A0A061IF78_CRIGR Loading...

Nuclear RNA export factor 1

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 134 ms (Link to these results)

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