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Cleavage and polyadenylation specificity factor subunit 6

Component of the cleavage factor Im (CFIm) complex that functions as an activator of the pre-mRNA 3'-end cleavage and polyadenylation processing required for the maturation of pre-mRNA into functional mRNAs^1,2,3,4. CFIm contributes to the recruitment of multiprotein complexes on specific sequences on the pre-mRNA 3'-end, so called cleavage and polyadenylation signals (pA signals)^5,6,7. Most pre-mRNAs contain multiple pA signals, resulting in alternative cleavage and polyadenylation (APA) producing mRNAs with variable 3'-end formation^8,9. The CFIm complex acts as a key regulator of cleavage and polyadenylation site choice during APA through its binding to 5'-UGUA-3' elements localized in the 3'-untranslated region (UTR) for a huge number of pre-mRNAs^10,11. CPSF6 enhances NUDT21/CPSF5 binding to 5'-UGUA-3' elements localized upstream of pA signals and promotes RNA looping, and hence activates directly the mRNA 3'-processing machinery^12,13,14. Plays a role in mRNA export¹⁵. (Microbial infection) Binds HIV-1 capsid-nucleocapsid (HIV-1 CA-NC) complexes and might thereby promote the integration of the virus in the nucleus of dividing cells (in vitro).

AlphaFold DB , UniProt , Accession Q16630, Species HUMAN (Homo sapiens, Human), Gene CPSF6, Length 551 aa.

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(Predicted Aligned Error values between residue pairs)

Download Structure PDB PAE Table

Site	Residue	pLDDT	pLDDT confidence	pLDDT₁₀	pLDDT10 confidence	SASA	SASA [Å²]	SASA₁₀	SASA10 [Å²]	RSA	RSA unformatted	RSA₁₀	RSA10 unformatted	Surface	Surface10 (not used)	Disorder (not used)	Disorder	Sec. str.	Secondary structure	Isomer	Phi (φ)	Psi (ψ)	Omega (ω)	Chi 1 (χ₁)	Chi 2 (χ₂)	Chi 3 (χ₃)	Chi 4 (χ₄)	Chi 5 (χ₅)	Tau (τ)	Contacts (colored by PAE)	Contact details
1	M	44.4	Very low	57.4	Low	249 Å²	249	140.5 Å²	140.5	100%	1.227	77%	0.772	S	S	*	*				0	91.8	0	-73.8	114.3	171.9	0	0	107
2	A	44.2	Very low	57.7	Low	92 Å²	92	136.3 Å²	136.3	76%	0.76	77%	0.77	S	S	*	*			trans	-158.3	148.2	-173.3	0	0	0	0	0	110.8
3	D	51.7	Low	58	Low	143 Å²	143	137.9 Å²	137.9	77%	0.765	78%	0.776	S	S	*	*			trans	77.2	88.4	167.1	-76.2	-62.5	0	0	0	119.4	V5	D3-V5 HydrophobicContact CB-CG2 4.3Å; D3-V5 WeakPolarHBondContact OD1-CG2 3.3Å
4	G	48.3	Very low	58.2	Low	75 Å²	75	134.4 Å²	134.4	77%	0.773	76%	0.758	S	S	*	*			trans	-101.9	105.3	146	0	0	0	0	0	108.3
5	V	62.7	Low	58.2	Low	109 Å²	109	130.2 Å²	130.2	66%	0.661	76%	0.757	S	S	*	*			trans	-104.1	103.1	177.7	-175.9	0	0	0	0	107.4	D3 H7	D3-V5 HydrophobicContact CB-CG2 4.3Å; D3-V5 WeakPolarHBondContact OD1-CG2 3.3Å; V5-H7 PolarHBondContact O-N 3.42Å
6	D	60.4	Low	58.2	Low	149 Å²	149	134.1 Å²	134.1	80%	0.797	77%	0.766	S	S	*	*			trans	-66.8	121.4	178.4	-64.2	-41.1	0	0	0	110.7	I8	D6-I8 PolarHBondContact O-N 2.88Å
7	H	64.6	Low	58	Low	189 Å²	189	136.5 Å²	136.5	88%	0.875	77%	0.769	S	S	*	*			trans	-70.5	113.9	173.7	-83.6	-10.5	0	0	0	111	V5 D9	V5-H7 PolarHBondContact O-N 3.42Å; H7-D9 PolarHBondContact O-N 3.16Å
8	I	58.8	Low	57.6	Low	152 Å²	152	139.7 Å²	139.7	78%	0.779	77%	0.774	S	S	*	*			trans	-76.3	106.4	171.6	-62	157.3	0	0	0	107.9	D6 I10	D6-I8 PolarHBondContact O-N 2.88Å; I8-I10 WeakPolarHBondContact O-CG1 3.29Å; I8-I10 PolarHBondContact O-N 2.71Å
9	D	68.6	Low	57.2	Low	116 Å²	116	140.7 Å²	140.7	62%	0.62	78%	0.778	S	S	*	*			trans	-79	104.3	177.4	-162.1	-9.7	0	0	0	110.5	H7 Y11	H7-D9 PolarHBondContact O-N 3.16Å; D9-Y11 PolarHBondContact O-N 2.77Å; D9-Y11 PolarHBondContact OD1-N 2.68Å
10	I	65.2	Low	56.8	Low	145 Å²	145	141.3 Å²	141.3	74%	0.744	77%	0.774	S	S	*	*	T	Hydrogen-bonded Turn	trans	-76.8	2.8	-175	-25.3	177.8	0	0	0	111.5	I8	I8-I10 WeakPolarHBondContact O-CG1 3.29Å; I8-I10 PolarHBondContact O-N 2.71Å
11	Y	62.4	Low	56.3	Low	126 Å²	126	143.9 Å²	143.9	49%	0.494	78%	0.781	S	S	.	*	T	Hydrogen-bonded Turn	trans	-111.3	1.8	-173	-71.9	-82.4	0	0	0	115.1	D9 D13 V14	D9-Y11 PolarHBondContact O-N 2.77Å; D9-Y11 PolarHBondContact OD1-N 2.68Å; Y11-D13 VanDerWaalsContact C-N 3.29Å; Y11-D13 PolarHBondContact O-N 2.7Å; Y11-V14 HydrophobicContact CD1-CG2 4.05Å; Y11-V14 WeakPolarHBondContact O-CG2 3.48Å
12	A	60.9	Low	56.5	Low	90 Å²	90	137 Å²	137	74%	0.744	76%	0.764	S	S	*	*	T	Hydrogen-bonded Turn	trans	-71.4	-18.3	-177	0	0	0	0	0	114.8
13	D	61.4	Low	56.7	Low	158 Å²	158	140.9 Å²	140.9	85%	0.845	77%	0.766	S	S	*	*	T	Hydrogen-bonded Turn	trans	-116.8	8	-170.4	-132.3	-2.1	0	0	0	114.7	Y11	Y11-D13 VanDerWaalsContact C-N 3.29Å; Y11-D13 PolarHBondContact O-N 2.7Å
14	V	60.8	Low	56.2	Low	88 Å²	88	145.8 Å²	145.8	53%	0.533	78%	0.776	S	S	.	*	S	Bend	trans	-92	3.7	-179.6	-105	0	0	0	0	113.9	Y11	Y11-V14 HydrophobicContact CD1-CG2 4.05Å; Y11-V14 WeakPolarHBondContact O-CG2 3.48Å
15	G	59.1	Low	56	Low	72 Å²	72	146.1 Å²	146.1	74%	0.742	78%	0.779	S	S	*	*	S	Bend	trans	-86.7	-17.5	-173	0	0	0	0	0	116.5
16	E	57.2	Low	55	Low	192 Å²	192	144.7 Å²	144.7	90%	0.897	79%	0.787	S	S	*	*	S	Bend	trans	-110.7	-4.9	-171.8	-72.8	-139.9	151	0	0	116
17	E	54.6	Low	54.3	Low	176 Å²	176	145.5 Å²	145.5	82%	0.822	79%	0.785	S	S	*	*	S	Bend	trans	-97	-7.1	-178.6	-97.2	-168.8	154.2	0	0	115.9	N19	E17-N19 VanDerWaalsContact C-N 3.33Å; E17-N19 PolarHBondContact O-N 2.82Å
18	F	50.8	Low	53.6	Low	193 Å²	193	141.5 Å²	141.5	85%	0.846	77%	0.77	S	S	*	*	S	Bend	trans	-88.2	24	-171.8	-110.7	-87.6	0	0	0	116.1
19	N	51.1	Low	53.3	Low	159 Å²	159	143.1 Å²	143.1	85%	0.85	78%	0.775	S	S	*	*			trans	-127.7	34.5	-175.6	-149	10.2	0	0	0	114.4	E17	E17-N19 VanDerWaalsContact C-N 3.33Å; E17-N19 PolarHBondContact O-N 2.82Å
20	Q	48.2	Very low	52.6	Low	152 Å²	152	143.3 Å²	143.3	71%	0.71	77%	0.774	S	S	*	*			trans	-121.1	16.2	-176.9	-134.2	162.4	103	0	0	114.7	A22	Q20-A22 PolarHBondContact O-N 3.44Å
21	E	47.7	Very low	52.3	Low	197 Å²	197	142.5 Å²	142.5	92%	0.921	77%	0.771	S	S	*	*			trans	-102.8	71.9	179	-132.9	170.5	-172.8	0	0	110.7
22	A	48.1	Very low	52.5	Low	105 Å²	105	143.4 Å²	143.4	87%	0.868	78%	0.784	S	S	*	*			trans	-133.4	17	171.9	0	0	0	0	0	112.7	Q20	Q20-A22 PolarHBondContact O-N 3.44Å
23	E	47.7	Very low	52.4	Low	172 Å²	172	148.9 Å²	148.9	80%	0.804	79%	0.787	S	S	*	*			trans	-145.1	60.2	-171.7	-158.2	167.5	-169.4	0	0	111.5
24	Y	42.7	Very low	52.3	Low	246 Å²	246	148.4 Å²	148.4	97%	0.965	78%	0.784	S	S	*	*			trans	-149.2	65.2	159.3	-104.3	-85.2	0	0	0	108.2
25	G	42.8	Very low	52	Low	82 Å²	82	152.3 Å²	152.3	85%	0.845	80%	0.803	S	S	*	*			trans	-106.8	124	160.5	0	0	0	0	0	107.8
26	G	41.8	Very low	51.8	Low	79 Å²	79	154.2 Å²	154.2	81%	0.814	80%	0.8	S	S	*	*			trans	114.7	49.3	164.6	0	0	0	0	0	117.2
27	H	46.7	Very low	51.7	Low	166 Å²	166	152.5 Å²	152.5	77%	0.769	80%	0.795	S	S	*	*	S	Bend	trans	-139.9	122.1	148.1	-125.1	-38.2	0	0	0	109.8
28	D	49.5	Very low	51.3	Low	105 Å²	105	149.8 Å²	149.8	56%	0.561	80%	0.795	S	S	*	*			trans	82.1	66	152.9	-54.5	-30.5	0	0	0	117.9	I30	D28-I30 HydrophobicContact CB-CD1 3.56Å; D28-I30 HydrophobicContact CB-CG1 3.74Å; D28-I30 PolarHBondContact O-N 2.97Å; D28-I30 VanDerWaalsContact O-N 3.15Å
29	Q	51.2	Low	50.8	Low	187 Å²	187	146.5 Å²	146.5	87%	0.874	79%	0.793	S	S	*	*				-61	88.8	124.2	-90.5	-178.4	13.5	0	0	107.4
30	I	55.4	Low	50.4	Low	119 Å²	119	144.5 Å²	144.5	61%	0.61	79%	0.792	S	S	*	*			trans	-94.4	100.9	157.8	-63.5	152.7	0	0	0	103.7	D28 L32	D28-I30 HydrophobicContact CB-CD1 3.56Å; D28-I30 HydrophobicContact CB-CG1 3.74Å; D28-I30 PolarHBondContact O-N 2.97Å; D28-I30 VanDerWaalsContact O-N 3.15Å; I30-L32 PolarHBondContact O-N 3.32Å
31	D	58	Low	50.1	Low	128 Å²	128	141.7 Å²	141.7	68%	0.684	80%	0.795	S	S	*	*			trans	-58.8	106.4	174	-86	-42.4	0	0	0	108.8	Y33	D31-Y33 PolarHBondContact O-N 3.29Å; D31-Y33 VanDerWaalsContact O-N 3.09Å
32	L	65.9	Low	49.9	Very low	146 Å²	146	139 Å²	139	76%	0.764	79%	0.786	S	S	*	*	T	Hydrogen-bonded Turn	trans	-76.4	12.4	-176.7	-150.6	77.8	0	0	0	112.9	I30	I30-L32 PolarHBondContact O-N 3.32Å
33	Y	59.3	Low	49.5	Very low	204 Å²	204	140.8 Å²	140.8	80%	0.8	78%	0.782	S	S	*	*	T	Hydrogen-bonded Turn	trans	-129.3	23	-165.8	-79.1	-77.3	0	0	0	114.8	D31	D31-Y33 PolarHBondContact O-N 3.29Å; D31-Y33 VanDerWaalsContact O-N 3.09Å
34	D	58.9	Low	49.3	Very low	148 Å²	148	136 Å²	136	79%	0.791	78%	0.779	S	S	*	*	S	Bend	trans	-120	-0.1	175.7	-137.9	16.1	0	0	0	114.5	V36	D34-V36 VanDerWaalsContact C-N 3.3Å; D34-V36 PolarHBondContact O-N 2.99Å
35	D	56.1	Low	49.1	Very low	171 Å²	171	132.5 Å²	132.5	91%	0.914	78%	0.777	S	S	*	*			trans	-90.9	16.2	177	-82.8	-26	0	0	0	113.9
36	V	55.1	Low	49.3	Very low	112 Å²	112	132.5 Å²	132.5	68%	0.679	77%	0.769	S	S	*	*	S	Bend	trans	-103.7	107.2	173.7	-141.4	0	0	0	0	107.3	D34	D34-V36 VanDerWaalsContact C-N 3.3Å; D34-V36 PolarHBondContact O-N 2.99Å
37	I	54.7	Low	49.4	Very low	155 Å²	155	134.5 Å²	134.5	80%	0.795	77%	0.767	S	S	*	*			trans	116.1	83.7	176.3	-57.1	158.7	0	0	0	112.5
38	S	45.5	Very low	49.7	Very low	120 Å²	120	136 Å²	136	84%	0.839	78%	0.775	S	S	*	*			trans	-160.8	93.8	142.3	-82.8	0	0	0	0	109.9
39	P	41	Very low	49.5	Very low	123 Å²	123	138.1 Å²	138.1	80%	0.799	79%	0.786	S	S	*	*			trans	-87.3	114.2	163.7	32.1	-23.1	0	0	0	108.1
40	S	42.3	Very low	49.5	Very low	118 Å²	118	140.9 Å²	140.9	83%	0.825	79%	0.788	S	S	*	*			trans	-143.9	102.7	164.8	-137.2	0	0	0	0	112
41	A	42.2	Very low	48.8	Very low	93 Å²	93	142 Å²	142	77%	0.769	80%	0.796	S	S	*	*			trans	42.4	113.8	137.7	0	0	0	0	0	119.6
42	N	42.2	Very low	48.2	Very low	139 Å²	139	145.5 Å²	145.5	74%	0.743	80%	0.801	S	S	*	*				-170.2	126.3	113.3	-130.7	-0.5	0	0	0	112.5
43	N	41.4	Very low	47	Very low	144 Å²	144	144.7 Å²	144.7	77%	0.77	79%	0.794	S	S	*	*			trans	59.4	121	152	-49.1	-35.2	0	0	0	118.4
44	G	43.2	Very low	46.1	Very low	72 Å²	72	141.5 Å²	141.5	74%	0.742	79%	0.791	S	S	*	*			cis	165.8	156.7	8.8	0	0	0	0	0	108.2
45	D	38.2	Very low	45.3	Very low	172 Å²	172	140.8 Å²	140.8	92%	0.92	79%	0.792	S	S	*	*			trans	69.2	127.6	166.5	-121.6	49	0	0	0	117.3
46	A	46.9	Very low	44.8	Very low	82 Å²	82	140.2 Å²	140.2	68%	0.678	79%	0.789	S	S	*	*			cis	-159.9	165.4	4	0	0	0	0	0	107.9
47	P	44.8	Very low	44.4	Very low	121 Å²	121	140.2 Å²	140.2	79%	0.786	79%	0.791	S	S	*	*			trans	-100.7	136.8	-167.9	35.4	-26.5	0	0	0	113.1
48	E	52.7	Low	44.1	Very low	198 Å²	198	138.3 Å²	138.3	93%	0.925	79%	0.789	S	S	*	*			trans	-130.7	110.4	159.4	-72.7	-163	139.7	0	0	111.5
49	D	43.9	Very low	43.7	Very low	148 Å²	148	139.1 Å²	139.1	79%	0.791	79%	0.788	S	S	*	*			trans	-40	124.8	161	-155.7	42.6	0	0	0	113.5
50	R	51.7	Low	44.1	Very low	246 Å²	246	140.4 Å²	140.4	93%	0.928	79%	0.794	S	S	*	*			trans	-168.5	83.2	153.3	-113.2	173.6	-175.9	134.8	0.6	111.5
51	D	42	Very low	44	Very low	143 Å²	143	138.2 Å²	138.2	77%	0.765	79%	0.79	S	S	*	*			trans	-64.9	161	150	-68.1	-47.6	0	0	0	110.5
52	Y	43.3	Very low	43.9	Very low	201 Å²	201	141.3 Å²	141.3	79%	0.788	79%	0.794	S	S	*	*			trans	106	105	147.7	-145.5	-104.1	0	0	0	119.2
53	M	42.6	Very low	44	Very low	128 Å²	128	142.5 Å²	142.5	63%	0.631	80%	0.8	S	S	*	*			trans	69.7	117	137.9	-64.6	-60.9	150.4	0	0	119.2
54	D	38.9	Very low	44.1	Very low	137 Å²	137	142.1 Å²	142.1	73%	0.733	80%	0.802	S	S	*	*				76.7	101.1	91.7	-162.4	22.4	0	0	0	112.4
55	T	42.9	Very low	43.9	Very low	134 Å²	134	142 Å²	142	82%	0.822	80%	0.801	S	S	*	*			trans	-163.6	99.5	151.1	-11.8	0	0	0	0	110.5
56	L	46.2	Very low	43.9	Very low	159 Å²	159	144.3 Å²	144.3	83%	0.832	80%	0.803	S	S	*	*			trans	-77.5	151	143.1	-69.7	169.7	0	0	0	107.6
57	P	46.4	Very low	43.4	Very low	112 Å²	112	143.7 Å²	143.7	73%	0.727	81%	0.805	S	S	*	*				-162.5	-167.4	103.8	38.5	-16.9	0	0	0	114.3
58	P	48.8	Very low	43.1	Very low	115 Å²	115	142.9 Å²	142.9	75%	0.747	81%	0.808	S	S	*	*			cis	-129.5	175.9	-46.7	33.2	-14.9	0	0	0	113.5
59	T	36.5	Very low	42.7	Very low	136 Å²	136	137.7 Å²	137.7	83%	0.834	80%	0.8	S	S	*	*			trans	-76	132.2	169.7	51	0	0	0	0	113.8
60	V	48.4	Very low	42.8	Very low	150 Å²	150	136 Å²	136	91%	0.909	80%	0.797	S	S	*	*			trans	-159.9	140.2	155.4	-78.8	0	0	0	0	105.2
61	G	41.6	Very low	42.2	Very low	73 Å²	73	131.6 Å²	131.6	75%	0.753	79%	0.792	S	S	*	*			cis	151.6	127.7	15.8	0	0	0	0	0	104.3
62	D	39.3	Very low	42.3	Very low	158 Å²	158	128.9 Å²	128.9	85%	0.845	78%	0.78	S	S	*	*			trans	-41.4	134.5	-178.4	-87.7	-97.3	0	0	0	115.6
63	D	43.7	Very low	42.4	Very low	163 Å²	163	124.9 Å²	124.9	87%	0.872	78%	0.776	S	S	*	*			trans	-160.1	146.9	131.8	-126.1	-57.4	0	0	0	113
64	V	44.2	Very low	42.7	Very low	136 Å²	136	122.5 Å²	122.5	82%	0.824	76%	0.761	S	S	*	*			trans	-81.1	128.2	-162.1	165	0	0	0	0	112.1
65	G	39.6	Very low	42.9	Very low	70 Å²	70	120.9 Å²	120.9	72%	0.722	76%	0.756	S	S	*	*			trans	-161	103.3	172.7	0	0	0	0	0	113.4	G67	G65-G67 PolarHBondContact O-N 2.92Å
66	K	38.4	Very low	43.2	Very low	220 Å²	220	120.4 Å²	120.4	96%	0.957	74%	0.74	S	S	*	*			trans	-47.5	119.3	172.4	-75.3	167.1	169.9	172.9	0	112
67	G	34.8	Very low	43.5	Very low	70 Å²	70	116.3 Å²	116.3	72%	0.722	72%	0.722	S	S	*	*			trans	-177.2	113.3	169.6	0	0	0	0	0	113.8	G65	G65-G67 PolarHBondContact O-N 2.92Å
68	A	39	Very low	44.1	Very low	103 Å²	103	113.9 Å²	113.9	85%	0.851	72%	0.717	S	S	*	*			trans	46.5	120.8	157.6	0	0	0	0	0	119.5
69	A	44.8	Very low	45	Very low	90 Å²	90	116.2 Å²	116.2	74%	0.744	72%	0.716	S	S	*	*			trans	-47.7	140.4	171.6	0	0	0	0	0	112.3	N71	A69-N71 PolarHBondContact O-N 2.8Å; A69-N71 VanDerWaalsContact O-N 3.1Å
70	P	45.6	Very low	47.3	Very low	112 Å²	112	119.1 Å²	119.1	73%	0.727	71%	0.712	S	S	*	*			trans	-62.4	119.4	176.7	26.8	-32.8	0	0	0	108.4	V72	P70-V72 HydrophobicContact CB-CG2 4.42Å; P70-V72 HydrophobicContact CG-CG2 4.48Å; P70-V72 PolarHBondContact O-N 3.04Å
71	N	38.8	Very low	49.2	Very low	154 Å²	154	114 Å²	114	82%	0.824	68%	0.678	S	S	*	*			trans	-70.3	83.3	172.1	-149.8	-13.2	0	0	0	107.1	A69 V73	A69-N71 PolarHBondContact O-N 2.8Å; A69-N71 VanDerWaalsContact O-N 3.1Å; N71-V73 PolarHBondContact O-N 3.05Å
72	V	45.6	Very low	51.6	Low	85 Å²	85	112.1 Å²	112.1	52%	0.515	66%	0.656	S	S	.	*			trans	-69.5	97.6	176.8	178.4	0	0	0	0	107.1	P70 Y74	P70-V72 HydrophobicContact CB-CG2 4.42Å; P70-V72 HydrophobicContact CG-CG2 4.48Å; P70-V72 PolarHBondContact O-N 3.04Å; V72-Y74 HydrophobicContact CB-CE2 4.34Å; V72-Y74 HydrophobicContact CG1-CD2 4.36Å; V72-Y74 HydrophobicContact CG1-CE1 4.45Å; V72-Y74 HydrophobicContact CG1-CE2 4.05Å; V72-Y74 WeakPolarHBondContact O-CD2 3.45Å; V72-Y74 PolarHBondContact O-N 3.23Å; V72-Y74 VanDerWaalsContact O-N 3.11Å
73	V	43.7	Very low	54.2	Low	117 Å²	117	104.7 Å²	104.7	71%	0.709	62%	0.616	S	S	*	*			trans	-68.6	105.3	169.9	178.2	0	0	0	0	107.2	N71 T75	N71-V73 PolarHBondContact O-N 3.05Å; V73-T75 PolarHBondContact O-N 2.96Å; V73-T75 VanDerWaalsContact O-N 3.14Å
74	Y	49.3	Very low	56.6	Low	78 Å²	78	98 Å²	98	31%	0.306	58%	0.579	S	S	.	*			trans	-69.8	105.8	171.7	-73.4	-87.2	0	0	0	108.7	V72 Y76 G105 N107	V72-Y74 HydrophobicContact CB-CE2 4.34Å; V72-Y74 HydrophobicContact CG1-CD2 4.36Å; V72-Y74 HydrophobicContact CG1-CE1 4.45Å; V72-Y74 HydrophobicContact CG1-CE2 4.05Å; V72-Y74 WeakPolarHBondContact O-CD2 3.45Å; V72-Y74 PolarHBondContact O-N 3.23Å; V72-Y74 VanDerWaalsContact O-N 3.11Å; Y74-Y76 PolarHBondContact O-N 3.49Å; Y74-G105 PolarHBondContact OH-O 3.01Å; Y74-N107 HydrophobicContact CE2-CB 4.29Å
75	T	42.9	Very low	59	Low	104 Å²	104	91.5 Å²	91.5	64%	0.638	54%	0.539	S	S	*	.			trans	-72.7	108.4	173.3	54.2	0	0	0	0	108.7	V73 T77	V73-T75 PolarHBondContact O-N 2.96Å; V73-T75 VanDerWaalsContact O-N 3.14Å; T75-T77 PolarHBondContact O-N 2.98Å
76	Y	48.8	Very low	61.6	Low	123 Å²	123	88.2 Å²	88.2	48%	0.482	51%	0.505	S	S	.	.			trans	-66.6	100.6	168.5	-169.5	-104.3	0	0	0	108.3	Y74 G78 L110 G132	Y74-Y76 PolarHBondContact O-N 3.49Å; Y76-G78 PolarHBondContact O-N 2.91Å; Y76-L110 HydrophobicContact CD2-CD2 4.18Å; Y76-L110 HydrophobicContact CE2-CD1 3.56Å; Y76-L110 HydrophobicContact CE2-CD2 3.43Å; Y76-L110 VanDerWaalsContact CE2-CD2 3.43Å; Y76-L110 HydrophobicContact CE2-CG 3.98Å; Y76-L110 WeakPolarHBondContact OH-CD1 3.48Å; Y76-G132 VanDerWaalsContact CD2-CA 3.5Å
77	T	54.1	Low	64.3	Low	73 Å²	73	79.6 Å²	79.6	45%	0.448	47%	0.47	S	S	.	.			trans	-70.7	122.6	161	67.3	0	0	0	0	104.4	T75 K79	T75-T77 PolarHBondContact O-N 2.98Å; T77-K79 PolarHBondContact O-N 2.99Å
78	G	58	Low	67	Low	62 Å²	62	76.7 Å²	76.7	64%	0.639	44%	0.437	S	S	*	.	S	Bend	trans	-52.3	-0.3	-173	0	0	0	0	0	117.8	Y76 R80	Y76-G78 PolarHBondContact O-N 2.91Å; G78-R80 PolarHBondContact O-N 3.15Å
79	K	67.8	Low	69.6	Low	164 Å²	164	72.4 Å²	72.4	71%	0.713	40%	0.401	S	S	*	.			trans	-81.8	99.8	172.9	-59.8	179.5	-177.8	177.6	0	110	T77 I81	T77-K79 PolarHBondContact O-N 2.99Å; K79-I81 PolarHBondContact O-N 2.72Å
80	R	84.2	Confident	72	Confident	197 Å²	197	74.5 Å²	74.5	74%	0.743	39%	0.389	S	S	*	.			trans	-61.2	127.7	164.8	67.2	-174.8	179.8	-155.6	-3.7	109.6	G78 L110	G78-R80 PolarHBondContact O-N 3.15Å; R80-L110 HydrophobicContact CB-CD1 3.83Å
81	I	88.5	Confident	74.3	Confident	42 Å²	42	75.2 Å²	75.2	22%	0.215	38%	0.378	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-107.1	122.4	172.3	-60.5	119.5	0	0	0	107.4	K79 L83 G130 V131 E134	K79-I81 PolarHBondContact O-N 2.72Å; I81-L83 HydrophobicContact CG2-CD2 4.49Å; I81-G130 CarbonylContact O-C 3.57Å; I81-G130 WeakPolarHBondContact O-CA 3.15Å; I81-V131 HydrophobicContact CB-CG2 4.06Å; I81-V131 HydrophobicContact CG2-CG2 4.45Å; I81-V131 PolarHBondContact N-O 3.34Å; I81-V131 WeakPolarHBondContact O-CG2 3.38Å; I81-V131 PolarHBondContact O-N 3.43Å; I81-E134 HydrophobicContact CD1-CB 4.02Å
82	A	91.7	Very high	76.9	Confident	33 Å²	33	68.2 Å²	68.2	27%	0.273	34%	0.34	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-103	139.8	177.9	0	0	0	0	0	110.4	L128 V129 C159	A82-L128 HydrophobicContact CB-CD1 4.38Å; A82-L128 HydrophobicContact CB-CD2 4.17Å; A82-L128 HydrophobicContact CB-CG 4.27Å; A82-V129 WeakPolarHBondContact CA-O 3.45Å; A82-C159 HydrophobicContact CB-CB 4.07Å; A82-C159 WeakPolarHBondContact CB-SG 3.23Å; A82-C159 VanDerWaalsContact O-CB 3.23Å; A82-C159 WeakPolarHBondContact O-CB 3.21Å; A82-C159 PolarHBondContact O-N 2.99Å; A82-C159 PolarHBondContact O-SG 2.91Å
83	L	93.9	Very high	79.2	Confident	2 Å²	2	66.8 Å²	66.8	1%	0.01	33%	0.332	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-126.8	150.1	175.4	-59	178.5	0	0	0	110.1	I81 L128 V129 L140 M141 V156 C159	I81-L83 HydrophobicContact CG2-CD2 4.49Å; L83-L128 CarbonylContact O-C 3.58Å; L83-L128 WeakPolarHBondContact O-CA 3.12Å; L83-V129 PolarHBondContact N-O 2.94Å; L83-V129 PolarHBondContact O-N 3.43Å; L83-L140 HydrophobicContact CD1-CB 4.06Å; L83-L140 HydrophobicContact CD1-CD1 4.13Å; L83-M141 HydrophobicContact CD2-CE 3.77Å; L83-V156 HydrophobicContact CB-CG1 4.38Å; L83-V156 HydrophobicContact CD1-CG1 4.02Å; L83-C159 PolarHBondContact N-SG 3.48Å; L83-C159 VanDerWaalsContact N-SG 3.42Å
84	Y	95.6	Very high	81.5	Confident	23 Å²	23	66 Å²	66	9%	0.09	32%	0.324	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-96.9	128.7	166.6	-70.6	-63.4	0	0	0	109.8	F115 A127 L128 V156 T157 C159 F163 L164	Y84-F115 HydrophobicContact CD1-CE2 4.24Å; Y84-F115 AromaticContact CE1-CE2 3.67Å; Y84-F115 HydrophobicContact CE1-CE2 3.67Å; Y84-F115 AromaticContact CE1-CZ 3.81Å; Y84-F115 HydrophobicContact CE1-CZ 3.81Å; Y84-A127 WeakPolarHBondContact CA-O 3.47Å; Y84-L128 HydrophobicContact CD1-CB 4.09Å; Y84-L128 HydrophobicContact CE1-CB 3.97Å; Y84-L128 HydrophobicContact CE1-CD1 3.93Å; Y84-L128 HydrophobicContact CE1-CG 4.34Å; Y84-V156 CarbonylContact O-C 3.57Å; Y84-V156 WeakPolarHBondContact O-CA 3.39Å; Y84-T157 PolarHBondContact N-O 2.86Å; Y84-T157 PolarHBondContact O-N 3.42Å; Y84-T157 PolarHBondContact O-OG1 3.29Å; Y84-C159 HydrophobicContact CD2-CB 4.41Å; Y84-C159 HydrophobicContact CE2-CB 4.16Å; Y84-F163 HydrophobicContact CD2-CB 4.49Å; Y84-L164 HydrophobicContact CE1-CD1 4.12Å; Y84-L164 HydrophobicContact CE2-CB 4.04Å
85	I	94.6	Very high	83.6	Confident	0 Å²	0	68.4 Å²	68.4	0%	0	34%	0.338	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-114	113.8	171.9	-53.2	-179.9	0	0	0	107.2	L88 L97 F126 A127 V129 L144 P154 V155 V156	I85-L88 HydrophobicContact CG2-CD1 4.21Å; I85-L88 HydrophobicContact CG2-CD2 4.23Å; I85-L88 HydrophobicContact CG2-CG 4.42Å; I85-L97 HydrophobicContact CD1-CD1 3.99Å; I85-L97 HydrophobicContact CD1-CD2 4.43Å; I85-L97 HydrophobicContact CG2-CD1 4.17Å; I85-F126 CarbonylContact O-C 3.58Å; I85-F126 WeakPolarHBondContact O-CA 3.39Å; I85-F126 WeakPolarHBondContact O-CB 3.49Å; I85-A127 PolarHBondContact N-O 2.83Å; I85-A127 PolarHBondContact O-N 3.36Å; I85-V129 HydrophobicContact CD1-CB 4.07Å; I85-V129 HydrophobicContact CD1-CG2 3.52Å; I85-V129 HydrophobicContact CG1-CG2 4.1Å; I85-L144 HydrophobicContact CD1-CD1 3.59Å; I85-L144 HydrophobicContact CG1-CD1 4.4Å; I85-P154 HydrophobicContact CG2-CB 3.93Å; I85-V155 CarbonylContact C-O 3.56Å; I85-V155 WeakPolarHBondContact CA-O 3.45Å; I85-V156 HydrophobicContact CG1-CG1 4.45Å; I85-V156 HydrophobicContact CG1-CG2 4.21Å; I85-V156 HydrophobicContact CG2-CG2 4.43Å
86	G	93.9	Very high	86	Confident	0 Å²	0	65.5 Å²	65.5	0%	0	32%	0.319	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-121.9	-168.1	178.7	0	0	0	0	0	113.3	L88 G125 V155	G86-L88 PolarHBondContact O-N 3.1Å; G86-G125 CarbonylContact C-O 3.53Å; G86-G125 WeakPolarHBondContact CA-O 3.32Å; G86-V155 PolarHBondContact N-O 2.9Å; G86-V155 PolarHBondContact O-N 3.4Å
87	N	93.9	Very high	88.1	Confident	40 Å²	40	59.7 Å²	59.7	21%	0.214	30%	0.296	C	S	.	.	S	Bend	trans	58	33.7	-169.8	-160	54.7	0	0	0	113.1	G125 Q152 N153 V155 Q170	N87-G125 PolarHBondContact N-O 2.98Å; N87-Q152 PolarHBondContact ND2-OE1 3.44Å; N87-Q152 VanDerWaalsContact O-CB 3.3Å; N87-Q152 WeakPolarHBondContact O-CB 3.37Å; N87-N153 PolarHBondContact ND2-O 3.43Å; N87-V155 HydrophobicContact CB-CB 4.33Å; N87-V155 HydrophobicContact CB-CG2 3.75Å; N87-Q170 PolarHBondContact OD1-NE2 3.47Å
88	L	93.4	Very high	90	Very high	8 Å²	8	57.9 Å²	57.9	4%	0.042	29%	0.285	C	S	.	.			trans	-92.2	154.8	174.5	-54.9	178.8	0	0	0	109.8	I85 G86 T92 L97 F114 G125 L149 P154	I85-L88 HydrophobicContact CG2-CD1 4.21Å; I85-L88 HydrophobicContact CG2-CD2 4.23Å; I85-L88 HydrophobicContact CG2-CG 4.42Å; G86-L88 PolarHBondContact O-N 3.1Å; L88-T92 HydrophobicContact CB-CG2 4.35Å; L88-T92 HydrophobicContact CD1-CG2 4.38Å; L88-T92 HydrophobicContact CD2-CG2 4.44Å; L88-L97 HydrophobicContact CD1-CD1 4.4Å; L88-L97 HydrophobicContact CD1-CD2 4.4Å; L88-F114 HydrophobicContact CD1-CE1 4.25Å; L88-G125 PolarHBondContact N-O 3.09Å; L88-G125 WeakPolarHBondContact O-CA 3.5Å; L88-L149 HydrophobicContact CD2-CD1 3.89Å; L88-P154 HydrophobicContact CD2-CB 4.07Å; L88-P154 HydrophobicContact CD2-CG 4.19Å
89	T	93.4	Very high	91.7	Very high	14 Å²	14	60.3 Å²	60.3	9%	0.086	28%	0.279	C	S	.	.			trans	-73.9	155.9	171.8	67	0	0	0	0	109.8	W91 T92 H150 Q152	T89-W91 VanDerWaalsContact CB-CE2 3.41Å; T89-W91 HydrophobicContact CG2-CH2 4.22Å; T89-W91 HydrophobicContact CG2-CZ2 3.57Å; T89-W91 PolarHBondContact O-N 3Å; T89-W91 VanDerWaalsContact OG1-CD1 3.22Å; T89-W91 VanDerWaalsContact OG1-CE2 3.31Å; T89-W91 PolarHBondContact OG1-NE1 3.17Å; T89-W91 VanDerWaalsContact OG1-NE1 3.09Å; T89-T92 PolarHBondContact N-OG1 3.15Å; T89-T92 WeakPolarHBondContact O-CB 3.48Å; T89-T92 PolarHBondContact O-N 3.43Å; T89-T92 PolarHBondContact O-OG1 3.11Å; T89-T92 PolarHBondContact OG1-N 3.09Å; T89-T92 PolarHBondContact OG1-OG1 2.66Å; T89-H150 HydrophobicContact CG2-CB 3.84Å; T89-Q152 HydrophobicContact CG2-CG 4Å
90	W	93.9	Very high	92.8	Very high	133 Å²	133	53 Å²	53	50%	0.504	25%	0.25	S	C	.	.	T	Hydrogen-bonded Turn	trans	-69.2	-12.1	178.9	58.2	-101.1	0	0	0	113.5	Q122 S123	W90-Q122 HydrophobicContact CB-CG 4Å; W90-Q122 HydrophobicContact CG-CG 4.34Å; W90-S123 WeakPolarHBondContact CB-O 3.24Å; W90-S123 WeakPolarHBondContact O-CB 3.42Å
91	W	93.8	Very high	93.2	Very high	128 Å²	128	43.7 Å²	43.7	49%	0.485	22%	0.215	S	C	.	.	T	Hydrogen-bonded Turn	trans	-102.2	5.6	172.6	60.6	80.6	0	0	0	113.1	T89 T93 H150	T89-W91 VanDerWaalsContact CB-CE2 3.41Å; T89-W91 HydrophobicContact CG2-CH2 4.22Å; T89-W91 HydrophobicContact CG2-CZ2 3.57Å; T89-W91 PolarHBondContact O-N 3Å; T89-W91 VanDerWaalsContact OG1-CD1 3.22Å; T89-W91 VanDerWaalsContact OG1-CE2 3.31Å; T89-W91 PolarHBondContact OG1-NE1 3.17Å; T89-W91 VanDerWaalsContact OG1-NE1 3.09Å; W91-T93 PolarHBondContact O-N 3.05Å; W91-H150 AromaticContact NE1-CG 3.7Å; W91-H150 AromaticContact NE1-ND1 3.98Å
92	T	93.1	Very high	93.4	Very high	6 Å²	6	46 Å²	46	4%	0.037	22%	0.224	C	C	.	.			trans	-68.2	121.8	170.3	-56.3	0	0	0	0	108	L88 T89 D96 H150	L88-T92 HydrophobicContact CB-CG2 4.35Å; L88-T92 HydrophobicContact CD1-CG2 4.38Å; L88-T92 HydrophobicContact CD2-CG2 4.44Å; T89-T92 PolarHBondContact N-OG1 3.15Å; T89-T92 WeakPolarHBondContact O-CB 3.48Å; T89-T92 PolarHBondContact O-N 3.43Å; T89-T92 PolarHBondContact O-OG1 3.11Å; T89-T92 PolarHBondContact OG1-N 3.09Å; T89-T92 PolarHBondContact OG1-OG1 2.66Å; T92-D96 HydrophobicContact CG2-CB 4.21Å; T92-H150 PolarHBondContact OG1-CD2 3.02Å
93	T	94	Very high	93.3	Very high	56 Å²	56	48.7 Å²	48.7	34%	0.344	24%	0.241	S	C	.	.			trans	-88	166.3	-179.3	65.2	0	0	0	0	111.5	W91 E95 D96 L97	W91-T93 PolarHBondContact O-N 3.05Å; T93-E95 VanDerWaalsContact C-N 3.25Å; T93-E95 PolarHBondContact OG1-N 3.18Å; T93-D96 PolarHBondContact N-OD2 2.86Å; T93-D96 VanDerWaalsContact N-OD2 3.08Å; T93-D96 PolarHBondContact OG1-N 3.12Å; T93-D96 PolarHBondContact OG1-OD2 3.19Å; T93-L97 PolarHBondContact O-N 3.11Å
94	D	92.5	Very high	93.1	Very high	100 Å²	100	49.6 Å²	49.6	54%	0.535	25%	0.246	S	C	.	.	H	α-helix	trans	-63	-33.4	167.7	57	-41.1	0	0	0	112	L97 T98 I112 F114	D94-L97 PolarHBondContact O-N 3.44Å; D94-T98 VanDerWaalsContact O-CB 3.24Å; D94-T98 WeakPolarHBondContact O-CB 3.48Å; D94-T98 PolarHBondContact O-N 3.28Å; D94-T98 PolarHBondContact O-OG1 3.5Å; D94-I112 HydrophobicContact CB-CG2 4.34Å; D94-F114 HydrophobicContact CB-CE2 3.78Å
95	E	94	Very high	92.8	Very high	129 Å²	129	49.9 Å²	49.9	60%	0.603	26%	0.256	S	S	*	.	H	α-helix	trans	-62.5	-51	173.6	-170.9	169.7	-156.9	0	0	111.4	T93 L97 T98 E99	T93-E95 VanDerWaalsContact C-N 3.25Å; T93-E95 PolarHBondContact OG1-N 3.18Å; E95-L97 VanDerWaalsContact C-N 3.27Å; E95-L97 PolarHBondContact O-N 3.5Å; E95-T98 WeakPolarHBondContact O-CB 3.16Å; E95-T98 PolarHBondContact O-N 2.97Å; E95-T98 VanDerWaalsContact O-N 3.09Å; E95-E99 WeakPolarHBondContact O-CG 3.31Å; E95-E99 PolarHBondContact O-N 3.4Å
96	D	93.1	Very high	92.5	Very high	43 Å²	43	49.9 Å²	49.9	23%	0.23	26%	0.256	C	S	.	.	H	α-helix	trans	-56.7	-43.1	177.4	-62.3	-34.6	0	0	0	111.5	T92 T93 A100 H150	T92-D96 HydrophobicContact CG2-CB 4.21Å; T93-D96 PolarHBondContact N-OD2 2.86Å; T93-D96 VanDerWaalsContact N-OD2 3.08Å; T93-D96 PolarHBondContact OG1-N 3.12Å; T93-D96 PolarHBondContact OG1-OD2 3.19Å; D96-A100 WeakPolarHBondContact O-CB 3.41Å; D96-A100 PolarHBondContact O-N 3.46Å; D96-H150 IonicContact OD2-CD2 2.72Å; D96-H150 IonicContact OD2-CE1 3.84Å; D96-H150 IonicContact OD2-NE2 3.54Å; D96-H150 PolarHBondContact OD2-NE2 3.41Å
97	L	92.5	Very high	92.3	Very high	0 Å²	0	54.6 Å²	54.6	0%	0	28%	0.281	C	S	.	.	H	α-helix	trans	-68.4	-39.8	179.7	-172.6	61.7	0	0	0	111.3	I85 L88 T93 D94 E95 A100 V101 I112 F114 A127 V129 L149	I85-L97 HydrophobicContact CD1-CD1 3.99Å; I85-L97 HydrophobicContact CD1-CD2 4.43Å; I85-L97 HydrophobicContact CG2-CD1 4.17Å; L88-L97 HydrophobicContact CD1-CD1 4.4Å; L88-L97 HydrophobicContact CD1-CD2 4.4Å; T93-L97 PolarHBondContact O-N 3.11Å; D94-L97 PolarHBondContact O-N 3.44Å; E95-L97 VanDerWaalsContact C-N 3.27Å; E95-L97 PolarHBondContact O-N 3.5Å; L97-A100 PolarHBondContact O-N 3.07Å; L97-V101 WeakPolarHBondContact O-CB 3.32Å; L97-V101 WeakPolarHBondContact O-CG2 3.38Å; L97-V101 PolarHBondContact O-N 2.89Å; L97-I112 HydrophobicContact CD2-CG2 4.03Å; L97-F114 HydrophobicContact CD2-CZ 4.28Å; L97-A127 HydrophobicContact CD2-CB 4.15Å; L97-V129 HydrophobicContact CD2-CG2 3.84Å; L97-L149 HydrophobicContact CD1-CD1 4.04Å
98	T	93.6	Very high	92.1	Very high	36 Å²	36	53.6 Å²	53.6	22%	0.221	28%	0.276	C	S	.	.	H	α-helix	trans	-64.7	-45.9	176.4	-61.1	0	0	0	0	111	D94 E95 A100 V101 H102 I109 I112	D94-T98 VanDerWaalsContact O-CB 3.24Å; D94-T98 WeakPolarHBondContact O-CB 3.48Å; D94-T98 PolarHBondContact O-N 3.28Å; D94-T98 PolarHBondContact O-OG1 3.5Å; E95-T98 WeakPolarHBondContact O-CB 3.16Å; E95-T98 PolarHBondContact O-N 2.97Å; E95-T98 VanDerWaalsContact O-N 3.09Å; T98-A100 VanDerWaalsContact C-N 3.32Å; T98-A100 PolarHBondContact O-N 3.19Å; T98-V101 PolarHBondContact O-N 3.46Å; T98-H102 WeakPolarHBondContact O-CB 3.41Å; T98-H102 VanDerWaalsContact O-CG 3.3Å; T98-H102 PolarHBondContact O-N 2.95Å; T98-I109 HydrophobicContact CG2-CD1 4Å; T98-I112 WeakPolarHBondContact OG1-CD1 3.2Å
99	E	93.4	Very high	92	Very high	112 Å²	112	55 Å²	55	52%	0.523	28%	0.283	S	S	.	.	H	α-helix	trans	-60.2	-42.2	175.9	-73.2	-171.6	172.5	0	0	111.8	E95 V101 H102 S103	E95-E99 WeakPolarHBondContact O-CG 3.31Å; E95-E99 PolarHBondContact O-N 3.4Å; E99-V101 VanDerWaalsContact C-N 3.35Å; E99-V101 PolarHBondContact O-N 3.31Å; E99-H102 PolarHBondContact O-N 3.46Å; E99-S103 VanDerWaalsContact O-CB 3.25Å; E99-S103 WeakPolarHBondContact O-CB 3.38Å; E99-S103 PolarHBondContact O-N 3.49Å; E99-S103 PolarHBondContact O-OG 3.43Å
100	A	92	Very high	91.9	Very high	11 Å²	11	58.3 Å²	58.3	9%	0.091	30%	0.299	C	S	.	.	H	α-helix	trans	-63	-41.4	176.7	0	0	0	0	0	112.1	D96 L97 T98 L104 L144 L149	D96-A100 WeakPolarHBondContact O-CB 3.41Å; D96-A100 PolarHBondContact O-N 3.46Å; L97-A100 PolarHBondContact O-N 3.07Å; T98-A100 VanDerWaalsContact C-N 3.32Å; T98-A100 PolarHBondContact O-N 3.19Å; A100-L104 WeakPolarHBondContact O-CG 3.42Å; A100-L104 PolarHBondContact O-N 3.3Å; A100-L144 HydrophobicContact CB-CD2 4.33Å; A100-L149 HydrophobicContact CB-CD1 4.22Å; A100-L149 HydrophobicContact CB-CD2 3.65Å; A100-L149 HydrophobicContact CB-CG 4.49Å
101	V	91.8	Very high	91.8	Very high	1 Å²	1	56.5 Å²	56.5	1%	0.006	30%	0.297	C	S	.	.	H	α-helix	trans	-69.2	-46.3	177.4	169.2	0	0	0	0	111.1	L97 T98 E99 S103 L104 V106 I109 L140 L144	L97-V101 WeakPolarHBondContact O-CB 3.32Å; L97-V101 WeakPolarHBondContact O-CG2 3.38Å; L97-V101 PolarHBondContact O-N 2.89Å; T98-V101 PolarHBondContact O-N 3.46Å; E99-V101 VanDerWaalsContact C-N 3.35Å; E99-V101 PolarHBondContact O-N 3.31Å; V101-S103 VanDerWaalsContact C-N 3.28Å; V101-S103 PolarHBondContact O-N 3.43Å; V101-L104 WeakPolarHBondContact O-CB 3.29Å; V101-L104 PolarHBondContact O-N 2.86Å; V101-V106 HydrophobicContact CG1-CB 3.66Å; V101-V106 HydrophobicContact CG1-CG1 3.48Å; V101-V106 VanDerWaalsContact CG1-CG1 3.48Å; V101-V106 PolarHBondContact O-N 3.2Å; V101-I109 HydrophobicContact CB-CD1 3.86Å; V101-I109 HydrophobicContact CG1-CD1 3.44Å; V101-I109 VanDerWaalsContact CG1-CD1 3.44Å; V101-I109 HydrophobicContact CG1-CG1 3.68Å; V101-L140 HydrophobicContact CB-CD2 4.34Å; V101-L140 HydrophobicContact CG1-CD2 4Å; V101-L140 HydrophobicContact CG2-CD2 3.89Å; V101-L144 HydrophobicContact CG2-CD1 4.36Å
102	H	92.5	Very high	91.8	Very high	91 Å²	91	52.5 Å²	52.5	42%	0.421	28%	0.284	S	S	.	.	H	α-helix	trans	-60.7	-37.6	176.1	-75.4	-174.5	0	0	0	111.8	T98 E99 L104 G105 V106	T98-H102 WeakPolarHBondContact O-CB 3.41Å; T98-H102 VanDerWaalsContact O-CG 3.3Å; T98-H102 PolarHBondContact O-N 2.95Å; E99-H102 PolarHBondContact O-N 3.46Å; H102-L104 PolarHBondContact O-N 3.42Å; H102-G105 WeakPolarHBondContact O-CA 3.45Å; H102-G105 PolarHBondContact O-N 2.95Å; H102-V106 PolarHBondContact CD2-O 3.14Å
103	S	90.6	Very high	91.8	Very high	90 Å²	90	58.4 Å²	58.4	63%	0.629	31%	0.309	S	S	*	.	T	Hydrogen-bonded Turn	trans	-64.4	-19.1	176.1	-64.2	0	0	0	0	113.8	E99 V101 G105	E99-S103 VanDerWaalsContact O-CB 3.25Å; E99-S103 WeakPolarHBondContact O-CB 3.38Å; E99-S103 PolarHBondContact O-N 3.49Å; E99-S103 PolarHBondContact O-OG 3.43Å; V101-S103 VanDerWaalsContact C-N 3.28Å; V101-S103 PolarHBondContact O-N 3.43Å; S103-G105 VanDerWaalsContact C-N 3.31Å
104	L	89.4	Confident	91.9	Very high	21 Å²	21	57.8 Å²	57.8	11%	0.11	30%	0.302	C	S	.	.	T	Hydrogen-bonded Turn	trans	-87.9	-1.1	172.4	-61.3	176.6	0	0	0	112.8	A100 V101 H102 L140 L143 L144 R147	A100-L104 WeakPolarHBondContact O-CG 3.42Å; A100-L104 PolarHBondContact O-N 3.3Å; V101-L104 WeakPolarHBondContact O-CB 3.29Å; V101-L104 PolarHBondContact O-N 2.86Å; H102-L104 PolarHBondContact O-N 3.42Å; L104-L140 HydrophobicContact CD1-CD2 4.01Å; L104-L143 HydrophobicContact CB-CD1 4.48Å; L104-L143 HydrophobicContact CD1-CB 3.87Å; L104-L143 HydrophobicContact CD2-CB 3.66Å; L104-L143 HydrophobicContact CD2-CD1 4.14Å; L104-L143 HydrophobicContact CD2-CG 4.49Å; L104-L143 HydrophobicContact CG-CB 4.3Å; L104-L144 HydrophobicContact CD1-CB 4.34Å; L104-L144 HydrophobicContact CD1-CD2 3.6Å; L104-L144 HydrophobicContact CD1-CG 3.56Å; L104-R147 HydrophobicContact CD2-CG 4.35Å
105	G	88.4	Confident	91.9	Very high	28 Å²	28	55.1 Å²	55.1	29%	0.289	29%	0.286	S	S	.	.	T	Hydrogen-bonded Turn	trans	75.2	39.5	-176.7	0	0	0	0	0	112.5	Y74 H102 S103 K139	Y74-G105 PolarHBondContact OH-O 3.01Å; H102-G105 WeakPolarHBondContact O-CA 3.45Å; H102-G105 PolarHBondContact O-N 2.95Å; S103-G105 VanDerWaalsContact C-N 3.31Å; G105-K139 PolarHBondContact O-NZ 3.15Å
106	V	89.4	Confident	92	Very high	0 Å²	0	54.4 Å²	54.4	0%	0	28%	0.282	C	S	.	.			trans	-115.1	111.4	173	169.2	0	0	0	0	107.3	V101 H102 D108 V131 K139 L140	V101-V106 HydrophobicContact CG1-CB 3.66Å; V101-V106 HydrophobicContact CG1-CG1 3.48Å; V101-V106 VanDerWaalsContact CG1-CG1 3.48Å; V101-V106 PolarHBondContact O-N 3.2Å; H102-V106 PolarHBondContact CD2-O 3.14Å; V106-D108 WeakPolarHBondContact CG1-OD1 3.09Å; V106-V131 HydrophobicContact CG1-CG1 4.45Å; V106-K139 HydrophobicContact CG2-CB 4.16Å; V106-K139 HydrophobicContact CG2-CD 4.14Å; V106-L140 HydrophobicContact CG2-CD2 4.22Å; V106-L140 HydrophobicContact CG2-CG 4.39Å
107	N	90	Very high	91.9	Very high	99 Å²	99	55.6 Å²	55.6	53%	0.529	29%	0.289	S	S	.	.			trans	-117.6	8.1	-173.9	-57.6	-13.9	0	0	0	112.5	Y74	Y74-N107 HydrophobicContact CE2-CB 4.29Å
108	D	89.8	Confident	91.8	Very high	20 Å²	20	65.2 Å²	65.2	11%	0.107	33%	0.325	C	S	.	.			trans	-107.8	36	-174	61.9	-55.9	0	0	0	112.1	V106 L110 V131 G132 S133 S136	V106-D108 WeakPolarHBondContact CG1-OD1 3.09Å; D108-L110 PolarHBondContact O-N 3.28Å; D108-V131 WeakPolarHBondContact O-CA 3.32Å; D108-G132 PolarHBondContact O-N 3.16Å; D108-G132 PolarHBondContact OD2-N 2.98Å; D108-G132 VanDerWaalsContact OD2-N 3.16Å; D108-S133 WeakPolarHBondContact OD2-CA 3.37Å; D108-S133 WeakPolarHBondContact OD2-CB 3.48Å; D108-S133 PolarHBondContact OD2-N 2.89Å; D108-S136 VanDerWaalsContact CG-OG 3.24Å; D108-S136 WeakPolarHBondContact OD1-CB 3.49Å; D108-S136 PolarHBondContact OD1-OG 3.25Å; D108-S136 WeakPolarHBondContact OD2-CB 3.44Å; D108-S136 PolarHBondContact OD2-OG 3.11Å
109	I	90.4	Very high	91.5	Very high	38 Å²	38	67.6 Å²	67.6	20%	0.195	35%	0.349	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-69.4	124.8	173.2	-52.3	173.2	0	0	0	108.6	T98 V101 I112 V129	T98-I109 HydrophobicContact CG2-CD1 4Å; V101-I109 HydrophobicContact CB-CD1 3.86Å; V101-I109 HydrophobicContact CG1-CD1 3.44Å; V101-I109 VanDerWaalsContact CG1-CD1 3.44Å; V101-I109 HydrophobicContact CG1-CG1 3.68Å; I109-I112 HydrophobicContact CG2-CD1 4.06Å; I109-I112 HydrophobicContact CG2-CG1 3.75Å; I109-V129 HydrophobicContact CG2-CG1 4.32Å
110	L	91	Very high	91.4	Very high	82 Å²	82	66.9 Å²	66.9	43%	0.429	35%	0.348	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-98.3	-45.8	179.2	-58.7	170	0	0	0	112.3	Y76 R80 D108 G130	Y76-L110 HydrophobicContact CD2-CD2 4.18Å; Y76-L110 HydrophobicContact CE2-CD1 3.56Å; Y76-L110 HydrophobicContact CE2-CD2 3.43Å; Y76-L110 VanDerWaalsContact CE2-CD2 3.43Å; Y76-L110 HydrophobicContact CE2-CG 3.98Å; Y76-L110 WeakPolarHBondContact OH-CD1 3.48Å; R80-L110 HydrophobicContact CB-CD1 3.83Å; D108-L110 PolarHBondContact O-N 3.28Å; L110-G130 PolarHBondContact N-O 3.27Å
111	E	91.5	Very high	91.4	Very high	95 Å²	95	68.3 Å²	68.3	44%	0.444	36%	0.364	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-147.3	143.1	-179.5	74.1	179.7	-145.8	0	0	110.6	L128 V129 G130	E111-L128 HydrophobicContact CG-CD2 4.13Å; E111-L128 WeakPolarHBondContact OE1-CD2 3.43Å; E111-V129 CarbonylContact O-C 3.59Å; E111-V129 WeakPolarHBondContact O-CA 3.37Å; E111-G130 PolarHBondContact N-O 3.38Å; E111-G130 PolarHBondContact O-N 2.86Å
112	I	94.1	Very high	91.4	Very high	45 Å²	45	71 Å²	71	23%	0.231	38%	0.376	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-122.7	125.3	165.7	-59.5	178.2	0	0	0	106.5	D94 L97 T98 I109 F114 A127 L128 V129	D94-I112 HydrophobicContact CB-CG2 4.34Å; L97-I112 HydrophobicContact CD2-CG2 4.03Å; T98-I112 WeakPolarHBondContact OG1-CD1 3.2Å; I109-I112 HydrophobicContact CG2-CD1 4.06Å; I109-I112 HydrophobicContact CG2-CG1 3.75Å; I112-F114 HydrophobicContact CG2-CD2 4.15Å; I112-F114 HydrophobicContact CG2-CE2 3.79Å; I112-A127 HydrophobicContact CG2-CB 4.45Å; I112-L128 CarbonylContact C-O 3.58Å; I112-L128 WeakPolarHBondContact CA-O 3.43Å; I112-V129 HydrophobicContact CG1-CG1 4.48Å; I112-V129 HydrophobicContact CG1-CG2 4.3Å; I112-V129 HydrophobicContact CG2-CG2 4.44Å
113	K	94.6	Very high	91.4	Very high	129 Å²	129	67.5 Å²	67.5	56%	0.561	36%	0.362	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-130.9	106.4	179.8	-176.5	176.2	-178	174.1	0	110.4	A127 L128	K113-A127 CarbonylContact O-C 3.48Å; K113-A127 VanDerWaalsContact O-CA 3.31Å; K113-A127 WeakPolarHBondContact O-CA 3.22Å; K113-L128 HydrophobicContact CB-CB 4.48Å; K113-L128 PolarHBondContact N-O 2.57Å; K113-L128 PolarHBondContact O-N 3.48Å
114	F	95	Very high	91.5	Very high	44 Å²	44	65.8 Å²	65.8	19%	0.193	34%	0.344	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-69.5	141.3	171.9	-77.9	-91.5	0	0	0	111.2	L88 D94 L97 I112 A127	L88-F114 HydrophobicContact CD1-CE1 4.25Å; D94-F114 HydrophobicContact CB-CE2 3.78Å; L97-F114 HydrophobicContact CD2-CZ 4.28Å; I112-F114 HydrophobicContact CG2-CD2 4.15Å; I112-F114 HydrophobicContact CG2-CE2 3.79Å; F114-A127 HydrophobicContact CD1-CB 3.88Å; F114-A127 HydrophobicContact CD2-CB 4.33Å; F114-A127 HydrophobicContact CE1-CB 3.98Å; F114-A127 HydrophobicContact CE2-CB 4.37Å; F114-A127 HydrophobicContact CG-CB 4.08Å; F114-A127 HydrophobicContact CZ-CB 4.23Å
115	F	93.7	Very high	91.7	Very high	43 Å²	43	65.2 Å²	65.2	19%	0.189	34%	0.343	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-89.5	119	165.7	-74.4	-103.3	0	0	0	107.4	Y84 K124 F126 L128 L164	Y84-F115 HydrophobicContact CD1-CE2 4.24Å; Y84-F115 AromaticContact CE1-CE2 3.67Å; Y84-F115 HydrophobicContact CE1-CE2 3.67Å; Y84-F115 AromaticContact CE1-CZ 3.81Å; Y84-F115 HydrophobicContact CE1-CZ 3.81Å; F115-K124 HydrophobicContact CB-CB 4.44Å; F115-K124 HydrophobicContact CB-CD 4.24Å; F115-K124 WeakPolarHBondContact O-CB 3.34Å; F115-K124 WeakPolarHBondContact O-CG 3.43Å; F115-K124 PolarHBondContact O-N 3.06Å; F115-F126 HydrophobicContact CB-CD1 4.31Å; F115-F126 HydrophobicContact CB-CD2 4.01Å; F115-F126 HydrophobicContact CB-CE1 3.83Å; F115-F126 HydrophobicContact CB-CE2 3.49Å; F115-F126 VanDerWaalsContact CB-CE2 3.49Å; F115-F126 HydrophobicContact CB-CG 4.4Å; F115-F126 HydrophobicContact CB-CZ 3.38Å; F115-F126 AromaticContact CD1-CE2 3.69Å; F115-F126 HydrophobicContact CD1-CE2 3.69Å; F115-F126 AromaticContact CD1-CZ 3.84Å; F115-F126 HydrophobicContact CD1-CZ 3.84Å; F115-F126 AromaticContact CD2-CD2 3.63Å; F115-F126 HydrophobicContact CD2-CD2 3.63Å; F115-F126 AromaticContact CD2-CE2 3.32Å; F115-F126 HydrophobicContact CD2-CE2 3.32Å; F115-F126 HydrophobicContact CD2-CZ 4.12Å; F115-F126 HydrophobicContact CE1-CE2 4.26Å; F115-F126 HydrophobicContact CE2-CD2 4.33Å; F115-F126 AromaticContact CE2-CE2 3.95Å; F115-F126 HydrophobicContact CE2-CE2 3.95Å; F115-F126 AromaticContact CG-CD2 3.88Å; F115-F126 HydrophobicContact CG-CD2 3.88Å; F115-F126 HydrophobicContact CG-CE1 4.42Å; F115-F126 AromaticContact CG-CE2 3.18Å; F115-F126 HydrophobicContact CG-CE2 3.18Å; F115-F126 AromaticContact CG-CZ 3.5Å; F115-F126 HydrophobicContact CG-CZ 3.5Å; F115-F126 HydrophobicContact CZ-CE2 4.38Å; F115-F126 PolarHBondContact N-O 3.12Å; F115-L128 HydrophobicContact CE2-CB 3.91Å; F115-L164 HydrophobicContact CD1-CD1 4.33Å; F115-L164 HydrophobicContact CE1-CD1 3.79Å; F115-L164 HydrophobicContact CZ-CD1 4.01Å
116	E	94.2	Very high	92	Very high	114 Å²	114	64 Å²	64	53%	0.533	33%	0.329	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-121.8	160.4	-176.4	63	-177.1	-167.8	0	0	111	R118 Q122 K124	E116-R118 PolarHBondContact O-N 3.41Å; E116-Q122 CarbonylContact C-O 3.53Å; E116-Q122 VanDerWaalsContact CA-O 3.28Å; E116-Q122 WeakPolarHBondContact CA-O 3.39Å; E116-K124 WeakPolarHBondContact O-CE 3.47Å
117	N	91.2	Very high	92.3	Very high	69 Å²	69	64 Å²	64	37%	0.369	33%	0.329	S	S	.	.			trans	-79.2	117.5	171.5	-178.2	20.4	0	0	0	109.7	A119 N120 G121 Q122	N117-A119 PolarHBondContact O-N 3.11Å; N117-N120 WeakPolarHBondContact CB-OD1 3.46Å; N117-N120 PolarHBondContact ND2-OD1 2.99Å; N117-N120 VanDerWaalsContact ND2-OD1 3.16Å; N117-N120 PolarHBondContact O-N 3.22Å; N117-G121 WeakPolarHBondContact O-CA 3.42Å; N117-G121 PolarHBondContact O-N 3.34Å; N117-Q122 PolarHBondContact N-O 3.42Å
118	R	90.3	Very high	92.5	Very high	202 Å²	202	60.3 Å²	60.3	76%	0.762	31%	0.31	S	S	*	.	T	Hydrogen-bonded Turn	trans	-58.1	-24.4	-176	-158.1	-174.9	-156.2	-179.8	4.4	113.9	E116	E116-R118 PolarHBondContact O-N 3.41Å
119	A	88.4	Confident	92.7	Very high	86 Å²	86	59.3 Å²	59.3	71%	0.711	31%	0.305	S	S	*	.	T	Hydrogen-bonded Turn	trans	-74	-34.5	-178.2	0	0	0	0	0	113.6	N117	N117-A119 PolarHBondContact O-N 3.11Å
120	N	90.8	Very high	92.9	Very high	97 Å²	97	57.7 Å²	57.7	52%	0.519	30%	0.297	S	S	.	.	T	Hydrogen-bonded Turn	trans	-136.5	1.4	-172.4	66.4	-6.1	0	0	0	114.5	N117 Q122	N117-N120 WeakPolarHBondContact CB-OD1 3.46Å; N117-N120 PolarHBondContact ND2-OD1 2.99Å; N117-N120 VanDerWaalsContact ND2-OD1 3.16Å; N117-N120 PolarHBondContact O-N 3.22Å; N120-Q122 PolarHBondContact O-N 3.22Å; N120-Q122 VanDerWaalsContact OD1-CB 3.28Å; N120-Q122 WeakPolarHBondContact OD1-CB 3.31Å; N120-Q122 PolarHBondContact OD1-N 3.09Å; N120-Q122 VanDerWaalsContact OD1-N 3.1Å
121	G	91.3	Very high	93	Very high	41 Å²	41	53.8 Å²	53.8	42%	0.423	28%	0.277	S	S	.	.			trans	68.2	9.9	-177.6	0	0	0	0	0	114.2	N117 S123	N117-G121 WeakPolarHBondContact O-CA 3.42Å; N117-G121 PolarHBondContact O-N 3.34Å; G121-S123 PolarHBondContact O-N 3.34Å
122	Q	91.8	Very high	92.8	Very high	56 Å²	56	49.3 Å²	49.3	26%	0.262	26%	0.256	S	S	.	.			trans	-71.4	129.4	-179.7	-172.7	179.4	29.7	0	0	110	W90 E116 N117 N120 K124	W90-Q122 HydrophobicContact CB-CG 4Å; W90-Q122 HydrophobicContact CG-CG 4.34Å; E116-Q122 CarbonylContact C-O 3.53Å; E116-Q122 VanDerWaalsContact CA-O 3.28Å; E116-Q122 WeakPolarHBondContact CA-O 3.39Å; N117-Q122 PolarHBondContact N-O 3.42Å; N120-Q122 PolarHBondContact O-N 3.22Å; N120-Q122 VanDerWaalsContact OD1-CB 3.28Å; N120-Q122 WeakPolarHBondContact OD1-CB 3.31Å; N120-Q122 PolarHBondContact OD1-N 3.09Å; N120-Q122 VanDerWaalsContact OD1-N 3.1Å; Q122-K124 PolarHBondContact O-N 3.25Å
123	S	93.5	Very high	92.5	Very high	18 Å²	18	48.1 Å²	48.1	13%	0.126	25%	0.252	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-58.1	133.1	173.3	173.4	0	0	0	0	111	W90 G121 G125	W90-S123 WeakPolarHBondContact CB-O 3.24Å; W90-S123 WeakPolarHBondContact O-CB 3.42Å; G121-S123 PolarHBondContact O-N 3.34Å; S123-G125 PolarHBondContact O-N 2.97Å; S123-G125 PolarHBondContact OG-N 3.22Å
124	K	93.6	Very high	92.2	Very high	54 Å²	54	49.1 Å²	49.1	24%	0.235	26%	0.258	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-75.4	-0.9	174.6	-65.8	-172.4	-175.3	-178.1	0	112.6	F115 E116 Q122 F126 E168 S171	F115-K124 HydrophobicContact CB-CB 4.44Å; F115-K124 HydrophobicContact CB-CD 4.24Å; F115-K124 WeakPolarHBondContact O-CB 3.34Å; F115-K124 WeakPolarHBondContact O-CG 3.43Å; F115-K124 PolarHBondContact O-N 3.06Å; E116-K124 WeakPolarHBondContact O-CE 3.47Å; Q122-K124 PolarHBondContact O-N 3.25Å; K124-F126 HydrophobicContact CB-CD1 3.79Å; K124-F126 HydrophobicContact CB-CE1 3.54Å; K124-F126 HydrophobicContact CD-CE1 3.88Å; K124-F126 HydrophobicContact CD-CZ 4.31Å; K124-F126 HydrophobicContact CG-CE1 4.38Å; K124-E168 IonicContact NZ-OE1 3.43Å; K124-E168 PolarHBondContact NZ-OE1 3.46Å; K124-E168 IonicContact NZ-OE2 2.7Å; K124-E168 PolarHBondContact NZ-OE2 2.83Å; K124-S171 WeakPolarHBondContact O-CB 3.43Å
125	G	92.7	Very high	91.9	Very high	9 Å²	9	50 Å²	50	9%	0.093	27%	0.273	C	S	.	.	E	Extended strand (participates in β ladder)	trans	81.2	20.4	-179.1	0	0	0	0	0	114.1	G86 N87 L88 S123	G86-G125 CarbonylContact C-O 3.53Å; G86-G125 WeakPolarHBondContact CA-O 3.32Å; N87-G125 PolarHBondContact N-O 2.98Å; L88-G125 PolarHBondContact N-O 3.09Å; L88-G125 WeakPolarHBondContact O-CA 3.5Å; S123-G125 PolarHBondContact O-N 2.97Å; S123-G125 PolarHBondContact OG-N 3.22Å
126	F	95	Very high	91.7	Very high	2 Å²	2	48 Å²	48	1%	0.009	27%	0.265	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-148.5	150.2	169.5	70.2	-81.1	0	0	0	111.9	I85 F115 K124 L164 F167 E168	I85-F126 CarbonylContact O-C 3.58Å; I85-F126 WeakPolarHBondContact O-CA 3.39Å; I85-F126 WeakPolarHBondContact O-CB 3.49Å; F115-F126 HydrophobicContact CB-CD1 4.31Å; F115-F126 HydrophobicContact CB-CD2 4.01Å; F115-F126 HydrophobicContact CB-CE1 3.83Å; F115-F126 HydrophobicContact CB-CE2 3.49Å; F115-F126 VanDerWaalsContact CB-CE2 3.49Å; F115-F126 HydrophobicContact CB-CG 4.4Å; F115-F126 HydrophobicContact CB-CZ 3.38Å; F115-F126 AromaticContact CD1-CE2 3.69Å; F115-F126 HydrophobicContact CD1-CE2 3.69Å; F115-F126 AromaticContact CD1-CZ 3.84Å; F115-F126 HydrophobicContact CD1-CZ 3.84Å; F115-F126 AromaticContact CD2-CD2 3.63Å; F115-F126 HydrophobicContact CD2-CD2 3.63Å; F115-F126 AromaticContact CD2-CE2 3.32Å; F115-F126 HydrophobicContact CD2-CE2 3.32Å; F115-F126 HydrophobicContact CD2-CZ 4.12Å; F115-F126 HydrophobicContact CE1-CE2 4.26Å; F115-F126 HydrophobicContact CE2-CD2 4.33Å; F115-F126 AromaticContact CE2-CE2 3.95Å; F115-F126 HydrophobicContact CE2-CE2 3.95Å; F115-F126 AromaticContact CG-CD2 3.88Å; F115-F126 HydrophobicContact CG-CD2 3.88Å; F115-F126 HydrophobicContact CG-CE1 4.42Å; F115-F126 AromaticContact CG-CE2 3.18Å; F115-F126 HydrophobicContact CG-CE2 3.18Å; F115-F126 AromaticContact CG-CZ 3.5Å; F115-F126 HydrophobicContact CG-CZ 3.5Å; F115-F126 HydrophobicContact CZ-CE2 4.38Å; F115-F126 PolarHBondContact N-O 3.12Å; K124-F126 HydrophobicContact CB-CD1 3.79Å; K124-F126 HydrophobicContact CB-CE1 3.54Å; K124-F126 HydrophobicContact CD-CE1 3.88Å; K124-F126 HydrophobicContact CD-CZ 4.31Å; K124-F126 HydrophobicContact CG-CE1 4.38Å; F126-L164 HydrophobicContact CE2-CD1 3.82Å; F126-L164 HydrophobicContact CZ-CD1 4.29Å; F126-F167 HydrophobicContact CB-CB 4.16Å; F126-F167 HydrophobicContact CB-CD1 4.33Å; F126-F167 HydrophobicContact CB-CG 4.15Å; F126-F167 HydrophobicContact CD1-CB 3.73Å; F126-F167 HydrophobicContact CD2-CB 3.81Å; F126-F167 HydrophobicContact CD2-CD2 4.46Å; F126-F167 HydrophobicContact CD2-CG 4.32Å; F126-F167 HydrophobicContact CE1-CB 3.98Å; F126-F167 HydrophobicContact CE2-CB 4.06Å; F126-F167 HydrophobicContact CG-CB 3.63Å; F126-F167 HydrophobicContact CG-CG 4.14Å; F126-F167 HydrophobicContact CZ-CB 4.15Å; F126-E168 HydrophobicContact CZ-CG 3.94Å
127	A	95	Very high	91.6	Very high	0 Å²	0	42.9 Å²	42.9	0%	0	24%	0.242	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-133.1	153.2	-178.6	0	0	0	0	0	110.9	Y84 I85 L97 I112 K113 F114	Y84-A127 WeakPolarHBondContact CA-O 3.47Å; I85-A127 PolarHBondContact N-O 2.83Å; I85-A127 PolarHBondContact O-N 3.36Å; L97-A127 HydrophobicContact CD2-CB 4.15Å; I112-A127 HydrophobicContact CG2-CB 4.45Å; K113-A127 CarbonylContact O-C 3.48Å; K113-A127 VanDerWaalsContact O-CA 3.31Å; K113-A127 WeakPolarHBondContact O-CA 3.22Å; F114-A127 HydrophobicContact CD1-CB 3.88Å; F114-A127 HydrophobicContact CD2-CB 4.33Å; F114-A127 HydrophobicContact CE1-CB 3.98Å; F114-A127 HydrophobicContact CE2-CB 4.37Å; F114-A127 HydrophobicContact CG-CB 4.08Å; F114-A127 HydrophobicContact CZ-CB 4.23Å
128	L	94.8	Very high	91.6	Very high	22 Å²	22	46.4 Å²	46.4	12%	0.115	25%	0.254	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-93.3	129.1	164.8	179.3	155.2	0	0	0	108.4	A82 L83 Y84 E111 I112 K113 F115	A82-L128 HydrophobicContact CB-CD1 4.38Å; A82-L128 HydrophobicContact CB-CD2 4.17Å; A82-L128 HydrophobicContact CB-CG 4.27Å; L83-L128 CarbonylContact O-C 3.58Å; L83-L128 WeakPolarHBondContact O-CA 3.12Å; Y84-L128 HydrophobicContact CD1-CB 4.09Å; Y84-L128 HydrophobicContact CE1-CB 3.97Å; Y84-L128 HydrophobicContact CE1-CD1 3.93Å; Y84-L128 HydrophobicContact CE1-CG 4.34Å; E111-L128 HydrophobicContact CG-CD2 4.13Å; E111-L128 WeakPolarHBondContact OE1-CD2 3.43Å; I112-L128 CarbonylContact C-O 3.58Å; I112-L128 WeakPolarHBondContact CA-O 3.43Å; K113-L128 HydrophobicContact CB-CB 4.48Å; K113-L128 PolarHBondContact N-O 2.57Å; K113-L128 PolarHBondContact O-N 3.48Å; F115-L128 HydrophobicContact CE2-CB 3.91Å
129	V	94.5	Very high	91.7	Very high	0 Å²	0	40.5 Å²	40.5	0%	0	23%	0.234	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-118.6	120.1	176.2	179.8	0	0	0	0	108.8	A82 L83 I85 L97 I109 E111 I112 V131	A82-V129 WeakPolarHBondContact CA-O 3.45Å; L83-V129 PolarHBondContact N-O 2.94Å; L83-V129 PolarHBondContact O-N 3.43Å; I85-V129 HydrophobicContact CD1-CB 4.07Å; I85-V129 HydrophobicContact CD1-CG2 3.52Å; I85-V129 HydrophobicContact CG1-CG2 4.1Å; L97-V129 HydrophobicContact CD2-CG2 3.84Å; I109-V129 HydrophobicContact CG2-CG1 4.32Å; E111-V129 CarbonylContact O-C 3.59Å; E111-V129 WeakPolarHBondContact O-CA 3.37Å; I112-V129 HydrophobicContact CG1-CG1 4.48Å; I112-V129 HydrophobicContact CG1-CG2 4.3Å; I112-V129 HydrophobicContact CG2-CG2 4.44Å; V129-V131 HydrophobicContact CG1-CG1 4.26Å
130	G	93.3	Very high	91.8	Very high	4 Å²	4	36.4 Å²	36.4	4%	0.041	20%	0.2	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-93.3	127	172.8	0	0	0	0	0	110.8	I81 L110 E111	I81-G130 CarbonylContact O-C 3.57Å; I81-G130 WeakPolarHBondContact O-CA 3.15Å; L110-G130 PolarHBondContact N-O 3.27Å; E111-G130 PolarHBondContact N-O 3.38Å; E111-G130 PolarHBondContact O-N 2.86Å
131	V	93	Very high	91.9	Very high	0 Å²	0	35 Å²	35	0%	0	19%	0.191	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-119.2	151	174.9	-63	0	0	0	0	111	I81 V106 D108 V129 L140	I81-V131 HydrophobicContact CB-CG2 4.06Å; I81-V131 HydrophobicContact CG2-CG2 4.45Å; I81-V131 PolarHBondContact N-O 3.34Å; I81-V131 WeakPolarHBondContact O-CG2 3.38Å; I81-V131 PolarHBondContact O-N 3.43Å; V106-V131 HydrophobicContact CG1-CG1 4.45Å; D108-V131 WeakPolarHBondContact O-CA 3.32Å; V129-V131 HydrophobicContact CG1-CG1 4.26Å; V131-L140 HydrophobicContact CG1-CD1 3.87Å
132	G	88.1	Confident	91.9	Very high	0 Å²	0	37.2 Å²	37.2	0%	0	19%	0.193	C	C	.	.	S	Bend	trans	-87.8	-16.3	-178.7	0	0	0	0	0	115.6	Y76 D108	Y76-G132 VanDerWaalsContact CD2-CA 3.5Å; D108-G132 PolarHBondContact O-N 3.16Å; D108-G132 PolarHBondContact OD2-N 2.98Å; D108-G132 VanDerWaalsContact OD2-N 3.16Å
133	S	87.9	Confident	91.9	Very high	21 Å²	21	37.8 Å²	37.8	15%	0.147	20%	0.197	C	C	.	.			trans	-121.2	133.6	-176.8	-176.8	0	0	0	0	111.6	D108 A135 S136 S137	D108-S133 WeakPolarHBondContact OD2-CA 3.37Å; D108-S133 WeakPolarHBondContact OD2-CB 3.48Å; D108-S133 PolarHBondContact OD2-N 2.89Å; S133-A135 PolarHBondContact O-N 3.05Å; S133-A135 PolarHBondContact OG-N 3.13Å; S133-S136 WeakPolarHBondContact O-CB 3.12Å; S133-S136 PolarHBondContact O-N 3.06Å; S133-S137 PolarHBondContact O-N 3.22Å; S133-S137 VanDerWaalsContact O-N 3.11Å
134	E	88.4	Confident	91.6	Very high	150 Å²	150	36.9 Å²	36.9	70%	0.701	19%	0.191	S	C	*	.	H	α-helix	trans	-63.4	-33.9	172.5	-172.2	177.3	177.3	0	0	111.7	I81 S136 S137 K138	I81-E134 HydrophobicContact CD1-CB 4.02Å; E134-S136 VanDerWaalsContact C-N 3.3Å; E134-S136 PolarHBondContact O-N 3.04Å; E134-S137 WeakPolarHBondContact O-CB 3.44Å; E134-S137 PolarHBondContact O-N 3.02Å; E134-K138 PolarHBondContact O-N 3.19Å
135	A	89.4	Confident	91.5	Very high	61 Å²	61	36.8 Å²	36.8	50%	0.504	20%	0.196	S	C	.	.	H	α-helix	trans	-62.5	-39.4	175.7	0	0	0	0	0	111.6	S133 K138 K139	S133-A135 PolarHBondContact O-N 3.05Å; S133-A135 PolarHBondContact OG-N 3.13Å; A135-K138 PolarHBondContact O-N 3.42Å; A135-K139 WeakPolarHBondContact O-CG 3.38Å; A135-K139 PolarHBondContact O-N 3.39Å; A135-K139 VanDerWaalsContact O-N 3.09Å
136	S	89.4	Confident	91.3	Very high	1 Å²	1	44 Å²	44	1%	0.007	23%	0.225	C	C	.	.	H	α-helix	trans	-67	-43.2	175.8	-66.7	0	0	0	0	111.9	D108 S133 E134 K138 K139 L140	D108-S136 VanDerWaalsContact CG-OG 3.24Å; D108-S136 WeakPolarHBondContact OD1-CB 3.49Å; D108-S136 PolarHBondContact OD1-OG 3.25Å; D108-S136 WeakPolarHBondContact OD2-CB 3.44Å; D108-S136 PolarHBondContact OD2-OG 3.11Å; S133-S136 WeakPolarHBondContact O-CB 3.12Å; S133-S136 PolarHBondContact O-N 3.06Å; E134-S136 VanDerWaalsContact C-N 3.3Å; E134-S136 PolarHBondContact O-N 3.04Å; S136-K138 VanDerWaalsContact C-N 3.32Å; S136-K138 PolarHBondContact O-N 2.98Å; S136-K139 WeakPolarHBondContact O-CB 3.43Å; S136-K139 PolarHBondContact O-N 3.49Å; S136-L140 WeakPolarHBondContact O-CG 3.44Å; S136-L140 PolarHBondContact O-N 3.42Å
137	S	90.7	Very high	90.9	Very high	7 Å²	7	50.2 Å²	50.2	5%	0.049	25%	0.248	C	C	.	.	H	α-helix	trans	-54.6	-46.6	174	167.7	0	0	0	0	112.3	S133 E134 L140 M141	S133-S137 PolarHBondContact O-N 3.22Å; S133-S137 VanDerWaalsContact O-N 3.11Å; E134-S137 WeakPolarHBondContact O-CB 3.44Å; E134-S137 PolarHBondContact O-N 3.02Å; S137-L140 PolarHBondContact O-N 2.93Å; S137-M141 PolarHBondContact O-N 3.22Å; S137-M141 VanDerWaalsContact O-N 3.09Å; S137-M141 VanDerWaalsContact OG-CE 3.29Å; S137-M141 WeakPolarHBondContact OG-CE 3.36Å
138	K	91.6	Very high	90.6	Very high	143 Å²	143	56.9 Å²	56.9	62%	0.622	28%	0.279	S	S	*	.	H	α-helix	trans	-64.9	-43	178.3	-167	172.9	-177.2	179.5	0	112.4	E134 A135 S136 L140 M141 D142	E134-K138 PolarHBondContact O-N 3.19Å; A135-K138 PolarHBondContact O-N 3.42Å; S136-K138 VanDerWaalsContact C-N 3.32Å; S136-K138 PolarHBondContact O-N 2.98Å; K138-L140 VanDerWaalsContact C-N 3.27Å; K138-L140 PolarHBondContact O-N 3.38Å; K138-M141 PolarHBondContact O-N 2.89Å; K138-D142 PolarHBondContact O-N 3.31Å; K138-D142 VanDerWaalsContact O-N 3.12Å
139	K	91.8	Very high	90.3	Very high	79 Å²	79	56.8 Å²	56.8	34%	0.343	28%	0.279	S	S	.	.	H	α-helix	trans	-56.8	-41.2	173.6	-75.5	179.6	-179.3	-179.7	0	111.9	G105 V106 A135 S136 D142 L143	G105-K139 PolarHBondContact O-NZ 3.15Å; V106-K139 HydrophobicContact CG2-CB 4.16Å; V106-K139 HydrophobicContact CG2-CD 4.14Å; A135-K139 WeakPolarHBondContact O-CG 3.38Å; A135-K139 PolarHBondContact O-N 3.39Å; A135-K139 VanDerWaalsContact O-N 3.09Å; S136-K139 WeakPolarHBondContact O-CB 3.43Å; S136-K139 PolarHBondContact O-N 3.49Å; K139-D142 PolarHBondContact O-N 3.38Å; K139-L143 HydrophobicContact CB-CD1 4.36Å; K139-L143 VanDerWaalsContact O-CB 3.24Å; K139-L143 WeakPolarHBondContact O-CB 3.5Å; K139-L143 WeakPolarHBondContact O-CG 3.42Å; K139-L143 PolarHBondContact O-N 3.43Å
140	L	92.2	Very high	90.1	Very high	0 Å²	0	61 Å²	61	0%	0	30%	0.299	C	S	.	.	H	α-helix	trans	-65.2	-43.5	177.8	-67.2	-178.7	0	0	0	112.1	L83 V101 L104 V106 V131 S136 S137 K138 D142 L144 V156	L83-L140 HydrophobicContact CD1-CB 4.06Å; L83-L140 HydrophobicContact CD1-CD1 4.13Å; V101-L140 HydrophobicContact CB-CD2 4.34Å; V101-L140 HydrophobicContact CG1-CD2 4Å; V101-L140 HydrophobicContact CG2-CD2 3.89Å; L104-L140 HydrophobicContact CD1-CD2 4.01Å; V106-L140 HydrophobicContact CG2-CD2 4.22Å; V106-L140 HydrophobicContact CG2-CG 4.39Å; V131-L140 HydrophobicContact CG1-CD1 3.87Å; S136-L140 WeakPolarHBondContact O-CG 3.44Å; S136-L140 PolarHBondContact O-N 3.42Å; S137-L140 PolarHBondContact O-N 2.93Å; K138-L140 VanDerWaalsContact C-N 3.27Å; K138-L140 PolarHBondContact O-N 3.38Å; L140-D142 VanDerWaalsContact C-N 3.31Å; L140-D142 PolarHBondContact O-N 2.97Å; L140-L144 HydrophobicContact CB-CD1 4.14Å; L140-L144 HydrophobicContact CD2-CD1 3.65Å; L140-L144 HydrophobicContact CD2-CG 3.84Å; L140-L144 HydrophobicContact CG-CD1 4.36Å; L140-L144 VanDerWaalsContact O-CB 3.31Å; L140-L144 WeakPolarHBondContact O-CB 3.4Å; L140-L144 PolarHBondContact O-N 3.05Å; L140-L144 VanDerWaalsContact O-N 3.16Å; L140-V156 HydrophobicContact CB-CG1 4.44Å
141	M	91.2	Very high	89.8	Confident	66 Å²	66	63.6 Å²	63.6	33%	0.325	33%	0.325	S	S	.	.	H	α-helix	trans	-61.5	-37.1	176.9	-68.2	-169.6	-129.7	0	0	113.1	L83 S137 K138 P145 V156 P158	L83-M141 HydrophobicContact CD2-CE 3.77Å; S137-M141 PolarHBondContact O-N 3.22Å; S137-M141 VanDerWaalsContact O-N 3.09Å; S137-M141 VanDerWaalsContact OG-CE 3.29Å; S137-M141 WeakPolarHBondContact OG-CE 3.36Å; K138-M141 PolarHBondContact O-N 2.89Å; M141-P145 WeakPolarHBondContact O-CD 3.36Å; M141-P145 WeakPolarHBondContact O-CG 3.41Å; M141-V156 HydrophobicContact CG-CG1 4Å; M141-P158 HydrophobicContact CE-CG 4.34Å; M141-P158 HydrophobicContact SD-CG 4.18Å
142	D	91.7	Very high	89.7	Confident	88 Å²	88	67.5 Å²	67.5	47%	0.471	34%	0.343	S	S	.	.	H	α-helix	trans	-88.5	-28.4	-173.9	-68.2	-29.5	0	0	0	114.5	K138 K139 L140 K146	K138-D142 PolarHBondContact O-N 3.31Å; K138-D142 VanDerWaalsContact O-N 3.12Å; K139-D142 PolarHBondContact O-N 3.38Å; L140-D142 VanDerWaalsContact C-N 3.31Å; L140-D142 PolarHBondContact O-N 2.97Å; D142-K146 WeakPolarHBondContact O-CE 3.23Å; D142-K146 PolarHBondContact O-NZ 3.29Å
143	L	91.3	Very high	89.9	Confident	68 Å²	68	71.2 Å²	71.2	36%	0.356	36%	0.363	S	S	.	.	H	α-helix	trans	-110.3	-34.9	-169.9	-60.2	172.9	0	0	0	114.2	L104 K139 K146	L104-L143 HydrophobicContact CB-CD1 4.48Å; L104-L143 HydrophobicContact CD1-CB 3.87Å; L104-L143 HydrophobicContact CD2-CB 3.66Å; L104-L143 HydrophobicContact CD2-CD1 4.14Å; L104-L143 HydrophobicContact CD2-CG 4.49Å; L104-L143 HydrophobicContact CG-CB 4.3Å; K139-L143 HydrophobicContact CB-CD1 4.36Å; K139-L143 VanDerWaalsContact O-CB 3.24Å; K139-L143 WeakPolarHBondContact O-CB 3.5Å; K139-L143 WeakPolarHBondContact O-CG 3.42Å; K139-L143 PolarHBondContact O-N 3.43Å; L143-K146 PolarHBondContact O-N 2.84Å
144	L	88.6	Confident	90.1	Very high	0 Å²	0	70.2 Å²	70.2	0%	0	36%	0.356	C	S	.	.	G	3₁₀ helix	trans	-63.8	-39.4	-179.5	-85.5	179.8	0	0	0	113.4	I85 A100 V101 L104 L140 K146 R147 V156	I85-L144 HydrophobicContact CD1-CD1 3.59Å; I85-L144 HydrophobicContact CG1-CD1 4.4Å; A100-L144 HydrophobicContact CB-CD2 4.33Å; V101-L144 HydrophobicContact CG2-CD1 4.36Å; L104-L144 HydrophobicContact CD1-CB 4.34Å; L104-L144 HydrophobicContact CD1-CD2 3.6Å; L104-L144 HydrophobicContact CD1-CG 3.56Å; L140-L144 HydrophobicContact CB-CD1 4.14Å; L140-L144 HydrophobicContact CD2-CD1 3.65Å; L140-L144 HydrophobicContact CD2-CG 3.84Å; L140-L144 HydrophobicContact CG-CD1 4.36Å; L140-L144 VanDerWaalsContact O-CB 3.31Å; L140-L144 WeakPolarHBondContact O-CB 3.4Å; L140-L144 PolarHBondContact O-N 3.05Å; L140-L144 VanDerWaalsContact O-N 3.16Å; L144-K146 PolarHBondContact O-N 3.45Å; L144-R147 WeakPolarHBondContact O-CB 3.42Å; L144-R147 PolarHBondContact O-N 3.18Å; L144-V156 HydrophobicContact CB-CG2 3.5Å; L144-V156 VanDerWaalsContact CB-CG2 3.5Å; L144-V156 HydrophobicContact CD1-CG2 3.56Å; L144-V156 HydrophobicContact CG-CG2 4.18Å
145	P	90.9	Very high	90.4	Very high	51 Å²	51	66 Å²	66	33%	0.331	34%	0.34	S	S	.	.	G	3₁₀ helix	trans	-63.8	-12.6	177.3	-24	35.5	0	0	0	114.9	M141 P154 V156	M141-P145 WeakPolarHBondContact O-CD 3.36Å; M141-P145 WeakPolarHBondContact O-CG 3.41Å; P145-P154 VanDerWaalsContact CA-O 3.23Å; P145-P154 WeakPolarHBondContact CA-O 3.45Å; P145-V156 HydrophobicContact CG-CG2 4.36Å
146	K	87.9	Confident	90.6	Very high	161 Å²	161	63.9 Å²	63.9	70%	0.7	32%	0.321	S	S	*	.	G	3₁₀ helix	trans	-94.7	-1.9	175.7	-60.7	174.2	-177.5	156.7	0	112.7	D142 L143 L144	D142-K146 WeakPolarHBondContact O-CE 3.23Å; D142-K146 PolarHBondContact O-NZ 3.29Å; L143-K146 PolarHBondContact O-N 2.84Å; L144-K146 PolarHBondContact O-N 3.45Å
147	R	86.8	Confident	90.8	Very high	133 Å²	133	64.4 Å²	64.4	50%	0.502	32%	0.324	S	S	.	.	S	Bend	trans	-99	153.3	174.2	-64	-61.4	-173.4	-177.8	1.4	109.2	L104 L144 N153 P154	L104-R147 HydrophobicContact CD2-CG 4.35Å; L144-R147 WeakPolarHBondContact O-CB 3.42Å; L144-R147 PolarHBondContact O-N 3.18Å; R147-N153 PolarHBondContact O-OD1 3Å; R147-P154 WeakPolarHBondContact O-CD 3.35Å
148	E	89.4	Confident	90.8	Very high	140 Å²	140	67 Å²	67	65%	0.654	34%	0.341	S	S	*	.			trans	-108.5	124	172.7	-72.3	179	176.6	0	0	108.5	Q152 N153	E148-Q152 CarbonylContact C-O 3.59Å; E148-Q152 WeakPolarHBondContact CA-O 3.38Å; E148-N153 VanDerWaalsContact CG-OD1 3.27Å; E148-N153 WeakPolarHBondContact CG-OD1 3.42Å
149	L	89	Confident	90.6	Very high	20 Å²	20	62.8 Å²	62.8	11%	0.105	33%	0.329	C	S	.	.	B	Isolated β-bridge	trans	-108.2	116	168.4	-62	-176.4	0	0	0	107.8	L88 L97 A100 G151 Q152 P154	L88-L149 HydrophobicContact CD2-CD1 3.89Å; L97-L149 HydrophobicContact CD1-CD1 4.04Å; A100-L149 HydrophobicContact CB-CD1 4.22Å; A100-L149 HydrophobicContact CB-CD2 3.65Å; A100-L149 HydrophobicContact CB-CG 4.49Å; L149-G151 PolarHBondContact O-N 3.33Å; L149-G151 VanDerWaalsContact O-N 3.12Å; L149-Q152 PolarHBondContact N-O 2.86Å; L149-Q152 PolarHBondContact O-N 2.72Å; L149-P154 HydrophobicContact CB-CG 4.22Å; L149-P154 HydrophobicContact CD1-CG 3.66Å; L149-P154 HydrophobicContact CG-CG 3.67Å
150	H	89.4	Confident	90.5	Very high	89 Å²	89	62.5 Å²	62.5	41%	0.412	33%	0.331	S	S	.	.	T	Hydrogen-bonded Turn	trans	52.3	34.9	-179.1	-58.3	-64	0	0	0	114	T89 W91 T92 D96 Q152	T89-H150 HydrophobicContact CG2-CB 3.84Å; W91-H150 AromaticContact NE1-CG 3.7Å; W91-H150 AromaticContact NE1-ND1 3.98Å; T92-H150 PolarHBondContact OG1-CD2 3.02Å; D96-H150 IonicContact OD2-CD2 2.72Å; D96-H150 IonicContact OD2-CE1 3.84Å; D96-H150 IonicContact OD2-NE2 3.54Å; D96-H150 PolarHBondContact OD2-NE2 3.41Å; H150-Q152 VanDerWaalsContact C-N 3.34Å
151	G	88.1	Confident	90.3	Very high	57 Å²	57	70.6 Å²	70.6	59%	0.588	37%	0.366	S	S	*	.	T	Hydrogen-bonded Turn	trans	77	13.7	-178.2	0	0	0	0	0	115.1	L149	L149-G151 PolarHBondContact O-N 3.33Å; L149-G151 VanDerWaalsContact O-N 3.12Å
152	Q	89.7	Confident	90.3	Very high	83 Å²	83	74.5 Å²	74.5	39%	0.388	38%	0.383	S	S	.	.	B	Isolated β-bridge	trans	-117.2	143.1	171.6	-64.7	-65.1	-38.3	0	0	110.5	N87 T89 E148 L149 H150 P154	N87-Q152 PolarHBondContact ND2-OE1 3.44Å; N87-Q152 VanDerWaalsContact O-CB 3.3Å; N87-Q152 WeakPolarHBondContact O-CB 3.37Å; T89-Q152 HydrophobicContact CG2-CG 4Å; E148-Q152 CarbonylContact C-O 3.59Å; E148-Q152 WeakPolarHBondContact CA-O 3.38Å; L149-Q152 PolarHBondContact N-O 2.86Å; L149-Q152 PolarHBondContact O-N 2.72Å; H150-Q152 VanDerWaalsContact C-N 3.34Å; Q152-P154 WeakPolarHBondContact O-CD 2.94Å
153	N	92.3	Very high	90.4	Very high	78 Å²	78	73.4 Å²	73.4	42%	0.417	38%	0.375	S	S	.	.			trans	-84	118.2	172.8	-66.9	-35.5	0	0	0	109.3	N87 R147 E148	N87-N153 PolarHBondContact ND2-O 3.43Å; R147-N153 PolarHBondContact O-OD1 3Å; E148-N153 VanDerWaalsContact CG-OD1 3.27Å; E148-N153 WeakPolarHBondContact CG-OD1 3.42Å
154	P	92.9	Very high	90.4	Very high	0 Å²	0	72.3 Å²	72.3	0%	0	37%	0.369	C	S	.	.			trans	-62	136.7	176.7	-22.1	34.4	0	0	0	111.2	I85 L88 P145 R147 L149 Q152	I85-P154 HydrophobicContact CG2-CB 3.93Å; L88-P154 HydrophobicContact CD2-CB 4.07Å; L88-P154 HydrophobicContact CD2-CG 4.19Å; P145-P154 VanDerWaalsContact CA-O 3.23Å; P145-P154 WeakPolarHBondContact CA-O 3.45Å; R147-P154 WeakPolarHBondContact O-CD 3.35Å; L149-P154 HydrophobicContact CB-CG 4.22Å; L149-P154 HydrophobicContact CD1-CG 3.66Å; L149-P154 HydrophobicContact CG-CG 3.67Å; Q152-P154 WeakPolarHBondContact O-CD 2.94Å
155	V	93.6	Very high	90.6	Very high	60 Å²	60	74.7 Å²	74.7	36%	0.364	39%	0.386	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-105	110.8	176.5	179.2	0	0	0	0	108.6	I85 G86 N87 T157 F167	I85-V155 CarbonylContact C-O 3.56Å; I85-V155 WeakPolarHBondContact CA-O 3.45Å; G86-V155 PolarHBondContact N-O 2.9Å; G86-V155 PolarHBondContact O-N 3.4Å; N87-V155 HydrophobicContact CB-CB 4.33Å; N87-V155 HydrophobicContact CB-CG2 3.75Å; V155-T157 HydrophobicContact CG1-CG2 4.18Å; V155-F167 HydrophobicContact CB-CE1 4.27Å; V155-F167 HydrophobicContact CB-CZ 4.3Å; V155-F167 HydrophobicContact CG1-CE1 4.31Å; V155-F167 HydrophobicContact CG1-CZ 4.07Å
156	V	94.1	Very high	90.6	Very high	17 Å²	17	77.3 Å²	77.3	10%	0.103	39%	0.394	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-97.1	128.6	179.2	-172	0	0	0	0	110.1	L83 Y84 I85 L140 M141 L144 P145	L83-V156 HydrophobicContact CB-CG1 4.38Å; L83-V156 HydrophobicContact CD1-CG1 4.02Å; Y84-V156 CarbonylContact O-C 3.57Å; Y84-V156 WeakPolarHBondContact O-CA 3.39Å; I85-V156 HydrophobicContact CG1-CG1 4.45Å; I85-V156 HydrophobicContact CG1-CG2 4.21Å; I85-V156 HydrophobicContact CG2-CG2 4.43Å; L140-V156 HydrophobicContact CB-CG1 4.44Å; M141-V156 HydrophobicContact CG-CG1 4Å; L144-V156 HydrophobicContact CB-CG2 3.5Å; L144-V156 VanDerWaalsContact CB-CG2 3.5Å; L144-V156 HydrophobicContact CD1-CG2 3.56Å; L144-V156 HydrophobicContact CG-CG2 4.18Å; P145-V156 HydrophobicContact CG-CG2 4.36Å
157	T	93	Very high	90.9	Very high	12 Å²	12	69.9 Å²	69.9	7%	0.074	36%	0.361	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-136.3	151.5	177.7	59.7	0	0	0	0	110.8	Y84 V155 F163 F167	Y84-T157 PolarHBondContact N-O 2.86Å; Y84-T157 PolarHBondContact O-N 3.42Å; Y84-T157 PolarHBondContact O-OG1 3.29Å; V155-T157 HydrophobicContact CG1-CG2 4.18Å; T157-F163 HydrophobicContact CG2-CD1 3.78Å; T157-F163 HydrophobicContact CG2-CD2 4.49Å; T157-F163 HydrophobicContact CG2-CE1 3.98Å; T157-F163 HydrophobicContact CG2-CG 4.08Å; T157-F163 HydrophobicContact CG2-CZ 4.44Å; T157-F167 HydrophobicContact CG2-CE2 4.3Å; T157-F167 HydrophobicContact CG2-CZ 4.16Å; T157-F167 WeakPolarHBondContact OG1-CE2 3.37Å
158	P	90.8	Very high	91.2	Very high	62 Å²	62	65.7 Å²	65.7	40%	0.403	35%	0.347	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-59	150.8	171.2	-23	33.6	0	0	0	112	M141 N160 F163	M141-P158 HydrophobicContact CE-CG 4.34Å; M141-P158 HydrophobicContact SD-CG 4.18Å; P158-N160 PolarHBondContact O-N 3.31Å; P158-F163 WeakPolarHBondContact O-CD2 3.27Å
159	C	88	Confident	91.3	Very high	54 Å²	54	64.6 Å²	64.6	37%	0.365	34%	0.344	S	S	.	.	S	Bend	trans	-66.9	94.3	174	-85.3	0	0	0	0	112.3	A82 L83 Y84	A82-C159 HydrophobicContact CB-CB 4.07Å; A82-C159 WeakPolarHBondContact CB-SG 3.23Å; A82-C159 VanDerWaalsContact O-CB 3.23Å; A82-C159 WeakPolarHBondContact O-CB 3.21Å; A82-C159 PolarHBondContact O-N 2.99Å; A82-C159 PolarHBondContact O-SG 2.91Å; L83-C159 PolarHBondContact N-SG 3.48Å; L83-C159 VanDerWaalsContact N-SG 3.42Å; Y84-C159 HydrophobicContact CD2-CB 4.41Å; Y84-C159 HydrophobicContact CE2-CB 4.16Å
160	N	89.3	Confident	91.3	Very high	73 Å²	73	66.9 Å²	66.9	39%	0.39	35%	0.354	S	S	.	.			trans	-131	144.8	174.9	-172.3	-19.4	0	0	0	110.4	P158 Q162 F163 L164	P158-N160 PolarHBondContact O-N 3.31Å; N160-Q162 PolarHBondContact O-N 3.42Å; N160-Q162 PolarHBondContact OD1-N 3.42Å; N160-F163 HydrophobicContact CB-CD2 3.73Å; N160-F163 HydrophobicContact CB-CE2 4.29Å; N160-F163 PolarHBondContact O-N 3.23Å; N160-F163 VanDerWaalsContact O-N 3.11Å; N160-L164 PolarHBondContact O-N 2.9Å; N160-L164 VanDerWaalsContact O-N 3.1Å
161	K	88.4	Confident	91.2	Very high	170 Å²	170	63 Å²	63	74%	0.739	34%	0.336	S	S	*	.	H	α-helix	trans	-56.4	-31.1	177	-172.3	176.4	179.3	-180	0	112.9	S165	K161-S165 PolarHBondContact O-N 2.76Å; K161-S165 PolarHBondContact O-OG 2.62Å
162	Q	92	Very high	91.1	Very high	148 Å²	148	68.7 Å²	68.7	69%	0.692	34%	0.34	S	S	*	.	H	α-helix	trans	-66.2	-46.3	175.4	-68.7	-170.7	-14.7	0	0	112.2	N160 S165 Q166	N160-Q162 PolarHBondContact O-N 3.42Å; N160-Q162 PolarHBondContact OD1-N 3.42Å; Q162-S165 WeakPolarHBondContact O-CB 3.49Å; Q162-S165 PolarHBondContact O-N 3.04Å; Q162-Q166 PolarHBondContact O-N 3.03Å
163	F	92.3	Very high	90.3	Very high	65 Å²	65	72.2 Å²	72.2	29%	0.285	35%	0.354	S	S	.	.	H	α-helix	trans	-68.5	-36.8	178.6	-66.5	-57.4	0	0	0	112.5	Y84 T157 P158 N160 S165 Q166 F167	Y84-F163 HydrophobicContact CD2-CB 4.49Å; T157-F163 HydrophobicContact CG2-CD1 3.78Å; T157-F163 HydrophobicContact CG2-CD2 4.49Å; T157-F163 HydrophobicContact CG2-CE1 3.98Å; T157-F163 HydrophobicContact CG2-CG 4.08Å; T157-F163 HydrophobicContact CG2-CZ 4.44Å; P158-F163 WeakPolarHBondContact O-CD2 3.27Å; N160-F163 HydrophobicContact CB-CD2 3.73Å; N160-F163 HydrophobicContact CB-CE2 4.29Å; N160-F163 PolarHBondContact O-N 3.23Å; N160-F163 VanDerWaalsContact O-N 3.11Å; F163-S165 VanDerWaalsContact C-N 3.28Å; F163-S165 PolarHBondContact O-N 3.32Å; F163-Q166 WeakPolarHBondContact O-CB 3.27Å; F163-Q166 PolarHBondContact O-N 2.85Å; F163-Q166 VanDerWaalsContact O-N 3.13Å; F163-F167 HydrophobicContact CB-CE2 4.5Å; F163-F167 VanDerWaalsContact O-CD2 3.26Å; F163-F167 WeakPolarHBondContact O-CD2 3.25Å; F163-F167 PolarHBondContact O-N 3.39Å
164	L	91.2	Very high	88.9	Confident	46 Å²	46	71.7 Å²	71.7	24%	0.241	35%	0.354	C	S	.	.	H	α-helix	trans	-57.1	-45.1	172.5	178.2	61.1	0	0	0	111.3	Y84 F115 F126 N160 Q166 F167 E168	Y84-L164 HydrophobicContact CE1-CD1 4.12Å; Y84-L164 HydrophobicContact CE2-CB 4.04Å; F115-L164 HydrophobicContact CD1-CD1 4.33Å; F115-L164 HydrophobicContact CE1-CD1 3.79Å; F115-L164 HydrophobicContact CZ-CD1 4.01Å; F126-L164 HydrophobicContact CE2-CD1 3.82Å; F126-L164 HydrophobicContact CZ-CD1 4.29Å; N160-L164 PolarHBondContact O-N 2.9Å; N160-L164 VanDerWaalsContact O-N 3.1Å; L164-Q166 VanDerWaalsContact C-N 3.32Å; L164-Q166 PolarHBondContact O-N 3.2Å; L164-F167 PolarHBondContact O-N 2.73Å; L164-E168 HydrophobicContact CD1-CG 4.34Å; L164-E168 WeakPolarHBondContact O-CB 3.4Å; L164-E168 WeakPolarHBondContact O-CG 3.42Å; L164-E168 PolarHBondContact O-N 3.46Å
165	S	92.6	Very high	87	Confident	50 Å²	50	75.6 Å²	75.6	35%	0.35	38%	0.378	S	S	.	.	H	α-helix	trans	-63.9	-38.6	177.7	-56.8	0	0	0	0	111.5	K161 Q162 F163 M169	K161-S165 PolarHBondContact O-N 2.76Å; K161-S165 PolarHBondContact O-OG 2.62Å; Q162-S165 WeakPolarHBondContact O-CB 3.49Å; Q162-S165 PolarHBondContact O-N 3.04Å; F163-S165 VanDerWaalsContact C-N 3.28Å; F163-S165 PolarHBondContact O-N 3.32Å; S165-M169 WeakPolarHBondContact O-CB 3.47Å; S165-M169 WeakPolarHBondContact O-CG 3.34Å; S165-M169 PolarHBondContact O-N 2.87Å
166	Q	92	Very high	84.7	Confident	106 Å²	106	80.4 Å²	80.4	50%	0.495	40%	0.397	S	S	.	.	H	α-helix	trans	-62.9	-48	177	-172.8	-176.8	48.6	0	0	112.2	Q162 F163 L164 M169 Q170	Q162-Q166 PolarHBondContact O-N 3.03Å; F163-Q166 WeakPolarHBondContact O-CB 3.27Å; F163-Q166 PolarHBondContact O-N 2.85Å; F163-Q166 VanDerWaalsContact O-N 3.13Å; L164-Q166 VanDerWaalsContact C-N 3.32Å; L164-Q166 PolarHBondContact O-N 3.2Å; Q166-M169 PolarHBondContact O-N 3.19Å; Q166-Q170 WeakPolarHBondContact O-CB 3.39Å; Q166-Q170 PolarHBondContact O-N 2.8Å
167	F	93.9	Very high	82.4	Confident	4 Å²	4	82.4 Å²	82.4	2%	0.018	41%	0.411	C	S	.	.	H	α-helix	trans	-68.9	-38.1	178.3	-70.6	-57.1	0	0	0	112.8	F126 V155 T157 F163 L164 M169 Q170 S171	F126-F167 HydrophobicContact CB-CB 4.16Å; F126-F167 HydrophobicContact CB-CD1 4.33Å; F126-F167 HydrophobicContact CB-CG 4.15Å; F126-F167 HydrophobicContact CD1-CB 3.73Å; F126-F167 HydrophobicContact CD2-CB 3.81Å; F126-F167 HydrophobicContact CD2-CD2 4.46Å; F126-F167 HydrophobicContact CD2-CG 4.32Å; F126-F167 HydrophobicContact CE1-CB 3.98Å; F126-F167 HydrophobicContact CE2-CB 4.06Å; F126-F167 HydrophobicContact CG-CB 3.63Å; F126-F167 HydrophobicContact CG-CG 4.14Å; F126-F167 HydrophobicContact CZ-CB 4.15Å; V155-F167 HydrophobicContact CB-CE1 4.27Å; V155-F167 HydrophobicContact CB-CZ 4.3Å; V155-F167 HydrophobicContact CG1-CE1 4.31Å; V155-F167 HydrophobicContact CG1-CZ 4.07Å; T157-F167 HydrophobicContact CG2-CE2 4.3Å; T157-F167 HydrophobicContact CG2-CZ 4.16Å; T157-F167 WeakPolarHBondContact OG1-CE2 3.37Å; F163-F167 HydrophobicContact CB-CE2 4.5Å; F163-F167 VanDerWaalsContact O-CD2 3.26Å; F163-F167 WeakPolarHBondContact O-CD2 3.25Å; F163-F167 PolarHBondContact O-N 3.39Å; L164-F167 PolarHBondContact O-N 2.73Å; F167-M169 VanDerWaalsContact C-N 3.3Å; F167-M169 PolarHBondContact O-N 3.41Å; F167-Q170 PolarHBondContact O-N 3.16Å; F167-Q170 VanDerWaalsContact O-N 3.16Å; F167-S171 WeakPolarHBondContact O-CB 3.33Å; F167-S171 PolarHBondContact O-N 3.02Å; F167-S171 PolarHBondContact O-OG 3.23Å
168	E	92.6	Very high	80	Confident	45 Å²	45	84.9 Å²	84.9	21%	0.21	44%	0.439	C	S	.	.	H	α-helix	trans	-58.8	-41.7	171.6	-79	-73.8	168.2	0	0	111.4	K124 F126 L164 S171	K124-E168 IonicContact NZ-OE1 3.43Å; K124-E168 PolarHBondContact NZ-OE1 3.46Å; K124-E168 IonicContact NZ-OE2 2.7Å; K124-E168 PolarHBondContact NZ-OE2 2.83Å; F126-E168 HydrophobicContact CZ-CG 3.94Å; L164-E168 HydrophobicContact CD1-CG 4.34Å; L164-E168 WeakPolarHBondContact O-CB 3.4Å; L164-E168 WeakPolarHBondContact O-CG 3.42Å; L164-E168 PolarHBondContact O-N 3.46Å; E168-S171 PolarHBondContact O-OG 3.32Å
169	M	91.8	Very high	77.4	Confident	118 Å²	118	90.8 Å²	90.8	58%	0.581	46%	0.461	S	S	*	.	H	α-helix	trans	-69.3	-34.5	174.7	-68.9	167.9	-153.3	0	0	113.1	S165 Q166 F167	S165-M169 WeakPolarHBondContact O-CB 3.47Å; S165-M169 WeakPolarHBondContact O-CG 3.34Å; S165-M169 PolarHBondContact O-N 2.87Å; Q166-M169 PolarHBondContact O-N 3.19Å; F167-M169 VanDerWaalsContact C-N 3.3Å; F167-M169 PolarHBondContact O-N 3.41Å
170	Q	89.3	Confident	74.9	Confident	67 Å²	67	95.1 Å²	95.1	31%	0.313	48%	0.478	S	S	.	.	H	α-helix	trans	-69.3	-43.7	178.3	-171.7	176.7	10.3	0	0	111.6	N87 Q166 F167 R172 K173 T174	N87-Q170 PolarHBondContact OD1-NE2 3.47Å; Q166-Q170 WeakPolarHBondContact O-CB 3.39Å; Q166-Q170 PolarHBondContact O-N 2.8Å; F167-Q170 PolarHBondContact O-N 3.16Å; F167-Q170 VanDerWaalsContact O-N 3.16Å; Q170-R172 VanDerWaalsContact C-N 3.27Å; Q170-R172 PolarHBondContact O-N 3.05Å; Q170-K173 WeakPolarHBondContact O-CB 3.3Å; Q170-K173 PolarHBondContact O-N 3.5Å; Q170-T174 PolarHBondContact O-N 3.2Å; Q170-T174 PolarHBondContact O-OG1 2.8Å
171	S	87.4	Confident	72.4	Confident	7 Å²	7	97.8 Å²	97.8	5%	0.049	50%	0.502	C	S	.	.	H	α-helix	trans	-56.9	-38.6	-179.8	66.8	0	0	0	0	113	K124 F167 E168 K173 T174 T175	K124-S171 WeakPolarHBondContact O-CB 3.43Å; F167-S171 WeakPolarHBondContact O-CB 3.33Å; F167-S171 PolarHBondContact O-N 3.02Å; F167-S171 PolarHBondContact O-OG 3.23Å; E168-S171 PolarHBondContact O-OG 3.32Å; S171-K173 PolarHBondContact O-N 3.49Å; S171-K173 VanDerWaalsContact O-N 3.15Å; S171-T174 PolarHBondContact O-N 3.36Å; S171-T175 PolarHBondContact O-N 3.23Å; S171-T175 PolarHBondContact O-OG1 3Å
172	R	86	Confident	70.1	Confident	178 Å²	178	92.8 Å²	92.8	67%	0.672	50%	0.499	S	S	*	.	H	α-helix	trans	-59.7	-26.3	176.7	-67.2	176.7	-173.9	-164.5	0.3	113.5	Q170	Q170-R172 VanDerWaalsContact C-N 3.27Å; Q170-R172 PolarHBondContact O-N 3.05Å
173	K	73.7	Confident	67.5	Low	157 Å²	157	96 Å²	96	68%	0.683	51%	0.514	S	S	*	.	H	α-helix	trans	-85.1	-42	178.6	-60.8	178.2	-177.7	178.5	0	111.2	Q170 S171 T175 Q176 S177	Q170-K173 WeakPolarHBondContact O-CB 3.3Å; Q170-K173 PolarHBondContact O-N 3.5Å; S171-K173 PolarHBondContact O-N 3.49Å; S171-K173 VanDerWaalsContact O-N 3.15Å; K173-T175 VanDerWaalsContact C-N 3.31Å; K173-T175 PolarHBondContact O-N 2.94Å; K173-Q176 PolarHBondContact O-N 3.21Å; K173-S177 PolarHBondContact O-N 3.39Å; K173-S177 PolarHBondContact O-OG 2.94Å
174	T	61.1	Low	65	Low	66 Å²	66	96 Å²	96	41%	0.405	53%	0.532	S	S	.	.	H	α-helix	trans	-64.4	-34.4	-178.8	-52.8	0	0	0	0	112.4	Q170 S171 Q176 S177	Q170-T174 PolarHBondContact O-N 3.2Å; Q170-T174 PolarHBondContact O-OG1 2.8Å; S171-T174 PolarHBondContact O-N 3.36Å; T174-Q176 PolarHBondContact O-N 2.73Å; T174-S177 WeakPolarHBondContact CA-OG 3.27Å; T174-S177 PolarHBondContact O-N 2.88Å; T174-S177 PolarHBondContact O-OG 3.03Å; T174-S177 VanDerWaalsContact O-OG 3.05Å
175	T	53.7	Low	62.7	Low	82 Å²	82	104.2 Å²	104.2	50%	0.503	57%	0.566	S	S	.	*	H	α-helix	trans	-66.8	-24.2	177.6	-39.5	0	0	0	0	112.9	S171 K173	S171-T175 PolarHBondContact O-N 3.23Å; S171-T175 PolarHBondContact O-OG1 3Å; K173-T175 VanDerWaalsContact C-N 3.31Å; K173-T175 PolarHBondContact O-N 2.94Å
176	Q	46.4	Very low	60.3	Low	162 Å²	162	106.6 Å²	106.6	76%	0.757	59%	0.589	S	S	*	*	H	α-helix	trans	-89.2	-23.6	176.2	-70.2	-174.5	6.2	0	0	113.1	K173 T174 G178	K173-Q176 PolarHBondContact O-N 3.21Å; T174-Q176 PolarHBondContact O-N 2.73Å; Q176-G178 VanDerWaalsContact C-N 3.32Å; Q176-G178 PolarHBondContact O-N 2.87Å
177	S	45.7	Very low	57.8	Low	59 Å²	59	105 Å²	105	41%	0.413	60%	0.6	S	S	.	*	H	α-helix	trans	-81.7	-4.8	-180	54.4	0	0	0	0	114.7	K173 T174 Q179	K173-S177 PolarHBondContact O-N 3.39Å; K173-S177 PolarHBondContact O-OG 2.94Å; T174-S177 WeakPolarHBondContact CA-OG 3.27Å; T174-S177 PolarHBondContact O-N 2.88Å; T174-S177 PolarHBondContact O-OG 3.03Å; T174-S177 VanDerWaalsContact O-OG 3.05Å; S177-Q179 VanDerWaalsContact C-N 3.3Å; S177-Q179 PolarHBondContact O-N 3.47Å
178	G	42.8	Very low	55.7	Low	63 Å²	63	110.5 Å²	110.5	65%	0.649	64%	0.637	S	S	*	*	T	Hydrogen-bonded Turn	trans	-79.4	0.3	177.6	0	0	0	0	0	115.9	Q176	Q176-G178 VanDerWaalsContact C-N 3.32Å; Q176-G178 PolarHBondContact O-N 2.87Å
179	Q	36.2	Very low	53.6	Low	186 Å²	186	114.7 Å²	114.7	87%	0.869	67%	0.668	S	S	*	*	S	Bend	trans	-117.7	49.7	174.2	-74.7	-174.2	-17.1	0	0	111.4	S177	S177-Q179 VanDerWaalsContact C-N 3.3Å; S177-Q179 PolarHBondContact O-N 3.47Å
180	M	34.8	Very low	51.1	Low	145 Å²	145	112.4 Å²	112.4	71%	0.714	67%	0.674	S	S	*	*			trans	-165	62.5	168.1	45	-179.6	177.9	0	0	112.2
181	S	37	Very low	48.7	Very low	129 Å²	129	112.8 Å²	112.8	90%	0.902	70%	0.697	S	S	*	*			trans	-133.4	58.5	161.2	-43	0	0	0	0	108.2
182	G	39.3	Very low	46.5	Very low	65 Å²	65	118.4 Å²	118.4	67%	0.67	74%	0.736	S	S	*	*	S	Bend	trans	-144.6	103.9	175.5	0	0	0	0	0	107.9	G184	G182-G184 PolarHBondContact O-N 3.48Å
183	E	37.2	Very low	44.4	Very low	215 Å²	215	115.3 Å²	115.3	100%	1.005	74%	0.741	S	S	*	*			trans	-49.1	102.5	166.8	-91.4	146.1	54.3	0	0	109.7
184	G	40.4	Very low	42.8	Very low	66 Å²	66	120.1 Å²	120.1	68%	0.68	76%	0.755	S	S	*	*			trans	-155.3	94.7	-177.1	0	0	0	0	0	109.6	G182 A186	G182-G184 PolarHBondContact O-N 3.48Å; G184-A186 PolarHBondContact O-N 2.92Å
185	K	42.4	Very low	41.9	Very low	218 Å²	218	121.6 Å²	121.6	95%	0.948	77%	0.774	S	S	*	*			trans	-40.7	114.8	167.2	-79.1	167.8	158.5	174.3	0	111.8
186	A	42.1	Very low	41.2	Very low	101 Å²	101	121.2 Å²	121.2	84%	0.835	78%	0.779	S	S	*	*			trans	170.6	102.9	137.6	0	0	0	0	0	113	G184	G184-A186 PolarHBondContact O-N 2.92Å
187	G	40.4	Very low	40.8	Very low	71 Å²	71	122.8 Å²	122.8	73%	0.732	78%	0.784	S	S	*	*			trans	69.7	119.5	139.8	0	0	0	0	0	121.1
188	P	50.5	Low	40.8	Very low	120 Å²	120	125 Å²	125	78%	0.779	80%	0.797	S	S	*	*			trans	-88.4	139.7	164.3	33.8	-27.3	0	0	0	110.9	G190	P188-G190 PolarHBondContact O-N 3.41Å; P188-G190 VanDerWaalsContact O-N 3.07Å
189	P	47.6	Very low	40.9	Very low	134 Å²	134	130.9 Å²	130.9	87%	0.87	81%	0.807	S	S	*	*			trans	-73.2	101.9	162	28.5	-27.3	0	0	0	108	G191	P189-G191 PolarHBondContact O-N 3.46Å
190	G	39.4	Very low	41	Very low	69 Å²	69	125.9 Å²	125.9	71%	0.711	81%	0.806	S	S	*	*			trans	-60.4	128.6	178.4	0	0	0	0	0	112.4	P188	P188-G190 PolarHBondContact O-N 3.41Å; P188-G190 VanDerWaalsContact O-N 3.07Å
191	G	38.3	Very low	41.3	Very low	76 Å²	76	122.3 Å²	122.3	78%	0.784	81%	0.806	S	S	*	*			trans	-70.8	122.9	152.4	0	0	0	0	0	109	P189	P189-G191 PolarHBondContact O-N 3.46Å
192	S	40.6	Very low	41.5	Very low	125 Å²	125	128.7 Å²	128.7	87%	0.874	81%	0.81	S	S	*	*			trans	-114.9	102.6	163.1	-87.1	0	0	0	0	109
193	S	43.6	Very low	41.5	Very low	112 Å²	112	129.1 Å²	129.1	78%	0.783	82%	0.815	S	S	*	*			trans	-47	135.4	169.1	-55.4	0	0	0	0	112.3	A195	S193-A195 PolarHBondContact O-N 2.88Å
194	R	40	Very low	41.7	Very low	259 Å²	259	131.4 Å²	131.4	98%	0.977	81%	0.814	S	S	*	*			trans	-56.1	104.4	156.1	-93.9	174.5	171	134.1	-2.4	108.3
195	A	41.2	Very low	41.7	Very low	96 Å²	96	131.9 Å²	131.9	79%	0.793	82%	0.819	S	S	*	*			trans	-112.8	121.5	162.9	0	0	0	0	0	108.2	S193	S193-A195 PolarHBondContact O-N 2.88Å
196	A	39.6	Very low	41.5	Very low	75 Å²	75	132.6 Å²	132.6	62%	0.62	82%	0.816	S	S	*	*			trans	-78.4	166	173.6	0	0	0	0	0	111.2
197	F	38.7	Very low	41.5	Very low	195 Å²	195	138 Å²	138	86%	0.855	82%	0.821	S	S	*	*			trans	91.9	150	164.5	-52.9	-73.7	0	0	0	117.8
198	P	45.6	Very low	41.6	Very low	104 Å²	104	140.7 Å²	140.7	68%	0.675	83%	0.825	S	S	*	*			cis	-141	168.1	-48.4	38.4	-22.1	0	0	0	113.9
199	Q	44.7	Very low	41.2	Very low	188 Å²	188	138.6 Å²	138.6	88%	0.879	83%	0.825	S	S	*	*			trans	62.5	122.3	137.9	-171.5	169.9	-19	0	0	122.1
200	G	38.5	Very low	40.9	Very low	81 Å²	81	136.9 Å²	136.9	84%	0.835	82%	0.823	S	S	*	*			trans	99.1	129.1	154.1	0	0	0	0	0	113.4
201	G	39.4	Very low	41.2	Very low	70 Å²	70	140.8 Å²	140.8	72%	0.722	83%	0.832	S	S	*	*			cis	168.9	146.4	6	0	0	0	0	0	108.5
202	R	41.5	Very low	41.5	Very low	263 Å²	263	143.6 Å²	143.6	99%	0.992	84%	0.837	S	S	*	*			trans	70.5	131.8	155.4	-56.4	-161.9	-179.8	-152.7	2.9	121.1
203	G	39.7	Very low	41.6	Very low	74 Å²	74	141.7 Å²	141.7	76%	0.763	84%	0.837	S	S	*	*			trans	135.2	72	148.9	0	0	0	0	0	114.4
204	R	41.5	Very low	41.5	Very low	263 Å²	263	139.9 Å²	139.9	99%	0.992	84%	0.836	S	S	*	*				58.6	122.2	97.7	-108.1	-164.5	-176.3	-170.9	2.9	117.3
205	G	40.7	Very low	41.6	Very low	76 Å²	76	135.1 Å²	135.1	78%	0.784	83%	0.83	S	S	*	*			trans	129.2	85	156	0	0	0	0	0	113.5
206	R	38.7	Very low	41.5	Very low	232 Å²	232	142.5 Å²	142.5	88%	0.875	84%	0.837	S	S	*	*				67.2	103.6	78.7	-163.7	-174.5	-142.2	-149.3	5.5	114.8
207	F	41.6	Very low	41.7	Very low	216 Å²	216	148.5 Å²	148.5	95%	0.947	85%	0.85	S	S	*	*			trans	-164.9	127.3	139.3	-87.6	-71.5	0	0	0	110.9
208	P	42.1	Very low	42.3	Very low	126 Å²	126	144.7 Å²	144.7	82%	0.818	84%	0.844	S	S	*	*			trans	-128.7	150.6	160.5	36.9	-23	0	0	0	113.6
209	G	42.2	Very low	42.1	Very low	76 Å²	76	143.2 Å²	143.2	78%	0.784	85%	0.848	S	S	*	*			trans	176.6	113.5	167	0	0	0	0	0	109.3
210	A	41.6	Very low	42.3	Very low	98 Å²	98	140.7 Å²	140.7	81%	0.81	85%	0.848	S	S	*	*				82.9	104.3	61.2	0	0	0	0	0	113.9
211	V	45.7	Very low	42.7	Very low	151 Å²	151	141.9 Å²	141.9	92%	0.915	85%	0.85	S	S	*	*			trans	-152.5	121.2	147.1	-89.3	0	0	0	0	109.6
212	P	44.2	Very low	42.8	Very low	136 Å²	136	142.1 Å²	142.1	88%	0.883	85%	0.852	S	S	*	*			trans	-118.6	157.2	170.6	37.1	-24.6	0	0	0	113.3
213	G	42	Very low	43	Very low	85 Å²	85	136.3 Å²	136.3	88%	0.876	85%	0.848	S	S	*	*			trans	151	137.7	168.9	0	0	0	0	0	111.5
214	G	43.2	Very low	43.2	Very low	73 Å²	73	136.9 Å²	136.9	75%	0.753	86%	0.855	S	S	*	*			cis	-171.8	162.7	6	0	0	0	0	0	110.2
215	D	40.8	Very low	43.5	Very low	159 Å²	159	127.9 Å²	127.9	85%	0.85	84%	0.843	S	S	*	*			trans	-68.8	150.8	-166.3	-51.1	-95.1	0	0	0	116.8
216	R	40.3	Very low	44	Very low	251 Å²	251	130.3 Å²	130.3	95%	0.947	85%	0.845	S	S	*	*				-173.2	112.2	125.8	-106.1	173.6	-162.2	177.4	5.8	114.4
217	F	42.3	Very low	44.6	Very low	202 Å²	202	125 Å²	125	89%	0.886	84%	0.841	S	S	*	*			trans	-56.3	-177.3	157.9	-109.4	-127.9	0	0	0	113.6
218	P	51.4	Low	45.6	Very low	114 Å²	114	120.4 Å²	120.4	74%	0.74	83%	0.833	S	S	*	*			cis	-142.7	176.6	-35.3	33.7	-13.9	0	0	0	115.7
219	G	41.9	Very low	46	Very low	73 Å²	73	120.1 Å²	120.1	75%	0.753	83%	0.831	S	S	*	*			trans	144.3	127.7	144.8	0	0	0	0	0	118.3
220	P	49.5	Very low	46.2	Very low	136 Å²	136	126 Å²	126	88%	0.883	84%	0.835	S	S	*	*			trans	-106.6	150	178.6	38.2	-28.6	0	0	0	114.1
221	A	45.6	Very low	46.7	Very low	106 Å²	106	127.4 Å²	127.4	88%	0.876	84%	0.836	S	S	*	*			trans	-158.3	128.7	160.6	0	0	0	0	0	105.8
222	G	43.3	Very low	46.7	Very low	74 Å²	74	125.1 Å²	125.1	76%	0.763	83%	0.833	S	S	*	*			cis	124.6	132.3	45.3	0	0	0	0	0	106.5
223	P	45.4	Very low	46.7	Very low	141 Å²	141	122.1 Å²	122.1	92%	0.916	83%	0.827	S	S	*	*			trans	-93.9	151	-160.5	36.4	-33.5	0	0	0	113.9
224	G	44.1	Very low	46.9	Very low	87 Å²	87	126.6 Å²	126.6	90%	0.897	83%	0.825	S	S	*	*			trans	134.7	112.1	160.7	0	0	0	0	0	115.8
225	G	47	Very low	47.1	Very low	73 Å²	73	129.1 Å²	129.1	75%	0.753	83%	0.826	S	S	*	*			trans	168.3	117	165.9	0	0	0	0	0	112.6
226	P	51.7	Low	47.4	Very low	127 Å²	127	126.7 Å²	126.7	83%	0.825	82%	0.819	S	S	*	*			trans	-95.2	178.1	-179.7	44.2	-37.4	0	0	0	111.1
227	P	51.6	Low	47.8	Very low	120 Å²	120	121.2 Å²	121.2	78%	0.779	82%	0.816	S	S	*	*				-102.1	-178.4	-123.3	41	-26.6	0	0	0	114.8
228	P	62.4	Low	48.4	Very low	121 Å²	121	122.2 Å²	122.2	79%	0.786	81%	0.814	S	S	*	*			trans	-121.5	157.9	149.6	34.2	-20.7	0	0	0	113.5
229	P	49.1	Very low	48.6	Very low	120 Å²	120	122 Å²	122	78%	0.779	81%	0.812	S	S	*	*			trans	-88.9	166.5	-165.5	36.1	-34.7	0	0	0	115.1
230	F	46.5	Very low	49.3	Very low	198 Å²	198	124.6 Å²	124.6	87%	0.868	82%	0.816	S	S	*	*			trans	-35.9	159	-176.6	-60.7	-88.8	0	0	0	119.3
231	P	53	Low	49.6	Very low	128 Å²	128	125.6 Å²	125.6	83%	0.831	81%	0.813	S	S	*	*				-128	149.7	107.2	36.3	-28.6	0	0	0	113.6
232	A	45.5	Very low	50.3	Low	103 Å²	103	123.5 Å²	123.5	85%	0.851	80%	0.802	S	S	*	*			trans	-56.4	139.3	179.2	0	0	0	0	0	113.2
233	G	45	Very low	51.4	Low	73 Å²	73	126.1 Å²	126.1	75%	0.753	81%	0.805	S	S	*	*			trans	165.8	50.8	172.4	0	0	0	0	0	117.2
234	Q	44.9	Very low	52	Low	179 Å²	179	125.5 Å²	125.5	84%	0.836	80%	0.801	S	S	*	*			trans	28.8	98.7	147.5	-62.7	-179.6	22.1	0	0	119.7
235	T	47.9	Very low	52.9	Low	126 Å²	126	124.5 Å²	124.5	77%	0.773	79%	0.791	S	S	*	*				92.2	135.1	95.2	53.1	0	0	0	0	116.7
236	P	46.3	Very low	54	Low	108 Å²	108	126.9 Å²	126.9	70%	0.701	79%	0.793	S	S	*	*	P	Polyproline II helix	trans	-78	164.8	-173	34.5	-36.4	0	0	0	113.4	R238	P236-R238 PolarHBondContact O-N 3.19Å
237	P	49.2	Very low	54.4	Low	136 Å²	136	127.1 Å²	127.1	88%	0.883	80%	0.795	S	S	*	*	P	Polyproline II helix	trans	-70.4	127.8	-164	29.5	-33.7	0	0	0	111.7
238	R	54.3	Low	55.2	Low	224 Å²	224	124.4 Å²	124.4	85%	0.845	79%	0.789	S	S	*	*	P	Polyproline II helix	trans	-90.6	146.5	174.2	-79.7	177.2	169.4	-110.3	0.8	110.8	P236	P236-R238 PolarHBondContact O-N 3.19Å
239	P	55.8	Low	55.5	Low	108 Å²	108	124.4 Å²	124.4	70%	0.701	79%	0.789	S	S	*	*	P	Polyproline II helix	trans	-67.4	157.1	170.7	30.3	-33.3	0	0	0	110.9	L241	P239-L241 PolarHBondContact O-N 2.91Å
240	P	58.1	Low	56.2	Low	129 Å²	129	125 Å²	125	84%	0.838	79%	0.792	S	S	*	*	P	Polyproline II helix	trans	-65.5	129.8	-165.8	25.7	-32.9	0	0	0	112.4
241	L	54.6	Low	57.3	Low	157 Å²	157	118.4 Å²	118.4	82%	0.822	78%	0.781	S	S	*	*	P	Polyproline II helix	trans	-61.1	129	169.9	-95.6	75.8	0	0	0	110	P239	P239-L241 PolarHBondContact O-N 2.91Å
242	G	60.2	Low	58	Low	62 Å²	62	118.3 Å²	118.3	64%	0.639	78%	0.78	S	S	*	*	P	Polyproline II helix	trans	-67.8	165.4	167.5	0	0	0	0	0	112.9
243	P	66	Low	59.3	Low	128 Å²	128	119 Å²	119	83%	0.831	78%	0.776	S	S	*	*	P	Polyproline II helix	trans	-71	160.9	-171.9	28.9	-33.6	0	0	0	113.4
244	P	58.8	Low	60.4	Low	128 Å²	128	121.1 Å²	121.1	83%	0.831	78%	0.776	S	S	*	*	P	Polyproline II helix	trans	-73.5	135.8	-169.4	-5.5	22.9	0	0	0	111.7
245	G	63.9	Low	60.6	Low	66 Å²	66	119.1 Å²	119.1	68%	0.68	78%	0.779	S	S	*	*	P	Polyproline II helix	trans	-68.2	152.7	175.1	0	0	0	0	0	113.1
246	P	69.1	Low	60.7	Low	123 Å²	123	116.3 Å²	116.3	80%	0.799	78%	0.775	S	S	*	*	P	Polyproline II helix	trans	-69.9	157.1	-177.2	28.4	-33.9	0	0	0	112.7	G248	P246-G248 PolarHBondContact O-N 3.48Å
247	P	61.2	Low	60.8	Low	132 Å²	132	120.7 Å²	120.7	86%	0.857	79%	0.786	S	S	*	*	P	Polyproline II helix	trans	-66.5	129.8	-174.1	-14.3	28.7	0	0	0	111.7
248	G	66.5	Low	60.6	Low	64 Å²	64	120.3 Å²	120.3	66%	0.66	78%	0.781	S	S	*	*	P	Polyproline II helix	trans	-64.6	155.6	174.2	0	0	0	0	0	112.7	P246	P246-G248 PolarHBondContact O-N 3.48Å
249	P	69	Low	60.3	Low	120 Å²	120	117.2 Å²	117.2	78%	0.779	78%	0.78	S	S	*	*	P	Polyproline II helix	trans	-64.8	154.1	-179.1	27.6	-34	0	0	0	111.8	G251	P249-G251 PolarHBondContact O-N 2.94Å
250	P	64.1	Low	60.3	Low	132 Å²	132	117.3 Å²	117.3	86%	0.857	78%	0.781	S	S	*	*	P	Polyproline II helix	trans	-61.3	125.4	-176.4	-17.5	30	0	0	0	110.8
251	G	69	Low	60.1	Low	61 Å²	61	116.7 Å²	116.7	63%	0.629	78%	0.777	S	S	*	*	P	Polyproline II helix	trans	-62.6	154.8	172.7	0	0	0	0	0	111.8	P249	P249-G251 PolarHBondContact O-N 2.94Å
252	P	69.3	Low	60.6	Low	125 Å²	125	115.2 Å²	115.2	81%	0.812	78%	0.777	S	S	*	*	P	Polyproline II helix	trans	-64.9	147.9	-179.7	28.9	-33.6	0	0	0	110.7
253	P	72.2	Confident	60.2	Low	117 Å²	117	120.5 Å²	120.5	76%	0.76	79%	0.789	S	S	*	*	P	Polyproline II helix	trans	-67	149.8	-178.2	28	-33.8	0	0	0	111.5
254	P	67.6	Low	59.1	Low	118 Å²	118	119.6 Å²	119.6	77%	0.766	79%	0.793	S	S	*	*	P	Polyproline II helix	trans	-64.6	146.5	178.7	27	-33.5	0	0	0	111.4	G256	P254-G256 PolarHBondContact O-N 3.25Å
255	P	50.2	Low	58.6	Low	137 Å²	137	116.8 Å²	116.8	89%	0.89	79%	0.787	S	S	*	*	S	Bend	trans	-71.3	124.2	-176.9	27.6	-31.1	0	0	0	110.4
256	G	49.3	Very low	58.1	Low	67 Å²	67	119.8 Å²	119.8	69%	0.691	79%	0.794	S	S	*	*			trans	121.4	73.1	165	0	0	0	0	0	113.9	P254	P254-G256 PolarHBondContact O-N 3.25Å
257	Q	48.6	Very low	57.1	Low	201 Å²	201	119.6 Å²	119.6	94%	0.939	79%	0.793	S	S	*	*			trans	-142.5	139.2	142.1	-68.5	-159.8	44.5	0	0	108.8
258	V	44.9	Very low	56.5	Low	128 Å²	128	120.4 Å²	120.4	78%	0.776	79%	0.79	S	S	*	*			trans	-103.6	150.2	-158.6	-158.5	0	0	0	0	108.6
259	L	47.5	Very low	55.6	Low	159 Å²	159	128.6 Å²	128.6	83%	0.832	80%	0.801	S	S	*	*			trans	90.8	155.9	160.6	-55.3	162.5	0	0	0	118.3
260	P	55.7	Low	54.4	Low	110 Å²	110	126.3 Å²	126.3	71%	0.714	80%	0.8	S	S	*	*			cis	-126.8	172.6	-22.2	23.7	-0.4	0	0	0	112.8
261	P	54.7	Low	53.5	Low	115 Å²	115	128.3 Å²	128.3	75%	0.747	80%	0.803	S	S	*	*	P	Polyproline II helix	trans	-87.7	149.4	-164	35.5	-32.7	0	0	0	113.2
262	P	64.1	Low	52.5	Low	126 Å²	126	135.9 Å²	135.9	82%	0.818	81%	0.813	S	S	*	*	P	Polyproline II helix	trans	-93	140.5	164.6	33.3	-27.5	0	0	0	112
263	L	52.6	Low	52.4	Low	174 Å²	174	135 Å²	135	91%	0.911	81%	0.807	S	S	*	*	P	Polyproline II helix	trans	-53.1	152.5	-178.5	-102.8	66.5	0	0	0	115.6
264	A	43.6	Very low	52.1	Low	109 Å²	109	135.1 Å²	135.1	90%	0.901	81%	0.808	S	S	*	*	P	Polyproline II helix	trans	-63.1	143.8	179.1	0	0	0	0	0	115.6
265	G	46.6	Very low	52	Low	68 Å²	68	134.2 Å²	134.2	70%	0.701	80%	0.802	S	S	*	*			trans	-143	149.8	158.9	0	0	0	0	0	109.7
266	P	55.1	Low	52.6	Low	129 Å²	129	133.2 Å²	133.2	84%	0.838	80%	0.796	S	S	*	*			trans	-89.9	165.7	-140.4	35	-35.9	0	0	0	116.1
267	P	47.6	Very low	53.1	Low	120 Å²	120	136.1 Å²	136.1	78%	0.779	80%	0.8	S	S	*	*			trans	-95.3	142.3	-163.5	36.6	-31	0	0	0	113.5
268	N	49.2	Very low	53.1	Low	148 Å²	148	134.3 Å²	134.3	79%	0.791	80%	0.795	S	S	*	*			trans	-149.3	101.8	155.8	-107.9	-50.3	0	0	0	107.2
269	R	46.3	Very low	53.4	Low	236 Å²	236	137.2 Å²	137.2	89%	0.891	80%	0.798	S	S	*	*				73.8	96.4	78.8	-164.4	-178.6	-162.6	168.8	4.1	110.2
270	G	44.7	Very low	53.2	Low	73 Å²	73	135.3 Å²	135.3	75%	0.753	80%	0.795	S	S	*	*			trans	176.7	-25.3	169.9	0	0	0	0	0	119.9	R272	G270-R272 PolarHBondContact O-N 3.02Å
271	D	44.6	Very low	52.7	Low	174 Å²	174	133.5 Å²	133.5	93%	0.93	80%	0.796	S	S	*	*			trans	-84.7	99.6	-176	-72	-67.9	0	0	0	112.5
272	R	48.6	Very low	52.3	Low	220 Å²	220	137 Å²	137	83%	0.83	80%	0.803	S	S	*	*			trans	-129.6	106.5	161.3	-165.2	174.1	-179	-123.4	1.1	109.4	G270	G270-R272 PolarHBondContact O-N 3.02Å
273	P	66.8	Low	51.5	Low	107 Å²	107	135.9 Å²	135.9	70%	0.695	80%	0.795	S	S	*	*	P	Polyproline II helix	trans	-71.1	144.8	167.7	29.3	-31.3	0	0	0	109.7
274	P	65.9	Low	50.9	Low	118 Å²	118	138.2 Å²	138.2	77%	0.766	80%	0.799	S	S	*	*	P	Polyproline II helix	trans	-69.7	148.5	174.6	28.9	-32.6	0	0	0	111.2
275	P	65.5	Low	50.8	Low	99 Å²	99	136.3 Å²	136.3	64%	0.643	79%	0.79	S	S	*	*	P	Polyproline II helix	trans	-76	157.4	-178.7	33.2	-34.1	0	0	0	111.5	V277	P275-V277 PolarHBondContact O-N 3.14Å
276	P	62.4	Low	50.9	Low	117 Å²	117	142.6 Å²	142.6	76%	0.76	80%	0.801	S	S	*	*	P	Polyproline II helix	trans	-71.8	127.2	176.4	30.6	-31.2	0	0	0	109.6	L278	P276-L278 PolarHBondContact O-N 2.98Å
277	V	59.6	Low	50.9	Low	128 Å²	128	141.9 Å²	141.9	78%	0.776	80%	0.796	S	S	*	*			trans	-69.8	106.4	168.5	-86.1	0	0	0	0	109.3	P275	P275-V277 PolarHBondContact O-N 3.14Å
278	L	48.9	Very low	51.2	Low	163 Å²	163	142.2 Å²	142.2	85%	0.853	80%	0.798	S	S	*	*			trans	-73.6	115.1	159.3	-90.2	115	0	0	0	108.3	P276	P276-L278 PolarHBondContact O-N 2.98Å
279	F	51.7	Low	51.2	Low	188 Å²	188	144 Å²	144	83%	0.825	81%	0.807	S	S	*	*			trans	-96	126.5	160.6	-99.4	-87.2	0	0	0	109.6
280	P	43.3	Very low	51.9	Low	119 Å²	119	135.7 Å²	135.7	77%	0.773	79%	0.794	S	S	*	*			trans	-90.7	141.7	-178.7	34.2	-30.6	0	0	0	111.9
281	G	45.3	Very low	53	Low	72 Å²	72	138.5 Å²	138.5	74%	0.742	80%	0.799	S	S	*	*			trans	92.6	103.7	153.5	0	0	0	0	0	116.4
282	Q	46.2	Very low	53.3	Low	189 Å²	189	138 Å²	138	88%	0.883	80%	0.796	S	S	*	*				-159	142	127.2	-94.9	-67.1	-52.4	0	0	107.9
283	P	46.7	Very low	54.3	Low	102 Å²	102	132.9 Å²	132.9	66%	0.662	79%	0.791	S	S	*	*			trans	-90.4	164	-160.8	36.1	-30.9	0	0	0	113.3
284	F	39.6	Very low	54.5	Low	224 Å²	224	133.9 Å²	133.9	98%	0.982	80%	0.798	S	S	*	*			trans	-33.6	127.9	166	-81	-105.4	0	0	0	114.6
285	G	42.6	Very low	54.3	Low	69 Å²	69	131.2 Å²	131.2	71%	0.711	79%	0.791	S	S	*	*			trans	-166.5	101.6	165.8	0	0	0	0	0	110.7
286	Q	48.3	Very low	54.7	Low	199 Å²	199	132.4 Å²	132.4	93%	0.93	80%	0.799	S	S	*	*	P	Polyproline II helix	trans	-64	133.7	168.1	-69.3	174.6	-61.6	0	0	109.6
287	P	54.7	Low	55.2	Low	114 Å²	114	132.2 Å²	132.2	74%	0.74	80%	0.798	S	S	*	*	P	Polyproline II helix	trans	-91.2	151.5	156.1	29.1	-20	0	0	0	110.7
288	P	55.2	Low	55.9	Low	127 Å²	127	131.5 Å²	131.5	83%	0.825	80%	0.796	S	S	*	*	P	Polyproline II helix	trans	-78.8	145.3	-160.9	31.8	-34.6	0	0	0	113	G290	P288-G290 PolarHBondContact O-N 3.26Å
289	L	48.8	Very low	56.7	Low	187 Å²	187	129.5 Å²	129.5	98%	0.979	79%	0.793	S	S	*	*			trans	-65.1	101.5	167.8	-70.2	166.7	0	0	0	109.4
290	G	60.5	Low	57.2	Low	60 Å²	60	125.9 Å²	125.9	62%	0.619	79%	0.786	S	S	*	*	P	Polyproline II helix	trans	-74.4	152.1	166.6	0	0	0	0	0	111.5	P288	P288-G290 PolarHBondContact O-N 3.26Å
291	P	66.8	Low	57.9	Low	132 Å²	132	126.9 Å²	126.9	86%	0.857	79%	0.792	S	S	*	*	P	Polyproline II helix	trans	-68.9	134.8	-172	27.5	-31.7	0	0	0	111.7
292	L	51.8	Low	58.5	Low	165 Å²	165	126.9 Å²	126.9	86%	0.864	79%	0.792	S	S	*	*	P	Polyproline II helix	trans	-59.2	137.8	174.8	-72.8	159.8	0	0	0	110.9
293	P	70	Confident	58.8	Low	111 Å²	111	128.1 Å²	128.1	72%	0.721	79%	0.79	S	S	*	*	P	Polyproline II helix	trans	-64.6	148.4	170.1	26.9	-32.3	0	0	0	110.6	G295	P293-G295 PolarHBondContact O-N 3.4Å
294	P	69.7	Low	59.6	Low	129 Å²	129	126.2 Å²	126.2	84%	0.838	79%	0.788	S	S	*	*	P	Polyproline II helix	trans	-59	124.7	179.6	-18.7	30	0	0	0	110.7
295	G	63.1	Low	60.8	Low	61 Å²	61	121.3 Å²	121.3	63%	0.629	78%	0.779	S	S	*	*	P	Polyproline II helix	trans	-61.4	153.8	173.4	0	0	0	0	0	111.8	P293	P293-G295 PolarHBondContact O-N 3.4Å
296	P	73.7	Confident	62.1	Low	124 Å²	124	123.5 Å²	123.5	81%	0.805	78%	0.781	S	S	*	*	P	Polyproline II helix	trans	-59	144.7	178.2	24.8	-32.9	0	0	0	110.8
297	P	73.1	Confident	63.2	Low	114 Å²	114	120.2 Å²	120.2	74%	0.74	78%	0.777	S	S	*	*	P	Polyproline II helix	trans	-61.3	145.9	-178	25.5	-33.6	0	0	0	111
298	P	73.9	Confident	63.9	Low	113 Å²	113	117.8 Å²	117.8	73%	0.734	77%	0.773	S	S	*	*	P	Polyproline II helix	trans	-60.1	145.2	176	26	-33.5	0	0	0	110.1	V300	P298-V300 PolarHBondContact O-N 3.08Å; P298-V300 VanDerWaalsContact O-N 3.14Å
299	P	65.5	Low	64.9	Low	121 Å²	121	117.6 Å²	117.6	79%	0.786	77%	0.771	S	S	*	*	P	Polyproline II helix	trans	-60.5	121.5	179	23.9	-31.5	0	0	0	109.3	P301	P299-P301 VanDerWaalsContact O-CD 3.31Å; P299-P301 WeakPolarHBondContact O-CD 3.29Å
300	V	62.3	Low	66.1	Low	112 Å²	112	114.1 Å²	114.1	68%	0.679	76%	0.76	S	S	*	*	P	Polyproline II helix	trans	-57.6	121	169.8	-80	0	0	0	0	109.1	P298 G302	P298-V300 PolarHBondContact O-N 3.08Å; P298-V300 VanDerWaalsContact O-N 3.14Å; V300-G302 PolarHBondContact O-N 3Å; V300-G302 VanDerWaalsContact O-N 3.08Å
301	P	57.8	Low	66.6	Low	140 Å²	140	116.5 Å²	116.5	91%	0.909	77%	0.765	S	S	*	*	T	Hydrogen-bonded Turn	trans	-66.6	109.2	171.1	-16.2	30.3	0	0	0	108.3	P299	P299-P301 VanDerWaalsContact O-CD 3.31Å; P299-P301 WeakPolarHBondContact O-CD 3.29Å
302	G	57.7	Low	66.6	Low	71 Å²	71	116 Å²	116	73%	0.732	76%	0.761	S	S	*	*	T	Hydrogen-bonded Turn	trans	151.2	-10	171.5	0	0	0	0	0	118	V300	V300-G302 PolarHBondContact O-N 3Å; V300-G302 VanDerWaalsContact O-N 3.08Å
303	Y	53.8	Low	66.7	Low	216 Å²	216	117.5 Å²	117.5	85%	0.847	76%	0.764	S	S	*	*			trans	-114.5	104.3	176.4	-83.2	-93.8	0	0	0	110.5
304	G	62.2	Low	65.8	Low	61 Å²	61	121.5 Å²	121.5	63%	0.629	77%	0.773	S	S	*	*	P	Polyproline II helix	trans	-63.5	156.9	170.3	0	0	0	0	0	111.5
305	P	66	Low	65.3	Low	121 Å²	121	118 Å²	118	79%	0.786	76%	0.76	S	S	*	*	P	Polyproline II helix	trans	-58.7	145.6	177.4	26.2	-33.5	0	0	0	110.5
306	P	70.1	Confident	65.6	Low	115 Å²	115	120.9 Å²	120.9	75%	0.747	77%	0.768	S	S	*	*	P	Polyproline II helix	trans	-59.5	146.2	178.9	25.2	-33.3	0	0	0	110.7	G308	P306-G308 PolarHBondContact O-N 3.4Å
307	P	71.4	Confident	65.4	Low	131 Å²	131	120.5 Å²	120.5	85%	0.851	77%	0.765	S	S	*	*	P	Polyproline II helix	trans	-59.9	128.4	177.4	-17.9	29.7	0	0	0	110.4
308	G	69	Low	65.2	Low	63 Å²	63	120.6 Å²	120.6	65%	0.649	77%	0.766	S	S	*	*	P	Polyproline II helix	trans	-61.8	156.9	173.2	0	0	0	0	0	112.2	P306	P306-G308 PolarHBondContact O-N 3.4Å
309	P	76.5	Confident	65	Low	122 Å²	122	120.6 Å²	120.6	79%	0.792	77%	0.766	S	S	*	*	P	Polyproline II helix	trans	-60.9	147.2	-179.6	25.4	-33.4	0	0	0	111.4
310	P	73.9	Confident	65	Low	114 Å²	114	121.1 Å²	121.1	74%	0.74	77%	0.769	S	S	*	*	P	Polyproline II helix	trans	-64.6	147	-179.3	27.4	-33.8	0	0	0	110.9
311	P	69.6	Low	65	Low	111 Å²	111	118.4 Å²	118.4	72%	0.721	76%	0.764	S	S	*	*	P	Polyproline II helix	trans	-59.7	143.4	172.6	26	-32.9	0	0	0	109.9	Q313	P311-Q313 PolarHBondContact O-N 3.5Å
312	P	67	Low	65	Low	121 Å²	121	117.9 Å²	117.9	79%	0.786	76%	0.761	S	S	*	*	P	Polyproline II helix	trans	-58.2	125.9	177.8	22.1	-30.9	0	0	0	109.7	Q314	P312-Q314 PolarHBondContact O-N 2.87Å
313	Q	54.9	Low	65	Low	197 Å²	197	124 Å²	124	92%	0.921	77%	0.767	S	S	*	*			trans	-56.5	112.5	171.9	-79.1	-170.6	44.8	0	0	108.5	P311 G315	P311-Q313 PolarHBondContact O-N 3.5Å; Q313-G315 PolarHBondContact O-N 2.9Å
314	Q	51.3	Low	65.8	Low	195 Å²	195	119.1 Å²	119.1	91%	0.911	76%	0.762	S	S	*	*			trans	-66.5	103.3	166.7	-70.8	178.1	1	0	0	107.2	P312	P312-Q314 PolarHBondContact O-N 2.87Å
315	G	57.8	Low	65.4	Low	56 Å²	56	122.2 Å²	122.2	58%	0.577	77%	0.772	S	S	*	*	P	Polyproline II helix	trans	-61.1	153.1	165.2	0	0	0	0	0	110.3	Q313	Q313-G315 PolarHBondContact O-N 2.9Å
316	P	70.2	Confident	65	Low	121 Å²	121	128 Å²	128	79%	0.786	78%	0.778	S	S	*	*	P	Polyproline II helix	trans	-60.4	146.1	179.3	25.6	-32.9	0	0	0	110.7
317	P	68.5	Low	64.8	Low	115 Å²	115	128.2 Å²	128.2	75%	0.747	78%	0.779	S	S	*	*	P	Polyproline II helix	trans	-60.8	141.1	-179.8	25.5	-33.7	0	0	0	110.7
318	P	70.4	Confident	63.7	Low	117 Å²	117	128.3 Å²	128.3	76%	0.76	78%	0.78	S	S	*	*	P	Polyproline II helix	trans	-63.9	145.4	174.7	26.8	-33	0	0	0	110.5
319	P	69	Low	62.7	Low	113 Å²	113	128.9 Å²	128.9	73%	0.734	79%	0.785	S	S	*	*	P	Polyproline II helix	trans	-65	147.9	179.7	26.8	-33.4	0	0	0	111.3	G321	P319-G321 PolarHBondContact O-N 2.92Å; P319-G321 VanDerWaalsContact O-N 3.13Å
320	P	65.7	Low	61.7	Low	131 Å²	131	129.3 Å²	129.3	85%	0.851	79%	0.788	S	S	*	*			trans	-62.2	115.4	176.8	-16.9	29.4	0	0	0	110.5
321	G	61.6	Low	60.3	Low	55 Å²	55	132.6 Å²	132.6	57%	0.567	80%	0.799	S	S	*	*	P	Polyproline II helix	trans	-70.9	153.3	170.6	0	0	0	0	0	111.8	P319	P319-G321 PolarHBondContact O-N 2.92Å; P319-G321 VanDerWaalsContact O-N 3.13Å
322	P	58.2	Low	59.5	Low	130 Å²	130	130.7 Å²	130.7	84%	0.844	80%	0.799	S	S	*	*	P	Polyproline II helix	trans	-74	128.4	-170.6	29.6	-32.8	0	0	0	111.9
323	F	57.9	Low	58.7	Low	198 Å²	198	131 Å²	131	87%	0.868	80%	0.801	S	S	*	*	P	Polyproline II helix	trans	-67.5	134.1	172.5	-69.1	-87.6	0	0	0	111.3
324	P	69.7	Low	58.2	Low	114 Å²	114	126.6 Å²	126.6	74%	0.74	79%	0.79	S	S	*	*	P	Polyproline II helix	trans	-75.4	147.8	164.9	30.3	-31.2	0	0	0	110.8
325	P	55.7	Low	57.9	Low	127 Å²	127	124.7 Å²	124.7	83%	0.825	79%	0.785	S	S	*	*	P	Polyproline II helix	trans	-76.9	131.4	-168.8	31.8	-33	0	0	0	111.1
326	R	57.6	Low	57.1	Low	242 Å²	242	127.4 Å²	127.4	91%	0.913	79%	0.79	S	S	*	*	P	Polyproline II helix	trans	-80	133.6	169.1	-111.4	175.9	176.5	-103.9	2.9	109.9
327	P	64.2	Low	55.5	Low	120 Å²	120	129.7 Å²	129.7	78%	0.779	80%	0.795	S	S	*	*	P	Polyproline II helix	trans	-74.8	152.5	179.7	28.7	-32.3	0	0	0	112.6
328	P	48.2	Very low	54.3	Low	133 Å²	133	128.4 Å²	128.4	86%	0.864	79%	0.794	S	S	*	*	P	Polyproline II helix	trans	-98.9	143.2	-170.4	35.4	-29.3	0	0	0	114.9
329	G	49.7	Very low	53.3	Low	74 Å²	74	128.6 Å²	128.6	76%	0.763	80%	0.795	S	S	*	*			trans	108.8	165.6	150.3	0	0	0	0	0	117.3
330	P	53.7	Low	53.2	Low	132 Å²	132	128.8 Å²	128.8	86%	0.857	80%	0.797	S	S	*	*			cis	-125.7	160.6	8.3	35.8	-18	0	0	0	116.2
331	L	45.3	Very low	52.6	Low	183 Å²	183	127 Å²	127	96%	0.958	79%	0.785	S	S	*	*			trans	-64.2	143.3	177.4	-67.1	145.5	0	0	0	113.2
332	G	52.1	Low	51.9	Low	71 Å²	71	132.9 Å²	132.9	73%	0.732	80%	0.797	S	S	*	*			trans	-143.6	145.1	164.3	0	0	0	0	0	110.8
333	P	51	Low	51.9	Low	127 Å²	127	134.5 Å²	134.5	83%	0.825	80%	0.798	S	S	*	*			trans	-97.6	169.7	-139.5	37.5	-34.6	0	0	0	115.5
334	P	43.7	Very low	51.6	Low	105 Å²	105	130.9 Å²	130.9	68%	0.682	79%	0.794	S	S	*	*			trans	-95.5	176.2	-169.2	36.2	-28.7	0	0	0	113.7
335	L	46.3	Very low	50.8	Low	154 Å²	154	128.7 Å²	128.7	81%	0.806	79%	0.792	S	S	*	*			trans	84.3	140.5	167.8	-47.1	178.1	0	0	0	113
336	T	39.8	Very low	51.1	Low	114 Å²	114	128.4 Å²	128.4	70%	0.699	79%	0.791	S	S	*	*			cis	-178.5	156.2	1.5	26.4	0	0	0	0	103.9
337	L	36.5	Very low	51.1	Low	168 Å²	168	122.4 Å²	122.4	88%	0.88	78%	0.783	S	S	*	*			trans	89.7	124.2	147.1	-134	69.8	0	0	0	119.7
338	A	43.2	Very low	50.5	Low	88 Å²	88	123.2 Å²	123.2	73%	0.727	79%	0.788	S	S	*	*			trans	94.4	123	147.5	0	0	0	0	0	119.1
339	P	51.2	Low	50.7	Low	121 Å²	121	120.6 Å²	120.6	79%	0.786	79%	0.786	S	S	*	*	P	Polyproline II helix	trans	-84.7	142.5	168.9	35.3	-29.5	0	0	0	110
340	P	66.8	Low	50.6	Low	118 Å²	118	121.5 Å²	121.5	77%	0.766	79%	0.786	S	S	*	*	P	Polyproline II helix	trans	-80.3	152.9	172.2	27.8	-24.2	0	0	0	111.6
341	P	52.2	Low	50.9	Low	93 Å²	93	120.6 Å²	120.6	60%	0.604	78%	0.78	S	S	*	*	P	Polyproline II helix	trans	-86	138	-168.8	22.5	-9.6	0	0	0	113	L343	P341-L343 PolarHBondContact O-N 3.15Å
342	H	46.5	Very low	51.9	Low	178 Å²	178	117.7 Å²	117.7	82%	0.824	77%	0.772	S	S	*	*			trans	5.2	107.4	145.1	45.9	-88.1	0	0	0	117.3
343	L	57.8	Low	52	Low	165 Å²	165	120.3 Å²	120.3	86%	0.864	78%	0.776	S	S	*	*			trans	-109.9	135.6	157.1	-81.5	166.9	0	0	0	109.7	P341	P341-L343 PolarHBondContact O-N 3.15Å
344	P	52.4	Low	52.3	Low	121 Å²	121	118 Å²	118	79%	0.786	77%	0.768	S	S	*	*	P	Polyproline II helix	trans	-75.9	128.7	-172.6	30.1	-31.3	0	0	0	110.7
345	G	52.3	Low	53	Low	68 Å²	68	118.5 Å²	118.5	70%	0.701	77%	0.771	S	S	*	*	P	Polyproline II helix	trans	-69	149.3	173.7	0	0	0	0	0	112.1
346	P	62.7	Low	53.5	Low	122 Å²	122	119.7 Å²	119.7	79%	0.792	77%	0.772	S	S	*	*	P	Polyproline II helix	trans	-71.6	151.9	175.5	30.9	-32.2	0	0	0	110.7
347	P	58.2	Low	54.5	Low	115 Å²	115	119.8 Å²	119.8	75%	0.747	77%	0.772	S	S	*	*	P	Polyproline II helix	trans	-68	152.8	-175.6	29	-34.6	0	0	0	112	G349	P347-G349 PolarHBondContact O-N 3.21Å
348	P	52.1	Low	55.6	Low	137 Å²	137	116.9 Å²	116.9	89%	0.89	76%	0.758	S	S	*	*	S	Bend	trans	-73.3	123.2	-178.9	30	-31.8	0	0	0	110.2
349	G	50.5	Low	56.5	Low	79 Å²	79	118 Å²	118	81%	0.814	76%	0.758	S	S	*	*			trans	153.9	3.4	169.7	0	0	0	0	0	119.2	P347	P347-G349 PolarHBondContact O-N 3.21Å
350	A	48.5	Very low	56.7	Low	93 Å²	93	116.2 Å²	116.2	77%	0.769	75%	0.753	S	S	*	*			trans	-104.5	133	-178.4	0	0	0	0	0	112.5
351	P	60	Low	56.2	Low	113 Å²	113	119.4 Å²	119.4	73%	0.734	76%	0.755	S	S	*	*	P	Polyproline II helix	trans	-67.5	149.8	174.8	29.8	-33.4	0	0	0	110.5
352	P	66.2	Low	56.5	Low	121 Å²	121	123 Å²	123	79%	0.786	76%	0.762	S	S	*	*	P	Polyproline II helix	trans	-63	138.6	178.4	26.6	-33.2	0	0	0	110.5	A354	P352-A354 PolarHBondContact O-N 3.08Å
353	P	54	Low	57.3	Low	127 Å²	127	119.9 Å²	119.9	83%	0.825	76%	0.757	S	S	*	*	P	Polyproline II helix	trans	-69.9	126.9	179.1	28.8	-31.9	0	0	0	109.8
354	A	58.3	Low	57.4	Low	79 Å²	79	117.3 Å²	117.3	65%	0.653	75%	0.751	S	S	*	*	P	Polyproline II helix	trans	-58.6	152.2	175	0	0	0	0	0	111.6	P352 H356	P352-A354 PolarHBondContact O-N 3.08Å; A354-H356 PolarHBondContact O-N 3.02Å
355	P	57.6	Low	57.7	Low	114 Å²	114	117.6 Å²	117.6	74%	0.74	75%	0.752	S	S	*	*			trans	-65.1	112.6	174.5	29	-31.9	0	0	0	108	V357	P355-V357 PolarHBondContact O-N 3.18Å
356	H	56.9	Low	57.5	Low	179 Å²	179	120.6 Å²	120.6	83%	0.829	76%	0.757	S	S	*	*			trans	-69	95.7	174.6	50.4	-74.1	0	0	0	107.8	A354 N358	A354-H356 PolarHBondContact O-N 3.02Å; H356-N358 PolarHBondContact O-N 3.3Å
357	V	61.5	Low	56.3	Low	116 Å²	116	122.6 Å²	122.6	70%	0.703	76%	0.761	S	S	*	*			trans	-71.9	119.2	170.4	-179	0	0	0	0	107.5	P355	P355-V357 PolarHBondContact O-N 3.18Å
358	N	58.3	Low	55.6	Low	108 Å²	108	122.2 Å²	122.2	58%	0.578	76%	0.761	S	S	*	*			trans	-60.6	121.9	-175.6	-163.6	-6.5	0	0	0	110.6	H356 A360	H356-N358 PolarHBondContact O-N 3.3Å; N358-A360 PolarHBondContact O-N 3.1Å
359	P	62.4	Low	54.9	Low	112 Å²	112	119.2 Å²	119.2	73%	0.727	76%	0.755	S	S	*	*	G	3₁₀ helix	trans	-66.6	-6.8	-178.4	-14.4	27.2	0	0	0	113.9	F361	P359-F361 PolarHBondContact O-N 3.11Å
360	A	55.6	Low	54.4	Low	83 Å²	83	124.5 Å²	124.5	69%	0.686	76%	0.761	S	S	*	*	G	3₁₀ helix	trans	-72.4	-2.5	-179.8	0	0	0	0	0	114.8	N358	N358-A360 PolarHBondContact O-N 3.1Å
361	F	55.8	Low	54.3	Low	184 Å²	184	126 Å²	126	81%	0.807	76%	0.763	S	S	*	*	G	3₁₀ helix	trans	-99.7	3.6	-179.2	-106	-95.6	0	0	0	115.2	P359	P359-F361 PolarHBondContact O-N 3.11Å
362	F	58.1	Low	53.2	Low	169 Å²	169	126.6 Å²	126.6	74%	0.741	77%	0.765	S	S	*	*			trans	-117.5	119.5	177.3	-79.4	-86.8	0	0	0	111.6
363	P	64.3	Low	52.2	Low	112 Å²	112	126 Å²	126	73%	0.727	76%	0.763	S	S	*	*			trans	-72.2	136.2	167.7	30.4	-30.6	0	0	0	109.3
364	P	59.3	Low	51.4	Low	112 Å²	112	126.2 Å²	126.2	73%	0.727	76%	0.757	S	S	*	*			trans	-77.5	135.9	-179.5	30.5	-32	0	0	0	110.6	T366	P364-T366 PolarHBondContact O-N 3.28Å
365	P	58.6	Low	50.6	Low	126 Å²	126	127.2 Å²	127.2	82%	0.818	76%	0.76	S	S	*	*			trans	-75	115.4	165	29	-28.3	0	0	0	108.7	N367	P365-N367 PolarHBondContact O-N 3.04Å
366	T	48.9	Very low	49.8	Very low	131 Å²	131	133.9 Å²	133.9	80%	0.804	77%	0.77	S	S	*	*			trans	-59.6	116.8	174.8	49.9	0	0	0	0	110.9	P364	P364-T366 PolarHBondContact O-N 3.28Å
367	N	37.9	Very low	49.1	Very low	165 Å²	165	128.6 Å²	128.6	88%	0.882	76%	0.764	S	S	*	*			trans	-115.4	99.3	163.1	-170.6	25.2	0	0	0	107.9	P365	P365-N367 PolarHBondContact O-N 3.04Å
368	S	42.3	Very low	48.8	Very low	107 Å²	107	129 Å²	129	75%	0.748	77%	0.769	S	S	*	*			trans	-162.6	115.4	174.8	50.7	0	0	0	0	110.9
369	G	38.3	Very low	49	Very low	74 Å²	74	129.8 Å²	129.8	76%	0.763	78%	0.78	S	S	*	*			trans	107	95.2	140.9	0	0	0	0	0	117
370	M	40.5	Very low	48.4	Very low	190 Å²	190	130.2 Å²	130.2	94%	0.936	78%	0.782	S	S	*	*			trans	-52	154	152.1	-74	160.7	156.8	0	0	111
371	P	44.8	Very low	47.9	Very low	124 Å²	124	132.2 Å²	132.2	81%	0.805	79%	0.786	S	S	*	*				-140.2	162.8	102.4	33.4	-16.8	0	0	0	115
372	T	37.7	Very low	47.5	Very low	126 Å²	126	131.1 Å²	131.1	77%	0.773	79%	0.789	S	S	*	*			trans	-61.6	162.4	177.6	48.5	0	0	0	0	115.7
373	S	44.5	Very low	46.9	Very low	107 Å²	107	126.7 Å²	126.7	75%	0.748	78%	0.777	S	S	*	*			trans	106.3	132.8	170.5	-50.7	0	0	0	0	111.4
374	D	37.9	Very low	46.1	Very low	133 Å²	133	132.4 Å²	132.4	71%	0.711	79%	0.786	S	S	*	*			cis	-172.3	152.3	2.4	-129.9	-61.6	0	0	0	106.8
375	S	40.9	Very low	45.4	Very low	100 Å²	100	130.9 Å²	130.9	70%	0.699	79%	0.79	S	S	*	*			trans	65.6	93	143.7	-61.7	0	0	0	0	120.9
376	R	41.1	Very low	44.8	Very low	254 Å²	254	136.4 Å²	136.4	96%	0.958	80%	0.795	S	S	*	*				173.3	109.5	118.9	-108.7	169.9	166.8	158	-2.8	112.3
377	G	42	Very low	44.9	Very low	67 Å²	67	135.6 Å²	135.6	69%	0.691	79%	0.791	S	S	*	*	P	Polyproline II helix	trans	-81.3	170.8	175.4	0	0	0	0	0	114.4
378	P	54.9	Low	45.7	Very low	126 Å²	126	132.8 Å²	132.8	82%	0.818	78%	0.783	S	S	*	*	P	Polyproline II helix	trans	-85.2	142.9	177.8	34.1	-30.1	0	0	0	111
379	P	64	Low	46.1	Very low	123 Å²	123	132.1 Å²	132.1	80%	0.799	78%	0.775	S	S	*	*	P	Polyproline II helix	trans	-82.2	156.4	172	33.4	-31.1	0	0	0	111.6
380	P	49.3	Very low	46.5	Very low	121 Å²	121	138.1 Å²	138.1	79%	0.786	78%	0.777	S	S	*	*	P	Polyproline II helix	trans	-99.3	160.5	-159.8	34.3	-23.7	0	0	0	114.5
381	T	45.1	Very low	46.7	Very low	125 Å²	125	136.8 Å²	136.8	77%	0.767	77%	0.773	S	S	*	*			trans	-15.9	130.5	162.2	-43.6	0	0	0	0	117.3	P383	T381-P383 HydrophobicContact CG2-CG 4.38Å
382	D	47.6	Very low	46.5	Very low	161 Å²	161	142.1 Å²	142.1	86%	0.861	78%	0.777	S	S	*	*			trans	-117.9	109	154.1	-138.5	-11	0	0	0	109.4
383	P	44.7	Very low	46.8	Very low	77 Å²	77	139.4 Å²	139.4	50%	0.5	78%	0.775	S	S	.	*			trans	-91	145.3	170.8	33.1	-22.7	0	0	0	109.2	T381	T381-P383 HydrophobicContact CG2-CG 4.38Å
384	Y	47.8	Very low	46.6	Very low	232 Å²	232	141.1 Å²	141.1	91%	0.91	78%	0.775	S	S	*	*			trans	87.5	101.3	178	-56.7	-84.2	0	0	0	117.2
385	G	44.2	Very low	46.9	Very low	79 Å²	79	146.1 Å²	146.1	81%	0.814	79%	0.786	S	S	*	*				103.1	103.4	129.8	0	0	0	0	0	116.1
386	R	46.8	Very low	46.9	Very low	243 Å²	243	143.9 Å²	143.9	92%	0.917	78%	0.779	S	S	*	*				160	104.2	115.4	-170.8	171.8	-156.3	-105.5	2.7	112
387	P	50.2	Low	47.3	Very low	113 Å²	113	137.4 Å²	137.4	73%	0.734	77%	0.77	S	S	*	*			trans	-92.3	-178.6	152.4	38.7	-28.9	0	0	0	108.8
388	P	54	Low	47.8	Very low	107 Å²	107	140.5 Å²	140.5	70%	0.695	78%	0.778	S	S	*	*			cis	-130.9	-153.5	1.4	47	-26.6	0	0	0	109.6	Y390	P388-Y390 HydrophobicContact CG-CE1 4.38Å
389	P	51.2	Low	47	Very low	92 Å²	92	137.5 Å²	137.5	60%	0.597	77%	0.77	S	S	*	*			cis	-131.8	142.7	37	31.3	-8.4	0	0	0	116.8
390	Y	46.1	Very low	45.9	Very low	201 Å²	201	143.3 Å²	143.3	79%	0.788	78%	0.776	S	S	*	*			trans	-5.4	116.5	144.7	44.9	-87.1	0	0	0	117.2	P388	P388-Y390 HydrophobicContact CG-CE1 4.38Å
391	D	46.7	Very low	45.4	Very low	161 Å²	161	146 Å²	146	86%	0.861	78%	0.778	S	S	*	*			trans	-150.8	130.6	142.8	-143.2	-49.2	0	0	0	108.7
392	R	40.6	Very low	45.2	Very low	236 Å²	236	148.4 Å²	148.4	89%	0.891	78%	0.782	S	S	*	*			trans	77.7	78.8	175.2	-137.1	168.5	-156.3	156.1	5.1	119.1
393	G	42.8	Very low	44.7	Very low	70 Å²	70	148.2 Å²	148.2	72%	0.722	78%	0.781	S	S	*	*			trans	-69.4	172.7	137	0	0	0	0	0	110.2
394	D	41.5	Very low	44.6	Very low	143 Å²	143	150 Å²	150	77%	0.765	79%	0.791	S	S	*	*			cis	-165.5	110.1	-8.4	178.7	51	0	0	0	103.4
395	Y	43.9	Very low	44.3	Very low	237 Å²	237	143.2 Å²	143.2	93%	0.929	78%	0.783	S	S	*	*			trans	-163.2	79.5	150.6	-100.6	-72.9	0	0	0	103.9
396	G	40.1	Very low	44.5	Very low	54 Å²	54	147.3 Å²	147.3	56%	0.557	77%	0.774	S	S	*	*			trans	-69	156.1	179.9	0	0	0	0	0	112.4
397	P	50.3	Low	45.2	Very low	118 Å²	118	141 Å²	141	77%	0.766	76%	0.762	S	S	*	*			trans	-85.6	130.4	-174.9	33.5	-29.6	0	0	0	110.3	G399	P397-G399 PolarHBondContact O-N 3.2Å
398	P	51.5	Low	45.8	Very low	132 Å²	132	141.5 Å²	141.5	86%	0.857	77%	0.766	S	S	*	*	S	Bend	trans	-82	112.5	160	31	-25.1	0	0	0	107.8
399	G	37.7	Very low	46.5	Very low	63 Å²	63	138.6 Å²	138.6	65%	0.649	74%	0.744	S	S	*	*			trans	75.8	83.6	157.1	0	0	0	0	0	115.8	P397 E401	P397-G399 PolarHBondContact O-N 3.2Å; G399-E401 PolarHBondContact O-N 2.9Å
400	R	42.7	Very low	47.9	Very low	245 Å²	245	136.9 Å²	136.9	93%	0.925	73%	0.734	S	S	*	*			trans	-63.2	79.7	135.3	-76.1	-177.9	175.4	170.6	-1.5	106.7	M402	R400-M402 PolarHBondContact O-N 3.42Å; R400-M402 VanDerWaalsContact O-N 3.16Å
401	E	37.3	Very low	49.7	Very low	178 Å²	178	135.3 Å²	135.3	83%	0.832	73%	0.734	S	S	*	*			trans	-57.8	118.7	149.3	-81.8	-172	157.4	0	0	104.6	G399 D403	G399-E401 PolarHBondContact O-N 2.9Å; E401-D403 PolarHBondContact O-N 3.21Å
402	M	41.9	Very low	51.6	Low	174 Å²	174	131 Å²	131	86%	0.857	72%	0.721	S	S	*	*			trans	-58.7	85.3	173.7	-77.2	174.9	164.4	0	0	107.7	R400 T404	R400-M402 PolarHBondContact O-N 3.42Å; R400-M402 VanDerWaalsContact O-N 3.16Å; M402-T404 PolarHBondContact O-N 2.85Å
403	D	37.4	Very low	53.8	Low	157 Å²	157	124.3 Å²	124.3	84%	0.84	70%	0.7	S	S	*	*			trans	-54.5	95.8	145.4	-89.3	-47.3	0	0	0	104.2	E401 A405	E401-D403 PolarHBondContact O-N 3.21Å; D403-A405 PolarHBondContact O-N 2.83Å
404	T	41.9	Very low	55.9	Low	115 Å²	115	123.2 Å²	123.2	71%	0.706	68%	0.675	S	S	*	*			trans	-62.5	83.4	166.7	-58.7	0	0	0	0	103.4	M402 R406	M402-T404 PolarHBondContact O-N 2.85Å; T404-R406 PolarHBondContact O-N 2.83Å
405	A	41.6	Very low	58.2	Low	89 Å²	89	121.9 Å²	121.9	74%	0.736	67%	0.665	S	S	*	*			trans	-53.1	96.6	171.2	0	0	0	0	0	104.3	D403 T407	D403-A405 PolarHBondContact O-N 2.83Å; A405-T407 VanDerWaalsContact C-N 3.32Å; A405-T407 PolarHBondContact O-N 3.5Å
406	R	49.3	Very low	60.4	Low	166 Å²	166	116.2 Å²	116.2	63%	0.626	65%	0.646	S	S	*	*			trans	-57.2	102	-174.8	-78.7	167.1	122.3	147.5	-3.5	104.8	T404 P408 K459	T404-R406 PolarHBondContact O-N 2.83Å; R406-P408 VanDerWaalsContact O-N 3.17Å; R406-K459 PolarHBondContact NH2-O 2.79Å
407	T	60.2	Low	62.8	Low	110 Å²	110	114.6 Å²	114.6	68%	0.675	63%	0.625	S	S	*	*	P	Polyproline II helix	trans	-49.1	124.6	155.6	29.3	0	0	0	0	105.6	A405 L409	A405-T407 VanDerWaalsContact C-N 3.32Å; A405-T407 PolarHBondContact O-N 3.5Å; T407-L409 PolarHBondContact O-N 3.13Å
408	P	64.3	Low	64.6	Low	124 Å²	124	109.3 Å²	109.3	81%	0.805	59%	0.59	S	S	*	*	P	Polyproline II helix	trans	-54.7	118	174.4	22.4	-30.9	0	0	0	106	R406 S410	R406-P408 VanDerWaalsContact O-N 3.17Å; P408-S410 PolarHBondContact O-N 3.46Å
409	L	68	Low	66.6	Low	46 Å²	46	106.5 Å²	106.5	24%	0.241	57%	0.568	C	S	.	*	P	Polyproline II helix	trans	-54.5	133.9	177.4	-68.4	166.8	0	0	0	107.2	T407 F414 I417 K459 V460	T407-L409 PolarHBondContact O-N 3.13Å; L409-F414 HydrophobicContact CB-CB 4.47Å; L409-I417 HydrophobicContact CD1-CD1 4.3Å; L409-I417 HydrophobicContact CD2-CD1 4.39Å; L409-K459 HydrophobicContact CD1-CB 3.75Å; L409-K459 HydrophobicContact CD2-CB 4.43Å; L409-K459 HydrophobicContact CD2-CD 3.76Å; L409-V460 HydrophobicContact CD1-CG2 3.83Å
410	S	80.1	Confident	69.2	Low	56 Å²	56	109 Å²	109	39%	0.392	56%	0.558	S	S	.	*	P	Polyproline II helix	trans	-59.1	148.1	170.7	63.4	0	0	0	0	109	P408 A412 E413 F414	P408-S410 PolarHBondContact O-N 3.46Å; S410-A412 PolarHBondContact O-N 2.85Å; S410-A412 VanDerWaalsContact O-N 3.15Å; S410-E413 WeakPolarHBondContact CB-OE2 3.37Å; S410-E413 PolarHBondContact N-OE2 2.97Å; S410-E413 PolarHBondContact O-N 2.85Å; S410-E413 WeakPolarHBondContact OG-CB 3.19Å; S410-E413 VanDerWaalsContact OG-CD 3.23Å; S410-E413 WeakPolarHBondContact OG-CG 3.14Å; S410-E413 PolarHBondContact OG-N 3.22Å; S410-E413 PolarHBondContact OG-OE2 3.43Å; S410-F414 PolarHBondContact O-N 2.86Å
411	E	83.3	Confident	71.6	Confident	167 Å²	167	97.6 Å²	97.6	78%	0.78	52%	0.515	S	S	*	.	H	α-helix	trans	-57.4	-32.8	-178.2	-173.9	144.9	-167.5	0	0	112	F414 E415	E411-F414 PolarHBondContact O-N 3.09Å; E411-E415 WeakPolarHBondContact O-CB 3.31Å; E411-E415 PolarHBondContact O-N 3.4Å
412	A	86.6	Confident	74.3	Confident	72 Å²	72	95 Å²	95	60%	0.595	50%	0.498	S	S	*	.	H	α-helix	trans	-64.3	-45.6	172.6	0	0	0	0	0	113	S410 E415 E416	S410-A412 PolarHBondContact O-N 2.85Å; S410-A412 VanDerWaalsContact O-N 3.15Å; A412-E415 PolarHBondContact O-N 2.85Å; A412-E416 WeakPolarHBondContact O-CB 3.35Å; A412-E416 PolarHBondContact O-N 2.88Å
413	E	87.9	Confident	76.8	Confident	94 Å²	94	89.3 Å²	89.3	44%	0.439	48%	0.478	S	S	.	.	H	α-helix	trans	-66.6	-38.6	176.6	-72.9	167.4	129.7	0	0	111.7	S410 E416 I417	S410-E413 WeakPolarHBondContact CB-OE2 3.37Å; S410-E413 PolarHBondContact N-OE2 2.97Å; S410-E413 PolarHBondContact O-N 2.85Å; S410-E413 WeakPolarHBondContact OG-CB 3.19Å; S410-E413 VanDerWaalsContact OG-CD 3.23Å; S410-E413 WeakPolarHBondContact OG-CG 3.14Å; S410-E413 PolarHBondContact OG-N 3.22Å; S410-E413 PolarHBondContact OG-OE2 3.43Å; E413-E416 PolarHBondContact O-N 2.82Å; E413-I417 WeakPolarHBondContact O-CB 3.45Å; E413-I417 WeakPolarHBondContact O-CD1 3.41Å; E413-I417 WeakPolarHBondContact O-CG1 3.4Å; E413-I417 PolarHBondContact O-N 3.01Å
414	F	87.6	Confident	79.5	Confident	47 Å²	47	84.3 Å²	84.3	21%	0.206	45%	0.451	C	S	.	.	H	α-helix	trans	-61	-47.4	175.3	175.7	-86.3	0	0	0	111	L409 S410 E411 I417 M418 V460 D463	L409-F414 HydrophobicContact CB-CB 4.47Å; S410-F414 PolarHBondContact O-N 2.86Å; E411-F414 PolarHBondContact O-N 3.09Å; F414-I417 PolarHBondContact O-N 2.84Å; F414-M418 VanDerWaalsContact O-CB 3.32Å; F414-M418 WeakPolarHBondContact O-CB 3.47Å; F414-M418 PolarHBondContact O-N 2.92Å; F414-V460 HydrophobicContact CD2-CB 4.4Å; F414-V460 HydrophobicContact CD2-CG1 3.67Å; F414-V460 HydrophobicContact CD2-CG2 3.82Å; F414-V460 HydrophobicContact CE2-CB 4.37Å; F414-V460 HydrophobicContact CE2-CG1 3.25Å; F414-V460 HydrophobicContact CE2-CG2 4.28Å; F414-V460 HydrophobicContact CG-CG2 4.49Å; F414-V460 HydrophobicContact CZ-CG1 3.81Å; F414-D463 HydrophobicContact CE2-CB 4.1Å; F414-D463 HydrophobicContact CZ-CB 4.18Å; F414-D463 WeakPolarHBondContact CZ-OD1 3.38Å
415	E	89.1	Confident	82	Confident	116 Å²	116	79 Å²	79	54%	0.542	42%	0.418	S	S	.	.	H	α-helix	trans	-65.8	-40.9	179.3	-172.3	171.4	-166.2	0	0	112	E411 A412 M418 N419	E411-E415 WeakPolarHBondContact O-CB 3.31Å; E411-E415 PolarHBondContact O-N 3.4Å; A412-E415 PolarHBondContact O-N 2.85Å; E415-M418 PolarHBondContact O-N 3.12Å; E415-N419 WeakPolarHBondContact O-CB 3.37Å; E415-N419 VanDerWaalsContact O-CG 3.31Å; E415-N419 PolarHBondContact O-N 3.42Å; E415-N419 PolarHBondContact O-ND2 3.47Å
416	E	90.5	Very high	84.5	Confident	117 Å²	117	78.2 Å²	78.2	55%	0.547	41%	0.408	S	S	.	.	H	α-helix	trans	-62.8	-46.3	175.9	-162.4	-159.6	137.3	0	0	111.5	A412 E413 M418 N419 R420	A412-E416 WeakPolarHBondContact O-CB 3.35Å; A412-E416 PolarHBondContact O-N 2.88Å; E413-E416 PolarHBondContact O-N 2.82Å; E416-M418 VanDerWaalsContact C-N 3.33Å; E416-M418 PolarHBondContact O-N 3.2Å; E416-N419 PolarHBondContact O-N 3.27Å; E416-R420 WeakPolarHBondContact O-CB 3.26Å; E416-R420 PolarHBondContact O-N 3.18Å; E416-R420 IonicContact OE1-CZ 3.85Å; E416-R420 IonicContact OE1-NH2 2.76Å; E416-R420 PolarHBondContact OE1-NH2 3.43Å
417	I	90.4	Very high	86.7	Confident	20 Å²	20	73 Å²	73	10%	0.103	40%	0.397	C	S	.	.	H	α-helix	trans	-62.4	-41.3	176.3	-66.5	163.7	0	0	0	110.6	L409 E413 F414 R420 N421 V460	L409-I417 HydrophobicContact CD1-CD1 4.3Å; L409-I417 HydrophobicContact CD2-CD1 4.39Å; E413-I417 WeakPolarHBondContact O-CB 3.45Å; E413-I417 WeakPolarHBondContact O-CD1 3.41Å; E413-I417 WeakPolarHBondContact O-CG1 3.4Å; E413-I417 PolarHBondContact O-N 3.01Å; F414-I417 PolarHBondContact O-N 2.84Å; I417-R420 WeakPolarHBondContact O-CB 3.38Å; I417-R420 PolarHBondContact O-N 3.34Å; I417-N421 WeakPolarHBondContact O-CB 3.42Å; I417-N421 VanDerWaalsContact O-CG 3.3Å; I417-N421 PolarHBondContact O-N 3.47Å; I417-V460 HydrophobicContact CB-CG2 3.84Å; I417-V460 HydrophobicContact CD1-CG2 4.14Å; I417-V460 HydrophobicContact CG2-CB 4.06Å; I417-V460 HydrophobicContact CG2-CG2 3.52Å
418	M	88.4	Confident	88.4	Confident	7 Å²	7	68.1 Å²	68.1	3%	0.034	37%	0.367	C	S	.	.	H	α-helix	trans	-68.1	-40.4	-179.9	-172.7	60.2	-160.7	0	0	112.3	F414 E415 E416 R420 N421 R422 R465 C466 L469	F414-M418 VanDerWaalsContact O-CB 3.32Å; F414-M418 WeakPolarHBondContact O-CB 3.47Å; F414-M418 PolarHBondContact O-N 2.92Å; E415-M418 PolarHBondContact O-N 3.12Å; E416-M418 VanDerWaalsContact C-N 3.33Å; E416-M418 PolarHBondContact O-N 3.2Å; M418-R420 VanDerWaalsContact C-N 3.3Å; M418-R420 PolarHBondContact O-N 2.7Å; M418-N421 PolarHBondContact O-N 3.22Å; M418-R422 WeakPolarHBondContact O-CB 3.49Å; M418-R422 PolarHBondContact O-N 2.95Å; M418-R465 HydrophobicContact CE-CB 3.58Å; M418-R465 HydrophobicContact SD-CB 4.14Å; M418-C466 PolarHBondContact SD-SG 3.29Å; M418-L469 HydrophobicContact CE-CD1 3.43Å; M418-L469 VanDerWaalsContact CE-CD1 3.43Å; M418-L469 HydrophobicContact CE-CG 4.08Å; M418-L469 HydrophobicContact SD-CD1 4.33Å
419	N	92.4	Very high	89.8	Confident	74 Å²	74	64.4 Å²	64.4	40%	0.396	34%	0.34	S	S	.	.	H	α-helix	trans	-63	-39.7	173.9	-75.5	-28	0	0	0	111.1	E415 E416 R422 A423	E415-N419 WeakPolarHBondContact O-CB 3.37Å; E415-N419 VanDerWaalsContact O-CG 3.31Å; E415-N419 PolarHBondContact O-N 3.42Å; E415-N419 PolarHBondContact O-ND2 3.47Å; E416-N419 PolarHBondContact O-N 3.27Å; N419-R422 PolarHBondContact O-N 3.09Å; N419-R422 PolarHBondContact OD1-NH1 3.48Å; N419-A423 PolarHBondContact O-N 3.07Å
420	R	92.8	Very high	91.1	Very high	115 Å²	115	65.6 Å²	65.6	43%	0.434	35%	0.352	S	S	.	.	H	α-helix	trans	-62.3	-46.9	172.9	-147.1	-175.9	-55.5	114.5	-1.2	111.6	E416 I417 M418 R422 A423 I424	E416-R420 WeakPolarHBondContact O-CB 3.26Å; E416-R420 PolarHBondContact O-N 3.18Å; E416-R420 IonicContact OE1-CZ 3.85Å; E416-R420 IonicContact OE1-NH2 2.76Å; E416-R420 PolarHBondContact OE1-NH2 3.43Å; I417-R420 WeakPolarHBondContact O-CB 3.38Å; I417-R420 PolarHBondContact O-N 3.34Å; M418-R420 VanDerWaalsContact C-N 3.3Å; M418-R420 PolarHBondContact O-N 2.7Å; R420-R422 VanDerWaalsContact C-N 3.33Å; R420-R422 PolarHBondContact O-N 2.85Å; R420-A423 PolarHBondContact O-N 2.97Å; R420-I424 HydrophobicContact CG-CD1 4.45Å; R420-I424 VanDerWaalsContact O-CG1 3.29Å; R420-I424 WeakPolarHBondContact O-CG1 3.46Å; R420-I424 PolarHBondContact O-N 2.81Å
421	N	92.7	Very high	91.8	Very high	5 Å²	5	70.7 Å²	70.7	3%	0.027	36%	0.363	C	S	.	.	H	α-helix	trans	-62.2	-38.9	177.3	-74.1	-10.4	0	0	0	112.2	I417 M418 I424 S425 I455 S458 C466 L469	I417-N421 WeakPolarHBondContact O-CB 3.42Å; I417-N421 VanDerWaalsContact O-CG 3.3Å; I417-N421 PolarHBondContact O-N 3.47Å; M418-N421 PolarHBondContact O-N 3.22Å; N421-I424 PolarHBondContact O-N 3.24Å; N421-S425 WeakPolarHBondContact O-CB 3.45Å; N421-S425 PolarHBondContact O-N 3.19Å; N421-S425 PolarHBondContact O-OG 3.04Å; N421-I455 HydrophobicContact CB-CG1 4.34Å; N421-S458 PolarHBondContact ND2-OG 2.7Å; N421-C466 PolarHBondContact ND2-SG 3.18Å; N421-C466 VanDerWaalsContact ND2-SG 3.4Å; N421-L469 HydrophobicContact CB-CD1 4.08Å
422	R	93.8	Very high	92.4	Very high	125 Å²	125	62.7 Å²	62.7	47%	0.472	33%	0.326	S	S	.	.	H	α-helix	trans	-63.7	-41.6	175.6	-165.4	-176.6	-72.5	135.4	-5.8	111.2	M418 N419 R420 S426 L469	M418-R422 WeakPolarHBondContact O-CB 3.49Å; M418-R422 PolarHBondContact O-N 2.95Å; N419-R422 PolarHBondContact O-N 3.09Å; N419-R422 PolarHBondContact OD1-NH1 3.48Å; R420-R422 VanDerWaalsContact C-N 3.33Å; R420-R422 PolarHBondContact O-N 2.85Å; R422-S426 PolarHBondContact O-N 2.86Å; R422-S426 PolarHBondContact O-OG 3.31Å; R422-L469 HydrophobicContact CB-CD1 4.5Å
423	A	94.4	Very high	92.7	Very high	54 Å²	54	63 Å²	63	45%	0.446	32%	0.32	S	S	.	.	H	α-helix	trans	-68.3	-41.1	175.5	0	0	0	0	0	113	N419 R420 S425 S426 S427	N419-A423 PolarHBondContact O-N 3.07Å; R420-A423 PolarHBondContact O-N 2.97Å; A423-S425 VanDerWaalsContact C-N 3.34Å; A423-S426 PolarHBondContact O-OG 2.88Å; A423-S427 WeakPolarHBondContact O-CB 3.18Å; A423-S427 PolarHBondContact O-N 3.5Å
424	I	93.8	Very high	92.9	Very high	51 Å²	51	61.4 Å²	61.4	26%	0.262	32%	0.319	S	S	.	.	H	α-helix	trans	-61.6	-45.5	174.9	-68.4	165	0	0	0	109.9	R420 N421 A428 A451	R420-I424 HydrophobicContact CG-CD1 4.45Å; R420-I424 VanDerWaalsContact O-CG1 3.29Å; R420-I424 WeakPolarHBondContact O-CG1 3.46Å; R420-I424 PolarHBondContact O-N 2.81Å; N421-I424 PolarHBondContact O-N 3.24Å; I424-A428 WeakPolarHBondContact O-CB 3.18Å; I424-A428 PolarHBondContact O-N 3.07Å; I424-A451 HydrophobicContact CG2-CB 4.08Å
425	S	94.9	Very high	93.1	Very high	4 Å²	4	61.3 Å²	61.3	3%	0.028	32%	0.321	C	S	.	.	H	α-helix	trans	-61.5	-51	179.3	-54.9	0	0	0	0	111.6	N421 A423 S427 A428 I429 I455	N421-S425 WeakPolarHBondContact O-CB 3.45Å; N421-S425 PolarHBondContact O-N 3.19Å; N421-S425 PolarHBondContact O-OG 3.04Å; A423-S425 VanDerWaalsContact C-N 3.34Å; S425-S427 PolarHBondContact O-N 2.94Å; S425-A428 PolarHBondContact O-N 3.3Å; S425-I429 VanDerWaalsContact O-CG1 3.27Å; S425-I429 WeakPolarHBondContact O-CG1 3.34Å; S425-I429 PolarHBondContact O-N 3.16Å; S425-I455 WeakPolarHBondContact OG-CD1 3.31Å
426	S	94.6	Very high	93.2	Very high	73 Å²	73	56.5 Å²	56.5	51%	0.51	30%	0.301	S	S	.	.	H	α-helix	trans	-66.2	-39.3	-179	63.4	0	0	0	0	112.5	R422 A423 S430	R422-S426 PolarHBondContact O-N 2.86Å; R422-S426 PolarHBondContact O-OG 3.31Å; A423-S426 PolarHBondContact O-OG 2.88Å; S426-S430 WeakPolarHBondContact O-CB 3.24Å; S426-S430 PolarHBondContact O-N 3.32Å
427	S	95	Very high	93.1	Very high	57 Å²	57	55.9 Å²	55.9	40%	0.399	31%	0.309	S	S	.	.	H	α-helix	trans	-65.1	-43	176.3	-175.6	0	0	0	0	111.9	A423 S425 S430 R431	A423-S427 WeakPolarHBondContact O-CB 3.18Å; A423-S427 PolarHBondContact O-N 3.5Å; S425-S427 PolarHBondContact O-N 2.94Å; S427-S430 PolarHBondContact O-N 3.37Å; S427-R431 PolarHBondContact O-N 3.42Å
428	A	95.6	Very high	93.1	Very high	6 Å²	6	58.5 Å²	58.5	5%	0.05	33%	0.334	C	S	.	.	H	α-helix	trans	-65.4	-43.7	178.2	0	0	0	0	0	112.1	I424 S425 R431 A432 T447 A451 L473	I424-A428 WeakPolarHBondContact O-CB 3.18Å; I424-A428 PolarHBondContact O-N 3.07Å; S425-A428 PolarHBondContact O-N 3.3Å; A428-R431 PolarHBondContact O-N 3.46Å; A428-A432 WeakPolarHBondContact O-CB 3.35Å; A428-A432 PolarHBondContact O-N 3.01Å; A428-T447 HydrophobicContact CB-CG2 4.2Å; A428-A451 HydrophobicContact CB-CB 3.41Å; A428-A451 VanDerWaalsContact CB-CB 3.41Å; A428-L473 HydrophobicContact CB-CD2 4.12Å
429	I	94.8	Very high	93	Very high	46 Å²	46	60 Å²	60	24%	0.236	35%	0.351	C	S	.	.	H	α-helix	trans	-61.9	-48	175.8	-66.9	166.8	0	0	0	110.4	S425 R431 A432 V433 L448 L473 C476	S425-I429 VanDerWaalsContact O-CG1 3.27Å; S425-I429 WeakPolarHBondContact O-CG1 3.34Å; S425-I429 PolarHBondContact O-N 3.16Å; I429-R431 PolarHBondContact O-N 2.86Å; I429-A432 PolarHBondContact O-N 3.48Å; I429-V433 HydrophobicContact CG2-CG2 4.15Å; I429-V433 WeakPolarHBondContact O-CB 3.3Å; I429-V433 VanDerWaalsContact O-CG2 3.22Å; I429-V433 WeakPolarHBondContact O-CG2 3.48Å; I429-V433 PolarHBondContact O-N 3Å; I429-L448 HydrophobicContact CG1-CD2 4.47Å; I429-L473 HydrophobicContact CD1-CD2 4.25Å; I429-L473 HydrophobicContact CG1-CD2 3.76Å; I429-C476 HydrophobicContact CG1-CB 4.46Å
430	S	95.3	Very high	92.9	Very high	72 Å²	72	61.3 Å²	61.3	50%	0.503	36%	0.358	S	S	.	.	H	α-helix	trans	-60.2	-43.7	-179.5	-176.6	0	0	0	0	112.3	S426 S427 S434	S426-S430 WeakPolarHBondContact O-CB 3.24Å; S426-S430 PolarHBondContact O-N 3.32Å; S427-S430 PolarHBondContact O-N 3.37Å; S430-S434 WeakPolarHBondContact O-CB 3Å; S430-S434 PolarHBondContact O-N 2.97Å; S430-S434 PolarHBondContact O-OG 2.87Å
431	R	94.7	Very high	92.9	Very high	162 Å²	162	58.2 Å²	58.2	61%	0.611	35%	0.347	S	S	*	.	H	α-helix	trans	-65.3	-48.5	174.5	-77.6	-173.4	179.7	172.8	1.4	112.1	S427 A428 I429 V433 S434 D435 T447	S427-R431 PolarHBondContact O-N 3.42Å; A428-R431 PolarHBondContact O-N 3.46Å; I429-R431 PolarHBondContact O-N 2.86Å; R431-V433 VanDerWaalsContact C-N 3.31Å; R431-V433 PolarHBondContact O-N 3.3Å; R431-S434 WeakPolarHBondContact O-CB 3.42Å; R431-S434 PolarHBondContact O-N 3.45Å; R431-S434 VanDerWaalsContact O-N 3.09Å; R431-D435 WeakPolarHBondContact O-CB 3.48Å; R431-D435 PolarHBondContact O-N 3.4Å; R431-T447 HydrophobicContact CB-CG2 4.19Å
432	A	94.7	Very high	92.8	Very high	0 Å²	0	60.3 Å²	60.3	0%	0	37%	0.369	C	S	.	.	H	α-helix	trans	-62.5	-38.3	-178.9	0	0	0	0	0	112.5	A428 I429 A436 A444 L448 I480	A428-A432 WeakPolarHBondContact O-CB 3.35Å; A428-A432 PolarHBondContact O-N 3.01Å; I429-A432 PolarHBondContact O-N 3.48Å; A432-A436 WeakPolarHBondContact O-CB 3.32Å; A432-A436 PolarHBondContact O-N 2.92Å; A432-A444 HydrophobicContact CB-CB 4.14Å; A432-A444 WeakPolarHBondContact O-CB 3.43Å; A432-L448 HydrophobicContact CB-CD1 3.79Å; A432-L448 HydrophobicContact CB-CD2 3.79Å; A432-L448 HydrophobicContact CB-CG 3.55Å; A432-I480 HydrophobicContact CB-CD1 3.82Å
433	V	92.9	Very high	92.7	Very high	78 Å²	78	56.4 Å²	56.4	47%	0.473	36%	0.361	S	S	.	.	H	α-helix	trans	-66.5	-40.2	174.1	172.3	0	0	0	0	111.1	I429 R431 S437	I429-V433 HydrophobicContact CG2-CG2 4.15Å; I429-V433 WeakPolarHBondContact O-CB 3.3Å; I429-V433 VanDerWaalsContact O-CG2 3.22Å; I429-V433 WeakPolarHBondContact O-CG2 3.48Å; I429-V433 PolarHBondContact O-N 3Å; R431-V433 VanDerWaalsContact C-N 3.31Å; R431-V433 PolarHBondContact O-N 3.3Å; V433-S437 WeakPolarHBondContact O-CB 3.16Å; V433-S437 PolarHBondContact O-N 2.99Å
434	S	93.5	Very high	92.7	Very high	61 Å²	61	53.8 Å²	53.8	43%	0.427	34%	0.34	S	S	.	.	H	α-helix	trans	-65.2	-47.2	177	-58.1	0	0	0	0	111.6	S430 R431 S437 A438	S430-S434 WeakPolarHBondContact O-CB 3Å; S430-S434 PolarHBondContact O-N 2.97Å; S430-S434 PolarHBondContact O-OG 2.87Å; R431-S434 WeakPolarHBondContact O-CB 3.42Å; R431-S434 PolarHBondContact O-N 3.45Å; R431-S434 VanDerWaalsContact O-N 3.09Å; S434-S437 WeakPolarHBondContact O-CB 3.48Å; S434-S437 PolarHBondContact O-N 2.8Å; S434-S437 VanDerWaalsContact O-N 3.13Å; S434-S437 PolarHBondContact O-OG 2.81Å; S434-A438 PolarHBondContact O-N 3.03Å
435	D	91.4	Very high	92.7	Very high	45 Å²	45	53.1 Å²	53.1	24%	0.241	34%	0.336	C	S	.	.	H	α-helix	trans	-63.4	-43.3	176.5	-73.7	8.6	0	0	0	111.5	R431 S437 A438 G439 D440 S443 A444	R431-D435 WeakPolarHBondContact O-CB 3.48Å; R431-D435 PolarHBondContact O-N 3.4Å; D435-S437 PolarHBondContact O-N 3.16Å; D435-A438 WeakPolarHBondContact O-CB 3.25Å; D435-A438 PolarHBondContact O-N 3.44Å; D435-G439 PolarHBondContact O-N 2.81Å; D435-D440 PolarHBondContact O-N 3.02Å; D435-S443 VanDerWaalsContact CG-OG 3.29Å; D435-S443 WeakPolarHBondContact OD2-CB 3.38Å; D435-S443 PolarHBondContact OD2-OG 3.21Å; D435-A444 HydrophobicContact CB-CB 3.82Å
436	A	90.2	Very high	92.6	Very high	15 Å²	15	59.5 Å²	59.5	12%	0.124	37%	0.366	C	S	.	.	H	α-helix	trans	-64.2	-26.6	175.1	0	0	0	0	0	112.9	A432 Y441 A444 I480	A432-A436 WeakPolarHBondContact O-CB 3.32Å; A432-A436 PolarHBondContact O-N 2.92Å; A436-Y441 HydrophobicContact CB-CD1 3.98Å; A436-Y441 HydrophobicContact CB-CE1 3.95Å; A436-Y441 WeakPolarHBondContact O-CE1 3.45Å; A436-A444 HydrophobicContact CB-CB 4.4Å; A436-I480 HydrophobicContact CB-CD1 4.03Å; A436-I480 HydrophobicContact CB-CG1 4.09Å; A436-I480 HydrophobicContact CB-CG2 4.14Å
437	S	89.4	Confident	92.6	Very high	103 Å²	103	57.9 Å²	57.9	72%	0.72	35%	0.353	S	S	*	.	H	α-helix	trans	-78	-30	173.3	80.2	0	0	0	0	112.6	V433 S434 D435 G439	V433-S437 WeakPolarHBondContact O-CB 3.16Å; V433-S437 PolarHBondContact O-N 2.99Å; S434-S437 WeakPolarHBondContact O-CB 3.48Å; S434-S437 PolarHBondContact O-N 2.8Å; S434-S437 VanDerWaalsContact O-N 3.13Å; S434-S437 PolarHBondContact O-OG 2.81Å; D435-S437 PolarHBondContact O-N 3.16Å; S437-G439 VanDerWaalsContact C-N 3.27Å
438	A	89.7	Confident	92.6	Very high	75 Å²	75	55.1 Å²	55.1	62%	0.62	33%	0.334	S	S	*	.	H	α-helix	trans	-74.4	-18.3	171.6	0	0	0	0	0	112.9	S434 D435	S434-A438 PolarHBondContact O-N 3.03Å; D435-A438 WeakPolarHBondContact O-CB 3.25Å; D435-A438 PolarHBondContact O-N 3.44Å
439	G	87	Confident	92.5	Very high	38 Å²	38	58 Å²	58	39%	0.392	35%	0.35	S	S	.	.	T	Hydrogen-bonded Turn	trans	99.3	-3.1	-177.3	0	0	0	0	0	113.9	D435 S437 Y441	D435-G439 PolarHBondContact O-N 2.81Å; S437-G439 VanDerWaalsContact C-N 3.27Å; G439-Y441 VanDerWaalsContact C-N 3.3Å; G439-Y441 WeakPolarHBondContact O-CD2 3.47Å; G439-Y441 PolarHBondContact O-N 3.35Å
440	D	90.8	Very high	92.6	Very high	102 Å²	102	59.6 Å²	59.6	55%	0.545	36%	0.362	S	S	.	.			trans	-84.5	71.4	178.9	-67.9	-44.1	0	0	0	110.6	D435 G442 S443 A444	D435-D440 PolarHBondContact O-N 3.02Å; D440-G442 PolarHBondContact O-N 3.27Å; D440-S443 PolarHBondContact O-OG 2.67Å; D440-A444 PolarHBondContact O-N 3.27Å
441	Y	92	Very high	92.6	Very high	51 Å²	51	56.3 Å²	56.3	20%	0.2	34%	0.34	C	S	.	.	H	α-helix	trans	-64.1	-28.9	178.6	-58.9	-61.5	0	0	0	112.7	A436 G439 A444 I445 I480 K483	A436-Y441 HydrophobicContact CB-CD1 3.98Å; A436-Y441 HydrophobicContact CB-CE1 3.95Å; A436-Y441 WeakPolarHBondContact O-CE1 3.45Å; G439-Y441 VanDerWaalsContact C-N 3.3Å; G439-Y441 WeakPolarHBondContact O-CD2 3.47Å; G439-Y441 PolarHBondContact O-N 3.35Å; Y441-A444 PolarHBondContact O-N 3.24Å; Y441-I445 WeakPolarHBondContact O-CB 3.26Å; Y441-I445 WeakPolarHBondContact O-CD1 3.22Å; Y441-I445 WeakPolarHBondContact O-CG1 3.35Å; Y441-I445 PolarHBondContact O-N 3.25Å; Y441-I480 HydrophobicContact CD1-CG2 3.86Å; Y441-K483 HydrophobicContact CE1-CB 4.3Å
442	G	91.5	Very high	92.5	Very high	48 Å²	48	49.4 Å²	49.4	50%	0.495	32%	0.315	S	S	.	.	H	α-helix	trans	-62	-52.8	178.6	0	0	0	0	0	112.7	D440 A444 I445 E446	D440-G442 PolarHBondContact O-N 3.27Å; G442-A444 VanDerWaalsContact C-N 3.31Å; G442-A444 PolarHBondContact O-N 3.46Å; G442-I445 PolarHBondContact O-N 2.98Å; G442-E446 WeakPolarHBondContact O-CG 3.2Å; G442-E446 PolarHBondContact O-N 3.06Å; G442-E446 VanDerWaalsContact O-N 3.07Å
443	S	91.8	Very high	92.4	Very high	43 Å²	43	52 Å²	52	30%	0.301	33%	0.332	S	S	.	.	H	α-helix	trans	-66.1	-35.5	178.8	65.6	0	0	0	0	112.1	D435 D440 E446 T447	D435-S443 VanDerWaalsContact CG-OG 3.29Å; D435-S443 WeakPolarHBondContact OD2-CB 3.38Å; D435-S443 PolarHBondContact OD2-OG 3.21Å; D440-S443 PolarHBondContact O-OG 2.67Å; S443-E446 PolarHBondContact O-N 3.17Å; S443-T447 WeakPolarHBondContact O-CB 3.37Å; S443-T447 PolarHBondContact O-N 3.09Å; S443-T447 PolarHBondContact O-OG1 2.9Å
444	A	93.8	Very high	92.4	Very high	0 Å²	0	52.3 Å²	52.3	0%	0	33%	0.331	C	S	.	.	H	α-helix	trans	-60.7	-46.7	175.6	0	0	0	0	0	111.9	A432 D435 A436 D440 Y441 G442 T447 L448 I480	A432-A444 HydrophobicContact CB-CB 4.14Å; A432-A444 WeakPolarHBondContact O-CB 3.43Å; D435-A444 HydrophobicContact CB-CB 3.82Å; A436-A444 HydrophobicContact CB-CB 4.4Å; D440-A444 PolarHBondContact O-N 3.27Å; Y441-A444 PolarHBondContact O-N 3.24Å; G442-A444 VanDerWaalsContact C-N 3.31Å; G442-A444 PolarHBondContact O-N 3.46Å; A444-T447 PolarHBondContact O-N 3.17Å; A444-L448 WeakPolarHBondContact O-CG 3.36Å; A444-L448 PolarHBondContact O-N 3.47Å; A444-L448 VanDerWaalsContact O-N 3.16Å; A444-I480 HydrophobicContact CB-CD1 4.2Å; A444-I480 HydrophobicContact CB-CG2 4.15Å
445	I	93	Very high	92.2	Very high	36 Å²	36	49.4 Å²	49.4	19%	0.185	31%	0.311	C	S	.	.	H	α-helix	trans	-65.8	-46.5	179.5	-67.9	163.5	0	0	0	110.4	Y441 G442 T447 L448 V449 I480 E481	Y441-I445 WeakPolarHBondContact O-CB 3.26Å; Y441-I445 WeakPolarHBondContact O-CD1 3.22Å; Y441-I445 WeakPolarHBondContact O-CG1 3.35Å; Y441-I445 PolarHBondContact O-N 3.25Å; G442-I445 PolarHBondContact O-N 2.98Å; I445-T447 VanDerWaalsContact C-N 3.29Å; I445-T447 PolarHBondContact O-N 3.47Å; I445-L448 PolarHBondContact O-N 2.74Å; I445-V449 HydrophobicContact CG2-CG2 4.19Å; I445-V449 WeakPolarHBondContact O-CG2 3.16Å; I445-V449 PolarHBondContact O-N 3.08Å; I445-I480 HydrophobicContact CG1-CG2 4.17Å; I445-E481 HydrophobicContact CD1-CG 4.05Å; I445-E481 HydrophobicContact CG1-CG 4.32Å
446	E	94	Very high	92.2	Very high	138 Å²	138	53.1 Å²	53.1	65%	0.645	33%	0.325	S	S	*	.	H	α-helix	trans	-58.4	-41.5	177.5	-73.9	-179.6	-176.3	0	0	112.1	G442 S443 L448 V449 T450	G442-E446 WeakPolarHBondContact O-CG 3.2Å; G442-E446 PolarHBondContact O-N 3.06Å; G442-E446 VanDerWaalsContact O-N 3.07Å; S443-E446 PolarHBondContact O-N 3.17Å; E446-L448 PolarHBondContact O-N 3.45Å; E446-V449 PolarHBondContact O-N 2.74Å; E446-T450 VanDerWaalsContact O-CB 3.25Å; E446-T450 WeakPolarHBondContact O-CB 3.19Å; E446-T450 PolarHBondContact O-N 3.04Å; E446-T450 PolarHBondContact O-OG1 3.47Å
447	T	94.7	Very high	92.1	Very high	39 Å²	39	59.7 Å²	59.7	24%	0.239	35%	0.353	C	S	.	.	H	α-helix	trans	-60.8	-44.9	177.3	-61.2	0	0	0	0	111.5	A428 R431 S443 A444 I445 A451	A428-T447 HydrophobicContact CB-CG2 4.2Å; R431-T447 HydrophobicContact CB-CG2 4.19Å; S443-T447 WeakPolarHBondContact O-CB 3.37Å; S443-T447 PolarHBondContact O-N 3.09Å; S443-T447 PolarHBondContact O-OG1 2.9Å; A444-T447 PolarHBondContact O-N 3.17Å; I445-T447 VanDerWaalsContact C-N 3.29Å; I445-T447 PolarHBondContact O-N 3.47Å; T447-A451 WeakPolarHBondContact O-CB 3.38Å; T447-A451 PolarHBondContact O-N 3.09Å
448	L	94.4	Very high	92	Very high	0 Å²	0	55.6 Å²	55.6	0%	0	33%	0.325	C	S	.	.	H	α-helix	trans	-68	-45.5	179.2	-69.9	174	0	0	0	112.3	I429 A432 A444 I445 E446 T450 A451 I452 L473 C476 L477 I480	I429-L448 HydrophobicContact CG1-CD2 4.47Å; A432-L448 HydrophobicContact CB-CD1 3.79Å; A432-L448 HydrophobicContact CB-CD2 3.79Å; A432-L448 HydrophobicContact CB-CG 3.55Å; A444-L448 WeakPolarHBondContact O-CG 3.36Å; A444-L448 PolarHBondContact O-N 3.47Å; A444-L448 VanDerWaalsContact O-N 3.16Å; I445-L448 PolarHBondContact O-N 2.74Å; E446-L448 PolarHBondContact O-N 3.45Å; L448-T450 VanDerWaalsContact C-N 3.3Å; L448-T450 PolarHBondContact O-N 3.4Å; L448-A451 PolarHBondContact O-N 3.31Å; L448-I452 VanDerWaalsContact O-CG1 3.3Å; L448-I452 WeakPolarHBondContact O-CG1 3.49Å; L448-I452 PolarHBondContact O-N 3.5Å; L448-L473 HydrophobicContact CD2-CD2 3.69Å; L448-C476 HydrophobicContact CD1-CB 4.18Å; L448-C476 HydrophobicContact CD2-CB 4.32Å; L448-L477 HydrophobicContact CB-CB 4.36Å; L448-L477 HydrophobicContact CB-CD1 4.28Å; L448-L477 HydrophobicContact CD1-CB 3.9Å; L448-I480 HydrophobicContact CD1-CD1 3.83Å
449	V	94	Very high	91.7	Very high	66 Å²	66	58.5 Å²	58.5	40%	0.4	32%	0.323	S	S	.	.	H	α-helix	trans	-62.7	-39.4	178.6	174.5	0	0	0	0	111.2	I445 E446 I452 S453 L477	I445-V449 HydrophobicContact CG2-CG2 4.19Å; I445-V449 WeakPolarHBondContact O-CG2 3.16Å; I445-V449 PolarHBondContact O-N 3.08Å; E446-V449 PolarHBondContact O-N 2.74Å; V449-I452 PolarHBondContact O-N 3.14Å; V449-S453 WeakPolarHBondContact O-CB 3.49Å; V449-S453 PolarHBondContact O-N 3.33Å; V449-S453 PolarHBondContact O-OG 2.68Å; V449-L477 HydrophobicContact CG2-CD1 3.6Å
450	T	95.6	Very high	91.5	Very high	80 Å²	80	56.9 Å²	56.9	49%	0.491	31%	0.305	S	S	.	.	H	α-helix	trans	-64	-45.8	175.7	-57.9	0	0	0	0	111	E446 L448 I452 S453 L454	E446-T450 VanDerWaalsContact O-CB 3.25Å; E446-T450 WeakPolarHBondContact O-CB 3.19Å; E446-T450 PolarHBondContact O-N 3.04Å; E446-T450 PolarHBondContact O-OG1 3.47Å; L448-T450 VanDerWaalsContact C-N 3.3Å; L448-T450 PolarHBondContact O-N 3.4Å; T450-I452 PolarHBondContact O-N 3.48Å; T450-S453 WeakPolarHBondContact O-CB 3.33Å; T450-S453 PolarHBondContact O-N 2.92Å; T450-L454 HydrophobicContact CG2-CD1 4.36Å; T450-L454 WeakPolarHBondContact O-CG 3.47Å; T450-L454 PolarHBondContact O-N 2.8Å
451	A	94.9	Very high	91.2	Very high	3 Å²	3	53.7 Å²	53.7	3%	0.025	29%	0.291	C	S	.	.	H	α-helix	trans	-61.9	-42.8	177.4	0	0	0	0	0	112.5	I424 A428 T447 L448 S453 L454 I455 L473	I424-A451 HydrophobicContact CG2-CB 4.08Å; A428-A451 HydrophobicContact CB-CB 3.41Å; A428-A451 VanDerWaalsContact CB-CB 3.41Å; T447-A451 WeakPolarHBondContact O-CB 3.38Å; T447-A451 PolarHBondContact O-N 3.09Å; L448-A451 PolarHBondContact O-N 3.31Å; A451-S453 VanDerWaalsContact C-N 3.3Å; A451-S453 PolarHBondContact O-N 3.25Å; A451-L454 PolarHBondContact O-N 2.89Å; A451-I455 WeakPolarHBondContact O-CG1 3.45Å; A451-I455 PolarHBondContact O-N 3.09Å; A451-L473 HydrophobicContact CB-CD1 4.16Å; A451-L473 HydrophobicContact CB-CD2 4.35Å
452	I	93.1	Very high	90.7	Very high	17 Å²	17	54.3 Å²	54.3	9%	0.087	31%	0.307	C	S	.	.	H	α-helix	trans	-59.7	-43.3	175.1	-68.4	165.5	0	0	0	110.6	L448 V449 T450 I455 K456 I470 L473 Q474 L477	L448-I452 VanDerWaalsContact O-CG1 3.3Å; L448-I452 WeakPolarHBondContact O-CG1 3.49Å; L448-I452 PolarHBondContact O-N 3.5Å; V449-I452 PolarHBondContact O-N 3.14Å; T450-I452 PolarHBondContact O-N 3.48Å; I452-I455 PolarHBondContact O-N 3.01Å; I452-K456 HydrophobicContact CG2-CD 4.17Å; I452-K456 HydrophobicContact CG2-CG 4.46Å; I452-K456 WeakPolarHBondContact O-CB 3.43Å; I452-K456 WeakPolarHBondContact O-CG 3.43Å; I452-K456 PolarHBondContact O-N 3.43Å; I452-I470 HydrophobicContact CG2-CG2 4.4Å; I452-L473 HydrophobicContact CD1-CB 4.02Å; I452-L473 HydrophobicContact CG1-CB 3.62Å; I452-L473 HydrophobicContact CG1-CD1 3.92Å; I452-L473 HydrophobicContact CG1-CG 4.39Å; I452-Q474 HydrophobicContact CD1-CG 4.01Å; I452-L477 HydrophobicContact CD1-CD1 4.04Å
453	S	92.5	Very high	90.6	Very high	53 Å²	53	54.3 Å²	54.3	37%	0.371	30%	0.296	S	S	.	.	H	α-helix	trans	-63.7	-43.1	179.4	-59.3	0	0	0	0	111.7	V449 T450 A451 I455 K456 Q457	V449-S453 WeakPolarHBondContact O-CB 3.49Å; V449-S453 PolarHBondContact O-N 3.33Å; V449-S453 PolarHBondContact O-OG 2.68Å; T450-S453 WeakPolarHBondContact O-CB 3.33Å; T450-S453 PolarHBondContact O-N 2.92Å; A451-S453 VanDerWaalsContact C-N 3.3Å; A451-S453 PolarHBondContact O-N 3.25Å; S453-I455 PolarHBondContact O-N 3.29Å; S453-K456 PolarHBondContact O-N 3.19Å; S453-Q457 WeakPolarHBondContact O-CB 3.15Å; S453-Q457 WeakPolarHBondContact O-CG 3.42Å; S453-Q457 PolarHBondContact O-N 2.99Å
454	L	92.2	Very high	90.6	Very high	85 Å²	85	57.4 Å²	57.4	45%	0.445	31%	0.309	S	S	.	.	H	α-helix	trans	-62.5	-42.1	176.6	-70.8	172.8	0	0	0	112.4	T450 A451 Q457 S458	T450-L454 HydrophobicContact CG2-CD1 4.36Å; T450-L454 WeakPolarHBondContact O-CG 3.47Å; T450-L454 PolarHBondContact O-N 2.8Å; A451-L454 PolarHBondContact O-N 2.89Å; L454-Q457 PolarHBondContact O-N 3.36Å; L454-S458 PolarHBondContact O-N 2.83Å
455	I	90.6	Very high	90.4	Very high	0 Å²	0	64.8 Å²	64.8	0%	0	34%	0.337	C	S	.	.	H	α-helix	trans	-70.5	-39.8	179.3	-64.5	167.7	0	0	0	110.7	N421 S425 A451 I452 S453 Q457 S458 S461 I470 L473	N421-I455 HydrophobicContact CB-CG1 4.34Å; S425-I455 WeakPolarHBondContact OG-CD1 3.31Å; A451-I455 WeakPolarHBondContact O-CG1 3.45Å; A451-I455 PolarHBondContact O-N 3.09Å; I452-I455 PolarHBondContact O-N 3.01Å; S453-I455 PolarHBondContact O-N 3.29Å; I455-Q457 VanDerWaalsContact C-N 3.31Å; I455-Q457 PolarHBondContact O-N 2.75Å; I455-S458 VanDerWaalsContact O-CB 3.31Å; I455-S458 WeakPolarHBondContact O-CB 3.36Å; I455-S458 PolarHBondContact O-N 2.72Å; I455-S458 VanDerWaalsContact O-N 3.11Å; I455-S458 PolarHBondContact O-OG 2.77Å; I455-S461 WeakPolarHBondContact O-CB 3.49Å; I455-I470 HydrophobicContact CB-CG1 4.43Å; I455-I470 HydrophobicContact CG2-CD1 4.05Å; I455-I470 HydrophobicContact CG2-CG1 3.8Å; I455-L473 HydrophobicContact CD1-CD1 3.47Å; I455-L473 VanDerWaalsContact CD1-CD1 3.47Å
456	K	90	Very high	90.2	Very high	123 Å²	123	63 Å²	63	54%	0.535	33%	0.328	S	S	.	.	H	α-helix	trans	-63.3	-35.6	175.5	-82.4	-173.1	159.6	-175.6	0	113	I452 S453 S458 S461 I470	I452-K456 HydrophobicContact CG2-CD 4.17Å; I452-K456 HydrophobicContact CG2-CG 4.46Å; I452-K456 WeakPolarHBondContact O-CB 3.43Å; I452-K456 WeakPolarHBondContact O-CG 3.43Å; I452-K456 PolarHBondContact O-N 3.43Å; S453-K456 PolarHBondContact O-N 3.19Å; K456-S458 VanDerWaalsContact C-N 3.28Å; K456-S461 WeakPolarHBondContact O-CB 3.15Å; K456-S461 PolarHBondContact O-OG 3.05Å; K456-I470 HydrophobicContact CG-CD1 3.95Å
457	Q	89.2	Confident	90.1	Very high	153 Å²	153	61.2 Å²	61.2	72%	0.715	32%	0.318	S	S	*	.	H	α-helix	trans	-73.7	-17.7	175.1	-72.1	172	-0.3	0	0	113.1	S453 L454 I455	S453-Q457 WeakPolarHBondContact O-CB 3.15Å; S453-Q457 WeakPolarHBondContact O-CG 3.42Å; S453-Q457 PolarHBondContact O-N 2.99Å; L454-Q457 PolarHBondContact O-N 3.36Å; I455-Q457 VanDerWaalsContact C-N 3.31Å; I455-Q457 PolarHBondContact O-N 2.75Å
458	S	86.8	Confident	90.1	Very high	18 Å²	18	64.2 Å²	64.2	13%	0.126	34%	0.335	C	S	.	.	S	Bend	trans	-66	145.7	176.9	81	0	0	0	0	111.2	N421 L454 I455 K456 V460 S461	N421-S458 PolarHBondContact ND2-OG 2.7Å; L454-S458 PolarHBondContact O-N 2.83Å; I455-S458 VanDerWaalsContact O-CB 3.31Å; I455-S458 WeakPolarHBondContact O-CB 3.36Å; I455-S458 PolarHBondContact O-N 2.72Å; I455-S458 VanDerWaalsContact O-N 3.11Å; I455-S458 PolarHBondContact O-OG 2.77Å; K456-S458 VanDerWaalsContact C-N 3.28Å; S458-V460 PolarHBondContact O-N 2.8Å; S458-S461 WeakPolarHBondContact O-CB 3.41Å; S458-S461 PolarHBondContact O-N 3.03Å; S458-S461 VanDerWaalsContact O-N 3.11Å; S458-S461 PolarHBondContact O-OG 3.15Å
459	K	82.9	Confident	90	Very high	135 Å²	135	65.5 Å²	65.5	59%	0.587	34%	0.342	S	S	*	.	T	Hydrogen-bonded Turn	trans	-62.8	-16.9	-178.8	-61.2	179.9	-179.8	178.8	0	113.4	R406 L409	R406-K459 PolarHBondContact NH2-O 2.79Å; L409-K459 HydrophobicContact CD1-CB 3.75Å; L409-K459 HydrophobicContact CD2-CB 4.43Å; L409-K459 HydrophobicContact CD2-CD 3.76Å
460	V	84.4	Confident	90	Very high	4 Å²	4	63.1 Å²	63.1	2%	0.024	33%	0.327	C	S	.	.	T	Hydrogen-bonded Turn	trans	-94.9	1.3	-177	-172.6	0	0	0	0	112.3	L409 F414 I417 S458 A462 D463 C466	L409-V460 HydrophobicContact CD1-CG2 3.83Å; F414-V460 HydrophobicContact CD2-CB 4.4Å; F414-V460 HydrophobicContact CD2-CG1 3.67Å; F414-V460 HydrophobicContact CD2-CG2 3.82Å; F414-V460 HydrophobicContact CE2-CB 4.37Å; F414-V460 HydrophobicContact CE2-CG1 3.25Å; F414-V460 HydrophobicContact CE2-CG2 4.28Å; F414-V460 HydrophobicContact CG-CG2 4.49Å; F414-V460 HydrophobicContact CZ-CG1 3.81Å; I417-V460 HydrophobicContact CB-CG2 3.84Å; I417-V460 HydrophobicContact CD1-CG2 4.14Å; I417-V460 HydrophobicContact CG2-CB 4.06Å; I417-V460 HydrophobicContact CG2-CG2 3.52Å; S458-V460 PolarHBondContact O-N 2.8Å; V460-A462 PolarHBondContact O-N 2.95Å; V460-D463 HydrophobicContact CG1-CB 3.82Å; V460-D463 VanDerWaalsContact O-CB 3.29Å; V460-D463 WeakPolarHBondContact O-CB 3.3Å; V460-D463 PolarHBondContact O-N 3.18Å; V460-C466 WeakPolarHBondContact O-CB 3.37Å; V460-C466 PolarHBondContact O-SG 2.98Å
461	S	83	Confident	89.9	Confident	36 Å²	36	62 Å²	62	25%	0.252	32%	0.323	S	S	.	.	T	Hydrogen-bonded Turn	trans	-57.6	-22.1	-176.6	60.8	0	0	0	0	115.5	I455 K456 S458 D463	I455-S461 WeakPolarHBondContact O-CB 3.49Å; K456-S461 WeakPolarHBondContact O-CB 3.15Å; K456-S461 PolarHBondContact O-OG 3.05Å; S458-S461 WeakPolarHBondContact O-CB 3.41Å; S458-S461 PolarHBondContact O-N 3.03Å; S458-S461 VanDerWaalsContact O-N 3.11Å; S458-S461 PolarHBondContact O-OG 3.15Å; S461-D463 VanDerWaalsContact C-N 3.33Å
462	A	83.1	Confident	89.9	Confident	63 Å²	63	64.4 Å²	64.4	52%	0.521	34%	0.339	S	S	.	.	T	Hydrogen-bonded Turn	trans	-76.8	-17.1	177.2	0	0	0	0	0	113.9	V460 K467	V460-A462 PolarHBondContact O-N 2.95Å; A462-K467 VanDerWaalsContact O-CE 3.3Å; A462-K467 WeakPolarHBondContact O-CE 3.14Å
463	D	88.3	Confident	89.9	Confident	49 Å²	49	63.6 Å²	63.6	26%	0.262	34%	0.335	S	S	.	.	S	Bend	trans	-73.1	142.6	-177.7	-171.1	80.7	0	0	0	112.1	F414 V460 S461 R465 C466 K467	F414-D463 HydrophobicContact CE2-CB 4.1Å; F414-D463 HydrophobicContact CZ-CB 4.18Å; F414-D463 WeakPolarHBondContact CZ-OD1 3.38Å; V460-D463 HydrophobicContact CG1-CB 3.82Å; V460-D463 VanDerWaalsContact O-CB 3.29Å; V460-D463 WeakPolarHBondContact O-CB 3.3Å; V460-D463 PolarHBondContact O-N 3.18Å; S461-D463 VanDerWaalsContact C-N 3.33Å; D463-R465 PolarHBondContact O-N 3.22Å; D463-R465 WeakPolarHBondContact OD2-CB 3.45Å; D463-R465 WeakPolarHBondContact OD2-CG 3.38Å; D463-R465 PolarHBondContact OD2-N 3.41Å; D463-C466 PolarHBondContact O-N 3.3Å; D463-K467 PolarHBondContact O-N 3.2Å
464	D	91.1	Very high	90	Very high	108 Å²	108	64.7 Å²	64.7	58%	0.578	33%	0.334	S	S	*	.	H	α-helix	trans	-62	-30	-178.3	-63	-50.2	0	0	0	112.5	C466 K467 V468	D464-C466 PolarHBondContact O-N 3.39Å; D464-K467 PolarHBondContact O-N 3.5Å; D464-K467 IonicContact OD1-NZ 2.8Å; D464-K467 PolarHBondContact OD1-NZ 3.34Å; D464-V468 WeakPolarHBondContact O-CG2 3.4Å; D464-V468 PolarHBondContact O-N 3.02Å
465	R	89.7	Confident	90.1	Very high	154 Å²	154	65.7 Å²	65.7	58%	0.581	34%	0.34	S	S	*	.	H	α-helix	trans	-66.8	-38.2	175.5	-55.7	173.5	173.3	178.1	1.3	111.5	M418 D463 V468 L469	M418-R465 HydrophobicContact CE-CB 3.58Å; M418-R465 HydrophobicContact SD-CB 4.14Å; D463-R465 PolarHBondContact O-N 3.22Å; D463-R465 WeakPolarHBondContact OD2-CB 3.45Å; D463-R465 WeakPolarHBondContact OD2-CG 3.38Å; D463-R465 PolarHBondContact OD2-N 3.41Å; R465-V468 PolarHBondContact O-N 3.45Å; R465-L469 PolarHBondContact O-N 3.18Å
466	C	90.3	Very high	90.2	Very high	0 Å²	0	66.8 Å²	66.8	0%	0	35%	0.348	C	S	.	.	H	α-helix	trans	-69.9	-36.5	174.4	-82.6	0	0	0	0	111.7	M418 N421 V460 D463 D464 V468 L469 I470	M418-C466 PolarHBondContact SD-SG 3.29Å; N421-C466 PolarHBondContact ND2-SG 3.18Å; N421-C466 VanDerWaalsContact ND2-SG 3.4Å; V460-C466 WeakPolarHBondContact O-CB 3.37Å; V460-C466 PolarHBondContact O-SG 2.98Å; D463-C466 PolarHBondContact O-N 3.3Å; D464-C466 PolarHBondContact O-N 3.39Å; C466-V468 VanDerWaalsContact C-N 3.32Å; C466-V468 PolarHBondContact O-N 3.43Å; C466-L469 WeakPolarHBondContact O-CB 3.49Å; C466-L469 PolarHBondContact O-N 3.31Å; C466-I470 WeakPolarHBondContact O-CG1 3.46Å; C466-I470 PolarHBondContact O-N 3.05Å
467	K	92.1	Very high	90.3	Very high	100 Å²	100	61.7 Å²	61.7	44%	0.435	33%	0.326	S	S	.	.	H	α-helix	trans	-59.5	-42.7	174	-65.1	176.8	-163.4	155.8	0	111.6	A462 D463 D464 L469 I470 S471	A462-K467 VanDerWaalsContact O-CE 3.3Å; A462-K467 WeakPolarHBondContact O-CE 3.14Å; D463-K467 PolarHBondContact O-N 3.2Å; D464-K467 PolarHBondContact O-N 3.5Å; D464-K467 IonicContact OD1-NZ 2.8Å; D464-K467 PolarHBondContact OD1-NZ 3.34Å; K467-L469 VanDerWaalsContact C-N 3.32Å; K467-L469 PolarHBondContact O-N 3.3Å; K467-I470 PolarHBondContact O-N 3.17Å; K467-S471 PolarHBondContact O-N 3.03Å; K467-S471 PolarHBondContact O-OG 3.26Å; K467-S471 VanDerWaalsContact O-OG 3.12Å
468	V	93.4	Very high	90.5	Very high	101 Å²	101	59.6 Å²	59.6	61%	0.612	32%	0.316	S	S	*	.	H	α-helix	trans	-60.1	-40.9	175.8	174.3	0	0	0	0	111.8	D464 R465 C466 S471 S472	D464-V468 WeakPolarHBondContact O-CG2 3.4Å; D464-V468 PolarHBondContact O-N 3.02Å; R465-V468 PolarHBondContact O-N 3.45Å; C466-V468 VanDerWaalsContact C-N 3.32Å; C466-V468 PolarHBondContact O-N 3.43Å; V468-S471 PolarHBondContact O-N 2.99Å; V468-S472 PolarHBondContact O-N 3.48Å
469	L	93.1	Very high	90.7	Very high	27 Å²	27	60.1 Å²	60.1	14%	0.141	33%	0.325	C	S	.	.	H	α-helix	trans	-64.3	-42.3	175	-69.1	179.1	0	0	0	112.3	M418 N421 R422 R465 C466 K467 S472 L473	M418-L469 HydrophobicContact CE-CD1 3.43Å; M418-L469 VanDerWaalsContact CE-CD1 3.43Å; M418-L469 HydrophobicContact CE-CG 4.08Å; M418-L469 HydrophobicContact SD-CD1 4.33Å; N421-L469 HydrophobicContact CB-CD1 4.08Å; R422-L469 HydrophobicContact CB-CD1 4.5Å; R465-L469 PolarHBondContact O-N 3.18Å; C466-L469 WeakPolarHBondContact O-CB 3.49Å; C466-L469 PolarHBondContact O-N 3.31Å; K467-L469 VanDerWaalsContact C-N 3.32Å; K467-L469 PolarHBondContact O-N 3.3Å; L469-S472 PolarHBondContact O-N 3.13Å; L469-L473 PolarHBondContact O-N 3.16Å
470	I	93.5	Very high	91	Very high	16 Å²	16	54.1 Å²	54.1	8%	0.082	30%	0.299	C	S	.	.	H	α-helix	trans	-63.3	-46.1	176.8	-66.3	167.7	0	0	0	110.2	I452 I455 K456 C466 K467 S472 L473 Q474	I452-I470 HydrophobicContact CG2-CG2 4.4Å; I455-I470 HydrophobicContact CB-CG1 4.43Å; I455-I470 HydrophobicContact CG2-CD1 4.05Å; I455-I470 HydrophobicContact CG2-CG1 3.8Å; K456-I470 HydrophobicContact CG-CD1 3.95Å; C466-I470 WeakPolarHBondContact O-CG1 3.46Å; C466-I470 PolarHBondContact O-N 3.05Å; K467-I470 PolarHBondContact O-N 3.17Å; I470-S472 VanDerWaalsContact C-N 3.29Å; I470-S472 PolarHBondContact O-N 3.01Å; I470-L473 PolarHBondContact O-N 3.03Å; I470-Q474 HydrophobicContact CG2-CG 4.3Å; I470-Q474 VanDerWaalsContact O-CG 3.32Å; I470-Q474 WeakPolarHBondContact O-CG 3.35Å; I470-Q474 PolarHBondContact O-N 2.63Å
471	S	94.4	Very high	91.2	Very high	57 Å²	57	56.7 Å²	56.7	40%	0.399	31%	0.311	S	S	.	.	H	α-helix	trans	-57.4	-43.2	175.1	-59.9	0	0	0	0	111.4	K467 V468 L473 Q474 D475	K467-S471 PolarHBondContact O-N 3.03Å; K467-S471 PolarHBondContact O-OG 3.26Å; K467-S471 VanDerWaalsContact O-OG 3.12Å; V468-S471 PolarHBondContact O-N 2.99Å; S471-L473 PolarHBondContact O-N 3.03Å; S471-Q474 PolarHBondContact O-N 3.48Å; S471-D475 WeakPolarHBondContact O-CB 3.39Å; S471-D475 VanDerWaalsContact O-CG 3.23Å; S471-D475 PolarHBondContact O-N 3.07Å
472	S	94.1	Very high	91.3	Very high	54 Å²	54	58.7 Å²	58.7	38%	0.378	33%	0.325	S	S	.	.	H	α-helix	trans	-61.9	-41	177.1	-175	0	0	0	0	112.9	V468 L469 I470 C476	V468-S472 PolarHBondContact O-N 3.48Å; L469-S472 PolarHBondContact O-N 3.13Å; I470-S472 VanDerWaalsContact C-N 3.29Å; I470-S472 PolarHBondContact O-N 3.01Å; S472-C476 PolarHBondContact O-N 3.38Å; S472-C476 VanDerWaalsContact O-N 3.08Å
473	L	94.1	Very high	91.3	Very high	0 Å²	0	61.9 Å²	61.9	0%	0	33%	0.327	C	S	.	.	H	α-helix	trans	-67	-39.8	175.3	-73.8	168.6	0	0	0	111.9	A428 I429 L448 A451 I452 I455 L469 I470 S471 C476 L477	A428-L473 HydrophobicContact CB-CD2 4.12Å; I429-L473 HydrophobicContact CD1-CD2 4.25Å; I429-L473 HydrophobicContact CG1-CD2 3.76Å; L448-L473 HydrophobicContact CD2-CD2 3.69Å; A451-L473 HydrophobicContact CB-CD1 4.16Å; A451-L473 HydrophobicContact CB-CD2 4.35Å; I452-L473 HydrophobicContact CD1-CB 4.02Å; I452-L473 HydrophobicContact CG1-CB 3.62Å; I452-L473 HydrophobicContact CG1-CD1 3.92Å; I452-L473 HydrophobicContact CG1-CG 4.39Å; I455-L473 HydrophobicContact CD1-CD1 3.47Å; I455-L473 VanDerWaalsContact CD1-CD1 3.47Å; L469-L473 PolarHBondContact O-N 3.16Å; I470-L473 PolarHBondContact O-N 3.03Å; S471-L473 PolarHBondContact O-N 3.03Å; L473-C476 PolarHBondContact O-N 3.41Å; L473-L477 WeakPolarHBondContact O-CB 3.37Å; L473-L477 PolarHBondContact O-N 3.22Å
474	Q	93.8	Very high	90.9	Very high	75 Å²	75	61.4 Å²	61.4	35%	0.35	33%	0.327	S	S	.	.	H	α-helix	trans	-65.6	-41.2	176.4	-71.8	179.1	-55.5	0	0	112	I452 I470 S471 C476 L477 H478	I452-Q474 HydrophobicContact CD1-CG 4.01Å; I470-Q474 HydrophobicContact CG2-CG 4.3Å; I470-Q474 VanDerWaalsContact O-CG 3.32Å; I470-Q474 WeakPolarHBondContact O-CG 3.35Å; I470-Q474 PolarHBondContact O-N 2.63Å; S471-Q474 PolarHBondContact O-N 3.48Å; Q474-C476 VanDerWaalsContact C-N 3.33Å; Q474-C476 PolarHBondContact O-N 2.83Å; Q474-L477 WeakPolarHBondContact O-CB 3.17Å; Q474-L477 PolarHBondContact O-N 3.1Å; Q474-H478 PolarHBondContact O-N 3.07Å; Q474-H478 PolarHBondContact O-ND1 3.3Å
475	D	94.2	Very high	89.8	Confident	107 Å²	107	64.5 Å²	64.5	57%	0.572	33%	0.332	S	S	*	.	H	α-helix	trans	-62.5	-41.6	175.6	-70.8	-23.9	0	0	0	111.3	S471 G479	S471-D475 WeakPolarHBondContact O-CB 3.39Å; S471-D475 VanDerWaalsContact O-CG 3.23Å; S471-D475 PolarHBondContact O-N 3.07Å; D475-G479 PolarHBondContact O-N 3.45Å
476	C	92.8	Very high	88.5	Confident	23 Å²	23	58.8 Å²	58.8	16%	0.155	32%	0.321	C	S	.	.	H	α-helix	trans	-62.7	-43.5	173.6	-168.6	0	0	0	0	111.2	I429 L448 S472 L473 Q474 G479 I480	I429-C476 HydrophobicContact CG1-CB 4.46Å; L448-C476 HydrophobicContact CD1-CB 4.18Å; L448-C476 HydrophobicContact CD2-CB 4.32Å; S472-C476 PolarHBondContact O-N 3.38Å; S472-C476 VanDerWaalsContact O-N 3.08Å; L473-C476 PolarHBondContact O-N 3.41Å; Q474-C476 VanDerWaalsContact C-N 3.33Å; Q474-C476 PolarHBondContact O-N 2.83Å; C476-G479 PolarHBondContact O-N 3.12Å; C476-I480 WeakPolarHBondContact O-CG1 3.41Å; C476-I480 PolarHBondContact O-N 3.16Å
477	L	93.1	Very high	87	Confident	16 Å²	16	61.9 Å²	61.9	8%	0.084	34%	0.343	C	S	.	.	H	α-helix	trans	-61.4	-52.7	179.3	-172.1	162.2	0	0	0	110.9	L448 V449 I452 L473 Q474 G479 I480 E481	L448-L477 HydrophobicContact CB-CB 4.36Å; L448-L477 HydrophobicContact CB-CD1 4.28Å; L448-L477 HydrophobicContact CD1-CB 3.9Å; V449-L477 HydrophobicContact CG2-CD1 3.6Å; I452-L477 HydrophobicContact CD1-CD1 4.04Å; L473-L477 WeakPolarHBondContact O-CB 3.37Å; L473-L477 PolarHBondContact O-N 3.22Å; Q474-L477 WeakPolarHBondContact O-CB 3.17Å; Q474-L477 PolarHBondContact O-N 3.1Å; L477-G479 PolarHBondContact O-N 3.45Å; L477-I480 PolarHBondContact O-N 3.21Å; L477-I480 VanDerWaalsContact O-N 3.07Å; L477-E481 HydrophobicContact CD2-CG 3.76Å; L477-E481 WeakPolarHBondContact CD2-OE1 3.33Å; L477-E481 VanDerWaalsContact CD2-OE2 3.27Å; L477-E481 WeakPolarHBondContact CD2-OE2 3.28Å; L477-E481 WeakPolarHBondContact O-CB 3.46Å; L477-E481 WeakPolarHBondContact O-CG 3.45Å; L477-E481 PolarHBondContact O-N 3.19Å
478	H	92.5	Very high	85.2	Confident	109 Å²	109	59.7 Å²	59.7	51%	0.505	35%	0.348	S	S	.	.	H	α-helix	trans	-61.3	-35.6	177.1	-63.8	153.3	0	0	0	112	Q474 I480 E481 S482	Q474-H478 PolarHBondContact O-N 3.07Å; Q474-H478 PolarHBondContact O-ND1 3.3Å; H478-I480 VanDerWaalsContact C-N 3.34Å; H478-I480 PolarHBondContact O-N 3.18Å; H478-E481 IonicContact CD2-OE2 2.74Å; H478-S482 VanDerWaalsContact O-CB 3.32Å; H478-S482 WeakPolarHBondContact O-CB 3.28Å; H478-S482 PolarHBondContact O-N 3.16Å; H478-S482 PolarHBondContact O-OG 2.9Å
479	G	90.5	Very high	83.2	Confident	29 Å²	29	57.5 Å²	57.5	30%	0.299	34%	0.338	S	S	.	.	H	α-helix	trans	-63.5	-36.2	174.5	0	0	0	0	0	113.3	D475 C476 L477 S482 K483	D475-G479 PolarHBondContact O-N 3.45Å; C476-G479 PolarHBondContact O-N 3.12Å; L477-G479 PolarHBondContact O-N 3.45Å; G479-S482 PolarHBondContact O-OG 3.24Å; G479-S482 VanDerWaalsContact O-OG 3.04Å; G479-K483 WeakPolarHBondContact O-CD 3.36Å; G479-K483 VanDerWaalsContact O-CG 3.26Å; G479-K483 WeakPolarHBondContact O-CG 3.08Å
480	I	90	Very high	81.3	Confident	8 Å²	8	66 Å²	66	4%	0.041	37%	0.368	C	S	.	.	H	α-helix	trans	-81.3	-40.1	177.3	-66.9	176.3	0	0	0	111	A432 A436 Y441 A444 I445 L448 C476 L477 H478 K483 S484	A432-I480 HydrophobicContact CB-CD1 3.82Å; A436-I480 HydrophobicContact CB-CD1 4.03Å; A436-I480 HydrophobicContact CB-CG1 4.09Å; A436-I480 HydrophobicContact CB-CG2 4.14Å; Y441-I480 HydrophobicContact CD1-CG2 3.86Å; A444-I480 HydrophobicContact CB-CD1 4.2Å; A444-I480 HydrophobicContact CB-CG2 4.15Å; I445-I480 HydrophobicContact CG1-CG2 4.17Å; L448-I480 HydrophobicContact CD1-CD1 3.83Å; C476-I480 WeakPolarHBondContact O-CG1 3.41Å; C476-I480 PolarHBondContact O-N 3.16Å; L477-I480 PolarHBondContact O-N 3.21Å; L477-I480 VanDerWaalsContact O-N 3.07Å; H478-I480 VanDerWaalsContact C-N 3.34Å; H478-I480 PolarHBondContact O-N 3.18Å; I480-K483 WeakPolarHBondContact O-CB 3.47Å; I480-K483 PolarHBondContact O-N 3.07Å; I480-S484 WeakPolarHBondContact O-CB 3.42Å; I480-S484 PolarHBondContact O-N 3.03Å
481	E	87.9	Confident	79.3	Confident	59 Å²	59	74.7 Å²	74.7	28%	0.276	40%	0.4	S	S	.	.	H	α-helix	trans	-60.1	-47.5	175.6	-76.6	-174	149.9	0	0	111.6	I445 L477 H478 K483 S484 Y485	I445-E481 HydrophobicContact CD1-CG 4.05Å; I445-E481 HydrophobicContact CG1-CG 4.32Å; L477-E481 HydrophobicContact CD2-CG 3.76Å; L477-E481 WeakPolarHBondContact CD2-OE1 3.33Å; L477-E481 VanDerWaalsContact CD2-OE2 3.27Å; L477-E481 WeakPolarHBondContact CD2-OE2 3.28Å; L477-E481 WeakPolarHBondContact O-CB 3.46Å; L477-E481 WeakPolarHBondContact O-CG 3.45Å; L477-E481 PolarHBondContact O-N 3.19Å; H478-E481 IonicContact CD2-OE2 2.74Å; E481-K483 PolarHBondContact O-N 3.39Å; E481-S484 WeakPolarHBondContact O-CB 3.38Å; E481-S484 PolarHBondContact O-N 2.81Å; E481-S484 VanDerWaalsContact O-N 3.09Å; E481-Y485 HydrophobicContact CB-CE2 4.19Å; E481-Y485 WeakPolarHBondContact O-CD2 3.32Å; E481-Y485 PolarHBondContact O-N 3.46Å; E481-Y485 VanDerWaalsContact O-N 3.09Å
482	S	85.1	Confident	77	Confident	78 Å²	78	79.3 Å²	79.3	55%	0.545	42%	0.415	S	S	.	.	H	α-helix	trans	-59.7	-33.1	176.9	57.8	0	0	0	0	112.9	H478 G479 G486	H478-S482 VanDerWaalsContact O-CB 3.32Å; H478-S482 WeakPolarHBondContact O-CB 3.28Å; H478-S482 PolarHBondContact O-N 3.16Å; H478-S482 PolarHBondContact O-OG 2.9Å; G479-S482 PolarHBondContact O-OG 3.24Å; G479-S482 VanDerWaalsContact O-OG 3.04Å; S482-G486 PolarHBondContact O-N 3.43Å
483	K	82.6	Confident	74.7	Confident	130 Å²	130	85.4 Å²	85.4	57%	0.565	43%	0.43	S	S	*	.	H	α-helix	trans	-73.4	-41.2	173.4	-70.9	174.3	-177.6	-165.6	0	112.3	Y441 G479 I480 E481 Y485 G486 S487	Y441-K483 HydrophobicContact CE1-CB 4.3Å; G479-K483 WeakPolarHBondContact O-CD 3.36Å; G479-K483 VanDerWaalsContact O-CG 3.26Å; G479-K483 WeakPolarHBondContact O-CG 3.08Å; I480-K483 WeakPolarHBondContact O-CB 3.47Å; I480-K483 PolarHBondContact O-N 3.07Å; E481-K483 PolarHBondContact O-N 3.39Å; K483-Y485 PolarHBondContact O-N 3.31Å; K483-G486 PolarHBondContact O-N 3.38Å; K483-S487 VanDerWaalsContact O-CB 3.3Å; K483-S487 WeakPolarHBondContact O-CB 3.4Å; K483-S487 PolarHBondContact O-N 2.97Å
484	S	80.4	Confident	72.4	Confident	38 Å²	38	88.9 Å²	88.9	27%	0.266	45%	0.454	S	S	.	.	H	α-helix	trans	-56.2	-50	178.2	-175.2	0	0	0	0	111.3	I480 E481	I480-S484 WeakPolarHBondContact O-CB 3.42Å; I480-S484 PolarHBondContact O-N 3.03Å; E481-S484 WeakPolarHBondContact O-CB 3.38Å; E481-S484 PolarHBondContact O-N 2.81Å; E481-S484 VanDerWaalsContact O-N 3.09Å
485	Y	68.6	Low	70.2	Confident	173 Å²	173	95 Å²	95	68%	0.678	47%	0.473	S	S	*	.	H	α-helix	trans	-72.8	-30.5	178.7	-60.1	-66.3	0	0	0	113.4	E481 K483	E481-Y485 HydrophobicContact CB-CE2 4.19Å; E481-Y485 WeakPolarHBondContact O-CD2 3.32Å; E481-Y485 PolarHBondContact O-N 3.46Å; E481-Y485 VanDerWaalsContact O-N 3.09Å; K483-Y485 PolarHBondContact O-N 3.31Å
486	G	63	Low	67.8	Low	34 Å²	34	97.1 Å²	97.1	35%	0.351	48%	0.48	S	S	.	.	H	α-helix	trans	-76.5	-29.8	-179.5	0	0	0	0	0	114.5	S482 K483	S482-G486 PolarHBondContact O-N 3.43Å; K483-G486 PolarHBondContact O-N 3.38Å
487	S	57.7	Low	65.6	Low	66 Å²	66	104 Å²	104	46%	0.462	50%	0.503	S	S	.	.	H	α-helix	trans	-76.4	-35.8	-175.1	-165.4	0	0	0	0	112.6	K483	K483-S487 VanDerWaalsContact O-CB 3.3Å; K483-S487 WeakPolarHBondContact O-CB 3.4Å; K483-S487 PolarHBondContact O-N 2.97Å
488	G	55	Low	63.5	Low	54 Å²	54	108.5 Å²	108.5	56%	0.557	53%	0.527	S	S	*	.	H	α-helix	trans	-74.3	-35.8	179.3	0	0	0	0	0	114.6
489	S	52.1	Low	61.4	Low	55 Å²	55	110.5 Å²	110.5	39%	0.385	54%	0.536	S	S	.	.	H	α-helix	trans	-87.2	-25.1	-169.8	-166.7	0	0	0	0	114.6	R493	S489-R493 PolarHBondContact OG-NH1 3.22Å
490	R	52	Low	59.5	Low	205 Å²	205	112.9 Å²	112.9	77%	0.774	55%	0.548	S	S	*	.	H	α-helix	trans	-82.5	-21.9	-178.1	-74.2	-173.7	-175.6	-171.9	2.5	113.8	S494	R490-S494 PolarHBondContact O-OG 2.97Å
491	R	52	Low	57.7	Low	199 Å²	199	119.9 Å²	119.9	75%	0.751	57%	0.574	S	S	*	*	H	α-helix	trans	-89.1	-17.4	-172.5	-149.8	157.4	-171.3	165.8	-0.4	114.5
492	E	47	Very low	56	Low	153 Å²	153	120.4 Å²	120.4	72%	0.715	58%	0.584	S	S	*	*	H	α-helix	trans	-96.6	-33.6	173.6	-67.1	-155.9	149.3	0	0	113.7	S494 R495	E492-S494 PolarHBondContact O-N 3.35Å; E492-S494 VanDerWaalsContact O-N 3.16Å; E492-R495 PolarHBondContact O-N 3.44Å; E492-R495 VanDerWaalsContact O-N 3.12Å
493	R	44	Very low	54.4	Low	183 Å²	183	125.1 Å²	125.1	69%	0.691	59%	0.59	S	S	*	*	H	α-helix	trans	-66.8	-18.6	-179.7	-82.9	177.1	172	164.5	-3.3	114.7	S489 R497	S489-R493 PolarHBondContact OG-NH1 3.22Å; R493-R497 WeakPolarHBondContact O-CB 3.18Å
494	S	46.7	Very low	52.9	Low	72 Å²	72	125.8 Å²	125.8	50%	0.503	60%	0.595	S	S	.	*	H	α-helix	trans	-76.7	-31.4	175.4	-50	0	0	0	0	112	R490 E492 D498	R490-S494 PolarHBondContact O-OG 2.97Å; E492-S494 PolarHBondContact O-N 3.35Å; E492-S494 VanDerWaalsContact O-N 3.16Å; S494-D498 VanDerWaalsContact O-OD2 3.13Å
495	R	48.5	Very low	51.4	Low	204 Å²	204	128.8 Å²	128.8	77%	0.77	60%	0.604	S	S	*	*	H	α-helix	trans	-84.1	-25.4	-175	-74.7	179.1	173.5	165.1	-3.3	114	E492	E492-R495 PolarHBondContact O-N 3.44Å; E492-R495 VanDerWaalsContact O-N 3.12Å
496	E	43	Very low	50.7	Low	152 Å²	152	124 Å²	124	71%	0.71	60%	0.595	S	S	*	*	H	α-helix	trans	-87.7	-27.7	177	-67.4	-169.2	154.2	0	0	113.5	H499	E496-H499 PolarHBondContact O-N 3.38Å
497	R	46.6	Very low	50.1	Low	168 Å²	168	130.6 Å²	130.6	63%	0.634	61%	0.61	S	S	*	*	H	α-helix	trans	-74.3	-27.7	-177.2	-165.9	170.8	-98.3	-174.3	-7.2	112.6	R493 R501	R493-R497 WeakPolarHBondContact O-CB 3.18Å; R497-R501 PolarHBondContact O-N 3.25Å
498	D	48.6	Very low	49.8	Very low	110 Å²	110	135.9 Å²	135.9	59%	0.588	62%	0.619	S	S	*	*	H	α-helix	trans	-72.1	-31.8	175.6	-72.1	-35.6	0	0	0	112.9	S494 S500 S502	S494-D498 VanDerWaalsContact O-OD2 3.13Å; D498-S500 PolarHBondContact O-N 3.15Å; D498-S502 PolarHBondContact O-N 3.5Å
499	H	49.3	Very low	49.7	Very low	150 Å²	150	138.4 Å²	138.4	69%	0.694	62%	0.616	S	S	*	*	H	α-helix	trans	-75.1	-26.3	179.7	-132.5	75.9	0	0	0	113.3	E496	E496-H499 PolarHBondContact O-N 3.38Å
500	S	50.2	Low	49.4	Very low	79 Å²	79	143.8 Å²	143.8	55%	0.552	63%	0.633	S	S	*	*	H	α-helix	trans	-80.9	-38.6	176.8	-58.4	0	0	0	0	111.9	D498 R503 E504	D498-S500 PolarHBondContact O-N 3.15Å; S500-R503 PolarHBondContact O-N 2.99Å; S500-E504 PolarHBondContact O-N 3.49Å
501	R	52.7	Low	49.1	Very low	155 Å²	155	137.6 Å²	137.6	59%	0.585	62%	0.621	S	S	*	*	H	α-helix	trans	-71.4	-31.1	179.7	-77.5	178.3	170.9	174.8	-5.9	113.4	R497 R503 K505	R497-R501 PolarHBondContact O-N 3.25Å; R501-R503 VanDerWaalsContact C-N 3.3Å; R501-R503 PolarHBondContact O-N 2.98Å; R501-K505 WeakPolarHBondContact O-CB 3.39Å; R501-K505 PolarHBondContact O-N 3.11Å
502	S	51.3	Low	49	Very low	71 Å²	71	136 Å²	136	50%	0.497	62%	0.615	S	S	.	*	H	α-helix	trans	-67.2	-33.1	176.1	91.3	0	0	0	0	112.1	D498 S506	D498-S502 PolarHBondContact O-N 3.5Å; S502-S506 WeakPolarHBondContact O-CB 3.41Å; S502-S506 PolarHBondContact O-N 3.28Å; S502-S506 PolarHBondContact O-OG 3.41Å
503	R	51.4	Low	49.1	Very low	177 Å²	177	133 Å²	133	67%	0.668	61%	0.611	S	S	*	*	H	α-helix	trans	-77.4	-32.4	-178.2	-146.3	167.4	-169.2	178	1.9	112.9	S500 R501 S506 R507	S500-R503 PolarHBondContact O-N 2.99Å; R501-R503 VanDerWaalsContact C-N 3.3Å; R501-R503 PolarHBondContact O-N 2.98Å; R503-S506 PolarHBondContact O-OG 3.43Å; R503-R507 WeakPolarHBondContact O-CG 3.14Å
504	E	50.9	Low	49.3	Very low	144 Å²	144	134 Å²	134	67%	0.673	61%	0.614	S	S	*	*	H	α-helix	trans	-76.8	-40.9	171	-91	179.3	150.1	0	0	112.8	S500 R507 R508	S500-E504 PolarHBondContact O-N 3.49Å; E504-R507 PolarHBondContact O-N 3.39Å; E504-R508 PolarHBondContact O-N 2.8Å; E504-R508 VanDerWaalsContact O-N 3.07Å
505	K	50.2	Low	49.5	Very low	101 Å²	101	135.5 Å²	135.5	44%	0.439	62%	0.617	S	S	.	*	H	α-helix	trans	-66.1	-40.7	179.1	-158.5	160.7	-177.7	178.9	0	110.9	R501 R507 R508 H509	R501-K505 WeakPolarHBondContact O-CB 3.39Å; R501-K505 PolarHBondContact O-N 3.11Å; K505-R507 VanDerWaalsContact C-N 3.34Å; K505-R507 PolarHBondContact O-N 3.22Å; K505-R508 PolarHBondContact O-N 3.37Å; K505-H509 WeakPolarHBondContact CG-NE2 3.42Å; K505-H509 PolarHBondContact O-CD2 3.25Å; K505-H509 PolarHBondContact O-N 3.38Å
506	S	52.7	Low	49.6	Very low	71 Å²	71	136 Å²	136	50%	0.497	62%	0.619	S	S	.	*	H	α-helix	trans	-64	-34.4	175.9	68.6	0	0	0	0	113.7	S502 R503 K510	S502-S506 WeakPolarHBondContact O-CB 3.41Å; S502-S506 PolarHBondContact O-N 3.28Å; S502-S506 PolarHBondContact O-OG 3.41Å; R503-S506 PolarHBondContact O-OG 3.43Å; S506-K510 PolarHBondContact O-N 3.34Å
507	R	51.3	Low	50.1	Low	174 Å²	174	134.3 Å²	134.3	66%	0.657	61%	0.611	S	S	*	*	H	α-helix	trans	-70	-39.9	174.8	-72.7	177.8	178.4	-178.5	-0.2	111.8	R503 E504 K505 K510 S511	R503-R507 WeakPolarHBondContact O-CG 3.14Å; E504-R507 PolarHBondContact O-N 3.39Å; K505-R507 VanDerWaalsContact C-N 3.34Å; K505-R507 PolarHBondContact O-N 3.22Å; R507-K510 PolarHBondContact O-N 3.32Å; R507-S511 PolarHBondContact O-N 3.36Å; R507-S511 PolarHBondContact O-OG 3.32Å
508	R	51.6	Low	50.3	Low	176 Å²	176	131.5 Å²	131.5	66%	0.664	61%	0.608	S	S	*	*	H	α-helix	trans	-71.8	-30.6	179.9	-133.8	171.1	-172.1	-177.2	1.5	113.1	E504 K505 R512	E504-R508 PolarHBondContact O-N 2.8Å; E504-R508 VanDerWaalsContact O-N 3.07Å; K505-R508 PolarHBondContact O-N 3.37Å; R508-R512 PolarHBondContact O-N 3.29Å
509	H	51.8	Low	50.5	Low	107 Å²	107	131.2 Å²	131.2	50%	0.495	61%	0.607	S	S	.	*	H	α-helix	trans	-76.8	-27.9	174.1	-72.1	-68.1	0	0	0	113.4	K505 S511 S513	K505-H509 WeakPolarHBondContact CG-NE2 3.42Å; K505-H509 PolarHBondContact O-CD2 3.25Å; K505-H509 PolarHBondContact O-N 3.38Å; H509-S511 VanDerWaalsContact C-N 3.34Å; H509-S513 WeakPolarHBondContact O-CB 3.31Å; H509-S513 PolarHBondContact O-N 3.19Å; H509-S513 VanDerWaalsContact O-N 3.16Å
510	K	45.9	Very low	50.8	Low	169 Å²	169	132.6 Å²	132.6	74%	0.735	61%	0.607	S	S	*	*	H	α-helix	trans	-67.5	-34.5	174.5	-159.6	84.4	176.2	-172.5	0	112.1	S506 R507	S506-K510 PolarHBondContact O-N 3.34Å; R507-K510 PolarHBondContact O-N 3.32Å
511	S	46.2	Very low	50.9	Low	74 Å²	74	135.4 Å²	135.4	52%	0.517	61%	0.607	S	S	.	*	H	α-helix	trans	-71.9	-47.8	176.7	-50.9	0	0	0	0	111.6	R507 H509 S513 R514 D515	R507-S511 PolarHBondContact O-N 3.36Å; R507-S511 PolarHBondContact O-OG 3.32Å; H509-S511 VanDerWaalsContact C-N 3.34Å; S511-S513 VanDerWaalsContact C-N 3.3Å; S511-S513 PolarHBondContact O-N 3.16Å; S511-R514 PolarHBondContact O-N 2.95Å; S511-R514 VanDerWaalsContact O-N 3.11Å; S511-D515 PolarHBondContact O-N 2.95Å; S511-D515 VanDerWaalsContact O-OD2 3.11Å
512	R	48.5	Very low	51.1	Low	167 Å²	167	134.9 Å²	134.9	63%	0.63	61%	0.605	S	S	*	*	H	α-helix	trans	-68.7	-23.1	-178.5	-74.7	179.6	172.3	160.9	-3.3	114.8	R508	R508-R512 PolarHBondContact O-N 3.29Å
513	S	49.6	Very low	51.1	Low	90 Å²	90	138.1 Å²	138.1	63%	0.629	61%	0.612	S	S	*	*	H	α-helix	trans	-77.6	-23.5	175.1	-162.6	0	0	0	0	112.5	H509 S511	H509-S513 WeakPolarHBondContact O-CB 3.31Å; H509-S513 PolarHBondContact O-N 3.19Å; H509-S513 VanDerWaalsContact O-N 3.16Å; S511-S513 VanDerWaalsContact C-N 3.3Å; S511-S513 PolarHBondContact O-N 3.16Å
514	R	48.2	Very low	51.3	Low	202 Å²	202	138.2 Å²	138.2	76%	0.762	61%	0.612	S	S	*	*	H	α-helix	trans	-74.3	-40.5	172.8	-108.1	177.6	179.2	177.4	-1.9	111.9	S511 R516 H517	S511-R514 PolarHBondContact O-N 2.95Å; S511-R514 VanDerWaalsContact O-N 3.11Å; R514-R516 VanDerWaalsContact C-N 3.3Å; R514-R516 PolarHBondContact O-N 3.26Å; R514-H517 PolarHBondContact O-N 3.43Å
515	D	50.8	Low	51.5	Low	105 Å²	105	134.6 Å²	134.6	56%	0.561	60%	0.603	S	S	*	*	H	α-helix	trans	-66.2	-32	-178.2	-61.6	-51.1	0	0	0	112.7	S511 H517 D518	S511-D515 PolarHBondContact O-N 2.95Å; S511-D515 VanDerWaalsContact O-OD2 3.11Å; D515-H517 VanDerWaalsContact C-N 3.3Å; D515-H517 PolarHBondContact O-N 3.49Å; D515-D518 PolarHBondContact O-N 2.89Å
516	R	51.2	Low	51.8	Low	213 Å²	213	136.3 Å²	136.3	80%	0.804	61%	0.607	S	S	*	*	H	α-helix	trans	-73.4	-19.1	179.5	-134.2	179.2	-151.1	179.4	5.7	114.2	R514	R514-R516 VanDerWaalsContact C-N 3.3Å; R514-R516 PolarHBondContact O-N 3.26Å
517	H	52.6	Low	51.9	Low	118 Å²	118	139.2 Å²	139.2	55%	0.546	61%	0.612	S	S	.	*	H	α-helix	trans	-86.6	-21.6	177.4	-164	-98.3	0	0	0	112.1	R514 D515 Y520 Y521	R514-H517 PolarHBondContact O-N 3.43Å; D515-H517 VanDerWaalsContact C-N 3.3Å; D515-H517 PolarHBondContact O-N 3.49Å; H517-Y520 PolarHBondContact O-N 3.03Å; H517-Y521 AromaticContact CE1-CD2 3.62Å; H517-Y521 AromaticContact CE1-CE2 3.24Å; H517-Y521 WeakPolarHBondContact CE1-CE2 3.35Å; H517-Y521 AromaticContact ND1-CD2 3.76Å; H517-Y521 AromaticContact ND1-CE2 3.86Å; H517-Y521 AromaticContact NE2-CE2 3.98Å; H517-Y521 PolarHBondContact O-N 2.89Å
518	D	52	Low	52.3	Low	109 Å²	109	139.7 Å²	139.7	58%	0.583	61%	0.614	S	S	*	*	H	α-helix	trans	-67.6	-34.9	173.7	-107	-73.6	0	0	0	111.8	D515 Y520 Y521 R522	D515-D518 PolarHBondContact O-N 2.89Å; D518-Y520 VanDerWaalsContact C-N 3.32Å; D518-Y520 PolarHBondContact O-N 3.14Å; D518-Y521 PolarHBondContact O-N 3.33Å; D518-R522 WeakPolarHBondContact O-CB 3.41Å; D518-R522 PolarHBondContact O-N 2.76Å
519	D	52.7	Low	52.6	Low	104 Å²	104	137.2 Å²	137.2	56%	0.556	61%	0.61	S	S	*	*	H	α-helix	trans	-63.6	-35.6	177	-77.9	-46.4	0	0	0	112.9	R522 E523	D519-R522 PolarHBondContact O-N 3.45Å; D519-E523 PolarHBondContact O-N 3.48Å
520	Y	54.3	Low	53.1	Low	179 Å²	179	140.9 Å²	140.9	70%	0.702	62%	0.62	S	S	*	*	H	α-helix	trans	-74.2	-32.7	179.2	-142.4	-94.2	0	0	0	112.7	H517 D518 R524	H517-Y520 PolarHBondContact O-N 3.03Å; D518-Y520 VanDerWaalsContact C-N 3.32Å; D518-Y520 PolarHBondContact O-N 3.14Å; Y520-R524 PolarHBondContact O-N 3.4Å
521	Y	53.7	Low	53.9	Low	138 Å²	138	138.1 Å²	138.1	54%	0.541	61%	0.609	S	S	.	*	H	α-helix	trans	-77.4	-29.3	171.5	-89.9	-93.4	0	0	0	112.4	H517 D518 R524 S525	H517-Y521 AromaticContact CE1-CD2 3.62Å; H517-Y521 AromaticContact CE1-CE2 3.24Å; H517-Y521 WeakPolarHBondContact CE1-CE2 3.35Å; H517-Y521 AromaticContact ND1-CD2 3.76Å; H517-Y521 AromaticContact ND1-CE2 3.86Å; H517-Y521 AromaticContact NE2-CE2 3.98Å; H517-Y521 PolarHBondContact O-N 2.89Å; D518-Y521 PolarHBondContact O-N 3.33Å; Y521-R524 PolarHBondContact O-N 3.34Å; Y521-S525 WeakPolarHBondContact O-CB 3.4Å; Y521-S525 PolarHBondContact O-N 3.46Å; Y521-S525 PolarHBondContact O-OG 2.94Å
522	R	55.9	Low	54.7	Low	144 Å²	144	143 Å²	143	54%	0.543	62%	0.616	S	S	.	*	H	α-helix	trans	-73.8	-38.3	178.2	-164.4	168.7	-146.8	160.1	6.7	112.3	D518 D519 S525 R526	D518-R522 WeakPolarHBondContact O-CB 3.41Å; D518-R522 PolarHBondContact O-N 2.76Å; D519-R522 PolarHBondContact O-N 3.45Å; R522-S525 PolarHBondContact O-N 2.85Å; R522-R526 WeakPolarHBondContact O-CB 3.44Å; R522-R526 WeakPolarHBondContact O-CG 3.33Å; R522-R526 PolarHBondContact O-N 3.37Å
523	E	52.2	Low	55.6	Low	138 Å²	138	139.2 Å²	139.2	65%	0.645	61%	0.608	S	S	*	*	H	α-helix	trans	-63.6	-44.3	169.9	-85.3	-159.2	160.9	0	0	111.5	D519 S525 R526 E527	D519-E523 PolarHBondContact O-N 3.48Å; E523-S525 VanDerWaalsContact C-N 3.29Å; E523-S525 PolarHBondContact O-N 3.3Å; E523-R526 PolarHBondContact O-N 3.42Å; E523-E527 WeakPolarHBondContact O-CB 3.24Å; E523-E527 PolarHBondContact O-N 3.32Å
524	R	54.5	Low	56.5	Low	180 Å²	180	143.5 Å²	143.5	68%	0.679	61%	0.611	S	S	*	*	H	α-helix	trans	-66.1	-31.7	178.6	-152.8	172.9	-160.2	177.4	6.1	113.1	Y520 Y521 R528	Y520-R524 PolarHBondContact O-N 3.4Å; Y521-R524 PolarHBondContact O-N 3.34Å; R524-R528 VanDerWaalsContact O-CB 3.32Å; R524-R528 WeakPolarHBondContact O-CB 3.39Å; R524-R528 PolarHBondContact O-N 3.45Å
525	S	55.9	Low	57.6	Low	67 Å²	67	137.9 Å²	137.9	47%	0.469	60%	0.596	S	S	.	*	H	α-helix	trans	-71.6	-40.6	174	-59.1	0	0	0	0	111.4	Y521 R522 E523 R528 E529	Y521-S525 WeakPolarHBondContact O-CB 3.4Å; Y521-S525 PolarHBondContact O-N 3.46Å; Y521-S525 PolarHBondContact O-OG 2.94Å; R522-S525 PolarHBondContact O-N 2.85Å; E523-S525 VanDerWaalsContact C-N 3.29Å; E523-S525 PolarHBondContact O-N 3.3Å; S525-R528 PolarHBondContact O-N 3.36Å; S525-E529 PolarHBondContact O-N 3.03Å
526	R	55.7	Low	58.7	Low	138 Å²	138	140.3 Å²	140.3	52%	0.521	60%	0.597	S	S	.	*	H	α-helix	trans	-67.6	-34.6	174.7	-77.1	176.1	173.1	156.6	-2.3	112.8	R522 E523 R530	R522-R526 WeakPolarHBondContact O-CB 3.44Å; R522-R526 WeakPolarHBondContact O-CG 3.33Å; R522-R526 PolarHBondContact O-N 3.37Å; E523-R526 PolarHBondContact O-N 3.42Å; R526-R530 WeakPolarHBondContact O-CB 3.39Å; R526-R530 VanDerWaalsContact O-CG 3.31Å; R526-R530 WeakPolarHBondContact O-CG 3.42Å; R526-R530 PolarHBondContact O-N 3.45Å
527	E	56	Low	59.7	Low	131 Å²	131	134.6 Å²	134.6	61%	0.612	58%	0.583	S	S	*	*	H	α-helix	trans	-70.6	-36.7	175.7	-150.8	172	-143.8	0	0	111	E523 R530 H531	E523-E527 WeakPolarHBondContact O-CB 3.24Å; E523-E527 PolarHBondContact O-N 3.32Å; E527-R530 PolarHBondContact O-N 3.46Å; E527-H531 PolarHBondContact O-CD2 2.88Å; E527-H531 PolarHBondContact O-N 2.88Å
528	R	58.2	Low	60.9	Low	184 Å²	184	137.4 Å²	137.4	69%	0.694	59%	0.588	S	S	*	*	H	α-helix	trans	-72.8	-34.2	175.9	-157.1	168.2	-163.7	163.3	3.6	113.3	R524 S525 R532	R524-R528 VanDerWaalsContact O-CB 3.32Å; R524-R528 WeakPolarHBondContact O-CB 3.39Å; R524-R528 PolarHBondContact O-N 3.45Å; S525-R528 PolarHBondContact O-N 3.36Å; R528-R532 PolarHBondContact O-N 3.31Å; R528-R532 VanDerWaalsContact O-N 3.14Å
529	E	59.6	Low	62.1	Low	125 Å²	125	136.9 Å²	136.9	58%	0.584	59%	0.585	S	S	*	*	H	α-helix	trans	-66.9	-45.5	170.3	-82.2	-178.5	163.5	0	0	111.2	S525 H531 R532 D533	S525-E529 PolarHBondContact O-N 3.03Å; E529-H531 VanDerWaalsContact C-N 3.25Å; E529-H531 PolarHBondContact O-N 3.43Å; E529-R532 PolarHBondContact O-N 3.41Å; E529-D533 PolarHBondContact O-N 3.14Å
530	R	61.4	Low	63.3	Low	184 Å²	184	138.3 Å²	138.3	69%	0.694	58%	0.583	S	S	*	*	H	α-helix	trans	-59.7	-34.1	175.7	-78.3	177.5	177.4	178.6	0.3	113.4	R526 E527 R534	R526-R530 WeakPolarHBondContact O-CB 3.39Å; R526-R530 VanDerWaalsContact O-CG 3.31Å; R526-R530 WeakPolarHBondContact O-CG 3.42Å; R526-R530 PolarHBondContact O-N 3.45Å; E527-R530 PolarHBondContact O-N 3.46Å; R530-R534 PolarHBondContact O-N 2.86Å; R530-R534 VanDerWaalsContact O-N 3.14Å
531	H	62.9	Low	64.5	Low	111 Å²	111	136 Å²	136	51%	0.514	58%	0.579	S	S	.	*	H	α-helix	trans	-68.7	-43.9	173.2	-95.5	-76.8	0	0	0	112.2	E527 E529 D533 R534 D535	E527-H531 PolarHBondContact O-CD2 2.88Å; E527-H531 PolarHBondContact O-N 2.88Å; E529-H531 VanDerWaalsContact C-N 3.25Å; E529-H531 PolarHBondContact O-N 3.43Å; H531-D533 VanDerWaalsContact C-N 3.34Å; H531-D533 PolarHBondContact O-N 3.46Å; H531-R534 PolarHBondContact O-N 3.25Å; H531-D535 PolarHBondContact O-N 3.04Å
532	R	62.9	Low	65.7	Low	176 Å²	176	137.8 Å²	137.8	66%	0.664	58%	0.584	S	S	*	*	H	α-helix	trans	-64.6	-36.3	176.4	-85.8	-178.3	172.3	162.8	-2.9	113.1	R528 E529 D535 R536	R528-R532 PolarHBondContact O-N 3.31Å; R528-R532 VanDerWaalsContact O-N 3.14Å; E529-R532 PolarHBondContact O-N 3.41Å; R532-D535 PolarHBondContact O-N 2.99Å; R532-R536 PolarHBondContact O-N 3.31Å
533	D	66.7	Low	67	Low	88 Å²	88	135.9 Å²	135.9	47%	0.471	59%	0.585	S	S	.	*	H	α-helix	trans	-68.4	-40.7	176.5	-70.9	-32.9	0	0	0	111.1	E529 H531 D535 R536 D537	E529-D533 PolarHBondContact O-N 3.14Å; H531-D533 VanDerWaalsContact C-N 3.34Å; H531-D533 PolarHBondContact O-N 3.46Å; D533-D535 PolarHBondContact O-N 3.31Å; D533-R536 PolarHBondContact O-N 3.46Å; D533-D537 WeakPolarHBondContact O-CB 3.33Å; D533-D537 PolarHBondContact O-N 3.05Å
534	R	69.8	Low	68.4	Low	179 Å²	179	137 Å²	137	68%	0.675	58%	0.583	S	S	*	*	H	α-helix	trans	-62.5	-40.1	173.6	-97.6	-176.3	-177.1	149.6	1.4	113.6	R530 H531 D537 R538	R530-R534 PolarHBondContact O-N 2.86Å; R530-R534 VanDerWaalsContact O-N 3.14Å; H531-R534 PolarHBondContact O-N 3.25Å; R534-D537 PolarHBondContact O-N 3.06Å; R534-R538 PolarHBondContact O-N 3.18Å
535	D	70.6	Confident	69.7	Low	84 Å²	84	134.9 Å²	134.9	45%	0.449	58%	0.581	S	S	.	*	H	α-helix	trans	-67.7	-41.3	177.6	-69.6	-31.8	0	0	0	110.6	H531 R532 D533 D537 R538 D539	H531-D535 PolarHBondContact O-N 3.04Å; R532-D535 PolarHBondContact O-N 2.99Å; D533-D535 PolarHBondContact O-N 3.31Å; D535-D537 PolarHBondContact O-N 3.42Å; D535-R538 PolarHBondContact O-N 3.39Å; D535-D539 PolarHBondContact O-N 3.3Å
536	R	72.9	Confident	70.9	Confident	157 Å²	157	140.3 Å²	140.3	59%	0.592	59%	0.592	S	S	*	*	H	α-helix	trans	-62.6	-39.2	173.7	-102.5	-178.9	-176.3	163.2	0.9	113.5	R532 D533 D539 R540	R532-R536 PolarHBondContact O-N 3.31Å; D533-R536 PolarHBondContact O-N 3.46Å; R536-D539 PolarHBondContact O-N 3.48Å; R536-R540 WeakPolarHBondContact O-CG 3.42Å; R536-R540 PolarHBondContact O-N 3Å
537	D	74.2	Confident	72.1	Confident	93 Å²	93	139.8 Å²	139.8	50%	0.497	60%	0.595	S	S	.	*	H	α-helix	trans	-69.8	-37	178.5	-73.6	-22.8	0	0	0	111.1	D533 R534 D535 R540 E541	D533-D537 WeakPolarHBondContact O-CB 3.33Å; D533-D537 PolarHBondContact O-N 3.05Å; R534-D537 PolarHBondContact O-N 3.06Å; D535-D537 PolarHBondContact O-N 3.42Å; D537-R540 PolarHBondContact O-N 2.82Å; D537-R540 IonicContact OD1-NH1 3.76Å; D537-R540 PolarHBondContact OD1-NH1 3.37Å; D537-E541 WeakPolarHBondContact O-CB 3.5Å; D537-E541 PolarHBondContact O-N 3.27Å
538	R	75.9	Confident	73.3	Confident	176 Å²	176	142.8 Å²	142.8	66%	0.664	60%	0.602	S	S	*	*	H	α-helix	trans	-63.6	-41	171	-98.9	-176.8	-172.1	163.7	2.7	113.3	R534 D535 E541 R542	R534-R538 PolarHBondContact O-N 3.18Å; D535-R538 PolarHBondContact O-N 3.39Å; R538-E541 PolarHBondContact O-N 3Å; R538-R542 PolarHBondContact O-N 2.96Å
539	D	77.1	Confident	74.4	Confident	98 Å²	98	144.9 Å²	144.9	52%	0.524	61%	0.61	S	S	.	*	H	α-helix	trans	-65.9	-42.5	177.8	-74.4	-24.3	0	0	0	110.6	D535 R536 E541 R542 D543	D535-D539 PolarHBondContact O-N 3.3Å; R536-D539 PolarHBondContact O-N 3.48Å; D539-E541 VanDerWaalsContact C-N 3.32Å; D539-E541 PolarHBondContact O-N 3.22Å; D539-R542 PolarHBondContact O-N 3.42Å; D539-D543 PolarHBondContact O-N 3.13Å
540	R	78.6	Confident	75.3	Confident	134 Å²	134	147.4 Å²	147.4	51%	0.506	62%	0.621	S	S	.	*	H	α-helix	trans	-63.4	-36.3	173.1	-76.1	-175.7	-173.9	120.5	-2.3	113.1	R536 D537 D543 R544	R536-R540 WeakPolarHBondContact O-CG 3.42Å; R536-R540 PolarHBondContact O-N 3Å; D537-R540 PolarHBondContact O-N 2.82Å; D537-R540 IonicContact OD1-NH1 3.76Å; D537-R540 PolarHBondContact OD1-NH1 3.37Å; R540-D543 PolarHBondContact O-N 3.35Å; R540-R544 PolarHBondContact O-N 3.09Å
541	E	80	Confident	75.7	Confident	132 Å²	132	150.9 Å²	150.9	62%	0.617	63%	0.634	S	S	*	*	H	α-helix	trans	-68.9	-40.7	177.3	-157.9	166.3	-138.7	0	0	110.5	D537 R538 D539 R544 E545	D537-E541 WeakPolarHBondContact O-CB 3.5Å; D537-E541 PolarHBondContact O-N 3.27Å; R538-E541 PolarHBondContact O-N 3Å; D539-E541 VanDerWaalsContact C-N 3.32Å; D539-E541 PolarHBondContact O-N 3.22Å; E541-R544 PolarHBondContact O-N 2.85Å; E541-E545 VanDerWaalsContact O-CB 3.32Å; E541-E545 WeakPolarHBondContact O-CB 3.41Å; E541-E545 PolarHBondContact O-N 3.34Å
542	R	79.8	Confident	76.3	Confident	174 Å²	174	152.9 Å²	152.9	66%	0.657	64%	0.64	S	S	*	*	H	α-helix	trans	-63.3	-39.5	170.8	-95.2	-174.8	-177.6	-162	1.1	113.4	R538 D539 E545 R546	R538-R542 PolarHBondContact O-N 2.96Å; D539-R542 PolarHBondContact O-N 3.42Å; R542-E545 PolarHBondContact O-N 2.85Å; R542-R546 WeakPolarHBondContact O-CB 3.44Å; R542-R546 PolarHBondContact O-N 2.85Å
543	D	81.6	Confident	77	Confident	104 Å²	104	151.6 Å²	151.6	56%	0.556	64%	0.639	S	S	*	*	H	α-helix	trans	-67.2	-41.1	177.3	-77.9	-22.2	0	0	0	110.7	D539 R540 R546 E547	D539-D543 PolarHBondContact O-N 3.13Å; R540-D543 PolarHBondContact O-N 3.35Å; D543-R546 PolarHBondContact O-N 3.28Å; D543-E547 WeakPolarHBondContact O-CB 3.32Å; D543-E547 PolarHBondContact O-N 2.89Å
544	R	81.7	Confident	77.6	Confident	161 Å²	161	155.2 Å²	155.2	61%	0.608	65%	0.648	S	S	*	*	H	α-helix	trans	-63.4	-39.7	171.2	-80.5	-171.1	-169.6	120.9	0.8	112.6	R540 E541 R546 E547 Y548	R540-R544 PolarHBondContact O-N 3.09Å; E541-R544 PolarHBondContact O-N 2.85Å; R544-R546 VanDerWaalsContact C-N 3.33Å; R544-E547 PolarHBondContact O-N 3.35Å; R544-Y548 WeakPolarHBondContact O-CB 3.32Å; R544-Y548 PolarHBondContact O-N 2.84Å
545	E	81.7	Confident	78	Confident	137 Å²	137	153.8 Å²	153.8	64%	0.64	65%	0.647	S	S	*	*	H	α-helix	trans	-69.5	-33.3	179.2	-155.2	176.2	-151.4	0	0	111.3	E541 R542 R549	E541-E545 VanDerWaalsContact O-CB 3.32Å; E541-E545 WeakPolarHBondContact O-CB 3.41Å; E541-E545 PolarHBondContact O-N 3.34Å; R542-E545 PolarHBondContact O-N 2.85Å; E545-R549 PolarHBondContact O-N 2.94Å; E545-R549 VanDerWaalsContact O-N 3.09Å
546	R	81.5	Confident	78.5	Confident	181 Å²	181	158.1 Å²	158.1	68%	0.683	66%	0.659	S	S	*	*	H	α-helix	trans	-67.6	-43.6	168.7	-83.5	-175.9	178.6	-156.4	-0	112.1	R542 D543 R544 Y548 R549 H550	R542-R546 WeakPolarHBondContact O-CB 3.44Å; R542-R546 PolarHBondContact O-N 2.85Å; D543-R546 PolarHBondContact O-N 3.28Å; R544-R546 VanDerWaalsContact C-N 3.33Å; R546-Y548 VanDerWaalsContact C-N 3.33Å; R546-R549 PolarHBondContact O-N 3.02Å; R546-R549 VanDerWaalsContact O-N 3.13Å; R546-H550 PolarHBondContact O-N 3.41Å
547	E	81.7	Confident	78.9	Confident	126 Å²	126	158.2 Å²	158.2	59%	0.589	66%	0.664	S	S	*	*	H	α-helix	trans	-64	-40.2	178.2	-166.6	176.7	-165.8	0	0	111.1	D543 R544 R549 H550 R551	D543-E547 WeakPolarHBondContact O-CB 3.32Å; D543-E547 PolarHBondContact O-N 2.89Å; R544-E547 PolarHBondContact O-N 3.35Å; E547-R549 VanDerWaalsContact C-N 3.29Å; E547-R549 PolarHBondContact O-N 3.44Å; E547-H550 PolarHBondContact O-N 3.36Å; E547-R551 WeakPolarHBondContact O-CB 3.47Å; E547-R551 PolarHBondContact O-N 3.41Å
548	Y	80.9	Confident	79.2	Confident	195 Å²	195	162.9 Å²	162.9	77%	0.765	68%	0.676	S	S	*	*	H	α-helix	trans	-68.1	-23.7	172.6	-105.5	-84.3	0	0	0	114.2	R544 R546	R544-Y548 WeakPolarHBondContact O-CB 3.32Å; R544-Y548 PolarHBondContact O-N 2.84Å; R546-Y548 VanDerWaalsContact C-N 3.33Å
549	R	82	Confident	79.5	Confident	228 Å²	228	161.8 Å²	161.8	86%	0.86	68%	0.676	S	S	*	*	H	α-helix	trans	-83.3	-23.4	172.1	-103.1	-171.9	-178	-177	2.8	113.3	E545 R546 E547	E545-R549 PolarHBondContact O-N 2.94Å; E545-R549 VanDerWaalsContact O-N 3.09Å; R546-R549 PolarHBondContact O-N 3.02Å; R546-R549 VanDerWaalsContact O-N 3.13Å; E547-R549 VanDerWaalsContact C-N 3.29Å; E547-R549 PolarHBondContact O-N 3.44Å
550	H	77.8	Confident	79.7	Confident	178 Å²	178	167.2 Å²	167.2	82%	0.824	69%	0.689	S	S	*	*	H	α-helix	trans	-91.1	-19.1	-179.7	-116.6	-63.1	0	0	0	113.3	R546 E547	R546-H550 PolarHBondContact O-N 3.41Å; E547-H550 PolarHBondContact O-N 3.36Å
551	R	68.6	Low	79.7	Confident	256 Å²	256	170.2 Å²	170.2	97%	0.966	71%	0.706	S	S	*	*			trans	-93.7	0	170.9	-162.8	-177.5	-109.3	-173.5	-1.6	109.8	E547	E547-R551 WeakPolarHBondContact O-CB 3.47Å; E547-R551 PolarHBondContact O-N 3.41Å

Retrieved 551 of 551 residues in 356.5 ms (Link to these results)

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