A0A096MT31_PAPAN Loading...

Fibroblast growth factor receptor

AlphaFold DB , UniProt , Accession A0A096MT31, Species PAPAN (Papio anubis, Olive baboon), Gene FGFR1, Length 853 aa.

						>A0A096MT31_PAPAN|A0A096MT31|FGFR1
MEAGISLKRRIELTVKYPWRCGALSLTSKCRTGMWSWKCLLFWAVLVTATLCTARPSPTLPEQAQPWGAPVEVESFLVHPGDLLQLRCRLRDDVQSINWLRDGVQLAESNRTRITGEEVEVQDSVPADSGLYACVTSSPSGSDTTYFSVNVSDALPSSEDDDDDDDSSSEEKETDNTKPNPVAPYWTSPEKMEKKLHAVPAAKTVKFKCPSSGTPNPTLRWLKNGKEFKPDHRIGGYKVRYATWSIIMDSVVPSDKGNYTCIVENEYGSINHTYQLDVVERSPHRPILQAGLPANKTVALGSNVEFMCKVYSDPQPHIQWLKHIEVNGSKIGPDNLPYVQILKTAGVNTTDKEMEVLHLRNVSFEDAGEYTCLAGNSIGLSHHSAWLTVLEALEERPAVMTSPLYLEIIIYCTGAFLISCMVGSVIVYKMKSGTKKSDFHSQMAVHKLAKSIPLRRQVTVSADSSASMNSGVLLVRPSRLSSSGTPMLAGVSEYELPEDPRWELPRDRLVLGKPLGEGCFGQVVLAEAIGLDKDKPNRVTKVAVKMLKSDATEKDLSDLISEMEMMKMIGKHKNIINLLGACTQDGPLYVIVEYASKGNLREYLQARRPPGLEYCYNPSHNPEEQLSSKDLVSCAYQVARGMEYLASKKCIHRDLAARNVLVTEDNVMKIADFGLARDIHHIDYYKKTTNGRLPVKWMAPEALFDRIYTHQSDVWSFGVLLWEIFTLGGSPYPGVPVEELFKLLKEGHRMDKPSNCTNELYMMMRDCWHAVPSQRPTFKQLVEDLDRIVALTSNQEYLDLSMPLDQYSPSFPDTRSSTCSSGEDSVFSHEPLPEEPCLPRHPAQLANGGLKRR
					

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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	31.1	Very low	29.1	Very low	237 Å²	237	171.6 Å²	171.6	100%	1.167	88%	0.883	S	S	*	*				0	172.8	0	-74.7	154.8	173	0	0	108.1
2	E	28.9	Very low	28.7	Very low	183 Å²	183	171 Å²	171	86%	0.855	87%	0.873	S	S	*	*			trans	-59.7	168.8	-175.6	-66.6	119.4	135.2	0	0	114.5
3	A	32.9	Very low	28.3	Very low	102 Å²	102	169 Å²	169	84%	0.843	86%	0.864	S	S	*	*			cis	-170.2	159	-28.7	0	0	0	0	0	107.8
4	G	27.3	Very low	27.9	Very low	80 Å²	80	165.6 Å²	165.6	83%	0.825	86%	0.856	S	S	*	*			trans	178.4	74.3	-176.7	0	0	0	0	0	117.8
5	I	30.9	Very low	27.5	Very low	171 Å²	171	162.3 Å²	162.3	88%	0.877	85%	0.845	S	S	*	*			trans	-33.2	144.5	163.2	-68	156.9	0	0	0	113.7
6	S	27.3	Very low	27.2	Very low	114 Å²	114	163.3 Å²	163.3	80%	0.797	84%	0.841	S	S	*	*			cis	-149.6	165.4	23.6	-160.3	0	0	0	0	113.8
7	L	29.7	Very low	27.1	Very low	151 Å²	151	166.4 Å²	166.4	79%	0.791	84%	0.841	S	S	*	*			trans	-136.8	136.9	175.1	-157.6	87.6	0	0	0	112.6
8	K	30.4	Very low	27.6	Very low	200 Å²	200	162.9 Å²	162.9	87%	0.87	83%	0.832	S	S	*	*			trans	-83.5	129.4	166.7	-89.4	-177.8	173.9	176	0	111.1
9	R	27.3	Very low	27.4	Very low	239 Å²	239	165 Å²	165	90%	0.902	83%	0.829	S	S	*	*			trans	-162.3	158.8	151.3	-110.8	168.6	-157.3	-141.6	3.6	112.3
10	R	29.8	Very low	27.2	Very low	239 Å²	239	167.3 Å²	167.3	90%	0.902	83%	0.827	S	S	*	*			trans	-71.7	157.7	170	-66.6	176.1	172.7	174.5	-3.7	111
11	I	24.5	Very low	27.2	Very low	172 Å²	172	165.9 Å²	165.9	88%	0.882	83%	0.832	S	S	*	*			trans	-159	166.4	138.6	-104.8	154.3	0	0	0	109
12	E	24	Very low	26.9	Very low	164 Å²	164	158 Å²	158	77%	0.766	81%	0.812	S	S	*	*			trans	-95.2	-172.2	-170.9	-51	166.1	108.6	0	0	113.4
13	L	23.4	Very low	26.7	Very low	145 Å²	145	154.3 Å²	154.3	76%	0.759	81%	0.813	S	S	*	*			trans	73.6	96.8	149.4	-68.1	160.9	0	0	0	121.2
14	T	22.9	Very low	26.4	Very low	121 Å²	121	157.9 Å²	157.9	74%	0.742	82%	0.817	S	S	*	*				80.3	156.8	123.3	-39	0	0	0	0	120.8
15	V	22.5	Very low	26.2	Very low	116 Å²	116	158.4 Å²	158.4	70%	0.703	81%	0.808	S	S	*	*			trans	111.7	97	151.8	-171	0	0	0	0	119.3
16	K	22.7	Very low	26	Very low	178 Å²	178	158.8 Å²	158.8	77%	0.774	81%	0.811	S	S	*	*			trans	49	130.6	132.7	-57.6	178.1	-176.5	173.1	0	123.7
17	Y	24.9	Very low	26	Very low	216 Å²	216	158.7 Å²	158.7	85%	0.847	81%	0.806	S	S	*	*				27.9	146	121.5	-60.5	-67.3	0	0	0	121.1
18	P	37.3	Very low	25.9	Very low	104 Å²	104	156.2 Å²	156.2	68%	0.675	80%	0.801	S	S	*	*				-137.2	-177.8	52.3	19	9.3	0	0	0	114.6
19	W	23.7	Very low	25.7	Very low	203 Å²	203	155.6 Å²	155.6	77%	0.769	80%	0.798	S	S	*	*			cis	-153.1	154.3	42.6	-87.6	75.4	0	0	0	116.5
20	R	23.3	Very low	25.9	Very low	210 Å²	210	150.9 Å²	150.9	79%	0.792	80%	0.8	S	S	*	*			trans	17.7	115.3	155.5	-65.7	-174.5	-176.6	179.7	1.3	121.9
21	C	25.8	Very low	25.9	Very low	138 Å²	138	150.4 Å²	150.4	93%	0.932	80%	0.798	S	S	*	*				-167	160.7	103.9	-104.8	0	0	0	0	107.5
22	G	25.6	Very low	26.5	Very low	73 Å²	73	149.3 Å²	149.3	75%	0.753	80%	0.8	S	S	*	*			cis	-172.6	135.2	-8	0	0	0	0	0	105.4
23	A	25.4	Very low	26.9	Very low	105 Å²	105	144.2 Å²	144.2	87%	0.868	79%	0.791	S	S	*	*			trans	-85.6	147.2	-158.9	0	0	0	0	0	114.9
24	L	25.1	Very low	27.5	Very low	176 Å²	176	146.5 Å²	146.5	92%	0.921	80%	0.8	S	S	*	*			trans	-154.6	150.4	135.3	-110.5	164.6	0	0	0	110.2
25	S	24.9	Very low	28.3	Very low	92 Å²	92	149.5 Å²	149.5	64%	0.643	80%	0.798	S	S	*	*			trans	-104.3	155	-170.2	63.1	0	0	0	0	112.5
26	L	25.9	Very low	29.6	Very low	179 Å²	179	147 Å²	147	94%	0.937	79%	0.786	S	S	*	*			trans	-142.5	130.3	152.6	-113.3	161	0	0	0	109.1
27	T	26.5	Very low	30.7	Very low	112 Å²	112	146.6 Å²	146.6	69%	0.687	78%	0.78	S	S	*	*			trans	-121.8	151.9	-169.1	53.7	0	0	0	0	112.3
28	S	27.1	Very low	31.7	Very low	99 Å²	99	144.5 Å²	144.5	69%	0.692	78%	0.775	S	S	*	*			trans	82.9	134.7	151.1	87.2	0	0	0	0	119.9
29	K	28	Very low	32.4	Very low	187 Å²	187	142.2 Å²	142.2	81%	0.813	76%	0.761	S	S	*	*			trans	62.1	97.9	138.9	-67.1	166.9	-176	172.7	0	117.9	R31	K29-R31 PolarHBondContact O-N 2.9Å
30	C	31.1	Very low	33.7	Very low	139 Å²	139	137.8 Å²	137.8	94%	0.939	75%	0.752	S	S	*	*			trans	-49	119.8	141.2	-75.6	0	0	0	0	110.5
31	R	28.6	Very low	35	Very low	230 Å²	230	132.9 Å²	132.9	87%	0.868	74%	0.74	S	S	*	*			trans	-137.7	123.3	153.9	-101.8	-172.2	173.6	-171.4	-3	109.4	K29 G33	K29-R31 PolarHBondContact O-N 2.9Å; R31-G33 PolarHBondContact O-N 3.41Å
32	T	38.4	Very low	36	Very low	149 Å²	149	133.3 Å²	133.3	91%	0.914	73%	0.727	S	S	*	*			trans	-14.4	111.6	164.1	50.8	0	0	0	0	115.5
33	G	31.3	Very low	37.2	Very low	57 Å²	57	137.2 Å²	137.2	59%	0.588	72%	0.719	S	S	*	*			trans	-138.1	132	170.7	0	0	0	0	0	110.5	R31 W35	R31-G33 PolarHBondContact O-N 3.41Å; G33-W35 PolarHBondContact O-N 2.99Å
34	M	37.3	Very low	38.5	Very low	192 Å²	192	134.8 Å²	134.8	95%	0.946	70%	0.699	S	S	*	*			trans	-74.3	112.2	-175.7	-160.3	99	72.9	0	0	110.4	S36	M34-S36 PolarHBondContact O-N 3.23Å; M34-S36 VanDerWaalsContact O-N 3.14Å
35	W	38.5	Very low	39.9	Very low	185 Å²	185	130.7 Å²	130.7	70%	0.701	68%	0.681	S	S	*	*			trans	-72.3	109.5	177.7	-82.8	46.6	0	0	0	110.4	G33 C39	G33-W35 PolarHBondContact O-N 2.99Å; W35-C39 HydrophobicContact CE3-CB 4.48Å
36	S	50.2	Low	41	Very low	64 Å²	64	130.1 Å²	130.1	45%	0.448	67%	0.67	S	S	.	*			trans	-65.6	145.1	176.9	-179.5	0	0	0	0	111.2	M34 K38 C39	M34-S36 PolarHBondContact O-N 3.23Å; M34-S36 VanDerWaalsContact O-N 3.14Å; S36-K38 PolarHBondContact O-N 3.36Å; S36-C39 WeakPolarHBondContact O-CB 3.42Å; S36-C39 PolarHBondContact O-N 2.87Å
37	W	45.8	Very low	42.3	Very low	169 Å²	169	125.3 Å²	125.3	64%	0.64	65%	0.648	S	S	*	*	H	α-helix	trans	-56.2	-26.3	178.7	-150.9	-22.6	0	0	0	112.3	C39 L40 L41 K429	W37-C39 VanDerWaalsContact C-N 3.32Å; W37-C39 PolarHBondContact O-N 3.32Å; W37-L40 PolarHBondContact O-N 3Å; W37-L41 PolarHBondContact O-N 2.97Å; W37-K429 HydrophobicContact CH2-CD 3.88Å; W37-K429 VanDerWaalsContact CH2-NZ 3.27Å; W37-K429 HydrophobicContact CZ3-CD 4.33Å
38	K	46.2	Very low	43.3	Very low	171 Å²	171	124 Å²	124	74%	0.743	64%	0.64	S	S	*	*	H	α-helix	trans	-63.7	-31.1	173.5	-66.5	-171.4	175.4	-173.8	0	113.5	S36 F42	S36-K38 PolarHBondContact O-N 3.36Å; K38-F42 WeakPolarHBondContact O-CB 3.44Å; K38-F42 PolarHBondContact O-N 2.87Å
39	C	50.8	Low	44.1	Very low	57 Å²	57	121.6 Å²	121.6	39%	0.385	63%	0.626	S	S	.	*	H	α-helix	trans	-71.6	-38.2	-179.9	-60.8	0	0	0	0	112.1	W35 S36 W37 F42 W43	W35-C39 HydrophobicContact CE3-CB 4.48Å; S36-C39 WeakPolarHBondContact O-CB 3.42Å; S36-C39 PolarHBondContact O-N 2.87Å; W37-C39 VanDerWaalsContact C-N 3.32Å; W37-C39 PolarHBondContact O-N 3.32Å; C39-F42 PolarHBondContact O-N 3.33Å; C39-W43 PolarHBondContact O-N 3.29Å
40	L	51.5	Low	44.8	Very low	109 Å²	109	117 Å²	117	57%	0.571	61%	0.614	S	S	*	*	H	α-helix	trans	-66.8	-38.6	174.8	-81.3	163.8	0	0	0	112	W37 W43 A44	W37-L40 PolarHBondContact O-N 3Å; L40-W43 PolarHBondContact O-N 3.02Å; L40-A44 WeakPolarHBondContact O-CB 3.34Å; L40-A44 PolarHBondContact O-N 3.32Å
41	L	50.5	Low	45.3	Very low	107 Å²	107	116.7 Å²	116.7	56%	0.56	60%	0.602	S	S	*	*	H	α-helix	trans	-64.2	-39.5	171.9	-79.5	163.7	0	0	0	112	W37 A44 V45	W37-L41 PolarHBondContact O-N 2.97Å; L41-A44 PolarHBondContact O-N 3.28Å; L41-V45 WeakPolarHBondContact O-CB 3.14Å; L41-V45 WeakPolarHBondContact O-CG2 3.13Å; L41-V45 PolarHBondContact O-N 3.24Å
42	F	48.1	Very low	45.9	Very low	147 Å²	147	111 Å²	111	65%	0.645	60%	0.596	S	S	*	*	H	α-helix	trans	-65.9	-39.9	177.8	-154.9	-99.1	0	0	0	112.3	K38 C39 L46	K38-F42 WeakPolarHBondContact O-CB 3.44Å; K38-F42 PolarHBondContact O-N 2.87Å; C39-F42 PolarHBondContact O-N 3.33Å; F42-L46 HydrophobicContact CD1-CD1 3.82Å; F42-L46 HydrophobicContact CE1-CD1 3.85Å; F42-L46 WeakPolarHBondContact O-CB 2.99Å; F42-L46 PolarHBondContact O-N 3.48Å
43	W	50.4	Low	46.1	Very low	155 Å²	155	109.7 Å²	109.7	59%	0.587	59%	0.589	S	S	*	*	H	α-helix	trans	-66.4	-40.5	172.3	-88.5	92.5	0	0	0	112.8	C39 L40 L46 V47	C39-W43 PolarHBondContact O-N 3.29Å; L40-W43 PolarHBondContact O-N 3.02Å; W43-L46 PolarHBondContact O-N 3.4Å; W43-V47 WeakPolarHBondContact O-CG2 3.4Å; W43-V47 PolarHBondContact O-N 2.72Å
44	A	51.5	Low	46.3	Very low	54 Å²	54	110.6 Å²	110.6	45%	0.446	59%	0.59	S	S	.	*	H	α-helix	trans	-62	-45.2	175.2	0	0	0	0	0	111.8	L40 L41 V47 T48	L40-A44 WeakPolarHBondContact O-CB 3.34Å; L40-A44 PolarHBondContact O-N 3.32Å; L41-A44 PolarHBondContact O-N 3.28Å; A44-V47 PolarHBondContact O-N 2.85Å; A44-T48 PolarHBondContact O-N 2.6Å; A44-T48 PolarHBondContact O-OG1 3.2Å
45	V	55.2	Low	46.1	Very low	90 Å²	90	112.9 Å²	112.9	55%	0.545	59%	0.588	S	S	.	*	H	α-helix	trans	-62.4	-42.3	176	170.3	0	0	0	0	111.3	L41 T48 A49	L41-V45 WeakPolarHBondContact O-CB 3.14Å; L41-V45 WeakPolarHBondContact O-CG2 3.13Å; L41-V45 PolarHBondContact O-N 3.24Å; V45-T48 WeakPolarHBondContact CA-OG1 3.48Å; V45-T48 PolarHBondContact O-N 3Å; V45-T48 PolarHBondContact O-OG1 2.77Å; V45-A49 WeakPolarHBondContact O-CB 3.39Å; V45-A49 PolarHBondContact O-N 3.37Å
46	L	48.9	Very low	46	Very low	81 Å²	81	109.7 Å²	109.7	42%	0.424	59%	0.592	S	S	.	*	H	α-helix	trans	-59.2	-46.9	175	-95.8	161	0	0	0	112.4	F42 W43 T48 A49 T50	F42-L46 HydrophobicContact CD1-CD1 3.82Å; F42-L46 HydrophobicContact CE1-CD1 3.85Å; F42-L46 WeakPolarHBondContact O-CB 2.99Å; F42-L46 PolarHBondContact O-N 3.48Å; W43-L46 PolarHBondContact O-N 3.4Å; L46-T48 VanDerWaalsContact C-N 3.34Å; L46-T48 PolarHBondContact O-N 2.85Å; L46-A49 PolarHBondContact O-N 2.77Å; L46-A49 VanDerWaalsContact O-N 3.17Å; L46-T50 PolarHBondContact O-N 2.94Å; L46-T50 PolarHBondContact O-OG1 2.87Å
47	V	51.4	Low	45	Very low	78 Å²	78	111 Å²	111	47%	0.473	60%	0.601	S	S	.	*	H	α-helix	trans	-61.6	-41.2	177.7	170.6	0	0	0	0	111.5	W43 A44 T50 L51	W43-V47 WeakPolarHBondContact O-CG2 3.4Å; W43-V47 PolarHBondContact O-N 2.72Å; A44-V47 PolarHBondContact O-N 2.85Å; V47-T50 PolarHBondContact O-OG1 2.87Å; V47-T50 VanDerWaalsContact O-OG1 3.08Å; V47-L51 HydrophobicContact CG1-CD1 4.33Å; V47-L51 PolarHBondContact O-N 2.85Å
48	T	47.8	Very low	44.3	Very low	84 Å²	84	109.2 Å²	109.2	52%	0.515	61%	0.611	S	S	.	*	H	α-helix	trans	-68	-36.1	173.9	51.4	0	0	0	0	113.1	A44 V45 L46 L51 C52	A44-T48 PolarHBondContact O-N 2.6Å; A44-T48 PolarHBondContact O-OG1 3.2Å; V45-T48 WeakPolarHBondContact CA-OG1 3.48Å; V45-T48 PolarHBondContact O-N 3Å; V45-T48 PolarHBondContact O-OG1 2.77Å; L46-T48 VanDerWaalsContact C-N 3.34Å; L46-T48 PolarHBondContact O-N 2.85Å; T48-L51 PolarHBondContact O-N 3.28Å; T48-C52 PolarHBondContact O-N 2.76Å; T48-C52 PolarHBondContact O-SG 3.02Å
49	A	43.7	Very low	43.5	Very low	49 Å²	49	106.8 Å²	106.8	41%	0.405	61%	0.611	S	S	.	*	H	α-helix	trans	-65.8	-44.4	177.7	0	0	0	0	0	111.7	V45 L46 L51 C52 T53	V45-A49 WeakPolarHBondContact O-CB 3.39Å; V45-A49 PolarHBondContact O-N 3.37Å; L46-A49 PolarHBondContact O-N 2.77Å; L46-A49 VanDerWaalsContact O-N 3.17Å; A49-L51 PolarHBondContact O-N 3.12Å; A49-C52 PolarHBondContact O-N 2.82Å; A49-C52 VanDerWaalsContact O-N 3.09Å; A49-T53 PolarHBondContact O-N 2.88Å
50	T	44.2	Very low	42.5	Very low	89 Å²	89	111.2 Å²	111.2	55%	0.546	63%	0.63	S	S	.	*	H	α-helix	trans	-67.6	-21	178	51.2	0	0	0	0	113.7	L46 V47	L46-T50 PolarHBondContact O-N 2.94Å; L46-T50 PolarHBondContact O-OG1 2.87Å; V47-T50 PolarHBondContact O-OG1 2.87Å; V47-T50 VanDerWaalsContact O-OG1 3.08Å
51	L	41.8	Very low	41.4	Very low	133 Å²	133	111.7 Å²	111.7	70%	0.696	64%	0.639	S	S	*	*	H	α-helix	trans	-83.2	-18.3	172.4	-77.8	166.2	0	0	0	113.5	V47 T48 A49	V47-L51 HydrophobicContact CG1-CD1 4.33Å; V47-L51 PolarHBondContact O-N 2.85Å; T48-L51 PolarHBondContact O-N 3.28Å; A49-L51 PolarHBondContact O-N 3.12Å
52	C	41	Very low	40.3	Very low	110 Å²	110	115.4 Å²	115.4	74%	0.743	65%	0.654	S	S	*	*	H	α-helix	trans	-94	-12.8	178.3	-69.8	0	0	0	0	114.4	T48 A49	T48-C52 PolarHBondContact O-N 2.76Å; T48-C52 PolarHBondContact O-SG 3.02Å; A49-C52 PolarHBondContact O-N 2.82Å; A49-C52 VanDerWaalsContact O-N 3.09Å
53	T	41.9	Very low	39.4	Very low	123 Å²	123	116.8 Å²	116.8	76%	0.755	66%	0.662	S	S	*	*	S	Bend	trans	-111.7	44.3	174	63.5	0	0	0	0	112.6	A49	A49-T53 PolarHBondContact O-N 2.88Å
54	A	34.8	Very low	38.3	Very low	75 Å²	75	113.9 Å²	113.9	62%	0.62	67%	0.672	S	S	*	*			trans	-124.5	51.2	174.6	0	0	0	0	0	111.3	P56	A54-P56 WeakPolarHBondContact O-CD 3.37Å
55	R	34.4	Very low	37.2	Very low	240 Å²	240	119 Å²	119	91%	0.906	69%	0.686	S	S	*	*	P	Polyproline II helix	trans	-83.9	120.4	161.6	-81.7	-172.9	173.9	-176.2	-2.4	108.7
56	P	35	Very low	36	Very low	119 Å²	119	120.2 Å²	120.2	77%	0.773	70%	0.696	S	S	*	*	P	Polyproline II helix	trans	-58.8	146.4	157.5	-18.7	32.4	0	0	0	109.8	A54	A54-P56 WeakPolarHBondContact O-CD 3.37Å
57	S	29.9	Very low	35.1	Very low	91 Å²	91	128.9 Å²	128.9	64%	0.636	72%	0.723	S	S	*	*	P	Polyproline II helix	trans	-59.7	153.2	161.7	-54.1	0	0	0	0	109.8	T59	S57-T59 PolarHBondContact O-N 2.91Å
58	P	31.1	Very low	34.2	Very low	132 Å²	132	128.1 Å²	128.1	86%	0.857	73%	0.731	S	S	*	*			trans	-72.4	74.4	164.3	32.6	-34.2	0	0	0	109.3
59	T	30.1	Very low	33.5	Very low	120 Å²	120	128.3 Å²	128.3	74%	0.736	74%	0.741	S	S	*	*			trans	-59.4	139.2	159	44.2	0	0	0	0	108.2	S57	S57-T59 PolarHBondContact O-N 2.91Å
60	L	29.2	Very low	33.3	Very low	149 Å²	149	131.8 Å²	131.8	78%	0.78	76%	0.759	S	S	*	*			trans	-54.5	156	165.4	-79.6	78.1	0	0	0	109.2	E62	L60-E62 VanDerWaalsContact C-N 3.27Å; L60-E62 PolarHBondContact O-N 2.8Å
61	P	29	Very low	33.7	Very low	119 Å²	119	132 Å²	132	77%	0.773	76%	0.761	S	S	*	*			trans	-64.9	90.3	171.3	28.3	-34.7	0	0	0	109.9	Q63	P61-Q63 PolarHBondContact O-N 2.78Å; P61-Q63 VanDerWaalsContact O-N 3.17Å
62	E	27.8	Very low	34.4	Very low	185 Å²	185	131.6 Å²	131.6	86%	0.864	76%	0.755	S	S	*	*			trans	-54.7	116.2	157.2	-174.1	176.6	159.4	0	0	106.7	L60 A64	L60-E62 VanDerWaalsContact C-N 3.27Å; L60-E62 PolarHBondContact O-N 2.8Å; E62-A64 PolarHBondContact O-N 3.25Å
63	Q	27.3	Very low	36	Very low	176 Å²	176	129.5 Å²	129.5	82%	0.822	74%	0.739	S	S	*	*			trans	-72.4	81.7	-173.2	-73.1	177	-66.8	0	0	110.5	P61 Q65	P61-Q63 PolarHBondContact O-N 2.78Å; P61-Q63 VanDerWaalsContact O-N 3.17Å; Q63-Q65 PolarHBondContact O-N 2.78Å
64	A	27.3	Very low	37.8	Very low	95 Å²	95	126.5 Å²	126.5	79%	0.785	72%	0.716	S	S	*	*			trans	-59.3	91.5	150.4	0	0	0	0	0	107.2	E62	E62-A64 PolarHBondContact O-N 3.25Å
65	Q	28.7	Very low	39.9	Very low	161 Å²	161	127.8 Å²	127.8	75%	0.752	72%	0.72	S	S	*	*			trans	-53.5	133.7	179.5	-72.9	-177.5	-56.9	0	0	109.2	Q63	Q63-Q65 PolarHBondContact O-N 2.78Å
66	P	30.6	Very low	41.9	Very low	115 Å²	115	119.6 Å²	119.6	75%	0.747	69%	0.691	S	S	*	*			trans	-51	143.7	155.5	-19.3	31.7	0	0	0	108	G68	P66-G68 WeakPolarHBondContact O-CA 3.37Å; P66-G68 PolarHBondContact O-N 2.91Å
67	W	29.5	Very low	43.9	Very low	264 Å²	264	117.1 Å²	117.1	100%	1	67%	0.671	S	S	*	*	S	Bend	trans	-54.5	109.1	176.7	-83.2	40.1	0	0	0	108.6
68	G	32.3	Very low	46.2	Very low	61 Å²	61	113.4 Å²	113.4	63%	0.629	65%	0.645	S	S	*	*	P	Polyproline II helix	trans	-65.6	149.3	-158.6	0	0	0	0	0	112.3	P66	P66-G68 WeakPolarHBondContact O-CA 3.37Å; P66-G68 PolarHBondContact O-N 2.91Å
69	A	34.2	Very low	48.4	Very low	89 Å²	89	110.3 Å²	110.3	74%	0.736	62%	0.619	S	S	*	*	P	Polyproline II helix	trans	-51.8	137.8	143.2	0	0	0	0	0	107.3	V71	A69-V71 PolarHBondContact O-N 3.43Å
70	P	38.1	Very low	50.9	Low	121 Å²	121	107.2 Å²	107.2	79%	0.786	60%	0.601	S	S	*	*	P	Polyproline II helix	trans	-56.5	129.5	178.2	24.8	-33.5	0	0	0	108.5	E72	P70-E72 PolarHBondContact O-N 3.44Å
71	V	54.5	Low	53.1	Low	95 Å²	95	102.1 Å²	102.1	58%	0.576	58%	0.584	S	S	*	*	P	Polyproline II helix	trans	-59.6	116.1	171.7	176.8	0	0	0	0	106.4	A69 V73 Y146	A69-V71 PolarHBondContact O-N 3.43Å; V71-V73 VanDerWaalsContact C-N 3.32Å; V71-V73 HydrophobicContact CG1-CG2 4.21Å; V71-V73 PolarHBondContact O-N 3.18Å; V71-Y146 HydrophobicContact CG1-CD2 3.56Å; V71-Y146 HydrophobicContact CG1-CE2 4.11Å; V71-Y146 HydrophobicContact CG1-CG 4.43Å
72	E	56.2	Low	55.5	Low	123 Å²	123	100.2 Å²	100.2	58%	0.575	57%	0.567	S	S	*	*			trans	-75.9	87.1	-175.2	-169.1	169.5	-102.8	0	0	108.7	P70 E74 R89	P70-E72 PolarHBondContact O-N 3.44Å; E72-E74 PolarHBondContact O-N 2.84Å; E72-R89 IonicContact OE2-CZ 2.73Å; E72-R89 IonicContact OE2-NH1 3.34Å; E72-R89 PolarHBondContact OE2-NH1 3.12Å; E72-R89 IonicContact OE2-NH2 3.95Å; E72-R89 PolarHBondContact OE2-NH2 2.89Å
73	V	73.8	Confident	58.2	Low	67 Å²	67	95.9 Å²	95.9	41%	0.406	55%	0.55	S	S	.	.			trans	-82.5	108.6	176.3	-175.2	0	0	0	0	108.5	V71 S75 L131 Y146	V71-V73 VanDerWaalsContact C-N 3.32Å; V71-V73 HydrophobicContact CG1-CG2 4.21Å; V71-V73 PolarHBondContact O-N 3.18Å; V73-S75 PolarHBondContact O-N 3.03Å; V73-L131 HydrophobicContact CG1-CD1 4.11Å; V73-Y146 WeakPolarHBondContact CA-O 3.43Å
74	E	79.1	Confident	61	Low	59 Å²	59	87.6 Å²	87.6	28%	0.276	51%	0.511	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-73	123	174.6	-67	-179.4	174.8	0	0	109.5	E72 F76 R89 Y146 F147 S148	E72-E74 PolarHBondContact O-N 2.84Å; E74-F76 HydrophobicContact CB-CD2 4.32Å; E74-F76 HydrophobicContact CB-CE2 3.78Å; E74-R89 IonicContact OE1-CZ 2.7Å; E74-R89 IonicContact OE1-NE 3.42Å; E74-R89 PolarHBondContact OE1-NE 2.84Å; E74-R89 IonicContact OE1-NH2 2.7Å; E74-R89 PolarHBondContact OE1-NH2 3.35Å; E74-Y146 PolarHBondContact N-O 2.86Å; E74-F147 HydrophobicContact CB-CD1 4.09Å; E74-F147 CarbonylContact O-C 3.45Å; E74-F147 VanDerWaalsContact O-CA 3.3Å; E74-F147 WeakPolarHBondContact O-CA 3.24Å; E74-F147 WeakPolarHBondContact OE2-CE1 3.34Å; E74-S148 PolarHBondContact O-N 3.09Å
75	S	79.4	Confident	64	Low	102 Å²	102	87.4 Å²	87.4	71%	0.713	49%	0.494	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-94.9	117.5	-178.6	60	0	0	0	0	111.3	V73 S148	V73-S75 PolarHBondContact O-N 3.03Å; S75-S148 WeakPolarHBondContact CA-O 3.31Å
76	F	77.7	Confident	66.8	Low	68 Å²	68	79.8 Å²	79.8	30%	0.298	46%	0.458	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-106	128.4	177.4	-76.3	-101.6	0	0	0	110.1	E74 L84 L86 F147 S148 V149 N150	E74-F76 HydrophobicContact CB-CD2 4.32Å; E74-F76 HydrophobicContact CB-CE2 3.78Å; F76-L84 HydrophobicContact CB-CD1 4.49Å; F76-L86 HydrophobicContact CD1-CD2 4.09Å; F76-L86 HydrophobicContact CD2-CD2 3.69Å; F76-L86 HydrophobicContact CE1-CD2 4.18Å; F76-L86 HydrophobicContact CE2-CD2 3.8Å; F76-L86 HydrophobicContact CG-CD2 3.85Å; F76-L86 HydrophobicContact CZ-CD2 4.05Å; F76-F147 HydrophobicContact CD2-CB 4.49Å; F76-F147 AromaticContact CE2-CD1 3.95Å; F76-F147 HydrophobicContact CE2-CD1 3.95Å; F76-S148 PolarHBondContact N-O 3.33Å; F76-V149 HydrophobicContact CB-CG2 4.26Å; F76-V149 WeakPolarHBondContact O-CA 3.21Å; F76-N150 PolarHBondContact O-N 3.09Å
77	L	76.6	Confident	69.5	Low	67 Å²	67	80.6 Å²	80.6	35%	0.351	45%	0.447	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-113.7	126.7	171.7	-175.8	79.8	0	0	0	107.5	N150 A154 P156	L77-N150 WeakPolarHBondContact CA-O 3.42Å; L77-N150 HydrophobicContact CD1-CB 4.24Å; L77-N150 VanDerWaalsContact CD1-ND2 3.3Å; L77-N150 WeakPolarHBondContact CD1-ND2 3.32Å; L77-A154 WeakPolarHBondContact CD2-O 3.36Å; L77-P156 HydrophobicContact CD2-CB 4.1Å; L77-P156 HydrophobicContact CD2-CG 3.84Å
78	V	77.4	Confident	72	Confident	14 Å²	14	68.3 Å²	68.3	9%	0.085	40%	0.401	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-135.1	146.1	-173.7	179.9	0	0	0	0	108.4	D82 L84 N150 V151 S152	V78-D82 HydrophobicContact CG1-CB 3.58Å; V78-L84 HydrophobicContact CG2-CB 4.43Å; V78-L84 HydrophobicContact CG2-CD1 3.87Å; V78-N150 PolarHBondContact N-O 3.23Å; V78-N150 VanDerWaalsContact N-O 3.14Å; V78-V151 HydrophobicContact CB-CG2 4.4Å; V78-V151 CarbonylContact O-C 3.56Å; V78-V151 VanDerWaalsContact O-CA 3.23Å; V78-V151 WeakPolarHBondContact O-CA 3.29Å; V78-S152 PolarHBondContact O-N 3.2Å
79	H	77.5	Confident	74	Confident	67 Å²	67	71.6 Å²	71.6	31%	0.31	39%	0.394	S	S	.	.			trans	-92.3	153.8	177.5	-59	-53.5	0	0	0	111.8	G81 D82 S152	H79-G81 PolarHBondContact O-N 2.96Å; H79-G81 VanDerWaalsContact O-N 3.15Å; H79-D82 WeakPolarHBondContact CB-OD2 3.31Å; H79-D82 IonicContact CD2-OD2 3.18Å; H79-D82 IonicContact CG-OD2 2.81Å; H79-D82 PolarHBondContact N-OD2 2.91Å; H79-D82 WeakPolarHBondContact O-CB 3.45Å; H79-D82 PolarHBondContact O-N 2.96Å; H79-S152 PolarHBondContact ND1-O 3.01Å
80	P	81.8	Confident	76	Confident	54 Å²	54	71 Å²	71	35%	0.351	38%	0.378	S	S	.	.	T	Hydrogen-bonded Turn	trans	-59	118.4	176.6	-25.6	36.6	0	0	0	111.9	S124 P126 V151 D153	P80-S124 CarbonylContact C-O 3.57Å; P80-S124 VanDerWaalsContact CA-O 3.26Å; P80-S124 WeakPolarHBondContact CA-O 3.34Å; P80-P126 HydrophobicContact CG-CG 4.19Å; P80-V151 HydrophobicContact CG-CG1 4.38Å; P80-D153 WeakPolarHBondContact CD-OD1 3.09Å; P80-D153 WeakPolarHBondContact CG-OD1 3.08Å
81	G	76.3	Confident	77.5	Confident	42 Å²	42	72.4 Å²	72.4	43%	0.433	37%	0.368	S	S	.	.	T	Hydrogen-bonded Turn	trans	108.2	-18.3	-174.5	0	0	0	0	0	115	H79 S124	H79-G81 PolarHBondContact O-N 2.96Å; H79-G81 VanDerWaalsContact O-N 3.15Å; G81-S124 PolarHBondContact N-O 3.25Å
82	D	79.1	Confident	78.3	Confident	79 Å²	79	76.7 Å²	76.7	42%	0.422	39%	0.388	S	S	.	.	S	Bend	trans	-76.3	160.8	-178	-73.2	-25.9	0	0	0	113.3	V78 H79 L84 S124	V78-D82 HydrophobicContact CG1-CB 3.58Å; H79-D82 WeakPolarHBondContact CB-OD2 3.31Å; H79-D82 IonicContact CD2-OD2 3.18Å; H79-D82 IonicContact CG-OD2 2.81Å; H79-D82 PolarHBondContact N-OD2 2.91Å; H79-D82 WeakPolarHBondContact O-CB 3.45Å; H79-D82 PolarHBondContact O-N 2.96Å; D82-L84 PolarHBondContact O-N 3.4Å; D82-S124 WeakPolarHBondContact O-CB 3.4Å; D82-S124 PolarHBondContact O-N 2.88Å; D82-S124 PolarHBondContact O-OG 3.46Å
83	L	84	Confident	79.1	Confident	95 Å²	95	73.6 Å²	73.6	50%	0.497	38%	0.375	S	S	.	.			trans	-78.8	112.9	169.2	176.5	66.7	0	0	0	110.4	E120 Q122	L83-E120 HydrophobicContact CD1-CB 4.29Å; L83-Q122 HydrophobicContact CD1-CG 3.86Å
84	L	86.8	Confident	79.4	Confident	2 Å²	2	72.1 Å²	72.1	1%	0.01	37%	0.366	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-83.2	124.9	165.7	168	70.9	0	0	0	108.9	F76 V78 D82 L86 E120 V121 S124 Y132 V149	F76-L84 HydrophobicContact CB-CD1 4.49Å; V78-L84 HydrophobicContact CG2-CB 4.43Å; V78-L84 HydrophobicContact CG2-CD1 3.87Å; D82-L84 PolarHBondContact O-N 3.4Å; L84-L86 HydrophobicContact CD1-CD2 3.99Å; L84-L86 HydrophobicContact CD1-CG 4.06Å; L84-L86 HydrophobicContact CG-CG 4.36Å; L84-E120 CarbonylContact O-C 3.54Å; L84-E120 WeakPolarHBondContact O-CA 3.47Å; L84-V121 HydrophobicContact CB-CB 4.19Å; L84-V121 HydrophobicContact CD2-CB 4.24Å; L84-V121 HydrophobicContact CD2-CG2 4.06Å; L84-V121 PolarHBondContact N-O 3.07Å; L84-V121 PolarHBondContact O-N 3.21Å; L84-S124 WeakPolarHBondContact CB-OG 3.44Å; L84-S124 PolarHBondContact N-OG 2.94Å; L84-Y132 HydrophobicContact CD2-CE2 4.42Å; L84-V149 HydrophobicContact CD1-CG1 3.95Å; L84-V149 HydrophobicContact CD1-CG2 3.97Å; L84-V149 HydrophobicContact CD2-CG1 3.87Å; L84-V149 HydrophobicContact CD2-CG2 4.2Å
85	Q	89.5	Confident	79.4	Confident	90 Å²	90	76.7 Å²	76.7	42%	0.421	39%	0.387	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-127.2	127	172	-171.4	175.6	6.5	0	0	109.7	E118 V119 E120	Q85-E118 PolarHBondContact NE2-OE2 2.92Å; Q85-V119 WeakPolarHBondContact CA-O 3.44Å; Q85-E120 HydrophobicContact CG-CG 4.18Å
86	L	88.4	Confident	79.5	Confident	1 Å²	1	74.4 Å²	74.4	1%	0.005	37%	0.371	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-122.2	134.9	178.9	-61.6	176.5	0	0	0	109.5	F76 L84 W99 E118 V119 Y132 F147 V149	F76-L86 HydrophobicContact CD1-CD2 4.09Å; F76-L86 HydrophobicContact CD2-CD2 3.69Å; F76-L86 HydrophobicContact CE1-CD2 4.18Å; F76-L86 HydrophobicContact CE2-CD2 3.8Å; F76-L86 HydrophobicContact CG-CD2 3.85Å; F76-L86 HydrophobicContact CZ-CD2 4.05Å; L84-L86 HydrophobicContact CD1-CD2 3.99Å; L84-L86 HydrophobicContact CD1-CG 4.06Å; L84-L86 HydrophobicContact CG-CG 4.36Å; L86-W99 HydrophobicContact CB-CH2 3.84Å; L86-W99 HydrophobicContact CB-CZ3 4.08Å; L86-W99 HydrophobicContact CD1-CZ3 4.34Å; L86-E118 CarbonylContact O-C 3.31Å; L86-E118 WeakPolarHBondContact O-CA 3.43Å; L86-V119 PolarHBondContact N-O 3.24Å; L86-V119 PolarHBondContact O-N 2.88Å; L86-Y132 HydrophobicContact CD1-CD1 3.8Å; L86-Y132 HydrophobicContact CD1-CD2 4.13Å; L86-Y132 HydrophobicContact CD1-CE1 4.43Å; L86-Y132 HydrophobicContact CD1-CG 3.62Å; L86-F147 HydrophobicContact CD1-CB 4.17Å; L86-F147 HydrophobicContact CD1-CG 4.41Å; L86-F147 HydrophobicContact CD2-CB 4Å; L86-F147 HydrophobicContact CD2-CD1 4.18Å; L86-F147 HydrophobicContact CD2-CG 4.16Å; L86-V149 HydrophobicContact CD1-CG2 4.01Å; L86-V149 HydrophobicContact CD2-CG2 4.26Å
87	R	86.6	Confident	80	Confident	133 Å²	133	73.3 Å²	73.3	50%	0.502	37%	0.368	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-120.1	133.9	178.7	-171.5	172	-162.8	139	-4.6	112.2	E117 E118 F147	R87-E117 IonicContact CZ-OE1 3.85Å; R87-E117 IonicContact CZ-OE2 3.29Å; R87-E117 VanDerWaalsContact CZ-OE2 3.29Å; R87-E117 IonicContact NE-OE2 2.74Å; R87-E117 PolarHBondContact NE-OE2 3.29Å; R87-E117 IonicContact NH2-OE1 3.02Å; R87-E117 PolarHBondContact NH2-OE1 3.22Å; R87-E117 IonicContact NH2-OE2 2.67Å; R87-E117 PolarHBondContact NH2-OE2 3.33Å; R87-E118 HydrophobicContact CB-CG 3.74Å; R87-E118 WeakPolarHBondContact CD-OE1 3.46Å; R87-E118 HydrophobicContact CG-CG 3.61Å; R87-E118 IonicContact CZ-OE1 3.23Å; R87-E118 VanDerWaalsContact CZ-OE1 3.23Å; R87-E118 IonicContact NE-OE1 3.73Å; R87-E118 PolarHBondContact NE-OE1 2.87Å; R87-E118 IonicContact NH1-OE1 2.67Å; R87-E118 PolarHBondContact NH1-OE1 3.37Å; R87-F147 WeakPolarHBondContact O-CE1 3.15Å; R87-F147 WeakPolarHBondContact O-CZ 3.48Å
88	C	82.9	Confident	80.5	Confident	5 Å²	5	73.2 Å²	73.2	3%	0.034	37%	0.368	C	S	.	.			trans	-80.4	138.5	176.3	-163.2	0	0	0	0	112	L90 W99 E117 C134 T136	C88-L90 HydrophobicContact CB-CD2 4.2Å; C88-L90 PolarHBondContact O-N 3.19Å; C88-W99 HydrophobicContact CB-CH2 4.37Å; C88-W99 HydrophobicContact CB-CZ2 3.74Å; C88-E117 WeakPolarHBondContact CB-O 3.39Å; C88-E117 PolarHBondContact N-O 3.29Å; C88-C134 HydrophobicContact CB-CB 3.74Å; C88-C134 WeakPolarHBondContact CB-SG 3.49Å; C88-C134 WeakPolarHBondContact SG-CB 3.44Å; C88-C134 CovalentContact SG-SG 2.03Å; C88-C134 PolarHBondContact SG-SG 3.49Å; C88-T136 VanDerWaalsContact SG-CG2 3.53Å
89	R	74.3	Confident	81.1	Confident	130 Å²	130	72.9 Å²	72.9	49%	0.491	37%	0.366	S	S	.	.			trans	-79.7	108.3	172.8	-62.2	-177.9	-175.9	180	1.8	109.2	E72 E74	E72-R89 IonicContact OE2-CZ 2.73Å; E72-R89 IonicContact OE2-NH1 3.34Å; E72-R89 PolarHBondContact OE2-NH1 3.12Å; E72-R89 IonicContact OE2-NH2 3.95Å; E72-R89 PolarHBondContact OE2-NH2 2.89Å; E74-R89 IonicContact OE1-CZ 2.7Å; E74-R89 IonicContact OE1-NE 3.42Å; E74-R89 PolarHBondContact OE1-NE 2.84Å; E74-R89 IonicContact OE1-NH2 2.7Å; E74-R89 PolarHBondContact OE1-NH2 3.35Å
90	L	76.3	Confident	81.6	Confident	77 Å²	77	71.7 Å²	71.7	40%	0.403	36%	0.361	S	S	.	.			trans	-93.2	158.3	-177.9	-58.1	-172.9	0	0	0	113.1	C88 I97 E117 T136	C88-L90 HydrophobicContact CB-CD2 4.2Å; C88-L90 PolarHBondContact O-N 3.19Å; L90-I97 HydrophobicContact CD1-CD1 4.05Å; L90-I97 HydrophobicContact CD2-CD1 3.69Å; L90-I97 HydrophobicContact CD2-CG1 4.12Å; L90-E117 HydrophobicContact CD1-CB 3.86Å; L90-T136 HydrophobicContact CD2-CG2 3.79Å
91	R	70.3	Confident	81.9	Confident	150 Å²	150	72 Å²	72	57%	0.566	36%	0.355	S	S	*	.			trans	-118	158.7	169.3	-55.9	-179.6	-173.8	-134	4.5	109.1	D93 V94 D143	R91-D93 PolarHBondContact O-N 2.82Å; R91-V94 HydrophobicContact CB-CG2 4.23Å; R91-V94 WeakPolarHBondContact O-CG2 3.49Å; R91-V94 PolarHBondContact O-N 2.68Å; R91-D143 IonicContact CZ-OD2 3.16Å; R91-D143 IonicContact NE-OD2 3.69Å; R91-D143 PolarHBondContact NE-OD2 3.03Å; R91-D143 IonicContact NH2-OD2 2.86Å; R91-D143 PolarHBondContact NH2-OD2 3.27Å
92	D	70.9	Confident	82.3	Confident	186 Å²	186	74.9 Å²	74.9	100%	0.995	36%	0.361	S	S	*	.	T	Hydrogen-bonded Turn	trans	-64.2	-11.4	-175.1	-54.6	-55.7	0	0	0	114.9
93	D	73.3	Confident	82.2	Confident	57 Å²	57	74.2 Å²	74.2	31%	0.305	37%	0.372	S	S	.	.	T	Hydrogen-bonded Turn	trans	-109.5	6.4	-177.1	73.4	-35.5	0	0	0	115.1	R91 Q95 S138 P139 S140	R91-D93 PolarHBondContact O-N 2.82Å; D93-Q95 PolarHBondContact O-N 3.33Å; D93-S138 VanDerWaalsContact CG-CB 3.46Å; D93-S138 VanDerWaalsContact O-CB 3.25Å; D93-S138 WeakPolarHBondContact O-CB 3.06Å; D93-S138 VanDerWaalsContact OD2-CB 3.26Å; D93-S138 WeakPolarHBondContact OD2-CB 3.5Å; D93-S138 PolarHBondContact OD2-OG 2.74Å; D93-P139 VanDerWaalsContact O-CD 3.24Å; D93-P139 WeakPolarHBondContact O-CD 3.42Å; D93-S140 WeakPolarHBondContact OD2-CB 3.47Å; D93-S140 PolarHBondContact OD2-OG 3.38Å
94	V	79.2	Confident	82.2	Confident	37 Å²	37	74.7 Å²	74.7	22%	0.224	38%	0.379	C	S	.	.			trans	-66.1	130.2	-178.5	175.8	0	0	0	0	111.9	R91 S96 I97 T136	R91-V94 HydrophobicContact CB-CG2 4.23Å; R91-V94 WeakPolarHBondContact O-CG2 3.49Å; R91-V94 PolarHBondContact O-N 2.68Å; V94-S96 WeakPolarHBondContact CG1-O 3.25Å; V94-I97 HydrophobicContact CG1-CG1 3.92Å; V94-T136 HydrophobicContact CG1-CG2 4.32Å; V94-T136 HydrophobicContact CG2-CG2 4.47Å
95	Q	79.4	Confident	82.1	Confident	154 Å²	154	80.9 Å²	80.9	72%	0.72	41%	0.408	S	S	*	.			trans	-106.7	-26.4	179.7	-67.8	-172.4	-13.7	0	0	114	D93 S137 P139	D93-Q95 PolarHBondContact O-N 3.33Å; Q95-S137 PolarHBondContact N-O 3.04Å; Q95-P139 HydrophobicContact CG-CG 4.46Å
96	S	80.7	Confident	82	Confident	54 Å²	54	77.8 Å²	77.8	38%	0.378	39%	0.394	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-152.6	155.1	173.5	65.6	0	0	0	0	112.1	V94 T136 S137	V94-S96 WeakPolarHBondContact CG1-O 3.25Å; S96-T136 WeakPolarHBondContact O-CA 3.46Å; S96-S137 PolarHBondContact N-O 3.29Å; S96-S137 PolarHBondContact O-N 3.16Å; S96-S137 WeakPolarHBondContact OG-CB 3.32Å
97	I	87.8	Confident	81.6	Confident	45 Å²	45	81.2 Å²	81.2	23%	0.231	42%	0.422	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-132.2	130.4	-177.9	-48.3	165.5	0	0	0	107.6	L90 V94 G116 E117 C134 V135 T136	L90-I97 HydrophobicContact CD1-CD1 4.05Å; L90-I97 HydrophobicContact CD2-CD1 3.69Å; L90-I97 HydrophobicContact CD2-CG1 4.12Å; V94-I97 HydrophobicContact CG1-CG1 3.92Å; I97-G116 VanDerWaalsContact CG2-O 3.22Å; I97-G116 WeakPolarHBondContact CG2-O 3.42Å; I97-E117 HydrophobicContact CD1-CB 4.32Å; I97-C134 WeakPolarHBondContact CG2-SG 3.22Å; I97-V135 WeakPolarHBondContact CA-O 3.3Å; I97-T136 HydrophobicContact CG1-CG2 4.37Å; I97-T136 HydrophobicContact CG2-CG2 4.26Å
98	N	87.3	Confident	81.5	Confident	66 Å²	66	81 Å²	81	35%	0.353	43%	0.427	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-127.9	131.2	175.9	-67.5	-74.8	0	0	0	110.1	V135	N98-V135 PolarHBondContact N-O 3.32Å; N98-V135 PolarHBondContact O-N 2.71Å
99	W	90.9	Very high	81.4	Confident	7 Å²	7	83.6 Å²	83.6	3%	0.027	45%	0.446	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-101.6	140.7	175.7	-74.8	91.4	0	0	0	111.7	L86 C88 L106 I114 G116 V119 A133 C134 F147	L86-W99 HydrophobicContact CB-CH2 3.84Å; L86-W99 HydrophobicContact CB-CZ3 4.08Å; L86-W99 HydrophobicContact CD1-CZ3 4.34Å; C88-W99 HydrophobicContact CB-CH2 4.37Å; C88-W99 HydrophobicContact CB-CZ2 3.74Å; W99-L106 HydrophobicContact CB-CB 4.28Å; W99-L106 PolarHBondContact O-N 3.21Å; W99-I114 HydrophobicContact CG-CG2 4.47Å; W99-G116 PolarHBondContact NE1-O 3.38Å; W99-V119 HydrophobicContact CB-CG2 3.98Å; W99-V119 HydrophobicContact CD2-CB 4.44Å; W99-V119 HydrophobicContact CD2-CG2 3.33Å; W99-V119 HydrophobicContact CE3-CG2 3.77Å; W99-V119 HydrophobicContact CG-CG2 3.43Å; W99-V119 VanDerWaalsContact CG-CG2 3.43Å; W99-V119 HydrophobicContact CH2-CG2 4.48Å; W99-V119 HydrophobicContact CZ2-CG2 4.14Å; W99-V119 HydrophobicContact CZ3-CG2 4.32Å; W99-A133 CarbonylContact C-O 3.52Å; W99-A133 WeakPolarHBondContact CA-O 3.42Å; W99-C134 HydrophobicContact CD2-CB 3.93Å; W99-C134 HydrophobicContact CE3-CB 3.9Å; W99-C134 HydrophobicContact CH2-CB 3.86Å; W99-C134 HydrophobicContact CZ2-CB 3.86Å; W99-C134 HydrophobicContact CZ3-CB 3.87Å; W99-F147 HydrophobicContact CH2-CD2 4.13Å; W99-F147 AromaticContact CH2-CE2 3.5Å; W99-F147 HydrophobicContact CH2-CE2 3.5Å; W99-F147 VanDerWaalsContact CH2-CE2 3.5Å; W99-F147 AromaticContact CH2-CZ 3.96Å; W99-F147 HydrophobicContact CH2-CZ 3.96Å; W99-F147 AromaticContact CZ3-CD2 3.68Å; W99-F147 HydrophobicContact CZ3-CD2 3.68Å; W99-F147 AromaticContact CZ3-CE2 3.44Å; W99-F147 HydrophobicContact CZ3-CE2 3.44Å; W99-F147 VanDerWaalsContact CZ3-CE2 3.44Å; W99-F147 HydrophobicContact CZ3-CZ 4.33Å
100	L	88.1	Confident	81.6	Confident	41 Å²	41	85.7 Å²	85.7	22%	0.215	47%	0.466	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-130.4	154.2	175.4	-55.6	94.9	0	0	0	110.2	V104 Y132 A133 V135	L100-V104 CarbonylContact C-O 3.6Å; L100-V104 WeakPolarHBondContact CA-O 3.49Å; L100-V104 WeakPolarHBondContact CB-O 3.49Å; L100-Y132 CarbonylContact O-C 3.49Å; L100-Y132 VanDerWaalsContact O-CA 3.28Å; L100-Y132 WeakPolarHBondContact O-CA 3.18Å; L100-A133 PolarHBondContact N-O 3.1Å; L100-A133 PolarHBondContact O-N 3.1Å; L100-V135 HydrophobicContact CD1-CB 4.42Å; L100-V135 HydrophobicContact CD1-CG2 3.58Å
101	R	88.6	Confident	82	Confident	62 Å²	62	85.6 Å²	85.6	23%	0.234	46%	0.461	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-127	124.6	166.3	-176	170.8	88.2	-176.3	12.2	108.6	G103 V104 L106 A127 D128 Y132	R101-G103 PolarHBondContact O-N 2.8Å; R101-G103 VanDerWaalsContact O-N 3.1Å; R101-V104 PolarHBondContact N-O 2.82Å; R101-V104 PolarHBondContact O-N 3.13Å; R101-L106 HydrophobicContact CB-CD1 4.13Å; R101-A127 PolarHBondContact NH2-O 2.91Å; R101-D128 IonicContact CZ-OD1 3.64Å; R101-D128 IonicContact NH1-OD1 3.28Å; R101-D128 PolarHBondContact NH1-OD1 3.22Å; R101-D128 IonicContact NH2-OD1 2.74Å; R101-Y132 HydrophobicContact CB-CD1 4.21Å; R101-Y132 HydrophobicContact CB-CE1 4.21Å; R101-Y132 WeakPolarHBondContact CD-OH 3.47Å; R101-Y132 HydrophobicContact CG-CD1 4.37Å; R101-Y132 HydrophobicContact CG-CD2 4.21Å; R101-Y132 HydrophobicContact CG-CE1 4.16Å; R101-Y132 HydrophobicContact CG-CE2 3.98Å; R101-Y132 HydrophobicContact CG-CG 4.4Å; R101-Y132 PolarHBondContact NH1-OH 2.86Å
102	D	83.7	Confident	82.7	Confident	101 Å²	101	79 Å²	79	54%	0.54	44%	0.437	S	S	.	.	T	Hydrogen-bonded Turn	trans	51.3	33.3	-177.4	-54.7	-57.3	0	0	0	113.7	G130 L131	D102-G130 WeakPolarHBondContact OD1-CA 3.19Å; D102-L131 PolarHBondContact N-O 3.03Å; D102-L131 PolarHBondContact OD1-N 3.47Å
103	G	77.7	Confident	83.4	Confident	65 Å²	65	76.3 Å²	76.3	67%	0.67	41%	0.413	S	S	*	.	T	Hydrogen-bonded Turn	trans	84.2	-1.1	-178.8	0	0	0	0	0	115.7	R101	R101-G103 PolarHBondContact O-N 2.8Å; R101-G103 VanDerWaalsContact O-N 3.1Å
104	V	83.6	Confident	84	Confident	105 Å²	105	75.4 Å²	75.4	64%	0.636	41%	0.408	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-99.1	136.8	174.1	-175.8	0	0	0	0	109.5	L100 R101 L106	L100-V104 CarbonylContact C-O 3.6Å; L100-V104 WeakPolarHBondContact CA-O 3.49Å; L100-V104 WeakPolarHBondContact CB-O 3.49Å; R101-V104 PolarHBondContact N-O 2.82Å; R101-V104 PolarHBondContact O-N 3.13Å; V104-L106 PolarHBondContact O-N 3.37Å
105	Q	85.5	Confident	84	Confident	132 Å²	132	77.2 Å²	77.2	62%	0.617	42%	0.419	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-59.5	128	177.1	-172.9	173.2	13.1	0	0	110.8
106	L	86.2	Confident	83.9	Confident	26 Å²	26	71.2 Å²	71.2	14%	0.136	40%	0.398	C	S	.	.	P	Polyproline II helix	trans	-75.8	132.1	-179.7	-167.7	69.3	0	0	0	109.4	W99 R101 V104 T112 I114 V119 Y132	W99-L106 HydrophobicContact CB-CB 4.28Å; W99-L106 PolarHBondContact O-N 3.21Å; R101-L106 HydrophobicContact CB-CD1 4.13Å; V104-L106 PolarHBondContact O-N 3.37Å; L106-T112 HydrophobicContact CD2-CG2 4.1Å; L106-T112 HydrophobicContact CG-CG2 4.3Å; L106-I114 HydrophobicContact CB-CD1 4.08Å; L106-I114 HydrophobicContact CD2-CD1 3.98Å; L106-I114 HydrophobicContact CD2-CG1 4.41Å; L106-I114 HydrophobicContact CG-CD1 3.9Å; L106-I114 WeakPolarHBondContact O-CD1 3.43Å; L106-V119 HydrophobicContact CD2-CB 4.48Å; L106-V119 HydrophobicContact CD2-CG1 3.58Å; L106-V119 HydrophobicContact CD2-CG2 4Å; L106-Y132 HydrophobicContact CD1-CE1 4.43Å; L106-Y132 HydrophobicContact CD2-CD1 4.3Å; L106-Y132 HydrophobicContact CD2-CE1 4.08Å
107	A	81.1	Confident	83.9	Confident	72 Å²	72	72 Å²	72	60%	0.595	40%	0.396	S	S	*	.			trans	-110.6	148.5	178.3	0	0	0	0	0	110.6
108	E	82.9	Confident	83.9	Confident	128 Å²	128	71 Å²	71	60%	0.598	39%	0.39	S	S	*	.			trans	-65.6	146	173.8	-61.3	-158.6	112.6	0	0	111.5	T112 I114	E108-T112 CarbonylContact C-O 3.36Å; E108-T112 VanDerWaalsContact CA-O 3.3Å; E108-T112 WeakPolarHBondContact CA-O 3.36Å; E108-I114 HydrophobicContact CG-CB 4.11Å; E108-I114 HydrophobicContact CG-CD1 4.16Å; E108-I114 HydrophobicContact CG-CG1 3.99Å; E108-I114 PolarHBondContact OE1-N 3.23Å
109	S	81.9	Confident	84	Confident	61 Å²	61	67.9 Å²	67.9	43%	0.427	37%	0.374	S	S	.	.	B	Isolated β-bridge	trans	-147.2	171	-178.2	89.8	0	0	0	0	110.4	R111 T112	S109-R111 PolarHBondContact O-N 2.89Å; S109-R111 PolarHBondContact OG-N 3.06Å; S109-R111 VanDerWaalsContact OG-N 3.14Å; S109-T112 PolarHBondContact N-O 2.57Å; S109-T112 PolarHBondContact O-N 2.94Å; S109-T112 VanDerWaalsContact O-O 3.07Å; S109-T112 WeakPolarHBondContact OG-CB 3.44Å; S109-T112 PolarHBondContact OG-N 2.99Å; S109-T112 VanDerWaalsContact OG-N 3.09Å; S109-T112 PolarHBondContact OG-OG1 2.87Å
110	N	78	Confident	83.9	Confident	173 Å²	173	68.6 Å²	68.6	93%	0.925	38%	0.377	S	S	*	.	T	Hydrogen-bonded Turn	trans	-58.6	-15.5	175.3	-64.8	5.1	0	0	0	114
111	R	84.7	Confident	84.1	Confident	76 Å²	76	66.7 Å²	66.7	29%	0.287	37%	0.367	S	S	.	.	T	Hydrogen-bonded Turn	trans	-110.7	-11.3	171.5	-67.1	-167.7	-52.8	117.2	9.9	113.8	S109 V121 Q122 D123 D128	S109-R111 PolarHBondContact O-N 2.89Å; S109-R111 PolarHBondContact OG-N 3.06Å; S109-R111 VanDerWaalsContact OG-N 3.14Å; R111-V121 CarbonylContact O-C 3.57Å; R111-V121 VanDerWaalsContact O-CA 3.29Å; R111-V121 WeakPolarHBondContact O-CA 3.38Å; R111-Q122 WeakPolarHBondContact CD-O 3.37Å; R111-Q122 PolarHBondContact NH1-O 3.5Å; R111-Q122 PolarHBondContact O-N 2.88Å; R111-D123 PolarHBondContact NH1-O 3.4Å; R111-D128 IonicContact CZ-OD2 3.41Å; R111-D128 VanDerWaalsContact CZ-OD2 3.23Å; R111-D128 IonicContact NH1-OD2 2.76Å; R111-D128 PolarHBondContact NH1-OD2 3.03Å; R111-D128 IonicContact NH2-OD1 3.23Å; R111-D128 PolarHBondContact NH2-OD1 3.26Å; R111-D128 IonicContact NH2-OD2 3.25Å; R111-D128 PolarHBondContact NH2-OD2 3.45Å
112	T	84.4	Confident	83.8	Confident	10 Å²	10	68.5 Å²	68.5	6%	0.061	38%	0.379	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-125.5	116.3	-166.4	-48.7	0	0	0	0	111.1	L106 E108 S109 E120 V121	L106-T112 HydrophobicContact CD2-CG2 4.1Å; L106-T112 HydrophobicContact CG-CG2 4.3Å; E108-T112 CarbonylContact C-O 3.36Å; E108-T112 VanDerWaalsContact CA-O 3.3Å; E108-T112 WeakPolarHBondContact CA-O 3.36Å; S109-T112 PolarHBondContact N-O 2.57Å; S109-T112 PolarHBondContact O-N 2.94Å; S109-T112 VanDerWaalsContact O-O 3.07Å; S109-T112 WeakPolarHBondContact OG-CB 3.44Å; S109-T112 PolarHBondContact OG-N 2.99Å; S109-T112 VanDerWaalsContact OG-N 3.09Å; S109-T112 PolarHBondContact OG-OG1 2.87Å; T112-E120 VanDerWaalsContact CA-O 3.32Å; T112-E120 WeakPolarHBondContact CA-O 3.25Å; T112-V121 HydrophobicContact CG2-CG2 4.13Å
113	R	86.4	Confident	83.7	Confident	131 Å²	131	68.9 Å²	68.9	49%	0.494	38%	0.38	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-116.7	138.4	-179.4	-176.4	169.6	67.8	160.2	2.1	110.3	T115 V119 E120	R113-T115 HydrophobicContact CG-CG2 4.35Å; R113-V119 WeakPolarHBondContact O-CA 3.47Å; R113-E120 HydrophobicContact CB-CB 4.46Å; R113-E120 IonicContact CZ-OE1 3.64Å; R113-E120 IonicContact CZ-OE2 3.06Å; R113-E120 PolarHBondContact N-O 2.97Å; R113-E120 IonicContact NE-OE1 3.81Å; R113-E120 IonicContact NE-OE2 2.76Å; R113-E120 PolarHBondContact NE-OE2 3.47Å; R113-E120 IonicContact NH2-OE1 2.74Å; R113-E120 PolarHBondContact NH2-OE1 2.97Å; R113-E120 IonicContact NH2-OE2 2.66Å; R113-E120 PolarHBondContact NH2-OE2 3.48Å; R113-E120 PolarHBondContact O-N 3.01Å
114	I	86.7	Confident	84.1	Confident	38 Å²	38	65.8 Å²	65.8	20%	0.195	35%	0.348	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-128.3	98	-174.7	-51.8	177.1	0	0	0	109.5	W99 L106 E108 G116 V119	W99-I114 HydrophobicContact CG-CG2 4.47Å; L106-I114 HydrophobicContact CB-CD1 4.08Å; L106-I114 HydrophobicContact CD2-CD1 3.98Å; L106-I114 HydrophobicContact CD2-CG1 4.41Å; L106-I114 HydrophobicContact CG-CD1 3.9Å; L106-I114 WeakPolarHBondContact O-CD1 3.43Å; E108-I114 HydrophobicContact CG-CB 4.11Å; E108-I114 HydrophobicContact CG-CD1 4.16Å; E108-I114 HydrophobicContact CG-CG1 3.99Å; E108-I114 PolarHBondContact OE1-N 3.23Å; I114-G116 PolarHBondContact O-N 2.88Å; I114-V119 HydrophobicContact CG1-CG2 4.23Å; I114-V119 HydrophobicContact CG2-CG2 4.13Å
115	T	77.8	Confident	84.1	Confident	75 Å²	75	63.6 Å²	63.6	46%	0.46	34%	0.335	S	S	.	.			trans	-87.2	24	-177.5	52.6	0	0	0	0	112.9	R113 E117 E118	R113-T115 HydrophobicContact CG-CG2 4.35Å; T115-E117 PolarHBondContact O-N 3.38Å; T115-E118 PolarHBondContact N-O 3.14Å; T115-E118 WeakPolarHBondContact OG1-CB 3.37Å; T115-E118 PolarHBondContact OG1-O 2.83Å
116	G	77.8	Confident	83.9	Confident	28 Å²	28	61 Å²	61	29%	0.289	33%	0.33	S	S	.	.	S	Bend	trans	76.7	-66.9	-175.2	0	0	0	0	0	112	I97 W99 I114	I97-G116 VanDerWaalsContact CG2-O 3.22Å; I97-G116 WeakPolarHBondContact CG2-O 3.42Å; W99-G116 PolarHBondContact NE1-O 3.38Å; I114-G116 PolarHBondContact O-N 2.88Å
117	E	81.3	Confident	83.7	Confident	69 Å²	69	63.4 Å²	63.4	32%	0.322	35%	0.353	S	S	.	.	S	Bend	trans	-79.4	-21.8	178.9	68.1	166.1	156.4	0	0	114.3	R87 C88 L90 I97 T115	R87-E117 IonicContact CZ-OE1 3.85Å; R87-E117 IonicContact CZ-OE2 3.29Å; R87-E117 VanDerWaalsContact CZ-OE2 3.29Å; R87-E117 IonicContact NE-OE2 2.74Å; R87-E117 PolarHBondContact NE-OE2 3.29Å; R87-E117 IonicContact NH2-OE1 3.02Å; R87-E117 PolarHBondContact NH2-OE1 3.22Å; R87-E117 IonicContact NH2-OE2 2.67Å; R87-E117 PolarHBondContact NH2-OE2 3.33Å; C88-E117 WeakPolarHBondContact CB-O 3.39Å; C88-E117 PolarHBondContact N-O 3.29Å; L90-E117 HydrophobicContact CD1-CB 3.86Å; I97-E117 HydrophobicContact CD1-CB 4.32Å; T115-E117 PolarHBondContact O-N 3.38Å
118	E	87.1	Confident	83.9	Confident	25 Å²	25	60.3 Å²	60.3	12%	0.117	33%	0.327	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-129.1	155.8	178.7	-70.5	177.5	-177.6	0	0	112.8	Q85 L86 R87 T115	Q85-E118 PolarHBondContact NE2-OE2 2.92Å; L86-E118 CarbonylContact O-C 3.31Å; L86-E118 WeakPolarHBondContact O-CA 3.43Å; R87-E118 HydrophobicContact CB-CG 3.74Å; R87-E118 WeakPolarHBondContact CD-OE1 3.46Å; R87-E118 HydrophobicContact CG-CG 3.61Å; R87-E118 IonicContact CZ-OE1 3.23Å; R87-E118 VanDerWaalsContact CZ-OE1 3.23Å; R87-E118 IonicContact NE-OE1 3.73Å; R87-E118 PolarHBondContact NE-OE1 2.87Å; R87-E118 IonicContact NH1-OE1 2.67Å; R87-E118 PolarHBondContact NH1-OE1 3.37Å; T115-E118 PolarHBondContact N-O 3.14Å; T115-E118 WeakPolarHBondContact OG1-CB 3.37Å; T115-E118 PolarHBondContact OG1-O 2.83Å
119	V	90.3	Very high	84.1	Confident	0 Å²	0	55.9 Å²	55.9	0%	0	31%	0.31	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-123.2	129.5	169	169.9	0	0	0	0	108.3	Q85 L86 W99 L106 R113 I114 V121	Q85-V119 WeakPolarHBondContact CA-O 3.44Å; L86-V119 PolarHBondContact N-O 3.24Å; L86-V119 PolarHBondContact O-N 2.88Å; W99-V119 HydrophobicContact CB-CG2 3.98Å; W99-V119 HydrophobicContact CD2-CB 4.44Å; W99-V119 HydrophobicContact CD2-CG2 3.33Å; W99-V119 HydrophobicContact CE3-CG2 3.77Å; W99-V119 HydrophobicContact CG-CG2 3.43Å; W99-V119 VanDerWaalsContact CG-CG2 3.43Å; W99-V119 HydrophobicContact CH2-CG2 4.48Å; W99-V119 HydrophobicContact CZ2-CG2 4.14Å; W99-V119 HydrophobicContact CZ3-CG2 4.32Å; L106-V119 HydrophobicContact CD2-CB 4.48Å; L106-V119 HydrophobicContact CD2-CG1 3.58Å; L106-V119 HydrophobicContact CD2-CG2 4Å; R113-V119 WeakPolarHBondContact O-CA 3.47Å; I114-V119 HydrophobicContact CG1-CG2 4.23Å; I114-V119 HydrophobicContact CG2-CG2 4.13Å; V119-V121 HydrophobicContact CG1-CG2 4.43Å
120	E	89.1	Confident	84.3	Confident	23 Å²	23	53.8 Å²	53.8	11%	0.107	30%	0.298	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-115.6	136.1	172.6	-66.5	169.3	-176.5	0	0	109.9	L83 L84 Q85 T112 R113	L83-E120 HydrophobicContact CD1-CB 4.29Å; L84-E120 CarbonylContact O-C 3.54Å; L84-E120 WeakPolarHBondContact O-CA 3.47Å; Q85-E120 HydrophobicContact CG-CG 4.18Å; T112-E120 VanDerWaalsContact CA-O 3.32Å; T112-E120 WeakPolarHBondContact CA-O 3.25Å; R113-E120 HydrophobicContact CB-CB 4.46Å; R113-E120 IonicContact CZ-OE1 3.64Å; R113-E120 IonicContact CZ-OE2 3.06Å; R113-E120 PolarHBondContact N-O 2.97Å; R113-E120 IonicContact NE-OE1 3.81Å; R113-E120 IonicContact NE-OE2 2.76Å; R113-E120 PolarHBondContact NE-OE2 3.47Å; R113-E120 IonicContact NH2-OE1 2.74Å; R113-E120 PolarHBondContact NH2-OE1 2.97Å; R113-E120 IonicContact NH2-OE2 2.66Å; R113-E120 PolarHBondContact NH2-OE2 3.48Å; R113-E120 PolarHBondContact O-N 3.01Å
121	V	90.7	Very high	84.8	Confident	0 Å²	0	48.9 Å²	48.9	0%	0	27%	0.271	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-123.9	112.3	167.3	-172.6	0	0	0	0	109.5	L84 R111 T112 V119 S124	L84-V121 HydrophobicContact CB-CB 4.19Å; L84-V121 HydrophobicContact CD2-CB 4.24Å; L84-V121 HydrophobicContact CD2-CG2 4.06Å; L84-V121 PolarHBondContact N-O 3.07Å; L84-V121 PolarHBondContact O-N 3.21Å; R111-V121 CarbonylContact O-C 3.57Å; R111-V121 VanDerWaalsContact O-CA 3.29Å; R111-V121 WeakPolarHBondContact O-CA 3.38Å; T112-V121 HydrophobicContact CG2-CG2 4.13Å; V119-V121 HydrophobicContact CG1-CG2 4.43Å; V121-S124 PolarHBondContact O-OG 3.15Å
122	Q	83.3	Confident	85.2	Confident	101 Å²	101	45.3 Å²	45.3	47%	0.472	26%	0.258	S	S	.	.	S	Bend	trans	-80.6	150.1	173.9	-68.2	175.4	7.7	0	0	110.5	L83 R111 S124	L83-Q122 HydrophobicContact CD1-CG 3.86Å; R111-Q122 WeakPolarHBondContact CD-O 3.37Å; R111-Q122 PolarHBondContact NH1-O 3.5Å; R111-Q122 PolarHBondContact O-N 2.88Å; Q122-S124 PolarHBondContact O-N 3.43Å
123	D	81.8	Confident	85.4	Confident	108 Å²	108	45.3 Å²	45.3	58%	0.578	26%	0.259	S	S	*	.	S	Bend	trans	46.1	57.9	-176.7	-54.5	-24.2	0	0	0	111.9	R111 V125	R111-D123 PolarHBondContact NH1-O 3.4Å; D123-V125 PolarHBondContact O-N 3.45Å
124	S	84.6	Confident	85.5	Confident	0 Å²	0	39 Å²	39	0%	0	24%	0.235	C	C	.	.			trans	-55.3	135.8	-175.3	-62.5	0	0	0	0	111.4	P80 G81 D82 L84 V121 Q122	P80-S124 CarbonylContact C-O 3.57Å; P80-S124 VanDerWaalsContact CA-O 3.26Å; P80-S124 WeakPolarHBondContact CA-O 3.34Å; G81-S124 PolarHBondContact N-O 3.25Å; D82-S124 WeakPolarHBondContact O-CB 3.4Å; D82-S124 PolarHBondContact O-N 2.88Å; D82-S124 PolarHBondContact O-OG 3.46Å; L84-S124 WeakPolarHBondContact CB-OG 3.44Å; L84-S124 PolarHBondContact N-OG 2.94Å; V121-S124 PolarHBondContact O-OG 3.15Å; Q122-S124 PolarHBondContact O-N 3.43Å
125	V	84.7	Confident	85.6	Confident	59 Å²	59	39 Å²	39	36%	0.358	24%	0.237	S	C	.	.			trans	-119.7	161.2	175.4	-66.5	0	0	0	0	111.3	D123 A127 D128 V151	D123-V125 PolarHBondContact O-N 3.45Å; V125-A127 HydrophobicContact CG2-CB 4.21Å; V125-A127 PolarHBondContact O-N 3.33Å; V125-D128 VanDerWaalsContact CG2-OD2 3.27Å; V125-D128 WeakPolarHBondContact CG2-OD2 3.28Å; V125-D128 PolarHBondContact N-OD2 3.26Å; V125-D128 WeakPolarHBondContact O-CB 3.06Å; V125-D128 PolarHBondContact O-N 2.87Å; V125-V151 WeakPolarHBondContact O-CB 3.48Å
126	P	81.9	Confident	86	Confident	79 Å²	79	35.7 Å²	35.7	51%	0.513	22%	0.216	S	C	.	.	G	3₁₀ helix	trans	-51.4	-26.9	177.2	-31.8	38	0	0	0	115.3	P80 D128 S129 V151	P80-P126 HydrophobicContact CG-CG 4.19Å; P126-D128 VanDerWaalsContact C-N 3.27Å; P126-D128 PolarHBondContact O-N 2.66Å; P126-S129 VanDerWaalsContact O-CB 3.29Å; P126-S129 WeakPolarHBondContact O-CB 3.24Å; P126-S129 PolarHBondContact O-N 2.96Å; P126-S129 PolarHBondContact O-OG 3.29Å; P126-V151 WeakPolarHBondContact CA-O 3.31Å
127	A	81.5	Confident	86.2	Confident	75 Å²	75	36.3 Å²	36.3	62%	0.62	22%	0.216	S	C	*	.	G	3₁₀ helix	trans	-77.6	-1.6	174.9	0	0	0	0	0	115.2	R101 V125	R101-A127 PolarHBondContact NH2-O 2.91Å; V125-A127 HydrophobicContact CG2-CB 4.21Å; V125-A127 PolarHBondContact O-N 3.33Å
128	D	85.3	Confident	86.2	Confident	8 Å²	8	34.1 Å²	34.1	4%	0.043	21%	0.209	C	C	.	.	G	3₁₀ helix	trans	-96.9	-2.3	169.3	-64.2	-50	0	0	0	113.3	R101 R111 V125 P126 Y132	R101-D128 IonicContact CZ-OD1 3.64Å; R101-D128 IonicContact NH1-OD1 3.28Å; R101-D128 PolarHBondContact NH1-OD1 3.22Å; R101-D128 IonicContact NH2-OD1 2.74Å; R111-D128 IonicContact CZ-OD2 3.41Å; R111-D128 VanDerWaalsContact CZ-OD2 3.23Å; R111-D128 IonicContact NH1-OD2 2.76Å; R111-D128 PolarHBondContact NH1-OD2 3.03Å; R111-D128 IonicContact NH2-OD1 3.23Å; R111-D128 PolarHBondContact NH2-OD1 3.26Å; R111-D128 IonicContact NH2-OD2 3.25Å; R111-D128 PolarHBondContact NH2-OD2 3.45Å; V125-D128 VanDerWaalsContact CG2-OD2 3.27Å; V125-D128 WeakPolarHBondContact CG2-OD2 3.28Å; V125-D128 PolarHBondContact N-OD2 3.26Å; V125-D128 WeakPolarHBondContact O-CB 3.06Å; V125-D128 PolarHBondContact O-N 2.87Å; P126-D128 VanDerWaalsContact C-N 3.27Å; P126-D128 PolarHBondContact O-N 2.66Å; D128-Y132 VanDerWaalsContact O-CE2 3.31Å; D128-Y132 WeakPolarHBondContact O-CE2 3.4Å; D128-Y132 PolarHBondContact O-OH 3.44Å
129	S	86.6	Confident	85.6	Confident	35 Å²	35	37.6 Å²	37.6	25%	0.245	23%	0.233	C	C	.	.			trans	-60.6	141	165.1	-47.4	0	0	0	0	110.5	P126 V149 V151	P126-S129 VanDerWaalsContact O-CB 3.29Å; P126-S129 WeakPolarHBondContact O-CB 3.24Å; P126-S129 PolarHBondContact O-N 2.96Å; P126-S129 PolarHBondContact O-OG 3.29Å; S129-V149 CarbonylContact C-O 3.52Å; S129-V149 VanDerWaalsContact CA-O 3.32Å; S129-V149 WeakPolarHBondContact CA-O 3.48Å; S129-V151 PolarHBondContact OG-N 3.42Å
130	G	87.1	Confident	84.5	Confident	16 Å²	16	42 Å²	42	17%	0.165	26%	0.264	C	S	.	.	E	Extended strand (participates in β ladder)	trans	162.7	175	-178.4	0	0	0	0	0	112.6	D102 V149	D102-G130 WeakPolarHBondContact OD1-CA 3.19Å; G130-V149 PolarHBondContact N-O 3.02Å; G130-V149 PolarHBondContact O-N 2.99Å
131	L	88.9	Confident	83.7	Confident	71 Å²	71	42.9 Å²	42.9	37%	0.372	28%	0.279	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-89.5	104.5	172.5	-172.8	72.6	0	0	0	109.4	V73 D102 Y146	V73-L131 HydrophobicContact CG1-CD1 4.11Å; D102-L131 PolarHBondContact N-O 3.03Å; D102-L131 PolarHBondContact OD1-N 3.47Å; L131-Y146 HydrophobicContact CD1-CD1 4.46Å; L131-Y146 HydrophobicContact CD2-CD1 3.93Å; L131-Y146 HydrophobicContact CD2-CE1 4.34Å; L131-Y146 HydrophobicContact CG-CD1 4.18Å
132	Y	91.5	Very high	83	Confident	0 Å²	0	47.2 Å²	47.2	0%	0	31%	0.309	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-82.4	145.1	172	-68.3	-110.6	0	0	0	109.5	L84 L86 L100 R101 L106 D128 Y146 F147 V149	L84-Y132 HydrophobicContact CD2-CE2 4.42Å; L86-Y132 HydrophobicContact CD1-CD1 3.8Å; L86-Y132 HydrophobicContact CD1-CD2 4.13Å; L86-Y132 HydrophobicContact CD1-CE1 4.43Å; L86-Y132 HydrophobicContact CD1-CG 3.62Å; L100-Y132 CarbonylContact O-C 3.49Å; L100-Y132 VanDerWaalsContact O-CA 3.28Å; L100-Y132 WeakPolarHBondContact O-CA 3.18Å; R101-Y132 HydrophobicContact CB-CD1 4.21Å; R101-Y132 HydrophobicContact CB-CE1 4.21Å; R101-Y132 WeakPolarHBondContact CD-OH 3.47Å; R101-Y132 HydrophobicContact CG-CD1 4.37Å; R101-Y132 HydrophobicContact CG-CD2 4.21Å; R101-Y132 HydrophobicContact CG-CE1 4.16Å; R101-Y132 HydrophobicContact CG-CE2 3.98Å; R101-Y132 HydrophobicContact CG-CG 4.4Å; R101-Y132 PolarHBondContact NH1-OH 2.86Å; L106-Y132 HydrophobicContact CD1-CE1 4.43Å; L106-Y132 HydrophobicContact CD2-CD1 4.3Å; L106-Y132 HydrophobicContact CD2-CE1 4.08Å; D128-Y132 VanDerWaalsContact O-CE2 3.31Å; D128-Y132 WeakPolarHBondContact O-CE2 3.4Å; D128-Y132 PolarHBondContact O-OH 3.44Å; Y132-Y146 WeakPolarHBondContact O-CA 3.49Å; Y132-F147 PolarHBondContact N-O 3.05Å; Y132-F147 PolarHBondContact O-N 2.8Å; Y132-V149 HydrophobicContact CD2-CB 3.94Å; Y132-V149 HydrophobicContact CD2-CG2 3.44Å; Y132-V149 VanDerWaalsContact CD2-CG2 3.44Å; Y132-V149 HydrophobicContact CE2-CB 3.79Å; Y132-V149 HydrophobicContact CE2-CG1 4.36Å; Y132-V149 HydrophobicContact CE2-CG2 3.64Å; Y132-V149 HydrophobicContact CG-CG2 4.34Å
133	A	88.6	Confident	82.9	Confident	10 Å²	10	45.4 Å²	45.4	8%	0.083	30%	0.303	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-136.4	128.9	176.3	0	0	0	0	0	110.5	W99 L100 T144 T145 Y146	W99-A133 CarbonylContact C-O 3.52Å; W99-A133 WeakPolarHBondContact CA-O 3.42Å; L100-A133 PolarHBondContact N-O 3.1Å; L100-A133 PolarHBondContact O-N 3.1Å; A133-T144 HydrophobicContact CB-CG2 4.24Å; A133-T145 CarbonylContact C-O 3.57Å; A133-T145 WeakPolarHBondContact CA-O 3.44Å; A133-Y146 HydrophobicContact CB-CD1 3.8Å; A133-Y146 HydrophobicContact CB-CE1 3.86Å
134	C	89.7	Confident	83	Confident	0 Å²	0	42.2 Å²	42.2	0%	0	29%	0.287	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-98.3	118.2	166.7	175.6	0	0	0	0	109	C88 I97 W99 T144 T145 F147	C88-C134 HydrophobicContact CB-CB 3.74Å; C88-C134 WeakPolarHBondContact CB-SG 3.49Å; C88-C134 WeakPolarHBondContact SG-CB 3.44Å; C88-C134 CovalentContact SG-SG 2.03Å; C88-C134 PolarHBondContact SG-SG 3.49Å; I97-C134 WeakPolarHBondContact CG2-SG 3.22Å; W99-C134 HydrophobicContact CD2-CB 3.93Å; W99-C134 HydrophobicContact CE3-CB 3.9Å; W99-C134 HydrophobicContact CH2-CB 3.86Å; W99-C134 HydrophobicContact CZ2-CB 3.86Å; W99-C134 HydrophobicContact CZ3-CB 3.87Å; C134-T144 CarbonylContact O-C 3.59Å; C134-T144 VanDerWaalsContact O-CA 3.28Å; C134-T144 WeakPolarHBondContact O-CA 3.36Å; C134-T145 PolarHBondContact N-O 2.91Å; C134-T145 PolarHBondContact O-N 2.94Å; C134-F147 HydrophobicContact CB-CE2 4.11Å
135	V	87.6	Confident	83	Confident	37 Å²	37	43.1 Å²	43.1	22%	0.224	29%	0.293	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-103.2	115.5	174.6	-178.5	0	0	0	0	108.7	I97 N98 L100 D143 T144	I97-V135 WeakPolarHBondContact CA-O 3.3Å; N98-V135 PolarHBondContact N-O 3.32Å; N98-V135 PolarHBondContact O-N 2.71Å; L100-V135 HydrophobicContact CD1-CB 4.42Å; L100-V135 HydrophobicContact CD1-CG2 3.58Å; V135-D143 WeakPolarHBondContact CA-O 3.48Å; V135-T144 HydrophobicContact CG2-CG2 3.88Å
136	T	87.6	Confident	83.1	Confident	5 Å²	5	44.3 Å²	44.3	3%	0.031	29%	0.291	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-101.3	139.1	174.9	59.7	0	0	0	0	109.9	C88 L90 V94 S96 I97 S142 D143	C88-T136 VanDerWaalsContact SG-CG2 3.53Å; L90-T136 HydrophobicContact CD2-CG2 3.79Å; V94-T136 HydrophobicContact CG1-CG2 4.32Å; V94-T136 HydrophobicContact CG2-CG2 4.47Å; S96-T136 WeakPolarHBondContact O-CA 3.46Å; I97-T136 HydrophobicContact CG1-CG2 4.37Å; I97-T136 HydrophobicContact CG2-CG2 4.26Å; T136-S142 CarbonylContact O-C 3.51Å; T136-S142 VanDerWaalsContact O-CA 3.24Å; T136-S142 WeakPolarHBondContact O-CA 3.47Å; T136-D143 PolarHBondContact N-O 2.74Å; T136-D143 PolarHBondContact O-N 3.33Å; T136-D143 WeakPolarHBondContact OG1-CB 3.49Å
137	S	80.6	Confident	83.5	Confident	42 Å²	42	40.6 Å²	40.6	29%	0.294	27%	0.267	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-116	125.5	175.8	-54	0	0	0	0	110.1	Q95 S96	Q95-S137 PolarHBondContact N-O 3.04Å; S96-S137 PolarHBondContact N-O 3.29Å; S96-S137 PolarHBondContact O-N 3.16Å; S96-S137 WeakPolarHBondContact OG-CB 3.32Å
138	S	81.7	Confident	83.7	Confident	23 Å²	23	39.6 Å²	39.6	16%	0.161	26%	0.256	C	S	.	.			trans	-128.6	170	172.7	78.1	0	0	0	0	111.1	D93 S140 G141	D93-S138 VanDerWaalsContact CG-CB 3.46Å; D93-S138 VanDerWaalsContact O-CB 3.25Å; D93-S138 WeakPolarHBondContact O-CB 3.06Å; D93-S138 VanDerWaalsContact OD2-CB 3.26Å; D93-S138 WeakPolarHBondContact OD2-CB 3.5Å; D93-S138 PolarHBondContact OD2-OG 2.74Å; S138-S140 PolarHBondContact O-N 3.39Å; S138-S140 PolarHBondContact OG-N 3.23Å; S138-S140 PolarHBondContact OG-OG 3.08Å; S138-G141 PolarHBondContact N-O 2.62Å; S138-G141 PolarHBondContact O-N 3.4Å; S138-G141 VanDerWaalsContact O-O 3.11Å; S138-G141 PolarHBondContact OG-N 2.98Å; S138-G141 PolarHBondContact OG-O 2.99Å
139	P	73.9	Confident	83.9	Confident	98 Å²	98	39.4 Å²	39.4	64%	0.636	26%	0.255	S	S	*	.	S	Bend	trans	-64.4	-18.5	173.1	-22.1	35.3	0	0	0	113.9	D93 Q95	D93-P139 VanDerWaalsContact O-CD 3.24Å; D93-P139 WeakPolarHBondContact O-CD 3.42Å; Q95-P139 HydrophobicContact CG-CG 4.46Å
140	S	67	Low	83.7	Confident	93 Å²	93	41.4 Å²	41.4	65%	0.65	26%	0.263	S	S	*	.	S	Bend	trans	-92.4	-18.7	179.9	62.8	0	0	0	0	113.5	D93 S138	D93-S140 WeakPolarHBondContact OD2-CB 3.47Å; D93-S140 PolarHBondContact OD2-OG 3.38Å; S138-S140 PolarHBondContact O-N 3.39Å; S138-S140 PolarHBondContact OG-N 3.23Å; S138-S140 PolarHBondContact OG-OG 3.08Å
141	G	72.5	Confident	83.5	Confident	40 Å²	40	40.7 Å²	40.7	41%	0.412	26%	0.256	S	S	.	.			trans	166.3	-176.1	172.7	0	0	0	0	0	113.6	S138	S138-G141 PolarHBondContact N-O 2.62Å; S138-G141 PolarHBondContact O-N 3.4Å; S138-G141 VanDerWaalsContact O-O 3.11Å; S138-G141 PolarHBondContact OG-N 2.98Å; S138-G141 PolarHBondContact OG-O 2.99Å
142	S	76.6	Confident	82.6	Confident	92 Å²	92	38.5 Å²	38.5	64%	0.643	25%	0.246	S	C	*	.	E	Extended strand (participates in β ladder)	trans	-106.8	125.1	165.4	58.6	0	0	0	0	109.7	T136	T136-S142 CarbonylContact O-C 3.51Å; T136-S142 VanDerWaalsContact O-CA 3.24Å; T136-S142 WeakPolarHBondContact O-CA 3.47Å
143	D	81.1	Confident	80.9	Confident	62 Å²	62	44.9 Å²	44.9	33%	0.332	28%	0.28	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-106.3	159.5	176.4	-150.5	-19.4	0	0	0	109.9	R91 V135 T136	R91-D143 IonicContact CZ-OD2 3.16Å; R91-D143 IonicContact NE-OD2 3.69Å; R91-D143 PolarHBondContact NE-OD2 3.03Å; R91-D143 IonicContact NH2-OD2 2.86Å; R91-D143 PolarHBondContact NH2-OD2 3.27Å; V135-D143 WeakPolarHBondContact CA-O 3.48Å; T136-D143 PolarHBondContact N-O 2.74Å; T136-D143 PolarHBondContact O-N 3.33Å; T136-D143 WeakPolarHBondContact OG1-CB 3.49Å
144	T	83.9	Confident	78.9	Confident	41 Å²	41	47.3 Å²	47.3	25%	0.252	30%	0.3	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-147.7	116.1	-179	-56.7	0	0	0	0	112.4	A133 C134 V135 Y146	A133-T144 HydrophobicContact CB-CG2 4.24Å; C134-T144 CarbonylContact O-C 3.59Å; C134-T144 VanDerWaalsContact O-CA 3.28Å; C134-T144 WeakPolarHBondContact O-CA 3.36Å; V135-T144 HydrophobicContact CG2-CG2 3.88Å; T144-Y146 HydrophobicContact CG2-CD2 4.15Å; T144-Y146 HydrophobicContact CG2-CE1 4.18Å; T144-Y146 HydrophobicContact CG2-CE2 3.59Å
145	T	85.3	Confident	76.3	Confident	19 Å²	19	54.2 Å²	54.2	12%	0.117	34%	0.336	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-96.2	138.6	174.2	-49.3	0	0	0	0	109.6	A133 C134 F147	A133-T145 CarbonylContact C-O 3.57Å; A133-T145 WeakPolarHBondContact CA-O 3.44Å; C134-T145 PolarHBondContact N-O 2.91Å; C134-T145 PolarHBondContact O-N 2.94Å; T145-F147 HydrophobicContact CG2-CE1 3.89Å; T145-F147 HydrophobicContact CG2-CE2 3.86Å; T145-F147 HydrophobicContact CG2-CZ 3.4Å
146	Y	87	Confident	73.9	Confident	84 Å²	84	56.9 Å²	56.9	33%	0.329	35%	0.354	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-119	138.4	-176.7	-70	-87.1	0	0	0	111.4	V71 V73 E74 L131 Y132 A133 T144	V71-Y146 HydrophobicContact CG1-CD2 3.56Å; V71-Y146 HydrophobicContact CG1-CE2 4.11Å; V71-Y146 HydrophobicContact CG1-CG 4.43Å; V73-Y146 WeakPolarHBondContact CA-O 3.43Å; E74-Y146 PolarHBondContact N-O 2.86Å; L131-Y146 HydrophobicContact CD1-CD1 4.46Å; L131-Y146 HydrophobicContact CD2-CD1 3.93Å; L131-Y146 HydrophobicContact CD2-CE1 4.34Å; L131-Y146 HydrophobicContact CG-CD1 4.18Å; Y132-Y146 WeakPolarHBondContact O-CA 3.49Å; A133-Y146 HydrophobicContact CB-CD1 3.8Å; A133-Y146 HydrophobicContact CB-CE1 3.86Å; T144-Y146 HydrophobicContact CG2-CD2 4.15Å; T144-Y146 HydrophobicContact CG2-CE1 4.18Å; T144-Y146 HydrophobicContact CG2-CE2 3.59Å
147	F	89	Confident	71.5	Confident	1 Å²	1	62.7 Å²	62.7	0%	0.004	40%	0.395	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-130	121.1	-178.7	-45.8	-93.5	0	0	0	109.4	E74 F76 L86 R87 W99 Y132 C134 T145	E74-F147 HydrophobicContact CB-CD1 4.09Å; E74-F147 CarbonylContact O-C 3.45Å; E74-F147 VanDerWaalsContact O-CA 3.3Å; E74-F147 WeakPolarHBondContact O-CA 3.24Å; E74-F147 WeakPolarHBondContact OE2-CE1 3.34Å; F76-F147 HydrophobicContact CD2-CB 4.49Å; F76-F147 AromaticContact CE2-CD1 3.95Å; F76-F147 HydrophobicContact CE2-CD1 3.95Å; L86-F147 HydrophobicContact CD1-CB 4.17Å; L86-F147 HydrophobicContact CD1-CG 4.41Å; L86-F147 HydrophobicContact CD2-CB 4Å; L86-F147 HydrophobicContact CD2-CD1 4.18Å; L86-F147 HydrophobicContact CD2-CG 4.16Å; R87-F147 WeakPolarHBondContact O-CE1 3.15Å; R87-F147 WeakPolarHBondContact O-CZ 3.48Å; W99-F147 HydrophobicContact CH2-CD2 4.13Å; W99-F147 AromaticContact CH2-CE2 3.5Å; W99-F147 HydrophobicContact CH2-CE2 3.5Å; W99-F147 VanDerWaalsContact CH2-CE2 3.5Å; W99-F147 AromaticContact CH2-CZ 3.96Å; W99-F147 HydrophobicContact CH2-CZ 3.96Å; W99-F147 AromaticContact CZ3-CD2 3.68Å; W99-F147 HydrophobicContact CZ3-CD2 3.68Å; W99-F147 AromaticContact CZ3-CE2 3.44Å; W99-F147 HydrophobicContact CZ3-CE2 3.44Å; W99-F147 VanDerWaalsContact CZ3-CE2 3.44Å; W99-F147 HydrophobicContact CZ3-CZ 4.33Å; Y132-F147 PolarHBondContact N-O 3.05Å; Y132-F147 PolarHBondContact O-N 2.8Å; C134-F147 HydrophobicContact CB-CE2 4.11Å; T145-F147 HydrophobicContact CG2-CE1 3.89Å; T145-F147 HydrophobicContact CG2-CE2 3.86Å; T145-F147 HydrophobicContact CG2-CZ 3.4Å
148	S	87.2	Confident	69.2	Low	54 Å²	54	66.1 Å²	66.1	38%	0.378	42%	0.419	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-95.1	99.9	179.5	174	0	0	0	0	109.5	E74 S75 F76	E74-S148 PolarHBondContact O-N 3.09Å; S75-S148 WeakPolarHBondContact CA-O 3.31Å; F76-S148 PolarHBondContact N-O 3.33Å
149	V	88.6	Confident	67.2	Low	5 Å²	5	71.6 Å²	71.6	3%	0.03	44%	0.442	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-93.9	127.6	-178.8	-178.3	0	0	0	0	110.5	F76 L84 L86 S129 G130 Y132 V151	F76-V149 HydrophobicContact CB-CG2 4.26Å; F76-V149 WeakPolarHBondContact O-CA 3.21Å; L84-V149 HydrophobicContact CD1-CG1 3.95Å; L84-V149 HydrophobicContact CD1-CG2 3.97Å; L84-V149 HydrophobicContact CD2-CG1 3.87Å; L84-V149 HydrophobicContact CD2-CG2 4.2Å; L86-V149 HydrophobicContact CD1-CG2 4.01Å; L86-V149 HydrophobicContact CD2-CG2 4.26Å; S129-V149 CarbonylContact C-O 3.52Å; S129-V149 VanDerWaalsContact CA-O 3.32Å; S129-V149 WeakPolarHBondContact CA-O 3.48Å; G130-V149 PolarHBondContact N-O 3.02Å; G130-V149 PolarHBondContact O-N 2.99Å; Y132-V149 HydrophobicContact CD2-CB 3.94Å; Y132-V149 HydrophobicContact CD2-CG2 3.44Å; Y132-V149 VanDerWaalsContact CD2-CG2 3.44Å; Y132-V149 HydrophobicContact CE2-CB 3.79Å; Y132-V149 HydrophobicContact CE2-CG1 4.36Å; Y132-V149 HydrophobicContact CE2-CG2 3.64Å; Y132-V149 HydrophobicContact CG-CG2 4.34Å; V149-V151 HydrophobicContact CG1-CG2 3.94Å
150	N	83.4	Confident	65.5	Low	76 Å²	76	73.5 Å²	73.5	41%	0.406	45%	0.447	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-123.7	113.4	170.1	177.7	46.6	0	0	0	109.8	F76 L77 V78 S152	F76-N150 PolarHBondContact O-N 3.09Å; L77-N150 WeakPolarHBondContact CA-O 3.42Å; L77-N150 HydrophobicContact CD1-CB 4.24Å; L77-N150 VanDerWaalsContact CD1-ND2 3.3Å; L77-N150 WeakPolarHBondContact CD1-ND2 3.32Å; V78-N150 PolarHBondContact N-O 3.23Å; V78-N150 VanDerWaalsContact N-O 3.14Å; N150-S152 PolarHBondContact ND2-OG 2.66Å
151	V	81.4	Confident	64.2	Low	2 Å²	2	76 Å²	76	1%	0.012	45%	0.453	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-97.9	102.8	178.5	-172.8	0	0	0	0	108.9	V78 P80 V125 P126 S129 V149	V78-V151 HydrophobicContact CB-CG2 4.4Å; V78-V151 CarbonylContact O-C 3.56Å; V78-V151 VanDerWaalsContact O-CA 3.23Å; V78-V151 WeakPolarHBondContact O-CA 3.29Å; P80-V151 HydrophobicContact CG-CG1 4.38Å; V125-V151 WeakPolarHBondContact O-CB 3.48Å; P126-V151 WeakPolarHBondContact CA-O 3.31Å; S129-V151 PolarHBondContact OG-N 3.42Å; V149-V151 HydrophobicContact CG1-CG2 3.94Å
152	S	70.7	Confident	62.5	Low	24 Å²	24	81 Å²	81	17%	0.168	47%	0.471	C	S	.	.	S	Bend	trans	-159.5	155.4	-172.5	68.3	0	0	0	0	114.1	V78 H79 N150 A154	V78-S152 PolarHBondContact O-N 3.2Å; H79-S152 PolarHBondContact ND1-O 3.01Å; N150-S152 PolarHBondContact ND2-OG 2.66Å; S152-A154 PolarHBondContact O-N 3.24Å
153	D	55.1	Low	60.9	Low	135 Å²	135	83.9 Å²	83.9	72%	0.722	48%	0.478	S	S	*	.	S	Bend	trans	-75.8	16.8	-179.8	-46.4	-55.7	0	0	0	114	P80	P80-D153 WeakPolarHBondContact CD-OD1 3.09Å; P80-D153 WeakPolarHBondContact CG-OD1 3.08Å
154	A	46.6	Very low	58.6	Low	60 Å²	60	89 Å²	89	50%	0.496	51%	0.506	S	S	.	.			trans	-106.8	96.4	-170	0	0	0	0	0	111.8	L77 S152	L77-A154 WeakPolarHBondContact CD2-O 3.36Å; S152-A154 PolarHBondContact O-N 3.24Å
155	L	36.3	Very low	56.6	Low	145 Å²	145	94.8 Å²	94.8	76%	0.759	54%	0.535	S	S	*	.			trans	-52.7	140.9	177.6	-69.5	168.9	0	0	0	113.2
156	P	37.2	Very low	53.9	Low	94 Å²	94	100.9 Å²	100.9	61%	0.61	57%	0.567	S	S	*	*			trans	-79.6	153	173.2	34.5	-29.9	0	0	0	110.4	L77	L77-P156 HydrophobicContact CD2-CB 4.1Å; L77-P156 HydrophobicContact CD2-CG 3.84Å
157	S	36.1	Very low	51.7	Low	126 Å²	126	102.3 Å²	102.3	88%	0.881	59%	0.59	S	S	*	*			trans	-98	102.9	-180	62.1	0	0	0	0	112.7
158	S	31.7	Very low	49	Very low	115 Å²	115	107.3 Å²	107.3	80%	0.804	62%	0.624	S	S	*	*			trans	-102	167.1	154.8	47.4	0	0	0	0	110.3
159	E	40.2	Very low	46.5	Very low	137 Å²	137	110.1 Å²	110.1	64%	0.64	64%	0.644	S	S	*	*			trans	-93.6	154.5	-176.6	-56.5	-165.6	104.7	0	0	112	K203	E159-K203 IonicContact OE1-NZ 3.01Å; E159-K203 PolarHBondContact OE1-NZ 2.87Å; E159-K203 IonicContact OE2-NZ 2.75Å; E159-K203 PolarHBondContact OE2-NZ 2.79Å
160	D	39.5	Very low	44.4	Very low	139 Å²	139	117 Å²	117	74%	0.743	68%	0.676	S	S	*	*			trans	68.8	142.1	160	-51.2	-25.4	0	0	0	121.1
161	D	39.7	Very low	42	Very low	146 Å²	146	123.1 Å²	123.1	78%	0.781	70%	0.702	S	S	*	*			trans	52.9	141.7	164.1	-49.9	-15.8	0	0	0	119.7
162	D	36.9	Very low	40.2	Very low	145 Å²	145	130.7 Å²	130.7	78%	0.775	74%	0.735	S	S	*	*			cis	-148.5	-160.6	0.4	-131.5	-18.2	0	0	0	111.3
163	D	41.1	Very low	38.5	Very low	151 Å²	151	139.2 Å²	139.2	81%	0.807	77%	0.772	S	S	*	*			trans	-51.5	146.2	-177.9	-70.6	-44.9	0	0	0	116.8
164	D	34.5	Very low	37.8	Very low	169 Å²	169	138.9 Å²	138.9	90%	0.904	78%	0.775	S	S	*	*			trans	-151.2	132	134.5	-114.9	-27.2	0	0	0	109.8
165	D	41.6	Very low	37.2	Very low	164 Å²	164	142.1 Å²	142.1	88%	0.877	78%	0.784	S	S	*	*			trans	-88.8	129.5	168	-112.7	-26.1	0	0	0	107.7
166	D	28.6	Very low	37.6	Very low	147 Å²	147	143 Å²	143	79%	0.786	79%	0.79	S	S	*	*			trans	-140	135.8	153.9	-160.4	1.9	0	0	0	111.6
167	S	39.7	Very low	38.3	Very low	114 Å²	114	143.1 Å²	143.1	80%	0.797	79%	0.789	S	S	*	*			trans	-123.3	67.3	-172.6	170.5	0	0	0	0	109.3
168	S	32.4	Very low	38.9	Very low	105 Å²	105	146.3 Å²	146.3	73%	0.734	79%	0.787	S	S	*	*			trans	-79.1	125	170.2	33.7	0	0	0	0	111.2
169	S	36.2	Very low	40.3	Very low	114 Å²	114	145.2 Å²	145.2	80%	0.797	78%	0.777	S	S	*	*			trans	-83.1	174.3	-177.4	55.1	0	0	0	0	113.5
170	E	42.8	Very low	41.8	Very low	150 Å²	150	145 Å²	145	70%	0.701	78%	0.78	S	S	*	*			trans	-43.3	139.8	172.8	-53	-178.8	175.5	0	0	114.1
171	E	34.5	Very low	43.8	Very low	203 Å²	203	142 Å²	142	95%	0.949	77%	0.768	S	S	*	*				-130.3	161.2	127.6	-75.1	-149.7	152.8	0	0	109.7
172	K	43.9	Very low	46	Very low	162 Å²	162	137.6 Å²	137.6	70%	0.704	75%	0.747	S	S	*	*			trans	-110.8	146.1	-172.3	-64.7	163.2	-176.6	154.9	0	110.4
173	E	34	Very low	48.5	Very low	203 Å²	203	132.9 Å²	132.9	95%	0.949	73%	0.727	S	S	*	*			trans	-117.5	148.9	139.5	-76.6	-148.1	125.8	0	0	110.6
174	T	39.8	Very low	50.9	Low	127 Å²	127	126.1 Å²	126.1	78%	0.779	69%	0.692	S	S	*	*			trans	-106.2	122.1	-176.2	53	0	0	0	0	110.8
175	D	35	Very low	53.6	Low	129 Å²	129	123.5 Å²	123.5	69%	0.69	67%	0.67	S	S	*	*			trans	-123.6	142.5	148.7	-177.7	38.9	0	0	0	110.2	T177	D175-T177 VanDerWaalsContact C-N 3.29Å; D175-T177 PolarHBondContact O-N 3.16Å; D175-T177 VanDerWaalsContact OD2-CB 3.22Å; D175-T177 WeakPolarHBondContact OD2-CB 3.48Å; D175-T177 PolarHBondContact OD2-N 3.27Å; D175-T177 PolarHBondContact OD2-OG1 2.93Å
176	N	45	Very low	56	Low	163 Å²	163	118.7 Å²	118.7	87%	0.872	64%	0.64	S	S	*	*			trans	-93.6	25.5	-175.7	-95	-58.2	0	0	0	113.1	K178	N176-K178 PolarHBondContact O-N 2.6Å
177	T	50.2	Low	58.9	Low	96 Å²	96	114.8 Å²	114.8	59%	0.589	62%	0.621	S	S	*	*			trans	-83.4	109.6	167.5	-54.9	0	0	0	0	109.2	D175 P179	D175-T177 VanDerWaalsContact C-N 3.29Å; D175-T177 PolarHBondContact O-N 3.16Å; D175-T177 VanDerWaalsContact OD2-CB 3.22Å; D175-T177 WeakPolarHBondContact OD2-CB 3.48Å; D175-T177 PolarHBondContact OD2-N 3.27Å; D175-T177 PolarHBondContact OD2-OG1 2.93Å; T177-P179 VanDerWaalsContact O-CD 3.27Å; T177-P179 WeakPolarHBondContact O-CD 3.47Å
178	K	49.5	Very low	61.2	Low	193 Å²	193	110.4 Å²	110.4	84%	0.839	59%	0.591	S	S	*	*	P	Polyproline II helix	trans	-55.9	116.4	168.3	-80.9	-172.2	175.9	-175.8	0	108.1	N176 N180	N176-K178 PolarHBondContact O-N 2.6Å; K178-N180 PolarHBondContact O-N 2.81Å
179	P	60.6	Low	63.7	Low	92 Å²	92	108.8 Å²	108.8	60%	0.597	58%	0.577	S	S	*	*	P	Polyproline II helix	trans	-64.1	136	178.9	27.3	-34.2	0	0	0	108.5	T177 T214	T177-P179 VanDerWaalsContact O-CD 3.27Å; T177-P179 WeakPolarHBondContact O-CD 3.47Å; P179-T214 HydrophobicContact CB-CG2 4.03Å; P179-T214 HydrophobicContact CG-CG2 3.81Å
180	N	72.4	Confident	65.8	Low	133 Å²	133	107.7 Å²	107.7	71%	0.711	56%	0.56	S	S	*	*	P	Polyproline II helix	trans	-57.9	142.1	177.5	-80.6	-34.9	0	0	0	109.7	K178 V182	K178-N180 PolarHBondContact O-N 2.81Å; N180-V182 WeakPolarHBondContact O-CG2 3.37Å; N180-V182 PolarHBondContact O-N 2.86Å
181	P	80.6	Confident	67.5	Low	75 Å²	75	106.1 Å²	106.1	49%	0.487	55%	0.551	S	S	.	*	P	Polyproline II helix	trans	-61.2	126.9	174.8	25	-33.4	0	0	0	110.2	Y267	P181-Y267 HydrophobicContact CB-CD1 4.17Å; P181-Y267 HydrophobicContact CB-CD2 3.6Å; P181-Y267 HydrophobicContact CB-CE1 3.81Å; P181-Y267 HydrophobicContact CB-CE2 3.16Å; P181-Y267 HydrophobicContact CB-CG 4.09Å; P181-Y267 HydrophobicContact CG-CE1 4.46Å; P181-Y267 HydrophobicContact CG-CE2 4.46Å
182	V	87.1	Confident	69.8	Low	55 Å²	55	96.6 Å²	96.6	33%	0.333	51%	0.506	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-131.5	117	-173.6	167	0	0	0	0	109.1	N180 Y185 T214 N265	N180-V182 WeakPolarHBondContact O-CG2 3.37Å; N180-V182 PolarHBondContact O-N 2.86Å; V182-Y185 HydrophobicContact CG1-CD1 3.97Å; V182-Y185 HydrophobicContact CG1-CE1 3.93Å; V182-T214 PolarHBondContact N-O 2.68Å; V182-T214 PolarHBondContact O-N 3.28Å; V182-N265 PolarHBondContact O-ND2 2.71Å
183	A	88.4	Confident	71.2	Confident	45 Å²	45	96 Å²	96	37%	0.372	51%	0.506	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-58.9	150.5	169.4	0	0	0	0	0	110.7	Y267	A183-Y267 WeakPolarHBondContact CB-O 3.43Å
184	P	92.3	Very high	73.1	Confident	9 Å²	9	94.1 Å²	94.1	6%	0.058	49%	0.494	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-62.3	143.8	-174.2	26.5	-36.5	0	0	0	112.5	S212 P217 V263 N265 G268 I270	P184-S212 CarbonylContact C-O 3.56Å; P184-S212 VanDerWaalsContact CA-O 3.29Å; P184-S212 WeakPolarHBondContact CA-O 3.4Å; P184-P217 HydrophobicContact CB-CB 4.06Å; P184-P217 HydrophobicContact CB-CG 4.03Å; P184-V263 HydrophobicContact CB-CG1 4.03Å; P184-V263 WeakPolarHBondContact CG-O 3.36Å; P184-N265 WeakPolarHBondContact CD-OD1 3.46Å; P184-G268 VanDerWaalsContact CD-O 3.3Å; P184-G268 WeakPolarHBondContact CD-O 3.48Å; P184-G268 WeakPolarHBondContact CG-O 3.38Å; P184-I270 HydrophobicContact CB-CD1 3.95Å; P184-I270 HydrophobicContact CB-CG1 4.03Å; P184-I270 HydrophobicContact CG-CG1 4.11Å; P184-I270 HydrophobicContact CG-CG2 4.36Å; P184-I270 VanDerWaalsContact O-CG2 3.29Å; P184-I270 WeakPolarHBondContact O-CG2 3.45Å
185	Y	90.2	Very high	75	Confident	114 Å²	114	94.4 Å²	94.4	45%	0.447	49%	0.485	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-139.6	154.9	175	65.7	-83.5	0	0	0	111.3	V182 T187 S211 S212	V182-Y185 HydrophobicContact CG1-CD1 3.97Å; V182-Y185 HydrophobicContact CG1-CE1 3.93Å; Y185-T187 HydrophobicContact CD2-CG2 4.34Å; Y185-T187 HydrophobicContact CE2-CG2 3.79Å; Y185-S211 CarbonylContact O-C 3.58Å; Y185-S211 VanDerWaalsContact O-CA 3.22Å; Y185-S211 WeakPolarHBondContact O-CA 3.05Å; Y185-S212 WeakPolarHBondContact CD1-O 3.4Å; Y185-S212 PolarHBondContact N-O 3.42Å; Y185-S212 PolarHBondContact O-N 2.79Å
186	W	92.4	Very high	77.3	Confident	64 Å²	64	93.2 Å²	93.2	24%	0.242	48%	0.478	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-74.5	128.3	176.4	-52.5	118.3	0	0	0	110.9	P189 M192 C209 P210 S211 V263 I270 N271 H272	W186-P189 HydrophobicContact CB-CB 4.36Å; W186-M192 HydrophobicContact CD2-CE 3.99Å; W186-M192 HydrophobicContact CD2-SD 4.01Å; W186-M192 HydrophobicContact CE3-CE 3.76Å; W186-M192 HydrophobicContact CE3-SD 3.87Å; W186-M192 HydrophobicContact CG-SD 4.32Å; W186-M192 HydrophobicContact CH2-CE 4.15Å; W186-M192 HydrophobicContact CZ2-CE 4.33Å; W186-M192 HydrophobicContact CZ3-CE 3.87Å; W186-C209 HydrophobicContact CH2-CB 4.4Å; W186-C209 HydrophobicContact CZ3-CB 3.77Å; W186-P210 CarbonylContact C-O 3.57Å; W186-P210 WeakPolarHBondContact CA-O 3.38Å; W186-S211 WeakPolarHBondContact CZ3-OG 3.36Å; W186-V263 HydrophobicContact CH2-CG2 4.42Å; W186-V263 HydrophobicContact CZ3-CG2 4.12Å; W186-I270 HydrophobicContact CD2-CD1 3.69Å; W186-I270 HydrophobicContact CE3-CD1 3.76Å; W186-I270 HydrophobicContact CG-CD1 4.33Å; W186-I270 HydrophobicContact CH2-CB 4.38Å; W186-I270 HydrophobicContact CH2-CD1 3.8Å; W186-I270 HydrophobicContact CH2-CG1 3.76Å; W186-I270 HydrophobicContact CZ2-CB 3.88Å; W186-I270 HydrophobicContact CZ2-CD1 3.73Å; W186-I270 HydrophobicContact CZ2-CG1 3.73Å; W186-I270 HydrophobicContact CZ3-CD1 3.8Å; W186-I270 HydrophobicContact CZ3-CG1 4.21Å; W186-N271 VanDerWaalsContact CZ2-C 3.5Å; W186-H272 HydrophobicContact CH2-CB 4.17Å; W186-H272 HydrophobicContact CZ2-CB 3.9Å
187	T	89.8	Confident	79.1	Confident	65 Å²	65	87.9 Å²	87.9	40%	0.399	45%	0.448	S	S	.	.	S	Bend	trans	-94.9	-10.8	178.8	51.1	0	0	0	0	113.6	Y185 P210 S211	Y185-T187 HydrophobicContact CD2-CG2 4.34Å; Y185-T187 HydrophobicContact CE2-CG2 3.79Å; T187-P210 PolarHBondContact N-O 2.93Å; T187-P210 VanDerWaalsContact OG1-C 3.26Å; T187-P210 PolarHBondContact OG1-O 3.07Å; T187-S211 PolarHBondContact OG1-N 2.94Å
188	S	87.6	Confident	80.7	Confident	22 Å²	22	86.5 Å²	86.5	15%	0.154	45%	0.446	C	S	.	.			trans	-155.1	67	178	-71.5	0	0	0	0	111.4	E190 K191	S188-E190 WeakPolarHBondContact CA-OE2 3.36Å; S188-E190 WeakPolarHBondContact CB-OE1 3.29Å; S188-E190 PolarHBondContact O-N 3.05Å; S188-E190 PolarHBondContact OG-OE1 2.99Å; S188-K191 VanDerWaalsContact CB-NZ 3.29Å; S188-K191 PolarHBondContact O-N 3.19Å; S188-K191 PolarHBondContact OG-NZ 2.87Å
189	P	84.9	Confident	82.2	Confident	70 Å²	70	78.2 Å²	78.2	46%	0.455	41%	0.411	S	S	.	.	G	3₁₀ helix	trans	-64.3	-23.6	-176.7	28.5	-36.2	0	0	0	114	W186 K191 M192	W186-P189 HydrophobicContact CB-CB 4.36Å; P189-K191 PolarHBondContact O-N 2.98Å; P189-M192 WeakPolarHBondContact O-CA 3.21Å; P189-M192 VanDerWaalsContact O-CB 3.27Å; P189-M192 WeakPolarHBondContact O-CB 3.13Å; P189-M192 PolarHBondContact O-N 3.04Å
190	E	80.8	Confident	82.7	Confident	92 Å²	92	76.5 Å²	76.5	43%	0.43	40%	0.4	S	S	.	.	G	3₁₀ helix	trans	-61.8	-33.5	175.8	74	-63	155	0	0	111.8	S188 M192 E193	S188-E190 WeakPolarHBondContact CA-OE2 3.36Å; S188-E190 WeakPolarHBondContact CB-OE1 3.29Å; S188-E190 PolarHBondContact O-N 3.05Å; S188-E190 PolarHBondContact OG-OE1 2.99Å; E190-M192 PolarHBondContact O-N 3.3Å; E190-E193 PolarHBondContact O-N 2.85Å
191	K	78.3	Confident	82.9	Confident	116 Å²	116	71 Å²	71	50%	0.504	37%	0.374	S	S	.	.	G	3₁₀ helix	trans	-70.6	0.2	173.5	-63	171.4	-168.7	99.8	0	112.6	S188 P189	S188-K191 VanDerWaalsContact CB-NZ 3.29Å; S188-K191 PolarHBondContact O-N 3.19Å; S188-K191 PolarHBondContact OG-NZ 2.87Å; P189-K191 PolarHBondContact O-N 2.98Å
192	M	83.6	Confident	82.2	Confident	3 Å²	3	70.2 Å²	70.2	2%	0.015	37%	0.373	C	S	.	.	G	3₁₀ helix	trans	-121	4	-176.3	-45.1	174.2	63.3	0	0	113	W186 P189 E190 K194 C209 P210 H272 Y274	W186-M192 HydrophobicContact CD2-CE 3.99Å; W186-M192 HydrophobicContact CD2-SD 4.01Å; W186-M192 HydrophobicContact CE3-CE 3.76Å; W186-M192 HydrophobicContact CE3-SD 3.87Å; W186-M192 HydrophobicContact CG-SD 4.32Å; W186-M192 HydrophobicContact CH2-CE 4.15Å; W186-M192 HydrophobicContact CZ2-CE 4.33Å; W186-M192 HydrophobicContact CZ3-CE 3.87Å; P189-M192 WeakPolarHBondContact O-CA 3.21Å; P189-M192 VanDerWaalsContact O-CB 3.27Å; P189-M192 WeakPolarHBondContact O-CB 3.13Å; P189-M192 PolarHBondContact O-N 3.04Å; E190-M192 PolarHBondContact O-N 3.3Å; M192-K194 VanDerWaalsContact C-N 3.34Å; M192-K194 PolarHBondContact O-N 3Å; M192-C209 HydrophobicContact CE-CB 3.94Å; M192-P210 HydrophobicContact SD-CG 4.4Å; M192-H272 HydrophobicContact CE-CB 3.46Å; M192-H272 VanDerWaalsContact CE-CB 3.46Å; M192-H272 VanDerWaalsContact CE-CG 3.49Å; M192-H272 PolarHBondContact O-CE1 3.15Å; M192-H272 PolarHBondContact O-NE2 3.33Å; M192-Y274 WeakPolarHBondContact CA-OH 3.46Å
193	E	71.9	Confident	81.7	Confident	149 Å²	149	71.6 Å²	71.6	70%	0.696	38%	0.375	S	S	*	.			trans	-69.2	-27.2	-176	-72.6	-177.5	-175.5	0	0	114.6	E190 K195	E190-E193 PolarHBondContact O-N 2.85Å; E193-K195 PolarHBondContact O-N 3.09Å
194	K	75.7	Confident	81.4	Confident	164 Å²	164	73.2 Å²	73.2	71%	0.713	38%	0.38	S	S	*	.			trans	-74.3	66.2	179.4	-69.3	-176	178.6	176.5	0	112.1	M192 L196 Y274	M192-K194 VanDerWaalsContact C-N 3.34Å; M192-K194 PolarHBondContact O-N 3Å; K194-L196 PolarHBondContact O-N 3.49Å; K194-Y274 WeakPolarHBondContact O-CD1 3.25Å
195	K	78.1	Confident	81.2	Confident	133 Å²	133	72.9 Å²	72.9	58%	0.578	38%	0.378	S	S	*	.			trans	-61.5	-24.3	179.5	-70.2	177.7	-179.5	174.6	0	114.1	E193 Y274 Q275	E193-K195 PolarHBondContact O-N 3.09Å; K195-Y274 CarbonylContact O-C 3.45Å; K195-Q275 WeakPolarHBondContact O-CB 3.36Å; K195-Q275 PolarHBondContact O-N 3.09Å
196	L	83.8	Confident	81.3	Confident	104 Å²	104	72.1 Å²	72.1	55%	0.545	38%	0.377	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-110.9	127.6	167.8	179.5	65.5	0	0	0	108.6	K194 Q275	K194-L196 PolarHBondContact O-N 3.49Å; L196-Q275 HydrophobicContact CD1-CB 4.07Å; L196-Q275 HydrophobicContact CD1-CG 3.78Å
197	H	83.6	Confident	81.3	Confident	52 Å²	52	69.3 Å²	69.3	24%	0.241	37%	0.366	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-127.7	101.5	179.8	-168.1	66.7	0	0	0	109	V199 F207 Q275 D277	H197-V199 WeakPolarHBondContact NE2-CG1 3.3Å; H197-F207 HydrophobicContact CB-CE1 3.82Å; H197-F207 HydrophobicContact CB-CZ 4.24Å; H197-F207 AromaticContact CD2-CE1 3.77Å; H197-F207 AromaticContact CG-CE1 3.9Å; H197-Q275 PolarHBondContact N-O 3.33Å; H197-D277 PolarHBondContact O-N 2.89Å
198	A	82.9	Confident	81.3	Confident	67 Å²	67	70.6 Å²	70.6	55%	0.554	37%	0.366	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-99	125.9	177.8	0	0	0	0	0	109.9	D277	A198-D277 VanDerWaalsContact CA-O 3.32Å; A198-D277 WeakPolarHBondContact CA-O 3.18Å; A198-D277 HydrophobicContact CB-CB 4.38Å
199	V	81.1	Confident	81.6	Confident	18 Å²	18	69.5 Å²	69.5	11%	0.109	36%	0.359	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-142.1	149.1	-175.6	-72	0	0	0	0	112.2	H197 V205 V251 L276 D277 V278 V279	H197-V199 WeakPolarHBondContact NE2-CG1 3.3Å; V199-V205 HydrophobicContact CB-CG2 4.49Å; V199-V205 HydrophobicContact CG1-CG2 4.28Å; V199-V205 HydrophobicContact CG2-CG2 3.7Å; V199-V251 HydrophobicContact CG2-CG2 3.74Å; V199-L276 HydrophobicContact CG2-CD1 3.77Å; V199-D277 PolarHBondContact N-O 3.3Å; V199-V278 HydrophobicContact CG2-CG2 4.47Å; V199-V278 WeakPolarHBondContact O-CA 3.28Å; V199-V279 PolarHBondContact O-N 3.36Å
200	P	72.3	Confident	81.9	Confident	56 Å²	56	67 Å²	67	36%	0.364	34%	0.343	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-65.4	149.6	169.9	-19.8	33	0	0	0	112.5	K203 V279 R281	P200-K203 PolarHBondContact O-N 3.4Å; P200-V279 CarbonylContact C-O 3.59Å; P200-V279 WeakPolarHBondContact CA-O 3.37Å; P200-R281 HydrophobicContact CB-CG 4.45Å
201	A	74.7	Confident	82.4	Confident	19 Å²	19	62.9 Å²	62.9	16%	0.157	32%	0.324	C	S	.	.	T	Hydrogen-bonded Turn	trans	-58.2	142.6	171.4	0	0	0	0	0	112	V251 V278 V279 R281	A201-V251 CarbonylContact C-O 3.56Å; A201-V251 WeakPolarHBondContact CA-O 3.25Å; A201-V278 HydrophobicContact CB-CG1 4.02Å; A201-V279 PolarHBondContact N-O 2.58Å; A201-R281 PolarHBondContact O-NE 3.33Å
202	A	66.4	Low	83.1	Confident	57 Å²	57	59.5 Å²	59.5	47%	0.471	32%	0.315	S	S	.	.	T	Hydrogen-bonded Turn	trans	64.4	24.6	-173.5	0	0	0	0	0	116.2	V251	A202-V251 PolarHBondContact N-O 2.89Å
203	K	76.8	Confident	83.3	Confident	85 Å²	85	59.4 Å²	59.4	37%	0.37	32%	0.315	S	S	.	.			trans	-94.4	158.7	154.1	-85	-139	166.3	-167	0	110.8	E159 P200 V251	E159-K203 IonicContact OE1-NZ 3.01Å; E159-K203 PolarHBondContact OE1-NZ 2.87Å; E159-K203 IonicContact OE2-NZ 2.75Å; E159-K203 PolarHBondContact OE2-NZ 2.79Å; P200-K203 PolarHBondContact O-N 3.4Å; K203-V251 WeakPolarHBondContact O-CG2 3.32Å; K203-V251 PolarHBondContact O-N 2.67Å
204	T	81.9	Confident	84.1	Confident	79 Å²	79	54.6 Å²	54.6	49%	0.485	30%	0.295	S	S	.	.			trans	-84.8	139.4	173.8	-66.3	0	0	0	0	111	I247 M248 D249	T204-I247 HydrophobicContact CG2-CG2 3.7Å; T204-M248 WeakPolarHBondContact CA-O 3.43Å; T204-D249 VanDerWaalsContact CG2-OD1 3.3Å; T204-D249 WeakPolarHBondContact CG2-OD1 3.49Å; T204-D249 WeakPolarHBondContact OG1-CA 3.48Å
205	V	89.1	Confident	84.7	Confident	1 Å²	1	49.6 Å²	49.6	1%	0.006	28%	0.28	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-115.6	136.1	177.7	170.5	0	0	0	0	110.3	V199 F207 I247 M248 V251 L276	V199-V205 HydrophobicContact CB-CG2 4.49Å; V199-V205 HydrophobicContact CG1-CG2 4.28Å; V199-V205 HydrophobicContact CG2-CG2 3.7Å; V205-F207 HydrophobicContact CG1-CD1 4.1Å; V205-F207 HydrophobicContact CG1-CD2 4.33Å; V205-F207 HydrophobicContact CG1-CE1 3.68Å; V205-F207 HydrophobicContact CG1-CE2 3.94Å; V205-F207 HydrophobicContact CG1-CG 4.41Å; V205-F207 HydrophobicContact CG1-CZ 3.59Å; V205-I247 WeakPolarHBondContact O-CA 3.36Å; V205-M248 HydrophobicContact CB-CB 4.47Å; V205-M248 HydrophobicContact CB-CE 4.38Å; V205-M248 HydrophobicContact CG1-CE 3.96Å; V205-M248 PolarHBondContact N-O 3.26Å; V205-M248 PolarHBondContact O-N 2.84Å; V205-V251 HydrophobicContact CB-CG1 3.85Å; V205-V251 HydrophobicContact CG2-CB 4.43Å; V205-V251 HydrophobicContact CG2-CG1 3.57Å; V205-V251 HydrophobicContact CG2-CG2 4.02Å; V205-L276 HydrophobicContact CG1-CD1 4.38Å; V205-L276 HydrophobicContact CG2-CD1 4.03Å
206	K	91.1	Very high	85	Confident	98 Å²	98	50.3 Å²	50.3	43%	0.426	29%	0.29	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-129.1	108.8	177.4	-173.3	166.7	-170.7	171.7	0	111.2	S245 I246 I247	K206-S245 WeakPolarHBondContact CE-OG 3.47Å; K206-I246 WeakPolarHBondContact CA-O 3.39Å; K206-I247 HydrophobicContact CD-CD1 4.25Å; K206-I247 HydrophobicContact CD-CG1 3.92Å; K206-I247 HydrophobicContact CG-CG1 3.95Å
207	F	93	Very high	85.4	Confident	5 Å²	5	45.9 Å²	45.9	2%	0.022	27%	0.268	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-95.9	142.2	171.3	-59.3	-42.9	0	0	0	110	H197 V205 W221 S245 I246 M248 Y259 Y274 L276	H197-F207 HydrophobicContact CB-CE1 3.82Å; H197-F207 HydrophobicContact CB-CZ 4.24Å; H197-F207 AromaticContact CD2-CE1 3.77Å; H197-F207 AromaticContact CG-CE1 3.9Å; V205-F207 HydrophobicContact CG1-CD1 4.1Å; V205-F207 HydrophobicContact CG1-CD2 4.33Å; V205-F207 HydrophobicContact CG1-CE1 3.68Å; V205-F207 HydrophobicContact CG1-CE2 3.94Å; V205-F207 HydrophobicContact CG1-CG 4.41Å; V205-F207 HydrophobicContact CG1-CZ 3.59Å; F207-W221 HydrophobicContact CB-CH2 3.51Å; F207-W221 HydrophobicContact CB-CZ2 4.38Å; F207-W221 HydrophobicContact CB-CZ3 3.94Å; F207-W221 HydrophobicContact CD2-CZ3 4.38Å; F207-S245 CarbonylContact O-C 3.54Å; F207-S245 VanDerWaalsContact O-CA 3.23Å; F207-S245 WeakPolarHBondContact O-CA 3.32Å; F207-S245 WeakPolarHBondContact O-CB 3.43Å; F207-I246 HydrophobicContact CB-CG2 3.85Å; F207-I246 HydrophobicContact CD2-CG2 4.34Å; F207-I246 PolarHBondContact N-O 2.73Å; F207-I246 PolarHBondContact O-N 2.93Å; F207-M248 HydrophobicContact CD2-CE 3.9Å; F207-M248 HydrophobicContact CE2-CE 3.62Å; F207-Y259 HydrophobicContact CD2-CG 4.21Å; F207-Y259 HydrophobicContact CE2-CD1 4.4Å; F207-Y259 AromaticContact CE2-CD2 4Å; F207-Y259 HydrophobicContact CE2-CD2 4Å; F207-Y259 AromaticContact CE2-CG 3.82Å; F207-Y259 HydrophobicContact CE2-CG 3.82Å; F207-Y274 HydrophobicContact CB-CD2 3.86Å; F207-Y274 HydrophobicContact CB-CE2 3.8Å; F207-Y274 HydrophobicContact CB-CG 4.34Å; F207-Y274 AromaticContact CD1-CD1 3.64Å; F207-Y274 HydrophobicContact CD1-CD1 3.64Å; F207-Y274 HydrophobicContact CD1-CD2 4.08Å; F207-Y274 AromaticContact CD1-CE1 3.99Å; F207-Y274 HydrophobicContact CD1-CE1 3.99Å; F207-Y274 HydrophobicContact CD1-CE2 4.4Å; F207-Y274 AromaticContact CD1-CG 3.67Å; F207-Y274 HydrophobicContact CD1-CG 3.67Å; F207-Y274 HydrophobicContact CD2-CD2 4.31Å; F207-Y274 HydrophobicContact CD2-CG 4.28Å; F207-Y274 AromaticContact CE1-CD1 3.88Å; F207-Y274 HydrophobicContact CE1-CD1 3.88Å; F207-Y274 AromaticContact CE1-CG 3.96Å; F207-Y274 HydrophobicContact CE1-CG 3.96Å; F207-Y274 HydrophobicContact CG-CD1 4.27Å; F207-Y274 AromaticContact CG-CD2 3.85Å; F207-Y274 HydrophobicContact CG-CD2 3.85Å; F207-Y274 HydrophobicContact CG-CE2 4.22Å; F207-Y274 AromaticContact CG-CG 3.86Å; F207-Y274 HydrophobicContact CG-CG 3.86Å; F207-Y274 HydrophobicContact CZ-CG 4.37Å; F207-L276 HydrophobicContact CE2-CB 4.31Å; F207-L276 HydrophobicContact CZ-CB 3.99Å; F207-L276 HydrophobicContact CZ-CD1 4.3Å
208	K	90.8	Very high	85.7	Confident	92 Å²	92	47.6 Å²	47.6	40%	0.4	28%	0.282	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-128.1	131.6	-175	-59	-178	178.4	178.6	0	109.3	P210 Y274	K208-P210 WeakPolarHBondContact O-CD 3.4Å; K208-Y274 PolarHBondContact O-OH 3.23Å
209	C	92.6	Very high	86.1	Confident	0 Å²	0	44.9 Å²	44.9	0%	0	26%	0.258	C	S	.	.			trans	-126.6	61.4	175.1	-67.4	0	0	0	0	111.3	W186 M192 S211 W221 W244 C261	W186-C209 HydrophobicContact CH2-CB 4.4Å; W186-C209 HydrophobicContact CZ3-CB 3.77Å; M192-C209 HydrophobicContact CE-CB 3.94Å; C209-S211 PolarHBondContact O-N 3.19Å; C209-S211 PolarHBondContact O-OG 3.38Å; C209-W221 HydrophobicContact CB-CZ2 4.41Å; C209-W221 WeakPolarHBondContact SG-CH2 3.4Å; C209-W244 PolarHBondContact N-O 3.01Å; C209-W244 VanDerWaalsContact O-CB 3.29Å; C209-W244 WeakPolarHBondContact O-CB 3.44Å; C209-C261 HydrophobicContact CB-CB 3.7Å; C209-C261 WeakPolarHBondContact CB-SG 3.46Å; C209-C261 WeakPolarHBondContact SG-CB 3.36Å; C209-C261 CovalentContact SG-SG 2.02Å; C209-C261 PolarHBondContact SG-SG 3.21Å
210	P	92	Very high	86.6	Confident	17 Å²	17	48.5 Å²	48.5	11%	0.11	27%	0.27	C	S	.	.			trans	-60.3	121.9	-173.5	25.9	-35.4	0	0	0	112	W186 T187 M192 K208	W186-P210 CarbonylContact C-O 3.57Å; W186-P210 WeakPolarHBondContact CA-O 3.38Å; T187-P210 PolarHBondContact N-O 2.93Å; T187-P210 VanDerWaalsContact OG1-C 3.26Å; T187-P210 PolarHBondContact OG1-O 3.07Å; M192-P210 HydrophobicContact SD-CG 4.4Å; K208-P210 WeakPolarHBondContact O-CD 3.4Å
211	S	92.1	Very high	87.7	Confident	5 Å²	5	46.1 Å²	46.1	4%	0.035	25%	0.253	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-138.7	164	-172	-67.9	0	0	0	0	112.8	Y185 W186 T187 C209 W244	Y185-S211 CarbonylContact O-C 3.58Å; Y185-S211 VanDerWaalsContact O-CA 3.22Å; Y185-S211 WeakPolarHBondContact O-CA 3.05Å; W186-S211 WeakPolarHBondContact CZ3-OG 3.36Å; T187-S211 PolarHBondContact OG1-N 2.94Å; C209-S211 PolarHBondContact O-N 3.19Å; C209-S211 PolarHBondContact O-OG 3.38Å; S211-W244 PolarHBondContact O-NE1 3.29Å
212	S	91.4	Very high	88.4	Confident	45 Å²	45	46.4 Å²	46.4	32%	0.315	25%	0.252	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-144.7	163.7	165.7	-175.9	0	0	0	0	109.9	P184 Y185	P184-S212 CarbonylContact C-O 3.56Å; P184-S212 VanDerWaalsContact CA-O 3.29Å; P184-S212 WeakPolarHBondContact CA-O 3.4Å; Y185-S212 WeakPolarHBondContact CD1-O 3.4Å; Y185-S212 PolarHBondContact N-O 3.42Å; Y185-S212 PolarHBondContact O-N 2.79Å
213	G	88.8	Confident	89.6	Confident	1 Å²	1	45.2 Å²	45.2	1%	0.01	24%	0.236	C	C	.	.	E	Extended strand (participates in β ladder)	trans	177.2	163.3	-178.4	0	0	0	0	0	111.1	P215 N216	G213-P215 CarbonylContact C-O 3.47Å; G213-P215 CarbonylContact O-C 3.57Å; G213-N216 PolarHBondContact O-N 3.22Å
214	T	87.8	Confident	90.2	Very high	48 Å²	48	45.9 Å²	45.9	29%	0.294	24%	0.244	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-133.6	111.1	-178.3	-55.7	0	0	0	0	110	P179 V182 Y267	P179-T214 HydrophobicContact CB-CG2 4.03Å; P179-T214 HydrophobicContact CG-CG2 3.81Å; V182-T214 PolarHBondContact N-O 2.68Å; V182-T214 PolarHBondContact O-N 3.28Å; T214-Y267 WeakPolarHBondContact O-CD2 3.49Å
215	P	87.8	Confident	90.4	Very high	59 Å²	59	44.9 Å²	44.9	38%	0.383	25%	0.249	S	C	.	.	S	Bend	cis	-60.4	163.6	-3.7	-25	34.5	0	0	0	115.2	G213 P217 N265 E266	G213-P215 CarbonylContact C-O 3.47Å; G213-P215 CarbonylContact O-C 3.57Å; P215-P217 WeakPolarHBondContact O-CD 3.37Å; P215-N265 PolarHBondContact O-ND2 2.73Å; P215-E266 WeakPolarHBondContact CD-OE1 3.35Å; P215-E266 WeakPolarHBondContact CG-OE1 3.46Å
216	N	86.3	Confident	90.4	Very high	148 Å²	148	52.8 Å²	52.8	79%	0.791	28%	0.283	S	S	*	.	P	Polyproline II helix	trans	-50.4	119.3	175	-73.3	-8.8	0	0	0	110.4	G213	G213-N216 PolarHBondContact O-N 3.22Å
217	P	90.9	Very high	90.2	Very high	12 Å²	12	52.9 Å²	52.9	8%	0.078	29%	0.285	C	S	.	.	P	Polyproline II helix	trans	-77.1	157.8	-175.7	28.9	-31	0	0	0	112	P184 P215 W244 V263 E264 N265	P184-P217 HydrophobicContact CB-CB 4.06Å; P184-P217 HydrophobicContact CB-CG 4.03Å; P215-P217 WeakPolarHBondContact O-CD 3.37Å; P217-W244 HydrophobicContact CG-CH2 3.74Å; P217-W244 HydrophobicContact CG-CZ3 4.36Å; P217-W244 WeakPolarHBondContact O-CH2 3.32Å; P217-V263 HydrophobicContact CB-CG1 3.58Å; P217-V263 HydrophobicContact CG-CG1 3.56Å; P217-E264 CarbonylContact C-O 3.38Å; P217-E264 VanDerWaalsContact CA-O 3.25Å; P217-E264 WeakPolarHBondContact CA-O 3.33Å; P217-E264 VanDerWaalsContact CB-O 3.32Å; P217-E264 WeakPolarHBondContact CB-O 3.5Å; P217-N265 HydrophobicContact CB-CB 4.06Å
218	T	90	Very high	89.9	Confident	87 Å²	87	53 Å²	53	53%	0.534	29%	0.286	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-86.4	151.1	173.7	62.5	0	0	0	0	110.7	V263 E264	T218-V263 VanDerWaalsContact O-CA 3.25Å; T218-V263 WeakPolarHBondContact O-CA 3.33Å; T218-E264 PolarHBondContact N-O 2.81Å; T218-E264 PolarHBondContact O-N 3.08Å; T218-E264 VanDerWaalsContact O-N 3.11Å; T218-E264 PolarHBondContact OG1-O 3.19Å
219	L	92.6	Very high	89.3	Confident	11 Å²	11	52.4 Å²	52.4	6%	0.058	28%	0.283	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-113.1	126.2	175.2	172.4	64	0	0	0	109.9	V239 Y241 W244 C261 V263	L219-V239 HydrophobicContact CD2-CG1 4.24Å; L219-Y241 HydrophobicContact CB-CD1 4.17Å; L219-Y241 HydrophobicContact CB-CE1 4.46Å; L219-W244 HydrophobicContact CB-CE3 3.98Å; L219-W244 HydrophobicContact CB-CZ3 3.93Å; L219-W244 HydrophobicContact CD2-CB 4.49Å; L219-W244 HydrophobicContact CD2-CE3 4.2Å; L219-W244 HydrophobicContact CG-CE3 4.46Å; L219-C261 HydrophobicContact CD1-CB 4.11Å; L219-V263 HydrophobicContact CD1-CG2 3.64Å
220	R	91.4	Very high	88.2	Confident	94 Å²	94	55.6 Å²	55.6	36%	0.355	30%	0.304	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-133	153	169.5	61.3	-174.9	169.9	101.8	-0.9	111.5	I262 E264	R220-I262 HydrophobicContact CG-CB 3.99Å; R220-I262 PolarHBondContact N-O 2.88Å; R220-I262 PolarHBondContact O-N 3.25Å; R220-E264 IonicContact CZ-OE1 3.88Å; R220-E264 VanDerWaalsContact CZ-OE1 3.26Å; R220-E264 IonicContact CZ-OE2 3.93Å; R220-E264 IonicContact NE-OE1 3.59Å; R220-E264 PolarHBondContact NE-OE1 3.18Å; R220-E264 IonicContact NE-OE2 3.72Å; R220-E264 VanDerWaalsContact NH2-CD 3.28Å; R220-E264 IonicContact NH2-OE1 2.67Å; R220-E264 PolarHBondContact NH2-OE1 2.9Å; R220-E264 IonicContact NH2-OE2 3.22Å; R220-E264 PolarHBondContact NH2-OE2 2.93Å
221	W	93.5	Very high	87.1	Confident	5 Å²	5	61.3 Å²	61.3	2%	0.019	33%	0.334	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-115.9	142.8	179.8	-72	86.5	0	0	0	110.9	F207 C209 F228 I246 T260 C261 Y274	F207-W221 HydrophobicContact CB-CH2 3.51Å; F207-W221 HydrophobicContact CB-CZ2 4.38Å; F207-W221 HydrophobicContact CB-CZ3 3.94Å; F207-W221 HydrophobicContact CD2-CZ3 4.38Å; C209-W221 HydrophobicContact CB-CZ2 4.41Å; C209-W221 WeakPolarHBondContact SG-CH2 3.4Å; W221-F228 HydrophobicContact CB-CB 4.27Å; W221-F228 WeakPolarHBondContact O-CB 3.49Å; W221-F228 PolarHBondContact O-N 3.35Å; W221-I246 HydrophobicContact CB-CD1 4.32Å; W221-I246 HydrophobicContact CD2-CB 4.09Å; W221-I246 HydrophobicContact CD2-CD1 4.32Å; W221-I246 HydrophobicContact CD2-CG2 3.69Å; W221-I246 VanDerWaalsContact CE2-CG2 3.45Å; W221-I246 HydrophobicContact CE3-CG2 3.87Å; W221-I246 HydrophobicContact CG-CB 4.37Å; W221-I246 HydrophobicContact CG-CD1 4.05Å; W221-I246 HydrophobicContact CG-CG2 4.42Å; W221-I246 HydrophobicContact CH2-CG2 3.64Å; W221-I246 HydrophobicContact CZ2-CB 4.04Å; W221-I246 HydrophobicContact CZ2-CG2 3.45Å; W221-I246 VanDerWaalsContact CZ2-CG2 3.45Å; W221-I246 HydrophobicContact CZ3-CG2 3.84Å; W221-T260 CarbonylContact C-O 3.57Å; W221-T260 WeakPolarHBondContact CA-O 3.33Å; W221-C261 HydrophobicContact CD2-CB 3.88Å; W221-C261 HydrophobicContact CE3-CB 3.79Å; W221-C261 HydrophobicContact CH2-CB 3.62Å; W221-C261 HydrophobicContact CZ2-CB 3.69Å; W221-C261 HydrophobicContact CZ3-CB 3.68Å; W221-Y274 HydrophobicContact CH2-CD2 4.34Å; W221-Y274 HydrophobicContact CH2-CE2 4.22Å; W221-Y274 HydrophobicContact CZ3-CD2 4.2Å
222	L	91.1	Very high	85.9	Confident	25 Å²	25	65.9 Å²	65.9	13%	0.131	35%	0.354	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-116.8	144.8	169.8	-48.7	-175	0	0	0	109.9	K226 E227 Y259 T260 I262	L222-K226 CarbonylContact C-O 3.49Å; L222-K226 WeakPolarHBondContact CA-O 3.49Å; L222-K226 WeakPolarHBondContact CB-O 3.46Å; L222-E227 HydrophobicContact CD2-CB 4.43Å; L222-Y259 CarbonylContact O-C 3.55Å; L222-Y259 WeakPolarHBondContact O-CA 3.41Å; L222-T260 PolarHBondContact N-O 2.77Å; L222-T260 PolarHBondContact O-N 2.98Å; L222-I262 HydrophobicContact CD1-CD1 3.58Å; L222-I262 HydrophobicContact CD2-CD1 4.43Å; L222-I262 HydrophobicContact CG-CD1 3.91Å
223	K	91.6	Very high	84.7	Confident	32 Å²	32	64.8 Å²	64.8	14%	0.139	34%	0.343	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-115.8	120.9	167	-176.5	177.1	-179.6	179.4	0	108.2	G225 K226 F228 S254 D255 N258 Y259	K223-G225 PolarHBondContact O-N 3.07Å; K223-K226 PolarHBondContact N-O 3.36Å; K223-K226 PolarHBondContact O-N 3.3Å; K223-F228 HydrophobicContact CB-CB 4.14Å; K223-F228 HydrophobicContact CB-CD2 3.53Å; K223-F228 HydrophobicContact CB-CE2 4.11Å; K223-F228 HydrophobicContact CB-CG 3.89Å; K223-F228 HydrophobicContact CD-CD2 3.8Å; K223-F228 HydrophobicContact CD-CE2 3.47Å; K223-F228 VanDerWaalsContact CD-CE2 3.47Å; K223-F228 HydrophobicContact CD-CZ 4.15Å; K223-F228 HydrophobicContact CG-CD2 4.32Å; K223-F228 HydrophobicContact CG-CE2 4.43Å; K223-S254 PolarHBondContact NZ-O 2.7Å; K223-D255 IonicContact NZ-OD1 3.24Å; K223-D255 PolarHBondContact NZ-OD1 3.23Å; K223-N258 CarbonylContact C-O 3.43Å; K223-N258 WeakPolarHBondContact CA-O 3.49Å; K223-Y259 HydrophobicContact CB-CE1 4.35Å; K223-Y259 HydrophobicContact CD-CE1 4.08Å; K223-Y259 HydrophobicContact CD-CE2 4.34Å; K223-Y259 WeakPolarHBondContact CD-OH 3.08Å; K223-Y259 WeakPolarHBondContact CE-OH 3.5Å; K223-Y259 HydrophobicContact CG-CE1 4.21Å; K223-Y259 HydrophobicContact CG-CE2 4.24Å; K223-Y259 PolarHBondContact NZ-OH 3.29Å
224	N	89.3	Confident	82.8	Confident	100 Å²	100	69.6 Å²	69.6	54%	0.535	37%	0.368	S	S	.	.	T	Hydrogen-bonded Turn	trans	50.6	39.5	-176	-58.7	-31.8	0	0	0	113.1	K226 G257 N258	N224-K226 VanDerWaalsContact C-N 3.29Å; N224-K226 PolarHBondContact O-N 2.95Å; N224-G257 WeakPolarHBondContact OD1-CA 3.42Å; N224-N258 PolarHBondContact N-O 3Å; N224-N258 PolarHBondContact OD1-N 3.18Å
225	G	85.5	Confident	81.3	Confident	57 Å²	57	67.9 Å²	67.9	59%	0.588	36%	0.36	S	S	*	.	T	Hydrogen-bonded Turn	trans	79.3	-3.9	179.8	0	0	0	0	0	116.1	K223	K223-G225 PolarHBondContact O-N 3.07Å
226	K	88.1	Confident	80.4	Confident	167 Å²	167	66.7 Å²	66.7	73%	0.726	36%	0.358	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-98.8	149.2	171.9	-64.5	-173	178.6	-175.4	0	110.7	L222 K223 N224 F228	L222-K226 CarbonylContact C-O 3.49Å; L222-K226 WeakPolarHBondContact CA-O 3.49Å; L222-K226 WeakPolarHBondContact CB-O 3.46Å; K223-K226 PolarHBondContact N-O 3.36Å; K223-K226 PolarHBondContact O-N 3.3Å; N224-K226 VanDerWaalsContact C-N 3.29Å; N224-K226 PolarHBondContact O-N 2.95Å; K226-F228 PolarHBondContact O-N 3.08Å
227	E	87.3	Confident	80.3	Confident	100 Å²	100	62.2 Å²	62.2	47%	0.467	33%	0.331	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-53.4	135.7	175.5	-163	-176.6	-176.6	0	0	111.2	L222 K229 H232	L222-E227 HydrophobicContact CD2-CB 4.43Å; E227-K229 VanDerWaalsContact CD-NZ 3.3Å; E227-K229 WeakPolarHBondContact OE1-CE 3.5Å; E227-K229 IonicContact OE1-NZ 2.59Å; E227-K229 PolarHBondContact OE1-NZ 3.43Å; E227-K229 WeakPolarHBondContact OE2-CE 3.32Å; E227-K229 IonicContact OE2-NZ 2.76Å; E227-K229 PolarHBondContact OE2-NZ 3.43Å; E227-H232 PolarHBondContact O-CE1 3.38Å; E227-H232 PolarHBondContact O-ND1 2.93Å
228	F	86.3	Confident	79.9	Confident	7 Å²	7	67.5 Å²	67.5	3%	0.031	35%	0.352	C	S	.	.			trans	-108.9	118.5	-177.3	-165	-126.3	0	0	0	110.2	W221 K223 K226 H232 R233 Y237 I246 M248 Y259	W221-F228 HydrophobicContact CB-CB 4.27Å; W221-F228 WeakPolarHBondContact O-CB 3.49Å; W221-F228 PolarHBondContact O-N 3.35Å; K223-F228 HydrophobicContact CB-CB 4.14Å; K223-F228 HydrophobicContact CB-CD2 3.53Å; K223-F228 HydrophobicContact CB-CE2 4.11Å; K223-F228 HydrophobicContact CB-CG 3.89Å; K223-F228 HydrophobicContact CD-CD2 3.8Å; K223-F228 HydrophobicContact CD-CE2 3.47Å; K223-F228 VanDerWaalsContact CD-CE2 3.47Å; K223-F228 HydrophobicContact CD-CZ 4.15Å; K223-F228 HydrophobicContact CG-CD2 4.32Å; K223-F228 HydrophobicContact CG-CE2 4.43Å; K226-F228 PolarHBondContact O-N 3.08Å; F228-H232 HydrophobicContact CD2-CB 3.77Å; F228-H232 HydrophobicContact CE2-CB 3.79Å; F228-R233 HydrophobicContact CZ-CB 4.33Å; F228-R233 HydrophobicContact CZ-CG 4.26Å; F228-Y237 HydrophobicContact CD1-CD2 4.34Å; F228-Y237 AromaticContact CD1-CE2 3.63Å; F228-Y237 HydrophobicContact CD1-CE2 3.63Å; F228-Y237 AromaticContact CE1-CD2 3.85Å; F228-Y237 HydrophobicContact CE1-CD2 3.85Å; F228-Y237 AromaticContact CE1-CE2 3.6Å; F228-Y237 HydrophobicContact CE1-CE2 3.6Å; F228-Y237 HydrophobicContact CG-CE2 4.44Å; F228-Y237 HydrophobicContact CZ-CD2 4.41Å; F228-Y237 HydrophobicContact CZ-CE2 4.44Å; F228-Y237 PolarHBondContact O-OH 2.88Å; F228-I246 HydrophobicContact CD1-CD1 3.71Å; F228-I246 HydrophobicContact CE1-CD1 3.79Å; F228-M248 HydrophobicContact CE1-SD 3.85Å; F228-M248 HydrophobicContact CZ-SD 4.16Å; F228-Y259 HydrophobicContact CD1-CD1 4.29Å; F228-Y259 AromaticContact CD1-CE1 3.93Å; F228-Y259 HydrophobicContact CD1-CE1 3.93Å; F228-Y259 HydrophobicContact CE1-CD1 4.26Å; F228-Y259 AromaticContact CE1-CE1 3.52Å; F228-Y259 HydrophobicContact CE1-CE1 3.52Å; F228-Y259 HydrophobicContact CE2-CE1 4.39Å; F228-Y259 AromaticContact CZ-CE1 3.76Å; F228-Y259 HydrophobicContact CZ-CE1 3.76Å
229	K	79.9	Confident	79.7	Confident	80 Å²	80	64.7 Å²	64.7	35%	0.348	34%	0.335	S	S	.	.			trans	-121.7	162.7	-175.5	-67.6	-173.6	-178.7	170.1	0	109.5	E227 D231 H232	E227-K229 VanDerWaalsContact CD-NZ 3.3Å; E227-K229 WeakPolarHBondContact OE1-CE 3.5Å; E227-K229 IonicContact OE1-NZ 2.59Å; E227-K229 PolarHBondContact OE1-NZ 3.43Å; E227-K229 WeakPolarHBondContact OE2-CE 3.32Å; E227-K229 IonicContact OE2-NZ 2.76Å; E227-K229 PolarHBondContact OE2-NZ 3.43Å; K229-D231 PolarHBondContact O-N 2.88Å; K229-H232 WeakPolarHBondContact O-CB 3.44Å; K229-H232 PolarHBondContact O-N 3.22Å
230	P	69.4	Low	79.4	Confident	67 Å²	67	71.1 Å²	71.1	44%	0.435	36%	0.359	S	S	.	.	G	3₁₀ helix	trans	-48.3	-49.8	175.8	-24.4	31.7	0	0	0	111.8	H232 R233 Y237	P230-H232 PolarHBondContact O-N 3.29Å; P230-R233 PolarHBondContact O-N 3.41Å; P230-R233 VanDerWaalsContact O-N 3.16Å; P230-Y237 HydrophobicContact CB-CD1 3.93Å; P230-Y237 HydrophobicContact CB-CE1 4.42Å; P230-Y237 HydrophobicContact CB-CG 4.22Å; P230-Y237 HydrophobicContact CG-CD1 3.64Å; P230-Y237 HydrophobicContact CG-CE1 3.71Å; P230-Y237 HydrophobicContact CG-CG 4.38Å
231	D	68.9	Low	79	Confident	138 Å²	138	73.9 Å²	73.9	74%	0.738	37%	0.37	S	S	*	.	G	3₁₀ helix	trans	-60.6	-10	-178.3	-30.3	-30.6	0	0	0	114.6	K229	K229-D231 PolarHBondContact O-N 2.88Å
232	H	65.3	Low	78.2	Confident	101 Å²	101	78.4 Å²	78.4	47%	0.468	41%	0.409	S	S	.	.	G	3₁₀ helix	trans	-89.3	2.7	179.4	-63.5	177.8	0	0	0	113.4	E227 F228 K229 P230	E227-H232 PolarHBondContact O-CE1 3.38Å; E227-H232 PolarHBondContact O-ND1 2.93Å; F228-H232 HydrophobicContact CD2-CB 3.77Å; F228-H232 HydrophobicContact CE2-CB 3.79Å; K229-H232 WeakPolarHBondContact O-CB 3.44Å; K229-H232 PolarHBondContact O-N 3.22Å; P230-H232 PolarHBondContact O-N 3.29Å
233	R	66.5	Low	77.7	Confident	22 Å²	22	80.5 Å²	80.5	8%	0.083	42%	0.422	C	S	.	.			trans	-145.6	170.7	167.2	73.1	178.4	-54.5	-112.9	-0.3	111.3	F228 P230 G235 G236 M248 D249 D255	F228-R233 HydrophobicContact CZ-CB 4.33Å; F228-R233 HydrophobicContact CZ-CG 4.26Å; P230-R233 PolarHBondContact O-N 3.41Å; P230-R233 VanDerWaalsContact O-N 3.16Å; R233-G235 WeakPolarHBondContact CG-O 3.31Å; R233-G235 PolarHBondContact NH1-O 2.92Å; R233-G236 PolarHBondContact NH1-O 3.28Å; R233-M248 VanDerWaalsContact NH1-C 3.35Å; R233-M248 VanDerWaalsContact NH1-CA 3.34Å; R233-D249 VanDerWaalsContact NH1-N 3.19Å; R233-D249 PolarHBondContact NH1-O 3.08Å; R233-D249 PolarHBondContact NH2-O 3.02Å; R233-D255 IonicContact CZ-OD2 3.21Å; R233-D255 IonicContact NE-OD1 2.8Å; R233-D255 PolarHBondContact NE-OD1 2.98Å; R233-D255 VanDerWaalsContact NE-OD1 3.16Å; R233-D255 IonicContact NE-OD2 2.71Å; R233-D255 PolarHBondContact NE-OD2 2.83Å; R233-D255 IonicContact NH2-OD2 3.4Å; R233-D255 PolarHBondContact NH2-OD2 3.18Å
234	I	49.8	Very low	77.6	Confident	101 Å²	101	81.3 Å²	81.3	52%	0.518	43%	0.425	S	S	.	.	S	Bend	trans	-105	-24.8	-175.3	-36	-179.5	0	0	0	112.3	P736 E738	I234-P736 HydrophobicContact CG2-CB 4.01Å; I234-E738 WeakPolarHBondContact CG2-OE2 3.32Å
235	G	56.9	Low	77.6	Confident	13 Å²	13	76.6 Å²	76.6	13%	0.134	40%	0.399	C	S	.	.	S	Bend	trans	-83.8	161.2	173.2	0	0	0	0	0	113.5	R233 Y237	R233-G235 WeakPolarHBondContact CG-O 3.31Å; R233-G235 PolarHBondContact NH1-O 2.92Å; G235-Y237 PolarHBondContact O-N 3.49Å
236	G	68.6	Low	77.8	Confident	34 Å²	34	73.9 Å²	73.9	35%	0.351	37%	0.371	S	S	.	.			trans	-50.7	124.8	-174.8	0	0	0	0	0	114.5	R233 M248 D249	R233-G236 PolarHBondContact NH1-O 3.28Å; G236-M248 CarbonylContact O-C 3.54Å; G236-M248 WeakPolarHBondContact O-CA 3.26Å; G236-D249 PolarHBondContact O-N 2.94Å
237	Y	83.2	Confident	77.9	Confident	53 Å²	53	66.7 Å²	66.7	21%	0.208	34%	0.34	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-116.2	121.5	-178.1	173.5	-77.5	0	0	0	109	F228 P230 G235 V239 I246	F228-Y237 HydrophobicContact CD1-CD2 4.34Å; F228-Y237 AromaticContact CD1-CE2 3.63Å; F228-Y237 HydrophobicContact CD1-CE2 3.63Å; F228-Y237 AromaticContact CE1-CD2 3.85Å; F228-Y237 HydrophobicContact CE1-CD2 3.85Å; F228-Y237 AromaticContact CE1-CE2 3.6Å; F228-Y237 HydrophobicContact CE1-CE2 3.6Å; F228-Y237 HydrophobicContact CG-CE2 4.44Å; F228-Y237 HydrophobicContact CZ-CD2 4.41Å; F228-Y237 HydrophobicContact CZ-CE2 4.44Å; F228-Y237 PolarHBondContact O-OH 2.88Å; P230-Y237 HydrophobicContact CB-CD1 3.93Å; P230-Y237 HydrophobicContact CB-CE1 4.42Å; P230-Y237 HydrophobicContact CB-CG 4.22Å; P230-Y237 HydrophobicContact CG-CD1 3.64Å; P230-Y237 HydrophobicContact CG-CE1 3.71Å; P230-Y237 HydrophobicContact CG-CG 4.38Å; G235-Y237 PolarHBondContact O-N 3.49Å; Y237-V239 HydrophobicContact CE1-CG2 3.74Å; Y237-V239 WeakPolarHBondContact OH-CG2 3.46Å; Y237-I246 HydrophobicContact CD2-CD1 4.17Å; Y237-I246 HydrophobicContact CE2-CD1 3.6Å; Y237-I246 HydrophobicContact CE2-CG1 4.39Å
238	K	83.6	Confident	77.9	Confident	123 Å²	123	61.9 Å²	61.9	54%	0.535	32%	0.318	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-137.7	114.7	176.4	-61.9	174.8	-175.5	169.1	0	110.4	I247	K238-I247 HydrophobicContact CB-CB 4.3Å; K238-I247 PolarHBondContact N-O 3.17Å; K238-I247 PolarHBondContact O-N 3.17Å
239	V	85.6	Confident	77.6	Confident	28 Å²	28	63.4 Å²	63.4	17%	0.17	33%	0.327	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-94.9	114.8	168.3	173.2	0	0	0	0	108.6	L219 Y237 Y241 S245 I246	L219-V239 HydrophobicContact CD2-CG1 4.24Å; Y237-V239 HydrophobicContact CE1-CG2 3.74Å; Y237-V239 WeakPolarHBondContact OH-CG2 3.46Å; V239-Y241 HydrophobicContact CG1-CD1 4.1Å; V239-Y241 HydrophobicContact CG1-CD2 4.43Å; V239-Y241 HydrophobicContact CG1-CE1 3.83Å; V239-Y241 HydrophobicContact CG1-CE2 4.18Å; V239-Y241 HydrophobicContact CG1-CG 4.39Å; V239-S245 CarbonylContact C-O 3.4Å; V239-S245 WeakPolarHBondContact CA-O 3.5Å; V239-I246 HydrophobicContact CG2-CB 4.2Å; V239-I246 HydrophobicContact CG2-CD1 4.2Å; V239-I246 HydrophobicContact CG2-CG1 3.94Å
240	R	85.3	Confident	77.3	Confident	147 Å²	147	62.5 Å²	62.5	56%	0.555	33%	0.33	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-99.8	90.7	175.4	-70.6	-166.4	-178.4	-151.6	4	109.4	A242 T243 W244 S245	R240-A242 VanDerWaalsContact C-N 3.33Å; R240-A242 PolarHBondContact O-N 3.43Å; R240-T243 VanDerWaalsContact CB-OG1 3.24Å; R240-T243 WeakPolarHBondContact CB-OG1 3.45Å; R240-T243 CarbonylContact O-C 3.54Å; R240-T243 PolarHBondContact O-N 3.26Å; R240-T243 PolarHBondContact O-OG1 2.95Å; R240-W244 PolarHBondContact O-N 3Å; R240-W244 VanDerWaalsContact O-N 3.07Å; R240-S245 PolarHBondContact N-O 3.23Å; R240-S245 PolarHBondContact O-N 2.59Å
241	Y	82.6	Confident	77.6	Confident	152 Å²	152	59.3 Å²	59.3	60%	0.596	31%	0.309	S	S	*	.	G	3₁₀ helix	trans	-51.7	-46.5	-178.9	-61.7	-79.8	0	0	0	113.1	L219 V239 T243 W244	L219-Y241 HydrophobicContact CB-CD1 4.17Å; L219-Y241 HydrophobicContact CB-CE1 4.46Å; V239-Y241 HydrophobicContact CG1-CD1 4.1Å; V239-Y241 HydrophobicContact CG1-CD2 4.43Å; V239-Y241 HydrophobicContact CG1-CE1 3.83Å; V239-Y241 HydrophobicContact CG1-CE2 4.18Å; V239-Y241 HydrophobicContact CG1-CG 4.39Å; Y241-T243 PolarHBondContact O-N 3.36Å; Y241-T243 VanDerWaalsContact O-N 3.1Å; Y241-W244 PolarHBondContact O-N 3.48Å
242	A	77.3	Confident	77.8	Confident	100 Å²	100	54.4 Å²	54.4	83%	0.826	28%	0.284	S	S	*	.	G	3₁₀ helix	trans	-59.8	-21.2	178.5	0	0	0	0	0	114.9	R240	R240-A242 VanDerWaalsContact C-N 3.33Å; R240-A242 PolarHBondContact O-N 3.43Å
243	T	81.3	Confident	78.3	Confident	68 Å²	68	52.3 Å²	52.3	42%	0.417	28%	0.28	S	S	.	.	G	3₁₀ helix	trans	-114	12.5	175.5	62.4	0	0	0	0	112.5	R240 Y241 S245	R240-T243 VanDerWaalsContact CB-OG1 3.24Å; R240-T243 WeakPolarHBondContact CB-OG1 3.45Å; R240-T243 CarbonylContact O-C 3.54Å; R240-T243 PolarHBondContact O-N 3.26Å; R240-T243 PolarHBondContact O-OG1 2.95Å; Y241-T243 PolarHBondContact O-N 3.36Å; Y241-T243 VanDerWaalsContact O-N 3.1Å; T243-S245 PolarHBondContact O-N 2.92Å; T243-S245 VanDerWaalsContact O-N 3.08Å; T243-S245 PolarHBondContact OG1-OG 3.41Å
244	W	87.8	Confident	78.8	Confident	50 Å²	50	55.3 Å²	55.3	19%	0.189	30%	0.304	C	S	.	.	T	Hydrogen-bonded Turn	trans	46.9	35.4	-177.5	-59	89.3	0	0	0	114.7	C209 S211 P217 L219 R240 Y241 V263	C209-W244 PolarHBondContact N-O 3.01Å; C209-W244 VanDerWaalsContact O-CB 3.29Å; C209-W244 WeakPolarHBondContact O-CB 3.44Å; S211-W244 PolarHBondContact O-NE1 3.29Å; P217-W244 HydrophobicContact CG-CH2 3.74Å; P217-W244 HydrophobicContact CG-CZ3 4.36Å; P217-W244 WeakPolarHBondContact O-CH2 3.32Å; L219-W244 HydrophobicContact CB-CE3 3.98Å; L219-W244 HydrophobicContact CB-CZ3 3.93Å; L219-W244 HydrophobicContact CD2-CB 4.49Å; L219-W244 HydrophobicContact CD2-CE3 4.2Å; L219-W244 HydrophobicContact CG-CE3 4.46Å; R240-W244 PolarHBondContact O-N 3Å; R240-W244 VanDerWaalsContact O-N 3.07Å; Y241-W244 PolarHBondContact O-N 3.48Å; W244-V263 HydrophobicContact CE3-CG1 4.38Å; W244-V263 HydrophobicContact CE3-CG2 4.06Å; W244-V263 HydrophobicContact CH2-CG1 4.29Å; W244-V263 HydrophobicContact CZ3-CG1 3.68Å; W244-V263 HydrophobicContact CZ3-CG2 4.05Å
245	S	89.6	Confident	80.4	Confident	0 Å²	0	50.6 Å²	50.6	0%	0	28%	0.28	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-123.1	148	-168.8	67.4	0	0	0	0	113.9	K206 F207 V239 R240 T243	K206-S245 WeakPolarHBondContact CE-OG 3.47Å; F207-S245 CarbonylContact O-C 3.54Å; F207-S245 VanDerWaalsContact O-CA 3.23Å; F207-S245 WeakPolarHBondContact O-CA 3.32Å; F207-S245 WeakPolarHBondContact O-CB 3.43Å; V239-S245 CarbonylContact C-O 3.4Å; V239-S245 WeakPolarHBondContact CA-O 3.5Å; R240-S245 PolarHBondContact N-O 3.23Å; R240-S245 PolarHBondContact O-N 2.59Å; T243-S245 PolarHBondContact O-N 2.92Å; T243-S245 VanDerWaalsContact O-N 3.08Å; T243-S245 PolarHBondContact OG1-OG 3.41Å
246	I	91.3	Very high	81.9	Confident	0 Å²	0	55.1 Å²	55.1	0%	0	30%	0.296	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-109.2	131.8	164.4	-172.1	170.8	0	0	0	108.5	K206 F207 W221 F228 Y237 V239 M248	K206-I246 WeakPolarHBondContact CA-O 3.39Å; F207-I246 HydrophobicContact CB-CG2 3.85Å; F207-I246 HydrophobicContact CD2-CG2 4.34Å; F207-I246 PolarHBondContact N-O 2.73Å; F207-I246 PolarHBondContact O-N 2.93Å; W221-I246 HydrophobicContact CB-CD1 4.32Å; W221-I246 HydrophobicContact CD2-CB 4.09Å; W221-I246 HydrophobicContact CD2-CD1 4.32Å; W221-I246 HydrophobicContact CD2-CG2 3.69Å; W221-I246 VanDerWaalsContact CE2-CG2 3.45Å; W221-I246 HydrophobicContact CE3-CG2 3.87Å; W221-I246 HydrophobicContact CG-CB 4.37Å; W221-I246 HydrophobicContact CG-CD1 4.05Å; W221-I246 HydrophobicContact CG-CG2 4.42Å; W221-I246 HydrophobicContact CH2-CG2 3.64Å; W221-I246 HydrophobicContact CZ2-CB 4.04Å; W221-I246 HydrophobicContact CZ2-CG2 3.45Å; W221-I246 VanDerWaalsContact CZ2-CG2 3.45Å; W221-I246 HydrophobicContact CZ3-CG2 3.84Å; F228-I246 HydrophobicContact CD1-CD1 3.71Å; F228-I246 HydrophobicContact CE1-CD1 3.79Å; Y237-I246 HydrophobicContact CD2-CD1 4.17Å; Y237-I246 HydrophobicContact CE2-CD1 3.6Å; Y237-I246 HydrophobicContact CE2-CG1 4.39Å; V239-I246 HydrophobicContact CG2-CB 4.2Å; V239-I246 HydrophobicContact CG2-CD1 4.2Å; V239-I246 HydrophobicContact CG2-CG1 3.94Å; I246-M248 HydrophobicContact CD1-CG 4.47Å; I246-M248 HydrophobicContact CG1-CG 4.32Å
247	I	89.1	Confident	82.8	Confident	16 Å²	16	54 Å²	54	8%	0.082	28%	0.284	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-111.4	131.9	174.6	-52.1	173.3	0	0	0	107.1	T204 V205 K206 K238 D249	T204-I247 HydrophobicContact CG2-CG2 3.7Å; V205-I247 WeakPolarHBondContact O-CA 3.36Å; K206-I247 HydrophobicContact CD-CD1 4.25Å; K206-I247 HydrophobicContact CD-CG1 3.92Å; K206-I247 HydrophobicContact CG-CG1 3.95Å; K238-I247 HydrophobicContact CB-CB 4.3Å; K238-I247 PolarHBondContact N-O 3.17Å; K238-I247 PolarHBondContact O-N 3.17Å; I247-D249 WeakPolarHBondContact CG2-OD1 3.44Å
248	M	87.4	Confident	83.3	Confident	0 Å²	0	54.9 Å²	54.9	0%	0	29%	0.293	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-126.1	94.9	178.8	-69	-172.6	-66.6	0	0	108.5	T204 V205 F207 F228 R233 G236 I246 V251 Y259 L276	T204-M248 WeakPolarHBondContact CA-O 3.43Å; V205-M248 HydrophobicContact CB-CB 4.47Å; V205-M248 HydrophobicContact CB-CE 4.38Å; V205-M248 HydrophobicContact CG1-CE 3.96Å; V205-M248 PolarHBondContact N-O 3.26Å; V205-M248 PolarHBondContact O-N 2.84Å; F207-M248 HydrophobicContact CD2-CE 3.9Å; F207-M248 HydrophobicContact CE2-CE 3.62Å; F228-M248 HydrophobicContact CE1-SD 3.85Å; F228-M248 HydrophobicContact CZ-SD 4.16Å; R233-M248 VanDerWaalsContact NH1-C 3.35Å; R233-M248 VanDerWaalsContact NH1-CA 3.34Å; G236-M248 CarbonylContact O-C 3.54Å; G236-M248 WeakPolarHBondContact O-CA 3.26Å; I246-M248 HydrophobicContact CD1-CG 4.47Å; I246-M248 HydrophobicContact CG1-CG 4.32Å; M248-V251 HydrophobicContact CB-CG1 4.06Å; M248-V251 WeakPolarHBondContact O-CG1 3.32Å; M248-Y259 HydrophobicContact CE-CD1 4.01Å; M248-Y259 HydrophobicContact CE-CE1 3.65Å; M248-Y259 HydrophobicContact CE-CE2 4.37Å; M248-Y259 HydrophobicContact CE-CG 4.48Å; M248-Y259 HydrophobicContact SD-CD1 4.13Å; M248-Y259 HydrophobicContact SD-CE1 3.32Å; M248-Y259 WeakPolarHBondContact SD-CE1 3.34Å; M248-L276 HydrophobicContact CE-CD2 3.82Å
249	D	81	Confident	83.8	Confident	39 Å²	39	49 Å²	49	21%	0.209	27%	0.267	C	S	.	.			trans	-70.8	143.8	-178.6	-52	-45.7	0	0	0	110.3	T204 R233 G236 I247 V251	T204-D249 VanDerWaalsContact CG2-OD1 3.3Å; T204-D249 WeakPolarHBondContact CG2-OD1 3.49Å; T204-D249 WeakPolarHBondContact OG1-CA 3.48Å; R233-D249 VanDerWaalsContact NH1-N 3.19Å; R233-D249 PolarHBondContact NH1-O 3.08Å; R233-D249 PolarHBondContact NH2-O 3.02Å; G236-D249 PolarHBondContact O-N 2.94Å; I247-D249 WeakPolarHBondContact CG2-OD1 3.44Å; D249-V251 PolarHBondContact O-N 3.15Å
250	S	71.7	Confident	84.2	Confident	60 Å²	60	48.7 Å²	48.7	42%	0.42	27%	0.265	S	S	.	.	S	Bend	trans	44.8	65.5	177.2	-65.1	0	0	0	0	114.7
251	V	75.9	Confident	84.6	Confident	0 Å²	0	41.7 Å²	41.7	0%	0	24%	0.239	C	C	.	.			trans	-63.6	138.3	-176	-58.1	0	0	0	0	113.1	V199 A201 A202 K203 V205 M248 D249 D255 L276 V278	V199-V251 HydrophobicContact CG2-CG2 3.74Å; A201-V251 CarbonylContact C-O 3.56Å; A201-V251 WeakPolarHBondContact CA-O 3.25Å; A202-V251 PolarHBondContact N-O 2.89Å; K203-V251 WeakPolarHBondContact O-CG2 3.32Å; K203-V251 PolarHBondContact O-N 2.67Å; V205-V251 HydrophobicContact CB-CG1 3.85Å; V205-V251 HydrophobicContact CG2-CB 4.43Å; V205-V251 HydrophobicContact CG2-CG1 3.57Å; V205-V251 HydrophobicContact CG2-CG2 4.02Å; M248-V251 HydrophobicContact CB-CG1 4.06Å; M248-V251 WeakPolarHBondContact O-CG1 3.32Å; D249-V251 PolarHBondContact O-N 3.15Å; V251-D255 HydrophobicContact CB-CB 4.28Å; V251-L276 HydrophobicContact CG1-CD2 4.47Å; V251-V278 HydrophobicContact CB-CG2 4.1Å; V251-V278 HydrophobicContact CG2-CG1 3.98Å; V251-V278 HydrophobicContact CG2-CG2 3.76Å
252	V	74.9	Confident	85.1	Confident	35 Å²	35	35.3 Å²	35.3	21%	0.212	22%	0.215	C	C	.	.			trans	-110.8	161.9	-179.6	-73.7	0	0	0	0	110.9	S254 D255	V252-S254 VanDerWaalsContact CG2-OG 3.23Å; V252-S254 WeakPolarHBondContact CG2-OG 3.47Å; V252-S254 PolarHBondContact O-N 3.46Å; V252-D255 WeakPolarHBondContact CG2-OD2 3.48Å; V252-D255 PolarHBondContact N-OD2 3.43Å; V252-D255 WeakPolarHBondContact O-CA 3.1Å; V252-D255 WeakPolarHBondContact O-CB 3.26Å; V252-D255 PolarHBondContact O-N 3.32Å
253	P	74.7	Confident	85.9	Confident	57 Å²	57	30.6 Å²	30.6	37%	0.37	18%	0.176	S	C	.	.	G	3₁₀ helix	trans	-54.6	-25.6	178.3	-30.3	37.7	0	0	0	115.2	D255 K256 E280	P253-D255 VanDerWaalsContact C-N 3.3Å; P253-D255 PolarHBondContact O-N 3.48Å; P253-K256 VanDerWaalsContact O-CB 3.23Å; P253-K256 WeakPolarHBondContact O-CB 3.32Å; P253-K256 PolarHBondContact O-N 3.16Å; P253-E280 HydrophobicContact CG-CG 4.18Å
254	S	77.7	Confident	86.5	Confident	86 Å²	86	29.8 Å²	29.8	60%	0.601	17%	0.167	S	C	*	.	G	3₁₀ helix	trans	-76.8	-7.3	172.2	46.9	0	0	0	0	114.8	K223 V252 K256	K223-S254 PolarHBondContact NZ-O 2.7Å; V252-S254 VanDerWaalsContact CG2-OG 3.23Å; V252-S254 WeakPolarHBondContact CG2-OG 3.47Å; V252-S254 PolarHBondContact O-N 3.46Å; S254-K256 VanDerWaalsContact C-N 3.34Å
255	D	82.6	Confident	86.7	Confident	2 Å²	2	28.7 Å²	28.7	1%	0.011	17%	0.165	C	C	.	.	G	3₁₀ helix	trans	-78.9	-15	166	-73.6	-48.1	0	0	0	113.1	K223 R233 V251 V252 P253 G257 Y259 L276 V278	K223-D255 IonicContact NZ-OD1 3.24Å; K223-D255 PolarHBondContact NZ-OD1 3.23Å; R233-D255 IonicContact CZ-OD2 3.21Å; R233-D255 IonicContact NE-OD1 2.8Å; R233-D255 PolarHBondContact NE-OD1 2.98Å; R233-D255 VanDerWaalsContact NE-OD1 3.16Å; R233-D255 IonicContact NE-OD2 2.71Å; R233-D255 PolarHBondContact NE-OD2 2.83Å; R233-D255 IonicContact NH2-OD2 3.4Å; R233-D255 PolarHBondContact NH2-OD2 3.18Å; V251-D255 HydrophobicContact CB-CB 4.28Å; V252-D255 WeakPolarHBondContact CG2-OD2 3.48Å; V252-D255 PolarHBondContact N-OD2 3.43Å; V252-D255 WeakPolarHBondContact O-CA 3.1Å; V252-D255 WeakPolarHBondContact O-CB 3.26Å; V252-D255 PolarHBondContact O-N 3.32Å; P253-D255 VanDerWaalsContact C-N 3.3Å; P253-D255 PolarHBondContact O-N 3.48Å; D255-G257 PolarHBondContact O-N 3.24Å; D255-Y259 WeakPolarHBondContact O-CE2 3.43Å; D255-Y259 PolarHBondContact O-OH 2.59Å; D255-L276 HydrophobicContact CB-CD2 4.03Å; D255-V278 HydrophobicContact CB-CG2 4.41Å
256	K	87.8	Confident	86.8	Confident	107 Å²	107	35.5 Å²	35.5	47%	0.465	20%	0.197	S	C	.	.			trans	-51.8	129.8	173.8	-177.3	165.3	-174.4	152.2	0	112	P253 S254 L276 D277	P253-K256 VanDerWaalsContact O-CB 3.23Å; P253-K256 WeakPolarHBondContact O-CB 3.32Å; P253-K256 PolarHBondContact O-N 3.16Å; S254-K256 VanDerWaalsContact C-N 3.34Å; K256-L276 WeakPolarHBondContact CA-O 3.44Å; K256-D277 WeakPolarHBondContact CD-OD1 3.21Å; K256-D277 WeakPolarHBondContact CE-OD1 3.32Å; K256-D277 IonicContact NZ-OD1 3.38Å; K256-D277 PolarHBondContact NZ-OD1 3.15Å; K256-D277 IonicContact NZ-OD2 3.93Å; K256-D277 PolarHBondContact NZ-OD2 3.05Å
257	G	88.9	Confident	86.6	Confident	10 Å²	10	41.2 Å²	41.2	10%	0.103	22%	0.219	C	C	.	.	E	Extended strand (participates in β ladder)	trans	157.9	-177.4	-179.1	0	0	0	0	0	114.8	N224 D255 Y259 L276	N224-G257 WeakPolarHBondContact OD1-CA 3.42Å; D255-G257 PolarHBondContact O-N 3.24Å; G257-Y259 WeakPolarHBondContact O-CD2 3.47Å; G257-L276 PolarHBondContact N-O 3.43Å; G257-L276 PolarHBondContact O-N 2.83Å
258	N	92.9	Very high	86.6	Confident	73 Å²	73	41.7 Å²	41.7	39%	0.39	23%	0.228	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-95.6	119.9	179.3	-68.4	-7.9	0	0	0	110.3	K223 N224 T273 Y274	K223-N258 CarbonylContact C-O 3.43Å; K223-N258 WeakPolarHBondContact CA-O 3.49Å; N224-N258 PolarHBondContact N-O 3Å; N224-N258 PolarHBondContact OD1-N 3.18Å; N258-T273 HydrophobicContact CB-CG2 3.89Å; N258-Y274 CarbonylContact C-O 3.51Å; N258-Y274 VanDerWaalsContact CA-O 3.3Å; N258-Y274 WeakPolarHBondContact CA-O 3.31Å
259	Y	93.5	Very high	86.9	Confident	0 Å²	0	44.8 Å²	44.8	0%	0	25%	0.25	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-106.4	103.9	-178	-75.3	-99.8	0	0	0	109.9	F207 L222 K223 F228 M248 D255 G257 T273 Y274 L276	F207-Y259 HydrophobicContact CD2-CG 4.21Å; F207-Y259 HydrophobicContact CE2-CD1 4.4Å; F207-Y259 AromaticContact CE2-CD2 4Å; F207-Y259 HydrophobicContact CE2-CD2 4Å; F207-Y259 AromaticContact CE2-CG 3.82Å; F207-Y259 HydrophobicContact CE2-CG 3.82Å; L222-Y259 CarbonylContact O-C 3.55Å; L222-Y259 WeakPolarHBondContact O-CA 3.41Å; K223-Y259 HydrophobicContact CB-CE1 4.35Å; K223-Y259 HydrophobicContact CD-CE1 4.08Å; K223-Y259 HydrophobicContact CD-CE2 4.34Å; K223-Y259 WeakPolarHBondContact CD-OH 3.08Å; K223-Y259 WeakPolarHBondContact CE-OH 3.5Å; K223-Y259 HydrophobicContact CG-CE1 4.21Å; K223-Y259 HydrophobicContact CG-CE2 4.24Å; K223-Y259 PolarHBondContact NZ-OH 3.29Å; F228-Y259 HydrophobicContact CD1-CD1 4.29Å; F228-Y259 AromaticContact CD1-CE1 3.93Å; F228-Y259 HydrophobicContact CD1-CE1 3.93Å; F228-Y259 HydrophobicContact CE1-CD1 4.26Å; F228-Y259 AromaticContact CE1-CE1 3.52Å; F228-Y259 HydrophobicContact CE1-CE1 3.52Å; F228-Y259 HydrophobicContact CE2-CE1 4.39Å; F228-Y259 AromaticContact CZ-CE1 3.76Å; F228-Y259 HydrophobicContact CZ-CE1 3.76Å; M248-Y259 HydrophobicContact CE-CD1 4.01Å; M248-Y259 HydrophobicContact CE-CE1 3.65Å; M248-Y259 HydrophobicContact CE-CE2 4.37Å; M248-Y259 HydrophobicContact CE-CG 4.48Å; M248-Y259 HydrophobicContact SD-CD1 4.13Å; M248-Y259 HydrophobicContact SD-CE1 3.32Å; M248-Y259 WeakPolarHBondContact SD-CE1 3.34Å; D255-Y259 WeakPolarHBondContact O-CE2 3.43Å; D255-Y259 PolarHBondContact O-OH 2.59Å; G257-Y259 WeakPolarHBondContact O-CD2 3.47Å; Y259-T273 WeakPolarHBondContact O-CA 3.13Å; Y259-Y274 PolarHBondContact N-O 3.44Å; Y259-Y274 PolarHBondContact O-N 2.98Å; Y259-L276 HydrophobicContact CD2-CB 3.9Å; Y259-L276 HydrophobicContact CD2-CD2 4.49Å; Y259-L276 HydrophobicContact CE2-CB 3.83Å; Y259-L276 HydrophobicContact CE2-CD2 3.82Å; Y259-L276 HydrophobicContact CE2-CG 4.44Å
260	T	94.2	Very high	87.5	Confident	20 Å²	20	44.6 Å²	44.6	12%	0.123	25%	0.249	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-100	114.5	-179.9	-51.9	0	0	0	0	109.8	W221 L222 I262 N271 H272 T273	W221-T260 CarbonylContact C-O 3.57Å; W221-T260 WeakPolarHBondContact CA-O 3.33Å; L222-T260 PolarHBondContact N-O 2.77Å; L222-T260 PolarHBondContact O-N 2.98Å; T260-I262 HydrophobicContact CG2-CG1 4.18Å; T260-N271 HydrophobicContact CG2-CB 4.03Å; T260-H272 CarbonylContact C-O 3.53Å; T260-H272 VanDerWaalsContact CA-O 3.25Å; T260-H272 WeakPolarHBondContact CA-O 3.49Å; T260-T273 WeakPolarHBondContact CG2-OG1 3.46Å; T260-T273 WeakPolarHBondContact OG1-CG2 3.42Å; T260-T273 PolarHBondContact OG1-OG1 3.44Å
261	C	94.3	Very high	88.6	Confident	0 Å²	0	46.5 Å²	46.5	0%	0	25%	0.254	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-79.4	142.3	162.7	59.6	0	0	0	0	109.5	C209 L219 W221 N271 H272	C209-C261 HydrophobicContact CB-CB 3.7Å; C209-C261 WeakPolarHBondContact CB-SG 3.46Å; C209-C261 WeakPolarHBondContact SG-CB 3.36Å; C209-C261 CovalentContact SG-SG 2.02Å; C209-C261 PolarHBondContact SG-SG 3.21Å; L219-C261 HydrophobicContact CD1-CB 4.11Å; W221-C261 HydrophobicContact CD2-CB 3.88Å; W221-C261 HydrophobicContact CE3-CB 3.79Å; W221-C261 HydrophobicContact CH2-CB 3.62Å; W221-C261 HydrophobicContact CZ2-CB 3.69Å; W221-C261 HydrophobicContact CZ3-CB 3.68Å; C261-N271 WeakPolarHBondContact O-CA 3.14Å; C261-N271 VanDerWaalsContact O-CB 3.31Å; C261-N271 WeakPolarHBondContact O-CB 3.26Å; C261-H272 PolarHBondContact N-O 3.44Å; C261-H272 PolarHBondContact O-N 2.93Å; C261-H272 VanDerWaalsContact O-N 3.1Å; C261-H272 PolarHBondContact SG-O 3.24Å
262	I	93.7	Very high	89.4	Confident	19 Å²	19	47.9 Å²	47.9	10%	0.097	26%	0.26	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-125.3	131.4	171.1	-58.1	176	0	0	0	107	R220 L222 T260 E264 S269 I270 N271	R220-I262 HydrophobicContact CG-CB 3.99Å; R220-I262 PolarHBondContact N-O 2.88Å; R220-I262 PolarHBondContact O-N 3.25Å; L222-I262 HydrophobicContact CD1-CD1 3.58Å; L222-I262 HydrophobicContact CD2-CD1 4.43Å; L222-I262 HydrophobicContact CG-CD1 3.91Å; T260-I262 HydrophobicContact CG2-CG1 4.18Å; I262-E264 WeakPolarHBondContact CG2-OE2 3.39Å; I262-S269 WeakPolarHBondContact CG2-OG 3.31Å; I262-I270 WeakPolarHBondContact CA-O 3.49Å; I262-N271 HydrophobicContact CG1-CB 3.95Å
263	V	93.9	Very high	90.3	Very high	0 Å²	0	48.8 Å²	48.8	0%	0	27%	0.266	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-125.7	123.8	178.2	176.9	0	0	0	0	109	P184 W186 P217 T218 L219 W244 S269 I270	P184-V263 HydrophobicContact CB-CG1 4.03Å; P184-V263 WeakPolarHBondContact CG-O 3.36Å; W186-V263 HydrophobicContact CH2-CG2 4.42Å; W186-V263 HydrophobicContact CZ3-CG2 4.12Å; P217-V263 HydrophobicContact CB-CG1 3.58Å; P217-V263 HydrophobicContact CG-CG1 3.56Å; T218-V263 VanDerWaalsContact O-CA 3.25Å; T218-V263 WeakPolarHBondContact O-CA 3.33Å; L219-V263 HydrophobicContact CD1-CG2 3.64Å; W244-V263 HydrophobicContact CE3-CG1 4.38Å; W244-V263 HydrophobicContact CE3-CG2 4.06Å; W244-V263 HydrophobicContact CH2-CG1 4.29Å; W244-V263 HydrophobicContact CZ3-CG1 3.68Å; W244-V263 HydrophobicContact CZ3-CG2 4.05Å; V263-S269 WeakPolarHBondContact O-CA 3.33Å; V263-I270 HydrophobicContact CB-CD1 4.4Å; V263-I270 HydrophobicContact CB-CG1 3.93Å; V263-I270 PolarHBondContact N-O 2.87Å; V263-I270 WeakPolarHBondContact O-CG1 3.46Å; V263-I270 PolarHBondContact O-N 3.26Å
264	E	92.9	Very high	91.2	Very high	51 Å²	51	46.6 Å²	46.6	24%	0.238	25%	0.25	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-147.2	143.4	-168.6	63.1	-161.5	-174.7	0	0	115.2	P217 T218 R220 I262 G268 S269	P217-E264 CarbonylContact C-O 3.38Å; P217-E264 VanDerWaalsContact CA-O 3.25Å; P217-E264 WeakPolarHBondContact CA-O 3.33Å; P217-E264 VanDerWaalsContact CB-O 3.32Å; P217-E264 WeakPolarHBondContact CB-O 3.5Å; T218-E264 PolarHBondContact N-O 2.81Å; T218-E264 PolarHBondContact O-N 3.08Å; T218-E264 VanDerWaalsContact O-N 3.11Å; T218-E264 PolarHBondContact OG1-O 3.19Å; R220-E264 IonicContact CZ-OE1 3.88Å; R220-E264 VanDerWaalsContact CZ-OE1 3.26Å; R220-E264 IonicContact CZ-OE2 3.93Å; R220-E264 IonicContact NE-OE1 3.59Å; R220-E264 PolarHBondContact NE-OE1 3.18Å; R220-E264 IonicContact NE-OE2 3.72Å; R220-E264 VanDerWaalsContact NH2-CD 3.28Å; R220-E264 IonicContact NH2-OE1 2.67Å; R220-E264 PolarHBondContact NH2-OE1 2.9Å; R220-E264 IonicContact NH2-OE2 3.22Å; R220-E264 PolarHBondContact NH2-OE2 2.93Å; I262-E264 WeakPolarHBondContact CG2-OE2 3.39Å; E264-G268 VanDerWaalsContact CA-O 3.31Å; E264-G268 WeakPolarHBondContact CA-O 3.43Å; E264-S269 PolarHBondContact OE2-OG 3.3Å; E264-S269 VanDerWaalsContact OE2-OG 3.08Å
265	N	92.9	Very high	91.9	Very high	27 Å²	27	47 Å²	47	14%	0.144	24%	0.243	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-133.7	-176.7	167.3	72	12.4	0	0	0	110.2	V182 P184 P215 P217 Y267 G268	V182-N265 PolarHBondContact O-ND2 2.71Å; P184-N265 WeakPolarHBondContact CD-OD1 3.46Å; P215-N265 PolarHBondContact O-ND2 2.73Å; P217-N265 HydrophobicContact CB-CB 4.06Å; N265-Y267 PolarHBondContact O-N 3.45Å; N265-Y267 WeakPolarHBondContact OD1-CA 3.4Å; N265-Y267 PolarHBondContact OD1-N 3.23Å; N265-G268 PolarHBondContact N-O 3.03Å; N265-G268 PolarHBondContact O-N 3.02Å; N265-G268 VanDerWaalsContact O-O 3.09Å; N265-G268 PolarHBondContact OD1-N 3.34Å
266	E	90.7	Very high	92.3	Very high	143 Å²	143	47 Å²	47	67%	0.668	24%	0.243	S	C	*	.	T	Hydrogen-bonded Turn	trans	-61.8	-14.3	-178	70.5	-171.4	146.3	0	0	114.8	P215	P215-E266 WeakPolarHBondContact CD-OE1 3.35Å; P215-E266 WeakPolarHBondContact CG-OE1 3.46Å
267	Y	88.6	Confident	92.2	Very high	121 Å²	121	44 Å²	44	48%	0.475	23%	0.232	S	C	.	.	T	Hydrogen-bonded Turn	trans	-105.2	-7.7	-179.3	-60.2	-65.2	0	0	0	114.3	P181 A183 T214 N265	P181-Y267 HydrophobicContact CB-CD1 4.17Å; P181-Y267 HydrophobicContact CB-CD2 3.6Å; P181-Y267 HydrophobicContact CB-CE1 3.81Å; P181-Y267 HydrophobicContact CB-CE2 3.16Å; P181-Y267 HydrophobicContact CB-CG 4.09Å; P181-Y267 HydrophobicContact CG-CE1 4.46Å; P181-Y267 HydrophobicContact CG-CE2 4.46Å; A183-Y267 WeakPolarHBondContact CB-O 3.43Å; T214-Y267 WeakPolarHBondContact O-CD2 3.49Å; N265-Y267 PolarHBondContact O-N 3.45Å; N265-Y267 WeakPolarHBondContact OD1-CA 3.4Å; N265-Y267 PolarHBondContact OD1-N 3.23Å
268	G	89.3	Confident	91.9	Very high	26 Å²	26	44 Å²	44	27%	0.268	23%	0.23	S	C	.	.	E	Extended strand (participates in β ladder)	trans	169.5	173.8	175.4	0	0	0	0	0	115.5	P184 E264 N265	P184-G268 VanDerWaalsContact CD-O 3.3Å; P184-G268 WeakPolarHBondContact CD-O 3.48Å; P184-G268 WeakPolarHBondContact CG-O 3.38Å; E264-G268 VanDerWaalsContact CA-O 3.31Å; E264-G268 WeakPolarHBondContact CA-O 3.43Å; N265-G268 PolarHBondContact N-O 3.03Å; N265-G268 PolarHBondContact O-N 3.02Å; N265-G268 VanDerWaalsContact O-O 3.09Å; N265-G268 PolarHBondContact OD1-N 3.34Å
269	S	93.2	Very high	90.9	Very high	65 Å²	65	44.2 Å²	44.2	46%	0.455	23%	0.234	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-138.6	132.4	179.1	-176	0	0	0	0	109.9	I262 V263 E264	I262-S269 WeakPolarHBondContact CG2-OG 3.31Å; V263-S269 WeakPolarHBondContact O-CA 3.33Å; E264-S269 PolarHBondContact OE2-OG 3.3Å; E264-S269 VanDerWaalsContact OE2-OG 3.08Å
270	I	93.9	Very high	89.3	Confident	35 Å²	35	50.4 Å²	50.4	18%	0.179	26%	0.263	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-120.8	151.9	176.1	60.1	176.4	0	0	0	110	P184 W186 I262 V263	P184-I270 HydrophobicContact CB-CD1 3.95Å; P184-I270 HydrophobicContact CB-CG1 4.03Å; P184-I270 HydrophobicContact CG-CG1 4.11Å; P184-I270 HydrophobicContact CG-CG2 4.36Å; P184-I270 VanDerWaalsContact O-CG2 3.29Å; P184-I270 WeakPolarHBondContact O-CG2 3.45Å; W186-I270 HydrophobicContact CD2-CD1 3.69Å; W186-I270 HydrophobicContact CE3-CD1 3.76Å; W186-I270 HydrophobicContact CG-CD1 4.33Å; W186-I270 HydrophobicContact CH2-CB 4.38Å; W186-I270 HydrophobicContact CH2-CD1 3.8Å; W186-I270 HydrophobicContact CH2-CG1 3.76Å; W186-I270 HydrophobicContact CZ2-CB 3.88Å; W186-I270 HydrophobicContact CZ2-CD1 3.73Å; W186-I270 HydrophobicContact CZ2-CG1 3.73Å; W186-I270 HydrophobicContact CZ3-CD1 3.8Å; W186-I270 HydrophobicContact CZ3-CG1 4.21Å; I262-I270 WeakPolarHBondContact CA-O 3.49Å; V263-I270 HydrophobicContact CB-CD1 4.4Å; V263-I270 HydrophobicContact CB-CG1 3.93Å; V263-I270 PolarHBondContact N-O 2.87Å; V263-I270 WeakPolarHBondContact O-CG1 3.46Å; V263-I270 PolarHBondContact O-N 3.26Å
271	N	93.6	Very high	87.8	Confident	100 Å²	100	54.2 Å²	54.2	54%	0.535	28%	0.275	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-143.8	152.9	178.8	65.8	76.7	0	0	0	113.2	W186 T260 C261 I262	W186-N271 VanDerWaalsContact CZ2-C 3.5Å; T260-N271 HydrophobicContact CG2-CB 4.03Å; C261-N271 WeakPolarHBondContact O-CA 3.14Å; C261-N271 VanDerWaalsContact O-CB 3.31Å; C261-N271 WeakPolarHBondContact O-CB 3.26Å; I262-N271 HydrophobicContact CG1-CB 3.95Å
272	H	94.1	Very high	85.7	Confident	28 Å²	28	56.8 Å²	56.8	13%	0.13	29%	0.293	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-142.4	141.7	174.8	-177.4	107.8	0	0	0	109.2	W186 M192 T260 C261 Y274	W186-H272 HydrophobicContact CH2-CB 4.17Å; W186-H272 HydrophobicContact CZ2-CB 3.9Å; M192-H272 HydrophobicContact CE-CB 3.46Å; M192-H272 VanDerWaalsContact CE-CB 3.46Å; M192-H272 VanDerWaalsContact CE-CG 3.49Å; M192-H272 PolarHBondContact O-CE1 3.15Å; M192-H272 PolarHBondContact O-NE2 3.33Å; T260-H272 CarbonylContact C-O 3.53Å; T260-H272 VanDerWaalsContact CA-O 3.25Å; T260-H272 WeakPolarHBondContact CA-O 3.49Å; C261-H272 PolarHBondContact N-O 3.44Å; C261-H272 PolarHBondContact O-N 2.93Å; C261-H272 VanDerWaalsContact O-N 3.1Å; C261-H272 PolarHBondContact SG-O 3.24Å; H272-Y274 AromaticContact CD2-CD2 3.93Å; H272-Y274 AromaticContact CD2-CE2 3.77Å
273	T	93.4	Very high	84.1	Confident	55 Å²	55	57.8 Å²	57.8	34%	0.337	30%	0.3	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-120.6	121	-177.1	-57.3	0	0	0	0	112.2	N258 Y259 T260	N258-T273 HydrophobicContact CB-CG2 3.89Å; Y259-T273 WeakPolarHBondContact O-CA 3.13Å; T260-T273 WeakPolarHBondContact CG2-OG1 3.46Å; T260-T273 WeakPolarHBondContact OG1-CG2 3.42Å; T260-T273 PolarHBondContact OG1-OG1 3.44Å
274	Y	94.2	Very high	82.8	Confident	10 Å²	10	60.5 Å²	60.5	4%	0.039	31%	0.313	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-88.9	149.5	165.2	-66.5	-87.4	0	0	0	110.5	M192 K194 K195 F207 K208 W221 N258 Y259 H272	M192-Y274 WeakPolarHBondContact CA-OH 3.46Å; K194-Y274 WeakPolarHBondContact O-CD1 3.25Å; K195-Y274 CarbonylContact O-C 3.45Å; F207-Y274 HydrophobicContact CB-CD2 3.86Å; F207-Y274 HydrophobicContact CB-CE2 3.8Å; F207-Y274 HydrophobicContact CB-CG 4.34Å; F207-Y274 AromaticContact CD1-CD1 3.64Å; F207-Y274 HydrophobicContact CD1-CD1 3.64Å; F207-Y274 HydrophobicContact CD1-CD2 4.08Å; F207-Y274 AromaticContact CD1-CE1 3.99Å; F207-Y274 HydrophobicContact CD1-CE1 3.99Å; F207-Y274 HydrophobicContact CD1-CE2 4.4Å; F207-Y274 AromaticContact CD1-CG 3.67Å; F207-Y274 HydrophobicContact CD1-CG 3.67Å; F207-Y274 HydrophobicContact CD2-CD2 4.31Å; F207-Y274 HydrophobicContact CD2-CG 4.28Å; F207-Y274 AromaticContact CE1-CD1 3.88Å; F207-Y274 HydrophobicContact CE1-CD1 3.88Å; F207-Y274 AromaticContact CE1-CG 3.96Å; F207-Y274 HydrophobicContact CE1-CG 3.96Å; F207-Y274 HydrophobicContact CG-CD1 4.27Å; F207-Y274 AromaticContact CG-CD2 3.85Å; F207-Y274 HydrophobicContact CG-CD2 3.85Å; F207-Y274 HydrophobicContact CG-CE2 4.22Å; F207-Y274 AromaticContact CG-CG 3.86Å; F207-Y274 HydrophobicContact CG-CG 3.86Å; F207-Y274 HydrophobicContact CZ-CG 4.37Å; K208-Y274 PolarHBondContact O-OH 3.23Å; W221-Y274 HydrophobicContact CH2-CD2 4.34Å; W221-Y274 HydrophobicContact CH2-CE2 4.22Å; W221-Y274 HydrophobicContact CZ3-CD2 4.2Å; N258-Y274 CarbonylContact C-O 3.51Å; N258-Y274 VanDerWaalsContact CA-O 3.3Å; N258-Y274 WeakPolarHBondContact CA-O 3.31Å; Y259-Y274 PolarHBondContact N-O 3.44Å; Y259-Y274 PolarHBondContact O-N 2.98Å; H272-Y274 AromaticContact CD2-CD2 3.93Å; H272-Y274 AromaticContact CD2-CE2 3.77Å
275	Q	91.6	Very high	82.2	Confident	96 Å²	96	65.1 Å²	65.1	45%	0.449	33%	0.328	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-111.9	108.7	169.4	-179	177.9	-7.6	0	0	108.1	K195 L196 H197	K195-Q275 WeakPolarHBondContact O-CB 3.36Å; K195-Q275 PolarHBondContact O-N 3.09Å; L196-Q275 HydrophobicContact CD1-CB 4.07Å; L196-Q275 HydrophobicContact CD1-CG 3.78Å; H197-Q275 PolarHBondContact N-O 3.33Å
276	L	91	Very high	82	Confident	1 Å²	1	63.8 Å²	63.8	1%	0.005	32%	0.321	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-86.2	123.3	174.9	179.5	53.4	0	0	0	109.3	V199 V205 F207 M248 V251 D255 K256 G257 Y259 V278	V199-L276 HydrophobicContact CG2-CD1 3.77Å; V205-L276 HydrophobicContact CG1-CD1 4.38Å; V205-L276 HydrophobicContact CG2-CD1 4.03Å; F207-L276 HydrophobicContact CE2-CB 4.31Å; F207-L276 HydrophobicContact CZ-CB 3.99Å; F207-L276 HydrophobicContact CZ-CD1 4.3Å; M248-L276 HydrophobicContact CE-CD2 3.82Å; V251-L276 HydrophobicContact CG1-CD2 4.47Å; D255-L276 HydrophobicContact CB-CD2 4.03Å; K256-L276 WeakPolarHBondContact CA-O 3.44Å; G257-L276 PolarHBondContact N-O 3.43Å; G257-L276 PolarHBondContact O-N 2.83Å; Y259-L276 HydrophobicContact CD2-CB 3.9Å; Y259-L276 HydrophobicContact CD2-CD2 4.49Å; Y259-L276 HydrophobicContact CE2-CB 3.83Å; Y259-L276 HydrophobicContact CE2-CD2 3.82Å; Y259-L276 HydrophobicContact CE2-CG 4.44Å; L276-V278 HydrophobicContact CD1-CG2 4.08Å; L276-V278 HydrophobicContact CD2-CG2 4.19Å; L276-V278 HydrophobicContact CG-CG2 3.9Å
277	D	85.3	Confident	81.8	Confident	43 Å²	43	61 Å²	61	23%	0.23	31%	0.31	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-114.5	123.1	166.9	-157.2	-16.1	0	0	0	109.8	H197 A198 V199 K256	H197-D277 PolarHBondContact O-N 2.89Å; A198-D277 VanDerWaalsContact CA-O 3.32Å; A198-D277 WeakPolarHBondContact CA-O 3.18Å; A198-D277 HydrophobicContact CB-CB 4.38Å; V199-D277 PolarHBondContact N-O 3.3Å; K256-D277 WeakPolarHBondContact CD-OD1 3.21Å; K256-D277 WeakPolarHBondContact CE-OD1 3.32Å; K256-D277 IonicContact NZ-OD1 3.38Å; K256-D277 PolarHBondContact NZ-OD1 3.15Å; K256-D277 IonicContact NZ-OD2 3.93Å; K256-D277 PolarHBondContact NZ-OD2 3.05Å
278	V	81.8	Confident	81.9	Confident	10 Å²	10	56 Å²	56	6%	0.061	29%	0.291	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-108	115.6	-179.6	-176.3	0	0	0	0	108.7	V199 A201 V251 D255 L276	V199-V278 HydrophobicContact CG2-CG2 4.47Å; V199-V278 WeakPolarHBondContact O-CA 3.28Å; A201-V278 HydrophobicContact CB-CG1 4.02Å; V251-V278 HydrophobicContact CB-CG2 4.1Å; V251-V278 HydrophobicContact CG2-CG1 3.98Å; V251-V278 HydrophobicContact CG2-CG2 3.76Å; D255-V278 HydrophobicContact CB-CG2 4.41Å; L276-V278 HydrophobicContact CD1-CG2 4.08Å; L276-V278 HydrophobicContact CD2-CG2 4.19Å; L276-V278 HydrophobicContact CG-CG2 3.9Å
279	V	73.2	Confident	82	Confident	79 Å²	79	58.2 Å²	58.2	48%	0.479	30%	0.295	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-92.2	132	-176.8	-172.2	0	0	0	0	109.1	V199 P200 A201	V199-V279 PolarHBondContact O-N 3.36Å; P200-V279 CarbonylContact C-O 3.59Å; P200-V279 WeakPolarHBondContact CA-O 3.37Å; A201-V279 PolarHBondContact N-O 2.58Å
280	E	60	Low	81.7	Confident	130 Å²	130	59.2 Å²	59.2	61%	0.607	31%	0.307	S	S	*	.	P	Polyproline II helix	trans	-67	139.1	173.4	-64.4	-166	146.5	0	0	111.1	P253	P253-E280 HydrophobicContact CG-CG 4.18Å
281	R	61.6	Low	81.2	Confident	100 Å²	100	60.3 Å²	60.3	38%	0.377	33%	0.327	S	S	.	.	P	Polyproline II helix	trans	-63.9	144.9	176.1	-73.3	-174.5	178.8	-119.7	16.6	111.9	P200 A201 P283 D313	P200-R281 HydrophobicContact CB-CG 4.45Å; A201-R281 PolarHBondContact O-NE 3.33Å; R281-P283 WeakPolarHBondContact O-CD 3.48Å; R281-D313 WeakPolarHBondContact CA-OD2 3.47Å; R281-D313 WeakPolarHBondContact CB-OD2 3.16Å; R281-D313 WeakPolarHBondContact CD-OD1 3.34Å; R281-D313 WeakPolarHBondContact CG-OD1 3.39Å; R281-D313 WeakPolarHBondContact CG-OD2 3.38Å; R281-D313 IonicContact CZ-OD1 2.68Å; R281-D313 IonicContact NE-OD1 3.33Å; R281-D313 IonicContact NH1-OD1 3.82Å; R281-D313 PolarHBondContact NH1-OD1 3.16Å
282	S	51.9	Low	81.1	Confident	53 Å²	53	56.7 Å²	56.7	37%	0.371	31%	0.308	S	S	.	.			trans	-71.9	103.3	-171.7	-60.8	0	0	0	0	111.6	H284 D313	S282-H284 VanDerWaalsContact C-N 3.27Å; S282-H284 PolarHBondContact O-N 3.01Å; S282-D313 PolarHBondContact N-OD2 2.88Å
283	P	59.4	Low	81.1	Confident	40 Å²	40	55.8 Å²	55.8	26%	0.26	30%	0.304	S	S	.	.			trans	-88.5	67	-162.7	36.6	-34	0	0	0	111	R281	R281-P283 WeakPolarHBondContact O-CD 3.48Å
284	H	67.2	Low	81.1	Confident	58 Å²	58	55.4 Å²	55.4	27%	0.269	31%	0.306	S	S	.	.	S	Bend	trans	-135.8	152.3	176.6	58.1	70.3	0	0	0	111	S282 Y311 N376	S282-H284 VanDerWaalsContact C-N 3.27Å; S282-H284 PolarHBondContact O-N 3.01Å; H284-Y311 PolarHBondContact CE1-O 2.67Å; H284-N376 PolarHBondContact O-ND2 3.29Å
285	R	80.6	Confident	81.1	Confident	147 Å²	147	60.6 Å²	60.6	56%	0.555	34%	0.335	S	S	*	.	S	Bend	trans	-56.6	161.4	159.9	65.5	175.8	-162.8	-96.4	-1.9	110	I287 L380 S381	R285-I287 PolarHBondContact O-N 2.75Å; R285-L380 WeakPolarHBondContact CD-O 3.4Å; R285-S381 VanDerWaalsContact CD-OG 3.26Å; R285-S381 WeakPolarHBondContact CD-OG 3.49Å; R285-S381 WeakPolarHBondContact CG-OG 3.45Å; R285-S381 PolarHBondContact NE-OG 3.24Å
286	P	87.6	Confident	81.2	Confident	0 Å²	0	59.9 Å²	59.9	0%	0	33%	0.33	C	S	.	.			trans	-57	133.8	-176.2	-25.6	37.3	0	0	0	111.7	V310 P316 A374 N376 G379 S381	P286-V310 HydrophobicContact CB-CG1 3.64Å; P286-P316 HydrophobicContact CB-CB 4.21Å; P286-P316 HydrophobicContact CG-CB 3.89Å; P286-A374 HydrophobicContact CB-CB 3.79Å; P286-A374 HydrophobicContact CG-CB 4.14Å; P286-N376 HydrophobicContact CG-CB 3.91Å; P286-G379 VanDerWaalsContact CD-O 3.24Å; P286-G379 WeakPolarHBondContact CD-O 3.32Å; P286-S381 WeakPolarHBondContact O-CB 3.14Å; P286-S381 PolarHBondContact O-OG 2.9Å
287	I	87.2	Confident	81.4	Confident	85 Å²	85	64 Å²	64	44%	0.436	36%	0.356	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-94.9	113.3	177.7	-64.9	173.1	0	0	0	107.9	R285 Y311	R285-I287 PolarHBondContact O-N 2.75Å; I287-Y311 PolarHBondContact N-O 3.05Å; I287-Y311 PolarHBondContact O-N 3.38Å
288	L	90.4	Very high	81.7	Confident	14 Å²	14	63.4 Å²	63.4	7%	0.073	35%	0.354	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-81.3	136.9	173.6	-58	-174.2	0	0	0	109.8	A290 K309 V310 A374 H382 H383	L288-A290 PolarHBondContact O-N 2.92Å; L288-K309 WeakPolarHBondContact CA-O 3.23Å; L288-V310 HydrophobicContact CD2-CB 4.28Å; L288-V310 HydrophobicContact CD2-CG1 4.11Å; L288-V310 HydrophobicContact CD2-CG2 3.67Å; L288-A374 HydrophobicContact CD2-CB 3.81Å; L288-H382 VanDerWaalsContact CD1-C 3.4Å; L288-H383 WeakPolarHBondContact CB-ND1 3.38Å; L288-H383 HydrophobicContact CD1-CB 3.9Å
289	Q	90.9	Very high	82.1	Confident	74 Å²	74	64.8 Å²	64.8	35%	0.346	37%	0.366	S	S	.	.	P	Polyproline II helix	trans	-61.5	128.4	176.8	-169.7	-172.5	-53.9	0	0	110.5	G291 L292 K309 Y311 H383	Q289-G291 PolarHBondContact O-N 3.38Å; Q289-L292 HydrophobicContact CB-CB 4.38Å; Q289-L292 HydrophobicContact CB-CD1 4.18Å; Q289-L292 HydrophobicContact CG-CD1 4.35Å; Q289-L292 PolarHBondContact O-N 3.18Å; Q289-L292 VanDerWaalsContact O-N 3.09Å; Q289-K309 HydrophobicContact CB-CB 3.92Å; Q289-K309 PolarHBondContact N-O 3.12Å; Q289-Y311 HydrophobicContact CB-CE2 4.3Å; Q289-H383 PolarHBondContact O-CE1 3.21Å; Q289-H383 PolarHBondContact O-ND1 3.49Å
290	A	86.3	Confident	83	Confident	85 Å²	85	65 Å²	65	70%	0.702	36%	0.364	S	S	*	.	T	Hydrogen-bonded Turn	trans	-59.1	136.4	177.1	0	0	0	0	0	111.4	L288 L292	L288-A290 PolarHBondContact O-N 2.92Å; A290-L292 VanDerWaalsContact C-N 3.29Å
291	G	84.7	Confident	84.3	Confident	59 Å²	59	60.2 Å²	60.2	61%	0.608	35%	0.35	S	S	*	.	T	Hydrogen-bonded Turn	trans	78	6.5	-174.8	0	0	0	0	0	115	Q289	Q289-G291 PolarHBondContact O-N 3.38Å
292	L	91.6	Very high	85.7	Confident	24 Å²	24	57.4 Å²	57.4	13%	0.126	35%	0.345	C	S	.	.			trans	-124.2	133.9	172.6	-71.6	-176	0	0	0	111.5	Q289 A290 M307 K309 H383	Q289-L292 HydrophobicContact CB-CB 4.38Å; Q289-L292 HydrophobicContact CB-CD1 4.18Å; Q289-L292 HydrophobicContact CG-CD1 4.35Å; Q289-L292 PolarHBondContact O-N 3.18Å; Q289-L292 VanDerWaalsContact O-N 3.09Å; A290-L292 VanDerWaalsContact C-N 3.29Å; L292-M307 WeakPolarHBondContact CB-O 3.39Å; L292-M307 HydrophobicContact CD1-CE 3.95Å; L292-M307 HydrophobicContact CD1-CG 4.34Å; L292-M307 HydrophobicContact CD2-CE 4.19Å; L292-K309 HydrophobicContact CD1-CB 4.26Å; L292-K309 HydrophobicContact CD1-CD 4.18Å; L292-K309 HydrophobicContact CD1-CG 4.12Å; L292-H383 WeakPolarHBondContact O-CB 3.32Å; L292-H383 PolarHBondContact O-ND1 3.2Å
293	P	93.8	Very high	87.6	Confident	8 Å²	8	60.2 Å²	60.2	5%	0.052	36%	0.356	C	S	.	.	S	Bend	cis	-62.5	156	-10.2	27.9	-35	0	0	0	112.7	F306 M307 W320 A385	P293-F306 HydrophobicContact CB-CB 4.18Å; P293-F306 HydrophobicContact CB-CD1 4.03Å; P293-M307 VanDerWaalsContact CA-O 3.27Å; P293-M307 WeakPolarHBondContact CA-O 3.45Å; P293-W320 HydrophobicContact CB-CH2 4.03Å; P293-W320 HydrophobicContact CB-CZ3 4.24Å; P293-W320 HydrophobicContact CG-CH2 4.14Å; P293-W320 HydrophobicContact CG-CZ3 4.06Å; P293-A385 HydrophobicContact CB-CB 3.67Å; P293-A385 HydrophobicContact CG-CB 3.77Å
294	A	93.1	Very high	89.2	Confident	47 Å²	47	58.4 Å²	58.4	39%	0.388	34%	0.344	S	S	.	.			trans	-105	143.7	178.2	0	0	0	0	0	110.5	K296 F306	A294-K296 PolarHBondContact O-N 2.97Å; A294-F306 WeakPolarHBondContact O-CE1 3.49Å
295	N	94.8	Very high	90.5	Very high	119 Å²	119	60.5 Å²	60.5	64%	0.636	35%	0.354	S	S	*	.			trans	-55.8	137.6	174.1	-65	-8.4	0	0	0	110.7	A385 W386	N295-A385 WeakPolarHBondContact OD1-CA 3.2Å; N295-W386 WeakPolarHBondContact CA-O 3.48Å; N295-W386 PolarHBondContact OD1-N 3.42Å
296	K	93.3	Very high	91.1	Very high	82 Å²	82	53.6 Å²	53.6	36%	0.357	33%	0.328	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-127.7	143.8	179.5	-77.6	-170.9	167.9	-173.9	0	111.5	A294 V304 E305 F306 W386 L387 T388	A294-K296 PolarHBondContact O-N 2.97Å; K296-V304 HydrophobicContact CD-CG1 4.09Å; K296-E305 WeakPolarHBondContact CE-O 3.41Å; K296-E305 PolarHBondContact NZ-O 3.36Å; K296-F306 HydrophobicContact CB-CE1 4.15Å; K296-F306 HydrophobicContact CB-CZ 4.35Å; K296-F306 HydrophobicContact CD-CE1 4.41Å; K296-F306 HydrophobicContact CG-CE1 4.24Å; K296-W386 PolarHBondContact N-O 2.91Å; K296-L387 HydrophobicContact CB-CD1 4.39Å; K296-T388 PolarHBondContact O-N 3.26Å
297	T	94.3	Very high	91.4	Very high	88 Å²	88	57.2 Å²	57.2	54%	0.54	35%	0.346	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-124.5	127.7	173	-57.8	0	0	0	0	108.1	T388 L390	T297-T388 VanDerWaalsContact CA-O 3.29Å; T297-T388 WeakPolarHBondContact CA-O 3.49Å; T297-T388 HydrophobicContact CG2-CG2 4.05Å; T297-L390 HydrophobicContact CG2-CD1 3.58Å; T297-L390 HydrophobicContact CG2-CD2 4.42Å; T297-L390 HydrophobicContact CG2-CG 3.78Å
298	V	92.4	Very high	91.7	Very high	30 Å²	30	53.2 Å²	53.2	18%	0.182	33%	0.326	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-139.9	161.6	-178.2	-65.1	0	0	0	0	112	V304 V362 L387 T388 V389 L390	V298-V304 HydrophobicContact CB-CG2 4.18Å; V298-V304 HydrophobicContact CG1-CG2 3.53Å; V298-V304 HydrophobicContact CG2-CG2 3.65Å; V298-V362 HydrophobicContact CG2-CG1 4.13Å; V298-L387 HydrophobicContact CG2-CD1 4.13Å; V298-T388 PolarHBondContact N-O 3.46Å; V298-V389 WeakPolarHBondContact O-CA 3.14Å; V298-L390 PolarHBondContact O-N 3.23Å
299	A	90.8	Very high	91.7	Very high	39 Å²	39	56.1 Å²	56.1	32%	0.322	34%	0.338	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-77.4	150.6	167.7	0	0	0	0	0	111.1	S302 L390 A392	A299-S302 WeakPolarHBondContact O-CB 3.46Å; A299-S302 PolarHBondContact O-N 2.83Å; A299-S302 VanDerWaalsContact O-N 3.13Å; A299-S302 PolarHBondContact O-OG 2.93Å; A299-L390 CarbonylContact C-O 3.54Å; A299-L390 WeakPolarHBondContact CA-O 3.1Å; A299-A392 HydrophobicContact CB-CB 4.14Å
300	L	91.6	Very high	91.6	Very high	83 Å²	83	53.3 Å²	53.3	44%	0.435	33%	0.325	S	S	.	.	T	Hydrogen-bonded Turn	trans	-50.6	137.9	173.1	-179.2	145.9	0	0	0	111.8	S302 F364 V389 L390	L300-S302 VanDerWaalsContact C-N 3.29Å; L300-S302 PolarHBondContact O-N 3.06Å; L300-F364 HydrophobicContact CD1-CD2 3.66Å; L300-F364 HydrophobicContact CD1-CE2 3.36Å; L300-F364 HydrophobicContact CD1-CG 4.39Å; L300-F364 HydrophobicContact CD1-CZ 3.87Å; L300-V389 HydrophobicContact CB-CG1 4.31Å; L300-L390 PolarHBondContact N-O 3.46Å
301	G	87.6	Confident	91.6	Very high	30 Å²	30	55.5 Å²	55.5	31%	0.309	32%	0.316	S	S	.	.	T	Hydrogen-bonded Turn	trans	82.6	-4.8	-176.4	0	0	0	0	0	115.1	N361 V362	G301-N361 WeakPolarHBondContact CA-OD1 3.47Å; G301-V362 PolarHBondContact N-O 2.87Å
302	S	90.8	Very high	91.1	Very high	40 Å²	40	54 Å²	54	28%	0.28	30%	0.296	S	S	.	.			trans	-67.7	160.3	175.8	-59.5	0	0	0	0	112.8	A299 L300 N361 V362	A299-S302 WeakPolarHBondContact O-CB 3.46Å; A299-S302 PolarHBondContact O-N 2.83Å; A299-S302 VanDerWaalsContact O-N 3.13Å; A299-S302 PolarHBondContact O-OG 2.93Å; L300-S302 VanDerWaalsContact C-N 3.29Å; L300-S302 PolarHBondContact O-N 3.06Å; S302-N361 PolarHBondContact O-N 2.84Å; S302-V362 WeakPolarHBondContact O-CB 3.46Å; S302-V362 WeakPolarHBondContact O-CG2 3.41Å; S302-V362 PolarHBondContact O-N 3.13Å
303	N	92.6	Very high	90	Very high	112 Å²	112	54.5 Å²	54.5	60%	0.599	30%	0.3	S	S	*	.			trans	-94.2	143.1	165.3	-61.8	-26.9	0	0	0	109.9	L359 R360 N361	N303-L359 CarbonylContact C-O 3.54Å; N303-L359 WeakPolarHBondContact CA-O 3.31Å; N303-R360 WeakPolarHBondContact OD1-CA 3.47Å; N303-N361 PolarHBondContact OD1-N 3.12Å
304	V	92.7	Very high	88.6	Confident	3 Å²	3	55.9 Å²	55.9	2%	0.018	31%	0.309	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-131.2	142.8	-176.8	166.4	0	0	0	0	110.2	K296 V298 F306 L359 V362 L387	K296-V304 HydrophobicContact CD-CG1 4.09Å; V298-V304 HydrophobicContact CB-CG2 4.18Å; V298-V304 HydrophobicContact CG1-CG2 3.53Å; V298-V304 HydrophobicContact CG2-CG2 3.65Å; V304-F306 HydrophobicContact CG1-CD2 4.01Å; V304-F306 HydrophobicContact CG1-CE2 3.65Å; V304-F306 HydrophobicContact CG1-CZ 3.99Å; V304-L359 HydrophobicContact CB-CB 4.3Å; V304-L359 HydrophobicContact CG1-CD1 4.34Å; V304-L359 PolarHBondContact N-O 3.04Å; V304-L359 PolarHBondContact O-N 3.45Å; V304-V362 HydrophobicContact CB-CG2 4.07Å; V304-V362 HydrophobicContact CG2-CG2 3.93Å; V304-L387 HydrophobicContact CG1-CD1 4.24Å; V304-L387 HydrophobicContact CG1-CD2 4.43Å; V304-L387 HydrophobicContact CG2-CD1 4.07Å
305	E	93.6	Very high	87.6	Confident	102 Å²	102	59.9 Å²	59.9	48%	0.477	32%	0.319	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-128.6	122.9	177.3	-55.1	-172.5	147.4	0	0	109.7	K296 L357 H358	K296-E305 WeakPolarHBondContact CE-O 3.41Å; K296-E305 PolarHBondContact NZ-O 3.36Å; E305-L357 CarbonylContact C-O 3.57Å; E305-L357 WeakPolarHBondContact CA-O 3.33Å; E305-H358 IonicContact OE1-CE1 3.19Å; E305-H358 PolarHBondContact OE1-CE1 3.26Å; E305-H358 IonicContact OE1-ND1 3.4Å; E305-H358 PolarHBondContact OE1-ND1 2.89Å
306	F	94.4	Very high	87.1	Confident	1 Å²	1	54.7 Å²	54.7	0%	0.004	29%	0.292	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-103.4	124.1	168.9	-68.8	-70.6	0	0	0	108.7	P293 A294 K296 V304 W320 V356 L357 L359 Y370 A385 L387	P293-F306 HydrophobicContact CB-CB 4.18Å; P293-F306 HydrophobicContact CB-CD1 4.03Å; A294-F306 WeakPolarHBondContact O-CE1 3.49Å; K296-F306 HydrophobicContact CB-CE1 4.15Å; K296-F306 HydrophobicContact CB-CZ 4.35Å; K296-F306 HydrophobicContact CD-CE1 4.41Å; K296-F306 HydrophobicContact CG-CE1 4.24Å; V304-F306 HydrophobicContact CG1-CD2 4.01Å; V304-F306 HydrophobicContact CG1-CE2 3.65Å; V304-F306 HydrophobicContact CG1-CZ 3.99Å; F306-W320 HydrophobicContact CB-CH2 3.52Å; F306-W320 HydrophobicContact CB-CZ2 4.4Å; F306-W320 HydrophobicContact CB-CZ3 3.63Å; F306-W320 WeakPolarHBondContact O-CZ2 3.39Å; F306-V356 WeakPolarHBondContact O-CA 3.2Å; F306-L357 HydrophobicContact CB-CB 4.41Å; F306-L357 HydrophobicContact CD2-CD2 4.37Å; F306-L357 PolarHBondContact N-O 3.33Å; F306-L357 PolarHBondContact O-N 3.32Å; F306-L359 HydrophobicContact CD2-CD1 4.28Å; F306-L359 HydrophobicContact CE2-CD1 3.99Å; F306-Y370 HydrophobicContact CD2-CD1 4.45Å; F306-Y370 HydrophobicContact CD2-CG 4.32Å; F306-Y370 HydrophobicContact CE2-CD1 4.37Å; F306-Y370 HydrophobicContact CE2-CD2 4.06Å; F306-Y370 AromaticContact CE2-CG 3.99Å; F306-Y370 HydrophobicContact CE2-CG 3.99Å; F306-Y370 HydrophobicContact CZ-CD2 4.48Å; F306-A385 HydrophobicContact CD1-CB 4.03Å; F306-A385 HydrophobicContact CE1-CB 3.83Å; F306-L387 HydrophobicContact CE2-CB 4.28Å; F306-L387 HydrophobicContact CE2-CD2 4.2Å; F306-L387 HydrophobicContact CZ-CB 3.91Å; F306-L387 HydrophobicContact CZ-CD1 4.31Å; F306-L387 HydrophobicContact CZ-CD2 4.49Å; F306-L387 HydrophobicContact CZ-CG 4.46Å
307	M	93.3	Very high	86.8	Confident	76 Å²	76	54.9 Å²	54.9	37%	0.374	29%	0.294	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-108.7	135.8	178.7	178	173.6	51.4	0	0	109.2	L292 P293 K309 E355 V356	L292-M307 WeakPolarHBondContact CB-O 3.39Å; L292-M307 HydrophobicContact CD1-CE 3.95Å; L292-M307 HydrophobicContact CD1-CG 4.34Å; L292-M307 HydrophobicContact CD2-CE 4.19Å; P293-M307 VanDerWaalsContact CA-O 3.27Å; P293-M307 WeakPolarHBondContact CA-O 3.45Å; M307-K309 HydrophobicContact CG-CG 4.22Å; M307-K309 HydrophobicContact SD-CD 4.33Å; M307-K309 HydrophobicContact SD-CG 4.29Å; M307-E355 CarbonylContact C-O 3.58Å; M307-E355 WeakPolarHBondContact CA-O 3.47Å; M307-V356 HydrophobicContact CG-CG2 4.45Å
308	C	92.1	Very high	86.6	Confident	1 Å²	1	50.9 Å²	50.9	1%	0.007	27%	0.269	C	S	.	.			trans	-134.4	98.3	-179.3	179.2	0	0	0	0	108	V310 W320 E355 C372	C308-V310 WeakPolarHBondContact O-CG2 3.38Å; C308-W320 HydrophobicContact CB-CH2 3.64Å; C308-W320 HydrophobicContact CB-CZ2 3.36Å; C308-E355 PolarHBondContact N-O 2.94Å; C308-E355 WeakPolarHBondContact O-CA 3.46Å; C308-E355 VanDerWaalsContact O-CB 3.3Å; C308-E355 WeakPolarHBondContact O-CB 3.3Å; C308-E355 WeakPolarHBondContact O-CG 3.23Å; C308-C372 HydrophobicContact CB-CB 3.51Å; C308-C372 WeakPolarHBondContact CB-SG 3.44Å; C308-C372 WeakPolarHBondContact SG-CB 3.49Å; C308-C372 CovalentContact SG-SG 2.02Å; C308-C372 PolarHBondContact SG-SG 3.19Å
309	K	91.6	Very high	86.6	Confident	75 Å²	75	51.4 Å²	51.4	33%	0.326	27%	0.27	S	S	.	.			trans	-83.4	128.3	-179.2	-76.7	-176.3	165.9	-176.1	0	111.3	L288 Q289 L292 M307 E355	L288-K309 WeakPolarHBondContact CA-O 3.23Å; Q289-K309 HydrophobicContact CB-CB 3.92Å; Q289-K309 PolarHBondContact N-O 3.12Å; L292-K309 HydrophobicContact CD1-CB 4.26Å; L292-K309 HydrophobicContact CD1-CD 4.18Å; L292-K309 HydrophobicContact CD1-CG 4.12Å; M307-K309 HydrophobicContact CG-CG 4.22Å; M307-K309 HydrophobicContact SD-CD 4.33Å; M307-K309 HydrophobicContact SD-CG 4.29Å; K309-E355 VanDerWaalsContact CA-OE1 3.28Å; K309-E355 WeakPolarHBondContact CA-OE1 3.46Å
310	V	88.9	Confident	86.7	Confident	15 Å²	15	49.6 Å²	49.6	9%	0.091	25%	0.254	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-123.6	108.1	-166.2	-169.4	0	0	0	0	111.3	P286 L288 C308 P316 I318 E355 A374	P286-V310 HydrophobicContact CB-CG1 3.64Å; L288-V310 HydrophobicContact CD2-CB 4.28Å; L288-V310 HydrophobicContact CD2-CG1 4.11Å; L288-V310 HydrophobicContact CD2-CG2 3.67Å; C308-V310 WeakPolarHBondContact O-CG2 3.38Å; V310-P316 HydrophobicContact CB-CG 4.4Å; V310-P316 HydrophobicContact CG1-CB 3.84Å; V310-P316 HydrophobicContact CG1-CG 3.69Å; V310-I318 HydrophobicContact CB-CD1 4.02Å; V310-I318 HydrophobicContact CG1-CD1 4.45Å; V310-I318 HydrophobicContact CG2-CD1 3.59Å; V310-I318 HydrophobicContact CG2-CG1 4.06Å; V310-E355 PolarHBondContact N-OE1 3.45Å; V310-A374 HydrophobicContact CG1-CB 3.74Å; V310-A374 HydrophobicContact CG2-CB 4.26Å
311	Y	85.4	Confident	86.8	Confident	131 Å²	131	46.7 Å²	46.7	51%	0.514	24%	0.239	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-94.7	111.2	174.4	-58	-80.6	0	0	0	109.9	H284 I287 Q289	H284-Y311 PolarHBondContact CE1-O 2.67Å; I287-Y311 PolarHBondContact N-O 3.05Å; I287-Y311 PolarHBondContact O-N 3.38Å; Q289-Y311 HydrophobicContact CB-CE2 4.3Å
312	S	74.6	Confident	87.1	Confident	27 Å²	27	46.3 Å²	46.3	19%	0.189	23%	0.229	C	C	.	.			trans	-148.9	143.5	-176.6	-170.9	0	0	0	0	112.5	P314 N376	S312-P314 CarbonylContact C-O 3.58Å; S312-P314 WeakPolarHBondContact CB-O 3.41Å; S312-P314 PolarHBondContact OG-O 3.43Å; S312-N376 PolarHBondContact OG-ND2 3.32Å
313	D	67.6	Low	87	Confident	36 Å²	36	46.7 Å²	46.7	19%	0.193	23%	0.226	C	C	.	.	S	Bend	trans	-146.1	114.9	165.3	161.2	33	0	0	0	106.7	R281 S282	R281-D313 WeakPolarHBondContact CA-OD2 3.47Å; R281-D313 WeakPolarHBondContact CB-OD2 3.16Å; R281-D313 WeakPolarHBondContact CD-OD1 3.34Å; R281-D313 WeakPolarHBondContact CG-OD1 3.39Å; R281-D313 WeakPolarHBondContact CG-OD2 3.38Å; R281-D313 IonicContact CZ-OD1 2.68Å; R281-D313 IonicContact NE-OD1 3.33Å; R281-D313 IonicContact NH1-OD1 3.82Å; R281-D313 PolarHBondContact NH1-OD1 3.16Å; S282-D313 PolarHBondContact N-OD2 2.88Å
314	P	65.4	Low	86.8	Confident	37 Å²	37	44.1 Å²	44.1	24%	0.24	21%	0.212	C	C	.	.	S	Bend	cis	-70.4	177.5	5.2	31.4	-36.5	0	0	0	113.9	S312 S377	S312-P314 CarbonylContact C-O 3.58Å; S312-P314 WeakPolarHBondContact CB-O 3.41Å; S312-P314 PolarHBondContact OG-O 3.43Å; P314-S377 WeakPolarHBondContact CG-OG 3.46Å
315	Q	72.3	Confident	86.5	Confident	130 Å²	130	49.8 Å²	49.8	61%	0.607	24%	0.238	S	C	*	.	P	Polyproline II helix	trans	-50.9	138	-177.5	-147.3	63.4	12.4	0	0	112.6	D351	Q315-D351 PolarHBondContact NE2-OD2 3.45Å
316	P	83.9	Confident	86.1	Confident	10 Å²	10	47.3 Å²	47.3	7%	0.065	23%	0.23	C	C	.	.	P	Polyproline II helix	trans	-93.8	134.7	-179.1	35	-29.1	0	0	0	112.1	P286 V310 I318 G375	P286-P316 HydrophobicContact CB-CB 4.21Å; P286-P316 HydrophobicContact CG-CB 3.89Å; V310-P316 HydrophobicContact CB-CG 4.4Å; V310-P316 HydrophobicContact CG1-CB 3.84Å; V310-P316 HydrophobicContact CG1-CG 3.69Å; P316-I318 HydrophobicContact CB-CG1 4.39Å; P316-I318 HydrophobicContact CG-CD1 4.37Å; P316-I318 HydrophobicContact CG-CG1 4.34Å; P316-G375 CarbonylContact C-O 3.48Å; P316-G375 WeakPolarHBondContact CA-O 3.43Å
317	H	86.3	Confident	85.4	Confident	87 Å²	87	55.4 Å²	55.4	40%	0.403	27%	0.273	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-77.7	120.9	160.8	-175.6	68.8	0	0	0	109.3	Q319 A374 G375	H317-Q319 WeakPolarHBondContact NE2-CG 3.21Å; H317-A374 WeakPolarHBondContact O-CA 3.23Å; H317-G375 PolarHBondContact N-O 2.81Å; H317-G375 PolarHBondContact O-N 2.83Å
318	I	90.3	Very high	84.8	Confident	3 Å²	3	55 Å²	55	2%	0.015	29%	0.289	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-108.4	139.8	-177.6	-57.9	168.7	0	0	0	109.7	V310 P316 M354 E355 L373 A374	V310-I318 HydrophobicContact CB-CD1 4.02Å; V310-I318 HydrophobicContact CG1-CD1 4.45Å; V310-I318 HydrophobicContact CG2-CD1 3.59Å; V310-I318 HydrophobicContact CG2-CG1 4.06Å; P316-I318 HydrophobicContact CB-CG1 4.39Å; P316-I318 HydrophobicContact CG-CD1 4.37Å; P316-I318 HydrophobicContact CG-CG1 4.34Å; I318-M354 HydrophobicContact CB-CB 4.05Å; I318-M354 HydrophobicContact CB-CE 4.45Å; I318-M354 HydrophobicContact CD1-CB 4.21Å; I318-M354 HydrophobicContact CG2-CB 4.34Å; I318-M354 WeakPolarHBondContact O-CE 3.3Å; I318-E355 HydrophobicContact CD1-CG 4.32Å; I318-L373 CarbonylContact C-O 3.55Å; I318-L373 WeakPolarHBondContact CA-O 3.44Å; I318-A374 HydrophobicContact CG1-CB 4.3Å
319	Q	91.9	Very high	84.2	Confident	42 Å²	42	57.4 Å²	57.4	20%	0.196	31%	0.306	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-138.2	148	175.4	-59.9	-173.4	-66.4	0	0	110.7	H317 K343 T344 L373	H317-Q319 WeakPolarHBondContact NE2-CG 3.21Å; Q319-K343 WeakPolarHBondContact CA-O 3.39Å; Q319-T344 HydrophobicContact CG-CG2 4.33Å; Q319-T344 WeakPolarHBondContact CG-OG1 3.2Å; Q319-T344 PolarHBondContact NE2-OG1 3.41Å; Q319-L373 PolarHBondContact N-O 2.8Å; Q319-L373 PolarHBondContact O-N 3.3Å
320	W	94.1	Very high	83.6	Confident	0 Å²	0	58.7 Å²	58.7	0%	0	31%	0.311	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-113.7	132.6	172.2	-74.4	90	0	0	0	110.6	P293 F306 C308 L342 K343 M354 L357 C372	P293-W320 HydrophobicContact CB-CH2 4.03Å; P293-W320 HydrophobicContact CB-CZ3 4.24Å; P293-W320 HydrophobicContact CG-CH2 4.14Å; P293-W320 HydrophobicContact CG-CZ3 4.06Å; F306-W320 HydrophobicContact CB-CH2 3.52Å; F306-W320 HydrophobicContact CB-CZ2 4.4Å; F306-W320 HydrophobicContact CB-CZ3 3.63Å; F306-W320 WeakPolarHBondContact O-CZ2 3.39Å; C308-W320 HydrophobicContact CB-CH2 3.64Å; C308-W320 HydrophobicContact CB-CZ2 3.36Å; W320-L342 HydrophobicContact CB-CB 4.49Å; W320-L342 PolarHBondContact O-N 3.23Å; W320-K343 HydrophobicContact CB-CB 3.98Å; W320-K343 HydrophobicContact CG-CB 4.38Å; W320-K343 PolarHBondContact N-O 3.48Å; W320-K343 PolarHBondContact O-N 3Å; W320-M354 PolarHBondContact NE1-O 3.35Å; W320-L357 HydrophobicContact CB-CD1 4.35Å; W320-L357 HydrophobicContact CB-CD2 4.19Å; W320-L357 HydrophobicContact CD2-CB 3.58Å; W320-L357 HydrophobicContact CD2-CD2 4.03Å; W320-L357 HydrophobicContact CD2-CG 4.36Å; W320-L357 HydrophobicContact CE3-CB 3.97Å; W320-L357 HydrophobicContact CE3-CD2 3.79Å; W320-L357 HydrophobicContact CG-CB 3.85Å; W320-L357 HydrophobicContact CG-CD1 4.47Å; W320-L357 HydrophobicContact CG-CD2 4.24Å; W320-L357 HydrophobicContact CG-CG 4.41Å; W320-L357 HydrophobicContact CH2-CB 4.44Å; W320-L357 HydrophobicContact CZ2-CB 4.11Å; W320-L357 HydrophobicContact CZ3-CB 4.39Å; W320-L357 HydrophobicContact CZ3-CD2 4.45Å; W320-C372 HydrophobicContact CD2-CB 4.28Å; W320-C372 HydrophobicContact CE3-CB 4.03Å; W320-C372 HydrophobicContact CH2-CB 3.88Å; W320-C372 HydrophobicContact CZ2-CB 4.11Å; W320-C372 HydrophobicContact CZ3-CB 3.83Å
321	L	93.4	Very high	83.3	Confident	22 Å²	22	62 Å²	62	12%	0.115	33%	0.328	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-123.8	143.2	-175.5	-51.9	177.3	0	0	0	110.1	V339 Q340 I341 Y370 T371 L373	L321-V339 HydrophobicContact CB-CB 4.39Å; L321-V339 HydrophobicContact CD1-CG2 4.48Å; L321-Q340 CarbonylContact C-O 3.53Å; L321-Q340 WeakPolarHBondContact CA-O 3.46Å; L321-I341 HydrophobicContact CD2-CB 4.32Å; L321-I341 HydrophobicContact CD2-CG1 3.79Å; L321-Y370 CarbonylContact O-C 3.6Å; L321-Y370 WeakPolarHBondContact O-CA 3.26Å; L321-T371 PolarHBondContact N-O 3.04Å; L321-T371 PolarHBondContact O-N 2.85Å; L321-L373 HydrophobicContact CD1-CB 4.34Å; L321-L373 HydrophobicContact CD1-CD2 4.23Å
322	K	93	Very high	83.1	Confident	22 Å²	22	56.2 Å²	56.2	10%	0.096	31%	0.308	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-112	129.2	166.3	-178	-178.5	-177	-175.7	0	108.3	V339 Q340 L342 E365 D366 Y370	K322-V339 CarbonylContact O-C 3.54Å; K322-V339 WeakPolarHBondContact O-CA 3.38Å; K322-Q340 PolarHBondContact N-O 2.89Å; K322-Q340 PolarHBondContact O-N 3.03Å; K322-L342 HydrophobicContact CB-CD1 3.84Å; K322-L342 HydrophobicContact CB-CD2 4.38Å; K322-L342 HydrophobicContact CB-CG 4.08Å; K322-E365 PolarHBondContact NZ-O 3.4Å; K322-D366 IonicContact NZ-OD1 3.14Å; K322-D366 PolarHBondContact NZ-OD1 2.99Å; K322-Y370 HydrophobicContact CB-CD1 4.41Å; K322-Y370 HydrophobicContact CB-CE1 4.24Å; K322-Y370 HydrophobicContact CD-CE1 4.19Å; K322-Y370 WeakPolarHBondContact CE-OH 3.4Å; K322-Y370 HydrophobicContact CG-CE1 4.18Å; K322-Y370 HydrophobicContact CG-CE2 4.36Å
323	H	89.9	Confident	83.2	Confident	48 Å²	48	61.3 Å²	61.3	22%	0.222	34%	0.34	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-75	136.3	172.8	-66.8	-105.2	0	0	0	109.6	E369 T371	H323-E369 HydrophobicContact CB-CB 4.22Å; H323-E369 PolarHBondContact CD2-O 3.35Å; H323-E369 PolarHBondContact N-O 2.96Å; H323-E369 IonicContact NE2-OE1 3.35Å; H323-T371 PolarHBondContact NE2-OG1 2.76Å
324	I	88.9	Confident	83.8	Confident	59 Å²	59	64.7 Å²	64.7	30%	0.303	36%	0.358	S	S	.	.			trans	-128.6	158	-176.6	58.5	167.5	0	0	0	110.9	V326 Y338 Q340	I324-V326 HydrophobicContact CD1-CG2 4.17Å; I324-V326 HydrophobicContact CG1-CG2 4.47Å; I324-Y338 WeakPolarHBondContact CG1-O 3.09Å; I324-Y338 PolarHBondContact N-O 3.36Å; I324-Q340 HydrophobicContact CG2-CB 4.18Å
325	E	85.6	Confident	84.4	Confident	122 Å²	122	69.3 Å²	69.3	57%	0.57	38%	0.381	S	S	*	.			trans	-103.6	128.3	172.8	-76.2	177	-148.5	0	0	109.9	S329 K330	E325-S329 WeakPolarHBondContact CA-O 3.4Å; E325-K330 HydrophobicContact CG-CD 4.32Å; E325-K330 HydrophobicContact CG-CG 3.52Å; E325-K330 WeakPolarHBondContact OE1-CE 3.42Å; E325-K330 IonicContact OE1-NZ 3.24Å; E325-K330 PolarHBondContact OE1-NZ 2.91Å
326	V	84.4	Confident	84.7	Confident	49 Å²	49	68.1 Å²	68.1	30%	0.297	38%	0.378	S	S	.	.	B	Isolated β-bridge	trans	-119.3	122	176.5	-176.1	0	0	0	0	107.9	I324 G328 S329 Y338	I324-V326 HydrophobicContact CD1-CG2 4.17Å; I324-V326 HydrophobicContact CG1-CG2 4.47Å; V326-G328 PolarHBondContact O-N 2.74Å; V326-G328 VanDerWaalsContact O-N 3.13Å; V326-S329 PolarHBondContact N-O 3.43Å; V326-S329 PolarHBondContact O-N 2.92Å; V326-Y338 HydrophobicContact CB-CD1 4.46Å; V326-Y338 HydrophobicContact CB-CD2 3.81Å; V326-Y338 HydrophobicContact CB-CE1 4.44Å; V326-Y338 HydrophobicContact CB-CE2 3.79Å; V326-Y338 HydrophobicContact CB-CG 4.16Å; V326-Y338 HydrophobicContact CG2-CD1 3.98Å; V326-Y338 HydrophobicContact CG2-CD2 3.91Å; V326-Y338 HydrophobicContact CG2-CE1 4.35Å; V326-Y338 HydrophobicContact CG2-CE2 4.29Å; V326-Y338 HydrophobicContact CG2-CG 3.74Å
327	N	81.2	Confident	84.8	Confident	171 Å²	171	70.8 Å²	70.8	91%	0.914	40%	0.395	S	S	*	.	T	Hydrogen-bonded Turn	trans	52.6	30.4	-175.8	-57.2	-34.1	0	0	0	114.3
328	G	79.3	Confident	84.8	Confident	69 Å²	69	70.3 Å²	70.3	71%	0.711	39%	0.39	S	S	*	.	T	Hydrogen-bonded Turn	trans	79.7	9.1	-177.5	0	0	0	0	0	115.3	V326	V326-G328 PolarHBondContact O-N 2.74Å; V326-G328 VanDerWaalsContact O-N 3.13Å
329	S	80.7	Confident	84.7	Confident	50 Å²	50	72.8 Å²	72.8	35%	0.35	41%	0.406	S	S	.	.	B	Isolated β-bridge	trans	-111	141.1	170	-172.8	0	0	0	0	111.3	E325 V326 I331	E325-S329 WeakPolarHBondContact CA-O 3.4Å; V326-S329 PolarHBondContact N-O 3.43Å; V326-S329 PolarHBondContact O-N 2.92Å; S329-I331 VanDerWaalsContact C-N 3.34Å; S329-I331 PolarHBondContact OG-N 3.3Å; S329-I331 PolarHBondContact OG-O 2.92Å
330	K	79.5	Confident	84.6	Confident	103 Å²	103	75.4 Å²	75.4	45%	0.448	42%	0.418	S	S	.	.	S	Bend	trans	-84.1	-11	166.1	-68	-171.4	179.7	-168.5	0	113.2	E325 P337 Y338	E325-K330 HydrophobicContact CG-CD 4.32Å; E325-K330 HydrophobicContact CG-CG 3.52Å; E325-K330 WeakPolarHBondContact OE1-CE 3.42Å; E325-K330 IonicContact OE1-NZ 3.24Å; E325-K330 PolarHBondContact OE1-NZ 2.91Å; K330-P337 CarbonylContact O-C 3.51Å; K330-P337 VanDerWaalsContact O-CA 3.28Å; K330-P337 WeakPolarHBondContact O-CA 3.34Å; K330-Y338 PolarHBondContact O-N 2.96Å
331	I	82.3	Confident	84.3	Confident	84 Å²	84	80.3 Å²	80.3	43%	0.431	44%	0.443	S	S	.	.	B	Isolated β-bridge	trans	-126.6	133.8	-168.8	-54.4	178.3	0	0	0	109.4	S329 L336 Y338	S329-I331 VanDerWaalsContact C-N 3.34Å; S329-I331 PolarHBondContact OG-N 3.3Å; S329-I331 PolarHBondContact OG-O 2.92Å; I331-L336 CarbonylContact C-O 3.58Å; I331-L336 WeakPolarHBondContact CA-O 3.3Å; I331-Y338 WeakPolarHBondContact O-CE2 3.49Å
332	G	80.2	Confident	84.1	Confident	9 Å²	9	82.2 Å²	82.2	9%	0.093	45%	0.453	C	S	.	.			trans	-77.1	172.6	177.4	0	0	0	0	0	114.2	D334 N335 L336	G332-D334 WeakPolarHBondContact CA-OD1 3.34Å; G332-D334 PolarHBondContact O-N 2.84Å; G332-N335 PolarHBondContact O-N 3.35Å; G332-L336 PolarHBondContact N-O 3.43Å
333	P	77.1	Confident	83.7	Confident	134 Å²	134	83.7 Å²	83.7	87%	0.87	46%	0.46	S	S	*	.	T	Hydrogen-bonded Turn	trans	-67.8	-11.7	178.1	30.4	-36.5	0	0	0	113.6
334	D	80.4	Confident	83.2	Confident	107 Å²	107	84.1 Å²	84.1	57%	0.572	47%	0.466	S	S	*	.	T	Hydrogen-bonded Turn	trans	-89.1	1	172.1	58.3	-3.7	0	0	0	113.4	G332 L336	G332-D334 WeakPolarHBondContact CA-OD1 3.34Å; G332-D334 PolarHBondContact O-N 2.84Å; D334-L336 VanDerWaalsContact C-N 3.27Å; D334-L336 PolarHBondContact O-N 3.36Å; D334-L336 PolarHBondContact OD1-N 2.92Å; D334-L336 VanDerWaalsContact OD1-N 3.12Å
335	N	78.5	Confident	82.3	Confident	134 Å²	134	83 Å²	83	72%	0.717	47%	0.466	S	S	*	.	S	Bend	trans	65.8	21.7	-176	-154.6	64	0	0	0	114.6	G332	G332-N335 PolarHBondContact O-N 3.35Å
336	L	78.7	Confident	81	Confident	105 Å²	105	79.2 Å²	79.2	55%	0.55	46%	0.459	S	S	.	.			trans	-99.4	151.3	172	-63	-179.2	0	0	0	111.6	I331 G332 D334	I331-L336 CarbonylContact C-O 3.58Å; I331-L336 WeakPolarHBondContact CA-O 3.3Å; G332-L336 PolarHBondContact N-O 3.43Å; D334-L336 VanDerWaalsContact C-N 3.27Å; D334-L336 PolarHBondContact O-N 3.36Å; D334-L336 PolarHBondContact OD1-N 2.92Å; D334-L336 VanDerWaalsContact OD1-N 3.12Å
337	P	84.1	Confident	79.2	Confident	66 Å²	66	84 Å²	84	43%	0.429	49%	0.488	S	S	.	.	B	Isolated β-bridge	trans	-70.5	139.9	177.1	29.3	-34.4	0	0	0	111.7	K330 V339	K330-P337 CarbonylContact O-C 3.51Å; K330-P337 VanDerWaalsContact O-CA 3.28Å; K330-P337 WeakPolarHBondContact O-CA 3.34Å; P337-V339 HydrophobicContact CB-CG1 4.4Å; P337-V339 HydrophobicContact CG-CG1 4.39Å; P337-V339 PolarHBondContact O-N 3.36Å
338	Y	86.4	Confident	77.7	Confident	77 Å²	77	83.1 Å²	83.1	30%	0.302	48%	0.483	S	S	.	.			trans	-70.9	115.8	170.3	-72.8	-64	0	0	0	109.8	I324 V326 K330 I331	I324-Y338 WeakPolarHBondContact CG1-O 3.09Å; I324-Y338 PolarHBondContact N-O 3.36Å; V326-Y338 HydrophobicContact CB-CD1 4.46Å; V326-Y338 HydrophobicContact CB-CD2 3.81Å; V326-Y338 HydrophobicContact CB-CE1 4.44Å; V326-Y338 HydrophobicContact CB-CE2 3.79Å; V326-Y338 HydrophobicContact CB-CG 4.16Å; V326-Y338 HydrophobicContact CG2-CD1 3.98Å; V326-Y338 HydrophobicContact CG2-CD2 3.91Å; V326-Y338 HydrophobicContact CG2-CE1 4.35Å; V326-Y338 HydrophobicContact CG2-CE2 4.29Å; V326-Y338 HydrophobicContact CG2-CG 3.74Å; K330-Y338 PolarHBondContact O-N 2.96Å; I331-Y338 WeakPolarHBondContact O-CE2 3.49Å
339	V	88.9	Confident	77.1	Confident	56 Å²	56	82.4 Å²	82.4	34%	0.339	47%	0.465	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-128.6	140	-177.6	-68.1	0	0	0	0	112.1	L321 K322 P337	L321-V339 HydrophobicContact CB-CB 4.39Å; L321-V339 HydrophobicContact CD1-CG2 4.48Å; K322-V339 CarbonylContact O-C 3.54Å; K322-V339 WeakPolarHBondContact O-CA 3.38Å; P337-V339 HydrophobicContact CB-CG1 4.4Å; P337-V339 HydrophobicContact CG-CG1 4.39Å; P337-V339 PolarHBondContact O-N 3.36Å
340	Q	89.4	Confident	76.4	Confident	96 Å²	96	83.6 Å²	83.6	45%	0.449	47%	0.47	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-100.1	125.8	170.3	-175.2	-179.6	10.7	0	0	109.3	L321 K322 I324 L342	L321-Q340 CarbonylContact C-O 3.53Å; L321-Q340 WeakPolarHBondContact CA-O 3.46Å; K322-Q340 PolarHBondContact N-O 2.89Å; K322-Q340 PolarHBondContact O-N 3.03Å; I324-Q340 HydrophobicContact CG2-CB 4.18Å; Q340-L342 HydrophobicContact CG-CD2 4.21Å; Q340-L342 PolarHBondContact O-N 2.99Å
341	I	89.3	Confident	75.7	Confident	103 Å²	103	81.6 Å²	81.6	53%	0.528	46%	0.464	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-75.2	122.5	173.3	-54.4	177.3	0	0	0	108.6	L321 T344	L321-I341 HydrophobicContact CD2-CB 4.32Å; L321-I341 HydrophobicContact CD2-CG1 3.79Å; I341-T344 VanDerWaalsContact CG2-OG1 3.32Å; I341-T344 WeakPolarHBondContact CG2-OG1 3.4Å
342	L	87.3	Confident	75.2	Confident	63 Å²	63	86 Å²	86	33%	0.33	48%	0.481	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-102	-32.6	179.1	-62.5	-173.1	0	0	0	113.4	W320 K322 Q340 L357 Y370	W320-L342 HydrophobicContact CB-CB 4.49Å; W320-L342 PolarHBondContact O-N 3.23Å; K322-L342 HydrophobicContact CB-CD1 3.84Å; K322-L342 HydrophobicContact CB-CD2 4.38Å; K322-L342 HydrophobicContact CB-CG 4.08Å; Q340-L342 HydrophobicContact CG-CD2 4.21Å; Q340-L342 PolarHBondContact O-N 2.99Å; L342-L357 HydrophobicContact CB-CD1 4.28Å; L342-L357 HydrophobicContact CD1-CD1 4.5Å; L342-L357 HydrophobicContact CD1-CD2 4.06Å; L342-Y370 HydrophobicContact CD1-CD1 3.83Å; L342-Y370 HydrophobicContact CD1-CE1 3.48Å; L342-Y370 VanDerWaalsContact CD1-CE1 3.48Å
343	K	85.4	Confident	75.1	Confident	52 Å²	52	90.3 Å²	90.3	23%	0.226	50%	0.498	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-147.6	141.1	180	-160.4	173.9	177.8	171.4	0	110	Q319 W320 E353 M354 V356	Q319-K343 WeakPolarHBondContact CA-O 3.39Å; W320-K343 HydrophobicContact CB-CB 3.98Å; W320-K343 HydrophobicContact CG-CB 4.38Å; W320-K343 PolarHBondContact N-O 3.48Å; W320-K343 PolarHBondContact O-N 3Å; K343-E353 PolarHBondContact NZ-O 3.2Å; K343-M354 HydrophobicContact CD-CE 4.4Å; K343-M354 HydrophobicContact CD-SD 4.12Å; K343-M354 VanDerWaalsContact CE-SD 3.57Å; K343-M354 HydrophobicContact CG-CE 3.91Å; K343-M354 HydrophobicContact CG-SD 3.93Å; K343-V356 PolarHBondContact NZ-O 3.25Å
344	T	80.4	Confident	75.4	Confident	57 Å²	57	84 Å²	84	35%	0.35	46%	0.457	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-153	144.6	176.8	-73.9	0	0	0	0	107.4	Q319 I341 G346 M354	Q319-T344 HydrophobicContact CG-CG2 4.33Å; Q319-T344 WeakPolarHBondContact CG-OG1 3.2Å; Q319-T344 PolarHBondContact NE2-OG1 3.41Å; I341-T344 VanDerWaalsContact CG2-OG1 3.32Å; I341-T344 WeakPolarHBondContact CG2-OG1 3.4Å; T344-G346 PolarHBondContact O-N 2.97Å; T344-M354 VanDerWaalsContact C-CE 3.44Å
345	A	68.3	Low	75.7	Confident	37 Å²	37	80.9 Å²	80.9	31%	0.306	44%	0.439	S	S	.	.			trans	-63.1	133.1	-178	0	0	0	0	0	111.4	M354	A345-M354 HydrophobicContact CB-CE 4.27Å; A345-M354 HydrophobicContact CB-CG 4.27Å; A345-M354 HydrophobicContact CB-SD 4.33Å; A345-M354 VanDerWaalsContact N-CE 3.29Å
346	G	58.6	Low	76.3	Confident	41 Å²	41	75.9 Å²	75.9	42%	0.423	41%	0.413	S	S	.	.			trans	-111	175.7	168.6	0	0	0	0	0	111.2	T344 N348 T349	T344-G346 PolarHBondContact O-N 2.97Å; G346-N348 PolarHBondContact O-N 2.59Å; G346-T349 PolarHBondContact N-OG1 3.28Å; G346-T349 PolarHBondContact O-N 2.93Å; G346-T349 VanDerWaalsContact O-N 3.08Å; G346-T349 PolarHBondContact O-OG1 3.17Å
347	V	47.7	Very low	77	Confident	150 Å²	150	71.4 Å²	71.4	91%	0.909	39%	0.39	S	S	*	.	T	Hydrogen-bonded Turn	trans	-54.1	-30.1	-173.3	-174.1	0	0	0	0	113.6
348	N	50	Low	77.3	Confident	153 Å²	153	72.8 Å²	72.8	82%	0.818	39%	0.391	S	S	*	.	T	Hydrogen-bonded Turn	trans	-111.2	11.8	-175.6	-58.3	20.5	0	0	0	113.3	G346	G346-N348 PolarHBondContact O-N 2.59Å
349	T	65	Low	77.6	Confident	54 Å²	54	70.3 Å²	70.3	33%	0.331	38%	0.382	S	S	.	.			trans	-99.8	126.7	-173.8	-37.9	0	0	0	0	111.4	G346 E353 M354	G346-T349 PolarHBondContact N-OG1 3.28Å; G346-T349 PolarHBondContact O-N 2.93Å; G346-T349 VanDerWaalsContact O-N 3.08Å; G346-T349 PolarHBondContact O-OG1 3.17Å; T349-E353 HydrophobicContact CG2-CB 4.41Å; T349-M354 HydrophobicContact CG2-CG 3.96Å; T349-M354 HydrophobicContact CG2-SD 3.65Å
350	T	67.1	Low	77.7	Confident	74 Å²	74	77.4 Å²	77.4	45%	0.454	40%	0.403	S	S	.	.			trans	-82.8	149.5	-179.6	70.1	0	0	0	0	112.2	K352 E353 M354	T350-K352 PolarHBondContact O-N 3.18Å; T350-E353 WeakPolarHBondContact CB-OE2 3.25Å; T350-E353 PolarHBondContact N-OE2 3.48Å; T350-E353 WeakPolarHBondContact O-CB 3.46Å; T350-E353 PolarHBondContact O-N 3.28Å; T350-E353 WeakPolarHBondContact OG1-CG 3.46Å; T350-E353 PolarHBondContact OG1-N 3.3Å; T350-E353 PolarHBondContact OG1-OE2 3.45Å; T350-M354 WeakPolarHBondContact O-CG 3.31Å; T350-M354 PolarHBondContact O-N 3.39Å; T350-M354 VanDerWaalsContact O-N 3.08Å
351	D	64.9	Low	77.7	Confident	61 Å²	61	78.5 Å²	78.5	33%	0.326	41%	0.412	S	S	.	.	H	α-helix	trans	-58.7	-34.3	179.7	-60.5	-61.8	0	0	0	112.8	Q315 E353 M354 E355	Q315-D351 PolarHBondContact NE2-OD2 3.45Å; D351-E353 VanDerWaalsContact C-N 3.32Å; D351-E353 PolarHBondContact O-N 2.91Å; D351-M354 CarbonylContact O-C 3.59Å; D351-M354 WeakPolarHBondContact O-CA 3.32Å; D351-M354 WeakPolarHBondContact O-CB 3.46Å; D351-M354 PolarHBondContact O-N 3.38Å; D351-E355 WeakPolarHBondContact O-CG 3.39Å; D351-E355 PolarHBondContact O-N 3.13Å
352	K	70.4	Confident	77.8	Confident	177 Å²	177	73.6 Å²	73.6	77%	0.77	39%	0.387	S	S	*	.	H	α-helix	trans	-63.1	-36.3	176.2	-71.6	-179.1	179.9	173.2	0	112.7	T350	T350-K352 PolarHBondContact O-N 3.18Å
353	E	78.4	Confident	78.1	Confident	99 Å²	99	72.5 Å²	72.5	46%	0.463	38%	0.384	S	S	.	.	H	α-helix	trans	-71.3	-36.5	172.2	-66.4	163.6	112.3	0	0	110.4	K343 T349 T350 D351 E355 V356	K343-E353 PolarHBondContact NZ-O 3.2Å; T349-E353 HydrophobicContact CG2-CB 4.41Å; T350-E353 WeakPolarHBondContact CB-OE2 3.25Å; T350-E353 PolarHBondContact N-OE2 3.48Å; T350-E353 WeakPolarHBondContact O-CB 3.46Å; T350-E353 PolarHBondContact O-N 3.28Å; T350-E353 WeakPolarHBondContact OG1-CG 3.46Å; T350-E353 PolarHBondContact OG1-N 3.3Å; T350-E353 PolarHBondContact OG1-OE2 3.45Å; D351-E353 VanDerWaalsContact C-N 3.32Å; D351-E353 PolarHBondContact O-N 2.91Å; E353-E355 VanDerWaalsContact C-N 3.31Å; E353-E355 PolarHBondContact O-N 3.22Å; E353-V356 PolarHBondContact O-N 3.29Å; E353-V356 VanDerWaalsContact O-N 3.1Å
354	M	83.8	Confident	78.3	Confident	1 Å²	1	74.9 Å²	74.9	1%	0.005	40%	0.395	C	S	.	.	H	α-helix	trans	-67	-28.5	178.8	-67.8	-58.5	-58.4	0	0	113.5	I318 W320 K343 T344 A345 T349 T350 D351 V356	I318-M354 HydrophobicContact CB-CB 4.05Å; I318-M354 HydrophobicContact CB-CE 4.45Å; I318-M354 HydrophobicContact CD1-CB 4.21Å; I318-M354 HydrophobicContact CG2-CB 4.34Å; I318-M354 WeakPolarHBondContact O-CE 3.3Å; W320-M354 PolarHBondContact NE1-O 3.35Å; K343-M354 HydrophobicContact CD-CE 4.4Å; K343-M354 HydrophobicContact CD-SD 4.12Å; K343-M354 VanDerWaalsContact CE-SD 3.57Å; K343-M354 HydrophobicContact CG-CE 3.91Å; K343-M354 HydrophobicContact CG-SD 3.93Å; T344-M354 VanDerWaalsContact C-CE 3.44Å; A345-M354 HydrophobicContact CB-CE 4.27Å; A345-M354 HydrophobicContact CB-CG 4.27Å; A345-M354 HydrophobicContact CB-SD 4.33Å; A345-M354 VanDerWaalsContact N-CE 3.29Å; T349-M354 HydrophobicContact CG2-CG 3.96Å; T349-M354 HydrophobicContact CG2-SD 3.65Å; T350-M354 WeakPolarHBondContact O-CG 3.31Å; T350-M354 PolarHBondContact O-N 3.39Å; T350-M354 VanDerWaalsContact O-N 3.08Å; D351-M354 CarbonylContact O-C 3.59Å; D351-M354 WeakPolarHBondContact O-CA 3.32Å; D351-M354 WeakPolarHBondContact O-CB 3.46Å; D351-M354 PolarHBondContact O-N 3.38Å; M354-V356 PolarHBondContact O-N 3.21Å; M354-V356 VanDerWaalsContact O-N 3.13Å
355	E	87.4	Confident	78.7	Confident	43 Å²	43	80.4 Å²	80.4	20%	0.201	42%	0.417	C	S	.	.	T	Hydrogen-bonded Turn	trans	-59.3	-16.3	169.1	-67.4	-158.2	141.4	0	0	113.6	M307 C308 K309 V310 I318 D351 E353	M307-E355 CarbonylContact C-O 3.58Å; M307-E355 WeakPolarHBondContact CA-O 3.47Å; C308-E355 PolarHBondContact N-O 2.94Å; C308-E355 WeakPolarHBondContact O-CA 3.46Å; C308-E355 VanDerWaalsContact O-CB 3.3Å; C308-E355 WeakPolarHBondContact O-CB 3.3Å; C308-E355 WeakPolarHBondContact O-CG 3.23Å; K309-E355 VanDerWaalsContact CA-OE1 3.28Å; K309-E355 WeakPolarHBondContact CA-OE1 3.46Å; V310-E355 PolarHBondContact N-OE1 3.45Å; I318-E355 HydrophobicContact CD1-CG 4.32Å; D351-E355 WeakPolarHBondContact O-CG 3.39Å; D351-E355 PolarHBondContact O-N 3.13Å; E353-E355 VanDerWaalsContact C-N 3.31Å; E353-E355 PolarHBondContact O-N 3.22Å
356	V	90.8	Very high	79.7	Confident	29 Å²	29	80.6 Å²	80.6	18%	0.176	41%	0.413	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-125.1	128.9	-176	-166.7	0	0	0	0	113	F306 M307 K343 E353 M354 H358	F306-V356 WeakPolarHBondContact O-CA 3.2Å; M307-V356 HydrophobicContact CG-CG2 4.45Å; K343-V356 PolarHBondContact NZ-O 3.25Å; E353-V356 PolarHBondContact O-N 3.29Å; E353-V356 VanDerWaalsContact O-N 3.1Å; M354-V356 PolarHBondContact O-N 3.21Å; M354-V356 VanDerWaalsContact O-N 3.13Å; V356-H358 WeakPolarHBondContact CG1-NE2 3.42Å
357	L	92.5	Very high	81.2	Confident	10 Å²	10	80.8 Å²	80.8	5%	0.052	41%	0.41	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-104.3	117.6	167.7	175	69.4	0	0	0	109.3	E305 F306 W320 L342 L359 Y370	E305-L357 CarbonylContact C-O 3.57Å; E305-L357 WeakPolarHBondContact CA-O 3.33Å; F306-L357 HydrophobicContact CB-CB 4.41Å; F306-L357 HydrophobicContact CD2-CD2 4.37Å; F306-L357 PolarHBondContact N-O 3.33Å; F306-L357 PolarHBondContact O-N 3.32Å; W320-L357 HydrophobicContact CB-CD1 4.35Å; W320-L357 HydrophobicContact CB-CD2 4.19Å; W320-L357 HydrophobicContact CD2-CB 3.58Å; W320-L357 HydrophobicContact CD2-CD2 4.03Å; W320-L357 HydrophobicContact CD2-CG 4.36Å; W320-L357 HydrophobicContact CE3-CB 3.97Å; W320-L357 HydrophobicContact CE3-CD2 3.79Å; W320-L357 HydrophobicContact CG-CB 3.85Å; W320-L357 HydrophobicContact CG-CD1 4.47Å; W320-L357 HydrophobicContact CG-CD2 4.24Å; W320-L357 HydrophobicContact CG-CG 4.41Å; W320-L357 HydrophobicContact CH2-CB 4.44Å; W320-L357 HydrophobicContact CZ2-CB 4.11Å; W320-L357 HydrophobicContact CZ3-CB 4.39Å; W320-L357 HydrophobicContact CZ3-CD2 4.45Å; L342-L357 HydrophobicContact CB-CD1 4.28Å; L342-L357 HydrophobicContact CD1-CD1 4.5Å; L342-L357 HydrophobicContact CD1-CD2 4.06Å; L357-L359 HydrophobicContact CD1-CD2 4.5Å; L357-L359 HydrophobicContact CD2-CD2 4.44Å; L357-L359 HydrophobicContact CG-CD2 4.39Å; L357-Y370 HydrophobicContact CD2-CD1 3.68Å; L357-Y370 HydrophobicContact CD2-CE1 4.18Å
358	H	91.6	Very high	83.3	Confident	96 Å²	96	74.1 Å²	74.1	44%	0.444	37%	0.372	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-101	127.8	172.5	-51.1	-100.4	0	0	0	109.6	E305 V356	E305-H358 IonicContact OE1-CE1 3.19Å; E305-H358 PolarHBondContact OE1-CE1 3.26Å; E305-H358 IonicContact OE1-ND1 3.4Å; E305-H358 PolarHBondContact OE1-ND1 2.89Å; V356-H358 WeakPolarHBondContact CG1-NE2 3.42Å
359	L	91.7	Very high	85.4	Confident	25 Å²	25	69.6 Å²	69.6	13%	0.131	35%	0.346	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-109.9	136.6	169	-56	170.4	0	0	0	107.5	N303 V304 F306 L357 V362 Y370 L387	N303-L359 CarbonylContact C-O 3.54Å; N303-L359 WeakPolarHBondContact CA-O 3.31Å; V304-L359 HydrophobicContact CB-CB 4.3Å; V304-L359 HydrophobicContact CG1-CD1 4.34Å; V304-L359 PolarHBondContact N-O 3.04Å; V304-L359 PolarHBondContact O-N 3.45Å; F306-L359 HydrophobicContact CD2-CD1 4.28Å; F306-L359 HydrophobicContact CE2-CD1 3.99Å; L357-L359 HydrophobicContact CD1-CD2 4.5Å; L357-L359 HydrophobicContact CD2-CD2 4.44Å; L357-L359 HydrophobicContact CG-CD2 4.39Å; L359-V362 HydrophobicContact CB-CG2 3.88Å; L359-Y370 HydrophobicContact CD1-CD1 4.4Å; L359-Y370 HydrophobicContact CD1-CE1 3.64Å; L359-Y370 HydrophobicContact CD1-CE2 4.49Å; L359-Y370 HydrophobicContact CD2-CE1 4.13Å; L359-Y370 HydrophobicContact CG-CE1 4.47Å; L359-L387 HydrophobicContact CD1-CD2 3.69Å
360	R	91.3	Very high	86.9	Confident	204 Å²	204	67.1 Å²	67.1	77%	0.77	33%	0.33	S	S	*	.			trans	-122.5	143.2	-178.7	-64.4	-178.5	-178.7	175.9	0.5	110.2	N303	N303-R360 WeakPolarHBondContact OD1-CA 3.47Å
361	N	89.9	Confident	88.2	Confident	119 Å²	119	64 Å²	64	64%	0.636	31%	0.311	S	S	*	.	S	Bend	trans	52.8	52.6	-179.4	-170.1	50.2	0	0	0	113.1	G301 S302 N303 S363	G301-N361 WeakPolarHBondContact CA-OD1 3.47Å; S302-N361 PolarHBondContact O-N 2.84Å; N303-N361 PolarHBondContact OD1-N 3.12Å; N361-S363 PolarHBondContact O-N 3.17Å
362	V	92.1	Very high	89.6	Confident	1 Å²	1	61.1 Å²	61.1	1%	0.006	30%	0.296	C	S	.	.			trans	-58.6	129.1	-171.2	167.7	0	0	0	0	112.5	V298 G301 S302 V304 L359 D366 L387 V389	V298-V362 HydrophobicContact CG2-CG1 4.13Å; G301-V362 PolarHBondContact N-O 2.87Å; S302-V362 WeakPolarHBondContact O-CB 3.46Å; S302-V362 WeakPolarHBondContact O-CG2 3.41Å; S302-V362 PolarHBondContact O-N 3.13Å; V304-V362 HydrophobicContact CB-CG2 4.07Å; V304-V362 HydrophobicContact CG2-CG2 3.93Å; L359-V362 HydrophobicContact CB-CG2 3.88Å; V362-D366 HydrophobicContact CG1-CB 4.02Å; V362-L387 HydrophobicContact CG1-CD2 4.04Å; V362-V389 HydrophobicContact CG1-CG1 4.28Å; V362-V389 HydrophobicContact CG1-CG2 3.47Å; V362-V389 VanDerWaalsContact CG1-CG2 3.47Å
363	S	92.3	Very high	90.7	Very high	39 Å²	39	54.2 Å²	54.2	27%	0.273	27%	0.268	S	S	.	.			trans	-102.7	173.1	-179.2	75.4	0	0	0	0	112.8	N361 E365 D366 V389	N361-S363 PolarHBondContact O-N 3.17Å; S363-E365 PolarHBondContact O-N 2.94Å; S363-E365 PolarHBondContact OG-N 2.9Å; S363-D366 WeakPolarHBondContact CB-OD2 3.38Å; S363-D366 PolarHBondContact N-OD2 3.43Å; S363-D366 WeakPolarHBondContact O-CB 3.42Å; S363-D366 PolarHBondContact O-N 3.37Å; S363-D366 VanDerWaalsContact O-N 3.13Å; S363-D366 PolarHBondContact OG-N 3.47Å; S363-D366 PolarHBondContact OG-OD2 2.99Å; S363-V389 WeakPolarHBondContact O-CG2 3.4Å
364	F	90.3	Very high	91.3	Very high	103 Å²	103	49.5 Å²	49.5	45%	0.452	25%	0.245	S	C	.	.	G	3₁₀ helix	trans	-65.2	-26.7	170.3	-68.9	-58.9	0	0	0	113.4	L300 D366 A367 V389 E391	L300-F364 HydrophobicContact CD1-CD2 3.66Å; L300-F364 HydrophobicContact CD1-CE2 3.36Å; L300-F364 HydrophobicContact CD1-CG 4.39Å; L300-F364 HydrophobicContact CD1-CZ 3.87Å; F364-D366 PolarHBondContact O-N 2.9Å; F364-A367 WeakPolarHBondContact O-CB 3.45Å; F364-A367 PolarHBondContact O-N 3.31Å; F364-V389 HydrophobicContact CD1-CB 4.07Å; F364-V389 HydrophobicContact CD1-CG1 3.93Å; F364-V389 HydrophobicContact CE1-CB 4.43Å; F364-V389 HydrophobicContact CE1-CG1 4.05Å; F364-E391 HydrophobicContact CZ-CG 3.74Å
365	E	88.3	Confident	91.4	Very high	172 Å²	172	50 Å²	50	80%	0.804	25%	0.251	S	S	*	.	G	3₁₀ helix	trans	-71.5	-12	175	-59.9	-178.9	-170.3	0	0	112.1	K322 S363	K322-E365 PolarHBondContact NZ-O 3.4Å; S363-E365 PolarHBondContact O-N 2.94Å; S363-E365 PolarHBondContact OG-N 2.9Å
366	D	89.6	Confident	91.3	Very high	41 Å²	41	49 Å²	49	22%	0.219	25%	0.247	C	C	.	.	G	3₁₀ helix	trans	-91.1	-4.9	172.8	-62.2	-59.2	0	0	0	114	K322 V362 S363 F364 G368 Y370 L387	K322-D366 IonicContact NZ-OD1 3.14Å; K322-D366 PolarHBondContact NZ-OD1 2.99Å; V362-D366 HydrophobicContact CG1-CB 4.02Å; S363-D366 WeakPolarHBondContact CB-OD2 3.38Å; S363-D366 PolarHBondContact N-OD2 3.43Å; S363-D366 WeakPolarHBondContact O-CB 3.42Å; S363-D366 PolarHBondContact O-N 3.37Å; S363-D366 VanDerWaalsContact O-N 3.13Å; S363-D366 PolarHBondContact OG-N 3.47Å; S363-D366 PolarHBondContact OG-OD2 2.99Å; F364-D366 PolarHBondContact O-N 2.9Å; D366-G368 PolarHBondContact O-N 2.97Å; D366-Y370 WeakPolarHBondContact O-CE2 3.38Å; D366-Y370 PolarHBondContact O-OH 3.18Å; D366-Y370 VanDerWaalsContact O-OH 3.11Å; D366-L387 HydrophobicContact CB-CD2 4.41Å; D366-L387 WeakPolarHBondContact O-CD2 3.23Å
367	A	91.1	Very high	90.4	Very high	46 Å²	46	52.4 Å²	52.4	38%	0.38	27%	0.272	S	S	.	.			trans	-67.1	132.6	168.9	0	0	0	0	0	110.4	F364 L387 V389	F364-A367 WeakPolarHBondContact O-CB 3.45Å; F364-A367 PolarHBondContact O-N 3.31Å; A367-L387 WeakPolarHBondContact CA-O 3.35Å; A367-V389 HydrophobicContact CB-CB 4.46Å; A367-V389 HydrophobicContact CB-CG2 4.13Å
368	G	91.6	Very high	89.6	Confident	10 Å²	10	55.4 Å²	55.4	10%	0.103	29%	0.287	C	S	.	.	E	Extended strand (participates in β ladder)	trans	155.3	-168.7	-177.5	0	0	0	0	0	114.7	D366 W386 L387	D366-G368 PolarHBondContact O-N 2.97Å; G368-W386 WeakPolarHBondContact O-CA 3.28Å; G368-L387 PolarHBondContact N-O 2.96Å; G368-L387 VanDerWaalsContact N-O 3.08Å; G368-L387 PolarHBondContact O-N 3Å
369	E	94.4	Very high	88.9	Confident	58 Å²	58	52.2 Å²	52.2	27%	0.271	28%	0.28	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-95.2	129	179.8	-168.4	177.2	155.5	0	0	111.5	H323 S384 W386	H323-E369 HydrophobicContact CB-CB 4.22Å; H323-E369 PolarHBondContact CD2-O 3.35Å; H323-E369 PolarHBondContact N-O 2.96Å; H323-E369 IonicContact NE2-OE1 3.35Å; E369-S384 WeakPolarHBondContact OE1-CB 3.31Å; E369-S384 PolarHBondContact OE1-OG 3.46Å; E369-W386 HydrophobicContact CB-CE3 3.83Å; E369-W386 HydrophobicContact CB-CZ3 3.77Å; E369-W386 HydrophobicContact CG-CE3 4.26Å; E369-W386 HydrophobicContact CG-CZ3 4.41Å
370	Y	95.1	Very high	88.7	Confident	1 Å²	1	56.3 Å²	56.3	0%	0.004	30%	0.302	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-116.3	120.5	177.6	-72.2	-103.9	0	0	0	109.3	F306 L321 K322 L342 L357 L359 D366 S384 A385 L387	F306-Y370 HydrophobicContact CD2-CD1 4.45Å; F306-Y370 HydrophobicContact CD2-CG 4.32Å; F306-Y370 HydrophobicContact CE2-CD1 4.37Å; F306-Y370 HydrophobicContact CE2-CD2 4.06Å; F306-Y370 AromaticContact CE2-CG 3.99Å; F306-Y370 HydrophobicContact CE2-CG 3.99Å; F306-Y370 HydrophobicContact CZ-CD2 4.48Å; L321-Y370 CarbonylContact O-C 3.6Å; L321-Y370 WeakPolarHBondContact O-CA 3.26Å; K322-Y370 HydrophobicContact CB-CD1 4.41Å; K322-Y370 HydrophobicContact CB-CE1 4.24Å; K322-Y370 HydrophobicContact CD-CE1 4.19Å; K322-Y370 WeakPolarHBondContact CE-OH 3.4Å; K322-Y370 HydrophobicContact CG-CE1 4.18Å; K322-Y370 HydrophobicContact CG-CE2 4.36Å; L342-Y370 HydrophobicContact CD1-CD1 3.83Å; L342-Y370 HydrophobicContact CD1-CE1 3.48Å; L342-Y370 VanDerWaalsContact CD1-CE1 3.48Å; L357-Y370 HydrophobicContact CD2-CD1 3.68Å; L357-Y370 HydrophobicContact CD2-CE1 4.18Å; L359-Y370 HydrophobicContact CD1-CD1 4.4Å; L359-Y370 HydrophobicContact CD1-CE1 3.64Å; L359-Y370 HydrophobicContact CD1-CE2 4.49Å; L359-Y370 HydrophobicContact CD2-CE1 4.13Å; L359-Y370 HydrophobicContact CG-CE1 4.47Å; D366-Y370 WeakPolarHBondContact O-CE2 3.38Å; D366-Y370 PolarHBondContact O-OH 3.18Å; D366-Y370 VanDerWaalsContact O-OH 3.11Å; Y370-S384 CarbonylContact O-C 3.57Å; Y370-S384 WeakPolarHBondContact O-CA 3.35Å; Y370-A385 PolarHBondContact N-O 3.18Å; Y370-A385 PolarHBondContact O-N 3.29Å; Y370-L387 HydrophobicContact CD2-CB 4.01Å; Y370-L387 HydrophobicContact CE2-CB 3.78Å; Y370-L387 HydrophobicContact CE2-CD2 3.98Å
371	T	94.6	Very high	88.7	Confident	9 Å²	9	47.3 Å²	47.3	6%	0.055	27%	0.27	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-109.2	127.3	-179.5	-55.7	0	0	0	0	110.5	L321 H323 H382 H383 S384	L321-T371 PolarHBondContact N-O 3.04Å; L321-T371 PolarHBondContact O-N 2.85Å; H323-T371 PolarHBondContact NE2-OG1 2.76Å; T371-H382 HydrophobicContact CG2-CB 3.79Å; T371-H383 WeakPolarHBondContact CA-O 3.36Å; T371-S384 PolarHBondContact OG1-OG 2.79Å
372	C	94.4	Very high	88.8	Confident	0 Å²	0	47.4 Å²	47.4	0%	0	27%	0.267	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-85.2	127.7	161	175.2	0	0	0	0	108.8	C308 W320 H382 H383	C308-C372 HydrophobicContact CB-CB 3.51Å; C308-C372 WeakPolarHBondContact CB-SG 3.44Å; C308-C372 WeakPolarHBondContact SG-CB 3.49Å; C308-C372 CovalentContact SG-SG 2.02Å; C308-C372 PolarHBondContact SG-SG 3.19Å; W320-C372 HydrophobicContact CD2-CB 4.28Å; W320-C372 HydrophobicContact CE3-CB 4.03Å; W320-C372 HydrophobicContact CH2-CB 3.88Å; W320-C372 HydrophobicContact CZ2-CB 4.11Å; W320-C372 HydrophobicContact CZ3-CB 3.83Å; C372-H382 WeakPolarHBondContact O-CA 3.44Å; C372-H382 WeakPolarHBondContact O-CB 3.43Å; C372-H383 PolarHBondContact N-O 2.89Å; C372-H383 PolarHBondContact O-N 2.77Å; C372-H383 VanDerWaalsContact O-N 3.09Å
373	L	93	Very high	89	Confident	33 Å²	33	50.5 Å²	50.5	17%	0.173	28%	0.281	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-117.6	123.9	175.9	-179.4	68.5	0	0	0	108.5	I318 Q319 L321 L380 H382	I318-L373 CarbonylContact C-O 3.55Å; I318-L373 WeakPolarHBondContact CA-O 3.44Å; Q319-L373 PolarHBondContact N-O 2.8Å; Q319-L373 PolarHBondContact O-N 3.3Å; L321-L373 HydrophobicContact CD1-CB 4.34Å; L321-L373 HydrophobicContact CD1-CD2 4.23Å; L373-L380 HydrophobicContact CD1-CB 4.28Å; L373-L380 HydrophobicContact CD1-CD2 3.95Å; L373-L380 HydrophobicContact CD2-CD2 4.32Å; L373-L380 HydrophobicContact CG-CD2 4.06Å; L373-H382 HydrophobicContact CD1-CB 3.97Å
374	A	91.8	Very high	89.1	Confident	0 Å²	0	50.9 Å²	50.9	0%	0	28%	0.283	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-124.2	124.3	176.1	0	0	0	0	0	110.3	P286 L288 V310 H317 I318 L380 S381	P286-A374 HydrophobicContact CB-CB 3.79Å; P286-A374 HydrophobicContact CG-CB 4.14Å; L288-A374 HydrophobicContact CD2-CB 3.81Å; V310-A374 HydrophobicContact CG1-CB 3.74Å; V310-A374 HydrophobicContact CG2-CB 4.26Å; H317-A374 WeakPolarHBondContact O-CA 3.23Å; I318-A374 HydrophobicContact CG1-CB 4.3Å; A374-L380 WeakPolarHBondContact O-CA 3.43Å; A374-S381 PolarHBondContact N-O 3.12Å; A374-S381 PolarHBondContact O-N 2.88Å
375	G	86.6	Confident	89.4	Confident	12 Å²	12	46 Å²	46	12%	0.124	26%	0.263	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-120.5	139.3	178.7	0	0	0	0	0	112.6	P316 H317 G379	P316-G375 CarbonylContact C-O 3.48Å; P316-G375 WeakPolarHBondContact CA-O 3.43Å; H317-G375 PolarHBondContact N-O 2.81Å; H317-G375 PolarHBondContact O-N 2.83Å; G375-G379 WeakPolarHBondContact CA-O 3.26Å
376	N	84.4	Confident	89.7	Confident	21 Å²	21	43 Å²	43	11%	0.112	24%	0.244	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-126.7	-176.7	163.2	71.9	12	0	0	0	109	H284 P286 S312 I378 G379	H284-N376 PolarHBondContact O-ND2 3.29Å; P286-N376 HydrophobicContact CG-CB 3.91Å; S312-N376 PolarHBondContact OG-ND2 3.32Å; N376-I378 PolarHBondContact O-N 3.22Å; N376-I378 WeakPolarHBondContact OD1-CA 3.49Å; N376-I378 VanDerWaalsContact OD1-CB 3.24Å; N376-I378 WeakPolarHBondContact OD1-CB 3.43Å; N376-I378 PolarHBondContact OD1-N 3.11Å; N376-G379 PolarHBondContact N-O 2.81Å; N376-G379 PolarHBondContact O-N 3.4Å; N376-G379 PolarHBondContact OD1-N 3.44Å
377	S	72.1	Confident	90	Very high	100 Å²	100	41 Å²	41	70%	0.699	23%	0.233	S	C	*	.	T	Hydrogen-bonded Turn	trans	-65	-3	178.6	57.1	0	0	0	0	115.4	P314	P314-S377 WeakPolarHBondContact CG-OG 3.46Å
378	I	74.5	Confident	90.1	Very high	73 Å²	73	41.5 Å²	41.5	37%	0.374	23%	0.231	S	C	.	.	T	Hydrogen-bonded Turn	trans	-102.3	-14.5	175.3	-44.4	-60.4	0	0	0	111.6	N376	N376-I378 PolarHBondContact O-N 3.22Å; N376-I378 WeakPolarHBondContact OD1-CA 3.49Å; N376-I378 VanDerWaalsContact OD1-CB 3.24Å; N376-I378 WeakPolarHBondContact OD1-CB 3.43Å; N376-I378 PolarHBondContact OD1-N 3.11Å
379	G	77.9	Confident	90.2	Very high	29 Å²	29	41.7 Å²	41.7	30%	0.299	23%	0.23	S	C	.	.	E	Extended strand (participates in β ladder)	trans	140.4	-171.8	173.5	0	0	0	0	0	115	P286 G375 N376	P286-G379 VanDerWaalsContact CD-O 3.24Å; P286-G379 WeakPolarHBondContact CD-O 3.32Å; G375-G379 WeakPolarHBondContact CA-O 3.26Å; N376-G379 PolarHBondContact N-O 2.81Å; N376-G379 PolarHBondContact O-N 3.4Å; N376-G379 PolarHBondContact OD1-N 3.44Å
380	L	87.3	Confident	90	Very high	112 Å²	112	43.3 Å²	43.3	59%	0.586	24%	0.241	S	C	*	.	E	Extended strand (participates in β ladder)	trans	-106.9	138.1	-174.4	-69	159.2	0	0	0	112.4	R285 L373 A374	R285-L380 WeakPolarHBondContact CD-O 3.4Å; L373-L380 HydrophobicContact CD1-CB 4.28Å; L373-L380 HydrophobicContact CD1-CD2 3.95Å; L373-L380 HydrophobicContact CD2-CD2 4.32Å; L373-L380 HydrophobicContact CG-CD2 4.06Å; A374-L380 WeakPolarHBondContact O-CA 3.43Å
381	S	90.7	Very high	89.4	Confident	15 Å²	15	50.4 Å²	50.4	11%	0.105	27%	0.274	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-122.7	148.6	165.7	-74.4	0	0	0	0	110	R285 P286 A374	R285-S381 VanDerWaalsContact CD-OG 3.26Å; R285-S381 WeakPolarHBondContact CD-OG 3.49Å; R285-S381 WeakPolarHBondContact CG-OG 3.45Å; R285-S381 PolarHBondContact NE-OG 3.24Å; P286-S381 WeakPolarHBondContact O-CB 3.14Å; P286-S381 PolarHBondContact O-OG 2.9Å; A374-S381 PolarHBondContact N-O 3.12Å; A374-S381 PolarHBondContact O-N 2.88Å
382	H	93.6	Very high	88.1	Confident	121 Å²	121	53 Å²	53	56%	0.56	30%	0.296	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-141.3	151.4	175.2	62.7	-93.9	0	0	0	112	L288 T371 C372 L373	L288-H382 VanDerWaalsContact CD1-C 3.4Å; T371-H382 HydrophobicContact CG2-CB 3.79Å; C372-H382 WeakPolarHBondContact O-CA 3.44Å; C372-H382 WeakPolarHBondContact O-CB 3.43Å; L373-H382 HydrophobicContact CD1-CB 3.97Å
383	H	95.4	Very high	86.5	Confident	66 Å²	66	60.3 Å²	60.3	31%	0.306	33%	0.334	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-137.8	140.8	167.4	-77.5	169.9	0	0	0	108.6	L288 Q289 L292 T371 C372	L288-H383 WeakPolarHBondContact CB-ND1 3.38Å; L288-H383 HydrophobicContact CD1-CB 3.9Å; Q289-H383 PolarHBondContact O-CE1 3.21Å; Q289-H383 PolarHBondContact O-ND1 3.49Å; L292-H383 WeakPolarHBondContact O-CB 3.32Å; L292-H383 PolarHBondContact O-ND1 3.2Å; T371-H383 WeakPolarHBondContact CA-O 3.36Å; C372-H383 PolarHBondContact N-O 2.89Å; C372-H383 PolarHBondContact O-N 2.77Å; C372-H383 VanDerWaalsContact O-N 3.09Å
384	S	94.8	Very high	84.8	Confident	46 Å²	46	67.6 Å²	67.6	32%	0.322	37%	0.367	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-109	151.8	177.9	-67.4	0	0	0	0	112.5	E369 Y370 T371	E369-S384 WeakPolarHBondContact OE1-CB 3.31Å; E369-S384 PolarHBondContact OE1-OG 3.46Å; Y370-S384 CarbonylContact O-C 3.57Å; Y370-S384 WeakPolarHBondContact O-CA 3.35Å; T371-S384 PolarHBondContact OG1-OG 2.79Å
385	A	95.6	Very high	82.7	Confident	2 Å²	2	76.5 Å²	76.5	2%	0.017	41%	0.409	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-134.9	149.8	166.7	0	0	0	0	0	111	P293 N295 F306 Y370	P293-A385 HydrophobicContact CB-CB 3.67Å; P293-A385 HydrophobicContact CG-CB 3.77Å; N295-A385 WeakPolarHBondContact OD1-CA 3.2Å; F306-A385 HydrophobicContact CD1-CB 4.03Å; F306-A385 HydrophobicContact CE1-CB 3.83Å; Y370-A385 PolarHBondContact N-O 3.18Å; Y370-A385 PolarHBondContact O-N 3.29Å
386	W	95.7	Very high	80.9	Confident	108 Å²	108	86.7 Å²	86.7	41%	0.409	44%	0.444	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-94.7	135.9	175.5	-152.6	-84.6	0	0	0	111.7	N295 K296 G368 E369	N295-W386 WeakPolarHBondContact CA-O 3.48Å; N295-W386 PolarHBondContact OD1-N 3.42Å; K296-W386 PolarHBondContact N-O 2.91Å; G368-W386 WeakPolarHBondContact O-CA 3.28Å; E369-W386 HydrophobicContact CB-CE3 3.83Å; E369-W386 HydrophobicContact CB-CZ3 3.77Å; E369-W386 HydrophobicContact CG-CE3 4.26Å; E369-W386 HydrophobicContact CG-CZ3 4.41Å
387	L	95.7	Very high	79.1	Confident	0 Å²	0	91.6 Å²	91.6	0%	0	48%	0.477	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-100.5	118.2	167.4	-175.1	46	0	0	0	109.7	K296 V298 V304 F306 L359 V362 D366 A367 G368 Y370 V389	K296-L387 HydrophobicContact CB-CD1 4.39Å; V298-L387 HydrophobicContact CG2-CD1 4.13Å; V304-L387 HydrophobicContact CG1-CD1 4.24Å; V304-L387 HydrophobicContact CG1-CD2 4.43Å; V304-L387 HydrophobicContact CG2-CD1 4.07Å; F306-L387 HydrophobicContact CE2-CB 4.28Å; F306-L387 HydrophobicContact CE2-CD2 4.2Å; F306-L387 HydrophobicContact CZ-CB 3.91Å; F306-L387 HydrophobicContact CZ-CD1 4.31Å; F306-L387 HydrophobicContact CZ-CD2 4.49Å; F306-L387 HydrophobicContact CZ-CG 4.46Å; L359-L387 HydrophobicContact CD1-CD2 3.69Å; V362-L387 HydrophobicContact CG1-CD2 4.04Å; D366-L387 HydrophobicContact CB-CD2 4.41Å; D366-L387 WeakPolarHBondContact O-CD2 3.23Å; A367-L387 WeakPolarHBondContact CA-O 3.35Å; G368-L387 PolarHBondContact N-O 2.96Å; G368-L387 VanDerWaalsContact N-O 3.08Å; G368-L387 PolarHBondContact O-N 3Å; Y370-L387 HydrophobicContact CD2-CB 4.01Å; Y370-L387 HydrophobicContact CE2-CB 3.78Å; Y370-L387 HydrophobicContact CE2-CD2 3.98Å; L387-V389 HydrophobicContact CD1-CG2 4.48Å; L387-V389 HydrophobicContact CG-CG2 4.12Å
388	T	93.1	Very high	77.6	Confident	55 Å²	55	91.2 Å²	91.2	34%	0.337	48%	0.48	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-104.9	130.1	170.9	-53.3	0	0	0	0	109.1	K296 T297 V298 L390	K296-T388 PolarHBondContact O-N 3.26Å; T297-T388 VanDerWaalsContact CA-O 3.29Å; T297-T388 WeakPolarHBondContact CA-O 3.49Å; T297-T388 HydrophobicContact CG2-CG2 4.05Å; V298-T388 PolarHBondContact N-O 3.46Å; T388-L390 HydrophobicContact CG2-CD2 4.16Å
389	V	93.2	Very high	76.3	Confident	14 Å²	14	94.3 Å²	94.3	9%	0.085	50%	0.502	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-116.3	126.9	178.7	-173.1	0	0	0	0	108.6	V298 L300 V362 S363 F364 A367 L387	V298-V389 WeakPolarHBondContact O-CA 3.14Å; L300-V389 HydrophobicContact CB-CG1 4.31Å; V362-V389 HydrophobicContact CG1-CG1 4.28Å; V362-V389 HydrophobicContact CG1-CG2 3.47Å; V362-V389 VanDerWaalsContact CG1-CG2 3.47Å; S363-V389 WeakPolarHBondContact O-CG2 3.4Å; F364-V389 HydrophobicContact CD1-CB 4.07Å; F364-V389 HydrophobicContact CD1-CG1 3.93Å; F364-V389 HydrophobicContact CE1-CB 4.43Å; F364-V389 HydrophobicContact CE1-CG1 4.05Å; A367-V389 HydrophobicContact CB-CB 4.46Å; A367-V389 HydrophobicContact CB-CG2 4.13Å; L387-V389 HydrophobicContact CD1-CG2 4.48Å; L387-V389 HydrophobicContact CG-CG2 4.12Å
390	L	90.1	Very high	74.6	Confident	93 Å²	93	101.1 Å²	101.1	49%	0.487	53%	0.528	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-108.8	153.8	-179.6	-58.2	-178.9	0	0	0	110.2	T297 V298 A299 L300 T388 A392	T297-L390 HydrophobicContact CG2-CD1 3.58Å; T297-L390 HydrophobicContact CG2-CD2 4.42Å; T297-L390 HydrophobicContact CG2-CG 3.78Å; V298-L390 PolarHBondContact O-N 3.23Å; A299-L390 CarbonylContact C-O 3.54Å; A299-L390 WeakPolarHBondContact CA-O 3.1Å; L300-L390 PolarHBondContact N-O 3.46Å; T388-L390 HydrophobicContact CG2-CD2 4.16Å; L390-A392 PolarHBondContact O-N 3.14Å
391	E	83	Confident	72.9	Confident	150 Å²	150	102.1 Å²	102.1	70%	0.701	54%	0.539	S	S	*	.			trans	-58.3	135.6	164.1	-70.9	179.4	164.4	0	0	109.8	F364 L393	F364-E391 HydrophobicContact CZ-CG 3.74Å; E391-L393 PolarHBondContact O-N 3.28Å
392	A	67.7	Low	71.5	Confident	62 Å²	62	103.8 Å²	103.8	51%	0.512	55%	0.55	S	S	.	*			trans	-69.8	102.2	170.5	0	0	0	0	0	108.4	A299 L390 E394	A299-A392 HydrophobicContact CB-CB 4.14Å; L390-A392 PolarHBondContact O-N 3.14Å; A392-E394 PolarHBondContact O-N 3.4Å
393	L	60.4	Low	69.9	Low	154 Å²	154	102.9 Å²	102.9	81%	0.806	56%	0.555	S	S	*	*			trans	-61.9	117.3	171.2	-67.4	175.7	0	0	0	108.5	E391 E395	E391-L393 PolarHBondContact O-N 3.28Å; L393-E395 PolarHBondContact O-N 2.82Å
394	E	56.9	Low	68.3	Low	186 Å²	186	105 Å²	105	87%	0.869	57%	0.568	S	S	*	*			trans	-59.4	108.6	169.1	-72.1	-170.9	132.2	0	0	109.2	A392 R396	A392-E394 PolarHBondContact O-N 3.4Å; E394-R396 VanDerWaalsContact C-N 3.29Å; E394-R396 PolarHBondContact O-N 3.4Å
395	E	48.9	Very low	66.8	Low	187 Å²	187	110.6 Å²	110.6	87%	0.874	58%	0.583	S	S	*	*			trans	-66.4	91.9	168.8	-73.3	-159.7	165.7	0	0	109.5	L393	L393-E395 PolarHBondContact O-N 2.82Å
396	R	48.4	Very low	65.6	Low	226 Å²	226	115.9 Å²	115.9	85%	0.853	61%	0.611	S	S	*	*			trans	-52.3	126.2	156.6	-67.9	-176.6	178.5	-176.9	0.7	106.9	E394 A398	E394-R396 VanDerWaalsContact C-N 3.29Å; E394-R396 PolarHBondContact O-N 3.4Å; R396-A398 PolarHBondContact O-N 3.1Å
397	P	46.2	Very low	64.4	Low	124 Å²	124	115.6 Å²	115.6	81%	0.805	61%	0.614	S	S	*	*			trans	-58	115.3	-170.4	21.2	-33.1	0	0	0	110.4	V399	P397-V399 PolarHBondContact O-N 2.96Å
398	A	40.9	Very low	63.3	Low	93 Å²	93	119.8 Å²	119.8	77%	0.769	64%	0.635	S	S	*	*			trans	-60.1	127.7	179.8	0	0	0	0	0	109.5	R396 M400	R396-A398 PolarHBondContact O-N 3.1Å; A398-M400 PolarHBondContact O-N 2.79Å; A398-M400 VanDerWaalsContact O-N 3.12Å
399	V	47.7	Very low	62.5	Low	137 Å²	137	121.8 Å²	121.8	83%	0.83	64%	0.643	S	S	*	*			trans	-60.4	120.3	-179.3	177.5	0	0	0	0	108.8	P397 T401	P397-V399 PolarHBondContact O-N 2.96Å; V399-T401 PolarHBondContact O-N 2.78Å
400	M	41.2	Very low	61.9	Low	173 Å²	173	125.8 Å²	125.8	85%	0.852	66%	0.663	S	S	*	*			trans	-66.6	82.5	-163.9	-174.1	177.1	61.5	0	0	113.6	A398 S402	A398-M400 PolarHBondContact O-N 2.79Å; A398-M400 VanDerWaalsContact O-N 3.12Å; M400-S402 VanDerWaalsContact C-N 3.3Å; M400-S402 PolarHBondContact O-N 3.41Å
401	T	52.3	Low	61.4	Low	133 Å²	133	128.8 Å²	128.8	82%	0.816	67%	0.669	S	S	*	*			trans	-75.7	81.7	169.2	54.9	0	0	0	0	110	V399	V399-T401 PolarHBondContact O-N 2.78Å
402	S	59.9	Low	61.3	Low	50 Å²	50	125.7 Å²	125.7	35%	0.35	66%	0.663	S	S	.	*			trans	-53	136.1	176.9	175.2	0	0	0	0	111.8	M400 L404 Y405	M400-S402 VanDerWaalsContact C-N 3.3Å; M400-S402 PolarHBondContact O-N 3.41Å; S402-L404 PolarHBondContact O-N 3.34Å; S402-Y405 PolarHBondContact O-N 3.48Å; S402-Y405 VanDerWaalsContact O-N 3.07Å
403	P	61.5	Low	62.1	Low	102 Å²	102	126.4 Å²	126.4	66%	0.662	66%	0.661	S	S	*	*	H	α-helix	trans	-58.6	-23.1	-175.4	22.4	-33.9	0	0	0	113.8	Y405 L406 E407	P403-Y405 PolarHBondContact O-N 2.99Å; P403-L406 PolarHBondContact O-N 3.29Å; P403-L406 VanDerWaalsContact O-N 3.09Å; P403-E407 PolarHBondContact O-N 3.25Å
404	L	60.3	Low	63.1	Low	109 Å²	109	120.4 Å²	120.4	57%	0.571	64%	0.637	S	S	*	*	H	α-helix	trans	-50.7	-40.6	173.3	-118.9	79	0	0	0	112.9	S402 E407 I408	S402-L404 PolarHBondContact O-N 3.34Å; L404-E407 PolarHBondContact O-N 2.94Å; L404-I408 WeakPolarHBondContact O-CB 3.48Å; L404-I408 WeakPolarHBondContact O-CD1 3.41Å; L404-I408 WeakPolarHBondContact O-CG1 3.38Å; L404-I408 PolarHBondContact O-N 3.05Å
405	Y	64.5	Low	64.2	Low	165 Å²	165	114.2 Å²	114.2	65%	0.647	62%	0.617	S	S	*	*	H	α-helix	trans	-69.2	-34.2	-178.2	-87.7	-82.6	0	0	0	112.5	S402 P403 I409	S402-Y405 PolarHBondContact O-N 3.48Å; S402-Y405 VanDerWaalsContact O-N 3.07Å; P403-Y405 PolarHBondContact O-N 2.99Å; Y405-I409 WeakPolarHBondContact O-CD1 3.34Å; Y405-I409 VanDerWaalsContact O-CG1 3.24Å; Y405-I409 WeakPolarHBondContact O-CG1 3.43Å; Y405-I409 PolarHBondContact O-N 3.03Å
406	L	70.4	Confident	66	Low	113 Å²	113	112 Å²	112	59%	0.592	61%	0.605	S	S	*	*	H	α-helix	trans	-70	-43.2	177.7	-173.4	62.9	0	0	0	110.8	P403 I409 I410	P403-L406 PolarHBondContact O-N 3.29Å; P403-L406 VanDerWaalsContact O-N 3.09Å; L406-I409 PolarHBondContact O-N 3.49Å; L406-I410 HydrophobicContact CD1-CD1 4.46Å; L406-I410 HydrophobicContact CG-CD1 4.06Å; L406-I410 VanDerWaalsContact O-CG1 3.29Å; L406-I410 WeakPolarHBondContact O-CG1 3.47Å; L406-I410 PolarHBondContact O-N 3.03Å
407	E	69.6	Low	67.8	Low	101 Å²	101	106.7 Å²	106.7	47%	0.472	59%	0.593	S	S	.	*	H	α-helix	trans	-58.5	-49	172.1	-76.9	-160.2	116.9	0	0	112	P403 L404 I409 I410 Y411	P403-E407 PolarHBondContact O-N 3.25Å; L404-E407 PolarHBondContact O-N 2.94Å; E407-I409 VanDerWaalsContact C-N 3.29Å; E407-I409 PolarHBondContact O-N 3.1Å; E407-I410 PolarHBondContact O-N 2.93Å; E407-I410 VanDerWaalsContact O-N 3.08Å; E407-Y411 HydrophobicContact CB-CD2 4.2Å; E407-Y411 HydrophobicContact CB-CE2 4.01Å; E407-Y411 HydrophobicContact CG-CE2 4.48Å; E407-Y411 WeakPolarHBondContact O-CD2 3.07Å; E407-Y411 PolarHBondContact O-N 2.64Å
408	I	73.1	Confident	69.5	Low	88 Å²	88	106.1 Å²	106.1	45%	0.451	58%	0.582	S	S	.	*	H	α-helix	trans	-56.7	-43.7	178.8	-70.5	163.5	0	0	0	111	L404 Y411 C412	L404-I408 WeakPolarHBondContact O-CB 3.48Å; L404-I408 WeakPolarHBondContact O-CD1 3.41Å; L404-I408 WeakPolarHBondContact O-CG1 3.38Å; L404-I408 PolarHBondContact O-N 3.05Å; I408-Y411 PolarHBondContact O-N 3.41Å; I408-C412 WeakPolarHBondContact O-CB 3.37Å; I408-C412 PolarHBondContact O-N 3.31Å; I408-C412 PolarHBondContact O-SG 2.98Å
409	I	76.8	Confident	71.3	Confident	98 Å²	98	105.5 Å²	105.5	50%	0.503	57%	0.572	S	S	.	*	H	α-helix	trans	-64	-41	177	-69.9	165	0	0	0	111.4	Y405 L406 E407 T413	Y405-I409 WeakPolarHBondContact O-CD1 3.34Å; Y405-I409 VanDerWaalsContact O-CG1 3.24Å; Y405-I409 WeakPolarHBondContact O-CG1 3.43Å; Y405-I409 PolarHBondContact O-N 3.03Å; L406-I409 PolarHBondContact O-N 3.49Å; E407-I409 VanDerWaalsContact C-N 3.29Å; E407-I409 PolarHBondContact O-N 3.1Å; I409-T413 HydrophobicContact CG2-CG2 4.49Å; I409-T413 WeakPolarHBondContact O-CB 3.34Å; I409-T413 WeakPolarHBondContact O-CG2 3.41Å; I409-T413 PolarHBondContact O-N 2.87Å; I409-T413 PolarHBondContact O-OG1 3.29Å
410	I	79.9	Confident	72.9	Confident	98 Å²	98	101.7 Å²	101.7	50%	0.503	55%	0.551	S	S	.	*	H	α-helix	trans	-65	-46	177.2	-69.6	165	0	0	0	110.9	L406 E407 T413 G414	L406-I410 HydrophobicContact CD1-CD1 4.46Å; L406-I410 HydrophobicContact CG-CD1 4.06Å; L406-I410 VanDerWaalsContact O-CG1 3.29Å; L406-I410 WeakPolarHBondContact O-CG1 3.47Å; L406-I410 PolarHBondContact O-N 3.03Å; E407-I410 PolarHBondContact O-N 2.93Å; E407-I410 VanDerWaalsContact O-N 3.08Å; I410-T413 PolarHBondContact O-OG1 3.06Å; I410-T413 VanDerWaalsContact O-OG1 3.12Å; I410-G414 PolarHBondContact O-N 2.85Å
411	Y	80.1	Confident	74.9	Confident	156 Å²	156	99.8 Å²	99.8	61%	0.612	54%	0.541	S	S	*	.	H	α-helix	trans	-65.6	-42.6	177.9	-71.1	-59.5	0	0	0	112.4	E407 I408 A415	E407-Y411 HydrophobicContact CB-CD2 4.2Å; E407-Y411 HydrophobicContact CB-CE2 4.01Å; E407-Y411 HydrophobicContact CG-CE2 4.48Å; E407-Y411 WeakPolarHBondContact O-CD2 3.07Å; E407-Y411 PolarHBondContact O-N 2.64Å; I408-Y411 PolarHBondContact O-N 3.41Å; Y411-A415 WeakPolarHBondContact O-CB 3.32Å; Y411-A415 PolarHBondContact O-N 2.82Å
412	C	80.1	Confident	76.2	Confident	84 Å²	84	97.2 Å²	97.2	57%	0.568	53%	0.525	S	S	*	.	H	α-helix	trans	-65.3	-42.5	177.2	-73.4	0	0	0	0	112.7	I408 F416	I408-C412 WeakPolarHBondContact O-CB 3.37Å; I408-C412 PolarHBondContact O-N 3.31Å; I408-C412 PolarHBondContact O-SG 2.98Å; C412-F416 WeakPolarHBondContact O-CB 3.47Å; C412-F416 PolarHBondContact O-N 3.07Å; C412-F416 VanDerWaalsContact O-N 3.08Å
413	T	83.9	Confident	77.1	Confident	77 Å²	77	96.3 Å²	96.3	47%	0.472	52%	0.524	S	S	.	.	H	α-helix	trans	-69.2	-39.8	177.6	51.4	0	0	0	0	112.1	I409 I410 F416 L417	I409-T413 HydrophobicContact CG2-CG2 4.49Å; I409-T413 WeakPolarHBondContact O-CB 3.34Å; I409-T413 WeakPolarHBondContact O-CG2 3.41Å; I409-T413 PolarHBondContact O-N 2.87Å; I409-T413 PolarHBondContact O-OG1 3.29Å; I410-T413 PolarHBondContact O-OG1 3.06Å; I410-T413 VanDerWaalsContact O-OG1 3.12Å; T413-F416 PolarHBondContact O-N 3.42Å; T413-L417 WeakPolarHBondContact O-CG 3.32Å; T413-L417 PolarHBondContact O-N 3.09Å
414	G	81.6	Confident	77.7	Confident	29 Å²	29	95 Å²	95	30%	0.299	52%	0.517	S	S	.	.	H	α-helix	trans	-60.1	-47.7	172.8	0	0	0	0	0	112.9	I410 F416 L417 I418	I410-G414 PolarHBondContact O-N 2.85Å; G414-F416 VanDerWaalsContact C-N 3.32Å; G414-F416 PolarHBondContact O-N 3.21Å; G414-L417 PolarHBondContact O-N 2.87Å; G414-I418 WeakPolarHBondContact O-CG1 3.09Å; G414-I418 PolarHBondContact O-N 3.45Å
415	A	80.8	Confident	78.4	Confident	56 Å²	56	93.5 Å²	93.5	46%	0.463	51%	0.513	S	S	.	.	H	α-helix	trans	-62.1	-37.8	178	0	0	0	0	0	112.7	Y411 S419	Y411-A415 WeakPolarHBondContact O-CB 3.32Å; Y411-A415 PolarHBondContact O-N 2.82Å; A415-S419 WeakPolarHBondContact O-CB 2.98Å; A415-S419 PolarHBondContact O-N 2.8Å; A415-S419 PolarHBondContact O-OG 2.73Å
416	F	86.3	Confident	78.7	Confident	139 Å²	139	90.1 Å²	90.1	61%	0.61	50%	0.504	S	S	*	.	H	α-helix	trans	-63.3	-49.9	174.6	-178.3	-100.8	0	0	0	111.9	C412 T413 G414 I418 S419 C420	C412-F416 WeakPolarHBondContact O-CB 3.47Å; C412-F416 PolarHBondContact O-N 3.07Å; C412-F416 VanDerWaalsContact O-N 3.08Å; T413-F416 PolarHBondContact O-N 3.42Å; G414-F416 VanDerWaalsContact C-N 3.32Å; G414-F416 PolarHBondContact O-N 3.21Å; F416-I418 PolarHBondContact O-N 2.85Å; F416-S419 WeakPolarHBondContact O-CB 3.43Å; F416-S419 PolarHBondContact O-N 2.78Å; F416-S419 VanDerWaalsContact O-N 3.1Å; F416-C420 PolarHBondContact O-N 3.4Å; F416-C420 PolarHBondContact O-SG 3.22Å; F416-C420 VanDerWaalsContact O-SG 3.41Å
417	L	85.8	Confident	78.7	Confident	115 Å²	115	89.1 Å²	89.1	60%	0.602	50%	0.503	S	S	*	.	H	α-helix	trans	-61.5	-41.2	179.6	-69.2	172.6	0	0	0	112.6	T413 G414 S419 C420 M421	T413-L417 WeakPolarHBondContact O-CG 3.32Å; T413-L417 PolarHBondContact O-N 3.09Å; G414-L417 PolarHBondContact O-N 2.87Å; L417-S419 VanDerWaalsContact C-N 3.32Å; L417-S419 PolarHBondContact O-N 2.75Å; L417-C420 PolarHBondContact O-N 2.76Å; L417-M421 WeakPolarHBondContact O-CG 3.41Å; L417-M421 PolarHBondContact O-N 2.88Å
418	I	83.4	Confident	78.6	Confident	113 Å²	113	92.5 Å²	92.5	58%	0.579	51%	0.513	S	S	*	.	H	α-helix	trans	-62	-41.9	174.4	-67.7	166.7	0	0	0	110.6	G414 F416 M421 V422	G414-I418 WeakPolarHBondContact O-CG1 3.09Å; G414-I418 PolarHBondContact O-N 3.45Å; F416-I418 PolarHBondContact O-N 2.85Å; I418-M421 PolarHBondContact O-N 2.84Å; I418-V422 HydrophobicContact CG2-CG2 4.46Å; I418-V422 WeakPolarHBondContact O-CG2 3.43Å; I418-V422 PolarHBondContact O-N 3.33Å
419	S	78.1	Confident	77.9	Confident	79 Å²	79	94.3 Å²	94.3	55%	0.552	52%	0.517	S	S	*	.	H	α-helix	trans	-63.2	-42.1	177.4	-58.6	0	0	0	0	112.1	A415 F416 L417 V422 G423	A415-S419 WeakPolarHBondContact O-CB 2.98Å; A415-S419 PolarHBondContact O-N 2.8Å; A415-S419 PolarHBondContact O-OG 2.73Å; F416-S419 WeakPolarHBondContact O-CB 3.43Å; F416-S419 PolarHBondContact O-N 2.78Å; F416-S419 VanDerWaalsContact O-N 3.1Å; L417-S419 VanDerWaalsContact C-N 3.32Å; L417-S419 PolarHBondContact O-N 2.75Å; S419-V422 PolarHBondContact O-N 3.05Å; S419-G423 PolarHBondContact O-N 3.34Å
420	C	82.3	Confident	77.2	Confident	58 Å²	58	96.9 Å²	96.9	39%	0.392	53%	0.529	S	S	.	.	H	α-helix	trans	-62.7	-40	173.7	-67.4	0	0	0	0	112.6	F416 L417 S424	F416-C420 PolarHBondContact O-N 3.4Å; F416-C420 PolarHBondContact O-SG 3.22Å; F416-C420 VanDerWaalsContact O-SG 3.41Å; L417-C420 PolarHBondContact O-N 2.76Å; C420-S424 WeakPolarHBondContact O-CB 3.01Å; C420-S424 PolarHBondContact O-N 2.82Å; C420-S424 PolarHBondContact O-OG 2.95Å
421	M	81.8	Confident	76.2	Confident	132 Å²	132	101 Å²	101	65%	0.65	54%	0.543	S	S	*	.	H	α-helix	trans	-66.9	-44.1	176.5	-72.7	-69.5	-79.2	0	0	111.9	L417 I418 S424 V425	L417-M421 WeakPolarHBondContact O-CG 3.41Å; L417-M421 PolarHBondContact O-N 2.88Å; I418-M421 PolarHBondContact O-N 2.84Å; M421-S424 PolarHBondContact O-N 3.08Å; M421-V425 WeakPolarHBondContact O-CG2 3.31Å; M421-V425 PolarHBondContact O-N 3.17Å
422	V	79.7	Confident	74.8	Confident	79 Å²	79	97.2 Å²	97.2	48%	0.479	54%	0.539	S	S	.	.	H	α-helix	trans	-62.8	-45.5	175.6	171.3	0	0	0	0	111.1	I418 S419 S424 V425 I426	I418-V422 HydrophobicContact CG2-CG2 4.46Å; I418-V422 WeakPolarHBondContact O-CG2 3.43Å; I418-V422 PolarHBondContact O-N 3.33Å; S419-V422 PolarHBondContact O-N 3.05Å; V422-S424 VanDerWaalsContact C-N 3.33Å; V422-S424 PolarHBondContact O-N 3.14Å; V422-V425 PolarHBondContact O-N 2.79Å; V422-I426 HydrophobicContact CG1-CD1 3.86Å; V422-I426 WeakPolarHBondContact O-CG1 3.49Å; V422-I426 PolarHBondContact O-N 3.08Å
423	G	78.6	Confident	73.3	Confident	32 Å²	32	96 Å²	96	33%	0.33	54%	0.541	S	S	.	.	H	α-helix	trans	-58.3	-43.8	174.3	0	0	0	0	0	112.5	S419 V425 I426 V427	S419-G423 PolarHBondContact O-N 3.34Å; G423-V425 PolarHBondContact O-N 2.7Å; G423-I426 PolarHBondContact O-N 2.75Å; G423-V427 WeakPolarHBondContact O-CG2 3.19Å; G423-V427 PolarHBondContact O-N 3.01Å
424	S	75.3	Confident	71.2	Confident	73 Å²	73	98.7 Å²	98.7	51%	0.51	56%	0.558	S	S	.	*	H	α-helix	trans	-62.3	-42.3	176.7	-60.2	0	0	0	0	112.3	C420 M421 V422 V427 Y428	C420-S424 WeakPolarHBondContact O-CB 3.01Å; C420-S424 PolarHBondContact O-N 2.82Å; C420-S424 PolarHBondContact O-OG 2.95Å; M421-S424 PolarHBondContact O-N 3.08Å; V422-S424 VanDerWaalsContact C-N 3.33Å; V422-S424 PolarHBondContact O-N 3.14Å; S424-V427 PolarHBondContact O-N 3.44Å; S424-Y428 WeakPolarHBondContact O-CB 3Å; S424-Y428 PolarHBondContact O-N 3.31Å
425	V	74.8	Confident	68.9	Low	79 Å²	79	107 Å²	107	48%	0.479	59%	0.586	S	S	.	*	H	α-helix	trans	-66.9	-37.6	176	170.2	0	0	0	0	111.9	M421 V422 G423 Y428 K429	M421-V425 WeakPolarHBondContact O-CG2 3.31Å; M421-V425 PolarHBondContact O-N 3.17Å; V422-V425 PolarHBondContact O-N 2.79Å; G423-V425 PolarHBondContact O-N 2.7Å; V425-Y428 PolarHBondContact O-N 3.14Å; V425-K429 WeakPolarHBondContact O-CG 3.4Å; V425-K429 PolarHBondContact O-N 2.7Å
426	I	69.4	Low	66.8	Low	93 Å²	93	113 Å²	113	48%	0.477	60%	0.601	S	S	.	*	H	α-helix	trans	-63.1	-49.9	174.2	-69.9	166.4	0	0	0	110	V422 G423 Y428 K429 M430	V422-I426 HydrophobicContact CG1-CD1 3.86Å; V422-I426 WeakPolarHBondContact O-CG1 3.49Å; V422-I426 PolarHBondContact O-N 3.08Å; G423-I426 PolarHBondContact O-N 2.75Å; I426-Y428 VanDerWaalsContact C-N 3.31Å; I426-Y428 PolarHBondContact O-N 2.73Å; I426-K429 PolarHBondContact O-N 2.74Å; I426-M430 HydrophobicContact CG2-CG 4.46Å; I426-M430 HydrophobicContact CG2-SD 3.9Å; I426-M430 WeakPolarHBondContact O-CG 3.16Å; I426-M430 PolarHBondContact O-N 3.46Å
427	V	71.8	Confident	64.5	Low	92 Å²	92	112 Å²	112	56%	0.558	61%	0.612	S	S	*	*	H	α-helix	trans	-57.8	-43.5	175.7	170.3	0	0	0	0	111.2	G423 S424 M430 K431	G423-V427 WeakPolarHBondContact O-CG2 3.19Å; G423-V427 PolarHBondContact O-N 3.01Å; S424-V427 PolarHBondContact O-N 3.44Å; V427-M430 PolarHBondContact O-N 3.04Å; V427-K431 WeakPolarHBondContact O-CB 3.31Å; V427-K431 PolarHBondContact O-N 2.99Å
428	Y	67.1	Low	61.9	Low	173 Å²	173	112.7 Å²	112.7	68%	0.678	62%	0.616	S	S	*	*	H	α-helix	trans	-63.4	-43.1	178.3	-154	-87.4	0	0	0	111.9	S424 V425 I426 K431 S432	S424-Y428 WeakPolarHBondContact O-CB 3Å; S424-Y428 PolarHBondContact O-N 3.31Å; V425-Y428 PolarHBondContact O-N 3.14Å; I426-Y428 VanDerWaalsContact C-N 3.31Å; I426-Y428 PolarHBondContact O-N 2.73Å; Y428-K431 PolarHBondContact O-N 2.86Å; Y428-S432 PolarHBondContact O-N 3.03Å; Y428-S432 PolarHBondContact O-OG 3.32Å; Y428-S432 VanDerWaalsContact O-OG 3.05Å
429	K	59.3	Low	59.2	Low	125 Å²	125	117.5 Å²	117.5	54%	0.543	63%	0.633	S	S	.	*	H	α-helix	trans	-68.6	-32.3	175.3	-71.9	-139.9	-174.2	176.9	0	113.6	W37 V425 I426 K431	W37-K429 HydrophobicContact CH2-CD 3.88Å; W37-K429 VanDerWaalsContact CH2-NZ 3.27Å; W37-K429 HydrophobicContact CZ3-CD 4.33Å; V425-K429 WeakPolarHBondContact O-CG 3.4Å; V425-K429 PolarHBondContact O-N 2.7Å; I426-K429 PolarHBondContact O-N 2.74Å; K429-K431 VanDerWaalsContact C-N 3.3Å
430	M	61	Low	56.8	Low	153 Å²	153	120.7 Å²	120.7	75%	0.754	64%	0.639	S	S	*	*	H	α-helix	trans	-68	-30.4	171.6	-69.8	175.9	75.1	0	0	112	I426 V427	I426-M430 HydrophobicContact CG2-CG 4.46Å; I426-M430 HydrophobicContact CG2-SD 3.9Å; I426-M430 WeakPolarHBondContact O-CG 3.16Å; I426-M430 PolarHBondContact O-N 3.46Å; V427-M430 PolarHBondContact O-N 3.04Å
431	K	60	Low	54.3	Low	185 Å²	185	123.6 Å²	123.6	80%	0.804	66%	0.659	S	S	*	*	H	α-helix	trans	-87.5	-20.8	-180	-129.8	176.1	-174.9	179.3	0	114.9	V427 Y428 K429	V427-K431 WeakPolarHBondContact O-CB 3.31Å; V427-K431 PolarHBondContact O-N 2.99Å; Y428-K431 PolarHBondContact O-N 2.86Å; K429-K431 VanDerWaalsContact C-N 3.3Å
432	S	50.1	Low	51.7	Low	75 Å²	75	124.8 Å²	124.8	52%	0.524	66%	0.664	S	S	.	*			trans	-91.5	16.7	-179.2	-57.9	0	0	0	0	114.9	Y428 T434	Y428-S432 PolarHBondContact O-N 3.03Å; Y428-S432 PolarHBondContact O-OG 3.32Å; Y428-S432 VanDerWaalsContact O-OG 3.05Å; S432-T434 PolarHBondContact O-N 2.81Å
433	G	47.3	Very low	49.2	Very low	58 Å²	58	129.5 Å²	129.5	60%	0.598	68%	0.682	S	S	*	*			trans	-86.7	52.5	-174.8	0	0	0	0	0	116.2
434	T	40.6	Very low	46.9	Very low	135 Å²	135	132.2 Å²	132.2	83%	0.828	70%	0.702	S	S	*	*			trans	-171.7	153.2	157.2	10.1	0	0	0	0	114.5	S432	S432-T434 PolarHBondContact O-N 2.81Å
435	K	34.3	Very low	44.9	Very low	204 Å²	204	135 Å²	135	89%	0.887	72%	0.716	S	S	*	*			trans	80.9	100.3	171.3	-62	-177	178.8	-179	0	118
436	K	36	Very low	42.9	Very low	182 Å²	182	140.3 Å²	140.3	79%	0.791	74%	0.735	S	S	*	*			trans	-84.4	154	140.1	-78.3	-172.8	167.1	-160.1	0	109.7
437	S	37.1	Very low	41	Very low	118 Å²	118	144.4 Å²	144.4	83%	0.825	75%	0.749	S	S	*	*			trans	-156.4	114.6	147	54.5	0	0	0	0	108.7
438	D	31.1	Very low	39.2	Very low	129 Å²	129	147.8 Å²	147.8	69%	0.69	76%	0.763	S	S	*	*			trans	-77.5	146.5	-180	-44.9	-96.5	0	0	0	111
439	F	26.7	Very low	37.3	Very low	214 Å²	214	143.3 Å²	143.3	94%	0.939	76%	0.762	S	S	*	*			trans	-156.3	169.3	140.6	-135.4	-100.5	0	0	0	112.5
440	H	29.3	Very low	36.1	Very low	146 Å²	146	146.9 Å²	146.9	68%	0.676	78%	0.778	S	S	*	*			trans	-135.2	134.5	-154.2	154.6	-64.6	0	0	0	112.8
441	S	29.6	Very low	34.6	Very low	118 Å²	118	144.1 Å²	144.1	83%	0.825	77%	0.774	S	S	*	*			trans	-162.1	160	157.6	52.6	0	0	0	0	112.8
442	Q	27	Very low	33.3	Very low	158 Å²	158	143 Å²	143	74%	0.738	78%	0.775	S	S	*	*			trans	-103	178.4	-172.7	-56.8	166.1	-86.4	0	0	113
443	M	27.9	Very low	32.7	Very low	177 Å²	177	145 Å²	145	87%	0.872	79%	0.785	S	S	*	*			trans	72.1	154.2	161.9	-64.1	168.9	57.4	0	0	115.5
444	A	28.8	Very low	31.7	Very low	90 Å²	90	150.7 Å²	150.7	74%	0.744	80%	0.802	S	S	*	*			cis	-144.1	175.7	13.8	0	0	0	0	0	113.4
445	V	34.5	Very low	31.1	Very low	132 Å²	132	154 Å²	154	80%	0.8	80%	0.799	S	S	*	*			trans	-77.1	140.5	168.9	175	0	0	0	0	110.5
446	H	31.1	Very low	31	Very low	189 Å²	189	153.2 Å²	153.2	88%	0.875	79%	0.79	S	S	*	*			trans	-148.4	146.1	152	-130	-91	0	0	0	113.8
447	K	30.7	Very low	30.5	Very low	179 Å²	179	150.9 Å²	150.9	78%	0.778	78%	0.782	S	S	*	*			trans	-91.6	142.4	176.4	-64.8	176.3	178.6	176.1	0	111.1
448	L	33.7	Very low	30	Very low	163 Å²	163	150.9 Å²	150.9	85%	0.853	78%	0.777	S	S	*	*			trans	-160.4	119.6	142	-132.4	68.3	0	0	0	106.8
449	A	28.1	Very low	29.7	Very low	80 Å²	80	151.5 Å²	151.5	66%	0.661	79%	0.786	S	S	*	*			cis	79.8	76.1	38.2	0	0	0	0	0	114.1
450	K	33.9	Very low	29.8	Very low	199 Å²	199	147.2 Å²	147.2	87%	0.865	78%	0.777	S	S	*	*			trans	-171.3	108.5	157.9	-102.4	166.9	-176.3	-179.7	0	106.8
451	S	29.6	Very low	29.7	Very low	96 Å²	96	146.3 Å²	146.3	67%	0.671	79%	0.787	S	S	*	*			cis	89.6	125	17.6	93.1	0	0	0	0	116.8
452	I	32.2	Very low	29.7	Very low	162 Å²	162	144.6 Å²	144.6	83%	0.831	78%	0.78	S	S	*	*			trans	88.6	132.9	159.4	-60.6	172.4	0	0	0	116.2
453	P	36.5	Very low	29.7	Very low	115 Å²	115	145.1 Å²	145.1	75%	0.747	79%	0.788	S	S	*	*			trans	-102.6	-179.8	-172.9	41.9	-37.2	0	0	0	113.5
454	L	27.5	Very low	29.6	Very low	179 Å²	179	142.2 Å²	142.2	94%	0.937	79%	0.785	S	S	*	*			trans	-104.2	141.2	168.5	-79.6	166.1	0	0	0	112.3
455	R	27.9	Very low	29.5	Very low	205 Å²	205	143.9 Å²	143.9	77%	0.774	79%	0.791	S	S	*	*			trans	-156.5	143.5	-178.6	-168	-158.1	-176.7	-171	4.7	108.1
456	R	30.9	Very low	29.2	Very low	187 Å²	187	142.3 Å²	142.3	71%	0.706	79%	0.792	S	S	*	*			trans	66.5	163.9	170.8	-75.7	167.6	149.9	-149.6	3.8	114.8
457	Q	26.3	Very low	28.8	Very low	133 Å²	133	138.8 Å²	138.8	62%	0.621	79%	0.788	S	S	*	*			cis	-143.7	140.5	-5.4	-123.4	153.2	-65.1	0	0	107.9
458	V	27.4	Very low	29	Very low	118 Å²	118	138.1 Å²	138.1	72%	0.715	79%	0.79	S	S	*	*				37.6	119.7	101.1	-167.3	0	0	0	0	115.3	V460	V458-V460 HydrophobicContact CG1-CG2 4.12Å
459	T	25.2	Very low	28.8	Very low	142 Å²	142	138.3 Å²	138.3	87%	0.871	79%	0.792	S	S	*	*			trans	-114	152.5	149.2	38.9	0	0	0	0	109.3
460	V	28.4	Very low	28.9	Very low	124 Å²	124	139.7 Å²	139.7	75%	0.752	80%	0.797	S	S	*	*			trans	-115.8	138.4	-178.1	176.1	0	0	0	0	108.7	V458	V458-V460 HydrophobicContact CG1-CG2 4.12Å
461	S	26.6	Very low	28.8	Very low	127 Å²	127	134.4 Å²	134.4	89%	0.888	80%	0.799	S	S	*	*			trans	-131.1	129.8	160.4	-59.5	0	0	0	0	107.6
462	A	29.9	Very low	28.9	Very low	82 Å²	82	135.5 Å²	135.5	68%	0.678	80%	0.801	S	S	*	*			trans	-118.1	137.5	170.3	0	0	0	0	0	108.2
463	D	26.5	Very low	28.9	Very low	169 Å²	169	135.1 Å²	135.1	90%	0.904	80%	0.8	S	S	*	*			trans	-168	170.9	132	-98.8	-29	0	0	0	110.4
464	S	25.2	Very low	28.6	Very low	115 Å²	115	136.9 Å²	136.9	80%	0.804	80%	0.802	S	S	*	*			trans	-100.1	141.2	-153.9	-56.4	0	0	0	0	115.4
465	S	26.6	Very low	28.7	Very low	125 Å²	125	134.7 Å²	134.7	87%	0.874	80%	0.796	S	S	*	*				-173.2	135.8	122.9	59.8	0	0	0	0	113.4
466	A	28.5	Very low	28.7	Very low	100 Å²	100	135 Å²	135	83%	0.826	80%	0.797	S	S	*	*			trans	-58.4	147.4	-170.1	0	0	0	0	0	118.8
467	S	24.2	Very low	28.5	Very low	114 Å²	114	132.3 Å²	132.3	80%	0.797	80%	0.804	S	S	*	*				-145.8	144.8	119.7	69.5	0	0	0	0	110.1
468	M	33.7	Very low	28.6	Very low	166 Å²	166	130.8 Å²	130.8	82%	0.818	81%	0.808	S	S	*	*			trans	-122.3	125	179.2	-73.8	-87.8	95.1	0	0	109
469	N	29.6	Very low	28.7	Very low	166 Å²	166	136.6 Å²	136.6	89%	0.888	82%	0.817	S	S	*	*			trans	168.3	100	136	-89	-6	0	0	0	111.6
470	S	30.6	Very low	29.1	Very low	110 Å²	110	138.3 Å²	138.3	77%	0.769	82%	0.82	S	S	*	*			trans	-154.7	106.7	152.9	51	0	0	0	0	109.8	V472	S470-V472 VanDerWaalsContact C-N 3.31Å; S470-V472 PolarHBondContact O-N 2.61Å
471	G	31.5	Very low	28.9	Very low	88 Å²	88	138.6 Å²	138.6	91%	0.907	83%	0.827	S	S	*	*			trans	-79.4	67.2	-175.7	0	0	0	0	0	113.5
472	V	31.5	Very low	29.3	Very low	118 Å²	118	137.8 Å²	137.8	72%	0.715	82%	0.822	S	S	*	*			trans	-103.8	92.6	172.2	-176.5	0	0	0	0	109.2	S470 L474	S470-V472 VanDerWaalsContact C-N 3.31Å; S470-V472 PolarHBondContact O-N 2.61Å; V472-L474 PolarHBondContact O-N 3.05Å
473	L	31.6	Very low	29.4	Very low	154 Å²	154	140 Å²	140	81%	0.806	83%	0.832	S	S	*	*			trans	-82.3	107.5	-174.5	-142.7	154.4	0	0	0	110.3	V475	L473-V475 PolarHBondContact O-N 3.24Å
474	L	30.3	Very low	29.5	Very low	153 Å²	153	135.5 Å²	135.5	80%	0.801	83%	0.826	S	S	*	*			trans	-75.5	92	-174.6	-72.9	168.9	0	0	0	112.2	V472	V472-L474 PolarHBondContact O-N 3.05Å
475	V	30.6	Very low	29.9	Very low	133 Å²	133	136 Å²	136	81%	0.806	82%	0.824	S	S	*	*			trans	-62.6	137.3	175.2	-178.3	0	0	0	0	111.6	L473	L473-V475 PolarHBondContact O-N 3.24Å
476	R	28	Very low	30.3	Very low	212 Å²	212	136.3 Å²	136.3	80%	0.8	82%	0.823	S	S	*	*			trans	-119.8	118.9	175.8	-96.6	-167.8	171.2	93.2	-1.7	111.5	S478	R476-S478 PolarHBondContact O-N 3.19Å
477	P	26.4	Very low	30.8	Very low	130 Å²	130	137.3 Å²	137.3	84%	0.844	81%	0.812	S	S	*	*			trans	-74.6	120.4	172.4	29.7	-32.8	0	0	0	111.3
478	S	28	Very low	31.8	Very low	100 Å²	100	136.7 Å²	136.7	70%	0.699	80%	0.8	S	S	*	*			trans	-136.5	77.4	-173.1	-60.5	0	0	0	0	114.8	R476	R476-S478 PolarHBondContact O-N 3.19Å
479	R	29	Very low	31.8	Very low	240 Å²	240	134.2 Å²	134.2	91%	0.906	81%	0.805	S	S	*	*			trans	33	102.1	151.4	-61.8	-176.6	178.5	-163.7	-2	119.3
480	L	33.9	Very low	32.1	Very low	179 Å²	179	130 Å²	130	94%	0.937	80%	0.801	S	S	*	*			trans	24.7	110.9	134.8	-73.8	166.4	0	0	0	118.3
481	S	25.1	Very low	32.7	Very low	129 Å²	129	127.1 Å²	127.1	90%	0.902	78%	0.779	S	S	*	*			trans	-133	153.7	146.5	-170	0	0	0	0	108.8
482	S	35	Very low	33.4	Very low	111 Å²	111	125.8 Å²	125.8	78%	0.776	76%	0.756	S	S	*	*			trans	-117.4	116.7	-163	60.7	0	0	0	0	114.7
483	S	32.3	Very low	34.3	Very low	128 Å²	128	129.5 Å²	129.5	90%	0.895	77%	0.765	S	S	*	*			trans	-179.1	109.9	136.4	54.3	0	0	0	0	111.5
484	G	27.7	Very low	35.4	Very low	75 Å²	75	129 Å²	129	77%	0.773	75%	0.753	S	S	*	*			trans	-168.7	153.4	176	0	0	0	0	0	111.9
485	T	34.2	Very low	37.1	Very low	124 Å²	124	130.7 Å²	130.7	76%	0.761	76%	0.757	S	S	*	*			trans	-67.7	152.5	176.5	35.3	0	0	0	0	112.2	M487	T485-M487 PolarHBondContact O-N 2.92Å
486	P	35.4	Very low	39.3	Very low	133 Å²	133	125.8 Å²	125.8	86%	0.864	73%	0.726	S	S	*	*			trans	-66.6	107.3	-174.9	27.4	-35.1	0	0	0	111.8
487	M	37.6	Very low	42	Very low	120 Å²	120	120.8 Å²	120.8	59%	0.591	72%	0.721	S	S	*	*			trans	-79.6	173.4	165.5	-67.5	-153.8	72.1	0	0	111.4	T485 A489 P587	T485-M487 PolarHBondContact O-N 2.92Å; M487-A489 PolarHBondContact O-N 3.24Å; M487-P587 HydrophobicContact CE-CB 4.13Å; M487-P587 HydrophobicContact CE-CG 4.45Å
488	L	46.6	Very low	44.8	Very low	102 Å²	102	120.4 Å²	120.4	53%	0.534	71%	0.708	S	S	.	*			trans	-56.2	119.4	-171.4	-75.9	160.9	0	0	0	112.8	G490 S549	L488-G490 PolarHBondContact O-N 3.2Å; L488-G490 VanDerWaalsContact O-N 3.12Å; L488-S549 WeakPolarHBondContact CD2-O 3.44Å
489	A	32.1	Very low	47.8	Very low	113 Å²	113	117.7 Å²	117.7	93%	0.934	69%	0.686	S	S	*	*	T	Hydrogen-bonded Turn	trans	-77.4	98.2	-175.4	0	0	0	0	0	111.7	M487	M487-A489 PolarHBondContact O-N 3.24Å
490	G	37.4	Very low	50.7	Low	78 Å²	78	110.8 Å²	110.8	80%	0.804	67%	0.673	S	S	*	*	T	Hydrogen-bonded Turn	trans	157.9	-18.4	169.3	0	0	0	0	0	116.7	L488	L488-G490 PolarHBondContact O-N 3.2Å; L488-G490 VanDerWaalsContact O-N 3.12Å
491	V	43.1	Very low	53.4	Low	50 Å²	50	112 Å²	112	30%	0.303	66%	0.664	S	S	.	*	S	Bend	trans	-97.1	143	180	-171.2	0	0	0	0	110.1	E553 L556	V491-E553 HydrophobicContact CG1-CB 4.22Å; V491-E553 HydrophobicContact CG1-CG 4.35Å; V491-L556 HydrophobicContact CG1-CD2 3.66Å
492	S	46.7	Very low	56.7	Low	60 Å²	60	108 Å²	108	42%	0.42	63%	0.63	S	S	.	*			trans	-73.5	152.7	175.4	68.9	0	0	0	0	111.9	Y494 E553	S492-Y494 VanDerWaalsContact C-N 3.34Å; S492-Y494 PolarHBondContact O-N 3.12Å; S492-Y494 WeakPolarHBondContact OG-CD2 3.5Å; S492-Y494 WeakPolarHBondContact OG-CE2 3.25Å; S492-E553 WeakPolarHBondContact CB-OE1 3.42Å; S492-E553 PolarHBondContact OG-OE1 3.37Å
493	E	48.7	Very low	59.5	Low	195 Å²	195	104.6 Å²	104.6	91%	0.911	60%	0.602	S	S	*	*			trans	-71.3	85.6	179	-71	175.5	141	0	0	110.9	E495	E493-E495 PolarHBondContact O-N 2.98Å
494	Y	55.9	Low	62.4	Low	143 Å²	143	99.2 Å²	99.2	56%	0.561	56%	0.563	S	S	*	*			trans	-76.6	93.8	164	-87.3	-96.5	0	0	0	109.7	S492 L496 E553 L556	S492-Y494 VanDerWaalsContact C-N 3.34Å; S492-Y494 PolarHBondContact O-N 3.12Å; S492-Y494 WeakPolarHBondContact OG-CD2 3.5Å; S492-Y494 WeakPolarHBondContact OG-CE2 3.25Å; Y494-L496 PolarHBondContact O-N 3.23Å; Y494-E553 HydrophobicContact CE2-CG 4.32Å; Y494-L556 HydrophobicContact CD2-CD2 4.38Å
495	E	64.6	Low	65.5	Low	189 Å²	189	98.8 Å²	98.8	88%	0.883	55%	0.547	S	S	*	.			trans	-63.3	101.9	162	-70.7	-176.7	156.2	0	0	109	E493	E493-E495 PolarHBondContact O-N 2.98Å
496	L	77.9	Confident	68.3	Low	30 Å²	30	96 Å²	96	16%	0.157	52%	0.522	C	S	.	.	P	Polyproline II helix	trans	-71.9	134.7	171	-77.9	170	0	0	0	109.5	Y494 E498 I560 T583 Q584 L588	Y494-L496 PolarHBondContact O-N 3.23Å; L496-E498 PolarHBondContact O-N 3Å; L496-I560 HydrophobicContact CD1-CD1 4.39Å; L496-I560 HydrophobicContact CD1-CG1 4.2Å; L496-I560 HydrophobicContact CD2-CD1 3.88Å; L496-I560 HydrophobicContact CD2-CG1 4.03Å; L496-I560 HydrophobicContact CD2-CG2 4.03Å; L496-I560 HydrophobicContact CG-CD1 4.44Å; L496-T583 HydrophobicContact CD1-CG2 4.3Å; L496-Q584 PolarHBondContact O-NE2 2.77Å; L496-L588 HydrophobicContact CD1-CD1 3.9Å; L496-L588 HydrophobicContact CD1-CD2 4.17Å; L496-L588 HydrophobicContact CD1-CG 4.49Å
497	P	83.6	Confident	71.1	Confident	107 Å²	107	95.6 Å²	95.6	70%	0.695	51%	0.513	S	S	*	.	P	Polyproline II helix	trans	-65.8	132.8	175.7	28	-33.8	0	0	0	110.4	D499	P497-D499 PolarHBondContact O-N 3.45Å
498	E	85.9	Confident	73.8	Confident	122 Å²	122	94.6 Å²	94.6	57%	0.57	50%	0.502	S	S	*	.	P	Polyproline II helix	trans	-60.1	133.2	176	-168.7	-167.4	168.3	0	0	110.8	L496 P500 Q584	L496-E498 PolarHBondContact O-N 3Å; E498-P500 HydrophobicContact CG-CG 4.18Å; E498-Q584 HydrophobicContact CB-CG 4.16Å; E498-Q584 HydrophobicContact CG-CG 4.01Å
499	D	91.2	Very high	76.2	Confident	43 Å²	43	90.5 Å²	90.5	23%	0.23	48%	0.481	C	S	.	.			trans	-121.4	88.2	172.9	-172.8	-18.2	0	0	0	109.6	P497 R501 W502 E503 K567	P497-D499 PolarHBondContact O-N 3.45Å; D499-R501 PolarHBondContact O-N 3.26Å; D499-R501 VanDerWaalsContact OD1-CB 3.32Å; D499-R501 WeakPolarHBondContact OD1-CB 3.25Å; D499-R501 PolarHBondContact OD1-N 2.94Å; D499-W502 PolarHBondContact O-N 3.16Å; D499-W502 VanDerWaalsContact OD2-CD1 3.31Å; D499-E503 PolarHBondContact O-N 3.35Å; D499-K567 WeakPolarHBondContact OD2-CE 3.32Å; D499-K567 IonicContact OD2-NZ 3.76Å; D499-K567 PolarHBondContact OD2-NZ 2.61Å
500	P	90.8	Very high	79.2	Confident	96 Å²	96	89.2 Å²	89.2	62%	0.623	46%	0.461	S	S	*	.	T	Hydrogen-bonded Turn	trans	-62.8	-1.6	-174.4	-24.2	33.7	0	0	0	115.3	E498	E498-P500 HydrophobicContact CG-CG 4.18Å
501	R	90.6	Very high	82	Confident	203 Å²	203	88.8 Å²	88.8	77%	0.766	44%	0.44	S	S	*	.	T	Hydrogen-bonded Turn	trans	-81.1	-30.2	171.2	-167.8	-178.8	-56.3	-175.1	5.8	112.3	D499	D499-R501 PolarHBondContact O-N 3.26Å; D499-R501 VanDerWaalsContact OD1-CB 3.32Å; D499-R501 WeakPolarHBondContact OD1-CB 3.25Å; D499-R501 PolarHBondContact OD1-N 2.94Å
502	W	93.1	Very high	84.5	Confident	45 Å²	45	88.7 Å²	88.7	17%	0.17	45%	0.449	C	S	.	.	T	Hydrogen-bonded Turn	trans	-118.6	-21.2	-173.2	-64.6	103.9	0	0	0	113.5	D499 L504 K567 L578 G580 A581	D499-W502 PolarHBondContact O-N 3.16Å; D499-W502 VanDerWaalsContact OD2-CD1 3.31Å; W502-L504 PolarHBondContact O-N 3.08Å; W502-K567 HydrophobicContact CD2-CG 4.36Å; W502-K567 HydrophobicContact CG-CD 4.42Å; W502-K567 HydrophobicContact CG-CG 4.42Å; W502-K567 HydrophobicContact CZ2-CB 4.44Å; W502-K567 HydrophobicContact CZ2-CG 4.27Å; W502-L578 HydrophobicContact CD2-CD2 3.92Å; W502-L578 HydrophobicContact CE3-CB 4.49Å; W502-L578 HydrophobicContact CE3-CD2 3.66Å; W502-L578 HydrophobicContact CE3-CG 3.84Å; W502-L578 HydrophobicContact CH2-CB 4.17Å; W502-L578 HydrophobicContact CH2-CD2 4.05Å; W502-L578 HydrophobicContact CH2-CG 4.33Å; W502-L578 HydrophobicContact CZ2-CD2 4.31Å; W502-L578 HydrophobicContact CZ3-CB 3.84Å; W502-L578 HydrophobicContact CZ3-CD2 3.75Å; W502-L578 HydrophobicContact CZ3-CG 3.71Å; W502-L578 WeakPolarHBondContact CZ3-O 3.45Å; W502-G580 CarbonylContact O-C 3.06Å; W502-G580 WeakPolarHBondContact O-CA 3.29Å; W502-A581 PolarHBondContact O-N 3.48Å
503	E	94	Very high	86.6	Confident	41 Å²	41	92.1 Å²	92.1	19%	0.192	46%	0.456	C	S	.	.	B	Isolated β-bridge	trans	-61.7	126.6	178.9	-164	67.5	-168.6	0	0	111.8	D499 A581 C582 T583 Q584	D499-E503 PolarHBondContact O-N 3.35Å; E503-A581 CarbonylContact C-O 3.6Å; E503-A581 WeakPolarHBondContact CA-O 3.3Å; E503-C582 WeakPolarHBondContact OE1-CA 3.45Å; E503-T583 VanDerWaalsContact CD-N 3.29Å; E503-T583 VanDerWaalsContact CD-OG1 3.31Å; E503-T583 PolarHBondContact OE1-N 2.82Å; E503-T583 WeakPolarHBondContact OE2-CB 3.36Å; E503-T583 WeakPolarHBondContact OE2-CG2 3.37Å; E503-T583 PolarHBondContact OE2-N 3.36Å; E503-T583 PolarHBondContact OE2-OG1 3.49Å; E503-Q584 PolarHBondContact OE1-N 3.25Å
504	L	92.8	Very high	88.6	Confident	14 Å²	14	86.9 Å²	86.9	7%	0.073	44%	0.439	C	S	.	.			trans	-109.3	126.5	175.2	-174.9	73.7	0	0	0	109.5	W502 R506 L509 A528 L531 A581 C582 I591	W502-L504 PolarHBondContact O-N 3.08Å; L504-R506 PolarHBondContact O-N 2.93Å; L504-L509 HydrophobicContact CD2-CB 4.25Å; L504-L509 HydrophobicContact CD2-CD1 4.36Å; L504-A528 HydrophobicContact CD2-CB 4.25Å; L504-L531 HydrophobicContact CD1-CD2 3.96Å; L504-L531 HydrophobicContact CD2-CD2 4.29Å; L504-A581 PolarHBondContact N-O 3.07Å; L504-C582 PolarHBondContact O-SG 2.74Å; L504-I591 HydrophobicContact CB-CD1 3.97Å; L504-I591 HydrophobicContact CD2-CD1 3.47Å; L504-I591 VanDerWaalsContact CD2-CD1 3.47Å; L504-I591 HydrophobicContact CG-CD1 4.35Å
505	P	93	Very high	90.1	Very high	67 Å²	67	83.4 Å²	83.4	44%	0.435	43%	0.43	S	S	.	.			trans	-55.8	128.7	173.5	-27.2	36.4	0	0	0	112.4	D507 R508	P505-D507 WeakPolarHBondContact CB-OD1 3.48Å; P505-D507 PolarHBondContact O-N 3.1Å; P505-R508 HydrophobicContact CB-CG 4.33Å; P505-R508 WeakPolarHBondContact O-CB 3.49Å; P505-R508 PolarHBondContact O-N 3.34Å
506	R	94.3	Very high	90.8	Very high	65 Å²	65	76.1 Å²	76.1	25%	0.245	41%	0.405	C	S	.	.	G	3₁₀ helix	trans	-63.3	-27	-173.1	-66.5	-178.2	-178.4	-85.2	-2	113.4	L504 R508 L509 C582 Q584 D585 G586 P587	L504-R506 PolarHBondContact O-N 2.93Å; R506-R508 PolarHBondContact O-N 3.15Å; R506-L509 PolarHBondContact O-N 3.26Å; R506-C582 HydrophobicContact CG-CB 3.94Å; R506-C582 PolarHBondContact NH2-O 3.43Å; R506-Q584 PolarHBondContact NE-O 3.2Å; R506-Q584 PolarHBondContact NH2-O 3.19Å; R506-D585 PolarHBondContact NE-O 2.82Å; R506-G586 PolarHBondContact NH2-O 3.16Å; R506-P587 VanDerWaalsContact CZ-O 3.31Å; R506-P587 PolarHBondContact NH1-O 3.2Å; R506-P587 PolarHBondContact NH2-O 3.35Å
507	D	93.7	Very high	90.5	Very high	125 Å²	125	80.6 Å²	80.6	67%	0.668	43%	0.425	S	S	*	.	G	3₁₀ helix	trans	-64.1	-19.5	173.1	64.5	-58.1	0	0	0	113.3	P505	P505-D507 WeakPolarHBondContact CB-OD1 3.48Å; P505-D507 PolarHBondContact O-N 3.1Å
508	R	94	Very high	89.6	Confident	98 Å²	98	77.4 Å²	77.4	37%	0.37	41%	0.412	S	S	.	.	G	3₁₀ helix	trans	-96.6	7.6	179.6	-61	-177.3	172.8	-133.1	-2.2	113.8	P505 R506 A528 I529	P505-R508 HydrophobicContact CB-CG 4.33Å; P505-R508 WeakPolarHBondContact O-CB 3.49Å; P505-R508 PolarHBondContact O-N 3.34Å; R506-R508 PolarHBondContact O-N 3.15Å; R508-A528 CarbonylContact O-C 3.58Å; R508-A528 WeakPolarHBondContact O-CA 3.46Å; R508-I529 HydrophobicContact CB-CB 4.24Å; R508-I529 PolarHBondContact O-N 3.33Å
509	L	96.3	Very high	88	Confident	17 Å²	17	76.3 Å²	76.3	9%	0.089	42%	0.417	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-124	107.4	-178.9	-174.3	68.1	0	0	0	111.2	L504 R506 L511 A526 A528 V542 V544 Y589 I591	L504-L509 HydrophobicContact CD2-CB 4.25Å; L504-L509 HydrophobicContact CD2-CD1 4.36Å; R506-L509 PolarHBondContact O-N 3.26Å; L509-L511 HydrophobicContact CD2-CD2 4.07Å; L509-L511 HydrophobicContact CG-CD2 4.12Å; L509-A526 HydrophobicContact CD1-CB 3.83Å; L509-A526 HydrophobicContact CG-CB 4.47Å; L509-A528 HydrophobicContact CD1-CB 3.95Å; L509-V542 HydrophobicContact CD1-CG2 4.18Å; L509-V544 HydrophobicContact CD1-CG2 4.07Å; L509-V544 HydrophobicContact CD2-CG2 4.22Å; L509-Y589 HydrophobicContact CD2-CD2 3.86Å; L509-I591 HydrophobicContact CD1-CD1 4.24Å; L509-I591 HydrophobicContact CD2-CD1 3.88Å; L509-I591 HydrophobicContact CD2-CG1 4.35Å
510	V	96.4	Very high	86.3	Confident	86 Å²	86	78 Å²	78	52%	0.521	42%	0.423	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-98.1	107.8	177.3	-176.1	0	0	0	0	109.3	A526 E527	V510-A526 CarbonylContact O-C 3.6Å; V510-A526 WeakPolarHBondContact O-CA 3.47Å; V510-A526 VanDerWaalsContact O-CB 3.31Å; V510-A526 WeakPolarHBondContact O-CB 3.43Å; V510-E527 PolarHBondContact N-O 3.24Å; V510-E527 PolarHBondContact O-N 3.05Å
511	L	95.9	Very high	85.5	Confident	69 Å²	69	73.8 Å²	73.8	36%	0.361	40%	0.396	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-72.5	142.1	176.8	-56.5	-178.1	0	0	0	111.4	L509 V524 A526 V544 M546 Y589	L509-L511 HydrophobicContact CD2-CD2 4.07Å; L509-L511 HydrophobicContact CG-CD2 4.12Å; L511-V524 HydrophobicContact CD2-CG2 4Å; L511-A526 HydrophobicContact CD2-CB 3.93Å; L511-V544 HydrophobicContact CD2-CB 4.35Å; L511-V544 HydrophobicContact CD2-CG1 4.41Å; L511-V544 HydrophobicContact CD2-CG2 4.14Å; L511-M546 HydrophobicContact CD1-CE 3.94Å; L511-M546 HydrophobicContact CD2-CE 4Å; L511-Y589 HydrophobicContact CD1-CE1 4.46Å; L511-Y589 HydrophobicContact CD1-CE2 4.14Å
512	G	94.3	Very high	85.3	Confident	47 Å²	47	66.8 Å²	66.8	49%	0.485	37%	0.372	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-128	-144.2	-178.8	0	0	0	0	0	112.9	L525	G512-L525 CarbonylContact C-O 3.58Å; G512-L525 VanDerWaalsContact CA-O 3.25Å; G512-L525 WeakPolarHBondContact CA-O 3.37Å; G512-L525 PolarHBondContact N-O 2.87Å
513	K	92.5	Very high	85.2	Confident	132 Å²	132	66.7 Å²	66.7	57%	0.574	38%	0.376	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-65.5	147.7	-174.9	67.8	172.4	-174	169.8	0	112.7	L525	K513-L525 HydrophobicContact CG-CB 4.18Å; K513-L525 HydrophobicContact CG-CD2 4.26Å; K513-L525 PolarHBondContact O-N 2.68Å
514	P	90.9	Very high	85.2	Confident	86 Å²	86	65.1 Å²	65.1	56%	0.558	37%	0.37	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-59.8	144.1	165.1	27.2	-34.2	0	0	0	110.9
515	L	87.3	Confident	85.4	Confident	70 Å²	70	65.8 Å²	65.8	37%	0.366	37%	0.373	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-107	-33.8	174.3	-69.7	172.9	0	0	0	111.5	V523 L525 A543 Y594	L515-V523 HydrophobicContact CB-CG1 4.37Å; L515-V523 HydrophobicContact CD1-CG1 4.4Å; L515-V523 PolarHBondContact N-O 3.18Å; L515-L525 HydrophobicContact CD1-CB 3.92Å; L515-L525 HydrophobicContact CD1-CD1 4.46Å; L515-L525 HydrophobicContact CD2-CB 4.07Å; L515-L525 HydrophobicContact CG-CB 3.89Å; L515-A543 HydrophobicContact CD1-CB 4.22Å; L515-Y594 HydrophobicContact CD1-CD2 3.79Å; L515-Y594 HydrophobicContact CD1-CE2 3.62Å; L515-Y594 HydrophobicContact CD2-CE2 3.85Å; L515-Y594 HydrophobicContact CG-CE2 4.41Å
516	G	78.8	Confident	85.6	Confident	35 Å²	35	62.7 Å²	62.7	36%	0.361	35%	0.353	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-170.3	157.4	177.2	0	0	0	0	0	111.5	V523	G516-V523 PolarHBondContact N-O 3.49Å; G516-V523 PolarHBondContact O-N 2.94Å
517	E	72.3	Confident	85.7	Confident	124 Å²	124	63.6 Å²	63.6	58%	0.579	36%	0.36	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-131.8	113.8	179.6	-164.4	-176	128.4	0	0	109.8	Q522 K548	E517-Q522 HydrophobicContact CG-CB 4.4Å; E517-Q522 HydrophobicContact CG-CG 4.31Å; E517-Q522 PolarHBondContact OE2-NE2 3.14Å; E517-K548 HydrophobicContact CG-CD 4.36Å; E517-K548 VanDerWaalsContact CG-CE 3.49Å; E517-K548 WeakPolarHBondContact OE1-CE 3.15Å; E517-K548 IonicContact OE1-NZ 3.27Å; E517-K548 PolarHBondContact OE1-NZ 3.41Å
518	G	63.1	Low	85.8	Confident	41 Å²	41	57.6 Å²	57.6	42%	0.423	33%	0.328	S	S	.	.			trans	-92.4	-174.6	-177.3	0	0	0	0	0	112.7	F520 G521 K548	G518-F520 VanDerWaalsContact C-N 3.3Å; G518-G521 PolarHBondContact N-O 3.27Å; G518-K548 WeakPolarHBondContact O-CE 3.34Å; G518-K548 PolarHBondContact O-NZ 2.96Å
519	C	52.8	Low	85.8	Confident	98 Å²	98	55.7 Å²	55.7	66%	0.662	33%	0.325	S	S	*	.	S	Bend	trans	-71.2	-24.3	171.2	-66.5	0	0	0	0	113.3
520	F	54.8	Low	85.4	Confident	80 Å²	80	55.5 Å²	55.5	35%	0.351	33%	0.327	S	S	.	.	S	Bend	trans	-119	6.9	-167.9	-43.5	-67.7	0	0	0	113.7	G518	G518-F520 VanDerWaalsContact C-N 3.3Å
521	G	74.1	Confident	84.9	Confident	7 Å²	7	53.5 Å²	53.5	7%	0.072	31%	0.313	C	S	.	.			trans	167	179.6	-176.3	0	0	0	0	0	113.6	G518 M546 K548	G518-G521 PolarHBondContact N-O 3.27Å; G521-M546 WeakPolarHBondContact CA-O 3.46Å; G521-K548 WeakPolarHBondContact O-CE 3.34Å
522	Q	86.3	Confident	84.3	Confident	55 Å²	55	51.9 Å²	51.9	26%	0.257	31%	0.305	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-119.8	145.5	175.1	-169.4	174.9	67.3	0	0	109.9	E517 V524 M546	E517-Q522 HydrophobicContact CG-CB 4.4Å; E517-Q522 HydrophobicContact CG-CG 4.31Å; E517-Q522 PolarHBondContact OE2-NE2 3.14Å; Q522-V524 HydrophobicContact CG-CG1 4.33Å; Q522-M546 PolarHBondContact N-O 3.08Å; Q522-M546 PolarHBondContact O-N 2.76Å
523	V	91.5	Very high	83.7	Confident	43 Å²	43	58 Å²	58	26%	0.261	32%	0.318	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-116.1	125.4	172.6	-177.8	0	0	0	0	108.7	L515 G516 A543 V544 K545	L515-V523 HydrophobicContact CB-CG1 4.37Å; L515-V523 HydrophobicContact CD1-CG1 4.4Å; L515-V523 PolarHBondContact N-O 3.18Å; G516-V523 PolarHBondContact N-O 3.49Å; G516-V523 PolarHBondContact O-N 2.94Å; V523-A543 HydrophobicContact CG1-CB 4.01Å; V523-V544 WeakPolarHBondContact CA-O 3.42Å; V523-K545 HydrophobicContact CG2-CB 4.39Å; V523-K545 HydrophobicContact CG2-CG 4.03Å
524	V	94.6	Very high	83.4	Confident	9 Å²	9	58.7 Å²	58.7	6%	0.055	33%	0.328	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-116.9	152.4	175.9	-50.4	0	0	0	0	111.2	L511 Q522 A543 V544 M546	L511-V524 HydrophobicContact CD2-CG2 4Å; Q522-V524 HydrophobicContact CG-CG1 4.33Å; V524-A543 WeakPolarHBondContact O-CA 3.45Å; V524-V544 HydrophobicContact CG2-CB 4.05Å; V524-V544 PolarHBondContact N-O 2.79Å; V524-V544 PolarHBondContact O-N 2.83Å; V524-M546 HydrophobicContact CG1-CE 4.45Å; V524-M546 HydrophobicContact CG2-CE 3.55Å
525	L	96.3	Very high	83.3	Confident	28 Å²	28	60.3 Å²	60.3	15%	0.147	33%	0.327	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-73.2	138.7	164.5	-179.2	64.5	0	0	0	108.1	G512 K513 L515 K541 Y594	G512-L525 CarbonylContact C-O 3.58Å; G512-L525 VanDerWaalsContact CA-O 3.25Å; G512-L525 WeakPolarHBondContact CA-O 3.37Å; G512-L525 PolarHBondContact N-O 2.87Å; K513-L525 HydrophobicContact CG-CB 4.18Å; K513-L525 HydrophobicContact CG-CD2 4.26Å; K513-L525 PolarHBondContact O-N 2.68Å; L515-L525 HydrophobicContact CD1-CB 3.92Å; L515-L525 HydrophobicContact CD1-CD1 4.46Å; L515-L525 HydrophobicContact CD2-CB 4.07Å; L515-L525 HydrophobicContact CG-CB 3.89Å; L525-K541 HydrophobicContact CD1-CB 4.42Å; L525-Y594 HydrophobicContact CD1-CD1 4.07Å; L525-Y594 HydrophobicContact CD1-CD2 3.77Å; L525-Y594 HydrophobicContact CD1-CE1 4.1Å; L525-Y594 HydrophobicContact CD1-CE2 3.81Å; L525-Y594 HydrophobicContact CD1-CG 3.91Å
526	A	96.9	Very high	83.2	Confident	1 Å²	1	60.3 Å²	60.3	1%	0.008	33%	0.331	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-140.3	163.8	171.8	0	0	0	0	0	111.3	L509 V510 L511 K541 V542 V544	L509-A526 HydrophobicContact CD1-CB 3.83Å; L509-A526 HydrophobicContact CG-CB 4.47Å; V510-A526 CarbonylContact O-C 3.6Å; V510-A526 WeakPolarHBondContact O-CA 3.47Å; V510-A526 VanDerWaalsContact O-CB 3.31Å; V510-A526 WeakPolarHBondContact O-CB 3.43Å; L511-A526 HydrophobicContact CD2-CB 3.93Å; A526-K541 WeakPolarHBondContact O-CA 3.23Å; A526-V542 HydrophobicContact CB-CG2 3.97Å; A526-V542 PolarHBondContact N-O 3.39Å; A526-V542 PolarHBondContact O-N 3.06Å; A526-V544 HydrophobicContact CB-CG2 3.56Å
527	E	96.9	Very high	83.7	Confident	84 Å²	84	65.7 Å²	65.7	39%	0.393	35%	0.351	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-113.4	119.4	171.3	-65	-162.8	157.5	0	0	109.2	V510 V539 K541	V510-E527 PolarHBondContact N-O 3.24Å; V510-E527 PolarHBondContact O-N 3.05Å; E527-V539 HydrophobicContact CB-CG1 3.75Å; E527-V539 HydrophobicContact CG-CG1 4.28Å; E527-K541 HydrophobicContact CG-CG 4.29Å; E527-K541 WeakPolarHBondContact OE1-CE 3.38Å
528	A	96.1	Very high	84.7	Confident	0 Å²	0	65.7 Å²	65.7	0%	0	35%	0.346	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-111.4	132.5	-176.3	0	0	0	0	0	111	L504 R508 L509 L531 T540 V542	L504-A528 HydrophobicContact CD2-CB 4.25Å; R508-A528 CarbonylContact O-C 3.58Å; R508-A528 WeakPolarHBondContact O-CA 3.46Å; L509-A528 HydrophobicContact CD1-CB 3.95Å; A528-L531 HydrophobicContact CB-CD1 3.51Å; A528-L531 HydrophobicContact CB-CG 3.94Å; A528-T540 PolarHBondContact N-O 3.41Å; A528-T540 PolarHBondContact O-N 3.07Å; A528-V542 HydrophobicContact CB-CG1 4.16Å; A528-V542 HydrophobicContact CB-CG2 3.88Å
529	I	94.2	Very high	86.2	Confident	57 Å²	57	67.4 Å²	67.4	29%	0.292	35%	0.348	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-103.1	117.4	-171.7	-50	179.6	0	0	0	110.5	R508 V539	R508-I529 HydrophobicContact CB-CB 4.24Å; R508-I529 PolarHBondContact O-N 3.33Å; I529-V539 HydrophobicContact CG1-CG2 4.46Å
530	G	87.5	Confident	88.2	Confident	14 Å²	14	64.5 Å²	64.5	14%	0.144	33%	0.327	C	S	.	.	S	Bend	trans	79.6	24.9	171.2	0	0	0	0	0	115.9	D532 P536 R538	G530-D532 PolarHBondContact O-N 3.14Å; G530-P536 WeakPolarHBondContact CA-O 3.25Å; G530-R538 PolarHBondContact N-O 2.9Å
531	L	86.2	Confident	90.1	Very high	44 Å²	44	66.5 Å²	66.5	23%	0.23	34%	0.336	C	S	.	.			trans	-57.5	-32.4	165.6	-75.5	172.1	0	0	0	112.3	L504 A528 K533 V542 L579	L504-L531 HydrophobicContact CD1-CD2 3.96Å; L504-L531 HydrophobicContact CD2-CD2 4.29Å; A528-L531 HydrophobicContact CB-CD1 3.51Å; A528-L531 HydrophobicContact CB-CG 3.94Å; L531-K533 PolarHBondContact O-N 3.02Å; L531-V542 HydrophobicContact CD1-CG1 3.65Å; L531-L579 HydrophobicContact CD1-CB 4.2Å; L531-L579 HydrophobicContact CD1-CD1 4.17Å; L531-L579 HydrophobicContact CD2-CB 4.36Å
532	D	83.5	Confident	91.2	Very high	34 Å²	34	66.2 Å²	66.2	18%	0.182	33%	0.332	C	S	.	.	S	Bend	trans	-81.1	101.6	172.8	-172.9	-16.7	0	0	0	108.5	G530 D534 K535 R538	G530-D532 PolarHBondContact O-N 3.14Å; D532-D534 PolarHBondContact O-N 2.83Å; D532-D534 PolarHBondContact OD1-N 3.06Å; D532-K535 HydrophobicContact CB-CB 4.18Å; D532-K535 CarbonylContact O-C 3.59Å; D532-K535 WeakPolarHBondContact O-CA 3.39Å; D532-K535 PolarHBondContact O-N 2.73Å; D532-K535 WeakPolarHBondContact OD2-CD 3.39Å; D532-R538 WeakPolarHBondContact OD2-CD 3.42Å; D532-R538 IonicContact OD2-CZ 3.81Å; D532-R538 IonicContact OD2-NE 2.77Å; D532-R538 IonicContact OD2-NH1 3.19Å; D532-R538 PolarHBondContact OD2-NH1 2.81Å
533	K	80.9	Confident	91.7	Very high	175 Å²	175	64 Å²	64	76%	0.761	32%	0.323	S	S	*	.	T	Hydrogen-bonded Turn	trans	-62.3	-26.8	-174.7	-68.1	-168.9	177.1	-172.9	0	113.1	L531 K535	L531-K533 PolarHBondContact O-N 3.02Å; K533-K535 VanDerWaalsContact C-N 3.26Å
534	D	86.9	Confident	91.9	Very high	148 Å²	148	61.9 Å²	61.9	79%	0.791	31%	0.311	S	S	*	.	T	Hydrogen-bonded Turn	trans	-79.9	-12.1	176.1	-55.9	-33.5	0	0	0	111.9	D532	D532-D534 PolarHBondContact O-N 2.83Å; D532-D534 PolarHBondContact OD1-N 3.06Å
535	K	89.3	Confident	91.8	Very high	120 Å²	120	63.3 Å²	63.3	52%	0.522	32%	0.316	S	S	.	.			trans	-138.3	67.3	-177.4	-55.5	-179.3	-169.5	157.1	0	110.6	D532 K533 N537 R538	D532-K535 HydrophobicContact CB-CB 4.18Å; D532-K535 CarbonylContact O-C 3.59Å; D532-K535 WeakPolarHBondContact O-CA 3.39Å; D532-K535 PolarHBondContact O-N 2.73Å; D532-K535 WeakPolarHBondContact OD2-CD 3.39Å; K533-K535 VanDerWaalsContact C-N 3.26Å; K535-N537 PolarHBondContact O-N 2.74Å; K535-R538 HydrophobicContact CB-CB 3.84Å; K535-R538 WeakPolarHBondContact O-CB 3.38Å; K535-R538 PolarHBondContact O-N 2.86Å
536	P	85.1	Confident	91.6	Very high	70 Å²	70	62.9 Å²	62.9	46%	0.455	31%	0.314	S	S	.	.	T	Hydrogen-bonded Turn	trans	-62.8	-15.9	-168.7	23.9	-35.6	0	0	0	115.7	G530	G530-P536 WeakPolarHBondContact CA-O 3.25Å
537	N	89.1	Confident	91.2	Very high	148 Å²	148	64.9 Å²	64.9	79%	0.791	32%	0.324	S	S	*	.	T	Hydrogen-bonded Turn	trans	-98.8	4	175.5	-63.9	-5.9	0	0	0	113.1	K535 V539	K535-N537 PolarHBondContact O-N 2.74Å; N537-V539 PolarHBondContact O-N 3.32Å
538	R	93.1	Very high	90.6	Very high	124 Å²	124	62.7 Å²	62.7	47%	0.468	31%	0.313	S	S	.	.			trans	-74.5	114.7	-179.4	-177.1	-178.5	-179.6	-173.9	-2.6	110.2	G530 D532 K535	G530-R538 PolarHBondContact N-O 2.9Å; D532-R538 WeakPolarHBondContact OD2-CD 3.42Å; D532-R538 IonicContact OD2-CZ 3.81Å; D532-R538 IonicContact OD2-NE 2.77Å; D532-R538 IonicContact OD2-NH1 3.19Å; D532-R538 PolarHBondContact OD2-NH1 2.81Å; K535-R538 HydrophobicContact CB-CB 3.84Å; K535-R538 WeakPolarHBondContact O-CB 3.38Å; K535-R538 PolarHBondContact O-N 2.86Å
539	V	93.8	Very high	90	Very high	77 Å²	77	67.8 Å²	67.8	47%	0.467	35%	0.349	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-71.7	131.6	165.9	-172	0	0	0	0	108.9	E527 I529 N537	E527-V539 HydrophobicContact CB-CG1 3.75Å; E527-V539 HydrophobicContact CG-CG1 4.28Å; I529-V539 HydrophobicContact CG1-CG2 4.46Å; N537-V539 PolarHBondContact O-N 3.32Å
540	T	94.7	Very high	89.4	Confident	36 Å²	36	70.9 Å²	70.9	22%	0.221	37%	0.366	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-129	130.5	178.7	-55.3	0	0	0	0	109.5	A528 V542	A528-T540 PolarHBondContact N-O 3.41Å; A528-T540 PolarHBondContact O-N 3.07Å; T540-V542 HydrophobicContact CG2-CG1 4.21Å
541	K	96.3	Very high	89	Confident	123 Å²	123	71.2 Å²	71.2	54%	0.535	37%	0.367	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-74.9	128.7	172.9	-69.9	-179.4	-179	175.7	0	109.7	L525 A526 E527 Y594	L525-K541 HydrophobicContact CD1-CB 4.42Å; A526-K541 WeakPolarHBondContact O-CA 3.23Å; E527-K541 HydrophobicContact CG-CG 4.29Å; E527-K541 WeakPolarHBondContact OE1-CE 3.38Å; K541-Y594 HydrophobicContact CB-CD1 4.19Å
542	V	96.7	Very high	88.9	Confident	0 Å²	0	72.4 Å²	72.4	0%	0	38%	0.377	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-135.7	159.5	-176	-61.8	0	0	0	0	110.2	L509 A526 A528 L531 T540 V544 L579 I591 V592	L509-V542 HydrophobicContact CD1-CG2 4.18Å; A526-V542 HydrophobicContact CB-CG2 3.97Å; A526-V542 PolarHBondContact N-O 3.39Å; A526-V542 PolarHBondContact O-N 3.06Å; A528-V542 HydrophobicContact CB-CG1 4.16Å; A528-V542 HydrophobicContact CB-CG2 3.88Å; L531-V542 HydrophobicContact CD1-CG1 3.65Å; T540-V542 HydrophobicContact CG2-CG1 4.21Å; V542-V544 HydrophobicContact CG2-CG2 4.27Å; V542-L579 HydrophobicContact CB-CD1 4.43Å; V542-L579 HydrophobicContact CG1-CD1 3.57Å; V542-I591 HydrophobicContact CB-CG2 3.87Å; V542-I591 HydrophobicContact CG1-CG2 4.24Å; V542-I591 HydrophobicContact CG2-CG2 3.66Å; V542-V592 WeakPolarHBondContact CB-O 3.38Å
543	A	96.1	Very high	88.7	Confident	8 Å²	8	75 Å²	75	7%	0.066	39%	0.388	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-99.4	140.4	166.5	0	0	0	0	0	109.1	L515 V523 V524 V592	L515-A543 HydrophobicContact CD1-CB 4.22Å; V523-A543 HydrophobicContact CG1-CB 4.01Å; V524-A543 WeakPolarHBondContact O-CA 3.45Å; A543-V592 HydrophobicContact CB-CG2 3.91Å; A543-V592 PolarHBondContact N-O 2.85Å; A543-V592 PolarHBondContact O-N 2.82Å
544	V	95.8	Very high	88.4	Confident	0 Å²	0	68.4 Å²	68.4	0%	0	36%	0.359	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-120.6	117	178.2	-175	0	0	0	0	108.8	L509 L511 V523 V524 A526 V542 M546 Y589 V590 I591	L509-V544 HydrophobicContact CD1-CG2 4.07Å; L509-V544 HydrophobicContact CD2-CG2 4.22Å; L511-V544 HydrophobicContact CD2-CB 4.35Å; L511-V544 HydrophobicContact CD2-CG1 4.41Å; L511-V544 HydrophobicContact CD2-CG2 4.14Å; V523-V544 WeakPolarHBondContact CA-O 3.42Å; V524-V544 HydrophobicContact CG2-CB 4.05Å; V524-V544 PolarHBondContact N-O 2.79Å; V524-V544 PolarHBondContact O-N 2.83Å; A526-V544 HydrophobicContact CB-CG2 3.56Å; V542-V544 HydrophobicContact CG2-CG2 4.27Å; V544-M546 HydrophobicContact CB-CE 4.02Å; V544-M546 HydrophobicContact CG1-CE 3.54Å; V544-Y589 HydrophobicContact CG1-CD1 4.23Å; V544-Y589 HydrophobicContact CG1-CG 3.99Å; V544-V590 WeakPolarHBondContact CA-O 3.38Å; V544-I591 HydrophobicContact CG2-CG1 4.39Å; V544-I591 HydrophobicContact CG2-CG2 4.4Å
545	K	93.1	Very high	88.2	Confident	38 Å²	38	62.2 Å²	62.2	17%	0.165	33%	0.326	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-89.4	129.9	172.5	-159.8	175.2	-156.6	-175.9	0	108.6	V523 L559 E562 V590 D672	V523-K545 HydrophobicContact CG2-CB 4.39Å; V523-K545 HydrophobicContact CG2-CG 4.03Å; K545-L559 HydrophobicContact CB-CD1 4.26Å; K545-L559 HydrophobicContact CD-CD1 3.87Å; K545-L559 HydrophobicContact CG-CD1 3.88Å; K545-E562 WeakPolarHBondContact CE-OE2 3.37Å; K545-E562 IonicContact NZ-OE1 2.93Å; K545-E562 PolarHBondContact NZ-OE1 3.47Å; K545-E562 IonicContact NZ-OE2 3.89Å; K545-E562 PolarHBondContact NZ-OE2 2.02Å; K545-V590 HydrophobicContact CB-CB 4.4Å; K545-V590 PolarHBondContact N-O 3.1Å; K545-V590 PolarHBondContact O-N 3.15Å; K545-D672 IonicContact NZ-OD1 2.78Å; K545-D672 PolarHBondContact NZ-OD1 3.25Å
546	M	90.7	Very high	87.9	Confident	20 Å²	20	57.4 Å²	57.4	10%	0.099	31%	0.306	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-148.7	165.3	-176.2	65.6	-174.9	64.9	0	0	111.6	L511 G521 Q522 V524 V544 Y589	L511-M546 HydrophobicContact CD1-CE 3.94Å; L511-M546 HydrophobicContact CD2-CE 4Å; G521-M546 WeakPolarHBondContact CA-O 3.46Å; Q522-M546 PolarHBondContact N-O 3.08Å; Q522-M546 PolarHBondContact O-N 2.76Å; V524-M546 HydrophobicContact CG1-CE 4.45Å; V524-M546 HydrophobicContact CG2-CE 3.55Å; V544-M546 HydrophobicContact CB-CE 4.02Å; V544-M546 HydrophobicContact CG1-CE 3.54Å; M546-Y589 HydrophobicContact CB-CD1 3.77Å; M546-Y589 HydrophobicContact CB-CE1 4.07Å; M546-Y589 HydrophobicContact CE-CD1 3.75Å; M546-Y589 HydrophobicContact CE-CE1 3.64Å; M546-Y589 HydrophobicContact SD-CD1 4.32Å; M546-Y589 HydrophobicContact SD-CE1 3.83Å
547	L	89.1	Confident	87.8	Confident	42 Å²	42	56.9 Å²	56.9	22%	0.22	30%	0.304	C	S	.	.			trans	-75	153.3	176.4	-61.1	-179.1	0	0	0	112.2	A551 D555 L556 L559	L547-A551 HydrophobicContact CB-CB 3.83Å; L547-A551 HydrophobicContact CD1-CB 4.48Å; L547-A551 HydrophobicContact CD2-CB 4.22Å; L547-A551 HydrophobicContact CG-CB 4.4Å; L547-D555 HydrophobicContact CD2-CB 4.03Å; L547-L556 HydrophobicContact CD1-CB 3.75Å; L547-L556 HydrophobicContact CD1-CD1 3.85Å; L547-L556 HydrophobicContact CD1-CG 4.33Å; L547-L559 HydrophobicContact CD2-CB 4.32Å; L547-L559 HydrophobicContact CD2-CD2 3.74Å; L547-L559 HydrophobicContact CG-CD2 3.94Å
548	K	85.6	Confident	87.4	Confident	38 Å²	38	50.6 Å²	50.6	17%	0.165	27%	0.27	C	S	.	.			trans	-81.4	170.6	171.2	-56.3	-169.4	-170.4	-169.3	0	111.9	E517 G518 G521 D550 A551	E517-K548 HydrophobicContact CG-CD 4.36Å; E517-K548 VanDerWaalsContact CG-CE 3.49Å; E517-K548 WeakPolarHBondContact OE1-CE 3.15Å; E517-K548 IonicContact OE1-NZ 3.27Å; E517-K548 PolarHBondContact OE1-NZ 3.41Å; G518-K548 WeakPolarHBondContact O-CE 3.34Å; G518-K548 PolarHBondContact O-NZ 2.96Å; G521-K548 WeakPolarHBondContact O-CE 3.34Å; K548-D550 WeakPolarHBondContact CB-OD1 3.43Å; K548-D550 VanDerWaalsContact CD-OD1 3.31Å; K548-D550 WeakPolarHBondContact CD-OD1 3.48Å; K548-D550 PolarHBondContact O-N 2.95Å; K548-A551 HydrophobicContact CB-CB 4.45Å; K548-A551 WeakPolarHBondContact O-CB 3.26Å; K548-A551 PolarHBondContact O-N 2.97Å
549	S	82.5	Confident	87	Confident	107 Å²	107	45.1 Å²	45.1	75%	0.748	25%	0.25	S	C	*	.	T	Hydrogen-bonded Turn	trans	-71.4	-11.1	171.6	48.3	0	0	0	0	114.9	L488	L488-S549 WeakPolarHBondContact CD2-O 3.44Å
550	D	81.5	Confident	86.7	Confident	122 Å²	122	42.8 Å²	42.8	65%	0.652	24%	0.235	S	C	*	.	T	Hydrogen-bonded Turn	trans	-113.1	10.8	174.9	65.1	-27.5	0	0	0	113.2	K548	K548-D550 WeakPolarHBondContact CB-OD1 3.43Å; K548-D550 VanDerWaalsContact CD-OD1 3.31Å; K548-D550 WeakPolarHBondContact CD-OD1 3.48Å; K548-D550 PolarHBondContact O-N 2.95Å
551	A	80.1	Confident	86.2	Confident	21 Å²	21	43.3 Å²	43.3	17%	0.174	24%	0.24	C	C	.	.			trans	-65.7	143.3	-175.6	0	0	0	0	0	113.6	L547 K548 D555	L547-A551 HydrophobicContact CB-CB 3.83Å; L547-A551 HydrophobicContact CD1-CB 4.48Å; L547-A551 HydrophobicContact CD2-CB 4.22Å; L547-A551 HydrophobicContact CG-CB 4.4Å; K548-A551 HydrophobicContact CB-CB 4.45Å; K548-A551 WeakPolarHBondContact O-CB 3.26Å; K548-A551 PolarHBondContact O-N 2.97Å; A551-D555 HydrophobicContact CB-CB 4.23Å
552	T	82.2	Confident	85.6	Confident	70 Å²	70	38.1 Å²	38.1	43%	0.429	22%	0.217	S	C	.	.			trans	-89.2	164.6	177.2	72.8	0	0	0	0	112.1	K554 D555 L556	T552-K554 PolarHBondContact O-N 3.16Å; T552-K554 VanDerWaalsContact O-N 3.16Å; T552-K554 PolarHBondContact OG1-N 3.16Å; T552-D555 WeakPolarHBondContact CA-OD2 3.46Å; T552-D555 VanDerWaalsContact CB-OD2 3.29Å; T552-D555 WeakPolarHBondContact CB-OD2 3.24Å; T552-D555 PolarHBondContact N-OD2 2.7Å; T552-D555 PolarHBondContact O-N 2.94Å; T552-D555 PolarHBondContact OG1-N 3.02Å; T552-D555 PolarHBondContact OG1-OD2 3.18Å; T552-L556 PolarHBondContact O-N 3.26Å
553	E	79.6	Confident	85.3	Confident	89 Å²	89	38.2 Å²	38.2	42%	0.416	22%	0.218	S	C	.	.	H	α-helix	trans	-56.2	-26.9	169.8	-176	172.5	-116.8	0	0	112.6	V491 S492 Y494 S557	V491-E553 HydrophobicContact CG1-CB 4.22Å; V491-E553 HydrophobicContact CG1-CG 4.35Å; S492-E553 WeakPolarHBondContact CB-OE1 3.42Å; S492-E553 PolarHBondContact OG-OE1 3.37Å; Y494-E553 HydrophobicContact CE2-CG 4.32Å; E553-S557 PolarHBondContact O-N 3.19Å; E553-S557 VanDerWaalsContact O-N 3.09Å
554	K	76.3	Confident	84.9	Confident	35 Å²	35	41.7 Å²	41.7	15%	0.152	23%	0.233	C	C	.	.	H	α-helix	trans	-75.8	-35.8	173.5	-178.3	163.3	177.6	-175.3	0	112.9	T552 L556 S557 D558 Y685 T688 T689	T552-K554 PolarHBondContact O-N 3.16Å; T552-K554 VanDerWaalsContact O-N 3.16Å; T552-K554 PolarHBondContact OG1-N 3.16Å; K554-L556 VanDerWaalsContact C-N 3.25Å; K554-L556 PolarHBondContact O-N 2.89Å; K554-S557 CarbonylContact O-C 3.2Å; K554-S557 WeakPolarHBondContact O-CA 3.23Å; K554-S557 WeakPolarHBondContact O-CB 3.25Å; K554-S557 PolarHBondContact O-N 3.26Å; K554-D558 WeakPolarHBondContact CE-OD2 3.04Å; K554-D558 PolarHBondContact O-N 2.87Å; K554-Y685 WeakPolarHBondContact CE-OH 3.45Å; K554-Y685 PolarHBondContact NZ-OH 3.16Å; K554-T688 PolarHBondContact NZ-OG1 2.86Å; K554-T689 HydrophobicContact CD-CG2 3.8Å; K554-T689 WeakPolarHBondContact CE-OG1 3.34Å; K554-T689 PolarHBondContact NZ-OG1 2.8Å
555	D	81.6	Confident	84.4	Confident	18 Å²	18	43 Å²	43	10%	0.096	24%	0.239	C	C	.	.	H	α-helix	trans	-64.4	-36	175.9	-57.3	-65.7	0	0	0	110.6	L547 A551 T552 L559	L547-D555 HydrophobicContact CD2-CB 4.03Å; A551-D555 HydrophobicContact CB-CB 4.23Å; T552-D555 WeakPolarHBondContact CA-OD2 3.46Å; T552-D555 VanDerWaalsContact CB-OD2 3.29Å; T552-D555 WeakPolarHBondContact CB-OD2 3.24Å; T552-D555 PolarHBondContact N-OD2 2.7Å; T552-D555 PolarHBondContact O-N 2.94Å; T552-D555 PolarHBondContact OG1-N 3.02Å; T552-D555 PolarHBondContact OG1-OD2 3.18Å; D555-L559 VanDerWaalsContact O-CB 3.24Å; D555-L559 WeakPolarHBondContact O-CB 3.45Å; D555-L559 PolarHBondContact O-N 3.26Å
556	L	84.2	Confident	84.2	Confident	20 Å²	20	41.7 Å²	41.7	11%	0.105	23%	0.234	C	C	.	.	H	α-helix	trans	-59.4	-48.7	166.9	177.8	59.9	0	0	0	111.6	V491 Y494 L547 T552 K554 L559 I560 L588	V491-L556 HydrophobicContact CG1-CD2 3.66Å; Y494-L556 HydrophobicContact CD2-CD2 4.38Å; L547-L556 HydrophobicContact CD1-CB 3.75Å; L547-L556 HydrophobicContact CD1-CD1 3.85Å; L547-L556 HydrophobicContact CD1-CG 4.33Å; T552-L556 PolarHBondContact O-N 3.26Å; K554-L556 VanDerWaalsContact C-N 3.25Å; K554-L556 PolarHBondContact O-N 2.89Å; L556-L559 PolarHBondContact O-N 2.88Å; L556-I560 HydrophobicContact CD1-CD1 3.74Å; L556-I560 HydrophobicContact CD1-CG1 4.08Å; L556-I560 HydrophobicContact CG-CD1 3.74Å; L556-I560 HydrophobicContact CG-CG1 4.49Å; L556-I560 WeakPolarHBondContact O-CD1 3.17Å; L556-I560 VanDerWaalsContact O-CG1 3.25Å; L556-I560 WeakPolarHBondContact O-CG1 3.39Å; L556-I560 PolarHBondContact O-N 3.3Å; L556-L588 HydrophobicContact CD1-CB 4.47Å; L556-L588 HydrophobicContact CD1-CD2 4Å
557	S	81.8	Confident	84.2	Confident	58 Å²	58	42.4 Å²	42.4	41%	0.406	24%	0.236	S	C	.	.	H	α-helix	trans	-63.1	-43.9	-179.1	-168	0	0	0	0	113.7	E553 K554 S561	E553-S557 PolarHBondContact O-N 3.19Å; E553-S557 VanDerWaalsContact O-N 3.09Å; K554-S557 CarbonylContact O-C 3.2Å; K554-S557 WeakPolarHBondContact O-CA 3.23Å; K554-S557 WeakPolarHBondContact O-CB 3.25Å; K554-S557 PolarHBondContact O-N 3.26Å; S557-S561 WeakPolarHBondContact O-CB 3.39Å; S557-S561 PolarHBondContact O-N 3.47Å; S557-S561 PolarHBondContact O-OG 3.07Å
558	D	80.5	Confident	84.1	Confident	16 Å²	16	46.7 Å²	46.7	9%	0.086	26%	0.257	C	S	.	.	H	α-helix	trans	-69.1	-34.7	176.9	-75.8	-35.7	0	0	0	110.5	K554 S561 E562 R677 Y685	K554-D558 WeakPolarHBondContact CE-OD2 3.04Å; K554-D558 PolarHBondContact O-N 2.87Å; D558-S561 WeakPolarHBondContact O-CB 3.46Å; D558-S561 PolarHBondContact O-N 2.8Å; D558-E562 PolarHBondContact O-N 3.38Å; D558-R677 IonicContact OD1-NH2 3.66Å; D558-Y685 PolarHBondContact OD1-OH 3.09Å
559	L	85.9	Confident	84.3	Confident	9 Å²	9	45 Å²	45	5%	0.047	25%	0.25	C	C	.	.	H	α-helix	trans	-68.7	-40.3	174.2	-179.1	62.6	0	0	0	113.3	K545 L547 D555 L556 S561 E562 M563 L588 V590	K545-L559 HydrophobicContact CB-CD1 4.26Å; K545-L559 HydrophobicContact CD-CD1 3.87Å; K545-L559 HydrophobicContact CG-CD1 3.88Å; L547-L559 HydrophobicContact CD2-CB 4.32Å; L547-L559 HydrophobicContact CD2-CD2 3.74Å; L547-L559 HydrophobicContact CG-CD2 3.94Å; D555-L559 VanDerWaalsContact O-CB 3.24Å; D555-L559 WeakPolarHBondContact O-CB 3.45Å; D555-L559 PolarHBondContact O-N 3.26Å; L556-L559 PolarHBondContact O-N 2.88Å; L559-S561 VanDerWaalsContact C-N 3.33Å; L559-E562 PolarHBondContact O-N 3.2Å; L559-M563 PolarHBondContact O-N 3.1Å; L559-M563 VanDerWaalsContact O-N 3.08Å; L559-L588 HydrophobicContact CD2-CD2 3.97Å; L559-L588 HydrophobicContact CD2-CG 4.27Å; L559-L588 HydrophobicContact CG-CD2 4Å; L559-V590 HydrophobicContact CD1-CB 4.45Å; L559-V590 HydrophobicContact CD1-CG2 3.79Å; L559-V590 HydrophobicContact CG-CG2 4.05Å
560	I	86.9	Confident	84.6	Confident	29 Å²	29	41.2 Å²	41.2	15%	0.149	23%	0.227	C	C	.	.	H	α-helix	trans	-62.1	-44.7	171.9	-67.8	161	0	0	0	109.9	L496 L556 E562 M563 E564 L588	L496-I560 HydrophobicContact CD1-CD1 4.39Å; L496-I560 HydrophobicContact CD1-CG1 4.2Å; L496-I560 HydrophobicContact CD2-CD1 3.88Å; L496-I560 HydrophobicContact CD2-CG1 4.03Å; L496-I560 HydrophobicContact CD2-CG2 4.03Å; L496-I560 HydrophobicContact CG-CD1 4.44Å; L556-I560 HydrophobicContact CD1-CD1 3.74Å; L556-I560 HydrophobicContact CD1-CG1 4.08Å; L556-I560 HydrophobicContact CG-CD1 3.74Å; L556-I560 HydrophobicContact CG-CG1 4.49Å; L556-I560 WeakPolarHBondContact O-CD1 3.17Å; L556-I560 VanDerWaalsContact O-CG1 3.25Å; L556-I560 WeakPolarHBondContact O-CG1 3.39Å; L556-I560 PolarHBondContact O-N 3.3Å; I560-E562 VanDerWaalsContact C-N 3.29Å; I560-E562 PolarHBondContact O-N 3.35Å; I560-M563 PolarHBondContact O-N 3.34Å; I560-E564 PolarHBondContact O-N 2.96Å; I560-L588 HydrophobicContact CG1-CD2 3.67Å
561	S	83	Confident	85.2	Confident	46 Å²	46	41.7 Å²	41.7	32%	0.322	22%	0.223	S	C	.	.	H	α-helix	trans	-60	-39.8	178.6	-59.1	0	0	0	0	111.8	S557 D558 L559 M565	S557-S561 WeakPolarHBondContact O-CB 3.39Å; S557-S561 PolarHBondContact O-N 3.47Å; S557-S561 PolarHBondContact O-OG 3.07Å; D558-S561 WeakPolarHBondContact O-CB 3.46Å; D558-S561 PolarHBondContact O-N 2.8Å; L559-S561 VanDerWaalsContact C-N 3.33Å; S561-M565 VanDerWaalsContact O-CB 3.3Å; S561-M565 WeakPolarHBondContact O-CB 3.34Å; S561-M565 PolarHBondContact O-N 2.89Å
562	E	85.7	Confident	86	Confident	14 Å²	14	42.4 Å²	42.4	7%	0.065	22%	0.223	C	C	.	.	H	α-helix	trans	-64.1	-47	174.9	-171.3	175.8	179.6	0	0	112.2	K545 D558 L559 I560 E564 M565 M566 F673	K545-E562 WeakPolarHBondContact CE-OE2 3.37Å; K545-E562 IonicContact NZ-OE1 2.93Å; K545-E562 PolarHBondContact NZ-OE1 3.47Å; K545-E562 IonicContact NZ-OE2 3.89Å; K545-E562 PolarHBondContact NZ-OE2 2.02Å; D558-E562 PolarHBondContact O-N 3.38Å; L559-E562 PolarHBondContact O-N 3.2Å; I560-E562 VanDerWaalsContact C-N 3.29Å; I560-E562 PolarHBondContact O-N 3.35Å; E562-E564 PolarHBondContact O-N 2.84Å; E562-M565 PolarHBondContact O-N 3.11Å; E562-M566 HydrophobicContact CG-SD 4.47Å; E562-M566 VanDerWaalsContact O-CG 3.32Å; E562-M566 WeakPolarHBondContact O-CG 3.15Å; E562-M566 PolarHBondContact O-N 2.88Å; E562-F673 HydrophobicContact CG-CB 3.93Å; E562-F673 PolarHBondContact OE1-N 2.93Å
563	M	89.2	Confident	86.7	Confident	3 Å²	3	45.1 Å²	45.1	2%	0.015	23%	0.229	C	C	.	.	H	α-helix	trans	-57	-50.3	177.4	-179.7	180	66.9	0	0	111.8	L559 I560 M566 K567 A581 T583 L588 V590	L559-M563 PolarHBondContact O-N 3.1Å; L559-M563 VanDerWaalsContact O-N 3.08Å; I560-M563 PolarHBondContact O-N 3.34Å; M563-M566 PolarHBondContact O-N 3.4Å; M563-K567 WeakPolarHBondContact O-CG 3.32Å; M563-K567 PolarHBondContact O-N 3.05Å; M563-A581 HydrophobicContact SD-CB 3.57Å; M563-A581 VanDerWaalsContact SD-CB 3.57Å; M563-T583 HydrophobicContact CE-CG2 4.11Å; M563-T583 HydrophobicContact SD-CG2 4.16Å; M563-L588 HydrophobicContact CE-CD1 4.39Å; M563-L588 HydrophobicContact SD-CD1 4.13Å; M563-V590 HydrophobicContact CB-CG1 4.19Å; M563-V590 HydrophobicContact CB-CG2 3.98Å; M563-V590 HydrophobicContact CG-CG1 4.28Å; M563-V590 HydrophobicContact CG-CG2 4.3Å; M563-V590 HydrophobicContact SD-CG2 4.23Å
564	E	87.9	Confident	87.6	Confident	81 Å²	81	41 Å²	41	38%	0.379	21%	0.21	S	C	.	.	H	α-helix	trans	-66.5	-36.6	179.4	-67.3	-56.5	131.1	0	0	112.2	I560 E562 M566 K567 M568	I560-E564 PolarHBondContact O-N 2.96Å; E562-E564 PolarHBondContact O-N 2.84Å; E564-M566 VanDerWaalsContact C-N 3.33Å; E564-M566 PolarHBondContact O-N 2.84Å; E564-K567 WeakPolarHBondContact O-CB 3.36Å; E564-K567 PolarHBondContact O-N 3.21Å; E564-K567 WeakPolarHBondContact OE1-CE 3.09Å; E564-K567 IonicContact OE1-NZ 2.72Å; E564-K567 PolarHBondContact OE1-NZ 3.26Å; E564-K567 IonicContact OE2-NZ 3.73Å; E564-M568 WeakPolarHBondContact O-CG 3.41Å; E564-M568 PolarHBondContact O-N 2.95Å; E564-M568 VanDerWaalsContact O-N 3.07Å
565	M	84.7	Confident	88.6	Confident	26 Å²	26	39.5 Å²	39.5	13%	0.128	20%	0.204	C	C	.	.	H	α-helix	trans	-61.3	-42.6	173.5	-169.2	77.1	-94.8	0	0	111.2	S561 E562 M568 I569 C650 A676	S561-M565 VanDerWaalsContact O-CB 3.3Å; S561-M565 WeakPolarHBondContact O-CB 3.34Å; S561-M565 PolarHBondContact O-N 2.89Å; E562-M565 PolarHBondContact O-N 3.11Å; M565-M568 HydrophobicContact CE-CB 4.06Å; M565-M568 PolarHBondContact O-N 2.92Å; M565-I569 HydrophobicContact CE-CG1 4.19Å; M565-I569 HydrophobicContact CG-CD1 3.94Å; M565-I569 WeakPolarHBondContact O-CD1 3.41Å; M565-I569 VanDerWaalsContact O-CG1 3.29Å; M565-I569 WeakPolarHBondContact O-CG1 3.44Å; M565-I569 PolarHBondContact O-N 3.3Å; M565-C650 HydrophobicContact CE-CB 4.48Å; M565-A676 HydrophobicContact CG-CB 4.33Å
566	M	89.8	Confident	89.2	Confident	11 Å²	11	39 Å²	39	5%	0.054	20%	0.201	C	C	.	.	H	α-helix	trans	-66.5	-35.4	176.4	-66.4	-177.9	80.2	0	0	113	E562 M563 E564 M568 G570 I576 L578 V592 F673	E562-M566 HydrophobicContact CG-SD 4.47Å; E562-M566 VanDerWaalsContact O-CG 3.32Å; E562-M566 WeakPolarHBondContact O-CG 3.15Å; E562-M566 PolarHBondContact O-N 2.88Å; M563-M566 PolarHBondContact O-N 3.4Å; E564-M566 VanDerWaalsContact C-N 3.33Å; E564-M566 PolarHBondContact O-N 2.84Å; M566-M568 VanDerWaalsContact C-N 3.31Å; M566-M568 PolarHBondContact O-N 2.86Å; M566-G570 PolarHBondContact O-N 2.95Å; M566-I576 HydrophobicContact CE-CG2 3.88Å; M566-I576 WeakPolarHBondContact CE-O 3.29Å; M566-L578 HydrophobicContact CB-CB 4.08Å; M566-L578 HydrophobicContact CB-CD2 4.4Å; M566-L578 HydrophobicContact CE-CB 4.28Å; M566-V592 HydrophobicContact CE-CB 4.5Å; M566-V592 HydrophobicContact CE-CG1 3.72Å; M566-V592 HydrophobicContact SD-CG1 4.1Å; M566-F673 HydrophobicContact CE-CD2 4.41Å; M566-F673 HydrophobicContact CG-CB 4.42Å; M566-F673 HydrophobicContact CG-CD2 3.87Å; M566-F673 HydrophobicContact CG-CG 4.38Å; M566-F673 HydrophobicContact SD-CD2 4.31Å
567	K	90.4	Very high	89.7	Confident	35 Å²	35	38.6 Å²	38.6	15%	0.152	20%	0.199	C	C	.	.	H	α-helix	trans	-60.2	-41.5	171	-67.9	-176.2	-173.7	174.7	0	111.7	D499 W502 M563 E564 L578	D499-K567 WeakPolarHBondContact OD2-CE 3.32Å; D499-K567 IonicContact OD2-NZ 3.76Å; D499-K567 PolarHBondContact OD2-NZ 2.61Å; W502-K567 HydrophobicContact CD2-CG 4.36Å; W502-K567 HydrophobicContact CG-CD 4.42Å; W502-K567 HydrophobicContact CG-CG 4.42Å; W502-K567 HydrophobicContact CZ2-CB 4.44Å; W502-K567 HydrophobicContact CZ2-CG 4.27Å; M563-K567 WeakPolarHBondContact O-CG 3.32Å; M563-K567 PolarHBondContact O-N 3.05Å; E564-K567 WeakPolarHBondContact O-CB 3.36Å; E564-K567 PolarHBondContact O-N 3.21Å; E564-K567 WeakPolarHBondContact OE1-CE 3.09Å; E564-K567 IonicContact OE1-NZ 2.72Å; E564-K567 PolarHBondContact OE1-NZ 3.26Å; E564-K567 IonicContact OE2-NZ 3.73Å; K567-L578 HydrophobicContact CG-CD2 3.64Å
568	M	86.9	Confident	90.4	Very high	133 Å²	133	36.1 Å²	36.1	66%	0.655	18%	0.181	S	C	*	.	H	α-helix	trans	-73.8	-38.4	-177.5	-74.6	-67.4	-71.3	0	0	113.8	E564 M565 M566 G570	E564-M568 WeakPolarHBondContact O-CG 3.41Å; E564-M568 PolarHBondContact O-N 2.95Å; E564-M568 VanDerWaalsContact O-N 3.07Å; M565-M568 HydrophobicContact CE-CB 4.06Å; M565-M568 PolarHBondContact O-N 2.92Å; M566-M568 VanDerWaalsContact C-N 3.31Å; M566-M568 PolarHBondContact O-N 2.86Å; M568-G570 VanDerWaalsContact C-N 3.33Å; M568-G570 PolarHBondContact O-N 3.31Å
569	I	89.2	Confident	91.1	Very high	3 Å²	3	37.6 Å²	37.6	2%	0.015	19%	0.189	C	C	.	.	H	α-helix	trans	-60.8	-43.6	177.1	-70.3	160	0	0	0	110.6	M565 I575 Y644 L645 K648 C650 F673	M565-I569 HydrophobicContact CE-CG1 4.19Å; M565-I569 HydrophobicContact CG-CD1 3.94Å; M565-I569 WeakPolarHBondContact O-CD1 3.41Å; M565-I569 VanDerWaalsContact O-CG1 3.29Å; M565-I569 WeakPolarHBondContact O-CG1 3.44Å; M565-I569 PolarHBondContact O-N 3.3Å; I569-I575 HydrophobicContact CG2-CD1 3.98Å; I569-Y644 HydrophobicContact CG2-CD1 4.31Å; I569-Y644 HydrophobicContact CG2-CE1 3.91Å; I569-Y644 WeakPolarHBondContact O-CE1 3.47Å; I569-Y644 PolarHBondContact O-OH 3.5Å; I569-L645 HydrophobicContact CB-CD2 4.49Å; I569-L645 HydrophobicContact CD1-CD2 3.68Å; I569-L645 HydrophobicContact CG1-CD2 3.86Å; I569-L645 HydrophobicContact CG2-CD2 3.75Å; I569-K648 WeakPolarHBondContact O-CD 3.43Å; I569-K648 WeakPolarHBondContact O-CE 3.47Å; I569-C650 HydrophobicContact CG1-CB 4.3Å; I569-F673 HydrophobicContact CD1-CD1 3.69Å; I569-F673 HydrophobicContact CD1-CE1 3.62Å; I569-F673 HydrophobicContact CD1-CG 4.23Å; I569-F673 HydrophobicContact CD1-CZ 4.11Å
570	G	89.4	Confident	91.5	Very high	27 Å²	27	37.2 Å²	37.2	28%	0.278	19%	0.187	S	C	.	.			trans	79.7	-163.9	-173.5	0	0	0	0	0	112.7	M566 M568	M566-G570 PolarHBondContact O-N 2.95Å; M568-G570 VanDerWaalsContact C-N 3.33Å; M568-G570 PolarHBondContact O-N 3.31Å
571	K	93.8	Very high	91.9	Very high	131 Å²	131	36 Å²	36	57%	0.57	18%	0.181	S	C	*	.			trans	-97.8	135.2	-170.1	-64	-170.3	176.6	-173.1	0	113.7	N577 Y644	K571-N577 VanDerWaalsContact CA-OD1 3.24Å; K571-N577 WeakPolarHBondContact CA-OD1 3.47Å; K571-N577 HydrophobicContact CG-CB 4.41Å; K571-Y644 PolarHBondContact O-OH 2.93Å
572	H	97.1	Very high	92.5	Very high	36 Å²	36	33.8 Å²	33.8	17%	0.167	17%	0.165	C	C	.	.			trans	-143.4	159.3	172.1	-172.8	-122.5	0	0	0	111.6	N574 I575 N577 R640 Y644	H572-N574 PolarHBondContact ND1-N 3.13Å; H572-I575 HydrophobicContact CB-CB 4.21Å; H572-I575 HydrophobicContact CB-CD1 3.85Å; H572-I575 HydrophobicContact CB-CG1 4.09Å; H572-N577 PolarHBondContact N-OD1 3.25Å; H572-N577 PolarHBondContact O-ND2 3.02Å; H572-N577 PolarHBondContact O-OD1 3.17Å; H572-R640 PolarHBondContact CE1-O 3.31Å; H572-R640 VanDerWaalsContact CE1-O 3.3Å; H572-Y644 HydrophobicContact CB-CD1 3.88Å; H572-Y644 HydrophobicContact CB-CD2 3.97Å; H572-Y644 HydrophobicContact CB-CE1 3.98Å; H572-Y644 HydrophobicContact CB-CE2 4.04Å; H572-Y644 HydrophobicContact CB-CG 3.86Å; H572-Y644 AromaticContact CD2-CD2 3.61Å; H572-Y644 AromaticContact CD2-CG 3.99Å; H572-Y644 AromaticContact CG-CD2 3.78Å; H572-Y644 AromaticContact CG-CG 3.73Å
573	K	96.9	Very high	92.8	Very high	128 Å²	128	33.9 Å²	33.9	56%	0.557	17%	0.167	S	C	*	.	T	Hydrogen-bonded Turn	trans	-64	-47.2	178.3	-175.5	177.9	179.7	-176.2	0	111	I575 V667 K669	K573-I575 PolarHBondContact O-N 3.06Å; K573-V667 HydrophobicContact CG-CG1 3.99Å; K573-K669 WeakPolarHBondContact O-CE 2.97Å; K573-K669 PolarHBondContact O-NZ 3.07Å
574	N	98.3	Very high	92.9	Very high	3 Å²	3	36.6 Å²	36.6	2%	0.016	18%	0.18	C	C	.	.	T	Hydrogen-bonded Turn	trans	-97.4	26.5	-170.9	-60.3	100.8	0	0	0	114.5	H572 Q637 M668 I670	H572-N574 PolarHBondContact ND1-N 3.13Å; N574-Q637 WeakPolarHBondContact CB-O 3.42Å; N574-Q637 VanDerWaalsContact CG-O 3.24Å; N574-Q637 WeakPolarHBondContact ND2-CB 3.46Å; N574-Q637 PolarHBondContact ND2-OE1 2.83Å; N574-Q637 VanDerWaalsContact ND2-OE1 3.09Å; N574-M668 WeakPolarHBondContact CA-O 3.44Å; N574-M668 WeakPolarHBondContact CB-O 3.5Å; N574-M668 PolarHBondContact ND2-O 3.08Å; N574-I670 PolarHBondContact O-N 3.3Å
575	I	96.9	Very high	92.8	Very high	3 Å²	3	40.6 Å²	40.6	2%	0.015	20%	0.204	C	C	.	.	B	Isolated β-bridge	trans	-125.9	147.5	171.6	-65.2	174.9	0	0	0	107.2	I569 H572 K573 N577 Y644 L645 K669 F673	I569-I575 HydrophobicContact CG2-CD1 3.98Å; H572-I575 HydrophobicContact CB-CB 4.21Å; H572-I575 HydrophobicContact CB-CD1 3.85Å; H572-I575 HydrophobicContact CB-CG1 4.09Å; K573-I575 PolarHBondContact O-N 3.06Å; I575-N577 PolarHBondContact O-N 3.46Å; I575-N577 PolarHBondContact O-ND2 3.49Å; I575-Y644 HydrophobicContact CD1-CD1 3.59Å; I575-Y644 HydrophobicContact CD1-CE1 4.22Å; I575-Y644 HydrophobicContact CD1-CG 4.35Å; I575-L645 HydrophobicContact CD1-CD1 4.41Å; I575-L645 HydrophobicContact CD1-CD2 3.85Å; I575-L645 HydrophobicContact CD1-CG 3.79Å; I575-K669 PolarHBondContact O-NZ 2.97Å; I575-F673 HydrophobicContact CG2-CE2 3.81Å; I575-F673 HydrophobicContact CG2-CZ 3.67Å
576	I	95.8	Very high	93	Very high	8 Å²	8	40.8 Å²	40.8	4%	0.041	21%	0.212	C	C	.	.			trans	-72.5	112.1	169.4	-153.4	71.6	0	0	0	107.9	M566 V592 E593 A595 L661 K669 I670 A671 F673	M566-I576 HydrophobicContact CE-CG2 3.88Å; M566-I576 WeakPolarHBondContact CE-O 3.29Å; I576-V592 HydrophobicContact CG1-CB 4.46Å; I576-V592 HydrophobicContact CG1-CG2 4.36Å; I576-E593 HydrophobicContact CD1-CB 3.83Å; I576-E593 WeakPolarHBondContact CD1-O 3.23Å; I576-E593 HydrophobicContact CG1-CB 4.26Å; I576-A595 HydrophobicContact CD1-CB 4.44Å; I576-L661 HydrophobicContact CD1-CD1 3.96Å; I576-L661 HydrophobicContact CG1-CD1 4.22Å; I576-K669 HydrophobicContact CB-CB 4.47Å; I576-K669 HydrophobicContact CD1-CB 4.21Å; I576-K669 HydrophobicContact CD1-CD 3.83Å; I576-I670 WeakPolarHBondContact CG2-O 3.33Å; I576-I670 PolarHBondContact N-O 3.27Å; I576-A671 HydrophobicContact CB-CB 4.11Å; I576-A671 HydrophobicContact CG2-CB 3.67Å; I576-F673 HydrophobicContact CG2-CE2 4.3Å
577	N	94.8	Very high	93	Very high	11 Å²	11	42.9 Å²	42.9	6%	0.059	23%	0.227	C	C	.	.			trans	-84.8	140.4	-172.2	-61	-66.3	0	0	0	111	K571 H572 I575 V592 E593 K669	K571-N577 VanDerWaalsContact CA-OD1 3.24Å; K571-N577 WeakPolarHBondContact CA-OD1 3.47Å; K571-N577 HydrophobicContact CG-CB 4.41Å; H572-N577 PolarHBondContact N-OD1 3.25Å; H572-N577 PolarHBondContact O-ND2 3.02Å; H572-N577 PolarHBondContact O-OD1 3.17Å; I575-N577 PolarHBondContact O-N 3.46Å; I575-N577 PolarHBondContact O-ND2 3.49Å; N577-V592 WeakPolarHBondContact O-CA 3.29Å; N577-E593 HydrophobicContact CB-CG 4.1Å; N577-E593 PolarHBondContact N-OE2 3.13Å; N577-E593 VanDerWaalsContact ND2-CD 3.27Å; N577-E593 PolarHBondContact ND2-OE1 2.93Å; N577-E593 PolarHBondContact ND2-OE2 3.16Å; N577-E593 VanDerWaalsContact ND2-OE2 3.15Å; N577-E593 PolarHBondContact O-N 3.14Å; N577-E593 VanDerWaalsContact O-N 3.13Å; N577-K669 PolarHBondContact ND2-NZ 2.97Å
578	L	94.9	Very high	93.1	Very high	6 Å²	6	42 Å²	42	3%	0.031	22%	0.223	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-64.8	136.6	164.8	-171.3	68	0	0	0	109.1	W502 M566 K567 G580 V590 V592	W502-L578 HydrophobicContact CD2-CD2 3.92Å; W502-L578 HydrophobicContact CE3-CB 4.49Å; W502-L578 HydrophobicContact CE3-CD2 3.66Å; W502-L578 HydrophobicContact CE3-CG 3.84Å; W502-L578 HydrophobicContact CH2-CB 4.17Å; W502-L578 HydrophobicContact CH2-CD2 4.05Å; W502-L578 HydrophobicContact CH2-CG 4.33Å; W502-L578 HydrophobicContact CZ2-CD2 4.31Å; W502-L578 HydrophobicContact CZ3-CB 3.84Å; W502-L578 HydrophobicContact CZ3-CD2 3.75Å; W502-L578 HydrophobicContact CZ3-CG 3.71Å; W502-L578 WeakPolarHBondContact CZ3-O 3.45Å; M566-L578 HydrophobicContact CB-CB 4.08Å; M566-L578 HydrophobicContact CB-CD2 4.4Å; M566-L578 HydrophobicContact CE-CB 4.28Å; K567-L578 HydrophobicContact CG-CD2 3.64Å; L578-G580 WeakPolarHBondContact CD1-O 3.27Å; L578-V590 HydrophobicContact CD1-CG1 3.66Å; L578-V592 HydrophobicContact CD1-CG1 4.24Å
579	L	94.8	Very high	93.5	Very high	47 Å²	47	37.8 Å²	37.8	25%	0.246	20%	0.201	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-112.9	-32	177.8	-59.9	-178.4	0	0	0	111.7	L531 V542 I591 E593	L531-L579 HydrophobicContact CD1-CB 4.2Å; L531-L579 HydrophobicContact CD1-CD1 4.17Å; L531-L579 HydrophobicContact CD2-CB 4.36Å; V542-L579 HydrophobicContact CB-CD1 4.43Å; V542-L579 HydrophobicContact CG1-CD1 3.57Å; L579-I591 HydrophobicContact CB-CG2 4.5Å; L579-I591 PolarHBondContact N-O 2.82Å; L579-E593 HydrophobicContact CD1-CG 4.21Å; L579-E593 HydrophobicContact CD2-CG 4.05Å; L579-E593 HydrophobicContact CG-CG 4.25Å
580	G	94.4	Very high	93.8	Very high	1 Å²	1	37.7 Å²	37.7	1%	0.01	20%	0.2	C	C	.	.	E	Extended strand (participates in β ladder)	trans	177.3	-172.5	175.1	0	0	0	0	0	111.9	W502 L578 I591	W502-G580 CarbonylContact O-C 3.06Å; W502-G580 WeakPolarHBondContact O-CA 3.29Å; L578-G580 WeakPolarHBondContact CD1-O 3.27Å; G580-I591 PolarHBondContact N-O 3.31Å; G580-I591 WeakPolarHBondContact O-CA 3.37Å; G580-I591 VanDerWaalsContact O-CB 3.31Å; G580-I591 WeakPolarHBondContact O-CB 3.47Å; G580-I591 PolarHBondContact O-N 3.22Å
581	A	95.6	Very high	94.1	Very high	2 Å²	2	36.4 Å²	36.4	2%	0.017	19%	0.187	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-146	162	171.5	0	0	0	0	0	110.6	W502 E503 L504 M563 T583 Y589	W502-A581 PolarHBondContact O-N 3.48Å; E503-A581 CarbonylContact C-O 3.6Å; E503-A581 WeakPolarHBondContact CA-O 3.3Å; L504-A581 PolarHBondContact N-O 3.07Å; M563-A581 HydrophobicContact SD-CB 3.57Å; M563-A581 VanDerWaalsContact SD-CB 3.57Å; A581-T583 HydrophobicContact CB-CG2 4.02Å; A581-Y589 CarbonylContact C-O 3.51Å; A581-Y589 WeakPolarHBondContact CA-O 3.22Å; A581-Y589 WeakPolarHBondContact CB-O 3.33Å
582	C	95.1	Very high	94.1	Very high	0 Å²	0	31.1 Å²	31.1	0%	0	17%	0.166	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-116.7	104.2	160	-51	0	0	0	0	107.2	E503 L504 R506 L588 Y589	E503-C582 WeakPolarHBondContact OE1-CA 3.45Å; L504-C582 PolarHBondContact O-SG 2.74Å; R506-C582 HydrophobicContact CG-CB 3.94Å; R506-C582 PolarHBondContact NH2-O 3.43Å; C582-L588 WeakPolarHBondContact O-CA 3.39Å; C582-Y589 HydrophobicContact CB-CD2 4.12Å; C582-Y589 HydrophobicContact CB-CG 4.48Å; C582-Y589 PolarHBondContact N-O 2.95Å; C582-Y589 PolarHBondContact O-N 3.37Å; C582-Y589 VanDerWaalsContact O-N 3.09Å
583	T	93.6	Very high	94.1	Very high	17 Å²	17	31.6 Å²	31.6	10%	0.104	17%	0.168	C	C	.	.			trans	-102.3	-31.3	-177.6	64.8	0	0	0	0	112.4	L496 E503 M563 A581 L588	L496-T583 HydrophobicContact CD1-CG2 4.3Å; E503-T583 VanDerWaalsContact CD-N 3.29Å; E503-T583 VanDerWaalsContact CD-OG1 3.31Å; E503-T583 PolarHBondContact OE1-N 2.82Å; E503-T583 WeakPolarHBondContact OE2-CB 3.36Å; E503-T583 WeakPolarHBondContact OE2-CG2 3.37Å; E503-T583 PolarHBondContact OE2-N 3.36Å; E503-T583 PolarHBondContact OE2-OG1 3.49Å; M563-T583 HydrophobicContact CE-CG2 4.11Å; M563-T583 HydrophobicContact SD-CG2 4.16Å; A581-T583 HydrophobicContact CB-CG2 4.02Å; T583-L588 HydrophobicContact CG2-CD1 3.97Å
584	Q	90.3	Very high	94	Very high	59 Å²	59	28.7 Å²	28.7	28%	0.276	15%	0.154	S	C	.	.	S	Bend	trans	-92.5	157.5	-175.5	-53.3	-53.1	-61.9	0	0	112.5	L496 E498 E503 R506 G586	L496-Q584 PolarHBondContact O-NE2 2.77Å; E498-Q584 HydrophobicContact CB-CG 4.16Å; E498-Q584 HydrophobicContact CG-CG 4.01Å; E503-Q584 PolarHBondContact OE1-N 3.25Å; R506-Q584 PolarHBondContact NE-O 3.2Å; R506-Q584 PolarHBondContact NH2-O 3.19Å; Q584-G586 VanDerWaalsContact C-N 3.32Å; Q584-G586 PolarHBondContact O-N 3.21Å; Q584-G586 VanDerWaalsContact O-N 3.12Å
585	D	86.9	Confident	93.9	Very high	165 Å²	165	29.1 Å²	29.1	88%	0.882	16%	0.158	S	C	*	.	S	Bend	trans	47.9	41.4	170.1	-63	-40.8	0	0	0	116.1	R506	R506-D585 PolarHBondContact NE-O 2.82Å
586	G	87.9	Confident	93.8	Very high	30 Å²	30	30.9 Å²	30.9	31%	0.309	17%	0.17	S	C	.	.	S	Bend	trans	156.7	-165.7	175.2	0	0	0	0	0	114.6	R506 Q584	R506-G586 PolarHBondContact NH2-O 3.16Å; Q584-G586 VanDerWaalsContact C-N 3.32Å; Q584-G586 PolarHBondContact O-N 3.21Å; Q584-G586 VanDerWaalsContact O-N 3.12Å
587	P	90.7	Very high	93.7	Very high	56 Å²	56	34.1 Å²	34.1	36%	0.364	18%	0.184	S	C	.	.	S	Bend	trans	-66.6	144.9	-179.7	28.5	-35.4	0	0	0	112	M487 R506 Y589	M487-P587 HydrophobicContact CE-CB 4.13Å; M487-P587 HydrophobicContact CE-CG 4.45Å; R506-P587 VanDerWaalsContact CZ-O 3.31Å; R506-P587 PolarHBondContact NH1-O 3.2Å; R506-P587 PolarHBondContact NH2-O 3.35Å; P587-Y589 HydrophobicContact CB-CE1 4.15Å; P587-Y589 HydrophobicContact CG-CE1 3.74Å; P587-Y589 HydrophobicContact CG-CE2 4.43Å; P587-Y589 PolarHBondContact O-N 2.99Å
588	L	92.3	Very high	93.6	Very high	15 Å²	15	35.1 Å²	35.1	8%	0.079	20%	0.197	C	C	.	.			trans	-63.9	121.1	176.4	177.3	60.3	0	0	0	111	L496 L556 L559 I560 M563 C582 T583 V590	L496-L588 HydrophobicContact CD1-CD1 3.9Å; L496-L588 HydrophobicContact CD1-CD2 4.17Å; L496-L588 HydrophobicContact CD1-CG 4.49Å; L556-L588 HydrophobicContact CD1-CB 4.47Å; L556-L588 HydrophobicContact CD1-CD2 4Å; L559-L588 HydrophobicContact CD2-CD2 3.97Å; L559-L588 HydrophobicContact CD2-CG 4.27Å; L559-L588 HydrophobicContact CG-CD2 4Å; I560-L588 HydrophobicContact CG1-CD2 3.67Å; M563-L588 HydrophobicContact CE-CD1 4.39Å; M563-L588 HydrophobicContact SD-CD1 4.13Å; C582-L588 WeakPolarHBondContact O-CA 3.39Å; T583-L588 HydrophobicContact CG2-CD1 3.97Å; L588-V590 HydrophobicContact CD1-CG2 4.41Å; L588-V590 HydrophobicContact CG-CG2 4.3Å
589	Y	94.9	Very high	93.6	Very high	45 Å²	45	36.1 Å²	36.1	18%	0.176	20%	0.202	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-117.6	122.3	172.2	-65.1	-24.4	0	0	0	109.7	L509 L511 V544 M546 A581 C582 P587	L509-Y589 HydrophobicContact CD2-CD2 3.86Å; L511-Y589 HydrophobicContact CD1-CE1 4.46Å; L511-Y589 HydrophobicContact CD1-CE2 4.14Å; V544-Y589 HydrophobicContact CG1-CD1 4.23Å; V544-Y589 HydrophobicContact CG1-CG 3.99Å; M546-Y589 HydrophobicContact CB-CD1 3.77Å; M546-Y589 HydrophobicContact CB-CE1 4.07Å; M546-Y589 HydrophobicContact CE-CD1 3.75Å; M546-Y589 HydrophobicContact CE-CE1 3.64Å; M546-Y589 HydrophobicContact SD-CD1 4.32Å; M546-Y589 HydrophobicContact SD-CE1 3.83Å; A581-Y589 CarbonylContact C-O 3.51Å; A581-Y589 WeakPolarHBondContact CA-O 3.22Å; A581-Y589 WeakPolarHBondContact CB-O 3.33Å; C582-Y589 HydrophobicContact CB-CD2 4.12Å; C582-Y589 HydrophobicContact CB-CG 4.48Å; C582-Y589 PolarHBondContact N-O 2.95Å; C582-Y589 PolarHBondContact O-N 3.37Å; C582-Y589 VanDerWaalsContact O-N 3.09Å; P587-Y589 HydrophobicContact CB-CE1 4.15Å; P587-Y589 HydrophobicContact CG-CE1 3.74Å; P587-Y589 HydrophobicContact CG-CE2 4.43Å; P587-Y589 PolarHBondContact O-N 2.99Å
590	V	94.6	Very high	93.6	Very high	2 Å²	2	33.9 Å²	33.9	1%	0.012	19%	0.191	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-103.8	117.8	174.7	-174.5	0	0	0	0	108.3	V544 K545 L559 M563 L578 L588 V592	V544-V590 WeakPolarHBondContact CA-O 3.38Å; K545-V590 HydrophobicContact CB-CB 4.4Å; K545-V590 PolarHBondContact N-O 3.1Å; K545-V590 PolarHBondContact O-N 3.15Å; L559-V590 HydrophobicContact CD1-CB 4.45Å; L559-V590 HydrophobicContact CD1-CG2 3.79Å; L559-V590 HydrophobicContact CG-CG2 4.05Å; M563-V590 HydrophobicContact CB-CG1 4.19Å; M563-V590 HydrophobicContact CB-CG2 3.98Å; M563-V590 HydrophobicContact CG-CG1 4.28Å; M563-V590 HydrophobicContact CG-CG2 4.3Å; M563-V590 HydrophobicContact SD-CG2 4.23Å; L578-V590 HydrophobicContact CD1-CG1 3.66Å; L588-V590 HydrophobicContact CD1-CG2 4.41Å; L588-V590 HydrophobicContact CG-CG2 4.3Å; V590-V592 HydrophobicContact CG1-CG1 4.33Å
591	I	95.8	Very high	93.6	Very high	0 Å²	0	37.6 Å²	37.6	0%	0	20%	0.204	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-107.6	116.5	-166.6	-47.7	172.9	0	0	0	109.6	L504 L509 V542 V544 L579 G580	L504-I591 HydrophobicContact CB-CD1 3.97Å; L504-I591 HydrophobicContact CD2-CD1 3.47Å; L504-I591 VanDerWaalsContact CD2-CD1 3.47Å; L504-I591 HydrophobicContact CG-CD1 4.35Å; L509-I591 HydrophobicContact CD1-CD1 4.24Å; L509-I591 HydrophobicContact CD2-CD1 3.88Å; L509-I591 HydrophobicContact CD2-CG1 4.35Å; V542-I591 HydrophobicContact CB-CG2 3.87Å; V542-I591 HydrophobicContact CG1-CG2 4.24Å; V542-I591 HydrophobicContact CG2-CG2 3.66Å; V544-I591 HydrophobicContact CG2-CG1 4.39Å; V544-I591 HydrophobicContact CG2-CG2 4.4Å; L579-I591 HydrophobicContact CB-CG2 4.5Å; L579-I591 PolarHBondContact N-O 2.82Å; G580-I591 PolarHBondContact N-O 3.31Å; G580-I591 WeakPolarHBondContact O-CA 3.37Å; G580-I591 VanDerWaalsContact O-CB 3.31Å; G580-I591 WeakPolarHBondContact O-CB 3.47Å; G580-I591 PolarHBondContact O-N 3.22Å
592	V	95.6	Very high	93.4	Very high	19 Å²	19	43.3 Å²	43.3	12%	0.115	23%	0.231	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-127.3	165.6	-173.1	-54	0	0	0	0	111.5	V542 A543 M566 I576 N577 L578 V590	V542-V592 WeakPolarHBondContact CB-O 3.38Å; A543-V592 HydrophobicContact CB-CG2 3.91Å; A543-V592 PolarHBondContact N-O 2.85Å; A543-V592 PolarHBondContact O-N 2.82Å; M566-V592 HydrophobicContact CE-CB 4.5Å; M566-V592 HydrophobicContact CE-CG1 3.72Å; M566-V592 HydrophobicContact SD-CG1 4.1Å; I576-V592 HydrophobicContact CG1-CB 4.46Å; I576-V592 HydrophobicContact CG1-CG2 4.36Å; N577-V592 WeakPolarHBondContact O-CA 3.29Å; L578-V592 HydrophobicContact CD1-CG1 4.24Å; V590-V592 HydrophobicContact CG1-CG1 4.33Å
593	E	95.4	Very high	93.4	Very high	47 Å²	47	43.9 Å²	43.9	22%	0.22	23%	0.233	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-52.4	140.8	173.3	-70.6	171.1	149.1	0	0	112.4	I576 N577 L579 K669	I576-E593 HydrophobicContact CD1-CB 3.83Å; I576-E593 WeakPolarHBondContact CD1-O 3.23Å; I576-E593 HydrophobicContact CG1-CB 4.26Å; N577-E593 HydrophobicContact CB-CG 4.1Å; N577-E593 PolarHBondContact N-OE2 3.13Å; N577-E593 VanDerWaalsContact ND2-CD 3.27Å; N577-E593 PolarHBondContact ND2-OE1 2.93Å; N577-E593 PolarHBondContact ND2-OE2 3.16Å; N577-E593 VanDerWaalsContact ND2-OE2 3.15Å; N577-E593 PolarHBondContact O-N 3.14Å; N577-E593 VanDerWaalsContact O-N 3.13Å; L579-E593 HydrophobicContact CD1-CG 4.21Å; L579-E593 HydrophobicContact CD2-CG 4.05Å; L579-E593 HydrophobicContact CG-CG 4.25Å; E593-K669 VanDerWaalsContact CD-NZ 3.32Å; E593-K669 IonicContact OE1-NZ 2.88Å; E593-K669 PolarHBondContact OE1-NZ 3.23Å; E593-K669 WeakPolarHBondContact OE2-CE 3.36Å; E593-K669 IonicContact OE2-NZ 3.97Å; E593-K669 PolarHBondContact OE2-NZ 3.31Å
594	Y	95.8	Very high	93.4	Very high	66 Å²	66	43 Å²	43	26%	0.259	23%	0.228	S	C	.	.			trans	-87.2	131.2	171.8	176.7	-122.4	0	0	0	111.1	L515 L525 K541	L515-Y594 HydrophobicContact CD1-CD2 3.79Å; L515-Y594 HydrophobicContact CD1-CE2 3.62Å; L515-Y594 HydrophobicContact CD2-CE2 3.85Å; L515-Y594 HydrophobicContact CG-CE2 4.41Å; L525-Y594 HydrophobicContact CD1-CD1 4.07Å; L525-Y594 HydrophobicContact CD1-CD2 3.77Å; L525-Y594 HydrophobicContact CD1-CE1 4.1Å; L525-Y594 HydrophobicContact CD1-CE2 3.81Å; L525-Y594 HydrophobicContact CD1-CG 3.91Å; K541-Y594 HydrophobicContact CB-CD1 4.19Å
595	A	95.8	Very high	93.4	Very high	12 Å²	12	43.9 Å²	43.9	10%	0.099	23%	0.232	C	C	.	.			trans	-111.2	107.7	174.7	0	0	0	0	0	109.3	I576 K597 L661 V662	I576-A595 HydrophobicContact CD1-CB 4.44Å; A595-K597 PolarHBondContact O-N 2.93Å; A595-L661 HydrophobicContact CB-CB 3.63Å; A595-L661 HydrophobicContact CB-CD1 4.25Å; A595-L661 HydrophobicContact CB-CG 4.48Å; A595-V662 CarbonylContact C-O 3.59Å
596	S	94.7	Very high	93.5	Very high	40 Å²	40	37.7 Å²	37.7	28%	0.28	20%	0.204	S	C	.	.	T	Hydrogen-bonded Turn	trans	-75.4	-17.3	-166.4	49.1	0	0	0	0	115.4	V662 E664	S596-V662 PolarHBondContact N-O 3.38Å; S596-E664 WeakPolarHBondContact OG-CA 3.38Å; S596-E664 WeakPolarHBondContact OG-CB 2.97Å; S596-E664 PolarHBondContact OG-N 3.09Å; S596-E664 PolarHBondContact OG-OE2 3Å
597	K	94.2	Very high	93.5	Very high	77 Å²	77	37.5 Å²	37.5	34%	0.335	19%	0.194	S	C	.	.	T	Hydrogen-bonded Turn	trans	-101.4	15	-178.9	-68.2	178.2	172.5	163.1	0	113.8	A595 Y603 V662 T663 E664 N666	A595-K597 PolarHBondContact O-N 2.93Å; K597-Y603 HydrophobicContact CB-CD2 4.18Å; K597-Y603 HydrophobicContact CD-CD2 4.37Å; K597-Y603 HydrophobicContact CD-CE2 3.98Å; K597-V662 HydrophobicContact CB-CB 3.91Å; K597-V662 HydrophobicContact CB-CG1 3.96Å; K597-V662 WeakPolarHBondContact CB-O 3.47Å; K597-V662 HydrophobicContact CD-CG1 4.22Å; K597-V662 PolarHBondContact N-O 2.8Å; K597-T663 WeakPolarHBondContact CD-O 3.35Å; K597-E664 WeakPolarHBondContact CE-O 3.43Å; K597-E664 PolarHBondContact NZ-O 3.06Å; K597-N666 PolarHBondContact NZ-OD1 2.61Å
598	G	92.5	Very high	93.2	Very high	31 Å²	31	36.2 Å²	36.2	32%	0.32	18%	0.182	S	C	.	.			trans	73.5	-150.2	173.8	0	0	0	0	0	113.7	L661 V662	G598-L661 WeakPolarHBondContact O-CA 3.48Å; G598-V662 PolarHBondContact O-N 3.02Å
599	N	94.4	Very high	92.5	Very high	28 Å²	28	37.2 Å²	37.2	15%	0.15	19%	0.189	C	C	.	.	B	Isolated β-bridge	trans	-89.3	153.4	176.6	70.3	76.7	0	0	0	112.4	R601 E602 Y603 R658 V660 L661	N599-R601 VanDerWaalsContact C-N 3.27Å; N599-R601 PolarHBondContact O-N 3.01Å; N599-R601 WeakPolarHBondContact OD1-CB 3.22Å; N599-R601 PolarHBondContact OD1-N 2.88Å; N599-E602 PolarHBondContact ND2-OE1 2.85Å; N599-E602 PolarHBondContact O-N 3.46Å; N599-E602 PolarHBondContact OD1-N 3.31Å; N599-Y603 WeakPolarHBondContact O-CB 3.43Å; N599-Y603 PolarHBondContact O-N 3.28Å; N599-R658 WeakPolarHBondContact CB-O 3.02Å; N599-V660 CarbonylContact C-O 3.41Å; N599-V660 WeakPolarHBondContact CA-O 3.34Å; N599-L661 HydrophobicContact CB-CD2 4.15Å
600	L	96.1	Very high	91.2	Very high	0 Å²	0	39.9 Å²	39.9	0%	0	21%	0.212	C	C	.	.	H	α-helix	trans	-61.6	-33.8	-174.7	177.8	58.6	0	0	0	112.1	Y603 L604 A657 V660 V662 M668 L720 I724	L600-Y603 HydrophobicContact CD1-CD1 4Å; L600-Y603 PolarHBondContact O-N 2.95Å; L600-L604 HydrophobicContact CD1-CD1 3.95Å; L600-L604 HydrophobicContact CD1-CD2 4.29Å; L600-L604 HydrophobicContact CD1-CG 3.8Å; L600-L604 HydrophobicContact CG-CD1 3.84Å; L600-L604 HydrophobicContact CG-CG 4.21Å; L600-L604 WeakPolarHBondContact O-CB 3.18Å; L600-L604 WeakPolarHBondContact O-CD1 3.36Å; L600-L604 WeakPolarHBondContact O-CG 3.47Å; L600-L604 PolarHBondContact O-N 2.62Å; L600-A657 WeakPolarHBondContact CB-O 3.48Å; L600-A657 PolarHBondContact N-O 3.49Å; L600-V660 HydrophobicContact CB-CB 3.93Å; L600-V660 HydrophobicContact CB-CG1 4.13Å; L600-V660 HydrophobicContact CD2-CB 4.01Å; L600-V660 HydrophobicContact CD2-CG1 3.9Å; L600-V660 PolarHBondContact N-O 3.18Å; L600-V662 HydrophobicContact CB-CG2 4.21Å; L600-V662 HydrophobicContact CD1-CG2 4.19Å; L600-M668 HydrophobicContact CD1-SD 3.74Å; L600-M668 HydrophobicContact CD2-SD 4.24Å; L600-M668 HydrophobicContact CG-SD 4.5Å; L600-L720 HydrophobicContact CD2-CD1 4.4Å; L600-I724 HydrophobicContact CD2-CD1 4.26Å; L600-I724 HydrophobicContact CD2-CG1 4.14Å
601	R	93.8	Very high	89.6	Confident	78 Å²	78	43.6 Å²	43.6	29%	0.294	25%	0.25	S	S	.	.	H	α-helix	trans	-63	-48.2	178.3	-166.7	-179	-171.2	-161.9	5.5	112	N599 Q605 A657 G728	N599-R601 VanDerWaalsContact C-N 3.27Å; N599-R601 PolarHBondContact O-N 3.01Å; N599-R601 WeakPolarHBondContact OD1-CB 3.22Å; N599-R601 PolarHBondContact OD1-N 2.88Å; R601-Q605 WeakPolarHBondContact O-CB 3.44Å; R601-Q605 VanDerWaalsContact O-CG 3.26Å; R601-Q605 WeakPolarHBondContact O-CG 3.19Å; R601-Q605 PolarHBondContact O-N 3.11Å; R601-A657 HydrophobicContact CB-CB 3.91Å; R601-A657 PolarHBondContact N-O 2.87Å; R601-G728 PolarHBondContact NE-O 3.17Å
602	E	91.9	Very high	87.8	Confident	122 Å²	122	46.9 Å²	46.9	57%	0.57	27%	0.267	S	S	*	.	H	α-helix	trans	-67.1	-42.6	176.3	-77.2	160.6	-137.7	0	0	111.6	N599 L604 Q605 A606	N599-E602 PolarHBondContact ND2-OE1 2.85Å; N599-E602 PolarHBondContact O-N 3.46Å; N599-E602 PolarHBondContact OD1-N 3.31Å; E602-L604 VanDerWaalsContact C-N 3.32Å; E602-L604 PolarHBondContact O-N 3.09Å; E602-Q605 PolarHBondContact O-N 2.94Å; E602-A606 WeakPolarHBondContact O-CB 3.4Å; E602-A606 PolarHBondContact O-N 2.83Å
603	Y	94.1	Very high	85.4	Confident	12 Å²	12	54.4 Å²	54.4	5%	0.047	30%	0.301	C	S	.	.	H	α-helix	trans	-56.6	-42.2	176.3	173.9	-94.9	0	0	0	113.2	K597 N599 L600 R607 L626 V662 N666	K597-Y603 HydrophobicContact CB-CD2 4.18Å; K597-Y603 HydrophobicContact CD-CD2 4.37Å; K597-Y603 HydrophobicContact CD-CE2 3.98Å; N599-Y603 WeakPolarHBondContact O-CB 3.43Å; N599-Y603 PolarHBondContact O-N 3.28Å; L600-Y603 HydrophobicContact CD1-CD1 4Å; L600-Y603 PolarHBondContact O-N 2.95Å; Y603-R607 VanDerWaalsContact CD2-NH1 3.35Å; Y603-R607 PolarHBondContact O-NH1 3.42Å; Y603-L626 HydrophobicContact CE1-CD1 4.07Å; Y603-L626 HydrophobicContact CE1-CD2 4.08Å; Y603-V662 HydrophobicContact CD1-CG2 4.22Å; Y603-V662 HydrophobicContact CD2-CB 4.46Å; Y603-V662 HydrophobicContact CD2-CG1 4.08Å; Y603-V662 HydrophobicContact CD2-CG2 4.47Å; Y603-V662 HydrophobicContact CE2-CG1 4.08Å; Y603-V662 HydrophobicContact CG-CB 4.47Å; Y603-V662 HydrophobicContact CG-CG1 4.35Å; Y603-V662 HydrophobicContact CG-CG2 4Å; Y603-N666 PolarHBondContact OH-OD1 2.82Å
604	L	93.4	Very high	83.1	Confident	0 Å²	0	59.7 Å²	59.7	0%	0	32%	0.32	C	S	.	.	H	α-helix	trans	-69	-44.6	174.8	-71.1	166	0	0	0	111.8	L600 E602 A606 R607 L626 L631 I724 L727	L600-L604 HydrophobicContact CD1-CD1 3.95Å; L600-L604 HydrophobicContact CD1-CD2 4.29Å; L600-L604 HydrophobicContact CD1-CG 3.8Å; L600-L604 HydrophobicContact CG-CD1 3.84Å; L600-L604 HydrophobicContact CG-CG 4.21Å; L600-L604 WeakPolarHBondContact O-CB 3.18Å; L600-L604 WeakPolarHBondContact O-CD1 3.36Å; L600-L604 WeakPolarHBondContact O-CG 3.47Å; L600-L604 PolarHBondContact O-N 2.62Å; E602-L604 VanDerWaalsContact C-N 3.32Å; E602-L604 PolarHBondContact O-N 3.09Å; L604-A606 VanDerWaalsContact C-N 3.33Å; L604-A606 PolarHBondContact O-N 2.86Å; L604-R607 PolarHBondContact O-N 3.49Å; L604-R607 VanDerWaalsContact O-N 3.16Å; L604-L626 HydrophobicContact CD2-CD1 3.59Å; L604-L631 HydrophobicContact CD2-CD2 3.79Å; L604-I724 HydrophobicContact CD1-CG1 4.34Å; L604-L727 HydrophobicContact CD2-CD2 4.19Å
605	Q	90.6	Very high	80.5	Confident	76 Å²	76	60 Å²	60	36%	0.355	33%	0.332	S	S	.	.	H	α-helix	trans	-64.5	-36.1	-178.4	-76	176.4	1.6	0	0	112.4	R601 E602 R607 R608 G728	R601-Q605 WeakPolarHBondContact O-CB 3.44Å; R601-Q605 VanDerWaalsContact O-CG 3.26Å; R601-Q605 WeakPolarHBondContact O-CG 3.19Å; R601-Q605 PolarHBondContact O-N 3.11Å; E602-Q605 PolarHBondContact O-N 2.94Å; Q605-R607 PolarHBondContact O-N 2.92Å; Q605-R608 WeakPolarHBondContact O-CG 3.38Å; Q605-R608 PolarHBondContact O-N 3.37Å; Q605-G728 PolarHBondContact NE2-O 3.05Å
606	A	88.2	Confident	77.9	Confident	36 Å²	36	70.1 Å²	70.1	30%	0.298	37%	0.369	S	S	.	.	T	Hydrogen-bonded Turn	trans	-66.8	-12.8	175.9	0	0	0	0	0	114.6	E602 L604 E623	E602-A606 WeakPolarHBondContact O-CB 3.4Å; E602-A606 PolarHBondContact O-N 2.83Å; L604-A606 VanDerWaalsContact C-N 3.33Å; L604-A606 PolarHBondContact O-N 2.86Å; A606-E623 PolarHBondContact O-N 3.34Å
607	R	88.9	Confident	75.3	Confident	26 Å²	26	74.5 Å²	74.5	10%	0.098	39%	0.389	C	S	.	.	T	Hydrogen-bonded Turn	trans	-114.5	15.9	-177.4	-67.8	171.8	172.5	53.7	18.5	113.3	Y603 L604 Q605 E623 E624 L626	Y603-R607 VanDerWaalsContact CD2-NH1 3.35Å; Y603-R607 PolarHBondContact O-NH1 3.42Å; L604-R607 PolarHBondContact O-N 3.49Å; L604-R607 VanDerWaalsContact O-N 3.16Å; Q605-R607 PolarHBondContact O-N 2.92Å; R607-E623 HydrophobicContact CG-CB 4.04Å; R607-E623 IonicContact CZ-OE2 2.68Å; R607-E623 IonicContact NH1-OE2 2.62Å; R607-E623 PolarHBondContact NH1-OE2 3.23Å; R607-E623 IonicContact NH2-OE2 2.66Å; R607-E623 PolarHBondContact NH2-OE2 3.34Å; R607-E624 WeakPolarHBondContact CD-O 3.16Å; R607-E624 WeakPolarHBondContact CG-O 3.49Å; R607-L626 HydrophobicContact CB-CD1 4.31Å; R607-L626 HydrophobicContact CB-CG 4.05Å; R607-L626 HydrophobicContact CG-CG 4.45Å
608	R	84.8	Confident	72.8	Confident	29 Å²	29	77.1 Å²	77.1	11%	0.109	41%	0.414	C	S	.	.	P	Polyproline II helix	trans	-67.2	138.5	175.4	-76.4	174.3	167.5	-155.9	-15.2	111.1	Q605 T726 L727	Q605-R608 WeakPolarHBondContact O-CG 3.38Å; Q605-R608 PolarHBondContact O-N 3.37Å; R608-T726 PolarHBondContact NH2-O 3.11Å; R608-L727 HydrophobicContact CG-CB 3.78Å; R608-L727 HydrophobicContact CG-CD1 4.07Å; R608-L727 VanDerWaalsContact CZ-O 3.31Å; R608-L727 PolarHBondContact NE-O 2.76Å; R608-L727 PolarHBondContact NH2-O 3.18Å; R608-L727 VanDerWaalsContact NH2-O 3.1Å
609	P	77.6	Confident	70.5	Confident	36 Å²	36	80.8 Å²	80.8	23%	0.234	44%	0.435	C	S	.	.	P	Polyproline II helix	trans	-64.6	142.6	171.5	28.3	-34.3	0	0	0	110.3	L612	P609-L612 HydrophobicContact CG-CD1 4.45Å
610	P	66.6	Low	68.2	Low	100 Å²	100	85.9 Å²	85.9	65%	0.649	46%	0.458	S	S	*	.	T	Hydrogen-bonded Turn	trans	-57.3	140.7	175.1	-25	34.7	0	0	0	112.2	P622	P610-P622 HydrophobicContact CG-CG 4.4Å
611	G	60.8	Low	66	Low	80 Å²	80	92.8 Å²	92.8	83%	0.825	49%	0.494	S	S	*	.	T	Hydrogen-bonded Turn	trans	94.8	-5.1	175.9	0	0	0	0	0	116.2
612	L	58.9	Low	64.2	Low	69 Å²	69	92.3 Å²	92.3	36%	0.361	50%	0.501	S	S	.	.			trans	-68.5	142.4	168	-127.9	76.7	0	0	0	110.8	P609 Y614	P609-L612 HydrophobicContact CG-CD1 4.45Å; L612-Y614 PolarHBondContact O-N 2.91Å
613	E	45.3	Very low	62.9	Low	177 Å²	177	90.7 Å²	90.7	83%	0.827	49%	0.494	S	S	*	.	T	Hydrogen-bonded Turn	trans	-67.4	13.2	-163.5	-153.2	170.1	-152	0	0	116.5
614	Y	46.4	Very low	61.9	Low	158 Å²	158	98.5 Å²	98.5	62%	0.62	53%	0.531	S	S	*	.	T	Hydrogen-bonded Turn	trans	-135.3	29.3	-173.2	-68.7	-85.9	0	0	0	113.4	L612	L612-Y614 PolarHBondContact O-N 2.91Å
615	C	42.5	Very low	61.4	Low	73 Å²	73	104 Å²	104	49%	0.493	56%	0.556	S	S	.	*			trans	-102.4	96.8	178.8	-71.9	0	0	0	0	111.8
616	Y	39.9	Very low	61.2	Low	225 Å²	225	101.7 Å²	101.7	88%	0.882	55%	0.547	S	S	*	.			trans	-91.1	-1.2	-176.7	-143.1	-91.3	0	0	0	115
617	N	40.2	Very low	61.3	Low	131 Å²	131	102.3 Å²	102.3	70%	0.701	55%	0.548	S	S	*	.			trans	-119.2	105.9	-179.3	-85.5	-19.8	0	0	0	111.2	S619	N617-S619 PolarHBondContact O-N 2.88Å; N617-S619 VanDerWaalsContact O-N 3.08Å
618	P	42.4	Very low	61.3	Low	132 Å²	132	104.7 Å²	104.7	86%	0.857	57%	0.569	S	S	*	*	T	Hydrogen-bonded Turn	trans	-71.5	5.7	178	-19.8	33.5	0	0	0	115.7
619	S	43.2	Very low	61.6	Low	109 Å²	109	106.2 Å²	106.2	76%	0.762	58%	0.576	S	S	*	*	T	Hydrogen-bonded Turn	trans	-113.7	-0.6	-158.3	-47.2	0	0	0	0	115.4	N617	N617-S619 PolarHBondContact O-N 2.88Å; N617-S619 VanDerWaalsContact O-N 3.08Å
620	H	47.8	Very low	62.4	Low	135 Å²	135	107.5 Å²	107.5	63%	0.625	58%	0.582	S	S	*	*	P	Polyproline II helix	trans	-102.8	123.9	179.6	-118.1	-92.9	0	0	0	110.7
621	N	49.6	Very low	63.7	Low	145 Å²	145	102.9 Å²	102.9	78%	0.775	55%	0.551	S	S	*	*	P	Polyproline II helix	trans	-60.7	130.5	155.4	-69.4	-8.1	0	0	0	106.8	E623	N621-E623 PolarHBondContact O-N 2.97Å
622	P	55.1	Low	65.4	Low	68 Å²	68	99.3 Å²	99.3	44%	0.442	51%	0.513	S	S	.	.	P	Polyproline II helix	trans	-62.7	131.1	177.4	25.4	-32.8	0	0	0	109.3	P610	P610-P622 HydrophobicContact CG-CG 4.4Å
623	E	63.7	Low	67.1	Low	87 Å²	87	97.9 Å²	97.9	41%	0.407	51%	0.509	S	S	.	.	P	Polyproline II helix	trans	-67.8	162.4	165.4	-62.6	-171.6	162.2	0	0	109.2	A606 R607 N621 Q625	A606-E623 PolarHBondContact O-N 3.34Å; R607-E623 HydrophobicContact CG-CB 4.04Å; R607-E623 IonicContact CZ-OE2 2.68Å; R607-E623 IonicContact NH1-OE2 2.62Å; R607-E623 PolarHBondContact NH1-OE2 3.23Å; R607-E623 IonicContact NH2-OE2 2.66Å; R607-E623 PolarHBondContact NH2-OE2 3.34Å; N621-E623 PolarHBondContact O-N 2.97Å; E623-Q625 PolarHBondContact O-N 2.77Å
624	E	75.1	Confident	69.6	Low	177 Å²	177	89.7 Å²	89.7	83%	0.827	47%	0.472	S	S	*	.	S	Bend	trans	-44.6	121.2	-176.8	-171.5	170.1	-144.8	0	0	112.2	R607	R607-E624 WeakPolarHBondContact CD-O 3.16Å; R607-E624 WeakPolarHBondContact CG-O 3.49Å
625	Q	81.9	Confident	72.1	Confident	114 Å²	114	82.2 Å²	82.2	53%	0.533	44%	0.442	S	S	.	.	P	Polyproline II helix	trans	-67.4	137.7	-171.8	-67.3	-175.4	11	0	0	110.7	E623	E623-Q625 PolarHBondContact O-N 2.77Å
626	L	87.5	Confident	74.7	Confident	29 Å²	29	80.4 Å²	80.4	15%	0.152	43%	0.425	C	S	.	.	P	Polyproline II helix	trans	-75.8	127.4	179.3	-61.4	174	0	0	0	110.6	Y603 L604 R607 D630 L631 L727	Y603-L626 HydrophobicContact CE1-CD1 4.07Å; Y603-L626 HydrophobicContact CE1-CD2 4.08Å; L604-L626 HydrophobicContact CD2-CD1 3.59Å; R607-L626 HydrophobicContact CB-CD1 4.31Å; R607-L626 HydrophobicContact CB-CG 4.05Å; R607-L626 HydrophobicContact CG-CG 4.45Å; L626-D630 HydrophobicContact CB-CB 4.25Å; L626-D630 HydrophobicContact CD2-CB 4.1Å; L626-L631 HydrophobicContact CB-CD2 4.08Å; L626-L631 HydrophobicContact CB-CG 4.45Å; L626-L631 HydrophobicContact CD1-CD2 3.87Å; L626-L727 HydrophobicContact CD1-CD2 4.49Å
627	S	90.1	Very high	77.5	Confident	48 Å²	48	70.8 Å²	70.8	34%	0.336	39%	0.388	S	S	.	.	P	Polyproline II helix	trans	-72.6	162.5	170.1	73.1	0	0	0	0	111	K629 D630 L631	S627-K629 PolarHBondContact O-N 3.08Å; S627-K629 WeakPolarHBondContact OG-CB 3.08Å; S627-K629 PolarHBondContact OG-N 3.12Å; S627-D630 WeakPolarHBondContact CB-OD2 3.24Å; S627-D630 PolarHBondContact N-OD2 3.31Å; S627-D630 WeakPolarHBondContact O-CB 3.41Å; S627-D630 PolarHBondContact O-N 2.89Å; S627-D630 VanDerWaalsContact OG-CG 3.28Å; S627-D630 PolarHBondContact OG-N 3.49Å; S627-D630 VanDerWaalsContact OG-N 3.15Å; S627-D630 PolarHBondContact OG-OD2 2.97Å; S627-L631 PolarHBondContact O-N 2.91Å
628	S	88.4	Confident	80.3	Confident	77 Å²	77	64.5 Å²	64.5	54%	0.538	36%	0.355	S	S	.	.	H	α-helix	trans	-54.9	-34.9	170.9	-53.4	0	0	0	0	112.1	L631 V632	S628-L631 PolarHBondContact O-N 3Å; S628-V632 WeakPolarHBondContact O-CG2 3.48Å; S628-V632 PolarHBondContact O-N 3.44Å
629	K	90.9	Very high	83	Confident	60 Å²	60	58.2 Å²	58.2	26%	0.261	31%	0.314	S	S	.	.	H	α-helix	trans	-63.5	-40	176.8	-174.6	-177.9	171.2	-172.2	0	111.8	S627 S633 T792 S793 E796	S627-K629 PolarHBondContact O-N 3.08Å; S627-K629 WeakPolarHBondContact OG-CB 3.08Å; S627-K629 PolarHBondContact OG-N 3.12Å; K629-S633 VanDerWaalsContact O-CB 3.26Å; K629-S633 WeakPolarHBondContact O-CB 3.44Å; K629-S633 PolarHBondContact O-N 2.86Å; K629-T792 HydrophobicContact CB-CG2 3.79Å; K629-T792 HydrophobicContact CG-CG2 4.2Å; K629-S793 WeakPolarHBondContact CE-OG 3.34Å; K629-E796 WeakPolarHBondContact CD-OE1 3.48Å; K629-E796 VanDerWaalsContact NZ-CD 3.3Å; K629-E796 IonicContact NZ-OE1 2.66Å; K629-E796 PolarHBondContact NZ-OE1 3.34Å; K629-E796 IonicContact NZ-OE2 2.71Å; K629-E796 PolarHBondContact NZ-OE2 2.84Å
630	D	93.4	Very high	85.6	Confident	64 Å²	64	57.4 Å²	57.4	34%	0.342	29%	0.294	S	S	.	.	H	α-helix	trans	-66.3	-39.6	175.3	-60.5	-59.4	0	0	0	111.8	L626 S627 S633 C634	L626-D630 HydrophobicContact CB-CB 4.25Å; L626-D630 HydrophobicContact CD2-CB 4.1Å; S627-D630 WeakPolarHBondContact CB-OD2 3.24Å; S627-D630 PolarHBondContact N-OD2 3.31Å; S627-D630 WeakPolarHBondContact O-CB 3.41Å; S627-D630 PolarHBondContact O-N 2.89Å; S627-D630 VanDerWaalsContact OG-CG 3.28Å; S627-D630 PolarHBondContact OG-N 3.49Å; S627-D630 VanDerWaalsContact OG-N 3.15Å; S627-D630 PolarHBondContact OG-OD2 2.97Å; D630-S633 WeakPolarHBondContact O-CB 3.31Å; D630-S633 PolarHBondContact O-N 3.32Å; D630-C634 PolarHBondContact O-N 2.91Å; D630-C634 PolarHBondContact O-SG 2.77Å
631	L	95.2	Very high	88	Confident	3 Å²	3	51 Å²	51	2%	0.016	26%	0.264	C	S	.	.	H	α-helix	trans	-66.4	-43	178.1	-60.5	-179.6	0	0	0	112	L604 L626 S627 S628 C634 A635 I724 F725 L727	L604-L631 HydrophobicContact CD2-CD2 3.79Å; L626-L631 HydrophobicContact CB-CD2 4.08Å; L626-L631 HydrophobicContact CB-CG 4.45Å; L626-L631 HydrophobicContact CD1-CD2 3.87Å; S627-L631 PolarHBondContact O-N 2.91Å; S628-L631 PolarHBondContact O-N 3Å; L631-C634 WeakPolarHBondContact O-CB 3.3Å; L631-C634 PolarHBondContact O-N 2.84Å; L631-A635 PolarHBondContact O-N 2.84Å; L631-A635 VanDerWaalsContact O-N 3.09Å; L631-I724 HydrophobicContact CB-CG2 3.97Å; L631-I724 HydrophobicContact CD2-CG2 4.01Å; L631-F725 HydrophobicContact CB-CD1 3.98Å; L631-F725 HydrophobicContact CB-CE1 3.48Å; L631-F725 VanDerWaalsContact CB-CE1 3.48Å; L631-F725 HydrophobicContact CB-CZ 4Å; L631-F725 HydrophobicContact CD1-CD1 3.93Å; L631-F725 HydrophobicContact CD1-CE1 4.21Å; L631-L727 HydrophobicContact CD1-CD2 3.99Å; L631-L727 HydrophobicContact CD2-CD2 3.7Å; L631-L727 HydrophobicContact CG-CD2 4.47Å
632	V	95.4	Very high	90.3	Very high	4 Å²	4	44.1 Å²	44.1	2%	0.024	23%	0.228	C	C	.	.	H	α-helix	trans	-66.3	-38.8	172.8	-172.7	0	0	0	0	110.7	S628 C634 A635 Y636 F725 L760 L785 I788 V789	S628-V632 WeakPolarHBondContact O-CG2 3.48Å; S628-V632 PolarHBondContact O-N 3.44Å; V632-C634 VanDerWaalsContact C-N 3.34Å; V632-C634 PolarHBondContact O-N 2.86Å; V632-A635 WeakPolarHBondContact O-CB 3.46Å; V632-A635 PolarHBondContact O-N 2.9Å; V632-Y636 VanDerWaalsContact O-CB 3.32Å; V632-Y636 WeakPolarHBondContact O-CB 3.39Å; V632-Y636 PolarHBondContact O-N 3.33Å; V632-F725 HydrophobicContact CG2-CE1 4.27Å; V632-F725 HydrophobicContact CG2-CZ 3.9Å; V632-L760 HydrophobicContact CG2-CD1 3.82Å; V632-L760 HydrophobicContact CG2-CD2 4.36Å; V632-L785 HydrophobicContact CG1-CD2 4Å; V632-I788 HydrophobicContact CG1-CB 4.22Å; V632-I788 HydrophobicContact CG1-CG2 3.84Å; V632-I788 HydrophobicContact CG2-CG2 4.17Å; V632-V789 HydrophobicContact CB-CG2 4.17Å; V632-V789 HydrophobicContact CG1-CG2 3.53Å
633	S	96.1	Very high	92.4	Very high	40 Å²	40	43.9 Å²	43.9	28%	0.28	22%	0.221	S	C	.	.	H	α-helix	trans	-59.9	-40.6	173.4	178.5	0	0	0	0	112.3	K629 D630 Q637	K629-S633 VanDerWaalsContact O-CB 3.26Å; K629-S633 WeakPolarHBondContact O-CB 3.44Å; K629-S633 PolarHBondContact O-N 2.86Å; D630-S633 WeakPolarHBondContact O-CB 3.31Å; D630-S633 PolarHBondContact O-N 3.32Å; S633-Q637 VanDerWaalsContact O-CB 3.32Å; S633-Q637 WeakPolarHBondContact O-CB 3.42Å; S633-Q637 VanDerWaalsContact O-CG 3.25Å; S633-Q637 WeakPolarHBondContact O-CG 3.33Å; S633-Q637 PolarHBondContact O-N 3.03Å; S633-Q637 PolarHBondContact OG-NE2 3.36Å
634	C	97.3	Very high	94	Very high	5 Å²	5	41.9 Å²	41.9	3%	0.034	21%	0.21	C	C	.	.	H	α-helix	trans	-60.8	-48.6	173.8	-67	0	0	0	0	111.3	D630 L631 V632 Q637 V638 M668 I724	D630-C634 PolarHBondContact O-N 2.91Å; D630-C634 PolarHBondContact O-SG 2.77Å; L631-C634 WeakPolarHBondContact O-CB 3.3Å; L631-C634 PolarHBondContact O-N 2.84Å; V632-C634 VanDerWaalsContact C-N 3.34Å; V632-C634 PolarHBondContact O-N 2.86Å; C634-Q637 PolarHBondContact O-N 2.99Å; C634-V638 WeakPolarHBondContact O-CG2 3.27Å; C634-V638 PolarHBondContact O-N 2.93Å; C634-V638 VanDerWaalsContact O-N 3.15Å; C634-M668 HydrophobicContact CB-CG 4.23Å; C634-M668 HydrophobicContact CB-SD 4.31Å; C634-M668 VanDerWaalsContact SG-CE 3.59Å; C634-I724 HydrophobicContact CB-CD1 4.36Å; C634-I724 HydrophobicContact CB-CG2 4.42Å
635	A	97.9	Very high	95	Very high	0 Å²	0	33.5 Å²	33.5	0%	0	17%	0.171	C	C	.	.	H	α-helix	trans	-59.3	-50.7	177.7	0	0	0	0	0	112.3	L631 V632 Q637 V638 A639 L721 I724 L785	L631-A635 PolarHBondContact O-N 2.84Å; L631-A635 VanDerWaalsContact O-N 3.09Å; V632-A635 WeakPolarHBondContact O-CB 3.46Å; V632-A635 PolarHBondContact O-N 2.9Å; A635-Q637 PolarHBondContact O-N 2.94Å; A635-V638 PolarHBondContact O-N 2.81Å; A635-A639 WeakPolarHBondContact O-CB 3.46Å; A635-A639 PolarHBondContact O-N 3.36Å; A635-L721 HydrophobicContact CB-CD2 3.4Å; A635-L721 VanDerWaalsContact CB-CD2 3.4Å; A635-I724 HydrophobicContact CB-CD1 4.39Å; A635-L785 HydrophobicContact CB-CD1 4.19Å; A635-L785 HydrophobicContact CB-CD2 4.21Å
636	Y	98.4	Very high	95.5	Very high	36 Å²	36	29.4 Å²	29.4	14%	0.141	16%	0.156	C	C	.	.	H	α-helix	trans	-56.7	-46.2	177.7	169.3	-104.7	0	0	0	112.5	V632 V638 A639 R640 V782 L785 D786	V632-Y636 VanDerWaalsContact O-CB 3.32Å; V632-Y636 WeakPolarHBondContact O-CB 3.39Å; V632-Y636 PolarHBondContact O-N 3.33Å; Y636-V638 VanDerWaalsContact C-N 3.35Å; Y636-V638 PolarHBondContact O-N 2.8Å; Y636-A639 PolarHBondContact O-N 3.23Å; Y636-R640 HydrophobicContact CE2-CG 4.26Å; Y636-R640 WeakPolarHBondContact O-CG 3.28Å; Y636-R640 PolarHBondContact O-N 3.27Å; Y636-R640 PolarHBondContact OH-NH1 2.81Å; Y636-V782 HydrophobicContact CE2-CG1 4.25Å; Y636-L785 HydrophobicContact CD2-CB 4.03Å; Y636-D786 HydrophobicContact CD2-CB 4.3Å; Y636-D786 HydrophobicContact CE2-CB 3.67Å; Y636-D786 WeakPolarHBondContact CE2-OD1 3.48Å; Y636-D786 PolarHBondContact OH-OD1 2.88Å
637	Q	98.5	Very high	95.9	Very high	22 Å²	22	32 Å²	32	10%	0.103	18%	0.177	C	C	.	.	H	α-helix	trans	-62	-41	178.6	-79.4	-170.6	77.3	0	0	112.3	N574 S633 C634 A635 G641 N666 M668	N574-Q637 WeakPolarHBondContact CB-O 3.42Å; N574-Q637 VanDerWaalsContact CG-O 3.24Å; N574-Q637 WeakPolarHBondContact ND2-CB 3.46Å; N574-Q637 PolarHBondContact ND2-OE1 2.83Å; N574-Q637 VanDerWaalsContact ND2-OE1 3.09Å; S633-Q637 VanDerWaalsContact O-CB 3.32Å; S633-Q637 WeakPolarHBondContact O-CB 3.42Å; S633-Q637 VanDerWaalsContact O-CG 3.25Å; S633-Q637 WeakPolarHBondContact O-CG 3.33Å; S633-Q637 PolarHBondContact O-N 3.03Å; S633-Q637 PolarHBondContact OG-NE2 3.36Å; C634-Q637 PolarHBondContact O-N 2.99Å; A635-Q637 PolarHBondContact O-N 2.94Å; Q637-G641 PolarHBondContact O-N 3.21Å; Q637-N666 PolarHBondContact NE2-O 3.06Å; Q637-M668 HydrophobicContact CB-CB 3.87Å; Q637-M668 HydrophobicContact CB-CG 3.98Å; Q637-M668 VanDerWaalsContact OE1-N 3.12Å
638	V	98.6	Very high	96	Very high	0 Å²	0	33.9 Å²	33.9	0%	0	18%	0.179	C	C	.	.	H	α-helix	trans	-72.3	-38.6	175.9	-179.7	0	0	0	0	111.6	C634 A635 Y636 R640 G641 M642 L655 V660 M668 I670 F717 L720	C634-V638 WeakPolarHBondContact O-CG2 3.27Å; C634-V638 PolarHBondContact O-N 2.93Å; C634-V638 VanDerWaalsContact O-N 3.15Å; A635-V638 PolarHBondContact O-N 2.81Å; Y636-V638 VanDerWaalsContact C-N 3.35Å; Y636-V638 PolarHBondContact O-N 2.8Å; V638-R640 VanDerWaalsContact C-N 3.29Å; V638-R640 PolarHBondContact O-N 2.9Å; V638-G641 WeakPolarHBondContact O-CA 3.46Å; V638-G641 PolarHBondContact O-N 3.31Å; V638-M642 HydrophobicContact CG1-CG 4.35Å; V638-M642 PolarHBondContact O-N 3.41Å; V638-L655 HydrophobicContact CG1-CD1 4.19Å; V638-V660 HydrophobicContact CG1-CG2 4.41Å; V638-V660 HydrophobicContact CG2-CG1 3.86Å; V638-V660 HydrophobicContact CG2-CG2 4.08Å; V638-M668 HydrophobicContact CG2-CB 3.91Å; V638-M668 HydrophobicContact CG2-CG 4.45Å; V638-I670 HydrophobicContact CG1-CD1 4.1Å; V638-I670 HydrophobicContact CG1-CG1 3.99Å; V638-F717 HydrophobicContact CB-CE2 4.21Å; V638-F717 HydrophobicContact CG1-CD2 4.26Å; V638-F717 HydrophobicContact CG1-CE2 4.16Å; V638-L720 HydrophobicContact CB-CD2 4.27Å; V638-L720 HydrophobicContact CG1-CD2 3.61Å; V638-L720 HydrophobicContact CG2-CD2 4.42Å
639	A	98.7	Very high	95.9	Very high	0 Å²	0	35.1 Å²	35.1	0%	0	18%	0.175	C	C	.	.	H	α-helix	trans	-55.2	-45.2	175	0	0	0	0	0	111.5	A635 Y636 G641 M642 E643 F717 V782 L785	A635-A639 WeakPolarHBondContact O-CB 3.46Å; A635-A639 PolarHBondContact O-N 3.36Å; Y636-A639 PolarHBondContact O-N 3.23Å; A639-G641 VanDerWaalsContact C-N 3.34Å; A639-G641 PolarHBondContact O-N 3.3Å; A639-M642 PolarHBondContact O-N 2.95Å; A639-E643 WeakPolarHBondContact O-CB 3.41Å; A639-E643 PolarHBondContact O-N 3.01Å; A639-F717 HydrophobicContact CB-CE1 4.45Å; A639-F717 HydrophobicContact CB-CE2 4.05Å; A639-F717 HydrophobicContact CB-CZ 3.71Å; A639-V782 VanDerWaalsContact C-CG2 3.47Å; A639-V782 HydrophobicContact CB-CG2 3.74Å; A639-L785 HydrophobicContact CB-CD1 3.83Å
640	R	98.6	Very high	95.8	Very high	91 Å²	91	32.3 Å²	32.3	34%	0.343	16%	0.163	S	C	.	.	H	α-helix	trans	-64.4	-34.3	174.8	-73	-178.4	56.3	166.2	0.3	113.6	H572 Y636 V638 Y644 V782	H572-R640 PolarHBondContact CE1-O 3.31Å; H572-R640 VanDerWaalsContact CE1-O 3.3Å; Y636-R640 HydrophobicContact CE2-CG 4.26Å; Y636-R640 WeakPolarHBondContact O-CG 3.28Å; Y636-R640 PolarHBondContact O-N 3.27Å; Y636-R640 PolarHBondContact OH-NH1 2.81Å; V638-R640 VanDerWaalsContact C-N 3.29Å; V638-R640 PolarHBondContact O-N 2.9Å; R640-Y644 PolarHBondContact O-N 2.93Å; R640-Y644 VanDerWaalsContact O-N 3.16Å; R640-V782 HydrophobicContact CB-CG2 4.29Å; R640-V782 HydrophobicContact CG-CB 4.33Å; R640-V782 HydrophobicContact CG-CG1 3.68Å; R640-V782 HydrophobicContact CG-CG2 3.61Å
641	G	98.1	Very high	95.6	Very high	0 Å²	0	29.4 Å²	29.4	0%	0	15%	0.147	C	C	.	.	H	α-helix	trans	-64.4	-42.1	172.2	0	0	0	0	0	112.3	Q637 V638 A639 Y644 L645 I670	Q637-G641 PolarHBondContact O-N 3.21Å; V638-G641 WeakPolarHBondContact O-CA 3.46Å; V638-G641 PolarHBondContact O-N 3.31Å; A639-G641 VanDerWaalsContact C-N 3.34Å; A639-G641 PolarHBondContact O-N 3.3Å; G641-Y644 PolarHBondContact O-N 2.95Å; G641-L645 WeakPolarHBondContact O-CG 3.48Å; G641-L645 PolarHBondContact O-N 3.18Å; G641-L645 VanDerWaalsContact O-N 3.08Å; G641-I670 VanDerWaalsContact C-CD1 3.43Å
642	M	98.4	Very high	95.5	Very high	1 Å²	1	29.3 Å²	29.3	1%	0.005	15%	0.146	C	C	.	.	H	α-helix	trans	-74.2	-34.8	178.2	-69.4	-57	-52.7	0	0	113.5	V638 A639 Y644 L645 A646 H652 L655 I670 D713 F778	V638-M642 HydrophobicContact CG1-CG 4.35Å; V638-M642 PolarHBondContact O-N 3.41Å; A639-M642 PolarHBondContact O-N 2.95Å; M642-Y644 VanDerWaalsContact C-N 3.32Å; M642-L645 HydrophobicContact CE-CD1 4.35Å; M642-L645 PolarHBondContact O-N 3.17Å; M642-L645 HydrophobicContact SD-CD1 3.74Å; M642-A646 WeakPolarHBondContact O-CB 3.2Å; M642-A646 PolarHBondContact O-N 3.2Å; M642-H652 HydrophobicContact CE-CB 4.03Å; M642-H652 HydrophobicContact SD-CB 4.31Å; M642-L655 HydrophobicContact CE-CD2 4.2Å; M642-L655 HydrophobicContact CG-CD1 4.44Å; M642-L655 HydrophobicContact CG-CD2 3.79Å; M642-L655 HydrophobicContact SD-CD1 3.95Å; M642-L655 HydrophobicContact SD-CD2 3.76Å; M642-L655 HydrophobicContact SD-CG 4.39Å; M642-I670 HydrophobicContact CG-CD1 3.82Å; M642-I670 HydrophobicContact SD-CD1 3.73Å; M642-D713 HydrophobicContact CE-CB 3.68Å; M642-F778 HydrophobicContact CB-CD1 3.42Å; M642-F778 VanDerWaalsContact CB-CD1 3.42Å; M642-F778 HydrophobicContact CB-CD2 3.92Å; M642-F778 HydrophobicContact CB-CE1 3.35Å; M642-F778 HydrophobicContact CB-CE2 3.85Å; M642-F778 HydrophobicContact CB-CG 3.71Å; M642-F778 HydrophobicContact CB-CZ 3.58Å; M642-F778 HydrophobicContact CE-CE2 3.76Å; M642-F778 HydrophobicContact CE-CZ 3.74Å; M642-F778 HydrophobicContact CG-CD1 4.34Å; M642-F778 HydrophobicContact CG-CE1 3.81Å; M642-F778 HydrophobicContact CG-CZ 3.9Å
643	E	98.4	Very high	95.2	Very high	63 Å²	63	31 Å²	31	29%	0.294	15%	0.153	S	C	.	.	H	α-helix	trans	-58.1	-46.6	169.8	-174.9	-168.3	-155.6	0	0	110.5	A639 L645 A646 S647 F778 K779 V782	A639-E643 WeakPolarHBondContact O-CB 3.41Å; A639-E643 PolarHBondContact O-N 3.01Å; E643-L645 PolarHBondContact O-N 2.86Å; E643-A646 PolarHBondContact O-N 2.89Å; E643-S647 PolarHBondContact O-N 3.48Å; E643-F778 HydrophobicContact CB-CB 4.02Å; E643-K779 HydrophobicContact CG-CB 4.46Å; E643-V782 HydrophobicContact CB-CG2 4.14Å
644	Y	97.8	Very high	94.9	Very high	46 Å²	46	30 Å²	30	18%	0.18	14%	0.144	C	C	.	.	H	α-helix	trans	-59.4	-47	174.7	-173.9	-84.5	0	0	0	111.5	I569 K571 H572 I575 R640 G641 M642 A646 S647 K648	I569-Y644 HydrophobicContact CG2-CD1 4.31Å; I569-Y644 HydrophobicContact CG2-CE1 3.91Å; I569-Y644 WeakPolarHBondContact O-CE1 3.47Å; I569-Y644 PolarHBondContact O-OH 3.5Å; K571-Y644 PolarHBondContact O-OH 2.93Å; H572-Y644 HydrophobicContact CB-CD1 3.88Å; H572-Y644 HydrophobicContact CB-CD2 3.97Å; H572-Y644 HydrophobicContact CB-CE1 3.98Å; H572-Y644 HydrophobicContact CB-CE2 4.04Å; H572-Y644 HydrophobicContact CB-CG 3.86Å; H572-Y644 AromaticContact CD2-CD2 3.61Å; H572-Y644 AromaticContact CD2-CG 3.99Å; H572-Y644 AromaticContact CG-CD2 3.78Å; H572-Y644 AromaticContact CG-CG 3.73Å; I575-Y644 HydrophobicContact CD1-CD1 3.59Å; I575-Y644 HydrophobicContact CD1-CE1 4.22Å; I575-Y644 HydrophobicContact CD1-CG 4.35Å; R640-Y644 PolarHBondContact O-N 2.93Å; R640-Y644 VanDerWaalsContact O-N 3.16Å; G641-Y644 PolarHBondContact O-N 2.95Å; M642-Y644 VanDerWaalsContact C-N 3.32Å; Y644-A646 PolarHBondContact O-N 3.3Å; Y644-S647 WeakPolarHBondContact O-CB 3.45Å; Y644-S647 PolarHBondContact O-N 2.99Å; Y644-S647 VanDerWaalsContact O-N 3.15Å; Y644-S647 PolarHBondContact O-OG 2.91Å; Y644-K648 HydrophobicContact CD1-CG 3.97Å; Y644-K648 HydrophobicContact CE1-CD 4.29Å; Y644-K648 HydrophobicContact CE1-CG 3.7Å; Y644-K648 WeakPolarHBondContact O-CG 3.34Å; Y644-K648 PolarHBondContact O-N 3.46Å; Y644-K648 VanDerWaalsContact OH-CE 3.28Å; Y644-K648 WeakPolarHBondContact OH-CE 3.24Å
645	L	95.1	Very high	94.8	Very high	0 Å²	0	29.8 Å²	29.8	0%	0	14%	0.143	C	C	.	.	H	α-helix	trans	-60	-42.4	177.2	-72.6	168.7	0	0	0	112.6	I569 I575 G641 M642 E643 K648 K649 C650 I670 F673	I569-L645 HydrophobicContact CB-CD2 4.49Å; I569-L645 HydrophobicContact CD1-CD2 3.68Å; I569-L645 HydrophobicContact CG1-CD2 3.86Å; I569-L645 HydrophobicContact CG2-CD2 3.75Å; I575-L645 HydrophobicContact CD1-CD1 4.41Å; I575-L645 HydrophobicContact CD1-CD2 3.85Å; I575-L645 HydrophobicContact CD1-CG 3.79Å; G641-L645 WeakPolarHBondContact O-CG 3.48Å; G641-L645 PolarHBondContact O-N 3.18Å; G641-L645 VanDerWaalsContact O-N 3.08Å; M642-L645 HydrophobicContact CE-CD1 4.35Å; M642-L645 PolarHBondContact O-N 3.17Å; M642-L645 HydrophobicContact SD-CD1 3.74Å; E643-L645 PolarHBondContact O-N 2.86Å; L645-K648 CarbonylContact O-C 3.33Å; L645-K648 WeakPolarHBondContact O-CA 3.3Å; L645-K648 WeakPolarHBondContact O-CB 3.33Å; L645-K648 PolarHBondContact O-N 3.4Å; L645-K648 VanDerWaalsContact O-N 3.08Å; L645-K649 PolarHBondContact O-N 2.84Å; L645-C650 HydrophobicContact CB-CB 4.36Å; L645-C650 HydrophobicContact CD2-CB 4.05Å; L645-C650 PolarHBondContact O-N 3.09Å; L645-I670 HydrophobicContact CD1-CD1 4.15Å; L645-I670 HydrophobicContact CD1-CG2 4.28Å; L645-F673 HydrophobicContact CD1-CE1 3.91Å; L645-F673 HydrophobicContact CD1-CZ 4.33Å; L645-F673 HydrophobicContact CD2-CE1 3.7Å; L645-F673 HydrophobicContact CD2-CZ 4.19Å; L645-F673 HydrophobicContact CG-CE1 4.48Å
646	A	93.8	Very high	94.7	Very high	28 Å²	28	29.8 Å²	29.8	23%	0.231	14%	0.143	C	C	.	.	H	α-helix	trans	-63.4	-40	174.3	0	0	0	0	0	111.9	M642 E643 Y644 K648 K649 H710 F778	M642-A646 WeakPolarHBondContact O-CB 3.2Å; M642-A646 PolarHBondContact O-N 3.2Å; E643-A646 PolarHBondContact O-N 2.89Å; Y644-A646 PolarHBondContact O-N 3.3Å; A646-K648 PolarHBondContact O-N 3.34Å; A646-K649 WeakPolarHBondContact O-CA 3.38Å; A646-K649 PolarHBondContact O-N 3.47Å; A646-H710 HydrophobicContact CB-CB 4.47Å; A646-F778 HydrophobicContact CB-CD2 4.44Å
647	S	94.5	Very high	94.6	Very high	84 Å²	84	28.1 Å²	28.1	59%	0.587	14%	0.136	S	C	*	.	H	α-helix	trans	-62.4	-27	173	85.2	0	0	0	0	113.1	E643 Y644 K649	E643-S647 PolarHBondContact O-N 3.48Å; Y644-S647 WeakPolarHBondContact O-CB 3.45Å; Y644-S647 PolarHBondContact O-N 2.99Å; Y644-S647 VanDerWaalsContact O-N 3.15Å; Y644-S647 PolarHBondContact O-OG 2.91Å; S647-K649 VanDerWaalsContact C-N 3.32Å
648	K	91.9	Very high	94.3	Very high	88 Å²	88	30.6 Å²	30.6	38%	0.383	14%	0.144	S	C	.	.	T	Hydrogen-bonded Turn	trans	-87.7	5.5	172.8	-61.7	-63.1	179.8	174.2	0	113.7	I569 Y644 L645 A646 C650	I569-K648 WeakPolarHBondContact O-CD 3.43Å; I569-K648 WeakPolarHBondContact O-CE 3.47Å; Y644-K648 HydrophobicContact CD1-CG 3.97Å; Y644-K648 HydrophobicContact CE1-CD 4.29Å; Y644-K648 HydrophobicContact CE1-CG 3.7Å; Y644-K648 WeakPolarHBondContact O-CG 3.34Å; Y644-K648 PolarHBondContact O-N 3.46Å; Y644-K648 VanDerWaalsContact OH-CE 3.28Å; Y644-K648 WeakPolarHBondContact OH-CE 3.24Å; L645-K648 CarbonylContact O-C 3.33Å; L645-K648 WeakPolarHBondContact O-CA 3.3Å; L645-K648 WeakPolarHBondContact O-CB 3.33Å; L645-K648 PolarHBondContact O-N 3.4Å; L645-K648 VanDerWaalsContact O-N 3.08Å; A646-K648 PolarHBondContact O-N 3.34Å; K648-C650 PolarHBondContact O-N 3.25Å
649	K	88.1	Confident	94.1	Very high	103 Å²	103	31.2 Å²	31.2	45%	0.448	15%	0.148	S	C	.	.	T	Hydrogen-bonded Turn	trans	58.3	20	-175.7	-55.2	-178	177.1	176.7	0	114.5	L645 A646 S647 I679 H680	L645-K649 PolarHBondContact O-N 2.84Å; A646-K649 WeakPolarHBondContact O-CA 3.38Å; A646-K649 PolarHBondContact O-N 3.47Å; S647-K649 VanDerWaalsContact C-N 3.32Å; K649-I679 HydrophobicContact CB-CG2 3.78Å; K649-I679 HydrophobicContact CD-CG2 4.21Å; K649-I679 HydrophobicContact CG-CG2 4.33Å; K649-I679 PolarHBondContact O-N 2.99Å; K649-H680 WeakPolarHBondContact CD-NE2 3.4Å; K649-H680 PolarHBondContact NZ-NE2 2.86Å
650	C	88.3	Confident	94.1	Very high	1 Å²	1	31.2 Å²	31.2	1%	0.007	15%	0.148	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-88.2	137.3	176.7	-173	0	0	0	0	110.3	M565 I569 L645 K648 H710	M565-C650 HydrophobicContact CE-CB 4.48Å; I569-C650 HydrophobicContact CG1-CB 4.3Å; L645-C650 HydrophobicContact CB-CB 4.36Å; L645-C650 HydrophobicContact CD2-CB 4.05Å; L645-C650 PolarHBondContact O-N 3.09Å; K648-C650 PolarHBondContact O-N 3.25Å; C650-H710 PolarHBondContact O-CE1 2.85Å; C650-H710 PolarHBondContact O-ND1 2.86Å
651	I	88.9	Confident	94	Very high	3 Å²	3	29.1 Å²	29.1	2%	0.015	14%	0.143	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-111.8	127.5	171.9	-50.6	170.8	0	0	0	107.2	R653 A676 R677 I679 Y708 D713	I651-R653 HydrophobicContact CB-CG 4.14Å; I651-R653 HydrophobicContact CG2-CG 3.55Å; I651-A676 CarbonylContact O-C 3.55Å; I651-A676 WeakPolarHBondContact O-CA 3.37Å; I651-A676 WeakPolarHBondContact O-CB 3.36Å; I651-R677 PolarHBondContact N-O 3.49Å; I651-R677 PolarHBondContact O-N 3.2Å; I651-I679 HydrophobicContact CD1-CB 4.26Å; I651-I679 HydrophobicContact CD1-CD1 4.4Å; I651-I679 HydrophobicContact CD1-CG1 4.05Å; I651-Y708 WeakPolarHBondContact CD1-O 3.29Å; I651-D713 VanDerWaalsContact CA-OD2 3.26Å; I651-D713 WeakPolarHBondContact CA-OD2 3.46Å; I651-D713 WeakPolarHBondContact CG2-OD2 3.24Å
652	H	91.9	Very high	93.9	Very high	0 Å²	0	29.1 Å²	29.1	0%	0	14%	0.143	C	C	.	.			trans	-78.7	-42.7	-173.5	-161.8	-85.5	0	0	0	113	M642 D654 L655 I670 A671 F673 D713	M642-H652 HydrophobicContact CE-CB 4.03Å; M642-H652 HydrophobicContact SD-CB 4.31Å; H652-D654 PolarHBondContact CE1-O 2.83Å; H652-D654 VanDerWaalsContact ND1-C 3.31Å; H652-D654 PolarHBondContact ND1-O 3.28Å; H652-D654 PolarHBondContact O-N 3.43Å; H652-L655 PolarHBondContact ND1-N 3Å; H652-I670 VanDerWaalsContact CD2-CG2 3.49Å; H652-I670 WeakPolarHBondContact CD2-CG2 3.42Å; H652-I670 VanDerWaalsContact NE2-CG2 3.25Å; H652-I670 WeakPolarHBondContact NE2-CG2 3.3Å; H652-A671 PolarHBondContact CE1-O 3.22Å; H652-A671 PolarHBondContact NE2-O 3.05Å; H652-F673 AromaticContact CD2-CD1 3.85Å; H652-F673 AromaticContact CD2-CE1 3.56Å; H652-F673 AromaticContact NE2-CD1 3.97Å; H652-F673 AromaticContact NE2-CE1 3.83Å; H652-D713 PolarHBondContact N-OD1 3.02Å; H652-D713 PolarHBondContact N-OD2 3.03Å
653	R	89.3	Confident	93.8	Very high	41 Å²	41	29.8 Å²	29.8	16%	0.155	15%	0.147	C	C	.	.	S	Bend	trans	66	-13.4	173.8	-50.4	175.6	60.4	-139.3	13.2	116.6	I651 L675 Y708 D713	I651-R653 HydrophobicContact CB-CG 4.14Å; I651-R653 HydrophobicContact CG2-CG 3.55Å; R653-L675 WeakPolarHBondContact CD-O 3.42Å; R653-L675 PolarHBondContact NH1-O 3.49Å; R653-Y708 HydrophobicContact CB-CD1 4.05Å; R653-Y708 HydrophobicContact CB-CE1 4.17Å; R653-Y708 HydrophobicContact CG-CD1 3.66Å; R653-Y708 HydrophobicContact CG-CE1 4.27Å; R653-Y708 HydrophobicContact CG-CG 4.31Å; R653-Y708 VanDerWaalsContact NE-CG 3.31Å; R653-Y708 VanDerWaalsContact NH2-CE2 3.33Å; R653-D713 PolarHBondContact N-OD1 2.82Å
654	D	90	Very high	93.6	Very high	19 Å²	19	33.4 Å²	33.4	10%	0.102	16%	0.164	C	C	.	.			trans	-136.5	57.2	169.5	-168.9	19.7	0	0	0	111.9	H652 R658 N659 L675 P694	H652-D654 PolarHBondContact CE1-O 2.83Å; H652-D654 VanDerWaalsContact ND1-C 3.31Å; H652-D654 PolarHBondContact ND1-O 3.28Å; H652-D654 PolarHBondContact O-N 3.43Å; D654-R658 IonicContact OD1-CZ 3.05Å; D654-R658 IonicContact OD1-NE 2.68Å; D654-R658 IonicContact OD1-NH2 3.66Å; D654-R658 PolarHBondContact OD1-NH2 3.28Å; D654-R658 IonicContact OD2-NE 2.61Å; D654-N659 PolarHBondContact O-ND2 2.9Å; D654-N659 PolarHBondContact OD2-ND2 2.95Å; D654-L675 HydrophobicContact CB-CD1 3.98Å; D654-P694 HydrophobicContact CB-CG 4.28Å; D654-P694 WeakPolarHBondContact OD1-CB 3.18Å; D654-P694 WeakPolarHBondContact OD1-CG 3.19Å
655	L	95.8	Very high	93.4	Very high	0 Å²	0	37.7 Å²	37.7	0%	0	19%	0.19	C	C	.	.			trans	-84.7	115.2	176.8	179.4	67.2	0	0	0	110.3	V638 M642 H652 I670 W697 F717 L720	V638-L655 HydrophobicContact CG1-CD1 4.19Å; M642-L655 HydrophobicContact CE-CD2 4.2Å; M642-L655 HydrophobicContact CG-CD1 4.44Å; M642-L655 HydrophobicContact CG-CD2 3.79Å; M642-L655 HydrophobicContact SD-CD1 3.95Å; M642-L655 HydrophobicContact SD-CD2 3.76Å; M642-L655 HydrophobicContact SD-CG 4.39Å; H652-L655 PolarHBondContact ND1-N 3Å; L655-I670 HydrophobicContact CD1-CG2 4.5Å; L655-W697 VanDerWaalsContact O-CD1 3.28Å; L655-F717 HydrophobicContact CD2-CB 3.82Å; L655-F717 HydrophobicContact CD2-CD2 4.27Å; L655-L720 HydrophobicContact CD1-CD2 4.1Å; L655-L720 HydrophobicContact CG-CD2 4.17Å
656	A	95.5	Very high	93.4	Very high	0 Å²	0	40.6 Å²	40.6	0%	0	21%	0.206	C	C	.	.	S	Bend	trans	-159.7	163.2	-177.3	0	0	0	0	0	111.1	R658 N659 V660 W697	A656-R658 HydrophobicContact CB-CG 3.8Å; A656-R658 PolarHBondContact O-N 3.24Å; A656-R658 VanDerWaalsContact O-N 3.13Å; A656-N659 PolarHBondContact O-N 2.63Å; A656-V660 PolarHBondContact O-N 2.94Å; A656-W697 HydrophobicContact CB-CD2 4.11Å; A656-W697 HydrophobicContact CB-CG 4.1Å; A656-W697 HydrophobicContact CB-CZ2 4.28Å; A656-W697 VanDerWaalsContact CB-NE1 3.29Å
657	A	96.3	Very high	93.6	Very high	0 Å²	0	40.1 Å²	40.1	0%	0	20%	0.2	C	C	.	.	G	3₁₀ helix	trans	-65.1	-20.3	-176.1	0	0	0	0	0	114.1	L600 R601 N659 L720 E723	L600-A657 WeakPolarHBondContact CB-O 3.48Å; L600-A657 PolarHBondContact N-O 3.49Å; R601-A657 HydrophobicContact CB-CB 3.91Å; R601-A657 PolarHBondContact N-O 2.87Å; A657-N659 VanDerWaalsContact C-N 3.3Å; A657-L720 HydrophobicContact CB-CD1 3.77Å; A657-E723 HydrophobicContact CB-CB 4.03Å; A657-E723 HydrophobicContact CB-CG 4.42Å; A657-E723 WeakPolarHBondContact CB-OE1 3.27Å; A657-E723 PolarHBondContact N-OE2 3.42Å
658	R	93.3	Very high	93.8	Very high	75 Å²	75	36.2 Å²	36.2	28%	0.283	17%	0.172	S	C	.	.	G	3₁₀ helix	trans	-67	-27.5	168.8	50.2	159.7	-179.9	-67.1	-8.6	113.8	N599 D654 A656 W697	N599-R658 WeakPolarHBondContact CB-O 3.02Å; D654-R658 IonicContact OD1-CZ 3.05Å; D654-R658 IonicContact OD1-NE 2.68Å; D654-R658 IonicContact OD1-NH2 3.66Å; D654-R658 PolarHBondContact OD1-NH2 3.28Å; D654-R658 IonicContact OD2-NE 2.61Å; A656-R658 HydrophobicContact CB-CG 3.8Å; A656-R658 PolarHBondContact O-N 3.24Å; A656-R658 VanDerWaalsContact O-N 3.13Å; R658-W697 VanDerWaalsContact NH1-CZ2 3.3Å
659	N	94.4	Very high	94.1	Very high	13 Å²	13	32.7 Å²	32.7	7%	0.07	16%	0.157	C	C	.	.	G	3₁₀ helix	trans	-107.4	11.6	-171.9	-63.4	0.5	0	0	0	111.6	D654 A656 A657 A671	D654-N659 PolarHBondContact O-ND2 2.9Å; D654-N659 PolarHBondContact OD2-ND2 2.95Å; A656-N659 PolarHBondContact O-N 2.63Å; A657-N659 VanDerWaalsContact C-N 3.3Å; N659-A671 PolarHBondContact O-N 3.1Å
660	V	97.6	Very high	94.5	Very high	0 Å²	0	27.8 Å²	27.8	0%	0	14%	0.136	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-108.9	129.9	165.4	-179.6	0	0	0	0	107.5	N599 L600 V638 A656 M668 K669 L720	N599-V660 CarbonylContact C-O 3.41Å; N599-V660 WeakPolarHBondContact CA-O 3.34Å; L600-V660 HydrophobicContact CB-CB 3.93Å; L600-V660 HydrophobicContact CB-CG1 4.13Å; L600-V660 HydrophobicContact CD2-CB 4.01Å; L600-V660 HydrophobicContact CD2-CG1 3.9Å; L600-V660 PolarHBondContact N-O 3.18Å; V638-V660 HydrophobicContact CG1-CG2 4.41Å; V638-V660 HydrophobicContact CG2-CG1 3.86Å; V638-V660 HydrophobicContact CG2-CG2 4.08Å; A656-V660 PolarHBondContact O-N 2.94Å; V660-M668 HydrophobicContact CG1-CB 4.02Å; V660-M668 HydrophobicContact CG1-SD 4.45Å; V660-K669 CarbonylContact C-O 3.53Å; V660-K669 WeakPolarHBondContact CA-O 3.45Å; V660-L720 HydrophobicContact CG2-CD2 4.23Å
661	L	96.7	Very high	94.7	Very high	47 Å²	47	28.1 Å²	28.1	25%	0.246	14%	0.138	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-105.3	153	179.1	-60.9	177.8	0	0	0	111.1	I576 A595 G598 N599 K669 A671	I576-L661 HydrophobicContact CD1-CD1 3.96Å; I576-L661 HydrophobicContact CG1-CD1 4.22Å; A595-L661 HydrophobicContact CB-CB 3.63Å; A595-L661 HydrophobicContact CB-CD1 4.25Å; A595-L661 HydrophobicContact CB-CG 4.48Å; G598-L661 WeakPolarHBondContact O-CA 3.48Å; N599-L661 HydrophobicContact CB-CD2 4.15Å; L661-K669 PolarHBondContact N-O 2.95Å; L661-K669 PolarHBondContact O-N 3.23Å; L661-A671 HydrophobicContact CD1-CB 3.71Å; L661-A671 HydrophobicContact CG-CB 3.85Å
662	V	97.2	Very high	94.4	Very high	0 Å²	0	30.9 Å²	30.9	0%	0	15%	0.153	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-117.8	122.6	-176.1	-171.5	0	0	0	0	110.7	A595 S596 K597 G598 L600 Y603 M668	A595-V662 CarbonylContact C-O 3.59Å; S596-V662 PolarHBondContact N-O 3.38Å; K597-V662 HydrophobicContact CB-CB 3.91Å; K597-V662 HydrophobicContact CB-CG1 3.96Å; K597-V662 WeakPolarHBondContact CB-O 3.47Å; K597-V662 HydrophobicContact CD-CG1 4.22Å; K597-V662 PolarHBondContact N-O 2.8Å; G598-V662 PolarHBondContact O-N 3.02Å; L600-V662 HydrophobicContact CB-CG2 4.21Å; L600-V662 HydrophobicContact CD1-CG2 4.19Å; Y603-V662 HydrophobicContact CD1-CG2 4.22Å; Y603-V662 HydrophobicContact CD2-CB 4.46Å; Y603-V662 HydrophobicContact CD2-CG1 4.08Å; Y603-V662 HydrophobicContact CD2-CG2 4.47Å; Y603-V662 HydrophobicContact CE2-CG1 4.08Å; Y603-V662 HydrophobicContact CG-CB 4.47Å; Y603-V662 HydrophobicContact CG-CG1 4.35Å; Y603-V662 HydrophobicContact CG-CG2 4Å; V662-M668 HydrophobicContact CG1-CE 3.84Å; V662-M668 HydrophobicContact CG2-CE 4.1Å; V662-M668 HydrophobicContact CG2-SD 3.93Å
663	T	96.1	Very high	93.6	Very high	15 Å²	15	31 Å²	31	9%	0.092	15%	0.153	C	C	.	.			trans	-79.9	171	175.4	73.2	0	0	0	0	112.4	K597 D665 N666 V667 K669	K597-T663 WeakPolarHBondContact CD-O 3.35Å; T663-D665 VanDerWaalsContact C-N 3.25Å; T663-D665 PolarHBondContact O-N 3.5Å; T663-D665 PolarHBondContact OG1-N 3.35Å; T663-N666 PolarHBondContact O-N 3.21Å; T663-V667 HydrophobicContact CG2-CB 4.14Å; T663-V667 PolarHBondContact N-O 2.84Å; T663-V667 VanDerWaalsContact N-O 3.1Å; T663-V667 VanDerWaalsContact OG1-CB 3.3Å; T663-V667 WeakPolarHBondContact OG1-CB 3.46Å; T663-V667 PolarHBondContact OG1-N 2.86Å; T663-V667 VanDerWaalsContact OG1-N 3.1Å; T663-K669 HydrophobicContact CG2-CD 3.74Å; T663-K669 HydrophobicContact CG2-CG 4.4Å
664	E	93.8	Very high	92.6	Very high	139 Å²	139	29.5 Å²	29.5	65%	0.65	15%	0.151	S	C	*	.	T	Hydrogen-bonded Turn	trans	-52.6	-43.9	175.1	-150.7	153.6	147.2	0	0	112.1	S596 K597 N666	S596-E664 WeakPolarHBondContact OG-CA 3.38Å; S596-E664 WeakPolarHBondContact OG-CB 2.97Å; S596-E664 PolarHBondContact OG-N 3.09Å; S596-E664 PolarHBondContact OG-OE2 3Å; K597-E664 WeakPolarHBondContact CE-O 3.43Å; K597-E664 PolarHBondContact NZ-O 3.06Å; E664-N666 PolarHBondContact O-N 2.93Å; E664-N666 VanDerWaalsContact O-N 3.16Å
665	D	93.6	Very high	91.4	Very high	135 Å²	135	30 Å²	30	72%	0.722	15%	0.154	S	C	*	.	T	Hydrogen-bonded Turn	trans	-80.4	20.1	178.4	-35.1	-86.7	0	0	0	114.4	T663 V667	T663-D665 VanDerWaalsContact C-N 3.25Å; T663-D665 PolarHBondContact O-N 3.5Å; T663-D665 PolarHBondContact OG1-N 3.35Å; D665-V667 HydrophobicContact CB-CG2 4.34Å; D665-V667 PolarHBondContact O-N 3.19Å
666	N	94.6	Very high	90.1	Very high	61 Å²	61	30 Å²	30	33%	0.326	15%	0.154	S	C	.	.			trans	55.5	31.5	-176.2	-62	-19.2	0	0	0	114.1	K597 Y603 Q637 T663 E664 M668	K597-N666 PolarHBondContact NZ-OD1 2.61Å; Y603-N666 PolarHBondContact OH-OD1 2.82Å; Q637-N666 PolarHBondContact NE2-O 3.06Å; T663-N666 PolarHBondContact O-N 3.21Å; E664-N666 PolarHBondContact O-N 2.93Å; E664-N666 VanDerWaalsContact O-N 3.16Å; N666-M668 WeakPolarHBondContact O-CE 3.33Å
667	V	97.8	Very high	88.9	Confident	18 Å²	18	32 Å²	32	11%	0.109	16%	0.162	C	C	.	.			trans	-82.2	124.6	173	-176.6	0	0	0	0	109.4	K573 T663 D665 K669	K573-V667 HydrophobicContact CG-CG1 3.99Å; T663-V667 HydrophobicContact CG2-CB 4.14Å; T663-V667 PolarHBondContact N-O 2.84Å; T663-V667 VanDerWaalsContact N-O 3.1Å; T663-V667 VanDerWaalsContact OG1-CB 3.3Å; T663-V667 WeakPolarHBondContact OG1-CB 3.46Å; T663-V667 PolarHBondContact OG1-N 2.86Å; T663-V667 VanDerWaalsContact OG1-N 3.1Å; D665-V667 HydrophobicContact CB-CG2 4.34Å; D665-V667 PolarHBondContact O-N 3.19Å; V667-K669 HydrophobicContact CG1-CG 4.42Å
668	M	98.2	Very high	87.3	Confident	2 Å²	2	34 Å²	34	1%	0.01	17%	0.172	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-78	129.1	174.6	-55	-60.9	128.3	0	0	110.1	N574 L600 C634 Q637 V638 V660 V662 N666	N574-M668 WeakPolarHBondContact CA-O 3.44Å; N574-M668 WeakPolarHBondContact CB-O 3.5Å; N574-M668 PolarHBondContact ND2-O 3.08Å; L600-M668 HydrophobicContact CD1-SD 3.74Å; L600-M668 HydrophobicContact CD2-SD 4.24Å; L600-M668 HydrophobicContact CG-SD 4.5Å; C634-M668 HydrophobicContact CB-CG 4.23Å; C634-M668 HydrophobicContact CB-SD 4.31Å; C634-M668 VanDerWaalsContact SG-CE 3.59Å; Q637-M668 HydrophobicContact CB-CB 3.87Å; Q637-M668 HydrophobicContact CB-CG 3.98Å; Q637-M668 VanDerWaalsContact OE1-N 3.12Å; V638-M668 HydrophobicContact CG2-CB 3.91Å; V638-M668 HydrophobicContact CG2-CG 4.45Å; V660-M668 HydrophobicContact CG1-CB 4.02Å; V660-M668 HydrophobicContact CG1-SD 4.45Å; V662-M668 HydrophobicContact CG1-CE 3.84Å; V662-M668 HydrophobicContact CG2-CE 4.1Å; V662-M668 HydrophobicContact CG2-SD 3.93Å; N666-M668 WeakPolarHBondContact O-CE 3.33Å
669	K	98.1	Very high	85.6	Confident	15 Å²	15	32.8 Å²	32.8	7%	0.065	17%	0.171	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-129.7	118.1	179.8	-76.2	-179.5	171.1	-75.9	0	111.6	K573 I575 I576 N577 E593 V660 L661 T663 V667	K573-K669 WeakPolarHBondContact O-CE 2.97Å; K573-K669 PolarHBondContact O-NZ 3.07Å; I575-K669 PolarHBondContact O-NZ 2.97Å; I576-K669 HydrophobicContact CB-CB 4.47Å; I576-K669 HydrophobicContact CD1-CB 4.21Å; I576-K669 HydrophobicContact CD1-CD 3.83Å; N577-K669 PolarHBondContact ND2-NZ 2.97Å; E593-K669 VanDerWaalsContact CD-NZ 3.32Å; E593-K669 IonicContact OE1-NZ 2.88Å; E593-K669 PolarHBondContact OE1-NZ 3.23Å; E593-K669 WeakPolarHBondContact OE2-CE 3.36Å; E593-K669 IonicContact OE2-NZ 3.97Å; E593-K669 PolarHBondContact OE2-NZ 3.31Å; V660-K669 CarbonylContact C-O 3.53Å; V660-K669 WeakPolarHBondContact CA-O 3.45Å; L661-K669 PolarHBondContact N-O 2.95Å; L661-K669 PolarHBondContact O-N 3.23Å; T663-K669 HydrophobicContact CG2-CD 3.74Å; T663-K669 HydrophobicContact CG2-CG 4.4Å; V667-K669 HydrophobicContact CG1-CG 4.42Å
670	I	97.3	Very high	83.3	Confident	0 Å²	0	38.2 Å²	38.2	0%	0	20%	0.195	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-66.1	137.2	174	-58.4	161.8	0	0	0	109.8	N574 I576 V638 G641 M642 L645 H652 L655 F673	N574-I670 PolarHBondContact O-N 3.3Å; I576-I670 WeakPolarHBondContact CG2-O 3.33Å; I576-I670 PolarHBondContact N-O 3.27Å; V638-I670 HydrophobicContact CG1-CD1 4.1Å; V638-I670 HydrophobicContact CG1-CG1 3.99Å; G641-I670 VanDerWaalsContact C-CD1 3.43Å; M642-I670 HydrophobicContact CG-CD1 3.82Å; M642-I670 HydrophobicContact SD-CD1 3.73Å; L645-I670 HydrophobicContact CD1-CD1 4.15Å; L645-I670 HydrophobicContact CD1-CG2 4.28Å; H652-I670 VanDerWaalsContact CD2-CG2 3.49Å; H652-I670 WeakPolarHBondContact CD2-CG2 3.42Å; H652-I670 VanDerWaalsContact NE2-CG2 3.25Å; H652-I670 WeakPolarHBondContact NE2-CG2 3.3Å; L655-I670 HydrophobicContact CD1-CG2 4.5Å; I670-F673 HydrophobicContact CG2-CZ 4.21Å
671	A	91.8	Very high	80.9	Confident	7 Å²	7	44.8 Å²	44.8	6%	0.058	23%	0.226	C	C	.	.			trans	-146.6	175.2	-172.8	0	0	0	0	0	112.8	I576 H652 N659 L661	I576-A671 HydrophobicContact CB-CB 4.11Å; I576-A671 HydrophobicContact CG2-CB 3.67Å; H652-A671 PolarHBondContact CE1-O 3.22Å; H652-A671 PolarHBondContact NE2-O 3.05Å; N659-A671 PolarHBondContact O-N 3.1Å; L661-A671 HydrophobicContact CD1-CB 3.71Å; L661-A671 HydrophobicContact CG-CB 3.85Å
672	D	82.5	Confident	78.6	Confident	62 Å²	62	47.6 Å²	47.6	33%	0.332	24%	0.24	S	C	.	.			trans	63.9	65.9	-178.4	-154.9	25.6	0	0	0	114.3	K545 G674	K545-D672 IonicContact NZ-OD1 2.78Å; K545-D672 PolarHBondContact NZ-OD1 3.25Å; D672-G674 PolarHBondContact O-N 2.82Å
673	F	76.3	Confident	75.4	Confident	1 Å²	1	54.7 Å²	54.7	0%	0.004	28%	0.278	C	S	.	.	G	3₁₀ helix	trans	-77.8	7	-176	-70.8	-79.4	0	0	0	114.4	E562 M566 I569 I575 I576 L645 H652 I670 L675 A676	E562-F673 HydrophobicContact CG-CB 3.93Å; E562-F673 PolarHBondContact OE1-N 2.93Å; M566-F673 HydrophobicContact CE-CD2 4.41Å; M566-F673 HydrophobicContact CG-CB 4.42Å; M566-F673 HydrophobicContact CG-CD2 3.87Å; M566-F673 HydrophobicContact CG-CG 4.38Å; M566-F673 HydrophobicContact SD-CD2 4.31Å; I569-F673 HydrophobicContact CD1-CD1 3.69Å; I569-F673 HydrophobicContact CD1-CE1 3.62Å; I569-F673 HydrophobicContact CD1-CG 4.23Å; I569-F673 HydrophobicContact CD1-CZ 4.11Å; I575-F673 HydrophobicContact CG2-CE2 3.81Å; I575-F673 HydrophobicContact CG2-CZ 3.67Å; I576-F673 HydrophobicContact CG2-CE2 4.3Å; L645-F673 HydrophobicContact CD1-CE1 3.91Å; L645-F673 HydrophobicContact CD1-CZ 4.33Å; L645-F673 HydrophobicContact CD2-CE1 3.7Å; L645-F673 HydrophobicContact CD2-CZ 4.19Å; L645-F673 HydrophobicContact CG-CE1 4.48Å; H652-F673 AromaticContact CD2-CD1 3.85Å; H652-F673 AromaticContact CD2-CE1 3.56Å; H652-F673 AromaticContact NE2-CD1 3.97Å; H652-F673 AromaticContact NE2-CE1 3.83Å; I670-F673 HydrophobicContact CG2-CZ 4.21Å; F673-L675 PolarHBondContact O-N 2.86Å; F673-L675 VanDerWaalsContact O-N 3.07Å; F673-A676 HydrophobicContact CB-CB 4.18Å; F673-A676 HydrophobicContact CD1-CB 3.85Å; F673-A676 VanDerWaalsContact O-CB 3.32Å; F673-A676 WeakPolarHBondContact O-CB 3.44Å; F673-A676 PolarHBondContact O-N 3.01Å
674	G	67.4	Low	72.5	Confident	11 Å²	11	62.5 Å²	62.5	11%	0.113	31%	0.307	C	S	.	.	G	3₁₀ helix	trans	-57.3	-28	-175	0	0	0	0	0	114.9	D672 R677	D672-G674 PolarHBondContact O-N 2.82Å; G674-R677 PolarHBondContact O-NH1 3.39Å
675	L	65.5	Low	69.6	Low	29 Å²	29	59.2 Å²	59.2	15%	0.152	29%	0.289	C	S	.	.	G	3₁₀ helix	trans	-97.6	-7.5	176.4	-61.1	-179.8	0	0	0	114.4	R653 D654 F673 K687	R653-L675 WeakPolarHBondContact CD-O 3.42Å; R653-L675 PolarHBondContact NH1-O 3.49Å; D654-L675 HydrophobicContact CB-CD1 3.98Å; F673-L675 PolarHBondContact O-N 2.86Å; F673-L675 VanDerWaalsContact O-N 3.07Å; L675-K687 HydrophobicContact CD2-CD 4.13Å
676	A	69.2	Low	66.8	Low	0 Å²	0	57.1 Å²	57.1	0%	0	27%	0.273	C	S	.	.			trans	-75	148.3	-175.9	0	0	0	0	0	112.5	M565 I651 F673	M565-A676 HydrophobicContact CG-CB 4.33Å; I651-A676 CarbonylContact O-C 3.55Å; I651-A676 WeakPolarHBondContact O-CA 3.37Å; I651-A676 WeakPolarHBondContact O-CB 3.36Å; F673-A676 HydrophobicContact CB-CB 4.18Å; F673-A676 HydrophobicContact CD1-CB 3.85Å; F673-A676 VanDerWaalsContact O-CB 3.32Å; F673-A676 WeakPolarHBondContact O-CB 3.44Å; F673-A676 PolarHBondContact O-N 3.01Å
677	R	69.3	Low	63.8	Low	43 Å²	43	56.4 Å²	56.4	16%	0.162	27%	0.267	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-147.8	156	-175.3	-61.2	-65.2	179.7	-94.8	8.1	112	D558 I651 G674 Y685	D558-R677 IonicContact OD1-NH2 3.66Å; I651-R677 PolarHBondContact N-O 3.49Å; I651-R677 PolarHBondContact O-N 3.2Å; G674-R677 PolarHBondContact O-NH1 3.39Å; R677-Y685 VanDerWaalsContact NH2-CZ 3.33Å
678	D	62.1	Low	60.7	Low	41 Å²	41	60.4 Å²	60.4	22%	0.219	29%	0.292	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-73.8	136.6	167.5	-171	-44.6	0	0	0	110.3	H680 H681	D678-H680 PolarHBondContact O-N 3.44Å; D678-H680 IonicContact OD1-CD2 2.74Å; D678-H680 PolarHBondContact OD1-CD2 2.85Å; D678-H680 IonicContact OD1-CG 3.97Å; D678-H680 PolarHBondContact OD1-N 3.49Å; D678-H681 PolarHBondContact O-N 2.85Å
679	I	58.1	Low	57.5	Low	50 Å²	50	62.5 Å²	62.5	26%	0.256	31%	0.305	S	S	.	.	T	Hydrogen-bonded Turn	trans	-60.2	-20.8	178.1	-157.2	165.4	0	0	0	114.2	K649 I651 I682	K649-I679 HydrophobicContact CB-CG2 3.78Å; K649-I679 HydrophobicContact CD-CG2 4.21Å; K649-I679 HydrophobicContact CG-CG2 4.33Å; K649-I679 PolarHBondContact O-N 2.99Å; I651-I679 HydrophobicContact CD1-CB 4.26Å; I651-I679 HydrophobicContact CD1-CD1 4.4Å; I651-I679 HydrophobicContact CD1-CG1 4.05Å; I679-I682 HydrophobicContact CG1-CD1 3.92Å; I679-I682 VanDerWaalsContact O-CD1 3.28Å; I679-I682 WeakPolarHBondContact O-CD1 3.5Å; I679-I682 WeakPolarHBondContact O-CG1 2.83Å
680	H	45.4	Very low	54.4	Low	126 Å²	126	68.7 Å²	68.7	58%	0.583	34%	0.339	S	S	*	.	T	Hydrogen-bonded Turn	trans	-85.5	-10.4	174.9	-65.9	-77.7	0	0	0	113.1	K649 D678	K649-H680 WeakPolarHBondContact CD-NE2 3.4Å; K649-H680 PolarHBondContact NZ-NE2 2.86Å; D678-H680 PolarHBondContact O-N 3.44Å; D678-H680 IonicContact OD1-CD2 2.74Å; D678-H680 PolarHBondContact OD1-CD2 2.85Å; D678-H680 IonicContact OD1-CG 3.97Å; D678-H680 PolarHBondContact OD1-N 3.49Å
681	H	48.5	Very low	51.6	Low	139 Å²	139	69.2 Å²	69.2	64%	0.644	34%	0.344	S	S	*	.			trans	-108.6	42.9	175.2	-88.5	-79.3	0	0	0	112.1	D678 D683	D678-H681 PolarHBondContact O-N 2.85Å; H681-D683 PolarHBondContact O-N 2.59Å
682	I	48.7	Very low	49.7	Very low	105 Å²	105	79.9 Å²	79.9	54%	0.538	38%	0.383	S	S	.	.			trans	-73.2	-6.3	173	-71.9	174.9	0	0	0	112.3	I679 Y684	I679-I682 HydrophobicContact CG1-CD1 3.92Å; I679-I682 VanDerWaalsContact O-CD1 3.28Å; I679-I682 WeakPolarHBondContact O-CD1 3.5Å; I679-I682 WeakPolarHBondContact O-CG1 2.83Å; I682-Y684 PolarHBondContact O-N 2.76Å
683	D	30	Very low	48.9	Very low	150 Å²	150	81.3 Å²	81.3	80%	0.802	39%	0.39	S	S	*	.	S	Bend	trans	-58.9	91	172.8	-79.6	-28.4	0	0	0	113.3	H681 Y685	H681-D683 PolarHBondContact O-N 2.59Å; D683-Y685 PolarHBondContact O-N 2.84Å
684	Y	34.2	Very low	49.1	Very low	178 Å²	178	81.9 Å²	81.9	70%	0.698	39%	0.394	S	S	*	.			trans	59.4	41.6	153.9	-152.7	-100.7	0	0	0	118.1	I682 K686	I682-Y684 PolarHBondContact O-N 2.76Å; Y684-K686 VanDerWaalsContact C-N 3.26Å; Y684-K686 HydrophobicContact CE1-CB 4.11Å; Y684-K686 HydrophobicContact CE1-CD 4.41Å; Y684-K686 PolarHBondContact O-N 3.24Å
685	Y	32.8	Very low	49.8	Very low	71 Å²	71	82.5 Å²	82.5	28%	0.278	40%	0.395	S	S	.	.			trans	-72.8	82.4	159.6	-170.1	-93.4	0	0	0	111.4	K554 D558 R677 D683 K687	K554-Y685 WeakPolarHBondContact CE-OH 3.45Å; K554-Y685 PolarHBondContact NZ-OH 3.16Å; D558-Y685 PolarHBondContact OD1-OH 3.09Å; R677-Y685 VanDerWaalsContact NH2-CZ 3.33Å; D683-Y685 PolarHBondContact O-N 2.84Å; Y685-K687 HydrophobicContact CD1-CB 4.41Å; Y685-K687 HydrophobicContact CE1-CB 3.72Å; Y685-K687 HydrophobicContact CE1-CG 3.96Å; Y685-K687 PolarHBondContact O-N 3.49Å
686	K	34.5	Very low	51	Low	90 Å²	90	82.5 Å²	82.5	39%	0.391	39%	0.394	S	S	.	.			trans	-74	113	161.7	178.8	178.1	173.5	-179.9	0	108.3	Y684 T688	Y684-K686 VanDerWaalsContact C-N 3.26Å; Y684-K686 HydrophobicContact CE1-CB 4.11Å; Y684-K686 HydrophobicContact CE1-CD 4.41Å; Y684-K686 PolarHBondContact O-N 3.24Å; K686-T688 PolarHBondContact O-N 2.94Å
687	K	32.9	Very low	52.1	Low	46 Å²	46	83.8 Å²	83.8	20%	0.2	40%	0.399	C	S	.	.			trans	-68.8	95.1	178.5	-167.3	179.6	-176.7	-174.8	0	110.7	L675 Y685 T689 G691 L693	L675-K687 HydrophobicContact CD2-CD 4.13Å; Y685-K687 HydrophobicContact CD1-CB 4.41Å; Y685-K687 HydrophobicContact CE1-CB 3.72Å; Y685-K687 HydrophobicContact CE1-CG 3.96Å; Y685-K687 PolarHBondContact O-N 3.49Å; K687-T689 PolarHBondContact O-N 2.92Å; K687-G691 PolarHBondContact NZ-O 2.86Å; K687-L693 HydrophobicContact CD-CD2 4.41Å
688	T	31.9	Very low	53.1	Low	102 Å²	102	82.1 Å²	82.1	63%	0.626	39%	0.393	S	S	*	.			trans	-74.9	33.3	-179.9	45.7	0	0	0	0	115.3	K554 K686	K554-T688 PolarHBondContact NZ-OG1 2.86Å; K686-T688 PolarHBondContact O-N 2.94Å
689	T	31.5	Very low	54.4	Low	46 Å²	46	80.2 Å²	80.2	28%	0.282	38%	0.383	S	S	.	.	S	Bend	trans	-144.8	149.8	-179.4	22	0	0	0	0	112.5	K554 K687 G691	K554-T689 HydrophobicContact CD-CG2 3.8Å; K554-T689 WeakPolarHBondContact CE-OG1 3.34Å; K554-T689 PolarHBondContact NZ-OG1 2.8Å; K687-T689 PolarHBondContact O-N 2.92Å; T689-G691 PolarHBondContact O-N 2.88Å
690	N	33.4	Very low	55.8	Low	146 Å²	146	78.8 Å²	78.8	78%	0.781	38%	0.377	S	S	*	.			trans	-62.3	21	175.6	-56.6	-36.1	0	0	0	114.9	R692	N690-R692 PolarHBondContact O-N 3Å
691	G	38.7	Very low	57.6	Low	10 Å²	10	73.4 Å²	73.4	10%	0.103	35%	0.352	C	S	.	.			trans	-83.4	106.2	-176.7	0	0	0	0	0	111.2	K687 T689 L693	K687-G691 PolarHBondContact NZ-O 2.86Å; T689-G691 PolarHBondContact O-N 2.88Å; G691-L693 PolarHBondContact O-N 2.86Å
692	R	51.3	Low	59.2	Low	232 Å²	232	67 Å²	67	88%	0.875	32%	0.323	S	S	*	.			trans	-30.2	122.1	177.3	-62.9	175.3	-178.7	164.4	-0.2	112.4	N690	N690-R692 PolarHBondContact O-N 3Å
693	L	64.7	Low	60.5	Low	91 Å²	91	63.1 Å²	63.1	48%	0.476	30%	0.303	S	S	.	.			trans	-78	146.4	168.7	-70.1	176.4	0	0	0	109.8	K687 G691 V695 M698	K687-L693 HydrophobicContact CD-CD2 4.41Å; G691-L693 PolarHBondContact O-N 2.86Å; L693-V695 HydrophobicContact CB-CG2 4.25Å; L693-V695 PolarHBondContact O-N 2.72Å; L693-M698 HydrophobicContact CB-SD 3.97Å
694	P	80.1	Confident	62.6	Low	13 Å²	13	58.9 Å²	58.9	8%	0.084	28%	0.278	C	S	.	.			trans	-81.8	54.2	-176	36.3	-38.5	0	0	0	111.6	D654 K696 W697 M698	D654-P694 HydrophobicContact CB-CG 4.28Å; D654-P694 WeakPolarHBondContact OD1-CB 3.18Å; D654-P694 WeakPolarHBondContact OD1-CG 3.19Å; P694-K696 VanDerWaalsContact C-N 3.26Å; P694-K696 PolarHBondContact O-N 2.02Å; P694-W697 HydrophobicContact CB-CB 4.5Å; P694-W697 HydrophobicContact CB-CE3 4.19Å; P694-W697 WeakPolarHBondContact O-CA 3.22Å; P694-W697 PolarHBondContact O-N 3.44Å; P694-M698 HydrophobicContact CG-CG 4.08Å; P694-M698 HydrophobicContact CG-SD 4.4Å; P694-M698 PolarHBondContact O-N 3.06Å
695	V	83.4	Confident	64.3	Low	24 Å²	24	55.4 Å²	55.4	15%	0.145	27%	0.271	C	S	.	.	G	3₁₀ helix	trans	-49.9	-41	-164.7	177.2	0	0	0	0	113.9	L693 W697 M698 L703 V737 F741	L693-V695 HydrophobicContact CB-CG2 4.25Å; L693-V695 PolarHBondContact O-N 2.72Å; V695-W697 PolarHBondContact O-N 2.93Å; V695-W697 VanDerWaalsContact O-N 3.14Å; V695-M698 HydrophobicContact CG2-SD 4.4Å; V695-M698 PolarHBondContact O-N 3.44Å; V695-L703 HydrophobicContact CB-CD1 4.47Å; V695-L703 HydrophobicContact CG1-CD1 3.75Å; V695-L703 HydrophobicContact CG1-CD2 4.12Å; V695-L703 HydrophobicContact CG2-CD1 4.28Å; V695-V737 HydrophobicContact CB-CG1 3.7Å; V695-V737 HydrophobicContact CG1-CG1 3.56Å; V695-V737 HydrophobicContact CG2-CG1 4.05Å; V695-F741 HydrophobicContact CG1-CE2 4.44Å; V695-F741 HydrophobicContact CG1-CZ 4.1Å
696	K	89.4	Confident	66.1	Low	29 Å²	29	59 Å²	59	13%	0.126	28%	0.284	C	S	.	.	G	3₁₀ helix	trans	-66.7	-11.4	178.9	-61.4	-152.8	167.6	-174.2	0	115.4	P694 P731 Y732 V735 V737 L740	P694-K696 VanDerWaalsContact C-N 3.26Å; P694-K696 PolarHBondContact O-N 2.02Å; K696-P731 HydrophobicContact CB-CB 4.23Å; K696-P731 WeakPolarHBondContact CD-O 3.41Å; K696-P731 PolarHBondContact NZ-O 3Å; K696-Y732 HydrophobicContact CB-CD2 4.29Å; K696-Y732 HydrophobicContact CD-CD2 4.37Å; K696-Y732 PolarHBondContact NZ-O 2.77Å; K696-V735 WeakPolarHBondContact CE-O 3.46Å; K696-V735 PolarHBondContact NZ-O 2.76Å; K696-V737 HydrophobicContact CG-CG2 4.39Å; K696-L740 HydrophobicContact CB-CD2 4.27Å; K696-L740 HydrophobicContact CD-CD2 4.44Å; K696-L740 HydrophobicContact CG-CD2 3.8Å
697	W	94.1	Very high	68.1	Low	27 Å²	27	59 Å²	59	10%	0.102	29%	0.288	C	S	.	.	G	3₁₀ helix	trans	-106.1	-11.5	173.3	-65.6	-101.9	0	0	0	112.7	L655 A656 R658 P694 V695 W715 S716 V719 E723 P731	L655-W697 VanDerWaalsContact O-CD1 3.28Å; A656-W697 HydrophobicContact CB-CD2 4.11Å; A656-W697 HydrophobicContact CB-CG 4.1Å; A656-W697 HydrophobicContact CB-CZ2 4.28Å; A656-W697 VanDerWaalsContact CB-NE1 3.29Å; R658-W697 VanDerWaalsContact NH1-CZ2 3.3Å; P694-W697 HydrophobicContact CB-CB 4.5Å; P694-W697 HydrophobicContact CB-CE3 4.19Å; P694-W697 WeakPolarHBondContact O-CA 3.22Å; P694-W697 PolarHBondContact O-N 3.44Å; V695-W697 PolarHBondContact O-N 2.93Å; V695-W697 VanDerWaalsContact O-N 3.14Å; W697-W715 VanDerWaalsContact O-CD1 3.32Å; W697-S716 WeakPolarHBondContact O-CA 3.47Å; W697-S716 PolarHBondContact O-OG 2.8Å; W697-S716 VanDerWaalsContact O-OG 3.12Å; W697-V719 VanDerWaalsContact CD1-CG1 3.4Å; W697-V719 HydrophobicContact CD2-CG1 4.35Å; W697-V719 HydrophobicContact CG-CB 4.39Å; W697-V719 HydrophobicContact CG-CG1 3.87Å; W697-E723 WeakPolarHBondContact CZ2-OE1 3.28Å; W697-E723 PolarHBondContact NE1-OE2 2.97Å; W697-P731 HydrophobicContact CH2-CG 4.32Å; W697-P731 HydrophobicContact CZ2-CG 3.73Å
698	M	89.1	Confident	70.4	Confident	9 Å²	9	58.7 Å²	58.7	4%	0.044	29%	0.285	C	S	.	.			trans	-77.5	137.3	-173.8	-70.6	175	58.6	0	0	112.3	L693 P694 V695 A702 L703 Y708 W715	L693-M698 HydrophobicContact CB-SD 3.97Å; P694-M698 HydrophobicContact CG-CG 4.08Å; P694-M698 HydrophobicContact CG-SD 4.4Å; P694-M698 PolarHBondContact O-N 3.06Å; V695-M698 HydrophobicContact CG2-SD 4.4Å; V695-M698 PolarHBondContact O-N 3.44Å; M698-A702 HydrophobicContact CE-CB 4.47Å; M698-A702 VanDerWaalsContact CE-O 3.28Å; M698-A702 WeakPolarHBondContact CE-O 3.37Å; M698-L703 HydrophobicContact CB-CB 4.4Å; M698-L703 HydrophobicContact CB-CD1 4.39Å; M698-L703 HydrophobicContact CE-CB 4.29Å; M698-L703 HydrophobicContact CE-CD1 3.81Å; M698-L703 HydrophobicContact SD-CD1 4.17Å; M698-Y708 VanDerWaalsContact CE-OH 3.31Å; M698-Y708 WeakPolarHBondContact CE-OH 3.34Å; M698-W715 PolarHBondContact O-NE1 2.73Å; M698-W715 VanDerWaalsContact O-NE1 3.14Å
699	A	90.5	Very high	73	Confident	1 Å²	1	55.8 Å²	55.8	1%	0.008	27%	0.268	C	S	.	.			trans	-67.2	151.4	172.3	0	0	0	0	0	112	E701 A702 L703 W715	A699-E701 VanDerWaalsContact C-N 3.32Å; A699-E701 VanDerWaalsContact CB-OE1 3.23Å; A699-E701 WeakPolarHBondContact CB-OE1 2.75Å; A699-E701 WeakPolarHBondContact CB-OE2 3.43Å; A699-E701 PolarHBondContact O-N 3.03Å; A699-A702 HydrophobicContact CB-CB 4.26Å; A699-A702 CarbonylContact O-C 3.55Å; A699-A702 WeakPolarHBondContact O-CA 3.28Å; A699-A702 WeakPolarHBondContact O-CB 3.36Å; A699-A702 PolarHBondContact O-N 2.84Å; A699-L703 WeakPolarHBondContact O-CB 3.44Å; A699-L703 PolarHBondContact O-N 2.78Å; A699-W715 HydrophobicContact CB-CB 3.68Å; A699-W715 HydrophobicContact CB-CD2 4.16Å; A699-W715 HydrophobicContact CB-CG 3.72Å
700	P	86.7	Confident	75.9	Confident	19 Å²	19	55.3 Å²	55.3	12%	0.123	26%	0.262	C	S	.	.	H	α-helix	trans	-52.7	-45.4	178.9	-29	36.2	0	0	0	113.4	A702 L703 F704 W715	P700-A702 VanDerWaalsContact C-N 3.29Å; P700-A702 PolarHBondContact O-N 3.21Å; P700-L703 PolarHBondContact O-N 3.17Å; P700-L703 VanDerWaalsContact O-N 3.13Å; P700-F704 HydrophobicContact CB-CD2 4.08Å; P700-F704 HydrophobicContact CB-CE2 4.07Å; P700-F704 WeakPolarHBondContact O-CD2 3.49Å; P700-F704 PolarHBondContact O-N 3.07Å; P700-W715 VanDerWaalsContact CD-CE3 3.42Å; P700-W715 HydrophobicContact CG-CE3 4.18Å; P700-W715 HydrophobicContact CG-CH2 3.52Å; P700-W715 HydrophobicContact CG-CZ2 4.11Å; P700-W715 HydrophobicContact CG-CZ3 3.56Å
701	E	83.2	Confident	78.9	Confident	14 Å²	14	50 Å²	50	7%	0.065	23%	0.233	C	C	.	.	H	α-helix	trans	-68.7	-27.7	179.6	74.5	-71.2	174	0	0	112.9	A699 D705 R706 I707 S712 P772 R775	A699-E701 VanDerWaalsContact C-N 3.32Å; A699-E701 VanDerWaalsContact CB-OE1 3.23Å; A699-E701 WeakPolarHBondContact CB-OE1 2.75Å; A699-E701 WeakPolarHBondContact CB-OE2 3.43Å; A699-E701 PolarHBondContact O-N 3.03Å; E701-D705 WeakPolarHBondContact CA-OD2 3.32Å; E701-D705 CarbonylContact O-C 3.56Å; E701-D705 WeakPolarHBondContact O-CA 3.42Å; E701-D705 WeakPolarHBondContact O-CB 3.45Å; E701-D705 PolarHBondContact O-N 2.85Å; E701-R706 PolarHBondContact O-N 2.78Å; E701-I707 CarbonylContact C-O 3.58Å; E701-I707 HydrophobicContact CB-CB 4.34Å; E701-I707 HydrophobicContact CG-CB 4.3Å; E701-I707 HydrophobicContact CG-CG2 4.39Å; E701-I707 PolarHBondContact O-N 3.48Å; E701-S712 WeakPolarHBondContact OE1-CA 3.47Å; E701-S712 VanDerWaalsContact OE1-CB 3.26Å; E701-S712 WeakPolarHBondContact OE1-CB 3.34Å; E701-S712 PolarHBondContact OE1-OG 2.83Å; E701-P772 HydrophobicContact CB-CG 4.49Å; E701-P772 HydrophobicContact CG-CG 3.96Å; E701-R775 IonicContact OE1-CZ 3.4Å; E701-R775 IonicContact OE1-NH1 3.63Å; E701-R775 PolarHBondContact OE1-NH1 2.83Å; E701-R775 IonicContact OE1-NH2 3.6Å; E701-R775 IonicContact OE2-CZ 2.73Å; E701-R775 IonicContact OE2-NH1 2.7Å; E701-R775 PolarHBondContact OE2-NH1 2.86Å; E701-R775 IonicContact OE2-NH2 3.26Å; E701-R775 PolarHBondContact OE2-NH2 3.4Å
702	A	83.1	Confident	81.5	Confident	3 Å²	3	49.7 Å²	49.7	3%	0.025	23%	0.229	C	C	.	.	H	α-helix	trans	-79	-23.5	173.8	0	0	0	0	0	112.8	M698 A699 P700 I707 Y708	M698-A702 HydrophobicContact CE-CB 4.47Å; M698-A702 VanDerWaalsContact CE-O 3.28Å; M698-A702 WeakPolarHBondContact CE-O 3.37Å; A699-A702 HydrophobicContact CB-CB 4.26Å; A699-A702 CarbonylContact O-C 3.55Å; A699-A702 WeakPolarHBondContact O-CA 3.28Å; A699-A702 WeakPolarHBondContact O-CB 3.36Å; A699-A702 PolarHBondContact O-N 2.84Å; P700-A702 VanDerWaalsContact C-N 3.29Å; P700-A702 PolarHBondContact O-N 3.21Å; A702-I707 WeakPolarHBondContact CA-O 3.35Å; A702-I707 WeakPolarHBondContact CB-O 3.35Å; A702-I707 PolarHBondContact N-O 3.41Å; A702-Y708 HydrophobicContact CB-CD1 3.94Å; A702-Y708 HydrophobicContact CB-CE1 3.75Å; A702-Y708 HydrophobicContact CB-CE2 4.41Å; A702-Y708 HydrophobicContact CB-CG 4.41Å; A702-Y708 PolarHBondContact O-OH 2.8Å
703	L	74.4	Confident	83.7	Confident	25 Å²	25	38.7 Å²	38.7	13%	0.131	19%	0.188	C	C	.	.	H	α-helix	trans	-92.6	-42.8	-175.5	-171.5	62.8	0	0	0	113	V695 M698 A699 P700 F741 L744	V695-L703 HydrophobicContact CB-CD1 4.47Å; V695-L703 HydrophobicContact CG1-CD1 3.75Å; V695-L703 HydrophobicContact CG1-CD2 4.12Å; V695-L703 HydrophobicContact CG2-CD1 4.28Å; M698-L703 HydrophobicContact CB-CB 4.4Å; M698-L703 HydrophobicContact CB-CD1 4.39Å; M698-L703 HydrophobicContact CE-CB 4.29Å; M698-L703 HydrophobicContact CE-CD1 3.81Å; M698-L703 HydrophobicContact SD-CD1 4.17Å; A699-L703 WeakPolarHBondContact O-CB 3.44Å; A699-L703 PolarHBondContact O-N 2.78Å; P700-L703 PolarHBondContact O-N 3.17Å; P700-L703 VanDerWaalsContact O-N 3.13Å; L703-F741 HydrophobicContact CD1-CD1 4.29Å; L703-F741 HydrophobicContact CD1-CE1 3.52Å; L703-F741 HydrophobicContact CD1-CZ 4.15Å; L703-F741 HydrophobicContact CD2-CD1 3.71Å; L703-F741 HydrophobicContact CD2-CE1 3.8Å; L703-F741 HydrophobicContact CG-CD1 3.88Å; L703-F741 HydrophobicContact CG-CE1 3.6Å; L703-L744 HydrophobicContact CD2-CD1 4.09Å
704	F	74.1	Confident	85.3	Confident	60 Å²	60	34.4 Å²	34.4	26%	0.263	17%	0.165	S	C	.	.	T	Hydrogen-bonded Turn	trans	-92.4	-56.5	179	-56.2	-59.3	0	0	0	111.2	P700 F741 K745	P700-F704 HydrophobicContact CB-CD2 4.08Å; P700-F704 HydrophobicContact CB-CE2 4.07Å; P700-F704 WeakPolarHBondContact O-CD2 3.49Å; P700-F704 PolarHBondContact O-N 3.07Å; F704-F741 HydrophobicContact CE1-CB 4.22Å; F704-F741 AromaticContact CE1-CD1 3.8Å; F704-F741 HydrophobicContact CE1-CD1 3.8Å; F704-F741 HydrophobicContact CZ-CD1 4.42Å; F704-F741 WeakPolarHBondContact CZ-O 3.46Å; F704-K745 HydrophobicContact CE1-CD 4.34Å; F704-K745 VanDerWaalsContact CE1-CE 3.42Å; F704-K745 HydrophobicContact CE1-CG 4.31Å; F704-K745 HydrophobicContact CE2-CG 3.9Å; F704-K745 HydrophobicContact CZ-CD 4.19Å; F704-K745 HydrophobicContact CZ-CG 3.68Å
705	D	70.3	Confident	86.2	Confident	106 Å²	106	33.8 Å²	33.8	57%	0.567	16%	0.161	S	C	*	.	S	Bend	trans	-90.4	-8.1	-170.6	-41.8	-53.7	0	0	0	113	E701 I707	E701-D705 WeakPolarHBondContact CA-OD2 3.32Å; E701-D705 CarbonylContact O-C 3.56Å; E701-D705 WeakPolarHBondContact O-CA 3.42Å; E701-D705 WeakPolarHBondContact O-CB 3.45Å; E701-D705 PolarHBondContact O-N 2.85Å; D705-I707 HydrophobicContact CB-CD1 3.84Å; D705-I707 HydrophobicContact CB-CG1 3.95Å; D705-I707 PolarHBondContact O-N 2.62Å
706	R	71.7	Confident	86.9	Confident	145 Å²	145	33 Å²	33	55%	0.547	16%	0.156	S	C	.	.			trans	60	21	-175.1	-52.6	-178.1	177.5	-151.2	-4.1	114.3	E701 Y708	E701-R706 PolarHBondContact O-N 2.78Å; R706-Y708 WeakPolarHBondContact O-CD2 3.29Å; R706-Y708 WeakPolarHBondContact O-CE2 3.35Å
707	I	74.8	Confident	87.3	Confident	90 Å²	90	31.6 Å²	31.6	46%	0.462	15%	0.15	S	C	.	.			trans	-81	124.7	176.8	-63	172.7	0	0	0	108.8	E701 A702 D705 T709	E701-I707 CarbonylContact C-O 3.58Å; E701-I707 HydrophobicContact CB-CB 4.34Å; E701-I707 HydrophobicContact CG-CB 4.3Å; E701-I707 HydrophobicContact CG-CG2 4.39Å; E701-I707 PolarHBondContact O-N 3.48Å; A702-I707 WeakPolarHBondContact CA-O 3.35Å; A702-I707 WeakPolarHBondContact CB-O 3.35Å; A702-I707 PolarHBondContact N-O 3.41Å; D705-I707 HydrophobicContact CB-CD1 3.84Å; D705-I707 HydrophobicContact CB-CG1 3.95Å; D705-I707 PolarHBondContact O-N 2.62Å; I707-T709 HydrophobicContact CG2-CG2 4.06Å
708	Y	81.4	Confident	87.6	Confident	40 Å²	40	30.3 Å²	30.3	16%	0.157	15%	0.145	C	C	.	.			trans	-116.4	127.4	175.8	-68.2	-96.3	0	0	0	109.9	I651 R653 M698 A702 R706	I651-Y708 WeakPolarHBondContact CD1-O 3.29Å; R653-Y708 HydrophobicContact CB-CD1 4.05Å; R653-Y708 HydrophobicContact CB-CE1 4.17Å; R653-Y708 HydrophobicContact CG-CD1 3.66Å; R653-Y708 HydrophobicContact CG-CE1 4.27Å; R653-Y708 HydrophobicContact CG-CG 4.31Å; R653-Y708 VanDerWaalsContact NE-CG 3.31Å; R653-Y708 VanDerWaalsContact NH2-CE2 3.33Å; M698-Y708 VanDerWaalsContact CE-OH 3.31Å; M698-Y708 WeakPolarHBondContact CE-OH 3.34Å; A702-Y708 HydrophobicContact CB-CD1 3.94Å; A702-Y708 HydrophobicContact CB-CE1 3.75Å; A702-Y708 HydrophobicContact CB-CE2 4.41Å; A702-Y708 HydrophobicContact CB-CG 4.41Å; A702-Y708 PolarHBondContact O-OH 2.8Å; R706-Y708 WeakPolarHBondContact O-CD2 3.29Å; R706-Y708 WeakPolarHBondContact O-CE2 3.35Å
709	T	88.3	Confident	88	Confident	41 Å²	41	29.9 Å²	29.9	25%	0.252	14%	0.143	S	C	.	.			trans	-139.8	171.8	177.4	66.7	0	0	0	0	110.3	I707 Q711 S712 D713	I707-T709 HydrophobicContact CG2-CG2 4.06Å; T709-Q711 PolarHBondContact O-N 3.28Å; T709-Q711 PolarHBondContact OG1-N 3.12Å; T709-S712 PolarHBondContact N-OG 2.89Å; T709-S712 WeakPolarHBondContact O-CA 3.49Å; T709-S712 VanDerWaalsContact O-CB 3.23Å; T709-S712 WeakPolarHBondContact O-CB 3.5Å; T709-S712 PolarHBondContact O-N 2.69Å; T709-S712 PolarHBondContact O-OG 2.83Å; T709-S712 PolarHBondContact OG1-N 3.19Å; T709-S712 PolarHBondContact OG1-OG 3.38Å; T709-S712 VanDerWaalsContact OG1-OG 3.05Å; T709-D713 PolarHBondContact O-N 3.03Å
710	H	91.6	Very high	88.4	Confident	37 Å²	37	29.8 Å²	29.8	17%	0.171	14%	0.143	C	C	.	.	H	α-helix	trans	-57.4	-31.2	168.5	-55.8	-53	0	0	0	112.4	A646 C650 S712 D713 V714	A646-H710 HydrophobicContact CB-CB 4.47Å; C650-H710 PolarHBondContact O-CE1 2.85Å; C650-H710 PolarHBondContact O-ND1 2.86Å; H710-S712 PolarHBondContact O-N 2.89Å; H710-D713 WeakPolarHBondContact O-CB 3.35Å; H710-D713 PolarHBondContact O-N 2.86Å; H710-V714 WeakPolarHBondContact O-CG2 3.44Å; H710-V714 PolarHBondContact O-N 2.94Å
711	Q	96.3	Very high	88.9	Confident	35 Å²	35	28.9 Å²	28.9	16%	0.164	14%	0.137	C	C	.	.	H	α-helix	trans	-70.6	-20.5	175.1	-56.1	-58.6	101.4	0	0	112.7	T709 W715 P772 R775	T709-Q711 PolarHBondContact O-N 3.28Å; T709-Q711 PolarHBondContact OG1-N 3.12Å; Q711-W715 PolarHBondContact O-N 2.88Å; Q711-P772 HydrophobicContact CB-CB 3.82Å; Q711-P772 WeakPolarHBondContact CB-O 3.02Å; Q711-P772 WeakPolarHBondContact CG-O 3.49Å; Q711-P772 PolarHBondContact NE2-O 2.83Å; Q711-R775 PolarHBondContact NE2-O 3.25Å; Q711-R775 WeakPolarHBondContact O-CD 3.42Å; Q711-R775 PolarHBondContact O-NH1 3.08Å
712	S	94	Very high	89.6	Confident	3 Å²	3	29.2 Å²	29.2	2%	0.021	14%	0.137	C	C	.	.	H	α-helix	trans	-77.9	-33	172.1	-43.2	0	0	0	0	111.4	E701 T709 H710 S716	E701-S712 WeakPolarHBondContact OE1-CA 3.47Å; E701-S712 VanDerWaalsContact OE1-CB 3.26Å; E701-S712 WeakPolarHBondContact OE1-CB 3.34Å; E701-S712 PolarHBondContact OE1-OG 2.83Å; T709-S712 PolarHBondContact N-OG 2.89Å; T709-S712 WeakPolarHBondContact O-CA 3.49Å; T709-S712 VanDerWaalsContact O-CB 3.23Å; T709-S712 WeakPolarHBondContact O-CB 3.5Å; T709-S712 PolarHBondContact O-N 2.69Å; T709-S712 PolarHBondContact O-OG 2.83Å; T709-S712 PolarHBondContact OG1-N 3.19Å; T709-S712 PolarHBondContact OG1-OG 3.38Å; T709-S712 VanDerWaalsContact OG1-OG 3.05Å; H710-S712 PolarHBondContact O-N 2.89Å; S712-S716 PolarHBondContact O-N 3.47Å; S712-S716 PolarHBondContact O-OG 2.94Å
713	D	96.7	Very high	90.3	Very high	1 Å²	1	29.1 Å²	29.1	1%	0.005	14%	0.136	C	C	.	.	H	α-helix	trans	-70.1	-34.2	167.9	-75.8	-24.3	0	0	0	111.9	M642 I651 H652 R653 T709 H710 W715 S716 F717 F778	M642-D713 HydrophobicContact CE-CB 3.68Å; I651-D713 VanDerWaalsContact CA-OD2 3.26Å; I651-D713 WeakPolarHBondContact CA-OD2 3.46Å; I651-D713 WeakPolarHBondContact CG2-OD2 3.24Å; H652-D713 PolarHBondContact N-OD1 3.02Å; H652-D713 PolarHBondContact N-OD2 3.03Å; R653-D713 PolarHBondContact N-OD1 2.82Å; T709-D713 PolarHBondContact O-N 3.03Å; H710-D713 WeakPolarHBondContact O-CB 3.35Å; H710-D713 PolarHBondContact O-N 2.86Å; D713-W715 VanDerWaalsContact C-N 3.29Å; D713-W715 PolarHBondContact O-N 3.01Å; D713-S716 CarbonylContact O-C 3.54Å; D713-S716 WeakPolarHBondContact O-CA 3.37Å; D713-S716 VanDerWaalsContact O-CB 3.31Å; D713-S716 WeakPolarHBondContact O-CB 3.41Å; D713-S716 PolarHBondContact O-N 3.4Å; D713-S716 VanDerWaalsContact O-N 3.11Å; D713-F717 PolarHBondContact O-N 2.76Å; D713-F778 HydrophobicContact CB-CE2 3.84Å; D713-F778 HydrophobicContact CB-CZ 3.97Å
714	V	98.6	Very high	91.4	Very high	0 Å²	0	27.9 Å²	27.9	0%	0	13%	0.13	C	C	.	.	H	α-helix	trans	-58.7	-40.5	173.9	166.3	0	0	0	0	111.5	H710 F717 G718 C767 R775 P776 F778 L781	H710-V714 WeakPolarHBondContact O-CG2 3.44Å; H710-V714 PolarHBondContact O-N 2.94Å; V714-F717 WeakPolarHBondContact O-CB 3.49Å; V714-F717 PolarHBondContact O-N 3.22Å; V714-G718 PolarHBondContact O-N 2.99Å; V714-C767 HydrophobicContact CG1-CB 4.05Å; V714-R775 HydrophobicContact CG1-CB 3.92Å; V714-P776 HydrophobicContact CG1-CG 4.47Å; V714-P776 WeakPolarHBondContact CG1-O 3.26Å; V714-P776 WeakPolarHBondContact CG2-O 3.24Å; V714-F778 HydrophobicContact CB-CZ 4.36Å; V714-F778 HydrophobicContact CG2-CD1 4.38Å; V714-F778 HydrophobicContact CG2-CD2 3.85Å; V714-F778 HydrophobicContact CG2-CE1 4.15Å; V714-F778 HydrophobicContact CG2-CE2 3.59Å; V714-F778 HydrophobicContact CG2-CG 4.24Å; V714-F778 HydrophobicContact CG2-CZ 3.75Å; V714-L781 HydrophobicContact CG1-CD1 4.19Å; V714-L781 HydrophobicContact CG2-CD1 4.43Å
715	W	98.5	Very high	92.4	Very high	1 Å²	1	25.1 Å²	25.1	0%	0.004	12%	0.118	C	C	.	.	H	α-helix	trans	-60.6	-47.3	172.5	176.3	-71.5	0	0	0	111.5	W697 M698 A699 P700 Q711 D713 F717 G718 V719 L744 R749 C767 W768	W697-W715 VanDerWaalsContact O-CD1 3.32Å; M698-W715 PolarHBondContact O-NE1 2.73Å; M698-W715 VanDerWaalsContact O-NE1 3.14Å; A699-W715 HydrophobicContact CB-CB 3.68Å; A699-W715 HydrophobicContact CB-CD2 4.16Å; A699-W715 HydrophobicContact CB-CG 3.72Å; P700-W715 VanDerWaalsContact CD-CE3 3.42Å; P700-W715 HydrophobicContact CG-CE3 4.18Å; P700-W715 HydrophobicContact CG-CH2 3.52Å; P700-W715 HydrophobicContact CG-CZ2 4.11Å; P700-W715 HydrophobicContact CG-CZ3 3.56Å; Q711-W715 PolarHBondContact O-N 2.88Å; D713-W715 VanDerWaalsContact C-N 3.29Å; D713-W715 PolarHBondContact O-N 3.01Å; W715-F717 PolarHBondContact O-N 2.78Å; W715-G718 WeakPolarHBondContact O-CA 3.3Å; W715-G718 PolarHBondContact O-N 2.9Å; W715-G718 VanDerWaalsContact O-N 3.07Å; W715-V719 PolarHBondContact O-N 2.86Å; W715-V719 VanDerWaalsContact O-N 3.08Å; W715-L744 HydrophobicContact CH2-CD2 3.96Å; W715-L744 HydrophobicContact CZ2-CD2 3.7Å; W715-R749 VanDerWaalsContact CH2-CZ 3.49Å; W715-C767 WeakPolarHBondContact CA-O 3.45Å; W715-W768 HydrophobicContact CD2-CB 4.44Å; W715-W768 AromaticContact CD2-CD1 3.79Å; W715-W768 HydrophobicContact CD2-CG 4.47Å; W715-W768 AromaticContact CE2-CD1 3.89Å; W715-W768 VanDerWaalsContact CE3-CA 3.48Å; W715-W768 HydrophobicContact CE3-CB 4.02Å; W715-W768 HydrophobicContact CH2-CB 4.13Å; W715-W768 HydrophobicContact CZ3-CB 3.86Å; W715-W768 WeakPolarHBondContact CZ3-O 3.41Å; W715-W768 PolarHBondContact O-NE1 2.87Å
716	S	98.3	Very high	93.5	Very high	6 Å²	6	21.3 Å²	21.3	4%	0.042	10%	0.098	C	C	.	.	H	α-helix	trans	-57.4	-37.7	175.3	-49.5	0	0	0	0	111.6	W697 S712 D713 V719 L720	W697-S716 WeakPolarHBondContact O-CA 3.47Å; W697-S716 PolarHBondContact O-OG 2.8Å; W697-S716 VanDerWaalsContact O-OG 3.12Å; S712-S716 PolarHBondContact O-N 3.47Å; S712-S716 PolarHBondContact O-OG 2.94Å; D713-S716 CarbonylContact O-C 3.54Å; D713-S716 WeakPolarHBondContact O-CA 3.37Å; D713-S716 VanDerWaalsContact O-CB 3.31Å; D713-S716 WeakPolarHBondContact O-CB 3.41Å; D713-S716 PolarHBondContact O-N 3.4Å; D713-S716 VanDerWaalsContact O-N 3.11Å; S716-V719 PolarHBondContact O-N 2.95Å; S716-L720 PolarHBondContact O-N 3.13Å
717	F	98.8	Very high	94.5	Very high	0 Å²	0	14.7 Å²	14.7	0%	0	7%	0.074	C	C	.	.	H	α-helix	trans	-66.2	-40.5	174.5	-179.5	-100.5	0	0	0	112.1	V638 A639 L655 D713 V714 W715 V719 L720 L721 F778 L781 L785	V638-F717 HydrophobicContact CB-CE2 4.21Å; V638-F717 HydrophobicContact CG1-CD2 4.26Å; V638-F717 HydrophobicContact CG1-CE2 4.16Å; A639-F717 HydrophobicContact CB-CE1 4.45Å; A639-F717 HydrophobicContact CB-CE2 4.05Å; A639-F717 HydrophobicContact CB-CZ 3.71Å; L655-F717 HydrophobicContact CD2-CB 3.82Å; L655-F717 HydrophobicContact CD2-CD2 4.27Å; D713-F717 PolarHBondContact O-N 2.76Å; V714-F717 WeakPolarHBondContact O-CB 3.49Å; V714-F717 PolarHBondContact O-N 3.22Å; W715-F717 PolarHBondContact O-N 2.78Å; F717-V719 VanDerWaalsContact C-N 3.26Å; F717-V719 PolarHBondContact O-N 3.1Å; F717-L720 HydrophobicContact CD2-CD2 4.28Å; F717-L720 CarbonylContact O-C 3.48Å; F717-L720 WeakPolarHBondContact O-CA 3.41Å; F717-L720 WeakPolarHBondContact O-CB 3.48Å; F717-L720 PolarHBondContact O-N 2.67Å; F717-L720 VanDerWaalsContact O-N 3.1Å; F717-L721 HydrophobicContact CD1-CD1 4.14Å; F717-L721 HydrophobicContact CD1-CG 4.11Å; F717-L721 HydrophobicContact CE1-CD1 3.76Å; F717-L721 HydrophobicContact CE1-CD2 3.8Å; F717-L721 HydrophobicContact CE1-CG 3.75Å; F717-L721 HydrophobicContact CE2-CD2 4.39Å; F717-L721 HydrophobicContact CZ-CD1 4.49Å; F717-L721 HydrophobicContact CZ-CD2 3.67Å; F717-L721 HydrophobicContact CZ-CG 4.07Å; F717-L721 WeakPolarHBondContact O-CG 3.43Å; F717-L721 PolarHBondContact O-N 2.67Å; F717-F778 HydrophobicContact CB-CE1 3.67Å; F717-F778 HydrophobicContact CB-CZ 4.04Å; F717-F778 HydrophobicContact CD1-CE1 4.26Å; F717-F778 HydrophobicContact CD2-CE1 4.17Å; F717-F778 AromaticContact CG-CE1 3.78Å; F717-F778 HydrophobicContact CG-CE1 3.78Å; F717-L781 HydrophobicContact CD1-CD1 3.75Å; F717-L781 HydrophobicContact CE1-CB 4.48Å; F717-L781 HydrophobicContact CE1-CD1 3.98Å; F717-L781 HydrophobicContact CE1-CD2 4.32Å; F717-L785 HydrophobicContact CE1-CD1 4.27Å; F717-L785 HydrophobicContact CZ-CD1 3.91Å
718	G	98.5	Very high	95.3	Very high	0 Å²	0	10.4 Å²	10.4	0%	0	5%	0.052	C	C	.	.	H	α-helix	trans	-57.1	-39.6	170.5	0	0	0	0	0	112.6	V714 W715 L721 W722 W768	V714-G718 PolarHBondContact O-N 2.99Å; W715-G718 WeakPolarHBondContact O-CA 3.3Å; W715-G718 PolarHBondContact O-N 2.9Å; W715-G718 VanDerWaalsContact O-N 3.07Å; G718-L721 PolarHBondContact O-N 2.85Å; G718-W722 PolarHBondContact O-N 3.08Å; G718-W768 VanDerWaalsContact C-NE1 3.3Å; G718-W768 VanDerWaalsContact O-CZ2 3.23Å; G718-W768 WeakPolarHBondContact O-CZ2 3.39Å
719	V	98.4	Very high	95.7	Very high	0 Å²	0	9 Å²	9	0%	0	5%	0.049	C	C	.	.	H	α-helix	trans	-68	-39.7	173.9	-178	0	0	0	0	111.6	W697 W715 S716 F717 W722 E723 P731 M750 W768	W697-V719 VanDerWaalsContact CD1-CG1 3.4Å; W697-V719 HydrophobicContact CD2-CG1 4.35Å; W697-V719 HydrophobicContact CG-CB 4.39Å; W697-V719 HydrophobicContact CG-CG1 3.87Å; W715-V719 PolarHBondContact O-N 2.86Å; W715-V719 VanDerWaalsContact O-N 3.08Å; S716-V719 PolarHBondContact O-N 2.95Å; F717-V719 VanDerWaalsContact C-N 3.26Å; F717-V719 PolarHBondContact O-N 3.1Å; V719-W722 WeakPolarHBondContact O-CB 3.43Å; V719-W722 PolarHBondContact O-N 3.03Å; V719-E723 PolarHBondContact O-N 3.2Å; V719-P731 HydrophobicContact CG1-CB 3.76Å; V719-P731 HydrophobicContact CG1-CG 3.47Å; V719-P731 VanDerWaalsContact CG1-CG 3.47Å; V719-M750 HydrophobicContact CG1-CE 4.18Å; V719-M750 HydrophobicContact CG2-CE 4.27Å; V719-W768 HydrophobicContact CG2-CZ2 4.44Å
720	L	98.4	Very high	95.7	Very high	0 Å²	0	9.9 Å²	9.9	0%	0	6%	0.057	C	C	.	.	H	α-helix	trans	-63.2	-39.3	173.4	173.1	63.1	0	0	0	112.6	L600 V638 L655 A657 V660 S716 F717 W722 E723 I724	L600-L720 HydrophobicContact CD2-CD1 4.4Å; V638-L720 HydrophobicContact CB-CD2 4.27Å; V638-L720 HydrophobicContact CG1-CD2 3.61Å; V638-L720 HydrophobicContact CG2-CD2 4.42Å; L655-L720 HydrophobicContact CD1-CD2 4.1Å; L655-L720 HydrophobicContact CG-CD2 4.17Å; A657-L720 HydrophobicContact CB-CD1 3.77Å; V660-L720 HydrophobicContact CG2-CD2 4.23Å; S716-L720 PolarHBondContact O-N 3.13Å; F717-L720 HydrophobicContact CD2-CD2 4.28Å; F717-L720 CarbonylContact O-C 3.48Å; F717-L720 WeakPolarHBondContact O-CA 3.41Å; F717-L720 WeakPolarHBondContact O-CB 3.48Å; F717-L720 PolarHBondContact O-N 2.67Å; F717-L720 VanDerWaalsContact O-N 3.1Å; L720-W722 VanDerWaalsContact C-N 3.27Å; L720-W722 PolarHBondContact O-N 2.97Å; L720-E723 WeakPolarHBondContact O-CB 3.17Å; L720-E723 PolarHBondContact O-N 3.49Å; L720-I724 HydrophobicContact CD1-CD1 4.14Å; L720-I724 HydrophobicContact CD1-CG1 4.21Å; L720-I724 HydrophobicContact CG-CD1 4Å; L720-I724 WeakPolarHBondContact O-CG1 3.48Å; L720-I724 PolarHBondContact O-N 3.13Å
721	L	98.4	Very high	95.7	Very high	0 Å²	0	8.1 Å²	8.1	0%	0	5%	0.049	C	C	.	.	H	α-helix	trans	-56.8	-45.4	171.9	-69.5	179.8	0	0	0	110	A635 F717 G718 E723 I724 F725 M763 M764	A635-L721 HydrophobicContact CB-CD2 3.4Å; A635-L721 VanDerWaalsContact CB-CD2 3.4Å; F717-L721 HydrophobicContact CD1-CD1 4.14Å; F717-L721 HydrophobicContact CD1-CG 4.11Å; F717-L721 HydrophobicContact CE1-CD1 3.76Å; F717-L721 HydrophobicContact CE1-CD2 3.8Å; F717-L721 HydrophobicContact CE1-CG 3.75Å; F717-L721 HydrophobicContact CE2-CD2 4.39Å; F717-L721 HydrophobicContact CZ-CD1 4.49Å; F717-L721 HydrophobicContact CZ-CD2 3.67Å; F717-L721 HydrophobicContact CZ-CG 4.07Å; F717-L721 WeakPolarHBondContact O-CG 3.43Å; F717-L721 PolarHBondContact O-N 2.67Å; G718-L721 PolarHBondContact O-N 2.85Å; L721-E723 PolarHBondContact O-N 3.43Å; L721-I724 PolarHBondContact O-N 3.18Å; L721-F725 VanDerWaalsContact O-CD2 3.26Å; L721-F725 WeakPolarHBondContact O-CD2 3.34Å; L721-F725 PolarHBondContact O-N 3.13Å; L721-M763 HydrophobicContact CD1-CG 4.22Å; L721-M763 HydrophobicContact CD1-SD 4.16Å; L721-M764 HydrophobicContact CB-CE 3.92Å; L721-M764 HydrophobicContact CB-CG 3.84Å; L721-M764 HydrophobicContact CD1-CG 4.06Å
722	W	97.9	Very high	95.4	Very high	20 Å²	20	6.6 Å²	6.6	8%	0.076	4%	0.042	C	C	.	.	H	α-helix	trans	-63.4	-39.8	176.4	-167.3	97.6	0	0	0	112.2	G718 V719 L720 I724 T726 S730 P731 P733 M750 D751 P753 M764 W768	G718-W722 PolarHBondContact O-N 3.08Å; V719-W722 WeakPolarHBondContact O-CB 3.43Å; V719-W722 PolarHBondContact O-N 3.03Å; L720-W722 VanDerWaalsContact C-N 3.27Å; L720-W722 PolarHBondContact O-N 2.97Å; W722-I724 PolarHBondContact O-N 3.29Å; W722-T726 HydrophobicContact CD2-CG2 3.88Å; W722-T726 HydrophobicContact CE3-CG2 3.9Å; W722-T726 HydrophobicContact CH2-CG2 3.82Å; W722-T726 HydrophobicContact CZ2-CG2 3.8Å; W722-T726 HydrophobicContact CZ3-CG2 3.85Å; W722-T726 WeakPolarHBondContact O-CB 3.42Å; W722-T726 WeakPolarHBondContact O-CG2 3.35Å; W722-T726 PolarHBondContact O-N 2.92Å; W722-T726 PolarHBondContact O-OG1 3.06Å; W722-S730 WeakPolarHBondContact CH2-O 3.33Å; W722-S730 WeakPolarHBondContact CZ3-O 3.32Å; W722-P731 HydrophobicContact CE3-CG 4.45Å; W722-P733 HydrophobicContact CH2-CG 4.19Å; W722-P733 HydrophobicContact CZ2-CG 4.4Å; W722-M750 HydrophobicContact CB-CE 3.77Å; W722-M750 HydrophobicContact CD2-CE 3.9Å; W722-M750 HydrophobicContact CD2-SD 3.66Å; W722-M750 HydrophobicContact CE3-CE 4.36Å; W722-M750 HydrophobicContact CE3-SD 3.94Å; W722-M750 HydrophobicContact CG-CB 4.49Å; W722-M750 HydrophobicContact CG-CE 3.63Å; W722-M750 HydrophobicContact CG-SD 4.02Å; W722-M750 HydrophobicContact CH2-SD 4.47Å; W722-M750 HydrophobicContact CZ2-SD 4.21Å; W722-M750 HydrophobicContact CZ3-SD 4.36Å; W722-D751 PolarHBondContact NE1-O 2.88Å; W722-P753 HydrophobicContact CG-CG 4.16Å; W722-M764 HydrophobicContact CB-SD 4.24Å; W722-W768 HydrophobicContact CB-CH2 4.12Å; W722-W768 HydrophobicContact CB-CZ2 4.07Å; W722-W768 AromaticContact CD1-CH2 3.93Å; W722-W768 HydrophobicContact CG-CH2 4.28Å
723	E	97.5	Very high	95	Very high	1 Å²	1	9.6 Å²	9.6	1%	0.005	6%	0.061	C	C	.	.	H	α-helix	trans	-59.5	-43	171	-70.7	-173	100	0	0	112.2	A657 W697 V719 L720 L721 T726 L727 G728 P731	A657-E723 HydrophobicContact CB-CB 4.03Å; A657-E723 HydrophobicContact CB-CG 4.42Å; A657-E723 WeakPolarHBondContact CB-OE1 3.27Å; A657-E723 PolarHBondContact N-OE2 3.42Å; W697-E723 WeakPolarHBondContact CZ2-OE1 3.28Å; W697-E723 PolarHBondContact NE1-OE2 2.97Å; V719-E723 PolarHBondContact O-N 3.2Å; L720-E723 WeakPolarHBondContact O-CB 3.17Å; L720-E723 PolarHBondContact O-N 3.49Å; L721-E723 PolarHBondContact O-N 3.43Å; E723-T726 PolarHBondContact O-N 2.83Å; E723-T726 PolarHBondContact O-OG1 2.96Å; E723-L727 PolarHBondContact O-N 3.03Å; E723-G728 WeakPolarHBondContact O-CA 3.42Å; E723-G728 PolarHBondContact O-N 3.43Å; E723-P731 HydrophobicContact CG-CG 3.85Å
724	I	96.7	Very high	94.2	Very high	0 Å²	0	13.7 Å²	13.7	0%	0	10%	0.103	C	C	.	.	H	α-helix	trans	-63.4	-52.8	179.6	-70.5	166.5	0	0	0	110.7	L600 L604 L631 C634 A635 L720 L721 W722 T726 L727	L600-I724 HydrophobicContact CD2-CD1 4.26Å; L600-I724 HydrophobicContact CD2-CG1 4.14Å; L604-I724 HydrophobicContact CD1-CG1 4.34Å; L631-I724 HydrophobicContact CB-CG2 3.97Å; L631-I724 HydrophobicContact CD2-CG2 4.01Å; C634-I724 HydrophobicContact CB-CD1 4.36Å; C634-I724 HydrophobicContact CB-CG2 4.42Å; A635-I724 HydrophobicContact CB-CD1 4.39Å; L720-I724 HydrophobicContact CD1-CD1 4.14Å; L720-I724 HydrophobicContact CD1-CG1 4.21Å; L720-I724 HydrophobicContact CG-CD1 4Å; L720-I724 WeakPolarHBondContact O-CG1 3.48Å; L720-I724 PolarHBondContact O-N 3.13Å; L721-I724 PolarHBondContact O-N 3.18Å; W722-I724 PolarHBondContact O-N 3.29Å; I724-T726 PolarHBondContact O-N 3.39Å; I724-L727 PolarHBondContact O-N 3.4Å
725	F	95.6	Very high	93.1	Very high	1 Å²	1	15 Å²	15	0%	0.004	11%	0.112	C	C	.	.	H	α-helix	trans	-77.1	-3.1	-177.8	-68.4	-75	0	0	0	114.4	L631 V632 L721 P753 C756 L760 M764	L631-F725 HydrophobicContact CB-CD1 3.98Å; L631-F725 HydrophobicContact CB-CE1 3.48Å; L631-F725 VanDerWaalsContact CB-CE1 3.48Å; L631-F725 HydrophobicContact CB-CZ 4Å; L631-F725 HydrophobicContact CD1-CD1 3.93Å; L631-F725 HydrophobicContact CD1-CE1 4.21Å; V632-F725 HydrophobicContact CG2-CE1 4.27Å; V632-F725 HydrophobicContact CG2-CZ 3.9Å; L721-F725 VanDerWaalsContact O-CD2 3.26Å; L721-F725 WeakPolarHBondContact O-CD2 3.34Å; L721-F725 PolarHBondContact O-N 3.13Å; F725-P753 HydrophobicContact CB-CB 4.02Å; F725-P753 HydrophobicContact CB-CG 4.08Å; F725-P753 WeakPolarHBondContact O-CB 3.48Å; F725-C756 HydrophobicContact CB-CB 4.06Å; F725-C756 HydrophobicContact CG-CB 4.32Å; F725-L760 HydrophobicContact CE1-CD1 3.91Å; F725-L760 HydrophobicContact CE2-CD1 4.31Å; F725-L760 HydrophobicContact CE2-CD2 4.35Å; F725-L760 HydrophobicContact CZ-CD1 3.69Å; F725-L760 HydrophobicContact CZ-CD2 4.24Å; F725-L760 HydrophobicContact CZ-CG 4.48Å; F725-M764 HydrophobicContact CB-CE 4.18Å; F725-M764 HydrophobicContact CD2-CE 3.61Å; F725-M764 HydrophobicContact CE2-CE 4.48Å; F725-M764 HydrophobicContact CG-CE 4.23Å
726	T	93.8	Very high	91.9	Very high	26 Å²	26	16.6 Å²	16.6	16%	0.16	12%	0.122	C	C	.	.	T	Hydrogen-bonded Turn	trans	-104.1	13.1	164.8	57.2	0	0	0	0	113.3	R608 W722 E723 I724 G728 G729 P753	R608-T726 PolarHBondContact NH2-O 3.11Å; W722-T726 HydrophobicContact CD2-CG2 3.88Å; W722-T726 HydrophobicContact CE3-CG2 3.9Å; W722-T726 HydrophobicContact CH2-CG2 3.82Å; W722-T726 HydrophobicContact CZ2-CG2 3.8Å; W722-T726 HydrophobicContact CZ3-CG2 3.85Å; W722-T726 WeakPolarHBondContact O-CB 3.42Å; W722-T726 WeakPolarHBondContact O-CG2 3.35Å; W722-T726 PolarHBondContact O-N 2.92Å; W722-T726 PolarHBondContact O-OG1 3.06Å; E723-T726 PolarHBondContact O-N 2.83Å; E723-T726 PolarHBondContact O-OG1 2.96Å; I724-T726 PolarHBondContact O-N 3.39Å; T726-G728 PolarHBondContact O-N 3.46Å; T726-G729 PolarHBondContact O-N 3.45Å; T726-G729 VanDerWaalsContact OG1-CA 3.3Å; T726-G729 WeakPolarHBondContact OG1-CA 3.3Å; T726-G729 PolarHBondContact OG1-N 2.87Å; T726-G729 VanDerWaalsContact OG1-N 3.14Å; T726-P753 HydrophobicContact CG2-CB 3.72Å; T726-P753 HydrophobicContact CG2-CG 3.81Å
727	L	92.8	Very high	90.5	Very high	7 Å²	7	18.3 Å²	18.3	4%	0.037	13%	0.132	C	C	.	.	T	Hydrogen-bonded Turn	trans	51	53	-179.1	-57.2	178.6	0	0	0	112.1	L604 R608 L626 L631 E723 I724	L604-L727 HydrophobicContact CD2-CD2 4.19Å; R608-L727 HydrophobicContact CG-CB 3.78Å; R608-L727 HydrophobicContact CG-CD1 4.07Å; R608-L727 VanDerWaalsContact CZ-O 3.31Å; R608-L727 PolarHBondContact NE-O 2.76Å; R608-L727 PolarHBondContact NH2-O 3.18Å; R608-L727 VanDerWaalsContact NH2-O 3.1Å; L626-L727 HydrophobicContact CD1-CD2 4.49Å; L631-L727 HydrophobicContact CD1-CD2 3.99Å; L631-L727 HydrophobicContact CD2-CD2 3.7Å; L631-L727 HydrophobicContact CG-CD2 4.47Å; E723-L727 PolarHBondContact O-N 3.03Å; I724-L727 PolarHBondContact O-N 3.4Å
728	G	91.2	Very high	88.9	Confident	0 Å²	0	21.8 Å²	21.8	0%	0	15%	0.148	C	C	.	.	S	Bend	trans	78.9	29.9	-178.6	0	0	0	0	0	114	R601 Q605 E723 T726	R601-G728 PolarHBondContact NE-O 3.17Å; Q605-G728 PolarHBondContact NE2-O 3.05Å; E723-G728 WeakPolarHBondContact O-CA 3.42Å; E723-G728 PolarHBondContact O-N 3.43Å; T726-G728 PolarHBondContact O-N 3.46Å
729	G	88.9	Confident	87.9	Confident	9 Å²	9	27.2 Å²	27.2	9%	0.093	17%	0.174	C	C	.	.	P	Polyproline II helix	trans	-58	166.9	174	0	0	0	0	0	113.1	T726	T726-G729 PolarHBondContact O-N 3.45Å; T726-G729 VanDerWaalsContact OG1-CA 3.3Å; T726-G729 WeakPolarHBondContact OG1-CA 3.3Å; T726-G729 PolarHBondContact OG1-N 2.87Å; T726-G729 VanDerWaalsContact OG1-N 3.14Å
730	S	88.8	Confident	87	Confident	60 Å²	60	27.2 Å²	27.2	42%	0.42	17%	0.174	S	C	.	.	P	Polyproline II helix	trans	-95.6	121.2	171.5	-171.9	0	0	0	0	109	W722	W722-S730 WeakPolarHBondContact CH2-O 3.33Å; W722-S730 WeakPolarHBondContact CZ3-O 3.32Å
731	P	92.4	Very high	85.8	Confident	0 Å²	0	30.7 Å²	30.7	0%	0	19%	0.189	C	C	.	.	S	Bend	trans	-53.7	147.9	177.4	-30.2	37.7	0	0	0	113.1	K696 W697 V719 W722 E723 M750	K696-P731 HydrophobicContact CB-CB 4.23Å; K696-P731 WeakPolarHBondContact CD-O 3.41Å; K696-P731 PolarHBondContact NZ-O 3Å; W697-P731 HydrophobicContact CH2-CG 4.32Å; W697-P731 HydrophobicContact CZ2-CG 3.73Å; V719-P731 HydrophobicContact CG1-CB 3.76Å; V719-P731 HydrophobicContact CG1-CG 3.47Å; V719-P731 VanDerWaalsContact CG1-CG 3.47Å; W722-P731 HydrophobicContact CE3-CG 4.45Å; E723-P731 HydrophobicContact CG-CG 3.85Å; P731-M750 HydrophobicContact CB-CE 4.24Å; P731-M750 HydrophobicContact CB-SD 3.74Å
732	Y	89.6	Confident	84.8	Confident	3 Å²	3	37.1 Å²	37.1	1%	0.012	22%	0.217	C	C	.	.	S	Bend	trans	45.3	68.4	-174.9	-55.8	-90.6	0	0	0	110.9	K696 V735 L740 L744 H748 M750	K696-Y732 HydrophobicContact CB-CD2 4.29Å; K696-Y732 HydrophobicContact CD-CD2 4.37Å; K696-Y732 PolarHBondContact NZ-O 2.77Å; Y732-V735 PolarHBondContact O-N 2.83Å; Y732-L740 HydrophobicContact CD1-CD1 3.42Å; Y732-L740 VanDerWaalsContact CD1-CD1 3.42Å; Y732-L740 HydrophobicContact CD2-CD1 3.95Å; Y732-L740 HydrophobicContact CD2-CD2 3.87Å; Y732-L740 HydrophobicContact CE1-CD1 3.56Å; Y732-L740 HydrophobicContact CE2-CD1 4.08Å; Y732-L740 HydrophobicContact CE2-CD2 4.16Å; Y732-L740 HydrophobicContact CG-CD1 3.63Å; Y732-L740 HydrophobicContact CG-CD2 4.2Å; Y732-L744 HydrophobicContact CE1-CD2 4.39Å; Y732-H748 AromaticContact CD1-NE2 3.88Å; Y732-M750 HydrophobicContact CD1-CG 3.46Å; Y732-M750 VanDerWaalsContact CD1-CG 3.46Å; Y732-M750 HydrophobicContact CD1-SD 4.3Å; Y732-M750 HydrophobicContact CD2-CG 4.04Å; Y732-M750 HydrophobicContact CD2-SD 3.8Å; Y732-M750 HydrophobicContact CE1-CG 3.48Å; Y732-M750 VanDerWaalsContact CE1-CG 3.48Å; Y732-M750 HydrophobicContact CE1-SD 4.45Å; Y732-M750 HydrophobicContact CE2-CE 4.1Å; Y732-M750 HydrophobicContact CE2-CG 4.04Å; Y732-M750 HydrophobicContact CE2-SD 3.94Å; Y732-M750 HydrophobicContact CG-CG 3.75Å; Y732-M750 HydrophobicContact CG-SD 3.98Å; Y732-M750 PolarHBondContact N-SD 2.93Å
733	P	85.7	Confident	84.1	Confident	67 Å²	67	38.2 Å²	38.2	44%	0.435	22%	0.224	S	C	.	.	S	Bend	trans	-61.6	144.3	-177.8	27.1	-34.8	0	0	0	110.7	W722 V735	W722-P733 HydrophobicContact CH2-CG 4.19Å; W722-P733 HydrophobicContact CZ2-CG 4.4Å; P733-V735 PolarHBondContact O-N 3Å
734	G	79.8	Confident	83.5	Confident	86 Å²	86	38.5 Å²	38.5	89%	0.887	23%	0.226	S	C	*	.	S	Bend	trans	72.8	-37.8	-173.6	0	0	0	0	0	115.1
735	V	75.6	Confident	82.7	Confident	28 Å²	28	45.8 Å²	45.8	17%	0.17	26%	0.257	C	S	.	.			trans	-70.5	123	-174.3	-178.9	0	0	0	0	111.9	K696 Y732 P733 E739 L740 L743	K696-V735 WeakPolarHBondContact CE-O 3.46Å; K696-V735 PolarHBondContact NZ-O 2.76Å; Y732-V735 PolarHBondContact O-N 2.83Å; P733-V735 PolarHBondContact O-N 3Å; V735-E739 HydrophobicContact CG1-CB 4.42Å; V735-L740 HydrophobicContact CG1-CB 4.18Å; V735-L740 HydrophobicContact CG1-CD1 4.49Å; V735-L743 HydrophobicContact CG1-CD1 3.59Å; V735-L743 HydrophobicContact CG2-CD1 4.25Å
736	P	73.5	Confident	82.3	Confident	34 Å²	34	51.6 Å²	51.6	22%	0.221	28%	0.284	C	S	.	.			trans	-71.2	161.7	171.7	30.7	-33.8	0	0	0	111.4	I234 E738 E739 L740	I234-P736 HydrophobicContact CG2-CB 4.01Å; P736-E738 PolarHBondContact O-N 2.68Å; P736-E739 WeakPolarHBondContact CD-OE2 3.45Å; P736-E739 HydrophobicContact CG-CB 3.92Å; P736-E739 HydrophobicContact CG-CG 3.71Å; P736-L740 PolarHBondContact O-N 3.13Å
737	V	69.2	Low	81.9	Confident	42 Å²	42	52.2 Å²	52.2	26%	0.255	30%	0.296	S	S	.	.	H	α-helix	trans	-68.7	-29.9	-174.2	176.4	0	0	0	0	111.2	V695 K696 L740 F741	V695-V737 HydrophobicContact CB-CG1 3.7Å; V695-V737 HydrophobicContact CG1-CG1 3.56Å; V695-V737 HydrophobicContact CG2-CG1 4.05Å; K696-V737 HydrophobicContact CG-CG2 4.39Å; V737-L740 WeakPolarHBondContact O-CB 3.28Å; V737-L740 PolarHBondContact O-N 2.89Å; V737-F741 HydrophobicContact CG1-CE2 4.13Å; V737-F741 WeakPolarHBondContact O-CD2 3.23Å; V737-F741 VanDerWaalsContact O-CE2 3.25Å; V737-F741 WeakPolarHBondContact O-CE2 3.2Å
738	E	65.1	Low	81.8	Confident	73 Å²	73	55 Å²	55	34%	0.341	31%	0.309	S	S	.	.	H	α-helix	trans	-67.6	-44.2	-178.3	-64.4	70.6	-163.8	0	0	111.6	I234 P736	I234-E738 WeakPolarHBondContact CG2-OE2 3.32Å; P736-E738 PolarHBondContact O-N 2.68Å
739	E	77.7	Confident	82	Confident	114 Å²	114	56 Å²	56	53%	0.533	31%	0.313	S	S	.	.	H	α-helix	trans	-74.2	-30.1	174.6	-70.8	171.5	-160.5	0	0	112.4	V735 P736 F741 K742 L743	V735-E739 HydrophobicContact CG1-CB 4.42Å; P736-E739 WeakPolarHBondContact CD-OE2 3.45Å; P736-E739 HydrophobicContact CG-CB 3.92Å; P736-E739 HydrophobicContact CG-CG 3.71Å; E739-F741 PolarHBondContact O-N 3.48Å; E739-K742 WeakPolarHBondContact O-CB 3.31Å; E739-K742 PolarHBondContact O-N 2.86Å; E739-L743 HydrophobicContact CB-CD1 4.41Å; E739-L743 PolarHBondContact O-N 2.79Å
740	L	77.9	Confident	82.3	Confident	0 Å²	0	55.8 Å²	55.8	0%	0	31%	0.309	C	S	.	.	H	α-helix	trans	-57.6	-33.4	-179.4	-175.7	60.4	0	0	0	112.4	K696 Y732 V735 P736 V737 K742 L744	K696-L740 HydrophobicContact CB-CD2 4.27Å; K696-L740 HydrophobicContact CD-CD2 4.44Å; K696-L740 HydrophobicContact CG-CD2 3.8Å; Y732-L740 HydrophobicContact CD1-CD1 3.42Å; Y732-L740 VanDerWaalsContact CD1-CD1 3.42Å; Y732-L740 HydrophobicContact CD2-CD1 3.95Å; Y732-L740 HydrophobicContact CD2-CD2 3.87Å; Y732-L740 HydrophobicContact CE1-CD1 3.56Å; Y732-L740 HydrophobicContact CE2-CD1 4.08Å; Y732-L740 HydrophobicContact CE2-CD2 4.16Å; Y732-L740 HydrophobicContact CG-CD1 3.63Å; Y732-L740 HydrophobicContact CG-CD2 4.2Å; V735-L740 HydrophobicContact CG1-CB 4.18Å; V735-L740 HydrophobicContact CG1-CD1 4.49Å; P736-L740 PolarHBondContact O-N 3.13Å; V737-L740 WeakPolarHBondContact O-CB 3.28Å; V737-L740 PolarHBondContact O-N 2.89Å; L740-K742 VanDerWaalsContact C-N 3.31Å; L740-K742 PolarHBondContact O-N 3.38Å; L740-L744 HydrophobicContact CD1-CD1 4.16Å; L740-L744 HydrophobicContact CD1-CD2 4.25Å; L740-L744 HydrophobicContact CD1-CG 3.82Å; L740-L744 HydrophobicContact CG-CD1 3.92Å; L740-L744 HydrophobicContact CG-CG 4.06Å; L740-L744 VanDerWaalsContact O-CB 3.31Å; L740-L744 WeakPolarHBondContact O-CB 3.29Å; L740-L744 VanDerWaalsContact O-CG 3.23Å; L740-L744 WeakPolarHBondContact O-CG 3.48Å; L740-L744 PolarHBondContact O-N 3.31Å
741	F	73.3	Confident	82.6	Confident	74 Å²	74	58.8 Å²	58.8	33%	0.325	32%	0.321	S	S	.	.	H	α-helix	trans	-60.7	-38.2	174.1	-66	-88.2	0	0	0	112.9	V695 L703 F704 V737 E739 K745	V695-F741 HydrophobicContact CG1-CE2 4.44Å; V695-F741 HydrophobicContact CG1-CZ 4.1Å; L703-F741 HydrophobicContact CD1-CD1 4.29Å; L703-F741 HydrophobicContact CD1-CE1 3.52Å; L703-F741 HydrophobicContact CD1-CZ 4.15Å; L703-F741 HydrophobicContact CD2-CD1 3.71Å; L703-F741 HydrophobicContact CD2-CE1 3.8Å; L703-F741 HydrophobicContact CG-CD1 3.88Å; L703-F741 HydrophobicContact CG-CE1 3.6Å; F704-F741 HydrophobicContact CE1-CB 4.22Å; F704-F741 AromaticContact CE1-CD1 3.8Å; F704-F741 HydrophobicContact CE1-CD1 3.8Å; F704-F741 HydrophobicContact CZ-CD1 4.42Å; F704-F741 WeakPolarHBondContact CZ-O 3.46Å; V737-F741 HydrophobicContact CG1-CE2 4.13Å; V737-F741 WeakPolarHBondContact O-CD2 3.23Å; V737-F741 VanDerWaalsContact O-CE2 3.25Å; V737-F741 WeakPolarHBondContact O-CE2 3.2Å; E739-F741 PolarHBondContact O-N 3.48Å; F741-K745 WeakPolarHBondContact O-CG 3.47Å
742	K	78.8	Confident	82.7	Confident	135 Å²	135	62.8 Å²	62.8	59%	0.587	34%	0.338	S	S	*	.	H	α-helix	trans	-73.1	-52.3	177.7	178.7	178.5	174.4	-179	0	110	E739 L740 L744 K745 E746	E739-K742 WeakPolarHBondContact O-CB 3.31Å; E739-K742 PolarHBondContact O-N 2.86Å; L740-K742 VanDerWaalsContact C-N 3.31Å; L740-K742 PolarHBondContact O-N 3.38Å; K742-L744 VanDerWaalsContact C-N 3.32Å; K742-L744 PolarHBondContact O-N 3.12Å; K742-K745 WeakPolarHBondContact O-CB 3.45Å; K742-K745 PolarHBondContact O-N 3.08Å; K742-E746 WeakPolarHBondContact CE-OE1 3.46Å; K742-E746 WeakPolarHBondContact CG-OE1 3.37Å; K742-E746 IonicContact NZ-OE1 2.68Å; K742-E746 WeakPolarHBondContact O-CG 3.34Å; K742-E746 PolarHBondContact O-N 2.8Å
743	L	82.1	Confident	82.8	Confident	42 Å²	42	63 Å²	63	22%	0.22	34%	0.339	C	S	.	.	H	α-helix	trans	-56	-42.1	179.7	-71	169.5	0	0	0	112.5	V735 E739 K745 E746 G747 H748	V735-L743 HydrophobicContact CG1-CD1 3.59Å; V735-L743 HydrophobicContact CG2-CD1 4.25Å; E739-L743 HydrophobicContact CB-CD1 4.41Å; E739-L743 PolarHBondContact O-N 2.79Å; L743-K745 VanDerWaalsContact C-N 3.34Å; L743-K745 PolarHBondContact O-N 3.02Å; L743-E746 CarbonylContact O-C 3.55Å; L743-E746 PolarHBondContact O-N 3.46Å; L743-G747 PolarHBondContact O-N 2.68Å; L743-G747 VanDerWaalsContact O-N 3.16Å; L743-H748 HydrophobicContact CB-CB 3.92Å; L743-H748 HydrophobicContact CD2-CB 4.24Å; L743-H748 VanDerWaalsContact O-CB 3.3Å; L743-H748 WeakPolarHBondContact O-CB 3.19Å; L743-H748 PolarHBondContact O-N 3.2Å
744	L	85.9	Confident	82.8	Confident	8 Å²	8	64.4 Å²	64.4	4%	0.042	35%	0.351	C	S	.	.	H	α-helix	trans	-64.5	-35.6	177.8	-74.8	178.4	0	0	0	113.3	L703 W715 Y732 L740 K742 G747 R749	L703-L744 HydrophobicContact CD2-CD1 4.09Å; W715-L744 HydrophobicContact CH2-CD2 3.96Å; W715-L744 HydrophobicContact CZ2-CD2 3.7Å; Y732-L744 HydrophobicContact CE1-CD2 4.39Å; L740-L744 HydrophobicContact CD1-CD1 4.16Å; L740-L744 HydrophobicContact CD1-CD2 4.25Å; L740-L744 HydrophobicContact CD1-CG 3.82Å; L740-L744 HydrophobicContact CG-CD1 3.92Å; L740-L744 HydrophobicContact CG-CG 4.06Å; L740-L744 VanDerWaalsContact O-CB 3.31Å; L740-L744 WeakPolarHBondContact O-CB 3.29Å; L740-L744 VanDerWaalsContact O-CG 3.23Å; L740-L744 WeakPolarHBondContact O-CG 3.48Å; L740-L744 PolarHBondContact O-N 3.31Å; K742-L744 VanDerWaalsContact C-N 3.32Å; K742-L744 PolarHBondContact O-N 3.12Å; L744-G747 PolarHBondContact O-N 3.48Å; L744-R749 PolarHBondContact O-NH1 3.46Å
745	K	79.3	Confident	82.8	Confident	153 Å²	153	63.5 Å²	63.5	67%	0.665	33%	0.326	S	S	*	.	H	α-helix	trans	-69.9	-37.1	173.7	-73.4	-177.8	175.2	-173.4	0	112.1	F704 F741 K742 L743 G747	F704-K745 HydrophobicContact CE1-CD 4.34Å; F704-K745 VanDerWaalsContact CE1-CE 3.42Å; F704-K745 HydrophobicContact CE1-CG 4.31Å; F704-K745 HydrophobicContact CE2-CG 3.9Å; F704-K745 HydrophobicContact CZ-CD 4.19Å; F704-K745 HydrophobicContact CZ-CG 3.68Å; F741-K745 WeakPolarHBondContact O-CG 3.47Å; K742-K745 WeakPolarHBondContact O-CB 3.45Å; K742-K745 PolarHBondContact O-N 3.08Å; L743-K745 VanDerWaalsContact C-N 3.34Å; L743-K745 PolarHBondContact O-N 3.02Å; K745-G747 PolarHBondContact O-N 2.71Å
746	E	87.4	Confident	83.5	Confident	122 Å²	122	62.5 Å²	62.5	57%	0.57	32%	0.32	S	S	*	.	T	Hydrogen-bonded Turn	trans	-73.1	-1.2	174.6	-67.9	169.1	165.9	0	0	113	K742 L743	K742-E746 WeakPolarHBondContact CE-OE1 3.46Å; K742-E746 WeakPolarHBondContact CG-OE1 3.37Å; K742-E746 IonicContact NZ-OE1 2.68Å; K742-E746 WeakPolarHBondContact O-CG 3.34Å; K742-E746 PolarHBondContact O-N 2.8Å; L743-E746 CarbonylContact O-C 3.55Å; L743-E746 PolarHBondContact O-N 3.46Å
747	G	85.7	Confident	84.4	Confident	40 Å²	40	64.2 Å²	64.2	41%	0.412	33%	0.33	S	S	.	.	T	Hydrogen-bonded Turn	trans	86.5	3.7	175.6	0	0	0	0	0	114.9	L743 L744 K745 R749	L743-G747 PolarHBondContact O-N 2.68Å; L743-G747 VanDerWaalsContact O-N 3.16Å; L744-G747 PolarHBondContact O-N 3.48Å; K745-G747 PolarHBondContact O-N 2.71Å; G747-R749 PolarHBondContact O-NH1 3.17Å
748	H	90.9	Very high	85.5	Confident	65 Å²	65	67.3 Å²	67.3	30%	0.301	35%	0.345	S	S	.	.			trans	-58.3	143.8	175.8	171.8	80.2	0	0	0	111.5	Y732 L743	Y732-H748 AromaticContact CD1-NE2 3.88Å; L743-H748 HydrophobicContact CB-CB 3.92Å; L743-H748 HydrophobicContact CD2-CB 4.24Å; L743-H748 VanDerWaalsContact O-CB 3.3Å; L743-H748 WeakPolarHBondContact O-CB 3.19Å; L743-H748 PolarHBondContact O-N 3.2Å
749	R	94.7	Very high	86.9	Confident	21 Å²	21	67.9 Å²	67.9	8%	0.079	35%	0.348	C	S	.	.			trans	-141.9	155.2	177.3	-59.8	-62	-178.5	-95.5	2	108.3	W715 L744 G747 W768	W715-R749 VanDerWaalsContact CH2-CZ 3.49Å; L744-R749 PolarHBondContact O-NH1 3.46Å; G747-R749 PolarHBondContact O-NH1 3.17Å; R749-W768 HydrophobicContact CB-CE3 4Å; R749-W768 HydrophobicContact CB-CZ3 4.4Å; R749-W768 HydrophobicContact CG-CB 4.49Å; R749-W768 HydrophobicContact CG-CE3 4.37Å; R749-W768 PolarHBondContact NE-O 3.4Å; R749-W768 PolarHBondContact NH2-O 3.27Å
750	M	95.9	Very high	87.7	Confident	4 Å²	4	62.7 Å²	62.7	2%	0.02	32%	0.324	C	S	.	.	P	Polyproline II helix	trans	-64.4	143.3	178	-60.4	-178.4	-73.2	0	0	111.6	V719 W722 P731 Y732 Y761 W768	V719-M750 HydrophobicContact CG1-CE 4.18Å; V719-M750 HydrophobicContact CG2-CE 4.27Å; W722-M750 HydrophobicContact CB-CE 3.77Å; W722-M750 HydrophobicContact CD2-CE 3.9Å; W722-M750 HydrophobicContact CD2-SD 3.66Å; W722-M750 HydrophobicContact CE3-CE 4.36Å; W722-M750 HydrophobicContact CE3-SD 3.94Å; W722-M750 HydrophobicContact CG-CB 4.49Å; W722-M750 HydrophobicContact CG-CE 3.63Å; W722-M750 HydrophobicContact CG-SD 4.02Å; W722-M750 HydrophobicContact CH2-SD 4.47Å; W722-M750 HydrophobicContact CZ2-SD 4.21Å; W722-M750 HydrophobicContact CZ3-SD 4.36Å; P731-M750 HydrophobicContact CB-CE 4.24Å; P731-M750 HydrophobicContact CB-SD 3.74Å; Y732-M750 HydrophobicContact CD1-CG 3.46Å; Y732-M750 VanDerWaalsContact CD1-CG 3.46Å; Y732-M750 HydrophobicContact CD1-SD 4.3Å; Y732-M750 HydrophobicContact CD2-CG 4.04Å; Y732-M750 HydrophobicContact CD2-SD 3.8Å; Y732-M750 HydrophobicContact CE1-CG 3.48Å; Y732-M750 VanDerWaalsContact CE1-CG 3.48Å; Y732-M750 HydrophobicContact CE1-SD 4.45Å; Y732-M750 HydrophobicContact CE2-CE 4.1Å; Y732-M750 HydrophobicContact CE2-CG 4.04Å; Y732-M750 HydrophobicContact CE2-SD 3.94Å; Y732-M750 HydrophobicContact CG-CG 3.75Å; Y732-M750 HydrophobicContact CG-SD 3.98Å; Y732-M750 PolarHBondContact N-SD 2.93Å; M750-Y761 PolarHBondContact O-OH 3.01Å; M750-W768 HydrophobicContact CB-CH2 4.12Å; M750-W768 HydrophobicContact CB-CZ3 4.36Å; M750-W768 HydrophobicContact CE-CH2 3.58Å; M750-W768 HydrophobicContact CE-CZ2 3.32Å
751	D	93.4	Very high	88.7	Confident	124 Å²	124	64.1 Å²	64.1	66%	0.663	33%	0.33	S	S	*	.	P	Polyproline II helix	trans	-69.2	164.9	176.5	-62.6	-64.8	0	0	0	113.4	W722 P753	W722-D751 PolarHBondContact NE1-O 2.88Å; D751-P753 WeakPolarHBondContact O-CD 3.19Å
752	K	95.4	Very high	89.8	Confident	84 Å²	84	65.6 Å²	65.6	37%	0.365	34%	0.338	S	S	.	.	P	Polyproline II helix	trans	-65.4	126.9	-178.2	-169.7	179.5	78.9	142.9	0	111.7	C756 N758 Y761	K752-C756 WeakPolarHBondContact CE-O 3.44Å; K752-C756 HydrophobicContact CG-CB 4.08Å; K752-C756 PolarHBondContact NZ-O 3.14Å; K752-N758 PolarHBondContact NZ-OD1 2.84Å; K752-Y761 HydrophobicContact CB-CD1 3.85Å; K752-Y761 HydrophobicContact CB-CD2 3.83Å; K752-Y761 HydrophobicContact CB-CE1 4Å; K752-Y761 HydrophobicContact CB-CE2 4.01Å; K752-Y761 HydrophobicContact CB-CG 3.75Å; K752-Y761 HydrophobicContact CD-CD1 4.12Å; K752-Y761 HydrophobicContact CD-CG 3.99Å; K752-Y761 HydrophobicContact CG-CD1 4.02Å; K752-Y761 HydrophobicContact CG-CD2 3.92Å; K752-Y761 HydrophobicContact CG-CG 3.6Å
753	P	92.4	Very high	90.8	Very high	6 Å²	6	59.9 Å²	59.9	4%	0.039	31%	0.314	C	S	.	.	P	Polyproline II helix	trans	-60.7	147.9	170.5	-22.5	33.4	0	0	0	112.8	W722 F725 T726 D751 N755 C756 M764	W722-P753 HydrophobicContact CG-CG 4.16Å; F725-P753 HydrophobicContact CB-CB 4.02Å; F725-P753 HydrophobicContact CB-CG 4.08Å; F725-P753 WeakPolarHBondContact O-CB 3.48Å; T726-P753 HydrophobicContact CG2-CB 3.72Å; T726-P753 HydrophobicContact CG2-CG 3.81Å; D751-P753 WeakPolarHBondContact O-CD 3.19Å; P753-N755 PolarHBondContact O-N 2.83Å; P753-C756 HydrophobicContact CB-CB 3.92Å; P753-C756 HydrophobicContact CG-CB 4.16Å; P753-C756 WeakPolarHBondContact O-CB 3.22Å; P753-C756 PolarHBondContact O-N 2.89Å; P753-C756 VanDerWaalsContact O-N 3.15Å; P753-M764 HydrophobicContact CG-CE 4.38Å
754	S	84.6	Confident	91.5	Very high	97 Å²	97	57.9 Å²	57.9	68%	0.678	30%	0.304	S	S	*	.	T	Hydrogen-bonded Turn	trans	-54.7	-40.3	178	53.6	0	0	0	0	112.9	C756	S754-C756 VanDerWaalsContact C-N 3.26Å; S754-C756 PolarHBondContact O-N 2.89Å
755	N	80.3	Confident	92.1	Very high	67 Å²	67	62.6 Å²	62.6	36%	0.358	32%	0.321	S	S	.	.	T	Hydrogen-bonded Turn	trans	-90.4	16.4	-173.8	-57.3	16.7	0	0	0	112.2	P753	P753-N755 PolarHBondContact O-N 2.83Å
756	C	90.4	Very high	93	Very high	7 Å²	7	59.3 Å²	59.3	5%	0.047	31%	0.311	C	S	.	.			trans	-111.2	133.4	-173.7	-169.9	0	0	0	0	112	F725 K752 P753 S754 L760 M764	F725-C756 HydrophobicContact CB-CB 4.06Å; F725-C756 HydrophobicContact CG-CB 4.32Å; K752-C756 WeakPolarHBondContact CE-O 3.44Å; K752-C756 HydrophobicContact CG-CB 4.08Å; K752-C756 PolarHBondContact NZ-O 3.14Å; P753-C756 HydrophobicContact CB-CB 3.92Å; P753-C756 HydrophobicContact CG-CB 4.16Å; P753-C756 WeakPolarHBondContact O-CB 3.22Å; P753-C756 PolarHBondContact O-N 2.89Å; P753-C756 VanDerWaalsContact O-N 3.15Å; S754-C756 VanDerWaalsContact C-N 3.26Å; S754-C756 PolarHBondContact O-N 2.89Å; C756-L760 VanDerWaalsContact SG-CB 3.54Å; C756-M764 VanDerWaalsContact SG-CE 3.52Å
757	T	92.6	Very high	93.5	Very high	71 Å²	71	53.5 Å²	53.5	44%	0.436	28%	0.284	S	S	.	.			trans	-70.6	161.3	171.1	72.3	0	0	0	0	110.5	E759 L760 Y761	T757-E759 VanDerWaalsContact C-N 3.28Å; T757-E759 PolarHBondContact O-N 2.84Å; T757-L760 HydrophobicContact CG2-CD1 4.2Å; T757-L760 PolarHBondContact O-N 2.96Å; T757-L760 WeakPolarHBondContact OG1-CD1 3.48Å; T757-L760 WeakPolarHBondContact OG1-CG 3.24Å; T757-L760 PolarHBondContact OG1-N 2.92Å; T757-Y761 PolarHBondContact O-N 3.01Å; T757-Y761 VanDerWaalsContact O-N 3.1Å
758	N	92.2	Very high	94.2	Very high	107 Å²	107	51.7 Å²	51.7	57%	0.572	26%	0.264	S	S	*	.	H	α-helix	trans	-66.7	-32.9	178	-66.4	-2.4	0	0	0	111.7	K752 Y761 M762	K752-N758 PolarHBondContact NZ-OD1 2.84Å; N758-Y761 PolarHBondContact O-N 2.85Å; N758-M762 WeakPolarHBondContact O-CG 3.48Å; N758-M762 PolarHBondContact O-N 3.1Å
759	E	93.6	Very high	94.5	Very high	85 Å²	85	51.7 Å²	51.7	40%	0.397	26%	0.264	S	S	.	.	H	α-helix	trans	-63.2	-49.8	175.2	-177.7	175.5	-160	0	0	112	T757 Y761 M762 M763 R787 I788	T757-E759 VanDerWaalsContact C-N 3.28Å; T757-E759 PolarHBondContact O-N 2.84Å; E759-Y761 PolarHBondContact O-N 2.84Å; E759-M762 PolarHBondContact O-N 2.93Å; E759-M762 VanDerWaalsContact O-N 3.16Å; E759-M763 PolarHBondContact O-N 2.82Å; E759-R787 IonicContact OE1-CZ 2.59Å; E759-R787 VanDerWaalsContact OE1-CZ 3.24Å; E759-R787 IonicContact OE1-NH1 2.64Å; E759-R787 PolarHBondContact OE1-NH1 2.89Å; E759-R787 IonicContact OE1-NH2 3.42Å; E759-R787 PolarHBondContact OE1-NH2 2.95Å; E759-I788 HydrophobicContact CG-CD1 4.1Å
760	L	95.6	Very high	94.3	Very high	4 Å²	4	53.5 Å²	53.5	2%	0.021	28%	0.284	C	S	.	.	H	α-helix	trans	-62.8	-31.6	176.9	-71.6	163.9	0	0	0	112.1	V632 F725 C756 T757 M764 L785 I788	V632-L760 HydrophobicContact CG2-CD1 3.82Å; V632-L760 HydrophobicContact CG2-CD2 4.36Å; F725-L760 HydrophobicContact CE1-CD1 3.91Å; F725-L760 HydrophobicContact CE2-CD1 4.31Å; F725-L760 HydrophobicContact CE2-CD2 4.35Å; F725-L760 HydrophobicContact CZ-CD1 3.69Å; F725-L760 HydrophobicContact CZ-CD2 4.24Å; F725-L760 HydrophobicContact CZ-CG 4.48Å; C756-L760 VanDerWaalsContact SG-CB 3.54Å; T757-L760 HydrophobicContact CG2-CD1 4.2Å; T757-L760 PolarHBondContact O-N 2.96Å; T757-L760 WeakPolarHBondContact OG1-CD1 3.48Å; T757-L760 WeakPolarHBondContact OG1-CG 3.24Å; T757-L760 PolarHBondContact OG1-N 2.92Å; L760-M764 WeakPolarHBondContact O-CG 3.45Å; L760-M764 PolarHBondContact O-N 2.89Å; L760-L785 HydrophobicContact CD2-CD2 3.96Å; L760-I788 HydrophobicContact CD2-CD1 3.88Å; L760-I788 HydrophobicContact CG-CD1 4.38Å
761	Y	97.4	Very high	94.1	Very high	31 Å²	31	56.3 Å²	56.3	12%	0.122	30%	0.301	C	S	.	.	H	α-helix	trans	-72.7	-37.8	173.9	-178.2	-123.6	0	0	0	113.2	M750 K752 T757 N758 E759 M763 M764 R765 W768	M750-Y761 PolarHBondContact O-OH 3.01Å; K752-Y761 HydrophobicContact CB-CD1 3.85Å; K752-Y761 HydrophobicContact CB-CD2 3.83Å; K752-Y761 HydrophobicContact CB-CE1 4Å; K752-Y761 HydrophobicContact CB-CE2 4.01Å; K752-Y761 HydrophobicContact CB-CG 3.75Å; K752-Y761 HydrophobicContact CD-CD1 4.12Å; K752-Y761 HydrophobicContact CD-CG 3.99Å; K752-Y761 HydrophobicContact CG-CD1 4.02Å; K752-Y761 HydrophobicContact CG-CD2 3.92Å; K752-Y761 HydrophobicContact CG-CG 3.6Å; T757-Y761 PolarHBondContact O-N 3.01Å; T757-Y761 VanDerWaalsContact O-N 3.1Å; N758-Y761 PolarHBondContact O-N 2.85Å; E759-Y761 PolarHBondContact O-N 2.84Å; Y761-M763 VanDerWaalsContact C-N 3.31Å; Y761-M763 PolarHBondContact O-N 2.75Å; Y761-M764 HydrophobicContact CD2-SD 4.05Å; Y761-M764 WeakPolarHBondContact O-CB 3.04Å; Y761-M764 PolarHBondContact O-N 3.42Å; Y761-M764 VanDerWaalsContact O-N 3.15Å; Y761-R765 HydrophobicContact CD1-CG 4.49Å; Y761-R765 HydrophobicContact CE1-CG 4.17Å; Y761-R765 HydrophobicContact CE2-CG 4.23Å; Y761-R765 WeakPolarHBondContact O-CG 3.48Å; Y761-R765 PolarHBondContact O-N 2.81Å; Y761-W768 HydrophobicContact CE2-CZ3 4.48Å
762	M	97.7	Very high	94.1	Very high	104 Å²	104	52.2 Å²	52.2	51%	0.512	28%	0.281	S	S	.	.	H	α-helix	trans	-64.2	-39.3	172.8	-64.7	-52.2	164.1	0	0	110.9	N758 E759 M764 R765 D766	N758-M762 WeakPolarHBondContact O-CG 3.48Å; N758-M762 PolarHBondContact O-N 3.1Å; E759-M762 PolarHBondContact O-N 2.93Å; E759-M762 VanDerWaalsContact O-N 3.16Å; M762-M764 VanDerWaalsContact C-N 3.29Å; M762-M764 PolarHBondContact O-N 2.82Å; M762-R765 CarbonylContact O-C 3.53Å; M762-R765 WeakPolarHBondContact O-CA 2.98Å; M762-R765 WeakPolarHBondContact O-CB 3.35Å; M762-R765 PolarHBondContact O-N 3.33Å; M762-R765 HydrophobicContact SD-CG 4.41Å; M762-D766 PolarHBondContact O-N 2.97Å
763	M	98.2	Very high	93.9	Very high	15 Å²	15	53 Å²	53	7%	0.074	30%	0.298	C	S	.	.	H	α-helix	trans	-56.2	-39.7	170.5	-174	-175.3	-69.3	0	0	112.9	L721 E759 Y761 C767 L781 D784 L785 I788	L721-M763 HydrophobicContact CD1-CG 4.22Å; L721-M763 HydrophobicContact CD1-SD 4.16Å; E759-M763 PolarHBondContact O-N 2.82Å; Y761-M763 VanDerWaalsContact C-N 3.31Å; Y761-M763 PolarHBondContact O-N 2.75Å; M763-C767 PolarHBondContact O-N 2.88Å; M763-C767 PolarHBondContact O-SG 3.04Å; M763-L781 HydrophobicContact CG-CD2 3.5Å; M763-L781 HydrophobicContact SD-CD2 3.75Å; M763-D784 HydrophobicContact CE-CB 3.57Å; M763-L785 HydrophobicContact CE-CD2 4.02Å; M763-L785 HydrophobicContact CE-CG 3.96Å; M763-L785 HydrophobicContact SD-CD1 4.19Å; M763-L785 HydrophobicContact SD-CD2 3.78Å; M763-L785 HydrophobicContact SD-CG 3.82Å; M763-I788 HydrophobicContact CE-CD1 3.99Å
764	M	98.4	Very high	94.2	Very high	0 Å²	0	58.8 Å²	58.8	0%	0	32%	0.324	C	S	.	.	H	α-helix	trans	-63.7	-44.4	171.5	-62.3	169.3	-166.9	0	0	112	L721 W722 F725 P753 C756 L760 Y761 M762 D766 C767 W768	L721-M764 HydrophobicContact CB-CE 3.92Å; L721-M764 HydrophobicContact CB-CG 3.84Å; L721-M764 HydrophobicContact CD1-CG 4.06Å; W722-M764 HydrophobicContact CB-SD 4.24Å; F725-M764 HydrophobicContact CB-CE 4.18Å; F725-M764 HydrophobicContact CD2-CE 3.61Å; F725-M764 HydrophobicContact CE2-CE 4.48Å; F725-M764 HydrophobicContact CG-CE 4.23Å; P753-M764 HydrophobicContact CG-CE 4.38Å; C756-M764 VanDerWaalsContact SG-CE 3.52Å; L760-M764 WeakPolarHBondContact O-CG 3.45Å; L760-M764 PolarHBondContact O-N 2.89Å; Y761-M764 HydrophobicContact CD2-SD 4.05Å; Y761-M764 WeakPolarHBondContact O-CB 3.04Å; Y761-M764 PolarHBondContact O-N 3.42Å; Y761-M764 VanDerWaalsContact O-N 3.15Å; M762-M764 VanDerWaalsContact C-N 3.29Å; M762-M764 PolarHBondContact O-N 2.82Å; M764-D766 VanDerWaalsContact C-N 3.34Å; M764-D766 PolarHBondContact O-N 3.25Å; M764-C767 WeakPolarHBondContact O-CB 3.49Å; M764-C767 PolarHBondContact O-N 3.46Å; M764-W768 HydrophobicContact CB-CE3 4.31Å; M764-W768 HydrophobicContact CB-CH2 3.83Å; M764-W768 HydrophobicContact CB-CZ2 4.14Å; M764-W768 HydrophobicContact CB-CZ3 3.93Å; M764-W768 HydrophobicContact CG-CH2 4.44Å; M764-W768 VanDerWaalsContact O-CG 3.3Å; M764-W768 PolarHBondContact O-N 3.03Å; M764-W768 HydrophobicContact SD-CH2 4.32Å
765	R	98	Very high	94.8	Very high	107 Å²	107	54.5 Å²	54.5	40%	0.404	29%	0.293	S	S	.	.	H	α-helix	trans	-61.7	-40.1	178.9	-70	-68.3	-58.1	-144.9	-1.5	112.2	Y761 M762 W768 H769	Y761-R765 HydrophobicContact CD1-CG 4.49Å; Y761-R765 HydrophobicContact CE1-CG 4.17Å; Y761-R765 HydrophobicContact CE2-CG 4.23Å; Y761-R765 WeakPolarHBondContact O-CG 3.48Å; Y761-R765 PolarHBondContact O-N 2.81Å; M762-R765 CarbonylContact O-C 3.53Å; M762-R765 WeakPolarHBondContact O-CA 2.98Å; M762-R765 WeakPolarHBondContact O-CB 3.35Å; M762-R765 PolarHBondContact O-N 3.33Å; M762-R765 HydrophobicContact SD-CG 4.41Å; R765-W768 CarbonylContact O-C 3.5Å; R765-W768 VanDerWaalsContact O-C 3.31Å; R765-W768 PolarHBondContact O-N 2.68Å; R765-W768 VanDerWaalsContact O-N 3.16Å; R765-H769 PolarHBondContact O-N 3.37Å
766	D	98.3	Very high	95.7	Very high	85 Å²	85	52.2 Å²	52.2	46%	0.455	28%	0.282	S	S	.	.	H	α-helix	trans	-70	-39.6	177.6	-60.6	-29.5	0	0	0	111	M762 M764 W768 H769 R775 P776	M762-D766 PolarHBondContact O-N 2.97Å; M764-D766 VanDerWaalsContact C-N 3.34Å; M764-D766 PolarHBondContact O-N 3.25Å; D766-W768 PolarHBondContact O-N 3.23Å; D766-H769 WeakPolarHBondContact O-CB 3.37Å; D766-H769 PolarHBondContact O-N 2.68Å; D766-H769 VanDerWaalsContact O-N 3.13Å; D766-R775 WeakPolarHBondContact O-CA 3.14Å; D766-P776 HydrophobicContact CB-CG 4.38Å
767	C	98.7	Very high	96.1	Very high	0 Å²	0	54.6 Å²	54.6	0%	0	30%	0.296	C	S	.	.	H	α-helix	trans	-59.4	-32	168.9	-68.2	0	0	0	0	112.6	V714 W715 M763 M764 R775	V714-C767 HydrophobicContact CG1-CB 4.05Å; W715-C767 WeakPolarHBondContact CA-O 3.45Å; M763-C767 PolarHBondContact O-N 2.88Å; M763-C767 PolarHBondContact O-SG 3.04Å; M764-C767 WeakPolarHBondContact O-CB 3.49Å; M764-C767 PolarHBondContact O-N 3.46Å; C767-R775 VanDerWaalsContact O-CD 3.25Å; C767-R775 WeakPolarHBondContact O-CD 3.27Å
768	W	98.4	Very high	96.4	Very high	1 Å²	1	51.5 Å²	51.5	0%	0.004	28%	0.277	C	S	.	.	T	Hydrogen-bonded Turn	trans	-94.4	20.5	176.2	-52.6	-39.2	0	0	0	114.6	W715 G718 V719 W722 R749 M750 Y761 M764 R765 D766 A770	W715-W768 HydrophobicContact CD2-CB 4.44Å; W715-W768 AromaticContact CD2-CD1 3.79Å; W715-W768 HydrophobicContact CD2-CG 4.47Å; W715-W768 AromaticContact CE2-CD1 3.89Å; W715-W768 VanDerWaalsContact CE3-CA 3.48Å; W715-W768 HydrophobicContact CE3-CB 4.02Å; W715-W768 HydrophobicContact CH2-CB 4.13Å; W715-W768 HydrophobicContact CZ3-CB 3.86Å; W715-W768 WeakPolarHBondContact CZ3-O 3.41Å; W715-W768 PolarHBondContact O-NE1 2.87Å; G718-W768 VanDerWaalsContact C-NE1 3.3Å; G718-W768 VanDerWaalsContact O-CZ2 3.23Å; G718-W768 WeakPolarHBondContact O-CZ2 3.39Å; V719-W768 HydrophobicContact CG2-CZ2 4.44Å; W722-W768 HydrophobicContact CB-CH2 4.12Å; W722-W768 HydrophobicContact CB-CZ2 4.07Å; W722-W768 AromaticContact CD1-CH2 3.93Å; W722-W768 HydrophobicContact CG-CH2 4.28Å; R749-W768 HydrophobicContact CB-CE3 4Å; R749-W768 HydrophobicContact CB-CZ3 4.4Å; R749-W768 HydrophobicContact CG-CB 4.49Å; R749-W768 HydrophobicContact CG-CE3 4.37Å; R749-W768 PolarHBondContact NE-O 3.4Å; R749-W768 PolarHBondContact NH2-O 3.27Å; M750-W768 HydrophobicContact CB-CH2 4.12Å; M750-W768 HydrophobicContact CB-CZ3 4.36Å; M750-W768 HydrophobicContact CE-CH2 3.58Å; M750-W768 HydrophobicContact CE-CZ2 3.32Å; Y761-W768 HydrophobicContact CE2-CZ3 4.48Å; M764-W768 HydrophobicContact CB-CE3 4.31Å; M764-W768 HydrophobicContact CB-CH2 3.83Å; M764-W768 HydrophobicContact CB-CZ2 4.14Å; M764-W768 HydrophobicContact CB-CZ3 3.93Å; M764-W768 HydrophobicContact CG-CH2 4.44Å; M764-W768 VanDerWaalsContact O-CG 3.3Å; M764-W768 PolarHBondContact O-N 3.03Å; M764-W768 HydrophobicContact SD-CH2 4.32Å; R765-W768 CarbonylContact O-C 3.5Å; R765-W768 VanDerWaalsContact O-C 3.31Å; R765-W768 PolarHBondContact O-N 2.68Å; R765-W768 VanDerWaalsContact O-N 3.16Å; D766-W768 PolarHBondContact O-N 3.23Å; W768-A770 PolarHBondContact O-N 2.61Å
769	H	97.5	Very high	96.6	Very high	65 Å²	65	51.5 Å²	51.5	30%	0.301	27%	0.272	S	S	.	.			trans	-60.5	139.5	174.1	-166.2	-92	0	0	0	111	R765 D766 V771 Q774 R775	R765-H769 PolarHBondContact O-N 3.37Å; D766-H769 WeakPolarHBondContact O-CB 3.37Å; D766-H769 PolarHBondContact O-N 2.68Å; D766-H769 VanDerWaalsContact O-N 3.13Å; H769-V771 PolarHBondContact ND1-N 2.91Å; H769-V771 VanDerWaalsContact ND1-N 3.2Å; H769-V771 PolarHBondContact ND1-O 3.24Å; H769-V771 VanDerWaalsContact ND1-O 3.17Å; H769-Q774 PolarHBondContact CE1-OE1 2.99Å; H769-Q774 PolarHBondContact NE2-OE1 2.03Å; H769-R775 HydrophobicContact CB-CG 3.92Å; H769-R775 PolarHBondContact O-NE 2.88Å; H769-R775 PolarHBondContact O-NH2 3.44Å
770	A	91.1	Very high	96.9	Very high	60 Å²	60	51.7 Å²	51.7	50%	0.496	27%	0.272	S	S	.	.	S	Bend	trans	-63.2	-50.9	-174.8	0	0	0	0	0	111.5	W768 P772 R775	W768-A770 PolarHBondContact O-N 2.61Å; A770-P772 WeakPolarHBondContact O-CD 3.18Å; A770-R775 PolarHBondContact O-NH2 2.69Å
771	V	91.6	Very high	97	Very high	62 Å²	62	51.6 Å²	51.6	38%	0.376	27%	0.272	S	S	.	.	S	Bend	trans	-73.5	118.2	174.5	-177.2	0	0	0	0	109.7	H769 S773 Q774	H769-V771 PolarHBondContact ND1-N 2.91Å; H769-V771 VanDerWaalsContact ND1-N 3.2Å; H769-V771 PolarHBondContact ND1-O 3.24Å; H769-V771 VanDerWaalsContact ND1-O 3.17Å; V771-S773 VanDerWaalsContact C-N 3.34Å; V771-S773 WeakPolarHBondContact CG1-OG 3.47Å; V771-S773 PolarHBondContact O-N 2.88Å; V771-Q774 HydrophobicContact CB-CB 4.49Å; V771-Q774 HydrophobicContact CB-CG 4.26Å; V771-Q774 HydrophobicContact CG1-CG 4.17Å; V771-Q774 PolarHBondContact O-N 2.97Å
772	P	92.8	Very high	97.1	Very high	38 Å²	38	50.9 Å²	50.9	25%	0.247	27%	0.271	C	S	.	.	G	3₁₀ helix	trans	-63.9	-32.4	-173	-23.5	33.4	0	0	0	114.9	E701 Q711 A770 Q774 R775	E701-P772 HydrophobicContact CB-CG 4.49Å; E701-P772 HydrophobicContact CG-CG 3.96Å; Q711-P772 HydrophobicContact CB-CB 3.82Å; Q711-P772 WeakPolarHBondContact CB-O 3.02Å; Q711-P772 WeakPolarHBondContact CG-O 3.49Å; Q711-P772 PolarHBondContact NE2-O 2.83Å; A770-P772 WeakPolarHBondContact O-CD 3.18Å; P772-Q774 PolarHBondContact O-N 3.25Å; P772-R775 WeakPolarHBondContact O-CB 3.43Å; P772-R775 PolarHBondContact O-N 3.19Å
773	S	93.1	Very high	97	Very high	102 Å²	102	50.7 Å²	50.7	71%	0.713	27%	0.269	S	S	*	.	G	3₁₀ helix	trans	-73.7	-6.5	179.1	52.6	0	0	0	0	114.6	V771	V771-S773 VanDerWaalsContact C-N 3.34Å; V771-S773 WeakPolarHBondContact CG1-OG 3.47Å; V771-S773 PolarHBondContact O-N 2.88Å
774	Q	96.9	Very high	96.9	Very high	127 Å²	127	52.7 Å²	52.7	59%	0.593	28%	0.28	S	S	*	.	G	3₁₀ helix	trans	-102.3	-4.7	173.6	-62.7	180	15.7	0	0	112.6	H769 V771 P772	H769-Q774 PolarHBondContact CE1-OE1 2.99Å; H769-Q774 PolarHBondContact NE2-OE1 2.03Å; V771-Q774 HydrophobicContact CB-CB 4.49Å; V771-Q774 HydrophobicContact CB-CG 4.26Å; V771-Q774 HydrophobicContact CG1-CG 4.17Å; V771-Q774 PolarHBondContact O-N 2.97Å; P772-Q774 PolarHBondContact O-N 3.25Å
775	R	98.5	Very high	96.8	Very high	6 Å²	6	52.7 Å²	52.7	2%	0.023	28%	0.28	C	S	.	.	S	Bend	trans	-71.8	145.8	168.5	-55.9	172	-170.8	151.5	11.7	109.2	E701 Q711 V714 D766 C767 H769 A770 P772	E701-R775 IonicContact OE1-CZ 3.4Å; E701-R775 IonicContact OE1-NH1 3.63Å; E701-R775 PolarHBondContact OE1-NH1 2.83Å; E701-R775 IonicContact OE1-NH2 3.6Å; E701-R775 IonicContact OE2-CZ 2.73Å; E701-R775 IonicContact OE2-NH1 2.7Å; E701-R775 PolarHBondContact OE2-NH1 2.86Å; E701-R775 IonicContact OE2-NH2 3.26Å; E701-R775 PolarHBondContact OE2-NH2 3.4Å; Q711-R775 PolarHBondContact NE2-O 3.25Å; Q711-R775 WeakPolarHBondContact O-CD 3.42Å; Q711-R775 PolarHBondContact O-NH1 3.08Å; V714-R775 HydrophobicContact CG1-CB 3.92Å; D766-R775 WeakPolarHBondContact O-CA 3.14Å; C767-R775 VanDerWaalsContact O-CD 3.25Å; C767-R775 WeakPolarHBondContact O-CD 3.27Å; H769-R775 HydrophobicContact CB-CG 3.92Å; H769-R775 PolarHBondContact O-NE 2.88Å; H769-R775 PolarHBondContact O-NH2 3.44Å; A770-R775 PolarHBondContact O-NH2 2.69Å; P772-R775 WeakPolarHBondContact O-CB 3.43Å; P772-R775 PolarHBondContact O-N 3.19Å
776	P	98.4	Very high	96.6	Very high	20 Å²	20	51.3 Å²	51.3	13%	0.13	28%	0.281	C	S	.	.	P	Polyproline II helix	trans	-62.4	149.7	175.9	28.1	-35.7	0	0	0	110.9	V714 D766 Q780 L781	V714-P776 HydrophobicContact CG1-CG 4.47Å; V714-P776 WeakPolarHBondContact CG1-O 3.26Å; V714-P776 WeakPolarHBondContact CG2-O 3.24Å; D766-P776 HydrophobicContact CB-CG 4.38Å; P776-Q780 HydrophobicContact CB-CB 4.33Å; P776-L781 HydrophobicContact CB-CD2 4.27Å; P776-L781 HydrophobicContact CB-CG 4.13Å; P776-L781 HydrophobicContact CG-CD1 4.3Å; P776-L781 HydrophobicContact CG-CD2 3.76Å; P776-L781 HydrophobicContact CG-CG 3.97Å
777	T	98.4	Very high	96.4	Very high	57 Å²	57	52.1 Å²	52.1	35%	0.35	28%	0.277	S	S	.	.	P	Polyproline II helix	trans	-76.7	158.5	170.3	62.2	0	0	0	0	110.8	K779 Q780 L781	T777-K779 PolarHBondContact O-N 2.9Å; T777-Q780 PolarHBondContact O-N 2.74Å; T777-Q780 PolarHBondContact OG1-N 2.76Å; T777-Q780 PolarHBondContact OG1-OE1 3.42Å; T777-L781 PolarHBondContact O-N 3.05Å
778	F	98.6	Very high	96.1	Very high	6 Å²	6	52.6 Å²	52.6	3%	0.026	28%	0.279	C	S	.	.	H	α-helix	trans	-57.1	-30.7	174.8	-78	-63.7	0	0	0	113.7	M642 E643 A646 D713 V714 F717 L781 V782	M642-F778 HydrophobicContact CB-CD1 3.42Å; M642-F778 VanDerWaalsContact CB-CD1 3.42Å; M642-F778 HydrophobicContact CB-CD2 3.92Å; M642-F778 HydrophobicContact CB-CE1 3.35Å; M642-F778 HydrophobicContact CB-CE2 3.85Å; M642-F778 HydrophobicContact CB-CG 3.71Å; M642-F778 HydrophobicContact CB-CZ 3.58Å; M642-F778 HydrophobicContact CE-CE2 3.76Å; M642-F778 HydrophobicContact CE-CZ 3.74Å; M642-F778 HydrophobicContact CG-CD1 4.34Å; M642-F778 HydrophobicContact CG-CE1 3.81Å; M642-F778 HydrophobicContact CG-CZ 3.9Å; E643-F778 HydrophobicContact CB-CB 4.02Å; A646-F778 HydrophobicContact CB-CD2 4.44Å; D713-F778 HydrophobicContact CB-CE2 3.84Å; D713-F778 HydrophobicContact CB-CZ 3.97Å; V714-F778 HydrophobicContact CB-CZ 4.36Å; V714-F778 HydrophobicContact CG2-CD1 4.38Å; V714-F778 HydrophobicContact CG2-CD2 3.85Å; V714-F778 HydrophobicContact CG2-CE1 4.15Å; V714-F778 HydrophobicContact CG2-CE2 3.59Å; V714-F778 HydrophobicContact CG2-CG 4.24Å; V714-F778 HydrophobicContact CG2-CZ 3.75Å; F717-F778 HydrophobicContact CB-CE1 3.67Å; F717-F778 HydrophobicContact CB-CZ 4.04Å; F717-F778 HydrophobicContact CD1-CE1 4.26Å; F717-F778 HydrophobicContact CD2-CE1 4.17Å; F717-F778 AromaticContact CG-CE1 3.78Å; F717-F778 HydrophobicContact CG-CE1 3.78Å; F778-L781 HydrophobicContact CD1-CD1 3.95Å; F778-L781 HydrophobicContact CE1-CD1 4.26Å; F778-L781 PolarHBondContact O-N 3.15Å; F778-V782 VanDerWaalsContact O-CG2 3.31Å; F778-V782 WeakPolarHBondContact O-CG2 3.26Å; F778-V782 PolarHBondContact O-N 3.31Å
779	K	98.2	Very high	95.7	Very high	107 Å²	107	54 Å²	54	47%	0.465	29%	0.288	S	S	.	.	H	α-helix	trans	-62.1	-48	172.7	178.7	172.8	-179.4	-72.7	0	112	E643 T777 L781 V782 E783	E643-K779 HydrophobicContact CG-CB 4.46Å; T777-K779 PolarHBondContact O-N 2.9Å; K779-L781 VanDerWaalsContact C-N 3.34Å; K779-L781 PolarHBondContact O-N 3.04Å; K779-V782 WeakPolarHBondContact O-CB 3.25Å; K779-V782 PolarHBondContact O-N 2.81Å; K779-E783 WeakPolarHBondContact CE-OE1 3.42Å; K779-E783 VanDerWaalsContact NZ-CD 3.28Å; K779-E783 IonicContact NZ-OE1 3.41Å; K779-E783 PolarHBondContact NZ-OE1 3.28Å; K779-E783 IonicContact NZ-OE2 2.73Å; K779-E783 PolarHBondContact NZ-OE2 3.28Å; K779-E783 WeakPolarHBondContact O-CG 3.45Å; K779-E783 PolarHBondContact O-N 3.04Å
780	Q	98.3	Very high	95.2	Very high	88 Å²	88	53.2 Å²	53.2	41%	0.411	29%	0.293	S	S	.	.	H	α-helix	trans	-63.7	-41.1	177.3	-68.4	162.1	-78.1	0	0	111.2	P776 T777 V782 E783 D784	P776-Q780 HydrophobicContact CB-CB 4.33Å; T777-Q780 PolarHBondContact O-N 2.74Å; T777-Q780 PolarHBondContact OG1-N 2.76Å; T777-Q780 PolarHBondContact OG1-OE1 3.42Å; Q780-V782 VanDerWaalsContact C-N 3.29Å; Q780-V782 PolarHBondContact O-N 3.3Å; Q780-E783 PolarHBondContact O-N 3.18Å; Q780-E783 VanDerWaalsContact O-N 3.17Å; Q780-D784 PolarHBondContact O-N 3.44Å
781	L	98.5	Very high	94.8	Very high	2 Å²	2	54.8 Å²	54.8	1%	0.01	29%	0.292	C	S	.	.	H	α-helix	trans	-60.7	-36.7	174.2	-69.9	168	0	0	0	112.5	V714 F717 M763 P776 T777 F778 K779 L785	V714-L781 HydrophobicContact CG1-CD1 4.19Å; V714-L781 HydrophobicContact CG2-CD1 4.43Å; F717-L781 HydrophobicContact CD1-CD1 3.75Å; F717-L781 HydrophobicContact CE1-CB 4.48Å; F717-L781 HydrophobicContact CE1-CD1 3.98Å; F717-L781 HydrophobicContact CE1-CD2 4.32Å; M763-L781 HydrophobicContact CG-CD2 3.5Å; M763-L781 HydrophobicContact SD-CD2 3.75Å; P776-L781 HydrophobicContact CB-CD2 4.27Å; P776-L781 HydrophobicContact CB-CG 4.13Å; P776-L781 HydrophobicContact CG-CD1 4.3Å; P776-L781 HydrophobicContact CG-CD2 3.76Å; P776-L781 HydrophobicContact CG-CG 3.97Å; T777-L781 PolarHBondContact O-N 3.05Å; F778-L781 HydrophobicContact CD1-CD1 3.95Å; F778-L781 HydrophobicContact CE1-CD1 4.26Å; F778-L781 PolarHBondContact O-N 3.15Å; K779-L781 VanDerWaalsContact C-N 3.34Å; K779-L781 PolarHBondContact O-N 3.04Å; L781-L785 WeakPolarHBondContact O-CB 3.2Å; L781-L785 WeakPolarHBondContact O-CD1 3.22Å; L781-L785 WeakPolarHBondContact O-CG 3.48Å; L781-L785 PolarHBondContact O-N 2.78Å
782	V	98.5	Very high	94.2	Very high	16 Å²	16	53.4 Å²	53.4	10%	0.097	28%	0.284	C	S	.	.	H	α-helix	trans	-66.8	-47.2	172.3	169.1	0	0	0	0	111	Y636 A639 R640 E643 F778 K779 Q780 D784 L785 D786	Y636-V782 HydrophobicContact CE2-CG1 4.25Å; A639-V782 VanDerWaalsContact C-CG2 3.47Å; A639-V782 HydrophobicContact CB-CG2 3.74Å; R640-V782 HydrophobicContact CB-CG2 4.29Å; R640-V782 HydrophobicContact CG-CB 4.33Å; R640-V782 HydrophobicContact CG-CG1 3.68Å; R640-V782 HydrophobicContact CG-CG2 3.61Å; E643-V782 HydrophobicContact CB-CG2 4.14Å; F778-V782 VanDerWaalsContact O-CG2 3.31Å; F778-V782 WeakPolarHBondContact O-CG2 3.26Å; F778-V782 PolarHBondContact O-N 3.31Å; K779-V782 WeakPolarHBondContact O-CB 3.25Å; K779-V782 PolarHBondContact O-N 2.81Å; Q780-V782 VanDerWaalsContact C-N 3.29Å; Q780-V782 PolarHBondContact O-N 3.3Å; V782-D784 PolarHBondContact O-N 2.82Å; V782-L785 PolarHBondContact O-N 3.04Å; V782-D786 VanDerWaalsContact O-CB 3.31Å; V782-D786 WeakPolarHBondContact O-CB 3.48Å; V782-D786 PolarHBondContact O-N 3.25Å
783	E	97.3	Very high	93.2	Very high	100 Å²	100	53.6 Å²	53.6	47%	0.467	29%	0.286	S	S	.	.	H	α-helix	trans	-59.9	-43.1	179.1	-70.8	171	148.9	0	0	112.2	K779 Q780 R787	K779-E783 WeakPolarHBondContact CE-OE1 3.42Å; K779-E783 VanDerWaalsContact NZ-CD 3.28Å; K779-E783 IonicContact NZ-OE1 3.41Å; K779-E783 PolarHBondContact NZ-OE1 3.28Å; K779-E783 IonicContact NZ-OE2 2.73Å; K779-E783 PolarHBondContact NZ-OE2 3.28Å; K779-E783 WeakPolarHBondContact O-CG 3.45Å; K779-E783 PolarHBondContact O-N 3.04Å; Q780-E783 PolarHBondContact O-N 3.18Å; Q780-E783 VanDerWaalsContact O-N 3.17Å; E783-R787 WeakPolarHBondContact O-CB 3.42Å; E783-R787 PolarHBondContact O-N 2.83Å
784	D	96.3	Very high	91.6	Very high	58 Å²	58	54.1 Å²	54.1	31%	0.31	28%	0.281	S	S	.	.	H	α-helix	trans	-73.6	-38.6	177.2	-80.1	-49.1	0	0	0	113.4	M763 Q780 V782 R787 I788	M763-D784 HydrophobicContact CE-CB 3.57Å; Q780-D784 PolarHBondContact O-N 3.44Å; V782-D784 PolarHBondContact O-N 2.82Å; D784-R787 WeakPolarHBondContact O-CB 3.32Å; D784-R787 PolarHBondContact O-N 2.91Å; D784-R787 IonicContact OD1-CZ 3.28Å; D784-R787 IonicContact OD1-NE 2.93Å; D784-R787 PolarHBondContact OD1-NE 2.88Å; D784-R787 VanDerWaalsContact OD1-NE 3.14Å; D784-R787 IonicContact OD1-NH2 3.18Å; D784-R787 PolarHBondContact OD1-NH2 3.31Å; D784-I788 VanDerWaalsContact O-CG1 3.3Å; D784-I788 WeakPolarHBondContact O-CG1 3.22Å; D784-I788 PolarHBondContact O-N 3.48Å
785	L	96.3	Very high	89.6	Confident	0 Å²	0	54.6 Å²	54.6	0%	0	28%	0.283	C	S	.	.	H	α-helix	trans	-70.9	-35.3	177	-72.3	166.8	0	0	0	112	V632 A635 Y636 A639 F717 L760 M763 L781 V782 R787 I788 V789	V632-L785 HydrophobicContact CG1-CD2 4Å; A635-L785 HydrophobicContact CB-CD1 4.19Å; A635-L785 HydrophobicContact CB-CD2 4.21Å; Y636-L785 HydrophobicContact CD2-CB 4.03Å; A639-L785 HydrophobicContact CB-CD1 3.83Å; F717-L785 HydrophobicContact CE1-CD1 4.27Å; F717-L785 HydrophobicContact CZ-CD1 3.91Å; L760-L785 HydrophobicContact CD2-CD2 3.96Å; M763-L785 HydrophobicContact CE-CD2 4.02Å; M763-L785 HydrophobicContact CE-CG 3.96Å; M763-L785 HydrophobicContact SD-CD1 4.19Å; M763-L785 HydrophobicContact SD-CD2 3.78Å; M763-L785 HydrophobicContact SD-CG 3.82Å; L781-L785 WeakPolarHBondContact O-CB 3.2Å; L781-L785 WeakPolarHBondContact O-CD1 3.22Å; L781-L785 WeakPolarHBondContact O-CG 3.48Å; L781-L785 PolarHBondContact O-N 2.78Å; V782-L785 PolarHBondContact O-N 3.04Å; L785-R787 VanDerWaalsContact C-N 3.34Å; L785-I788 PolarHBondContact O-N 3.34Å; L785-V789 VanDerWaalsContact O-CG2 3.32Å; L785-V789 WeakPolarHBondContact O-CG2 3.4Å; L785-V789 PolarHBondContact O-N 3.41Å
786	D	94	Very high	87.2	Confident	78 Å²	78	60.1 Å²	60.1	42%	0.417	31%	0.31	S	S	.	.	H	α-helix	trans	-58.7	-47.2	172.8	-156.7	84.1	0	0	0	110.5	Y636 V782 I788 V789 A790	Y636-D786 HydrophobicContact CD2-CB 4.3Å; Y636-D786 HydrophobicContact CE2-CB 3.67Å; Y636-D786 WeakPolarHBondContact CE2-OD1 3.48Å; Y636-D786 PolarHBondContact OH-OD1 2.88Å; V782-D786 VanDerWaalsContact O-CB 3.31Å; V782-D786 WeakPolarHBondContact O-CB 3.48Å; V782-D786 PolarHBondContact O-N 3.25Å; D786-I788 PolarHBondContact O-N 3.3Å; D786-V789 PolarHBondContact O-N 2.81Å; D786-A790 WeakPolarHBondContact O-CB 3.41Å; D786-A790 PolarHBondContact O-N 2.94Å
787	R	93.9	Very high	84.5	Confident	102 Å²	102	69.6 Å²	69.6	39%	0.385	34%	0.344	S	S	.	.	H	α-helix	trans	-57.8	-44.4	175.4	179.7	178.4	63	70.2	-2.8	112.4	E759 E783 D784 L785 L791	E759-R787 IonicContact OE1-CZ 2.59Å; E759-R787 VanDerWaalsContact OE1-CZ 3.24Å; E759-R787 IonicContact OE1-NH1 2.64Å; E759-R787 PolarHBondContact OE1-NH1 2.89Å; E759-R787 IonicContact OE1-NH2 3.42Å; E759-R787 PolarHBondContact OE1-NH2 2.95Å; E783-R787 WeakPolarHBondContact O-CB 3.42Å; E783-R787 PolarHBondContact O-N 2.83Å; D784-R787 WeakPolarHBondContact O-CB 3.32Å; D784-R787 PolarHBondContact O-N 2.91Å; D784-R787 IonicContact OD1-CZ 3.28Å; D784-R787 IonicContact OD1-NE 2.93Å; D784-R787 PolarHBondContact OD1-NE 2.88Å; D784-R787 VanDerWaalsContact OD1-NE 3.14Å; D784-R787 IonicContact OD1-NH2 3.18Å; D784-R787 PolarHBondContact OD1-NH2 3.31Å; L785-R787 VanDerWaalsContact C-N 3.34Å; R787-L791 HydrophobicContact CG-CD1 4.39Å; R787-L791 VanDerWaalsContact O-CG 3.31Å; R787-L791 WeakPolarHBondContact O-CG 3.33Å; R787-L791 PolarHBondContact O-N 2.99Å; R787-L791 VanDerWaalsContact O-N 3.13Å
788	I	91.9	Very high	81.9	Confident	9 Å²	9	73.3 Å²	73.3	5%	0.046	36%	0.361	C	S	.	.	H	α-helix	trans	-68.5	-44.6	177.4	-63.9	165.1	0	0	0	111	V632 E759 L760 M763 D784 L785 D786 A790 L791 T792	V632-I788 HydrophobicContact CG1-CB 4.22Å; V632-I788 HydrophobicContact CG1-CG2 3.84Å; V632-I788 HydrophobicContact CG2-CG2 4.17Å; E759-I788 HydrophobicContact CG-CD1 4.1Å; L760-I788 HydrophobicContact CD2-CD1 3.88Å; L760-I788 HydrophobicContact CG-CD1 4.38Å; M763-I788 HydrophobicContact CE-CD1 3.99Å; D784-I788 VanDerWaalsContact O-CG1 3.3Å; D784-I788 WeakPolarHBondContact O-CG1 3.22Å; D784-I788 PolarHBondContact O-N 3.48Å; L785-I788 PolarHBondContact O-N 3.34Å; D786-I788 PolarHBondContact O-N 3.3Å; I788-A790 VanDerWaalsContact C-N 3.31Å; I788-A790 PolarHBondContact O-N 2.97Å; I788-L791 PolarHBondContact O-N 2.95Å; I788-T792 PolarHBondContact O-N 2.81Å; I788-T792 PolarHBondContact O-OG1 2.96Å
789	V	89.1	Confident	79	Confident	32 Å²	32	78.3 Å²	78.3	19%	0.194	39%	0.388	C	S	.	.	H	α-helix	trans	-58.2	-42.9	176	171.5	0	0	0	0	111.4	V632 L785 D786 S793	V632-V789 HydrophobicContact CB-CG2 4.17Å; V632-V789 HydrophobicContact CG1-CG2 3.53Å; L785-V789 VanDerWaalsContact O-CG2 3.32Å; L785-V789 WeakPolarHBondContact O-CG2 3.4Å; L785-V789 PolarHBondContact O-N 3.41Å; D786-V789 PolarHBondContact O-N 2.81Å; V789-S793 VanDerWaalsContact O-CB 3.31Å; V789-S793 WeakPolarHBondContact O-CB 3.29Å; V789-S793 PolarHBondContact O-N 2.67Å; V789-S793 PolarHBondContact O-OG 3.02Å
790	A	86.8	Confident	76.7	Confident	47 Å²	47	81.1 Å²	81.1	39%	0.388	41%	0.408	S	S	.	.	H	α-helix	trans	-63.2	-42.7	177.7	0	0	0	0	0	112.2	D786 I788 S793 N794	D786-A790 WeakPolarHBondContact O-CB 3.41Å; D786-A790 PolarHBondContact O-N 2.94Å; I788-A790 VanDerWaalsContact C-N 3.31Å; I788-A790 PolarHBondContact O-N 2.97Å; A790-S793 PolarHBondContact O-N 3.48Å; A790-N794 PolarHBondContact O-N 3.01Å; A790-N794 PolarHBondContact O-ND2 2.77Å
791	L	84.3	Confident	74	Confident	93 Å²	93	81.5 Å²	81.5	49%	0.487	42%	0.42	S	S	.	.	H	α-helix	trans	-64.4	-48.3	177	-72.8	167.6	0	0	0	112	R787 I788 S793 N794 Q795	R787-L791 HydrophobicContact CG-CD1 4.39Å; R787-L791 VanDerWaalsContact O-CG 3.31Å; R787-L791 WeakPolarHBondContact O-CG 3.33Å; R787-L791 PolarHBondContact O-N 2.99Å; R787-L791 VanDerWaalsContact O-N 3.13Å; I788-L791 PolarHBondContact O-N 2.95Å; L791-S793 VanDerWaalsContact C-N 3.3Å; L791-S793 PolarHBondContact O-N 3.09Å; L791-N794 PolarHBondContact O-N 2.84Å; L791-Q795 PolarHBondContact O-N 3.14Å
792	T	78.8	Confident	71	Confident	34 Å²	34	89.7 Å²	89.7	21%	0.209	46%	0.46	C	S	.	.	H	α-helix	trans	-62.8	-36.8	177.5	-53.2	0	0	0	0	112	K629 I788 N794 Q795	K629-T792 HydrophobicContact CB-CG2 3.79Å; K629-T792 HydrophobicContact CG-CG2 4.2Å; I788-T792 PolarHBondContact O-N 2.81Å; I788-T792 PolarHBondContact O-OG1 2.96Å; T792-N794 VanDerWaalsContact C-N 3.25Å; T792-N794 PolarHBondContact O-N 2.67Å; T792-Q795 PolarHBondContact O-N 3.32Å
793	S	72.1	Confident	68.2	Low	42 Å²	42	94.4 Å²	94.4	29%	0.294	49%	0.491	S	S	.	.	H	α-helix	trans	-67.1	-23.6	178.5	-58.4	0	0	0	0	113.7	K629 V789 A790 L791	K629-S793 WeakPolarHBondContact CE-OG 3.34Å; V789-S793 VanDerWaalsContact O-CB 3.31Å; V789-S793 WeakPolarHBondContact O-CB 3.29Å; V789-S793 PolarHBondContact O-N 2.67Å; V789-S793 PolarHBondContact O-OG 3.02Å; A790-S793 PolarHBondContact O-N 3.48Å; L791-S793 VanDerWaalsContact C-N 3.3Å; L791-S793 PolarHBondContact O-N 3.09Å
794	N	59.2	Low	65.1	Low	112 Å²	112	97.5 Å²	97.5	60%	0.599	51%	0.51	S	S	*	.	H	α-helix	trans	-87.1	-21.1	176.4	-69.8	-31.5	0	0	0	113	A790 L791 T792 Y797	A790-N794 PolarHBondContact O-N 3.01Å; A790-N794 PolarHBondContact O-ND2 2.77Å; L791-N794 PolarHBondContact O-N 2.84Å; T792-N794 VanDerWaalsContact C-N 3.25Å; T792-N794 PolarHBondContact O-N 2.67Å; N794-Y797 PolarHBondContact O-N 2.95Å
795	Q	54.2	Low	62.2	Low	137 Å²	137	102.3 Å²	102.3	64%	0.64	54%	0.536	S	S	*	.	H	α-helix	trans	-72.2	-28.4	-179.6	-75.4	179.9	-34.6	0	0	113.1	L791 T792 Y797 L798	L791-Q795 PolarHBondContact O-N 3.14Å; T792-Q795 PolarHBondContact O-N 3.32Å; Q795-Y797 PolarHBondContact O-N 2.74Å; Q795-Y797 VanDerWaalsContact O-N 3.12Å; Q795-L798 PolarHBondContact O-N 3.21Å
796	E	48	Very low	59.1	Low	123 Å²	123	110.9 Å²	110.9	58%	0.575	58%	0.576	S	S	*	*	T	Hydrogen-bonded Turn	trans	-61.2	-16.5	172.5	-70.2	169.6	149.4	0	0	113.6	K629	K629-E796 WeakPolarHBondContact CD-OE1 3.48Å; K629-E796 VanDerWaalsContact NZ-CD 3.3Å; K629-E796 IonicContact NZ-OE1 2.66Å; K629-E796 PolarHBondContact NZ-OE1 3.34Å; K629-E796 IonicContact NZ-OE2 2.71Å; K629-E796 PolarHBondContact NZ-OE2 2.84Å
797	Y	42	Very low	56	Low	219 Å²	219	117.8 Å²	117.8	86%	0.859	60%	0.598	S	S	*	*	T	Hydrogen-bonded Turn	trans	-92.4	-1.7	176.9	-152.8	-94.9	0	0	0	113.3	N794 Q795	N794-Y797 PolarHBondContact O-N 2.95Å; Q795-Y797 PolarHBondContact O-N 2.74Å; Q795-Y797 VanDerWaalsContact O-N 3.12Å
798	L	43.6	Very low	52.8	Low	134 Å²	134	118.5 Å²	118.5	70%	0.702	62%	0.618	S	S	*	*			trans	-134.4	29.3	-170.5	-94.8	167.4	0	0	0	113.9	Q795 L800	Q795-L798 PolarHBondContact O-N 3.21Å; L798-L800 PolarHBondContact O-N 2.76Å
799	D	38.8	Very low	50.1	Low	111 Å²	111	123.9 Å²	123.9	59%	0.594	65%	0.653	S	S	*	*			trans	-77.4	107.6	168	-168.7	-1.7	0	0	0	111	S801	D799-S801 WeakPolarHBondContact OD1-CA 3.3Å; D799-S801 WeakPolarHBondContact OD1-CB 3.42Å; D799-S801 PolarHBondContact OD1-N 2.88Å; D799-S801 PolarHBondContact OD1-OG 2.66Å
800	L	48.1	Very low	47.1	Very low	167 Å²	167	126.7 Å²	126.7	87%	0.874	68%	0.675	S	S	*	*			trans	-110	17.9	170.1	-79.8	170.1	0	0	0	111.9	L798	L798-L800 PolarHBondContact O-N 2.76Å
801	S	43	Very low	44.4	Very low	96 Å²	96	133.8 Å²	133.8	67%	0.671	70%	0.697	S	S	*	*			trans	-109.1	48.2	-172.6	28.8	0	0	0	0	113.4	D799	D799-S801 WeakPolarHBondContact OD1-CA 3.3Å; D799-S801 WeakPolarHBondContact OD1-CB 3.42Å; D799-S801 PolarHBondContact OD1-N 2.88Å; D799-S801 PolarHBondContact OD1-OG 2.66Å
802	M	35.6	Very low	42.8	Very low	174 Å²	174	134 Å²	134	86%	0.857	70%	0.704	S	S	*	*			trans	-65.8	139.7	159.1	-74.1	-141.8	-63.4	0	0	110.3
803	P	39.8	Very low	40.4	Very low	115 Å²	115	139.2 Å²	139.2	75%	0.747	73%	0.731	S	S	*	*			trans	-64.3	140.6	-176.3	-22.3	33.6	0	0	0	113.4	D805	P803-D805 PolarHBondContact O-N 2.87Å
804	L	31.7	Very low	38.3	Very low	164 Å²	164	143.1 Å²	143.1	86%	0.859	75%	0.753	S	S	*	*			trans	-79.3	94.6	160	-83.9	168.8	0	0	0	109	Q806	L804-Q806 PolarHBondContact O-N 2.98Å; L804-Q806 VanDerWaalsContact O-N 3.14Å
805	D	34.9	Very low	37	Very low	159 Å²	159	148.6 Å²	148.6	85%	0.85	77%	0.765	S	S	*	*			trans	-57.8	113.8	161.7	-88.6	-40.5	0	0	0	109.1	P803	P803-D805 PolarHBondContact O-N 2.87Å
806	Q	30.9	Very low	35.9	Very low	181 Å²	181	147.6 Å²	147.6	85%	0.846	77%	0.774	S	S	*	*			trans	-131.4	99	170.6	-129.4	170.5	32.2	0	0	111.8	L804	L804-Q806 PolarHBondContact O-N 2.98Å; L804-Q806 VanDerWaalsContact O-N 3.14Å
807	Y	29.8	Very low	35.2	Very low	223 Å²	223	146.3 Å²	146.3	88%	0.875	78%	0.778	S	S	*	*			trans	-38.8	136.1	160.2	-98.1	-108.2	0	0	0	112.3
808	S	27.4	Very low	34.6	Very low	116 Å²	116	141.8 Å²	141.8	81%	0.811	77%	0.773	S	S	*	*			trans	-157	145.8	138.7	-85	0	0	0	0	111.7
809	P	33.5	Very low	34	Very low	122 Å²	122	141.2 Å²	141.2	79%	0.792	78%	0.779	S	S	*	*			trans	-90.5	165.9	-176.3	-0.5	22	0	0	0	113.3
810	S	27.6	Very low	33.7	Very low	92 Å²	92	140.5 Å²	140.5	64%	0.643	78%	0.783	S	S	*	*			trans	-71.6	140.7	176	54.4	0	0	0	0	114.5
811	F	29.9	Very low	33.2	Very low	195 Å²	195	138.2 Å²	138.2	86%	0.855	78%	0.781	S	S	*	*				175.2	170.3	121.6	-93.7	-53.9	0	0	0	111.4
812	P	49.2	Very low	32.5	Very low	98 Å²	98	137 Å²	137	64%	0.636	78%	0.784	S	S	*	*			trans	-125.6	-166.9	-130.7	45.6	-31	0	0	0	116.6
813	D	28.4	Very low	32.5	Very low	144 Å²	144	137.9 Å²	137.9	77%	0.77	79%	0.786	S	S	*	*			trans	72.5	148.5	172.3	-59.9	-41.5	0	0	0	116
814	T	29.6	Very low	32.3	Very low	124 Å²	124	139.9 Å²	139.9	76%	0.761	79%	0.79	S	S	*	*			cis	-148.7	163.8	17.7	-27.4	0	0	0	0	113.2
815	R	31.8	Very low	32.5	Very low	227 Å²	227	137.6 Å²	137.6	86%	0.857	79%	0.788	S	S	*	*			trans	-13.6	159.4	163.8	-72.6	170	146.8	154.8	-7.2	121.8
816	S	30.1	Very low	32.4	Very low	116 Å²	116	135.5 Å²	135.5	81%	0.811	78%	0.781	S	S	*	*			trans	81.2	148.4	152.8	70	0	0	0	0	117.6
817	S	33.1	Very low	32.3	Very low	95 Å²	95	135.8 Å²	135.8	66%	0.664	78%	0.779	S	S	*	*			cis	-173.7	140	-15	47.1	0	0	0	0	113.4
818	T	30.8	Very low	32.4	Very low	124 Å²	124	129.4 Å²	129.4	76%	0.761	77%	0.767	S	S	*	*			trans	50.9	152.9	149.2	49.9	0	0	0	0	123.6
819	C	29.6	Very low	32.7	Very low	123 Å²	123	133.3 Å²	133.3	83%	0.831	77%	0.772	S	S	*	*			trans	59.9	153.4	153.6	58.6	0	0	0	0	119.9
820	S	32.6	Very low	32.7	Very low	95 Å²	95	134.7 Å²	134.7	66%	0.664	77%	0.768	S	S	*	*			cis	-171	156.9	-16.6	166.4	0	0	0	0	109.8
821	S	37	Very low	33.5	Very low	119 Å²	119	135.8 Å²	135.8	83%	0.832	77%	0.773	S	S	*	*			trans	62.2	165.2	160.6	36.5	0	0	0	0	116.9
822	G	28.3	Very low	33.4	Very low	72 Å²	72	133.1 Å²	133.1	74%	0.742	77%	0.767	S	S	*	*			cis	-163.9	-165	2.2	0	0	0	0	0	111.6
823	E	37.4	Very low	33.6	Very low	191 Å²	191	133.7 Å²	133.7	89%	0.893	77%	0.771	S	S	*	*			trans	-108.6	173.1	-163.2	-60.2	172.1	143.8	0	0	114.9
824	D	34.6	Very low	33.6	Very low	158 Å²	158	136 Å²	136	85%	0.845	78%	0.777	S	S	*	*			trans	61.9	127.1	163.9	-80.9	-3.5	0	0	0	122.1
825	S	35	Very low	33.8	Very low	116 Å²	116	138.1 Å²	138.1	81%	0.811	78%	0.778	S	S	*	*				163.2	-175.5	94.3	-154.1	0	0	0	0	113.3
826	V	33.5	Very low	35	Very low	114 Å²	114	132 Å²	132	69%	0.691	77%	0.768	S	S	*	*			trans	-137.6	134	-166.5	-176.9	0	0	0	0	111.9
827	F	29.6	Very low	34.9	Very low	187 Å²	187	132.2 Å²	132.2	82%	0.82	77%	0.768	S	S	*	*				169.8	132.6	125.3	-107.3	-82.6	0	0	0	116.2
828	S	31.9	Very low	34.8	Very low	89 Å²	89	135.3 Å²	135.3	62%	0.622	78%	0.776	S	S	*	*			trans	43.5	131.9	147.6	59.9	0	0	0	0	124.1
829	H	32.6	Very low	35.8	Very low	198 Å²	198	134.3 Å²	134.3	92%	0.917	77%	0.772	S	S	*	*				-158.1	155.5	111.7	-103.8	-71.9	0	0	0	111.4
830	E	33.5	Very low	35.7	Very low	152 Å²	152	139.2 Å²	139.2	71%	0.71	77%	0.773	S	S	*	*			trans	-143.7	160.4	-173.9	-163.8	-164.3	-150.6	0	0	109.8
831	P	44.3	Very low	35.6	Very low	114 Å²	114	142.9 Å²	142.9	74%	0.74	78%	0.779	S	S	*	*				-152	130.7	118	34.9	-16.2	0	0	0	117.9
832	L	28.6	Very low	36.1	Very low	139 Å²	139	142.5 Å²	142.5	73%	0.728	77%	0.774	S	S	*	*				42.1	162.3	115.3	-59.7	177.8	0	0	0	122.4
833	P	54	Low	36.3	Very low	110 Å²	110	143.5 Å²	143.5	71%	0.714	78%	0.775	S	S	*	*			cis	-144.1	178.6	-36.9	40.5	-23.9	0	0	0	115.1
834	E	27.8	Very low	36	Very low	193 Å²	193	142.6 Å²	142.6	90%	0.902	77%	0.771	S	S	*	*			trans	-159.4	154.4	130.7	-123.7	177.6	-145.3	0	0	112.4
835	E	33.3	Very low	35.8	Very low	169 Å²	169	142.3 Å²	142.3	79%	0.79	77%	0.769	S	S	*	*			trans	-154.9	-178.6	-174.5	-126.1	-147.4	-149.6	0	0	108.2
836	P	57.3	Low	35.7	Very low	98 Å²	98	140.2 Å²	140.2	64%	0.636	76%	0.758	S	S	*	*			cis	-143.2	178.7	19.4	43.8	-24.8	0	0	0	117.7
837	C	28.6	Very low	35.7	Very low	120 Å²	120	143.1 Å²	143.1	81%	0.811	77%	0.77	S	S	*	*				176.6	153.2	125.5	-93.6	0	0	0	0	115
838	L	30.1	Very low	35.7	Very low	160 Å²	160	138.2 Å²	138.2	84%	0.838	77%	0.772	S	S	*	*			trans	-137.8	-174.3	-168.5	-83.5	172.9	0	0	0	111.6
839	P	51.2	Low	35.7	Very low	103 Å²	103	137.3 Å²	137.3	67%	0.669	78%	0.777	S	S	*	*			cis	-123.1	-150.1	-14	20.4	7.4	0	0	0	110.8
840	R	27.7	Very low	36	Very low	226 Å²	226	136 Å²	136	85%	0.853	78%	0.776	S	S	*	*			cis	-152.9	141.6	15.7	-74.2	-178	168.9	158.9	-1.3	114.6
841	H	31.3	Very low	36	Very low	173 Å²	173	138.4 Å²	138.4	80%	0.801	78%	0.784	S	S	*	*				1.5	165.2	129	-69.8	-37.7	0	0	0	123.9
842	P	48.3	Very low	36.1	Very low	110 Å²	110	144.6 Å²	144.6	71%	0.714	79%	0.793	S	S	*	*			cis	-145	159	-20.9	35.7	-15.7	0	0	0	119
843	A	31.9	Very low	36.7	Very low	94 Å²	94	152.9 Å²	152.9	78%	0.777	81%	0.814	S	S	*	*			trans	26.7	146.5	137.2	0	0	0	0	0	125
844	Q	31.2	Very low	35.8	Very low	171 Å²	171	155.1 Å²	155.1	80%	0.799	82%	0.819	S	S	*	*				-173.5	139.2	111.6	-102.3	-174.2	15.4	0	0	115.4
845	L	30.7	Very low	36.2	Very low	152 Å²	152	153.1 Å²	153.1	80%	0.796	82%	0.815	S	S	*	*			trans	55.6	165.2	144.4	-59.3	168.9	0	0	0	121.5
846	A	32.2	Very low	36.4	Very low	72 Å²	72	152.2 Å²	152.2	60%	0.595	82%	0.816	S	S	*	*			cis	-173.4	152.2	-43.9	0	0	0	0	0	111
847	N	32.7	Very low	35.1	Very low	175 Å²	175	155.4 Å²	155.4	94%	0.936	83%	0.827	S	S	*	*			trans	61.4	152.2	161.1	-73	-13	0	0	0	120.8
848	G	30.4	Very low	35.5	Very low	84 Å²	84	157.6 Å²	157.6	87%	0.866	83%	0.828	S	S	*	*			trans	134.2	105.9	164.2	0	0	0	0	0	113.4
849	G	32.3	Very low	35.9	Very low	71 Å²	71	157.4 Å²	157.4	73%	0.732	83%	0.827	S	S	*	*			trans	-134	168.8	-176.9	0	0	0	0	0	114.7
850	L	37.9	Very low	34.8	Very low	169 Å²	169	161.3 Å²	161.3	89%	0.885	84%	0.839	S	S	*	*			trans	54.4	115.1	170.6	-74.9	82.4	0	0	0	118
851	K	34.3	Very low	35.4	Very low	203 Å²	203	156.3 Å²	156.3	88%	0.883	84%	0.838	S	S	*	*				-165.6	155	91.8	-106.4	173	-177.4	173.8	0	112.8
852	R	46.2	Very low	35.7	Very low	244 Å²	244	154.9 Å²	154.9	92%	0.921	84%	0.841	S	S	*	*			trans	-69.6	147.6	162.3	-69.6	177.8	172.9	170.7	-4.5	109.8
853	R	40.3	Very low	34.6	Very low	314 Å²	314	159 Å²	159	100%	1.185	85%	0.852	S	S	*	*				-136.3	0	113	-153	172.3	-165.5	178.4	3.6	109.7

Retrieved 853 of 853 residues in 4954.3 ms (Link to these results)

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