%	0.545	26%	0.257	S	S	.	.	H	α-helix	trans	-60.1	-40.4	169.6	0	0	0	0	0	112.2	Q391 Q392 S399	Q391-A395 WeakPolarHBondContact O-CB 3.46Å; Q391-A395 PolarHBondContact O-N 3.43Å; Q392-A395 PolarHBondContact O-N 3.02Å; A395-S399 PolarHBondContact O-N 2.95Å
396	I	97.8	Very high	96.2	Very high	58 Å²	58	45.3 Å²	45.3	30%	0.297	26%	0.255	S	S	.	.	H	α-helix	trans	-71.6	-43.1	172.9	-60.2	167.4	0	0	0	110.5	Q392 Y393 Y394 D398 S399 L405	Q392-I396 WeakPolarHBondContact O-CG1 3.43Å; Q392-I396 PolarHBondContact O-N 2.96Å; Q392-I396 VanDerWaalsContact O-N 3.16Å; Y393-I396 PolarHBondContact O-N 3.39Å; Y394-I396 VanDerWaalsContact C-N 3.31Å; Y394-I396 PolarHBondContact O-N 3.43Å; I396-D398 VanDerWaalsContact C-N 3.29Å; I396-D398 PolarHBondContact O-N 2.86Å; I396-S399 WeakPolarHBondContact O-CB 3.25Å; I396-S399 PolarHBondContact O-N 2.96Å; I396-S399 PolarHBondContact O-OG 2.66Å; I396-L405 HydrophobicContact CB-CD2 3.79Å; I396-L405 HydrophobicContact CB-CG 4.44Å; I396-L405 HydrophobicContact CD1-CD2 4.45Å; I396-L405 HydrophobicContact CG2-CD2 3.68Å; I396-L405 HydrophobicContact CG2-CG 3.79Å
397	Y	97.8	Very high	96.1	Very high	7 Å²	7	51.8 Å²	51.8	3%	0.027	29%	0.29	C	S	.	.	H	α-helix	trans	-60.2	-35.1	-177.8	-162.3	-85.4	0	0	0	113.3	Y393 Y394 R402 L405 L465 T471 H473	Y393-Y397 AromaticContact CE1-CD2 3.67Å; Y393-Y397 HydrophobicContact CE1-CD2 3.67Å; Y393-Y397 HydrophobicContact CE1-CE2 4.42Å; Y393-Y397 HydrophobicContact CE1-CG 4.22Å; Y393-Y397 AromaticContact CZ-CD2 3.95Å; Y393-Y397 WeakPolarHBondContact O-CB 3.35Å; Y393-Y397 PolarHBondContact O-N 2.78Å; Y394-Y397 HydrophobicContact CD1-CD1 4.45Å; Y394-Y397 HydrophobicContact CD1-CG 4.4Å; Y394-Y397 PolarHBondContact O-N 2.82Å; Y397-R402 PolarHBondContact O-NE 2.95Å; Y397-R402 PolarHBondContact O-NH2 2.89Å; Y397-L405 HydrophobicContact CD2-CD1 3.72Å; Y397-L405 HydrophobicContact CE2-CD1 4.45Å; Y397-L465 HydrophobicContact CE2-CD1 4.22Å; Y397-L465 HydrophobicContact CE2-CD2 4.1Å; Y397-L465 HydrophobicContact CE2-CG 4.5Å; Y397-T471 WeakPolarHBondContact CD1-OG1 3.4Å; Y397-T471 HydrophobicContact CE1-CG2 4.42Å; Y397-T471 WeakPolarHBondContact CE1-OG1 3.44Å; Y397-H473 AromaticContact CD1-CE1 3.68Å; Y397-H473 AromaticContact CE1-CE1 3.82Å
398	D	97.2	Very high	96.2	Very high	41 Å²	41	49.8 Å²	49.8	22%	0.219	28%	0.282	C	S	.	.	H	α-helix	trans	-97.2	-6.3	-178.4	-68	-19	0	0	0	113.9	Y394 I396 G400 T471 Q472 H473	Y394-D398 WeakPolarHBondContact O-CB 3.43Å; Y394-D398 PolarHBondContact O-N 2.98Å; I396-D398 VanDerWaalsContact C-N 3.29Å; I396-D398 PolarHBondContact O-N 2.86Å; D398-G400 PolarHBondContact O-N 3.13Å; D398-G400 VanDerWaalsContact O-N 3.09Å; D398-T471 VanDerWaalsContact CB-O 3.3Å; D398-T471 WeakPolarHBondContact CB-O 3.38Å; D398-T471 VanDerWaalsContact CG-O 3.23Å; D398-T471 VanDerWaalsContact OD1-C 3.27Å; D398-T471 VanDerWaalsContact OD1-CB 3.23Å; D398-T471 WeakPolarHBondContact OD1-CB 3.41Å; D398-T471 VanDerWaalsContact OD1-O 3.1Å; D398-T471 PolarHBondContact OD1-OG1 2.85Å; D398-Q472 WeakPolarHBondContact OD2-CA 3.43Å; D398-H473 VanDerWaalsContact CG-ND1 3.25Å; D398-H473 IonicContact OD1-CE1 2.9Å; D398-H473 PolarHBondContact OD1-CE1 3.26Å; D398-H473 IonicContact OD1-ND1 3.39Å; D398-H473 PolarHBondContact OD1-ND1 3.21Å; D398-H473 WeakPolarHBondContact OD2-CB 3.26Å; D398-H473 IonicContact OD2-CG 2.75Å; D398-H473 PolarHBondContact OD2-N 2.85Å; D398-H473 IonicContact OD2-ND1 3.5Å; D398-H473 PolarHBondContact OD2-ND1 3.5Å
399	S	94.7	Very high	96.3	Very high	79 Å²	79	45.2 Å²	45.2	55%	0.552	26%	0.261	S	S	*	.	S	Bend	trans	-58.1	-22.8	174.9	72.2	0	0	0	0	114	A395 I396 D401	A395-S399 PolarHBondContact O-N 2.95Å; I396-S399 WeakPolarHBondContact O-CB 3.25Å; I396-S399 PolarHBondContact O-N 2.96Å; I396-S399 PolarHBondContact O-OG 2.66Å; S399-D401 PolarHBondContact OG-N 3.02Å; S399-D401 PolarHBondContact OG-O 2.91Å
400	G	86.7	Confident	96.4	Very high	20 Å²	20	48.8 Å²	48.8	21%	0.206	28%	0.278	C	S	.	.	S	Bend	trans	87	0.8	-175.3	0	0	0	0	0	115	D398 K470	D398-G400 PolarHBondContact O-N 3.13Å; D398-G400 VanDerWaalsContact O-N 3.09Å; G400-K470 WeakPolarHBondContact O-CE 3.32Å; G400-K470 PolarHBondContact O-NZ 3.38Å
401	D	93.4	Very high	96.4	Very high	77 Å²	77	53.5 Å²	53.5	41%	0.412	30%	0.303	S	S	.	.			trans	-131.5	108.1	160.8	179.4	3	0	0	0	109.1	S399 Q403	S399-D401 PolarHBondContact OG-N 3.02Å; S399-D401 PolarHBondContact OG-O 2.91Å; D401-Q403 VanDerWaalsContact C-N 3.28Å; D401-Q403 VanDerWaalsContact CG-NE2 3.3Å; D401-Q403 PolarHBondContact O-N 3.14Å; D401-Q403 VanDerWaalsContact OD1-CB 3.29Å; D401-Q403 WeakPolarHBondContact OD1-CB 3.41Å; D401-Q403 VanDerWaalsContact OD1-CG 3.22Å; D401-Q403 WeakPolarHBondContact OD1-CG 3.38Å; D401-Q403 PolarHBondContact OD1-N 3.14Å; D401-Q403 PolarHBondContact OD1-NE2 3.21Å; D401-Q403 PolarHBondContact OD2-NE2 2.95Å
402	R	97.1	Very high	96.4	Very high	6 Å²	6	49.9 Å²	49.9	2%	0.023	29%	0.294	C	S	.	.	G	3₁₀ helix	trans	-87.1	5.8	-173.1	-57	-176.2	175.9	120.9	-0.1	112.8	Y397 G404 L405 V462 L465 N466 L468 P469 T471	Y397-R402 PolarHBondContact O-NE 2.95Å; Y397-R402 PolarHBondContact O-NH2 2.89Å; R402-G404 PolarHBondContact O-N 2.75Å; R402-L405 HydrophobicContact CB-CD1 3.96Å; R402-L405 HydrophobicContact CB-CG 4.46Å; R402-L405 VanDerWaalsContact O-CB 3.32Å; R402-L405 WeakPolarHBondContact O-CB 3.48Å; R402-L405 WeakPolarHBondContact O-CG 3.32Å; R402-L405 PolarHBondContact O-N 3.4Å; R402-V462 VanDerWaalsContact O-CG1 3.26Å; R402-V462 WeakPolarHBondContact O-CG1 3.46Å; R402-L465 WeakPolarHBondContact CD-O 3.34Å; R402-L465 PolarHBondContact NH1-O 3.18Å; R402-N466 WeakPolarHBondContact CB-OD1 3.42Å; R402-N466 PolarHBondContact N-OD1 2.84Å; R402-L468 PolarHBondContact NH1-O 3.18Å; R402-P469 PolarHBondContact NH1-O 3.11Å; R402-P469 PolarHBondContact NH2-O 3.34Å; R402-T471 PolarHBondContact NH2-OG1 3.21Å
403	Q	96.3	Very high	96.5	Very high	115 Å²	115	44.9 Å²	44.9	54%	0.537	27%	0.271	S	S	.	.	G	3₁₀ helix	trans	-55.8	-34.4	178.6	-77.8	174.8	94	0	0	113.7	D401 L405 L406	D401-Q403 VanDerWaalsContact C-N 3.28Å; D401-Q403 VanDerWaalsContact CG-NE2 3.3Å; D401-Q403 PolarHBondContact O-N 3.14Å; D401-Q403 VanDerWaalsContact OD1-CB 3.29Å; D401-Q403 WeakPolarHBondContact OD1-CB 3.41Å; D401-Q403 VanDerWaalsContact OD1-CG 3.22Å; D401-Q403 WeakPolarHBondContact OD1-CG 3.38Å; D401-Q403 PolarHBondContact OD1-N 3.14Å; D401-Q403 PolarHBondContact OD1-NE2 3.21Å; D401-Q403 PolarHBondContact OD2-NE2 2.95Å; Q403-L405 PolarHBondContact O-N 3.36Å; Q403-L406 WeakPolarHBondContact O-CB 3.47Å; Q403-L406 VanDerWaalsContact O-CG 3.3Å; Q403-L406 WeakPolarHBondContact O-CG 3.27Å; Q403-L406 PolarHBondContact O-N 3.31Å
404	G	96.1	Very high	96.5	Very high	42 Å²	42	45.9 Å²	45.9	43%	0.433	28%	0.279	S	S	.	.	G	3₁₀ helix	trans	-60.6	-15.8	176.7	0	0	0	0	0	114.6	R402 L406	R402-G404 PolarHBondContact O-N 2.75Å; G404-L406 PolarHBondContact O-N 3.44Å
405	L	97.6	Very high	96.6	Very high	1 Å²	1	45.9 Å²	45.9	1%	0.005	28%	0.279	C	S	.	.	G	3₁₀ helix	trans	-71.4	-12.5	173.3	-58.8	178.9	0	0	0	112.8	Y393 I396 Y397 R402 Q403 D407 A408 Y409 V462 L465	Y393-L405 HydrophobicContact CD2-CD2 3.79Å; Y393-L405 HydrophobicContact CE2-CD1 4.19Å; Y393-L405 HydrophobicContact CE2-CD2 3.76Å; Y393-L405 HydrophobicContact CE2-CG 4.49Å; Y393-L405 HydrophobicContact CG-CD2 4.28Å; I396-L405 HydrophobicContact CB-CD2 3.79Å; I396-L405 HydrophobicContact CB-CG 4.44Å; I396-L405 HydrophobicContact CD1-CD2 4.45Å; I396-L405 HydrophobicContact CG2-CD2 3.68Å; I396-L405 HydrophobicContact CG2-CG 3.79Å; Y397-L405 HydrophobicContact CD2-CD1 3.72Å; Y397-L405 HydrophobicContact CE2-CD1 4.45Å; R402-L405 HydrophobicContact CB-CD1 3.96Å; R402-L405 HydrophobicContact CB-CG 4.46Å; R402-L405 VanDerWaalsContact O-CB 3.32Å; R402-L405 WeakPolarHBondContact O-CB 3.48Å; R402-L405 WeakPolarHBondContact O-CG 3.32Å; R402-L405 PolarHBondContact O-N 3.4Å; Q403-L405 PolarHBondContact O-N 3.36Å; L405-D407 PolarHBondContact O-N 2.92Å; L405-D407 VanDerWaalsContact O-N 3.1Å; L405-A408 WeakPolarHBondContact O-CB 3.32Å; L405-A408 PolarHBondContact O-N 2.92Å; L405-Y409 HydrophobicContact CB-CD2 4.29Å; L405-Y409 HydrophobicContact CB-CE2 4.21Å; L405-Y409 WeakPolarHBondContact O-CD2 3.39Å; L405-Y409 PolarHBondContact O-N 2.82Å; L405-V462 HydrophobicContact CB-CG2 4.02Å; L405-L465 HydrophobicContact CD1-CD1 3.96Å
406	L	97.3	Very high	96.6	Very high	43 Å²	43	43.2 Å²	43.2	23%	0.225	26%	0.256	C	S	.	.	G	3₁₀ helix	trans	-54.9	-31.1	-179.8	-80.3	170.6	0	0	0	112.8	Q403 G404 R458 L459 V462	Q403-L406 WeakPolarHBondContact O-CB 3.47Å; Q403-L406 VanDerWaalsContact O-CG 3.3Å; Q403-L406 WeakPolarHBondContact O-CG 3.27Å; Q403-L406 PolarHBondContact O-N 3.31Å; G404-L406 PolarHBondContact O-N 3.44Å; L406-R458 HydrophobicContact CD2-CB 4.41Å; L406-R458 HydrophobicContact CD2-CG 4.22Å; L406-R458 PolarHBondContact O-NE 3.17Å; L406-R458 PolarHBondContact O-NH2 3.06Å; L406-L459 HydrophobicContact CD2-CD2 3.98Å; L406-V462 HydrophobicContact CD2-CB 3.85Å; L406-V462 HydrophobicContact CD2-CG1 4.32Å; L406-V462 HydrophobicContact CD2-CG2 3.87Å; L406-V462 HydrophobicContact CG-CB 4.17Å; L406-V462 HydrophobicContact CG-CG1 4.1Å; L406-V462 HydrophobicContact CG-CG2 4.13Å
407	D	95.3	Very high	96.6	Very high	135 Å²	135	40.5 Å²	40.5	72%	0.722	24%	0.242	S	C	*	.	G	3₁₀ helix	trans	-88.3	-9.3	-180	-60.8	-34.4	0	0	0	113.5	L405 R458	L405-D407 PolarHBondContact O-N 2.92Å; L405-D407 VanDerWaalsContact O-N 3.1Å; D407-R458 IonicContact OD1-NH2 3.49Å; D407-R458 PolarHBondContact OD1-NH2 3.08Å
408	A	96.4	Very high	96.6	Very high	21 Å²	21	41.1 Å²	41.1	17%	0.174	25%	0.248	C	C	.	.	T	Hydrogen-bonded Turn	trans	-87.3	-17.8	172.1	0	0	0	0	0	113.2	L405 I528	L405-A408 WeakPolarHBondContact O-CB 3.32Å; L405-A408 PolarHBondContact O-N 2.92Å; A408-I528 HydrophobicContact CB-CD1 4.33Å; A408-I528 WeakPolarHBondContact O-CG1 3.27Å; A408-I528 PolarHBondContact O-N 3.32Å
409	Y	98.3	Very high	96.5	Very high	4 Å²	4	39.6 Å²	39.6	2%	0.016	24%	0.239	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-105.4	135	-178.8	-77.2	-84.8	0	0	0	112.7	Y393 L405 A413 V461 V462 L465 R514 I528 D531	Y393-Y409 AromaticContact CE2-CE2 3.99Å; Y393-Y409 HydrophobicContact CE2-CE2 3.99Å; Y393-Y409 PolarHBondContact OH-OH 2.89Å; L405-Y409 HydrophobicContact CB-CD2 4.29Å; L405-Y409 HydrophobicContact CB-CE2 4.21Å; L405-Y409 WeakPolarHBondContact O-CD2 3.39Å; L405-Y409 PolarHBondContact O-N 2.82Å; Y409-A413 HydrophobicContact CD1-CB 3.87Å; Y409-V461 HydrophobicContact CD1-CG1 3.9Å; Y409-V461 HydrophobicContact CD2-CG1 4.28Å; Y409-V461 HydrophobicContact CE1-CG1 3.61Å; Y409-V461 HydrophobicContact CE2-CG1 4.04Å; Y409-V461 HydrophobicContact CG-CG1 4.22Å; Y409-V462 HydrophobicContact CD2-CG2 4.04Å; Y409-V462 HydrophobicContact CE2-CG2 4.47Å; Y409-L465 HydrophobicContact CE2-CD1 3.93Å; Y409-L465 WeakPolarHBondContact OH-CD1 3.37Å; Y409-R514 PolarHBondContact OH-NH2 3.41Å; Y409-I528 HydrophobicContact CD1-CB 3.67Å; Y409-I528 HydrophobicContact CD1-CD1 4.01Å; Y409-I528 HydrophobicContact CD1-CG1 4.47Å; Y409-I528 HydrophobicContact CD1-CG2 3.77Å; Y409-I528 HydrophobicContact CD2-CD1 4.15Å; Y409-I528 HydrophobicContact CE1-CB 3.86Å; Y409-I528 HydrophobicContact CE1-CD1 3.7Å; Y409-I528 HydrophobicContact CE1-CG1 4.41Å; Y409-I528 HydrophobicContact CE1-CG2 3.56Å; Y409-I528 HydrophobicContact CE2-CD1 3.83Å; Y409-I528 HydrophobicContact CG-CB 4.31Å; Y409-I528 HydrophobicContact CG-CD1 4.23Å; Y409-D531 HydrophobicContact CE1-CB 3.94Å; Y409-D531 PolarHBondContact OH-OD2 3.33Å
410	H	98.1	Very high	96.4	Very high	90 Å²	90	38.2 Å²	38.2	42%	0.417	23%	0.228	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-63	148.3	173.5	-176.7	-110.3	0	0	0	111.6	G412 A413 C527 I528 V529	H410-G412 PolarHBondContact ND1-N 3.11Å; H410-G412 PolarHBondContact O-N 3.31Å; H410-G412 VanDerWaalsContact O-N 3.1Å; H410-A413 HydrophobicContact CB-CB 4.28Å; H410-A413 WeakPolarHBondContact O-CB 3.33Å; H410-A413 PolarHBondContact O-N 3.46Å; H410-C527 VanDerWaalsContact CA-SG 3.58Å; H410-C527 PolarHBondContact N-SG 2.89Å; H410-C527 VanDerWaalsContact N-SG 3.38Å; H410-I528 WeakPolarHBondContact CB-O 3.31Å; H410-I528 PolarHBondContact N-O 3.05Å; H410-V529 HydrophobicContact CB-CG1 3.88Å
411	D	97.6	Very high	96.3	Very high	101 Å²	101	40.8 Å²	40.8	54%	0.54	24%	0.243	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-54.5	-36.5	-177.3	-69.8	-26.3	0	0	0	113	T457 R458	D411-T457 WeakPolarHBondContact O-CA 3.14Å; D411-T457 WeakPolarHBondContact O-CB 3.08Å; D411-R458 PolarHBondContact O-N 2.92Å; D411-R458 WeakPolarHBondContact OD1-CD 3.42Å; D411-R458 IonicContact OD1-CZ 2.72Å; D411-R458 IonicContact OD1-NE 3.96Å; D411-R458 IonicContact OD1-NH1 3.81Å; D411-R458 PolarHBondContact OD1-NH1 2.96Å
412	G	97.4	Very high	95.3	Very high	31 Å²	31	39.6 Å²	39.6	32%	0.32	24%	0.236	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-96.3	19.6	174.7	0	0	0	0	0	115.8	H410	H410-G412 PolarHBondContact ND1-N 3.11Å; H410-G412 PolarHBondContact O-N 3.31Å; H410-G412 VanDerWaalsContact O-N 3.1Å
413	A	98.3	Very high	93.5	Very high	0 Å²	0	44.8 Å²	44.8	0%	0	27%	0.271	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-62.6	152.2	-174.8	0	0	0	0	0	113.8	Y409 H410 H456 T457 I528 V529	Y409-A413 HydrophobicContact CD1-CB 3.87Å; H410-A413 HydrophobicContact CB-CB 4.28Å; H410-A413 WeakPolarHBondContact O-CB 3.33Å; H410-A413 PolarHBondContact O-N 3.46Å; A413-H456 CarbonylContact O-C 3.16Å; A413-H456 WeakPolarHBondContact O-CA 3.38Å; A413-T457 PolarHBondContact O-N 3.14Å; A413-I528 WeakPolarHBondContact CB-O 3.29Å; A413-V529 CarbonylContact C-O 3.51Å; A413-V529 WeakPolarHBondContact CA-O 3.3Å
414	C	98.5	Very high	91.2	Very high	26 Å²	26	48.3 Å²	48.3	18%	0.176	29%	0.287	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-114.4	132.1	176.4	-69.1	0	0	0	0	111.5	L454 K455 V529 N530 D531	C414-L454 HydrophobicContact CB-CD1 4.26Å; C414-K455 CarbonylContact C-O 3.54Å; C414-K455 WeakPolarHBondContact CA-O 3.35Å; C414-V529 PolarHBondContact N-O 3.13Å; C414-N530 CarbonylContact O-C 3.54Å; C414-N530 WeakPolarHBondContact O-CA 3.34Å; C414-D531 PolarHBondContact O-N 2.95Å
415	C	98.6	Very high	89.1	Confident	1 Å²	1	52.3 Å²	52.3	1%	0.007	30%	0.299	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-126.7	138	171	-178.1	0	0	0	0	111.3	K455 V461 D531	C415-K455 HydrophobicContact CB-CB 4.29Å; C415-K455 PolarHBondContact N-O 3.34Å; C415-K455 PolarHBondContact O-N 3.11Å; C415-V461 HydrophobicContact CB-CB 4.14Å; C415-V461 HydrophobicContact CB-CG1 3.59Å; C415-V461 HydrophobicContact CB-CG2 3.62Å; C415-D531 CarbonylContact C-O 3.57Å; C415-D531 VanDerWaalsContact CA-O 3.24Å; C415-D531 WeakPolarHBondContact CA-O 3.17Å; C415-D531 HydrophobicContact CB-CB 4.35Å; C415-D531 PolarHBondContact SG-OD2 3.18Å
416	S	98.4	Very high	87	Confident	9 Å²	9	55.9 Å²	55.9	6%	0.063	32%	0.324	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-140.4	165.5	161.6	48	0	0	0	0	113.6	D531 E532 L533	S416-D531 PolarHBondContact N-O 2.9Å; S416-E532 VanDerWaalsContact C-OE2 3.26Å; S416-E532 VanDerWaalsContact CB-OE2 3.29Å; S416-E532 WeakPolarHBondContact CB-OE2 3.24Å; S416-E532 WeakPolarHBondContact O-CA 3.23Å; S416-E532 PolarHBondContact OG-OE2 2.87Å; S416-L533 PolarHBondContact O-N 2.69Å
417	L	98.4	Very high	85	Confident	1 Å²	1	58.4 Å²	58.4	1%	0.005	35%	0.351	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-122.2	142.2	-176.5	172.4	74	0	0	0	109	Y434 D437 S438 R439 F464 L468 L533 V535	L417-Y434 HydrophobicContact CD1-CD1 4.22Å; L417-Y434 HydrophobicContact CD2-CD1 4.04Å; L417-D437 HydrophobicContact CD2-CB 3.95Å; L417-S438 CarbonylContact O-C 3.55Å; L417-S438 WeakPolarHBondContact O-CA 3.47Å; L417-R439 PolarHBondContact O-N 3.05Å; L417-F464 HydrophobicContact CB-CE1 4.28Å; L417-F464 HydrophobicContact CB-CZ 3.87Å; L417-F464 HydrophobicContact CD2-CZ 4Å; L417-L468 HydrophobicContact CD2-CD2 4.25Å; L417-L533 CarbonylContact C-O 3.59Å; L417-L533 WeakPolarHBondContact CA-O 3.33Å; L417-L533 HydrophobicContact CD1-CB 4.36Å; L417-L533 HydrophobicContact CD1-CD2 4.13Å; L417-L533 HydrophobicContact CD1-CG 4.03Å; L417-L533 WeakPolarHBondContact CD1-O 3.43Å; L417-V535 HydrophobicContact CD1-CG2 3.83Å
418	S	97.1	Very high	83.2	Confident	21 Å²	21	62.8 Å²	62.8	15%	0.147	36%	0.357	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-140.1	153.1	171.1	55.8	0	0	0	0	112.3	E532 L533 F534 V535	S418-E532 VanDerWaalsContact CB-OE1 3.24Å; S418-E532 WeakPolarHBondContact CB-OE1 3.36Å; S418-E532 PolarHBondContact N-OE1 3.33Å; S418-E532 PolarHBondContact OG-OE1 2.93Å; S418-L533 PolarHBondContact N-O 3.42Å; S418-F534 CarbonylContact O-C 3.58Å; S418-F534 VanDerWaalsContact O-CA 3.31Å; S418-F534 WeakPolarHBondContact O-CA 3.35Å; S418-V535 PolarHBondContact O-N 3.24Å
419	I	95.5	Very high	81.9	Confident	8 Å²	8	63 Å²	63	4%	0.041	36%	0.357	C	S	.	.			trans	-134.3	158.4	175.8	70.7	175.3	0	0	0	110	I422 L431 F435 V535	I419-I422 HydrophobicContact CD1-CD1 4.16Å; I419-L431 HydrophobicContact CD1-CB 4.23Å; I419-F435 HydrophobicContact CD1-CB 4.08Å; I419-F435 HydrophobicContact CD1-CD2 3.99Å; I419-F435 HydrophobicContact CD1-CG 4.46Å; I419-V535 WeakPolarHBondContact CA-O 3.04Å; I419-V535 WeakPolarHBondContact CB-O 3.47Å; I419-V535 HydrophobicContact CG2-CB 4.32Å; I419-V535 WeakPolarHBondContact CG2-O 3.27Å
420	P	92.9	Very high	80.9	Confident	50 Å²	50	67.7 Å²	67.7	33%	0.325	38%	0.383	S	S	.	.			trans	-62.4	154.4	179.6	24	-34	0	0	0	112.8	I422 L431 F534 V535 R536	P420-I422 PolarHBondContact O-N 3.19Å; P420-L431 HydrophobicContact CG-CD1 4.31Å; P420-F534 HydrophobicContact CB-CE2 4.45Å; P420-F534 HydrophobicContact CB-CZ 4.17Å; P420-F534 HydrophobicContact CG-CZ 4.35Å; P420-V535 WeakPolarHBondContact CD-O 3.27Å; P420-R536 HydrophobicContact CG-CB 3.92Å
421	S	83.3	Confident	80.4	Confident	75 Å²	75	63.6 Å²	63.6	52%	0.524	36%	0.364	S	S	.	.			trans	-68.9	93.8	-179.4	167.1	0	0	0	0	112.2	P423 K443	S421-P423 WeakPolarHBondContact O-CD 3.36Å; S421-K443 WeakPolarHBondContact OG-CE 3.42Å; S421-K443 PolarHBondContact OG-NZ 2.81Å
422	I	73.6	Confident	79.6	Confident	51 Å²	51	61.1 Å²	61.1	26%	0.262	36%	0.358	S	S	.	.			trans	-68.3	120.4	172.3	-58.9	150.1	0	0	0	110.1	I419 P420 S429 F435	I419-I422 HydrophobicContact CD1-CD1 4.16Å; P420-I422 PolarHBondContact O-N 3.19Å; I422-S429 VanDerWaalsContact CD1-OG 3.25Å; I422-S429 WeakPolarHBondContact CD1-OG 2.99Å; I422-F435 HydrophobicContact CD1-CD2 4.22Å
423	P	58.8	Low	79.1	Confident	115 Å²	115	63 Å²	63	75%	0.747	36%	0.358	S	S	*	.			trans	-75.1	145.1	168.4	31.5	-32.9	0	0	0	111	S421 N425	S421-P423 WeakPolarHBondContact O-CD 3.36Å; P423-N425 PolarHBondContact O-N 2.66Å
424	Q	48.8	Very low	78.8	Confident	190 Å²	190	63.3 Å²	63.3	89%	0.888	36%	0.359	S	S	*	.	S	Bend	trans	-16.2	86.2	-175.1	-62.4	-172.8	-6.9	0	0	118.7
425	N	51.4	Low	78.4	Confident	126 Å²	126	67.3 Å²	67.3	67%	0.674	37%	0.374	S	S	*	.			trans	-176.5	75.1	138.8	-101	-52.5	0	0	0	111.1	P423 A427 R428	P423-N425 PolarHBondContact O-N 2.66Å; N425-A427 PolarHBondContact O-N 2.79Å; N425-R428 PolarHBondContact O-N 2.98Å
426	S	53.9	Low	78	Confident	75 Å²	75	74.9 Å²	74.9	52%	0.524	41%	0.407	S	S	.	.	G	3₁₀ helix	trans	-59.2	-30.4	-175	50.2	0	0	0	0	114.4	R428 S429	S426-R428 PolarHBondContact O-N 3.2Å; S426-R428 VanDerWaalsContact O-N 3.09Å; S426-S429 PolarHBondContact O-N 2.56Å
427	A	54.2	Low	77.8	Confident	97 Å²	97	76.3 Å²	76.3	80%	0.802	41%	0.414	S	S	*	.	G	3₁₀ helix	trans	-68	-4.4	-177.2	0	0	0	0	0	115.6	N425	N425-A427 PolarHBondContact O-N 2.79Å
428	R	56.7	Low	77.6	Confident	227 Å²	227	77.5 Å²	77.5	86%	0.857	42%	0.422	S	S	*	.	G	3₁₀ helix	trans	-130.2	15.2	176.3	-67.5	-172.9	178.9	177.2	-0.6	113.8	N425 S426	N425-R428 PolarHBondContact O-N 2.98Å; S426-R428 PolarHBondContact O-N 3.2Å; S426-R428 VanDerWaalsContact O-N 3.09Å
429	S	69.3	Low	77.6	Confident	24 Å²	24	79.7 Å²	79.7	17%	0.168	43%	0.427	C	S	.	.			trans	-79.9	127.5	175.8	-176.4	0	0	0	0	111.1	I422 S426 L431 A432	I422-S429 VanDerWaalsContact CD1-OG 3.25Å; I422-S429 WeakPolarHBondContact CD1-OG 2.99Å; S426-S429 PolarHBondContact O-N 2.56Å; S429-L431 PolarHBondContact O-N 2.81Å; S429-L431 PolarHBondContact OG-N 3.07Å; S429-A432 VanDerWaalsContact O-CB 3.26Å; S429-A432 WeakPolarHBondContact O-CB 3.28Å; S429-A432 PolarHBondContact O-N 3.16Å; S429-A432 VanDerWaalsContact O-N 3.08Å
430	N	78.3	Confident	77.5	Confident	103 Å²	103	82 Å²	82	55%	0.551	44%	0.439	S	S	*	.	T	Hydrogen-bonded Turn	trans	-65.1	-6.9	172.4	-64.1	7.4	0	0	0	112.7	R510	N430-R510 VanDerWaalsContact O-CZ 3.24Å; N430-R510 PolarHBondContact O-NH1 3.22Å; N430-R510 PolarHBondContact O-NH2 2.88Å
431	L	86.5	Confident	77.7	Confident	5 Å²	5	83.2 Å²	83.2	3%	0.026	45%	0.446	C	S	.	.	T	Hydrogen-bonded Turn	trans	-100.4	16.7	174.4	-62.9	169.8	0	0	0	112.7	I419 P420 S429 E433 Y434 F435 V535	I419-L431 HydrophobicContact CD1-CB 4.23Å; P420-L431 HydrophobicContact CG-CD1 4.31Å; S429-L431 PolarHBondContact O-N 2.81Å; S429-L431 PolarHBondContact OG-N 3.07Å; L431-E433 PolarHBondContact O-N 3.47Å; L431-Y434 HydrophobicContact CD2-CD2 4.09Å; L431-Y434 PolarHBondContact O-N 2.67Å; L431-F435 PolarHBondContact O-N 3.13Å; L431-F435 VanDerWaalsContact O-N 3.14Å; L431-V535 HydrophobicContact CD2-CG1 4.23Å
432	A	82.6	Confident	78.2	Confident	49 Å²	49	88 Å²	88	41%	0.405	46%	0.457	S	S	.	.	T	Hydrogen-bonded Turn	trans	-61.7	-23.7	-174.9	0	0	0	0	0	114.8	S429	S429-A432 VanDerWaalsContact O-CB 3.26Å; S429-A432 WeakPolarHBondContact O-CB 3.28Å; S429-A432 PolarHBondContact O-N 3.16Å; S429-A432 VanDerWaalsContact O-N 3.08Å
433	E	86.1	Confident	79	Confident	70 Å²	70	91.7 Å²	91.7	33%	0.327	47%	0.471	S	S	.	.	T	Hydrogen-bonded Turn	trans	-72.8	-46.8	178.7	-57.6	-169.1	172.6	0	0	110.4	L431 F435 K504	L431-E433 PolarHBondContact O-N 3.47Å; E433-F435 VanDerWaalsContact C-N 3.32Å; E433-F435 PolarHBondContact O-N 3.26Å; E433-K504 PolarHBondContact OE1-N 2.81Å
434	Y	91.8	Very high	80.5	Confident	6 Å²	6	88.2 Å²	88.2	2%	0.024	45%	0.446	C	S	.	.	G	3₁₀ helix	trans	-68.5	-22	173.3	-57.7	-73.1	0	0	0	114.8	L417 L431 K436 D437 S438 L468 E500 V535	L417-Y434 HydrophobicContact CD1-CD1 4.22Å; L417-Y434 HydrophobicContact CD2-CD1 4.04Å; L431-Y434 HydrophobicContact CD2-CD2 4.09Å; L431-Y434 PolarHBondContact O-N 2.67Å; Y434-K436 PolarHBondContact O-N 3.22Å; Y434-D437 PolarHBondContact O-N 3.43Å; Y434-S438 PolarHBondContact O-N 3.34Å; Y434-L468 HydrophobicContact CD1-CD2 4.2Å; Y434-L468 HydrophobicContact CE1-CD2 4.26Å; Y434-E500 WeakPolarHBondContact CE2-OE1 3.12Å; Y434-E500 PolarHBondContact OH-OE1 3.22Å; Y434-V535 HydrophobicContact CD2-CG1 4.28Å; Y434-V535 HydrophobicContact CE1-CG2 4.5Å; Y434-V535 HydrophobicContact CE2-CG1 4.15Å
435	F	90.3	Very high	82.7	Confident	111 Å²	111	85.9 Å²	85.9	49%	0.487	43%	0.433	S	S	.	.	G	3₁₀ helix	trans	-59.4	-30.4	-173.8	-174.6	-83.8	0	0	0	113.8	I419 I422 L431 E433 D437	I419-F435 HydrophobicContact CD1-CB 4.08Å; I419-F435 HydrophobicContact CD1-CD2 3.99Å; I419-F435 HydrophobicContact CD1-CG 4.46Å; I422-F435 HydrophobicContact CD1-CD2 4.22Å; L431-F435 PolarHBondContact O-N 3.13Å; L431-F435 VanDerWaalsContact O-N 3.14Å; E433-F435 VanDerWaalsContact C-N 3.32Å; E433-F435 PolarHBondContact O-N 3.26Å; F435-D437 VanDerWaalsContact C-N 3.32Å; F435-D437 PolarHBondContact O-N 3.07Å
436	K	89.3	Confident	84.8	Confident	160 Å²	160	82.6 Å²	82.6	70%	0.696	42%	0.416	S	S	*	.	G	3₁₀ helix	trans	-66.4	-33	-176.5	-63.5	173.5	-172.5	164.6	0	113.3	Y434	Y434-K436 PolarHBondContact O-N 3.22Å
437	D	94.5	Very high	86.8	Confident	39 Å²	39	83.5 Å²	83.5	21%	0.209	42%	0.42	C	S	.	.	T	Hydrogen-bonded Turn	trans	-108	-0.1	-172.2	-73.5	-98.5	0	0	0	112.8	L417 Y434 F435 R439 K455 F464	L417-D437 HydrophobicContact CD2-CB 3.95Å; Y434-D437 PolarHBondContact O-N 3.43Å; F435-D437 VanDerWaalsContact C-N 3.32Å; F435-D437 PolarHBondContact O-N 3.07Å; D437-R439 PolarHBondContact O-N 2.97Å; D437-K455 IonicContact OD1-NZ 3.5Å; D437-K455 PolarHBondContact OD1-NZ 3.36Å; D437-F464 HydrophobicContact CB-CE2 3.77Å; D437-F464 HydrophobicContact CB-CZ 4.08Å
438	S	95.1	Very high	88.8	Confident	26 Å²	26	83.8 Å²	83.8	18%	0.182	41%	0.412	C	S	.	.	B	Isolated β-bridge	trans	-64.8	109.9	179.8	163.6	0	0	0	0	113.6	L417 Y434 N440	L417-S438 CarbonylContact O-C 3.55Å; L417-S438 WeakPolarHBondContact O-CA 3.47Å; Y434-S438 PolarHBondContact O-N 3.34Å; S438-N440 PolarHBondContact O-N 2.87Å
439	R	95.9	Very high	90.6	Very high	66 Å²	66	75.8 Å²	75.8	25%	0.249	39%	0.386	C	S	.	.			trans	-93.2	67.5	-173.4	-166.3	177.2	175.8	-106.1	-0.2	114	L417 D437 V441 R450 L453	L417-R439 PolarHBondContact O-N 3.05Å; D437-R439 PolarHBondContact O-N 2.97Å; R439-V441 PolarHBondContact O-N 3.05Å; R439-R450 PolarHBondContact NE-O 2.94Å; R439-R450 PolarHBondContact NH2-O 3.14Å; R439-L453 HydrophobicContact CB-CB 4.05Å; R439-L453 HydrophobicContact CB-CD1 4.47Å; R439-L453 HydrophobicContact CG-CB 3.83Å; R439-L453 HydrophobicContact CG-CD1 4.5Å
440	N	95	Very high	91.9	Very high	57 Å²	57	78.4 Å²	78.4	31%	0.305	39%	0.392	S	S	.	.			trans	-86.6	97.7	176.8	-170.1	-63	0	0	0	112.6	S438 K442 K443 L444	S438-N440 PolarHBondContact O-N 2.87Å; N440-K442 VanDerWaalsContact C-N 3.3Å; N440-K442 PolarHBondContact O-N 3.33Å; N440-K442 WeakPolarHBondContact OD1-CB 2.87Å; N440-K442 PolarHBondContact OD1-N 3Å; N440-K443 PolarHBondContact O-N 3.03Å; N440-K443 PolarHBondContact OD1-N 3.22Å; N440-L444 WeakPolarHBondContact O-CB 3.47Å; N440-L444 PolarHBondContact O-N 2.8Å
441	V	95.4	Very high	92.7	Very high	75 Å²	75	81.1 Å²	81.1	46%	0.455	40%	0.399	S	S	.	.	T	Hydrogen-bonded Turn	trans	-68.4	-19.2	-177.2	-61.1	0	0	0	0	115.3	R439 L444 R450	R439-V441 PolarHBondContact O-N 3.05Å; V441-L444 VanDerWaalsContact O-O 3.09Å; V441-R450 HydrophobicContact CG1-CG 4.46Å; V441-R450 PolarHBondContact O-NH2 3.05Å
442	K	94.3	Very high	93.1	Very high	176 Å²	176	89 Å²	89	77%	0.765	43%	0.429	S	S	*	.	T	Hydrogen-bonded Turn	trans	-68.1	-42.4	173.5	-175.2	171.6	-178.9	172.4	0	110.3	N440 K445	N440-K442 VanDerWaalsContact C-N 3.3Å; N440-K442 PolarHBondContact O-N 3.33Å; N440-K442 WeakPolarHBondContact OD1-CB 2.87Å; N440-K442 PolarHBondContact OD1-N 3Å; K442-K445 WeakPolarHBondContact O-CE 3.48Å; K442-K445 PolarHBondContact O-NZ 2.87Å
443	K	90.3	Very high	93.8	Very high	128 Å²	128	87.4 Å²	87.4	56%	0.557	41%	0.413	S	S	*	.	T	Hydrogen-bonded Turn	trans	-83.1	-54.9	177.4	-67.3	-167	177.1	-167.1	0	113.3	S421 N440 K445	S421-K443 WeakPolarHBondContact OG-CE 3.42Å; S421-K443 PolarHBondContact OG-NZ 2.81Å; N440-K443 PolarHBondContact O-N 3.03Å; N440-K443 PolarHBondContact OD1-N 3.22Å; K443-K445 PolarHBondContact O-N 3.22Å
444	L	91.1	Very high	94.4	Very high	43 Å²	43	86.4 Å²	86.4	23%	0.225	41%	0.41	C	S	.	.			trans	-74.8	116.9	-178.8	179.3	65.8	0	0	0	109.7	N440 V441 L449 R450 L453	N440-L444 WeakPolarHBondContact O-CB 3.47Å; N440-L444 PolarHBondContact O-N 2.8Å; V441-L444 VanDerWaalsContact O-O 3.09Å; L444-L449 HydrophobicContact CD1-CB 4.02Å; L444-L449 HydrophobicContact CD1-CD1 4.04Å; L444-L449 HydrophobicContact CD2-CB 3.89Å; L444-L449 HydrophobicContact CG-CB 4.42Å; L444-R450 HydrophobicContact CD2-CG 3.95Å; L444-R450 HydrophobicContact CG-CG 4.09Å; L444-R450 VanDerWaalsContact O-CZ 3.29Å; L444-R450 PolarHBondContact O-NE 3.03Å; L444-R450 PolarHBondContact O-NH2 3.03Å; L444-R450 VanDerWaalsContact O-NH2 3.08Å; L444-L453 HydrophobicContact CD2-CD1 3.62Å
445	K	94.5	Very high	94.7	Very high	140 Å²	140	87.5 Å²	87.5	61%	0.609	41%	0.414	S	S	*	.			trans	-96	-33.6	-179.7	-56.3	-54.8	-166.7	-172.9	0	114.2	K442 K443 R450	K442-K445 WeakPolarHBondContact O-CE 3.48Å; K442-K445 PolarHBondContact O-NZ 2.87Å; K443-K445 PolarHBondContact O-N 3.22Å; K445-R450 PolarHBondContact O-NE 2.7Å
446	D	95.6	Very high	95	Very high	58 Å²	58	86.7 Å²	86.7	31%	0.31	41%	0.412	S	S	.	.			trans	-61	123.7	-176.5	164.5	45.7	0	0	0	112.3	T448 L449 R450	D446-T448 VanDerWaalsContact C-N 3.28Å; D446-T448 PolarHBondContact O-N 3Å; D446-T448 WeakPolarHBondContact OD1-CB 3.37Å; D446-T448 PolarHBondContact OD1-N 2.94Å; D446-T448 PolarHBondContact OD1-OG1 2.92Å; D446-T448 WeakPolarHBondContact OD2-CB 3.47Å; D446-T448 PolarHBondContact OD2-N 3.33Å; D446-L449 HydrophobicContact CB-CD1 4.39Å; D446-L449 VanDerWaalsContact OD2-CB 3.25Å; D446-L449 WeakPolarHBondContact OD2-CB 3.4Å; D446-L449 WeakPolarHBondContact OD2-CD1 3.37Å; D446-L449 WeakPolarHBondContact OD2-CG 3.43Å; D446-L449 PolarHBondContact OD2-N 2.85Å; D446-R450 WeakPolarHBondContact O-CB 3.38Å; D446-R450 WeakPolarHBondContact O-CD 3.32Å; D446-R450 WeakPolarHBondContact O-CG 3.12Å; D446-R450 PolarHBondContact O-N 2.77Å; D446-R450 VanDerWaalsContact O-N 3.13Å
447	P	95.8	Very high	95.5	Very high	93 Å²	93	81.1 Å²	81.1	60%	0.604	39%	0.391	S	S	*	.	H	α-helix	trans	-62.9	-31.7	177	26.3	-35.1	0	0	0	113.2	R450 F451	P447-R450 PolarHBondContact O-N 3.28Å; P447-F451 WeakPolarHBondContact O-CB 3.21Å; P447-F451 PolarHBondContact O-N 2.78Å
448	T	96.6	Very high	95.6	Very high	104 Å²	104	82.4 Å²	82.4	64%	0.638	39%	0.393	S	S	*	.	H	α-helix	trans	-66.5	-48.8	-174.9	-35.5	0	0	0	0	111.2	D446 F451 R452	D446-T448 VanDerWaalsContact C-N 3.28Å; D446-T448 PolarHBondContact O-N 3Å; D446-T448 WeakPolarHBondContact OD1-CB 3.37Å; D446-T448 PolarHBondContact OD1-N 2.94Å; D446-T448 PolarHBondContact OD1-OG1 2.92Å; D446-T448 WeakPolarHBondContact OD2-CB 3.47Å; D446-T448 PolarHBondContact OD2-N 3.33Å; T448-F451 PolarHBondContact O-N 3.45Å; T448-R452 WeakPolarHBondContact O-CB 3.27Å; T448-R452 PolarHBondContact O-N 2.79Å
449	L	94.4	Very high	95.8	Very high	59 Å²	59	86.6 Å²	86.6	31%	0.309	41%	0.413	S	S	.	.	H	α-helix	trans	-68.2	-36.9	173.6	-71.1	166.5	0	0	0	111.9	L444 D446 F451 R452 L453	L444-L449 HydrophobicContact CD1-CB 4.02Å; L444-L449 HydrophobicContact CD1-CD1 4.04Å; L444-L449 HydrophobicContact CD2-CB 3.89Å; L444-L449 HydrophobicContact CG-CB 4.42Å; D446-L449 HydrophobicContact CB-CD1 4.39Å; D446-L449 VanDerWaalsContact OD2-CB 3.25Å; D446-L449 WeakPolarHBondContact OD2-CB 3.4Å; D446-L449 WeakPolarHBondContact OD2-CD1 3.37Å; D446-L449 WeakPolarHBondContact OD2-CG 3.43Å; D446-L449 PolarHBondContact OD2-N 2.85Å; L449-F451 VanDerWaalsContact C-N 3.26Å; L449-F451 PolarHBondContact O-N 2.88Å; L449-R452 VanDerWaalsContact CD2-CZ 3.42Å; L449-R452 PolarHBondContact O-N 3.41Å; L449-L453 WeakPolarHBondContact O-CB 3.45Å; L449-L453 VanDerWaalsContact O-CG 3.27Å; L449-L453 WeakPolarHBondContact O-CG 3.24Å; L449-L453 PolarHBondContact O-N 2.98Å
450	R	96	Very high	95.9	Very high	79 Å²	79	88 Å²	88	30%	0.298	43%	0.426	S	S	.	.	H	α-helix	trans	-61	-33.7	174.1	-77.1	167.3	166.5	-170.3	-5.8	113.1	R439 V441 L444 K445 D446 P447	R439-R450 PolarHBondContact NE-O 2.94Å; R439-R450 PolarHBondContact NH2-O 3.14Å; V441-R450 HydrophobicContact CG1-CG 4.46Å; V441-R450 PolarHBondContact O-NH2 3.05Å; L444-R450 HydrophobicContact CD2-CG 3.95Å; L444-R450 HydrophobicContact CG-CG 4.09Å; L444-R450 VanDerWaalsContact O-CZ 3.29Å; L444-R450 PolarHBondContact O-NE 3.03Å; L444-R450 PolarHBondContact O-NH2 3.03Å; L444-R450 VanDerWaalsContact O-NH2 3.08Å; K445-R450 PolarHBondContact O-NE 2.7Å; D446-R450 WeakPolarHBondContact O-CB 3.38Å; D446-R450 WeakPolarHBondContact O-CD 3.32Å; D446-R450 WeakPolarHBondContact O-CG 3.12Å; D446-R450 PolarHBondContact O-N 2.77Å; D446-R450 VanDerWaalsContact O-N 3.13Å; P447-R450 PolarHBondContact O-N 3.28Å
451	F	95.6	Very high	96	Very high	160 Å²	160	85.3 Å²	85.3	70%	0.702	41%	0.411	S	S	*	.	H	α-helix	trans	-74.7	-50.7	172.8	-178.2	-103	0	0	0	110.8	P447 T448 L449 L453 L454	P447-F451 WeakPolarHBondContact O-CB 3.21Å; P447-F451 PolarHBondContact O-N 2.78Å; T448-F451 PolarHBondContact O-N 3.45Å; L449-F451 VanDerWaalsContact C-N 3.26Å; L449-F451 PolarHBondContact O-N 2.88Å; F451-L453 PolarHBondContact O-N 3.23Å; F451-L454 WeakPolarHBondContact O-CB 3.31Å; F451-L454 PolarHBondContact O-N 3Å
452	R	95.4	Very high	96.2	Very high	171 Å²	171	81.9 Å²	81.9	65%	0.645	39%	0.391	S	S	*	.	H	α-helix	trans	-59.3	-29.8	-179.5	-163.3	-172	74.4	-173.7	3.5	114.3	T448 L449 L454	T448-R452 WeakPolarHBondContact O-CB 3.27Å; T448-R452 PolarHBondContact O-N 2.79Å; L449-R452 VanDerWaalsContact CD2-CZ 3.42Å; L449-R452 PolarHBondContact O-N 3.41Å; R452-L454 VanDerWaalsContact C-N 3.34Å
453	L	97.1	Very high	96.3	Very high	15 Å²	15	76.1 Å²	76.1	8%	0.079	38%	0.376	C	S	.	.	T	Hydrogen-bonded Turn	trans	-82.1	-9	176.6	-69.2	175.1	0	0	0	113.8	R439 L444 L449 F451	R439-L453 HydrophobicContact CB-CB 4.05Å; R439-L453 HydrophobicContact CB-CD1 4.47Å; R439-L453 HydrophobicContact CG-CB 3.83Å; R439-L453 HydrophobicContact CG-CD1 4.5Å; L444-L453 HydrophobicContact CD2-CD1 3.62Å; L449-L453 WeakPolarHBondContact O-CB 3.45Å; L449-L453 VanDerWaalsContact O-CG 3.27Å; L449-L453 WeakPolarHBondContact O-CG 3.24Å; L449-L453 PolarHBondContact O-N 2.98Å; F451-L453 PolarHBondContact O-N 3.23Å
454	L	98.3	Very high	96.7	Very high	49 Å²	49	70.3 Å²	70.3	26%	0.257	35%	0.35	S	S	.	.	S	Bend	trans	-92.2	117.8	169.8	-173.9	66.1	0	0	0	108.3	C414 F451 R452	C414-L454 HydrophobicContact CB-CD1 4.26Å; F451-L454 WeakPolarHBondContact O-CB 3.31Å; F451-L454 PolarHBondContact O-N 3Å; R452-L454 VanDerWaalsContact C-N 3.34Å
455	K	98.2	Very high	97	Very high	29 Å²	29	68.3 Å²	68.3	13%	0.126	34%	0.34	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-83.5	121.5	176.2	-40.8	-66.4	176.2	151.3	0	107.3	C414 C415 D437 V461 F464	C414-K455 CarbonylContact C-O 3.54Å; C414-K455 WeakPolarHBondContact CA-O 3.35Å; C415-K455 HydrophobicContact CB-CB 4.29Å; C415-K455 PolarHBondContact N-O 3.34Å; C415-K455 PolarHBondContact O-N 3.11Å; D437-K455 IonicContact OD1-NZ 3.5Å; D437-K455 PolarHBondContact OD1-NZ 3.36Å; K455-V461 HydrophobicContact CB-CG2 4.23Å; K455-F464 HydrophobicContact CD-CB 3.8Å; K455-F464 HydrophobicContact CD-CD1 4.13Å; K455-F464 HydrophobicContact CD-CD2 4.21Å; K455-F464 HydrophobicContact CD-CG 3.78Å; K455-F464 HydrophobicContact CG-CB 3.82Å; K455-F464 HydrophobicContact CG-CD1 3.56Å; K455-F464 HydrophobicContact CG-CE1 4.21Å; K455-F464 HydrophobicContact CG-CG 3.71Å
456	H	97.6	Very high	97	Very high	94 Å²	94	64.7 Å²	64.7	44%	0.435	33%	0.327	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-121.3	138.6	-177	174.9	-109.9	0	0	0	110.7	A413 N460	A413-H456 CarbonylContact O-C 3.16Å; A413-H456 WeakPolarHBondContact O-CA 3.38Å; H456-N460 WeakPolarHBondContact O-CB 3.33Å; H456-N460 PolarHBondContact O-ND2 2.6Å
457	T	98.1	Very high	96.9	Very high	43 Å²	43	68.8 Å²	68.8	26%	0.264	35%	0.345	S	S	.	.	S	Bend	trans	76.2	143.6	-166	76.1	0	0	0	0	115.3	D411 A413 L459 N460 V461	D411-T457 WeakPolarHBondContact O-CA 3.14Å; D411-T457 WeakPolarHBondContact O-CB 3.08Å; A413-T457 PolarHBondContact O-N 3.14Å; T457-L459 PolarHBondContact O-N 3.24Å; T457-L459 VanDerWaalsContact O-N 3.11Å; T457-N460 PolarHBondContact O-N 3.19Å; T457-V461 WeakPolarHBondContact O-CG2 3.2Å; T457-V461 PolarHBondContact O-N 2.86Å
458	R	97.9	Very high	96.9	Very high	65 Å²	65	65.1 Å²	65.1	25%	0.245	32%	0.32	C	S	.	.	H	α-helix	trans	-50.8	-37.1	-178.4	67.1	-163.6	-81.2	-154.9	-2.1	113.8	L406 D407 D411 V461 V462	L406-R458 HydrophobicContact CD2-CB 4.41Å; L406-R458 HydrophobicContact CD2-CG 4.22Å; L406-R458 PolarHBondContact O-NE 3.17Å; L406-R458 PolarHBondContact O-NH2 3.06Å; D407-R458 IonicContact OD1-NH2 3.49Å; D407-R458 PolarHBondContact OD1-NH2 3.08Å; D411-R458 PolarHBondContact O-N 2.92Å; D411-R458 WeakPolarHBondContact OD1-CD 3.42Å; D411-R458 IonicContact OD1-CZ 2.72Å; D411-R458 IonicContact OD1-NE 3.96Å; D411-R458 IonicContact OD1-NH1 3.81Å; D411-R458 PolarHBondContact OD1-NH1 2.96Å; R458-V461 PolarHBondContact O-N 2.81Å; R458-V462 WeakPolarHBondContact O-CB 3.35Å; R458-V462 WeakPolarHBondContact O-CG2 3.03Å; R458-V462 PolarHBondContact O-N 2.82Å
459	L	98	Very high	96.8	Very high	115 Å²	115	60.9 Å²	60.9	60%	0.602	29%	0.294	S	S	*	.	H	α-helix	trans	-64	-50.1	178.1	-68.5	173.9	0	0	0	111.6	L406 T457 V461 V462 A463	L406-L459 HydrophobicContact CD2-CD2 3.98Å; T457-L459 PolarHBondContact O-N 3.24Å; T457-L459 VanDerWaalsContact O-N 3.11Å; L459-V461 VanDerWaalsContact C-N 3.32Å; L459-V461 PolarHBondContact O-N 3.11Å; L459-V462 PolarHBondContact O-N 3.43Å; L459-A463 WeakPolarHBondContact O-CB 3.19Å; L459-A463 PolarHBondContact O-N 3.01Å
460	N	98	Very high	96.8	Very high	96 Å²	96	62.5 Å²	62.5	51%	0.513	30%	0.299	S	S	.	.	H	α-helix	trans	-70.8	-30.6	179.6	-65.6	9.8	0	0	0	112	H456 T457 F464	H456-N460 WeakPolarHBondContact O-CB 3.33Å; H456-N460 PolarHBondContact O-ND2 2.6Å; T457-N460 PolarHBondContact O-N 3.19Å; N460-F464 WeakPolarHBondContact O-CB 3.44Å; N460-F464 PolarHBondContact O-N 2.8Å; N460-F464 VanDerWaalsContact O-N 3.09Å
461	V	98.4	Very high	96.8	Very high	0 Å²	0	59 Å²	59	0%	0	29%	0.286	C	S	.	.	H	α-helix	trans	-63.9	-56.6	172.4	173.2	0	0	0	0	110.1	Y409 C415 K455 T457 R458 L459 A463 F464 L465	Y409-V461 HydrophobicContact CD1-CG1 3.9Å; Y409-V461 HydrophobicContact CD2-CG1 4.28Å; Y409-V461 HydrophobicContact CE1-CG1 3.61Å; Y409-V461 HydrophobicContact CE2-CG1 4.04Å; Y409-V461 HydrophobicContact CG-CG1 4.22Å; C415-V461 HydrophobicContact CB-CB 4.14Å; C415-V461 HydrophobicContact CB-CG1 3.59Å; C415-V461 HydrophobicContact CB-CG2 3.62Å; K455-V461 HydrophobicContact CB-CG2 4.23Å; T457-V461 WeakPolarHBondContact O-CG2 3.2Å; T457-V461 PolarHBondContact O-N 2.86Å; R458-V461 PolarHBondContact O-N 2.81Å; L459-V461 VanDerWaalsContact C-N 3.32Å; L459-V461 PolarHBondContact O-N 3.11Å; V461-A463 VanDerWaalsContact C-N 3.35Å; V461-A463 PolarHBondContact O-N 3.21Å; V461-F464 WeakPolarHBondContact O-CB 3.38Å; V461-F464 PolarHBondContact O-N 3.13Å; V461-L465 HydrophobicContact CG1-CD1 4.12Å; V461-L465 HydrophobicContact CG1-CG 4.4Å; V461-L465 WeakPolarHBondContact O-CG 3.36Å; V461-L465 PolarHBondContact O-N 3.37Å
462	V	98.3	Very high	96.8	Very high	3 Å²	3	56.2 Å²	56.2	2%	0.018	28%	0.275	C	S	.	.	H	α-helix	trans	-70.3	-30.5	-176.6	176.8	0	0	0	0	112.3	R402 L405 L406 Y409 R458 L459 L465 N466	R402-V462 VanDerWaalsContact O-CG1 3.26Å; R402-V462 WeakPolarHBondContact O-CG1 3.46Å; L405-V462 HydrophobicContact CB-CG2 4.02Å; L406-V462 HydrophobicContact CD2-CB 3.85Å; L406-V462 HydrophobicContact CD2-CG1 4.32Å; L406-V462 HydrophobicContact CD2-CG2 3.87Å; L406-V462 HydrophobicContact CG-CB 4.17Å; L406-V462 HydrophobicContact CG-CG1 4.1Å; L406-V462 HydrophobicContact CG-CG2 4.13Å; Y409-V462 HydrophobicContact CD2-CG2 4.04Å; Y409-V462 HydrophobicContact CE2-CG2 4.47Å; R458-V462 WeakPolarHBondContact O-CB 3.35Å; R458-V462 WeakPolarHBondContact O-CG2 3.03Å; R458-V462 PolarHBondContact O-N 2.82Å; L459-V462 PolarHBondContact O-N 3.43Å; V462-L465 PolarHBondContact O-N 2.8Å; V462-N466 PolarHBondContact O-N 2.94Å; V462-N466 PolarHBondContact O-ND2 3.49Å
463	A	97.8	Very high	96.9	Very high	55 Å²	55	48.8 Å²	48.8	46%	0.455	25%	0.248	S	C	.	.	H	α-helix	trans	-59.7	-50.5	168.6	0	0	0	0	0	111.2	L459 V461 L465 N466 E467	L459-A463 WeakPolarHBondContact O-CB 3.19Å; L459-A463 PolarHBondContact O-N 3.01Å; V461-A463 VanDerWaalsContact C-N 3.35Å; V461-A463 PolarHBondContact O-N 3.21Å; A463-L465 PolarHBondContact O-N 3.17Å; A463-N466 PolarHBondContact O-N 3.31Å; A463-N466 VanDerWaalsContact O-N 3.13Å; A463-E467 PolarHBondContact O-N 2.92Å
464	F	97.6	Very high	96.8	Very high	6 Å²	6	48.6 Å²	48.6	3%	0.026	25%	0.247	C	C	.	.	H	α-helix	trans	-61.3	-41.2	175.6	166.9	-118.6	0	0	0	113	L417 D437 K455 N460 V461 N466 E467 L468	L417-F464 HydrophobicContact CB-CE1 4.28Å; L417-F464 HydrophobicContact CB-CZ 3.87Å; L417-F464 HydrophobicContact CD2-CZ 4Å; D437-F464 HydrophobicContact CB-CE2 3.77Å; D437-F464 HydrophobicContact CB-CZ 4.08Å; K455-F464 HydrophobicContact CD-CB 3.8Å; K455-F464 HydrophobicContact CD-CD1 4.13Å; K455-F464 HydrophobicContact CD-CD2 4.21Å; K455-F464 HydrophobicContact CD-CG 3.78Å; K455-F464 HydrophobicContact CG-CB 3.82Å; K455-F464 HydrophobicContact CG-CD1 3.56Å; K455-F464 HydrophobicContact CG-CE1 4.21Å; K455-F464 HydrophobicContact CG-CG 3.71Å; N460-F464 WeakPolarHBondContact O-CB 3.44Å; N460-F464 PolarHBondContact O-N 2.8Å; N460-F464 VanDerWaalsContact O-N 3.09Å; V461-F464 WeakPolarHBondContact O-CB 3.38Å; V461-F464 PolarHBondContact O-N 3.13Å; F464-N466 PolarHBondContact O-N 3.49Å; F464-E467 WeakPolarHBondContact O-CA 3.34Å; F464-E467 WeakPolarHBondContact O-CB 3.27Å; F464-E467 PolarHBondContact O-N 2.98Å; F464-L468 HydrophobicContact CE1-CD1 4.31Å; F464-L468 HydrophobicContact CE2-CD2 3.83Å; F464-L468 HydrophobicContact CE2-CG 4.31Å; F464-L468 HydrophobicContact CZ-CD1 4.27Å; F464-L468 HydrophobicContact CZ-CD2 3.91Å; F464-L468 HydrophobicContact CZ-CG 4.31Å; F464-L468 PolarHBondContact O-N 2.73Å
465	L	97.3	Very high	96.6	Very high	0 Å²	0	49.2 Å²	49.2	0%	0	25%	0.249	C	C	.	.	H	α-helix	trans	-62.8	-31.7	176.5	-65.9	-179.5	0	0	0	111.7	Y397 R402 L405 Y409 V461 V462 A463 E467 L468	Y397-L465 HydrophobicContact CE2-CD1 4.22Å; Y397-L465 HydrophobicContact CE2-CD2 4.1Å; Y397-L465 HydrophobicContact CE2-CG 4.5Å; R402-L465 WeakPolarHBondContact CD-O 3.34Å; R402-L465 PolarHBondContact NH1-O 3.18Å; L405-L465 HydrophobicContact CD1-CD1 3.96Å; Y409-L465 HydrophobicContact CE2-CD1 3.93Å; Y409-L465 WeakPolarHBondContact OH-CD1 3.37Å; V461-L465 HydrophobicContact CG1-CD1 4.12Å; V461-L465 HydrophobicContact CG1-CG 4.4Å; V461-L465 WeakPolarHBondContact O-CG 3.36Å; V461-L465 PolarHBondContact O-N 3.37Å; V462-L465 PolarHBondContact O-N 2.8Å; A463-L465 PolarHBondContact O-N 3.17Å; L465-E467 VanDerWaalsContact C-N 3.33Å; L465-L468 HydrophobicContact CD2-CD1 3.91Å; L465-L468 PolarHBondContact O-N 3.35Å
466	N	95.4	Very high	96.2	Very high	64 Å²	64	54.4 Å²	54.4	34%	0.342	28%	0.279	S	S	.	.	H	α-helix	trans	-74.2	-17.4	171.4	-78	-65	0	0	0	114	R402 V462 A463 F464	R402-N466 WeakPolarHBondContact CB-OD1 3.42Å; R402-N466 PolarHBondContact N-OD1 2.84Å; V462-N466 PolarHBondContact O-N 2.94Å; V462-N466 PolarHBondContact O-ND2 3.49Å; A463-N466 PolarHBondContact O-N 3.31Å; A463-N466 VanDerWaalsContact O-N 3.13Å; F464-N466 PolarHBondContact O-N 3.49Å
467	E	94.1	Very high	95.8	Very high	145 Å²	145	51.8 Å²	51.8	68%	0.678	27%	0.271	S	S	*	.	H	α-helix	trans	-79.2	-17.2	171.4	-64.3	177.6	140.9	0	0	113	A463 F464 L465	A463-E467 PolarHBondContact O-N 2.92Å; F464-E467 WeakPolarHBondContact O-CA 3.34Å; F464-E467 WeakPolarHBondContact O-CB 3.27Å; F464-E467 PolarHBondContact O-N 2.98Å; L465-E467 VanDerWaalsContact C-N 3.33Å
468	L	94.4	Very high	95.7	Very high	16 Å²	16	50.6 Å²	50.6	8%	0.084	26%	0.262	C	S	.	.	S	Bend	trans	-78.3	148.2	177.5	-61.4	179.4	0	0	0	111.8	R402 L417 Y434 F464 L465 L533	R402-L468 PolarHBondContact NH1-O 3.18Å; L417-L468 HydrophobicContact CD2-CD2 4.25Å; Y434-L468 HydrophobicContact CD1-CD2 4.2Å; Y434-L468 HydrophobicContact CE1-CD2 4.26Å; F464-L468 HydrophobicContact CE1-CD1 4.31Å; F464-L468 HydrophobicContact CE2-CD2 3.83Å; F464-L468 HydrophobicContact CE2-CG 4.31Å; F464-L468 HydrophobicContact CZ-CD1 4.27Å; F464-L468 HydrophobicContact CZ-CD2 3.91Å; F464-L468 HydrophobicContact CZ-CG 4.31Å; F464-L468 PolarHBondContact O-N 2.73Å; L465-L468 HydrophobicContact CD2-CD1 3.91Å; L465-L468 PolarHBondContact O-N 3.35Å; L468-L533 HydrophobicContact CD1-CD2 4.39Å
469	P	93.9	Very high	95.7	Very high	15 Å²	15	50 Å²	50	10%	0.097	27%	0.266	C	S	.	.	P	Polyproline II helix	trans	-50.4	153.5	177.8	-28.6	35.5	0	0	0	114.1	R402 E500	R402-P469 PolarHBondContact NH1-O 3.11Å; R402-P469 PolarHBondContact NH2-O 3.34Å; P469-E500 HydrophobicContact CB-CG 4.29Å
470	K	95.3	Very high	95.7	Very high	93 Å²	93	44.5 Å²	44.5	40%	0.404	24%	0.237	S	C	.	.	P	Polyproline II helix	trans	-73.2	140.1	175.7	-69	-174.7	175.8	-160.1	0	110.5	G400 E500 V501 D502	G400-K470 WeakPolarHBondContact O-CE 3.32Å; G400-K470 PolarHBondContact O-NZ 3.38Å; K470-E500 WeakPolarHBondContact O-CA 3.26Å; K470-V501 HydrophobicContact CB-CB 4.26Å; K470-V501 PolarHBondContact O-N 3.19Å; K470-D502 WeakPolarHBondContact CD-OD2 3.25Å; K470-D502 VanDerWaalsContact CG-OD2 3.3Å; K470-D502 WeakPolarHBondContact CG-OD2 3.46Å; K470-D502 PolarHBondContact N-OD1 3.16Å
471	T	96.2	Very high	95.7	Very high	5 Å²	5	42.5 Å²	42.5	3%	0.031	23%	0.226	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-127	158.9	-166.8	44.5	0	0	0	0	111.8	Y397 D398 R402 H473 F498 K499	Y397-T471 WeakPolarHBondContact CD1-OG1 3.4Å; Y397-T471 HydrophobicContact CE1-CG2 4.42Å; Y397-T471 WeakPolarHBondContact CE1-OG1 3.44Å; D398-T471 VanDerWaalsContact CB-O 3.3Å; D398-T471 WeakPolarHBondContact CB-O 3.38Å; D398-T471 VanDerWaalsContact CG-O 3.23Å; D398-T471 VanDerWaalsContact OD1-C 3.27Å; D398-T471 VanDerWaalsContact OD1-CB 3.23Å; D398-T471 WeakPolarHBondContact OD1-CB 3.41Å; D398-T471 VanDerWaalsContact OD1-O 3.1Å; D398-T471 PolarHBondContact OD1-OG1 2.85Å; R402-T471 PolarHBondContact NH2-OG1 3.21Å; T471-H473 PolarHBondContact OG1-CE1 2.93Å; T471-F498 HydrophobicContact CG2-CD2 3.52Å; T471-F498 HydrophobicContact CG2-CE2 3.68Å; T471-F498 HydrophobicContact CG2-CG 4.15Å; T471-F498 HydrophobicContact CG2-CZ 4.4Å; T471-K499 CarbonylContact C-O 3.47Å; T471-K499 WeakPolarHBondContact CA-O 3.37Å
472	Q	96.3	Very high	95.7	Very high	101 Å²	101	43.4 Å²	43.4	47%	0.472	23%	0.231	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-135	116.2	163.1	-177.1	-178.1	13	0	0	106.9	D398 F498 K499 V501 F547	D398-Q472 WeakPolarHBondContact OD2-CA 3.43Å; Q472-F498 CarbonylContact O-C 3.54Å; Q472-F498 VanDerWaalsContact O-CA 3.27Å; Q472-F498 WeakPolarHBondContact O-CA 3.46Å; Q472-F498 WeakPolarHBondContact O-CB 3.47Å; Q472-K499 PolarHBondContact N-O 3.01Å; Q472-K499 PolarHBondContact O-N 2.87Å; Q472-V501 HydrophobicContact CB-CG2 4.06Å; Q472-F547 HydrophobicContact CG-CE1 4.2Å; Q472-F547 WeakPolarHBondContact O-CZ 3.46Å
473	H	97.2	Very high	95.6	Very high	16 Å²	16	46.9 Å²	46.9	7%	0.074	26%	0.256	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-92.8	142.5	-178.9	-68.4	72.2	0	0	0	111.3	Y394 Y397 D398 T471 I475 F478 F498 F512	Y394-H473 HydrophobicContact CD1-CB 4.12Å; Y394-H473 AromaticContact CD1-CD2 3.64Å; Y394-H473 AromaticContact CD1-CE1 3.73Å; Y394-H473 AromaticContact CD1-CG 3.48Å; Y394-H473 VanDerWaalsContact CD1-CG 3.48Å; Y394-H473 AromaticContact CD1-ND1 3.52Å; Y394-H473 AromaticContact CD1-NE2 3.83Å; Y394-H473 AromaticContact CE1-CD2 3.32Å; Y394-H473 WeakPolarHBondContact CE1-CD2 3.42Å; Y394-H473 AromaticContact CE1-CE1 3.6Å; Y394-H473 AromaticContact CE1-CG 3.7Å; Y394-H473 AromaticContact CE1-ND1 3.83Å; Y394-H473 AromaticContact CE1-NE2 3.29Å; Y394-H473 VanDerWaalsContact CE1-NE2 3.29Å; Y394-H473 WeakPolarHBondContact CE1-NE2 3.11Å; Y397-H473 AromaticContact CD1-CE1 3.68Å; Y397-H473 AromaticContact CE1-CE1 3.82Å; D398-H473 VanDerWaalsContact CG-ND1 3.25Å; D398-H473 IonicContact OD1-CE1 2.9Å; D398-H473 PolarHBondContact OD1-CE1 3.26Å; D398-H473 IonicContact OD1-ND1 3.39Å; D398-H473 PolarHBondContact OD1-ND1 3.21Å; D398-H473 WeakPolarHBondContact OD2-CB 3.26Å; D398-H473 IonicContact OD2-CG 2.75Å; D398-H473 PolarHBondContact OD2-N 2.85Å; D398-H473 IonicContact OD2-ND1 3.5Å; D398-H473 PolarHBondContact OD2-ND1 3.5Å; T471-H473 PolarHBondContact OG1-CE1 2.93Å; H473-I475 HydrophobicContact CB-CG1 4.39Å; H473-I475 PolarHBondContact O-N 3.06Å; H473-F478 HydrophobicContact CB-CE1 4.09Å; H473-F478 HydrophobicContact CB-CZ 3.85Å; H473-F498 HydrophobicContact CB-CB 4.4Å; H473-F498 VanDerWaalsContact CD2-CB 3.48Å; H473-F498 WeakPolarHBondContact CD2-CB 3.42Å; H473-F498 AromaticContact NE2-CD1 3.47Å; H473-F498 WeakPolarHBondContact NE2-CD1 3.42Å; H473-F498 AromaticContact NE2-CG 3.73Å; H473-F512 AromaticContact CD2-CE1 3.63Å
474	D	95.3	Very high	95.5	Very high	11 Å²	11	46.4 Å²	46.4	6%	0.059	25%	0.251	C	S	.	.			trans	-86.6	85.1	166.9	-175.3	-6.1	0	0	0	109.2	N476 S477 F478 V497 F547	D474-N476 PolarHBondContact O-N 3.34Å; D474-N476 WeakPolarHBondContact OD1-CB 3.25Å; D474-N476 PolarHBondContact OD1-N 3.21Å; D474-S477 WeakPolarHBondContact O-CB 3.47Å; D474-S477 PolarHBondContact O-N 3.19Å; D474-S477 PolarHBondContact O-OG 3Å; D474-S477 PolarHBondContact OD1-N 2.74Å; D474-F478 WeakPolarHBondContact O-CD1 3.42Å; D474-F478 WeakPolarHBondContact O-CE1 3.39Å; D474-V497 HydrophobicContact CB-CG2 3.87Å; D474-V497 PolarHBondContact N-O 3.41Å; D474-V497 VanDerWaalsContact N-O 3.1Å; D474-F547 HydrophobicContact CB-CD1 3.97Å; D474-F547 HydrophobicContact CB-CE1 3.8Å; D474-F547 HydrophobicContact CB-CG 4.48Å; D474-F547 HydrophobicContact CB-CZ 4.17Å; D474-F547 WeakPolarHBondContact OD2-CA 3.26Å; D474-F547 PolarHBondContact OD2-N 2.89Å
475	I	93.2	Very high	95.4	Very high	61 Å²	61	51.9 Å²	51.9	31%	0.313	28%	0.277	S	S	.	.	G	3₁₀ helix	trans	-60.6	-27	-178.5	-57.7	176.8	0	0	0	111.5	H473 S477 F478	H473-I475 HydrophobicContact CB-CG1 4.39Å; H473-I475 PolarHBondContact O-N 3.06Å; I475-S477 VanDerWaalsContact C-N 3.29Å; I475-S477 PolarHBondContact O-N 3.24Å; I475-F478 HydrophobicContact CB-CE2 4.39Å; I475-F478 HydrophobicContact CG1-CE2 4.18Å; I475-F478 HydrophobicContact CG1-CZ 4.09Å; I475-F478 HydrophobicContact CG2-CD2 4.21Å; I475-F478 HydrophobicContact CG2-CE2 4.25Å; I475-F478 WeakPolarHBondContact O-CB 3.37Å; I475-F478 PolarHBondContact O-N 3.2Å
476	N	89.2	Confident	95.3	Very high	138 Å²	138	55 Å²	55	74%	0.738	30%	0.296	S	S	*	.	G	3₁₀ helix	trans	-72.6	-23.5	177.4	-59.5	-41	0	0	0	112.3	D474 F478	D474-N476 PolarHBondContact O-N 3.34Å; D474-N476 WeakPolarHBondContact OD1-CB 3.25Å; D474-N476 PolarHBondContact OD1-N 3.21Å; N476-F478 VanDerWaalsContact C-N 3.32Å
477	S	89.9	Confident	95.1	Very high	40 Å²	40	57.5 Å²	57.5	28%	0.28	32%	0.319	S	S	.	.	G	3₁₀ helix	trans	-79.5	-7.8	176	76.9	0	0	0	0	114.7	D474 I475 V479	D474-S477 WeakPolarHBondContact O-CB 3.47Å; D474-S477 PolarHBondContact O-N 3.19Å; D474-S477 PolarHBondContact O-OG 3Å; D474-S477 PolarHBondContact OD1-N 2.74Å; I475-S477 VanDerWaalsContact C-N 3.29Å; I475-S477 PolarHBondContact O-N 3.24Å; S477-V479 PolarHBondContact O-N 3.45Å
478	F	96.2	Very high	95.2	Very high	18 Å²	18	55 Å²	55	8%	0.079	31%	0.313	C	S	.	.			trans	-68.1	120.2	-167.8	-75.1	6.6	0	0	0	113.1	L390 Y394 H473 D474 I475 N476 V480 V494 N495 F512	L390-F478 HydrophobicContact CD1-CD2 4.5Å; Y394-F478 HydrophobicContact CD1-CZ 4.34Å; Y394-F478 AromaticContact CD2-CE2 3.61Å; Y394-F478 HydrophobicContact CD2-CE2 3.61Å; Y394-F478 HydrophobicContact CD2-CZ 4.01Å; Y394-F478 HydrophobicContact CE1-CZ 4.37Å; Y394-F478 AromaticContact CE2-CE2 3.71Å; Y394-F478 HydrophobicContact CE2-CE2 3.71Å; Y394-F478 HydrophobicContact CE2-CZ 4.04Å; Y394-F478 HydrophobicContact CG-CE2 4.15Å; Y394-F478 HydrophobicContact CG-CZ 4.14Å; H473-F478 HydrophobicContact CB-CE1 4.09Å; H473-F478 HydrophobicContact CB-CZ 3.85Å; D474-F478 WeakPolarHBondContact O-CD1 3.42Å; D474-F478 WeakPolarHBondContact O-CE1 3.39Å; I475-F478 HydrophobicContact CB-CE2 4.39Å; I475-F478 HydrophobicContact CG1-CE2 4.18Å; I475-F478 HydrophobicContact CG1-CZ 4.09Å; I475-F478 HydrophobicContact CG2-CD2 4.21Å; I475-F478 HydrophobicContact CG2-CE2 4.25Å; I475-F478 WeakPolarHBondContact O-CB 3.37Å; I475-F478 PolarHBondContact O-N 3.2Å; N476-F478 VanDerWaalsContact C-N 3.32Å; F478-V480 HydrophobicContact CB-CG2 4.3Å; F478-V494 HydrophobicContact CB-CG1 4.21Å; F478-V494 HydrophobicContact CD1-CG1 4.49Å; F478-V494 HydrophobicContact CD2-CG1 3.68Å; F478-V494 HydrophobicContact CE2-CG1 4.11Å; F478-V494 HydrophobicContact CG-CG1 3.89Å; F478-N495 WeakPolarHBondContact CA-O 3.27Å; F478-F512 HydrophobicContact CD1-CE1 4.44Å; F478-F512 HydrophobicContact CD1-CZ 4.25Å; F478-F512 AromaticContact CE1-CE1 3.75Å; F478-F512 HydrophobicContact CE1-CE1 3.75Å; F478-F512 AromaticContact CE1-CZ 3.66Å; F478-F512 HydrophobicContact CE1-CZ 3.66Å; F478-F512 HydrophobicContact CZ-CE1 4.23Å; F478-F512 AromaticContact CZ-CZ 3.8Å; F478-F512 HydrophobicContact CZ-CZ 3.8Å
479	V	97.4	Very high	95.2	Very high	52 Å²	52	57 Å²	57	32%	0.315	32%	0.324	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-94.1	120.7	166.5	-178.1	0	0	0	0	108.7	S375 S477 N495	S375-V479 WeakPolarHBondContact OG-CA 3.42Å; S477-V479 PolarHBondContact O-N 3.45Å; V479-N495 HydrophobicContact CB-CB 4.32Å; V479-N495 PolarHBondContact N-O 3Å; V479-N495 PolarHBondContact O-N 2.96Å
480	V	98.1	Very high	95.4	Very high	0 Å²	0	56.7 Å²	56.7	0%	0	32%	0.321	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-121.5	125	-171.5	-176.5	0	0	0	0	110.6	S375 Y376 F377 V386 L390 F478 F492 S493 V494	S375-V480 CarbonylContact C-O 3.57Å; S375-V480 WeakPolarHBondContact CA-O 3.43Å; S375-V480 VanDerWaalsContact CB-O 3.23Å; S375-V480 WeakPolarHBondContact CB-O 3.45Å; S375-V480 PolarHBondContact OG-N 3.48Å; Y376-V480 PolarHBondContact N-O 3.12Å; F377-V480 HydrophobicContact CD1-CG1 4.26Å; F377-V480 HydrophobicContact CE1-CB 3.68Å; F377-V480 HydrophobicContact CE1-CG1 3.66Å; F377-V480 HydrophobicContact CE1-CG2 4.3Å; F377-V480 HydrophobicContact CZ-CB 3.77Å; F377-V480 HydrophobicContact CZ-CG1 4.29Å; F377-V480 HydrophobicContact CZ-CG2 4.24Å; V386-V480 HydrophobicContact CG1-CG1 3.86Å; L390-V480 HydrophobicContact CD1-CG1 4.42Å; L390-V480 HydrophobicContact CD1-CG2 3.79Å; F478-V480 HydrophobicContact CB-CG2 4.3Å; V480-F492 HydrophobicContact CG1-CD2 4.44Å; V480-S493 WeakPolarHBondContact CA-O 3.19Å; V480-V494 HydrophobicContact CG1-CG2 4.41Å; V480-V494 HydrophobicContact CG2-CG1 4.34Å; V480-V494 HydrophobicContact CG2-CG2 4.32Å
481	D	98.2	Very high	95.5	Very high	54 Å²	54	53.5 Å²	53.5	29%	0.289	31%	0.31	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-123	113.9	-177.4	-61.6	-51.8	0	0	0	110.7	Y376 S483 F492 S493	Y376-D481 PolarHBondContact N-OD1 3.5Å; D481-S483 PolarHBondContact O-N 2.82Å; D481-F492 CarbonylContact O-C 3.57Å; D481-F492 VanDerWaalsContact O-CA 3.29Å; D481-F492 WeakPolarHBondContact O-CA 3.11Å; D481-S493 PolarHBondContact N-O 2.96Å; D481-S493 PolarHBondContact O-N 2.84Å
482	I	97.6	Very high	95.6	Very high	18 Å²	18	53.2 Å²	53.2	9%	0.092	31%	0.309	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-79.4	105.2	174	-59.5	-171.1	0	0	0	108.8	Y376 F377 L382 V386 L490 F492	Y376-I482 PolarHBondContact O-N 3.22Å; F377-I482 HydrophobicContact CB-CD1 4.33Å; F377-I482 HydrophobicContact CD1-CD1 4.35Å; F377-I482 WeakPolarHBondContact O-CD1 3.38Å; L382-I482 HydrophobicContact CB-CD1 3.71Å; L382-I482 HydrophobicContact CD1-CD1 4.01Å; L382-I482 HydrophobicContact CG-CD1 4.35Å; V386-I482 HydrophobicContact CG2-CD1 4.1Å; I482-L490 HydrophobicContact CD1-CD1 4.43Å; I482-L490 HydrophobicContact CG2-CD1 3.77Å; I482-F492 HydrophobicContact CG1-CB 4.07Å
483	S	97	Very high	95.7	Very high	77 Å²	77	49.4 Å²	49.4	54%	0.538	29%	0.293	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-78.1	-34.5	-175.6	-42.5	0	0	0	0	112.7	D481 C491	D481-S483 PolarHBondContact O-N 2.82Å; S483-C491 PolarHBondContact N-O 2.83Å
484	A	96.3	Very high	95.8	Very high	44 Å²	44	48.7 Å²	48.7	36%	0.364	29%	0.29	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-157.4	147.9	175.7	0	0	0	0	0	112.2	C491	A484-C491 HydrophobicContact CB-CB 4.14Å; A484-C491 PolarHBondContact N-O 2.89Å; A484-C491 VanDerWaalsContact N-O 3.16Å; A484-C491 PolarHBondContact O-N 2.71Å
485	Q	95.5	Very high	95.9	Very high	121 Å²	121	50.5 Å²	50.5	57%	0.565	30%	0.299	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-132.2	136.5	170.3	-176.8	-166.7	12.5	0	0	109.1	L490	Q485-L490 HydrophobicContact CB-CD1 4.02Å; Q485-L490 HydrophobicContact CG-CD1 4.07Å
486	T	94.8	Very high	96.1	Very high	67 Å²	67	48.1 Å²	48.1	41%	0.411	29%	0.29	S	S	.	.			trans	-133	-175.3	165.7	76.3	0	0	0	0	109.7	T488 L489	T486-T488 PolarHBondContact O-N 3.43Å; T486-T488 PolarHBondContact OG1-N 3.35Å; T486-T488 PolarHBondContact OG1-OG1 3.19Å; T486-L489 HydrophobicContact CG2-CG 4.28Å; T486-L489 PolarHBondContact N-O 3.22Å; T486-L489 PolarHBondContact OG1-N 3.3Å
487	S	91.7	Very high	96.5	Very high	116 Å²	116	41.9 Å²	41.9	81%	0.811	26%	0.257	S	S	*	.	S	Bend	trans	-70.5	-14.3	168.2	50.4	0	0	0	0	114
488	T	94.5	Very high	96.8	Very high	91 Å²	91	40.1 Å²	40.1	56%	0.558	24%	0.244	S	C	*	.	S	Bend	trans	-116	-23.4	-174	55.5	0	0	0	0	114.1	T486 V519 P520	T486-T488 PolarHBondContact O-N 3.43Å; T486-T488 PolarHBondContact OG1-N 3.35Å; T486-T488 PolarHBondContact OG1-OG1 3.19Å; T488-V519 WeakPolarHBondContact O-CG1 3.42Å; T488-P520 WeakPolarHBondContact O-CD 3.36Å
489	L	95.3	Very high	96.7	Very high	59 Å²	59	42.2 Å²	42.2	31%	0.309	25%	0.253	S	S	.	.			trans	-144.7	153.5	-179	74.1	88.7	0	0	0	113	T486 C491 V517 A518	T486-L489 HydrophobicContact CG2-CG 4.28Å; T486-L489 PolarHBondContact N-O 3.22Å; T486-L489 PolarHBondContact OG1-N 3.3Å; L489-C491 HydrophobicContact CD1-CB 4.13Å; L489-V517 HydrophobicContact CB-CG1 4.3Å; L489-V517 HydrophobicContact CD1-CG1 4.3Å; L489-A518 CarbonylContact C-O 3.39Å; L489-A518 WeakPolarHBondContact CA-O 3.39Å
490	L	97.5	Very high	96.6	Very high	9 Å²	9	39.8 Å²	39.8	5%	0.047	24%	0.238	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-123.6	126.1	166.5	-174.2	67.9	0	0	0	108.2	L382 V386 I482 Q485 F492 V517 A518 L526	L382-L490 HydrophobicContact CD2-CD1 3.99Å; L382-L490 HydrophobicContact CD2-CD2 4.24Å; V386-L490 HydrophobicContact CG2-CD2 3.78Å; I482-L490 HydrophobicContact CD1-CD1 4.43Å; I482-L490 HydrophobicContact CG2-CD1 3.77Å; Q485-L490 HydrophobicContact CB-CD1 4.02Å; Q485-L490 HydrophobicContact CG-CD1 4.07Å; L490-F492 HydrophobicContact CD2-CD1 4.16Å; L490-F492 HydrophobicContact CD2-CE1 4.3Å; L490-F492 HydrophobicContact CG-CD1 4.04Å; L490-V517 WeakPolarHBondContact O-CA 3.4Å; L490-A518 PolarHBondContact N-O 3.01Å; L490-A518 PolarHBondContact O-N 3.09Å; L490-L526 HydrophobicContact CD2-CD1 4.03Å; L490-L526 HydrophobicContact CD2-CD2 4.13Å
491	C	98.4	Very high	96.3	Very high	25 Å²	25	43 Å²	43	17%	0.169	26%	0.258	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-116.8	123.6	177.5	-176.8	0	0	0	0	109.2	S483 A484 L489 F516 V517	S483-C491 PolarHBondContact N-O 2.83Å; A484-C491 HydrophobicContact CB-CB 4.14Å; A484-C491 PolarHBondContact N-O 2.89Å; A484-C491 VanDerWaalsContact N-O 3.16Å; A484-C491 PolarHBondContact O-N 2.71Å; L489-C491 HydrophobicContact CD1-CB 4.13Å; C491-F516 WeakPolarHBondContact CA-O 3.42Å; C491-V517 HydrophobicContact CB-CG2 4.41Å
492	F	98.4	Very high	95.7	Very high	0 Å²	0	43.4 Å²	43.4	0%	0	26%	0.26	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-147.7	145.1	-178.1	60.9	-79.7	0	0	0	112.2	V386 F389 L390 V480 D481 I482 L490 V494 T515 F516 L526	V386-F492 HydrophobicContact CG1-CD2 3.75Å; V386-F492 HydrophobicContact CG1-CE2 3.71Å; V386-F492 HydrophobicContact CG1-CG 4.36Å; V386-F492 HydrophobicContact CG1-CZ 4.3Å; F389-F492 HydrophobicContact CD1-CE2 4.28Å; F389-F492 AromaticContact CD1-CZ 3.83Å; F389-F492 HydrophobicContact CD1-CZ 3.83Å; F389-F492 HydrophobicContact CE1-CE2 4.19Å; F389-F492 AromaticContact CE1-CZ 3.67Å; F389-F492 HydrophobicContact CE1-CZ 3.67Å; L390-F492 HydrophobicContact CD2-CE2 4.31Å; V480-F492 HydrophobicContact CG1-CD2 4.44Å; D481-F492 CarbonylContact O-C 3.57Å; D481-F492 VanDerWaalsContact O-CA 3.29Å; D481-F492 WeakPolarHBondContact O-CA 3.11Å; I482-F492 HydrophobicContact CG1-CB 4.07Å; L490-F492 HydrophobicContact CD2-CD1 4.16Å; L490-F492 HydrophobicContact CD2-CE1 4.3Å; L490-F492 HydrophobicContact CG-CD1 4.04Å; F492-V494 HydrophobicContact CD2-CG2 4.08Å; F492-V494 HydrophobicContact CE2-CG2 4.28Å; F492-T515 WeakPolarHBondContact O-CA 3.28Å; F492-F516 HydrophobicContact CD1-CB 4.33Å; F492-F516 HydrophobicContact CD2-CD2 4.29Å; F492-F516 HydrophobicContact CE1-CB 3.85Å; F492-F516 HydrophobicContact CE2-CB 4.06Å; F492-F516 AromaticContact CE2-CD2 3.61Å; F492-F516 HydrophobicContact CE2-CD2 3.61Å; F492-F516 HydrophobicContact CE2-CE2 4.46Å; F492-F516 HydrophobicContact CE2-CG 4.22Å; F492-F516 HydrophobicContact CZ-CB 3.7Å; F492-F516 AromaticContact CZ-CD2 3.94Å; F492-F516 HydrophobicContact CZ-CD2 3.94Å; F492-F516 HydrophobicContact CZ-CG 4.11Å; F492-F516 PolarHBondContact N-O 3.16Å; F492-F516 PolarHBondContact O-N 2.7Å; F492-L526 HydrophobicContact CE1-CD1 4.23Å; F492-L526 HydrophobicContact CZ-CD1 4.4Å
493	S	98.6	Very high	94.8	Very high	21 Å²	21	45 Å²	45	15%	0.147	28%	0.28	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-109	142.6	175.8	-62.1	0	0	0	0	110.5	V480 D481 R514 T515	V480-S493 WeakPolarHBondContact CA-O 3.19Å; D481-S493 PolarHBondContact N-O 2.96Å; D481-S493 PolarHBondContact O-N 2.84Å; S493-R514 CarbonylContact C-O 3.59Å; S493-R514 WeakPolarHBondContact CA-O 3.35Å; S493-T515 PolarHBondContact OG-OG1 3.25Å
494	V	98.6	Very high	93.8	Very high	0 Å²	0	51 Å²	51	0%	0	30%	0.297	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-122.4	118.7	178.5	-176.4	0	0	0	0	108	L390 F478 V480 F492 F512 T513 R514 F516	L390-V494 HydrophobicContact CD1-CG2 3.84Å; L390-V494 HydrophobicContact CD2-CG2 3.77Å; L390-V494 HydrophobicContact CG-CG2 4.47Å; F478-V494 HydrophobicContact CB-CG1 4.21Å; F478-V494 HydrophobicContact CD1-CG1 4.49Å; F478-V494 HydrophobicContact CD2-CG1 3.68Å; F478-V494 HydrophobicContact CE2-CG1 4.11Å; F478-V494 HydrophobicContact CG-CG1 3.89Å; V480-V494 HydrophobicContact CG1-CG2 4.41Å; V480-V494 HydrophobicContact CG2-CG1 4.34Å; V480-V494 HydrophobicContact CG2-CG2 4.32Å; F492-V494 HydrophobicContact CD2-CG2 4.08Å; F492-V494 HydrophobicContact CE2-CG2 4.28Å; V494-F512 HydrophobicContact CB-CE2 4.32Å; V494-F512 HydrophobicContact CG1-CE2 4.04Å; V494-F512 HydrophobicContact CG1-CZ 4.01Å; V494-F512 WeakPolarHBondContact O-CE2 3.3Å; V494-T513 CarbonylContact O-C 3.41Å; V494-T513 WeakPolarHBondContact O-CA 3.43Å; V494-R514 PolarHBondContact N-O 3.37Å; V494-R514 PolarHBondContact O-N 3.44Å; V494-F516 HydrophobicContact CG2-CD2 4.48Å; V494-F516 HydrophobicContact CG2-CE2 4.47Å
495	N	98.2	Very high	92.9	Very high	49 Å²	49	49.7 Å²	49.7	26%	0.262	29%	0.285	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-105.6	134.9	173.4	-60.8	-78.7	0	0	0	108.7	F478 V479 F512 T513	F478-N495 WeakPolarHBondContact CA-O 3.27Å; V479-N495 HydrophobicContact CB-CB 4.32Å; V479-N495 PolarHBondContact N-O 3Å; V479-N495 PolarHBondContact O-N 2.96Å; N495-F512 WeakPolarHBondContact CA-O 3.49Å; N495-T513 WeakPolarHBondContact OD1-CB 3.3Å; N495-T513 WeakPolarHBondContact OD1-CG2 3.48Å; N495-T513 PolarHBondContact OD1-OG1 2.91Å
496	G	97	Very high	92.2	Very high	11 Å²	11	51.5 Å²	51.5	11%	0.113	29%	0.287	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-176.6	-168.5	-179.9	0	0	0	0	0	113	A511 F512	G496-A511 CarbonylContact O-C 3.39Å; G496-A511 WeakPolarHBondContact O-CA 3.47Å; G496-F512 VanDerWaalsContact C-CD1 3.45Å; G496-F512 VanDerWaalsContact C-CE1 3.41Å; G496-F512 PolarHBondContact N-O 3.38Å; G496-F512 VanDerWaalsContact N-O 3.11Å; G496-F512 WeakPolarHBondContact O-CD1 3.41Å; G496-F512 PolarHBondContact O-N 2.94Å
497	V	97.3	Very high	91.6	Very high	7 Å²	7	52.5 Å²	52.5	4%	0.042	29%	0.289	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-122.7	151.9	178	-64.2	0	0	0	0	112.6	D474 L509 R510 A511 E542 A546	D474-V497 HydrophobicContact CB-CG2 3.87Å; D474-V497 PolarHBondContact N-O 3.41Å; D474-V497 VanDerWaalsContact N-O 3.1Å; V497-L509 HydrophobicContact CB-CD1 4.24Å; V497-L509 HydrophobicContact CB-CD2 4.39Å; V497-L509 HydrophobicContact CB-CG 4.38Å; V497-L509 HydrophobicContact CG1-CD2 4.37Å; V497-L509 HydrophobicContact CG2-CD1 4.5Å; V497-R510 CarbonylContact C-O 3.38Å; V497-R510 VanDerWaalsContact CA-O 3.23Å; V497-R510 WeakPolarHBondContact CA-O 3.43Å; V497-R510 WeakPolarHBondContact CB-O 3.37Å; V497-A511 HydrophobicContact CG1-CB 4.15Å; V497-E542 HydrophobicContact CG1-CB 4.19Å; V497-A546 HydrophobicContact CB-CB 4.49Å; V497-A546 HydrophobicContact CG2-CB 3.71Å
498	F	96.4	Very high	91.5	Very high	4 Å²	4	48.4 Å²	48.4	2%	0.018	26%	0.261	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-141.7	156	170.4	70.8	-106.9	0	0	0	111.7	T471 Q472 H473 E500 L509 R510 F512 V535	T471-F498 HydrophobicContact CG2-CD2 3.52Å; T471-F498 HydrophobicContact CG2-CE2 3.68Å; T471-F498 HydrophobicContact CG2-CG 4.15Å; T471-F498 HydrophobicContact CG2-CZ 4.4Å; Q472-F498 CarbonylContact O-C 3.54Å; Q472-F498 VanDerWaalsContact O-CA 3.27Å; Q472-F498 WeakPolarHBondContact O-CA 3.46Å; Q472-F498 WeakPolarHBondContact O-CB 3.47Å; H473-F498 HydrophobicContact CB-CB 4.4Å; H473-F498 VanDerWaalsContact CD2-CB 3.48Å; H473-F498 WeakPolarHBondContact CD2-CB 3.42Å; H473-F498 AromaticContact NE2-CD1 3.47Å; H473-F498 WeakPolarHBondContact NE2-CD1 3.42Å; H473-F498 AromaticContact NE2-CG 3.73Å; F498-E500 HydrophobicContact CE2-CG 4.13Å; F498-L509 WeakPolarHBondContact O-CD1 3.4Å; F498-R510 HydrophobicContact CD1-CB 4.25Å; F498-R510 HydrophobicContact CD2-CB 4.01Å; F498-R510 HydrophobicContact CD2-CG 4.08Å; F498-R510 HydrophobicContact CE1-CB 3.91Å; F498-R510 HydrophobicContact CE1-CG 4.49Å; F498-R510 HydrophobicContact CE2-CB 3.64Å; F498-R510 HydrophobicContact CE2-CG 3.43Å; F498-R510 VanDerWaalsContact CE2-CG 3.43Å; F498-R510 HydrophobicContact CG-CB 4.29Å; F498-R510 HydrophobicContact CZ-CB 3.59Å; F498-R510 HydrophobicContact CZ-CG 3.68Å; F498-R510 PolarHBondContact N-O 2.7Å; F498-R510 PolarHBondContact O-N 3.33Å; F498-F512 HydrophobicContact CD1-CB 4.2Å; F498-F512 AromaticContact CD1-CD1 3.76Å; F498-F512 HydrophobicContact CD1-CD1 3.76Å; F498-F512 HydrophobicContact CD1-CG 4.21Å; F498-F512 HydrophobicContact CE1-CB 4Å; F498-F512 HydrophobicContact CE1-CD1 4.41Å; F498-F512 HydrophobicContact CE1-CG 4.45Å; F498-V535 HydrophobicContact CE1-CG1 4.25Å; F498-V535 HydrophobicContact CE1-CG2 4.42Å; F498-V535 HydrophobicContact CZ-CG1 3.89Å; F498-V535 HydrophobicContact CZ-CG2 4.45Å
499	K	94.9	Very high	91.5	Very high	62 Å²	62	45.6 Å²	45.6	27%	0.27	24%	0.242	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-108.6	138.3	176.3	-174.2	-179	177.3	-168.9	0	109.9	T471 Q472 D507 L509 F547	T471-K499 CarbonylContact C-O 3.47Å; T471-K499 WeakPolarHBondContact CA-O 3.37Å; Q472-K499 PolarHBondContact N-O 3.01Å; Q472-K499 PolarHBondContact O-N 2.87Å; K499-D507 WeakPolarHBondContact CE-OD1 3.36Å; K499-D507 IonicContact NZ-OD1 3.43Å; K499-D507 PolarHBondContact NZ-OD1 3.2Å; K499-L509 HydrophobicContact CB-CD1 4.43Å; K499-F547 HydrophobicContact CB-CE2 3.85Å; K499-F547 HydrophobicContact CB-CZ 3.91Å
500	E	94.1	Very high	91.5	Very high	0 Å²	0	42.9 Å²	42.9	0%	0	23%	0.228	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-81.5	133	172	-79.5	159	-148.3	0	0	111.1	Y434 P469 K470 F498 S505 D507 S508 R510	Y434-E500 WeakPolarHBondContact CE2-OE1 3.12Å; Y434-E500 PolarHBondContact OH-OE1 3.22Å; P469-E500 HydrophobicContact CB-CG 4.29Å; K470-E500 WeakPolarHBondContact O-CA 3.26Å; F498-E500 HydrophobicContact CE2-CG 4.13Å; E500-S505 WeakPolarHBondContact OE2-CB 3.46Å; E500-S505 PolarHBondContact OE2-OG 2.9Å; E500-D507 PolarHBondContact O-N 3.36Å; E500-S508 PolarHBondContact N-O 3.33Å; E500-R510 VanDerWaalsContact CD-NH2 3.29Å; E500-R510 VanDerWaalsContact OE1-CG 3.28Å; E500-R510 WeakPolarHBondContact OE1-CG 3.34Å; E500-R510 IonicContact OE1-CZ 3.52Å; E500-R510 VanDerWaalsContact OE1-CZ 3.23Å; E500-R510 IonicContact OE1-NE 2.89Å; E500-R510 PolarHBondContact OE1-NE 2.74Å; E500-R510 IonicContact OE1-NH2 3.51Å; E500-R510 PolarHBondContact OE1-NH2 2.63Å; E500-R510 IonicContact OE2-CZ 3.42Å; E500-R510 IonicContact OE2-NE 3.34Å; E500-R510 IonicContact OE2-NH2 2.81Å; E500-R510 PolarHBondContact OE2-NH2 3.02Å
501	V	91.9	Very high	91.5	Very high	69 Å²	69	42.5 Å²	42.5	42%	0.418	23%	0.226	S	C	.	.			trans	-102.7	-23.9	-172.1	-173.4	0	0	0	0	111.8	K470 Q472 R506	K470-V501 HydrophobicContact CB-CB 4.26Å; K470-V501 PolarHBondContact O-N 3.19Å; Q472-V501 HydrophobicContact CB-CG2 4.06Å; V501-R506 WeakPolarHBondContact O-CD 3.48Å; V501-R506 WeakPolarHBondContact O-CG 3.24Å
502	D	86.4	Confident	91.4	Very high	62 Å²	62	41.3 Å²	41.3	33%	0.332	22%	0.218	S	C	.	.	S	Bend	trans	-131.7	-164.8	176.9	65.6	1.7	0	0	0	112.3	K470 R506	K470-D502 WeakPolarHBondContact CD-OD2 3.25Å; K470-D502 VanDerWaalsContact CG-OD2 3.3Å; K470-D502 WeakPolarHBondContact CG-OD2 3.46Å; K470-D502 PolarHBondContact N-OD1 3.16Å; D502-R506 WeakPolarHBondContact O-CA 3.43Å; D502-R506 WeakPolarHBondContact O-CB 3.39Å; D502-R506 PolarHBondContact O-N 2.72Å
503	G	78.2	Confident	91.5	Very high	50 Å²	50	43 Å²	43	52%	0.515	23%	0.229	S	C	.	.	S	Bend	trans	73.7	-167	-178.5	0	0	0	0	0	114.4
504	K	75.9	Confident	91.5	Very high	205 Å²	205	42.1 Å²	42.1	89%	0.891	22%	0.222	S	C	*	.	S	Bend	trans	-82.9	-19.3	177.7	-72.1	-177.9	179	179	0	113.4	E433	E433-K504 PolarHBondContact OE1-N 2.81Å
505	S	77.3	Confident	91.5	Very high	15 Å²	15	44.1 Å²	44.1	11%	0.105	23%	0.234	C	C	.	.	S	Bend	trans	-105.7	19.3	178.5	43.1	0	0	0	0	112.6	E500 D507 S508 R510	E500-S505 WeakPolarHBondContact OE2-CB 3.46Å; E500-S505 PolarHBondContact OE2-OG 2.9Å; S505-D507 PolarHBondContact O-N 2.9Å; S505-S508 WeakPolarHBondContact O-CA 3.22Å; S505-S508 WeakPolarHBondContact O-CB 3.38Å; S505-S508 PolarHBondContact O-N 3.5Å; S505-S508 PolarHBondContact O-OG 3.47Å; S505-R510 VanDerWaalsContact CB-NH2 3.3Å; S505-R510 PolarHBondContact OG-NH2 3.29Å
506	R	81.9	Confident	91.5	Very high	159 Å²	159	41.8 Å²	41.8	60%	0.6	22%	0.222	S	C	*	.	T	Hydrogen-bonded Turn	trans	-40	140.2	164	173.3	179.2	161.9	155.6	4.7	111.2	V501 D502 S508	V501-R506 WeakPolarHBondContact O-CD 3.48Å; V501-R506 WeakPolarHBondContact O-CG 3.24Å; D502-R506 WeakPolarHBondContact O-CA 3.43Å; D502-R506 WeakPolarHBondContact O-CB 3.39Å; D502-R506 PolarHBondContact O-N 2.72Å; R506-S508 PolarHBondContact O-N 2.87Å
507	D	82	Confident	91.6	Very high	88 Å²	88	42.9 Å²	42.9	47%	0.471	23%	0.226	S	C	.	.	T	Hydrogen-bonded Turn	trans	66.1	2.2	-174.7	-62	-69	0	0	0	115	K499 E500 S505	K499-D507 WeakPolarHBondContact CE-OD1 3.36Å; K499-D507 IonicContact NZ-OD1 3.43Å; K499-D507 PolarHBondContact NZ-OD1 3.2Å; E500-D507 PolarHBondContact O-N 3.36Å; S505-D507 PolarHBondContact O-N 2.9Å
508	S	89.4	Confident	91.6	Very high	30 Å²	30	42.5 Å²	42.5	21%	0.21	22%	0.224	C	C	.	.			trans	-73.1	135.8	169	-57.8	0	0	0	0	111.7	E500 S505 R506	E500-S508 PolarHBondContact N-O 3.33Å; S505-S508 WeakPolarHBondContact O-CA 3.22Å; S505-S508 WeakPolarHBondContact O-CB 3.38Å; S505-S508 PolarHBondContact O-N 3.5Å; S505-S508 PolarHBondContact O-OG 3.47Å; R506-S508 PolarHBondContact O-N 2.87Å
509	L	93.1	Very high	91.6	Very high	33 Å²	33	44.6 Å²	44.6	17%	0.173	24%	0.237	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-90.3	130.4	171	-165.4	79.4	0	0	0	111.4	V497 F498 K499 A538 I543 A546 F547	V497-L509 HydrophobicContact CB-CD1 4.24Å; V497-L509 HydrophobicContact CB-CD2 4.39Å; V497-L509 HydrophobicContact CB-CG 4.38Å; V497-L509 HydrophobicContact CG1-CD2 4.37Å; V497-L509 HydrophobicContact CG2-CD1 4.5Å; F498-L509 WeakPolarHBondContact O-CD1 3.4Å; K499-L509 HydrophobicContact CB-CD1 4.43Å; L509-A538 HydrophobicContact CB-CB 4.44Å; L509-A538 HydrophobicContact CD2-CB 3.67Å; L509-A538 HydrophobicContact CG-CB 4.05Å; L509-I543 HydrophobicContact CD2-CB 4.21Å; L509-I543 HydrophobicContact CD2-CG1 3.72Å; L509-A546 HydrophobicContact CD1-CB 3.91Å; L509-A546 HydrophobicContact CD2-CB 3.42Å; L509-A546 VanDerWaalsContact CD2-CB 3.42Å; L509-A546 HydrophobicContact CG-CB 4.34Å; L509-F547 HydrophobicContact CD1-CD2 4.29Å; L509-F547 HydrophobicContact CD1-CE2 3.63Å
510	R	95.3	Very high	91.4	Very high	2 Å²	2	45.8 Å²	45.8	1%	0.008	25%	0.251	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-111	154.1	171	-50.9	-51.1	174.7	159.1	13.7	110.2	N430 V497 F498 E500 S505 V535 R536 N537	N430-R510 VanDerWaalsContact O-CZ 3.24Å; N430-R510 PolarHBondContact O-NH1 3.22Å; N430-R510 PolarHBondContact O-NH2 2.88Å; V497-R510 CarbonylContact C-O 3.38Å; V497-R510 VanDerWaalsContact CA-O 3.23Å; V497-R510 WeakPolarHBondContact CA-O 3.43Å; V497-R510 WeakPolarHBondContact CB-O 3.37Å; F498-R510 HydrophobicContact CD1-CB 4.25Å; F498-R510 HydrophobicContact CD2-CB 4.01Å; F498-R510 HydrophobicContact CD2-CG 4.08Å; F498-R510 HydrophobicContact CE1-CB 3.91Å; F498-R510 HydrophobicContact CE1-CG 4.49Å; F498-R510 HydrophobicContact CE2-CB 3.64Å; F498-R510 HydrophobicContact CE2-CG 3.43Å; F498-R510 VanDerWaalsContact CE2-CG 3.43Å; F498-R510 HydrophobicContact CG-CB 4.29Å; F498-R510 HydrophobicContact CZ-CB 3.59Å; F498-R510 HydrophobicContact CZ-CG 3.68Å; F498-R510 PolarHBondContact N-O 2.7Å; F498-R510 PolarHBondContact O-N 3.33Å; E500-R510 VanDerWaalsContact CD-NH2 3.29Å; E500-R510 VanDerWaalsContact OE1-CG 3.28Å; E500-R510 WeakPolarHBondContact OE1-CG 3.34Å; E500-R510 IonicContact OE1-CZ 3.52Å; E500-R510 VanDerWaalsContact OE1-CZ 3.23Å; E500-R510 IonicContact OE1-NE 2.89Å; E500-R510 PolarHBondContact OE1-NE 2.74Å; E500-R510 IonicContact OE1-NH2 3.51Å; E500-R510 PolarHBondContact OE1-NH2 2.63Å; E500-R510 IonicContact OE2-CZ 3.42Å; E500-R510 IonicContact OE2-NE 3.34Å; E500-R510 IonicContact OE2-NH2 2.81Å; E500-R510 PolarHBondContact OE2-NH2 3.02Å; S505-R510 VanDerWaalsContact CB-NH2 3.3Å; S505-R510 PolarHBondContact OG-NH2 3.29Å; R510-V535 HydrophobicContact CB-CG1 4.17Å; R510-V535 HydrophobicContact CG-CG1 4.29Å; R510-R536 WeakPolarHBondContact CA-O 3.33Å; R510-R536 WeakPolarHBondContact CB-O 3.5Å; R510-N537 PolarHBondContact NH1-OD1 3.5Å
511	A	97.4	Very high	91.2	Very high	0 Å²	0	47.9 Å²	47.9	0%	0	27%	0.268	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-112.2	144.7	162.6	0	0	0	0	0	108.5	G496 V497 R536 A538 E542	G496-A511 CarbonylContact O-C 3.39Å; G496-A511 WeakPolarHBondContact O-CA 3.47Å; V497-A511 HydrophobicContact CG1-CB 4.15Å; A511-R536 HydrophobicContact CB-CG 4.15Å; A511-R536 VanDerWaalsContact CB-CZ 3.46Å; A511-R536 VanDerWaalsContact CB-NH1 3.31Å; A511-R536 PolarHBondContact N-O 3.42Å; A511-R536 VanDerWaalsContact O-CG 3.27Å; A511-R536 WeakPolarHBondContact O-CG 3.31Å; A511-R536 PolarHBondContact O-N 2.88Å; A511-A538 HydrophobicContact CB-CB 4.12Å; A511-E542 WeakPolarHBondContact CB-OE2 3.49Å
512	F	98.2	Very high	90.7	Very high	1 Å²	1	49.6 Å²	49.6	0%	0.004	28%	0.283	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-134.3	155.7	-175.6	78.2	-84.3	0	0	0	111.7	Y394 H473 F478 V494 N495 G496 F498 R514 L533 F534	Y394-F512 VanDerWaalsContact OH-CE2 3.28Å; Y394-F512 WeakPolarHBondContact OH-CE2 3.42Å; H473-F512 AromaticContact CD2-CE1 3.63Å; F478-F512 HydrophobicContact CD1-CE1 4.44Å; F478-F512 HydrophobicContact CD1-CZ 4.25Å; F478-F512 AromaticContact CE1-CE1 3.75Å; F478-F512 HydrophobicContact CE1-CE1 3.75Å; F478-F512 AromaticContact CE1-CZ 3.66Å; F478-F512 HydrophobicContact CE1-CZ 3.66Å; F478-F512 HydrophobicContact CZ-CE1 4.23Å; F478-F512 AromaticContact CZ-CZ 3.8Å; F478-F512 HydrophobicContact CZ-CZ 3.8Å; V494-F512 HydrophobicContact CB-CE2 4.32Å; V494-F512 HydrophobicContact CG1-CE2 4.04Å; V494-F512 HydrophobicContact CG1-CZ 4.01Å; V494-F512 WeakPolarHBondContact O-CE2 3.3Å; N495-F512 WeakPolarHBondContact CA-O 3.49Å; G496-F512 VanDerWaalsContact C-CD1 3.45Å; G496-F512 VanDerWaalsContact C-CE1 3.41Å; G496-F512 PolarHBondContact N-O 3.38Å; G496-F512 VanDerWaalsContact N-O 3.11Å; G496-F512 WeakPolarHBondContact O-CD1 3.41Å; G496-F512 PolarHBondContact O-N 2.94Å; F498-F512 HydrophobicContact CD1-CB 4.2Å; F498-F512 AromaticContact CD1-CD1 3.76Å; F498-F512 HydrophobicContact CD1-CD1 3.76Å; F498-F512 HydrophobicContact CD1-CG 4.21Å; F498-F512 HydrophobicContact CE1-CB 4Å; F498-F512 HydrophobicContact CE1-CD1 4.41Å; F498-F512 HydrophobicContact CE1-CG 4.45Å; F512-R514 HydrophobicContact CD2-CB 3.8Å; F512-R514 HydrophobicContact CE2-CB 3.85Å; F512-L533 HydrophobicContact CB-CD1 4.14Å; F512-L533 HydrophobicContact CD2-CD1 4.15Å; F512-L533 HydrophobicContact CG-CD1 4.5Å; F512-F534 CarbonylContact C-O 3.57Å; F512-F534 WeakPolarHBondContact CA-O 3.39Å; F512-F534 WeakPolarHBondContact CB-O 3.42Å
513	T	98.6	Very high	90.5	Very high	36 Å²	36	54.4 Å²	54.4	22%	0.221	31%	0.309	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-127.8	113.4	164.5	-58.2	0	0	0	0	106.6	V494 N495 F534	V494-T513 CarbonylContact O-C 3.41Å; V494-T513 WeakPolarHBondContact O-CA 3.43Å; N495-T513 WeakPolarHBondContact OD1-CB 3.3Å; N495-T513 WeakPolarHBondContact OD1-CG2 3.48Å; N495-T513 PolarHBondContact OD1-OG1 2.91Å; T513-F534 PolarHBondContact N-O 2.75Å; T513-F534 WeakPolarHBondContact O-CB 3.27Å; T513-F534 PolarHBondContact O-N 2.8Å
514	R	98.6	Very high	90.5	Very high	1 Å²	1	56.8 Å²	56.8	0%	0.004	32%	0.318	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-113.8	127.7	179	-165.8	170.9	-164.5	154	10	109.7	Y393 Y394 Y409 S493 V494 F512 F516 D531 E532 L533	Y393-R514 VanDerWaalsContact OH-CZ 3.23Å; Y393-R514 PolarHBondContact OH-NH1 3.13Å; Y393-R514 PolarHBondContact OH-NH2 2.82Å; Y394-R514 WeakPolarHBondContact OH-CD 3.34Å; Y409-R514 PolarHBondContact OH-NH2 3.41Å; S493-R514 CarbonylContact C-O 3.59Å; S493-R514 WeakPolarHBondContact CA-O 3.35Å; V494-R514 PolarHBondContact N-O 3.37Å; V494-R514 PolarHBondContact O-N 3.44Å; F512-R514 HydrophobicContact CD2-CB 3.8Å; F512-R514 HydrophobicContact CE2-CB 3.85Å; R514-F516 VanDerWaalsContact CD-CZ 3.42Å; R514-F516 HydrophobicContact CG-CE1 4.38Å; R514-F516 HydrophobicContact CG-CE2 4.01Å; R514-F516 HydrophobicContact CG-CZ 3.95Å; R514-D531 WeakPolarHBondContact CG-OD1 3.33Å; R514-D531 IonicContact CZ-OD1 2.63Å; R514-D531 IonicContact CZ-OD2 2.69Å; R514-D531 IonicContact NE-OD1 3.86Å; R514-D531 PolarHBondContact NE-OD1 3.38Å; R514-D531 IonicContact NE-OD2 3.11Å; R514-D531 IonicContact NH2-OD1 3.84Å; R514-D531 PolarHBondContact NH2-OD1 2.98Å; R514-D531 IonicContact NH2-OD2 2.7Å; R514-D531 PolarHBondContact NH2-OD2 3.12Å; R514-E532 CarbonylContact C-O 3.52Å; R514-E532 WeakPolarHBondContact CA-O 3.43Å; R514-L533 HydrophobicContact CB-CD1 4.06Å; R514-L533 HydrophobicContact CG-CB 4.37Å; R514-L533 HydrophobicContact CG-CD1 4.17Å
515	T	98.8	Very high	91.2	Very high	42 Å²	42	48.4 Å²	48.4	26%	0.258	29%	0.29	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-113.7	121.2	179.6	-57.2	0	0	0	0	109.9	F492 S493 D531 E532	F492-T515 WeakPolarHBondContact O-CA 3.28Å; S493-T515 PolarHBondContact OG-OG1 3.25Å; T515-D531 WeakPolarHBondContact O-CA 3.49Å; T515-E532 PolarHBondContact N-O 3.06Å; T515-E532 PolarHBondContact O-N 2.69Å
516	F	98.7	Very high	92	Very high	0 Å²	0	48.6 Å²	48.6	0%	0	29%	0.289	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-105.3	134.2	176.9	-64.5	-75.5	0	0	0	109.9	F389 L390 Y393 C491 F492 V494 R514 I528 N530 D531	F389-F516 HydrophobicContact CE1-CD2 4.43Å; F389-F516 HydrophobicContact CE1-CE2 4.41Å; L390-F516 HydrophobicContact CD2-CE2 4.1Å; Y393-F516 HydrophobicContact CD1-CZ 4.23Å; Y393-F516 HydrophobicContact CE1-CE1 4.48Å; Y393-F516 AromaticContact CE1-CZ 3.95Å; Y393-F516 HydrophobicContact CE1-CZ 3.95Å; Y393-F516 HydrophobicContact CE2-CE1 4.2Å; Y393-F516 HydrophobicContact CE2-CZ 4.36Å; C491-F516 WeakPolarHBondContact CA-O 3.42Å; F492-F516 HydrophobicContact CD1-CB 4.33Å; F492-F516 HydrophobicContact CD2-CD2 4.29Å; F492-F516 HydrophobicContact CE1-CB 3.85Å; F492-F516 HydrophobicContact CE2-CB 4.06Å; F492-F516 AromaticContact CE2-CD2 3.61Å; F492-F516 HydrophobicContact CE2-CD2 3.61Å; F492-F516 HydrophobicContact CE2-CE2 4.46Å; F492-F516 HydrophobicContact CE2-CG 4.22Å; F492-F516 HydrophobicContact CZ-CB 3.7Å; F492-F516 AromaticContact CZ-CD2 3.94Å; F492-F516 HydrophobicContact CZ-CD2 3.94Å; F492-F516 HydrophobicContact CZ-CG 4.11Å; F492-F516 PolarHBondContact N-O 3.16Å; F492-F516 PolarHBondContact O-N 2.7Å; V494-F516 HydrophobicContact CG2-CD2 4.48Å; V494-F516 HydrophobicContact CG2-CE2 4.47Å; R514-F516 VanDerWaalsContact CD-CZ 3.42Å; R514-F516 HydrophobicContact CG-CE1 4.38Å; R514-F516 HydrophobicContact CG-CE2 4.01Å; R514-F516 HydrophobicContact CG-CZ 3.95Å; F516-I528 HydrophobicContact CD1-CD1 4.04Å; F516-I528 HydrophobicContact CD1-CG1 4.15Å; F516-I528 HydrophobicContact CD1-CG2 4.07Å; F516-I528 HydrophobicContact CE1-CD1 3.92Å; F516-N530 WeakPolarHBondContact CA-O 3.48Å; F516-D531 HydrophobicContact CD1-CB 4.41Å
517	V	98.5	Very high	92.7	Very high	34 Å²	34	42.1 Å²	42.1	21%	0.206	27%	0.268	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-109.4	121.2	156.7	-170.8	0	0	0	0	106.8	L489 L490 C491 V529 N530	L489-V517 HydrophobicContact CB-CG1 4.3Å; L489-V517 HydrophobicContact CD1-CG1 4.3Å; L490-V517 WeakPolarHBondContact O-CA 3.4Å; C491-V517 HydrophobicContact CB-CG2 4.41Å; V517-V529 HydrophobicContact CB-CG2 4.08Å; V517-V529 HydrophobicContact CG1-CG2 3.9Å; V517-V529 VanDerWaalsContact O-CG2 3.28Å; V517-V529 WeakPolarHBondContact O-CG2 3.39Å; V517-V529 PolarHBondContact O-N 3.15Å; V517-N530 HydrophobicContact CB-CB 4.01Å; V517-N530 HydrophobicContact CG2-CB 4.06Å; V517-N530 PolarHBondContact N-O 3.07Å; V517-N530 PolarHBondContact O-N 3.48Å; V517-N530 VanDerWaalsContact O-N 3.14Å
518	A	97.6	Very high	93.5	Very high	0 Å²	0	38 Å²	38	0%	0	25%	0.246	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-124.6	149.4	179.7	0	0	0	0	0	111.3	L489 L490 L526 C527	L489-A518 CarbonylContact C-O 3.39Å; L489-A518 WeakPolarHBondContact CA-O 3.39Å; L490-A518 PolarHBondContact N-O 3.01Å; L490-A518 PolarHBondContact O-N 3.09Å; A518-L526 HydrophobicContact CB-CB 3.98Å; A518-L526 HydrophobicContact CB-CD2 4.28Å; A518-C527 CarbonylContact C-O 3.56Å; A518-C527 WeakPolarHBondContact CA-O 3.38Å; A518-C527 WeakPolarHBondContact CB-O 3.24Å
519	V	96.6	Very high	94	Very high	47 Å²	47	37.9 Å²	37.9	29%	0.285	24%	0.244	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-99.5	150.6	168.6	-59	0	0	0	0	109.6	T488 A521 C527 V529	T488-V519 WeakPolarHBondContact O-CG1 3.42Å; V519-A521 PolarHBondContact O-N 2.96Å; V519-C527 HydrophobicContact CG2-CB 4Å; V519-C527 PolarHBondContact N-O 3.47Å; V519-C527 PolarHBondContact O-N 3.04Å; V519-V529 HydrophobicContact CG1-CG1 3.87Å; V519-V529 HydrophobicContact CG1-CG2 4.33Å; V519-V529 HydrophobicContact CG2-CG1 4.26Å
520	P	91.7	Very high	94.2	Very high	88 Å²	88	40.2 Å²	40.2	57%	0.571	26%	0.257	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-59.8	136.6	173.7	-22.4	33.6	0	0	0	111.7	T488	T488-P520 WeakPolarHBondContact O-CD 3.36Å
521	A	88.8	Confident	94.4	Very high	44 Å²	44	40.3 Å²	40.3	36%	0.364	26%	0.258	S	S	.	.			trans	-117.5	170.2	175	0	0	0	0	0	111.5	V519 G525 C527	V519-A521 PolarHBondContact O-N 2.96Å; A521-G525 PolarHBondContact N-O 3.01Å; A521-G525 PolarHBondContact O-N 3.08Å; A521-C527 HydrophobicContact CB-CB 4.18Å
522	S	82.5	Confident	94.4	Very high	105 Å²	105	43.1 Å²	43.1	73%	0.734	27%	0.271	S	S	*	.	G	3₁₀ helix	trans	-52	153.3	173.6	-57.6	0	0	0	0	112.1	S524 G525	S522-S524 PolarHBondContact O-N 3.04Å; S522-G525 PolarHBondContact O-N 3.09Å
523	N	80.8	Confident	94.5	Very high	162 Å²	162	43.4 Å²	43.4	87%	0.866	27%	0.272	S	S	*	.	G	3₁₀ helix	trans	55.4	35.9	177.6	-54.5	-15.2	0	0	0	113.9	G525	N523-G525 PolarHBondContact O-N 2.94Å
524	S	79.9	Confident	94.5	Very high	101 Å²	101	44.5 Å²	44.5	71%	0.706	27%	0.274	S	S	*	.	G	3₁₀ helix	trans	56.8	29.1	-174.7	53.9	0	0	0	0	114.7	L385 S522	L385-S524 WeakPolarHBondContact CD1-O 3.33Å; S522-S524 PolarHBondContact O-N 3.04Å
525	G	89	Confident	94.4	Very high	29 Å²	29	44.5 Å²	44.5	30%	0.299	27%	0.274	S	S	.	.			trans	-75	169.4	170.8	0	0	0	0	0	113.5	A521 S522 N523	A521-G525 PolarHBondContact N-O 3.01Å; A521-G525 PolarHBondContact O-N 3.08Å; S522-G525 PolarHBondContact O-N 3.09Å; N523-G525 PolarHBondContact O-N 2.94Å
526	L	94.8	Very high	94.2	Very high	18 Å²	18	45.8 Å²	45.8	9%	0.094	27%	0.274	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-121.3	129.3	169.5	-69.8	176.7	0	0	0	109.1	L385 V386 F389 L490 F492 A518	L385-L526 HydrophobicContact CD1-CD1 4.43Å; L385-L526 HydrophobicContact CD1-CG 4.2Å; L385-L526 HydrophobicContact CD2-CD1 4.48Å; L385-L526 HydrophobicContact CD2-CD2 4.22Å; L385-L526 HydrophobicContact CD2-CG 4.4Å; L385-L526 HydrophobicContact CG-CD1 4.15Å; L385-L526 HydrophobicContact CG-CG 4.31Å; V386-L526 HydrophobicContact CG2-CD1 4.48Å; F389-L526 HydrophobicContact CB-CD1 4.17Å; F389-L526 HydrophobicContact CD1-CD1 4.46Å; F389-L526 HydrophobicContact CD2-CB 3.83Å; F389-L526 HydrophobicContact CD2-CD1 4.34Å; F389-L526 HydrophobicContact CE2-CB 4.09Å; F389-L526 HydrophobicContact CG-CB 4.4Å; F389-L526 HydrophobicContact CG-CD1 4.06Å; L490-L526 HydrophobicContact CD2-CD1 4.03Å; L490-L526 HydrophobicContact CD2-CD2 4.13Å; F492-L526 HydrophobicContact CE1-CD1 4.23Å; F492-L526 HydrophobicContact CZ-CD1 4.4Å; A518-L526 HydrophobicContact CB-CB 3.98Å; A518-L526 HydrophobicContact CB-CD2 4.28Å
527	C	97.5	Very high	94	Very high	24 Å²	24	49.4 Å²	49.4	16%	0.162	29%	0.293	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-111.2	117.8	177.5	-172.9	0	0	0	0	109.9	H410 A518 V519 A521 V529	H410-C527 VanDerWaalsContact CA-SG 3.58Å; H410-C527 PolarHBondContact N-SG 2.89Å; H410-C527 VanDerWaalsContact N-SG 3.38Å; A518-C527 CarbonylContact C-O 3.56Å; A518-C527 WeakPolarHBondContact CA-O 3.38Å; A518-C527 WeakPolarHBondContact CB-O 3.24Å; V519-C527 HydrophobicContact CG2-CB 4Å; V519-C527 PolarHBondContact N-O 3.47Å; V519-C527 PolarHBondContact O-N 3.04Å; A521-C527 HydrophobicContact CB-CB 4.18Å; C527-V529 PolarHBondContact O-N 3.33Å
528	I	98.5	Very high	93.7	Very high	0 Å²	0	48.4 Å²	48.4	0%	0	29%	0.289	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-73.1	126.2	-173	-52.9	160.2	0	0	0	110.1	F389 Y393 A408 Y409 H410 A413 F516 N530 D531	F389-I528 HydrophobicContact CE2-CD1 4.48Å; F389-I528 HydrophobicContact CE2-CG1 4.3Å; F389-I528 HydrophobicContact CZ-CD1 3.94Å; F389-I528 HydrophobicContact CZ-CG1 3.88Å; Y393-I528 HydrophobicContact CD2-CD1 4.02Å; Y393-I528 HydrophobicContact CE2-CD1 3.65Å; A408-I528 HydrophobicContact CB-CD1 4.33Å; A408-I528 WeakPolarHBondContact O-CG1 3.27Å; A408-I528 PolarHBondContact O-N 3.32Å; Y409-I528 HydrophobicContact CD1-CB 3.67Å; Y409-I528 HydrophobicContact CD1-CD1 4.01Å; Y409-I528 HydrophobicContact CD1-CG1 4.47Å; Y409-I528 HydrophobicContact CD1-CG2 3.77Å; Y409-I528 HydrophobicContact CD2-CD1 4.15Å; Y409-I528 HydrophobicContact CE1-CB 3.86Å; Y409-I528 HydrophobicContact CE1-CD1 3.7Å; Y409-I528 HydrophobicContact CE1-CG1 4.41Å; Y409-I528 HydrophobicContact CE1-CG2 3.56Å; Y409-I528 HydrophobicContact CE2-CD1 3.83Å; Y409-I528 HydrophobicContact CG-CB 4.31Å; Y409-I528 HydrophobicContact CG-CD1 4.23Å; H410-I528 WeakPolarHBondContact CB-O 3.31Å; H410-I528 PolarHBondContact N-O 3.05Å; A413-I528 WeakPolarHBondContact CB-O 3.29Å; F516-I528 HydrophobicContact CD1-CD1 4.04Å; F516-I528 HydrophobicContact CD1-CG1 4.15Å; F516-I528 HydrophobicContact CD1-CG2 4.07Å; F516-I528 HydrophobicContact CE1-CD1 3.92Å; I528-N530 WeakPolarHBondContact CG2-O 3.26Å; I528-D531 HydrophobicContact CG2-CB 4.11Å
529	V	98.4	Very high	93.5	Very high	29 Å²	29	50.1 Å²	50.1	18%	0.176	30%	0.301	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-104.1	-33.8	171.2	-66.9	0	0	0	0	112.5	H410 A413 C414 V517 V519 C527	H410-V529 HydrophobicContact CB-CG1 3.88Å; A413-V529 CarbonylContact C-O 3.51Å; A413-V529 WeakPolarHBondContact CA-O 3.3Å; C414-V529 PolarHBondContact N-O 3.13Å; V517-V529 HydrophobicContact CB-CG2 4.08Å; V517-V529 HydrophobicContact CG1-CG2 3.9Å; V517-V529 VanDerWaalsContact O-CG2 3.28Å; V517-V529 WeakPolarHBondContact O-CG2 3.39Å; V517-V529 PolarHBondContact O-N 3.15Å; V519-V529 HydrophobicContact CG1-CG1 3.87Å; V519-V529 HydrophobicContact CG1-CG2 4.33Å; V519-V529 HydrophobicContact CG2-CG1 4.26Å; C527-V529 PolarHBondContact O-N 3.33Å
530	N	98.6	Very high	93.2	Very high	81 Å²	81	52.1 Å²	52.1	43%	0.433	32%	0.315	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-134	141.1	173.2	-68.3	72.6	0	0	0	111.3	C414 F516 V517 I528	C414-N530 CarbonylContact O-C 3.54Å; C414-N530 WeakPolarHBondContact O-CA 3.34Å; F516-N530 WeakPolarHBondContact CA-O 3.48Å; V517-N530 HydrophobicContact CB-CB 4.01Å; V517-N530 HydrophobicContact CG2-CB 4.06Å; V517-N530 PolarHBondContact N-O 3.07Å; V517-N530 PolarHBondContact O-N 3.48Å; V517-N530 VanDerWaalsContact O-N 3.14Å; I528-N530 WeakPolarHBondContact CG2-O 3.26Å
531	D	98.7	Very high	93.1	Very high	5 Å²	5	53.1 Å²	53.1	3%	0.027	31%	0.312	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-140.1	118.8	179	171.8	31.5	0	0	0	109.5	Y409 C414 C415 S416 R514 T515 F516 I528	Y409-D531 HydrophobicContact CE1-CB 3.94Å; Y409-D531 PolarHBondContact OH-OD2 3.33Å; C414-D531 PolarHBondContact O-N 2.95Å; C415-D531 CarbonylContact C-O 3.57Å; C415-D531 VanDerWaalsContact CA-O 3.24Å; C415-D531 WeakPolarHBondContact CA-O 3.17Å; C415-D531 HydrophobicContact CB-CB 4.35Å; C415-D531 PolarHBondContact SG-OD2 3.18Å; S416-D531 PolarHBondContact N-O 2.9Å; R514-D531 WeakPolarHBondContact CG-OD1 3.33Å; R514-D531 IonicContact CZ-OD1 2.63Å; R514-D531 IonicContact CZ-OD2 2.69Å; R514-D531 IonicContact NE-OD1 3.86Å; R514-D531 PolarHBondContact NE-OD1 3.38Å; R514-D531 IonicContact NE-OD2 3.11Å; R514-D531 IonicContact NH2-OD1 3.84Å; R514-D531 PolarHBondContact NH2-OD1 2.98Å; R514-D531 IonicContact NH2-OD2 2.7Å; R514-D531 PolarHBondContact NH2-OD2 3.12Å; T515-D531 WeakPolarHBondContact O-CA 3.49Å; F516-D531 HydrophobicContact CD1-CB 4.41Å; I528-D531 HydrophobicContact CG2-CB 4.11Å
532	E	98.6	Very high	93.2	Very high	58 Å²	58	52.9 Å²	52.9	27%	0.271	30%	0.303	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-120.8	120.6	171	174.2	62.7	-156.4	0	0	109.2	S416 S418 R514 T515	S416-E532 VanDerWaalsContact C-OE2 3.26Å; S416-E532 VanDerWaalsContact CB-OE2 3.29Å; S416-E532 WeakPolarHBondContact CB-OE2 3.24Å; S416-E532 WeakPolarHBondContact O-CA 3.23Å; S416-E532 PolarHBondContact OG-OE2 2.87Å; S418-E532 VanDerWaalsContact CB-OE1 3.24Å; S418-E532 WeakPolarHBondContact CB-OE1 3.36Å; S418-E532 PolarHBondContact N-OE1 3.33Å; S418-E532 PolarHBondContact OG-OE1 2.93Å; R514-E532 CarbonylContact C-O 3.52Å; R514-E532 WeakPolarHBondContact CA-O 3.43Å; T515-E532 PolarHBondContact N-O 3.06Å; T515-E532 PolarHBondContact O-N 2.69Å
533	L	98.7	Very high	93.5	Very high	8 Å²	8	52.5 Å²	52.5	4%	0.042	29%	0.292	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-106.4	111.5	178.7	175.1	57.9	0	0	0	110.3	S416 L417 S418 L468 F512 R514 V535	S416-L533 PolarHBondContact O-N 2.69Å; L417-L533 CarbonylContact C-O 3.59Å; L417-L533 WeakPolarHBondContact CA-O 3.33Å; L417-L533 HydrophobicContact CD1-CB 4.36Å; L417-L533 HydrophobicContact CD1-CD2 4.13Å; L417-L533 HydrophobicContact CD1-CG 4.03Å; L417-L533 WeakPolarHBondContact CD1-O 3.43Å; S418-L533 PolarHBondContact N-O 3.42Å; L468-L533 HydrophobicContact CD1-CD2 4.39Å; F512-L533 HydrophobicContact CB-CD1 4.14Å; F512-L533 HydrophobicContact CD2-CD1 4.15Å; F512-L533 HydrophobicContact CG-CD1 4.5Å; R514-L533 HydrophobicContact CB-CD1 4.06Å; R514-L533 HydrophobicContact CG-CB 4.37Å; R514-L533 HydrophobicContact CG-CD1 4.17Å; L533-V535 HydrophobicContact CD1-CG2 4.03Å; L533-V535 HydrophobicContact CD2-CG2 4.14Å; L533-V535 HydrophobicContact CG-CG2 3.78Å
534	F	98.4	Very high	93.8	Very high	59 Å²	59	52.8 Å²	52.8	26%	0.259	29%	0.288	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-94.8	124.1	168.6	176.7	-106.4	0	0	0	110.3	S418 P420 F512 T513 R536	S418-F534 CarbonylContact O-C 3.58Å; S418-F534 VanDerWaalsContact O-CA 3.31Å; S418-F534 WeakPolarHBondContact O-CA 3.35Å; P420-F534 HydrophobicContact CB-CE2 4.45Å; P420-F534 HydrophobicContact CB-CZ 4.17Å; P420-F534 HydrophobicContact CG-CZ 4.35Å; F512-F534 CarbonylContact C-O 3.57Å; F512-F534 WeakPolarHBondContact CA-O 3.39Å; F512-F534 WeakPolarHBondContact CB-O 3.42Å; T513-F534 PolarHBondContact N-O 2.75Å; T513-F534 WeakPolarHBondContact O-CB 3.27Å; T513-F534 PolarHBondContact O-N 2.8Å; F534-R536 HydrophobicContact CE1-CB 4.24Å; F534-R536 HydrophobicContact CE1-CG 4.09Å; F534-R536 HydrophobicContact CZ-CB 4.45Å
535	V	97.3	Very high	94.1	Very high	0 Å²	0	55.6 Å²	55.6	0%	0	28%	0.283	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-118.2	132.6	179.6	-174.6	0	0	0	0	111.1	L417 S418 I419 P420 L431 Y434 F498 R510 L533	L417-V535 HydrophobicContact CD1-CG2 3.83Å; S418-V535 PolarHBondContact O-N 3.24Å; I419-V535 WeakPolarHBondContact CA-O 3.04Å; I419-V535 WeakPolarHBondContact CB-O 3.47Å; I419-V535 HydrophobicContact CG2-CB 4.32Å; I419-V535 WeakPolarHBondContact CG2-O 3.27Å; P420-V535 WeakPolarHBondContact CD-O 3.27Å; L431-V535 HydrophobicContact CD2-CG1 4.23Å; Y434-V535 HydrophobicContact CD2-CG1 4.28Å; Y434-V535 HydrophobicContact CE1-CG2 4.5Å; Y434-V535 HydrophobicContact CE2-CG1 4.15Å; F498-V535 HydrophobicContact CE1-CG1 4.25Å; F498-V535 HydrophobicContact CE1-CG2 4.42Å; F498-V535 HydrophobicContact CZ-CG1 3.89Å; F498-V535 HydrophobicContact CZ-CG2 4.45Å; R510-V535 HydrophobicContact CB-CG1 4.17Å; R510-V535 HydrophobicContact CG-CG1 4.29Å; L533-V535 HydrophobicContact CD1-CG2 4.03Å; L533-V535 HydrophobicContact CD2-CG2 4.14Å; L533-V535 HydrophobicContact CG-CG2 3.78Å
536	R	95.3	Very high	93.9	Very high	70 Å²	70	55.1 Å²	55.1	26%	0.264	28%	0.276	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-136.9	171.2	173.1	57.9	170.8	175.7	89.3	0.6	111.2	P420 R510 A511 F534 E542	P420-R536 HydrophobicContact CG-CB 3.92Å; R510-R536 WeakPolarHBondContact CA-O 3.33Å; R510-R536 WeakPolarHBondContact CB-O 3.5Å; A511-R536 HydrophobicContact CB-CG 4.15Å; A511-R536 VanDerWaalsContact CB-CZ 3.46Å; A511-R536 VanDerWaalsContact CB-NH1 3.31Å; A511-R536 PolarHBondContact N-O 3.42Å; A511-R536 VanDerWaalsContact O-CG 3.27Å; A511-R536 WeakPolarHBondContact O-CG 3.31Å; A511-R536 PolarHBondContact O-N 2.88Å; F534-R536 HydrophobicContact CE1-CB 4.24Å; F534-R536 HydrophobicContact CE1-CG 4.09Å; F534-R536 HydrophobicContact CZ-CB 4.45Å; R536-E542 IonicContact CZ-OE1 2.87Å; R536-E542 IonicContact CZ-OE2 3.51Å; R536-E542 IonicContact NH1-OE1 2.69Å; R536-E542 PolarHBondContact NH1-OE1 3.13Å; R536-E542 IonicContact NH1-OE2 2.67Å; R536-E542 PolarHBondContact NH1-OE2 3.13Å; R536-E542 IonicContact NH2-OE1 2.93Å; R536-E542 PolarHBondContact NH2-OE1 2.86Å; R536-E542 IonicContact NH2-OE2 2.81Å
537	N	93.4	Very high	93.4	Very high	75 Å²	75	57.9 Å²	57.9	40%	0.401	29%	0.288	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-67.2	145.9	163.2	-63.3	-22.3	0	0	0	109.1	R510	R510-N537 PolarHBondContact NH1-OD1 3.5Å
538	A	93.5	Very high	92.2	Very high	14 Å²	14	59.6 Å²	59.6	12%	0.116	30%	0.304	C	S	.	.	P	Polyproline II helix	trans	-68.9	150.8	169.9	0	0	0	0	0	111.2	L509 A511 E542 I543	L509-A538 HydrophobicContact CB-CB 4.44Å; L509-A538 HydrophobicContact CD2-CB 3.67Å; L509-A538 HydrophobicContact CG-CB 4.05Å; A511-A538 HydrophobicContact CB-CB 4.12Å; A538-E542 WeakPolarHBondContact CA-OE2 3.3Å; A538-E542 HydrophobicContact CB-CB 4.05Å; A538-I543 HydrophobicContact CB-CD1 4.42Å; A538-I543 HydrophobicContact CB-CG1 3.82Å
539	S	92.4	Very high	90	Very high	35 Å²	35	67.5 Å²	67.5	25%	0.245	34%	0.343	C	S	.	.	P	Polyproline II helix	trans	-78.4	164.2	170.8	84	0	0	0	0	111.2	E541 E542 I543	S539-E541 WeakPolarHBondContact CB-OE2 3.26Å; S539-E541 PolarHBondContact O-N 3.4Å; S539-E541 PolarHBondContact OG-N 3.06Å; S539-E541 PolarHBondContact OG-OE2 3.33Å; S539-E542 PolarHBondContact N-OE2 3.15Å; S539-E542 PolarHBondContact O-N 3.07Å; S539-E542 VanDerWaalsContact O-N 3.12Å; S539-E542 WeakPolarHBondContact OG-CG 3.04Å; S539-E542 PolarHBondContact OG-N 3.4Å; S539-I543 VanDerWaalsContact O-CG1 3.28Å; S539-I543 WeakPolarHBondContact O-CG1 3.11Å; S539-I543 PolarHBondContact O-N 2.88Å
540	P	91.1	Very high	87.4	Confident	90 Å²	90	71.1 Å²	71.1	58%	0.584	37%	0.367	S	S	*	.	H	α-helix	trans	-54.8	-39.1	175.7	-25.4	35.6	0	0	0	113.2	E542 I543 Q544	P540-E542 VanDerWaalsContact C-N 3.33Å; P540-E542 PolarHBondContact O-N 3.15Å; P540-I543 PolarHBondContact O-N 3.33Å; P540-Q544 WeakPolarHBondContact O-CB 3.41Å; P540-Q544 PolarHBondContact O-N 3Å
541	E	89.2	Confident	84.4	Confident	108 Å²	108	70.8 Å²	70.8	51%	0.505	38%	0.375	S	S	.	.	H	α-helix	trans	-75.4	-22.3	-178.6	-46.1	72.5	-156.8	0	0	112.2	S539 R545	S539-E541 WeakPolarHBondContact CB-OE2 3.26Å; S539-E541 PolarHBondContact O-N 3.4Å; S539-E541 PolarHBondContact OG-N 3.06Å; S539-E541 PolarHBondContact OG-OE2 3.33Å; E541-R545 PolarHBondContact O-NE 3.25Å; E541-R545 PolarHBondContact O-NH2 3.45Å
542	E	91.5	Very high	81.3	Confident	39 Å²	39	76.6 Å²	76.6	18%	0.182	41%	0.413	C	S	.	.	H	α-helix	trans	-79.9	-44.2	168.7	-69.8	170.9	149.9	0	0	110.6	V497 A511 R536 A538 S539 P540 Q544 R545 A546	V497-E542 HydrophobicContact CG1-CB 4.19Å; A511-E542 WeakPolarHBondContact CB-OE2 3.49Å; R536-E542 IonicContact CZ-OE1 2.87Å; R536-E542 IonicContact CZ-OE2 3.51Å; R536-E542 IonicContact NH1-OE1 2.69Å; R536-E542 PolarHBondContact NH1-OE1 3.13Å; R536-E542 IonicContact NH1-OE2 2.67Å; R536-E542 PolarHBondContact NH1-OE2 3.13Å; R536-E542 IonicContact NH2-OE1 2.93Å; R536-E542 PolarHBondContact NH2-OE1 2.86Å; R536-E542 IonicContact NH2-OE2 2.81Å; A538-E542 WeakPolarHBondContact CA-OE2 3.3Å; A538-E542 HydrophobicContact CB-CB 4.05Å; S539-E542 PolarHBondContact N-OE2 3.15Å; S539-E542 PolarHBondContact O-N 3.07Å; S539-E542 VanDerWaalsContact O-N 3.12Å; S539-E542 WeakPolarHBondContact OG-CG 3.04Å; S539-E542 PolarHBondContact OG-N 3.4Å; P540-E542 VanDerWaalsContact C-N 3.33Å; P540-E542 PolarHBondContact O-N 3.15Å; E542-Q544 VanDerWaalsContact C-N 3.28Å; E542-Q544 PolarHBondContact O-N 3.39Å; E542-R545 PolarHBondContact O-N 2.58Å; E542-R545 VanDerWaalsContact O-N 3.1Å; E542-A546 WeakPolarHBondContact O-CB 3.38Å; E542-A546 PolarHBondContact O-N 2.96Å
543	I	88.3	Confident	78	Confident	97 Å²	97	79.8 Å²	79.8	50%	0.497	44%	0.437	S	S	.	.	H	α-helix	trans	-58.1	-40.4	176.2	-66.7	161	0	0	0	111.3	L509 A538 S539 P540 R545	L509-I543 HydrophobicContact CD2-CB 4.21Å; L509-I543 HydrophobicContact CD2-CG1 3.72Å; A538-I543 HydrophobicContact CB-CD1 4.42Å; A538-I543 HydrophobicContact CB-CG1 3.82Å; S539-I543 VanDerWaalsContact O-CG1 3.28Å; S539-I543 WeakPolarHBondContact O-CG1 3.11Å; S539-I543 PolarHBondContact O-N 2.88Å; P540-I543 PolarHBondContact O-N 3.33Å; I543-R545 VanDerWaalsContact C-N 3.27Å; I543-R545 PolarHBondContact O-N 3.01Å
544	Q	87	Confident	74.8	Confident	168 Å²	168	85.2 Å²	85.2	79%	0.785	47%	0.472	S	S	*	.	T	Hydrogen-bonded Turn	trans	-67.9	-23.3	178.7	-170.9	178.4	8.4	0	0	113.8	P540 E542	P540-Q544 WeakPolarHBondContact O-CB 3.41Å; P540-Q544 PolarHBondContact O-N 3Å; E542-Q544 VanDerWaalsContact C-N 3.28Å; E542-Q544 PolarHBondContact O-N 3.39Å
545	R	86.5	Confident	71.5	Confident	161 Å²	161	86.4 Å²	86.4	61%	0.608	49%	0.488	S	S	*	.	T	Hydrogen-bonded Turn	trans	-105.1	-16.3	-178.3	-69.7	179.9	-67.2	134.5	6.6	113.7	E541 E542 I543 A548	E541-R545 PolarHBondContact O-NE 3.25Å; E541-R545 PolarHBondContact O-NH2 3.45Å; E542-R545 PolarHBondContact O-N 2.58Å; E542-R545 VanDerWaalsContact O-N 3.1Å; I543-R545 VanDerWaalsContact C-N 3.27Å; I543-R545 PolarHBondContact O-N 3.01Å; R545-A548 VanDerWaalsContact O-CB 3.24Å; R545-A548 WeakPolarHBondContact O-CB 3.38Å; R545-A548 PolarHBondContact O-N 2.72Å
546	A	84.6	Confident	68.3	Low	18 Å²	18	92.6 Å²	92.6	15%	0.149	53%	0.532	C	S	.	.	T	Hydrogen-bonded Turn	trans	-65.6	131	-178.7	0	0	0	0	0	112.1	V497 L509 E542 A548	V497-A546 HydrophobicContact CB-CB 4.49Å; V497-A546 HydrophobicContact CG2-CB 3.71Å; L509-A546 HydrophobicContact CD1-CB 3.91Å; L509-A546 HydrophobicContact CD2-CB 3.42Å; L509-A546 VanDerWaalsContact CD2-CB 3.42Å; L509-A546 HydrophobicContact CG-CB 4.34Å; E542-A546 WeakPolarHBondContact O-CB 3.38Å; E542-A546 PolarHBondContact O-N 2.96Å; A546-A548 PolarHBondContact O-N 2.79Å; A546-A548 VanDerWaalsContact O-N 3.11Å
547	F	84.2	Confident	65.4	Low	76 Å²	76	93 Å²	93	33%	0.333	55%	0.545	S	S	.	.	T	Hydrogen-bonded Turn	trans	54.4	22.8	-175.1	-50.5	-80.4	0	0	0	113.7	Q472 D474 K499 L509 M549	Q472-F547 HydrophobicContact CG-CE1 4.2Å; Q472-F547 WeakPolarHBondContact O-CZ 3.46Å; D474-F547 HydrophobicContact CB-CD1 3.97Å; D474-F547 HydrophobicContact CB-CE1 3.8Å; D474-F547 HydrophobicContact CB-CG 4.48Å; D474-F547 HydrophobicContact CB-CZ 4.17Å; D474-F547 WeakPolarHBondContact OD2-CA 3.26Å; D474-F547 PolarHBondContact OD2-N 2.89Å; K499-F547 HydrophobicContact CB-CE2 3.85Å; K499-F547 HydrophobicContact CB-CZ 3.91Å; L509-F547 HydrophobicContact CD1-CD2 4.29Å; L509-F547 HydrophobicContact CD1-CE2 3.63Å; F547-M549 PolarHBondContact O-N 2.86Å
548	A	72.4	Confident	62.7	Low	61 Å²	61	95.4 Å²	95.4	50%	0.504	57%	0.565	S	S	.	*			trans	-58.7	113.1	162.5	0	0	0	0	0	107	R545 A546	R545-A548 VanDerWaalsContact O-CB 3.24Å; R545-A548 WeakPolarHBondContact O-CB 3.38Å; R545-A548 PolarHBondContact O-N 2.72Å; A546-A548 PolarHBondContact O-N 2.79Å; A546-A548 VanDerWaalsContact O-N 3.11Å
549	M	52.5	Low	59.9	Low	166 Å²	166	100.5 Å²	100.5	82%	0.818	59%	0.594	S	S	*	*			trans	-50.6	136.2	168.5	-70.5	176.1	62.6	0	0	107.4	F547 A551	F547-M549 PolarHBondContact O-N 2.86Å; M549-A551 PolarHBondContact O-N 3.24Å
550	P	43.2	Very low	57.6	Low	105 Å²	105	104.1 Å²	104.1	68%	0.682	62%	0.617	S	S	*	*			trans	-56.1	112.1	169.9	24.4	-32.1	0	0	0	106.8
551	A	36	Very low	56	Low	73 Å²	73	106.4 Å²	106.4	60%	0.603	63%	0.629	S	S	*	*			trans	-51.9	138.2	171.2	0	0	0	0	0	107	M549 T553	M549-A551 PolarHBondContact O-N 3.24Å; A551-T553 WeakPolarHBondContact O-CA 3.31Å; A551-T553 PolarHBondContact O-N 2.9Å
552	P	33.3	Very low	55.3	Low	127 Å²	127	102.8 Å²	102.8	83%	0.825	61%	0.613	S	S	*	*			trans	-50.5	114.7	-178.4	21.7	-33.2	0	0	0	107.4	P554	P552-P554 VanDerWaalsContact O-N 3.16Å
553	T	29.6	Very low	54.7	Low	125 Å²	125	102.6 Å²	102.6	77%	0.767	62%	0.616	S	S	*	*			trans	-57	126.9	-163.4	12.8	0	0	0	0	107.9	A551 S555	A551-T553 WeakPolarHBondContact O-CA 3.31Å; A551-T553 PolarHBondContact O-N 2.9Å; T553-S555 PolarHBondContact O-N 3.27Å
554	P	31.5	Very low	54.3	Low	122 Å²	122	103.4 Å²	103.4	79%	0.792	63%	0.628	S	S	*	*			trans	-66.8	90.2	175.8	27.1	-32.8	0	0	0	107.2	P552 S556	P552-P554 VanDerWaalsContact O-N 3.16Å; P554-S556 PolarHBondContact O-N 2.93Å
555	S	28.4	Very low	54	Low	85 Å²	85	102.6 Å²	102.6	59%	0.594	62%	0.624	S	S	*	*			trans	-54.9	127	176.9	-176	0	0	0	0	107.3	T553 S557	T553-S555 PolarHBondContact O-N 3.27Å; S555-S557 PolarHBondContact O-N 3.4Å
556	S	30.6	Very low	54	Low	130 Å²	130	97.3 Å²	97.3	91%	0.909	61%	0.606	S	S	*	*	S	Bend	trans	-73.5	19.7	179.1	44.9	0	0	0	0	113.2	P554	P554-S556 PolarHBondContact O-N 2.93Å
557	S	34.6	Very low	54.1	Low	79 Å²	79	100.5 Å²	100.5	55%	0.552	62%	0.618	S	S	*	*	S	Bend	trans	-92.4	126.2	162	-60.4	0	0	0	0	108.9	S555 V559	S555-S557 PolarHBondContact O-N 3.4Å; S557-V559 PolarHBondContact O-N 2.87Å; S557-V559 VanDerWaalsContact O-N 3.08Å
558	P	35.8	Very low	54.2	Low	124 Å²	124	104 Å²	104	81%	0.805	64%	0.635	S	S	*	*	P	Polyproline II helix	trans	-61.5	117.5	177.6	25.7	-33.4	0	0	0	109.9	P560	P558-P560 WeakPolarHBondContact O-CD 3.3Å
559	V	36	Very low	55	Low	121 Å²	121	103.7 Å²	103.7	73%	0.733	62%	0.624	S	S	*	*	P	Polyproline II helix	trans	-59.5	123	171	178.8	0	0	0	0	107.4	S557 T561	S557-V559 PolarHBondContact O-N 2.87Å; S557-V559 VanDerWaalsContact O-N 3.08Å; V559-T561 PolarHBondContact O-N 3.24Å
560	P	43.3	Very low	56.8	Low	111 Å²	111	96 Å²	96	72%	0.721	59%	0.586	S	S	*	*			trans	-59.7	108	176.6	-23.6	34.6	0	0	0	109.1	P558 L562	P558-P560 WeakPolarHBondContact O-CD 3.3Å; P560-L562 PolarHBondContact O-N 3.19Å
561	T	58.4	Low	59	Low	138 Å²	138	96.5 Å²	96.5	85%	0.847	58%	0.58	S	S	*	*	P	Polyproline II helix	trans	-68.6	118.3	173.6	-54.4	0	0	0	0	106.3	V559 S563	V559-T561 PolarHBondContact O-N 3.24Å; T561-S563 PolarHBondContact O-N 3.38Å
562	L	72.8	Confident	61.5	Low	32 Å²	32	95 Å²	95	17%	0.168	57%	0.567	C	S	.	*	P	Polyproline II helix	trans	-57.3	137.3	-176.8	-61.1	-176.3	0	0	0	109.9	P560 Q566 L570 W593	P560-L562 PolarHBondContact O-N 3.19Å; L562-Q566 HydrophobicContact CB-CB 4.03Å; L562-Q566 HydrophobicContact CD2-CB 4.5Å; L562-L570 HydrophobicContact CD1-CD2 4.05Å; L562-W593 HydrophobicContact CD1-CH2 3.78Å; L562-W593 HydrophobicContact CD1-CZ2 4.35Å; L562-W593 HydrophobicContact CD2-CH2 3.73Å; L562-W593 HydrophobicContact CD2-CZ2 3.46Å; L562-W593 VanDerWaalsContact CD2-CZ2 3.46Å; L562-W593 HydrophobicContact CG-CH2 4.38Å
563	S	80.4	Confident	64.3	Low	36 Å²	36	89.1 Å²	89.1	25%	0.252	53%	0.529	S	S	.	.	P	Polyproline II helix	trans	-63.2	157.2	172.8	74.4	0	0	0	0	110	T561 E565 Q566 Q567	T561-S563 PolarHBondContact O-N 3.38Å; S563-E565 PolarHBondContact O-N 3.15Å; S563-Q566 WeakPolarHBondContact O-CB 3.43Å; S563-Q566 PolarHBondContact O-N 3.45Å; S563-Q566 WeakPolarHBondContact OG-CG 3.11Å; S563-Q566 PolarHBondContact OG-N 2.67Å; S563-Q567 PolarHBondContact O-N 3.05Å
564	P	78.6	Confident	67.3	Low	114 Å²	114	83.7 Å²	83.7	74%	0.74	50%	0.496	S	S	*	.	H	α-helix	trans	-53.3	-38	175.3	-27.7	36.1	0	0	0	112.7	Q567 E568	P564-Q567 PolarHBondContact O-N 2.85Å; P564-E568 PolarHBondContact O-N 2.92Å
565	E	81.4	Confident	70.1	Confident	150 Å²	150	83.2 Å²	83.2	70%	0.701	49%	0.491	S	S	*	.	H	α-helix	trans	-62.8	-44.3	175.6	-57.9	166.8	168.3	0	0	112	S563 Q567 M569	S563-E565 PolarHBondContact O-N 3.15Å; E565-Q567 VanDerWaalsContact C-N 3.32Å; E565-M569 WeakPolarHBondContact O-CB 3.16Å; E565-M569 PolarHBondContact O-N 3.25Å
566	Q	85.9	Confident	72.9	Confident	51 Å²	51	85.6 Å²	85.6	24%	0.238	49%	0.493	C	S	.	.	H	α-helix	trans	-65.6	-36	174.8	-73.4	174	-35.1	0	0	111.7	L562 S563 L570 W593	L562-Q566 HydrophobicContact CB-CB 4.03Å; L562-Q566 HydrophobicContact CD2-CB 4.5Å; S563-Q566 WeakPolarHBondContact O-CB 3.43Å; S563-Q566 PolarHBondContact O-N 3.45Å; S563-Q566 WeakPolarHBondContact OG-CG 3.11Å; S563-Q566 PolarHBondContact OG-N 2.67Å; Q566-L570 VanDerWaalsContact O-CB 3.22Å; Q566-L570 WeakPolarHBondContact O-CB 3.5Å; Q566-L570 PolarHBondContact O-N 3.05Å; Q566-W593 HydrophobicContact CB-CD2 4.31Å; Q566-W593 HydrophobicContact CB-CE3 3.83Å; Q566-W593 HydrophobicContact CB-CH2 4.09Å; Q566-W593 HydrophobicContact CB-CZ3 3.7Å; Q566-W593 HydrophobicContact CG-CD2 3.78Å; Q566-W593 HydrophobicContact CG-CE3 3.72Å; Q566-W593 HydrophobicContact CG-CG 4.24Å; Q566-W593 HydrophobicContact CG-CZ3 4.11Å; Q566-W593 WeakPolarHBondContact O-CZ3 3.39Å
567	Q	86.1	Confident	75.6	Confident	85 Å²	85	79.8 Å²	79.8	40%	0.397	45%	0.452	S	S	.	.	H	α-helix	trans	-69	-41.1	178.6	-163.5	67.7	19.6	0	0	112.1	S563 P564 E565 Q571	S563-Q567 PolarHBondContact O-N 3.05Å; P564-Q567 PolarHBondContact O-N 2.85Å; E565-Q567 VanDerWaalsContact C-N 3.32Å; Q567-Q571 PolarHBondContact O-N 2.82Å
568	E	87	Confident	78	Confident	148 Å²	148	77.3 Å²	77.3	69%	0.692	44%	0.439	S	S	*	.	H	α-helix	trans	-66.5	-46.3	173.5	-176.1	171.9	-163.2	0	0	111.1	P564 L570 Q571 A572	P564-E568 PolarHBondContact O-N 2.92Å; E568-L570 VanDerWaalsContact C-N 3.27Å; E568-L570 PolarHBondContact O-N 2.8Å; E568-Q571 PolarHBondContact O-N 3.08Å; E568-Q571 VanDerWaalsContact O-N 3.16Å; E568-A572 PolarHBondContact O-N 3.03Å
569	M	89.1	Confident	80.5	Confident	55 Å²	55	71.7 Å²	71.7	27%	0.271	40%	0.402	S	S	.	.	H	α-helix	trans	-57.5	-39.8	175.9	-170.6	-174.7	-65.9	0	0	112.2	E565 A572 F573 L588 W593 Y595	E565-M569 WeakPolarHBondContact O-CB 3.16Å; E565-M569 PolarHBondContact O-N 3.25Å; M569-A572 PolarHBondContact O-N 2.81Å; M569-F573 WeakPolarHBondContact O-CB 3.47Å; M569-F573 PolarHBondContact O-N 2.83Å; M569-L588 HydrophobicContact CG-CD1 4.42Å; M569-L588 HydrophobicContact CG-CD2 4.15Å; M569-L588 HydrophobicContact SD-CD2 3.91Å; M569-W593 WeakPolarHBondContact CE-O 3.35Å; M569-W593 HydrophobicContact SD-CB 4.34Å; M569-W593 HydrophobicContact SD-CE3 4.15Å; M569-Y595 HydrophobicContact CG-CD2 3.58Å; M569-Y595 HydrophobicContact CG-CE2 4.34Å; M569-Y595 HydrophobicContact CG-CG 4.48Å; M569-Y595 HydrophobicContact SD-CD2 4.39Å
570	L	90.8	Very high	83.1	Confident	4 Å²	4	67.3 Å²	67.3	2%	0.021	38%	0.375	C	S	.	.	H	α-helix	trans	-63.1	-45.5	175.6	173.8	55.9	0	0	0	112.5	L562 Q566 E568 F573 S574 L581 Q585 L588 W593	L562-L570 HydrophobicContact CD1-CD2 4.05Å; Q566-L570 VanDerWaalsContact O-CB 3.22Å; Q566-L570 WeakPolarHBondContact O-CB 3.5Å; Q566-L570 PolarHBondContact O-N 3.05Å; E568-L570 VanDerWaalsContact C-N 3.27Å; E568-L570 PolarHBondContact O-N 2.8Å; L570-F573 PolarHBondContact O-N 2.97Å; L570-S574 WeakPolarHBondContact O-CB 3.23Å; L570-S574 PolarHBondContact O-N 3.49Å; L570-L581 HydrophobicContact CD1-CD2 4.34Å; L570-L581 HydrophobicContact CG-CD2 4.02Å; L570-Q585 HydrophobicContact CD1-CB 3.71Å; L570-Q585 VanDerWaalsContact CD1-N 3.27Å; L570-Q585 HydrophobicContact CD2-CB 4.06Å; L570-Q585 HydrophobicContact CD2-CG 4.46Å; L570-L588 HydrophobicContact CB-CD1 4.23Å; L570-L588 HydrophobicContact CD1-CD1 4.17Å; L570-W593 HydrophobicContact CB-CZ3 4.38Å
571	Q	89.2	Confident	85.2	Confident	116 Å²	116	66.3 Å²	66.3	54%	0.542	36%	0.363	S	S	.	.	H	α-helix	trans	-65.7	-41.2	177.4	-70	-173.3	6.7	0	0	111.9	Q567 E568 T575	Q567-Q571 PolarHBondContact O-N 2.82Å; E568-Q571 PolarHBondContact O-N 3.08Å; E568-Q571 VanDerWaalsContact O-N 3.16Å; Q571-T575 WeakPolarHBondContact O-CB 3.47Å; Q571-T575 PolarHBondContact O-N 3.13Å; Q571-T575 PolarHBondContact O-OG1 2.89Å
572	A	88.8	Confident	86.5	Confident	42 Å²	42	67 Å²	67	35%	0.347	36%	0.356	S	S	.	.	H	α-helix	trans	-60.7	-46.5	173.9	0	0	0	0	0	111.7	E568 M569 T575 Q576 Y595	E568-A572 PolarHBondContact O-N 3.03Å; M569-A572 PolarHBondContact O-N 2.81Å; A572-T575 PolarHBondContact O-N 3.04Å; A572-Q576 PolarHBondContact O-N 3.08Å; A572-Y595 HydrophobicContact CB-CE2 4.03Å
573	F	92.6	Very high	87.2	Confident	3 Å²	3	69.1 Å²	69.1	1%	0.013	36%	0.362	C	S	.	.	H	α-helix	trans	-68.4	-40.1	-177.6	-161.9	-96	0	0	0	112.9	M569 L570 T575 Q576 S577 M579 C587 L588 Y595 A599 F602	M569-F573 WeakPolarHBondContact O-CB 3.47Å; M569-F573 PolarHBondContact O-N 2.83Å; L570-F573 PolarHBondContact O-N 2.97Å; F573-T575 VanDerWaalsContact C-N 3.31Å; F573-T575 PolarHBondContact O-N 3.21Å; F573-Q576 PolarHBondContact O-N 3.1Å; F573-S577 VanDerWaalsContact O-CB 3.23Å; F573-S577 WeakPolarHBondContact O-CB 3.43Å; F573-S577 PolarHBondContact O-N 3.03Å; F573-S577 PolarHBondContact O-OG 3.2Å; F573-M579 HydrophobicContact CD1-CE 4.45Å; F573-M579 HydrophobicContact CE1-CE 3.85Å; F573-C587 HydrophobicContact CE1-CB 3.92Å; F573-L588 HydrophobicContact CB-CD1 3.89Å; F573-L588 HydrophobicContact CB-CD2 4.36Å; F573-L588 HydrophobicContact CB-CG 4.32Å; F573-L588 HydrophobicContact CD1-CG 4.28Å; F573-L588 HydrophobicContact CD2-CD2 4.13Å; F573-L588 HydrophobicContact CG-CD1 4.25Å; F573-L588 HydrophobicContact CG-CD2 4.12Å; F573-L588 HydrophobicContact CG-CG 4.14Å; F573-Y595 HydrophobicContact CB-CD2 4.35Å; F573-Y595 HydrophobicContact CB-CE2 3.78Å; F573-Y595 AromaticContact CD2-CD2 3.92Å; F573-Y595 HydrophobicContact CD2-CD2 3.92Å; F573-Y595 AromaticContact CD2-CE2 3.7Å; F573-Y595 HydrophobicContact CD2-CE2 3.7Å; F573-Y595 HydrophobicContact CD2-CG 4.47Å; F573-Y595 AromaticContact CD2-CZ 3.99Å; F573-Y595 HydrophobicContact CG-CE2 4.25Å; F573-A599 HydrophobicContact CE2-CB 4.09Å; F573-F602 HydrophobicContact CZ-CB 4.02Å
574	S	91.4	Very high	87.6	Confident	12 Å²	12	67.4 Å²	67.4	8%	0.084	35%	0.35	C	S	.	.	H	α-helix	trans	-62.2	-39.6	172.6	174.7	0	0	0	0	111.8	L570 G578 M579 S584	L570-S574 WeakPolarHBondContact O-CB 3.23Å; L570-S574 PolarHBondContact O-N 3.49Å; S574-G578 WeakPolarHBondContact O-CA 3.18Å; S574-G578 PolarHBondContact O-N 2.87Å; S574-M579 PolarHBondContact OG-O 3.02Å; S574-S584 WeakPolarHBondContact CA-OG 3.38Å; S574-S584 WeakPolarHBondContact CB-OG 3.33Å
575	T	90.1	Very high	88.2	Confident	112 Å²	112	65 Å²	65	69%	0.687	33%	0.329	S	S	*	.	H	α-helix	trans	-66.9	-42.7	177	-55.9	0	0	0	0	112	Q571 A572 F573	Q571-T575 WeakPolarHBondContact O-CB 3.47Å; Q571-T575 PolarHBondContact O-N 3.13Å; Q571-T575 PolarHBondContact O-OG1 2.89Å; A572-T575 PolarHBondContact O-N 3.04Å; F573-T575 VanDerWaalsContact C-N 3.31Å; F573-T575 PolarHBondContact O-N 3.21Å
576	Q	87.6	Confident	88.5	Confident	135 Å²	135	62.5 Å²	62.5	63%	0.631	32%	0.316	S	S	*	.	H	α-helix	trans	-77.9	-39.4	-178.2	-168.3	177.7	25.7	0	0	113.7	A572 F573 Y595	A572-Q576 PolarHBondContact O-N 3.08Å; F573-Q576 PolarHBondContact O-N 3.1Å; Q576-Y595 VanDerWaalsContact OE1-CE1 3.29Å; Q576-Y595 PolarHBondContact OE1-OH 2.92Å
577	S	87.6	Confident	88.5	Confident	8 Å²	8	60.9 Å²	60.9	6%	0.056	31%	0.31	C	S	.	.	H	α-helix	trans	-75	-28.8	178.5	64.4	0	0	0	0	112.8	F573 M579 F602	F573-S577 VanDerWaalsContact O-CB 3.23Å; F573-S577 WeakPolarHBondContact O-CB 3.43Å; F573-S577 PolarHBondContact O-N 3.03Å; F573-S577 PolarHBondContact O-OG 3.2Å; S577-M579 PolarHBondContact OG-N 3.45Å; S577-M579 VanDerWaalsContact OG-N 3.16Å; S577-F602 WeakPolarHBondContact O-CZ 3.35Å
578	G	85.7	Confident	88.7	Confident	27 Å²	27	56.9 Å²	56.9	28%	0.278	29%	0.291	S	S	.	.			trans	80.2	-2.5	-169.6	0	0	0	0	0	114	S574 K618	S574-G578 WeakPolarHBondContact O-CA 3.18Å; S574-G578 PolarHBondContact O-N 2.87Å; G578-K618 WeakPolarHBondContact O-CE 3.32Å
579	M	88.3	Confident	88.8	Confident	5 Å²	5	54.1 Å²	54.1	3%	0.025	28%	0.278	C	S	.	.			trans	-72.2	158	175.5	-64.9	-172.7	-60.6	0	0	111.5	F573 S574 S577 W583 C587 F602 I611 A615 F616	F573-M579 HydrophobicContact CD1-CE 4.45Å; F573-M579 HydrophobicContact CE1-CE 3.85Å; S574-M579 PolarHBondContact OG-O 3.02Å; S577-M579 PolarHBondContact OG-N 3.45Å; S577-M579 VanDerWaalsContact OG-N 3.16Å; M579-W583 HydrophobicContact CB-CB 4.39Å; M579-W583 HydrophobicContact SD-CB 4.11Å; M579-C587 HydrophobicContact CE-CB 4.08Å; M579-F602 HydrophobicContact CE-CD2 3.57Å; M579-F602 HydrophobicContact CE-CE2 3.81Å; M579-F602 HydrophobicContact CE-CG 4.46Å; M579-F602 HydrophobicContact CG-CD2 4.49Å; M579-F602 HydrophobicContact CG-CE2 3.78Å; M579-F602 HydrophobicContact SD-CD2 3.78Å; M579-F602 HydrophobicContact SD-CE2 3.59Å; M579-F602 VanDerWaalsContact SD-CE2 3.59Å; M579-I611 HydrophobicContact SD-CG2 4.28Å; M579-A615 CarbonylContact C-O 3.58Å; M579-A615 WeakPolarHBondContact CA-O 3.29Å; M579-A615 WeakPolarHBondContact CB-O 3.33Å; M579-A615 HydrophobicContact CG-CB 4.3Å; M579-A615 HydrophobicContact SD-CB 4.22Å; M579-F616 HydrophobicContact CG-CD1 3.92Å; M579-F616 HydrophobicContact CG-CE1 3.46Å; M579-F616 VanDerWaalsContact CG-CE1 3.46Å; M579-F616 HydrophobicContact CG-CZ 3.95Å
580	N	89.6	Confident	88.7	Confident	29 Å²	29	56.6 Å²	56.6	16%	0.155	29%	0.293	C	S	.	.			trans	-68.3	170.4	167.8	64	40.9	0	0	0	112.2	E582 W583 S584 V614 A615 M617	N580-E582 PolarHBondContact O-N 2.94Å; N580-E582 PolarHBondContact OD1-N 3.18Å; N580-W583 PolarHBondContact OD1-N 3.4Å; N580-W583 VanDerWaalsContact OD1-N 3.17Å; N580-S584 VanDerWaalsContact O-CB 3.26Å; N580-S584 WeakPolarHBondContact O-CB 3.26Å; N580-S584 PolarHBondContact O-N 2.99Å; N580-S584 PolarHBondContact O-OG 2.73Å; N580-V614 PolarHBondContact ND2-O 2.96Å; N580-V614 VanDerWaalsContact ND2-O 3.1Å; N580-A615 PolarHBondContact N-O 3.23Å; N580-M617 WeakPolarHBondContact CB-O 3.47Å; N580-M617 PolarHBondContact ND2-O 3Å
581	L	87.2	Confident	88.7	Confident	90 Å²	90	57.5 Å²	57.5	47%	0.471	30%	0.298	S	S	.	.	H	α-helix	trans	-63.8	-37.8	-173.2	-69.3	168.4	0	0	0	112.6	L570 S584 Q585	L570-L581 HydrophobicContact CD1-CD2 4.34Å; L570-L581 HydrophobicContact CG-CD2 4.02Å; L581-S584 PolarHBondContact O-N 2.88Å; L581-Q585 VanDerWaalsContact O-CB 3.26Å; L581-Q585 WeakPolarHBondContact O-CB 3.38Å; L581-Q585 PolarHBondContact O-N 3.49Å
582	E	86.3	Confident	88.6	Confident	152 Å²	152	58.1 Å²	58.1	71%	0.71	31%	0.305	S	S	*	.	H	α-helix	trans	-63.9	-49.3	-178.7	-60.6	-174.1	161.6	0	0	112	N580 S584 Q585 K586	N580-E582 PolarHBondContact O-N 2.94Å; N580-E582 PolarHBondContact OD1-N 3.18Å; E582-S584 VanDerWaalsContact C-N 3.35Å; E582-Q585 PolarHBondContact O-N 2.96Å; E582-K586 WeakPolarHBondContact O-CB 3.3Å; E582-K586 PolarHBondContact O-N 3.48Å
583	W	87.6	Confident	88.6	Confident	78 Å²	78	58.2 Å²	58.2	30%	0.295	30%	0.296	S	S	.	.	H	α-helix	trans	-72.8	-28.8	179	-75	83.8	0	0	0	112.7	M579 N580 C587 P612 V614 A615	M579-W583 HydrophobicContact CB-CB 4.39Å; M579-W583 HydrophobicContact SD-CB 4.11Å; N580-W583 PolarHBondContact OD1-N 3.4Å; N580-W583 VanDerWaalsContact OD1-N 3.17Å; W583-C587 WeakPolarHBondContact O-CB 3.42Å; W583-C587 PolarHBondContact O-N 2.98Å; W583-P612 HydrophobicContact CH2-CG 3.88Å; W583-P612 HydrophobicContact CZ2-CG 4.43Å; W583-P612 HydrophobicContact CZ3-CG 4.37Å; W583-V614 HydrophobicContact CZ2-CG2 4.14Å; W583-A615 HydrophobicContact CB-CB 3.79Å; W583-A615 HydrophobicContact CD2-CB 3.69Å; W583-A615 HydrophobicContact CE3-CB 4.17Å; W583-A615 HydrophobicContact CG-CB 3.5Å; W583-A615 VanDerWaalsContact CG-CB 3.5Å
584	S	89.4	Confident	88.4	Confident	0 Å²	0	61.6 Å²	61.6	0%	0	31%	0.314	C	S	.	.	H	α-helix	trans	-67.2	-45.2	171.3	-58.5	0	0	0	0	111.9	S574 N580 L581 E582 C587 L588	S574-S584 WeakPolarHBondContact CA-OG 3.38Å; S574-S584 WeakPolarHBondContact CB-OG 3.33Å; N580-S584 VanDerWaalsContact O-CB 3.26Å; N580-S584 WeakPolarHBondContact O-CB 3.26Å; N580-S584 PolarHBondContact O-N 2.99Å; N580-S584 PolarHBondContact O-OG 2.73Å; L581-S584 PolarHBondContact O-N 2.88Å; E582-S584 VanDerWaalsContact C-N 3.35Å; S584-C587 PolarHBondContact O-N 2.69Å; S584-L588 WeakPolarHBondContact O-CG 3.39Å; S584-L588 PolarHBondContact O-N 2.89Å
585	Q	89.8	Confident	88.3	Confident	62 Å²	62	64 Å²	64	29%	0.29	32%	0.322	S	S	.	.	H	α-helix	trans	-62.8	-44.5	176.5	178.6	173.7	-16	0	0	110.7	L570 L581 E582 C587 L588 Q589 W593	L570-Q585 HydrophobicContact CD1-CB 3.71Å; L570-Q585 VanDerWaalsContact CD1-N 3.27Å; L570-Q585 HydrophobicContact CD2-CB 4.06Å; L570-Q585 HydrophobicContact CD2-CG 4.46Å; L581-Q585 VanDerWaalsContact O-CB 3.26Å; L581-Q585 WeakPolarHBondContact O-CB 3.38Å; L581-Q585 PolarHBondContact O-N 3.49Å; E582-Q585 PolarHBondContact O-N 2.96Å; Q585-C587 PolarHBondContact O-N 3.33Å; Q585-L588 PolarHBondContact O-N 3.08Å; Q585-Q589 HydrophobicContact CG-CG 4.3Å; Q585-Q589 VanDerWaalsContact NE2-NE2 3.18Å; Q585-Q589 WeakPolarHBondContact O-CB 3.46Å; Q585-Q589 VanDerWaalsContact O-CG 3.28Å; Q585-Q589 WeakPolarHBondContact O-CG 3.29Å; Q585-Q589 PolarHBondContact O-N 2.64Å; Q585-W593 HydrophobicContact CG-CH2 4.14Å; Q585-W593 HydrophobicContact CG-CZ2 4.37Å
586	K	88	Confident	88.3	Confident	98 Å²	98	63 Å²	63	43%	0.426	32%	0.316	S	S	.	.	H	α-helix	trans	-59.5	-47	175.1	-174.9	176.5	178.6	-178.1	0	111.8	E582 L588 Q589 D590	E582-K586 WeakPolarHBondContact O-CB 3.3Å; E582-K586 PolarHBondContact O-N 3.48Å; K586-L588 VanDerWaalsContact C-N 3.31Å; K586-L588 PolarHBondContact O-N 2.9Å; K586-Q589 PolarHBondContact O-N 3.24Å; K586-D590 WeakPolarHBondContact CE-OD2 3.4Å; K586-D590 WeakPolarHBondContact CG-OD2 3.33Å; K586-D590 WeakPolarHBondContact O-CB 3.23Å; K586-D590 VanDerWaalsContact O-CG 3.28Å; K586-D590 PolarHBondContact O-N 3.5Å
587	C	87.4	Confident	88.4	Confident	18 Å²	18	63 Å²	63	12%	0.122	31%	0.31	C	S	.	.	H	α-helix	trans	-61	-38.3	179.5	-169.6	0	0	0	0	112.7	F573 M579 W583 S584 Q585 N591	F573-C587 HydrophobicContact CE1-CB 3.92Å; M579-C587 HydrophobicContact CE-CB 4.08Å; W583-C587 WeakPolarHBondContact O-CB 3.42Å; W583-C587 PolarHBondContact O-N 2.98Å; S584-C587 PolarHBondContact O-N 2.69Å; Q585-C587 PolarHBondContact O-N 3.33Å; C587-N591 PolarHBondContact O-N 3.43Å; C587-N591 PolarHBondContact O-ND2 2.85Å
588	L	89.1	Confident	88.6	Confident	0 Å²	0	62.6 Å²	62.6	0%	0	31%	0.307	C	S	.	.	H	α-helix	trans	-68.3	-45.9	173	-71.4	165.6	0	0	0	111.9	M569 L570 F573 S584 Q585 K586 N591 N592 W593 Y595	M569-L588 HydrophobicContact CG-CD1 4.42Å; M569-L588 HydrophobicContact CG-CD2 4.15Å; M569-L588 HydrophobicContact SD-CD2 3.91Å; L570-L588 HydrophobicContact CB-CD1 4.23Å; L570-L588 HydrophobicContact CD1-CD1 4.17Å; F573-L588 HydrophobicContact CB-CD1 3.89Å; F573-L588 HydrophobicContact CB-CD2 4.36Å; F573-L588 HydrophobicContact CB-CG 4.32Å; F573-L588 HydrophobicContact CD1-CG 4.28Å; F573-L588 HydrophobicContact CD2-CD2 4.13Å; F573-L588 HydrophobicContact CG-CD1 4.25Å; F573-L588 HydrophobicContact CG-CD2 4.12Å; F573-L588 HydrophobicContact CG-CG 4.14Å; S584-L588 WeakPolarHBondContact O-CG 3.39Å; S584-L588 PolarHBondContact O-N 2.89Å; Q585-L588 PolarHBondContact O-N 3.08Å; K586-L588 VanDerWaalsContact C-N 3.31Å; K586-L588 PolarHBondContact O-N 2.9Å; L588-N591 CarbonylContact O-C 3.54Å; L588-N591 PolarHBondContact O-N 2.76Å; L588-N592 PolarHBondContact O-N 3.08Å; L588-N592 VanDerWaalsContact O-N 3.13Å; L588-W593 HydrophobicContact CB-CD2 4.1Å; L588-W593 HydrophobicContact CB-CE3 3.76Å; L588-W593 HydrophobicContact CB-CH2 4.4Å; L588-W593 HydrophobicContact CB-CZ3 3.93Å; L588-W593 HydrophobicContact CD1-CE3 4Å; L588-W593 HydrophobicContact CD1-CZ3 3.69Å; L588-W593 HydrophobicContact CG-CE3 4.34Å; L588-W593 HydrophobicContact CG-CZ3 4.4Å; L588-W593 PolarHBondContact O-N 3.41Å; L588-Y595 HydrophobicContact CD2-CD2 4.49Å
589	Q	89.4	Confident	88.9	Confident	90 Å²	90	62.6 Å²	62.6	42%	0.421	30%	0.304	S	S	.	.	H	α-helix	trans	-61.1	-48.3	178.4	-75.5	177	-22.7	0	0	112.2	Q585 K586 N591 N592 W593	Q585-Q589 HydrophobicContact CG-CG 4.3Å; Q585-Q589 VanDerWaalsContact NE2-NE2 3.18Å; Q585-Q589 WeakPolarHBondContact O-CB 3.46Å; Q585-Q589 VanDerWaalsContact O-CG 3.28Å; Q585-Q589 WeakPolarHBondContact O-CG 3.29Å; Q585-Q589 PolarHBondContact O-N 2.64Å; K586-Q589 PolarHBondContact O-N 3.24Å; Q589-N591 PolarHBondContact O-N 2.92Å; Q589-N591 VanDerWaalsContact O-N 3.08Å; Q589-N592 PolarHBondContact O-N 2.69Å; Q589-W593 HydrophobicContact CG-CZ2 3.59Å
590	D	87.6	Confident	89	Confident	108 Å²	108	68.6 Å²	68.6	58%	0.578	33%	0.332	S	S	*	.	H	α-helix	trans	-60.8	-18.9	178.1	-69.9	-17.8	0	0	0	112.5	K586	K586-D590 WeakPolarHBondContact CE-OD2 3.4Å; K586-D590 WeakPolarHBondContact CG-OD2 3.33Å; K586-D590 WeakPolarHBondContact O-CB 3.23Å; K586-D590 VanDerWaalsContact O-CG 3.28Å; K586-D590 PolarHBondContact O-N 3.5Å
591	N	89.8	Confident	89	Confident	23 Å²	23	68.4 Å²	68.4	12%	0.123	34%	0.335	C	S	.	.	T	Hydrogen-bonded Turn	trans	-112.1	17	177.1	-70.9	-78.6	0	0	0	113.9	C587 L588 Q589 W593 D594 R597 S598	C587-N591 PolarHBondContact O-N 3.43Å; C587-N591 PolarHBondContact O-ND2 2.85Å; L588-N591 CarbonylContact O-C 3.54Å; L588-N591 PolarHBondContact O-N 2.76Å; Q589-N591 PolarHBondContact O-N 2.92Å; Q589-N591 VanDerWaalsContact O-N 3.08Å; N591-W593 VanDerWaalsContact C-N 3.33Å; N591-W593 PolarHBondContact O-N 2.67Å; N591-D594 PolarHBondContact O-N 2.69Å; N591-R597 HydrophobicContact CB-CG 4.26Å; N591-S598 WeakPolarHBondContact CB-OG 3.2Å
592	N	87.8	Confident	89.2	Confident	128 Å²	128	65 Å²	65	68%	0.684	32%	0.316	S	S	*	.	T	Hydrogen-bonded Turn	trans	60.4	33	177.3	-51	-87.7	0	0	0	114.8	L588 Q589 D594	L588-N592 PolarHBondContact O-N 3.08Å; L588-N592 VanDerWaalsContact O-N 3.13Å; Q589-N592 PolarHBondContact O-N 2.69Å; N592-D594 PolarHBondContact O-N 3.3Å
593	W	87.7	Confident	89.4	Confident	44 Å²	44	62 Å²	62	17%	0.167	31%	0.308	C	S	.	.	T	Hydrogen-bonded Turn	trans	61.5	22	-178.6	-59.1	86.4	0	0	0	115.1	L562 Q566 M569 L570 Q585 L588 Q589 N591 Y595	L562-W593 HydrophobicContact CD1-CH2 3.78Å; L562-W593 HydrophobicContact CD1-CZ2 4.35Å; L562-W593 HydrophobicContact CD2-CH2 3.73Å; L562-W593 HydrophobicContact CD2-CZ2 3.46Å; L562-W593 VanDerWaalsContact CD2-CZ2 3.46Å; L562-W593 HydrophobicContact CG-CH2 4.38Å; Q566-W593 HydrophobicContact CB-CD2 4.31Å; Q566-W593 HydrophobicContact CB-CE3 3.83Å; Q566-W593 HydrophobicContact CB-CH2 4.09Å; Q566-W593 HydrophobicContact CB-CZ3 3.7Å; Q566-W593 HydrophobicContact CG-CD2 3.78Å; Q566-W593 HydrophobicContact CG-CE3 3.72Å; Q566-W593 HydrophobicContact CG-CG 4.24Å; Q566-W593 HydrophobicContact CG-CZ3 4.11Å; Q566-W593 WeakPolarHBondContact O-CZ3 3.39Å; M569-W593 WeakPolarHBondContact CE-O 3.35Å; M569-W593 HydrophobicContact SD-CB 4.34Å; M569-W593 HydrophobicContact SD-CE3 4.15Å; L570-W593 HydrophobicContact CB-CZ3 4.38Å; Q585-W593 HydrophobicContact CG-CH2 4.14Å; Q585-W593 HydrophobicContact CG-CZ2 4.37Å; L588-W593 HydrophobicContact CB-CD2 4.1Å; L588-W593 HydrophobicContact CB-CE3 3.76Å; L588-W593 HydrophobicContact CB-CH2 4.4Å; L588-W593 HydrophobicContact CB-CZ3 3.93Å; L588-W593 HydrophobicContact CD1-CE3 4Å; L588-W593 HydrophobicContact CD1-CZ3 3.69Å; L588-W593 HydrophobicContact CG-CE3 4.34Å; L588-W593 HydrophobicContact CG-CZ3 4.4Å; L588-W593 PolarHBondContact O-N 3.41Å; Q589-W593 HydrophobicContact CG-CZ2 3.59Å; N591-W593 VanDerWaalsContact C-N 3.33Å; N591-W593 PolarHBondContact O-N 2.67Å; W593-Y595 PolarHBondContact O-N 3.05Å
594	D	88.9	Confident	89.5	Confident	74 Å²	74	63.5 Å²	63.5	40%	0.396	32%	0.318	S	S	.	.			trans	-80.3	106.9	164.1	177.8	-20.2	0	0	0	109.4	N591 N592 T596 R597 S598	N591-D594 PolarHBondContact O-N 2.69Å; N592-D594 PolarHBondContact O-N 3.3Å; D594-T596 VanDerWaalsContact C-N 3.31Å; D594-T596 PolarHBondContact O-N 3.29Å; D594-T596 WeakPolarHBondContact OD1-CA 3.48Å; D594-T596 WeakPolarHBondContact OD1-CB 3.47Å; D594-T596 PolarHBondContact OD1-N 3.41Å; D594-R597 HydrophobicContact CB-CB 3.79Å; D594-R597 PolarHBondContact O-N 3.08Å; D594-R597 PolarHBondContact OD1-N 3.36Å; D594-R597 WeakPolarHBondContact OD2-CB 3.37Å; D594-S598 VanDerWaalsContact O-CB 3.29Å; D594-S598 WeakPolarHBondContact O-CB 3.43Å; D594-S598 PolarHBondContact O-N 3.08Å; D594-S598 PolarHBondContact O-OG 2.87Å
595	Y	89.8	Confident	89.5	Confident	64 Å²	64	66.5 Å²	66.5	25%	0.251	33%	0.334	S	S	.	.	H	α-helix	trans	-58.7	-39.1	179.9	-167.9	-87.7	0	0	0	113.1	M569 A572 F573 Q576 L588 W593 A599	M569-Y595 HydrophobicContact CG-CD2 3.58Å; M569-Y595 HydrophobicContact CG-CE2 4.34Å; M569-Y595 HydrophobicContact CG-CG 4.48Å; M569-Y595 HydrophobicContact SD-CD2 4.39Å; A572-Y595 HydrophobicContact CB-CE2 4.03Å; F573-Y595 HydrophobicContact CB-CD2 4.35Å; F573-Y595 HydrophobicContact CB-CE2 3.78Å; F573-Y595 AromaticContact CD2-CD2 3.92Å; F573-Y595 HydrophobicContact CD2-CD2 3.92Å; F573-Y595 AromaticContact CD2-CE2 3.7Å; F573-Y595 HydrophobicContact CD2-CE2 3.7Å; F573-Y595 HydrophobicContact CD2-CG 4.47Å; F573-Y595 AromaticContact CD2-CZ 3.99Å; F573-Y595 HydrophobicContact CG-CE2 4.25Å; Q576-Y595 VanDerWaalsContact OE1-CE1 3.29Å; Q576-Y595 PolarHBondContact OE1-OH 2.92Å; L588-Y595 HydrophobicContact CD2-CD2 4.49Å; W593-Y595 PolarHBondContact O-N 3.05Å; Y595-A599 WeakPolarHBondContact O-CB 3.45Å; Y595-A599 PolarHBondContact O-N 3.45Å
596	T	90.3	Very high	89.4	Confident	90 Å²	90	68.7 Å²	68.7	55%	0.552	34%	0.343	S	S	*	.	H	α-helix	trans	-71.9	-45.5	-176.5	-56.8	0	0	0	0	110.2	D594 A599 Q600	D594-T596 VanDerWaalsContact C-N 3.31Å; D594-T596 PolarHBondContact O-N 3.29Å; D594-T596 WeakPolarHBondContact OD1-CA 3.48Å; D594-T596 WeakPolarHBondContact OD1-CB 3.47Å; D594-T596 PolarHBondContact OD1-N 3.41Å; T596-A599 PolarHBondContact O-N 3.3Å; T596-Q600 WeakPolarHBondContact O-CG 3.27Å; T596-Q600 PolarHBondContact O-N 3.49Å
597	R	89.8	Confident	89.4	Confident	135 Å²	135	68.2 Å²	68.2	51%	0.509	36%	0.358	S	S	.	.	H	α-helix	trans	-63.3	-41.7	175	-173.7	-177.6	178.7	147.1	2.1	111.8	N591 D594 A599 Q600 A601	N591-R597 HydrophobicContact CB-CG 4.26Å; D594-R597 HydrophobicContact CB-CB 3.79Å; D594-R597 PolarHBondContact O-N 3.08Å; D594-R597 PolarHBondContact OD1-N 3.36Å; D594-R597 WeakPolarHBondContact OD2-CB 3.37Å; R597-A599 PolarHBondContact O-N 3.34Å; R597-Q600 PolarHBondContact O-N 2.85Å; R597-A601 WeakPolarHBondContact O-CB 3.43Å; R597-A601 PolarHBondContact O-N 2.9Å
598	S	92	Very high	89.4	Confident	0 Å²	0	72.8 Å²	72.8	0%	0	38%	0.375	C	S	.	.	H	α-helix	trans	-61.2	-43.6	175	-55.2	0	0	0	0	111.4	N591 D594 Q600 A601 F602	N591-S598 WeakPolarHBondContact CB-OG 3.2Å; D594-S598 VanDerWaalsContact O-CB 3.29Å; D594-S598 WeakPolarHBondContact O-CB 3.43Å; D594-S598 PolarHBondContact O-N 3.08Å; D594-S598 PolarHBondContact O-OG 2.87Å; S598-Q600 PolarHBondContact O-N 3.11Å; S598-A601 PolarHBondContact O-N 2.95Å; S598-F602 VanDerWaalsContact O-CB 3.26Å; S598-F602 WeakPolarHBondContact O-CB 3.46Å; S598-F602 PolarHBondContact O-N 3.33Å
599	A	90.3	Very high	89.2	Confident	26 Å²	26	75.8 Å²	75.8	22%	0.215	41%	0.406	C	S	.	.	H	α-helix	trans	-65.1	-38.8	178.3	0	0	0	0	0	112.3	F573 Y595 T596 R597 T603	F573-A599 HydrophobicContact CE2-CB 4.09Å; Y595-A599 WeakPolarHBondContact O-CB 3.45Å; Y595-A599 PolarHBondContact O-N 3.45Å; T596-A599 PolarHBondContact O-N 3.3Å; R597-A599 PolarHBondContact O-N 3.34Å; A599-T603 WeakPolarHBondContact O-CB 3.4Å; A599-T603 PolarHBondContact O-N 3.09Å; A599-T603 PolarHBondContact O-OG1 3.12Å
600	Q	91	Very high	89	Confident	131 Å²	131	76.7 Å²	76.7	61%	0.612	41%	0.41	S	S	*	.	H	α-helix	trans	-65.4	-47.8	173.7	-70.5	173.3	7.6	0	0	111.7	T596 R597 S598 T603 H604	T596-Q600 WeakPolarHBondContact O-CG 3.27Å; T596-Q600 PolarHBondContact O-N 3.49Å; R597-Q600 PolarHBondContact O-N 2.85Å; S598-Q600 PolarHBondContact O-N 3.11Å; Q600-T603 PolarHBondContact O-N 2.74Å; Q600-H604 WeakPolarHBondContact O-CB 3.44Å; Q600-H604 PolarHBondContact O-N 3.46Å
601	A	89.1	Confident	89	Confident	26 Å²	26	72.8 Å²	72.8	22%	0.215	39%	0.389	C	S	.	.	H	α-helix	trans	-60.1	-48	177.6	0	0	0	0	0	111.7	R597 S598 T603 H604 L605	R597-A601 WeakPolarHBondContact O-CB 3.43Å; R597-A601 PolarHBondContact O-N 2.9Å; S598-A601 PolarHBondContact O-N 2.95Å; A601-T603 PolarHBondContact O-N 3.5Å; A601-H604 PolarHBondContact O-N 3.09Å; A601-L605 WeakPolarHBondContact O-CB 3.34Å; A601-L605 VanDerWaalsContact O-CG 3.28Å; A601-L605 WeakPolarHBondContact O-CG 3.41Å; A601-L605 PolarHBondContact O-N 3.35Å
602	F	91.9	Very high	88.8	Confident	18 Å²	18	74.5 Å²	74.5	8%	0.079	40%	0.402	C	S	.	.	H	α-helix	trans	-56.4	-48.7	173.9	170	-104.1	0	0	0	112.2	F573 S577 M579 S598 H604 L605 K606 I611 F616	F573-F602 HydrophobicContact CZ-CB 4.02Å; S577-F602 WeakPolarHBondContact O-CZ 3.35Å; M579-F602 HydrophobicContact CE-CD2 3.57Å; M579-F602 HydrophobicContact CE-CE2 3.81Å; M579-F602 HydrophobicContact CE-CG 4.46Å; M579-F602 HydrophobicContact CG-CD2 4.49Å; M579-F602 HydrophobicContact CG-CE2 3.78Å; M579-F602 HydrophobicContact SD-CD2 3.78Å; M579-F602 HydrophobicContact SD-CE2 3.59Å; M579-F602 VanDerWaalsContact SD-CE2 3.59Å; S598-F602 VanDerWaalsContact O-CB 3.26Å; S598-F602 WeakPolarHBondContact O-CB 3.46Å; S598-F602 PolarHBondContact O-N 3.33Å; F602-H604 VanDerWaalsContact C-N 3.34Å; F602-H604 PolarHBondContact O-N 3.17Å; F602-L605 PolarHBondContact O-N 3.02Å; F602-K606 HydrophobicContact CE1-CD 3.93Å; F602-K606 HydrophobicContact CE2-CD 4.23Å; F602-K606 HydrophobicContact CZ-CD 3.56Å; F602-K606 WeakPolarHBondContact O-CB 3.43Å; F602-K606 PolarHBondContact O-N 3.23Å; F602-I611 HydrophobicContact CD2-CD1 3.51Å; F602-I611 HydrophobicContact CE2-CD1 3.6Å; F602-F616 HydrophobicContact CE2-CE1 4.06Å; F602-F616 AromaticContact CE2-CZ 3.96Å; F602-F616 HydrophobicContact CE2-CZ 3.96Å; F602-F616 HydrophobicContact CZ-CE1 4.1Å; F602-F616 HydrophobicContact CZ-CZ 4.27Å
603	T	90	Very high	88.6	Confident	88 Å²	88	76.7 Å²	76.7	54%	0.54	41%	0.408	S	S	.	.	H	α-helix	trans	-61.9	-42.3	-179	-57.8	0	0	0	0	111.5	A599 Q600 A601 A607	A599-T603 WeakPolarHBondContact O-CB 3.4Å; A599-T603 PolarHBondContact O-N 3.09Å; A599-T603 PolarHBondContact O-OG1 3.12Å; Q600-T603 PolarHBondContact O-N 2.74Å; A601-T603 PolarHBondContact O-N 3.5Å; T603-A607 WeakPolarHBondContact O-CB 3.33Å; T603-A607 PolarHBondContact O-N 2.87Å
604	H	90.6	Very high	88.4	Confident	110 Å²	110	78.1 Å²	78.1	51%	0.509	42%	0.421	S	S	.	.	H	α-helix	trans	-65.8	-46.9	177	171.4	-101.5	0	0	0	112.6	Q600 A601 F602 K606 A607 K608	Q600-H604 WeakPolarHBondContact O-CB 3.44Å; Q600-H604 PolarHBondContact O-N 3.46Å; A601-H604 PolarHBondContact O-N 3.09Å; F602-H604 VanDerWaalsContact C-N 3.34Å; F602-H604 PolarHBondContact O-N 3.17Å; H604-K606 PolarHBondContact O-N 3.36Å; H604-A607 PolarHBondContact O-N 2.87Å; H604-K608 WeakPolarHBondContact NE2-CE 3.31Å; H604-K608 PolarHBondContact O-N 3.45Å
605	L	88.6	Confident	88.2	Confident	64 Å²	64	74.6 Å²	74.6	34%	0.335	40%	0.402	S	S	.	.	H	α-helix	trans	-65.2	-38.7	177.4	-67.2	171.5	0	0	0	111.8	A601 F602 K608 G609 E610 I611	A601-L605 WeakPolarHBondContact O-CB 3.34Å; A601-L605 VanDerWaalsContact O-CG 3.28Å; A601-L605 WeakPolarHBondContact O-CG 3.41Å; A601-L605 PolarHBondContact O-N 3.35Å; F602-L605 PolarHBondContact O-N 3.02Å; L605-K608 PolarHBondContact O-N 2.64Å; L605-G609 PolarHBondContact O-N 3.33Å; L605-G609 VanDerWaalsContact O-N 3.16Å; L605-E610 HydrophobicContact CD2-CB 4.13Å; L605-E610 VanDerWaalsContact CD2-OE2 3.23Å; L605-E610 WeakPolarHBondContact CD2-OE2 3.28Å; L605-E610 PolarHBondContact O-N 3.23Å; L605-I611 HydrophobicContact CB-CD1 4.01Å; L605-I611 HydrophobicContact CB-CG1 3.73Å
606	K	88.4	Confident	88	Confident	107 Å²	107	74.9 Å²	74.9	47%	0.465	41%	0.405	S	S	.	.	H	α-helix	trans	-65.2	-41.2	175.7	-169	170.6	-172	171.6	0	111.9	F602 H604 K608 G609 I611	F602-K606 HydrophobicContact CE1-CD 3.93Å; F602-K606 HydrophobicContact CE2-CD 4.23Å; F602-K606 HydrophobicContact CZ-CD 3.56Å; F602-K606 WeakPolarHBondContact O-CB 3.43Å; F602-K606 PolarHBondContact O-N 3.23Å; H604-K606 PolarHBondContact O-N 3.36Å; K606-K608 PolarHBondContact O-N 2.83Å; K606-G609 PolarHBondContact O-N 2.85Å; K606-G609 VanDerWaalsContact O-N 3.13Å; K606-I611 HydrophobicContact CB-CD1 3.87Å
607	A	88.2	Confident	87.4	Confident	89 Å²	89	76.6 Å²	76.6	74%	0.736	41%	0.408	S	S	*	.	H	α-helix	trans	-63.9	-24.1	176.4	0	0	0	0	0	113.3	T603 H604	T603-A607 WeakPolarHBondContact O-CB 3.33Å; T603-A607 PolarHBondContact O-N 2.87Å; H604-A607 PolarHBondContact O-N 2.87Å
608	K	86.8	Confident	86	Confident	114 Å²	114	80.4 Å²	80.4	50%	0.496	43%	0.428	S	S	.	.	H	α-helix	trans	-91.7	-10.4	174	-68.7	-175.7	172.2	-171.8	0	115	H604 L605 K606 E610	H604-K608 WeakPolarHBondContact NE2-CE 3.31Å; H604-K608 PolarHBondContact O-N 3.45Å; L605-K608 PolarHBondContact O-N 2.64Å; K606-K608 PolarHBondContact O-N 2.83Å; K608-E610 VanDerWaalsContact C-N 3.28Å; K608-E610 HydrophobicContact CB-CB 4.43Å; K608-E610 HydrophobicContact CB-CG 3.83Å; K608-E610 HydrophobicContact CD-CG 4.26Å; K608-E610 VanDerWaalsContact CD-OE1 3.22Å; K608-E610 WeakPolarHBondContact CD-OE1 3.08Å; K608-E610 VanDerWaalsContact CD-OE2 3.24Å; K608-E610 WeakPolarHBondContact CD-OE2 3.44Å; K608-E610 IonicContact NZ-OE1 2.81Å; K608-E610 PolarHBondContact NZ-OE1 2.76Å; K608-E610 IonicContact NZ-OE2 3.2Å; K608-E610 PolarHBondContact NZ-OE2 3.11Å; K608-E610 PolarHBondContact O-N 3.28Å
609	G	85.3	Confident	85.7	Confident	63 Å²	63	84.4 Å²	84.4	65%	0.649	45%	0.45	S	S	*	.	T	Hydrogen-bonded Turn	trans	71.6	18	-171.1	0	0	0	0	0	114.4	L605 K606 I611	L605-G609 PolarHBondContact O-N 3.33Å; L605-G609 VanDerWaalsContact O-N 3.16Å; K606-G609 PolarHBondContact O-N 2.85Å; K606-G609 VanDerWaalsContact O-N 3.13Å; G609-I611 PolarHBondContact O-N 3Å
610	E	86.1	Confident	85.5	Confident	108 Å²	108	87.5 Å²	87.5	51%	0.505	46%	0.462	S	S	.	.			trans	-80.3	0.8	-178	-71.7	172.3	173.8	0	0	113	L605 K608	L605-E610 HydrophobicContact CD2-CB 4.13Å; L605-E610 VanDerWaalsContact CD2-OE2 3.23Å; L605-E610 WeakPolarHBondContact CD2-OE2 3.28Å; L605-E610 PolarHBondContact O-N 3.23Å; K608-E610 VanDerWaalsContact C-N 3.28Å; K608-E610 HydrophobicContact CB-CB 4.43Å; K608-E610 HydrophobicContact CB-CG 3.83Å; K608-E610 HydrophobicContact CD-CG 4.26Å; K608-E610 VanDerWaalsContact CD-OE1 3.22Å; K608-E610 WeakPolarHBondContact CD-OE1 3.08Å; K608-E610 VanDerWaalsContact CD-OE2 3.24Å; K608-E610 WeakPolarHBondContact CD-OE2 3.44Å; K608-E610 IonicContact NZ-OE1 2.81Å; K608-E610 PolarHBondContact NZ-OE1 2.76Å; K608-E610 IonicContact NZ-OE2 3.2Å; K608-E610 PolarHBondContact NZ-OE2 3.11Å; K608-E610 PolarHBondContact O-N 3.28Å
611	I	86.6	Confident	85.2	Confident	27 Å²	27	85.1 Å²	85.1	14%	0.138	45%	0.454	C	S	.	.	S	Bend	trans	-98.3	120.3	177.9	-52.6	-177.6	0	0	0	110	M579 F602 L605 K606 G609 A615 F616	M579-I611 HydrophobicContact SD-CG2 4.28Å; F602-I611 HydrophobicContact CD2-CD1 3.51Å; F602-I611 HydrophobicContact CE2-CD1 3.6Å; L605-I611 HydrophobicContact CB-CD1 4.01Å; L605-I611 HydrophobicContact CB-CG1 3.73Å; K606-I611 HydrophobicContact CB-CD1 3.87Å; G609-I611 PolarHBondContact O-N 3Å; I611-A615 HydrophobicContact CG2-CB 3.75Å; I611-F616 HydrophobicContact CB-CE2 4.19Å; I611-F616 HydrophobicContact CB-CZ 4.5Å; I611-F616 HydrophobicContact CD1-CZ 4.46Å; I611-F616 HydrophobicContact CG2-CE2 3.64Å; I611-F616 HydrophobicContact CG2-CZ 3.94Å
612	P	85.4	Confident	84.9	Confident	59 Å²	59	88.5 Å²	88.5	38%	0.383	47%	0.468	S	S	.	.			trans	-60.5	144.1	178.3	-26.8	37	0	0	0	114	W583 V614 A615	W583-P612 HydrophobicContact CH2-CG 3.88Å; W583-P612 HydrophobicContact CZ2-CG 4.43Å; W583-P612 HydrophobicContact CZ3-CG 4.37Å; P612-V614 HydrophobicContact CB-CG2 3.72Å; P612-V614 PolarHBondContact O-N 2.99Å; P612-V614 VanDerWaalsContact O-N 3.14Å; P612-A615 VanDerWaalsContact O-CB 3.23Å; P612-A615 WeakPolarHBondContact O-CB 3.41Å; P612-A615 PolarHBondContact O-N 3.29Å
613	E	82.9	Confident	84.5	Confident	174 Å²	174	92.9 Å²	92.9	81%	0.813	49%	0.492	S	S	*	.	G	3₁₀ helix	trans	-57.6	-31	179.1	-62.3	-174.5	158.7	0	0	113.2	A615 F616	E613-A615 PolarHBondContact O-N 3.48Å; E613-A615 VanDerWaalsContact O-N 3.1Å; E613-F616 PolarHBondContact O-N 3.15Å
614	V	84.5	Confident	84.1	Confident	74 Å²	74	93.3 Å²	93.3	45%	0.448	49%	0.489	S	S	.	.	G	3₁₀ helix	trans	-57.7	-22.1	174.5	-62.1	0	0	0	0	113.7	N580 W583 P612 F616 M617	N580-V614 PolarHBondContact ND2-O 2.96Å; N580-V614 VanDerWaalsContact ND2-O 3.1Å; W583-V614 HydrophobicContact CZ2-CG2 4.14Å; P612-V614 HydrophobicContact CB-CG2 3.72Å; P612-V614 PolarHBondContact O-N 2.99Å; P612-V614 VanDerWaalsContact O-N 3.14Å; V614-F616 PolarHBondContact O-N 3.2Å; V614-M617 HydrophobicContact CB-CE 4.17Å; V614-M617 HydrophobicContact CG1-CE 3.78Å
615	A	84.3	Confident	83.7	Confident	0 Å²	0	92.1 Å²	92.1	0%	0	49%	0.488	C	S	.	.	G	3₁₀ helix	trans	-69.6	-20.8	175.6	0	0	0	0	0	113.1	M579 N580 W583 I611 P612 E613	M579-A615 CarbonylContact C-O 3.58Å; M579-A615 WeakPolarHBondContact CA-O 3.29Å; M579-A615 WeakPolarHBondContact CB-O 3.33Å; M579-A615 HydrophobicContact CG-CB 4.3Å; M579-A615 HydrophobicContact SD-CB 4.22Å; N580-A615 PolarHBondContact N-O 3.23Å; W583-A615 HydrophobicContact CB-CB 3.79Å; W583-A615 HydrophobicContact CD2-CB 3.69Å; W583-A615 HydrophobicContact CE3-CB 4.17Å; W583-A615 HydrophobicContact CG-CB 3.5Å; W583-A615 VanDerWaalsContact CG-CB 3.5Å; I611-A615 HydrophobicContact CG2-CB 3.75Å; P612-A615 VanDerWaalsContact O-CB 3.23Å; P612-A615 WeakPolarHBondContact O-CB 3.41Å; P612-A615 PolarHBondContact O-N 3.29Å; E613-A615 PolarHBondContact O-N 3.48Å; E613-A615 VanDerWaalsContact O-N 3.1Å
616	F	86.9	Confident	83.3	Confident	69 Å²	69	94.2 Å²	94.2	30%	0.303	50%	0.499	S	S	.	.	S	Bend	trans	-106	-3.5	-177.1	-58.9	-75.8	0	0	0	113.7	M579 F602 I611 E613 V614	M579-F616 HydrophobicContact CG-CD1 3.92Å; M579-F616 HydrophobicContact CG-CE1 3.46Å; M579-F616 VanDerWaalsContact CG-CE1 3.46Å; M579-F616 HydrophobicContact CG-CZ 3.95Å; F602-F616 HydrophobicContact CE2-CE1 4.06Å; F602-F616 AromaticContact CE2-CZ 3.96Å; F602-F616 HydrophobicContact CE2-CZ 3.96Å; F602-F616 HydrophobicContact CZ-CE1 4.1Å; F602-F616 HydrophobicContact CZ-CZ 4.27Å; I611-F616 HydrophobicContact CB-CE2 4.19Å; I611-F616 HydrophobicContact CB-CZ 4.5Å; I611-F616 HydrophobicContact CD1-CZ 4.46Å; I611-F616 HydrophobicContact CG2-CE2 3.64Å; I611-F616 HydrophobicContact CG2-CZ 3.94Å; E613-F616 PolarHBondContact O-N 3.15Å; V614-F616 PolarHBondContact O-N 3.2Å
617	M	77.7	Confident	82.9	Confident	127 Å²	127	93.2 Å²	93.2	63%	0.626	50%	0.502	S	S	*	.			trans	-75.2	131.9	167.1	-67.4	-162.2	-73.1	0	0	109.8	N580 V614	N580-M617 WeakPolarHBondContact CB-O 3.47Å; N580-M617 PolarHBondContact ND2-O 3Å; V614-M617 HydrophobicContact CB-CE 4.17Å; V614-M617 HydrophobicContact CG1-CE 3.78Å
618	K	59.8	Low	82.4	Confident	214 Å²	214	93.5 Å²	93.5	93%	0.93	48%	0.481	S	S	*	.			trans	-113.6	0	-177.5	-67.6	-170.8	174.6	-169.6	0	111.4	G578	G578-K618 WeakPolarHBondContact O-CE 3.32Å

Retrieved 618 of 618 residues in 140.3 ms (Link to these results)

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