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B-cell lymphoma/leukemia 11B

Key regulator of both differentiation and survival of T-lymphocytes during thymocyte development in mammals¹. Essential in controlling the responsiveness of hematopoietic stem cells to chemotactic signals by modulating the expression of receptors CCR7 and CCR9, which direct the movement of progenitor cells from the bone marrow to the thymus (By similarity). Is a regulator of IL2 promoter and enhances IL2 expression in activated CD4(+) T-lymphocytes². Tumor-suppressor protein involved in T-cell lymphomas. May function on the P53-signaling pathway. Repress transcription through direct, TFCOUP2-independent binding to a GC-rich response element.

AlphaFold DB , UniProt , Accession Q99PV8, Species MOUSE (Mus musculus, Mouse), Gene Bcl11b, Length 884 aa.

						>BC11B_MOUSE|Q99PV8|Bcl11b
MSRRKQGNPQHLSQRELITPEADHVEATILEEDEGLEIEEPSSLGLMVGGPDPDLLTCGQCQMNFPLGDILVFIEHKKKQCGGLGPCYDKVLDKSSPPPSSRSELRRVSEPVEIGIQVTPDEDDHLLSPTKGICPKQENIAGPCRPAQLPSMAPIAASSSHPPTSVITSPLRALGVLPPCFPLPCCGARPISGDGTQGEGQMEAPFGCQCELSGKDEPSSYICTTCKQPFNSAWFLLQHAQNTHGFRIYLEPGPASTSLTPRLTIPPPLGPETVAQSPLMNFLGDSNPFNLLRMTGPILRDHPGFGEGRLPGTPPLFSPPPRHHLDPHRLSAEEMGLVAQHPSAFDRVMRLNPMAIDSPAMDFSRRLRELAGNSSTPPPVSPGRGNPMHRLLNPFQPSPKSPFLSTPPLPPMPAGTPPPQPPAKSKSCEFCGKTFKFQSNLIVHRRSHTGEKPYKCQLCDHACSQASKLKRHMKTHMHKAGSLAGRSDDGLSAASSPEPGTSELPGDLKAADGDFRHHESDPSLGPEPEDDEDEEEEEEELLLENESRPESSFSMDSELGRGRENGGGVPPGVAGAGAAAAALADEKALALGKVMEDAGLGALPQYGEKRGAFLKRAGDTGDAGAVGCGDAGAPGAVNGRGGAFAPGAEPFPALFPRKPAPLPSPGLGGPALHAAKRIKVEKDLELPPAALIPSENVYSQWLVGYAASRHFMKDPFLGFTDARQSPFATSSEHSSENGSLRFSTPPGDLLDGGLSGRSGTASGGSTPHLGGPGPGRPSSKEGRRSDTCEYCGKVFKNCSNLTVHRRSHTGERPYKCELCNYACAQSSKLTRHMKTHGQIGKEVYRCDICQMPFSVYSTLEKHMKKWHGEHLLTNDVKIEQAERS
					

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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	34.5	Very low	45	Very low	225 Å²	225	171.5 Å²	171.5	100%	1.108	86%	0.855	S	S	*	*				0	120.8	0	-62.4	81.2	165.1	0	0	107.4
2	S	39	Very low	44.7	Very low	116 Å²	116	169.9 Å²	169.9	81%	0.811	85%	0.85	S	S	*	*				61.5	117.5	78	-55.3	0	0	0	0	111.9
3	R	46.5	Very low	44.3	Very low	247 Å²	247	164.5 Å²	164.5	93%	0.932	84%	0.839	S	S	*	*			cis	-133.2	143.6	23.5	-70.6	172	154	-171.6	-7	114
4	R	46.2	Very low	44	Very low	224 Å²	224	166.1 Å²	166.1	85%	0.845	84%	0.841	S	S	*	*			trans	-78.1	151.4	150.9	-77.2	179.6	172.9	165.6	-2.2	109.5
5	K	60.4	Low	44	Very low	211 Å²	211	169.1 Å²	169.1	92%	0.917	84%	0.838	S	S	*	*			trans	-140.7	94.1	154.5	-163.9	178.6	-175.7	-172.9	0	109.2
6	Q	49.3	Very low	43.9	Very low	171 Å²	171	168.4 Å²	168.4	80%	0.799	83%	0.832	S	S	*	*			trans	-74.2	144	169.7	-72.5	172.2	-64.3	0	0	109.3
7	G	52.7	Low	43.4	Very low	80 Å²	80	167.9 Å²	167.9	83%	0.825	83%	0.832	S	S	*	*			trans	-131.2	127.2	164	0	0	0	0	0	108.2
8	N	36.2	Very low	43.3	Very low	139 Å²	139	167.7 Å²	167.7	74%	0.743	83%	0.832	S	S	*	*			trans	-153.8	118.6	177.9	178.8	34.8	0	0	0	109.5
9	P	46.9	Very low	42.8	Very low	120 Å²	120	165.2 Å²	165.2	78%	0.779	83%	0.827	S	S	*	*			trans	-102.8	139.3	162.3	6.6	14.8	0	0	0	111.2
10	Q	40.9	Very low	43	Very low	178 Å²	178	162.1 Å²	162.1	83%	0.832	82%	0.82	S	S	*	*			trans	-87.4	-158.2	171.6	-61.5	-178.2	-60.2	0	0	111.5
11	H	42.9	Very low	42.8	Very low	176 Å²	176	162.9 Å²	162.9	82%	0.815	82%	0.82	S	S	*	*			trans	77.6	136.4	-175.2	-101.9	-152.2	0	0	0	113.9
12	L	40.6	Very low	42.9	Very low	152 Å²	152	156.9 Å²	156.9	80%	0.796	81%	0.806	S	S	*	*			cis	-133.9	-177.9	13.3	-105.7	171.4	0	0	0	113.9
13	S	39.3	Very low	43.2	Very low	100 Å²	100	159.3 Å²	159.3	70%	0.699	81%	0.81	S	S	*	*			trans	-105.4	168.9	-170.4	-162.8	0	0	0	0	115.3
14	Q	40.1	Very low	42.7	Very low	186 Å²	186	155.4 Å²	155.4	87%	0.869	80%	0.803	S	S	*	*			trans	-35	149.1	173.9	-55.6	163	-5.1	0	0	117.1
15	R	44.7	Very low	42.5	Very low	212 Å²	212	151.9 Å²	151.9	80%	0.8	81%	0.806	S	S	*	*			trans	-156.3	109.7	141	-170.3	157.1	-167.8	153.2	14.5	115.4
16	E	42.4	Very low	41.3	Very low	158 Å²	158	150.1 Å²	150.1	74%	0.738	80%	0.8	S	S	*	*			trans	54.4	166.6	144.3	-64.5	177.2	141.4	0	0	122.6
17	L	35.9	Very low	40.8	Very low	159 Å²	159	146.1 Å²	146.1	83%	0.832	80%	0.797	S	S	*	*			trans	-137.3	119.4	-163	171.8	82.6	0	0	0	109.4
18	I	41.7	Very low	40.1	Very low	164 Å²	164	148.6 Å²	148.6	84%	0.841	80%	0.796	S	S	*	*			trans	-144.1	129.2	169.4	-54.8	-179.7	0	0	0	110.8
19	T	33.9	Very low	39.8	Very low	120 Å²	120	149.2 Å²	149.2	74%	0.736	80%	0.798	S	S	*	*			trans	-145.6	173.1	162.2	51.7	0	0	0	0	106.6
20	P	45.4	Very low	39.6	Very low	104 Å²	104	151.4 Å²	151.4	68%	0.675	80%	0.802	S	S	*	*			cis	-123	-166.8	-1.7	21.9	4.6	0	0	0	111.6
21	E	38.7	Very low	39.4	Very low	178 Å²	178	151.6 Å²	151.6	83%	0.832	80%	0.803	S	S	*	*				179.2	164.3	114.1	-81.2	-55	68.6	0	0	108.6
22	A	38.2	Very low	39.7	Very low	99 Å²	99	152.6 Å²	152.6	82%	0.818	81%	0.808	S	S	*	*			trans	-133.9	158.6	-171.1	0	0	0	0	0	112.7
23	D	44.3	Very low	39.8	Very low	167 Å²	167	152.8 Å²	152.8	89%	0.893	81%	0.81	S	S	*	*			trans	-148.4	158.1	171.3	-139	-34.6	0	0	0	112.7
24	H	36.2	Very low	40	Very low	166 Å²	166	156.9 Å²	156.9	77%	0.769	82%	0.818	S	S	*	*			trans	-98.1	145.4	-169.2	-95.2	-92.4	0	0	0	113.8
25	V	41.4	Very low	39.8	Very low	150 Å²	150	151.4 Å²	151.4	91%	0.909	81%	0.812	S	S	*	*			trans	-144.9	148.7	139.6	-160.4	0	0	0	0	110.2
26	E	36.8	Very low	39.6	Very low	173 Å²	173	149 Å²	149	81%	0.808	81%	0.814	S	S	*	*			trans	-139.4	138.6	-173.9	179.6	-167	135.9	0	0	109.4
27	A	37	Very low	39.2	Very low	88 Å²	88	150.3 Å²	150.3	73%	0.727	82%	0.82	S	S	*	*			trans	-165.5	112.8	165.7	0	0	0	0	0	115.9
28	T	38.2	Very low	39.4	Very low	132 Å²	132	149.6 Å²	149.6	81%	0.81	82%	0.815	S	S	*	*			trans	45.8	96.2	136.3	58.1	0	0	0	0	122.6
29	I	31.2	Very low	39.2	Very low	151 Å²	151	149.5 Å²	149.5	77%	0.774	81%	0.812	S	S	*	*				-14.3	139.3	129	-42.1	163.4	0	0	0	116.7
30	L	41.4	Very low	39.3	Very low	167 Å²	167	151.7 Å²	151.7	87%	0.874	81%	0.813	S	S	*	*			trans	-150.1	154.7	132.7	-87.8	-169.8	0	0	0	109.9
31	E	37.9	Very low	39.1	Very low	182 Å²	182	151.7 Å²	151.7	85%	0.85	81%	0.813	S	S	*	*			trans	-120.1	138.1	179.7	-59.4	179.6	126.3	0	0	110.2
32	E	48.7	Very low	39	Very low	196 Å²	196	148 Å²	148	92%	0.916	81%	0.807	S	S	*	*			trans	-137.6	148.3	165.8	-41.7	-159.6	128.1	0	0	109.2
33	D	43	Very low	38.7	Very low	157 Å²	157	148.7 Å²	148.7	84%	0.84	81%	0.806	S	S	*	*			trans	-103.5	-155.5	-171	-162.5	-93.2	0	0	0	111.4
34	E	42.6	Very low	38.4	Very low	186 Å²	186	149.5 Å²	149.5	87%	0.869	81%	0.809	S	S	*	*			trans	71.2	130.2	177.5	-45.8	-163.1	144.3	0	0	115.7
35	G	36.1	Very low	38.1	Very low	71 Å²	71	144.8 Å²	144.8	73%	0.732	81%	0.806	S	S	*	*			cis	131.5	96.5	-0.4	0	0	0	0	0	111.3
36	L	40	Very low	37.9	Very low	162 Å²	162	145.3 Å²	145.3	85%	0.848	80%	0.802	S	S	*	*			trans	-161.2	99	173.5	-113.5	162	0	0	0	111.6	I38	L36-I38 HydrophobicContact CD2-CD1 4.09Å
37	E	34.6	Very low	37.8	Very low	184 Å²	184	144.3 Å²	144.3	86%	0.86	80%	0.8	S	S	*	*			trans	-79.3	156.6	160.5	-57.6	-174.9	114.9	0	0	109.9
38	I	39.7	Very low	37.9	Very low	144 Å²	144	147 Å²	147	74%	0.738	81%	0.807	S	S	*	*			trans	-164.3	117.6	154.8	-105.2	147.7	0	0	0	111	L36	L36-I38 HydrophobicContact CD2-CD1 4.09Å
39	E	39	Very low	37.6	Very low	163 Å²	163	144.3 Å²	144.3	76%	0.762	81%	0.805	S	S	*	*			trans	46.3	103.8	147.1	-43	-56.6	72.5	0	0	120.8
40	E	36	Very low	38.1	Very low	166 Å²	166	140.4 Å²	140.4	78%	0.776	80%	0.802	S	S	*	*			trans	-78.8	146.7	132.5	-151	-139.9	112.3	0	0	108	S42	E40-S42 PolarHBondContact OE1-N 2.76Å
41	P	39.8	Very low	38.4	Very low	103 Å²	103	138.9 Å²	138.9	67%	0.669	80%	0.802	S	S	*	*				-153.5	154.3	102.8	37.1	-20.1	0	0	0	115.7
42	S	37.3	Very low	38.9	Very low	100 Å²	100	137.5 Å²	137.5	70%	0.699	80%	0.801	S	S	*	*				171.6	116.4	105.3	-75	0	0	0	0	114.6	E40	E40-S42 PolarHBondContact OE1-N 2.76Å
43	S	31.7	Very low	39.6	Very low	115 Å²	115	132.4 Å²	132.4	80%	0.804	79%	0.785	S	S	*	*			trans	-66.8	133.9	170.9	-48.6	0	0	0	0	114
44	L	37.5	Very low	41	Very low	184 Å²	184	130.7 Å²	130.7	96%	0.963	78%	0.776	S	S	*	*			trans	-142.5	120.1	142.6	-77.3	-176	0	0	0	108.9
45	G	30.2	Very low	42.8	Very low	67 Å²	67	126.5 Å²	126.5	69%	0.691	76%	0.759	S	S	*	*			trans	-125.1	154	-175.5	0	0	0	0	0	113.6
46	L	36.5	Very low	44.9	Very low	160 Å²	160	124.5 Å²	124.5	84%	0.838	73%	0.731	S	S	*	*			trans	-147.3	85.9	175.9	-101.5	150.6	0	0	0	111.5
47	M	34.8	Very low	46.9	Very low	152 Å²	152	120.2 Å²	120.2	75%	0.749	71%	0.712	S	S	*	*			trans	9.5	132.1	146.9	62.7	-149.8	75.5	0	0	121.3
48	V	40.1	Very low	49.3	Very low	145 Å²	145	111.5 Å²	111.5	88%	0.879	67%	0.671	S	S	*	*				160.3	136.5	120.9	157.3	0	0	0	0	112.2
49	G	31.8	Very low	51.2	Low	75 Å²	75	108.5 Å²	108.5	77%	0.773	68%	0.675	S	S	*	*			trans	96	84.9	149.2	0	0	0	0	0	118.9
50	G	40.6	Very low	53	Low	70 Å²	70	107.1 Å²	107.1	72%	0.722	67%	0.669	S	S	*	*	P	Polyproline II helix	trans	-91.8	157.9	157.2	0	0	0	0	0	111.5
51	P	48.6	Very low	55.2	Low	134 Å²	134	101.5 Å²	101.5	87%	0.87	65%	0.648	S	S	*	*	P	Polyproline II helix	trans	-80	151.2	-166.2	31.8	-36.4	0	0	0	115
52	D	48.3	Very low	57.1	Low	153 Å²	153	104 Å²	104	82%	0.818	65%	0.65	S	S	*	*	P	Polyproline II helix	trans	-62.7	152.1	170.2	-69.2	-77.1	0	0	0	112.8
53	P	63	Low	59.1	Low	90 Å²	90	104.2 Å²	104.2	58%	0.584	64%	0.641	S	S	*	*	P	Polyproline II helix	trans	-70.8	146	175.3	30.5	-35.5	0	0	0	111.9	L55	P53-L55 WeakPolarHBondContact O-CG 3.4Å; P53-L55 PolarHBondContact O-N 3.06Å
54	D	72	Confident	61.6	Low	121 Å²	121	103 Å²	103	65%	0.647	63%	0.626	S	S	*	*	P	Polyproline II helix	trans	-61.2	126.2	173.8	-69.5	-63.2	0	0	0	112	L67	D54-L67 HydrophobicContact CB-CB 4.22Å; D54-L67 HydrophobicContact CB-CD1 3.37Å; D54-L67 HydrophobicContact CB-CG 3.58Å; D54-L67 PolarHBondContact O-N 2.82Å
55	L	80.3	Confident	63.8	Low	97 Å²	97	95.7 Å²	95.7	51%	0.508	59%	0.587	S	S	.	*	E	Extended strand (participates in β ladder)	trans	-113.8	137.8	-177.9	-59	173.2	0	0	0	112.9	P53 N64 F65	P53-L55 WeakPolarHBondContact O-CG 3.4Å; P53-L55 PolarHBondContact O-N 3.06Å; L55-N64 HydrophobicContact CB-CB 4.37Å; L55-N64 HydrophobicContact CD1-CB 4.17Å; L55-F65 CarbonylContact C-O 3.5Å; L55-F65 WeakPolarHBondContact CA-O 3.49Å
56	L	80.7	Confident	66.4	Low	30 Å²	30	95.1 Å²	95.1	16%	0.157	57%	0.571	C	S	.	*	E	Extended strand (participates in β ladder)	trans	-93.7	118.6	168.3	-66.1	156.2	0	0	0	109.7	N64 F65 L67 I70 F73	L56-N64 CarbonylContact O-C 3.36Å; L56-N64 WeakPolarHBondContact O-CA 3.49Å; L56-F65 HydrophobicContact CB-CB 4.38Å; L56-F65 PolarHBondContact N-O 3.35Å; L56-F65 PolarHBondContact O-N 3.41Å; L56-L67 HydrophobicContact CD1-CD2 4.13Å; L56-L67 HydrophobicContact CD2-CD2 4.02Å; L56-L67 HydrophobicContact CG-CD2 3.94Å; L56-I70 HydrophobicContact CD1-CB 3.93Å; L56-I70 HydrophobicContact CD1-CG1 3.98Å; L56-F73 HydrophobicContact CB-CB 4.39Å; L56-F73 HydrophobicContact CB-CD1 4.37Å; L56-F73 HydrophobicContact CB-CD2 3.82Å; L56-F73 HydrophobicContact CB-CE2 4.13Å; L56-F73 HydrophobicContact CB-CG 3.94Å; L56-F73 HydrophobicContact CD1-CB 3.99Å; L56-F73 HydrophobicContact CD1-CD1 4.29Å; L56-F73 HydrophobicContact CD1-CG 4.14Å; L56-F73 HydrophobicContact CD2-CD1 4.31Å; L56-F73 HydrophobicContact CD2-CE1 4.34Å; L56-F73 HydrophobicContact CG-CG 4.49Å
57	T	82.3	Confident	68.4	Low	71 Å²	71	91.2 Å²	91.2	44%	0.436	55%	0.55	S	S	.	*	E	Extended strand (participates in β ladder)	trans	-101.6	128.9	178.5	-46.1	0	0	0	0	111.7	G59 M63 N64	T57-G59 PolarHBondContact O-N 2.93Å; T57-G59 VanDerWaalsContact O-N 3.14Å; T57-M63 CarbonylContact C-O 3.27Å; T57-M63 WeakPolarHBondContact CA-O 3.49Å; T57-N64 WeakPolarHBondContact CB-OD1 3.32Å; T57-N64 WeakPolarHBondContact CG2-OD1 3.34Å; T57-N64 PolarHBondContact OG1-OD1 3.38Å
58	C	84.7	Confident	70.6	Confident	2 Å²	2	87.5 Å²	87.5	1%	0.014	55%	0.551	C	S	.	*			trans	-75.4	105.1	170.6	-171.6	0	0	0	0	109.5	Q60 C61 Q62 M63 F73 C81	C58-Q60 PolarHBondContact O-N 2.92Å; C58-C61 PolarHBondContact O-N 3.32Å; C58-Q62 WeakPolarHBondContact O-CA 3.33Å; C58-Q62 PolarHBondContact O-N 3.32Å; C58-M63 PolarHBondContact N-O 3Å; C58-F73 HydrophobicContact CB-CE2 4.24Å; C58-C81 WeakPolarHBondContact CB-SG 3.19Å; C58-C81 WeakPolarHBondContact SG-CB 3.4Å; C58-C81 CovalentContact SG-SG 2.07Å; C58-C81 PolarHBondContact SG-SG 3.1Å
59	G	79.9	Confident	72.7	Confident	80 Å²	80	84.3 Å²	84.3	83%	0.825	53%	0.529	S	S	*	.	T	Hydrogen-bonded Turn	trans	-59.6	0.9	-180	0	0	0	0	0	116.9	T57	T57-G59 PolarHBondContact O-N 2.93Å; T57-G59 VanDerWaalsContact O-N 3.14Å
60	Q	76.5	Confident	75.2	Confident	134 Å²	134	84.2 Å²	84.2	63%	0.626	51%	0.51	S	S	*	.	T	Hydrogen-bonded Turn	trans	-105.4	-13.7	173	-72.5	164.5	-91.9	0	0	113.8	C58 C81	C58-Q60 PolarHBondContact O-N 2.92Å; Q60-C81 WeakPolarHBondContact CB-O 3.4Å; Q60-C81 VanDerWaalsContact CD-O 3.24Å; Q60-C81 PolarHBondContact NE2-O 3.4Å
61	C	81.8	Confident	77.4	Confident	49 Å²	49	87.2 Å²	87.2	33%	0.331	51%	0.509	S	S	.	.	T	Hydrogen-bonded Turn	trans	-141.4	-3.8	179.5	75.7	0	0	0	0	115	C58 M63 H76 C81	C58-C61 PolarHBondContact O-N 3.32Å; C61-M63 PolarHBondContact O-N 2.74Å; C61-M63 WeakPolarHBondContact SG-CG 3.41Å; C61-M63 PolarHBondContact SG-N 3.21Å; C61-H76 PolarHBondContact SG-NE2 2.89Å; C61-C81 PolarHBondContact SG-SG 3.41Å
62	Q	79.5	Confident	79.1	Confident	154 Å²	154	83.8 Å²	83.8	72%	0.72	49%	0.485	S	S	*	.			trans	61.7	14.9	-178.5	-55.4	-178.3	4.2	0	0	116.1	C58	C58-Q62 WeakPolarHBondContact O-CA 3.33Å; C58-Q62 PolarHBondContact O-N 3.32Å
63	M	81	Confident	81	Confident	105 Å²	105	78 Å²	78	52%	0.517	45%	0.453	S	S	.	.			trans	-71.2	137	171.3	-63.8	-60.9	97.2	0	0	111.2	T57 C58 C61 F65	T57-M63 CarbonylContact C-O 3.27Å; T57-M63 WeakPolarHBondContact CA-O 3.49Å; C58-M63 PolarHBondContact N-O 3Å; C61-M63 PolarHBondContact O-N 2.74Å; C61-M63 WeakPolarHBondContact SG-CG 3.41Å; C61-M63 PolarHBondContact SG-N 3.21Å; M63-F65 HydrophobicContact CB-CE2 3.8Å; M63-F65 HydrophobicContact CB-CZ 4.18Å
64	N	82.6	Confident	81.9	Confident	91 Å²	91	77.7 Å²	77.7	49%	0.487	45%	0.445	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-102.8	142.1	179.7	-66.9	-48.3	0	0	0	111.6	L55 L56 T57	L55-N64 HydrophobicContact CB-CB 4.37Å; L55-N64 HydrophobicContact CD1-CB 4.17Å; L56-N64 CarbonylContact O-C 3.36Å; L56-N64 WeakPolarHBondContact O-CA 3.49Å; T57-N64 WeakPolarHBondContact CB-OD1 3.32Å; T57-N64 WeakPolarHBondContact CG2-OD1 3.34Å; T57-N64 PolarHBondContact OG1-OD1 3.38Å
65	F	84.2	Confident	82.6	Confident	30 Å²	30	76 Å²	76	13%	0.132	43%	0.434	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-133.5	139.6	178.2	-59.2	-96.2	0	0	0	108.7	L55 L56 M63 V72 F73 H76	L55-F65 CarbonylContact C-O 3.5Å; L55-F65 WeakPolarHBondContact CA-O 3.49Å; L56-F65 HydrophobicContact CB-CB 4.38Å; L56-F65 PolarHBondContact N-O 3.35Å; L56-F65 PolarHBondContact O-N 3.41Å; M63-F65 HydrophobicContact CB-CE2 3.8Å; M63-F65 HydrophobicContact CB-CZ 4.18Å; F65-V72 HydrophobicContact CD1-CB 4.39Å; F65-V72 HydrophobicContact CD1-CG1 4.07Å; F65-V72 HydrophobicContact CE1-CG1 4.01Å; F65-F73 HydrophobicContact CB-CB 4.22Å; F65-F73 HydrophobicContact CD2-CB 4.35Å; F65-F73 AromaticContact CD2-CD2 3.82Å; F65-F73 HydrophobicContact CD2-CD2 3.82Å; F65-F73 HydrophobicContact CE2-CD2 4.37Å; F65-F73 HydrophobicContact CG-CB 4.21Å; F65-F73 HydrophobicContact CG-CD2 4.47Å; F65-H76 HydrophobicContact CE1-CB 4.16Å; F65-H76 HydrophobicContact CE2-CB 4.27Å; F65-H76 AromaticContact CE2-CD2 3.68Å; F65-H76 AromaticContact CE2-CG 3.84Å; F65-H76 HydrophobicContact CZ-CB 3.67Å; F65-H76 AromaticContact CZ-CD2 3.72Å; F65-H76 AromaticContact CZ-CG 3.38Å; F65-H76 AromaticContact CZ-ND1 3.59Å
66	P	85.9	Confident	82.8	Confident	55 Å²	55	73.3 Å²	73.3	36%	0.357	42%	0.418	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-66.8	152.2	175.9	30	-35.1	0	0	0	111.3	G68 D69	P66-G68 PolarHBondContact O-N 3.09Å; P66-G68 VanDerWaalsContact O-N 3.09Å; P66-D69 HydrophobicContact CG-CB 3.96Å; P66-D69 WeakPolarHBondContact CG-OD2 3.46Å; P66-D69 PolarHBondContact O-N 2.92Å
67	L	78	Confident	83	Confident	77 Å²	77	77.5 Å²	77.5	40%	0.403	44%	0.435	S	S	.	.	G	3₁₀ helix	trans	-53.1	-33.2	-178.4	-98.5	-172.2	0	0	0	114.3	D54 L56 D69 I70	D54-L67 HydrophobicContact CB-CB 4.22Å; D54-L67 HydrophobicContact CB-CD1 3.37Å; D54-L67 HydrophobicContact CB-CG 3.58Å; D54-L67 PolarHBondContact O-N 2.82Å; L56-L67 HydrophobicContact CD1-CD2 4.13Å; L56-L67 HydrophobicContact CD2-CD2 4.02Å; L56-L67 HydrophobicContact CG-CD2 3.94Å; L67-D69 VanDerWaalsContact C-N 3.27Å; L67-D69 PolarHBondContact O-N 3.27Å; L67-I70 PolarHBondContact O-N 2.94Å
68	G	80.8	Confident	82.8	Confident	74 Å²	74	82.7 Å²	82.7	76%	0.763	45%	0.452	S	S	*	.	G	3₁₀ helix	trans	-63.4	-30.5	176.1	0	0	0	0	0	113.6	P66 I70	P66-G68 PolarHBondContact O-N 3.09Å; P66-G68 VanDerWaalsContact O-N 3.09Å; G68-I70 PolarHBondContact O-N 3.35Å
69	D	84.5	Confident	82	Confident	78 Å²	78	89.2 Å²	89.2	42%	0.417	48%	0.48	S	S	.	.	G	3₁₀ helix	trans	-88.9	29.7	-179.6	-72.5	-27.2	0	0	0	112.3	P66 L67 L71 V72 F73	P66-D69 HydrophobicContact CG-CB 3.96Å; P66-D69 WeakPolarHBondContact CG-OD2 3.46Å; P66-D69 PolarHBondContact O-N 2.92Å; L67-D69 VanDerWaalsContact C-N 3.27Å; L67-D69 PolarHBondContact O-N 3.27Å; D69-L71 PolarHBondContact O-N 3.3Å; D69-L71 VanDerWaalsContact O-N 3.11Å; D69-V72 HydrophobicContact CB-CB 4.06Å; D69-V72 HydrophobicContact CB-CG2 3.9Å; D69-V72 CarbonylContact O-C 3.14Å; D69-V72 WeakPolarHBondContact O-CA 3.46Å; D69-V72 WeakPolarHBondContact O-CB 3.38Å; D69-V72 PolarHBondContact O-N 3.5Å; D69-F73 PolarHBondContact O-N 2.78Å
70	I	83.9	Confident	81.1	Confident	73 Å²	73	92.8 Å²	92.8	37%	0.374	48%	0.475	S	S	.	.	H	α-helix	trans	-57.3	-29.6	-179.7	-166.1	167.3	0	0	0	113	L56 L67 G68 F73 I74	L56-I70 HydrophobicContact CD1-CB 3.93Å; L56-I70 HydrophobicContact CD1-CG1 3.98Å; L67-I70 PolarHBondContact O-N 2.94Å; G68-I70 PolarHBondContact O-N 3.35Å; I70-F73 PolarHBondContact O-N 3.29Å; I70-I74 HydrophobicContact CG1-CD1 4.23Å; I70-I74 WeakPolarHBondContact O-CB 3.38Å; I70-I74 WeakPolarHBondContact O-CD1 3.43Å; I70-I74 WeakPolarHBondContact O-CG1 3.34Å; I70-I74 PolarHBondContact O-N 2.91Å
71	L	85.9	Confident	80.4	Confident	134 Å²	134	86.9 Å²	86.9	70%	0.702	45%	0.449	S	S	*	.	H	α-helix	trans	-66.6	-39.7	171.5	-67.8	177.2	0	0	0	112.2	D69 I74 E75	D69-L71 PolarHBondContact O-N 3.3Å; D69-L71 VanDerWaalsContact O-N 3.11Å; L71-I74 PolarHBondContact O-N 3.41Å; L71-E75 VanDerWaalsContact O-CB 3.27Å; L71-E75 WeakPolarHBondContact O-CB 3.25Å; L71-E75 PolarHBondContact O-N 3.06Å
72	V	84.5	Confident	78.7	Confident	61 Å²	61	87.9 Å²	87.9	37%	0.37	47%	0.467	S	S	.	.	H	α-helix	trans	-69.3	-37.3	175.4	-168.5	0	0	0	0	110.6	F65 D69 E75 H76	F65-V72 HydrophobicContact CD1-CB 4.39Å; F65-V72 HydrophobicContact CD1-CG1 4.07Å; F65-V72 HydrophobicContact CE1-CG1 4.01Å; D69-V72 HydrophobicContact CB-CB 4.06Å; D69-V72 HydrophobicContact CB-CG2 3.9Å; D69-V72 CarbonylContact O-C 3.14Å; D69-V72 WeakPolarHBondContact O-CA 3.46Å; D69-V72 WeakPolarHBondContact O-CB 3.38Å; D69-V72 PolarHBondContact O-N 3.5Å; V72-E75 PolarHBondContact O-N 3Å; V72-H76 WeakPolarHBondContact O-CB 3.5Å; V72-H76 PolarHBondContact O-N 3.29Å
73	F	88.1	Confident	76.9	Confident	33 Å²	33	84 Å²	84	15%	0.145	47%	0.468	C	S	.	.	H	α-helix	trans	-62.1	-46	172.1	172.1	-105.6	0	0	0	112.1	L56 C58 F65 D69 I70 H76 K77	L56-F73 HydrophobicContact CB-CB 4.39Å; L56-F73 HydrophobicContact CB-CD1 4.37Å; L56-F73 HydrophobicContact CB-CD2 3.82Å; L56-F73 HydrophobicContact CB-CE2 4.13Å; L56-F73 HydrophobicContact CB-CG 3.94Å; L56-F73 HydrophobicContact CD1-CB 3.99Å; L56-F73 HydrophobicContact CD1-CD1 4.29Å; L56-F73 HydrophobicContact CD1-CG 4.14Å; L56-F73 HydrophobicContact CD2-CD1 4.31Å; L56-F73 HydrophobicContact CD2-CE1 4.34Å; L56-F73 HydrophobicContact CG-CG 4.49Å; C58-F73 HydrophobicContact CB-CE2 4.24Å; F65-F73 HydrophobicContact CB-CB 4.22Å; F65-F73 HydrophobicContact CD2-CB 4.35Å; F65-F73 AromaticContact CD2-CD2 3.82Å; F65-F73 HydrophobicContact CD2-CD2 3.82Å; F65-F73 HydrophobicContact CE2-CD2 4.37Å; F65-F73 HydrophobicContact CG-CB 4.21Å; F65-F73 HydrophobicContact CG-CD2 4.47Å; D69-F73 PolarHBondContact O-N 2.78Å; I70-F73 PolarHBondContact O-N 3.29Å; F73-H76 PolarHBondContact O-N 2.8Å; F73-K77 WeakPolarHBondContact O-CB 3.37Å; F73-K77 PolarHBondContact O-N 3.11Å
74	I	83.7	Confident	75	Confident	82 Å²	82	88 Å²	88	42%	0.421	49%	0.49	S	S	.	.	H	α-helix	trans	-62.5	-43.2	174.5	-70.5	163.6	0	0	0	110.5	I70 L71 K77 K78	I70-I74 HydrophobicContact CG1-CD1 4.23Å; I70-I74 WeakPolarHBondContact O-CB 3.38Å; I70-I74 WeakPolarHBondContact O-CD1 3.43Å; I70-I74 WeakPolarHBondContact O-CG1 3.34Å; I70-I74 PolarHBondContact O-N 2.91Å; L71-I74 PolarHBondContact O-N 3.41Å; I74-K77 PolarHBondContact O-N 2.93Å; I74-K78 WeakPolarHBondContact O-CB 3.45Å; I74-K78 PolarHBondContact O-N 3.12Å
75	E	85.8	Confident	72.9	Confident	86 Å²	86	86.8 Å²	86.8	40%	0.402	50%	0.5	S	S	.	.	H	α-helix	trans	-65.2	-44.2	177.9	-179	168.9	-145.1	0	0	112.2	L71 V72 K77 K78 K79	L71-E75 VanDerWaalsContact O-CB 3.27Å; L71-E75 WeakPolarHBondContact O-CB 3.25Å; L71-E75 PolarHBondContact O-N 3.06Å; V72-E75 PolarHBondContact O-N 3Å; E75-K77 PolarHBondContact O-N 2.96Å; E75-K78 CarbonylContact O-C 3.53Å; E75-K78 PolarHBondContact O-N 2.87Å; E75-K78 VanDerWaalsContact O-N 3.14Å; E75-K79 HydrophobicContact CG-CD 3.69Å; E75-K79 HydrophobicContact CG-CG 4.09Å; E75-K79 VanDerWaalsContact O-CB 3.27Å; E75-K79 WeakPolarHBondContact O-CB 3.25Å; E75-K79 PolarHBondContact O-N 3Å; E75-K79 WeakPolarHBondContact OE1-CE 3.48Å; E75-K79 IonicContact OE1-NZ 2.61Å; E75-K79 PolarHBondContact OE1-NZ 3.47Å
76	H	85.4	Confident	70.9	Confident	41 Å²	41	91.7 Å²	91.7	19%	0.19	53%	0.534	C	S	.	.	H	α-helix	trans	-59.3	-46.3	174.7	170.5	84.9	0	0	0	111.4	C61 F65 V72 F73 K78 K79 Q80 C81	C61-H76 PolarHBondContact SG-NE2 2.89Å; F65-H76 HydrophobicContact CE1-CB 4.16Å; F65-H76 HydrophobicContact CE2-CB 4.27Å; F65-H76 AromaticContact CE2-CD2 3.68Å; F65-H76 AromaticContact CE2-CG 3.84Å; F65-H76 HydrophobicContact CZ-CB 3.67Å; F65-H76 AromaticContact CZ-CD2 3.72Å; F65-H76 AromaticContact CZ-CG 3.38Å; F65-H76 AromaticContact CZ-ND1 3.59Å; V72-H76 WeakPolarHBondContact O-CB 3.5Å; V72-H76 PolarHBondContact O-N 3.29Å; F73-H76 PolarHBondContact O-N 2.8Å; H76-K78 VanDerWaalsContact C-N 3.29Å; H76-K78 PolarHBondContact O-N 3.3Å; H76-K79 PolarHBondContact O-N 3.34Å; H76-Q80 PolarHBondContact O-N 3.47Å; H76-C81 PolarHBondContact NE2-SG 3.13Å; H76-C81 VanDerWaalsContact NE2-SG 3.44Å; H76-C81 PolarHBondContact O-N 3.05Å; H76-C81 VanDerWaalsContact O-N 3.1Å
77	K	84.3	Confident	68.2	Low	118 Å²	118	94.8 Å²	94.8	51%	0.513	56%	0.556	S	S	.	*	H	α-helix	trans	-63.6	-33	174.7	-169	172.3	-177.8	176.1	0	112.6	F73 I74 E75	F73-K77 WeakPolarHBondContact O-CB 3.37Å; F73-K77 PolarHBondContact O-N 3.11Å; I74-K77 PolarHBondContact O-N 2.93Å; E75-K77 PolarHBondContact O-N 2.96Å
78	K	78.2	Confident	66.3	Low	180 Å²	180	101.3 Å²	101.3	78%	0.783	58%	0.577	S	S	*	*	H	α-helix	trans	-81.4	-31.7	178.3	-176.3	175.3	179.9	177.8	0	114.1	I74 E75 H76	I74-K78 WeakPolarHBondContact O-CB 3.45Å; I74-K78 PolarHBondContact O-N 3.12Å; E75-K78 CarbonylContact O-C 3.53Å; E75-K78 PolarHBondContact O-N 2.87Å; E75-K78 VanDerWaalsContact O-N 3.14Å; H76-K78 VanDerWaalsContact C-N 3.29Å; H76-K78 PolarHBondContact O-N 3.3Å
79	K	68.5	Low	63.9	Low	138 Å²	138	103.3 Å²	103.3	60%	0.6	57%	0.57	S	S	*	*	H	α-helix	trans	-103.4	-27.6	-171	-72.8	-170.3	173.4	175.6	0	115.4	E75 H76	E75-K79 HydrophobicContact CG-CD 3.69Å; E75-K79 HydrophobicContact CG-CG 4.09Å; E75-K79 VanDerWaalsContact O-CB 3.27Å; E75-K79 WeakPolarHBondContact O-CB 3.25Å; E75-K79 PolarHBondContact O-N 3Å; E75-K79 WeakPolarHBondContact OE1-CE 3.48Å; E75-K79 IonicContact OE1-NZ 2.61Å; E75-K79 PolarHBondContact OE1-NZ 3.47Å; H76-K79 PolarHBondContact O-N 3.34Å
80	Q	60.1	Low	61.7	Low	156 Å²	156	107.3 Å²	107.3	73%	0.729	58%	0.584	S	S	*	*	T	Hydrogen-bonded Turn	trans	-142	-26.7	-172.6	-66.6	-62.7	-14	0	0	116.2	H76 G82	H76-Q80 PolarHBondContact O-N 3.47Å; Q80-G82 PolarHBondContact O-N 3.49Å
81	C	60.8	Low	59.5	Low	10 Å²	10	109.7 Å²	109.7	7%	0.068	60%	0.601	C	S	.	*	T	Hydrogen-bonded Turn	trans	-72	25.1	-173.1	-137.2	0	0	0	0	114.6	C58 Q60 C61 H76	C58-C81 WeakPolarHBondContact CB-SG 3.19Å; C58-C81 WeakPolarHBondContact SG-CB 3.4Å; C58-C81 CovalentContact SG-SG 2.07Å; C58-C81 PolarHBondContact SG-SG 3.1Å; Q60-C81 WeakPolarHBondContact CB-O 3.4Å; Q60-C81 VanDerWaalsContact CD-O 3.24Å; Q60-C81 PolarHBondContact NE2-O 3.4Å; C61-C81 PolarHBondContact SG-SG 3.41Å; H76-C81 PolarHBondContact NE2-SG 3.13Å; H76-C81 VanDerWaalsContact NE2-SG 3.44Å; H76-C81 PolarHBondContact O-N 3.05Å; H76-C81 VanDerWaalsContact O-N 3.1Å
82	G	46.7	Very low	57.2	Low	69 Å²	69	111 Å²	111	71%	0.711	61%	0.608	S	S	*	*	T	Hydrogen-bonded Turn	trans	-135.3	8.6	-168.9	0	0	0	0	0	117.3	Q80	Q80-G82 PolarHBondContact O-N 3.49Å
83	G	41.8	Very low	55	Low	72 Å²	72	113 Å²	113	74%	0.742	62%	0.617	S	S	*	*			trans	-99.9	127.4	177.1	0	0	0	0	0	113.3
84	L	41.4	Very low	52.6	Low	189 Å²	189	119.6 Å²	119.6	99%	0.99	65%	0.646	S	S	*	*			trans	-78.2	119	173.1	-73.4	167.4	0	0	0	111
85	G	38.2	Very low	50.4	Low	66 Å²	66	121.1 Å²	121.1	68%	0.68	66%	0.663	S	S	*	*			trans	-177.1	127.3	171.1	0	0	0	0	0	112.3
86	P	43.4	Very low	48.1	Very low	133 Å²	133	122.3 Å²	122.3	86%	0.864	68%	0.681	S	S	*	*			trans	-82	158.4	-177.1	33.7	-35.7	0	0	0	112.8	Y88	P86-Y88 PolarHBondContact O-N 2.92Å
87	C	28.5	Very low	45.9	Very low	120 Å²	120	126.2 Å²	126.2	81%	0.811	71%	0.71	S	S	*	*			trans	-67.5	121.8	166.1	-61.7	0	0	0	0	110.2
88	Y	37.1	Very low	43.7	Very low	215 Å²	215	126 Å²	126	84%	0.843	72%	0.721	S	S	*	*				178.7	114.3	118.7	-112.4	-91.3	0	0	0	112.5	P86	P86-Y88 PolarHBondContact O-N 2.92Å
89	D	32.1	Very low	41.9	Very low	115 Å²	115	122.8 Å²	122.8	62%	0.615	72%	0.718	S	S	*	*			trans	60.1	150.5	137.7	-157.8	-157	0	0	0	123
90	K	37.4	Very low	40.2	Very low	162 Å²	162	121.9 Å²	121.9	70%	0.704	73%	0.729	S	S	*	*			trans	74.7	81.8	165.6	-49.1	-149.9	-173.9	-48.8	0	121.5
91	V	37	Very low	39.1	Very low	123 Å²	123	119.5 Å²	119.5	75%	0.745	73%	0.73	S	S	*	*				62.5	126.8	107.5	170.9	0	0	0	0	120.7
92	L	39.3	Very low	37.9	Very low	163 Å²	163	129.8 Å²	129.8	85%	0.853	77%	0.768	S	S	*	*			trans	68.8	144.9	163.1	-100.8	37.1	0	0	0	117.9
93	D	36.4	Very low	37.5	Very low	101 Å²	101	130.3 Å²	130.3	54%	0.54	76%	0.76	S	S	.	*			cis	-177.4	140.3	-17.3	166	-108.3	0	0	0	110.5
94	K	39.4	Very low	37.3	Very low	173 Å²	173	134.2 Å²	134.2	75%	0.752	76%	0.759	S	S	*	*			trans	52.2	145.7	177.1	-96.5	88.5	76.2	-163.6	0	116.9
95	S	36.5	Very low	36.8	Very low	113 Å²	113	132 Å²	132	79%	0.79	75%	0.748	S	S	*	*			cis	-157.1	-179.9	11.7	47.4	0	0	0	0	111.2
96	S	37.9	Very low	36.9	Very low	112 Å²	112	139.9 Å²	139.9	78%	0.783	76%	0.757	S	S	*	*			trans	-123.7	-177.2	-170.1	-29.4	0	0	0	0	111.8
97	P	39.2	Very low	36.6	Very low	123 Å²	123	145.1 Å²	145.1	80%	0.799	76%	0.759	S	S	*	*			cis	-131.3	-128.4	-9.2	41.3	-18.1	0	0	0	113.1
98	P	38.3	Very low	36.7	Very low	114 Å²	114	145.5 Å²	145.5	74%	0.74	76%	0.758	S	S	*	*			trans	-126.6	-151.6	-144.7	43.4	-18.9	0	0	0	113.6
99	P	40.7	Very low	36.6	Very low	112 Å²	112	141 Å²	141	73%	0.727	76%	0.758	S	S	*	*			cis	-129.4	-161.4	-18	42.9	-26.1	0	0	0	114.1
100	S	31.4	Very low	36.8	Very low	118 Å²	118	143.7 Å²	143.7	83%	0.825	77%	0.767	S	S	*	*			trans	94.9	152	175.5	-39.2	0	0	0	0	115.1
101	S	38.2	Very low	37	Very low	107 Å²	107	141.9 Å²	141.9	75%	0.748	77%	0.771	S	S	*	*			cis	-154.7	159.5	10.9	57.8	0	0	0	0	114.3
102	R	35.3	Very low	37	Very low	226 Å²	226	141.6 Å²	141.6	85%	0.853	77%	0.77	S	S	*	*			trans	8.8	142.4	151	-57	171.3	68.2	135.9	-0.9	119
103	S	37.1	Very low	36.9	Very low	80 Å²	80	143 Å²	143	56%	0.559	77%	0.772	S	S	*	*				-172.8	151.1	58.8	-125.9	0	0	0	0	115.6
104	E	37.7	Very low	37.1	Very low	153 Å²	153	141.1 Å²	141.1	72%	0.715	76%	0.761	S	S	*	*			trans	66.7	117	138.8	-70.9	169.1	105.3	0	0	126.1
105	L	31.8	Very low	37.2	Very low	144 Å²	144	135.5 Å²	135.5	75%	0.754	75%	0.752	S	S	*	*				56.4	103.6	129.6	-67.7	164.4	0	0	0	121.1
106	R	39.7	Very low	37.4	Very low	231 Å²	231	136.8 Å²	136.8	87%	0.872	75%	0.749	S	S	*	*				-179.9	140.9	106.4	-99.3	162.6	-179.3	-149.4	-4.3	115.8
107	R	37.1	Very low	37.4	Very low	243 Å²	243	139.4 Å²	139.4	92%	0.917	75%	0.749	S	S	*	*			trans	74.5	134.6	164.5	-63.6	177	176	-132	-7.5	116.9
108	V	30.1	Very low	37.2	Very low	128 Å²	128	138.9 Å²	138.9	78%	0.776	74%	0.743	S	S	*	*			trans	-101.5	133.2	-169.8	175.7	0	0	0	0	110.8
109	S	36.7	Very low	37.5	Very low	120 Å²	120	138 Å²	138	84%	0.839	74%	0.736	S	S	*	*			trans	-161.2	88.5	156.4	-80.6	0	0	0	0	107.4	P111	S109-P111 WeakPolarHBondContact O-CD 3.21Å
110	E	35.8	Very low	38.1	Very low	172 Å²	172	137.3 Å²	137.3	80%	0.804	73%	0.731	S	S	*	*			trans	-75	122.1	-179.8	-66.3	-179.4	132	0	0	110.9	V112	E110-V112 PolarHBondContact O-N 3.31Å
111	P	42.1	Very low	38.7	Very low	123 Å²	123	138.7 Å²	138.7	80%	0.799	73%	0.729	S	S	*	*			trans	-74.1	113.4	161.2	30.4	-29.3	0	0	0	107.8	S109 E113	S109-P111 WeakPolarHBondContact O-CD 3.21Å; P111-E113 PolarHBondContact O-N 2.99Å
112	V	36.8	Very low	39	Very low	118 Å²	118	141.8 Å²	141.8	72%	0.715	73%	0.732	S	S	*	*			trans	-57.3	124	-176.5	-178.3	0	0	0	0	110.3	E110 I114	E110-V112 PolarHBondContact O-N 3.31Å; V112-I114 HydrophobicContact CB-CG1 4.48Å; V112-I114 HydrophobicContact CG1-CD1 4.29Å; V112-I114 HydrophobicContact CG1-CG1 3.96Å; V112-I114 PolarHBondContact O-N 3.47Å
113	E	37.5	Very low	39.2	Very low	192 Å²	192	138.1 Å²	138.1	90%	0.897	73%	0.729	S	S	*	*			trans	-78.7	117.8	179.6	-172.3	169.5	-150	0	0	110.1	P111	P111-E113 PolarHBondContact O-N 2.99Å
114	I	39.3	Very low	39.5	Very low	62 Å²	62	141.5 Å²	141.5	32%	0.318	74%	0.741	S	S	.	*			trans	-120.7	89.7	-169.5	-66	177.8	0	0	0	109.3	V112 T224 F246	V112-I114 HydrophobicContact CB-CG1 4.48Å; V112-I114 HydrophobicContact CG1-CD1 4.29Å; V112-I114 HydrophobicContact CG1-CG1 3.96Å; V112-I114 PolarHBondContact O-N 3.47Å; I114-T224 HydrophobicContact CG2-CG2 4.18Å; I114-T224 WeakPolarHBondContact CG2-OG1 2.94Å; I114-F246 HydrophobicContact CD1-CE2 4.13Å; I114-F246 HydrophobicContact CD1-CZ 3.98Å
115	G	41.2	Very low	39.6	Very low	55 Å²	55	142.5 Å²	142.5	57%	0.567	75%	0.745	S	S	*	*			trans	-81.4	120.5	177.5	0	0	0	0	0	112.3	Q117 T224	G115-Q117 PolarHBondContact O-N 3.09Å; G115-T224 WeakPolarHBondContact O-CG2 3.32Å
116	I	41.7	Very low	39.9	Very low	139 Å²	139	143 Å²	143	71%	0.713	75%	0.748	S	S	*	*			trans	-68.8	113.4	167.7	-56.7	172.1	0	0	0	107.7	V118	I116-V118 HydrophobicContact CG2-CG2 4.28Å
117	Q	37.8	Very low	39.8	Very low	168 Å²	168	139.5 Å²	139.5	79%	0.785	75%	0.745	S	S	*	*			trans	-106	101.2	176.5	-168.6	165.3	24.5	0	0	108.8	G115	G115-Q117 PolarHBondContact O-N 3.09Å
118	V	35.6	Very low	39.5	Very low	111 Å²	111	133.2 Å²	133.2	67%	0.673	74%	0.739	S	S	*	*			trans	-81.4	115.1	169.6	-179.2	0	0	0	0	107.2	I116 P120	I116-V118 HydrophobicContact CG2-CG2 4.28Å; V118-P120 WeakPolarHBondContact O-CD 3.36Å
119	T	42.9	Very low	39.9	Very low	97 Å²	97	132.1 Å²	132.1	60%	0.595	73%	0.734	S	S	*	*			trans	-82.9	115.5	163.1	44.7	0	0	0	0	107.9
120	P	54.9	Low	39.8	Very low	97 Å²	97	132.1 Å²	132.1	63%	0.63	73%	0.73	S	S	*	*			trans	-63.6	135.3	158.1	30	-31.7	0	0	0	107.6	V118 E122	V118-P120 WeakPolarHBondContact O-CD 3.36Å; P120-E122 PolarHBondContact O-N 3.43Å
121	D	43.7	Very low	39.8	Very low	146 Å²	146	133.4 Å²	133.4	78%	0.781	73%	0.733	S	S	*	*			trans	-75.2	116.8	163.4	-125.4	-106.2	0	0	0	106.2	D123	D121-D123 PolarHBondContact O-N 3.35Å
122	E	44.9	Very low	39.4	Very low	172 Å²	172	131.1 Å²	131.1	80%	0.804	73%	0.731	S	S	*	*			trans	-95.1	85.8	-177.8	40.3	-170.9	57.2	0	0	109.9	P120 D124	P120-E122 PolarHBondContact O-N 3.43Å; E122-D124 PolarHBondContact O-N 2.79Å
123	D	39.5	Very low	39.3	Very low	150 Å²	150	133.1 Å²	133.1	80%	0.802	74%	0.736	S	S	*	*			trans	-61	67.9	173.4	-71.6	-71.8	0	0	0	112.8	D121	D121-D123 PolarHBondContact O-N 3.35Å
124	D	42.6	Very low	39	Very low	151 Å²	151	129.8 Å²	129.8	81%	0.807	73%	0.733	S	S	*	*			trans	-127.9	106	171.3	-135.2	-40.5	0	0	0	113.2	E122 L126	E122-D124 PolarHBondContact O-N 2.79Å; D124-L126 PolarHBondContact O-N 3.41Å
125	H	40.9	Very low	39.1	Very low	174 Å²	174	132 Å²	132	81%	0.806	75%	0.752	S	S	*	*			trans	-83.6	110.3	-176.4	-80.4	-34.2	0	0	0	112
126	L	37.5	Very low	38.8	Very low	154 Å²	154	137.9 Å²	137.9	81%	0.806	76%	0.761	S	S	*	*			trans	87.1	152.1	152	-49.6	159.9	0	0	0	118.3	D124	D124-L126 PolarHBondContact O-N 3.41Å
127	L	36.3	Very low	38.5	Very low	157 Å²	157	137.8 Å²	137.8	82%	0.822	76%	0.758	S	S	*	*			trans	81.7	83.5	162.3	-46.1	-173.6	0	0	0	119.2
128	S	32.2	Very low	38.4	Very low	111 Å²	111	137.6 Å²	137.6	78%	0.776	76%	0.757	S	S	*	*				25.6	155.4	116.9	-50.7	0	0	0	0	121.9
129	P	38.6	Very low	38.3	Very low	105 Å²	105	138.2 Å²	138.2	68%	0.682	76%	0.757	S	S	*	*			cis	-143.9	-172.5	-37.1	40.8	-22.4	0	0	0	114
130	T	34.6	Very low	38.1	Very low	121 Å²	121	140.8 Å²	140.8	74%	0.742	77%	0.765	S	S	*	*			trans	67.4	130	155.3	47	0	0	0	0	122.5
131	K	35.2	Very low	37.3	Very low	199 Å²	199	140.9 Å²	140.9	87%	0.865	77%	0.774	S	S	*	*			trans	53.6	96.7	147.1	-66.4	179	177.6	175.8	0	118.3
132	G	33.4	Very low	37	Very low	75 Å²	75	137.3 Å²	137.3	77%	0.773	77%	0.772	S	S	*	*			trans	-80.2	168.1	161.4	0	0	0	0	0	114
133	I	34.2	Very low	36.9	Very low	159 Å²	159	134.9 Å²	134.9	82%	0.815	77%	0.771	S	S	*	*			trans	-148.1	146.9	169	-87.2	131.8	0	0	0	108.4
134	C	32.6	Very low	36.4	Very low	123 Å²	123	133.2 Å²	133.2	83%	0.831	77%	0.77	S	S	*	*			trans	-140	145.6	160.7	-141	0	0	0	0	108.3
135	P	40.7	Very low	36.1	Very low	109 Å²	109	137.5 Å²	137.5	71%	0.708	77%	0.774	S	S	*	*				-128.5	147.6	-69.7	35.6	-25	0	0	0	112.7
136	K	34.8	Very low	36.1	Very low	178 Å²	178	134.8 Å²	134.8	77%	0.774	77%	0.772	S	S	*	*			trans	-154.4	117.4	161	-163.8	156	-177.3	178.4	0	114.1
137	Q	34.7	Very low	36	Very low	137 Å²	137	131.8 Å²	131.8	64%	0.64	77%	0.77	S	S	*	*			trans	72.7	114.7	142.3	-172.2	170.9	-17.1	0	0	120.2
138	E	36.9	Very low	36.1	Very low	163 Å²	163	133.7 Å²	133.7	76%	0.762	77%	0.774	S	S	*	*			trans	62.7	145.7	149.2	90.5	-173.4	96	0	0	120.3
139	N	33	Very low	36.1	Very low	125 Å²	125	136.2 Å²	136.2	67%	0.668	78%	0.779	S	S	*	*			cis	-169.6	151.9	-13.9	157	-86.5	0	0	0	110.2
140	I	39	Very low	36.4	Very low	150 Å²	150	137.6 Å²	137.6	77%	0.769	79%	0.787	S	S	*	*			trans	67.5	126.1	165.9	-81.3	173.7	0	0	0	120.4
141	A	38.4	Very low	36.5	Very low	100 Å²	100	136.6 Å²	136.6	83%	0.826	79%	0.786	S	S	*	*				125.5	48.4	118	0	0	0	0	0	123.3
142	G	36.6	Very low	36.8	Very low	70 Å²	70	135.5 Å²	135.5	72%	0.722	79%	0.785	S	S	*	*			trans	103.5	167	133	0	0	0	0	0	120.9
143	P	43.1	Very low	37	Very low	121 Å²	121	135.9 Å²	135.9	79%	0.786	78%	0.781	S	S	*	*			trans	-145.2	-177.3	-149.2	44.6	-24.5	0	0	0	119.4
144	C	29.7	Very low	37.9	Very low	116 Å²	116	133.3 Å²	133.3	78%	0.784	78%	0.775	S	S	*	*			trans	88.7	119.4	145.9	-72	0	0	0	0	124.7
145	R	36	Very low	38.2	Very low	240 Å²	240	135.1 Å²	135.1	91%	0.906	78%	0.775	S	S	*	*			trans	90.1	146	131.8	-89.2	-167.1	138.8	-145.5	-6	123.4
146	P	41.6	Very low	38	Very low	117 Å²	117	134.2 Å²	134.2	76%	0.76	78%	0.776	S	S	*	*			trans	-117.1	174	-179.5	44.2	-34.8	0	0	0	115.6
147	A	35.4	Very low	38.2	Very low	91 Å²	91	130.2 Å²	130.2	75%	0.752	78%	0.776	S	S	*	*			trans	-163.3	144.8	162.8	0	0	0	0	0	116.1
148	Q	36.7	Very low	38.6	Very low	197 Å²	197	128.6 Å²	128.6	92%	0.921	78%	0.781	S	S	*	*			trans	72.5	149.2	148.2	-72.5	176.3	-17.3	0	0	124
149	L	33.4	Very low	38.9	Very low	165 Å²	165	126.2 Å²	126.2	86%	0.864	78%	0.782	S	S	*	*			trans	-99.5	170.4	175.8	-68.7	162.6	0	0	0	111.3
150	P	44.3	Very low	39.4	Very low	133 Å²	133	124.8 Å²	124.8	86%	0.864	78%	0.781	S	S	*	*				-147	-176.5	110.1	38.2	-21.7	0	0	0	116.3
151	S	37.3	Very low	40	Very low	101 Å²	101	125.3 Å²	125.3	71%	0.706	78%	0.78	S	S	*	*			trans	-96.2	162.2	-171.5	173.3	0	0	0	0	114.7
152	M	41.1	Very low	40.6	Very low	175 Å²	175	126.1 Å²	126.1	86%	0.862	78%	0.777	S	S	*	*			trans	-179.5	153.6	130.3	-94.1	-67.1	104.2	0	0	112.8
153	A	37.8	Very low	41.4	Very low	83 Å²	83	128 Å²	128	69%	0.686	78%	0.777	S	S	*	*			trans	-112.9	179.7	173.7	0	0	0	0	0	111.2
154	P	52.8	Low	41.2	Very low	106 Å²	106	128.8 Å²	128.8	69%	0.688	78%	0.78	S	S	*	*				-162.2	167.4	104.6	41.2	-21	0	0	0	119.4
155	I	38.9	Very low	41.7	Very low	160 Å²	160	127.9 Å²	127.9	82%	0.821	78%	0.775	S	S	*	*			trans	41	159.8	141.8	72.3	-163.4	0	0	0	123.9
156	A	36	Very low	41.7	Very low	90 Å²	90	122.7 Å²	122.7	74%	0.744	77%	0.769	S	S	*	*			cis	-177.7	-173.6	-28.4	0	0	0	0	0	110.2
157	A	39.8	Very low	41.6	Very low	94 Å²	94	124 Å²	124	78%	0.777	77%	0.769	S	S	*	*			trans	78.4	148.7	171	0	0	0	0	0	118.1
158	S	43.3	Very low	41.6	Very low	104 Å²	104	124.7 Å²	124.7	73%	0.727	76%	0.763	S	S	*	*			cis	-168.9	153	-14.7	-95.8	0	0	0	0	112.3
159	S	43.1	Very low	41.4	Very low	112 Å²	112	120.5 Å²	120.5	78%	0.783	76%	0.756	S	S	*	*			trans	58.1	149.9	156.8	44.8	0	0	0	0	120.5
160	S	43.9	Very low	41.9	Very low	95 Å²	95	117.6 Å²	117.6	66%	0.664	75%	0.747	S	S	*	*			cis	-158.7	129.1	-1.3	45.7	0	0	0	0	114.4
161	H	50.9	Low	41.4	Very low	161 Å²	161	118 Å²	118	75%	0.745	74%	0.741	S	S	*	*			trans	-16.1	172.1	141	21.7	-105.4	0	0	0	121.2
162	P	51.7	Low	41.4	Very low	117 Å²	117	124.5 Å²	124.5	76%	0.76	75%	0.75	S	S	*	*			cis	-140.3	-134	-14.7	38.6	-13.1	0	0	0	114.6
163	P	52.4	Low	41.2	Very low	109 Å²	109	120.7 Å²	120.7	71%	0.708	75%	0.746	S	S	*	*				-141.6	172.2	-122.5	43.9	-20.9	0	0	0	119.6
164	T	38.5	Very low	41.2	Very low	139 Å²	139	125 Å²	125	85%	0.853	76%	0.757	S	S	*	*			trans	-177.4	144.1	144.5	37.3	0	0	0	0	108
165	S	40.2	Very low	40.5	Very low	97 Å²	97	123.6 Å²	123.6	68%	0.678	76%	0.762	S	S	*	*			cis	-168	129.4	-11.5	53.1	0	0	0	0	107.3
166	V	37.5	Very low	40.5	Very low	131 Å²	131	122.2 Å²	122.2	79%	0.794	76%	0.76	S	S	*	*				65.9	121.5	105.9	174.4	0	0	0	0	113.1
167	I	37.9	Very low	40.7	Very low	145 Å²	145	125.1 Å²	125.1	74%	0.744	76%	0.763	S	S	*	*			cis	-164.5	159.6	10.5	-133.9	178.9	0	0	0	113.8
168	T	36	Very low	41.1	Very low	105 Å²	105	126.2 Å²	126.2	64%	0.644	76%	0.761	S	S	*	*			trans	49.1	100.9	147.9	-51.9	0	0	0	0	123.1
169	S	33	Very low	41.4	Very low	109 Å²	109	126.2 Å²	126.2	76%	0.762	76%	0.759	S	S	*	*				17.4	-177.3	100.4	-46.2	0	0	0	0	121.4
170	P	43.3	Very low	41.2	Very low	104 Å²	104	126.9 Å²	126.9	68%	0.675	76%	0.763	S	S	*	*			cis	-133.7	-165.1	-38.4	25.9	-1.2	0	0	0	113.6
171	L	34.9	Very low	40.8	Very low	140 Å²	140	131.2 Å²	131.2	73%	0.733	77%	0.77	S	S	*	*			trans	79.3	115	158.6	-53.1	-172.4	0	0	0	117.4
172	R	35.7	Very low	40.5	Very low	239 Å²	239	129 Å²	129	90%	0.902	77%	0.77	S	S	*	*				79.4	106.6	80.1	-77.6	-171.4	175.9	172.9	-5.2	115.1
173	A	37.8	Very low	39.8	Very low	95 Å²	95	130.8 Å²	130.8	79%	0.785	77%	0.772	S	S	*	*			trans	-165.3	110.3	132.1	0	0	0	0	0	112.3
174	L	38.6	Very low	39.6	Very low	174 Å²	174	131.4 Å²	131.4	91%	0.911	78%	0.776	S	S	*	*			trans	39	113.2	131.3	-55.5	176.8	0	0	0	120.9
175	G	38	Very low	39.4	Very low	76 Å²	76	130.5 Å²	130.5	78%	0.784	77%	0.774	S	S	*	*			trans	-139.6	118.9	153	0	0	0	0	0	108.4
176	V	37.1	Very low	39.2	Very low	131 Å²	131	132.5 Å²	132.5	79%	0.794	79%	0.787	S	S	*	*	P	Polyproline II helix	trans	-85.5	125.9	-155.3	177.2	0	0	0	0	113.6
177	L	41	Very low	39.1	Very low	151 Å²	151	130.3 Å²	130.3	79%	0.791	79%	0.79	S	S	*	*	P	Polyproline II helix	trans	-88.4	144.8	157.5	-68.9	171.1	0	0	0	109.4	P179	L177-P179 VanDerWaalsContact O-CD 3.26Å; L177-P179 WeakPolarHBondContact O-CD 3.4Å
178	P	49.1	Very low	39	Very low	116 Å²	116	128 Å²	128	75%	0.753	79%	0.793	S	S	*	*	P	Polyproline II helix	trans	-75.7	118.7	175.4	30	-32.7	0	0	0	111.1
179	P	49.4	Very low	39.1	Very low	104 Å²	104	134.3 Å²	134.3	68%	0.675	81%	0.805	S	S	*	*	P	Polyproline II helix	trans	-78	138.6	165.3	33.1	-32.2	0	0	0	109.7	L177 F181	L177-P179 VanDerWaalsContact O-CD 3.26Å; L177-P179 WeakPolarHBondContact O-CD 3.4Å; P179-F181 PolarHBondContact O-N 2.73Å
180	C	38.1	Very low	39.4	Very low	127 Å²	127	134.1 Å²	134.1	86%	0.858	80%	0.801	S	S	*	*	P	Polyproline II helix	trans	-68.8	122.6	170.8	-61.1	0	0	0	0	109.6	P182	C180-P182 WeakPolarHBondContact O-CD 3.2Å
181	F	34.9	Very low	38.9	Very low	185 Å²	185	137.4 Å²	137.4	81%	0.811	81%	0.811	S	S	*	*	P	Polyproline II helix	trans	-69.6	124.1	172.8	-87.6	-94.7	0	0	0	111	P179	P179-F181 PolarHBondContact O-N 2.73Å
182	P	45.3	Very low	39.3	Very low	116 Å²	116	136.4 Å²	136.4	75%	0.753	82%	0.816	S	S	*	*			trans	-80.3	114.9	157.8	32.1	-28.3	0	0	0	108.6	C180	C180-P182 WeakPolarHBondContact O-CD 3.2Å
183	L	36.7	Very low	39.4	Very low	154 Å²	154	128.5 Å²	128.5	81%	0.806	81%	0.809	S	S	*	*	P	Polyproline II helix	trans	-80.9	125.4	171.8	-76.6	171.3	0	0	0	109.8	C185	L183-C185 PolarHBondContact O-N 3.24Å
184	P	48.7	Very low	39.5	Very low	122 Å²	122	132 Å²	132	79%	0.792	82%	0.815	S	S	*	*	P	Polyproline II helix	trans	-80.6	119.4	-179	31	-33.1	0	0	0	111.3
185	C	33.3	Very low	39.5	Very low	119 Å²	119	126.5 Å²	126.5	80%	0.804	80%	0.799	S	S	*	*	P	Polyproline II helix	trans	-80.6	150.7	167.1	-70.9	0	0	0	0	111.3	L183	L183-C185 PolarHBondContact O-N 3.24Å
186	C	36.4	Very low	39.7	Very low	140 Å²	140	129.3 Å²	129.3	95%	0.946	80%	0.802	S	S	*	*			trans	66.8	88.7	170.8	-60.2	0	0	0	0	117
187	G	35.8	Very low	40	Very low	85 Å²	85	132.5 Å²	132.5	88%	0.876	81%	0.808	S	S	*	*			trans	-142	75.5	167.6	0	0	0	0	0	112.4
188	A	36.9	Very low	39.9	Very low	97 Å²	97	129 Å²	129	80%	0.802	81%	0.809	S	S	*	*			trans	-102	119.3	-175.3	0	0	0	0	0	112.8
189	R	37	Very low	39.4	Very low	236 Å²	236	133.5 Å²	133.5	89%	0.891	82%	0.82	S	S	*	*			trans	176.6	156.4	164.4	-107.6	159.2	172.9	-79.1	-4.7	111.3
190	P	39.3	Very low	39	Very low	106 Å²	106	132.5 Å²	132.5	69%	0.688	83%	0.828	S	S	*	*			cis	-125.9	163.3	-47.4	35.1	-20	0	0	0	111.9
191	I	33.4	Very low	39	Very low	172 Å²	172	135.8 Å²	135.8	88%	0.882	83%	0.831	S	S	*	*			trans	-81.4	131.8	173.2	-67.6	173	0	0	0	110.5
192	S	42.1	Very low	39.2	Very low	120 Å²	120	134.9 Å²	134.9	84%	0.839	83%	0.831	S	S	*	*			trans	-160.2	135.5	164.4	-67.4	0	0	0	0	108.5
193	G	37.9	Very low	38.8	Very low	72 Å²	72	137.5 Å²	137.5	74%	0.742	83%	0.833	S	S	*	*			cis	168.1	79.4	-5.9	0	0	0	0	0	113.4
194	D	40	Very low	38.9	Very low	170 Å²	170	134.5 Å²	134.5	91%	0.909	83%	0.831	S	S	*	*			trans	-163.7	140.2	171	-133.3	-55.8	0	0	0	108.1
195	G	38.2	Very low	38.7	Very low	57 Å²	57	133.5 Å²	133.5	59%	0.588	82%	0.824	S	S	*	*			cis	167.6	107.8	-13.4	0	0	0	0	0	112.9
196	T	44	Very low	38.7	Very low	136 Å²	136	137.3 Å²	137.3	83%	0.834	83%	0.827	S	S	*	*			trans	-168.9	119.3	157.5	24.2	0	0	0	0	112.7
197	Q	41.6	Very low	38.6	Very low	197 Å²	197	134.6 Å²	134.6	92%	0.921	82%	0.823	S	S	*	*			trans	28.3	119.2	141.4	-55.2	179.8	16.9	0	0	120.4
198	G	40.1	Very low	38.4	Very low	79 Å²	79	136.3 Å²	136.3	81%	0.814	82%	0.82	S	S	*	*			trans	171.2	95.5	164.8	0	0	0	0	0	112.3
199	E	39.4	Very low	38.1	Very low	210 Å²	210	139.8 Å²	139.8	98%	0.981	82%	0.82	S	S	*	*			trans	-83.9	134.2	-175.4	-57.5	-168.8	110.4	0	0	112.4
200	G	39.2	Very low	38	Very low	82 Å²	82	133.5 Å²	133.5	85%	0.845	81%	0.811	S	S	*	*			trans	-174.4	75.4	-175.2	0	0	0	0	0	113.9
201	Q	38.4	Very low	37.6	Very low	197 Å²	197	136.4 Å²	136.4	92%	0.921	82%	0.815	S	S	*	*			trans	-88.9	118.7	-172.7	173.5	-175.4	95.1	0	0	112.8
202	M	39.6	Very low	37.9	Very low	165 Å²	165	134.3 Å²	134.3	81%	0.813	81%	0.805	S	S	*	*			trans	-169.2	111.3	160.9	-168.3	69.4	177.4	0	0	113.6
203	E	37.6	Very low	37.5	Very low	172 Å²	172	133.8 Å²	133.8	80%	0.804	80%	0.802	S	S	*	*			trans	62.7	164.3	156.8	-56	-60.6	76.8	0	0	122.5
204	A	39	Very low	37.3	Very low	91 Å²	91	133.6 Å²	133.6	75%	0.752	80%	0.8	S	S	*	*			trans	-123.7	-149.1	-163.4	0	0	0	0	0	110.2
205	P	44.3	Very low	37.4	Very low	100 Å²	100	133.1 Å²	133.1	65%	0.649	79%	0.789	S	S	*	*			cis	-140.6	-170.6	-1.4	27.3	0.7	0	0	0	116.4
206	F	33.5	Very low	38	Very low	200 Å²	200	137.8 Å²	137.8	88%	0.877	80%	0.801	S	S	*	*			trans	64.5	82.6	160	-54.2	-57.8	0	0	0	120
207	G	33.8	Very low	38.6	Very low	83 Å²	83	138.5 Å²	138.5	86%	0.856	80%	0.795	S	S	*	*			trans	-87.6	125.4	147.1	0	0	0	0	0	110.2
208	C	31.8	Very low	39.6	Very low	121 Å²	121	132.2 Å²	132.2	82%	0.818	77%	0.771	S	S	*	*			trans	-84.5	135.1	-175.4	-160.6	0	0	0	0	112.4
209	Q	30.5	Very low	40.9	Very low	169 Å²	169	133.5 Å²	133.5	79%	0.79	77%	0.767	S	S	*	*			trans	-103.6	92.2	-175.4	-173.9	175.8	6.4	0	0	110.8
210	C	33.9	Very low	42.7	Very low	104 Å²	104	126.6 Å²	126.6	70%	0.703	74%	0.742	S	S	*	*			trans	-113.6	81.2	-178.8	-68.7	0	0	0	0	111.9	L212	C210-L212 PolarHBondContact O-N 2.87Å
211	E	31.9	Very low	44.9	Very low	168 Å²	168	125 Å²	125	79%	0.785	71%	0.711	S	S	*	*			trans	-72.1	91.6	165	-71.7	-173.8	86.2	0	0	110.1
212	L	38.8	Very low	47.1	Very low	128 Å²	128	119.4 Å²	119.4	67%	0.67	69%	0.687	S	S	*	*			trans	-107.1	69.6	161.7	-72.4	-177.3	0	0	0	109.7	C210	C210-L212 PolarHBondContact O-N 2.87Å
213	S	33.6	Very low	49.3	Very low	109 Å²	109	111.6 Å²	111.6	76%	0.762	65%	0.649	S	S	*	*			trans	-57.8	153	162.8	-173.1	0	0	0	0	111
214	G	34.3	Very low	51.3	Low	68 Å²	68	106.1 Å²	106.1	70%	0.701	63%	0.627	S	S	*	*			trans	47.5	82.8	160.3	0	0	0	0	0	116.5
215	K	42.1	Very low	53.2	Low	159 Å²	159	105.1 Å²	105.1	69%	0.691	61%	0.611	S	S	*	*			trans	-133.5	96.3	162.9	-67	-174.1	-178.7	178.3	0	109	E217	K215-E217 PolarHBondContact O-N 3.44Å
216	D	50.5	Low	55.2	Low	155 Å²	155	102.4 Å²	102.4	83%	0.829	60%	0.595	S	S	*	*			trans	-50.2	127	179.8	-68.5	-111.1	0	0	0	111.7
217	E	56.8	Low	57.7	Low	151 Å²	151	101.1 Å²	101.1	71%	0.706	59%	0.589	S	S	*	*			trans	-62.5	127.2	165.6	-177.2	168.2	90.5	0	0	107.6	K215 S219 Y221	K215-E217 PolarHBondContact O-N 3.44Å; E217-S219 PolarHBondContact O-N 3.1Å; E217-Y221 WeakPolarHBondContact CG-OH 3.47Å
218	P	62.8	Low	60.1	Low	65 Å²	65	102.1 Å²	102.1	42%	0.422	57%	0.571	S	S	.	*			trans	-61.3	109.4	-170.2	22.1	-33.4	0	0	0	110.7	S220 Y221	P218-S220 PolarHBondContact O-N 2.97Å; P218-Y221 HydrophobicContact CG-CE1 3.94Å; P218-Y221 HydrophobicContact CG-CE2 4.48Å; P218-Y221 WeakPolarHBondContact O-CE2 3.49Å
219	S	66.8	Low	62.7	Low	106 Å²	106	99.9 Å²	99.9	74%	0.741	56%	0.555	S	S	*	*	S	Bend	trans	-57.9	-17.8	-171.4	-167.2	0	0	0	0	114.1	E217 N231	E217-S219 PolarHBondContact O-N 3.1Å; S219-N231 WeakPolarHBondContact O-CA 2.99Å
220	S	77.8	Confident	65.4	Low	65 Å²	65	93.6 Å²	93.6	46%	0.455	53%	0.525	S	S	.	.			trans	-134.4	138.2	165.7	71.4	0	0	0	0	112.9	P218	P218-S220 PolarHBondContact O-N 2.97Å
221	Y	85.7	Confident	67.7	Low	48 Å²	48	95.1 Å²	95.1	19%	0.188	53%	0.526	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-113	120	174.4	-61.3	-102.7	0	0	0	108.5	E217 P218 P229 F230 S232 A233	E217-Y221 WeakPolarHBondContact CG-OH 3.47Å; P218-Y221 HydrophobicContact CG-CE1 3.94Å; P218-Y221 HydrophobicContact CG-CE2 4.48Å; P218-Y221 WeakPolarHBondContact O-CE2 3.49Å; Y221-P229 CarbonylContact O-C 3.5Å; Y221-F230 PolarHBondContact N-O 2.92Å; Y221-F230 PolarHBondContact O-N 3.01Å; Y221-S232 VanDerWaalsContact CD2-C 3.44Å; Y221-A233 HydrophobicContact CD1-CB 4.26Å; Y221-A233 HydrophobicContact CE1-CB 3.78Å; Y221-A233 HydrophobicContact CE2-CB 4.27Å
222	I	83.8	Confident	70.3	Confident	80 Å²	80	88.9 Å²	88.9	41%	0.41	50%	0.501	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-93	127.5	-178.1	-57.7	175.1	0	0	0	110.2	T224 Q228 P229	I222-T224 PolarHBondContact O-N 3.26Å; I222-Q228 CarbonylContact C-O 3.51Å; I222-Q228 WeakPolarHBondContact CA-O 3.21Å; I222-P229 HydrophobicContact CG1-CB 4.41Å
223	C	85.6	Confident	72.5	Confident	2 Å²	2	84.4 Å²	84.4	1%	0.014	48%	0.483	C	S	.	.			trans	-71.3	101.4	168.4	-177.6	0	0	0	0	110.1	T225 C226 K227 Q228 F230 L236 H239 H244	C223-T225 PolarHBondContact O-N 3.25Å; C223-C226 PolarHBondContact O-N 3.3Å; C223-C226 VanDerWaalsContact O-N 3.1Å; C223-C226 VanDerWaalsContact SG-SG 3.63Å; C223-K227 VanDerWaalsContact O-CA 3.25Å; C223-K227 WeakPolarHBondContact O-CA 3.15Å; C223-K227 PolarHBondContact O-N 2.92Å; C223-Q228 PolarHBondContact N-O 2.92Å; C223-F230 HydrophobicContact CB-CD2 4.3Å; C223-F230 HydrophobicContact CB-CE2 3.67Å; C223-L236 VanDerWaalsContact CA-CD1 3.48Å; C223-L236 HydrophobicContact CB-CD1 3.45Å; C223-L236 VanDerWaalsContact CB-CD1 3.45Å; C223-H239 VanDerWaalsContact SG-CD2 3.53Å; C223-H239 PolarHBondContact SG-NE2 2.81Å; C223-H244 PolarHBondContact SG-CD2 2.84Å; C223-H244 PolarHBondContact SG-NE2 3.22Å
224	T	79.3	Confident	74.9	Confident	56 Å²	56	87 Å²	87	34%	0.344	48%	0.476	S	S	.	.	T	Hydrogen-bonded Turn	trans	-42.9	-34.5	174.2	44.2	0	0	0	0	115.6	I114 G115 I222	I114-T224 HydrophobicContact CG2-CG2 4.18Å; I114-T224 WeakPolarHBondContact CG2-OG1 2.94Å; G115-T224 WeakPolarHBondContact O-CG2 3.32Å; I222-T224 PolarHBondContact O-N 3.26Å
225	T	80.5	Confident	77.6	Confident	70 Å²	70	89.3 Å²	89.3	43%	0.429	47%	0.467	S	S	.	.	T	Hydrogen-bonded Turn	trans	-80	-28.5	-178.3	-42.8	0	0	0	0	114.2	C223	C223-T225 PolarHBondContact O-N 3.25Å
226	C	85.3	Confident	79.8	Confident	44 Å²	44	83.3 Å²	83.3	30%	0.297	44%	0.442	S	S	.	.	T	Hydrogen-bonded Turn	trans	-128.8	-0.6	-175.9	67	0	0	0	0	114.9	C223 Q228 H239	C223-C226 PolarHBondContact O-N 3.3Å; C223-C226 VanDerWaalsContact O-N 3.1Å; C223-C226 VanDerWaalsContact SG-SG 3.63Å; C226-Q228 HydrophobicContact CB-CG 4.49Å; C226-Q228 PolarHBondContact O-N 3.32Å; C226-Q228 VanDerWaalsContact SG-CG 3.6Å; C226-H239 PolarHBondContact SG-NE2 3.1Å
227	K	85.5	Confident	81.6	Confident	173 Å²	173	79.3 Å²	79.3	75%	0.752	42%	0.421	S	S	*	.			trans	58.4	19.9	-177.1	-54.7	-169.4	177.4	-170.4	0	116	C223	C223-K227 VanDerWaalsContact O-CA 3.25Å; C223-K227 WeakPolarHBondContact O-CA 3.15Å; C223-K227 PolarHBondContact O-N 2.92Å
228	Q	84.1	Confident	83	Confident	104 Å²	104	75.2 Å²	75.2	49%	0.486	40%	0.401	S	S	.	.			trans	-77.4	131.1	173.8	-68.3	-65.2	-32	0	0	111.5	I222 C223 C226 F230	I222-Q228 CarbonylContact C-O 3.51Å; I222-Q228 WeakPolarHBondContact CA-O 3.21Å; C223-Q228 PolarHBondContact N-O 2.92Å; C226-Q228 HydrophobicContact CB-CG 4.49Å; C226-Q228 PolarHBondContact O-N 3.32Å; C226-Q228 VanDerWaalsContact SG-CG 3.6Å; Q228-F230 HydrophobicContact CB-CE2 3.6Å; Q228-F230 HydrophobicContact CB-CZ 3.7Å; Q228-F230 WeakPolarHBondContact O-CD2 3.4Å; Q228-F230 WeakPolarHBondContact O-CE2 3.37Å
229	P	88	Confident	84.2	Confident	73 Å²	73	74.3 Å²	74.3	47%	0.474	39%	0.391	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-82.6	146.7	171.7	33.5	-33.6	0	0	0	112	Y221 I222	Y221-P229 CarbonylContact O-C 3.5Å; I222-P229 HydrophobicContact CG1-CB 4.41Å
230	F	86.5	Confident	85.1	Confident	38 Å²	38	70 Å²	70	17%	0.167	36%	0.362	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-137.1	130.2	179.3	-62.8	-82.7	0	0	0	110.7	Y221 C223 Q228 S232 F235 L236 H239	Y221-F230 PolarHBondContact N-O 2.92Å; Y221-F230 PolarHBondContact O-N 3.01Å; C223-F230 HydrophobicContact CB-CD2 4.3Å; C223-F230 HydrophobicContact CB-CE2 3.67Å; Q228-F230 HydrophobicContact CB-CE2 3.6Å; Q228-F230 HydrophobicContact CB-CZ 3.7Å; Q228-F230 WeakPolarHBondContact O-CD2 3.4Å; Q228-F230 WeakPolarHBondContact O-CE2 3.37Å; F230-S232 PolarHBondContact O-N 2.8Å; F230-F235 HydrophobicContact CB-CB 4.11Å; F230-F235 HydrophobicContact CD1-CB 3.87Å; F230-F235 HydrophobicContact CG-CB 4.33Å; F230-L236 HydrophobicContact CB-CB 4.26Å; F230-L236 HydrophobicContact CD2-CB 4.18Å; F230-L236 HydrophobicContact CD2-CD1 4.06Å; F230-L236 HydrophobicContact CE2-CD1 4.35Å; F230-L236 HydrophobicContact CG-CB 4.36Å; F230-H239 HydrophobicContact CE1-CB 3.81Å; F230-H239 AromaticContact CE1-CG 3.97Å; F230-H239 HydrophobicContact CE2-CB 4.11Å; F230-H239 AromaticContact CE2-CD2 3.87Å; F230-H239 AromaticContact CE2-CG 3.81Å; F230-H239 HydrophobicContact CZ-CB 3.54Å; F230-H239 AromaticContact CZ-CD2 3.74Å; F230-H239 AromaticContact CZ-CG 3.24Å; F230-H239 AromaticContact CZ-ND1 3.49Å; F230-H239 WeakPolarHBondContact CZ-ND1 3.4Å
231	N	82.2	Confident	85.4	Confident	135 Å²	135	70.4 Å²	70.4	72%	0.722	36%	0.357	S	S	*	.	S	Bend	trans	-81.9	23.8	-175.9	-53.1	-6.3	0	0	0	113.4	S219	S219-N231 WeakPolarHBondContact O-CA 2.99Å
232	S	86.5	Confident	85.3	Confident	37 Å²	37	73.4 Å²	73.4	26%	0.259	38%	0.376	S	S	.	.	S	Bend	trans	-168.1	143.5	173.4	178.9	0	0	0	0	110.3	Y221 F230 W234 F235 L236	Y221-S232 VanDerWaalsContact CD2-C 3.44Å; F230-S232 PolarHBondContact O-N 2.8Å; S232-W234 PolarHBondContact O-N 3.5Å; S232-W234 PolarHBondContact OG-N 2.82Å; S232-F235 PolarHBondContact O-N 3.46Å; S232-L236 PolarHBondContact O-N 3.1Å
233	A	84.6	Confident	85.2	Confident	35 Å²	35	73 Å²	73	29%	0.289	38%	0.378	S	S	.	.	H	α-helix	trans	-53.9	-34.9	170.1	0	0	0	0	0	112.3	Y221 F235 L236 L237	Y221-A233 HydrophobicContact CD1-CB 4.26Å; Y221-A233 HydrophobicContact CE1-CB 3.78Å; Y221-A233 HydrophobicContact CE2-CB 4.27Å; A233-F235 PolarHBondContact O-N 3.2Å; A233-L236 PolarHBondContact O-N 3.06Å; A233-L237 WeakPolarHBondContact O-CB 3.12Å; A233-L237 VanDerWaalsContact O-CD1 3.29Å; A233-L237 WeakPolarHBondContact O-CD1 3.19Å; A233-L237 PolarHBondContact O-N 3.24Å
234	W	85.2	Confident	85.1	Confident	163 Å²	163	75.7 Å²	75.7	62%	0.617	39%	0.39	S	S	*	.	H	α-helix	trans	-63.6	-43.2	179.8	-171.7	87.3	0	0	0	112.2	S232 L237 Q238	S232-W234 PolarHBondContact O-N 3.5Å; S232-W234 PolarHBondContact OG-N 2.82Å; W234-L237 PolarHBondContact O-N 2.81Å; W234-Q238 HydrophobicContact CH2-CG 4.47Å; W234-Q238 WeakPolarHBondContact O-CB 3.5Å; W234-Q238 PolarHBondContact O-N 3.46Å
235	F	89.9	Confident	84.8	Confident	116 Å²	116	76 Å²	76	51%	0.509	40%	0.404	S	S	.	.	H	α-helix	trans	-68.1	-38.5	175.8	-71.1	-60.4	0	0	0	112	F230 S232 A233 Q238 H239	F230-F235 HydrophobicContact CB-CB 4.11Å; F230-F235 HydrophobicContact CD1-CB 3.87Å; F230-F235 HydrophobicContact CG-CB 4.33Å; S232-F235 PolarHBondContact O-N 3.46Å; A233-F235 PolarHBondContact O-N 3.2Å; F235-Q238 PolarHBondContact O-N 3.03Å; F235-H239 WeakPolarHBondContact O-CB 3.45Å; F235-H239 PolarHBondContact O-N 2.61Å
236	L	88.5	Confident	84.4	Confident	33 Å²	33	77.7 Å²	77.7	17%	0.173	41%	0.406	C	S	.	.	H	α-helix	trans	-61	-46.1	172.6	171.3	59.8	0	0	0	111.6	C223 F230 S232 A233 H239 A240	C223-L236 VanDerWaalsContact CA-CD1 3.48Å; C223-L236 HydrophobicContact CB-CD1 3.45Å; C223-L236 VanDerWaalsContact CB-CD1 3.45Å; F230-L236 HydrophobicContact CB-CB 4.26Å; F230-L236 HydrophobicContact CD2-CB 4.18Å; F230-L236 HydrophobicContact CD2-CD1 4.06Å; F230-L236 HydrophobicContact CE2-CD1 4.35Å; F230-L236 HydrophobicContact CG-CB 4.36Å; S232-L236 PolarHBondContact O-N 3.1Å; A233-L236 PolarHBondContact O-N 3.06Å; L236-H239 PolarHBondContact O-N 2.9Å; L236-A240 WeakPolarHBondContact O-CB 3.26Å; L236-A240 PolarHBondContact O-N 3.46Å
237	L	87.4	Confident	83.2	Confident	72 Å²	72	84.2 Å²	84.2	38%	0.377	42%	0.424	S	S	.	.	H	α-helix	trans	-62.6	-48	177.9	-96.5	66.9	0	0	0	111.1	A233 W234 H239 A240 Q241 I248	A233-L237 WeakPolarHBondContact O-CB 3.12Å; A233-L237 VanDerWaalsContact O-CD1 3.29Å; A233-L237 WeakPolarHBondContact O-CD1 3.19Å; A233-L237 PolarHBondContact O-N 3.24Å; W234-L237 PolarHBondContact O-N 2.81Å; L237-H239 VanDerWaalsContact C-N 3.31Å; L237-H239 PolarHBondContact O-N 3.02Å; L237-A240 PolarHBondContact O-N 3.1Å; L237-Q241 VanDerWaalsContact O-CG 3.29Å; L237-Q241 WeakPolarHBondContact O-CG 3.29Å; L237-Q241 PolarHBondContact O-N 2.71Å; L237-I248 HydrophobicContact CD2-CD1 3.67Å; L237-I248 HydrophobicContact CG-CD1 4.03Å
238	Q	86.2	Confident	82	Confident	64 Å²	64	80.2 Å²	80.2	30%	0.299	41%	0.41	S	S	.	.	H	α-helix	trans	-62.7	-38.6	178.8	-171	66.4	86.6	0	0	111.9	W234 F235 N242	W234-Q238 HydrophobicContact CH2-CG 4.47Å; W234-Q238 WeakPolarHBondContact O-CB 3.5Å; W234-Q238 PolarHBondContact O-N 3.46Å; F235-Q238 PolarHBondContact O-N 3.03Å; Q238-N242 PolarHBondContact NE2-ND2 2.17Å; Q238-N242 PolarHBondContact NE2-OD1 3.19Å; Q238-N242 VanDerWaalsContact O-CB 3.27Å; Q238-N242 WeakPolarHBondContact O-CB 3.38Å; Q238-N242 PolarHBondContact O-N 3.27Å; Q238-N242 PolarHBondContact O-OD1 3.29Å
239	H	89	Confident	80.4	Confident	46 Å²	46	83.2 Å²	83.2	21%	0.213	42%	0.418	C	S	.	.	H	α-helix	trans	-63.4	-49.1	172.8	172.1	81.5	0	0	0	111.7	C223 C226 F230 F235 L236 L237 Q241 N242 T243 H244	C223-H239 VanDerWaalsContact SG-CD2 3.53Å; C223-H239 PolarHBondContact SG-NE2 2.81Å; C226-H239 PolarHBondContact SG-NE2 3.1Å; F230-H239 HydrophobicContact CE1-CB 3.81Å; F230-H239 AromaticContact CE1-CG 3.97Å; F230-H239 HydrophobicContact CE2-CB 4.11Å; F230-H239 AromaticContact CE2-CD2 3.87Å; F230-H239 AromaticContact CE2-CG 3.81Å; F230-H239 HydrophobicContact CZ-CB 3.54Å; F230-H239 AromaticContact CZ-CD2 3.74Å; F230-H239 AromaticContact CZ-CG 3.24Å; F230-H239 AromaticContact CZ-ND1 3.49Å; F230-H239 WeakPolarHBondContact CZ-ND1 3.4Å; F235-H239 WeakPolarHBondContact O-CB 3.45Å; F235-H239 PolarHBondContact O-N 2.61Å; L236-H239 PolarHBondContact O-N 2.9Å; L237-H239 VanDerWaalsContact C-N 3.31Å; L237-H239 PolarHBondContact O-N 3.02Å; H239-Q241 VanDerWaalsContact C-N 3.31Å; H239-Q241 PolarHBondContact O-N 2.92Å; H239-N242 PolarHBondContact O-N 2.88Å; H239-T243 PolarHBondContact CD2-OG1 2.05Å; H239-T243 VanDerWaalsContact CE1-CG2 3.4Å; H239-T243 WeakPolarHBondContact CE1-CG2 3.33Å; H239-T243 PolarHBondContact CE1-OG1 3.48Å; H239-T243 VanDerWaalsContact CE1-OG1 3.29Å; H239-T243 PolarHBondContact NE2-OG1 3.23Å; H239-T243 WeakPolarHBondContact O-CB 3.19Å; H239-T243 PolarHBondContact O-N 2.74Å; H239-T243 PolarHBondContact O-OG1 2.69Å; H239-H244 AromaticContact CD2-CD2 3.97Å; H239-H244 AromaticContact CD2-NE2 3.91Å; H239-H244 AromaticContact NE2-CD2 2.9Å; H239-H244 PolarHBondContact NE2-CD2 3.04Å; H239-H244 AromaticContact NE2-CE1 3.19Å; H239-H244 PolarHBondContact NE2-CE1 3.4Å; H239-H244 AromaticContact NE2-NE2 2.17Å; H239-H244 PolarHBondContact NE2-NE2 2.81Å
240	A	84.8	Confident	78.5	Confident	16 Å²	16	86.4 Å²	86.4	13%	0.132	43%	0.431	C	S	.	.	H	α-helix	trans	-63.1	-36	-179.6	0	0	0	0	0	112.5	L236 L237 H244 G245 F246	L236-A240 WeakPolarHBondContact O-CB 3.26Å; L236-A240 PolarHBondContact O-N 3.46Å; L237-A240 PolarHBondContact O-N 3.1Å; A240-H244 CarbonylContact O-C 3.58Å; A240-H244 WeakPolarHBondContact O-CA 3.22Å; A240-H244 WeakPolarHBondContact O-CB 3.27Å; A240-H244 PolarHBondContact O-N 3.19Å; A240-H244 VanDerWaalsContact O-N 3.17Å; A240-G245 PolarHBondContact O-N 2.14Å; A240-F246 HydrophobicContact CB-CB 4.37Å; A240-F246 HydrophobicContact CB-CD2 4.15Å; A240-F246 HydrophobicContact CB-CG 4.43Å; A240-F246 PolarHBondContact O-N 3.35Å
241	Q	84	Confident	76.2	Confident	74 Å²	74	92.9 Å²	92.9	35%	0.346	46%	0.461	S	S	.	.	H	α-helix	trans	-65.3	-50	171.4	-67.6	178.5	16.8	0	0	111.4	L237 H239 G245 F246	L237-Q241 VanDerWaalsContact O-CG 3.29Å; L237-Q241 WeakPolarHBondContact O-CG 3.29Å; L237-Q241 PolarHBondContact O-N 2.71Å; H239-Q241 VanDerWaalsContact C-N 3.31Å; H239-Q241 PolarHBondContact O-N 2.92Å; Q241-G245 WeakPolarHBondContact O-CA 3.37Å; Q241-G245 PolarHBondContact O-N 2.77Å; Q241-F246 WeakPolarHBondContact CA-O 3.33Å; Q241-F246 WeakPolarHBondContact CG-O 3.48Å
242	N	84.2	Confident	74.8	Confident	110 Å²	110	92.3 Å²	92.3	59%	0.588	47%	0.465	S	S	*	.	H	α-helix	trans	-77.5	-28.5	-170.5	-68.2	3.2	0	0	0	114.6	Q238 H239	Q238-N242 PolarHBondContact NE2-ND2 2.17Å; Q238-N242 PolarHBondContact NE2-OD1 3.19Å; Q238-N242 VanDerWaalsContact O-CB 3.27Å; Q238-N242 WeakPolarHBondContact O-CB 3.38Å; Q238-N242 PolarHBondContact O-N 3.27Å; Q238-N242 PolarHBondContact O-OD1 3.29Å; H239-N242 PolarHBondContact O-N 2.88Å
243	T	83.1	Confident	72.5	Confident	72 Å²	72	93 Å²	93	44%	0.442	48%	0.477	S	S	.	.	H	α-helix	trans	-114	-24.8	-173.4	66.3	0	0	0	0	114	H239	H239-T243 PolarHBondContact CD2-OG1 2.05Å; H239-T243 VanDerWaalsContact CE1-CG2 3.4Å; H239-T243 WeakPolarHBondContact CE1-CG2 3.33Å; H239-T243 PolarHBondContact CE1-OG1 3.48Å; H239-T243 VanDerWaalsContact CE1-OG1 3.29Å; H239-T243 PolarHBondContact NE2-OG1 3.23Å; H239-T243 WeakPolarHBondContact O-CB 3.19Å; H239-T243 PolarHBondContact O-N 2.74Å; H239-T243 PolarHBondContact O-OG1 2.69Å
244	H	81.9	Confident	70.5	Confident	58 Å²	58	97.6 Å²	97.6	27%	0.269	51%	0.505	S	S	.	.	H	α-helix	trans	-117.8	3.2	-177.8	-56	-43.2	0	0	0	112.9	C223 H239 A240 F246	C223-H244 PolarHBondContact SG-CD2 2.84Å; C223-H244 PolarHBondContact SG-NE2 3.22Å; H239-H244 AromaticContact CD2-CD2 3.97Å; H239-H244 AromaticContact CD2-NE2 3.91Å; H239-H244 AromaticContact NE2-CD2 2.9Å; H239-H244 PolarHBondContact NE2-CD2 3.04Å; H239-H244 AromaticContact NE2-CE1 3.19Å; H239-H244 PolarHBondContact NE2-CE1 3.4Å; H239-H244 AromaticContact NE2-NE2 2.17Å; H239-H244 PolarHBondContact NE2-NE2 2.81Å; A240-H244 CarbonylContact O-C 3.58Å; A240-H244 WeakPolarHBondContact O-CA 3.22Å; A240-H244 WeakPolarHBondContact O-CB 3.27Å; A240-H244 PolarHBondContact O-N 3.19Å; A240-H244 VanDerWaalsContact O-N 3.17Å; H244-F246 HydrophobicContact CB-CD2 4.09Å; H244-F246 HydrophobicContact CB-CE2 4.44Å; H244-F246 PolarHBondContact O-N 3.2Å
245	G	73.6	Confident	68.2	Low	63 Å²	63	94.4 Å²	94.4	65%	0.649	51%	0.513	S	S	*	.			trans	69	16.8	172.7	0	0	0	0	0	114.5	A240 Q241 R247	A240-G245 PolarHBondContact O-N 2.14Å; Q241-G245 WeakPolarHBondContact O-CA 3.37Å; Q241-G245 PolarHBondContact O-N 2.77Å; G245-R247 PolarHBondContact O-N 2.77Å
246	F	71.8	Confident	65.7	Low	105 Å²	105	94.3 Å²	94.3	46%	0.461	53%	0.527	S	S	.	.			trans	-59	137.2	171.7	-87.8	-95	0	0	0	109.8	I114 A240 Q241 H244	I114-F246 HydrophobicContact CD1-CE2 4.13Å; I114-F246 HydrophobicContact CD1-CZ 3.98Å; A240-F246 HydrophobicContact CB-CB 4.37Å; A240-F246 HydrophobicContact CB-CD2 4.15Å; A240-F246 HydrophobicContact CB-CG 4.43Å; A240-F246 PolarHBondContact O-N 3.35Å; Q241-F246 WeakPolarHBondContact CA-O 3.33Å; Q241-F246 WeakPolarHBondContact CG-O 3.48Å; H244-F246 HydrophobicContact CB-CD2 4.09Å; H244-F246 HydrophobicContact CB-CE2 4.44Å; H244-F246 PolarHBondContact O-N 3.2Å
247	R	60.9	Low	63.1	Low	181 Å²	181	98.6 Å²	98.6	68%	0.683	55%	0.554	S	S	*	*			trans	-129.4	98.3	178.3	-171.7	172.4	174.7	-165.1	-5	109.8	G245 Y249	G245-R247 PolarHBondContact O-N 2.77Å; R247-Y249 HydrophobicContact CB-CE2 4.43Å; R247-Y249 HydrophobicContact CG-CD2 4.29Å; R247-Y249 HydrophobicContact CG-CE2 3.9Å; R247-Y249 VanDerWaalsContact CZ-OH 3.23Å; R247-Y249 PolarHBondContact NH1-OH 3.37Å; R247-Y249 VanDerWaalsContact NH1-OH 3.14Å
248	I	60.1	Low	60.5	Low	89 Å²	89	100.3 Å²	100.3	46%	0.456	57%	0.572	S	S	.	*	P	Polyproline II helix	trans	-79.2	124.1	170.8	-54.3	177.6	0	0	0	106.9	L237 L250	L237-I248 HydrophobicContact CD2-CD1 3.67Å; L237-I248 HydrophobicContact CG-CD1 4.03Å; I248-L250 HydrophobicContact CG2-CD1 4.07Å
249	Y	50.5	Low	58.1	Low	167 Å²	167	106 Å²	106	66%	0.655	60%	0.604	S	S	*	*	P	Polyproline II helix	trans	-96.8	118.9	169.3	-65.8	-102.2	0	0	0	107.4	R247	R247-Y249 HydrophobicContact CB-CE2 4.43Å; R247-Y249 HydrophobicContact CG-CD2 4.29Å; R247-Y249 HydrophobicContact CG-CE2 3.9Å; R247-Y249 VanDerWaalsContact CZ-OH 3.23Å; R247-Y249 PolarHBondContact NH1-OH 3.37Å; R247-Y249 VanDerWaalsContact NH1-OH 3.14Å
250	L	47.7	Very low	55.8	Low	141 Å²	141	109 Å²	109	74%	0.738	63%	0.626	S	S	*	*	P	Polyproline II helix	trans	-90.4	126.9	158	-69.8	83.3	0	0	0	106.1	I248	I248-L250 HydrophobicContact CG2-CD1 4.07Å
251	E	38.2	Very low	53.6	Low	174 Å²	174	114.1 Å²	114.1	81%	0.813	66%	0.657	S	S	*	*	P	Polyproline II helix	trans	-91.4	126.2	178.2	-169.6	171.8	140.1	0	0	109.3	G253	E251-G253 PolarHBondContact O-N 3.05Å
252	P	52.6	Low	51.2	Low	123 Å²	123	120.9 Å²	120.9	80%	0.799	68%	0.68	S	S	*	*			trans	-66.5	107	172.3	-18.3	32	0	0	0	109.7
253	G	39.6	Very low	49	Very low	50 Å²	50	123 Å²	123	52%	0.515	69%	0.69	S	S	.	*			trans	-59.7	146.1	-174.9	0	0	0	0	0	113.4	E251 A255	E251-G253 PolarHBondContact O-N 3.05Å; G253-A255 PolarHBondContact O-N 3.04Å
254	P	41.9	Very low	46.7	Very low	133 Å²	133	124.9 Å²	124.9	86%	0.864	70%	0.702	S	S	*	*	T	Hydrogen-bonded Turn	trans	-78	65.4	-174.4	33.5	-37.6	0	0	0	112.8
255	A	37.6	Very low	44.6	Very low	95 Å²	95	129.3 Å²	129.3	79%	0.785	73%	0.726	S	S	*	*	T	Hydrogen-bonded Turn	trans	-115.8	-15.7	-175.8	0	0	0	0	0	114.8	G253 T257	G253-A255 PolarHBondContact O-N 3.04Å; A255-T257 PolarHBondContact O-N 3.5Å
256	S	36.7	Very low	42.9	Very low	115 Å²	115	131.6 Å²	131.6	80%	0.804	73%	0.729	S	S	*	*	S	Bend	trans	-99.3	29.3	-169.1	64.4	0	0	0	0	115.5
257	T	34.2	Very low	41.9	Very low	122 Å²	122	132 Å²	132	75%	0.748	74%	0.743	S	S	*	*			trans	-141.4	67	176.4	57.8	0	0	0	0	113.3	A255	A255-T257 PolarHBondContact O-N 3.5Å
258	S	32.1	Very low	41	Very low	109 Å²	109	128.4 Å²	128.4	76%	0.762	74%	0.743	S	S	*	*			trans	-160.9	84.2	163.1	-87.1	0	0	0	0	113.7
259	L	35	Very low	40.2	Very low	183 Å²	183	132.4 Å²	132.4	96%	0.958	76%	0.764	S	S	*	*			trans	-115.7	114.4	147.2	-75	179.1	0	0	0	108.1
260	T	40.8	Very low	39.8	Very low	110 Å²	110	127.9 Å²	127.9	68%	0.675	77%	0.768	S	S	*	*			trans	-121.2	160.9	173.6	59.8	0	0	0	0	109.1
261	P	38.8	Very low	39.6	Very low	122 Å²	122	127.2 Å²	127.2	79%	0.792	77%	0.772	S	S	*	*				-118.3	122.5	127.7	31.7	-26.2	0	0	0	108.7
262	R	34.5	Very low	39.7	Very low	216 Å²	216	126.5 Å²	126.5	82%	0.815	77%	0.769	S	S	*	*				55.4	130.4	83.2	-71.3	-163.9	164.8	-166.3	-4.1	112.3
263	L	37.8	Very low	38.7	Very low	154 Å²	154	125.9 Å²	125.9	81%	0.806	76%	0.763	S	S	*	*				-143.8	150.2	62.8	-74.2	152	0	0	0	115.4
264	T	35.4	Very low	38.7	Very low	112 Å²	112	130.1 Å²	130.1	69%	0.687	78%	0.778	S	S	*	*			trans	41.1	122.5	148.3	57.8	0	0	0	0	121.2
265	I	36.6	Very low	38.1	Very low	151 Å²	151	128 Å²	128	77%	0.774	77%	0.772	S	S	*	*				68.2	134.6	53.1	-58.8	170	0	0	0	111.9
266	P	38.4	Very low	38.1	Very low	111 Å²	111	132.8 Å²	132.8	72%	0.721	78%	0.778	S	S	*	*			cis	-133.9	172.9	11.4	39.2	-21.2	0	0	0	118.2
267	P	50.3	Low	38.1	Very low	114 Å²	114	132.6 Å²	132.6	74%	0.74	78%	0.777	S	S	*	*			trans	-89	-171.6	155.4	40.8	-36.2	0	0	0	111.1
268	P	42.9	Very low	38.4	Very low	106 Å²	106	131.5 Å²	131.5	69%	0.688	77%	0.772	S	S	*	*			cis	-142.4	-147.1	14.9	43.6	-20.3	0	0	0	115.2
269	L	42	Very low	38.5	Very low	173 Å²	173	132.9 Å²	132.9	91%	0.906	77%	0.77	S	S	*	*			trans	78.7	138.5	177.7	-44.7	179.8	0	0	0	114.7
270	G	43.5	Very low	38.7	Very low	71 Å²	71	131.4 Å²	131.4	73%	0.732	76%	0.76	S	S	*	*			cis	-155.4	-170.3	-0.3	0	0	0	0	0	112.3
271	P	43.6	Very low	38.5	Very low	127 Å²	127	131.9 Å²	131.9	83%	0.825	76%	0.758	S	S	*	*			trans	-101.8	156.5	-166.5	38.5	-35.3	0	0	0	116
272	E	39	Very low	38.3	Very low	160 Å²	160	134.4 Å²	134.4	75%	0.748	76%	0.757	S	S	*	*			trans	-160.3	129.1	141.7	-84.5	-63.1	27	0	0	106.2
273	T	32.4	Very low	38.6	Very low	109 Å²	109	131.5 Å²	131.5	67%	0.669	76%	0.757	S	S	*	*				44.8	133.9	89.5	80.8	0	0	0	0	113.9
274	V	38.6	Very low	38.6	Very low	140 Å²	140	127.6 Å²	127.6	85%	0.848	75%	0.754	S	S	*	*			cis	-143	161.3	30.6	168.2	0	0	0	0	111
275	A	30.4	Very low	38.9	Very low	88 Å²	88	129 Å²	129	73%	0.727	76%	0.757	S	S	*	*			trans	-91.7	151.3	-178.7	0	0	0	0	0	115
276	Q	37.4	Very low	39.1	Very low	195 Å²	195	127.7 Å²	127.7	91%	0.911	76%	0.761	S	S	*	*			trans	-158.2	130.4	149.6	-115.7	166.4	23.8	0	0	114.5
277	S	35.6	Very low	39.1	Very low	111 Å²	111	129.5 Å²	129.5	78%	0.776	77%	0.765	S	S	*	*			trans	-125.3	-170.8	156.2	-57.4	0	0	0	0	105.5
278	P	40.4	Very low	38.4	Very low	100 Å²	100	128.3 Å²	128.3	65%	0.649	76%	0.757	S	S	*	*			cis	-146.5	-170.9	4.4	46.5	-27.6	0	0	0	116.7
279	L	35.4	Very low	38	Very low	137 Å²	137	132.4 Å²	132.4	72%	0.717	77%	0.765	S	S	*	*			trans	67.4	171	155.2	-70.6	168.5	0	0	0	117.8
280	M	39.1	Very low	37.6	Very low	153 Å²	153	131.1 Å²	131.1	75%	0.754	76%	0.759	S	S	*	*			cis	-138.7	151.1	14.5	-71.6	70.9	-170.1	0	0	115.3
281	N	36.1	Very low	37.6	Very low	120 Å²	120	136.3 Å²	136.3	64%	0.642	77%	0.769	S	S	*	*			trans	7.2	152.9	144.9	-56.4	21.6	0	0	0	121.8
282	F	35.3	Very low	37.5	Very low	174 Å²	174	136.9 Å²	136.9	76%	0.763	76%	0.764	S	S	*	*				-174.5	144.3	76.9	-108.9	-91.9	0	0	0	116.4
283	L	39.8	Very low	37.2	Very low	156 Å²	156	139 Å²	139	82%	0.817	77%	0.766	S	S	*	*			trans	69.5	148.8	160.3	-52.1	-176.5	0	0	0	122.3
284	G	38.8	Very low	37.4	Very low	72 Å²	72	140.2 Å²	140.2	74%	0.742	77%	0.765	S	S	*	*			trans	159.1	7.5	167.7	0	0	0	0	0	120.3
285	D	40.3	Very low	37.5	Very low	140 Å²	140	139.9 Å²	139.9	75%	0.749	76%	0.763	S	S	*	*			trans	5.1	121.2	171.2	-61.9	-95.9	0	0	0	122.4
286	S	42.7	Very low	37.7	Very low	124 Å²	124	139 Å²	139	87%	0.867	76%	0.763	S	S	*	*				172.8	123.7	109.2	43.1	0	0	0	0	113.6
287	N	37.1	Very low	38.2	Very low	150 Å²	150	135.4 Å²	135.4	80%	0.802	76%	0.757	S	S	*	*			trans	-157.4	125.5	170.5	-179	42	0	0	0	111.5
288	P	36.3	Very low	38.3	Very low	88 Å²	88	136.7 Å²	136.7	57%	0.571	75%	0.753	S	S	*	*			trans	-90.5	168.6	173.3	35.4	-32.9	0	0	0	113.5
289	F	34.3	Very low	38	Very low	192 Å²	192	139.5 Å²	139.5	84%	0.842	76%	0.762	S	S	*	*			trans	73	74.3	172	-50.9	-66.4	0	0	0	117.7
290	N	34.5	Very low	38.2	Very low	146 Å²	146	142.8 Å²	142.8	78%	0.781	77%	0.765	S	S	*	*			trans	-150.3	101	141	-118	-73	0	0	0	110.7
291	L	42.9	Very low	38.2	Very low	180 Å²	180	140.3 Å²	140.3	94%	0.942	76%	0.755	S	S	*	*			trans	-156.9	151.6	152.7	-86.9	-163.1	0	0	0	109.7
292	L	40.9	Very low	38.5	Very low	139 Å²	139	142.6 Å²	142.6	73%	0.728	76%	0.761	S	S	*	*			trans	-111	171.1	-168.7	-87.8	63.6	0	0	0	112.5
293	R	33.2	Very low	38.8	Very low	206 Å²	206	140.2 Å²	140.2	78%	0.777	76%	0.763	S	S	*	*			trans	81	114.1	146.4	-93.7	-175.5	137.7	81.7	-2	120.1
294	M	36.5	Very low	38.9	Very low	134 Å²	134	136.2 Å²	136.2	66%	0.66	76%	0.76	S	S	*	*				119.2	140.1	119.5	-78.7	-61.5	171.8	0	0	120.7
295	T	39.9	Very low	38.7	Very low	132 Å²	132	142.1 Å²	142.1	81%	0.81	77%	0.765	S	S	*	*			trans	60.5	118.2	157.9	46.5	0	0	0	0	120.4
296	G	35.2	Very low	38.9	Very low	70 Å²	70	138.9 Å²	138.9	72%	0.722	77%	0.765	S	S	*	*			trans	-90.6	-141.7	154.6	0	0	0	0	0	111.1
297	P	47.4	Very low	38.6	Very low	120 Å²	120	141.5 Å²	141.5	78%	0.779	76%	0.763	S	S	*	*			cis	-139.5	-152.7	6.8	29	-1.7	0	0	0	113.9
298	I	39.1	Very low	38.7	Very low	138 Å²	138	138 Å²	138	71%	0.708	76%	0.763	S	S	*	*			trans	96.9	113.3	152.5	-63.8	167.4	0	0	0	120.3
299	L	34.5	Very low	38.8	Very low	158 Å²	158	145.5 Å²	145.5	83%	0.827	78%	0.78	S	S	*	*			trans	59.2	161.1	152.2	-65.5	173.4	0	0	0	119.2
300	R	39.6	Very low	39	Very low	206 Å²	206	144.3 Å²	144.3	78%	0.777	78%	0.781	S	S	*	*			cis	-152.2	174.8	7.1	-135	-172.9	146.4	-179.3	-20.5	108.3
301	D	38.6	Very low	39.3	Very low	102 Å²	102	143.5 Å²	143.5	55%	0.545	78%	0.784	S	S	.	*			cis	-148.5	-125.6	1.2	-168.7	-127.4	0	0	0	112
302	H	42.6	Very low	39.3	Very low	167 Å²	167	138.3 Å²	138.3	77%	0.773	77%	0.774	S	S	*	*			trans	-134.1	172.2	-161	-84.1	-81.5	0	0	0	117.4
303	P	41.1	Very low	39.4	Very low	124 Å²	124	138.2 Å²	138.2	81%	0.805	78%	0.78	S	S	*	*			trans	-120.8	-172	-172.6	44.5	-32.8	0	0	0	115.6
304	G	41.2	Very low	40	Very low	72 Å²	72	134 Å²	134	74%	0.742	78%	0.779	S	S	*	*			trans	173.1	174.5	166.2	0	0	0	0	0	112.1
305	F	36.1	Very low	40.6	Very low	196 Å²	196	132.6 Å²	132.6	86%	0.86	78%	0.78	S	S	*	*			cis	-167	149	-20.2	-164.5	-85.8	0	0	0	107.7
306	G	44.2	Very low	40.4	Very low	72 Å²	72	134 Å²	134	74%	0.742	78%	0.781	S	S	*	*			trans	161.5	110.8	171.9	0	0	0	0	0	116.8
307	E	36.4	Very low	40.5	Very low	179 Å²	179	140.6 Å²	140.6	84%	0.836	79%	0.791	S	S	*	*			trans	-103.1	153.2	176.9	-63.8	168.5	68.2	0	0	112.2
308	G	38.9	Very low	39.8	Very low	76 Å²	76	139.9 Å²	139.9	78%	0.784	79%	0.788	S	S	*	*			trans	-167.2	63.7	-174.1	0	0	0	0	0	119.2
309	R	38.8	Very low	40.5	Very low	247 Å²	247	139.3 Å²	139.3	93%	0.932	79%	0.793	S	S	*	*			trans	41	120.9	151.5	-58.8	-67	-179.1	-158.9	-4.5	121.6
310	L	38.1	Very low	41.1	Very low	166 Å²	166	137.1 Å²	137.1	87%	0.869	79%	0.789	S	S	*	*			trans	-66.3	173.4	150.8	-68	176	0	0	0	111.7
311	P	40.7	Very low	41.2	Very low	129 Å²	129	132.9 Å²	132.9	84%	0.838	79%	0.788	S	S	*	*			cis	-146.2	-177.3	22.6	44.3	-24.3	0	0	0	118.6
312	G	42.8	Very low	41.5	Very low	72 Å²	72	139.7 Å²	139.7	74%	0.742	81%	0.806	S	S	*	*			trans	160.9	118	160.2	0	0	0	0	0	116.7
313	T	43	Very low	41.3	Very low	137 Å²	137	140.4 Å²	140.4	84%	0.84	81%	0.809	S	S	*	*			trans	-152.4	177.3	171.5	61	0	0	0	0	108.9
314	P	45.8	Very low	41.3	Very low	117 Å²	117	142.4 Å²	142.4	76%	0.76	81%	0.808	S	S	*	*			cis	-111.4	-128.5	-27	30.4	-7.4	0	0	0	107.2
315	P	48.7	Very low	41.3	Very low	105 Å²	105	146.5 Å²	146.5	68%	0.682	81%	0.812	S	S	*	*			cis	-132.5	165	-27.6	39.1	-21.5	0	0	0	117.3
316	L	34.9	Very low	41.3	Very low	160 Å²	160	142.2 Å²	142.2	84%	0.838	80%	0.798	S	S	*	*			trans	10.1	127.8	143.6	-53.2	171.8	0	0	0	121.2
317	F	38.7	Very low	41.3	Very low	210 Å²	210	144.9 Å²	144.9	92%	0.921	80%	0.802	S	S	*	*			trans	-154.1	140.6	144.1	-131.5	-87.2	0	0	0	111.6
318	S	32.5	Very low	41.6	Very low	104 Å²	104	142.4 Å²	142.4	73%	0.727	79%	0.79	S	S	*	*			trans	-128.8	133.5	179.8	-58.3	0	0	0	0	111.6
319	P	53.8	Low	41.5	Very low	126 Å²	126	149 Å²	149	82%	0.818	79%	0.791	S	S	*	*	P	Polyproline II helix	trans	-77.4	151.4	170.6	-15.6	31.8	0	0	0	113
320	P	46.6	Very low	41.4	Very low	112 Å²	112	145.7 Å²	145.7	73%	0.727	79%	0.791	S	S	*	*	P	Polyproline II helix	trans	-94.7	159.7	-170.4	36.7	-36.8	0	0	0	115.1
321	P	41.6	Very low	41.2	Very low	117 Å²	117	143 Å²	143	76%	0.76	79%	0.786	S	S	*	*	P	Polyproline II helix	trans	-73.3	154.5	171.4	32.5	-35.7	0	0	0	112.2
322	R	45.9	Very low	41.1	Very low	245 Å²	245	140.4 Å²	140.4	93%	0.925	78%	0.776	S	S	*	*			trans	-113.6	131	173.1	-58.8	-171.5	91.4	115.5	0.4	110.8
323	H	37.6	Very low	41	Very low	182 Å²	182	145.4 Å²	145.4	84%	0.843	78%	0.78	S	S	*	*			trans	-79.8	174.1	175.2	-80.6	-111.9	0	0	0	112.7
324	H	40.4	Very low	41.2	Very low	167 Å²	167	147.5 Å²	147.5	77%	0.773	78%	0.78	S	S	*	*			trans	101.4	90	139.8	-156.8	-89.8	0	0	0	117.7
325	L	42.2	Very low	40.9	Very low	158 Å²	158	150.7 Å²	150.7	83%	0.827	79%	0.787	S	S	*	*				-167.9	146.8	108.5	-95.5	169.5	0	0	0	110.5
326	D	36.5	Very low	40.5	Very low	106 Å²	106	148.9 Å²	148.9	57%	0.567	79%	0.787	S	S	*	*			trans	-152.1	134.6	-167.9	-179.8	-10.5	0	0	0	109.7	H328	D326-H328 IonicContact OD1-CE1 3.83Å; D326-H328 IonicContact OD1-CG 3.69Å; D326-H328 PolarHBondContact OD1-N 3.47Å; D326-H328 IonicContact OD1-ND1 2.92Å; D326-H328 PolarHBondContact OD1-ND1 3.35Å; D326-H328 IonicContact OD2-CE1 3.06Å; D326-H328 PolarHBondContact OD2-CE1 3.22Å; D326-H328 IonicContact OD2-ND1 2.93Å; D326-H328 PolarHBondContact OD2-ND1 3.35Å
327	P	44.5	Very low	41.1	Very low	128 Å²	128	149.5 Å²	149.5	83%	0.831	79%	0.791	S	S	*	*			trans	-134.4	65	155.8	34.9	-17.8	0	0	0	114.5
328	H	40.9	Very low	41.3	Very low	126 Å²	126	144.6 Å²	144.6	58%	0.583	78%	0.777	S	S	*	*				53.7	134.4	117.1	-88.3	14	0	0	0	122.1	D326	D326-H328 IonicContact OD1-CE1 3.83Å; D326-H328 IonicContact OD1-CG 3.69Å; D326-H328 PolarHBondContact OD1-N 3.47Å; D326-H328 IonicContact OD1-ND1 2.92Å; D326-H328 PolarHBondContact OD1-ND1 3.35Å; D326-H328 IonicContact OD2-CE1 3.06Å; D326-H328 PolarHBondContact OD2-CE1 3.22Å; D326-H328 IonicContact OD2-ND1 2.93Å; D326-H328 PolarHBondContact OD2-ND1 3.35Å
329	R	36.8	Very low	41.7	Very low	215 Å²	215	144.8 Å²	144.8	81%	0.811	79%	0.786	S	S	*	*			trans	75.9	135.5	168.4	-47.4	-69.5	153.2	153	-10.6	113.5
330	L	37.5	Very low	41.5	Very low	177 Å²	177	146.3 Å²	146.3	93%	0.927	78%	0.782	S	S	*	*			cis	-118.4	-170.9	27.1	-71.4	163.8	0	0	0	114.6
331	S	34.3	Very low	41.4	Very low	110 Å²	110	149.7 Å²	149.7	77%	0.769	79%	0.787	S	S	*	*			trans	-77.1	161	-164.1	-160.7	0	0	0	0	115.8
332	A	38.6	Very low	42.2	Very low	75 Å²	75	147.4 Å²	147.4	62%	0.62	77%	0.773	S	S	*	*			trans	-85.8	-168	158.2	0	0	0	0	0	111.2
333	E	39.6	Very low	42.4	Very low	176 Å²	176	139.8 Å²	139.8	82%	0.822	76%	0.757	S	S	*	*			trans	67.6	100.3	-168.6	-66.3	96.3	98.8	0	0	115.7
334	E	47.7	Very low	43.1	Very low	182 Å²	182	133.3 Å²	133.3	85%	0.85	74%	0.735	S	S	*	*	S	Bend		-176.7	-41.3	120.6	-170.7	163.6	116.4	0	0	111.5
335	M	40.1	Very low	43.5	Very low	183 Å²	183	130.6 Å²	130.6	90%	0.901	72%	0.721	S	S	*	*			trans	-102.4	93.6	-167	-64.5	-171.1	-172.6	0	0	115.2
336	G	40.8	Very low	44.2	Very low	67 Å²	67	126.3 Å²	126.3	69%	0.691	70%	0.699	S	S	*	*			trans	-112.9	123.8	152.6	0	0	0	0	0	110.3
337	L	46.9	Very low	45.3	Very low	174 Å²	174	129.6 Å²	129.6	91%	0.911	70%	0.704	S	S	*	*			trans	178.9	163.1	158.8	-103.1	172.1	0	0	0	110.5
338	V	42.6	Very low	46.1	Very low	106 Å²	106	128.1 Å²	128.1	64%	0.642	69%	0.692	S	S	*	*			trans	64.3	87.4	171.1	-171.6	0	0	0	0	117.1	Q340	V338-Q340 VanDerWaalsContact C-N 3.33Å; V338-Q340 HydrophobicContact CG1-CB 3.57Å; V338-Q340 PolarHBondContact O-N 3.17Å; V338-Q340 VanDerWaalsContact O-N 3.13Å
339	A	40.8	Very low	46.9	Very low	109 Å²	109	128.7 Å²	128.7	90%	0.901	70%	0.696	S	S	*	*			trans	-82.4	68.6	164.1	0	0	0	0	0	112.1
340	Q	49.2	Very low	47.8	Very low	157 Å²	157	127.5 Å²	127.5	73%	0.734	69%	0.692	S	S	*	*			trans	-92.4	106.6	-176.9	-177.2	173.5	0.7	0	0	112.3	V338 P342	V338-Q340 VanDerWaalsContact C-N 3.33Å; V338-Q340 HydrophobicContact CG1-CB 3.57Å; V338-Q340 PolarHBondContact O-N 3.17Å; V338-Q340 VanDerWaalsContact O-N 3.13Å; Q340-P342 WeakPolarHBondContact O-CD 3.42Å
341	H	45.4	Very low	48.1	Very low	183 Å²	183	126.2 Å²	126.2	85%	0.847	69%	0.685	S	S	*	*	P	Polyproline II helix	trans	-60	119.7	173.3	-95.9	-93.8	0	0	0	111.2	S343	H341-S343 PolarHBondContact O-N 3.31Å
342	P	57.9	Low	48.5	Very low	70 Å²	70	126.4 Å²	126.4	46%	0.455	68%	0.678	S	S	.	*	P	Polyproline II helix	trans	-74.6	117.1	-176.7	28.5	-33.8	0	0	0	111	Q340	Q340-P342 WeakPolarHBondContact O-CD 3.42Å
343	S	50.5	Low	49	Very low	84 Å²	84	128.6 Å²	128.6	59%	0.587	69%	0.686	S	S	*	*	P	Polyproline II helix	trans	-59	141.4	175	-177.3	0	0	0	0	111.3	H341 F345 D346	H341-S343 PolarHBondContact O-N 3.31Å; S343-F345 PolarHBondContact O-N 3.19Å; S343-D346 PolarHBondContact O-N 3.5Å
344	A	51.1	Low	48.9	Very low	47 Å²	47	127.7 Å²	127.7	39%	0.388	68%	0.683	S	S	.	*	T	Hydrogen-bonded Turn	trans	-59.4	-10	-172.5	0	0	0	0	0	115.6	W866	A344-W866 HydrophobicContact CB-CE3 4.17Å; A344-W866 HydrophobicContact CB-CH2 3.9Å; A344-W866 HydrophobicContact CB-CZ3 3.68Å; A344-W866 WeakPolarHBondContact O-CH2 3.4Å; A344-W866 WeakPolarHBondContact O-CZ3 3.47Å
345	F	50.6	Low	48.4	Very low	110 Å²	110	123.8 Å²	123.8	48%	0.482	68%	0.682	S	S	.	*	T	Hydrogen-bonded Turn	trans	-85	-34.2	173.7	-165.8	-106	0	0	0	112.8	S343 V348 M349	S343-F345 PolarHBondContact O-N 3.19Å; F345-V348 PolarHBondContact O-N 3.22Å; F345-M349 HydrophobicContact CE1-CG 4.36Å
346	D	56.2	Low	48.6	Very low	67 Å²	67	123.2 Å²	123.2	36%	0.358	68%	0.681	S	S	.	*	H	α-helix	trans	-71.1	-39.8	-172.1	-157.9	-83.9	0	0	0	111.7	S343 V348 M349 R350	S343-D346 PolarHBondContact O-N 3.5Å; D346-V348 PolarHBondContact O-N 2.9Å; D346-V348 VanDerWaalsContact O-N 3.1Å; D346-M349 PolarHBondContact O-N 3.39Å; D346-R350 PolarHBondContact O-N 3.15Å; D346-R350 VanDerWaalsContact OD1-CD 3.25Å; D346-R350 WeakPolarHBondContact OD1-CD 3.41Å; D346-R350 WeakPolarHBondContact OD1-CG 3.42Å; D346-R350 IonicContact OD1-CZ 3.32Å; D346-R350 IonicContact OD1-NE 3.49Å; D346-R350 IonicContact OD1-NH1 3.64Å; D346-R350 PolarHBondContact OD1-NH1 2.87Å; D346-R350 IonicContact OD2-NH1 2.74Å; D346-R350 PolarHBondContact OD2-NH1 3.42Å
347	R	59.7	Low	48.5	Very low	176 Å²	176	126.7 Å²	126.7	66%	0.664	68%	0.684	S	S	*	*	H	α-helix	trans	-58.7	-21.3	173.7	-74.8	-177.3	167.5	-178.3	-4.6	114.4
348	V	60.3	Low	47.9	Very low	97 Å²	97	122.9 Å²	122.9	59%	0.588	67%	0.672	S	S	*	*	H	α-helix	trans	-86.8	-24.9	176.5	178.6	0	0	0	0	111.7	F345 D346	F345-V348 PolarHBondContact O-N 3.22Å; D346-V348 PolarHBondContact O-N 2.9Å; D346-V348 VanDerWaalsContact O-N 3.1Å
349	M	59	Low	47.8	Very low	137 Å²	137	123.2 Å²	123.2	68%	0.675	68%	0.676	S	S	*	*	H	α-helix	trans	-95.1	-25.8	179.2	-63.1	-65.5	-71.9	0	0	113	F345 D346 L351	F345-M349 HydrophobicContact CE1-CG 4.36Å; D346-M349 PolarHBondContact O-N 3.39Å; M349-L351 VanDerWaalsContact C-N 3.3Å; M349-L351 PolarHBondContact O-N 2.86Å
350	R	55.2	Low	47.5	Very low	190 Å²	190	123 Å²	123	72%	0.717	67%	0.674	S	S	*	*	S	Bend	trans	-77.7	-4.7	177.8	-90.9	-169.1	155.8	78.6	2.6	115.3	D346 N352	D346-R350 PolarHBondContact O-N 3.15Å; D346-R350 VanDerWaalsContact OD1-CD 3.25Å; D346-R350 WeakPolarHBondContact OD1-CD 3.41Å; D346-R350 WeakPolarHBondContact OD1-CG 3.42Å; D346-R350 IonicContact OD1-CZ 3.32Å; D346-R350 IonicContact OD1-NE 3.49Å; D346-R350 IonicContact OD1-NH1 3.64Å; D346-R350 PolarHBondContact OD1-NH1 2.87Å; D346-R350 IonicContact OD2-NH1 2.74Å; D346-R350 PolarHBondContact OD2-NH1 3.42Å; R350-N352 PolarHBondContact O-N 3.41Å
351	L	43.7	Very low	47.7	Very low	150 Å²	150	124.3 Å²	124.3	79%	0.785	68%	0.682	S	S	*	*			trans	-78.2	61.1	169	-70.5	175.5	0	0	0	111.2	M349	M349-L351 VanDerWaalsContact C-N 3.3Å; M349-L351 PolarHBondContact O-N 2.86Å
352	N	42.3	Very low	47.6	Very low	115 Å²	115	119.6 Å²	119.6	62%	0.615	66%	0.663	S	S	*	*			trans	-83.1	117.6	168	-171.1	23.3	0	0	0	108.5	R350 M354	R350-N352 PolarHBondContact O-N 3.41Å; N352-M354 PolarHBondContact O-N 3.32Å
353	P	49.4	Very low	47.3	Very low	121 Å²	121	124 Å²	124	79%	0.786	68%	0.676	S	S	*	*			trans	-75.8	84.5	-173	30.4	-35.4	0	0	0	111.8	A355	P353-A355 PolarHBondContact O-N 3Å
354	M	38	Very low	47.8	Very low	156 Å²	156	124.1 Å²	124.1	77%	0.768	68%	0.677	S	S	*	*			trans	-82.8	104.3	177.8	-77.2	166.3	54	0	0	111.8	N352	N352-M354 PolarHBondContact O-N 3.32Å
355	A	36.7	Very low	48.5	Very low	100 Å²	100	128.9 Å²	128.9	83%	0.826	69%	0.685	S	S	*	*			trans	33.6	90.3	152	0	0	0	0	0	118	P353	P353-A355 PolarHBondContact O-N 3Å
356	I	43.8	Very low	49.2	Very low	172 Å²	172	131.8 Å²	131.8	88%	0.882	69%	0.692	S	S	*	*			trans	-114.2	133	143.9	-63.7	178.7	0	0	0	106.5
357	D	39.3	Very low	49.8	Very low	140 Å²	140	134.1 Å²	134.1	75%	0.749	70%	0.704	S	S	*	*			trans	-78.3	164.5	-175.7	-174.2	-97.8	0	0	0	112.7
358	S	35.3	Very low	50.2	Low	94 Å²	94	135.4 Å²	135.4	66%	0.657	71%	0.709	S	S	*	*	S	Bend	trans	72.9	148.3	167.8	-76.5	0	0	0	0	116.6
359	P	39	Very low	50.3	Low	112 Å²	112	136 Å²	136	73%	0.727	71%	0.705	S	S	*	*				-111.5	156.8	-69.6	-3	23.9	0	0	0	113	M361	P359-M361 PolarHBondContact O-N 3.48Å; P359-M361 VanDerWaalsContact O-N 3.1Å
360	A	34.8	Very low	50.3	Low	104 Å²	104	136.4 Å²	136.4	86%	0.86	71%	0.71	S	S	*	*			trans	-60	109.1	-171.3	0	0	0	0	0	114.8	D362	A360-D362 PolarHBondContact O-N 2.86Å
361	M	53.4	Low	50.1	Low	185 Å²	185	131.3 Å²	131.3	91%	0.911	71%	0.708	S	S	*	*			trans	-86.7	91.7	169	-66.9	-157.4	-174.6	0	0	111.3	P359 F363	P359-M361 PolarHBondContact O-N 3.48Å; P359-M361 VanDerWaalsContact O-N 3.1Å; M361-F363 PolarHBondContact O-N 3.15Å; M361-F363 VanDerWaalsContact O-N 3.09Å
362	D	44.3	Very low	49.9	Very low	84 Å²	84	126.8 Å²	126.8	45%	0.449	70%	0.698	S	S	.	*			trans	-77.6	94.1	-178.2	-173.7	-12.2	0	0	0	112.2	A360 S364 R365 R366	A360-D362 PolarHBondContact O-N 2.86Å; D362-S364 PolarHBondContact O-N 3.25Å; D362-S364 WeakPolarHBondContact OD1-CA 3.2Å; D362-S364 WeakPolarHBondContact OD1-CB 3.33Å; D362-S364 PolarHBondContact OD1-N 3.21Å; D362-R365 HydrophobicContact CB-CB 3.75Å; D362-R365 PolarHBondContact O-N 3.39Å; D362-R365 PolarHBondContact OD1-N 3.25Å; D362-R365 WeakPolarHBondContact OD2-CB 3.25Å; D362-R366 PolarHBondContact O-N 2.8Å
363	F	50.1	Low	49.7	Very low	162 Å²	162	129.5 Å²	129.5	71%	0.711	71%	0.712	S	S	*	*	H	α-helix	trans	-63.3	-27.8	176.1	-147.5	-88.3	0	0	0	112.8	M361 L367	M361-F363 PolarHBondContact O-N 3.15Å; M361-F363 VanDerWaalsContact O-N 3.09Å; F363-L367 HydrophobicContact CD1-CD1 4.09Å; F363-L367 HydrophobicContact CE1-CD1 4.33Å; F363-L367 WeakPolarHBondContact O-CB 3.27Å; F363-L367 PolarHBondContact O-N 2.95Å
364	S	60.9	Low	49.2	Very low	87 Å²	87	129.1 Å²	129.1	61%	0.608	71%	0.713	S	S	*	*	H	α-helix	trans	-75.5	-33.5	177.6	-62.7	0	0	0	0	111.9	D362 R368	D362-S364 PolarHBondContact O-N 3.25Å; D362-S364 WeakPolarHBondContact OD1-CA 3.2Å; D362-S364 WeakPolarHBondContact OD1-CB 3.33Å; D362-S364 PolarHBondContact OD1-N 3.21Å; S364-R368 PolarHBondContact O-N 3.32Å
365	R	66.7	Low	49.2	Very low	148 Å²	148	126.8 Å²	126.8	56%	0.558	71%	0.712	S	S	*	*	H	α-helix	trans	-74.4	-39.1	171.3	178.4	174.1	179.2	167.1	1.6	111.9	D362 L367 R368 E369	D362-R365 HydrophobicContact CB-CB 3.75Å; D362-R365 PolarHBondContact O-N 3.39Å; D362-R365 PolarHBondContact OD1-N 3.25Å; D362-R365 WeakPolarHBondContact OD2-CB 3.25Å; R365-L367 VanDerWaalsContact C-N 3.31Å; R365-L367 PolarHBondContact O-N 3.28Å; R365-R368 CarbonylContact O-C 3.52Å; R365-R368 WeakPolarHBondContact O-CA 3.2Å; R365-R368 WeakPolarHBondContact O-CB 3.44Å; R365-R368 PolarHBondContact O-N 2.86Å; R365-E369 HydrophobicContact CG-CG 4.16Å; R365-E369 WeakPolarHBondContact CG-OE1 3.42Å; R365-E369 IonicContact CZ-OE1 3.84Å; R365-E369 IonicContact NE-OE1 3.41Å; R365-E369 PolarHBondContact NE-OE1 3.18Å; R365-E369 IonicContact NH2-OE1 3.67Å; R365-E369 PolarHBondContact NH2-OE1 3.18Å; R365-E369 WeakPolarHBondContact O-CG 3.27Å; R365-E369 PolarHBondContact O-N 3.39Å
366	R	64.7	Low	49.2	Very low	171 Å²	171	128.6 Å²	128.6	65%	0.645	71%	0.713	S	S	*	*	H	α-helix	trans	-60.7	-40.4	172.3	-172.6	152.7	-71.8	-113.1	-6	111.9	D362 R368 E369 L370	D362-R366 PolarHBondContact O-N 2.8Å; R366-R368 PolarHBondContact O-N 3.19Å; R366-E369 PolarHBondContact O-N 2.73Å; R366-L370 HydrophobicContact CG-CD1 4.12Å; R366-L370 VanDerWaalsContact O-CB 3.32Å; R366-L370 WeakPolarHBondContact O-CB 3.19Å; R366-L370 WeakPolarHBondContact O-CD1 3.32Å; R366-L370 WeakPolarHBondContact O-CG 3.27Å; R366-L370 PolarHBondContact O-N 3.27Å
367	L	69.5	Low	49.1	Very low	115 Å²	115	126.1 Å²	126.1	60%	0.602	71%	0.707	S	S	*	*	H	α-helix	trans	-64.5	-17.9	170	-91.6	163.6	0	0	0	114.7	F363 R365	F363-L367 HydrophobicContact CD1-CD1 4.09Å; F363-L367 HydrophobicContact CE1-CD1 4.33Å; F363-L367 WeakPolarHBondContact O-CB 3.27Å; F363-L367 PolarHBondContact O-N 2.95Å; R365-L367 VanDerWaalsContact C-N 3.31Å; R365-L367 PolarHBondContact O-N 3.28Å
368	R	67.4	Low	49.2	Very low	203 Å²	203	125.3 Å²	125.3	77%	0.766	71%	0.71	S	S	*	*	H	α-helix	trans	-97.2	-33.5	177.4	-174.2	158.8	-70.2	150.3	5.2	113	S364 R365 R366 A371	S364-R368 PolarHBondContact O-N 3.32Å; R365-R368 CarbonylContact O-C 3.52Å; R365-R368 WeakPolarHBondContact O-CA 3.2Å; R365-R368 WeakPolarHBondContact O-CB 3.44Å; R365-R368 PolarHBondContact O-N 2.86Å; R366-R368 PolarHBondContact O-N 3.19Å; R368-A371 PolarHBondContact O-N 3.47Å
369	E	62.3	Low	49.6	Very low	110 Å²	110	126 Å²	126	51%	0.514	71%	0.712	S	S	.	*	H	α-helix	trans	-76.1	-31.4	175.7	-70.7	173.2	171.7	0	0	111.4	R365 R366 A371	R365-E369 HydrophobicContact CG-CG 4.16Å; R365-E369 WeakPolarHBondContact CG-OE1 3.42Å; R365-E369 IonicContact CZ-OE1 3.84Å; R365-E369 IonicContact NE-OE1 3.41Å; R365-E369 PolarHBondContact NE-OE1 3.18Å; R365-E369 IonicContact NH2-OE1 3.67Å; R365-E369 PolarHBondContact NH2-OE1 3.18Å; R365-E369 WeakPolarHBondContact O-CG 3.27Å; R365-E369 PolarHBondContact O-N 3.39Å; R366-E369 PolarHBondContact O-N 2.73Å; E369-A371 PolarHBondContact O-N 3.17Å
370	L	60.2	Low	49.7	Very low	146 Å²	146	126.8 Å²	126.8	76%	0.764	72%	0.715	S	S	*	*	T	Hydrogen-bonded Turn	trans	-65.3	-11.8	167.4	-79.8	166.2	0	0	0	114	R366	R366-L370 HydrophobicContact CG-CD1 4.12Å; R366-L370 VanDerWaalsContact O-CB 3.32Å; R366-L370 WeakPolarHBondContact O-CB 3.19Å; R366-L370 WeakPolarHBondContact O-CD1 3.32Å; R366-L370 WeakPolarHBondContact O-CG 3.27Å; R366-L370 PolarHBondContact O-N 3.27Å
371	A	51.1	Low	49.8	Very low	82 Å²	82	127.4 Å²	127.4	68%	0.678	71%	0.713	S	S	*	*	T	Hydrogen-bonded Turn	trans	-107.1	7.9	-170.5	0	0	0	0	0	114.8	R368 E369	R368-A371 PolarHBondContact O-N 3.47Å; E369-A371 PolarHBondContact O-N 3.17Å
372	G	38	Very low	49.2	Very low	56 Å²	56	124.8 Å²	124.8	58%	0.577	71%	0.71	S	S	*	*			trans	171.8	111.9	168.6	0	0	0	0	0	117
373	N	38.7	Very low	48.8	Very low	172 Å²	172	124.4 Å²	124.4	92%	0.92	73%	0.726	S	S	*	*			trans	-160.7	88.8	138.6	-131.4	10.9	0	0	0	113.4
374	S	39	Very low	48.3	Very low	113 Å²	113	129.1 Å²	129.1	79%	0.79	74%	0.738	S	S	*	*			trans	-155.7	75.4	159.4	51.5	0	0	0	0	112.4	T376	S374-T376 PolarHBondContact O-N 3.2Å
375	S	37.9	Very low	47.6	Very low	107 Å²	107	128.2 Å²	128.2	75%	0.748	74%	0.743	S	S	*	*			trans	8.5	102.1	141.4	54.8	0	0	0	0	119.1
376	T	37.7	Very low	46.4	Very low	138 Å²	138	128.9 Å²	128.9	85%	0.847	76%	0.758	S	S	*	*				176	127.3	122.8	25.1	0	0	0	0	112.4	S374	S374-T376 PolarHBondContact O-N 3.2Å
377	P	40.1	Very low	45.7	Very low	119 Å²	119	126.6 Å²	126.6	77%	0.773	77%	0.765	S	S	*	*			trans	-91.8	154.8	167.1	37.2	-32.8	0	0	0	111
378	P	42.1	Very low	44.5	Very low	124 Å²	124	129.4 Å²	129.4	81%	0.805	78%	0.777	S	S	*	*				-150.2	-156.8	89.6	40.4	-18.3	0	0	0	112.7
379	P	43	Very low	43.5	Very low	107 Å²	107	129 Å²	129	70%	0.695	78%	0.783	S	S	*	*				-133.7	174.7	-83.5	43.8	-27.8	0	0	0	115.7
380	V	42.3	Very low	42.6	Very low	130 Å²	130	134.6 Å²	134.6	79%	0.788	80%	0.8	S	S	*	*			trans	28.1	118.3	159.3	-64	0	0	0	0	121.2
381	S	36.3	Very low	42	Very low	117 Å²	117	134.4 Å²	134.4	82%	0.818	80%	0.799	S	S	*	*				-176.6	146.6	103.1	-78.1	0	0	0	0	112.4
382	P	40.5	Very low	41.8	Very low	130 Å²	130	138 Å²	138	84%	0.844	81%	0.806	S	S	*	*			trans	-103.6	152.8	-176.6	37.1	-31	0	0	0	114.4
383	G	35.7	Very low	41.9	Very low	76 Å²	76	141.7 Å²	141.7	78%	0.784	81%	0.812	S	S	*	*			trans	110.6	106.3	151.7	0	0	0	0	0	117.4
384	R	40.7	Very low	42.1	Very low	260 Å²	260	138.2 Å²	138.2	98%	0.981	80%	0.799	S	S	*	*			trans	-156.2	131	146.7	-105.2	172.6	-167.8	-166.8	2.6	108.1
385	G	45.5	Very low	42.3	Very low	68 Å²	68	142.3 Å²	142.3	70%	0.701	80%	0.803	S	S	*	*			trans	-143.6	139.1	-177.9	0	0	0	0	0	111.9
386	N	41.4	Very low	42.7	Very low	163 Å²	163	145.5 Å²	145.5	87%	0.872	81%	0.806	S	S	*	*			trans	60.5	152.5	177.8	-59.2	5	0	0	0	115.2
387	P	49.9	Very low	43.1	Very low	123 Å²	123	143.7 Å²	143.7	80%	0.799	80%	0.797	S	S	*	*				-149.8	132	96.1	35.8	-18.2	0	0	0	115.2
388	M	45.7	Very low	43	Very low	174 Å²	174	143.8 Å²	143.8	86%	0.857	80%	0.8	S	S	*	*			trans	-159.7	82.6	146.6	-94.3	-44.5	-67	0	0	110.3
389	H	44.8	Very low	43.7	Very low	193 Å²	193	143.6 Å²	143.6	89%	0.894	80%	0.799	S	S	*	*			trans	-160.5	112.3	157.1	-121.1	-83.2	0	0	0	111.3
390	R	45	Very low	43.6	Very low	229 Å²	229	148.3 Å²	148.3	86%	0.864	81%	0.809	S	S	*	*			trans	-144.7	144.1	159.2	-77.2	-175.4	168.8	160.1	-4.5	103.9
391	L	47.4	Very low	43.8	Very low	141 Å²	141	147.2 Å²	147.2	74%	0.738	81%	0.807	S	S	*	*			cis	-146.3	148.4	40.6	-71.7	159.2	0	0	0	111.4
392	L	46.7	Very low	44.5	Very low	159 Å²	159	147.1 Å²	147.1	83%	0.832	80%	0.803	S	S	*	*			trans	55.7	145.9	149.5	-84.2	57.5	0	0	0	119.3
393	N	40.4	Very low	44.6	Very low	132 Å²	132	150.6 Å²	150.6	71%	0.706	81%	0.806	S	S	*	*			cis	-153.1	138.5	-5.8	-178.7	64.5	0	0	0	109.6
394	P	41.9	Very low	44.9	Very low	100 Å²	100	154.7 Å²	154.7	65%	0.649	81%	0.808	S	S	*	*			trans	-107	141	-173.7	37.3	-30.6	0	0	0	114.9
395	F	42.6	Very low	44.9	Very low	199 Å²	199	148 Å²	148	87%	0.873	80%	0.802	S	S	*	*			trans	-144.3	160.4	149.9	-92.5	-74	0	0	0	110.4
396	Q	46.8	Very low	45.2	Very low	173 Å²	173	151.5 Å²	151.5	81%	0.808	81%	0.81	S	S	*	*			trans	-133.8	178.1	-153	-89	-74.6	-56.2	0	0	110.8
397	P	46.9	Very low	45.9	Very low	100 Å²	100	149.3 Å²	149.3	65%	0.649	80%	0.804	S	S	*	*				-124.6	-165.5	-127	42.8	-28.5	0	0	0	115.5
398	S	37.1	Very low	45.8	Very low	121 Å²	121	149.4 Å²	149.4	85%	0.846	81%	0.805	S	S	*	*			trans	-160	126.5	162.6	-83.6	0	0	0	0	113.5
399	P	56.4	Low	46.3	Very low	120 Å²	120	149 Å²	149	78%	0.779	81%	0.806	S	S	*	*			trans	-122.2	140.7	179.8	38.5	-27.6	0	0	0	116.2
400	K	42.6	Very low	47	Very low	206 Å²	206	145.2 Å²	145.2	90%	0.896	80%	0.798	S	S	*	*			trans	-161.6	157.2	166.8	-59.9	-173.3	-175.1	175.7	0	108.5
401	S	44.6	Very low	47.2	Very low	107 Å²	107	140.2 Å²	140.2	75%	0.748	80%	0.795	S	S	*	*			cis	-169.1	145.2	-24.1	48.4	0	0	0	0	108.5
402	P	52.7	Low	47.6	Very low	115 Å²	115	142 Å²	142	75%	0.747	80%	0.802	S	S	*	*			trans	-101.9	168.3	-166.4	40.2	-37.1	0	0	0	115.6
403	F	41.5	Very low	47.7	Very low	204 Å²	204	140 Å²	140	90%	0.895	80%	0.798	S	S	*	*			trans	170	157	153.7	-89.3	-59.2	0	0	0	106.9
404	L	42	Very low	47.6	Very low	161 Å²	161	138.9 Å²	138.9	84%	0.843	81%	0.807	S	S	*	*			cis	-133	-175.9	13.5	-72.2	169.5	0	0	0	111.5
405	S	41.7	Very low	47.8	Very low	120 Å²	120	137.4 Å²	137.4	84%	0.839	81%	0.811	S	S	*	*			trans	-125.3	159.1	175.1	-52.2	0	0	0	0	112.9
406	T	51.2	Low	48.3	Very low	142 Å²	142	134.5 Å²	134.5	87%	0.871	81%	0.809	S	S	*	*			trans	-134.7	147.2	172.3	16	0	0	0	0	111.5
407	P	55.3	Low	48.9	Very low	116 Å²	116	131.8 Å²	131.8	75%	0.753	81%	0.807	S	S	*	*			trans	-96.2	166.4	-166.4	37.9	-37.1	0	0	0	115.4
408	P	47.7	Very low	49.5	Very low	125 Å²	125	132.5 Å²	132.5	81%	0.812	81%	0.811	S	S	*	*			trans	-88.4	168.9	-177	36.2	-37	0	0	0	115.2
409	L	56.2	Low	50.1	Low	167 Å²	167	132.8 Å²	132.8	87%	0.874	81%	0.81	S	S	*	*			trans	-115.7	161.6	-178.3	-76.7	172.5	0	0	0	112.8
410	P	60.9	Low	49.7	Very low	112 Å²	112	135.8 Å²	135.8	73%	0.727	81%	0.814	S	S	*	*			trans	-87.2	163.8	-163.2	34.5	-37.4	0	0	0	115.9
411	P	48.5	Very low	50.4	Low	124 Å²	124	131.3 Å²	131.3	81%	0.805	81%	0.806	S	S	*	*			trans	-87.5	154.4	-177.6	35.4	-36.2	0	0	0	114.3
412	M	56.5	Low	50.6	Low	180 Å²	180	131.6 Å²	131.6	89%	0.887	81%	0.805	S	S	*	*			trans	-139.6	164.3	170.9	-80.7	-152.6	76.7	0	0	110.8
413	P	49.4	Very low	50.6	Low	116 Å²	116	130.8 Å²	130.8	75%	0.753	81%	0.808	S	S	*	*			trans	-91.9	177.6	-138	35.3	-38.4	0	0	0	116.8	G415	P413-G415 PolarHBondContact O-N 3.1Å
414	A	37.6	Very low	51.4	Low	108 Å²	108	130.2 Å²	130.2	89%	0.893	81%	0.805	S	S	*	*			trans	-56.4	126.8	-170	0	0	0	0	0	115.3
415	G	45.9	Very low	52.8	Low	70 Å²	70	126 Å²	126	72%	0.722	79%	0.789	S	S	*	*			trans	-109.1	137.8	154.6	0	0	0	0	0	109.9	P413	P413-G415 PolarHBondContact O-N 3.1Å
416	T	53.9	Low	54.3	Low	138 Å²	138	125 Å²	125	85%	0.847	77%	0.769	S	S	*	*	P	Polyproline II helix	trans	-68.1	132.6	176.1	43.6	0	0	0	0	111.3
417	P	57.8	Low	55.8	Low	116 Å²	116	121.5 Å²	121.5	75%	0.753	75%	0.751	S	S	*	*	P	Polyproline II helix	trans	-69.3	147	174	29.7	-34.3	0	0	0	111.2
418	P	60.1	Low	57.4	Low	114 Å²	114	116.1 Å²	116.1	74%	0.74	72%	0.715	S	S	*	*	P	Polyproline II helix	trans	-70.7	157.7	179.6	30	-35.6	0	0	0	112.4
419	P	49	Very low	59.2	Low	127 Å²	127	117.4 Å²	117.4	83%	0.825	71%	0.711	S	S	*	*	P	Polyproline II helix	trans	-64.8	138.6	178.1	27.9	-35.1	0	0	0	111.5
420	Q	49.8	Very low	60.4	Low	184 Å²	184	115.2 Å²	115.2	86%	0.86	69%	0.694	S	S	*	*	P	Polyproline II helix	trans	-71.6	144	174.5	-70.1	-165.7	-12.9	0	0	111.3
421	P	55.5	Low	61.6	Low	112 Å²	112	112.4 Å²	112.4	73%	0.727	68%	0.677	S	S	*	*	P	Polyproline II helix	trans	-65.3	147.7	176.1	28.5	-35	0	0	0	110.8	A423	P421-A423 PolarHBondContact O-N 3Å
422	P	49.5	Very low	63.3	Low	113 Å²	113	108.9 Å²	108.9	73%	0.734	66%	0.663	S	S	*	*	P	Polyproline II helix	trans	-64	120.9	-177.9	25.7	-34	0	0	0	110.9	K424	P422-K424 PolarHBondContact O-N 3.34Å; P422-K424 VanDerWaalsContact O-N 3.08Å
423	A	52.5	Low	64.6	Low	97 Å²	97	106.2 Å²	106.2	80%	0.802	65%	0.647	S	S	*	*			trans	-59.6	113.6	171.2	0	0	0	0	0	109	P421 S425	P421-A423 PolarHBondContact O-N 3Å; A423-S425 PolarHBondContact O-N 3.13Å
424	K	59	Low	66.4	Low	193 Å²	193	105.2 Å²	105.2	84%	0.839	64%	0.639	S	S	*	*			trans	-72.5	75	-172.8	-63.1	179.9	-177.5	176.7	0	111.1	P422	P422-K424 PolarHBondContact O-N 3.34Å; P422-K424 VanDerWaalsContact O-N 3.08Å
425	S	70.4	Confident	68.8	Low	71 Å²	71	102.3 Å²	102.3	50%	0.497	61%	0.606	S	S	.	*			trans	-55.1	135.9	-179.8	59.5	0	0	0	0	111.5	A423	A423-S425 PolarHBondContact O-N 3.13Å
426	K	72.9	Confident	70.7	Confident	101 Å²	101	108.2 Å²	108.2	44%	0.439	61%	0.612	S	S	.	*	E	Extended strand (participates in β ladder)	trans	-97.8	104.1	-175.2	-67.9	-67.1	-165.5	167.7	0	109.5	F435 Q438 L441	K426-F435 PolarHBondContact N-O 2.97Å; K426-F435 PolarHBondContact O-N 2.79Å; K426-Q438 VanDerWaalsContact CD-OE1 3.24Å; K426-Q438 VanDerWaalsContact CG-OE1 3.28Å; K426-L441 HydrophobicContact CB-CB 4.39Å; K426-L441 HydrophobicContact CB-CD2 3.76Å
427	S	84.3	Confident	72.2	Confident	68 Å²	68	107.1 Å²	107.1	48%	0.476	60%	0.595	S	S	.	*	E	Extended strand (participates in β ladder)	trans	-84.5	153.7	-179.2	47.8	0	0	0	0	112.8	K433 L441	S427-K433 CarbonylContact C-O 3.58Å; S427-K433 WeakPolarHBondContact CA-O 3.19Å; S427-L441 WeakPolarHBondContact O-CD2 3.4Å
428	C	88.6	Confident	73.8	Confident	2 Å²	2	105.7 Å²	105.7	1%	0.014	58%	0.578	C	S	.	*			trans	-90.6	122	173.7	-169.3	0	0	0	0	111.9	F430 C431 G432 K433 F435 L441 H444 H448	C428-F430 PolarHBondContact O-N 2.79Å; C428-F430 VanDerWaalsContact O-N 3.16Å; C428-C431 PolarHBondContact O-N 2.88Å; C428-G432 WeakPolarHBondContact O-CA 3.42Å; C428-G432 PolarHBondContact O-N 2.67Å; C428-K433 PolarHBondContact N-O 2.93Å; C428-F435 HydrophobicContact CB-CE2 4.46Å; C428-L441 HydrophobicContact CB-CD1 3.65Å; C428-H444 VanDerWaalsContact SG-CD2 3.59Å; C428-H448 VanDerWaalsContact SG-CD2 3.57Å; C428-H448 PolarHBondContact SG-NE2 2.84Å
429	E	85.9	Confident	75.1	Confident	153 Å²	153	101.8 Å²	101.8	72%	0.715	55%	0.554	S	S	*	*	T	Hydrogen-bonded Turn	trans	-52.7	-35.8	178.8	-64.1	143.2	163.9	0	0	112.9	R445	E429-R445 IonicContact OE2-NE 3.35Å; E429-R445 PolarHBondContact OE2-NE 3.36Å; E429-R445 IonicContact OE2-NH2 3.97Å
430	F	80.2	Confident	76.9	Confident	121 Å²	121	99.7 Å²	99.7	53%	0.531	54%	0.536	S	S	.	.	T	Hydrogen-bonded Turn	trans	-84.9	-13.1	-175.3	-60.1	-74.3	0	0	0	115.3	C428 H448	C428-F430 PolarHBondContact O-N 2.79Å; C428-F430 VanDerWaalsContact O-N 3.16Å; F430-H448 HydrophobicContact CB-CB 4.14Å; F430-H448 HydrophobicContact CD2-CB 3.79Å; F430-H448 AromaticContact CD2-CD2 3.95Å; F430-H448 AromaticContact CD2-CG 3.93Å; F430-H448 HydrophobicContact CE2-CB 4.37Å; F430-H448 HydrophobicContact CG-CB 3.94Å; F430-H448 AromaticContact CG-CG 3.92Å
431	C	85.8	Confident	78.8	Confident	52 Å²	52	91.4 Å²	91.4	35%	0.351	50%	0.498	S	S	.	.	T	Hydrogen-bonded Turn	trans	-158.8	13.4	-175.3	71.3	0	0	0	0	116.3	C428 K433 H444 H448	C428-C431 PolarHBondContact O-N 2.88Å; C431-K433 PolarHBondContact O-N 3.08Å; C431-H444 PolarHBondContact SG-NE2 2.76Å; C431-H448 PolarHBondContact SG-NE2 3.42Å; C431-H448 VanDerWaalsContact SG-NE2 3.38Å
432	G	84.3	Confident	80.3	Confident	51 Å²	51	89.5 Å²	89.5	53%	0.526	48%	0.48	S	S	.	.			trans	71.4	-19.9	177.3	0	0	0	0	0	116.6	C428 T434	C428-G432 WeakPolarHBondContact O-CA 3.42Å; C428-G432 PolarHBondContact O-N 2.67Å; G432-T434 PolarHBondContact O-N 3.04Å
433	K	84.9	Confident	82.1	Confident	124 Å²	124	86.1 Å²	86.1	54%	0.539	46%	0.457	S	S	.	.			trans	-51.8	121.3	-172.4	-70.3	179.2	-175.1	176.7	0	112.5	S427 C428 C431 F435	S427-K433 CarbonylContact C-O 3.58Å; S427-K433 WeakPolarHBondContact CA-O 3.19Å; C428-K433 PolarHBondContact N-O 2.93Å; C431-K433 PolarHBondContact O-N 3.08Å; K433-F435 HydrophobicContact CB-CE2 3.72Å; K433-F435 HydrophobicContact CB-CZ 3.99Å; K433-F435 WeakPolarHBondContact O-CD2 3.11Å; K433-F435 VanDerWaalsContact O-CE2 3.26Å; K433-F435 WeakPolarHBondContact O-CE2 3.44Å
434	T	86.6	Confident	83.8	Confident	95 Å²	95	82.8 Å²	82.8	58%	0.583	43%	0.425	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-89.4	129.4	-179.8	42.8	0	0	0	0	111.5	G432	G432-T434 PolarHBondContact O-N 3.04Å
435	F	87.1	Confident	85.2	Confident	46 Å²	46	77.6 Å²	77.6	20%	0.202	40%	0.401	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-114.1	146.5	176.2	-61.5	-87.9	0	0	0	110.4	K426 C428 K433 F437 N440 L441 H444	K426-F435 PolarHBondContact N-O 2.97Å; K426-F435 PolarHBondContact O-N 2.79Å; C428-F435 HydrophobicContact CB-CE2 4.46Å; K433-F435 HydrophobicContact CB-CE2 3.72Å; K433-F435 HydrophobicContact CB-CZ 3.99Å; K433-F435 WeakPolarHBondContact O-CD2 3.11Å; K433-F435 VanDerWaalsContact O-CE2 3.26Å; K433-F435 WeakPolarHBondContact O-CE2 3.44Å; F435-F437 VanDerWaalsContact C-N 3.33Å; F435-N440 HydrophobicContact CB-CB 4.16Å; F435-N440 HydrophobicContact CD1-CB 3.86Å; F435-N440 HydrophobicContact CG-CB 4.26Å; F435-L441 HydrophobicContact CB-CB 4.29Å; F435-L441 HydrophobicContact CD2-CB 4.06Å; F435-L441 HydrophobicContact CD2-CD1 3.97Å; F435-L441 HydrophobicContact CE2-CD1 4.27Å; F435-L441 HydrophobicContact CG-CB 4.37Å; F435-H444 HydrophobicContact CE1-CB 4.14Å; F435-H444 HydrophobicContact CE2-CB 3.83Å; F435-H444 AromaticContact CE2-CD2 3.35Å; F435-H444 WeakPolarHBondContact CE2-CD2 3.35Å; F435-H444 AromaticContact CE2-CG 3.69Å; F435-H444 HydrophobicContact CZ-CB 3.53Å; F435-H444 AromaticContact CZ-CD2 3.45Å; F435-H444 VanDerWaalsContact CZ-CD2 3.45Å; F435-H444 WeakPolarHBondContact CZ-CD2 3.36Å; F435-H444 AromaticContact CZ-CG 3.36Å
436	K	86.1	Confident	86.1	Confident	195 Å²	195	77.1 Å²	77.1	85%	0.848	39%	0.388	S	S	*	.	S	Bend	trans	-71.1	-30.6	175.5	-67	-173.8	177.9	-176.4	0	112.3
437	F	86.7	Confident	86.6	Confident	114 Å²	114	75.9 Å²	75.9	50%	0.5	39%	0.392	S	S	.	.	S	Bend	trans	-124.6	145.9	-175.5	-57.1	-75.4	0	0	0	111.3	F435 S439 N440 L441	F435-F437 VanDerWaalsContact C-N 3.33Å; F437-S439 VanDerWaalsContact C-N 3.34Å; F437-S439 WeakPolarHBondContact CB-OG 3.29Å; F437-N440 PolarHBondContact O-N 3.48Å; F437-L441 PolarHBondContact O-N 3.22Å
438	Q	89.8	Confident	86.7	Confident	86 Å²	86	76 Å²	76	40%	0.402	39%	0.385	S	S	.	.	H	α-helix	trans	-67.7	-33.9	178.7	-175.7	67.8	23.7	0	0	111.8	K426 N440 L441 I442	K426-Q438 VanDerWaalsContact CD-OE1 3.24Å; K426-Q438 VanDerWaalsContact CG-OE1 3.28Å; Q438-N440 PolarHBondContact O-N 2.61Å; Q438-L441 PolarHBondContact O-N 3.43Å; Q438-I442 HydrophobicContact CG-CD1 3.97Å; Q438-I442 HydrophobicContact CG-CG1 4.42Å; Q438-I442 WeakPolarHBondContact O-CG1 3.37Å; Q438-I442 PolarHBondContact O-N 3.03Å
439	S	88	Confident	86.4	Confident	33 Å²	33	78.9 Å²	78.9	23%	0.231	40%	0.403	C	S	.	.	H	α-helix	trans	-51.2	-54.3	172.4	51.2	0	0	0	0	111.3	F437 L441 I442 V443	F437-S439 VanDerWaalsContact C-N 3.34Å; F437-S439 WeakPolarHBondContact CB-OG 3.29Å; S439-L441 PolarHBondContact O-N 2.65Å; S439-I442 PolarHBondContact O-N 3.42Å; S439-V443 WeakPolarHBondContact O-CB 3.49Å; S439-V443 WeakPolarHBondContact O-CG2 3.35Å; S439-V443 PolarHBondContact O-N 3.47Å
440	N	87.4	Confident	86.1	Confident	82 Å²	82	74 Å²	74	44%	0.439	39%	0.393	S	S	.	.	H	α-helix	trans	-60.3	-39.6	176.8	-85.2	-83.8	0	0	0	113.1	F435 F437 Q438 H444	F435-N440 HydrophobicContact CB-CB 4.16Å; F435-N440 HydrophobicContact CD1-CB 3.86Å; F435-N440 HydrophobicContact CG-CB 4.26Å; F437-N440 PolarHBondContact O-N 3.48Å; Q438-N440 PolarHBondContact O-N 2.61Å; N440-H444 VanDerWaalsContact O-CB 3.28Å; N440-H444 WeakPolarHBondContact O-CB 3.46Å; N440-H444 PolarHBondContact O-N 3.15Å
441	L	89.9	Confident	86.2	Confident	11 Å²	11	73.5 Å²	73.5	6%	0.058	39%	0.392	C	S	.	.	H	α-helix	trans	-64.9	-44.2	173.4	173.2	60.8	0	0	0	112.2	K426 S427 C428 F435 F437 Q438 S439 H444 R445	K426-L441 HydrophobicContact CB-CB 4.39Å; K426-L441 HydrophobicContact CB-CD2 3.76Å; S427-L441 WeakPolarHBondContact O-CD2 3.4Å; C428-L441 HydrophobicContact CB-CD1 3.65Å; F435-L441 HydrophobicContact CB-CB 4.29Å; F435-L441 HydrophobicContact CD2-CB 4.06Å; F435-L441 HydrophobicContact CD2-CD1 3.97Å; F435-L441 HydrophobicContact CE2-CD1 4.27Å; F435-L441 HydrophobicContact CG-CB 4.37Å; F437-L441 PolarHBondContact O-N 3.22Å; Q438-L441 PolarHBondContact O-N 3.43Å; S439-L441 PolarHBondContact O-N 2.65Å; L441-H444 CarbonylContact O-C 3.51Å; L441-H444 PolarHBondContact O-N 2.84Å; L441-R445 HydrophobicContact CD1-CG 4.06Å; L441-R445 HydrophobicContact CG-CG 4.44Å; L441-R445 WeakPolarHBondContact O-CG 3.48Å; L441-R445 PolarHBondContact O-N 2.94Å
442	I	87.5	Confident	86.2	Confident	71 Å²	71	76.6 Å²	76.6	36%	0.364	40%	0.4	S	S	.	.	H	α-helix	trans	-61.5	-47.7	179	-69.4	164.1	0	0	0	110.2	Q438 S439 H444 R445 R446	Q438-I442 HydrophobicContact CG-CD1 3.97Å; Q438-I442 HydrophobicContact CG-CG1 4.42Å; Q438-I442 WeakPolarHBondContact O-CG1 3.37Å; Q438-I442 PolarHBondContact O-N 3.03Å; S439-I442 PolarHBondContact O-N 3.42Å; I442-H444 VanDerWaalsContact C-N 3.26Å; I442-H444 PolarHBondContact O-N 3.45Å; I442-R445 PolarHBondContact O-N 3.43Å; I442-R445 VanDerWaalsContact O-N 3.16Å; I442-R446 PolarHBondContact O-N 2.93Å
443	V	87.3	Confident	86.2	Confident	42 Å²	42	77.9 Å²	77.9	26%	0.255	40%	0.399	S	S	.	.	H	α-helix	trans	-61.6	-34.3	176.3	168.5	0	0	0	0	111.8	S439 Q465	S439-V443 WeakPolarHBondContact O-CB 3.49Å; S439-V443 WeakPolarHBondContact O-CG2 3.35Å; S439-V443 PolarHBondContact O-N 3.47Å; V443-Q465 HydrophobicContact CG1-CG 3.76Å
444	H	87.8	Confident	86.2	Confident	28 Å²	28	75.6 Å²	75.6	13%	0.13	39%	0.387	C	S	.	.	H	α-helix	trans	-73.5	-37.6	172.7	-180	51.3	0	0	0	113.3	C428 C431 F435 N440 L441 I442 R446 S447 H448	C428-H444 VanDerWaalsContact SG-CD2 3.59Å; C431-H444 PolarHBondContact SG-NE2 2.76Å; F435-H444 HydrophobicContact CE1-CB 4.14Å; F435-H444 HydrophobicContact CE2-CB 3.83Å; F435-H444 AromaticContact CE2-CD2 3.35Å; F435-H444 WeakPolarHBondContact CE2-CD2 3.35Å; F435-H444 AromaticContact CE2-CG 3.69Å; F435-H444 HydrophobicContact CZ-CB 3.53Å; F435-H444 AromaticContact CZ-CD2 3.45Å; F435-H444 VanDerWaalsContact CZ-CD2 3.45Å; F435-H444 WeakPolarHBondContact CZ-CD2 3.36Å; F435-H444 AromaticContact CZ-CG 3.36Å; N440-H444 VanDerWaalsContact O-CB 3.28Å; N440-H444 WeakPolarHBondContact O-CB 3.46Å; N440-H444 PolarHBondContact O-N 3.15Å; L441-H444 CarbonylContact O-C 3.51Å; L441-H444 PolarHBondContact O-N 2.84Å; I442-H444 VanDerWaalsContact C-N 3.26Å; I442-H444 PolarHBondContact O-N 3.45Å; H444-R446 PolarHBondContact O-N 3.24Å; H444-S447 PolarHBondContact CE1-OG 3.36Å; H444-S447 VanDerWaalsContact CE1-OG 3.3Å; H444-S447 PolarHBondContact ND1-OG 2.97Å; H444-S447 VanDerWaalsContact ND1-OG 3.09Å; H444-S447 WeakPolarHBondContact O-CA 3.31Å; H444-S447 WeakPolarHBondContact O-CB 3.32Å; H444-S447 PolarHBondContact O-N 3.32Å; H444-S447 PolarHBondContact O-OG 3.31Å; H444-H448 AromaticContact CD2-NE2 3.86Å; H444-H448 AromaticContact CE1-NE2 3.38Å; H444-H448 PolarHBondContact CE1-NE2 2.85Å; H444-H448 AromaticContact NE2-CD2 3.83Å; H444-H448 AromaticContact NE2-CE1 3.96Å; H444-H448 AromaticContact NE2-NE2 3Å; H444-H448 PolarHBondContact NE2-NE2 2.82Å
445	R	88.9	Confident	86.2	Confident	84 Å²	84	78.7 Å²	78.7	32%	0.317	39%	0.393	S	S	.	.	H	α-helix	trans	-58.1	-35.8	175.5	-76.3	173.7	74.2	-94.4	1.8	111.9	E429 L441 I442 S447 H448 T449	E429-R445 IonicContact OE2-NE 3.35Å; E429-R445 PolarHBondContact OE2-NE 3.36Å; E429-R445 IonicContact OE2-NH2 3.97Å; L441-R445 HydrophobicContact CD1-CG 4.06Å; L441-R445 HydrophobicContact CG-CG 4.44Å; L441-R445 WeakPolarHBondContact O-CG 3.48Å; L441-R445 PolarHBondContact O-N 2.94Å; I442-R445 PolarHBondContact O-N 3.43Å; I442-R445 VanDerWaalsContact O-N 3.16Å; R445-S447 PolarHBondContact O-N 2.86Å; R445-S447 VanDerWaalsContact O-N 3.1Å; R445-H448 PolarHBondContact O-N 2.62Å; R445-T449 PolarHBondContact O-N 3.16Å; R445-T449 VanDerWaalsContact O-N 3.13Å; R445-T449 PolarHBondContact O-OG1 3.32Å
446	R	88.7	Confident	86.3	Confident	60 Å²	60	77.1 Å²	77.1	23%	0.226	39%	0.387	C	S	.	.	H	α-helix	trans	-58.7	-18.5	171.2	-63.6	179.4	-173.4	161	2.9	114.5	I442 H444 T449 G450 S464	I442-R446 PolarHBondContact O-N 2.93Å; H444-R446 PolarHBondContact O-N 3.24Å; R446-T449 WeakPolarHBondContact CA-OG1 3.32Å; R446-G450 PolarHBondContact O-N 3.26Å; R446-S464 WeakPolarHBondContact CD-O 3.34Å; R446-S464 PolarHBondContact NH1-O 3.21Å
447	S	83.9	Confident	86.3	Confident	75 Å²	75	76.4 Å²	76.4	52%	0.524	39%	0.387	S	S	.	.	H	α-helix	trans	-82	-14.8	173.5	71.6	0	0	0	0	114.2	H444 R445	H444-S447 PolarHBondContact CE1-OG 3.36Å; H444-S447 VanDerWaalsContact CE1-OG 3.3Å; H444-S447 PolarHBondContact ND1-OG 2.97Å; H444-S447 VanDerWaalsContact ND1-OG 3.09Å; H444-S447 WeakPolarHBondContact O-CA 3.31Å; H444-S447 WeakPolarHBondContact O-CB 3.32Å; H444-S447 PolarHBondContact O-N 3.32Å; H444-S447 PolarHBondContact O-OG 3.31Å; R445-S447 PolarHBondContact O-N 2.86Å; R445-S447 VanDerWaalsContact O-N 3.1Å
448	H	84.6	Confident	86.2	Confident	72 Å²	72	76 Å²	76	33%	0.333	39%	0.39	S	S	.	.	H	α-helix	trans	-95.8	-42.5	172.1	-60.8	-73.5	0	0	0	111.8	C428 F430 C431 H444 R445 G450	C428-H448 VanDerWaalsContact SG-CD2 3.57Å; C428-H448 PolarHBondContact SG-NE2 2.84Å; F430-H448 HydrophobicContact CB-CB 4.14Å; F430-H448 HydrophobicContact CD2-CB 3.79Å; F430-H448 AromaticContact CD2-CD2 3.95Å; F430-H448 AromaticContact CD2-CG 3.93Å; F430-H448 HydrophobicContact CE2-CB 4.37Å; F430-H448 HydrophobicContact CG-CB 3.94Å; F430-H448 AromaticContact CG-CG 3.92Å; C431-H448 PolarHBondContact SG-NE2 3.42Å; C431-H448 VanDerWaalsContact SG-NE2 3.38Å; H444-H448 AromaticContact CD2-NE2 3.86Å; H444-H448 AromaticContact CE1-NE2 3.38Å; H444-H448 PolarHBondContact CE1-NE2 2.85Å; H444-H448 AromaticContact NE2-CD2 3.83Å; H444-H448 AromaticContact NE2-CE1 3.96Å; H444-H448 AromaticContact NE2-NE2 3Å; H444-H448 PolarHBondContact NE2-NE2 2.82Å; R445-H448 PolarHBondContact O-N 2.62Å; H448-G450 PolarHBondContact O-N 2.9Å
449	T	82.6	Confident	86	Confident	62 Å²	62	74.2 Å²	74.2	38%	0.38	39%	0.386	S	S	.	.	H	α-helix	trans	-72.8	-14.9	177.6	59.6	0	0	0	0	113.3	R445 R446 E451	R445-T449 PolarHBondContact O-N 3.16Å; R445-T449 VanDerWaalsContact O-N 3.13Å; R445-T449 PolarHBondContact O-OG1 3.32Å; R446-T449 WeakPolarHBondContact CA-OG1 3.32Å; T449-E451 VanDerWaalsContact CB-OE2 3.25Å; T449-E451 WeakPolarHBondContact CB-OE2 3.48Å; T449-E451 PolarHBondContact O-N 3.49Å; T449-E451 VanDerWaalsContact OG1-CD 3.3Å; T449-E451 WeakPolarHBondContact OG1-CG 3.39Å; T449-E451 PolarHBondContact OG1-OE2 2.75Å
450	G	80.4	Confident	85.9	Confident	50 Å²	50	80.9 Å²	80.9	52%	0.515	42%	0.419	S	S	.	.			trans	71.6	2.2	-176.6	0	0	0	0	0	114.4	R446 H448 K452	R446-G450 PolarHBondContact O-N 3.26Å; H448-G450 PolarHBondContact O-N 2.9Å; G450-K452 PolarHBondContact O-N 3.31Å
451	E	83.1	Confident	85.8	Confident	110 Å²	110	81 Å²	81	51%	0.514	42%	0.417	S	S	.	.			trans	-63.4	129.5	-174.1	-69.6	167.2	127.2	0	0	112.2	T449 S464	T449-E451 VanDerWaalsContact CB-OE2 3.25Å; T449-E451 WeakPolarHBondContact CB-OE2 3.48Å; T449-E451 PolarHBondContact O-N 3.49Å; T449-E451 VanDerWaalsContact OG1-CD 3.3Å; T449-E451 WeakPolarHBondContact OG1-CG 3.39Å; T449-E451 PolarHBondContact OG1-OE2 2.75Å; E451-S464 WeakPolarHBondContact O-CB 3.46Å
452	K	84.4	Confident	85.7	Confident	118 Å²	118	81.7 Å²	81.7	51%	0.513	42%	0.424	S	S	.	.			trans	-128.2	77	-176.9	-73.6	159.8	160.6	-123.5	0	111.2	G450 Y454 A462 C463	G450-K452 PolarHBondContact O-N 3.31Å; K452-Y454 PolarHBondContact O-N 3.28Å; K452-A462 HydrophobicContact CB-CB 3.76Å; K452-A462 HydrophobicContact CD-CB 4.32Å; K452-A462 WeakPolarHBondContact CD-O 3.5Å; K452-A462 WeakPolarHBondContact CE-O 3.38Å; K452-A462 PolarHBondContact NZ-O 3.45Å; K452-C463 CarbonylContact C-O 3.58Å; K452-C463 VanDerWaalsContact C-O 3.24Å; K452-C463 VanDerWaalsContact CA-O 3.23Å; K452-C463 WeakPolarHBondContact CA-O 3.37Å
453	P	84.8	Confident	85.5	Confident	78 Å²	78	78.8 Å²	78.8	51%	0.506	41%	0.41	S	S	.	.			trans	-62.3	-29.5	-177.4	-23.3	34.8	0	0	0	113.7	K455	P453-K455 PolarHBondContact O-N 2.68Å
454	Y	85.2	Confident	85.5	Confident	75 Å²	75	78.1 Å²	78.1	29%	0.294	41%	0.407	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-93.1	81.4	-170.1	-54.1	-87	0	0	0	110.8	K452 A462 C463 A466	K452-Y454 PolarHBondContact O-N 3.28Å; Y454-A462 WeakPolarHBondContact O-CA 3.22Å; Y454-C463 PolarHBondContact N-O 3.47Å; Y454-C463 PolarHBondContact O-N 3.01Å; Y454-A466 HydrophobicContact CD1-CB 4.06Å; Y454-A466 HydrophobicContact CE1-CB 3.7Å
455	K	86	Confident	85.4	Confident	161 Å²	161	79.1 Å²	79.1	70%	0.7	41%	0.412	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-74.7	138.3	171.6	63.7	-173.4	179.2	-177.7	0	111.7	P453 A462 L469	P453-K455 PolarHBondContact O-N 2.68Å; K455-A462 HydrophobicContact CB-CB 4.43Å; K455-L469 WeakPolarHBondContact O-CD2 3.46Å
456	C	89.8	Confident	85.4	Confident	13 Å²	13	76.6 Å²	76.6	9%	0.088	41%	0.409	C	S	.	.			trans	-72.8	149.5	167.7	-168.5	0	0	0	0	110.9	L458 C459 H461 L469 H472	C456-L458 PolarHBondContact SG-N 3Å; C456-L458 VanDerWaalsContact SG-N 3.4Å; C456-C459 WeakPolarHBondContact CB-O 3.38Å; C456-H461 WeakPolarHBondContact CB-O 3.41Å; C456-H461 PolarHBondContact N-O 3.22Å; C456-L469 HydrophobicContact CB-CD1 3.7Å; C456-H472 VanDerWaalsContact SG-CD2 3.57Å
457	Q	85	Confident	85.4	Confident	180 Å²	180	75.8 Å²	75.8	84%	0.841	41%	0.412	S	S	*	.	S	Bend	trans	-91.5	-10	175.2	-58	-173.3	18.8	0	0	112.8
458	L	84.4	Confident	85.6	Confident	106 Å²	106	76.7 Å²	76.7	56%	0.555	41%	0.407	S	S	*	.	S	Bend	trans	-110.3	-9	-174.5	-58.3	178.3	0	0	0	113.6	C456 M473 H476	C456-L458 PolarHBondContact SG-N 3Å; C456-L458 VanDerWaalsContact SG-N 3.4Å; L458-M473 HydrophobicContact CD1-CE 3.7Å; L458-M473 HydrophobicContact CG-CE 4.04Å; L458-H476 HydrophobicContact CB-CB 4.45Å; L458-H476 HydrophobicContact CD1-CB 3.57Å
459	C	87.5	Confident	85.9	Confident	48 Å²	48	74.6 Å²	74.6	32%	0.324	40%	0.398	S	S	.	.	S	Bend	trans	-164.1	172.3	165.8	69.2	0	0	0	0	110.8	C456 H461 H472 H476	C456-C459 WeakPolarHBondContact CB-O 3.38Å; C459-H461 PolarHBondContact O-N 2.98Å; C459-H472 PolarHBondContact SG-NE2 3.46Å; C459-H472 VanDerWaalsContact SG-NE2 3.37Å; C459-H476 VanDerWaalsContact SG-CE1 3.51Å; C459-H476 PolarHBondContact SG-NE2 2.88Å; C459-H476 VanDerWaalsContact SG-NE2 3.37Å
460	D	84.7	Confident	86.1	Confident	173 Å²	173	76.9 Å²	76.9	93%	0.925	40%	0.403	S	S	*	.	S	Bend	trans	-71.2	17.1	-175.3	-43.8	-75.3	0	0	0	115.1
461	H	84.7	Confident	86.5	Confident	85 Å²	85	81.7 Å²	81.7	39%	0.394	41%	0.405	S	S	.	.			trans	-83.2	120.1	-179.1	-166.4	74	0	0	0	111.9	C456 C459 C463 H472	C456-H461 WeakPolarHBondContact CB-O 3.41Å; C456-H461 PolarHBondContact N-O 3.22Å; C459-H461 PolarHBondContact O-N 2.98Å; H461-C463 VanDerWaalsContact CD2-SG 3.56Å; H461-H472 AromaticContact CD2-CE1 3.8Å; H461-H472 AromaticContact CD2-CG 3.84Å; H461-H472 AromaticContact CD2-ND1 3.57Å; H461-H472 AromaticContact CG-CE1 3.74Å; H461-H472 AromaticContact CG-ND1 3.95Å
462	A	87.9	Confident	86.8	Confident	25 Å²	25	78.1 Å²	78.1	21%	0.207	39%	0.389	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-114.8	138.1	175.7	0	0	0	0	0	113	K452 Y454 K455	K452-A462 HydrophobicContact CB-CB 3.76Å; K452-A462 HydrophobicContact CD-CB 4.32Å; K452-A462 WeakPolarHBondContact CD-O 3.5Å; K452-A462 WeakPolarHBondContact CE-O 3.38Å; K452-A462 PolarHBondContact NZ-O 3.45Å; Y454-A462 WeakPolarHBondContact O-CA 3.22Å; K455-A462 HydrophobicContact CB-CB 4.43Å
463	C	84.5	Confident	87	Confident	10 Å²	10	75.6 Å²	75.6	7%	0.068	38%	0.379	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-117.2	157.2	-177	-58.7	0	0	0	0	112.1	K452 Y454 H461 K468 L469	K452-C463 CarbonylContact C-O 3.58Å; K452-C463 VanDerWaalsContact C-O 3.24Å; K452-C463 VanDerWaalsContact CA-O 3.23Å; K452-C463 WeakPolarHBondContact CA-O 3.37Å; Y454-C463 PolarHBondContact N-O 3.47Å; Y454-C463 PolarHBondContact O-N 3.01Å; H461-C463 VanDerWaalsContact CD2-SG 3.56Å; C463-K468 HydrophobicContact CB-CB 4Å; C463-L469 HydrophobicContact CB-CB 4.41Å
464	S	86	Confident	87.2	Confident	28 Å²	28	78.2 Å²	78.2	20%	0.196	38%	0.383	C	S	.	.	S	Bend	trans	-92.5	-2.4	177.6	53.4	0	0	0	0	114.9	R446 E451	R446-S464 WeakPolarHBondContact CD-O 3.34Å; R446-S464 PolarHBondContact NH1-O 3.21Å; E451-S464 WeakPolarHBondContact O-CB 3.46Å
465	Q	87.2	Confident	87.2	Confident	48 Å²	48	79.1 Å²	79.1	22%	0.224	40%	0.396	C	S	.	.	S	Bend	trans	-141.6	151.4	-179.8	-67.3	167.8	-15.2	0	0	110.2	V443 K468 L469	V443-Q465 HydrophobicContact CG1-CG 3.76Å; Q465-K468 HydrophobicContact CB-CB 4.38Å; Q465-K468 HydrophobicContact CB-CD 4.25Å; Q465-K468 HydrophobicContact CB-CG 4.35Å; Q465-K468 VanDerWaalsContact CD-NZ 3.26Å; Q465-L469 PolarHBondContact O-N 2.97Å
466	A	89.1	Confident	87	Confident	31 Å²	31	73.4 Å²	73.4	26%	0.256	37%	0.372	S	S	.	.	H	α-helix	trans	-66.8	-52.2	179.1	0	0	0	0	0	112.6	Y454 K468 L469 K470	Y454-A466 HydrophobicContact CD1-CB 4.06Å; Y454-A466 HydrophobicContact CE1-CB 3.7Å; A466-K468 PolarHBondContact O-N 3.49Å; A466-K468 VanDerWaalsContact O-N 3.14Å; A466-L469 CarbonylContact O-C 3.57Å; A466-L469 WeakPolarHBondContact O-CA 3.17Å; A466-L469 WeakPolarHBondContact O-CB 3.34Å; A466-L469 PolarHBondContact O-N 3.38Å; A466-K470 PolarHBondContact O-N 3.27Å
467	S	88.2	Confident	86.3	Confident	43 Å²	43	79.6 Å²	79.6	30%	0.301	40%	0.401	S	S	.	.	H	α-helix	trans	-52.7	-34.9	177.1	61.5	0	0	0	0	114.1	K470 R471	S467-K470 PolarHBondContact O-N 3.02Å; S467-R471 WeakPolarHBondContact O-CB 3.2Å; S467-R471 PolarHBondContact O-N 3.05Å
468	K	88.1	Confident	85.2	Confident	95 Å²	95	78.5 Å²	78.5	41%	0.413	40%	0.396	S	S	.	.	H	α-helix	trans	-66.9	-38.7	172.5	-75.6	176.5	176.9	141.7	0	112.8	C463 Q465 A466 H472	C463-K468 HydrophobicContact CB-CB 4Å; Q465-K468 HydrophobicContact CB-CB 4.38Å; Q465-K468 HydrophobicContact CB-CD 4.25Å; Q465-K468 HydrophobicContact CB-CG 4.35Å; Q465-K468 VanDerWaalsContact CD-NZ 3.26Å; A466-K468 PolarHBondContact O-N 3.49Å; A466-K468 VanDerWaalsContact O-N 3.14Å; K468-H472 VanDerWaalsContact O-CB 3.31Å; K468-H472 WeakPolarHBondContact O-CB 3.39Å; K468-H472 PolarHBondContact O-N 3.4Å
469	L	89.5	Confident	83.7	Confident	27 Å²	27	81.6 Å²	81.6	14%	0.141	41%	0.405	C	S	.	.	H	α-helix	trans	-68.7	-42.4	172.5	175.6	60.2	0	0	0	111.3	K455 C456 C463 Q465 A466 R471 H472 M473	K455-L469 WeakPolarHBondContact O-CD2 3.46Å; C456-L469 HydrophobicContact CB-CD1 3.7Å; C463-L469 HydrophobicContact CB-CB 4.41Å; Q465-L469 PolarHBondContact O-N 2.97Å; A466-L469 CarbonylContact O-C 3.57Å; A466-L469 WeakPolarHBondContact O-CA 3.17Å; A466-L469 WeakPolarHBondContact O-CB 3.34Å; A466-L469 PolarHBondContact O-N 3.38Å; L469-R471 PolarHBondContact O-N 2.9Å; L469-H472 CarbonylContact O-C 3.24Å; L469-H472 WeakPolarHBondContact O-CA 3.4Å; L469-H472 WeakPolarHBondContact O-CB 3.43Å; L469-H472 PolarHBondContact O-N 3.23Å; L469-H472 VanDerWaalsContact O-N 3.11Å; L469-M473 HydrophobicContact CD1-CG 3.94Å; L469-M473 HydrophobicContact CG-CG 4.33Å; L469-M473 WeakPolarHBondContact O-CG 3.22Å; L469-M473 PolarHBondContact O-N 2.85Å
470	K	88.7	Confident	81.8	Confident	110 Å²	110	82.7 Å²	82.7	48%	0.478	42%	0.417	S	S	.	.	H	α-helix	trans	-56.7	-49.8	176.2	-167.1	173	-179.7	179.1	0	111.3	A466 S467 H472 M473 K474 E535	A466-K470 PolarHBondContact O-N 3.27Å; S467-K470 PolarHBondContact O-N 3.02Å; K470-H472 VanDerWaalsContact C-N 3.34Å; K470-H472 PolarHBondContact O-N 3.41Å; K470-M473 PolarHBondContact O-N 3.35Å; K470-K474 PolarHBondContact O-N 3.09Å; K470-K474 VanDerWaalsContact O-N 3.16Å; K470-E535 IonicContact NZ-OE1 2.61Å; K470-E535 PolarHBondContact NZ-OE1 2.99Å; K470-E535 IonicContact NZ-OE2 2.66Å; K470-E535 PolarHBondContact NZ-OE2 3.07Å
471	R	88.9	Confident	79.8	Confident	152 Å²	152	78 Å²	78	57%	0.574	41%	0.41	S	S	*	.	H	α-helix	trans	-62.5	-36.3	174.1	-166.9	176.3	-71.5	123.2	-5.7	112.8	S467 L469 E532	S467-R471 WeakPolarHBondContact O-CB 3.2Å; S467-R471 PolarHBondContact O-N 3.05Å; L469-R471 PolarHBondContact O-N 2.9Å; R471-E532 IonicContact NH2-OE1 3.28Å; R471-E532 PolarHBondContact NH2-OE1 3.03Å
472	H	89.4	Confident	78.1	Confident	35 Å²	35	78.7 Å²	78.7	16%	0.162	42%	0.424	C	S	.	.	H	α-helix	trans	-66.1	-42.3	172.3	172.4	80	0	0	0	112.1	C456 C459 H461 K468 L469 K470 K474 T475 H476	C456-H472 VanDerWaalsContact SG-CD2 3.57Å; C459-H472 PolarHBondContact SG-NE2 3.46Å; C459-H472 VanDerWaalsContact SG-NE2 3.37Å; H461-H472 AromaticContact CD2-CE1 3.8Å; H461-H472 AromaticContact CD2-CG 3.84Å; H461-H472 AromaticContact CD2-ND1 3.57Å; H461-H472 AromaticContact CG-CE1 3.74Å; H461-H472 AromaticContact CG-ND1 3.95Å; K468-H472 VanDerWaalsContact O-CB 3.31Å; K468-H472 WeakPolarHBondContact O-CB 3.39Å; K468-H472 PolarHBondContact O-N 3.4Å; L469-H472 CarbonylContact O-C 3.24Å; L469-H472 WeakPolarHBondContact O-CA 3.4Å; L469-H472 WeakPolarHBondContact O-CB 3.43Å; L469-H472 PolarHBondContact O-N 3.23Å; L469-H472 VanDerWaalsContact O-N 3.11Å; K470-H472 VanDerWaalsContact C-N 3.34Å; K470-H472 PolarHBondContact O-N 3.41Å; H472-K474 VanDerWaalsContact C-N 3.34Å; H472-K474 PolarHBondContact O-N 3.11Å; H472-T475 WeakPolarHBondContact O-CA 3.18Å; H472-T475 WeakPolarHBondContact O-CB 3.33Å; H472-T475 PolarHBondContact O-N 2.93Å; H472-T475 PolarHBondContact O-OG1 3.48Å; H472-T475 VanDerWaalsContact O-OG1 3.07Å; H472-H476 AromaticContact CD2-CD2 3.99Å; H472-H476 AromaticContact CD2-NE2 3.83Å; H472-H476 AromaticContact CE1-NE2 3.61Å; H472-H476 AromaticContact NE2-CD2 3.61Å; H472-H476 AromaticContact NE2-NE2 3Å; H472-H476 PolarHBondContact NE2-NE2 2.91Å
473	M	86.9	Confident	76.4	Confident	65 Å²	65	85.5 Å²	85.5	32%	0.32	46%	0.457	S	S	.	.	H	α-helix	trans	-64.8	-33	179.1	-70.2	-150.2	70	0	0	113.4	L458 L469 K470 T475 H476 M477	L458-M473 HydrophobicContact CD1-CE 3.7Å; L458-M473 HydrophobicContact CG-CE 4.04Å; L469-M473 HydrophobicContact CD1-CG 3.94Å; L469-M473 HydrophobicContact CG-CG 4.33Å; L469-M473 WeakPolarHBondContact O-CG 3.22Å; L469-M473 PolarHBondContact O-N 2.85Å; K470-M473 PolarHBondContact O-N 3.35Å; M473-T475 PolarHBondContact O-N 3.41Å; M473-H476 WeakPolarHBondContact O-CB 3.27Å; M473-H476 PolarHBondContact O-N 2.77Å; M473-M477 PolarHBondContact O-N 3.43Å
474	K	88.7	Confident	74.5	Confident	133 Å²	133	89.8 Å²	89.8	58%	0.578	49%	0.492	S	S	*	.	H	α-helix	trans	-57.1	-31.3	170.2	-164.6	167.5	-176.5	173.9	0	112.3	K470 H472 H476 M477 H478	K470-K474 PolarHBondContact O-N 3.09Å; K470-K474 VanDerWaalsContact O-N 3.16Å; H472-K474 VanDerWaalsContact C-N 3.34Å; H472-K474 PolarHBondContact O-N 3.11Å; K474-H476 VanDerWaalsContact C-N 3.31Å; K474-H476 PolarHBondContact O-N 2.83Å; K474-M477 PolarHBondContact O-N 2.96Å; K474-H478 PolarHBondContact O-CD2 3.49Å; K474-H478 PolarHBondContact O-N 3.14Å
475	T	85.3	Confident	72.4	Confident	94 Å²	94	91.7 Å²	91.7	58%	0.577	52%	0.516	S	S	*	.	H	α-helix	trans	-62.7	-35.5	173.5	-43.1	0	0	0	0	112.5	H472 M473	H472-T475 WeakPolarHBondContact O-CA 3.18Å; H472-T475 WeakPolarHBondContact O-CB 3.33Å; H472-T475 PolarHBondContact O-N 2.93Å; H472-T475 PolarHBondContact O-OG1 3.48Å; H472-T475 VanDerWaalsContact O-OG1 3.07Å; M473-T475 PolarHBondContact O-N 3.41Å
476	H	81.9	Confident	70.1	Confident	41 Å²	41	101.6 Å²	101.6	19%	0.19	55%	0.552	C	S	.	*	H	α-helix	trans	-74.9	-35.6	176.8	-70	-74.8	0	0	0	112.3	L458 C459 H472 M473 K474 H478 K479 A480	L458-H476 HydrophobicContact CB-CB 4.45Å; L458-H476 HydrophobicContact CD1-CB 3.57Å; C459-H476 VanDerWaalsContact SG-CE1 3.51Å; C459-H476 PolarHBondContact SG-NE2 2.88Å; C459-H476 VanDerWaalsContact SG-NE2 3.37Å; H472-H476 AromaticContact CD2-CD2 3.99Å; H472-H476 AromaticContact CD2-NE2 3.83Å; H472-H476 AromaticContact CE1-NE2 3.61Å; H472-H476 AromaticContact NE2-CD2 3.61Å; H472-H476 AromaticContact NE2-NE2 3Å; H472-H476 PolarHBondContact NE2-NE2 2.91Å; M473-H476 WeakPolarHBondContact O-CB 3.27Å; M473-H476 PolarHBondContact O-N 2.77Å; K474-H476 VanDerWaalsContact C-N 3.31Å; K474-H476 PolarHBondContact O-N 2.83Å; H476-H478 VanDerWaalsContact C-N 3.33Å; H476-H478 PolarHBondContact O-N 3.42Å; H476-K479 CarbonylContact O-C 3.57Å; H476-K479 WeakPolarHBondContact O-CA 3.2Å; H476-K479 PolarHBondContact O-N 3.02Å; H476-A480 PolarHBondContact O-N 3.25Å
477	M	74.9	Confident	68.2	Low	143 Å²	143	104.8 Å²	104.8	70%	0.704	57%	0.572	S	S	*	*	H	α-helix	trans	-58.7	-44	177.8	-63.9	-177.8	75.6	0	0	111.7	M473 K474 K479 A480	M473-M477 PolarHBondContact O-N 3.43Å; K474-M477 PolarHBondContact O-N 2.96Å; M477-K479 PolarHBondContact O-N 2.74Å; M477-K479 VanDerWaalsContact O-N 3.12Å; M477-A480 PolarHBondContact O-N 3.46Å
478	H	62.8	Low	66.4	Low	156 Å²	156	109.5 Å²	109.5	72%	0.722	59%	0.594	S	S	*	*	H	α-helix	trans	-68.3	-5.2	174.2	-64.3	-68.4	0	0	0	114.4	K474 H476	K474-H478 PolarHBondContact O-CD2 3.49Å; K474-H478 PolarHBondContact O-N 3.14Å; H476-H478 VanDerWaalsContact C-N 3.33Å; H476-H478 PolarHBondContact O-N 3.42Å
479	K	53.4	Low	64.5	Low	171 Å²	171	112.7 Å²	112.7	74%	0.743	62%	0.615	S	S	*	*	H	α-helix	trans	-110.4	-20.7	176.6	-164.1	57.8	174.3	172.5	0	113.6	H476 M477	H476-K479 CarbonylContact O-C 3.57Å; H476-K479 WeakPolarHBondContact O-CA 3.2Å; H476-K479 PolarHBondContact O-N 3.02Å; M477-K479 PolarHBondContact O-N 2.74Å; M477-K479 VanDerWaalsContact O-N 3.12Å
480	A	46.7	Very low	62.5	Low	71 Å²	71	114.5 Å²	114.5	59%	0.587	64%	0.641	S	S	*	*	H	α-helix	trans	-75.6	-21.2	-175.6	0	0	0	0	0	114.7	H476 M477 S482	H476-A480 PolarHBondContact O-N 3.25Å; M477-A480 PolarHBondContact O-N 3.46Å; A480-S482 PolarHBondContact O-N 2.89Å
481	G	43.8	Very low	60.5	Low	75 Å²	75	117.8 Å²	117.8	77%	0.773	66%	0.663	S	S	*	*	T	Hydrogen-bonded Turn	trans	-67.7	6.4	-175.4	0	0	0	0	0	116.9
482	S	48.3	Very low	58.2	Low	100 Å²	100	116.7 Å²	116.7	70%	0.699	68%	0.678	S	S	*	*	T	Hydrogen-bonded Turn	trans	-100.8	8.8	-173.2	-168.4	0	0	0	0	114.6	A480	A480-S482 PolarHBondContact O-N 2.89Å
483	L	52.1	Low	55.9	Low	168 Å²	168	120 Å²	120	88%	0.88	71%	0.711	S	S	*	*			trans	-132.6	34.5	-175.9	-68.9	176.9	0	0	0	114.2
484	A	44.9	Very low	53.8	Low	99 Å²	99	121.3 Å²	121.3	82%	0.818	73%	0.733	S	S	*	*			trans	-83.2	147.5	144.4	0	0	0	0	0	107.6
485	G	41.9	Very low	51.5	Low	68 Å²	68	120 Å²	120	70%	0.701	74%	0.741	S	S	*	*			cis	156.1	110.9	5.4	0	0	0	0	0	105
486	R	39.2	Very low	49.8	Very low	257 Å²	257	121.3 Å²	121.3	97%	0.97	75%	0.754	S	S	*	*			trans	-92	121.4	-158.8	-64.1	175.4	176.9	175.3	-3.6	112.8
487	S	48.8	Very low	48.4	Very low	98 Å²	98	124.9 Å²	124.9	69%	0.685	78%	0.78	S	S	*	*			trans	-154.9	118.3	149.4	36.9	0	0	0	0	105.1
488	D	49.8	Very low	47	Very low	141 Å²	141	126.7 Å²	126.7	75%	0.754	79%	0.787	S	S	*	*				77.8	150.8	56.4	101.1	-94	0	0	0	112.8
489	D	49	Very low	46.2	Very low	162 Å²	162	125.1 Å²	125.1	87%	0.866	79%	0.791	S	S	*	*			trans	58.9	141	-145	-63.1	-41	0	0	0	115.3
490	G	47.4	Very low	45.6	Very low	66 Å²	66	120.1 Å²	120.1	68%	0.68	79%	0.787	S	S	*	*			cis	177.5	169.3	-7.8	0	0	0	0	0	112.5
491	L	47	Very low	45.1	Very low	179 Å²	179	123.1 Å²	123.1	94%	0.937	80%	0.799	S	S	*	*			trans	70.6	92.3	168.6	-50.8	-178	0	0	0	119.2
492	S	39.9	Very low	45.3	Very low	128 Å²	128	124.6 Å²	124.6	90%	0.895	80%	0.797	S	S	*	*			trans	-95.9	140.7	157.8	-55.6	0	0	0	0	111.3
493	A	40.7	Very low	44.8	Very low	104 Å²	104	127.3 Å²	127.3	86%	0.86	80%	0.799	S	S	*	*			trans	-158.1	116.8	156	0	0	0	0	0	112.6
494	A	42.8	Very low	44.4	Very low	93 Å²	93	126.4 Å²	126.4	77%	0.769	79%	0.794	S	S	*	*			trans	-62.5	158.5	176.2	0	0	0	0	0	112.9
495	S	41.3	Very low	44.3	Very low	107 Å²	107	127.8 Å²	127.8	75%	0.748	80%	0.795	S	S	*	*				-177.6	135	69.6	-60.5	0	0	0	0	114.5
496	S	48.5	Very low	44.4	Very low	121 Å²	121	128.2 Å²	128.2	85%	0.846	80%	0.799	S	S	*	*			trans	47.2	156.5	140.9	-62.3	0	0	0	0	124.2
497	P	52.8	Low	44.5	Very low	115 Å²	115	123 Å²	123	75%	0.747	79%	0.79	S	S	*	*			trans	-108.6	174.9	-170.6	43.1	-34.9	0	0	0	114.3
498	E	46.6	Very low	44.5	Very low	182 Å²	182	126.1 Å²	126.1	85%	0.85	80%	0.799	S	S	*	*				-174.1	157.9	109.3	-87.4	-143.8	104.1	0	0	111.2
499	P	44.6	Very low	44.1	Very low	123 Å²	123	128.1 Å²	128.1	80%	0.799	80%	0.801	S	S	*	*			trans	-97.3	152.3	-174.8	37	-34	0	0	0	114.2
500	G	40.9	Very low	43.7	Very low	65 Å²	65	125.1 Å²	125.1	67%	0.67	80%	0.798	S	S	*	*			trans	-170.8	95.7	175.1	0	0	0	0	0	117.6
501	T	37.6	Very low	43.7	Very low	134 Å²	134	126.8 Å²	126.8	82%	0.822	81%	0.806	S	S	*	*			trans	54.9	151	140.9	58.3	0	0	0	0	123.2
502	S	46.5	Very low	43.6	Very low	106 Å²	106	126.7 Å²	126.7	74%	0.741	81%	0.806	S	S	*	*			trans	72	151.1	154.5	69.3	0	0	0	0	119.5
503	E	38.1	Very low	43.8	Very low	157 Å²	157	124.3 Å²	124.3	73%	0.734	80%	0.802	S	S	*	*			cis	-161.8	141.8	-22.9	-104.1	-67	68.2	0	0	108.4
504	L	43.4	Very low	44	Very low	150 Å²	150	126.1 Å²	126.1	79%	0.785	80%	0.797	S	S	*	*			trans	65.9	162.9	154.9	-62.5	174.5	0	0	0	121
505	P	44	Very low	43.7	Very low	128 Å²	128	130.9 Å²	130.9	83%	0.831	80%	0.801	S	S	*	*			trans	-118.5	175.7	-154.5	43.1	-33.3	0	0	0	116.4
506	G	43	Very low	43.8	Very low	77 Å²	77	136.7 Å²	136.7	79%	0.794	81%	0.806	S	S	*	*			trans	-148.1	132.1	170.4	0	0	0	0	0	113.3
507	D	42.5	Very low	43.4	Very low	146 Å²	146	140.1 Å²	140.1	78%	0.781	81%	0.809	S	S	*	*			trans	-77.7	142.2	-177.2	-141.2	-71.2	0	0	0	112.7
508	L	47	Very low	42.8	Very low	165 Å²	165	142.2 Å²	142.2	86%	0.864	81%	0.808	S	S	*	*			trans	-168.5	91.8	132.1	-126.7	75.6	0	0	0	114.9
509	K	42.5	Very low	42.4	Very low	182 Å²	182	141.3 Å²	141.3	79%	0.791	80%	0.804	S	S	*	*				48.6	98.2	127.6	-165.9	171	179.4	174.6	0	121.6
510	A	41.4	Very low	42.3	Very low	99 Å²	99	139.9 Å²	139.9	82%	0.818	80%	0.797	S	S	*	*				65.7	115.3	129.2	0	0	0	0	0	123.1
511	A	46.9	Very low	42.3	Very low	102 Å²	102	144 Å²	144	84%	0.843	80%	0.803	S	S	*	*				-158.3	148	126.4	0	0	0	0	0	110.5
512	D	44.4	Very low	42.9	Very low	177 Å²	177	143.3 Å²	143.3	95%	0.947	80%	0.801	S	S	*	*			trans	-68.4	147	174.9	-96.6	-111.5	0	0	0	112.6
513	G	43.6	Very low	42.6	Very low	78 Å²	78	143.8 Å²	143.8	80%	0.804	81%	0.805	S	S	*	*			trans	177.8	72.5	179.5	0	0	0	0	0	115.3	F515	G513-F515 PolarHBondContact O-N 2.84Å
514	D	45.8	Very low	42.9	Very low	141 Å²	141	144.1 Å²	144.1	75%	0.754	81%	0.811	S	S	*	*			trans	-73.3	118.8	170.5	-172.3	-66.9	0	0	0	111
515	F	37	Very low	42.9	Very low	194 Å²	194	139.9 Å²	139.9	85%	0.851	80%	0.803	S	S	*	*				-163	156.9	128.1	-130.5	-109.9	0	0	0	113.4	G513	G513-F515 PolarHBondContact O-N 2.84Å
516	R	42.2	Very low	42.9	Very low	229 Å²	229	140 Å²	140	86%	0.864	80%	0.804	S	S	*	*			trans	-85.9	146.6	-173.9	-66.4	171.3	62	158.9	0.7	112.7
517	H	40.6	Very low	43.1	Very low	192 Å²	192	144.8 Å²	144.8	89%	0.889	81%	0.805	S	S	*	*			trans	-80.6	172.6	178.2	-143.7	-106.5	0	0	0	113.5
518	H	40	Very low	43.5	Very low	160 Å²	160	143.3 Å²	143.3	74%	0.741	80%	0.804	S	S	*	*			trans	-78.1	-169.5	-164.1	-153.3	-109.3	0	0	0	115.3
519	E	38.8	Very low	43.4	Very low	162 Å²	162	144 Å²	144	76%	0.757	80%	0.803	S	S	*	*			trans	95	129.2	170.9	-55.5	-81.3	49.3	0	0	117.3
520	S	41.2	Very low	43.4	Very low	93 Å²	93	141.4 Å²	141.4	65%	0.65	80%	0.797	S	S	*	*			cis	-162.6	137.3	-37	20.3	0	0	0	0	109
521	D	41.2	Very low	44	Very low	151 Å²	151	143.1 Å²	143.1	81%	0.807	79%	0.793	S	S	*	*			trans	-134.3	115.8	-170.7	-171.2	-5.2	0	0	0	112.5	S523	D521-S523 PolarHBondContact O-N 3.44Å
522	P	50.5	Low	44.4	Very low	120 Å²	120	144 Å²	144	78%	0.779	78%	0.78	S	S	*	*			trans	-85.4	102.3	177.7	-4.9	23.8	0	0	0	112.6
523	S	41	Very low	44.9	Very low	116 Å²	116	142.8 Å²	142.8	81%	0.811	77%	0.773	S	S	*	*	P	Polyproline II helix	trans	-58.8	137.6	175.3	-177.2	0	0	0	0	113.1	D521	D521-S523 PolarHBondContact O-N 3.44Å
524	L	44.2	Very low	45.6	Very low	165 Å²	165	146.6 Å²	146.6	86%	0.864	77%	0.77	S	S	*	*	P	Polyproline II helix	trans	-63.3	139.7	168.6	-68	166.7	0	0	0	111.2
525	G	42.2	Very low	46.1	Very low	60 Å²	60	143.9 Å²	143.9	62%	0.619	75%	0.753	S	S	*	*	P	Polyproline II helix	trans	-89	164.4	163.7	0	0	0	0	0	111.8
526	P	45	Very low	47.1	Very low	132 Å²	132	142.2 Å²	142.2	86%	0.857	75%	0.748	S	S	*	*	P	Polyproline II helix	trans	-74.9	131	174.5	30.9	-33	0	0	0	111.2
527	E	47.2	Very low	47.9	Very low	176 Å²	176	138.1 Å²	138.1	82%	0.822	74%	0.738	S	S	*	*	P	Polyproline II helix	trans	-70	144.7	163.9	-61.4	-94.2	73.3	0	0	108.9
528	P	50.4	Low	48.8	Very low	116 Å²	116	134.3 Å²	134.3	75%	0.753	72%	0.721	S	S	*	*	P	Polyproline II helix	trans	-67.3	151.2	175.4	28.8	-34.4	0	0	0	111.9
529	E	45.1	Very low	49.6	Very low	180 Å²	180	130.5 Å²	130.5	84%	0.841	70%	0.704	S	S	*	*	P	Polyproline II helix	trans	-80.9	161.4	-177.3	-56.6	-174.4	102.7	0	0	111.6	D531	E529-D531 PolarHBondContact O-N 3.36Å
530	D	43.3	Very low	50.6	Low	126 Å²	126	126.7 Å²	126.7	67%	0.674	69%	0.686	S	S	*	*			trans	-78.4	108.4	-162.8	-46.6	-79.8	0	0	0	114.4	E532	D530-E532 HydrophobicContact CB-CG 4.45Å; D530-E532 PolarHBondContact O-N 3.14Å; D530-E532 VanDerWaalsContact O-N 3.13Å
531	D	53.6	Low	51.6	Low	136 Å²	136	127.4 Å²	127.4	73%	0.727	68%	0.681	S	S	*	*			trans	-77.9	27.3	169.2	-58.6	-57.6	0	0	0	113.3	E529 D533	E529-D531 PolarHBondContact O-N 3.36Å; D531-D533 VanDerWaalsContact C-N 3.28Å; D531-D533 PolarHBondContact O-N 3.47Å
532	E	55.5	Low	52.8	Low	120 Å²	120	125.6 Å²	125.6	56%	0.561	67%	0.671	S	S	*	*	H	α-helix	trans	-70.7	-14.2	-173.2	-74.5	-166.7	135.8	0	0	114.2	R471 D530	R471-E532 IonicContact NH2-OE1 3.28Å; R471-E532 PolarHBondContact NH2-OE1 3.03Å; D530-E532 HydrophobicContact CB-CG 4.45Å; D530-E532 PolarHBondContact O-N 3.14Å; D530-E532 VanDerWaalsContact O-N 3.13Å
533	D	54	Low	53.3	Low	151 Å²	151	123.6 Å²	123.6	81%	0.807	65%	0.654	S	S	*	*	H	α-helix	trans	-80	-27.7	-176.5	-76.7	-36.6	0	0	0	113.9	D531	D531-D533 VanDerWaalsContact C-N 3.28Å; D531-D533 PolarHBondContact O-N 3.47Å
534	E	58.7	Low	54	Low	158 Å²	158	124.8 Å²	124.8	74%	0.738	65%	0.646	S	S	*	*	H	α-helix	trans	-85.5	-30	-177.7	-67.6	-169	145.4	0	0	113	E536 E537	E534-E536 VanDerWaalsContact C-N 3.32Å; E534-E536 PolarHBondContact O-N 3.48Å; E534-E537 PolarHBondContact O-N 3.45Å
535	E	57.5	Low	54.3	Low	84 Å²	84	123.1 Å²	123.1	39%	0.393	64%	0.639	S	S	.	*	H	α-helix	trans	-67.8	-26.4	-178.8	-62.6	-161.7	159	0	0	113.4	K470 E538 E539	K470-E535 IonicContact NZ-OE1 2.61Å; K470-E535 PolarHBondContact NZ-OE1 2.99Å; K470-E535 IonicContact NZ-OE2 2.66Å; K470-E535 PolarHBondContact NZ-OE2 3.07Å; E535-E538 WeakPolarHBondContact O-CG 3.27Å; E535-E539 PolarHBondContact O-N 3.46Å; E535-E539 VanDerWaalsContact O-N 3.17Å
536	E	56.6	Low	54.9	Low	159 Å²	159	128.2 Å²	128.2	74%	0.743	65%	0.646	S	S	*	*	H	α-helix	trans	-74.1	-29.7	176.2	-70.5	-159.5	150.3	0	0	112.5	E534 E540	E534-E536 VanDerWaalsContact C-N 3.32Å; E534-E536 PolarHBondContact O-N 3.48Å; E536-E540 WeakPolarHBondContact O-CB 3.47Å; E536-E540 PolarHBondContact O-N 3.17Å; E536-E540 VanDerWaalsContact O-N 3.11Å
537	E	58.5	Low	54.7	Low	144 Å²	144	126 Å²	126	67%	0.673	63%	0.634	S	S	*	*	H	α-helix	trans	-71	-37.3	175.9	-67.3	-164.7	169.1	0	0	111.8	E534 E540 L541	E534-E537 PolarHBondContact O-N 3.45Å; E537-E540 PolarHBondContact O-N 3.01Å; E537-L541 WeakPolarHBondContact O-CB 3.49Å; E537-L541 WeakPolarHBondContact O-CG 3.46Å; E537-L541 PolarHBondContact O-N 3.09Å
538	E	59.4	Low	54.4	Low	112 Å²	112	128.3 Å²	128.3	52%	0.523	64%	0.635	S	S	.	*	H	α-helix	trans	-74.8	-34.6	175.1	60.1	169.9	-172	0	0	113.7	E535 E540 L542	E535-E538 WeakPolarHBondContact O-CG 3.27Å; E538-E540 VanDerWaalsContact C-N 3.31Å; E538-E540 PolarHBondContact O-N 3.13Å; E538-L542 WeakPolarHBondContact O-CB 3.32Å; E538-L542 VanDerWaalsContact O-CG 3.31Å; E538-L542 WeakPolarHBondContact O-CG 3.29Å; E538-L542 PolarHBondContact O-N 3.31Å
539	E	58.4	Low	53.9	Low	80 Å²	80	128 Å²	128	37%	0.374	63%	0.633	S	S	.	*	H	α-helix	trans	-63.3	-35.5	169.8	-80.4	-160.4	-164.6	0	0	111.4	E535 L543	E535-E539 PolarHBondContact O-N 3.46Å; E535-E539 VanDerWaalsContact O-N 3.17Å; E539-L543 WeakPolarHBondContact O-CD1 3.48Å; E539-L543 VanDerWaalsContact O-CG 3.27Å; E539-L543 WeakPolarHBondContact O-CG 3.43Å; E539-L543 PolarHBondContact O-N 3.18Å
540	E	59.7	Low	53.2	Low	82 Å²	82	128.7 Å²	128.7	38%	0.383	64%	0.636	S	S	.	*	H	α-helix	trans	-73	-42.7	177.3	-165.9	147.8	-111.2	0	0	112.3	E536 E537 E538 L542 L543 E544	E536-E540 WeakPolarHBondContact O-CB 3.47Å; E536-E540 PolarHBondContact O-N 3.17Å; E536-E540 VanDerWaalsContact O-N 3.11Å; E537-E540 PolarHBondContact O-N 3.01Å; E538-E540 VanDerWaalsContact C-N 3.31Å; E538-E540 PolarHBondContact O-N 3.13Å; E540-L542 VanDerWaalsContact C-N 3.34Å; E540-L542 PolarHBondContact O-N 2.86Å; E540-L543 PolarHBondContact O-N 3.38Å; E540-E544 PolarHBondContact O-N 3.2Å
541	L	62.3	Low	52.7	Low	107 Å²	107	128.1 Å²	128.1	56%	0.56	64%	0.642	S	S	*	*	H	α-helix	trans	-62.9	-34.2	174.9	-75.2	169.7	0	0	0	113.7	E537 N545	E537-L541 WeakPolarHBondContact O-CB 3.49Å; E537-L541 WeakPolarHBondContact O-CG 3.46Å; E537-L541 PolarHBondContact O-N 3.09Å; L541-N545 PolarHBondContact O-N 3.42Å; L541-N545 PolarHBondContact O-ND2 3.37Å
542	L	65.2	Low	51.9	Low	113 Å²	113	126.8 Å²	126.8	59%	0.592	64%	0.644	S	S	*	*	H	α-helix	trans	-67.7	-43.6	174.1	-76.7	166.8	0	0	0	111.3	E538 E540 E544 N545 E546	E538-L542 WeakPolarHBondContact O-CB 3.32Å; E538-L542 VanDerWaalsContact O-CG 3.31Å; E538-L542 WeakPolarHBondContact O-CG 3.29Å; E538-L542 PolarHBondContact O-N 3.31Å; E540-L542 VanDerWaalsContact C-N 3.34Å; E540-L542 PolarHBondContact O-N 2.86Å; L542-E544 PolarHBondContact O-N 3Å; L542-N545 PolarHBondContact O-N 3.29Å; L542-E546 PolarHBondContact O-N 2.93Å
543	L	61	Low	50.8	Low	79 Å²	79	130.4 Å²	130.4	41%	0.414	66%	0.658	S	S	.	*	H	α-helix	trans	-68.9	-31.9	-179.8	-70.7	170.6	0	0	0	113.2	E539 E540 S547	E539-L543 WeakPolarHBondContact O-CD1 3.48Å; E539-L543 VanDerWaalsContact O-CG 3.27Å; E539-L543 WeakPolarHBondContact O-CG 3.43Å; E539-L543 PolarHBondContact O-N 3.18Å; E540-L543 PolarHBondContact O-N 3.38Å; L543-S547 WeakPolarHBondContact O-CB 3.44Å; L543-S547 PolarHBondContact O-N 2.96Å; L543-S547 PolarHBondContact O-OG 3.36Å
544	E	56.9	Low	49.9	Very low	140 Å²	140	128.2 Å²	128.2	65%	0.654	65%	0.654	S	S	*	*	H	α-helix	trans	-67.8	-34.8	173	-87.2	-174.2	14.9	0	0	112.8	E540 L542 S547	E540-E544 PolarHBondContact O-N 3.2Å; L542-E544 PolarHBondContact O-N 3Å; E544-S547 PolarHBondContact O-N 3.03Å
545	N	51	Low	49	Very low	131 Å²	131	128.3 Å²	128.3	70%	0.701	66%	0.656	S	S	*	*	H	α-helix	trans	-71	-31.9	177.6	-77	-50	0	0	0	113.7	L541 L542 S547	L541-N545 PolarHBondContact O-N 3.42Å; L541-N545 PolarHBondContact O-ND2 3.37Å; L542-N545 PolarHBondContact O-N 3.29Å; N545-S547 VanDerWaalsContact C-N 3.32Å
546	E	53.5	Low	48.1	Very low	167 Å²	167	130.9 Å²	130.9	78%	0.78	67%	0.673	S	S	*	*	H	α-helix	trans	-79	-13.4	173.4	-65.6	-166.1	107.3	0	0	113.2	L542 R548	L542-E546 PolarHBondContact O-N 2.93Å; E546-R548 VanDerWaalsContact C-N 3.33Å; E546-R548 PolarHBondContact O-N 3.28Å
547	S	42	Very low	47.3	Very low	86 Å²	86	127.8 Å²	127.8	60%	0.601	67%	0.669	S	S	*	*			trans	-90.5	27.5	-172.5	-65.8	0	0	0	0	114.8	L543 E544 N545 P549	L543-S547 WeakPolarHBondContact O-CB 3.44Å; L543-S547 PolarHBondContact O-N 2.96Å; L543-S547 PolarHBondContact O-OG 3.36Å; E544-S547 PolarHBondContact O-N 3.03Å; N545-S547 VanDerWaalsContact C-N 3.32Å; S547-P549 WeakPolarHBondContact O-CD 3.43Å
548	R	39.4	Very low	46.6	Very low	224 Å²	224	130 Å²	130	85%	0.845	68%	0.679	S	S	*	*			trans	-104.5	87.9	-175.6	-173.7	-179.5	171.8	173.4	-2.1	113.4	E546	E546-R548 VanDerWaalsContact C-N 3.33Å; E546-R548 PolarHBondContact O-N 3.28Å
549	P	41.1	Very low	45.6	Very low	108 Å²	108	132.7 Å²	132.7	70%	0.701	70%	0.696	S	S	*	*			trans	-72	152.9	165.8	32.3	-35.3	0	0	0	111.4	S547 S551	S547-P549 WeakPolarHBondContact O-CD 3.43Å; P549-S551 PolarHBondContact O-N 3.02Å
550	E	30.7	Very low	44.8	Very low	195 Å²	195	132.6 Å²	132.6	91%	0.911	72%	0.717	S	S	*	*			trans	-79.6	114.4	178.9	-60	177.2	89.5	0	0	111.7
551	S	32.7	Very low	44	Very low	114 Å²	114	141 Å²	141	80%	0.797	75%	0.745	S	S	*	*			trans	178	168.3	153.2	39.1	0	0	0	0	114.1	P549	P549-S551 PolarHBondContact O-N 3.02Å
552	S	37.1	Very low	43	Very low	109 Å²	109	139.3 Å²	139.3	76%	0.762	75%	0.754	S	S	*	*			trans	81.5	110.7	163.9	-149.5	0	0	0	0	119.1
553	F	32.2	Very low	41.7	Very low	196 Å²	196	143.9 Å²	143.9	86%	0.86	76%	0.763	S	S	*	*			trans	-94.1	171.3	179.4	-30.5	-95.3	0	0	0	111.2
554	S	34.8	Very low	40.6	Very low	104 Å²	104	146.2 Å²	146.2	73%	0.727	77%	0.772	S	S	*	*			trans	98.6	137.8	146.9	-151.2	0	0	0	0	120.8
555	M	38.7	Very low	39.7	Very low	160 Å²	160	147.2 Å²	147.2	79%	0.788	78%	0.782	S	S	*	*			trans	60.8	147	172.3	-94.8	56.1	141	0	0	117.3
556	D	38.7	Very low	38.9	Very low	139 Å²	139	144.8 Å²	144.8	74%	0.743	79%	0.788	S	S	*	*			cis	-138.8	-179.5	22.1	-136.4	-62.6	0	0	0	115.9
557	S	39.4	Very low	38	Very low	94 Å²	94	141 Å²	141	66%	0.657	79%	0.794	S	S	*	*			trans	-72.2	160	-178.3	-35.8	0	0	0	0	113.7
558	E	45.2	Very low	37.7	Very low	189 Å²	189	140.4 Å²	140.4	88%	0.883	80%	0.801	S	S	*	*			trans	-152.1	150.1	141.3	-90.9	-120.4	88.7	0	0	112.2
559	L	38.4	Very low	37.8	Very low	169 Å²	169	136.5 Å²	136.5	89%	0.885	80%	0.802	S	S	*	*			trans	-76.7	145.9	-160	-59.1	158.1	0	0	0	115.2
560	G	42.1	Very low	37.8	Very low	79 Å²	79	136.9 Å²	136.9	81%	0.814	80%	0.804	S	S	*	*			trans	-163.1	112.6	173.7	0	0	0	0	0	116.6
561	R	42.1	Very low	38.6	Very low	257 Å²	257	133.8 Å²	133.8	97%	0.97	80%	0.801	S	S	*	*			trans	-49	150.9	177.9	-46.1	167.1	-164.5	-81.8	-2.4	113.9
562	G	40.6	Very low	38.9	Very low	72 Å²	72	131.5 Å²	131.5	74%	0.742	80%	0.796	S	S	*	*			cis	157.4	174.9	-1.7	0	0	0	0	0	112.9
563	R	37.7	Very low	39.2	Very low	210 Å²	210	133.6 Å²	133.6	79%	0.792	80%	0.804	S	S	*	*			trans	60.2	100.8	170.3	-68.5	-164.9	86.8	167.1	-2.6	120.7
564	E	39.2	Very low	39.5	Very low	128 Å²	128	129 Å²	129	60%	0.598	80%	0.802	S	S	*	*				64.3	132.2	123.5	85.6	-159.8	39.7	0	0	124.8
565	N	36.6	Very low	39.7	Very low	160 Å²	160	127.7 Å²	127.7	86%	0.856	81%	0.805	S	S	*	*			trans	62.9	128.8	146.7	-66.3	-24.2	0	0	0	122.5
566	G	35.2	Very low	39.8	Very low	80 Å²	80	125.4 Å²	125.4	83%	0.825	81%	0.811	S	S	*	*			trans	130.1	84.4	140.9	0	0	0	0	0	116
567	G	33.7	Very low	39.7	Very low	88 Å²	88	122.3 Å²	122.3	91%	0.907	81%	0.812	S	S	*	*			trans	-65.8	171.5	-171.1	0	0	0	0	0	118.3
568	G	36.3	Very low	39.6	Very low	74 Å²	74	123 Å²	123	76%	0.763	82%	0.824	S	S	*	*			trans	179.9	89.3	179.4	0	0	0	0	0	116.5
569	V	41.1	Very low	39.1	Very low	142 Å²	142	118.4 Å²	118.4	86%	0.861	82%	0.818	S	S	*	*			trans	43.8	117.8	142.4	-171	0	0	0	0	121.2
570	P	41	Very low	39	Very low	115 Å²	115	114.8 Å²	114.8	75%	0.747	81%	0.813	S	S	*	*			trans	-105	-171	153.1	40.2	-31.5	0	0	0	111.7
571	P	48.6	Very low	38.8	Very low	130 Å²	130	115.9 Å²	115.9	84%	0.844	81%	0.814	S	S	*	*			cis	-126.8	-172.2	-49.9	38.2	-22.5	0	0	0	112.1
572	G	38.8	Very low	38.5	Very low	67 Å²	67	107.7 Å²	107.7	69%	0.691	80%	0.801	S	S	*	*			trans	175.8	151.2	162.8	0	0	0	0	0	119.8
573	V	42.3	Very low	38.5	Very low	152 Å²	152	112.1 Å²	112.1	92%	0.921	81%	0.807	S	S	*	*			trans	62.4	146.5	159.1	-50.6	0	0	0	0	120.8
574	A	39.3	Very low	38.5	Very low	101 Å²	101	106.4 Å²	106.4	84%	0.835	80%	0.804	S	S	*	*			cis	-169.2	163.1	-23.8	0	0	0	0	0	112.1
575	G	39.3	Very low	38.7	Very low	75 Å²	75	107.7 Å²	107.7	77%	0.773	82%	0.815	S	S	*	*			trans	99.3	118.1	169	0	0	0	0	0	114.8
576	A	40.2	Very low	39.1	Very low	113 Å²	113	106.1 Å²	106.1	93%	0.934	80%	0.803	S	S	*	*			cis	93.9	128.8	35	0	0	0	0	0	114
577	G	36.9	Very low	39.4	Very low	73 Å²	73	110 Å²	110	75%	0.753	80%	0.797	S	S	*	*			cis	167.6	166.5	-10.1	0	0	0	0	0	114.1
578	A	36.4	Very low	39.7	Very low	109 Å²	109	109.9 Å²	109.9	90%	0.901	79%	0.787	S	S	*	*			trans	59	156.6	158.7	0	0	0	0	0	121.4
579	A	35.6	Very low	39.8	Very low	92 Å²	92	114.3 Å²	114.3	76%	0.76	79%	0.793	S	S	*	*			cis	-169.8	156.1	-27	0	0	0	0	0	112.8
580	A	35.9	Very low	39.9	Very low	94 Å²	94	111.6 Å²	111.6	78%	0.777	79%	0.785	S	S	*	*			trans	60.8	135.9	143.7	0	0	0	0	0	125
581	A	37.9	Very low	39.8	Very low	102 Å²	102	114.1 Å²	114.1	84%	0.843	79%	0.791	S	S	*	*			trans	67.5	158.9	139.9	0	0	0	0	0	121.2
582	A	35.5	Very low	39.7	Very low	84 Å²	84	110.9 Å²	110.9	69%	0.694	78%	0.782	S	S	*	*			cis	-170.9	167.1	-31.2	0	0	0	0	0	110.9
583	L	40.4	Very low	40	Very low	166 Å²	166	117.1 Å²	117.1	87%	0.869	79%	0.79	S	S	*	*			trans	66.2	116.2	155.9	-68.8	168.1	0	0	0	121.9
584	A	38.9	Very low	40	Very low	89 Å²	89	114.9 Å²	114.9	74%	0.736	78%	0.777	S	S	*	*				76.7	114.5	114.2	0	0	0	0	0	123.6
585	D	43.2	Very low	40.2	Very low	155 Å²	155	116.7 Å²	116.7	83%	0.829	77%	0.77	S	S	*	*				108.6	149.6	116	-147.3	-156.4	0	0	0	123.8
586	E	45.1	Very low	40.2	Very low	128 Å²	128	120.2 Å²	120.2	60%	0.598	77%	0.766	S	S	*	*			trans	53.8	124.5	165.3	-78.9	-149.2	163	0	0	127.5
587	K	41	Very low	40.2	Very low	160 Å²	160	122.2 Å²	122.2	70%	0.696	76%	0.761	S	S	*	*			trans	60.7	106	132.8	-71.7	-173.6	-169.8	133.2	0	123.8
588	A	40.4	Very low	40.2	Very low	86 Å²	86	122.9 Å²	122.9	71%	0.711	76%	0.759	S	S	*	*				66.6	130.4	107	0	0	0	0	0	122.6
589	L	39.1	Very low	39.9	Very low	168 Å²	168	121.1 Å²	121.1	88%	0.88	75%	0.752	S	S	*	*				-177.2	145	106.4	-97.1	163.5	0	0	0	113.6
590	A	41.3	Very low	39.9	Very low	85 Å²	85	125.5 Å²	125.5	70%	0.702	76%	0.761	S	S	*	*			trans	32	141.3	144.8	0	0	0	0	0	121.5
591	L	40.8	Very low	39.6	Very low	167 Å²	167	124.7 Å²	124.7	87%	0.874	76%	0.762	S	S	*	*			cis	-169.2	164.2	-0.4	-155.8	62	0	0	0	107.3
592	G	44.6	Very low	39.5	Very low	63 Å²	63	124.7 Å²	124.7	65%	0.649	76%	0.762	S	S	*	*			cis	135	157.2	-6.4	0	0	0	0	0	113.1
593	K	45.9	Very low	39.4	Very low	198 Å²	198	128.6 Å²	128.6	86%	0.861	77%	0.771	S	S	*	*			trans	80.4	143.3	173.4	-79.1	-176.1	173.7	-178.8	0	119.3
594	V	42.1	Very low	39.2	Very low	105 Å²	105	125.5 Å²	125.5	64%	0.636	76%	0.761	S	S	*	*			cis	-146.2	156.3	3.3	-141.2	0	0	0	0	112.3
595	M	42.9	Very low	39.1	Very low	139 Å²	139	129.2 Å²	129.2	69%	0.685	76%	0.763	S	S	*	*			trans	63.2	115.8	152.9	-120.7	65	87.1	0	0	118.1
596	E	40.1	Very low	38.4	Very low	149 Å²	149	132.9 Å²	132.9	70%	0.696	77%	0.766	S	S	*	*			cis	71.7	134	43.2	-51.5	147.2	74.2	0	0	111.8
597	D	40.4	Very low	38	Very low	155 Å²	155	130.4 Å²	130.4	83%	0.829	78%	0.775	S	S	*	*			cis	-166.5	170	-2	-128.9	-129.8	0	0	0	108.2
598	A	36.3	Very low	37.7	Very low	87 Å²	87	130.1 Å²	130.1	72%	0.719	78%	0.776	S	S	*	*			cis	-160.7	155.8	-41.3	0	0	0	0	0	107.6
599	G	30.8	Very low	37.6	Very low	72 Å²	72	133.4 Å²	133.4	74%	0.742	78%	0.775	S	S	*	*			trans	165	69	179.2	0	0	0	0	0	116.4
600	L	35.5	Very low	37.5	Very low	183 Å²	183	137.1 Å²	137.1	96%	0.958	78%	0.777	S	S	*	*			trans	-138.3	145.8	173.9	-69.2	174.2	0	0	0	110.8
601	G	29.6	Very low	37.3	Very low	78 Å²	78	137 Å²	137	80%	0.804	78%	0.783	S	S	*	*			trans	-103.6	161.2	168.8	0	0	0	0	0	111.7
602	A	35.1	Very low	37.2	Very low	102 Å²	102	133.7 Å²	133.7	84%	0.843	78%	0.781	S	S	*	*			trans	-150.4	149.5	179.9	0	0	0	0	0	113.5
603	L	33.2	Very low	36.7	Very low	165 Å²	165	139.2 Å²	139.2	86%	0.864	79%	0.787	S	S	*	*			trans	-91.1	-167.7	155.5	-58.8	171.9	0	0	0	107.3
604	P	36.4	Very low	36.5	Very low	102 Å²	102	137 Å²	137	66%	0.662	78%	0.784	S	S	*	*			cis	-143.8	-170.6	-0.6	44	-23.4	0	0	0	116.5
605	Q	36.6	Very low	36.3	Very low	166 Å²	166	140.5 Å²	140.5	78%	0.776	79%	0.791	S	S	*	*			trans	61.4	126.5	144.3	-76.7	169.6	20.1	0	0	124.9
606	Y	30.3	Very low	35.9	Very low	232 Å²	232	145.7 Å²	145.7	91%	0.91	80%	0.803	S	S	*	*			trans	49.6	136.9	132.7	-78.3	-110.3	0	0	0	123.3
607	G	35.5	Very low	35.7	Very low	76 Å²	76	143.5 Å²	143.5	78%	0.784	81%	0.81	S	S	*	*			trans	167.7	53.6	164	0	0	0	0	0	123.2
608	E	35.1	Very low	35.7	Very low	154 Å²	154	139.9 Å²	139.9	72%	0.72	81%	0.81	S	S	*	*			trans	28	139.9	150.8	-66.5	-152.6	101	0	0	127.6
609	K	38.6	Very low	35.7	Very low	155 Å²	155	142.9 Å²	142.9	67%	0.674	81%	0.813	S	S	*	*			trans	91.7	131.6	131.9	-82.7	163.5	178.3	142.5	0	125
610	R	36.5	Very low	36.3	Very low	247 Å²	247	145.7 Å²	145.7	93%	0.932	82%	0.816	S	S	*	*			trans	71.5	146	157.1	-65.9	172.7	170.4	163	-4.2	119.3
611	G	37	Very low	36.4	Very low	81 Å²	81	140.9 Å²	140.9	84%	0.835	81%	0.811	S	S	*	*			cis	143.3	115.8	-19.1	0	0	0	0	0	117.6
612	A	38.1	Very low	36.8	Very low	99 Å²	99	145.1 Å²	145.1	82%	0.818	82%	0.815	S	S	*	*			trans	-162.3	125.2	163.8	0	0	0	0	0	110.7
613	F	34.6	Very low	37.1	Very low	178 Å²	178	144.6 Å²	144.6	78%	0.781	81%	0.811	S	S	*	*				68.3	113.9	84.9	-135.2	-127.4	0	0	0	114
614	L	41	Very low	37.1	Very low	153 Å²	153	140 Å²	140	80%	0.801	80%	0.804	S	S	*	*				-159.8	173.5	72.2	-103.4	168.2	0	0	0	115.5
615	K	38.2	Very low	37.3	Very low	178 Å²	178	139.8 Å²	139.8	77%	0.774	81%	0.811	S	S	*	*			trans	-103.3	147.9	-172.3	-78.6	161.1	51	175.5	0	115.4
616	R	35.1	Very low	37.2	Very low	248 Å²	248	139.1 Å²	139.1	94%	0.936	82%	0.818	S	S	*	*				-162.9	162.9	112.6	-156	157.1	-68.5	-155.6	0.9	111.2
617	A	36.4	Very low	37.5	Very low	102 Å²	102	131.6 Å²	131.6	84%	0.843	81%	0.81	S	S	*	*			trans	-133.4	165	-174.7	0	0	0	0	0	112.1
618	G	40.4	Very low	37.3	Very low	80 Å²	80	134.7 Å²	134.7	83%	0.825	82%	0.818	S	S	*	*			trans	-167.1	144.7	170.8	0	0	0	0	0	108.5
619	D	36.7	Very low	37.4	Very low	150 Å²	150	130.8 Å²	130.8	80%	0.802	82%	0.819	S	S	*	*			trans	-141.7	175.8	-163.7	-179.1	-137.8	0	0	0	112.5
620	T	41.7	Very low	37.1	Very low	130 Å²	130	131.1 Å²	131.1	80%	0.798	83%	0.828	S	S	*	*			trans	83.8	138.9	169	72.5	0	0	0	0	118.8
621	G	38.9	Very low	36.9	Very low	83 Å²	83	123.7 Å²	123.7	86%	0.856	82%	0.82	S	S	*	*			trans	146.7	103.4	170.8	0	0	0	0	0	113.4
622	D	36.5	Very low	36.8	Very low	166 Å²	166	123.9 Å²	123.9	89%	0.888	82%	0.822	S	S	*	*			trans	-112	172.1	-178	179.7	-130.2	0	0	0	112.9
623	A	41.9	Very low	36.7	Very low	92 Å²	92	123.8 Å²	123.8	76%	0.76	82%	0.821	S	S	*	*			trans	76.2	151.5	177.5	0	0	0	0	0	116.3
624	G	34	Very low	37.1	Very low	69 Å²	69	121.9 Å²	121.9	71%	0.711	83%	0.826	S	S	*	*			cis	159.6	161.6	-3.7	0	0	0	0	0	111.8
625	A	39.3	Very low	36.8	Very low	97 Å²	97	118 Å²	118	80%	0.802	82%	0.823	S	S	*	*			trans	72.3	132.7	-167.8	0	0	0	0	0	114.3
626	V	34.5	Very low	36.7	Very low	152 Å²	152	114.2 Å²	114.2	92%	0.921	83%	0.825	S	S	*	*			cis	81.7	109.5	38.3	-179	0	0	0	0	113.1
627	G	37.3	Very low	37.2	Very low	73 Å²	73	109.5 Å²	109.5	75%	0.753	82%	0.824	S	S	*	*			trans	179.6	140.1	173.1	0	0	0	0	0	111.8
628	C	31.5	Very low	37	Very low	142 Å²	142	112.8 Å²	112.8	96%	0.959	83%	0.827	S	S	*	*			trans	-131.6	163.4	178.9	-60.7	0	0	0	0	110.7
629	G	36.7	Very low	37	Very low	71 Å²	71	112.4 Å²	112.4	73%	0.732	82%	0.823	S	S	*	*			trans	115.4	118.3	-173.1	0	0	0	0	0	109.3
630	D	32	Very low	37	Very low	162 Å²	162	117.6 Å²	117.6	87%	0.866	83%	0.832	S	S	*	*			cis	90.4	142.1	41.6	-169	-129.1	0	0	0	114
631	A	33.5	Very low	36.6	Very low	92 Å²	92	115 Å²	115	76%	0.76	83%	0.831	S	S	*	*			trans	56.3	127.8	178	0	0	0	0	0	118.5
632	G	35.3	Very low	36.4	Very low	85 Å²	85	115 Å²	115	88%	0.876	83%	0.831	S	S	*	*			trans	157.1	90.6	164.6	0	0	0	0	0	117.8
633	A	35.5	Very low	36	Very low	97 Å²	97	110.8 Å²	110.8	80%	0.802	82%	0.819	S	S	*	*			trans	-147.8	166	159.8	0	0	0	0	0	108.4
634	P	42.1	Very low	35.6	Very low	137 Å²	137	116.1 Å²	116.1	89%	0.89	83%	0.825	S	S	*	*			cis	-127.5	-168.2	-5.2	41.8	-25.9	0	0	0	113.2
635	G	34.6	Very low	35.7	Very low	71 Å²	71	117.1 Å²	117.1	73%	0.732	83%	0.826	S	S	*	*			trans	127.8	119.4	166.9	0	0	0	0	0	112.7
636	A	36.5	Very low	35.7	Very low	99 Å²	99	118.8 Å²	118.8	82%	0.818	83%	0.829	S	S	*	*			cis	83.4	99.8	41.9	0	0	0	0	0	115.1
637	V	45.6	Very low	35.6	Very low	150 Å²	150	115 Å²	115	91%	0.909	82%	0.82	S	S	*	*			trans	-156.9	151	149.9	-101.1	0	0	0	0	112.5
638	N	32.7	Very low	35.6	Very low	171 Å²	171	115.8 Å²	115.8	91%	0.914	82%	0.82	S	S	*	*			trans	-80.4	159.8	-165.6	-53.9	-37.9	0	0	0	116.5
639	G	39.4	Very low	35.8	Very low	72 Å²	72	116.7 Å²	116.7	74%	0.742	81%	0.81	S	S	*	*			trans	173	101.1	156.1	0	0	0	0	0	112
640	R	37.2	Very low	35.9	Very low	259 Å²	259	118.6 Å²	118.6	98%	0.977	81%	0.81	S	S	*	*				68.4	120.6	68.8	-168.5	-174.1	-175.7	-158.5	2	112.4
641	G	32.6	Very low	36.1	Very low	76 Å²	76	119.7 Å²	119.7	78%	0.784	81%	0.807	S	S	*	*			cis	163.7	167.8	-6.6	0	0	0	0	0	113.4
642	G	35.5	Very low	36.7	Very low	82 Å²	82	120.8 Å²	120.8	85%	0.845	81%	0.806	S	S	*	*			trans	93.2	159.4	174	0	0	0	0	0	115.4
643	A	28.8	Very low	36.8	Very low	77 Å²	77	120.9 Å²	120.9	64%	0.636	80%	0.799	S	S	*	*			cis	167.8	171.7	-19	0	0	0	0	0	107.6
644	F	32	Very low	37	Very low	205 Å²	205	124.3 Å²	124.3	90%	0.899	80%	0.803	S	S	*	*			trans	79.4	99.9	168.4	-53.6	-73.7	0	0	0	119.5
645	A	37	Very low	36.7	Very low	89 Å²	89	126.4 Å²	126.4	74%	0.736	80%	0.798	S	S	*	*			trans	-90.2	166.2	132.3	0	0	0	0	0	108.2
646	P	39.5	Very low	37	Very low	133 Å²	133	129 Å²	129	86%	0.864	80%	0.802	S	S	*	*				-154.8	-172.6	68.8	42.2	-21.8	0	0	0	116.3
647	G	32.9	Very low	37.1	Very low	71 Å²	71	134.9 Å²	134.9	73%	0.732	80%	0.803	S	S	*	*			trans	127.3	99.9	135.4	0	0	0	0	0	121.9
648	A	36	Very low	36.8	Very low	90 Å²	90	137 Å²	137	74%	0.744	80%	0.8	S	S	*	*			trans	65.4	119	130.7	0	0	0	0	0	124.7
649	E	35.7	Very low	37.1	Very low	162 Å²	162	135 Å²	135	76%	0.757	80%	0.796	S	S	*	*				61.9	157.9	127.5	-58.9	-43.4	101.7	0	0	123.8
650	P	39.2	Very low	37	Very low	111 Å²	111	136 Å²	136	72%	0.721	80%	0.797	S	S	*	*			cis	-135.3	-176.6	-23.7	31.7	-9.7	0	0	0	116.2
651	F	37.5	Very low	37.2	Very low	185 Å²	185	128.8 Å²	128.8	81%	0.811	78%	0.784	S	S	*	*			trans	-48.3	169.6	167.4	-81.8	-78	0	0	0	117.1
652	P	44.5	Very low	37.2	Very low	114 Å²	114	133.2 Å²	133.2	74%	0.74	79%	0.789	S	S	*	*			cis	-155.4	157.2	39.7	42.7	-20.1	0	0	0	123.4
653	A	37.5	Very low	37.2	Very low	87 Å²	87	134.8 Å²	134.8	72%	0.719	78%	0.784	S	S	*	*			trans	64.8	164.5	140.3	0	0	0	0	0	120.6
654	L	40	Very low	37.8	Very low	169 Å²	169	136.5 Å²	136.5	89%	0.885	79%	0.792	S	S	*	*			cis	-134.9	161.4	10.9	-79.9	165.3	0	0	0	113.1
655	F	37	Very low	38.1	Very low	182 Å²	182	132.7 Å²	132.7	80%	0.798	79%	0.787	S	S	*	*			trans	-96.7	165	167.9	-65.7	-99.7	0	0	0	111.5
656	P	40.9	Very low	37.7	Very low	124 Å²	124	131.4 Å²	131.4	81%	0.805	78%	0.783	S	S	*	*				-136.3	129.5	88.5	15.6	6.9	0	0	0	114
657	R	37.4	Very low	37.2	Very low	224 Å²	224	134.1 Å²	134.1	85%	0.845	79%	0.789	S	S	*	*				96.2	129.1	75.9	-73.6	-82.2	160.1	154.4	-2.6	114.2
658	K	39.5	Very low	37.2	Very low	193 Å²	193	134.5 Å²	134.5	84%	0.839	79%	0.794	S	S	*	*			trans	-73.7	168.3	169.9	-63.2	-179.4	177	-179.7	0	111.6
659	P	39.9	Very low	37.3	Very low	130 Å²	130	134 Å²	134	84%	0.844	80%	0.797	S	S	*	*				-131.7	-172	107.7	31.3	-17.5	0	0	0	113.7
660	A	36.7	Very low	37.7	Very low	92 Å²	92	131.9 Å²	131.9	76%	0.76	80%	0.797	S	S	*	*			trans	-126.6	-140.4	-171.2	0	0	0	0	0	113
661	P	40.2	Very low	37.4	Very low	109 Å²	109	131 Å²	131	71%	0.708	80%	0.799	S	S	*	*				-121.9	174.1	-117.8	38.8	-21.6	0	0	0	116.8
662	L	34.5	Very low	37.1	Very low	168 Å²	168	129.1 Å²	129.1	88%	0.88	80%	0.797	S	S	*	*			trans	70.3	162.2	174.6	-50.6	178.6	0	0	0	114.9
663	P	34.1	Very low	36.8	Very low	115 Å²	115	131.8 Å²	131.8	75%	0.747	80%	0.799	S	S	*	*			cis	-122.9	-177.5	-2.4	42.5	-29.3	0	0	0	114.3
664	S	41.1	Very low	37	Very low	114 Å²	114	131.8 Å²	131.8	80%	0.797	80%	0.799	S	S	*	*			trans	-82.1	138	158	-51.8	0	0	0	0	109.9
665	P	38.4	Very low	37	Very low	124 Å²	124	127.7 Å²	127.7	81%	0.805	79%	0.789	S	S	*	*				-127.9	-175.3	83.8	11.1	12.3	0	0	0	111.3
666	G	28.9	Very low	37.7	Very low	63 Å²	63	128.8 Å²	128.8	65%	0.649	79%	0.794	S	S	*	*			cis	127.7	134.2	5.6	0	0	0	0	0	111.2
667	L	29.6	Very low	37.6	Very low	189 Å²	189	133.4 Å²	133.4	99%	0.99	80%	0.795	S	S	*	*			trans	67	147.6	178.2	-61.3	164.7	0	0	0	118
668	G	31.7	Very low	38.1	Very low	80 Å²	80	130.3 Å²	130.3	83%	0.825	79%	0.794	S	S	*	*			trans	108	97	158.2	0	0	0	0	0	116.6
669	G	39.9	Very low	38	Very low	78 Å²	78	129.4 Å²	129.4	80%	0.804	79%	0.79	S	S	*	*			trans	-124.2	137.6	165.3	0	0	0	0	0	111.9
670	P	43	Very low	38.1	Very low	119 Å²	119	129 Å²	129	77%	0.773	79%	0.785	S	S	*	*			trans	-109.2	150.2	159	39.1	-30.2	0	0	0	110
671	A	32.8	Very low	38.2	Very low	92 Å²	92	131.1 Å²	131.1	76%	0.76	78%	0.779	S	S	*	*			cis	65.5	142	46.5	0	0	0	0	0	112
672	L	30.5	Very low	38.3	Very low	146 Å²	146	133.7 Å²	133.7	76%	0.764	78%	0.779	S	S	*	*			cis	-156.3	-171.1	13.7	-163.7	122.4	0	0	0	110.1
673	H	39.8	Very low	38.6	Very low	170 Å²	170	131.4 Å²	131.4	79%	0.787	77%	0.768	S	S	*	*			trans	82	137.4	176.1	-66.1	-102.5	0	0	0	116.4
674	A	40.4	Very low	38.7	Very low	86 Å²	86	134.1 Å²	134.1	71%	0.711	78%	0.775	S	S	*	*			cis	-168.7	158.9	-11.8	0	0	0	0	0	109.5
675	A	39.8	Very low	38.4	Very low	83 Å²	83	136.6 Å²	136.6	69%	0.686	77%	0.774	S	S	*	*			cis	-173.5	173.6	-20	0	0	0	0	0	109.3
676	K	52.3	Low	38.4	Very low	205 Å²	205	137.4 Å²	137.4	89%	0.891	77%	0.771	S	S	*	*			trans	88.9	140.1	172.3	-54.6	165.3	-175	172.5	0	116
677	R	39.4	Very low	39.1	Very low	222 Å²	222	140.3 Å²	140.3	84%	0.838	78%	0.778	S	S	*	*			cis	-169.9	161.3	-22.7	-151.8	-179	-173.7	157.7	2.3	110.3
678	I	46.8	Very low	39.6	Very low	158 Å²	158	136.3 Å²	136.3	81%	0.81	76%	0.763	S	S	*	*			trans	80.1	151.9	165.1	-51.4	156.3	0	0	0	115
679	K	39.1	Very low	39.8	Very low	174 Å²	174	136.8 Å²	136.8	76%	0.757	76%	0.759	S	S	*	*				-172.9	163.4	-78.6	175	170.7	174.5	-179.1	0	108.6
680	V	41.6	Very low	39.6	Very low	122 Å²	122	137.7 Å²	137.7	74%	0.739	76%	0.759	S	S	*	*			trans	88.9	110.5	172.4	-170.2	0	0	0	0	111.2
681	E	38.1	Very low	39.2	Very low	137 Å²	137	139.6 Å²	139.6	64%	0.64	76%	0.762	S	S	*	*			cis	89.3	101.1	36.7	-167.8	-157.7	147.4	0	0	114.5
682	K	41.9	Very low	39.6	Very low	163 Å²	163	142.5 Å²	142.5	71%	0.709	76%	0.764	S	S	*	*				-170.9	163.4	122.5	-144.7	70.7	-162.6	99.7	0	111.5
683	D	40.5	Very low	40.1	Very low	119 Å²	119	139.7 Å²	139.7	64%	0.636	75%	0.754	S	S	*	*			trans	-75.5	146.9	-170.3	-41.1	-114.5	0	0	0	114.8
684	L	37.8	Very low	40.4	Very low	172 Å²	172	137.9 Å²	137.9	90%	0.901	76%	0.761	S	S	*	*				-166.1	156.8	129.6	-137	61.4	0	0	0	115.3
685	E	33.5	Very low	40.6	Very low	167 Å²	167	141.8 Å²	141.8	78%	0.78	76%	0.764	S	S	*	*			trans	-32.9	150.8	-176.7	-133.6	96.8	90.5	0	0	122.9
686	L	40.1	Very low	41	Very low	141 Å²	141	142.3 Å²	142.3	74%	0.738	76%	0.755	S	S	*	*			trans	-10.4	153.5	155.8	-66.5	168	0	0	0	121.4
687	P	42.1	Very low	41.4	Very low	124 Å²	124	138 Å²	138	81%	0.805	75%	0.746	S	S	*	*				-132.2	155.9	91	39.1	-32.5	0	0	0	115.2
688	P	41.6	Very low	42.1	Very low	104 Å²	104	135.1 Å²	135.1	68%	0.675	74%	0.736	S	S	*	*			trans	-100.1	161.8	177	38.5	-34.5	0	0	0	114.9
689	A	34.7	Very low	43.3	Very low	90 Å²	90	130.6 Å²	130.6	74%	0.744	72%	0.719	S	S	*	*			trans	68.4	135.4	154.3	0	0	0	0	0	120.9
690	A	35.1	Very low	44.5	Very low	97 Å²	97	129.5 Å²	129.5	80%	0.802	72%	0.716	S	S	*	*			trans	-132.1	82.2	141.4	0	0	0	0	0	107.8	I692	A690-I692 PolarHBondContact O-N 3.49Å
691	L	34.7	Very low	45.6	Very low	160 Å²	160	130.7 Å²	130.7	84%	0.838	71%	0.708	S	S	*	*			trans	-70.6	112.4	170.4	-77.2	170	0	0	0	108	P693	L691-P693 WeakPolarHBondContact O-CD 3.46Å
692	I	42.3	Very low	47.3	Very low	153 Å²	153	128.7 Å²	128.7	79%	0.785	70%	0.701	S	S	*	*			trans	-74.4	119.8	176	-57.4	178	0	0	0	108	A690 S694	A690-I692 PolarHBondContact O-N 3.49Å; I692-S694 PolarHBondContact O-N 2.96Å
693	P	41.6	Very low	48.7	Very low	87 Å²	87	125.9 Å²	125.9	57%	0.565	70%	0.697	S	S	*	*			trans	-63.9	135.1	-176.3	-23.3	35	0	0	0	112.6	L691 E695	L691-P693 WeakPolarHBondContact O-CD 3.46Å; P693-E695 HydrophobicContact CB-CG 4.04Å; P693-E695 WeakPolarHBondContact CB-OE1 3.46Å; P693-E695 PolarHBondContact O-N 3.38Å
694	S	45.7	Very low	50.1	Low	132 Å²	132	122 Å²	122	92%	0.923	69%	0.685	S	S	*	*	T	Hydrogen-bonded Turn	trans	-84.4	31.8	-171.5	62.5	0	0	0	0	114	I692	I692-S694 PolarHBondContact O-N 2.96Å
695	E	44.4	Very low	51.1	Low	167 Å²	167	119.5 Å²	119.5	78%	0.78	67%	0.665	S	S	*	*	T	Hydrogen-bonded Turn	trans	-112.8	-10.8	-165.4	64.3	-166.1	90.1	0	0	115.2	P693	P693-E695 HydrophobicContact CB-CG 4.04Å; P693-E695 WeakPolarHBondContact CB-OE1 3.46Å; P693-E695 PolarHBondContact O-N 3.38Å
696	N	47.6	Very low	52	Low	95 Å²	95	114.8 Å²	114.8	51%	0.508	65%	0.654	S	S	.	*			trans	-106.4	95.9	177.7	-165.4	-16.2	0	0	0	112.7	Y698 S699	N696-Y698 PolarHBondContact O-N 2.91Å; N696-Y698 WeakPolarHBondContact OD1-CB 3.43Å; N696-Y698 PolarHBondContact OD1-N 3.42Å; N696-S699 PolarHBondContact O-N 2.9Å; N696-S699 PolarHBondContact O-OG 3.23Å
697	V	60.8	Low	52.7	Low	115 Å²	115	111.4 Å²	111.4	70%	0.697	65%	0.647	S	S	*	*	H	α-helix	trans	-59.2	-28.9	176.1	-178.8	0	0	0	0	112.2	Q700 W701	V697-Q700 PolarHBondContact O-N 3.17Å; V697-W701 PolarHBondContact O-N 3.26Å
698	Y	53.5	Low	53.3	Low	161 Å²	161	109.9 Å²	109.9	63%	0.631	64%	0.639	S	S	*	*	H	α-helix	trans	-70.7	-39.5	-174.7	-156.9	-98.3	0	0	0	112.7	N696 W701 L702	N696-Y698 PolarHBondContact O-N 2.91Å; N696-Y698 WeakPolarHBondContact OD1-CB 3.43Å; N696-Y698 PolarHBondContact OD1-N 3.42Å; Y698-W701 PolarHBondContact O-N 3.5Å; Y698-L702 HydrophobicContact CD1-CD1 4.27Å; Y698-L702 HydrophobicContact CE1-CD1 3.96Å; Y698-L702 PolarHBondContact O-N 3.06Å
699	S	71.9	Confident	53.7	Low	63 Å²	63	114.7 Å²	114.7	44%	0.441	64%	0.644	S	S	.	*	H	α-helix	trans	-70.6	-35.7	175.8	54.1	0	0	0	0	111.9	N696 W701 L702 V703	N696-S699 PolarHBondContact O-N 2.9Å; N696-S699 PolarHBondContact O-OG 3.23Å; S699-W701 VanDerWaalsContact C-N 3.33Å; S699-W701 PolarHBondContact O-N 2.99Å; S699-L702 PolarHBondContact O-N 3.5Å; S699-V703 WeakPolarHBondContact O-CG2 3.42Å; S699-V703 PolarHBondContact O-N 2.74Å
700	Q	65.9	Low	54.2	Low	151 Å²	151	118.6 Å²	118.6	71%	0.706	65%	0.646	S	S	*	*	H	α-helix	trans	-64.6	-38.1	173.3	-162.6	174	32.8	0	0	111.9	V697 G704	V697-Q700 PolarHBondContact O-N 3.17Å; Q700-G704 PolarHBondContact O-N 3.47Å; Q700-G704 VanDerWaalsContact O-N 3.1Å
701	W	64.9	Low	54.4	Low	147 Å²	147	123 Å²	123	56%	0.557	65%	0.647	S	S	*	*	H	α-helix	trans	-65.7	-43.9	173	-168.2	83.9	0	0	0	112.2	V697 Y698 S699 V703 G704 Y705	V697-W701 PolarHBondContact O-N 3.26Å; Y698-W701 PolarHBondContact O-N 3.5Å; S699-W701 VanDerWaalsContact C-N 3.33Å; S699-W701 PolarHBondContact O-N 2.99Å; W701-V703 PolarHBondContact O-N 3.18Å; W701-G704 PolarHBondContact O-N 3Å; W701-Y705 HydrophobicContact CD2-CD2 4.25Å; W701-Y705 AromaticContact CE2-CD2 3.9Å; W701-Y705 HydrophobicContact CE3-CD2 4.26Å; W701-Y705 AromaticContact CH2-CD2 3.66Å; W701-Y705 HydrophobicContact CH2-CD2 3.66Å; W701-Y705 AromaticContact CH2-CE2 3.52Å; W701-Y705 HydrophobicContact CH2-CE2 3.52Å; W701-Y705 AromaticContact CZ2-CD2 3.62Å; W701-Y705 HydrophobicContact CZ2-CD2 3.62Å; W701-Y705 AromaticContact CZ2-CE2 3.42Å; W701-Y705 HydrophobicContact CZ2-CE2 3.42Å; W701-Y705 VanDerWaalsContact CZ2-CE2 3.42Å; W701-Y705 AromaticContact CZ3-CD2 3.98Å; W701-Y705 HydrophobicContact CZ3-CD2 3.98Å; W701-Y705 HydrophobicContact CZ3-CE2 4.29Å; W701-Y705 PolarHBondContact O-N 3.33Å
702	L	73.8	Confident	54.8	Low	94 Å²	94	124.1 Å²	124.1	49%	0.492	65%	0.651	S	S	.	*	H	α-helix	trans	-59.8	-44.5	176.8	-122.2	75.2	0	0	0	112.6	Y698 S699 Y705 A706	Y698-L702 HydrophobicContact CD1-CD1 4.27Å; Y698-L702 HydrophobicContact CE1-CD1 3.96Å; Y698-L702 PolarHBondContact O-N 3.06Å; S699-L702 PolarHBondContact O-N 3.5Å; L702-Y705 WeakPolarHBondContact O-CB 3.42Å; L702-Y705 PolarHBondContact O-N 3.1Å; L702-A706 PolarHBondContact O-N 2.96Å
703	V	70.2	Confident	54.8	Low	104 Å²	104	125.2 Å²	125.2	63%	0.63	65%	0.65	S	S	*	*	H	α-helix	trans	-64.1	-40.2	176.5	171.4	0	0	0	0	111.1	S699 W701 Y705 A706 A707	S699-V703 WeakPolarHBondContact O-CG2 3.42Å; S699-V703 PolarHBondContact O-N 2.74Å; W701-V703 PolarHBondContact O-N 3.18Å; V703-Y705 VanDerWaalsContact C-N 3.33Å; V703-Y705 PolarHBondContact O-N 2.07Å; V703-A706 PolarHBondContact O-N 3.44Å; V703-A707 WeakPolarHBondContact O-CB 3.36Å; V703-A707 PolarHBondContact O-N 3.39Å
704	G	69.9	Low	54.6	Low	38 Å²	38	127.2 Å²	127.2	39%	0.392	66%	0.656	S	S	.	*	H	α-helix	trans	-61.6	-38.1	171.8	0	0	0	0	0	113.3	Q700 W701 A707 S708	Q700-G704 PolarHBondContact O-N 3.47Å; Q700-G704 VanDerWaalsContact O-N 3.1Å; W701-G704 PolarHBondContact O-N 3Å; G704-A707 PolarHBondContact O-N 3.1Å; G704-S708 WeakPolarHBondContact O-CB 3.45Å; G704-S708 PolarHBondContact O-N 2.88Å; G704-S708 PolarHBondContact O-OG 2.79Å
705	Y	59.2	Low	54.7	Low	119 Å²	119	126.1 Å²	126.1	47%	0.467	65%	0.646	S	S	.	*	H	α-helix	trans	-70.2	-29.4	177.3	-130.7	-87.3	0	0	0	113.3	W701 L702 V703	W701-Y705 HydrophobicContact CD2-CD2 4.25Å; W701-Y705 AromaticContact CE2-CD2 3.9Å; W701-Y705 HydrophobicContact CE3-CD2 4.26Å; W701-Y705 AromaticContact CH2-CD2 3.66Å; W701-Y705 HydrophobicContact CH2-CD2 3.66Å; W701-Y705 AromaticContact CH2-CE2 3.52Å; W701-Y705 HydrophobicContact CH2-CE2 3.52Å; W701-Y705 AromaticContact CZ2-CD2 3.62Å; W701-Y705 HydrophobicContact CZ2-CD2 3.62Å; W701-Y705 AromaticContact CZ2-CE2 3.42Å; W701-Y705 HydrophobicContact CZ2-CE2 3.42Å; W701-Y705 VanDerWaalsContact CZ2-CE2 3.42Å; W701-Y705 AromaticContact CZ3-CD2 3.98Å; W701-Y705 HydrophobicContact CZ3-CD2 3.98Å; W701-Y705 HydrophobicContact CZ3-CE2 4.29Å; W701-Y705 PolarHBondContact O-N 3.33Å; L702-Y705 WeakPolarHBondContact O-CB 3.42Å; L702-Y705 PolarHBondContact O-N 3.1Å; V703-Y705 VanDerWaalsContact C-N 3.33Å; V703-Y705 PolarHBondContact O-N 2.07Å
706	A	52.5	Low	54.3	Low	68 Å²	68	127.2 Å²	127.2	56%	0.562	65%	0.648	S	S	*	*	H	α-helix	trans	-74.5	-47.5	171.8	0	0	0	0	0	111.8	L702 V703 S708 R709	L702-A706 PolarHBondContact O-N 2.96Å; V703-A706 PolarHBondContact O-N 3.44Å; A706-S708 PolarHBondContact O-N 3.12Å; A706-R709 PolarHBondContact O-N 2.98Å
707	A	53.4	Low	54.1	Low	70 Å²	70	130.2 Å²	130.2	58%	0.579	66%	0.663	S	S	*	*	H	α-helix	trans	-63.4	-38.6	-178.4	0	0	0	0	0	113.1	V703 G704 R709 H710	V703-A707 WeakPolarHBondContact O-CB 3.36Å; V703-A707 PolarHBondContact O-N 3.39Å; G704-A707 PolarHBondContact O-N 3.1Å; A707-R709 PolarHBondContact O-N 3.48Å; A707-R709 VanDerWaalsContact O-N 3.1Å; A707-H710 PolarHBondContact O-N 3.06Å
708	S	55.6	Low	52.6	Low	92 Å²	92	128.3 Å²	128.3	64%	0.643	67%	0.667	S	S	*	*	T	Hydrogen-bonded Turn	trans	-72.3	1.8	-177	52	0	0	0	0	115.4	G704 A706	G704-S708 WeakPolarHBondContact O-CB 3.45Å; G704-S708 PolarHBondContact O-N 2.88Å; G704-S708 PolarHBondContact O-OG 2.79Å; A706-S708 PolarHBondContact O-N 3.12Å
709	R	50.1	Low	51.8	Low	206 Å²	206	130.5 Å²	130.5	78%	0.777	68%	0.68	S	S	*	*	T	Hydrogen-bonded Turn	trans	-99.7	-6.9	175.3	-79	-179.5	162.8	-90.7	4.3	115.1	A706 A707	A706-R709 PolarHBondContact O-N 2.98Å; A707-R709 PolarHBondContact O-N 3.48Å; A707-R709 VanDerWaalsContact O-N 3.1Å
710	H	46.1	Very low	50	Low	172 Å²	172	133.3 Å²	133.3	80%	0.796	70%	0.695	S	S	*	*	S	Bend	trans	-106.8	3.3	-169.4	-117.7	-77	0	0	0	115.9	A707	A707-H710 PolarHBondContact O-N 3.06Å
711	F	39.2	Very low	48.3	Very low	188 Å²	188	133.8 Å²	133.8	83%	0.825	70%	0.702	S	S	*	*			trans	-129.2	74.5	-173.4	-117.7	-89.5	0	0	0	112.1
712	M	42.5	Very low	46.9	Very low	185 Å²	185	130.8 Å²	130.8	91%	0.911	71%	0.708	S	S	*	*			trans	-164.3	89.4	161.2	-135.5	98.1	-92.2	0	0	110
713	K	41.3	Very low	45.2	Very low	176 Å²	176	137.5 Å²	137.5	77%	0.765	73%	0.727	S	S	*	*			trans	-150.4	69.9	176.3	-169.9	56.2	-168.5	148	0	113.2
714	D	38.8	Very low	43.3	Very low	128 Å²	128	141.7 Å²	141.7	68%	0.684	74%	0.74	S	S	*	*			trans	64.8	174.3	161.8	-63.8	-60.7	0	0	0	115.1
715	P	47.5	Very low	41.8	Very low	110 Å²	110	144.8 Å²	144.8	71%	0.714	76%	0.755	S	S	*	*			cis	-132.2	161.5	2.3	36.3	-17.4	0	0	0	118.3
716	F	35.7	Very low	40.8	Very low	190 Å²	190	144.2 Å²	144.2	83%	0.833	77%	0.767	S	S	*	*			trans	86.1	142.8	141.4	-102.5	-123.4	0	0	0	123
717	L	42.6	Very low	40.1	Very low	158 Å²	158	150.6 Å²	150.6	83%	0.827	78%	0.782	S	S	*	*			trans	68.7	97.4	163.2	-55.4	-177.3	0	0	0	121
718	G	30.5	Very low	39	Very low	75 Å²	75	151.9 Å²	151.9	77%	0.773	79%	0.793	S	S	*	*				100	85.8	108	0	0	0	0	0	119.7
719	F	36.7	Very low	37.9	Very low	207 Å²	207	153.5 Å²	153.5	91%	0.908	80%	0.799	S	S	*	*			trans	-151.8	147.8	141.1	-141.1	-94.3	0	0	0	111
720	T	33.1	Very low	37.2	Very low	122 Å²	122	148.6 Å²	148.6	75%	0.748	80%	0.796	S	S	*	*			trans	-121.4	158	-177.6	48.8	0	0	0	0	112
721	D	31	Very low	36.8	Very low	161 Å²	161	145 Å²	145	86%	0.861	79%	0.79	S	S	*	*			trans	80	167.6	163.7	-130.2	-70.1	0	0	0	119.3
722	A	35.1	Very low	36.7	Very low	83 Å²	83	143.7 Å²	143.7	69%	0.686	79%	0.787	S	S	*	*			trans	58.3	73	165	0	0	0	0	0	119.2
723	R	37.7	Very low	36.6	Very low	235 Å²	235	144.2 Å²	144.2	89%	0.887	79%	0.787	S	S	*	*			trans	-132	86.9	146.2	-65.4	-157.9	101.5	-107.6	0.4	112.6
724	Q	31.6	Very low	36.2	Very low	192 Å²	192	140.7 Å²	140.7	90%	0.897	78%	0.784	S	S	*	*			trans	-59.8	151.9	160.6	-65	168.8	-10.2	0	0	110.3
725	S	36.9	Very low	36.3	Very low	103 Å²	103	139.5 Å²	139.5	72%	0.72	79%	0.785	S	S	*	*			trans	-145.8	131.9	168.4	-167.7	0	0	0	0	109.5
726	P	38.8	Very low	35.8	Very low	108 Å²	108	141.6 Å²	141.6	70%	0.701	79%	0.786	S	S	*	*			trans	-115.4	92.6	-152.1	35.2	-19.4	0	0	0	113.1
727	F	37.5	Very low	35.6	Very low	202 Å²	202	139.5 Å²	139.5	89%	0.886	78%	0.783	S	S	*	*			trans	-144.9	51.9	170.1	-73.5	-71.1	0	0	0	111
728	A	30.9	Very low	35.2	Very low	97 Å²	97	135.7 Å²	135.7	80%	0.802	78%	0.782	S	S	*	*			trans	-131.6	53	-173.7	0	0	0	0	0	112.5
729	T	32.9	Very low	35.3	Very low	126 Å²	126	137.5 Å²	137.5	77%	0.773	78%	0.783	S	S	*	*			trans	-149.2	149.9	174.7	42.6	0	0	0	0	107.8
730	S	34.3	Very low	35.5	Very low	103 Å²	103	133.7 Å²	133.7	72%	0.72	77%	0.771	S	S	*	*			cis	-162.7	179.5	-10.4	-96.7	0	0	0	0	108.7
731	S	38.8	Very low	35.6	Very low	96 Å²	96	138.8 Å²	138.8	67%	0.671	78%	0.777	S	S	*	*			trans	73.3	147.1	150.6	-164.5	0	0	0	0	118
732	E	35.7	Very low	35.9	Very low	160 Å²	160	140 Å²	140	75%	0.748	78%	0.775	S	S	*	*			cis	-161.6	139.9	-45	-107.7	136	166.2	0	0	106.3
733	H	40.7	Very low	36	Very low	197 Å²	197	141.3 Å²	141.3	91%	0.912	78%	0.779	S	S	*	*			trans	-169.4	103.2	149.2	-111.1	-70.5	0	0	0	109
734	S	34	Very low	36.4	Very low	101 Å²	101	136.3 Å²	136.3	71%	0.706	78%	0.775	S	S	*	*			trans	-76.9	172.3	160.7	-67.9	0	0	0	0	109.9
735	S	40.8	Very low	37.3	Very low	103 Å²	103	132.5 Å²	132.5	72%	0.72	77%	0.767	S	S	*	*			trans	70.5	147.8	170.2	-49.8	0	0	0	0	115.3
736	E	36.4	Very low	37.8	Very low	155 Å²	155	133.7 Å²	133.7	72%	0.724	77%	0.772	S	S	*	*			cis	-160.3	173.3	-20	51.2	-171.5	86.7	0	0	110.8
737	N	31.3	Very low	37.9	Very low	146 Å²	146	131.9 Å²	131.9	78%	0.781	77%	0.773	S	S	*	*			trans	2.8	134.3	148.9	-52.6	-30.2	0	0	0	118.4
738	G	33.9	Very low	38.2	Very low	78 Å²	78	129.3 Å²	129.3	80%	0.804	77%	0.768	S	S	*	*			trans	120.3	121.2	144.2	0	0	0	0	0	116	L740	G738-L740 PolarHBondContact O-N 3.14Å
739	S	34.3	Very low	39	Very low	112 Å²	112	132.2 Å²	132.2	78%	0.783	77%	0.77	S	S	*	*			trans	-63.8	125.1	155.5	146.6	0	0	0	0	109.5
740	L	39	Very low	40	Very low	127 Å²	127	132.7 Å²	132.7	67%	0.665	77%	0.766	S	S	*	*			trans	-142	154.6	138.9	-137.7	86.8	0	0	0	111.8	G738 F742	G738-L740 PolarHBondContact O-N 3.14Å; L740-F742 HydrophobicContact CB-CD2 4.42Å; L740-F742 HydrophobicContact CB-CE2 4.12Å; L740-F742 HydrophobicContact CD2-CD1 4.4Å; L740-F742 HydrophobicContact CD2-CD2 4.08Å; L740-F742 HydrophobicContact CD2-CE1 3.79Å; L740-F742 HydrophobicContact CD2-CE2 3.42Å; L740-F742 VanDerWaalsContact CD2-CE2 3.42Å; L740-F742 HydrophobicContact CD2-CZ 3.26Å; L740-F742 HydrophobicContact CG-CE2 4.38Å
741	R	36.4	Very low	40.6	Very low	229 Å²	229	135.8 Å²	135.8	86%	0.864	78%	0.775	S	S	*	*			trans	-105.5	120.4	171.1	-50.3	172.9	80.8	154.7	3.8	105.9
742	F	37.9	Very low	40.8	Very low	188 Å²	188	134.3 Å²	134.3	83%	0.825	78%	0.775	S	S	*	*			trans	-107.9	120.7	169	-80.2	-70.3	0	0	0	109.6	L740	L740-F742 HydrophobicContact CB-CD2 4.42Å; L740-F742 HydrophobicContact CB-CE2 4.12Å; L740-F742 HydrophobicContact CD2-CD1 4.4Å; L740-F742 HydrophobicContact CD2-CD2 4.08Å; L740-F742 HydrophobicContact CD2-CE1 3.79Å; L740-F742 HydrophobicContact CD2-CE2 3.42Å; L740-F742 VanDerWaalsContact CD2-CE2 3.42Å; L740-F742 HydrophobicContact CD2-CZ 3.26Å; L740-F742 HydrophobicContact CG-CE2 4.38Å
743	S	36.9	Very low	41.2	Very low	109 Å²	109	130.2 Å²	130.2	76%	0.762	78%	0.776	S	S	*	*	P	Polyproline II helix	trans	-82.4	149.2	-177.5	-54.9	0	0	0	0	110.9
744	T	45.4	Very low	41.7	Very low	131 Å²	131	128.8 Å²	128.8	80%	0.804	77%	0.774	S	S	*	*	P	Polyproline II helix	trans	-56.9	133	152.9	-49	0	0	0	0	108.4
745	P	50.2	Low	42.1	Very low	112 Å²	112	129.4 Å²	129.4	73%	0.727	78%	0.778	S	S	*	*	P	Polyproline II helix	trans	-68.5	134.1	179.4	27.4	-34.1	0	0	0	110.8
746	P	47.7	Very low	42.2	Very low	127 Å²	127	128.2 Å²	128.2	83%	0.825	78%	0.782	S	S	*	*	P	Polyproline II helix	trans	-79.5	120.2	167.8	31.4	-30.1	0	0	0	109.6
747	G	41.7	Very low	42.3	Very low	70 Å²	70	132.7 Å²	132.7	72%	0.722	79%	0.793	S	S	*	*	P	Polyproline II helix	trans	-84.2	156.2	170.2	0	0	0	0	0	112.3
748	D	43.7	Very low	42.5	Very low	149 Å²	149	132 Å²	132	80%	0.797	80%	0.799	S	S	*	*	P	Polyproline II helix	trans	-48.9	136.7	-173.6	-61.4	-109.8	0	0	0	116.5
749	L	46.2	Very low	42.9	Very low	158 Å²	158	132 Å²	132	83%	0.827	80%	0.799	S	S	*	*				-155.9	98.7	121.7	-156.8	67.8	0	0	0	113.5
750	L	54	Low	43.3	Very low	135 Å²	135	133.8 Å²	133.8	71%	0.707	81%	0.805	S	S	*	*			trans	22.1	127.3	136.5	-49.5	176.7	0	0	0	121.6
751	D	48.4	Very low	43.5	Very low	169 Å²	169	132.6 Å²	132.6	90%	0.904	81%	0.814	S	S	*	*			trans	77.5	153.9	140.2	-117.3	-67.6	0	0	0	124.1
752	G	42.5	Very low	43.7	Very low	64 Å²	64	128 Å²	128	66%	0.66	82%	0.817	S	S	*	*			trans	77.4	116.3	-173.3	0	0	0	0	0	113.8
753	G	42.9	Very low	43.9	Very low	75 Å²	75	123.2 Å²	123.2	77%	0.773	82%	0.82	S	S	*	*			cis	79.4	109.5	41.7	0	0	0	0	0	109
754	L	51.7	Low	44.1	Very low	166 Å²	166	121.8 Å²	121.8	87%	0.869	82%	0.823	S	S	*	*			cis	-157	161.9	43.5	-74.7	164.6	0	0	0	113.6
755	S	42.7	Very low	43.8	Very low	115 Å²	115	120.5 Å²	120.5	80%	0.804	82%	0.819	S	S	*	*			trans	44.1	95	146.3	-60.6	0	0	0	0	119.8
756	G	42.1	Very low	43.7	Very low	78 Å²	78	121.4 Å²	121.4	80%	0.804	82%	0.823	S	S	*	*			trans	-83.1	-164.4	175	0	0	0	0	0	117
757	R	39.2	Very low	43.9	Very low	249 Å²	249	120.2 Å²	120.2	94%	0.94	82%	0.816	S	S	*	*			trans	-164.9	114.3	159.2	-122.9	177.9	174.4	-161.8	-3.2	111
758	S	36.2	Very low	43.8	Very low	131 Å²	131	125.4 Å²	125.4	92%	0.916	82%	0.821	S	S	*	*			trans	-81.1	135.8	155.8	-54.9	0	0	0	0	108.3
759	G	40.8	Very low	43.8	Very low	78 Å²	78	126.6 Å²	126.6	80%	0.804	83%	0.826	S	S	*	*			trans	-170.2	115.5	-178.9	0	0	0	0	0	112.8
760	T	44.3	Very low	43.6	Very low	149 Å²	149	123.1 Å²	123.1	91%	0.914	83%	0.828	S	S	*	*			trans	-84.6	141.7	175.5	47.5	0	0	0	0	111.5
761	A	41.6	Very low	43.2	Very low	103 Å²	103	120.3 Å²	120.3	85%	0.851	83%	0.832	S	S	*	*			trans	-166.4	148.9	152.2	0	0	0	0	0	111.1
762	S	42.2	Very low	43.1	Very low	133 Å²	133	118.5 Å²	118.5	93%	0.93	83%	0.83	S	S	*	*			trans	-115.5	151.5	173.4	-57.5	0	0	0	0	110.5
763	G	40.8	Very low	43	Very low	86 Å²	86	119 Å²	119	89%	0.887	84%	0.835	S	S	*	*			trans	127.3	142.8	160.5	0	0	0	0	0	115.7
764	G	40.6	Very low	43.6	Very low	80 Å²	80	121.8 Å²	121.8	83%	0.825	84%	0.839	S	S	*	*			trans	142.8	96.4	176.4	0	0	0	0	0	112.3
765	S	39.8	Very low	43	Very low	103 Å²	103	117.3 Å²	117.3	72%	0.72	83%	0.833	S	S	*	*			trans	-120.4	155.8	-173.9	-57.5	0	0	0	0	112.5
766	T	47.8	Very low	43.2	Very low	132 Å²	132	122.8 Å²	122.8	81%	0.81	84%	0.836	S	S	*	*			trans	66.8	165.1	153.1	41.5	0	0	0	0	119
767	P	51.9	Low	43.5	Very low	102 Å²	102	124.7 Å²	124.7	66%	0.662	83%	0.834	S	S	*	*			cis	-141.2	151.6	-25.8	32	-12.2	0	0	0	117.7
768	H	41	Very low	43.6	Very low	179 Å²	179	117.8 Å²	117.8	83%	0.829	82%	0.824	S	S	*	*			trans	59.3	165.9	138.8	-78.6	-90.6	0	0	0	125
769	L	44	Very low	44	Very low	173 Å²	173	117.4 Å²	117.4	91%	0.906	82%	0.821	S	S	*	*			trans	77	123.4	176.8	-46.9	-179.9	0	0	0	115.6
770	G	41	Very low	44.4	Very low	85 Å²	85	123.3 Å²	123.3	88%	0.876	83%	0.825	S	S	*	*			cis	169.4	124.9	-12	0	0	0	0	0	112.4
771	G	45.4	Very low	44.6	Very low	77 Å²	77	124.4 Å²	124.4	79%	0.794	82%	0.82	S	S	*	*			trans	172.6	152.1	178.5	0	0	0	0	0	113.2
772	P	46.3	Very low	44.9	Very low	131 Å²	131	122.8 Å²	122.8	85%	0.851	81%	0.813	S	S	*	*			trans	-105	145.6	-158.6	37.9	-34.1	0	0	0	117
773	G	40.4	Very low	45.3	Very low	74 Å²	74	127.3 Å²	127.3	76%	0.763	81%	0.81	S	S	*	*			trans	34.1	133.7	148.5	0	0	0	0	0	121.5
774	P	56.8	Low	46	Very low	133 Å²	133	134.2 Å²	134.2	86%	0.864	81%	0.809	S	S	*	*				-143.6	171.8	69.2	40.9	-27.2	0	0	0	116.1
775	G	39	Very low	47.5	Very low	72 Å²	72	133.5 Å²	133.5	74%	0.742	79%	0.791	S	S	*	*			trans	75.4	88.1	147.2	0	0	0	0	0	117.9	P777	G775-P777 WeakPolarHBondContact O-CD 3.19Å
776	R	45.5	Very low	49.4	Very low	231 Å²	231	130.8 Å²	130.8	87%	0.872	77%	0.769	S	S	*	*	P	Polyproline II helix	trans	-53.4	119.8	162.8	-179.5	-173.3	-165.4	-124	10	110.4	S778	R776-S778 PolarHBondContact O-N 2.73Å
777	P	49	Very low	51.1	Low	118 Å²	118	127.8 Å²	127.8	77%	0.766	75%	0.75	S	S	*	*	P	Polyproline II helix	trans	-66.2	129.2	169.8	27.6	-32.7	0	0	0	109.3	G775	G775-P777 WeakPolarHBondContact O-CD 3.19Å
778	S	40.9	Very low	52.8	Low	103 Å²	103	123 Å²	123	72%	0.72	72%	0.719	S	S	*	*	P	Polyproline II helix	trans	-83.4	129.6	179.4	-163.6	0	0	0	0	110.7	R776 K780	R776-S778 PolarHBondContact O-N 2.73Å; S778-K780 PolarHBondContact O-N 3Å
779	S	45.7	Very low	54.9	Low	123 Å²	123	122.1 Å²	122.1	86%	0.86	72%	0.715	S	S	*	*	S	Bend	trans	-81.2	76.3	-173.8	-174.5	0	0	0	0	112.2
780	K	48.7	Very low	56.7	Low	203 Å²	203	120.9 Å²	120.9	88%	0.883	70%	0.7	S	S	*	*			trans	-118.9	9	168.4	-154.2	171.9	-179.5	177.3	0	113.3	S778	S778-K780 PolarHBondContact O-N 3Å
781	E	47.5	Very low	58.8	Low	172 Å²	172	119.4 Å²	119.4	80%	0.804	68%	0.675	S	S	*	*			trans	-90.7	115.6	175.6	-164.8	63.9	-97.3	0	0	109.7
782	G	48.2	Very low	60.6	Low	69 Å²	69	118.1 Å²	118.1	71%	0.711	66%	0.662	S	S	*	*			trans	167	-17	-172.7	0	0	0	0	0	116.7	R784	G782-R784 PolarHBondContact O-N 3.24Å; G782-R784 VanDerWaalsContact O-N 3.14Å
783	R	51.6	Low	62.5	Low	228 Å²	228	117.8 Å²	117.8	86%	0.86	65%	0.647	S	S	*	*	S	Bend	trans	-70.6	101.7	160.3	-76.2	-79.7	-152.7	-103.2	-1.8	107.9	S785	R783-S785 PolarHBondContact O-N 3.48Å; R783-S785 PolarHBondContact O-OG 2.83Å
784	R	55.5	Low	64.7	Low	230 Å²	230	118.7 Å²	118.7	87%	0.868	64%	0.638	S	S	*	*			trans	-49.7	117.7	170.4	-101.8	-176.2	171.6	139	-3.7	109	G782	G782-R784 PolarHBondContact O-N 3.24Å; G782-R784 VanDerWaalsContact O-N 3.14Å
785	S	71.2	Confident	66.1	Low	65 Å²	65	114.6 Å²	114.6	46%	0.455	61%	0.607	S	S	.	*			trans	-96.4	112.5	179.2	-62.3	0	0	0	0	109.7	R783 T787 V794	R783-S785 PolarHBondContact O-N 3.48Å; R783-S785 PolarHBondContact O-OG 2.83Å; S785-T787 PolarHBondContact O-N 3.15Å; S785-T787 PolarHBondContact O-OG1 3.14Å; S785-V794 VanDerWaalsContact CB-CG1 3.46Å
786	D	79.7	Confident	68.2	Low	47 Å²	47	119.9 Å²	119.9	25%	0.251	61%	0.609	S	S	.	*	E	Extended strand (participates in β ladder)	trans	-76.2	104.5	-168.9	-71.4	-70	0	0	0	110.7	F795 N797 C798 L801	D786-F795 PolarHBondContact N-O 2.97Å; D786-F795 WeakPolarHBondContact O-CB 3.44Å; D786-F795 PolarHBondContact O-N 2.87Å; D786-N797 VanDerWaalsContact OD2-C 3.27Å; D786-C798 HydrophobicContact CB-CB 4.39Å; D786-C798 VanDerWaalsContact CG-CA 3.49Å; D786-C798 WeakPolarHBondContact OD2-CA 3.24Å; D786-C798 WeakPolarHBondContact OD2-CB 3.45Å; D786-C798 PolarHBondContact OD2-N 3.13Å; D786-L801 HydrophobicContact CB-CB 3.95Å; D786-L801 HydrophobicContact CB-CD2 3.8Å
787	T	84.3	Confident	70.1	Confident	68 Å²	68	112.8 Å²	112.8	42%	0.417	59%	0.589	S	S	.	*	E	Extended strand (participates in β ladder)	trans	-99.9	141	-171.4	-55.6	0	0	0	0	111.8	S785 K793 V794	S785-T787 PolarHBondContact O-N 3.15Å; S785-T787 PolarHBondContact O-OG1 3.14Å; T787-K793 WeakPolarHBondContact CA-O 3.37Å; T787-V794 HydrophobicContact CG2-CG2 4.08Å
788	C	87.6	Confident	71.7	Confident	2 Å²	2	110.4 Å²	110.4	1%	0.014	57%	0.574	C	S	.	*			trans	-87.7	118.7	-178.4	-168.2	0	0	0	0	113	Y790 C791 G792 K793 F795 L801 H804 H808	C788-Y790 VanDerWaalsContact C-N 3.27Å; C788-Y790 PolarHBondContact O-N 2.98Å; C788-C791 PolarHBondContact O-N 3.05Å; C788-G792 WeakPolarHBondContact O-CA 3.39Å; C788-G792 PolarHBondContact O-N 3.28Å; C788-K793 PolarHBondContact N-O 3.4Å; C788-F795 HydrophobicContact CB-CE2 4.29Å; C788-L801 VanDerWaalsContact CA-CD1 3.44Å; C788-L801 HydrophobicContact CB-CD1 3.43Å; C788-L801 VanDerWaalsContact CB-CD1 3.43Å; C788-H804 VanDerWaalsContact SG-CD2 3.6Å; C788-H808 VanDerWaalsContact SG-CD2 3.6Å; C788-H808 PolarHBondContact SG-NE2 3.27Å
789	E	85	Confident	73.8	Confident	160 Å²	160	109.4 Å²	109.4	75%	0.748	57%	0.567	S	S	*	*	T	Hydrogen-bonded Turn	trans	-54.3	-40.2	-179.9	-63.2	136.8	162.6	0	0	112.9	C791	E789-C791 VanDerWaalsContact C-N 3.35Å; E789-C791 PolarHBondContact O-N 3.16Å
790	Y	81.5	Confident	75.7	Confident	148 Å²	148	107.3 Å²	107.3	58%	0.58	55%	0.546	S	S	*	.	T	Hydrogen-bonded Turn	trans	-74.5	-15	-176.1	-63.1	-85.3	0	0	0	115.2	C788 R805 H808	C788-Y790 VanDerWaalsContact C-N 3.27Å; C788-Y790 PolarHBondContact O-N 2.98Å; Y790-R805 HydrophobicContact CD2-CG 4.46Å; Y790-R805 HydrophobicContact CE2-CG 4.12Å; Y790-H808 HydrophobicContact CD1-CB 4.22Å; Y790-H808 HydrophobicContact CD2-CB 4.07Å; Y790-H808 AromaticContact CD2-CD2 3.99Å; Y790-H808 HydrophobicContact CG-CB 3.86Å; Y790-H808 AromaticContact CG-CD2 4Å; Y790-H808 AromaticContact CG-CG 3.84Å
791	C	85.3	Confident	77.5	Confident	53 Å²	53	98.4 Å²	98.4	36%	0.358	51%	0.508	S	S	.	.	T	Hydrogen-bonded Turn	trans	-154.8	3.8	-171.6	71.3	0	0	0	0	116.4	C788 E789 K793 H804	C788-C791 PolarHBondContact O-N 3.05Å; E789-C791 VanDerWaalsContact C-N 3.35Å; E789-C791 PolarHBondContact O-N 3.16Å; C791-K793 PolarHBondContact O-N 3.48Å; C791-K793 VanDerWaalsContact O-N 3.1Å; C791-K793 VanDerWaalsContact SG-CG 3.58Å; C791-H804 PolarHBondContact SG-NE2 2.76Å
792	G	83.6	Confident	79.3	Confident	51 Å²	51	92.7 Å²	92.7	53%	0.526	49%	0.485	S	S	.	.			trans	67	4.9	-179.6	0	0	0	0	0	115.8	C788 V794	C788-G792 WeakPolarHBondContact O-CA 3.39Å; C788-G792 PolarHBondContact O-N 3.28Å; G792-V794 PolarHBondContact O-N 3.45Å
793	K	85.1	Confident	81	Confident	123 Å²	123	91.4 Å²	91.4	54%	0.535	46%	0.463	S	S	.	.			trans	-70.6	122.4	-179.4	-71.1	179.8	-176.5	179.7	0	110.8	T787 C788 C791 F795	T787-K793 WeakPolarHBondContact CA-O 3.37Å; C788-K793 PolarHBondContact N-O 3.4Å; C791-K793 PolarHBondContact O-N 3.48Å; C791-K793 VanDerWaalsContact O-N 3.1Å; C791-K793 VanDerWaalsContact SG-CG 3.58Å; K793-F795 HydrophobicContact CB-CE2 3.64Å; K793-F795 HydrophobicContact CB-CZ 3.99Å; K793-F795 VanDerWaalsContact O-CD2 3.31Å; K793-F795 WeakPolarHBondContact O-CD2 3.38Å; K793-F795 VanDerWaalsContact O-CE2 3.32Å; K793-F795 WeakPolarHBondContact O-CE2 3.16Å
794	V	87.5	Confident	82.7	Confident	93 Å²	93	81.9 Å²	81.9	56%	0.564	43%	0.429	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-88.6	129.2	179.4	-172.9	0	0	0	0	109.6	S785 T787 G792	S785-V794 VanDerWaalsContact CB-CG1 3.46Å; T787-V794 HydrophobicContact CG2-CG2 4.08Å; G792-V794 PolarHBondContact O-N 3.45Å
795	F	85	Confident	84.1	Confident	48 Å²	48	74.8 Å²	74.8	21%	0.211	40%	0.402	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-116.1	144.5	178.2	-65.3	-90.8	0	0	0	111.4	D786 C788 K793 N797 N800 L801 H804	D786-F795 PolarHBondContact N-O 2.97Å; D786-F795 WeakPolarHBondContact O-CB 3.44Å; D786-F795 PolarHBondContact O-N 2.87Å; C788-F795 HydrophobicContact CB-CE2 4.29Å; K793-F795 HydrophobicContact CB-CE2 3.64Å; K793-F795 HydrophobicContact CB-CZ 3.99Å; K793-F795 VanDerWaalsContact O-CD2 3.31Å; K793-F795 WeakPolarHBondContact O-CD2 3.38Å; K793-F795 VanDerWaalsContact O-CE2 3.32Å; K793-F795 WeakPolarHBondContact O-CE2 3.16Å; F795-N797 PolarHBondContact O-N 3.07Å; F795-N797 VanDerWaalsContact O-N 3.13Å; F795-N800 HydrophobicContact CB-CB 4.21Å; F795-N800 HydrophobicContact CD1-CB 3.89Å; F795-N800 HydrophobicContact CG-CB 4.33Å; F795-L801 HydrophobicContact CB-CB 4.37Å; F795-L801 HydrophobicContact CD2-CB 4.1Å; F795-L801 HydrophobicContact CD2-CD1 4.15Å; F795-L801 HydrophobicContact CE2-CD1 4.4Å; F795-L801 HydrophobicContact CG-CB 4.39Å; F795-H804 HydrophobicContact CE1-CB 4.09Å; F795-H804 HydrophobicContact CE2-CB 3.94Å; F795-H804 AromaticContact CE2-CD2 3.32Å; F795-H804 WeakPolarHBondContact CE2-CD2 3.22Å; F795-H804 AromaticContact CE2-CG 3.79Å; F795-H804 HydrophobicContact CZ-CB 3.54Å; F795-H804 AromaticContact CZ-CD2 3.34Å; F795-H804 WeakPolarHBondContact CZ-CD2 3.24Å; F795-H804 AromaticContact CZ-CG 3.38Å
796	K	84.6	Confident	84.8	Confident	182 Å²	182	75 Å²	75	79%	0.791	39%	0.393	S	S	*	.	S	Bend	trans	-62.6	-14.4	174.2	-65.3	-174.9	179.1	-178.4	0	113.3
797	N	83.9	Confident	84.9	Confident	82 Å²	82	75.7 Å²	75.7	44%	0.439	40%	0.401	S	S	.	.	S	Bend	trans	-155.1	144.4	-176.3	-38.9	85	0	0	0	113.4	D786 F795 S799 N800 L801	D786-N797 VanDerWaalsContact OD2-C 3.27Å; F795-N797 PolarHBondContact O-N 3.07Å; F795-N797 VanDerWaalsContact O-N 3.13Å; N797-S799 VanDerWaalsContact C-N 3.27Å; N797-S799 PolarHBondContact O-N 3.39Å; N797-N800 WeakPolarHBondContact O-CB 3.42Å; N797-N800 PolarHBondContact O-N 3.44Å; N797-N800 PolarHBondContact OD1-ND2 3.12Å; N797-L801 PolarHBondContact O-N 3.38Å; N797-L801 VanDerWaalsContact O-N 3.09Å
798	C	83.9	Confident	84.8	Confident	69 Å²	69	75.8 Å²	75.8	47%	0.466	40%	0.397	S	S	.	.	H	α-helix	trans	-60	-29.6	177.3	61.5	0	0	0	0	114.4	D786 L801 T802	D786-C798 HydrophobicContact CB-CB 4.39Å; D786-C798 VanDerWaalsContact CG-CA 3.49Å; D786-C798 WeakPolarHBondContact OD2-CA 3.24Å; D786-C798 WeakPolarHBondContact OD2-CB 3.45Å; D786-C798 PolarHBondContact OD2-N 3.13Å; C798-L801 PolarHBondContact O-N 3.4Å; C798-T802 VanDerWaalsContact O-CB 3.32Å; C798-T802 WeakPolarHBondContact O-CB 3.39Å; C798-T802 PolarHBondContact O-N 3.34Å; C798-T802 PolarHBondContact O-OG1 2.97Å
799	S	84.5	Confident	84.4	Confident	82 Å²	82	79 Å²	79	57%	0.573	42%	0.416	S	S	*	.	H	α-helix	trans	-64.5	-40.5	173	-50.2	0	0	0	0	111.9	N797 T802 V803	N797-S799 VanDerWaalsContact C-N 3.27Å; N797-S799 PolarHBondContact O-N 3.39Å; S799-T802 PolarHBondContact O-N 3.12Å; S799-V803 WeakPolarHBondContact O-CG2 3.46Å; S799-V803 PolarHBondContact O-N 3.31Å
800	N	84.7	Confident	84.1	Confident	78 Å²	78	73.2 Å²	73.2	42%	0.417	40%	0.4	S	S	.	.	H	α-helix	trans	-71.6	-41.3	177.5	-70	-38.5	0	0	0	110.7	F795 N797 T802 V803 H804	F795-N800 HydrophobicContact CB-CB 4.21Å; F795-N800 HydrophobicContact CD1-CB 3.89Å; F795-N800 HydrophobicContact CG-CB 4.33Å; N797-N800 WeakPolarHBondContact O-CB 3.42Å; N797-N800 PolarHBondContact O-N 3.44Å; N797-N800 PolarHBondContact OD1-ND2 3.12Å; N800-T802 VanDerWaalsContact C-N 3.32Å; N800-T802 PolarHBondContact O-N 2.9Å; N800-V803 PolarHBondContact O-N 3.46Å; N800-H804 WeakPolarHBondContact O-CB 3.44Å; N800-H804 PolarHBondContact O-N 3.31Å
801	L	86.7	Confident	84.1	Confident	16 Å²	16	71.3 Å²	71.3	8%	0.084	40%	0.396	C	S	.	.	H	α-helix	trans	-57.2	-44	169.3	170.8	60	0	0	0	111.8	D786 C788 F795 N797 C798 H804 R805	D786-L801 HydrophobicContact CB-CB 3.95Å; D786-L801 HydrophobicContact CB-CD2 3.8Å; C788-L801 VanDerWaalsContact CA-CD1 3.44Å; C788-L801 HydrophobicContact CB-CD1 3.43Å; C788-L801 VanDerWaalsContact CB-CD1 3.43Å; F795-L801 HydrophobicContact CB-CB 4.37Å; F795-L801 HydrophobicContact CD2-CB 4.1Å; F795-L801 HydrophobicContact CD2-CD1 4.15Å; F795-L801 HydrophobicContact CE2-CD1 4.4Å; F795-L801 HydrophobicContact CG-CB 4.39Å; N797-L801 PolarHBondContact O-N 3.38Å; N797-L801 VanDerWaalsContact O-N 3.09Å; C798-L801 PolarHBondContact O-N 3.4Å; L801-H804 CarbonylContact O-C 3.6Å; L801-H804 WeakPolarHBondContact O-CA 3.32Å; L801-H804 WeakPolarHBondContact O-CB 3.5Å; L801-H804 PolarHBondContact O-N 3.39Å; L801-H804 VanDerWaalsContact O-N 3.14Å; L801-R805 PolarHBondContact O-N 3.07Å
802	T	85.2	Confident	84.1	Confident	52 Å²	52	74.4 Å²	74.4	32%	0.319	40%	0.401	S	S	.	.	H	α-helix	trans	-68.6	-40.3	-177.1	-65.6	0	0	0	0	112.2	C798 S799 N800 H804 R805 R806	C798-T802 VanDerWaalsContact O-CB 3.32Å; C798-T802 WeakPolarHBondContact O-CB 3.39Å; C798-T802 PolarHBondContact O-N 3.34Å; C798-T802 PolarHBondContact O-OG1 2.97Å; S799-T802 PolarHBondContact O-N 3.12Å; N800-T802 VanDerWaalsContact C-N 3.32Å; N800-T802 PolarHBondContact O-N 2.9Å; T802-H804 VanDerWaalsContact C-N 3.28Å; T802-H804 PolarHBondContact O-N 3.49Å; T802-R805 PolarHBondContact O-N 2.94Å; T802-R805 PolarHBondContact OG1-NH2 3.36Å; T802-R806 PolarHBondContact O-N 2.67Å
803	V	84.3	Confident	84.1	Confident	42 Å²	42	75.7 Å²	75.7	26%	0.255	40%	0.399	S	S	.	.	H	α-helix	trans	-65.9	-31.9	170.9	174.2	0	0	0	0	111.5	S799 N800 Q825	S799-V803 WeakPolarHBondContact O-CG2 3.46Å; S799-V803 PolarHBondContact O-N 3.31Å; N800-V803 PolarHBondContact O-N 3.46Å; V803-Q825 HydrophobicContact CG1-CB 4.02Å; V803-Q825 HydrophobicContact CG1-CG 4.07Å
804	H	87	Confident	84	Confident	29 Å²	29	73.6 Å²	73.6	13%	0.134	39%	0.389	C	S	.	.	H	α-helix	trans	-72.9	-37.3	173.4	-179.6	47.3	0	0	0	113.3	C788 C791 F795 N800 L801 T802 R806 S807 H808	C788-H804 VanDerWaalsContact SG-CD2 3.6Å; C791-H804 PolarHBondContact SG-NE2 2.76Å; F795-H804 HydrophobicContact CE1-CB 4.09Å; F795-H804 HydrophobicContact CE2-CB 3.94Å; F795-H804 AromaticContact CE2-CD2 3.32Å; F795-H804 WeakPolarHBondContact CE2-CD2 3.22Å; F795-H804 AromaticContact CE2-CG 3.79Å; F795-H804 HydrophobicContact CZ-CB 3.54Å; F795-H804 AromaticContact CZ-CD2 3.34Å; F795-H804 WeakPolarHBondContact CZ-CD2 3.24Å; F795-H804 AromaticContact CZ-CG 3.38Å; N800-H804 WeakPolarHBondContact O-CB 3.44Å; N800-H804 PolarHBondContact O-N 3.31Å; L801-H804 CarbonylContact O-C 3.6Å; L801-H804 WeakPolarHBondContact O-CA 3.32Å; L801-H804 WeakPolarHBondContact O-CB 3.5Å; L801-H804 PolarHBondContact O-N 3.39Å; L801-H804 VanDerWaalsContact O-N 3.14Å; T802-H804 VanDerWaalsContact C-N 3.28Å; T802-H804 PolarHBondContact O-N 3.49Å; H804-R806 PolarHBondContact O-N 2.89Å; H804-S807 PolarHBondContact CE1-OG 2.8Å; H804-S807 VanDerWaalsContact CE1-OG 3.31Å; H804-S807 PolarHBondContact ND1-OG 3.14Å; H804-S807 WeakPolarHBondContact O-CA 3.5Å; H804-S807 WeakPolarHBondContact O-CB 3.42Å; H804-S807 PolarHBondContact O-N 3.21Å; H804-S807 PolarHBondContact O-OG 3.06Å; H804-H808 AromaticContact CD2-NE2 3.79Å; H804-H808 AromaticContact CE1-CE1 3.94Å; H804-H808 AromaticContact CE1-NE2 3.34Å; H804-H808 PolarHBondContact CE1-NE2 3.13Å; H804-H808 VanDerWaalsContact CE1-NE2 3.34Å; H804-H808 AromaticContact NE2-CD2 3.93Å; H804-H808 AromaticContact NE2-CE1 3.84Å; H804-H808 AromaticContact NE2-NE2 3Å; H804-H808 PolarHBondContact NE2-NE2 3.28Å
805	R	85.7	Confident	83.9	Confident	81 Å²	81	76.4 Å²	76.4	31%	0.306	39%	0.393	S	S	.	.	H	α-helix	trans	-58.7	-35.5	178.4	-171.9	166.3	57.5	-108.2	-6.8	111.7	Y790 L801 T802 S807 H808 T809	Y790-R805 HydrophobicContact CD2-CG 4.46Å; Y790-R805 HydrophobicContact CE2-CG 4.12Å; L801-R805 PolarHBondContact O-N 3.07Å; T802-R805 PolarHBondContact O-N 2.94Å; T802-R805 PolarHBondContact OG1-NH2 3.36Å; R805-S807 PolarHBondContact O-N 3.45Å; R805-S807 VanDerWaalsContact O-N 3.15Å; R805-H808 PolarHBondContact O-N 2.83Å; R805-T809 PolarHBondContact O-N 3.07Å; R805-T809 VanDerWaalsContact O-N 3.15Å
806	R	85	Confident	84	Confident	68 Å²	68	74.7 Å²	74.7	26%	0.257	39%	0.387	S	S	.	.	T	Hydrogen-bonded Turn	trans	-59.1	-19.9	170.4	-68	-179.8	179.7	166.5	0.2	115.2	T802 H804 H808 T809 G810 E811 A824	T802-R806 PolarHBondContact O-N 2.67Å; H804-R806 PolarHBondContact O-N 2.89Å; R806-H808 VanDerWaalsContact C-N 3.34Å; R806-T809 WeakPolarHBondContact CA-OG1 3.49Å; R806-G810 PolarHBondContact O-N 3.19Å; R806-E811 PolarHBondContact O-N 3.41Å; R806-A824 HydrophobicContact CB-CB 3.74Å; R806-A824 WeakPolarHBondContact CD-O 3.39Å; R806-A824 PolarHBondContact NH1-O 2.98Å
807	S	82.2	Confident	83.8	Confident	62 Å²	62	74.2 Å²	74.2	43%	0.434	39%	0.388	S	S	.	.	T	Hydrogen-bonded Turn	trans	-81.9	-11.6	173.4	67.8	0	0	0	0	114.1	H804 R805	H804-S807 PolarHBondContact CE1-OG 2.8Å; H804-S807 VanDerWaalsContact CE1-OG 3.31Å; H804-S807 PolarHBondContact ND1-OG 3.14Å; H804-S807 WeakPolarHBondContact O-CA 3.5Å; H804-S807 WeakPolarHBondContact O-CB 3.42Å; H804-S807 PolarHBondContact O-N 3.21Å; H804-S807 PolarHBondContact O-OG 3.06Å; R805-S807 PolarHBondContact O-N 3.45Å; R805-S807 VanDerWaalsContact O-N 3.15Å
808	H	82.7	Confident	83.6	Confident	71 Å²	71	75.6 Å²	75.6	33%	0.329	40%	0.395	S	S	.	.	T	Hydrogen-bonded Turn	trans	-96.5	-41.6	170.4	-58.8	-67.7	0	0	0	111.8	C788 Y790 H804 R805 R806 G810	C788-H808 VanDerWaalsContact SG-CD2 3.6Å; C788-H808 PolarHBondContact SG-NE2 3.27Å; Y790-H808 HydrophobicContact CD1-CB 4.22Å; Y790-H808 HydrophobicContact CD2-CB 4.07Å; Y790-H808 AromaticContact CD2-CD2 3.99Å; Y790-H808 HydrophobicContact CG-CB 3.86Å; Y790-H808 AromaticContact CG-CD2 4Å; Y790-H808 AromaticContact CG-CG 3.84Å; H804-H808 AromaticContact CD2-NE2 3.79Å; H804-H808 AromaticContact CE1-CE1 3.94Å; H804-H808 AromaticContact CE1-NE2 3.34Å; H804-H808 PolarHBondContact CE1-NE2 3.13Å; H804-H808 VanDerWaalsContact CE1-NE2 3.34Å; H804-H808 AromaticContact NE2-CD2 3.93Å; H804-H808 AromaticContact NE2-CE1 3.84Å; H804-H808 AromaticContact NE2-NE2 3Å; H804-H808 PolarHBondContact NE2-NE2 3.28Å; R805-H808 PolarHBondContact O-N 2.83Å; R806-H808 VanDerWaalsContact C-N 3.34Å; H808-G810 PolarHBondContact O-N 2.97Å
809	T	80.3	Confident	83.5	Confident	68 Å²	68	73.8 Å²	73.8	42%	0.417	38%	0.383	S	S	.	.	S	Bend	trans	-71.4	-10.9	176	60	0	0	0	0	113.4	R805 R806 E811	R805-T809 PolarHBondContact O-N 3.07Å; R805-T809 VanDerWaalsContact O-N 3.15Å; R806-T809 WeakPolarHBondContact CA-OG1 3.49Å; T809-E811 WeakPolarHBondContact CB-OE2 3.46Å; T809-E811 PolarHBondContact O-N 3.3Å; T809-E811 VanDerWaalsContact O-N 3.15Å; T809-E811 VanDerWaalsContact OG1-CD 3.3Å; T809-E811 WeakPolarHBondContact OG1-CG 3.36Å; T809-E811 PolarHBondContact OG1-OE2 2.94Å
810	G	78.7	Confident	83.3	Confident	39 Å²	39	77.7 Å²	77.7	40%	0.402	40%	0.397	S	S	.	.			trans	72.8	-3.4	-177.5	0	0	0	0	0	114.5	R806 H808 R812	R806-G810 PolarHBondContact O-N 3.19Å; H808-G810 PolarHBondContact O-N 2.97Å; G810-R812 WeakPolarHBondContact O-CG 3.38Å; G810-R812 PolarHBondContact O-N 3.2Å
811	E	80.8	Confident	83.2	Confident	109 Å²	109	76.9 Å²	76.9	51%	0.509	39%	0.388	S	S	.	.			trans	-62.6	121.2	-176	-66.6	168.8	128.4	0	0	111.9	R806 T809 P813	R806-E811 PolarHBondContact O-N 3.41Å; T809-E811 WeakPolarHBondContact CB-OE2 3.46Å; T809-E811 PolarHBondContact O-N 3.3Å; T809-E811 VanDerWaalsContact O-N 3.15Å; T809-E811 VanDerWaalsContact OG1-CD 3.3Å; T809-E811 WeakPolarHBondContact OG1-CG 3.36Å; T809-E811 PolarHBondContact OG1-OE2 2.94Å; E811-P813 WeakPolarHBondContact O-CD 3.38Å
812	R	84.7	Confident	83.1	Confident	118 Å²	118	77.2 Å²	77.2	45%	0.445	39%	0.394	S	S	.	.			trans	-127	69.3	-178.3	-68.8	162.4	82	152.7	0.4	110.7	G810 Y814 A822 C823	G810-R812 WeakPolarHBondContact O-CG 3.38Å; G810-R812 PolarHBondContact O-N 3.2Å; R812-Y814 PolarHBondContact O-N 2.72Å; R812-Y814 VanDerWaalsContact O-N 3.16Å; R812-A822 HydrophobicContact CB-CB 3.83Å; R812-A822 VanDerWaalsContact CZ-O 3.24Å; R812-A822 PolarHBondContact NE-O 2.97Å; R812-A822 PolarHBondContact NH2-O 2.9Å; R812-C823 CarbonylContact C-O 3.55Å; R812-C823 VanDerWaalsContact C-O 3.27Å; R812-C823 WeakPolarHBondContact CA-O 3.48Å
813	P	83.1	Confident	83	Confident	77 Å²	77	75 Å²	75	50%	0.5	38%	0.381	S	S	.	.			trans	-62	-27	-171.4	-23.1	34.9	0	0	0	114.2	E811 K815	E811-P813 WeakPolarHBondContact O-CD 3.38Å; P813-K815 PolarHBondContact O-N 3.37Å; P813-K815 VanDerWaalsContact O-N 3.17Å
814	Y	84.6	Confident	83.1	Confident	79 Å²	79	74 Å²	74	31%	0.31	38%	0.376	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-91.2	80.3	-176.3	-53	-78.6	0	0	0	109.9	R812 A822 C823 Q825 S826	R812-Y814 PolarHBondContact O-N 2.72Å; R812-Y814 VanDerWaalsContact O-N 3.16Å; Y814-A822 CarbonylContact O-C 3.52Å; Y814-A822 WeakPolarHBondContact O-CA 3.39Å; Y814-C823 WeakPolarHBondContact CB-O 3.47Å; Y814-C823 WeakPolarHBondContact CD2-O 3.47Å; Y814-C823 PolarHBondContact N-O 3.17Å; Y814-C823 PolarHBondContact O-N 3.44Å; Y814-Q825 VanDerWaalsContact CD2-C 3.44Å; Y814-S826 VanDerWaalsContact CD2-N 3.33Å; Y814-S826 VanDerWaalsContact CE2-N 3.34Å
815	K	85.2	Confident	83	Confident	152 Å²	152	75.3 Å²	75.3	66%	0.661	38%	0.382	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-73.5	146.2	169.3	62.9	-177.5	-179.4	178.8	0	111.4	P813 A822 L829	P813-K815 PolarHBondContact O-N 3.37Å; P813-K815 VanDerWaalsContact O-N 3.17Å; K815-A822 HydrophobicContact CB-CB 4.36Å; K815-L829 VanDerWaalsContact O-CD2 3.29Å; K815-L829 WeakPolarHBondContact O-CD2 3.48Å
816	C	87.1	Confident	83.1	Confident	13 Å²	13	74.2 Å²	74.2	9%	0.088	39%	0.387	C	S	.	.			trans	-86.2	144.9	167.5	-179.7	0	0	0	0	110.2	L818 C819 Y821 L829 H832 M833 H836	C816-L818 PolarHBondContact SG-N 3.1Å; C816-C819 WeakPolarHBondContact CB-O 3.08Å; C816-Y821 WeakPolarHBondContact CB-O 3.36Å; C816-Y821 PolarHBondContact N-O 2.66Å; C816-L829 HydrophobicContact CB-CD1 3.78Å; C816-H832 VanDerWaalsContact SG-CD2 3.57Å; C816-H832 PolarHBondContact SG-NE2 3.42Å; C816-H832 VanDerWaalsContact SG-NE2 3.37Å; C816-M833 HydrophobicContact CB-SD 4.4Å; C816-M833 PolarHBondContact SG-SD 3.43Å; C816-H836 PolarHBondContact SG-NE2 3.46Å
817	E	79.9	Confident	83.1	Confident	172 Å²	172	73.5 Å²	73.5	80%	0.804	39%	0.392	S	S	*	.	S	Bend	trans	-89.8	-11.2	178	-67.8	158.9	-174.3	0	0	112.6
818	L	79.2	Confident	83.2	Confident	110 Å²	110	75.5 Å²	75.5	58%	0.576	39%	0.393	S	S	*	.	S	Bend	trans	-113.1	-7	-174.3	-59.9	176.2	0	0	0	113.6	C816 M833 H836	C816-L818 PolarHBondContact SG-N 3.1Å; L818-M833 HydrophobicContact CD1-CE 3.86Å; L818-M833 HydrophobicContact CG-CE 4.29Å; L818-H836 HydrophobicContact CB-CB 4.47Å; L818-H836 HydrophobicContact CD1-CB 3.57Å
819	C	81.4	Confident	83.4	Confident	32 Å²	32	73.6 Å²	73.6	22%	0.216	39%	0.385	C	S	.	.	S	Bend	trans	-164.2	173.4	161.1	73.1	0	0	0	0	111.2	C816 Y821 H832	C816-C819 WeakPolarHBondContact CB-O 3.08Å; C819-Y821 PolarHBondContact O-N 3.27Å; C819-H832 PolarHBondContact SG-CE1 2.83Å; C819-H832 PolarHBondContact SG-NE2 3.39Å
820	N	80.3	Confident	83.6	Confident	163 Å²	163	75 Å²	75	87%	0.872	39%	0.394	S	S	*	.	S	Bend	trans	-68.9	19.1	-176.5	-60.6	-31.1	0	0	0	115.6	A822	N820-A822 PolarHBondContact O-N 2.61Å
821	Y	82.8	Confident	83.8	Confident	61 Å²	61	82.3 Å²	82.3	24%	0.239	41%	0.41	C	S	.	.			trans	-81.8	111.8	177.8	-178.8	-95.5	0	0	0	111.5	C816 C819 C823 H832 M851	C816-Y821 WeakPolarHBondContact CB-O 3.36Å; C816-Y821 PolarHBondContact N-O 2.66Å; C819-Y821 PolarHBondContact O-N 3.27Å; Y821-C823 HydrophobicContact CE1-CB 3.88Å; Y821-H832 WeakPolarHBondContact CB-NE2 3.45Å; Y821-H832 HydrophobicContact CD1-CB 3.98Å; Y821-H832 AromaticContact CD1-CD2 3.58Å; Y821-H832 AromaticContact CD1-CG 3.49Å; Y821-H832 VanDerWaalsContact CD1-CG 3.49Å; Y821-H832 AromaticContact CD1-ND1 3.79Å; Y821-H832 AromaticContact CD1-NE2 3.92Å; Y821-H832 HydrophobicContact CE1-CB 3.92Å; Y821-H832 AromaticContact CE1-CG 3.93Å; Y821-H832 AromaticContact CG-CE1 3.81Å; Y821-H832 AromaticContact CG-ND1 3.87Å; Y821-H832 AromaticContact CG-NE2 3.94Å; Y821-M851 HydrophobicContact CD2-CE 4.33Å
822	A	85.4	Confident	84	Confident	24 Å²	24	78 Å²	78	20%	0.198	39%	0.39	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-110.4	151.5	169.1	0	0	0	0	0	111.9	R812 Y814 K815 N820	R812-A822 HydrophobicContact CB-CB 3.83Å; R812-A822 VanDerWaalsContact CZ-O 3.24Å; R812-A822 PolarHBondContact NE-O 2.97Å; R812-A822 PolarHBondContact NH2-O 2.9Å; Y814-A822 CarbonylContact O-C 3.52Å; Y814-A822 WeakPolarHBondContact O-CA 3.39Å; K815-A822 HydrophobicContact CB-CB 4.36Å; N820-A822 PolarHBondContact O-N 2.61Å
823	C	83.6	Confident	83.8	Confident	6 Å²	6	75.3 Å²	75.3	4%	0.041	38%	0.382	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-147.5	162.6	176.8	66.3	0	0	0	0	114	R812 Y814 Y821 Q825 K828 L829	R812-C823 CarbonylContact C-O 3.55Å; R812-C823 VanDerWaalsContact C-O 3.27Å; R812-C823 WeakPolarHBondContact CA-O 3.48Å; Y814-C823 WeakPolarHBondContact CB-O 3.47Å; Y814-C823 WeakPolarHBondContact CD2-O 3.47Å; Y814-C823 PolarHBondContact N-O 3.17Å; Y814-C823 PolarHBondContact O-N 3.44Å; Y821-C823 HydrophobicContact CE1-CB 3.88Å; C823-Q825 VanDerWaalsContact C-N 3.34Å; C823-Q825 PolarHBondContact O-N 2.78Å; C823-Q825 PolarHBondContact SG-O 3.39Å; C823-Q825 VanDerWaalsContact SG-O 3.36Å; C823-K828 HydrophobicContact CB-CB 4.21Å; C823-L829 PolarHBondContact SG-N 3.37Å; C823-L829 VanDerWaalsContact SG-N 3.38Å
824	A	86.3	Confident	83.8	Confident	19 Å²	19	78.8 Å²	78.8	16%	0.157	39%	0.39	C	S	.	.	S	Bend	trans	-80.9	-6.3	-175.7	0	0	0	0	0	115.2	R806	R806-A824 HydrophobicContact CB-CB 3.74Å; R806-A824 WeakPolarHBondContact CD-O 3.39Å; R806-A824 PolarHBondContact NH1-O 2.98Å
825	Q	84.1	Confident	83	Confident	58 Å²	58	76.1 Å²	76.1	27%	0.271	38%	0.382	S	S	.	.	S	Bend	trans	-145.7	126.1	-170.4	-169	-175.7	12.5	0	0	111.6	V803 Y814 C823 S827 K828	V803-Q825 HydrophobicContact CG1-CB 4.02Å; V803-Q825 HydrophobicContact CG1-CG 4.07Å; Y814-Q825 VanDerWaalsContact CD2-C 3.44Å; C823-Q825 VanDerWaalsContact C-N 3.34Å; C823-Q825 PolarHBondContact O-N 2.78Å; C823-Q825 PolarHBondContact SG-O 3.39Å; C823-Q825 VanDerWaalsContact SG-O 3.36Å; Q825-S827 VanDerWaalsContact C-N 3.3Å; Q825-S827 WeakPolarHBondContact CG-OG 3.31Å; Q825-S827 PolarHBondContact NE2-OG 3Å; Q825-S827 PolarHBondContact O-N 3.42Å; Q825-K828 HydrophobicContact CB-CD 4.46Å; Q825-K828 WeakPolarHBondContact O-CB 3.4Å; Q825-K828 PolarHBondContact O-N 3.11Å
826	S	86.9	Confident	82.3	Confident	57 Å²	57	69.7 Å²	69.7	40%	0.399	35%	0.354	S	S	.	.	H	α-helix	trans	-52.7	-40.9	-175.9	52.7	0	0	0	0	114	Y814 K828 L829 T830	Y814-S826 VanDerWaalsContact CD2-N 3.33Å; Y814-S826 VanDerWaalsContact CE2-N 3.34Å; S826-K828 PolarHBondContact O-N 3.47Å; S826-K828 VanDerWaalsContact O-N 3.15Å; S826-L829 CarbonylContact O-C 3.55Å; S826-L829 WeakPolarHBondContact O-CA 3.42Å; S826-L829 WeakPolarHBondContact O-CB 3.44Å; S826-L829 PolarHBondContact O-N 2.91Å; S826-T830 PolarHBondContact O-N 3.16Å; S826-T830 PolarHBondContact O-OG1 2.89Å; S826-T830 VanDerWaalsContact O-OG1 3.13Å
827	S	85.7	Confident	81.1	Confident	53 Å²	53	72.4 Å²	72.4	37%	0.371	38%	0.384	S	S	.	.	H	α-helix	trans	-60.2	-25.4	179.2	60.7	0	0	0	0	114.2	Q825 R831	Q825-S827 VanDerWaalsContact C-N 3.3Å; Q825-S827 WeakPolarHBondContact CG-OG 3.31Å; Q825-S827 PolarHBondContact NE2-OG 3Å; Q825-S827 PolarHBondContact O-N 3.42Å; S827-R831 WeakPolarHBondContact O-CB 3.49Å; S827-R831 PolarHBondContact O-N 3Å
828	K	84.5	Confident	79.9	Confident	105 Å²	105	70.1 Å²	70.1	46%	0.457	37%	0.373	S	S	.	.	H	α-helix	trans	-78.2	-38.6	172.8	-63.7	-179.6	-177.1	176.5	0	110.9	C823 Q825 S826 R831 H832	C823-K828 HydrophobicContact CB-CB 4.21Å; Q825-K828 HydrophobicContact CB-CD 4.46Å; Q825-K828 WeakPolarHBondContact O-CB 3.4Å; Q825-K828 PolarHBondContact O-N 3.11Å; S826-K828 PolarHBondContact O-N 3.47Å; S826-K828 VanDerWaalsContact O-N 3.15Å; K828-R831 PolarHBondContact O-N 3.37Å; K828-H832 WeakPolarHBondContact O-CB 3.4Å; K828-H832 PolarHBondContact O-N 3.17Å
829	L	85.8	Confident	78.8	Confident	30 Å²	30	69.4 Å²	69.4	16%	0.157	37%	0.369	C	S	.	.	H	α-helix	trans	-63.8	-48.3	171.4	178.1	61.2	0	0	0	111.2	K815 C816 C823 S826 R831 H832 M833	K815-L829 VanDerWaalsContact O-CD2 3.29Å; K815-L829 WeakPolarHBondContact O-CD2 3.48Å; C816-L829 HydrophobicContact CB-CD1 3.78Å; C823-L829 PolarHBondContact SG-N 3.37Å; C823-L829 VanDerWaalsContact SG-N 3.38Å; S826-L829 CarbonylContact O-C 3.55Å; S826-L829 WeakPolarHBondContact O-CA 3.42Å; S826-L829 WeakPolarHBondContact O-CB 3.44Å; S826-L829 PolarHBondContact O-N 2.91Å; L829-R831 VanDerWaalsContact C-N 3.27Å; L829-R831 PolarHBondContact O-N 3.36Å; L829-H832 CarbonylContact O-C 3.56Å; L829-H832 WeakPolarHBondContact O-CA 3.38Å; L829-H832 WeakPolarHBondContact O-CB 3.37Å; L829-H832 PolarHBondContact O-N 3.14Å; L829-M833 HydrophobicContact CD1-CG 3.92Å; L829-M833 HydrophobicContact CD1-SD 4.1Å; L829-M833 HydrophobicContact CG-CG 4.11Å; L829-M833 WeakPolarHBondContact O-CG 3.37Å; L829-M833 PolarHBondContact O-N 3.48Å
830	T	85	Confident	77.5	Confident	99 Å²	99	71.4 Å²	71.4	61%	0.607	40%	0.395	S	S	*	.	H	α-helix	trans	-58.1	-39.9	178.4	-46.9	0	0	0	0	112	S826 M833 K834	S826-T830 PolarHBondContact O-N 3.16Å; S826-T830 PolarHBondContact O-OG1 2.89Å; S826-T830 VanDerWaalsContact O-OG1 3.13Å; T830-M833 PolarHBondContact O-N 3.29Å; T830-K834 PolarHBondContact O-N 3.11Å; T830-K834 VanDerWaalsContact O-N 3.16Å
831	R	83.8	Confident	76.2	Confident	192 Å²	192	71.7 Å²	71.7	73%	0.725	39%	0.389	S	S	*	.	H	α-helix	trans	-64.4	-40.1	174.8	-169.1	-177.2	-58.6	-179.8	0.1	112	S827 K828 L829 K834	S827-R831 WeakPolarHBondContact O-CB 3.49Å; S827-R831 PolarHBondContact O-N 3Å; K828-R831 PolarHBondContact O-N 3.37Å; L829-R831 VanDerWaalsContact C-N 3.27Å; L829-R831 PolarHBondContact O-N 3.36Å; R831-K834 PolarHBondContact O-N 2.87Å
832	H	84.5	Confident	74.8	Confident	19 Å²	19	76.2 Å²	76.2	9%	0.088	41%	0.412	C	S	.	.	H	α-helix	trans	-70.4	-39.7	176.3	173.8	77.5	0	0	0	112.9	C816 C819 Y821 K828 L829 K834 T835 H836	C816-H832 VanDerWaalsContact SG-CD2 3.57Å; C816-H832 PolarHBondContact SG-NE2 3.42Å; C816-H832 VanDerWaalsContact SG-NE2 3.37Å; C819-H832 PolarHBondContact SG-CE1 2.83Å; C819-H832 PolarHBondContact SG-NE2 3.39Å; Y821-H832 WeakPolarHBondContact CB-NE2 3.45Å; Y821-H832 HydrophobicContact CD1-CB 3.98Å; Y821-H832 AromaticContact CD1-CD2 3.58Å; Y821-H832 AromaticContact CD1-CG 3.49Å; Y821-H832 VanDerWaalsContact CD1-CG 3.49Å; Y821-H832 AromaticContact CD1-ND1 3.79Å; Y821-H832 AromaticContact CD1-NE2 3.92Å; Y821-H832 HydrophobicContact CE1-CB 3.92Å; Y821-H832 AromaticContact CE1-CG 3.93Å; Y821-H832 AromaticContact CG-CE1 3.81Å; Y821-H832 AromaticContact CG-ND1 3.87Å; Y821-H832 AromaticContact CG-NE2 3.94Å; K828-H832 WeakPolarHBondContact O-CB 3.4Å; K828-H832 PolarHBondContact O-N 3.17Å; L829-H832 CarbonylContact O-C 3.56Å; L829-H832 WeakPolarHBondContact O-CA 3.38Å; L829-H832 WeakPolarHBondContact O-CB 3.37Å; L829-H832 PolarHBondContact O-N 3.14Å; H832-K834 PolarHBondContact O-N 3.45Å; H832-T835 WeakPolarHBondContact O-CA 3.46Å; H832-T835 WeakPolarHBondContact O-CB 3.45Å; H832-T835 PolarHBondContact O-N 2.85Å; H832-T835 PolarHBondContact O-OG1 2.82Å; H832-H836 AromaticContact CD2-CD2 3.89Å; H832-H836 AromaticContact CD2-NE2 3.75Å; H832-H836 AromaticContact CE1-NE2 3.54Å; H832-H836 AromaticContact NE2-CD2 3.57Å; H832-H836 AromaticContact NE2-NE2 2.96Å; H832-H836 PolarHBondContact NE2-NE2 3.38Å; H832-H836 PolarHBondContact O-N 3.2Å
833	M	80.7	Confident	74	Confident	60 Å²	60	76.5 Å²	76.5	30%	0.296	41%	0.412	S	S	.	.	H	α-helix	trans	-60.9	-29.8	172.5	-67.8	-54.9	-70.5	0	0	111.9	C816 L818 L829 T830 T835 H836 G837	C816-M833 HydrophobicContact CB-SD 4.4Å; C816-M833 PolarHBondContact SG-SD 3.43Å; L818-M833 HydrophobicContact CD1-CE 3.86Å; L818-M833 HydrophobicContact CG-CE 4.29Å; L829-M833 HydrophobicContact CD1-CG 3.92Å; L829-M833 HydrophobicContact CD1-SD 4.1Å; L829-M833 HydrophobicContact CG-CG 4.11Å; L829-M833 WeakPolarHBondContact O-CG 3.37Å; L829-M833 PolarHBondContact O-N 3.48Å; T830-M833 PolarHBondContact O-N 3.29Å; M833-T835 VanDerWaalsContact C-N 3.29Å; M833-T835 PolarHBondContact O-N 2.85Å; M833-H836 PolarHBondContact O-N 2.92Å; M833-H836 VanDerWaalsContact O-N 3.17Å; M833-G837 PolarHBondContact O-N 2.87Å
834	K	82.2	Confident	73.4	Confident	150 Å²	150	80.1 Å²	80.1	65%	0.652	43%	0.425	S	S	*	.	H	α-helix	trans	-68.8	-24.7	171.5	-166	167.3	-176.7	174.8	0	113.4	T830 R831 H832 Q838	T830-K834 PolarHBondContact O-N 3.11Å; T830-K834 VanDerWaalsContact O-N 3.16Å; R831-K834 PolarHBondContact O-N 2.87Å; H832-K834 PolarHBondContact O-N 3.45Å; K834-Q838 PolarHBondContact O-N 3.4Å
835	T	69.3	Low	73	Confident	24 Å²	24	84.9 Å²	84.9	15%	0.147	44%	0.439	C	S	.	.	H	α-helix	trans	-67.1	-38.1	168.8	-48	0	0	0	0	111	H832 M833 Q838 V843	H832-T835 WeakPolarHBondContact O-CA 3.46Å; H832-T835 WeakPolarHBondContact O-CB 3.45Å; H832-T835 PolarHBondContact O-N 2.85Å; H832-T835 PolarHBondContact O-OG1 2.82Å; M833-T835 VanDerWaalsContact C-N 3.29Å; M833-T835 PolarHBondContact O-N 2.85Å; T835-Q838 PolarHBondContact O-N 3.5Å; T835-V843 HydrophobicContact CG2-CG1 4.3Å
836	H	69.8	Low	73	Confident	16 Å²	16	82.1 Å²	82.1	7%	0.074	43%	0.426	C	S	.	.	H	α-helix	trans	-71.6	-38.7	173.2	-66	-71.3	0	0	0	113	C816 L818 H832 M833 Q838 I839	C816-H836 PolarHBondContact SG-NE2 3.46Å; L818-H836 HydrophobicContact CB-CB 4.47Å; L818-H836 HydrophobicContact CD1-CB 3.57Å; H832-H836 AromaticContact CD2-CD2 3.89Å; H832-H836 AromaticContact CD2-NE2 3.75Å; H832-H836 AromaticContact CE1-NE2 3.54Å; H832-H836 AromaticContact NE2-CD2 3.57Å; H832-H836 AromaticContact NE2-NE2 2.96Å; H832-H836 PolarHBondContact NE2-NE2 3.38Å; H832-H836 PolarHBondContact O-N 3.2Å; M833-H836 PolarHBondContact O-N 2.92Å; M833-H836 VanDerWaalsContact O-N 3.17Å; H836-Q838 PolarHBondContact O-N 2.86Å; H836-I839 HydrophobicContact CB-CD1 4.11Å; H836-I839 VanDerWaalsContact O-CB 3.24Å; H836-I839 WeakPolarHBondContact O-CB 3.46Å; H836-I839 WeakPolarHBondContact O-CG1 3.45Å; H836-I839 PolarHBondContact O-N 3Å
837	G	61.6	Low	72.7	Confident	70 Å²	70	84.9 Å²	84.9	72%	0.722	44%	0.436	S	S	*	.	T	Hydrogen-bonded Turn	trans	-64.6	-8.5	175.4	0	0	0	0	0	115	M833	M833-G837 PolarHBondContact O-N 2.87Å
838	Q	56	Low	72.4	Confident	124 Å²	124	87.1 Å²	87.1	58%	0.579	44%	0.443	S	S	*	.	T	Hydrogen-bonded Turn	trans	-100.4	2.8	174	-148.9	80.7	24.6	0	0	112.6	K834 T835 H836 G840 K841	K834-Q838 PolarHBondContact O-N 3.4Å; T835-Q838 PolarHBondContact O-N 3.5Å; H836-Q838 PolarHBondContact O-N 2.86Å; Q838-G840 PolarHBondContact O-N 3.48Å; Q838-K841 PolarHBondContact O-N 3.38Å
839	I	54.5	Low	72.2	Confident	95 Å²	95	84.3 Å²	84.3	49%	0.487	44%	0.436	S	S	.	.	T	Hydrogen-bonded Turn	trans	-62.4	111.8	177.8	-71.5	170	0	0	0	109.4	H836 V843	H836-I839 HydrophobicContact CB-CD1 4.11Å; H836-I839 VanDerWaalsContact O-CB 3.24Å; H836-I839 WeakPolarHBondContact O-CB 3.46Å; H836-I839 WeakPolarHBondContact O-CG1 3.45Å; H836-I839 PolarHBondContact O-N 3Å; I839-V843 HydrophobicContact CG1-CG2 4.13Å
840	G	55.3	Low	71.7	Confident	74 Å²	74	87.8 Å²	87.8	76%	0.763	45%	0.451	S	S	*	.	T	Hydrogen-bonded Turn	trans	150.7	-27.7	-173.4	0	0	0	0	0	112.3	Q838	Q838-G840 PolarHBondContact O-N 3.48Å
841	K	51.6	Low	71.4	Confident	169 Å²	169	85.8 Å²	85.8	74%	0.735	44%	0.436	S	S	*	.	S	Bend	trans	-141	105.1	170.4	-62.7	-175.2	-178	178.9	0	110.5	Q838	Q838-K841 PolarHBondContact O-N 3.38Å
842	E	53.4	Low	71.2	Confident	157 Å²	157	77.3 Å²	77.3	73%	0.734	41%	0.405	S	S	*	.			trans	53.2	72.7	165	-65.3	173.1	-121.6	0	0	116.7
843	V	69.1	Low	70.9	Confident	30 Å²	30	77.9 Å²	77.9	18%	0.182	41%	0.408	C	S	.	.			trans	-97.8	115.6	159.6	177.9	0	0	0	0	108.2	T835 I839 P852	T835-V843 HydrophobicContact CG2-CG1 4.3Å; I839-V843 HydrophobicContact CG1-CG2 4.13Å; V843-P852 HydrophobicContact CG1-CB 3.53Å
844	Y	71.7	Confident	70.7	Confident	81 Å²	81	78.9 Å²	78.9	32%	0.318	42%	0.421	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-71.6	131.2	-179.6	-70	-85.2	0	0	0	110.3	P852 F853 Y856 L859	Y844-P852 CarbonylContact O-C 3.55Å; Y844-F853 PolarHBondContact N-O 2.94Å; Y844-F853 PolarHBondContact O-N 3.27Å; Y844-Y856 AromaticContact CD1-CD2 3.75Å; Y844-Y856 HydrophobicContact CD1-CD2 3.75Å; Y844-Y856 HydrophobicContact CD1-CG 4.46Å; Y844-Y856 AromaticContact CE1-CD2 3.74Å; Y844-Y856 HydrophobicContact CE1-CD2 3.74Å; Y844-Y856 HydrophobicContact CE1-CG 4.29Å; Y844-L859 HydrophobicContact CD1-CD2 4.35Å
845	R	77.8	Confident	70.6	Confident	120 Å²	120	75.1 Å²	75.1	45%	0.453	41%	0.41	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-112	137.8	179.3	-65.9	178.4	-177.1	-91.7	0.5	110.1	D847 L859	R845-D847 PolarHBondContact O-N 3.15Å; R845-L859 VanDerWaalsContact O-CD1 3.27Å; R845-L859 WeakPolarHBondContact O-CD1 3.26Å
846	C	84	Confident	71.1	Confident	0 Å²	0	80.1 Å²	80.1	0%	0	43%	0.427	C	S	.	.			trans	-72.6	111.4	169.7	159.7	0	0	0	0	109.4	I848 C849 Q850 M851 F853 L859 H862 H867	C846-I848 PolarHBondContact O-N 3.47Å; C846-C849 HydrophobicContact CB-CB 4.38Å; C846-C849 WeakPolarHBondContact CB-SG 3.33Å; C846-C849 PolarHBondContact O-N 3.43Å; C846-C849 VanDerWaalsContact O-N 3.1Å; C846-C849 WeakPolarHBondContact SG-CB 3.35Å; C846-C849 PolarHBondContact SG-N 2.91Å; C846-C849 CovalentContact SG-SG 2.05Å; C846-C849 PolarHBondContact SG-SG 3.37Å; C846-Q850 WeakPolarHBondContact O-CA 3.44Å; C846-Q850 PolarHBondContact O-N 2.63Å; C846-M851 HydrophobicContact CB-CB 4.33Å; C846-M851 PolarHBondContact N-O 3.1Å; C846-M851 VanDerWaalsContact N-O 3.08Å; C846-F853 HydrophobicContact CB-CE2 3.88Å; C846-L859 VanDerWaalsContact CA-CD1 3.5Å; C846-L859 HydrophobicContact CB-CD1 4.02Å; C846-L859 VanDerWaalsContact N-CD1 3.32Å; C846-H862 PolarHBondContact SG-NE2 2.79Å; C846-H867 PolarHBondContact SG-NE2 3.46Å
847	D	80.6	Confident	71.8	Confident	115 Å²	115	82 Å²	82	62%	0.615	44%	0.442	S	S	*	.	T	Hydrogen-bonded Turn	trans	-59.6	-37.2	-172.9	-55.8	-64.2	0	0	0	113	R845 C849 Q850	R845-D847 PolarHBondContact O-N 3.15Å; D847-C849 PolarHBondContact O-N 3.2Å; D847-Q850 PolarHBondContact O-NE2 3.3Å
848	I	79.3	Confident	72.9	Confident	99 Å²	99	81.3 Å²	81.3	51%	0.508	42%	0.424	S	S	.	.	T	Hydrogen-bonded Turn	trans	-75.7	-20.7	-177.8	-58.3	164.4	0	0	0	112.7	C846 H867	C846-I848 PolarHBondContact O-N 3.47Å; I848-H867 HydrophobicContact CD1-CB 3.63Å
849	C	79.7	Confident	74.3	Confident	46 Å²	46	75.9 Å²	75.9	31%	0.311	40%	0.399	S	S	.	.	T	Hydrogen-bonded Turn	trans	-140.5	-0.3	-168.1	75.2	0	0	0	0	115.7	C846 D847 M851 H862	C846-C849 HydrophobicContact CB-CB 4.38Å; C846-C849 WeakPolarHBondContact CB-SG 3.33Å; C846-C849 PolarHBondContact O-N 3.43Å; C846-C849 VanDerWaalsContact O-N 3.1Å; C846-C849 WeakPolarHBondContact SG-CB 3.35Å; C846-C849 PolarHBondContact SG-N 2.91Å; C846-C849 CovalentContact SG-SG 2.05Å; C846-C849 PolarHBondContact SG-SG 3.37Å; D847-C849 PolarHBondContact O-N 3.2Å; C849-M851 PolarHBondContact O-N 2.87Å; C849-H862 VanDerWaalsContact SG-CE1 3.59Å; C849-H862 PolarHBondContact SG-NE2 3.09Å
850	Q	75.7	Confident	75.8	Confident	103 Å²	103	76 Å²	76	48%	0.481	40%	0.398	S	S	.	.			trans	49.8	12.9	-179.5	-62.8	-60	-34.9	0	0	117.1	C846 D847	C846-Q850 WeakPolarHBondContact O-CA 3.44Å; C846-Q850 PolarHBondContact O-N 2.63Å; D847-Q850 PolarHBondContact O-NE2 3.3Å
851	M	78	Confident	77.2	Confident	57 Å²	57	79.8 Å²	79.8	28%	0.281	39%	0.393	S	S	.	.			trans	-62.8	129.4	175	-75.4	-65.5	-66.1	0	0	111	Y821 C846 C849 F853	Y821-M851 HydrophobicContact CD2-CE 4.33Å; C846-M851 HydrophobicContact CB-CB 4.33Å; C846-M851 PolarHBondContact N-O 3.1Å; C846-M851 VanDerWaalsContact N-O 3.08Å; C849-M851 PolarHBondContact O-N 2.87Å; M851-F853 HydrophobicContact CB-CE2 3.59Å; M851-F853 HydrophobicContact CB-CZ 3.92Å; M851-F853 WeakPolarHBondContact O-CD2 3.28Å; M851-F853 VanDerWaalsContact O-CE2 3.25Å; M851-F853 WeakPolarHBondContact O-CE2 3.36Å
852	P	80.8	Confident	78.8	Confident	14 Å²	14	73.2 Å²	73.2	9%	0.091	37%	0.365	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-83.9	134.5	176.7	31.3	-32.7	0	0	0	112.3	V843 Y844	V843-P852 HydrophobicContact CG1-CB 3.53Å; Y844-P852 CarbonylContact O-C 3.55Å
853	F	78.5	Confident	80.3	Confident	32 Å²	32	67.2 Å²	67.2	14%	0.14	34%	0.337	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-124.1	138.1	-179.7	-66.7	-83.9	0	0	0	110.7	Y844 C846 M851 V855 L859 H862	Y844-F853 PolarHBondContact N-O 2.94Å; Y844-F853 PolarHBondContact O-N 3.27Å; C846-F853 HydrophobicContact CB-CE2 3.88Å; M851-F853 HydrophobicContact CB-CE2 3.59Å; M851-F853 HydrophobicContact CB-CZ 3.92Å; M851-F853 WeakPolarHBondContact O-CD2 3.28Å; M851-F853 VanDerWaalsContact O-CE2 3.25Å; M851-F853 WeakPolarHBondContact O-CE2 3.36Å; F853-V855 VanDerWaalsContact C-N 3.34Å; F853-L859 HydrophobicContact CB-CB 4.16Å; F853-L859 HydrophobicContact CD2-CB 4.17Å; F853-L859 HydrophobicContact CD2-CD1 3.68Å; F853-L859 HydrophobicContact CE2-CD1 4.18Å; F853-L859 HydrophobicContact CG-CB 4.17Å; F853-L859 HydrophobicContact CG-CD1 4.49Å; F853-H862 HydrophobicContact CE1-CB 3.72Å; F853-H862 HydrophobicContact CE2-CB 4.12Å; F853-H862 AromaticContact CE2-CG 3.88Å; F853-H862 HydrophobicContact CZ-CB 3.44Å; F853-H862 VanDerWaalsContact CZ-CB 3.44Å; F853-H862 AromaticContact CZ-CD2 3.99Å; F853-H862 AromaticContact CZ-CG 3.3Å; F853-H862 AromaticContact CZ-ND1 3.51Å
854	S	76.4	Confident	81	Confident	81 Å²	81	74 Å²	74	57%	0.566	36%	0.364	S	S	*	.	S	Bend	trans	-82	-7	-179.1	56.2	0	0	0	0	114.5
855	V	78.4	Confident	81.5	Confident	71 Å²	71	78 Å²	78	43%	0.43	38%	0.383	S	S	.	.	S	Bend	trans	-152	138.5	179.8	-169.3	0	0	0	0	109.7	F853 S857 T858 L859	F853-V855 VanDerWaalsContact C-N 3.34Å; V855-S857 VanDerWaalsContact C-N 3.31Å; V855-S857 WeakPolarHBondContact CG1-OG 3.36Å; V855-S857 PolarHBondContact O-N 3.45Å; V855-T858 HydrophobicContact CB-CG2 4.41Å; V855-T858 PolarHBondContact O-N 3.29Å; V855-T858 PolarHBondContact O-OG1 3.46Å; V855-L859 PolarHBondContact O-N 3.48Å
856	Y	81	Confident	81.6	Confident	129 Å²	129	77.9 Å²	77.9	51%	0.506	38%	0.383	S	S	.	.	H	α-helix	trans	-53.1	-42.8	176.4	-175.3	-94.5	0	0	0	113.2	Y844 T858 L859 E860	Y844-Y856 AromaticContact CD1-CD2 3.75Å; Y844-Y856 HydrophobicContact CD1-CD2 3.75Å; Y844-Y856 HydrophobicContact CD1-CG 4.46Å; Y844-Y856 AromaticContact CE1-CD2 3.74Å; Y844-Y856 HydrophobicContact CE1-CD2 3.74Å; Y844-Y856 HydrophobicContact CE1-CG 4.29Å; Y856-T858 PolarHBondContact O-N 3.01Å; Y856-L859 HydrophobicContact CD2-CD2 3.81Å; Y856-L859 HydrophobicContact CE2-CD2 3.84Å; Y856-L859 CarbonylContact O-C 3.55Å; Y856-L859 WeakPolarHBondContact O-CA 3.44Å; Y856-L859 VanDerWaalsContact O-CB 3.27Å; Y856-L859 WeakPolarHBondContact O-CB 3.38Å; Y856-L859 PolarHBondContact O-N 3.28Å; Y856-E860 HydrophobicContact CD1-CB 4.35Å; Y856-E860 HydrophobicContact CE1-CB 4.09Å; Y856-E860 HydrophobicContact CE1-CG 4.43Å; Y856-E860 WeakPolarHBondContact O-CB 3.49Å; Y856-E860 PolarHBondContact O-N 3.03Å
857	S	84.8	Confident	81.5	Confident	54 Å²	54	79.1 Å²	79.1	38%	0.378	39%	0.388	S	S	.	.	H	α-helix	trans	-64.9	-12.1	177.5	63.1	0	0	0	0	114.7	V855 K861	V855-S857 VanDerWaalsContact C-N 3.31Å; V855-S857 WeakPolarHBondContact CG1-OG 3.36Å; V855-S857 PolarHBondContact O-N 3.45Å; S857-K861 WeakPolarHBondContact O-CB 3.32Å; S857-K861 WeakPolarHBondContact O-CD 3.47Å; S857-K861 WeakPolarHBondContact O-CG 3.27Å; S857-K861 PolarHBondContact O-N 3.07Å
858	T	84.3	Confident	80.9	Confident	57 Å²	57	74.5 Å²	74.5	35%	0.35	37%	0.368	S	S	.	.	H	α-helix	trans	-92.6	-31.4	169.1	62.1	0	0	0	0	112.7	V855 Y856 H862	V855-T858 HydrophobicContact CB-CG2 4.41Å; V855-T858 PolarHBondContact O-N 3.29Å; V855-T858 PolarHBondContact O-OG1 3.46Å; Y856-T858 PolarHBondContact O-N 3.01Å; T858-H862 WeakPolarHBondContact O-CB 3.23Å; T858-H862 PolarHBondContact O-N 3.26Å
859	L	85.9	Confident	80	Confident	9 Å²	9	78.1 Å²	78.1	5%	0.047	38%	0.383	C	S	.	.	H	α-helix	trans	-61.7	-52	166.3	174.3	84.2	0	0	0	110.4	Y844 R845 C846 F853 V855 Y856 K861 H862 M863	Y844-L859 HydrophobicContact CD1-CD2 4.35Å; R845-L859 VanDerWaalsContact O-CD1 3.27Å; R845-L859 WeakPolarHBondContact O-CD1 3.26Å; C846-L859 VanDerWaalsContact CA-CD1 3.5Å; C846-L859 HydrophobicContact CB-CD1 4.02Å; C846-L859 VanDerWaalsContact N-CD1 3.32Å; F853-L859 HydrophobicContact CB-CB 4.16Å; F853-L859 HydrophobicContact CD2-CB 4.17Å; F853-L859 HydrophobicContact CD2-CD1 3.68Å; F853-L859 HydrophobicContact CE2-CD1 4.18Å; F853-L859 HydrophobicContact CG-CB 4.17Å; F853-L859 HydrophobicContact CG-CD1 4.49Å; V855-L859 PolarHBondContact O-N 3.48Å; Y856-L859 HydrophobicContact CD2-CD2 3.81Å; Y856-L859 HydrophobicContact CE2-CD2 3.84Å; Y856-L859 CarbonylContact O-C 3.55Å; Y856-L859 WeakPolarHBondContact O-CA 3.44Å; Y856-L859 VanDerWaalsContact O-CB 3.27Å; Y856-L859 WeakPolarHBondContact O-CB 3.38Å; Y856-L859 PolarHBondContact O-N 3.28Å; L859-K861 PolarHBondContact O-N 3.05Å; L859-H862 CarbonylContact O-C 3.54Å; L859-H862 WeakPolarHBondContact O-CA 3.48Å; L859-H862 VanDerWaalsContact O-CB 3.27Å; L859-H862 WeakPolarHBondContact O-CB 3.31Å; L859-H862 PolarHBondContact O-N 3.21Å; L859-M863 HydrophobicContact CD1-SD 4.32Å; L859-M863 HydrophobicContact CD2-SD 4.3Å; L859-M863 HydrophobicContact CG-CG 4.45Å; L859-M863 HydrophobicContact CG-SD 4.06Å; L859-M863 WeakPolarHBondContact O-CG 3.36Å; L859-M863 PolarHBondContact O-N 3.19Å
860	E	85	Confident	78.8	Confident	99 Å²	99	82.2 Å²	82.2	46%	0.463	40%	0.397	S	S	.	.	H	α-helix	trans	-60.1	-46.5	-178.5	-177.6	-170.5	-162.3	0	0	111.6	Y856 H862 M863 K864	Y856-E860 HydrophobicContact CD1-CB 4.35Å; Y856-E860 HydrophobicContact CE1-CB 4.09Å; Y856-E860 HydrophobicContact CE1-CG 4.43Å; Y856-E860 WeakPolarHBondContact O-CB 3.49Å; Y856-E860 PolarHBondContact O-N 3.03Å; E860-H862 VanDerWaalsContact C-N 3.26Å; E860-H862 PolarHBondContact O-N 3.19Å; E860-M863 PolarHBondContact O-N 3.16Å; E860-K864 WeakPolarHBondContact O-CB 3.36Å; E860-K864 PolarHBondContact O-N 2.9Å
861	K	84.4	Confident	77.7	Confident	153 Å²	153	80.7 Å²	80.7	67%	0.665	39%	0.392	S	S	*	.	H	α-helix	trans	-64.8	-29.3	173.7	-73.4	175.9	-174.5	179.7	0	112.8	S857 L859 K865	S857-K861 WeakPolarHBondContact O-CB 3.32Å; S857-K861 WeakPolarHBondContact O-CD 3.47Å; S857-K861 WeakPolarHBondContact O-CG 3.27Å; S857-K861 PolarHBondContact O-N 3.07Å; L859-K861 PolarHBondContact O-N 3.05Å; K861-K865 WeakPolarHBondContact O-CB 3.36Å; K861-K865 PolarHBondContact O-N 2.89Å
862	H	86.3	Confident	76.5	Confident	31 Å²	31	84 Å²	84	14%	0.144	41%	0.41	C	S	.	.	H	α-helix	trans	-68.5	-51.5	169.2	167.9	91.2	0	0	0	110.8	C846 C849 F853 T858 L859 E860 K864 K865 W866 H867	C846-H862 PolarHBondContact SG-NE2 2.79Å; C849-H862 VanDerWaalsContact SG-CE1 3.59Å; C849-H862 PolarHBondContact SG-NE2 3.09Å; F853-H862 HydrophobicContact CE1-CB 3.72Å; F853-H862 HydrophobicContact CE2-CB 4.12Å; F853-H862 AromaticContact CE2-CG 3.88Å; F853-H862 HydrophobicContact CZ-CB 3.44Å; F853-H862 VanDerWaalsContact CZ-CB 3.44Å; F853-H862 AromaticContact CZ-CD2 3.99Å; F853-H862 AromaticContact CZ-CG 3.3Å; F853-H862 AromaticContact CZ-ND1 3.51Å; T858-H862 WeakPolarHBondContact O-CB 3.23Å; T858-H862 PolarHBondContact O-N 3.26Å; L859-H862 CarbonylContact O-C 3.54Å; L859-H862 WeakPolarHBondContact O-CA 3.48Å; L859-H862 VanDerWaalsContact O-CB 3.27Å; L859-H862 WeakPolarHBondContact O-CB 3.31Å; L859-H862 PolarHBondContact O-N 3.21Å; E860-H862 VanDerWaalsContact C-N 3.26Å; E860-H862 PolarHBondContact O-N 3.19Å; H862-K864 PolarHBondContact O-N 2.78Å; H862-K865 PolarHBondContact O-N 3.08Å; H862-K865 VanDerWaalsContact O-N 3.1Å; H862-W866 AromaticContact CE1-CD1 3.38Å; H862-W866 AromaticContact CE1-CG 3.53Å; H862-W866 AromaticContact CE1-NE1 3.91Å; H862-W866 AromaticContact CG-CD1 3.79Å; H862-W866 AromaticContact ND1-CD1 3.09Å; H862-W866 AromaticContact ND1-CG 3.95Å; H862-W866 AromaticContact ND1-NE1 3.64Å; H862-W866 WeakPolarHBondContact O-CB 3.43Å; H862-W866 VanDerWaalsContact O-CD1 3.31Å; H862-W866 PolarHBondContact O-N 3.17Å; H862-H867 AromaticContact CD2-CD2 3.95Å; H862-H867 AromaticContact CD2-NE2 3.96Å; H862-H867 AromaticContact NE2-CD2 2.77Å; H862-H867 PolarHBondContact NE2-CD2 2.8Å; H862-H867 AromaticContact NE2-CE1 3.3Å; H862-H867 PolarHBondContact NE2-CE1 3.42Å; H862-H867 VanDerWaalsContact NE2-CE1 3.3Å; H862-H867 AromaticContact NE2-CG 3.99Å; H862-H867 AromaticContact NE2-NE2 2.14Å; H862-H867 PolarHBondContact NE2-NE2 3.13Å
863	M	83.9	Confident	75.1	Confident	31 Å²	31	87.6 Å²	87.6	15%	0.153	43%	0.432	C	S	.	.	H	α-helix	trans	-61.8	-46.1	-178.4	-67.6	-177.1	78.5	0	0	111.2	L859 E860 K865 H867 G868 L871	L859-M863 HydrophobicContact CD1-SD 4.32Å; L859-M863 HydrophobicContact CD2-SD 4.3Å; L859-M863 HydrophobicContact CG-CG 4.45Å; L859-M863 HydrophobicContact CG-SD 4.06Å; L859-M863 WeakPolarHBondContact O-CG 3.36Å; L859-M863 PolarHBondContact O-N 3.19Å; E860-M863 PolarHBondContact O-N 3.16Å; M863-K865 PolarHBondContact O-N 3.03Å; M863-H867 CarbonylContact O-C 3.52Å; M863-H867 WeakPolarHBondContact O-CA 3.46Å; M863-H867 WeakPolarHBondContact O-CB 3.4Å; M863-H867 PolarHBondContact O-N 3.27Å; M863-G868 PolarHBondContact O-N 3.16Å; M863-L871 HydrophobicContact CB-CD1 4.48Å
864	K	84	Confident	73.7	Confident	172 Å²	172	90.2 Å²	90.2	75%	0.748	45%	0.448	S	S	*	.	H	α-helix	trans	-62.6	-25.8	175.8	-168.3	164.5	-173.7	166.1	0	113.6	E860 H862	E860-K864 WeakPolarHBondContact O-CB 3.36Å; E860-K864 PolarHBondContact O-N 2.9Å; H862-K864 PolarHBondContact O-N 2.78Å
865	K	82.5	Confident	72.7	Confident	165 Å²	165	91.4 Å²	91.4	72%	0.717	45%	0.447	S	S	*	.	H	α-helix	trans	-94.9	-30.5	-178.9	-175.1	166.5	-178.5	171.3	0	114.8	K861 H862 M863	K861-K865 WeakPolarHBondContact O-CB 3.36Å; K861-K865 PolarHBondContact O-N 2.89Å; H862-K865 PolarHBondContact O-N 3.08Å; H862-K865 VanDerWaalsContact O-N 3.1Å; M863-K865 PolarHBondContact O-N 3.03Å
866	W	79.2	Confident	71.4	Confident	118 Å²	118	92.8 Å²	92.8	45%	0.447	46%	0.456	S	S	.	.	H	α-helix	trans	-112.3	-16	-175.8	-63	104	0	0	0	113.9	A344 H862	A344-W866 HydrophobicContact CB-CE3 4.17Å; A344-W866 HydrophobicContact CB-CH2 3.9Å; A344-W866 HydrophobicContact CB-CZ3 3.68Å; A344-W866 WeakPolarHBondContact O-CH2 3.4Å; A344-W866 WeakPolarHBondContact O-CZ3 3.47Å; H862-W866 AromaticContact CE1-CD1 3.38Å; H862-W866 AromaticContact CE1-CG 3.53Å; H862-W866 AromaticContact CE1-NE1 3.91Å; H862-W866 AromaticContact CG-CD1 3.79Å; H862-W866 AromaticContact ND1-CD1 3.09Å; H862-W866 AromaticContact ND1-CG 3.95Å; H862-W866 AromaticContact ND1-NE1 3.64Å; H862-W866 WeakPolarHBondContact O-CB 3.43Å; H862-W866 VanDerWaalsContact O-CD1 3.31Å; H862-W866 PolarHBondContact O-N 3.17Å
867	H	82.7	Confident	70	Confident	25 Å²	25	94.1 Å²	94.1	12%	0.116	46%	0.464	C	S	.	.	S	Bend	trans	-136.5	9.4	-176.4	-50.3	-52.2	0	0	0	112.6	C846 I848 H862 M863 E869 H870 L871	C846-H867 PolarHBondContact SG-NE2 3.46Å; I848-H867 HydrophobicContact CD1-CB 3.63Å; H862-H867 AromaticContact CD2-CD2 3.95Å; H862-H867 AromaticContact CD2-NE2 3.96Å; H862-H867 AromaticContact NE2-CD2 2.77Å; H862-H867 PolarHBondContact NE2-CD2 2.8Å; H862-H867 AromaticContact NE2-CE1 3.3Å; H862-H867 PolarHBondContact NE2-CE1 3.42Å; H862-H867 VanDerWaalsContact NE2-CE1 3.3Å; H862-H867 AromaticContact NE2-CG 3.99Å; H862-H867 AromaticContact NE2-NE2 2.14Å; H862-H867 PolarHBondContact NE2-NE2 3.13Å; M863-H867 CarbonylContact O-C 3.52Å; M863-H867 WeakPolarHBondContact O-CA 3.46Å; M863-H867 WeakPolarHBondContact O-CB 3.4Å; M863-H867 PolarHBondContact O-N 3.27Å; H867-E869 VanDerWaalsContact C-N 3.33Å; H867-E869 PolarHBondContact O-N 2.95Å; H867-H870 WeakPolarHBondContact O-CA 3.35Å; H867-H870 WeakPolarHBondContact O-CB 3.43Å; H867-H870 PolarHBondContact O-N 2.59Å; H867-L871 PolarHBondContact O-N 3.2Å
868	G	67.9	Low	68.8	Low	18 Å²	18	95.9 Å²	95.9	19%	0.186	47%	0.469	C	S	.	.	H	α-helix	trans	-62.5	-35.6	-170.8	0	0	0	0	0	114.1	M863 H870 L871	M863-G868 PolarHBondContact O-N 3.16Å; G868-H870 VanDerWaalsContact C-N 3.28Å; G868-H870 PolarHBondContact O-N 3.2Å; G868-L871 PolarHBondContact O-N 3.35Å
869	E	61.2	Low	67.2	Low	175 Å²	175	99.4 Å²	99.4	82%	0.818	48%	0.481	S	S	*	.	H	α-helix	trans	-68.5	-28.1	175.2	-60.7	175.4	139	0	0	112.2	H867 T873	H867-E869 VanDerWaalsContact C-N 3.33Å; H867-E869 PolarHBondContact O-N 2.95Å; E869-T873 PolarHBondContact O-OG1 3.25Å; E869-T873 VanDerWaalsContact O-OG1 3.09Å
870	H	53.2	Low	65.7	Low	132 Å²	132	105.5 Å²	105.5	61%	0.611	51%	0.509	S	S	*	.	H	α-helix	trans	-77.9	-28.9	177.2	-101	-79	0	0	0	113.4	H867 G868 N874	H867-H870 WeakPolarHBondContact O-CA 3.35Å; H867-H870 WeakPolarHBondContact O-CB 3.43Å; H867-H870 PolarHBondContact O-N 2.59Å; G868-H870 VanDerWaalsContact C-N 3.28Å; G868-H870 PolarHBondContact O-N 3.2Å; H870-N874 PolarHBondContact O-ND2 3.28Å
871	L	54.4	Low	64.6	Low	71 Å²	71	104.1 Å²	104.1	37%	0.372	51%	0.514	S	S	.	.	H	α-helix	trans	-69.1	-53.7	178	-68.2	173.9	0	0	0	110.9	M863 H867 G868 T873 N874 D875	M863-L871 HydrophobicContact CB-CD1 4.48Å; H867-L871 PolarHBondContact O-N 3.2Å; G868-L871 PolarHBondContact O-N 3.35Å; L871-T873 PolarHBondContact O-N 3.01Å; L871-N874 PolarHBondContact O-N 3.5Å; L871-D875 PolarHBondContact O-N 3.41Å; L871-D875 VanDerWaalsContact O-OD2 3.13Å
872	L	51.5	Low	63.6	Low	126 Å²	126	104.4 Å²	104.4	66%	0.66	52%	0.518	S	S	*	.	H	α-helix	trans	-57.5	-22.1	-178.2	-62.4	175.4	0	0	0	114.5
873	T	52.9	Low	62.6	Low	90 Å²	90	112.6 Å²	112.6	55%	0.552	55%	0.548	S	S	*	.	H	α-helix	trans	-81	-22.1	177.3	-59.5	0	0	0	0	113	E869 L871 K877	E869-T873 PolarHBondContact O-OG1 3.25Å; E869-T873 VanDerWaalsContact O-OG1 3.09Å; L871-T873 PolarHBondContact O-N 3.01Å; T873-K877 WeakPolarHBondContact O-CB 3.36Å
874	N	49	Very low	61.3	Low	88 Å²	88	118.7 Å²	118.7	47%	0.471	59%	0.594	S	S	.	*	H	α-helix	trans	-90.8	-47.7	-179.7	-75.2	-78.5	0	0	0	111.9	H870 L871 V876 K877 I878	H870-N874 PolarHBondContact O-ND2 3.28Å; L871-N874 PolarHBondContact O-N 3.5Å; N874-V876 PolarHBondContact O-N 3.4Å; N874-K877 PolarHBondContact O-N 2.9Å; N874-I878 WeakPolarHBondContact O-CG1 3.25Å; N874-I878 PolarHBondContact O-N 3.32Å
875	D	53.7	Low	60.1	Low	105 Å²	105	116 Å²	116	56%	0.561	59%	0.586	S	S	*	*	H	α-helix	trans	-57	-47.6	-175.9	-58.3	-57.8	0	0	0	112	L871 K877 I878 E879	L871-D875 PolarHBondContact O-N 3.41Å; L871-D875 VanDerWaalsContact O-OD2 3.13Å; D875-K877 VanDerWaalsContact C-N 3.25Å; D875-K877 PolarHBondContact O-N 3.29Å; D875-I878 PolarHBondContact O-N 2.67Å; D875-E879 PolarHBondContact O-N 3.23Å
876	V	52	Low	59	Low	101 Å²	101	113.4 Å²	113.4	61%	0.612	58%	0.579	S	S	*	*	H	α-helix	trans	-65.5	-27.7	178.3	-179.1	0	0	0	0	112.5	N874	N874-V876 PolarHBondContact O-N 3.4Å
877	K	52	Low	57.8	Low	157 Å²	157	113.2 Å²	113.2	68%	0.683	59%	0.586	S	S	*	*	H	α-helix	trans	-92.2	-15.7	-173.2	-158.8	167.5	-174	175.9	0	113.5	T873 N874 D875 A881	T873-K877 WeakPolarHBondContact O-CB 3.36Å; N874-K877 PolarHBondContact O-N 2.9Å; D875-K877 VanDerWaalsContact C-N 3.25Å; D875-K877 PolarHBondContact O-N 3.29Å; K877-A881 WeakPolarHBondContact O-CB 3.34Å
878	I	59.1	Low	56.4	Low	91 Å²	91	118.4 Å²	118.4	47%	0.467	61%	0.614	S	S	.	*	H	α-helix	trans	-82.5	-52.1	172.6	-66.1	166.3	0	0	0	109.7	N874 D875 Q880 A881 E882	N874-I878 WeakPolarHBondContact O-CG1 3.25Å; N874-I878 PolarHBondContact O-N 3.32Å; D875-I878 PolarHBondContact O-N 2.67Å; I878-Q880 PolarHBondContact O-N 3.35Å; I878-Q880 VanDerWaalsContact O-N 3.12Å; I878-A881 PolarHBondContact O-N 3.28Å; I878-E882 PolarHBondContact O-N 3.29Å; I878-E882 VanDerWaalsContact O-N 3.11Å
879	E	51.2	Low	55.7	Low	130 Å²	130	124.6 Å²	124.6	61%	0.607	64%	0.641	S	S	*	*	H	α-helix	trans	-58.6	-29.3	178.2	-92.6	-147.1	94	0	0	113.6	D875 R883	D875-E879 PolarHBondContact O-N 3.23Å; E879-R883 WeakPolarHBondContact O-CB 3.03Å; E879-R883 IonicContact OE1-NH1 2.73Å
880	Q	54	Low	55.3	Low	138 Å²	138	121.3 Å²	121.3	65%	0.645	63%	0.629	S	S	*	*	T	Hydrogen-bonded Turn	trans	-82	-18.7	177.1	-162.1	163.8	24.9	0	0	113.5	I878 S884	I878-Q880 PolarHBondContact O-N 3.35Å; I878-Q880 VanDerWaalsContact O-N 3.12Å; Q880-S884 PolarHBondContact O-OG 3.48Å
881	A	60.6	Low	55.4	Low	69 Å²	69	120.5 Å²	120.5	57%	0.57	63%	0.63	S	S	*	*	T	Hydrogen-bonded Turn	trans	-88.3	-24.9	176.5	0	0	0	0	0	113.1	K877 I878 R883	K877-A881 WeakPolarHBondContact O-CB 3.34Å; I878-A881 PolarHBondContact O-N 3.28Å; A881-R883 VanDerWaalsContact C-N 3.28Å
882	E	64.3	Low	55.5	Low	160 Å²	160	124.3 Å²	124.3	75%	0.748	65%	0.65	S	S	*	*	T	Hydrogen-bonded Turn	trans	-87.4	5.2	175	-62	-173.7	129	0	0	113.2	I878	I878-E882 PolarHBondContact O-N 3.29Å; I878-E882 VanDerWaalsContact O-N 3.11Å
883	R	65.4	Low	55.9	Low	202 Å²	202	124.2 Å²	124.2	76%	0.762	65%	0.649	S	S	*	*	T	Hydrogen-bonded Turn	trans	-131.8	15.1	-172.5	-145.9	178.3	-161.5	125.4	1.6	114.1	E879 A881	E879-R883 WeakPolarHBondContact O-CB 3.03Å; E879-R883 IonicContact OE1-NH1 2.73Å; A881-R883 VanDerWaalsContact C-N 3.28Å
884	S	56	Low	56.1	Low	159 Å²	159	127.3 Å²	127.3	100%	1.112	66%	0.658	S	S	*	*			trans	-125.8	0	177.8	-58.1	0	0	0	0	110.8	Q880	Q880-S884 PolarHBondContact O-OG 3.48Å

Retrieved 884 of 884 residues in 720.8 ms (Link to these results)

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