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Isoform 3 of B-cell lymphoma/leukemia 11B AlphaSync

Canonical isoform description: 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 Q99PV8-3 (canonical: Q99PV8), Species MOUSE (Mus musculus, Mouse), Gene Bcl11b, Length 690 aa.

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(Predicted Aligned Error values between residue pairs)

Download Structure AlphaSync Parameters 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	39	Very low	43.8	Very low	233 Å²	233	177.7 Å²	177.7	100%	1.148	88%	0.881	S	S	*	*				0	102.9	0	-64.7	153.2	178.8	0	0	106.1
2	S	37	Very low	43.6	Very low	119 Å²	119	174.3 Å²	174.3	83%	0.832	87%	0.867	S	S	*	*				75.7	114.6	89.5	-58.8	0	0	0	0	111.2
3	R	42	Very low	43.4	Very low	242 Å²	242	168.6 Å²	168.6	91%	0.913	85%	0.854	S	S	*	*			cis	-145.3	159	8.1	-92.5	175.4	167.4	-129.4	2	111.2
4	R	38.1	Very low	43.4	Very low	246 Å²	246	170.9 Å²	170.9	93%	0.928	86%	0.86	S	S	*	*			trans	-69.4	145.6	160.7	-65.1	177.9	177.6	175.3	-1.9	110.4
5	K	58.3	Low	43.3	Very low	208 Å²	208	173.6 Å²	173.6	90%	0.904	86%	0.856	S	S	*	*			trans	-156.3	128.6	145.1	-138.1	179.6	-179.3	-171.5	0	110.2
6	Q	44.5	Very low	43.4	Very low	201 Å²	201	174.9 Å²	174.9	94%	0.939	86%	0.859	S	S	*	*			trans	-80.5	150.5	167.8	-71.9	156.2	-54.9	0	0	109.1
7	G	49.8	Very low	43.4	Very low	75 Å²	75	172.4 Å²	172.4	77%	0.773	85%	0.849	S	S	*	*			trans	-143	127.4	175.9	0	0	0	0	0	110.1
8	N	42.8	Very low	43.6	Very low	158 Å²	158	172.1 Å²	172.1	85%	0.845	85%	0.85	S	S	*	*			trans	-79.5	129.9	-175.8	-173.1	27.2	0	0	0	110.8
9	P	43.3	Very low	43.6	Very low	110 Å²	110	167.9 Å²	167.9	71%	0.714	84%	0.835	S	S	*	*			trans	-88.5	112.9	-179.3	32.7	-32.9	0	0	0	112.8
10	Q	41.8	Very low	43.7	Very low	190 Å²	190	166.2 Å²	166.2	89%	0.888	84%	0.836	S	S	*	*			trans	-159	118.5	144.6	-77.6	-149.6	4.7	0	0	110.1
11	H	45.1	Very low	43.9	Very low	173 Å²	173	167 Å²	167	80%	0.801	84%	0.835	S	S	*	*			trans	-149.6	151.3	152.3	-165	-97.2	0	0	0	111.4
12	L	41.9	Very low	44.6	Very low	137 Å²	137	162.7 Å²	162.7	72%	0.717	82%	0.816	S	S	*	*			trans	-58.3	132	-167.4	-81.3	51.2	0	0	0	114.7
13	S	40.6	Very low	45.8	Very low	100 Å²	100	164.8 Å²	164.8	70%	0.699	81%	0.813	S	S	*	*				10.9	113.6	124.5	-165.2	0	0	0	0	117.5
14	Q	43.7	Very low	47.1	Very low	201 Å²	201	156.7 Å²	156.7	94%	0.939	79%	0.792	S	S	*	*				-126.8	151.4	127.8	-90.9	-179.9	15.6	0	0	108.6
15	R	42.2	Very low	48.8	Very low	211 Å²	211	149.9 Å²	149.9	80%	0.796	78%	0.782	S	S	*	*			trans	-132.7	84	-158.8	-178.6	-177.7	174.6	171.1	-2.9	109.2	L17	R15-L17 HydrophobicContact CG-CD1 4.07Å; R15-L17 PolarHBondContact O-N 3.37Å
16	E	44.1	Very low	50	Low	194 Å²	194	143.3 Å²	143.3	91%	0.907	76%	0.762	S	S	*	*			trans	-67.7	105.3	176.6	-68.1	-167.2	96.6	0	0	110.3	I18	E16-I18 PolarHBondContact O-N 3Å
17	L	42.9	Very low	52.1	Low	132 Å²	132	136 Å²	136	69%	0.691	73%	0.726	S	S	*	*			trans	-71	107.2	167	-93.4	67.9	0	0	0	108.3	R15 T19	R15-L17 HydrophobicContact CG-CD1 4.07Å; R15-L17 PolarHBondContact O-N 3.37Å; L17-T19 PolarHBondContact O-N 2.76Å
18	I	47.2	Very low	53.9	Low	168 Å²	168	137.4 Å²	137.4	86%	0.862	72%	0.715	S	S	*	*			trans	-69.8	101.4	160.5	-60.6	174.9	0	0	0	106.6	E16	E16-I18 PolarHBondContact O-N 3Å
19	T	44.7	Very low	56.1	Low	92 Å²	92	130 Å²	130	56%	0.564	68%	0.675	S	S	*	*			trans	-62.6	146.9	175	50.6	0	0	0	0	110.8	L17 K21	L17-T19 PolarHBondContact O-N 2.76Å; T19-K21 PolarHBondContact O-N 2.68Å
20	P	44.4	Very low	58.2	Low	133 Å²	133	130.9 Å²	130.9	86%	0.864	68%	0.679	S	S	*	*			trans	-64.7	101.5	171.2	28.2	-33.3	0	0	0	109	D22	P20-D22 PolarHBondContact O-N 2.95Å
21	K	47.7	Very low	60.3	Low	184 Å²	184	125.3 Å²	125.3	80%	0.8	66%	0.658	S	S	*	*			trans	-75.1	123.1	178.8	-102.2	-178	172.3	179.1	0	110.1	T19	T19-K21 PolarHBondContact O-N 2.68Å
22	D	54.3	Low	62.4	Low	143 Å²	143	119.3 Å²	119.3	77%	0.765	64%	0.635	S	S	*	*			trans	12.4	105.8	167	-61.3	-116.5	0	0	0	116.8	P20	P20-D22 PolarHBondContact O-N 2.95Å
23	E	62.5	Low	64.6	Low	162 Å²	162	120.9 Å²	120.9	76%	0.757	64%	0.636	S	S	*	*			trans	-60.6	127.9	154	-177.5	168.1	103.1	0	0	108.2	S25 Y27	E23-S25 PolarHBondContact O-N 3.48Å; E23-Y27 WeakPolarHBondContact CG-OH 3.49Å
24	P	70.1	Confident	66.8	Low	72 Å²	72	121.2 Å²	121.2	47%	0.468	63%	0.627	S	S	.	*			trans	-67.8	108.8	-172.1	25.6	-34.3	0	0	0	110.9	S26 Y27	P24-S26 PolarHBondContact O-N 3.22Å; P24-Y27 HydrophobicContact CG-CD1 4.43Å; P24-Y27 HydrophobicContact CG-CE1 3.86Å; P24-Y27 WeakPolarHBondContact O-CE2 3.41Å
25	S	72.4	Confident	69	Low	104 Å²	104	115.5 Å²	115.5	73%	0.727	61%	0.607	S	S	*	*	S	Bend	trans	-57.1	-8.1	-177.8	-174.6	0	0	0	0	115.5	E23	E23-S25 PolarHBondContact O-N 3.48Å
26	S	84.3	Confident	71.2	Confident	70 Å²	70	107.2 Å²	107.2	49%	0.49	58%	0.577	S	S	.	*			trans	-142.9	130.2	170.4	64.1	0	0	0	0	111.1	P24	P24-S26 PolarHBondContact O-N 3.22Å
27	Y	88.2	Confident	73.3	Confident	47 Å²	47	104.7 Å²	104.7	18%	0.184	57%	0.569	C	S	.	*	E	Extended strand (participates in β ladder)	trans	-108.5	135.2	177	-60.2	-99.7	0	0	0	109.2	E23 P24 P35 F36 S38 A39	E23-Y27 WeakPolarHBondContact CG-OH 3.49Å; P24-Y27 HydrophobicContact CG-CD1 4.43Å; P24-Y27 HydrophobicContact CG-CE1 3.86Å; P24-Y27 WeakPolarHBondContact O-CE2 3.41Å; Y27-P35 CarbonylContact O-C 3.52Å; Y27-P35 WeakPolarHBondContact O-CA 3.43Å; Y27-F36 PolarHBondContact N-O 3.28Å; Y27-F36 PolarHBondContact O-N 3.48Å; Y27-S38 VanDerWaalsContact CD2-C 3.41Å; Y27-A39 HydrophobicContact CD1-CB 4.15Å; Y27-A39 VanDerWaalsContact CD2-N 3.3Å; Y27-A39 HydrophobicContact CE1-CB 3.74Å; Y27-A39 HydrophobicContact CE2-CB 4.19Å
28	I	87.7	Confident	75.4	Confident	105 Å²	105	100.5 Å²	100.5	54%	0.538	55%	0.551	S	S	.	*	E	Extended strand (participates in β ladder)	trans	-112.4	131.6	-177.7	-59.4	175.8	0	0	0	110	T30 Q34 P35	I28-T30 PolarHBondContact O-N 3.14Å; I28-Q34 WeakPolarHBondContact CA-O 3.44Å; I28-P35 HydrophobicContact CG1-CB 4.46Å
29	C	88.9	Confident	77.4	Confident	2 Å²	2	94.1 Å²	94.1	1%	0.014	52%	0.523	C	S	.	.			trans	-70.3	122.4	174.9	-177.3	0	0	0	0	111.3	T31 C32 K33 Q34 F36 L42 H50	C29-T31 PolarHBondContact O-N 2.75Å; C29-T31 VanDerWaalsContact O-N 3.12Å; C29-C32 VanDerWaalsContact CB-SG 3.54Å; C29-K33 WeakPolarHBondContact O-CA 3.23Å; C29-K33 PolarHBondContact O-N 3.27Å; C29-Q34 PolarHBondContact N-O 3.38Å; C29-F36 HydrophobicContact CB-CE2 3.91Å; C29-L42 VanDerWaalsContact CA-CD1 3.42Å; C29-L42 HydrophobicContact CB-CD1 3.48Å; C29-L42 VanDerWaalsContact CB-CD1 3.48Å; C29-H50 VanDerWaalsContact SG-CD2 3.55Å
30	T	87.1	Confident	79.5	Confident	129 Å²	129	97.3 Å²	97.3	79%	0.791	53%	0.525	S	S	*	.	T	Hydrogen-bonded Turn	trans	-59.9	-24.1	-179.9	51	0	0	0	0	114	I28	I28-T30 PolarHBondContact O-N 3.14Å
31	T	85.9	Confident	81.8	Confident	73 Å²	73	96.8 Å²	96.8	45%	0.448	51%	0.509	S	S	.	.	T	Hydrogen-bonded Turn	trans	-95.5	-43	-172.9	-45.9	0	0	0	0	113	C29 H50	C29-T31 PolarHBondContact O-N 2.75Å; C29-T31 VanDerWaalsContact O-N 3.12Å; T31-H50 HydrophobicContact CG2-CB 4.35Å
32	C	88.6	Confident	83.9	Confident	46 Å²	46	89.4 Å²	89.4	31%	0.311	48%	0.479	S	S	.	.	T	Hydrogen-bonded Turn	trans	-109.5	-5.3	-180	68.9	0	0	0	0	115.1	C29 Q34 H45 H50	C29-C32 VanDerWaalsContact CB-SG 3.54Å; C32-Q34 HydrophobicContact CB-CG 4.44Å; C32-Q34 PolarHBondContact O-N 2.86Å; C32-Q34 VanDerWaalsContact SG-CG 3.56Å; C32-H45 PolarHBondContact SG-NE2 2.84Å; C32-H50 WeakPolarHBondContact CB-NE2 3.49Å
33	K	88	Confident	85.6	Confident	171 Å²	171	86.7 Å²	86.7	74%	0.743	46%	0.464	S	S	*	.			trans	60.5	14.4	-176.3	-55.2	-173.8	179.4	-177.2	0	116.3	C29	C29-K33 WeakPolarHBondContact O-CA 3.23Å; C29-K33 PolarHBondContact O-N 3.27Å
34	Q	87	Confident	86.8	Confident	107 Å²	107	82.8 Å²	82.8	50%	0.5	45%	0.445	S	S	.	.			trans	-68.6	137	172.4	-68.9	-66.6	-12.1	0	0	111.4	I28 C29 C32 F36	I28-Q34 WeakPolarHBondContact CA-O 3.44Å; C29-Q34 PolarHBondContact N-O 3.38Å; C32-Q34 HydrophobicContact CB-CG 4.44Å; C32-Q34 PolarHBondContact O-N 2.86Å; C32-Q34 VanDerWaalsContact SG-CG 3.56Å; Q34-F36 HydrophobicContact CB-CE2 3.68Å; Q34-F36 HydrophobicContact CB-CZ 3.77Å; Q34-F36 WeakPolarHBondContact O-CD2 3.32Å; Q34-F36 WeakPolarHBondContact O-CE2 3.36Å
35	P	90.1	Very high	87.8	Confident	80 Å²	80	81.2 Å²	81.2	52%	0.519	43%	0.432	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-85.9	148.6	172.4	34.8	-33.5	0	0	0	112.1	Y27 I28	Y27-P35 CarbonylContact O-C 3.52Å; Y27-P35 WeakPolarHBondContact O-CA 3.43Å; I28-P35 HydrophobicContact CG1-CB 4.46Å
36	F	88.6	Confident	88.6	Confident	38 Å²	38	77 Å²	77	17%	0.167	40%	0.403	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-139.3	132.6	-179.6	-61.2	-85.7	0	0	0	110	Y27 C29 Q34 S38 F41 L42 H45	Y27-F36 PolarHBondContact N-O 3.28Å; Y27-F36 PolarHBondContact O-N 3.48Å; C29-F36 HydrophobicContact CB-CE2 3.91Å; Q34-F36 HydrophobicContact CB-CE2 3.68Å; Q34-F36 HydrophobicContact CB-CZ 3.77Å; Q34-F36 WeakPolarHBondContact O-CD2 3.32Å; Q34-F36 WeakPolarHBondContact O-CE2 3.36Å; F36-S38 PolarHBondContact O-N 3.14Å; F36-S38 VanDerWaalsContact O-N 3.13Å; F36-F41 HydrophobicContact CB-CB 4.28Å; F36-F41 HydrophobicContact CD1-CB 3.84Å; F36-F41 HydrophobicContact CG-CB 4.41Å; F36-L42 HydrophobicContact CB-CB 4.17Å; F36-L42 HydrophobicContact CD2-CB 3.96Å; F36-L42 HydrophobicContact CD2-CD1 3.96Å; F36-L42 HydrophobicContact CE2-CD1 4.12Å; F36-L42 HydrophobicContact CG-CB 4.14Å; F36-H45 HydrophobicContact CE1-CB 3.76Å; F36-H45 AromaticContact CE1-CG 3.95Å; F36-H45 HydrophobicContact CE2-CB 4.25Å; F36-H45 HydrophobicContact CZ-CB 3.53Å; F36-H45 AromaticContact CZ-CD2 3.73Å; F36-H45 AromaticContact CZ-CG 3.28Å; F36-H45 AromaticContact CZ-ND1 3.64Å
37	N	87.7	Confident	88.7	Confident	141 Å²	141	79.9 Å²	79.9	75%	0.754	41%	0.409	S	S	*	.	S	Bend	trans	-79.5	12.3	-178.9	-58.1	-24.4	0	0	0	113.6
38	S	87.8	Confident	88.6	Confident	44 Å²	44	82.9 Å²	82.9	31%	0.308	43%	0.428	S	S	.	.	S	Bend	trans	-159.5	144.8	174.5	178.7	0	0	0	0	110.6	Y27 F36 W40 F41 L42	Y27-S38 VanDerWaalsContact CD2-C 3.41Å; F36-S38 PolarHBondContact O-N 3.14Å; F36-S38 VanDerWaalsContact O-N 3.13Å; S38-W40 PolarHBondContact O-N 3.31Å; S38-W40 PolarHBondContact OG-N 3.42Å; S38-F41 PolarHBondContact O-N 3.33Å; S38-L42 PolarHBondContact O-N 2.96Å
39	A	89.2	Confident	88.5	Confident	33 Å²	33	81.4 Å²	81.4	27%	0.273	42%	0.424	S	S	.	.	H	α-helix	trans	-54.2	-37.2	170.9	0	0	0	0	0	111.9	Y27 F41 L42 L43	Y27-A39 HydrophobicContact CD1-CB 4.15Å; Y27-A39 VanDerWaalsContact CD2-N 3.3Å; Y27-A39 HydrophobicContact CE1-CB 3.74Å; Y27-A39 HydrophobicContact CE2-CB 4.19Å; A39-F41 PolarHBondContact O-N 3.01Å; A39-L42 PolarHBondContact O-N 2.99Å; A39-L43 HydrophobicContact CB-CD1 4.46Å; A39-L43 WeakPolarHBondContact O-CD1 3.25Å; A39-L43 PolarHBondContact O-N 3.17Å
40	W	89.8	Confident	88.2	Confident	160 Å²	160	84 Å²	84	61%	0.606	44%	0.436	S	S	*	.	H	α-helix	trans	-62	-45.3	-177.6	-171	89	0	0	0	112.2	S38 L43 Q44	S38-W40 PolarHBondContact O-N 3.31Å; S38-W40 PolarHBondContact OG-N 3.42Å; W40-L43 PolarHBondContact O-N 3.37Å; W40-Q44 HydrophobicContact CH2-CG 4.49Å; W40-Q44 WeakPolarHBondContact O-CB 3.5Å; W40-Q44 PolarHBondContact O-N 2.96Å
41	F	92.7	Very high	87.6	Confident	121 Å²	121	80.8 Å²	80.8	53%	0.531	43%	0.428	S	S	.	.	H	α-helix	trans	-66.7	-37.4	176	-71.2	-62.8	0	0	0	112.3	F36 S38 A39 H45	F36-F41 HydrophobicContact CB-CB 4.28Å; F36-F41 HydrophobicContact CD1-CB 3.84Å; F36-F41 HydrophobicContact CG-CB 4.41Å; S38-F41 PolarHBondContact O-N 3.33Å; A39-F41 PolarHBondContact O-N 3.01Å; F41-H45 WeakPolarHBondContact O-CB 3.36Å; F41-H45 PolarHBondContact O-N 3.02Å
42	L	91.7	Very high	86.6	Confident	30 Å²	30	82.9 Å²	82.9	16%	0.157	43%	0.431	C	S	.	.	H	α-helix	trans	-61.5	-46.3	172.6	168.5	59.9	0	0	0	111.6	C29 F36 S38 A39 H45 A46	C29-L42 VanDerWaalsContact CA-CD1 3.42Å; C29-L42 HydrophobicContact CB-CD1 3.48Å; C29-L42 VanDerWaalsContact CB-CD1 3.48Å; F36-L42 HydrophobicContact CB-CB 4.17Å; F36-L42 HydrophobicContact CD2-CB 3.96Å; F36-L42 HydrophobicContact CD2-CD1 3.96Å; F36-L42 HydrophobicContact CE2-CD1 4.12Å; F36-L42 HydrophobicContact CG-CB 4.14Å; S38-L42 PolarHBondContact O-N 2.96Å; A39-L42 PolarHBondContact O-N 2.99Å; L42-H45 PolarHBondContact O-N 3.04Å; L42-A46 WeakPolarHBondContact O-CB 3.48Å; L42-A46 PolarHBondContact O-N 2.93Å
43	L	89.4	Confident	85	Confident	86 Å²	86	89.4 Å²	89.4	45%	0.45	45%	0.45	S	S	.	.	H	α-helix	trans	-63	-48.3	180	-92.1	74.7	0	0	0	110.9	A39 W40 H45 A46 Q47 I54	A39-L43 HydrophobicContact CB-CD1 4.46Å; A39-L43 WeakPolarHBondContact O-CD1 3.25Å; A39-L43 PolarHBondContact O-N 3.17Å; W40-L43 PolarHBondContact O-N 3.37Å; L43-H45 VanDerWaalsContact C-N 3.33Å; L43-H45 PolarHBondContact O-N 2.9Å; L43-A46 PolarHBondContact O-N 3.23Å; L43-Q47 WeakPolarHBondContact O-CB 3.5Å; L43-Q47 PolarHBondContact O-N 3.33Å; L43-I54 HydrophobicContact CD2-CD1 3.77Å; L43-I54 HydrophobicContact CG-CD1 3.62Å
44	Q	88.4	Confident	83.1	Confident	79 Å²	79	85.7 Å²	85.7	37%	0.369	44%	0.437	S	S	.	.	H	α-helix	trans	-60.7	-41.3	177.4	-172.5	67.5	-2.4	0	0	111.7	W40 N48	W40-Q44 HydrophobicContact CH2-CG 4.49Å; W40-Q44 WeakPolarHBondContact O-CB 3.5Å; W40-Q44 PolarHBondContact O-N 2.96Å; Q44-N48 PolarHBondContact NE2-ND2 3.15Å; Q44-N48 VanDerWaalsContact O-CB 3.29Å; Q44-N48 WeakPolarHBondContact O-CB 3.5Å; Q44-N48 PolarHBondContact O-N 3.07Å; Q44-N48 PolarHBondContact O-OD1 3.37Å
45	H	91.3	Very high	81.2	Confident	40 Å²	40	89.1 Å²	89.1	19%	0.185	45%	0.447	C	S	.	.	H	α-helix	trans	-62.3	-50.4	173.3	172.5	84.5	0	0	0	112	C32 F36 F41 L42 L43 Q47 N48 T49 H50	C32-H45 PolarHBondContact SG-NE2 2.84Å; F36-H45 HydrophobicContact CE1-CB 3.76Å; F36-H45 AromaticContact CE1-CG 3.95Å; F36-H45 HydrophobicContact CE2-CB 4.25Å; F36-H45 HydrophobicContact CZ-CB 3.53Å; F36-H45 AromaticContact CZ-CD2 3.73Å; F36-H45 AromaticContact CZ-CG 3.28Å; F36-H45 AromaticContact CZ-ND1 3.64Å; F41-H45 WeakPolarHBondContact O-CB 3.36Å; F41-H45 PolarHBondContact O-N 3.02Å; L42-H45 PolarHBondContact O-N 3.04Å; L43-H45 VanDerWaalsContact C-N 3.33Å; L43-H45 PolarHBondContact O-N 2.9Å; H45-Q47 VanDerWaalsContact C-N 3.29Å; H45-Q47 PolarHBondContact O-N 2.84Å; H45-N48 PolarHBondContact O-N 2.99Å; H45-T49 PolarHBondContact CD2-OG1 3.44Å; H45-T49 PolarHBondContact CE1-OG1 2.87Å; H45-T49 PolarHBondContact NE2-OG1 3.35Å; H45-T49 WeakPolarHBondContact O-CB 3.01Å; H45-T49 PolarHBondContact O-N 2.78Å; H45-T49 PolarHBondContact O-OG1 3.16Å; H45-H50 AromaticContact CD2-NE2 3.99Å; H45-H50 AromaticContact NE2-CD2 3.69Å; H45-H50 AromaticContact NE2-NE2 3.18Å; H45-H50 PolarHBondContact NE2-NE2 3.32Å; H45-H50 VanDerWaalsContact NE2-NE2 3.18Å
46	A	87.7	Confident	79.1	Confident	15 Å²	15	92.5 Å²	92.5	12%	0.124	46%	0.459	C	S	.	.	H	α-helix	trans	-65.5	-32.5	-177.1	0	0	0	0	0	112.7	L42 L43 H50 G51 F52	L42-A46 WeakPolarHBondContact O-CB 3.48Å; L42-A46 PolarHBondContact O-N 2.93Å; L43-A46 PolarHBondContact O-N 3.23Å; A46-H50 CarbonylContact O-C 3.47Å; A46-H50 WeakPolarHBondContact O-CA 3.15Å; A46-H50 WeakPolarHBondContact O-CB 3.32Å; A46-H50 PolarHBondContact O-N 3.43Å; A46-G51 PolarHBondContact O-N 3.37Å; A46-F52 PolarHBondContact O-N 3.21Å
47	Q	86	Confident	77	Confident	130 Å²	130	99.2 Å²	99.2	61%	0.607	49%	0.491	S	S	*	.	H	α-helix	trans	-69.4	-48	172.1	-175.6	164.3	-23.8	0	0	111.3	L43 H45 G51	L43-Q47 WeakPolarHBondContact O-CB 3.5Å; L43-Q47 PolarHBondContact O-N 3.33Å; H45-Q47 VanDerWaalsContact C-N 3.29Å; H45-Q47 PolarHBondContact O-N 2.84Å; Q47-G51 WeakPolarHBondContact O-CA 3.4Å; Q47-G51 PolarHBondContact O-N 3.38Å
48	N	87.1	Confident	75.3	Confident	110 Å²	110	97.3 Å²	97.3	59%	0.588	49%	0.487	S	S	*	.	H	α-helix	trans	-77.4	-32.4	-173.4	-68.6	1	0	0	0	114.4	Q44 H45	Q44-N48 PolarHBondContact NE2-ND2 3.15Å; Q44-N48 VanDerWaalsContact O-CB 3.29Å; Q44-N48 WeakPolarHBondContact O-CB 3.5Å; Q44-N48 PolarHBondContact O-N 3.07Å; Q44-N48 PolarHBondContact O-OD1 3.37Å; H45-N48 PolarHBondContact O-N 2.99Å
49	T	85.2	Confident	73.1	Confident	74 Å²	74	97.3 Å²	97.3	45%	0.454	49%	0.494	S	S	.	.	H	α-helix	trans	-106.8	-20.5	-174.1	65.4	0	0	0	0	114.4	H45	H45-T49 PolarHBondContact CD2-OG1 3.44Å; H45-T49 PolarHBondContact CE1-OG1 2.87Å; H45-T49 PolarHBondContact NE2-OG1 3.35Å; H45-T49 WeakPolarHBondContact O-CB 3.01Å; H45-T49 PolarHBondContact O-N 2.78Å; H45-T49 PolarHBondContact O-OG1 3.16Å
50	H	83.8	Confident	71.1	Confident	57 Å²	57	102.7 Å²	102.7	26%	0.264	53%	0.526	S	S	.	.	H	α-helix	trans	-126.5	-1.9	-175.4	-53.6	-44.2	0	0	0	113.4	C29 T31 C32 H45 A46 F52	C29-H50 VanDerWaalsContact SG-CD2 3.55Å; T31-H50 HydrophobicContact CG2-CB 4.35Å; C32-H50 WeakPolarHBondContact CB-NE2 3.49Å; H45-H50 AromaticContact CD2-NE2 3.99Å; H45-H50 AromaticContact NE2-CD2 3.69Å; H45-H50 AromaticContact NE2-NE2 3.18Å; H45-H50 PolarHBondContact NE2-NE2 3.32Å; H45-H50 VanDerWaalsContact NE2-NE2 3.18Å; A46-H50 CarbonylContact O-C 3.47Å; A46-H50 WeakPolarHBondContact O-CA 3.15Å; A46-H50 WeakPolarHBondContact O-CB 3.32Å; A46-H50 PolarHBondContact O-N 3.43Å; H50-F52 HydrophobicContact CB-CD2 3.84Å; H50-F52 PolarHBondContact O-N 3.38Å; H50-F52 VanDerWaalsContact O-N 3.16Å
51	G	73.9	Confident	69	Low	62 Å²	62	99.6 Å²	99.6	64%	0.639	53%	0.534	S	S	*	.			trans	60.4	24.1	176.7	0	0	0	0	0	114	A46 Q47 R53	A46-G51 PolarHBondContact O-N 3.37Å; Q47-G51 WeakPolarHBondContact O-CA 3.4Å; Q47-G51 PolarHBondContact O-N 3.38Å; G51-R53 PolarHBondContact O-N 3.08Å
52	F	64.7	Low	66.6	Low	116 Å²	116	98.6 Å²	98.6	51%	0.509	54%	0.542	S	S	.	.			trans	-75.1	114.2	-166.3	-112.8	-97.7	0	0	0	112.5	A46 H50 I54	A46-F52 PolarHBondContact O-N 3.21Å; H50-F52 HydrophobicContact CB-CD2 3.84Å; H50-F52 PolarHBondContact O-N 3.38Å; H50-F52 VanDerWaalsContact O-N 3.16Å; F52-I54 PolarHBondContact O-N 2.95Å
53	R	54.3	Low	64.2	Low	184 Å²	184	103.3 Å²	103.3	69%	0.694	57%	0.572	S	S	*	*			trans	-73.7	103.4	158.8	-76	-176.3	61.9	-133.4	-7	108.6	G51 Y55	G51-R53 PolarHBondContact O-N 3.08Å; R53-Y55 PolarHBondContact NH2-OH 2.95Å; R53-Y55 PolarHBondContact O-N 2.99Å; R53-Y55 VanDerWaalsContact O-N 3.08Å
54	I	49.1	Very low	61.5	Low	92 Å²	92	104.8 Å²	104.8	47%	0.472	59%	0.59	S	S	.	*			trans	-66.5	108	-179.7	-47.3	174.2	0	0	0	109.4	L43 F52 L56	L43-I54 HydrophobicContact CD2-CD1 3.77Å; L43-I54 HydrophobicContact CG-CD1 3.62Å; F52-I54 PolarHBondContact O-N 2.95Å; I54-L56 HydrophobicContact CG2-CD1 3.83Å; I54-L56 HydrophobicContact CG2-CG 4.34Å
55	Y	46.2	Very low	59.2	Low	180 Å²	180	109.2 Å²	109.2	71%	0.706	62%	0.615	S	S	*	*			trans	-94	116.9	150.4	-72.7	-87.6	0	0	0	106.6	R53 E57	R53-Y55 PolarHBondContact NH2-OH 2.95Å; R53-Y55 PolarHBondContact O-N 2.99Å; R53-Y55 VanDerWaalsContact O-N 3.08Å; Y55-E57 PolarHBondContact O-N 3.23Å
56	L	47.5	Very low	56.8	Low	150 Å²	150	112.6 Å²	112.6	79%	0.785	64%	0.639	S	S	*	*			trans	-70.8	117.3	162.6	-69.1	85.9	0	0	0	106.5	I54 P58	I54-L56 HydrophobicContact CG2-CD1 3.83Å; I54-L56 HydrophobicContact CG2-CG 4.34Å; L56-P58 WeakPolarHBondContact O-CD 3.45Å
57	E	44.1	Very low	54.5	Low	180 Å²	180	118 Å²	118	84%	0.841	67%	0.673	S	S	*	*			trans	-84.5	113.4	162.9	-174.5	173.7	-177.9	0	0	107.6	Y55 G59	Y55-E57 PolarHBondContact O-N 3.23Å; E57-G59 PolarHBondContact O-N 2.83Å
58	P	50.9	Low	52.2	Low	101 Å²	101	121.5 Å²	121.5	66%	0.656	68%	0.68	S	S	*	*			trans	-71.8	113.7	174.6	-11.6	28.8	0	0	0	108.2	L56	L56-P58 WeakPolarHBondContact O-CD 3.45Å
59	G	42.5	Very low	50	Low	44 Å²	44	124.6 Å²	124.6	45%	0.454	70%	0.696	S	S	.	*			trans	-55.6	146	171.8	0	0	0	0	0	110.9	E57 A61 S62	E57-G59 PolarHBondContact O-N 2.83Å; G59-A61 PolarHBondContact O-N 3.24Å; G59-S62 PolarHBondContact O-N 2.76Å
60	P	46.5	Very low	47.8	Very low	146 Å²	146	125.9 Å²	125.9	95%	0.948	70%	0.704	S	S	*	*	T	Hydrogen-bonded Turn	trans	-74.4	67.3	-170.3	31.3	-37.3	0	0	0	113.1
61	A	47	Very low	46	Very low	95 Å²	95	131 Å²	131	79%	0.785	73%	0.731	S	S	*	*	T	Hydrogen-bonded Turn	trans	-153.1	-30	174.1	0	0	0	0	0	112	G59 T63	G59-A61 PolarHBondContact O-N 3.24Å; A61-T63 PolarHBondContact O-N 2.95Å
62	S	40.8	Very low	45.3	Very low	99 Å²	99	133 Å²	133	69%	0.692	73%	0.733	S	S	*	*			trans	-84.8	104.7	-174.2	-56.4	0	0	0	0	112.6	G59	G59-S62 PolarHBondContact O-N 2.76Å
63	T	41	Very low	45	Very low	129 Å²	129	133 Å²	133	79%	0.791	75%	0.745	S	S	*	*			trans	-62.5	146	171.3	48.1	0	0	0	0	112.3	A61 L65	A61-T63 PolarHBondContact O-N 2.95Å; T63-L65 PolarHBondContact O-N 2.86Å
64	S	34.2	Very low	44.7	Very low	118 Å²	118	130 Å²	130	83%	0.825	75%	0.749	S	S	*	*			trans	-37.9	109.7	-176.1	-52.6	0	0	0	0	116.2
65	L	40.2	Very low	44.9	Very low	172 Å²	172	134 Å²	134	90%	0.901	77%	0.77	S	S	*	*			trans	-104	95.3	159.1	-69.2	179.9	0	0	0	109.5	T63	T63-L65 PolarHBondContact O-N 2.86Å
66	T	40	Very low	45	Very low	111 Å²	111	128.8 Å²	128.8	68%	0.681	77%	0.772	S	S	*	*			trans	-72.2	143.4	157.7	44.7	0	0	0	0	108.7	R68	T66-R68 PolarHBondContact O-N 2.99Å
67	P	40.4	Very low	45	Very low	128 Å²	128	127.2 Å²	127.2	83%	0.831	77%	0.771	S	S	*	*			trans	-72.1	81.7	176.4	29.9	-34.6	0	0	0	109.5	L69	P67-L69 PolarHBondContact O-N 2.8Å; P67-L69 VanDerWaalsContact O-N 3.08Å
68	R	37.1	Very low	44.7	Very low	203 Å²	203	126.3 Å²	126.3	77%	0.766	77%	0.766	S	S	*	*			trans	-81.7	91.9	-179.5	-152.3	-178.6	-174.1	159.4	4.3	109.6	T66 T70	T66-R68 PolarHBondContact O-N 2.99Å; R68-T70 VanDerWaalsContact C-N 3.33Å; R68-T70 HydrophobicContact CB-CG2 4.27Å; R68-T70 HydrophobicContact CG-CG2 3.77Å; R68-T70 PolarHBondContact O-N 2.99Å
69	L	41	Very low	44.4	Very low	175 Å²	175	126.5 Å²	126.5	92%	0.916	77%	0.766	S	S	*	*			trans	-54.5	97.7	161.8	-72.4	163.2	0	0	0	108.4	P67	P67-L69 PolarHBondContact O-N 2.8Å; P67-L69 VanDerWaalsContact O-N 3.08Å
70	T	38.1	Very low	44.5	Very low	101 Å²	101	131.1 Å²	131.1	62%	0.62	79%	0.785	S	S	*	*			trans	-112.3	105.4	174.8	52.7	0	0	0	0	107.8	R68 P72	R68-T70 VanDerWaalsContact C-N 3.33Å; R68-T70 HydrophobicContact CB-CG2 4.27Å; R68-T70 HydrophobicContact CG-CG2 3.77Å; R68-T70 PolarHBondContact O-N 2.99Å; T70-P72 WeakPolarHBondContact O-CD 3.41Å
71	I	46.8	Very low	44.3	Very low	164 Å²	164	128 Å²	128	84%	0.841	77%	0.772	S	S	*	*	P	Polyproline II helix	trans	-69.5	121.9	171.8	-59.7	167.7	0	0	0	106.5
72	P	59.3	Low	43.9	Very low	105 Å²	105	132.2 Å²	132.2	68%	0.682	78%	0.775	S	S	*	*	P	Polyproline II helix	trans	-70.7	143.2	174.7	29.5	-33.5	0	0	0	110.2	T70	T70-P72 WeakPolarHBondContact O-CD 3.41Å
73	P	59	Low	43.7	Very low	116 Å²	116	132.4 Å²	132.4	75%	0.753	78%	0.776	S	S	*	*	P	Polyproline II helix	trans	-72.6	151.2	178.6	31.1	-35.3	0	0	0	111.7
74	P	46.8	Very low	44	Very low	122 Å²	122	131 Å²	131	79%	0.792	77%	0.77	S	S	*	*	P	Polyproline II helix	trans	-76.2	142.3	179	31.8	-34.9	0	0	0	112
75	L	54	Low	44.3	Very low	174 Å²	174	131.7 Å²	131.7	91%	0.911	76%	0.763	S	S	*	*			trans	-131.6	159.3	161.1	-72.1	177.2	0	0	0	109.1
76	G	48.5	Very low	44.3	Very low	72 Å²	72	131 Å²	131	74%	0.742	76%	0.758	S	S	*	*			trans	-70.3	173.8	-163.4	0	0	0	0	0	116.7
77	P	46.8	Very low	44.3	Very low	117 Å²	117	131.9 Å²	131.9	76%	0.76	76%	0.758	S	S	*	*			trans	-76.9	155.3	-176.4	33.6	-36.5	0	0	0	112.7
78	E	38.8	Very low	44.2	Very low	160 Å²	160	135 Å²	135	75%	0.748	76%	0.759	S	S	*	*				-177	138.7	108.4	-92	-73.3	61	0	0	112.2
79	T	43.9	Very low	44.5	Very low	106 Å²	106	132.4 Å²	132.4	65%	0.65	76%	0.759	S	S	*	*			trans	38.3	127.4	154.2	62.5	0	0	0	0	123.3
80	V	44.3	Very low	44.5	Very low	141 Å²	141	127.7 Å²	127.7	86%	0.855	75%	0.753	S	S	*	*			trans	61.8	133.7	131.1	176.9	0	0	0	0	118.8
81	A	41.7	Very low	44.7	Very low	80 Å²	80	130.3 Å²	130.3	66%	0.661	76%	0.763	S	S	*	*			cis	-168.9	-165.1	-17.5	0	0	0	0	0	106.2
82	Q	39.2	Very low	44.7	Very low	183 Å²	183	128.3 Å²	128.3	86%	0.855	76%	0.764	S	S	*	*			cis	-159	176	1	-150.3	167.8	-4.4	0	0	109.8
83	S	35.9	Very low	43.8	Very low	103 Å²	103	130 Å²	130	72%	0.72	77%	0.767	S	S	*	*			trans	-129.8	-156.2	169.9	-48.5	0	0	0	0	108.2
84	P	48.4	Very low	43	Very low	101 Å²	101	128.9 Å²	128.9	66%	0.656	76%	0.76	S	S	*	*			cis	-142.6	-158.8	-9.3	26.2	2.5	0	0	0	114.6
85	L	39.4	Very low	42.9	Very low	132 Å²	132	132.7 Å²	132.7	69%	0.691	76%	0.764	S	S	*	*			trans	82.3	160.7	157.2	-51	179.8	0	0	0	117.7
86	M	41.6	Very low	42	Very low	158 Å²	158	131.7 Å²	131.7	78%	0.778	76%	0.76	S	S	*	*			cis	-133.1	157.5	11.9	-76.2	74.7	-173.6	0	0	115.4
87	N	39.4	Very low	41.9	Very low	128 Å²	128	135.9 Å²	135.9	68%	0.684	76%	0.764	S	S	*	*			trans	-18.4	159.5	160.5	-46.5	3	0	0	0	120.6
88	F	38.2	Very low	41.9	Very low	193 Å²	193	138.6 Å²	138.6	85%	0.846	77%	0.772	S	S	*	*				-165.2	147.2	104.5	-114.2	-85.5	0	0	0	115.2
89	L	42.8	Very low	41.7	Very low	150 Å²	150	142 Å²	142	79%	0.785	78%	0.778	S	S	*	*			trans	-53.5	162.8	-170.8	-54.4	165.9	0	0	0	119.5
90	G	42.3	Very low	41.6	Very low	76 Å²	76	144.5 Å²	144.5	78%	0.784	78%	0.784	S	S	*	*			trans	168.6	113.2	161.3	0	0	0	0	0	115.2
91	D	41.3	Very low	41.5	Very low	156 Å²	156	144.1 Å²	144.1	83%	0.834	78%	0.782	S	S	*	*			trans	-85.2	148.5	-171.7	-56.4	-101.4	0	0	0	116.1
92	S	47.2	Very low	41.4	Very low	121 Å²	121	143.7 Å²	143.7	85%	0.846	79%	0.785	S	S	*	*				171.7	140.3	123.1	43.8	0	0	0	0	113.4
93	N	39.6	Very low	41.8	Very low	142 Å²	142	140.7 Å²	140.7	76%	0.759	78%	0.782	S	S	*	*			trans	-147.9	111	173.1	174.5	11.1	0	0	0	111.2
94	P	42.5	Very low	42	Very low	92 Å²	92	143.4 Å²	143.4	60%	0.597	79%	0.787	S	S	*	*			trans	-103.5	143.9	164.1	34.6	-25.6	0	0	0	112.5
95	F	44.3	Very low	41.3	Very low	202 Å²	202	145.5 Å²	145.5	89%	0.886	79%	0.791	S	S	*	*			trans	112.5	67.2	171.6	-60.1	-56.7	0	0	0	116
96	N	36.4	Very low	41.4	Very low	153 Å²	153	149.2 Å²	149.2	82%	0.818	80%	0.796	S	S	*	*			trans	-142.6	55.7	165.7	-145.4	-23.5	0	0	0	112.6
97	L	45.6	Very low	41.1	Very low	159 Å²	159	146.8 Å²	146.8	83%	0.832	79%	0.787	S	S	*	*			trans	-145	119.1	171.8	-67	176.4	0	0	0	104.3
98	L	47.1	Very low	41.3	Very low	175 Å²	175	147.7 Å²	147.7	92%	0.916	79%	0.786	S	S	*	*				-146.1	140.3	54.6	-119.9	55.6	0	0	0	111.9
99	R	34.8	Very low	41.4	Very low	231 Å²	231	144.2 Å²	144.2	87%	0.872	78%	0.783	S	S	*	*			trans	-138.6	117.5	164.3	170.8	-170.4	174.2	112.5	-1.9	108.4
100	M	42.1	Very low	41.3	Very low	159 Å²	159	140.3 Å²	140.3	78%	0.783	78%	0.779	S	S	*	*			trans	-165	121	160.3	-85.5	-36.9	150.3	0	0	108.4
101	T	41.5	Very low	41.1	Very low	133 Å²	133	146.4 Å²	146.4	82%	0.816	78%	0.784	S	S	*	*				53.4	135.6	108.7	67.9	0	0	0	0	116
102	G	39.1	Very low	41.1	Very low	71 Å²	71	142.6 Å²	142.6	73%	0.732	78%	0.782	S	S	*	*			cis	-172.9	-165.6	10.4	0	0	0	0	0	112.9
103	P	47.5	Very low	40.7	Very low	120 Å²	120	145.1 Å²	145.1	78%	0.779	78%	0.78	S	S	*	*			trans	-100.9	175.9	-166	39.7	-36.9	0	0	0	115
104	I	41.7	Very low	40.8	Very low	160 Å²	160	142 Å²	142	82%	0.821	78%	0.781	S	S	*	*			trans	-179.1	115.6	136.9	-94.8	152.9	0	0	0	114.4
105	L	33.7	Very low	40.6	Very low	145 Å²	145	147.8 Å²	147.8	76%	0.759	79%	0.791	S	S	*	*				35.7	119.4	125.1	-130.3	176.1	0	0	0	123.4	D107	L105-D107 HydrophobicContact CD2-CB 4.4Å
106	R	40.5	Very low	40.4	Very low	209 Å²	209	144.7 Å²	144.7	79%	0.789	78%	0.783	S	S	*	*			trans	170.2	126.7	135.2	-97	176.1	121.8	134.9	2.1	108.2
107	D	35.5	Very low	40.6	Very low	108 Å²	108	143.4 Å²	143.4	58%	0.578	78%	0.783	S	S	*	*			cis	74.1	112.7	36.3	-162.6	-96.5	0	0	0	116.3	L105	L105-D107 HydrophobicContact CD2-CB 4.4Å
108	H	44.4	Very low	40.5	Very low	147 Å²	147	139.3 Å²	139.3	68%	0.681	78%	0.78	S	S	*	*				-175.1	134.5	126.8	-84.8	-22.7	0	0	0	111.6
109	P	38.9	Very low	40.2	Very low	120 Å²	120	137.6 Å²	137.6	78%	0.779	78%	0.777	S	S	*	*			trans	-110.4	164.5	178.9	39.8	-34	0	0	0	115.1
110	G	41.9	Very low	40.7	Very low	68 Å²	68	132.3 Å²	132.3	70%	0.701	77%	0.772	S	S	*	*			trans	-178.1	118.1	162.2	0	0	0	0	0	111.6
111	F	37.6	Very low	41.1	Very low	204 Å²	204	129.8 Å²	129.8	90%	0.895	77%	0.767	S	S	*	*				81.6	120.4	75	-120.5	-78.2	0	0	0	114.7
112	G	41.8	Very low	40.8	Very low	75 Å²	75	131.5 Å²	131.5	77%	0.773	77%	0.771	S	S	*	*			trans	157.3	94.1	-179.9	0	0	0	0	0	112.4
113	E	38.5	Very low	40.7	Very low	174 Å²	174	137.7 Å²	137.7	81%	0.813	78%	0.778	S	S	*	*			trans	-87.1	152	-171.5	-66.4	173.9	65	0	0	114.4
114	G	41.2	Very low	40.4	Very low	76 Å²	76	136.4 Å²	136.4	78%	0.784	77%	0.771	S	S	*	*			trans	-158.4	31.3	-171.8	0	0	0	0	0	118.2
115	R	38.1	Very low	40.9	Very low	214 Å²	214	134.3 Å²	134.3	81%	0.808	77%	0.769	S	S	*	*			trans	32.9	99.4	159.7	-78.2	-82.1	175.3	-179.8	-3.8	120.5
116	L	40.1	Very low	41.8	Very low	138 Å²	138	132.7 Å²	132.7	72%	0.723	77%	0.766	S	S	*	*				56.7	167	127.7	-62.9	-177	0	0	0	121.9
117	P	41.9	Very low	42.1	Very low	126 Å²	126	127.5 Å²	127.5	82%	0.818	76%	0.76	S	S	*	*			cis	-125	164.7	-23.4	33.8	-17.6	0	0	0	114.1
118	G	42.9	Very low	42.4	Very low	73 Å²	73	134.2 Å²	134.2	75%	0.753	78%	0.777	S	S	*	*			trans	179.5	116	167.9	0	0	0	0	0	115.7
119	T	40.1	Very low	42.3	Very low	139 Å²	139	134.9 Å²	134.9	85%	0.853	78%	0.78	S	S	*	*			trans	-157.1	157.9	176.8	48.7	0	0	0	0	107.5
120	P	46.6	Very low	42.2	Very low	119 Å²	119	137.1 Å²	137.1	77%	0.773	78%	0.78	S	S	*	*			cis	-134.6	-149.5	35.2	45.5	-24.8	0	0	0	112.9
121	P	49.2	Very low	42.1	Very low	106 Å²	106	141.4 Å²	141.4	69%	0.688	79%	0.786	S	S	*	*				-113.5	157.5	-116.8	20.5	2.9	0	0	0	115.4	F123	P121-F123 PolarHBondContact O-N 3.11Å
122	L	35.1	Very low	42.1	Very low	170 Å²	170	136.4 Å²	136.4	89%	0.89	77%	0.769	S	S	*	*			trans	-72.7	102.6	168.6	-68.5	170	0	0	0	110.5	S124	L122-S124 PolarHBondContact O-N 2.83Å
123	F	36.9	Very low	42.3	Very low	201 Å²	201	138.8 Å²	138.8	88%	0.882	77%	0.771	S	S	*	*			trans	-80.6	103.5	172.5	-131.1	-88.3	0	0	0	110.1	P121	P121-F123 PolarHBondContact O-N 3.11Å
124	S	41.2	Very low	42.5	Very low	92 Å²	92	138.6 Å²	138.6	64%	0.643	77%	0.769	S	S	*	*	P	Polyproline II helix	trans	-73.6	142	175.6	-62.9	0	0	0	0	110.6	L122	L122-S124 PolarHBondContact O-N 2.83Å
125	P	53.9	Low	42.4	Very low	117 Å²	117	145.7 Å²	145.7	76%	0.76	77%	0.773	S	S	*	*	P	Polyproline II helix	trans	-63.8	142.8	169.7	28.3	-33.9	0	0	0	110
126	P	51.6	Low	42.6	Very low	110 Å²	110	143.8 Å²	143.8	71%	0.714	78%	0.777	S	S	*	*	P	Polyproline II helix	trans	-73	151.3	-170.5	29.3	-36	0	0	0	112.7	R128	P126-R128 PolarHBondContact O-N 3.39Å
127	P	46.4	Very low	42.5	Very low	101 Å²	101	142 Å²	142	66%	0.656	78%	0.776	S	S	*	*	P	Polyproline II helix	trans	-63.4	130.3	168.2	28.6	-33.6	0	0	0	109.4	H129	P127-H129 PolarHBondContact O-CD2 3.18Å; P127-H129 PolarHBondContact O-N 3.19Å; P127-H129 VanDerWaalsContact O-N 3.1Å
128	R	42	Very low	42.4	Very low	248 Å²	248	139.5 Å²	139.5	94%	0.936	77%	0.766	S	S	*	*			trans	-72.1	108.2	172.1	-62.9	-168.2	89.5	119.6	1.7	108.2	P126 H130	P126-R128 PolarHBondContact O-N 3.39Å; R128-H130 PolarHBondContact O-N 3.08Å
129	H	41.6	Very low	42.5	Very low	161 Å²	161	144.2 Å²	144.2	75%	0.745	77%	0.769	S	S	*	*			trans	-58.6	135.1	-177.4	-83.8	-108.7	0	0	0	112	P127 L131	P127-H129 PolarHBondContact O-CD2 3.18Å; P127-H129 PolarHBondContact O-N 3.19Å; P127-H129 VanDerWaalsContact O-N 3.1Å; H129-L131 PolarHBondContact O-N 3.38Å
130	H	37.4	Very low	42.7	Very low	167 Å²	167	146 Å²	146	77%	0.773	77%	0.767	S	S	*	*			trans	-69.3	104.7	169.6	179.8	-78.3	0	0	0	109	R128	R128-H130 PolarHBondContact O-N 3.08Å
131	L	39.4	Very low	42.1	Very low	158 Å²	158	148.7 Å²	148.7	83%	0.827	77%	0.772	S	S	*	*			trans	-92	124.8	172.7	-74.3	174.1	0	0	0	109.9	H129	H129-L131 PolarHBondContact O-N 3.38Å
132	D	38.2	Very low	41.7	Very low	99 Å²	99	146.8 Å²	146.8	53%	0.529	77%	0.771	S	S	.	*			trans	-103.8	118.9	-174.7	-169	-36.9	0	0	0	110.5	H134	D132-H134 WeakPolarHBondContact OD1-CB 3.14Å; D132-H134 IonicContact OD1-CD2 3.9Å; D132-H134 PolarHBondContact OD1-CD2 3.2Å; D132-H134 IonicContact OD1-CG 3.48Å; D132-H134 PolarHBondContact OD1-N 2.88Å
133	P	45	Very low	42.2	Very low	126 Å²	126	146.2 Å²	146.2	82%	0.818	77%	0.768	S	S	*	*			trans	-93.5	18.8	177	-11.1	31.2	0	0	0	115.9	R135	P133-R135 PolarHBondContact O-N 2.99Å
134	H	44.5	Very low	42.2	Very low	169 Å²	169	143.9 Å²	143.9	78%	0.782	77%	0.77	S	S	*	*	T	Hydrogen-bonded Turn	trans	-66.5	94.9	171.9	-86.9	-68.5	0	0	0	112.3	D132	D132-H134 WeakPolarHBondContact OD1-CB 3.14Å; D132-H134 IonicContact OD1-CD2 3.9Å; D132-H134 PolarHBondContact OD1-CD2 3.2Å; D132-H134 IonicContact OD1-CG 3.48Å; D132-H134 PolarHBondContact OD1-N 2.88Å
135	R	37.5	Very low	42.2	Very low	226 Å²	226	143.9 Å²	143.9	85%	0.853	78%	0.776	S	S	*	*	T	Hydrogen-bonded Turn	trans	-167.9	-22.6	144	-112.5	-67.5	88.7	95.1	-3.9	119.2	P133	P133-R135 PolarHBondContact O-N 2.99Å
136	L	43.1	Very low	41.7	Very low	174 Å²	174	146.4 Å²	146.4	91%	0.911	78%	0.778	S	S	*	*	S	Bend	trans	-78.5	146.9	-169.1	-65.3	-178.1	0	0	0	114.6
137	S	37.6	Very low	41.2	Very low	100 Å²	100	150.6 Å²	150.6	70%	0.699	79%	0.787	S	S	*	*			trans	-52.3	155	-154	-150.7	0	0	0	0	118.4	E139	S137-E139 PolarHBondContact O-N 3.14Å; S137-E139 PolarHBondContact OG-OE2 2.86Å
138	A	40.4	Very low	41.6	Very low	73 Å²	73	147.3 Å²	147.3	60%	0.603	77%	0.766	S	S	*	*	S	Bend	trans	-95.9	58.9	-172.7	0	0	0	0	0	113.7	M141	A138-M141 HydrophobicContact CB-CE 3.91Å
139	E	44.3	Very low	41.9	Very low	172 Å²	172	139.8 Å²	139.8	80%	0.804	75%	0.751	S	S	*	*			trans	-128.1	13.4	-175.6	-96.3	146.4	118.5	0	0	116.3	S137	S137-E139 PolarHBondContact O-N 3.14Å; S137-E139 PolarHBondContact OG-OE2 2.86Å
140	E	43.8	Very low	42.4	Very low	177 Å²	177	134.8 Å²	134.8	83%	0.827	74%	0.738	S	S	*	*			trans	-140.9	63.8	165.1	-154.2	178.1	139.8	0	0	112.8	G142	E140-G142 PolarHBondContact O-N 2.96Å
141	M	35.8	Very low	42.9	Very low	176 Å²	176	134.1 Å²	134.1	87%	0.867	73%	0.733	S	S	*	*			trans	-74.4	82.5	177.8	-63.6	-169.4	-170	0	0	112.1	A138	A138-M141 HydrophobicContact CB-CE 3.91Å
142	G	40.1	Very low	43.7	Very low	66 Å²	66	129.6 Å²	129.6	68%	0.68	71%	0.71	S	S	*	*			trans	-147.2	-4.3	-177.5	0	0	0	0	0	118.1	E140	E140-G142 PolarHBondContact O-N 2.96Å
143	L	45.6	Very low	44.7	Very low	157 Å²	157	133.4 Å²	133.4	82%	0.822	72%	0.717	S	S	*	*			trans	-136.2	172.9	-172.7	-67.9	174.6	0	0	0	112.8
144	V	37.1	Very low	45.4	Very low	152 Å²	152	132.8 Å²	132.8	92%	0.921	71%	0.71	S	S	*	*			trans	73.8	59.3	-178.1	-161.3	0	0	0	0	114.9
145	A	40.8	Very low	46.2	Very low	92 Å²	92	131.6 Å²	131.6	76%	0.76	71%	0.707	S	S	*	*			trans	-145.4	163.2	146.1	0	0	0	0	0	109.9
146	Q	44.5	Very low	47.1	Very low	171 Å²	171	129.8 Å²	129.8	80%	0.799	70%	0.7	S	S	*	*			trans	60.4	74.8	159.3	-164.2	179.7	-7.2	0	0	116.9	P148	Q146-P148 WeakPolarHBondContact O-CD 3.48Å
147	H	41.1	Very low	47.4	Very low	197 Å²	197	128.8 Å²	128.8	91%	0.912	70%	0.695	S	S	*	*			trans	-88.5	97.3	149.1	-109.1	-99.6	0	0	0	109.2
148	P	54.5	Low	47.6	Very low	33 Å²	33	129.7 Å²	129.7	21%	0.214	69%	0.692	C	S	.	*			trans	-75.1	134.1	178	32.3	-34.4	0	0	0	109.7	Q146 A150 R153	Q146-P148 WeakPolarHBondContact O-CD 3.48Å; P148-A150 PolarHBondContact O-N 3.43Å; P148-R153 HydrophobicContact CB-CG 4.31Å; P148-R153 HydrophobicContact CG-CG 3.89Å
149	S	48.6	Very low	47.8	Very low	89 Å²	89	131.9 Å²	131.9	62%	0.622	70%	0.7	S	S	*	*			trans	-53.2	138.3	169.8	-179.7	0	0	0	0	110.2	F151 D152	S149-F151 PolarHBondContact O-N 3.07Å; S149-D152 WeakPolarHBondContact O-CB 3.22Å; S149-D152 PolarHBondContact O-N 3.31Å
150	A	51.4	Low	47.6	Very low	57 Å²	57	131.2 Å²	131.2	47%	0.471	70%	0.699	S	S	.	*	T	Hydrogen-bonded Turn	trans	-57.7	-20.2	-175.3	0	0	0	0	0	113.8	P148 W672	P148-A150 PolarHBondContact O-N 3.43Å; A150-W672 HydrophobicContact CB-CZ3 4.03Å
151	F	48.8	Very low	47.6	Very low	152 Å²	152	127.1 Å²	127.1	67%	0.667	70%	0.695	S	S	*	*	T	Hydrogen-bonded Turn	trans	-73	-29.9	174.4	-159.4	-98.5	0	0	0	113.4	S149	S149-F151 PolarHBondContact O-N 3.07Å
152	D	55.8	Low	48.2	Very low	63 Å²	63	126.6 Å²	126.6	34%	0.337	69%	0.694	S	S	.	*	H	α-helix	trans	-80.2	-37.6	-174.2	-164.2	-81.5	0	0	0	112	S149 V154 M155 R156	S149-D152 WeakPolarHBondContact O-CB 3.22Å; S149-D152 PolarHBondContact O-N 3.31Å; D152-V154 PolarHBondContact O-N 3.42Å; D152-V154 VanDerWaalsContact O-N 3.14Å; D152-M155 PolarHBondContact O-N 3.12Å; D152-R156 PolarHBondContact O-N 3.27Å; D152-R156 VanDerWaalsContact OD1-CD 3.3Å; D152-R156 WeakPolarHBondContact OD1-CD 3.41Å; D152-R156 IonicContact OD1-CZ 3.48Å; D152-R156 IonicContact OD1-NE 3.19Å; D152-R156 IonicContact OD1-NH1 3.18Å; D152-R156 PolarHBondContact OD1-NH1 3.24Å; D152-R156 IonicContact OD2-NH1 3.85Å; D152-R156 PolarHBondContact OD2-NH1 3.05Å
153	R	58.8	Low	48	Very low	179 Å²	179	131 Å²	131	68%	0.675	70%	0.702	S	S	*	*	H	α-helix	trans	-56.5	-28.1	173.3	-80.3	-176.5	167.4	159.5	0.8	113.5	P148	P148-R153 HydrophobicContact CB-CG 4.31Å; P148-R153 HydrophobicContact CG-CG 3.89Å
154	V	60.3	Low	47.5	Very low	113 Å²	113	128.4 Å²	128.4	69%	0.685	70%	0.697	S	S	*	*	H	α-helix	trans	-81.1	-24.3	178	179.4	0	0	0	0	112.4	D152	D152-V154 PolarHBondContact O-N 3.42Å; D152-V154 VanDerWaalsContact O-N 3.14Å
155	M	61.1	Low	47.5	Very low	145 Å²	145	126.6 Å²	126.6	71%	0.714	69%	0.688	S	S	*	*	H	α-helix	trans	-96.9	-10.7	-176.3	-67.8	-68.8	-68.8	0	0	114.1	D152	D152-M155 PolarHBondContact O-N 3.12Å
156	R	55	Low	47.4	Very low	188 Å²	188	126.6 Å²	126.6	71%	0.709	69%	0.688	S	S	*	*			trans	-97.2	7.3	-174.8	-92.9	-169.5	161.3	75.7	1.1	116.2	D152 N158	D152-R156 PolarHBondContact O-N 3.27Å; D152-R156 VanDerWaalsContact OD1-CD 3.3Å; D152-R156 WeakPolarHBondContact OD1-CD 3.41Å; D152-R156 IonicContact OD1-CZ 3.48Å; D152-R156 IonicContact OD1-NE 3.19Å; D152-R156 IonicContact OD1-NH1 3.18Å; D152-R156 PolarHBondContact OD1-NH1 3.24Å; D152-R156 IonicContact OD2-NH1 3.85Å; D152-R156 PolarHBondContact OD2-NH1 3.05Å; R156-N158 PolarHBondContact O-N 3.3Å
157	L	50.6	Low	47.7	Very low	152 Å²	152	127.4 Å²	127.4	80%	0.796	69%	0.694	S	S	*	*			trans	-71.9	113.2	170.7	-72.9	175.4	0	0	0	110.3
158	N	41.5	Very low	48.2	Very low	120 Å²	120	121.6 Å²	121.6	64%	0.642	67%	0.67	S	S	*	*			trans	-71.7	125	-169.9	-164.9	40	0	0	0	111.5	R156 M160	R156-N158 PolarHBondContact O-N 3.3Å; N158-M160 PolarHBondContact O-N 2.97Å
159	P	45.5	Very low	48	Very low	118 Å²	118	128.1 Å²	128.1	77%	0.766	70%	0.695	S	S	*	*			trans	-77.8	89.2	-178.9	31.1	-34.5	0	0	0	111.3
160	M	40	Very low	48.7	Very low	159 Å²	159	127.9 Å²	127.9	78%	0.783	69%	0.694	S	S	*	*			trans	-72.4	146.8	164.9	-111.4	79.6	85.2	0	0	110.7	N158	N158-M160 PolarHBondContact O-N 2.97Å
161	A	42.9	Very low	49.5	Very low	90 Å²	90	132.1 Å²	132.1	74%	0.744	70%	0.698	S	S	*	*			trans	-80.7	176.8	-166.8	0	0	0	0	0	114.9
162	I	47.5	Very low	50.4	Low	165 Å²	165	132.8 Å²	132.8	85%	0.846	70%	0.696	S	S	*	*			trans	103.2	118.3	162.9	-56.5	159.7	0	0	0	115.5
163	D	36.4	Very low	51	Low	159 Å²	159	135.7 Å²	135.7	85%	0.85	71%	0.711	S	S	*	*			trans	58.4	133.6	168.3	-108.6	-132.4	0	0	0	123.4
164	S	35.2	Very low	51.5	Low	103 Å²	103	136.3 Å²	136.3	72%	0.72	71%	0.713	S	S	*	*			trans	-71.2	162.6	160.4	-88.6	0	0	0	0	110.7
165	P	37.5	Very low	51.9	Low	113 Å²	113	135.9 Å²	135.9	73%	0.734	70%	0.703	S	S	*	*			cis	-130.8	153.9	26.3	36.4	-18.9	0	0	0	116.8	M167	P165-M167 PolarHBondContact O-N 2.8Å
166	A	37.4	Very low	52.1	Low	93 Å²	93	136 Å²	136	77%	0.769	71%	0.706	S	S	*	*			trans	13.7	96.1	157.2	0	0	0	0	0	116.7	D168	A166-D168 VanDerWaalsContact C-N 3.34Å; A166-D168 PolarHBondContact O-N 3.18Å
167	M	51.8	Low	52.1	Low	187 Å²	187	130.8 Å²	130.8	92%	0.921	70%	0.704	S	S	*	*			trans	-64	91.8	173.6	-86	-76.2	-173.5	0	0	111.4	P165 F169	P165-M167 PolarHBondContact O-N 2.8Å; M167-F169 PolarHBondContact O-N 3.06Å
168	D	51.3	Low	51.7	Low	76 Å²	76	126.3 Å²	126.3	41%	0.406	69%	0.694	S	S	.	*			trans	-72.1	84.1	-173.3	-164.7	-25.8	0	0	0	111.7	A166 S170 R171 R172	A166-D168 VanDerWaalsContact C-N 3.34Å; A166-D168 PolarHBondContact O-N 3.18Å; D168-S170 PolarHBondContact O-N 3.4Å; D168-S170 VanDerWaalsContact O-N 3.15Å; D168-S170 WeakPolarHBondContact OD1-CB 3.18Å; D168-S170 PolarHBondContact OD1-N 2.98Å; D168-R171 HydrophobicContact CB-CB 3.95Å; D168-R171 HydrophobicContact CB-CG 4.32Å; D168-R171 VanDerWaalsContact CG-CG 3.48Å; D168-R171 PolarHBondContact O-N 2.94Å; D168-R171 VanDerWaalsContact O-N 3.16Å; D168-R171 PolarHBondContact OD1-N 2.95Å; D168-R171 WeakPolarHBondContact OD2-CD 3.34Å; D168-R171 WeakPolarHBondContact OD2-CG 3.26Å; D168-R172 PolarHBondContact O-N 2.85Å
169	F	51.4	Low	51.6	Low	169 Å²	169	128.6 Å²	128.6	74%	0.741	71%	0.706	S	S	*	*	H	α-helix	trans	-57.7	-25.7	175.9	-131.7	-87.5	0	0	0	112.2	M167 L173	M167-F169 PolarHBondContact O-N 3.06Å; F169-L173 HydrophobicContact CD1-CD1 4.38Å; F169-L173 WeakPolarHBondContact O-CB 3.45Å; F169-L173 PolarHBondContact O-N 2.87Å; F169-L173 VanDerWaalsContact O-N 3.08Å
170	S	62.6	Low	51.4	Low	85 Å²	85	128.8 Å²	128.8	59%	0.594	71%	0.71	S	S	*	*	H	α-helix	trans	-79.8	-34.4	177.9	-60.7	0	0	0	0	113.2	D168 R174	D168-S170 PolarHBondContact O-N 3.4Å; D168-S170 VanDerWaalsContact O-N 3.15Å; D168-S170 WeakPolarHBondContact OD1-CB 3.18Å; D168-S170 PolarHBondContact OD1-N 2.98Å; S170-R174 WeakPolarHBondContact O-CB 3.38Å; S170-R174 PolarHBondContact O-N 2.71Å
171	R	68.2	Low	51.3	Low	146 Å²	146	126.7 Å²	126.7	55%	0.551	71%	0.711	S	S	*	*	H	α-helix	trans	-71.7	-40.4	166.6	-79.4	178.3	72.4	168.9	3.1	111.6	D168 L173 R174 E175	D168-R171 HydrophobicContact CB-CB 3.95Å; D168-R171 HydrophobicContact CB-CG 4.32Å; D168-R171 VanDerWaalsContact CG-CG 3.48Å; D168-R171 PolarHBondContact O-N 2.94Å; D168-R171 VanDerWaalsContact O-N 3.16Å; D168-R171 PolarHBondContact OD1-N 2.95Å; D168-R171 WeakPolarHBondContact OD2-CD 3.34Å; D168-R171 WeakPolarHBondContact OD2-CG 3.26Å; R171-L173 VanDerWaalsContact C-N 3.32Å; R171-L173 PolarHBondContact O-N 3.22Å; R171-R174 CarbonylContact O-C 3.46Å; R171-R174 WeakPolarHBondContact O-CA 3.32Å; R171-R174 WeakPolarHBondContact O-CB 3.46Å; R171-R174 PolarHBondContact O-N 2.87Å; R171-E175 IonicContact CZ-OE1 3.81Å; R171-E175 IonicContact NE-OE1 2.71Å; R171-E175 PolarHBondContact NE-OE1 2.05Å; R171-E175 IonicContact NH2-OE1 2.87Å; R171-E175 PolarHBondContact NH2-OE1 3.25Å; R171-E175 WeakPolarHBondContact O-CB 3.46Å; R171-E175 WeakPolarHBondContact O-CG 3.42Å; R171-E175 PolarHBondContact O-N 3.22Å
172	R	66.8	Low	51.3	Low	165 Å²	165	128.9 Å²	128.9	62%	0.623	72%	0.716	S	S	*	*	H	α-helix	trans	-62.6	-39	177.4	-173.5	140.8	-76.4	-144.3	-5.9	112	D168 R174 L176	D168-R172 PolarHBondContact O-N 2.85Å; R172-R174 PolarHBondContact O-N 3.08Å; R172-L176 HydrophobicContact CG-CD1 3.86Å; R172-L176 VanDerWaalsContact O-CD1 3.23Å; R172-L176 WeakPolarHBondContact O-CD1 3.3Å; R172-L176 PolarHBondContact O-N 3.08Å; R172-L176 VanDerWaalsContact O-N 3.14Å
173	L	70.3	Confident	51	Low	125 Å²	125	126.6 Å²	126.6	65%	0.654	71%	0.712	S	S	*	*	H	α-helix	trans	-65	-16.1	169.3	-92.1	163.6	0	0	0	114.7	F169 R171	F169-L173 HydrophobicContact CD1-CD1 4.38Å; F169-L173 WeakPolarHBondContact O-CB 3.45Å; F169-L173 PolarHBondContact O-N 2.87Å; F169-L173 VanDerWaalsContact O-N 3.08Å; R171-L173 VanDerWaalsContact C-N 3.32Å; R171-L173 PolarHBondContact O-N 3.22Å
174	R	68.4	Low	51.3	Low	191 Å²	191	124.7 Å²	124.7	72%	0.721	71%	0.708	S	S	*	*	H	α-helix	trans	-99.7	-32	178	-173.8	163.3	-71.2	145.2	2.6	112.9	S170 R171 R172 A177	S170-R174 WeakPolarHBondContact O-CB 3.38Å; S170-R174 PolarHBondContact O-N 2.71Å; R171-R174 CarbonylContact O-C 3.46Å; R171-R174 WeakPolarHBondContact O-CA 3.32Å; R171-R174 WeakPolarHBondContact O-CB 3.46Å; R171-R174 PolarHBondContact O-N 2.87Å; R172-R174 PolarHBondContact O-N 3.08Å; R174-A177 WeakPolarHBondContact O-CB 3.4Å; R174-A177 PolarHBondContact O-N 2.66Å
175	E	67.9	Low	51.7	Low	104 Å²	104	125.2 Å²	125.2	49%	0.486	71%	0.709	S	S	.	*	H	α-helix	trans	-74.7	-29.9	175.7	-72.1	169.6	-179.4	0	0	111.6	R171 A177	R171-E175 IonicContact CZ-OE1 3.81Å; R171-E175 IonicContact NE-OE1 2.71Å; R171-E175 PolarHBondContact NE-OE1 2.05Å; R171-E175 IonicContact NH2-OE1 2.87Å; R171-E175 PolarHBondContact NH2-OE1 3.25Å; R171-E175 WeakPolarHBondContact O-CB 3.46Å; R171-E175 WeakPolarHBondContact O-CG 3.42Å; R171-E175 PolarHBondContact O-N 3.22Å; E175-A177 PolarHBondContact O-N 2.92Å
176	L	66	Low	52	Low	147 Å²	147	126.4 Å²	126.4	77%	0.77	71%	0.714	S	S	*	*	T	Hydrogen-bonded Turn	trans	-73.2	-6.7	168.2	-90.6	79.9	0	0	0	113.8	R172	R172-L176 HydrophobicContact CG-CD1 3.86Å; R172-L176 VanDerWaalsContact O-CD1 3.23Å; R172-L176 WeakPolarHBondContact O-CD1 3.3Å; R172-L176 PolarHBondContact O-N 3.08Å; R172-L176 VanDerWaalsContact O-N 3.14Å
177	A	55.4	Low	51.8	Low	80 Å²	80	126.4 Å²	126.4	66%	0.661	71%	0.708	S	S	*	*	T	Hydrogen-bonded Turn	trans	-106.1	0.1	-166.6	0	0	0	0	0	115.7	R174 E175	R174-A177 WeakPolarHBondContact O-CB 3.4Å; R174-A177 PolarHBondContact O-N 2.66Å; E175-A177 PolarHBondContact O-N 2.92Å
178	G	41.3	Very low	51.4	Low	57 Å²	57	122.6 Å²	122.6	59%	0.588	70%	0.697	S	S	*	*			trans	150.7	112.7	166.4	0	0	0	0	0	116.2
179	N	39.7	Very low	50.7	Low	169 Å²	169	121.4 Å²	121.4	90%	0.904	70%	0.703	S	S	*	*			trans	-95.8	105.6	156.5	-90.1	9.5	0	0	0	109.1
180	S	40.9	Very low	50.3	Low	121 Å²	121	126 Å²	126	85%	0.846	72%	0.715	S	S	*	*			trans	-143.1	146.4	160.5	60.4	0	0	0	0	109.7
181	S	39.5	Very low	49.7	Very low	116 Å²	116	124.9 Å²	124.9	81%	0.811	72%	0.717	S	S	*	*			trans	-117.6	101.9	-154	40.5	0	0	0	0	114.5
182	T	41.6	Very low	48.3	Very low	136 Å²	136	126.2 Å²	126.2	83%	0.834	74%	0.736	S	S	*	*			trans	-171	137	150	30	0	0	0	0	112.5
183	P	42.2	Very low	47.6	Very low	117 Å²	117	124 Å²	124	76%	0.76	74%	0.742	S	S	*	*			trans	-94.5	-173.3	157.6	40.8	-34.4	0	0	0	110.4
184	P	42.9	Very low	46	Very low	118 Å²	118	126.4 Å²	126.4	77%	0.766	75%	0.753	S	S	*	*			cis	-123	-145.6	-5.7	44	-26	0	0	0	109.8
185	P	41.9	Very low	44.8	Very low	114 Å²	114	126 Å²	126	74%	0.74	76%	0.758	S	S	*	*			cis	-131.8	-165.7	-15	41.8	-22.5	0	0	0	115.6
186	V	43.9	Very low	43.8	Very low	139 Å²	139	130.8 Å²	130.8	84%	0.842	77%	0.772	S	S	*	*			trans	-36.7	152	-175.8	-63.1	0	0	0	0	121.6
187	S	34.9	Very low	42.8	Very low	92 Å²	92	132.6 Å²	132.6	64%	0.643	78%	0.781	S	S	*	*			trans	-74.4	-175.7	172.9	-38.3	0	0	0	0	113.2
188	P	42.9	Very low	42.3	Very low	108 Å²	108	134.8 Å²	134.8	70%	0.701	78%	0.781	S	S	*	*			cis	-146.7	164.7	11.6	41.6	-20.8	0	0	0	120.5	V379	P188-V379 HydrophobicContact CB-CG1 4.14Å
189	G	35.7	Very low	42.4	Very low	51 Å²	51	138.1 Å²	138.1	53%	0.526	79%	0.786	S	S	.	*				97.7	91	127.1	0	0	0	0	0	121.3
190	R	44	Very low	42.5	Very low	265 Å²	265	134.9 Å²	134.9	100%	1	77%	0.774	S	S	*	*			trans	171.4	152.1	150	-93.6	157.1	-168.3	-156.7	4.3	105.6
191	G	48.5	Very low	42.5	Very low	62 Å²	62	137.8 Å²	137.8	64%	0.639	77%	0.771	S	S	*	*			cis	147.4	121.6	7.4	0	0	0	0	0	106.8	P193	G191-P193 WeakPolarHBondContact O-CD 3.26Å
192	N	40.5	Very low	42.6	Very low	174 Å²	174	140 Å²	140	93%	0.93	77%	0.769	S	S	*	*			trans	-51.9	121.3	-163.7	-74.6	13.2	0	0	0	114.7
193	P	50.8	Low	42.7	Very low	118 Å²	118	139 Å²	139	77%	0.766	77%	0.765	S	S	*	*			trans	-107.9	102.9	173.5	35.1	-23.6	0	0	0	111.8	G191	G191-P193 WeakPolarHBondContact O-CD 3.26Å
194	M	37.7	Very low	42.8	Very low	176 Å²	176	138.3 Å²	138.3	87%	0.867	76%	0.763	S	S	*	*			trans	-130.9	58.5	157.2	-106.1	-58.9	-67.6	0	0	109.6
195	H	43.6	Very low	43.4	Very low	181 Å²	181	137.6 Å²	137.6	84%	0.838	76%	0.758	S	S	*	*			trans	-158.7	105.6	168.3	-128.4	-84.7	0	0	0	110.7
196	R	45.4	Very low	43.5	Very low	205 Å²	205	142 Å²	142	77%	0.774	77%	0.765	S	S	*	*			trans	146.1	102.5	155.9	-85.7	170.7	176	177.6	-1	111.3	L198	R196-L198 HydrophobicContact CG-CD1 4.37Å
197	L	46.3	Very low	43.8	Very low	185 Å²	185	140.7 Å²	140.7	97%	0.969	76%	0.763	S	S	*	*				-87.9	150.2	120.3	-69.8	175.3	0	0	0	107.2
198	L	44.8	Very low	44.9	Very low	127 Å²	127	141.3 Å²	141.3	67%	0.665	77%	0.765	S	S	*	*			trans	-129	129.4	-167.7	-167.9	74.1	0	0	0	110.6	R196	R196-L198 HydrophobicContact CG-CD1 4.37Å
199	N	42.5	Very low	45	Very low	126 Å²	126	145 Å²	145	67%	0.674	77%	0.77	S	S	*	*			trans	4.6	127.2	155.3	-171.3	56.8	0	0	0	117.4	F201	N199-F201 PolarHBondContact OD1-N 3.4Å; N199-F201 VanDerWaalsContact OD1-N 3.08Å
200	P	41.2	Very low	45.6	Very low	101 Å²	101	149.8 Å²	149.8	66%	0.656	78%	0.783	S	S	*	*				-134.7	136.1	98	36.2	-26.9	0	0	0	114.3
201	F	41.8	Very low	45.5	Very low	182 Å²	182	141.8 Å²	141.8	80%	0.798	77%	0.768	S	S	*	*				-178.5	149.3	111.1	-96.8	-71.7	0	0	0	111.6	N199	N199-F201 PolarHBondContact OD1-N 3.4Å; N199-F201 VanDerWaalsContact OD1-N 3.08Å
202	Q	40.8	Very low	45.4	Very low	164 Å²	164	145.5 Å²	145.5	77%	0.766	78%	0.778	S	S	*	*			trans	-118.9	157.8	174	-75.8	-77.7	-76.5	0	0	107.2
203	P	43.7	Very low	46.3	Very low	113 Å²	113	142.7 Å²	142.7	73%	0.734	77%	0.769	S	S	*	*			cis	-132.8	-154.3	42.9	39.9	-18.5	0	0	0	112
204	S	44.5	Very low	46.3	Very low	103 Å²	103	143.1 Å²	143.1	72%	0.72	77%	0.772	S	S	*	*			cis	-156.8	155.1	4.8	-152.7	0	0	0	0	111.8
205	P	56.5	Low	47	Very low	103 Å²	103	142.5 Å²	142.5	67%	0.669	77%	0.771	S	S	*	*			trans	-104.9	177.4	178.2	39.8	-35	0	0	0	115.2
206	K	43	Very low	48.1	Very low	206 Å²	206	139 Å²	139	90%	0.896	76%	0.764	S	S	*	*			trans	92.7	143.3	-176.1	-53.7	154.6	-171.6	173.8	0	112.4
207	S	51.4	Low	48.8	Very low	112 Å²	112	135.3 Å²	135.3	78%	0.783	77%	0.767	S	S	*	*			cis	-143.8	157.4	7.2	46.1	0	0	0	0	112.3
208	P	57	Low	49.3	Very low	106 Å²	106	134.8 Å²	134.8	69%	0.688	76%	0.762	S	S	*	*			trans	-85.3	165.4	176.1	37.1	-36.8	0	0	0	112.6
209	F	45	Very low	49.9	Very low	186 Å²	186	134.6 Å²	134.6	82%	0.816	77%	0.768	S	S	*	*			trans	177.8	138.6	130.8	-99.9	-59.4	0	0	0	112.7
210	L	49.2	Very low	50	Low	150 Å²	150	133.4 Å²	133.4	79%	0.785	78%	0.776	S	S	*	*			trans	58.5	148.5	155.5	-55	171.4	0	0	0	119.3
211	S	40.4	Very low	50	Low	98 Å²	98	132.1 Å²	132.1	69%	0.685	78%	0.781	S	S	*	*			cis	-177	107.9	-31	-102.8	0	0	0	0	107.3
212	T	46.4	Very low	50.4	Low	140 Å²	140	129.7 Å²	129.7	86%	0.859	78%	0.781	S	S	*	*			trans	-156.8	134.6	169.4	-4.1	0	0	0	0	109.8
213	P	60.2	Low	51	Low	114 Å²	114	127.2 Å²	127.2	74%	0.74	78%	0.78	S	S	*	*	P	Polyproline II helix	trans	-80.7	158.4	-172.1	32.3	-35.7	0	0	0	113.1
214	P	51.7	Low	51.4	Low	127 Å²	127	127.1 Å²	127.1	83%	0.825	78%	0.779	S	S	*	*	P	Polyproline II helix	trans	-75.4	138.6	-174.8	30.5	-35.5	0	0	0	113.1
215	L	52	Low	51.6	Low	164 Å²	164	128.2 Å²	128.2	86%	0.859	78%	0.784	S	S	*	*	P	Polyproline II helix	trans	-80.5	150.8	165.1	-71.1	171.6	0	0	0	110.6
216	P	66.8	Low	51.3	Low	106 Å²	106	132 Å²	132	69%	0.688	79%	0.792	S	S	*	*	P	Polyproline II helix	trans	-69.5	151.9	-177.5	28.9	-35.6	0	0	0	112.5	M218	P216-M218 PolarHBondContact O-N 3.13Å
217	P	59.5	Low	51.8	Low	128 Å²	128	127.6 Å²	127.6	83%	0.831	78%	0.784	S	S	*	*	P	Polyproline II helix	trans	-67.3	126.2	178	28.3	-34.2	0	0	0	110.8
218	M	57	Low	51.7	Low	175 Å²	175	127.5 Å²	127.5	86%	0.862	78%	0.781	S	S	*	*	P	Polyproline II helix	trans	-67.8	142.9	171.4	-66.1	-179.8	69.5	0	0	110.2	P216 A220	P216-M218 PolarHBondContact O-N 3.13Å; M218-A220 PolarHBondContact O-N 3.41Å
219	P	57.1	Low	51.6	Low	123 Å²	123	127 Å²	127	80%	0.799	79%	0.787	S	S	*	*	P	Polyproline II helix	trans	-64.1	132.5	176.1	27.3	-33.9	0	0	0	110.1	G221	P219-G221 PolarHBondContact O-N 2.93Å
220	A	44.2	Very low	52.2	Low	100 Å²	100	127 Å²	127	83%	0.826	79%	0.786	S	S	*	*	P	Polyproline II helix	trans	-59	122.4	175.5	0	0	0	0	0	109.7	M218 T222	M218-A220 PolarHBondContact O-N 3.41Å; A220-T222 PolarHBondContact O-N 3.4Å; A220-T222 VanDerWaalsContact O-N 3.16Å
221	G	41.1	Very low	53.1	Low	75 Å²	75	123.5 Å²	123.5	77%	0.773	77%	0.774	S	S	*	*	P	Polyproline II helix	trans	-60.6	118	-176.6	0	0	0	0	0	111.3	P219	P219-G221 PolarHBondContact O-N 2.93Å
222	T	51.3	Low	54.6	Low	130 Å²	130	123.3 Å²	123.3	80%	0.798	76%	0.761	S	S	*	*	P	Polyproline II helix	trans	-56.7	128.9	170	44.3	0	0	0	0	109.4	A220	A220-T222 PolarHBondContact O-N 3.4Å; A220-T222 VanDerWaalsContact O-N 3.16Å
223	P	53.4	Low	56.4	Low	113 Å²	113	119.6 Å²	119.6	73%	0.734	74%	0.741	S	S	*	*	P	Polyproline II helix	trans	-60	146.9	175.7	26.2	-34.1	0	0	0	110
224	P	52.1	Low	57.8	Low	110 Å²	110	114.2 Å²	114.2	71%	0.714	71%	0.706	S	S	*	*	P	Polyproline II helix	trans	-61.6	149.4	-174.3	25.2	-34.6	0	0	0	111.5	Q226	P224-Q226 PolarHBondContact O-N 2.7Å; P224-Q226 VanDerWaalsContact O-N 3.13Å
225	P	49	Very low	59.3	Low	127 Å²	127	114.8 Å²	114.8	83%	0.825	70%	0.697	S	S	*	*	P	Polyproline II helix	trans	-59.8	120	179	-19.2	30.9	0	0	0	110
226	Q	49.7	Very low	60.7	Low	183 Å²	183	113 Å²	113	86%	0.855	68%	0.683	S	S	*	*	P	Polyproline II helix	trans	-63.8	128.7	174.8	-70	-160.8	-2.8	0	0	109.2	P224	P224-Q226 PolarHBondContact O-N 2.7Å; P224-Q226 VanDerWaalsContact O-N 3.13Å
227	P	52.6	Low	61.6	Low	112 Å²	112	110.4 Å²	110.4	73%	0.727	67%	0.667	S	S	*	*	P	Polyproline II helix	trans	-61.6	141.7	178.6	26.1	-34.1	0	0	0	109.3	A229	P227-A229 PolarHBondContact O-N 2.9Å
228	P	50.5	Low	62.7	Low	110 Å²	110	106.9 Å²	106.9	71%	0.714	65%	0.653	S	S	*	*			trans	-60	112.6	-173.4	23.3	-33.7	0	0	0	110.2	K230	P228-K230 VanDerWaalsContact O-CG 3.31Å; P228-K230 WeakPolarHBondContact O-CG 3.36Å; P228-K230 PolarHBondContact O-N 3.3Å
229	A	53.7	Low	64	Low	97 Å²	97	104.2 Å²	104.2	80%	0.802	64%	0.637	S	S	*	*			trans	-62.7	100.8	-178.8	0	0	0	0	0	109.5	P227 S231	P227-A229 PolarHBondContact O-N 2.9Å; A229-S231 VanDerWaalsContact C-N 3.26Å; A229-S231 PolarHBondContact O-N 3.24Å
230	K	58.7	Low	65.3	Low	186 Å²	186	102.9 Å²	102.9	81%	0.809	63%	0.627	S	S	*	*			trans	-67.6	77.1	-170.4	-57.8	-175.8	-176.8	177.8	0	111.4	P228 K232	P228-K230 VanDerWaalsContact O-CG 3.31Å; P228-K230 WeakPolarHBondContact O-CG 3.36Å; P228-K230 PolarHBondContact O-N 3.3Å; K230-K232 PolarHBondContact O-N 3.05Å
231	S	68.5	Low	67.4	Low	76 Å²	76	100.4 Å²	100.4	53%	0.531	60%	0.597	S	S	.	*			trans	-61	125.1	-173.2	64.1	0	0	0	0	111.3	A229 S233	A229-S231 VanDerWaalsContact C-N 3.26Å; A229-S231 PolarHBondContact O-N 3.24Å; S231-S233 PolarHBondContact O-N 3.19Å
232	K	72.2	Confident	69.5	Low	93 Å²	93	106.2 Å²	106.2	40%	0.404	60%	0.601	S	S	.	*	E	Extended strand (participates in β ladder)	trans	-82.8	97.1	-177.2	-64.7	-61.6	-166.2	133.2	0	109.8	K230 F241 L247	K230-K232 PolarHBondContact O-N 3.05Å; K232-F241 PolarHBondContact N-O 2.79Å; K232-F241 PolarHBondContact O-N 3.28Å; K232-L247 HydrophobicContact CB-CB 4.31Å; K232-L247 HydrophobicContact CB-CD2 3.78Å
233	S	83.8	Confident	71.2	Confident	63 Å²	63	106.2 Å²	106.2	44%	0.441	59%	0.591	S	S	.	*	E	Extended strand (participates in β ladder)	trans	-83	153	176.7	49.4	0	0	0	0	112.9	S231 K239 L247	S231-S233 PolarHBondContact O-N 3.19Å; S233-K239 CarbonylContact C-O 3.51Å; S233-K239 WeakPolarHBondContact CA-O 3.23Å; S233-L247 WeakPolarHBondContact O-CD2 3.47Å
234	C	88.1	Confident	72.9	Confident	1 Å²	1	104.7 Å²	104.7	1%	0.007	57%	0.573	C	S	.	*			trans	-94.7	122.2	172.5	-173.8	0	0	0	0	111.7	F236 C237 G238 K239 F241 L247	C234-F236 VanDerWaalsContact C-N 3.28Å; C234-F236 PolarHBondContact O-N 3.47Å; C234-C237 PolarHBondContact O-N 3.1Å; C234-G238 WeakPolarHBondContact O-CA 3.15Å; C234-G238 PolarHBondContact O-N 3.18Å; C234-K239 PolarHBondContact N-O 2.98Å; C234-F241 HydrophobicContact CB-CE2 4.45Å; C234-L247 HydrophobicContact CB-CD1 3.49Å; C234-L247 VanDerWaalsContact CB-CD1 3.49Å
235	E	84.7	Confident	74.6	Confident	138 Å²	138	103 Å²	103	65%	0.645	56%	0.564	S	S	*	*	T	Hydrogen-bonded Turn	trans	-54.6	-42.2	-178.3	-55.7	105.1	-84.8	0	0	112.8	C237	E235-C237 VanDerWaalsContact C-N 3.3Å; E235-C237 PolarHBondContact O-N 3.42Å
236	F	80	Confident	76.4	Confident	128 Å²	128	100.6 Å²	100.6	56%	0.561	55%	0.545	S	S	*	.	T	Hydrogen-bonded Turn	trans	-72	-10.8	-175.8	-59.9	-74.6	0	0	0	115.7	C234 R251 H254	C234-F236 VanDerWaalsContact C-N 3.28Å; C234-F236 PolarHBondContact O-N 3.47Å; F236-R251 HydrophobicContact CD2-CG 4.21Å; F236-R251 HydrophobicContact CE2-CG 3.95Å; F236-H254 HydrophobicContact CB-CB 4.26Å; F236-H254 HydrophobicContact CD2-CB 3.96Å; F236-H254 AromaticContact CD2-CD2 3.91Å; F236-H254 HydrophobicContact CG-CB 4.06Å; F236-H254 AromaticContact CG-CG 4Å
237	C	85.5	Confident	78.3	Confident	51 Å²	51	92.3 Å²	92.3	35%	0.345	51%	0.506	S	S	.	.	T	Hydrogen-bonded Turn	trans	-158.7	7.2	-174.6	72.1	0	0	0	0	116.7	C234 E235 K239 H250	C234-C237 PolarHBondContact O-N 3.1Å; E235-C237 VanDerWaalsContact C-N 3.3Å; E235-C237 PolarHBondContact O-N 3.42Å; C237-K239 PolarHBondContact O-N 3.35Å; C237-K239 VanDerWaalsContact SG-CG 3.58Å; C237-H250 PolarHBondContact SG-NE2 3.34Å
238	G	83.3	Confident	79.8	Confident	53 Å²	53	89.2 Å²	89.2	55%	0.546	48%	0.483	S	S	.	.			trans	69.6	-7.5	179.1	0	0	0	0	0	116.6	C234 T240	C234-G238 WeakPolarHBondContact O-CA 3.15Å; C234-G238 PolarHBondContact O-N 3.18Å; G238-T240 PolarHBondContact O-N 2.81Å
239	K	84	Confident	81.5	Confident	119 Å²	119	86 Å²	86	52%	0.517	46%	0.461	S	S	.	.			trans	-62	121.9	-175.3	-69.8	176.1	-172	171.8	0	111.5	S233 C234 C237 F241	S233-K239 CarbonylContact C-O 3.51Å; S233-K239 WeakPolarHBondContact CA-O 3.23Å; C234-K239 PolarHBondContact N-O 2.98Å; C237-K239 PolarHBondContact O-N 3.35Å; C237-K239 VanDerWaalsContact SG-CG 3.58Å; K239-F241 HydrophobicContact CB-CE2 3.74Å; K239-F241 HydrophobicContact CB-CZ 3.99Å; K239-F241 WeakPolarHBondContact O-CD2 3.34Å; K239-F241 VanDerWaalsContact O-CE2 3.27Å; K239-F241 WeakPolarHBondContact O-CE2 3.48Å
240	T	85.7	Confident	83.2	Confident	95 Å²	95	82.8 Å²	82.8	58%	0.583	43%	0.429	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-87.9	139	177	45.2	0	0	0	0	111.8	G238	G238-T240 PolarHBondContact O-N 2.81Å
241	F	87.4	Confident	84.6	Confident	49 Å²	49	78 Å²	78	22%	0.215	41%	0.406	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-125.4	141	177.9	-62.6	-87.7	0	0	0	110.6	K232 C234 K239 F243 N246 L247 H250	K232-F241 PolarHBondContact N-O 2.79Å; K232-F241 PolarHBondContact O-N 3.28Å; C234-F241 HydrophobicContact CB-CE2 4.45Å; K239-F241 HydrophobicContact CB-CE2 3.74Å; K239-F241 HydrophobicContact CB-CZ 3.99Å; K239-F241 WeakPolarHBondContact O-CD2 3.34Å; K239-F241 VanDerWaalsContact O-CE2 3.27Å; K239-F241 WeakPolarHBondContact O-CE2 3.48Å; F241-F243 PolarHBondContact O-N 3.37Å; F241-N246 HydrophobicContact CB-CB 4.14Å; F241-N246 HydrophobicContact CD1-CB 3.78Å; F241-N246 HydrophobicContact CG-CB 4.2Å; F241-L247 HydrophobicContact CB-CB 4.37Å; F241-L247 HydrophobicContact CD2-CB 4.06Å; F241-L247 HydrophobicContact CD2-CD1 4.09Å; F241-L247 HydrophobicContact CE2-CD1 4.34Å; F241-L247 HydrophobicContact CG-CB 4.42Å; F241-H250 HydrophobicContact CE1-CB 4.18Å; F241-H250 HydrophobicContact CE2-CB 3.86Å; F241-H250 AromaticContact CE2-CD2 3.45Å; F241-H250 VanDerWaalsContact CE2-CD2 3.45Å; F241-H250 WeakPolarHBondContact CE2-CD2 3.33Å; F241-H250 AromaticContact CE2-CG 3.82Å; F241-H250 HydrophobicContact CZ-CB 3.52Å; F241-H250 AromaticContact CZ-CD2 3.48Å; F241-H250 VanDerWaalsContact CZ-CD2 3.48Å; F241-H250 WeakPolarHBondContact CZ-CD2 3.2Å; F241-H250 AromaticContact CZ-CG 3.46Å; F241-H250 VanDerWaalsContact CZ-CG 3.46Å
242	K	85.6	Confident	85.4	Confident	197 Å²	197	77.5 Å²	77.5	86%	0.857	39%	0.393	S	S	*	.	S	Bend	trans	-65.1	-22.5	175.3	-66.6	-168.5	175.6	-169.2	0	113.4
243	F	86	Confident	85.9	Confident	130 Å²	130	76.6 Å²	76.6	57%	0.57	40%	0.398	S	S	*	.	S	Bend	trans	-135.1	141	-174.9	-57.5	-66.2	0	0	0	111.4	F241 S245 N246 L247	F241-F243 PolarHBondContact O-N 3.37Å; F243-S245 VanDerWaalsContact C-N 3.28Å; F243-S245 PolarHBondContact O-N 3.3Å; F243-N246 PolarHBondContact O-N 3.09Å; F243-L247 PolarHBondContact O-N 3.19Å
244	Q	89.2	Confident	85.9	Confident	80 Å²	80	77.1 Å²	77.1	37%	0.374	39%	0.393	S	S	.	.	H	α-helix	trans	-57.2	-39.8	176.7	-178.3	70.4	20.5	0	0	112	N246 L247 I248	Q244-N246 VanDerWaalsContact C-N 3.33Å; Q244-N246 PolarHBondContact O-N 2.8Å; Q244-L247 WeakPolarHBondContact O-CB 3.28Å; Q244-L247 PolarHBondContact O-N 3.32Å; Q244-L247 VanDerWaalsContact O-N 3.1Å; Q244-I248 HydrophobicContact CG-CG1 4.36Å; Q244-I248 WeakPolarHBondContact O-CG1 3.45Å; Q244-I248 PolarHBondContact O-N 2.78Å
245	S	87.3	Confident	85.6	Confident	74 Å²	74	80.3 Å²	80.3	52%	0.517	41%	0.413	S	S	.	.	H	α-helix	trans	-55.2	-45.2	178	50.8	0	0	0	0	112.5	F243 I248 V249	F243-S245 VanDerWaalsContact C-N 3.28Å; F243-S245 PolarHBondContact O-N 3.3Å; S245-I248 PolarHBondContact O-N 3.23Å; S245-V249 WeakPolarHBondContact O-CB 3.01Å; S245-V249 VanDerWaalsContact O-CG2 3.32Å; S245-V249 WeakPolarHBondContact O-CG2 3.12Å; S245-V249 PolarHBondContact O-N 2.76Å
246	N	87	Confident	85.3	Confident	78 Å²	78	76.2 Å²	76.2	42%	0.417	41%	0.408	S	S	.	.	H	α-helix	trans	-66.8	-36.4	176.8	-72.5	-32.6	0	0	0	112.4	F241 F243 Q244 H250	F241-N246 HydrophobicContact CB-CB 4.14Å; F241-N246 HydrophobicContact CD1-CB 3.78Å; F241-N246 HydrophobicContact CG-CB 4.2Å; F243-N246 PolarHBondContact O-N 3.09Å; Q244-N246 VanDerWaalsContact C-N 3.33Å; Q244-N246 PolarHBondContact O-N 2.8Å; N246-H250 WeakPolarHBondContact O-CB 3.17Å; N246-H250 PolarHBondContact O-N 3.29Å
247	L	89.3	Confident	85.3	Confident	8 Å²	8	75.3 Å²	75.3	4%	0.042	41%	0.405	C	S	.	.	H	α-helix	trans	-63.6	-47.5	172.1	172	60.5	0	0	0	111.7	K232 S233 C234 F241 F243 Q244 V249 H250 R251	K232-L247 HydrophobicContact CB-CB 4.31Å; K232-L247 HydrophobicContact CB-CD2 3.78Å; S233-L247 WeakPolarHBondContact O-CD2 3.47Å; C234-L247 HydrophobicContact CB-CD1 3.49Å; C234-L247 VanDerWaalsContact CB-CD1 3.49Å; F241-L247 HydrophobicContact CB-CB 4.37Å; F241-L247 HydrophobicContact CD2-CB 4.06Å; F241-L247 HydrophobicContact CD2-CD1 4.09Å; F241-L247 HydrophobicContact CE2-CD1 4.34Å; F241-L247 HydrophobicContact CG-CB 4.42Å; F243-L247 PolarHBondContact O-N 3.19Å; Q244-L247 WeakPolarHBondContact O-CB 3.28Å; Q244-L247 PolarHBondContact O-N 3.32Å; Q244-L247 VanDerWaalsContact O-N 3.1Å; L247-V249 VanDerWaalsContact C-N 3.33Å; L247-V249 PolarHBondContact O-N 3.48Å; L247-H250 CarbonylContact O-C 3.58Å; L247-H250 PolarHBondContact O-N 2.7Å; L247-H250 VanDerWaalsContact O-N 3.16Å; L247-R251 PolarHBondContact O-N 3.42Å
248	I	86	Confident	85.2	Confident	48 Å²	48	78.4 Å²	78.4	25%	0.246	41%	0.413	C	S	.	.	H	α-helix	trans	-59	-46.9	177.5	-63	-61	0	0	0	110.6	Q244 S245 H250 R251 R252	Q244-I248 HydrophobicContact CG-CG1 4.36Å; Q244-I248 WeakPolarHBondContact O-CG1 3.45Å; Q244-I248 PolarHBondContact O-N 2.78Å; S245-I248 PolarHBondContact O-N 3.23Å; I248-H250 VanDerWaalsContact C-N 3.28Å; I248-H250 PolarHBondContact O-N 3.47Å; I248-R251 PolarHBondContact O-N 3.39Å; I248-R252 PolarHBondContact O-N 3.29Å
249	V	86.3	Confident	85.2	Confident	43 Å²	43	79.7 Å²	79.7	26%	0.261	41%	0.412	S	S	.	.	H	α-helix	trans	-64.7	-31.4	178.1	168.2	0	0	0	0	112.2	S245 L247 Q271	S245-V249 WeakPolarHBondContact O-CB 3.01Å; S245-V249 VanDerWaalsContact O-CG2 3.32Å; S245-V249 WeakPolarHBondContact O-CG2 3.12Å; S245-V249 PolarHBondContact O-N 2.76Å; L247-V249 VanDerWaalsContact C-N 3.33Å; L247-V249 PolarHBondContact O-N 3.48Å; V249-Q271 HydrophobicContact CG1-CG 3.74Å
250	H	87.6	Confident	85.2	Confident	28 Å²	28	78 Å²	78	13%	0.13	40%	0.403	C	S	.	.	H	α-helix	trans	-74.9	-38.5	171.7	179.5	44.2	0	0	0	112.7	C237 F241 N246 L247 I248 R252 S253 H254	C237-H250 PolarHBondContact SG-NE2 3.34Å; F241-H250 HydrophobicContact CE1-CB 4.18Å; F241-H250 HydrophobicContact CE2-CB 3.86Å; F241-H250 AromaticContact CE2-CD2 3.45Å; F241-H250 VanDerWaalsContact CE2-CD2 3.45Å; F241-H250 WeakPolarHBondContact CE2-CD2 3.33Å; F241-H250 AromaticContact CE2-CG 3.82Å; F241-H250 HydrophobicContact CZ-CB 3.52Å; F241-H250 AromaticContact CZ-CD2 3.48Å; F241-H250 VanDerWaalsContact CZ-CD2 3.48Å; F241-H250 WeakPolarHBondContact CZ-CD2 3.2Å; F241-H250 AromaticContact CZ-CG 3.46Å; F241-H250 VanDerWaalsContact CZ-CG 3.46Å; N246-H250 WeakPolarHBondContact O-CB 3.17Å; N246-H250 PolarHBondContact O-N 3.29Å; L247-H250 CarbonylContact O-C 3.58Å; L247-H250 PolarHBondContact O-N 2.7Å; L247-H250 VanDerWaalsContact O-N 3.16Å; I248-H250 VanDerWaalsContact C-N 3.28Å; I248-H250 PolarHBondContact O-N 3.47Å; H250-R252 PolarHBondContact O-N 2.97Å; H250-S253 PolarHBondContact CE1-OG 3.17Å; H250-S253 VanDerWaalsContact CE1-OG 3.3Å; H250-S253 PolarHBondContact ND1-OG 3.5Å; H250-S253 WeakPolarHBondContact O-CA 3.46Å; H250-S253 WeakPolarHBondContact O-CB 3.48Å; H250-S253 PolarHBondContact O-N 3.26Å; H250-S253 PolarHBondContact O-OG 2.73Å; H250-H254 AromaticContact CD2-NE2 3.95Å; H250-H254 AromaticContact CE1-NE2 3.41Å; H250-H254 PolarHBondContact CE1-NE2 2.92Å; H250-H254 AromaticContact NE2-CD2 3.93Å; H250-H254 AromaticContact NE2-CE1 3.96Å; H250-H254 AromaticContact NE2-NE2 3.08Å; H250-H254 PolarHBondContact NE2-NE2 3.35Å
251	R	88.1	Confident	85.2	Confident	86 Å²	86	81.2 Å²	81.2	33%	0.325	41%	0.409	S	S	.	.	H	α-helix	trans	-60.9	-34	179.5	-166.4	168.9	64.6	-149.7	3.4	112.3	F236 L247 I248 S253 H254 T255	F236-R251 HydrophobicContact CD2-CG 4.21Å; F236-R251 HydrophobicContact CE2-CG 3.95Å; L247-R251 PolarHBondContact O-N 3.42Å; I248-R251 PolarHBondContact O-N 3.39Å; R251-S253 PolarHBondContact O-N 3.13Å; R251-S253 VanDerWaalsContact O-N 3.07Å; R251-H254 PolarHBondContact O-N 3.31Å; R251-T255 PolarHBondContact O-N 2.91Å
252	R	86.8	Confident	85.3	Confident	66 Å²	66	79.4 Å²	79.4	25%	0.249	40%	0.402	C	S	.	.	T	Hydrogen-bonded Turn	trans	-60.2	-11.4	169.1	-64.9	-179.4	-169.4	159.9	2.5	115.3	I248 H250 T255	I248-R252 PolarHBondContact O-N 3.29Å; H250-R252 PolarHBondContact O-N 2.97Å; R252-T255 WeakPolarHBondContact CA-OG1 3.21Å
253	S	82.4	Confident	85.2	Confident	73 Å²	73	78.8 Å²	78.8	51%	0.51	40%	0.402	S	S	.	.	T	Hydrogen-bonded Turn	trans	-89	-9.4	171.2	66.9	0	0	0	0	114	H250 R251	H250-S253 PolarHBondContact CE1-OG 3.17Å; H250-S253 VanDerWaalsContact CE1-OG 3.3Å; H250-S253 PolarHBondContact ND1-OG 3.5Å; H250-S253 WeakPolarHBondContact O-CA 3.46Å; H250-S253 WeakPolarHBondContact O-CB 3.48Å; H250-S253 PolarHBondContact O-N 3.26Å; H250-S253 PolarHBondContact O-OG 2.73Å; R251-S253 PolarHBondContact O-N 3.13Å; R251-S253 VanDerWaalsContact O-N 3.07Å
254	H	83.4	Confident	85.1	Confident	74 Å²	74	78.1 Å²	78.1	34%	0.343	40%	0.404	S	S	.	.	T	Hydrogen-bonded Turn	trans	-97.9	-42.7	169.8	-59.6	-70.7	0	0	0	111.7	F236 H250 R251 G256	F236-H254 HydrophobicContact CB-CB 4.26Å; F236-H254 HydrophobicContact CD2-CB 3.96Å; F236-H254 AromaticContact CD2-CD2 3.91Å; F236-H254 HydrophobicContact CG-CB 4.06Å; F236-H254 AromaticContact CG-CG 4Å; H250-H254 AromaticContact CD2-NE2 3.95Å; H250-H254 AromaticContact CE1-NE2 3.41Å; H250-H254 PolarHBondContact CE1-NE2 2.92Å; H250-H254 AromaticContact NE2-CD2 3.93Å; H250-H254 AromaticContact NE2-CE1 3.96Å; H250-H254 AromaticContact NE2-NE2 3.08Å; H250-H254 PolarHBondContact NE2-NE2 3.35Å; R251-H254 PolarHBondContact O-N 3.31Å; H254-G256 PolarHBondContact O-N 3.43Å
255	T	81	Confident	85.1	Confident	68 Å²	68	76.5 Å²	76.5	42%	0.417	40%	0.401	S	S	.	.	S	Bend	trans	-71.9	-10.3	178.2	58.3	0	0	0	0	113.8	R251 R252 E257	R251-T255 PolarHBondContact O-N 2.91Å; R252-T255 WeakPolarHBondContact CA-OG1 3.21Å; T255-E257 VanDerWaalsContact CB-OE2 3.32Å; T255-E257 WeakPolarHBondContact CB-OE2 3.39Å; T255-E257 PolarHBondContact O-N 2.62Å; T255-E257 VanDerWaalsContact OG1-CD 3.32Å; T255-E257 WeakPolarHBondContact OG1-CG 3.4Å; T255-E257 PolarHBondContact OG1-OE2 3.48Å
256	G	78.5	Confident	85	Confident	52 Å²	52	81 Å²	81	54%	0.536	42%	0.419	S	S	.	.			trans	70.1	-3.6	-178	0	0	0	0	0	115.1	H254 K258	H254-G256 PolarHBondContact O-N 3.43Å; G256-K258 WeakPolarHBondContact O-CG 3.32Å; G256-K258 PolarHBondContact O-N 2.97Å
257	E	81	Confident	84.8	Confident	109 Å²	109	81.8 Å²	81.8	51%	0.509	42%	0.42	S	S	.	.			trans	-60.2	130.8	-173.1	-66.4	166.7	123	0	0	112.7	T255 P259 S270	T255-E257 VanDerWaalsContact CB-OE2 3.32Å; T255-E257 WeakPolarHBondContact CB-OE2 3.39Å; T255-E257 PolarHBondContact O-N 2.62Å; T255-E257 VanDerWaalsContact OG1-CD 3.32Å; T255-E257 WeakPolarHBondContact OG1-CG 3.4Å; T255-E257 PolarHBondContact OG1-OE2 3.48Å; E257-P259 WeakPolarHBondContact O-CD 3.3Å; E257-S270 VanDerWaalsContact O-CB 3.26Å; E257-S270 WeakPolarHBondContact O-CB 3.48Å
258	K	83.1	Confident	84.7	Confident	116 Å²	116	82.5 Å²	82.5	50%	0.504	43%	0.427	S	S	.	.			trans	-125.9	72.3	-177.2	-72.5	164.9	159.3	-145.9	0	111.9	G256 Y260 A268 C269	G256-K258 WeakPolarHBondContact O-CG 3.32Å; G256-K258 PolarHBondContact O-N 2.97Å; K258-Y260 PolarHBondContact O-N 3.18Å; K258-Y260 VanDerWaalsContact O-N 3.13Å; K258-A268 HydrophobicContact CB-CB 3.81Å; K258-A268 HydrophobicContact CD-CB 4.23Å; K258-A268 VanDerWaalsContact CD-O 3.23Å; K258-A268 WeakPolarHBondContact CD-O 3.2Å; K258-A268 VanDerWaalsContact CE-O 3.25Å; K258-A268 WeakPolarHBondContact CE-O 3.37Å; K258-A268 PolarHBondContact NZ-O 3.45Å; K258-C269 CarbonylContact C-O 3.31Å; K258-C269 VanDerWaalsContact C-O 3.31Å; K258-C269 WeakPolarHBondContact CA-O 2.93Å
259	P	83.7	Confident	84.6	Confident	81 Å²	81	80.8 Å²	80.8	53%	0.526	42%	0.419	S	S	.	.			trans	-62.8	-21.7	-176.2	-23.4	35	0	0	0	114.5	E257 K261	E257-P259 WeakPolarHBondContact O-CD 3.3Å; P259-K261 PolarHBondContact O-N 2.78Å
260	Y	83.8	Confident	84.6	Confident	83 Å²	83	79.5 Å²	79.5	33%	0.325	41%	0.412	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-101	86	-173.1	-57.2	-81	0	0	0	110.6	K258 C269 Q271 A272	K258-Y260 PolarHBondContact O-N 3.18Å; K258-Y260 VanDerWaalsContact O-N 3.13Å; Y260-C269 WeakPolarHBondContact CB-O 3.43Å; Y260-C269 PolarHBondContact N-O 3.39Å; Y260-C269 PolarHBondContact O-N 2.84Å; Y260-C269 PolarHBondContact O-SG 2.98Å; Y260-C269 VanDerWaalsContact O-SG 3.42Å; Y260-Q271 VanDerWaalsContact CD2-C 3.48Å; Y260-A272 HydrophobicContact CD1-CB 4.01Å; Y260-A272 HydrophobicContact CE1-CB 3.71Å
261	K	85.5	Confident	84.5	Confident	163 Å²	163	80.6 Å²	80.6	71%	0.709	42%	0.417	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-75.4	144.3	170.4	61.2	-179.2	178.8	178.4	0	111.9	P259 A268	P259-K261 PolarHBondContact O-N 2.78Å; K261-A268 HydrophobicContact CB-CB 4.3Å
262	C	90.1	Very high	84.5	Confident	11 Å²	11	78.9 Å²	78.9	7%	0.074	42%	0.421	C	S	.	.			trans	-74.7	157.5	165.2	-174.8	0	0	0	0	110.5	L264 C265 H267 L275 H278 M279 H282	C262-L264 PolarHBondContact SG-N 2.83Å; C262-C265 WeakPolarHBondContact CB-O 3.46Å; C262-H267 WeakPolarHBondContact CB-O 3.32Å; C262-H267 PolarHBondContact N-O 3.14Å; C262-H267 VanDerWaalsContact N-O 3.16Å; C262-L275 HydrophobicContact CB-CD1 4.03Å; C262-H278 WeakPolarHBondContact CB-NE2 3.44Å; C262-H278 PolarHBondContact SG-NE2 3.19Å; C262-M279 PolarHBondContact SG-SD 3.13Å; C262-H282 PolarHBondContact SG-NE2 3.02Å
263	Q	83.8	Confident	84.6	Confident	184 Å²	184	79 Å²	79	86%	0.86	43%	0.433	S	S	*	.	S	Bend	trans	-102.6	-7.8	175.2	-62.9	-179.8	1.9	0	0	112.6
264	L	83.7	Confident	84.8	Confident	115 Å²	115	79.9 Å²	79.9	60%	0.602	43%	0.427	S	S	*	.	S	Bend	trans	-113.3	-3.5	-176.1	-57.1	175.6	0	0	0	113	C262 M279 H282	C262-L264 PolarHBondContact SG-N 2.83Å; L264-M279 HydrophobicContact CD1-SD 4.49Å; L264-H282 HydrophobicContact CD1-CB 3.62Å
265	C	88.5	Confident	85.1	Confident	46 Å²	46	77.7 Å²	77.7	31%	0.311	42%	0.418	S	S	.	.	S	Bend	trans	-169.1	171.6	169	68.3	0	0	0	0	109.8	C262 H267 H278 H282	C262-C265 WeakPolarHBondContact CB-O 3.46Å; C265-H267 PolarHBondContact O-N 2.86Å; C265-H278 VanDerWaalsContact SG-CE1 3.51Å; C265-H278 PolarHBondContact SG-NE2 3.4Å; C265-H282 VanDerWaalsContact SG-CE1 3.52Å; C265-H282 PolarHBondContact SG-NE2 3.41Å
266	D	85.1	Confident	85.5	Confident	168 Å²	168	83 Å²	83	90%	0.898	44%	0.435	S	S	*	.	S	Bend	trans	-72.8	10	-176	-47.1	-74.2	0	0	0	115.1	A268	D266-A268 PolarHBondContact O-N 3.28Å
267	H	83.7	Confident	86	Confident	96 Å²	96	89.5 Å²	89.5	44%	0.444	44%	0.444	S	S	.	.			trans	-77.4	99.6	-174.9	-163.8	68.2	0	0	0	112.7	C262 C265 H278	C262-H267 WeakPolarHBondContact CB-O 3.32Å; C262-H267 PolarHBondContact N-O 3.14Å; C262-H267 VanDerWaalsContact N-O 3.16Å; C265-H267 PolarHBondContact O-N 2.86Å; H267-H278 AromaticContact CD2-CE1 3.94Å; H267-H278 AromaticContact CD2-CG 3.92Å; H267-H278 AromaticContact CD2-ND1 3.68Å
268	A	86.9	Confident	86.5	Confident	23 Å²	23	85.9 Å²	85.9	19%	0.19	43%	0.427	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-94.4	143.1	172.3	0	0	0	0	0	113.3	K258 K261 D266	K258-A268 HydrophobicContact CB-CB 3.81Å; K258-A268 HydrophobicContact CD-CB 4.23Å; K258-A268 VanDerWaalsContact CD-O 3.23Å; K258-A268 WeakPolarHBondContact CD-O 3.2Å; K258-A268 VanDerWaalsContact CE-O 3.25Å; K258-A268 WeakPolarHBondContact CE-O 3.37Å; K258-A268 PolarHBondContact NZ-O 3.45Å; K261-A268 HydrophobicContact CB-CB 4.3Å; D266-A268 PolarHBondContact O-N 3.28Å
269	C	84.2	Confident	86.7	Confident	11 Å²	11	83.2 Å²	83.2	7%	0.074	42%	0.417	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-139.8	163.3	-177.7	72.6	0	0	0	0	113.8	K258 Y260 Q271 K274 L275	K258-C269 CarbonylContact C-O 3.31Å; K258-C269 VanDerWaalsContact C-O 3.31Å; K258-C269 WeakPolarHBondContact CA-O 2.93Å; Y260-C269 WeakPolarHBondContact CB-O 3.43Å; Y260-C269 PolarHBondContact N-O 3.39Å; Y260-C269 PolarHBondContact O-N 2.84Å; Y260-C269 PolarHBondContact O-SG 2.98Å; Y260-C269 VanDerWaalsContact O-SG 3.42Å; C269-Q271 PolarHBondContact SG-O 3.19Å; C269-Q271 VanDerWaalsContact SG-O 3.42Å; C269-K274 HydrophobicContact CB-CB 4.18Å; C269-L275 PolarHBondContact SG-N 3.26Å; C269-L275 VanDerWaalsContact SG-N 3.42Å
270	S	84.9	Confident	86.9	Confident	17 Å²	17	85.3 Å²	85.3	12%	0.119	42%	0.418	C	S	.	.	S	Bend	trans	-88.9	-1.1	-172.1	55.2	0	0	0	0	115.9	E257	E257-S270 VanDerWaalsContact O-CB 3.26Å; E257-S270 WeakPolarHBondContact O-CB 3.48Å
271	Q	85.9	Confident	87	Confident	50 Å²	50	85.5 Å²	85.5	23%	0.234	43%	0.427	C	S	.	.			trans	-147.1	134.4	-175.7	-63.7	172.2	12.8	0	0	111.8	V249 Y260 C269 S273 K274 L275	V249-Q271 HydrophobicContact CG1-CG 3.74Å; Y260-Q271 VanDerWaalsContact CD2-C 3.48Å; C269-Q271 PolarHBondContact SG-O 3.19Å; C269-Q271 VanDerWaalsContact SG-O 3.42Å; Q271-S273 PolarHBondContact O-N 3.37Å; Q271-S273 PolarHBondContact OE1-OG 3.26Å; Q271-K274 HydrophobicContact CB-CB 4.47Å; Q271-K274 HydrophobicContact CB-CD 4.24Å; Q271-K274 HydrophobicContact CB-CG 4.15Å; Q271-K274 WeakPolarHBondContact O-CB 3.48Å; Q271-K274 PolarHBondContact O-N 3.14Å; Q271-L275 PolarHBondContact O-N 3.38Å
272	A	88.7	Confident	86.9	Confident	50 Å²	50	79.7 Å²	79.7	41%	0.413	40%	0.403	S	S	.	.	H	α-helix	trans	-56.2	-34.7	176.6	0	0	0	0	0	113.7	Y260 K274 L275 K276	Y260-A272 HydrophobicContact CD1-CB 4.01Å; Y260-A272 HydrophobicContact CE1-CB 3.71Å; A272-K274 VanDerWaalsContact C-N 3.29Å; A272-K274 PolarHBondContact O-N 2.98Å; A272-L275 WeakPolarHBondContact O-CB 3.47Å; A272-L275 PolarHBondContact O-N 3.44Å; A272-L275 VanDerWaalsContact O-N 3.14Å; A272-K276 PolarHBondContact O-N 3.11Å
273	S	88.2	Confident	86.1	Confident	70 Å²	70	86.4 Å²	86.4	49%	0.49	44%	0.435	S	S	.	.	H	α-helix	trans	-63.8	-32	176.1	58.8	0	0	0	0	113.2	Q271 R277	Q271-S273 PolarHBondContact O-N 3.37Å; Q271-S273 PolarHBondContact OE1-OG 3.26Å; S273-R277 PolarHBondContact O-N 3.44Å
274	K	88.2	Confident	85	Confident	90 Å²	90	84.7 Å²	84.7	39%	0.391	43%	0.427	S	S	.	.	H	α-helix	trans	-73.7	-39.8	171.9	-65.4	178.3	-177.4	176	0	110.6	C269 Q271 A272 R277 H278	C269-K274 HydrophobicContact CB-CB 4.18Å; Q271-K274 HydrophobicContact CB-CB 4.47Å; Q271-K274 HydrophobicContact CB-CD 4.24Å; Q271-K274 HydrophobicContact CB-CG 4.15Å; Q271-K274 WeakPolarHBondContact O-CB 3.48Å; Q271-K274 PolarHBondContact O-N 3.14Å; A272-K274 VanDerWaalsContact C-N 3.29Å; A272-K274 PolarHBondContact O-N 2.98Å; K274-R277 PolarHBondContact O-N 3.33Å; K274-H278 WeakPolarHBondContact O-CB 3.36Å; K274-H278 PolarHBondContact O-N 3.48Å
275	L	89.6	Confident	83.7	Confident	29 Å²	29	86.1 Å²	86.1	15%	0.152	43%	0.428	C	S	.	.	H	α-helix	trans	-62.2	-48.4	175.6	-176.8	61.2	0	0	0	111.7	C262 C269 Q271 A272 R277 H278 M279	C262-L275 HydrophobicContact CB-CD1 4.03Å; C269-L275 PolarHBondContact SG-N 3.26Å; C269-L275 VanDerWaalsContact SG-N 3.42Å; Q271-L275 PolarHBondContact O-N 3.38Å; A272-L275 WeakPolarHBondContact O-CB 3.47Å; A272-L275 PolarHBondContact O-N 3.44Å; A272-L275 VanDerWaalsContact O-N 3.14Å; L275-R277 VanDerWaalsContact C-N 3.28Å; L275-R277 PolarHBondContact O-N 3.05Å; L275-H278 PolarHBondContact O-N 2.73Å; L275-H278 VanDerWaalsContact O-N 3.11Å; L275-M279 HydrophobicContact CD1-CE 3.8Å; L275-M279 HydrophobicContact CD2-CE 4.19Å; L275-M279 HydrophobicContact CG-CE 3.89Å; L275-M279 PolarHBondContact O-N 3Å
276	K	88.9	Confident	81.8	Confident	178 Å²	178	87.4 Å²	87.4	77%	0.774	44%	0.441	S	S	*	.	H	α-helix	trans	-60.9	-36.5	178.5	-166.1	167.8	-174.9	171.8	0	112	A272 K280	A272-K276 PolarHBondContact O-N 3.11Å; K276-K280 PolarHBondContact O-N 2.85Å
277	R	89.5	Confident	79.8	Confident	189 Å²	189	83.5 Å²	83.5	71%	0.713	44%	0.441	S	S	*	.	H	α-helix	trans	-68.1	-43.6	172.5	-171.5	-175.5	-58.2	162.3	3.6	112.4	S273 K274 L275 K280	S273-R277 PolarHBondContact O-N 3.44Å; K274-R277 PolarHBondContact O-N 3.33Å; L275-R277 VanDerWaalsContact C-N 3.28Å; L275-R277 PolarHBondContact O-N 3.05Å; R277-K280 PolarHBondContact O-N 3.06Å
278	H	90.3	Very high	78.3	Confident	34 Å²	34	82.6 Å²	82.6	16%	0.157	45%	0.446	C	S	.	.	H	α-helix	trans	-62.9	-42.6	176.7	168.3	72.7	0	0	0	111.4	C262 C265 H267 K274 L275 K280 T281 H282	C262-H278 WeakPolarHBondContact CB-NE2 3.44Å; C262-H278 PolarHBondContact SG-NE2 3.19Å; C265-H278 VanDerWaalsContact SG-CE1 3.51Å; C265-H278 PolarHBondContact SG-NE2 3.4Å; H267-H278 AromaticContact CD2-CE1 3.94Å; H267-H278 AromaticContact CD2-CG 3.92Å; H267-H278 AromaticContact CD2-ND1 3.68Å; K274-H278 WeakPolarHBondContact O-CB 3.36Å; K274-H278 PolarHBondContact O-N 3.48Å; L275-H278 PolarHBondContact O-N 2.73Å; L275-H278 VanDerWaalsContact O-N 3.11Å; H278-K280 VanDerWaalsContact C-N 3.26Å; H278-K280 PolarHBondContact O-N 2.92Å; H278-T281 WeakPolarHBondContact O-CA 3.4Å; H278-T281 WeakPolarHBondContact O-CB 3.23Å; H278-T281 PolarHBondContact O-N 3.39Å; H278-T281 PolarHBondContact O-OG1 3.46Å; H278-H282 AromaticContact CD2-NE2 3.9Å; H278-H282 AromaticContact CE1-NE2 3.46Å; H278-H282 PolarHBondContact CE1-NE2 2.93Å; H278-H282 AromaticContact NE2-CD2 3.79Å; H278-H282 AromaticContact NE2-CE1 3.99Å; H278-H282 AromaticContact NE2-NE2 3.01Å; H278-H282 PolarHBondContact NE2-NE2 2.91Å
279	M	87.6	Confident	76.8	Confident	60 Å²	60	89.7 Å²	89.7	30%	0.296	48%	0.479	S	S	.	.	H	α-helix	trans	-59.1	-35.4	179.7	-140.4	74.6	85.5	0	0	112.8	C262 L264 L275 T281 H282	C262-M279 PolarHBondContact SG-SD 3.13Å; L264-M279 HydrophobicContact CD1-SD 4.49Å; L275-M279 HydrophobicContact CD1-CE 3.8Å; L275-M279 HydrophobicContact CD2-CE 4.19Å; L275-M279 HydrophobicContact CG-CE 3.89Å; L275-M279 PolarHBondContact O-N 3Å; M279-T281 PolarHBondContact O-N 3.1Å; M279-H282 PolarHBondContact O-N 2.84Å; M279-H282 VanDerWaalsContact O-N 3.08Å
280	K	88.8	Confident	75	Confident	125 Å²	125	94.1 Å²	94.1	54%	0.543	52%	0.517	S	S	.	.	H	α-helix	trans	-62.3	-23.4	174.2	-175.1	155.6	-176.8	144.6	0	113.3	K276 R277 H278 H282 H284	K276-K280 PolarHBondContact O-N 2.85Å; R277-K280 PolarHBondContact O-N 3.06Å; H278-K280 VanDerWaalsContact C-N 3.26Å; H278-K280 PolarHBondContact O-N 2.92Å; K280-H282 VanDerWaalsContact C-N 3.34Å; K280-H284 WeakPolarHBondContact CE-NE2 3.26Å; K280-H284 PolarHBondContact O-CD2 3.22Å
281	T	85.3	Confident	73	Confident	86 Å²	86	97.1 Å²	97.1	53%	0.528	55%	0.551	S	S	.	*	H	α-helix	trans	-65.4	-37.4	173.7	-31.4	0	0	0	0	111.7	H278 M279 H284	H278-T281 WeakPolarHBondContact O-CA 3.4Å; H278-T281 WeakPolarHBondContact O-CB 3.23Å; H278-T281 PolarHBondContact O-N 3.39Å; H278-T281 PolarHBondContact O-OG1 3.46Å; M279-T281 PolarHBondContact O-N 3.1Å; T281-H284 PolarHBondContact O-N 3.24Å
282	H	82.2	Confident	71.1	Confident	41 Å²	41	106.6 Å²	106.6	19%	0.19	58%	0.584	C	S	.	*	H	α-helix	trans	-68.7	-37.6	179.1	-66.2	-59.3	0	0	0	112.4	C262 L264 C265 H278 M279 K280 H284 K285 A286	C262-H282 PolarHBondContact SG-NE2 3.02Å; L264-H282 HydrophobicContact CD1-CB 3.62Å; C265-H282 VanDerWaalsContact SG-CE1 3.52Å; C265-H282 PolarHBondContact SG-NE2 3.41Å; H278-H282 AromaticContact CD2-NE2 3.9Å; H278-H282 AromaticContact CE1-NE2 3.46Å; H278-H282 PolarHBondContact CE1-NE2 2.93Å; H278-H282 AromaticContact NE2-CD2 3.79Å; H278-H282 AromaticContact NE2-CE1 3.99Å; H278-H282 AromaticContact NE2-NE2 3.01Å; H278-H282 PolarHBondContact NE2-NE2 2.91Å; M279-H282 PolarHBondContact O-N 2.84Å; M279-H282 VanDerWaalsContact O-N 3.08Å; K280-H282 VanDerWaalsContact C-N 3.34Å; H282-H284 PolarHBondContact O-N 3.16Å; H282-K285 CarbonylContact O-C 3.55Å; H282-K285 WeakPolarHBondContact O-CA 3.37Å; H282-K285 PolarHBondContact O-N 3.2Å; H282-A286 PolarHBondContact O-N 3.02Å
283	M	73.6	Confident	69.1	Low	153 Å²	153	108.6 Å²	108.6	75%	0.754	60%	0.596	S	S	*	*	H	α-helix	trans	-60.8	-33.8	175.7	-61.8	-163	79.4	0	0	112.5	K285	M283-K285 PolarHBondContact O-N 3.01Å
284	H	62.1	Low	67.4	Low	148 Å²	148	111.8 Å²	111.8	69%	0.685	61%	0.607	S	S	*	*	T	Hydrogen-bonded Turn	trans	-79.4	3.7	173.6	-65.7	-62.1	0	0	0	114.2	K280 T281 H282	K280-H284 WeakPolarHBondContact CE-NE2 3.26Å; K280-H284 PolarHBondContact O-CD2 3.22Å; T281-H284 PolarHBondContact O-N 3.24Å; H282-H284 PolarHBondContact O-N 3.16Å
285	K	55.1	Low	65.7	Low	145 Å²	145	115.2 Å²	115.2	63%	0.63	63%	0.63	S	S	*	*	T	Hydrogen-bonded Turn	trans	-119.5	-18.8	176.2	-173	54.6	178.2	164.7	0	113.4	H282 M283 G287	H282-K285 CarbonylContact O-C 3.55Å; H282-K285 WeakPolarHBondContact O-CA 3.37Å; H282-K285 PolarHBondContact O-N 3.2Å; M283-K285 PolarHBondContact O-N 3.01Å; K285-G287 PolarHBondContact O-N 3.17Å
286	A	48.1	Very low	63.8	Low	72 Å²	72	116.9 Å²	116.9	60%	0.595	65%	0.654	S	S	*	*	S	Bend	trans	-67.8	-27.4	-175.7	0	0	0	0	0	114.9	H282 S288	H282-A286 PolarHBondContact O-N 3.02Å; A286-S288 PolarHBondContact O-N 3.41Å
287	G	44.8	Very low	61.9	Low	87 Å²	87	116.1 Å²	116.1	90%	0.897	66%	0.658	S	S	*	*	T	Hydrogen-bonded Turn	trans	-74.7	32	-179.6	0	0	0	0	0	115.6	K285	K285-G287 PolarHBondContact O-N 3.17Å
288	S	52	Low	59.7	Low	77 Å²	77	112.6 Å²	112.6	54%	0.538	66%	0.662	S	S	.	*	T	Hydrogen-bonded Turn	trans	-132.4	15.2	-169.4	-174.6	0	0	0	0	113.4	A286	A286-S288 PolarHBondContact O-N 3.41Å
289	L	54.5	Low	57.2	Low	171 Å²	171	115.8 Å²	115.8	90%	0.895	69%	0.694	S	S	*	*			trans	-135.4	49.9	-174.9	-68.1	176.1	0	0	0	112.5
290	A	47.8	Very low	54.9	Low	104 Å²	104	117.2 Å²	117.2	86%	0.86	72%	0.715	S	S	*	*			trans	-142.7	137.8	163.5	0	0	0	0	0	107.8
291	G	42.6	Very low	52.6	Low	81 Å²	81	117.1 Å²	117.1	84%	0.835	73%	0.73	S	S	*	*			trans	108.9	61.7	-173.6	0	0	0	0	0	115
292	R	45.9	Very low	50.7	Low	248 Å²	248	118.3 Å²	118.3	94%	0.936	74%	0.742	S	S	*	*			trans	-100.9	152.7	139.6	-67.2	173.3	171	174.3	-5.7	105
293	S	45.2	Very low	49.3	Very low	93 Å²	93	122 Å²	122	65%	0.65	77%	0.77	S	S	*	*			cis	-145.2	-167	26.2	43	0	0	0	0	111.6
294	D	53.8	Low	47.9	Very low	136 Å²	136	123 Å²	123	73%	0.727	77%	0.773	S	S	*	*			trans	56.7	147.8	167.4	35.5	-70.4	0	0	0	117.6
295	D	51.7	Low	46.9	Very low	162 Å²	162	122.2 Å²	122.2	87%	0.866	78%	0.781	S	S	*	*			cis	-124.8	-175.6	1	-96.3	-46.4	0	0	0	108.8
296	G	49.3	Very low	46.2	Very low	64 Å²	64	118.7 Å²	118.7	66%	0.66	79%	0.785	S	S	*	*			cis	155.3	68.2	3.6	0	0	0	0	0	111.3
297	L	50.4	Low	45.7	Very low	163 Å²	163	121.7 Å²	121.7	85%	0.853	80%	0.797	S	S	*	*			trans	43.2	118.5	160	-59.6	177.5	0	0	0	122.1
298	S	42	Very low	45.9	Very low	114 Å²	114	122.1 Å²	122.1	80%	0.797	79%	0.785	S	S	*	*				63.2	118.6	125.7	-56.5	0	0	0	0	122.6
299	A	39.2	Very low	45.4	Very low	101 Å²	101	126.4 Å²	126.4	84%	0.835	80%	0.797	S	S	*	*			trans	-46.1	150.3	162.4	0	0	0	0	0	117.3
300	A	39.3	Very low	44.9	Very low	90 Å²	90	125.4 Å²	125.4	74%	0.744	79%	0.792	S	S	*	*				-179.1	152	105.3	0	0	0	0	0	114.4
301	S	40.4	Very low	44.8	Very low	123 Å²	123	126.6 Å²	126.6	86%	0.86	79%	0.791	S	S	*	*			trans	71.1	137.3	154.9	-56.8	0	0	0	0	121.7
302	S	45.8	Very low	44.7	Very low	111 Å²	111	126.2 Å²	126.2	78%	0.776	79%	0.787	S	S	*	*			trans	-104.9	-172.6	170.1	-35.3	0	0	0	0	110.2
303	P	51.2	Low	44.4	Very low	119 Å²	119	121.4 Å²	121.4	77%	0.773	78%	0.78	S	S	*	*			cis	-114.2	-139.5	-26.2	19.7	6.5	0	0	0	108.4
304	E	45.8	Very low	44.5	Very low	175 Å²	175	124.1 Å²	124.1	82%	0.818	79%	0.786	S	S	*	*			cis	-144.7	162.2	2.3	-73.2	-173.3	87.7	0	0	109.8
305	P	39.4	Very low	43.9	Very low	131 Å²	131	126.8 Å²	126.8	85%	0.851	79%	0.791	S	S	*	*			trans	-100.8	154.4	-177.1	38.1	-33.6	0	0	0	115.4
306	G	41.9	Very low	43.3	Very low	70 Å²	70	123.3 Å²	123.3	72%	0.722	79%	0.785	S	S	*	*			trans	-157.4	124.6	170.9	0	0	0	0	0	114.3
307	T	37.7	Very low	43.1	Very low	136 Å²	136	125.2 Å²	125.2	83%	0.834	79%	0.794	S	S	*	*			trans	3.3	144.3	150.3	56.1	0	0	0	0	119.1
308	S	48.9	Very low	42.8	Very low	95 Å²	95	125.8 Å²	125.8	66%	0.664	80%	0.798	S	S	*	*			cis	-178	154	25.5	16.4	0	0	0	0	112.3
309	E	39.8	Very low	43	Very low	168 Å²	168	123.6 Å²	123.6	79%	0.785	79%	0.794	S	S	*	*			trans	52.4	136.3	135.7	-50.5	-68.5	78.5	0	0	120
310	L	44.9	Very low	43.3	Very low	150 Å²	150	125.5 Å²	125.5	79%	0.785	79%	0.79	S	S	*	*			cis	-151.4	169.5	10.9	-68.6	179.7	0	0	0	112.2
311	P	46.3	Very low	43.3	Very low	129 Å²	129	129.7 Å²	129.7	84%	0.838	79%	0.792	S	S	*	*			trans	-119.7	179.4	177.5	43.1	-32.7	0	0	0	116.5
312	G	39.9	Very low	43.4	Very low	73 Å²	73	132.8 Å²	132.8	75%	0.753	79%	0.785	S	S	*	*			trans	145	158.2	164.7	0	0	0	0	0	113.4
313	D	40	Very low	42.9	Very low	146 Å²	146	134.7 Å²	134.7	78%	0.781	78%	0.781	S	S	*	*			cis	-163	-172.7	-18.2	-164.4	-93.7	0	0	0	108.6
314	L	47.5	Very low	42.3	Very low	150 Å²	150	137.8 Å²	137.8	79%	0.785	79%	0.785	S	S	*	*			trans	69.5	154.8	173.6	-58.1	106.3	0	0	0	119.7
315	K	40.3	Very low	41.9	Very low	192 Å²	192	136.2 Å²	136.2	84%	0.835	78%	0.777	S	S	*	*			cis	-166.4	152.8	-41.1	-176.6	160.3	175.4	173.9	0	108.9
316	A	39.5	Very low	42.1	Very low	90 Å²	90	135.8 Å²	135.8	74%	0.744	78%	0.777	S	S	*	*			trans	-67.1	164.3	-176.1	0	0	0	0	0	117.2
317	A	46.1	Very low	42	Very low	103 Å²	103	140.1 Å²	140.1	85%	0.851	78%	0.784	S	S	*	*			trans	-148.1	158.2	161.1	0	0	0	0	0	110.5
318	D	43.9	Very low	42.3	Very low	175 Å²	175	139 Å²	139	94%	0.936	78%	0.779	S	S	*	*			trans	-114	172.8	-161.9	-97.8	-87.7	0	0	0	115.6
319	G	44.6	Very low	41.8	Very low	68 Å²	68	139.5 Å²	139.5	70%	0.701	78%	0.783	S	S	*	*			trans	133.1	109.6	168.9	0	0	0	0	0	112.6
320	D	46.8	Very low	41.7	Very low	141 Å²	141	139.5 Å²	139.5	75%	0.754	79%	0.787	S	S	*	*			cis	80.3	97.9	40.1	-161.3	-19.2	0	0	0	114.6
321	F	39.2	Very low	41.3	Very low	179 Å²	179	136 Å²	136	79%	0.785	79%	0.788	S	S	*	*				-163.1	127.3	123.8	-136.7	-112.5	0	0	0	115.9
322	R	41.2	Very low	41.1	Very low	188 Å²	188	135.9 Å²	135.9	71%	0.709	79%	0.787	S	S	*	*			trans	1.2	127.1	153.1	-37.5	-179.8	86.3	95.8	-0.2	118.8
323	H	37.1	Very low	41.2	Very low	151 Å²	151	141.2 Å²	141.2	70%	0.699	79%	0.792	S	S	*	*				60.3	110.5	79.9	-118.2	-84.8	0	0	0	116.4	E325	H323-E325 IonicContact CE1-OE1 3.29Å; H323-E325 IonicContact CE1-OE2 3.91Å; H323-E325 PolarHBondContact CE1-OE2 3.14Å; H323-E325 IonicContact ND1-OE2 2.68Å; H323-E325 PolarHBondContact ND1-OE2 3.43Å
324	H	38.1	Very low	41.4	Very low	183 Å²	183	139.5 Å²	139.5	85%	0.847	79%	0.789	S	S	*	*			trans	-154.2	150.8	135.8	-151.5	-76.1	0	0	0	110.7
325	E	36.1	Very low	40.9	Very low	142 Å²	142	140.5 Å²	140.5	66%	0.664	79%	0.79	S	S	*	*			trans	-127.1	150.7	-173	-62.3	154.3	107.7	0	0	110.1	H323	H323-E325 IonicContact CE1-OE1 3.29Å; H323-E325 IonicContact CE1-OE2 3.91Å; H323-E325 PolarHBondContact CE1-OE2 3.14Å; H323-E325 IonicContact ND1-OE2 2.68Å; H323-E325 PolarHBondContact ND1-OE2 3.43Å
326	S	44.8	Very low	40.5	Very low	122 Å²	122	138.3 Å²	138.3	85%	0.853	79%	0.787	S	S	*	*			trans	-169.8	137.6	163.6	52.5	0	0	0	0	112.6
327	D	38.6	Very low	40.7	Very low	161 Å²	161	141.9 Å²	141.9	86%	0.861	79%	0.794	S	S	*	*			trans	-86.2	170.3	-171.4	-141.1	-141.6	0	0	0	113.4
328	P	44.5	Very low	40.9	Very low	112 Å²	112	145.8 Å²	145.8	73%	0.727	79%	0.794	S	S	*	*			trans	-96	168.1	-170.9	38.3	-34.1	0	0	0	114.8
329	S	37.9	Very low	40.9	Very low	107 Å²	107	144 Å²	144	75%	0.748	79%	0.785	S	S	*	*			trans	-158.6	119.1	170	-162.1	0	0	0	0	116.1
330	L	38	Very low	41.3	Very low	167 Å²	167	149.4 Å²	149.4	87%	0.874	79%	0.792	S	S	*	*			trans	55.2	106.7	140.9	-59.4	175	0	0	0	123.8
331	G	36.5	Very low	41.4	Very low	77 Å²	77	150.4 Å²	150.4	79%	0.794	79%	0.792	S	S	*	*				80.1	177.1	125	0	0	0	0	0	120.3
332	P	41.9	Very low	41.7	Very low	127 Å²	127	149.6 Å²	149.6	83%	0.825	79%	0.79	S	S	*	*			cis	-112.6	-178	-8.9	41.4	-29.9	0	0	0	113.5
333	E	42.1	Very low	42	Very low	184 Å²	184	147.7 Å²	147.7	86%	0.86	79%	0.79	S	S	*	*			trans	-93.4	158.7	177.3	-53	-171.9	119.9	0	0	112.4
334	P	43.9	Very low	42.3	Very low	110 Å²	110	146.9 Å²	146.9	71%	0.714	79%	0.786	S	S	*	*			trans	-116.6	131.1	131.6	33.6	-28.2	0	0	0	109.7
335	E	38.9	Very low	42.8	Very low	172 Å²	172	145 Å²	145	80%	0.804	78%	0.778	S	S	*	*				75.5	97.3	70.7	-68.1	178.4	160.6	0	0	112.4
336	D	31.2	Very low	43.4	Very low	145 Å²	145	144.6 Å²	144.6	78%	0.775	78%	0.776	S	S	*	*			trans	56.7	103.8	145.9	-44.9	-25.8	0	0	0	121
337	D	43.8	Very low	43.6	Very low	165 Å²	165	143.7 Å²	143.7	88%	0.882	76%	0.761	S	S	*	*			trans	-159.2	64.8	159.1	-92	-41.6	0	0	0	108.8
338	E	49.7	Very low	44.2	Very low	185 Å²	185	142 Å²	142	86%	0.864	75%	0.751	S	S	*	*			trans	-103.3	-3.7	-178.5	-68	-161.4	120.8	0	0	114.4
339	D	44	Very low	44.6	Very low	139 Å²	139	141.8 Å²	141.8	74%	0.743	74%	0.743	S	S	*	*	S	Bend	trans	-95	-13.5	-162.2	-59.4	-86.5	0	0	0	117.1
340	E	53.7	Low	45.2	Very low	180 Å²	180	142.6 Å²	142.6	84%	0.841	74%	0.736	S	S	*	*	H	α-helix	trans	-85.2	-24.3	-172.2	-74	-161.1	131	0	0	115.8
341	E	47.3	Very low	45.4	Very low	162 Å²	162	141.5 Å²	141.5	76%	0.757	73%	0.731	S	S	*	*	H	α-helix	trans	-78.1	-20.6	-177.9	-74	-164.1	156.7	0	0	113.7
342	E	47.3	Very low	45.7	Very low	162 Å²	162	146.2 Å²	146.2	76%	0.757	73%	0.732	S	S	*	*	H	α-helix	trans	-75.5	-34.2	-179.4	-69.7	-154.8	140.9	0	0	113.5	E344 E345 E346	E342-E344 VanDerWaalsContact C-N 3.33Å; E342-E344 PolarHBondContact O-N 3.05Å; E342-E345 PolarHBondContact O-N 2.97Å; E342-E346 PolarHBondContact O-N 3.28Å
343	E	45.7	Very low	45.4	Very low	148 Å²	148	144.1 Å²	144.1	69%	0.692	72%	0.72	S	S	*	*	H	α-helix	trans	-62.9	-35.9	-179.6	-72.7	-156.7	156.7	0	0	112.5	L347	E343-L347 WeakPolarHBondContact O-CG 3.28Å; E343-L347 PolarHBondContact O-N 3.35Å; E343-L347 VanDerWaalsContact O-N 3.15Å
344	E	44.6	Very low	45.5	Very low	134 Å²	134	146.8 Å²	146.8	63%	0.626	72%	0.722	S	S	*	*	H	α-helix	trans	-81.6	-22.2	179.8	70	170.8	141.4	0	0	114.4	E342 L348	E342-E344 VanDerWaalsContact C-N 3.33Å; E342-E344 PolarHBondContact O-N 3.05Å; E344-L348 WeakPolarHBondContact O-CD1 3.49Å; E344-L348 WeakPolarHBondContact O-CG 3.34Å
345	E	47.6	Very low	45.4	Very low	143 Å²	143	146.7 Å²	146.7	67%	0.668	72%	0.722	S	S	*	*	H	α-helix	trans	-75.4	-39.3	165.1	-68.3	-140	144.5	0	0	111.9	E342 L348 L349	E342-E345 PolarHBondContact O-N 2.97Å; E345-L348 PolarHBondContact O-N 3.33Å; E345-L349 WeakPolarHBondContact O-CG 3.34Å; E345-L349 PolarHBondContact O-N 3.37Å; E345-L349 VanDerWaalsContact O-N 3.12Å
346	E	50.2	Low	45.3	Very low	134 Å²	134	147.7 Å²	147.7	63%	0.626	73%	0.726	S	S	*	*	H	α-helix	trans	-64.7	-44.9	179.6	-168	165.9	-141.3	0	0	111.9	E342 L348 L349 E350	E342-E346 PolarHBondContact O-N 3.28Å; E346-L348 PolarHBondContact O-N 2.77Å; E346-L349 PolarHBondContact O-N 3.22Å; E346-E350 PolarHBondContact O-N 3.31Å
347	L	47.7	Very low	45.6	Very low	103 Å²	103	145 Å²	145	54%	0.539	72%	0.719	S	S	.	*	H	α-helix	trans	-62	-24.5	175.9	-75.2	171	0	0	0	114	E343 N351	E343-L347 WeakPolarHBondContact O-CG 3.28Å; E343-L347 PolarHBondContact O-N 3.35Å; E343-L347 VanDerWaalsContact O-N 3.15Å; L347-N351 PolarHBondContact O-ND2 2.81Å
348	L	50.7	Low	45.2	Very low	126 Å²	126	142.8 Å²	142.8	66%	0.66	72%	0.717	S	S	*	*	H	α-helix	trans	-79.7	-32.7	172.3	-78.6	170.1	0	0	0	112.2	E344 E345 E346	E344-L348 WeakPolarHBondContact O-CD1 3.49Å; E344-L348 WeakPolarHBondContact O-CG 3.34Å; E345-L348 PolarHBondContact O-N 3.33Å; E346-L348 PolarHBondContact O-N 2.77Å
349	L	54.7	Low	44.5	Very low	107 Å²	107	141.9 Å²	141.9	56%	0.56	71%	0.71	S	S	*	*	H	α-helix	trans	-79.8	-32.2	179.8	-69	167.3	0	0	0	113.4	E345 E346 N351 E352 S353	E345-L349 WeakPolarHBondContact O-CG 3.34Å; E345-L349 PolarHBondContact O-N 3.37Å; E345-L349 VanDerWaalsContact O-N 3.12Å; E346-L349 PolarHBondContact O-N 3.22Å; L349-N351 PolarHBondContact O-N 3.4Å; L349-E352 PolarHBondContact O-N 3Å; L349-S353 WeakPolarHBondContact O-CB 3.47Å; L349-S353 PolarHBondContact O-OG 3.21Å
350	E	49.6	Very low	44.1	Very low	125 Å²	125	140 Å²	140	58%	0.584	71%	0.707	S	S	*	*	H	α-helix	trans	-58.4	-36.3	174.6	-78.9	-162.5	90.4	0	0	112.5	E346 E352 S353	E346-E350 PolarHBondContact O-N 3.31Å; E350-E352 PolarHBondContact O-N 3.3Å; E350-S353 PolarHBondContact O-N 2.9Å
351	N	41.8	Very low	43.4	Very low	144 Å²	144	139.6 Å²	139.6	77%	0.77	71%	0.708	S	S	*	*	T	Hydrogen-bonded Turn	trans	-70.5	-14.1	-179	-80.1	-63.5	0	0	0	114.2	L347 L349	L347-N351 PolarHBondContact O-ND2 2.81Å; L349-N351 PolarHBondContact O-N 3.4Å
352	E	43.8	Very low	42.7	Very low	175 Å²	175	138.9 Å²	138.9	82%	0.818	71%	0.709	S	S	*	*	T	Hydrogen-bonded Turn	trans	-100.2	1.1	175.1	-56.3	-147.9	113.7	0	0	113.2	L349 E350	L349-E352 PolarHBondContact O-N 3Å; E350-E352 PolarHBondContact O-N 3.3Å
353	S	35.6	Very low	42.4	Very low	83 Å²	83	136.6 Å²	136.6	58%	0.58	71%	0.711	S	S	*	*			trans	-124.9	51.4	-155.8	-62	0	0	0	0	116.7	L349 E350	L349-S353 WeakPolarHBondContact O-CB 3.47Å; L349-S353 PolarHBondContact O-OG 3.21Å; E350-S353 PolarHBondContact O-N 2.9Å
354	R	43.7	Very low	41.8	Very low	241 Å²	241	136.9 Å²	136.9	91%	0.909	71%	0.712	S	S	*	*			trans	-131.7	148.3	164.8	-81.4	-163.6	77.3	158.1	3.2	114.8
355	P	42	Very low	41.2	Very low	107 Å²	107	137.6 Å²	137.6	70%	0.695	72%	0.72	S	S	*	*				-131.6	145.1	-128.9	38	-22.2	0	0	0	115.5
356	E	37.5	Very low	40.8	Very low	193 Å²	193	134.2 Å²	134.2	90%	0.902	72%	0.723	S	S	*	*			trans	-127.8	101	168.4	-71	-155.2	103.5	0	0	113.9
357	S	37.5	Very low	40.1	Very low	90 Å²	90	140 Å²	140	63%	0.629	74%	0.739	S	S	*	*			trans	77.1	121.6	151.4	70.7	0	0	0	0	120.5	F359	S357-F359 VanDerWaalsContact CB-CZ 3.4Å; S357-F359 WeakPolarHBondContact OG-CZ 3.41Å
358	S	34	Very low	39.7	Very low	118 Å²	118	138.8 Å²	138.8	83%	0.825	75%	0.752	S	S	*	*			trans	-115.9	127.2	159.4	179.7	0	0	0	0	109.1
359	F	36.3	Very low	39	Very low	165 Å²	165	143.8 Å²	143.8	72%	0.724	76%	0.762	S	S	*	*			trans	-151.1	119.8	165.1	14.1	-112	0	0	0	106	S357	S357-F359 VanDerWaalsContact CB-CZ 3.4Å; S357-F359 WeakPolarHBondContact OG-CZ 3.41Å
360	S	35.4	Very low	38.3	Very low	99 Å²	99	145.3 Å²	145.3	69%	0.692	77%	0.766	S	S	*	*			cis	66.9	86.6	34.9	-158.6	0	0	0	0	113.7
361	M	37.8	Very low	37.8	Very low	172 Å²	172	146.4 Å²	146.4	85%	0.847	78%	0.776	S	S	*	*				-172.9	155.7	109.8	-150.2	75.7	81.6	0	0	110.7
362	D	32.4	Very low	37.6	Very low	148 Å²	148	143.4 Å²	143.4	79%	0.791	78%	0.779	S	S	*	*			trans	-62.8	146.7	160.7	-100.6	-91.5	0	0	0	112.5
363	S	40.9	Very low	37.3	Very low	114 Å²	114	139.2 Å²	139.2	80%	0.797	78%	0.783	S	S	*	*			trans	-175.2	102.5	148.8	-82.9	0	0	0	0	113.8
364	E	34.2	Very low	37.3	Very low	153 Å²	153	138.9 Å²	138.9	72%	0.715	79%	0.793	S	S	*	*				39.7	119.3	115.6	-63.3	-78.1	67.8	0	0	121.3
365	L	32.6	Very low	36.8	Very low	150 Å²	150	134.3 Å²	134.3	79%	0.785	79%	0.791	S	S	*	*			trans	53	114.6	131.1	-55.2	174.4	0	0	0	121.8
366	G	39.5	Very low	37.4	Very low	72 Å²	72	134.3 Å²	134.3	74%	0.742	79%	0.791	S	S	*	*			trans	168.9	75.8	159.8	0	0	0	0	0	114.5
367	R	34.5	Very low	37.7	Very low	254 Å²	254	131.3 Å²	131.3	96%	0.958	79%	0.788	S	S	*	*				41.2	99.1	92.2	-69.4	-169.7	-179	-121.5	2.8	115.2
368	G	38.3	Very low	37.7	Very low	78 Å²	78	130.3 Å²	130.3	80%	0.804	79%	0.792	S	S	*	*			trans	-174.4	121	167.9	0	0	0	0	0	113.8
369	R	37.1	Very low	38.1	Very low	232 Å²	232	129.5 Å²	129.5	88%	0.875	78%	0.782	S	S	*	*			trans	-24.8	158.8	165.5	-93.6	-179.8	167.4	149.2	-7.1	118.5
370	E	40.6	Very low	38.2	Very low	139 Å²	139	126.4 Å²	126.4	65%	0.65	79%	0.787	S	S	*	*			cis	-163.8	166.2	12	38.6	-173.9	73.5	0	0	114.9
371	N	37.4	Very low	38.3	Very low	147 Å²	147	125 Å²	125	79%	0.786	79%	0.788	S	S	*	*			trans	74.2	127.4	164.2	-52.4	-43.3	0	0	0	117.9
372	G	38.9	Very low	38.7	Very low	81 Å²	81	122.3 Å²	122.3	84%	0.835	79%	0.794	S	S	*	*			cis	169.9	132.1	-11.3	0	0	0	0	0	114.6
373	G	36.6	Very low	39	Very low	87 Å²	87	118.8 Å²	118.8	90%	0.897	79%	0.792	S	S	*	*			trans	91.8	143.6	164.4	0	0	0	0	0	118
374	G	36.3	Very low	38.9	Very low	76 Å²	76	118.5 Å²	118.5	78%	0.784	80%	0.796	S	S	*	*			trans	116.4	107.5	169.6	0	0	0	0	0	115.2
375	V	33.2	Very low	39.1	Very low	145 Å²	145	116.2 Å²	116.2	88%	0.879	80%	0.804	S	S	*	*			trans	-121.3	127.8	-171.4	176.3	0	0	0	0	113
376	P	53.5	Low	39.4	Very low	107 Å²	107	113.6 Å²	113.6	70%	0.695	80%	0.804	S	S	*	*			trans	-102.4	170.9	161.9	39.5	-32.5	0	0	0	111.8
377	P	44	Very low	39.4	Very low	130 Å²	130	115.1 Å²	115.1	84%	0.844	81%	0.81	S	S	*	*				-162.1	170.6	105.6	40.5	-21.3	0	0	0	119.1
378	G	38.3	Very low	39.5	Very low	69 Å²	69	107.2 Å²	107.2	71%	0.711	80%	0.798	S	S	*	*			trans	103.1	151.2	140.9	0	0	0	0	0	119
379	V	41.7	Very low	39.6	Very low	102 Å²	102	111.4 Å²	111.4	62%	0.618	80%	0.802	S	S	*	*			cis	-154.9	179.2	-0.4	-67.7	0	0	0	0	112.5	P188	P188-V379 HydrophobicContact CB-CG1 4.14Å
380	A	38.6	Very low	39.9	Very low	99 Å²	99	104.2 Å²	104.2	82%	0.818	79%	0.792	S	S	*	*			trans	-149.3	178.2	174.8	0	0	0	0	0	110.5
381	G	38.3	Very low	40.1	Very low	70 Å²	70	105 Å²	105	72%	0.722	80%	0.8	S	S	*	*			cis	178.4	-147.2	7.3	0	0	0	0	0	112.3
382	A	44.8	Very low	40.6	Very low	116 Å²	116	104.5 Å²	104.5	96%	0.959	79%	0.793	S	S	*	*			trans	78.3	160.6	176.1	0	0	0	0	0	118.5
383	G	39.3	Very low	41	Very low	73 Å²	73	109.5 Å²	109.5	75%	0.753	79%	0.792	S	S	*	*			cis	159.7	159.6	-17.2	0	0	0	0	0	117.6
384	A	39.8	Very low	41.1	Very low	108 Å²	108	109.6 Å²	109.6	89%	0.893	78%	0.784	S	S	*	*			trans	97.4	156.4	153.8	0	0	0	0	0	124.2
385	A	37.6	Very low	41.3	Very low	105 Å²	105	114.4 Å²	114.4	87%	0.868	79%	0.791	S	S	*	*			trans	79.5	140.3	169.3	0	0	0	0	0	120.6
386	A	39.2	Very low	41.5	Very low	96 Å²	96	111.3 Å²	111.3	79%	0.793	78%	0.781	S	S	*	*			cis	-167.8	163	-14.9	0	0	0	0	0	114.5
387	A	38.4	Very low	40.8	Very low	104 Å²	104	115.2 Å²	115.2	86%	0.86	80%	0.795	S	S	*	*			trans	66.7	160.5	155.3	0	0	0	0	0	121.9
388	A	36.6	Very low	40.5	Very low	87 Å²	87	112 Å²	112	72%	0.719	79%	0.786	S	S	*	*			cis	-173.8	177.3	-30.4	0	0	0	0	0	112.1
389	L	41.5	Very low	40.6	Very low	167 Å²	167	118.8 Å²	118.8	87%	0.874	80%	0.795	S	S	*	*			trans	81.2	133.4	174.1	-48.6	174.4	0	0	0	116.5
390	A	43	Very low	40.5	Very low	81 Å²	81	119.6 Å²	119.6	67%	0.669	80%	0.8	S	S	*	*			cis	87.6	139.3	22.5	0	0	0	0	0	114.8
391	D	44.5	Very low	40.7	Very low	155 Å²	155	122.4 Å²	122.4	83%	0.829	80%	0.798	S	S	*	*			cis	-162.1	-167.2	-6.5	-125.1	92.1	0	0	0	108.4
392	E	49.2	Very low	40.8	Very low	137 Å²	137	126.2 Å²	126.2	64%	0.64	80%	0.797	S	S	*	*			cis	-161.8	152.2	11	-177.8	-111.5	143.4	0	0	109.8
393	K	47.3	Very low	40.4	Very low	186 Å²	186	128 Å²	128	81%	0.809	79%	0.791	S	S	*	*			trans	156.5	138	138.4	-89.5	-176	178.2	179.4	0	118.2
394	A	37.8	Very low	40.5	Very low	88 Å²	88	129 Å²	129	73%	0.727	79%	0.793	S	S	*	*			trans	-155.7	156.5	167.6	0	0	0	0	0	111.9
395	L	40.1	Very low	40.5	Very low	177 Å²	177	127.1 Å²	127.1	93%	0.927	78%	0.783	S	S	*	*			trans	-165.3	176.2	157.9	-110.3	157.6	0	0	0	111.3
396	A	37.9	Very low	40.6	Very low	81 Å²	81	130.9 Å²	130.9	67%	0.669	79%	0.788	S	S	*	*			trans	-169.4	139.7	-138	0	0	0	0	0	113
397	L	39.3	Very low	40.3	Very low	189 Å²	189	130.3 Å²	130.3	99%	0.99	79%	0.791	S	S	*	*			trans	-157.9	164.7	168.7	-143.7	75.1	0	0	0	111.3
398	G	37.8	Very low	40.4	Very low	63 Å²	63	130.3 Å²	130.3	65%	0.649	79%	0.791	S	S	*	*			trans	174.5	-177.2	176.2	0	0	0	0	0	115.6
399	K	39	Very low	40.4	Very low	210 Å²	210	133.5 Å²	133.5	91%	0.913	80%	0.795	S	S	*	*			trans	73.3	159	-165.6	-53.9	179.8	173.9	-178.1	0	112.6
400	V	41	Very low	40.3	Very low	120 Å²	120	131.5 Å²	131.5	73%	0.727	79%	0.792	S	S	*	*			cis	-146.5	133	27	177.3	0	0	0	0	107.2
401	M	42.3	Very low	40	Very low	158 Å²	158	135.7 Å²	135.7	78%	0.778	80%	0.798	S	S	*	*				78.8	145.6	73.7	-144.3	166.2	78.3	0	0	116.7
402	E	39.6	Very low	39.7	Very low	149 Å²	149	140.1 Å²	140.1	70%	0.696	81%	0.805	S	S	*	*			trans	70.4	147.6	170.5	-74.2	138.9	118.6	0	0	119.2
403	D	37.7	Very low	39.1	Very low	153 Å²	153	136.9 Å²	136.9	82%	0.818	81%	0.808	S	S	*	*			cis	-163.8	-174.7	-21.3	-156.4	-96.4	0	0	0	111.4
404	A	41.4	Very low	38.6	Very low	96 Å²	96	135.8 Å²	135.8	79%	0.793	81%	0.806	S	S	*	*			trans	73	137.9	169.8	0	0	0	0	0	120.2
405	G	40.5	Very low	38.8	Very low	68 Å²	68	141.9 Å²	141.9	70%	0.701	82%	0.816	S	S	*	*			cis	172	147.4	-12.1	0	0	0	0	0	116.8
406	L	38.1	Very low	38.6	Very low	184 Å²	184	144.7 Å²	144.7	96%	0.963	81%	0.814	S	S	*	*			trans	52.1	106.7	152.7	-46.5	178.7	0	0	0	118.8
407	G	34.6	Very low	38.6	Very low	83 Å²	83	144.6 Å²	144.6	86%	0.856	82%	0.821	S	S	*	*				128.2	163.9	76.2	0	0	0	0	0	109.9
408	A	38.7	Very low	38.6	Very low	105 Å²	105	140.1 Å²	140.1	87%	0.868	81%	0.812	S	S	*	*			cis	-153.6	169.4	1.1	0	0	0	0	0	111.6
409	L	38.4	Very low	38.4	Very low	154 Å²	154	145.1 Å²	145.1	81%	0.806	82%	0.816	S	S	*	*			trans	-96.6	159.1	178.7	-92.2	171.4	0	0	0	112.9
410	P	38.1	Very low	38.6	Very low	125 Å²	125	143.1 Å²	143.1	81%	0.812	81%	0.814	S	S	*	*				-147.2	168.7	99	38.7	-22.4	0	0	0	116.6
411	Q	37.9	Very low	38.3	Very low	168 Å²	168	144.8 Å²	144.8	79%	0.785	81%	0.812	S	S	*	*			trans	-87.5	151.1	173.5	-55.5	168.3	1.7	0	0	112.4
412	Y	36.3	Very low	38.1	Very low	249 Å²	249	148.6 Å²	148.6	98%	0.976	82%	0.817	S	S	*	*			trans	175.8	146.8	147.7	-95.8	-66.9	0	0	0	107.9
413	G	38.1	Very low	38	Very low	68 Å²	68	145.5 Å²	145.5	70%	0.701	82%	0.818	S	S	*	*			cis	-173.5	176.6	-2.8	0	0	0	0	0	111.3
414	E	35.6	Very low	37.9	Very low	164 Å²	164	141.7 Å²	141.7	77%	0.766	81%	0.814	S	S	*	*			trans	-65.4	160.1	-172.8	-62.5	170.7	62.5	0	0	116.8
415	K	43.3	Very low	37.6	Very low	216 Å²	216	144.2 Å²	144.2	94%	0.939	81%	0.814	S	S	*	*			trans	-158	154.3	130.6	-102.8	136.6	-164.2	170.9	0	114.5
416	R	35.2	Very low	37.7	Very low	235 Å²	235	147.3 Å²	147.3	89%	0.887	82%	0.82	S	S	*	*			trans	-111.8	160.7	-173.1	-78.4	167	147.4	171.4	-6.3	112.8
417	G	37.4	Very low	37.8	Very low	80 Å²	80	142.2 Å²	142.2	83%	0.825	81%	0.812	S	S	*	*			trans	106	152.6	154.7	0	0	0	0	0	114.8
418	A	40.4	Very low	37.7	Very low	95 Å²	95	146.3 Å²	146.3	79%	0.785	81%	0.814	S	S	*	*			cis	-148.9	131.4	-2.4	0	0	0	0	0	108.3
419	F	32.7	Very low	37.9	Very low	167 Å²	167	145.6 Å²	145.6	73%	0.732	81%	0.809	S	S	*	*				57.1	111.2	85.3	-165.5	-82.4	0	0	0	115.4	K421	F419-K421 HydrophobicContact CE1-CB 4.44Å; F419-K421 HydrophobicContact CZ-CB 4.36Å; F419-K421 HydrophobicContact CZ-CD 3.98Å
420	L	42.5	Very low	37.7	Very low	168 Å²	168	141.6 Å²	141.6	88%	0.88	81%	0.805	S	S	*	*			trans	-161.6	162.1	139.2	-107.8	166.8	0	0	0	111.1
421	K	36.5	Very low	37.7	Very low	156 Å²	156	140.3 Å²	140.3	68%	0.678	80%	0.804	S	S	*	*			trans	-158.9	133.5	-145.9	165.4	-170.6	169.4	-175.1	0	114.3	F419	F419-K421 HydrophobicContact CE1-CB 4.44Å; F419-K421 HydrophobicContact CZ-CB 4.36Å; F419-K421 HydrophobicContact CZ-CD 3.98Å
422	R	36.9	Very low	37.7	Very low	237 Å²	237	139.3 Å²	139.3	89%	0.894	81%	0.81	S	S	*	*			trans	-170.8	120.1	165.4	-158.1	160.9	-74.3	-169.4	-3.2	107.5
423	A	37	Very low	37.7	Very low	85 Å²	85	130.8 Å²	130.8	70%	0.702	80%	0.797	S	S	*	*			cis	68.9	127.8	22.8	0	0	0	0	0	114.5
424	G	36.3	Very low	37.6	Very low	73 Å²	73	133.6 Å²	133.6	75%	0.753	80%	0.804	S	S	*	*			cis	-151.4	168.4	-4.5	0	0	0	0	0	109.2
425	D	36.3	Very low	37.7	Very low	148 Å²	148	129.4 Å²	129.4	79%	0.791	81%	0.805	S	S	*	*				108.6	158.4	77.8	-175.6	-134.7	0	0	0	111.5
426	T	42.1	Very low	37.4	Very low	133 Å²	133	126.7 Å²	126.7	82%	0.816	80%	0.801	S	S	*	*			trans	66.9	150.6	-173.7	73.5	0	0	0	0	116.1
427	G	39.6	Very low	37.6	Very low	78 Å²	78	119.9 Å²	119.9	80%	0.804	80%	0.795	S	S	*	*			cis	-162.1	174.6	-1.3	0	0	0	0	0	112.1
428	D	32.8	Very low	37.5	Very low	168 Å²	168	120 Å²	120	90%	0.898	80%	0.796	S	S	*	*			trans	-90.9	176.3	-172.5	-176.5	-131.4	0	0	0	114.5
429	A	43.4	Very low	37.4	Very low	91 Å²	91	120.1 Å²	120.1	75%	0.752	80%	0.797	S	S	*	*			trans	81.4	149.8	178.4	0	0	0	0	0	116.3
430	G	34.1	Very low	37.9	Very low	70 Å²	70	118.5 Å²	118.5	72%	0.722	80%	0.803	S	S	*	*			cis	160	154.2	-7.9	0	0	0	0	0	113.4
431	A	37.7	Very low	37.6	Very low	97 Å²	97	114.1 Å²	114.1	80%	0.802	80%	0.799	S	S	*	*			trans	71.9	109.5	166.9	0	0	0	0	0	121.6
432	V	36.8	Very low	37.7	Very low	148 Å²	148	110.9 Å²	110.9	90%	0.897	80%	0.802	S	S	*	*				40.4	129	124.8	-168.5	0	0	0	0	122.1
433	G	38	Very low	38.2	Very low	69 Å²	69	106.1 Å²	106.1	71%	0.711	80%	0.798	S	S	*	*			trans	144.8	113.2	159.9	0	0	0	0	0	111.1
434	C	34.6	Very low	38.1	Very low	127 Å²	127	110.1 Å²	110.1	86%	0.858	81%	0.808	S	S	*	*			cis	86.7	122.6	29.7	-54.7	0	0	0	0	114.4
435	G	39.1	Very low	38.2	Very low	76 Å²	76	110.3 Å²	110.3	78%	0.784	81%	0.81	S	S	*	*			trans	96.1	118	-170.6	0	0	0	0	0	111.1
436	D	35.7	Very low	38.5	Very low	160 Å²	160	115.3 Å²	115.3	86%	0.856	82%	0.817	S	S	*	*			cis	99.5	147.6	25.8	-166.2	-130.1	0	0	0	114.8
437	A	39.8	Very low	38.2	Very low	92 Å²	92	112.9 Å²	112.9	76%	0.76	82%	0.819	S	S	*	*			trans	65.8	148.9	177	0	0	0	0	0	118.7
438	G	36.3	Very low	38.1	Very low	82 Å²	82	112.5 Å²	112.5	85%	0.845	82%	0.815	S	S	*	*			trans	123.4	84.2	158.2	0	0	0	0	0	118.1
439	A	37.5	Very low	38.4	Very low	98 Å²	98	109.1 Å²	109.1	81%	0.81	81%	0.811	S	S	*	*			trans	-146.8	166.6	159.3	0	0	0	0	0	108.4
440	P	43.4	Very low	38	Very low	132 Å²	132	114.6 Å²	114.6	86%	0.857	82%	0.818	S	S	*	*			cis	-129.9	-175.9	-14.9	38.8	-21.9	0	0	0	113.8
441	G	36.3	Very low	38.3	Very low	77 Å²	77	115.1 Å²	115.1	79%	0.794	82%	0.815	S	S	*	*			trans	93.8	167.4	167.5	0	0	0	0	0	115.3
442	A	37.5	Very low	38.7	Very low	88 Å²	88	116.4 Å²	116.4	73%	0.727	82%	0.816	S	S	*	*			cis	-163.3	-173.2	-11.7	0	0	0	0	0	110.1
443	V	49.3	Very low	38.7	Very low	136 Å²	136	113 Å²	113	82%	0.824	81%	0.811	S	S	*	*			trans	64.1	101.3	162.4	-59.6	0	0	0	0	121.8
444	N	34.7	Very low	38.6	Very low	170 Å²	170	113.8 Å²	113.8	91%	0.909	81%	0.81	S	S	*	*			trans	17.9	135.1	133.5	-57.2	4.5	0	0	0	122.9
445	G	36.8	Very low	38.9	Very low	76 Å²	76	115.8 Å²	115.8	78%	0.784	81%	0.807	S	S	*	*			trans	120.7	157.1	144.4	0	0	0	0	0	116
446	R	42.3	Very low	39.2	Very low	253 Å²	253	117.5 Å²	117.5	96%	0.955	80%	0.804	S	S	*	*			cis	-169.4	136.5	-7.8	164.4	-177.6	164.8	-165.8	-4.6	110.9
447	G	37.1	Very low	39.5	Very low	82 Å²	82	119.3 Å²	119.3	85%	0.845	81%	0.805	S	S	*	*			trans	79.8	159.8	164.6	0	0	0	0	0	115.6
448	G	38.3	Very low	39.9	Very low	71 Å²	71	120.4 Å²	120.4	73%	0.732	80%	0.804	S	S	*	*			cis	-144.5	158.3	-4.8	0	0	0	0	0	110.5
449	A	38.5	Very low	39.9	Very low	97 Å²	97	120.4 Å²	120.4	80%	0.802	80%	0.796	S	S	*	*				69.2	131.1	84.4	0	0	0	0	0	113.4
450	F	34.7	Very low	40.1	Very low	206 Å²	206	123.7 Å²	123.7	90%	0.904	80%	0.799	S	S	*	*			cis	-157.6	175.8	2.9	-141.3	-110	0	0	0	110.4
451	A	39.5	Very low	40	Very low	80 Å²	80	127 Å²	127	66%	0.661	80%	0.801	S	S	*	*			trans	-95.5	-164.1	172.7	0	0	0	0	0	110.6
452	P	47	Very low	40.4	Very low	125 Å²	125	129 Å²	129	81%	0.812	80%	0.799	S	S	*	*			cis	-143.8	-176.3	-1.5	44.3	-25.2	0	0	0	117.5
453	G	37.1	Very low	40.4	Very low	77 Å²	77	135.8 Å²	135.8	79%	0.794	81%	0.806	S	S	*	*			trans	83.5	169.6	153.8	0	0	0	0	0	118.4
454	A	34.6	Very low	39.9	Very low	85 Å²	85	139.1 Å²	139.1	70%	0.702	81%	0.809	S	S	*	*			cis	-168.9	169.9	-19.4	0	0	0	0	0	110.6
455	E	40.8	Very low	40.3	Very low	168 Å²	168	136.7 Å²	136.7	79%	0.785	80%	0.803	S	S	*	*			trans	67.5	167.2	166.3	-49.9	-48.6	95.6	0	0	119.4
456	P	46.2	Very low	40.2	Very low	113 Å²	113	137.5 Å²	137.5	73%	0.734	80%	0.802	S	S	*	*				-136.4	-177.7	-66	41.7	-26.3	0	0	0	115.4
457	F	41.1	Very low	40.2	Very low	198 Å²	198	130.7 Å²	130.7	87%	0.868	79%	0.791	S	S	*	*			trans	-69.6	160	174.6	-82.1	-87.4	0	0	0	114.8
458	P	48.5	Very low	40.1	Very low	114 Å²	114	134.6 Å²	134.6	74%	0.74	79%	0.792	S	S	*	*				-121.1	151.7	99.3	-0.8	22.3	0	0	0	112.6
459	A	36.3	Very low	40.1	Very low	82 Å²	82	136.9 Å²	136.9	68%	0.678	79%	0.794	S	S	*	*				54.8	132.8	74.4	0	0	0	0	0	113.4
460	L	42.9	Very low	40.3	Very low	168 Å²	168	137.7 Å²	137.7	88%	0.88	79%	0.793	S	S	*	*			cis	-148.4	155.7	47.3	-71.2	159.8	0	0	0	113.8
461	F	39.7	Very low	40.8	Very low	202 Å²	202	133.9 Å²	133.9	89%	0.886	79%	0.789	S	S	*	*			trans	-94.5	154.7	161.9	-73.6	-92.7	0	0	0	111.2
462	P	45.3	Very low	40.6	Very low	117 Å²	117	133.5 Å²	133.5	76%	0.76	79%	0.793	S	S	*	*				-139.1	124.8	120.1	29.7	-13	0	0	0	113.7
463	R	36.6	Very low	40.4	Very low	231 Å²	231	136.5 Å²	136.5	87%	0.872	80%	0.801	S	S	*	*				89.2	122.5	91.7	-69.8	-81.1	157.1	166.3	-5.8	115.1
464	K	40.7	Very low	40.5	Very low	206 Å²	206	136.7 Å²	136.7	90%	0.896	80%	0.804	S	S	*	*			trans	-69.7	146.7	163.2	-76.5	-177.4	172.4	-178.4	0	111.3
465	P	42.1	Very low	40.7	Very low	119 Å²	119	136.3 Å²	136.3	77%	0.773	81%	0.807	S	S	*	*				-129.5	137.2	119.1	30.2	-16.7	0	0	0	110.7
466	A	35.1	Very low	41.3	Very low	93 Å²	93	134.4 Å²	134.4	77%	0.769	81%	0.81	S	S	*	*				93.9	152	74.5	0	0	0	0	0	112.4
467	P	42.2	Very low	41	Very low	111 Å²	111	133.3 Å²	133.3	72%	0.721	81%	0.81	S	S	*	*			trans	-114.3	179.5	-156.3	40.6	-31.1	0	0	0	116.6
468	L	35.6	Very low	41	Very low	164 Å²	164	130.7 Å²	130.7	86%	0.859	80%	0.804	S	S	*	*			trans	78.3	159.1	172.5	-49	175.7	0	0	0	116.1
469	P	37.8	Very low	40.6	Very low	119 Å²	119	133.6 Å²	133.6	77%	0.773	81%	0.808	S	S	*	*			cis	-126.6	177.4	-20.7	36.7	-19.8	0	0	0	114.2
470	S	42.9	Very low	40.9	Very low	113 Å²	113	133.6 Å²	133.6	79%	0.79	81%	0.808	S	S	*	*			trans	-72.5	159.6	168.4	-41	0	0	0	0	112.8
471	P	44.6	Very low	41	Very low	127 Å²	127	129.6 Å²	129.6	83%	0.825	80%	0.799	S	S	*	*				-156	160.5	104.5	39.4	-21.9	0	0	0	118.1
472	G	35	Very low	41.6	Very low	72 Å²	72	129.3 Å²	129.3	74%	0.742	80%	0.797	S	S	*	*			trans	83.8	158.7	155.6	0	0	0	0	0	117.6
473	L	42.7	Very low	41.5	Very low	187 Å²	187	134 Å²	134	98%	0.979	80%	0.8	S	S	*	*			cis	-161.3	146.6	-4	-107.8	166.3	0	0	0	109.6
474	G	38.8	Very low	42.1	Very low	82 Å²	82	130.2 Å²	130.2	85%	0.845	80%	0.795	S	S	*	*			trans	119.7	119.3	163.7	0	0	0	0	0	117.2
475	G	38.9	Very low	42	Very low	76 Å²	76	128.2 Å²	128.2	78%	0.784	79%	0.787	S	S	*	*			trans	-130.4	-144	166.3	0	0	0	0	0	109.5
476	P	53.5	Low	42.2	Very low	129 Å²	129	128.7 Å²	128.7	84%	0.838	79%	0.787	S	S	*	*			cis	-144	-162.5	3.5	43.8	-24	0	0	0	115.4
477	A	40.5	Very low	42.6	Very low	89 Å²	89	130 Å²	130	74%	0.736	78%	0.777	S	S	*	*			trans	83.9	146.3	159.5	0	0	0	0	0	117.9
478	L	40.6	Very low	43.2	Very low	143 Å²	143	132.4 Å²	132.4	75%	0.749	78%	0.776	S	S	*	*			cis	-153.2	130.3	1	-163.1	95.5	0	0	0	113.3
479	H	41.4	Very low	43.6	Very low	176 Å²	176	130.3 Å²	130.3	82%	0.815	77%	0.766	S	S	*	*			trans	54.9	161.5	152.4	-84.8	-152.8	0	0	0	121.4
480	A	42.8	Very low	43.9	Very low	82 Å²	82	133.1 Å²	133.1	68%	0.678	77%	0.774	S	S	*	*			cis	177.5	159.1	-27.2	0	0	0	0	0	108.5
481	A	44.1	Very low	43.5	Very low	83 Å²	83	136.9 Å²	136.9	69%	0.686	78%	0.779	S	S	*	*			cis	-177.7	-179.9	-22.1	0	0	0	0	0	108.6
482	K	52.7	Low	43.5	Very low	197 Å²	197	138.3 Å²	138.3	86%	0.857	78%	0.778	S	S	*	*			trans	89.5	142.3	175.2	-50.4	158.7	-175.5	169.3	0	114.2
483	R	43.2	Very low	44.2	Very low	216 Å²	216	140.3 Å²	140.3	82%	0.815	78%	0.778	S	S	*	*			cis	-158.8	132.8	3.7	-138.2	174.6	179	165.4	-0.6	113.8
484	I	48.1	Very low	44	Very low	150 Å²	150	137.3 Å²	137.3	77%	0.769	77%	0.77	S	S	*	*			trans	42.7	149.1	139.9	-61.4	173.2	0	0	0	120.5
485	K	39.7	Very low	43.6	Very low	165 Å²	165	138 Å²	138	72%	0.717	77%	0.768	S	S	*	*			cis	164.1	150.8	-41.5	173.7	168.5	178	-178.1	0	108.1	E487	K485-E487 IonicContact NZ-OE2 3.99Å
486	V	46	Very low	43.5	Very low	129 Å²	129	138.5 Å²	138.5	78%	0.782	76%	0.764	S	S	*	*			trans	123.7	109.8	164.7	170.7	0	0	0	0	108.6
487	E	42.8	Very low	42.6	Very low	120 Å²	120	140.5 Å²	140.5	56%	0.561	77%	0.767	S	S	*	*			cis	93.1	100.2	38.6	-166.7	-156	130	0	0	114.4	K485	K485-E487 IonicContact NZ-OE2 3.99Å
488	K	55.9	Low	42.6	Very low	161 Å²	161	143.2 Å²	143.2	70%	0.7	77%	0.768	S	S	*	*				-157.4	156.7	126.3	-144	73.6	-148.4	98.3	0	111.4
489	D	42.8	Very low	42.7	Very low	120 Å²	120	140.7 Å²	140.7	64%	0.642	76%	0.76	S	S	*	*			trans	-81.8	140.9	-167.7	-40.3	-109.3	0	0	0	113.3
490	L	44.7	Very low	42.7	Very low	179 Å²	179	138.4 Å²	138.4	94%	0.937	76%	0.764	S	S	*	*			trans	-154.4	152.6	131.8	-140.6	69.1	0	0	0	111
491	E	34	Very low	42.9	Very low	192 Å²	192	141.6 Å²	141.6	90%	0.897	77%	0.765	S	S	*	*			trans	-93.3	117.3	-160.1	-165	176.6	117.3	0	0	112.8
492	L	45.7	Very low	43.3	Very low	156 Å²	156	142.5 Å²	142.5	82%	0.817	76%	0.758	S	S	*	*			trans	-139.7	142.4	168.8	-77.6	172.9	0	0	0	109.3
493	P	49.9	Very low	43.7	Very low	114 Å²	114	138.7 Å²	138.7	74%	0.74	75%	0.751	S	S	*	*	P	Polyproline II helix	trans	-65.9	143.7	177.7	28.4	-34.5	0	0	0	110.5	A495	P493-A495 PolarHBondContact O-N 2.93Å
494	P	38.9	Very low	44.2	Very low	125 Å²	125	135.4 Å²	135.4	81%	0.812	74%	0.739	S	S	*	*	P	Polyproline II helix	trans	-64.1	129.8	179.4	27	-33.9	0	0	0	110.1	A496	P494-A496 PolarHBondContact O-N 3Å
495	A	30.1	Very low	45.3	Very low	97 Å²	97	130.9 Å²	130.9	80%	0.802	72%	0.721	S	S	*	*	P	Polyproline II helix	trans	-56.4	126.4	163.1	0	0	0	0	0	108	P493 L497	P493-A495 PolarHBondContact O-N 2.93Å; A495-L497 PolarHBondContact O-N 2.84Å; A495-L497 VanDerWaalsContact O-N 3.16Å
496	A	37.2	Very low	46.5	Very low	85 Å²	85	130.4 Å²	130.4	70%	0.702	72%	0.722	S	S	*	*	P	Polyproline II helix	trans	-60	123.2	179.1	0	0	0	0	0	109.1	P494 I498	P494-A496 PolarHBondContact O-N 3Å; A496-I498 VanDerWaalsContact C-N 3.27Å; A496-I498 PolarHBondContact O-N 3.26Å
497	L	34.1	Very low	47.7	Very low	172 Å²	172	131 Å²	131	90%	0.901	71%	0.71	S	S	*	*			trans	-62.4	95.2	163.3	-94.6	163	0	0	0	107.1	A495 P499	A495-L497 PolarHBondContact O-N 2.84Å; A495-L497 VanDerWaalsContact O-N 3.16Å; L497-P499 VanDerWaalsContact O-CD 3.29Å; L497-P499 WeakPolarHBondContact O-CD 3.39Å
498	I	40	Very low	49.1	Very low	146 Å²	146	129.6 Å²	129.6	75%	0.749	71%	0.706	S	S	*	*			trans	-67.1	118.5	171.5	-53.8	-178.9	0	0	0	105.9	A496	A496-I498 VanDerWaalsContact C-N 3.27Å; A496-I498 PolarHBondContact O-N 3.26Å
499	P	43.4	Very low	49.8	Very low	90 Å²	90	126.8 Å²	126.8	58%	0.584	70%	0.702	S	S	*	*			trans	-59.7	158.4	174	-21	34.1	0	0	0	110.3	L497 E501	L497-P499 VanDerWaalsContact O-CD 3.29Å; L497-P499 WeakPolarHBondContact O-CD 3.39Å; P499-E501 PolarHBondContact O-N 2.87Å
500	S	40.6	Very low	51	Low	128 Å²	128	122.9 Å²	122.9	90%	0.895	69%	0.69	S	S	*	*			trans	-73.6	60.1	174.8	56.6	0	0	0	0	111.8	N502	S500-N502 PolarHBondContact O-N 3.23Å
501	E	47.3	Very low	51.9	Low	149 Å²	149	120.2 Å²	120.2	70%	0.696	67%	0.668	S	S	*	*			trans	-65.5	124.2	168.8	-79	-173.5	67.2	0	0	109.3	P499 V503	P499-E501 PolarHBondContact O-N 2.87Å; E501-V503 PolarHBondContact O-N 3.08Å
502	N	52.9	Low	52.8	Low	102 Å²	102	114.1 Å²	114.1	55%	0.545	65%	0.65	S	S	.	*			trans	-53.7	131.4	-173.3	-176.3	-9.3	0	0	0	111.2	S500 Y504 S505 Q506	S500-N502 PolarHBondContact O-N 3.23Å; N502-Y504 PolarHBondContact O-N 3.19Å; N502-Y504 VanDerWaalsContact OD1-CB 3.29Å; N502-Y504 WeakPolarHBondContact OD1-CB 3.46Å; N502-Y504 PolarHBondContact OD1-N 3.45Å; N502-S505 WeakPolarHBondContact O-CA 3.47Å; N502-S505 VanDerWaalsContact O-CB 3.3Å; N502-S505 WeakPolarHBondContact O-CB 3.41Å; N502-S505 PolarHBondContact O-N 2.84Å; N502-Q506 PolarHBondContact O-N 3.34Å
503	V	59.7	Low	53.4	Low	116 Å²	116	109.7 Å²	109.7	70%	0.703	64%	0.636	S	S	*	*	H	α-helix	trans	-52.3	-31.7	175.4	178.4	0	0	0	0	111.1	E501 Q506 W507	E501-V503 PolarHBondContact O-N 3.08Å; V503-Q506 PolarHBondContact O-N 3.18Å; V503-W507 WeakPolarHBondContact O-CB 3.14Å; V503-W507 PolarHBondContact O-N 3.28Å
504	Y	53.9	Low	53.6	Low	147 Å²	147	107.4 Å²	107.4	58%	0.576	62%	0.623	S	S	*	*	H	α-helix	trans	-62.8	-39.8	174.6	-159.7	-108.8	0	0	0	113.2	N502 W507 L508	N502-Y504 PolarHBondContact O-N 3.19Å; N502-Y504 VanDerWaalsContact OD1-CB 3.29Å; N502-Y504 WeakPolarHBondContact OD1-CB 3.46Å; N502-Y504 PolarHBondContact OD1-N 3.45Å; Y504-W507 HydrophobicContact CE2-CE3 4.41Å; Y504-W507 PolarHBondContact O-N 3.02Å; Y504-L508 HydrophobicContact CD1-CD1 4.22Å; Y504-L508 HydrophobicContact CE1-CD1 3.86Å; Y504-L508 WeakPolarHBondContact O-CB 3.2Å; Y504-L508 PolarHBondContact O-N 2.74Å
505	S	71.1	Confident	54.2	Low	56 Å²	56	110.5 Å²	110.5	39%	0.392	62%	0.619	S	S	.	*	H	α-helix	trans	-64.5	-46.1	175.3	-51.4	0	0	0	0	111.2	N502 W507 L508 V509	N502-S505 WeakPolarHBondContact O-CA 3.47Å; N502-S505 VanDerWaalsContact O-CB 3.3Å; N502-S505 WeakPolarHBondContact O-CB 3.41Å; N502-S505 PolarHBondContact O-N 2.84Å; S505-W507 VanDerWaalsContact C-N 3.3Å; S505-W507 PolarHBondContact O-N 2.86Å; S505-L508 PolarHBondContact O-N 3.21Å; S505-V509 WeakPolarHBondContact O-CG2 3.42Å; S505-V509 PolarHBondContact O-N 3.05Å
506	Q	66.2	Low	55	Low	154 Å²	154	114.2 Å²	114.2	72%	0.72	62%	0.619	S	S	*	*	H	α-helix	trans	-66.8	-34	178.5	-163.3	171.6	78.7	0	0	111.6	N502 V503 G510	N502-Q506 PolarHBondContact O-N 3.34Å; V503-Q506 PolarHBondContact O-N 3.18Å; Q506-G510 PolarHBondContact O-N 2.81Å
507	W	71.1	Confident	55	Low	143 Å²	143	119 Å²	119	54%	0.542	63%	0.625	S	S	.	*	H	α-helix	trans	-67.1	-44	170.8	-173.3	81.5	0	0	0	112.3	V503 Y504 S505 G510 Y511	V503-W507 WeakPolarHBondContact O-CB 3.14Å; V503-W507 PolarHBondContact O-N 3.28Å; Y504-W507 HydrophobicContact CE2-CE3 4.41Å; Y504-W507 PolarHBondContact O-N 3.02Å; S505-W507 VanDerWaalsContact C-N 3.3Å; S505-W507 PolarHBondContact O-N 2.86Å; W507-G510 CarbonylContact O-C 3.53Å; W507-G510 PolarHBondContact O-N 3.13Å; W507-Y511 HydrophobicContact CH2-CD2 4.06Å; W507-Y511 HydrophobicContact CH2-CE2 4.17Å; W507-Y511 AromaticContact CZ2-CD2 3.8Å; W507-Y511 HydrophobicContact CZ2-CD2 3.8Å; W507-Y511 AromaticContact CZ2-CE2 3.95Å; W507-Y511 HydrophobicContact CZ2-CE2 3.95Å; W507-Y511 WeakPolarHBondContact O-CB 3.19Å; W507-Y511 PolarHBondContact O-N 2.76Å
508	L	72.1	Confident	55.4	Low	89 Å²	89	119 Å²	119	47%	0.466	62%	0.622	S	S	.	*	H	α-helix	trans	-60.5	-46.1	175.7	-119.2	73.3	0	0	0	112	Y504 S505 G510 Y511 A512	Y504-L508 HydrophobicContact CD1-CD1 4.22Å; Y504-L508 HydrophobicContact CE1-CD1 3.86Å; Y504-L508 WeakPolarHBondContact O-CB 3.2Å; Y504-L508 PolarHBondContact O-N 2.74Å; S505-L508 PolarHBondContact O-N 3.21Å; L508-G510 VanDerWaalsContact C-N 3.32Å; L508-G510 PolarHBondContact O-N 2.96Å; L508-Y511 WeakPolarHBondContact O-CB 3.35Å; L508-Y511 PolarHBondContact O-N 3.32Å; L508-Y511 VanDerWaalsContact O-N 3.13Å; L508-A512 PolarHBondContact O-N 3.25Å
509	V	71	Confident	55.3	Low	103 Å²	103	119.6 Å²	119.6	62%	0.624	62%	0.619	S	S	*	*	H	α-helix	trans	-62.9	-40.2	175.8	172.2	0	0	0	0	110.7	S505 Y511 A512 A513	S505-V509 WeakPolarHBondContact O-CG2 3.42Å; S505-V509 PolarHBondContact O-N 3.05Å; V509-Y511 PolarHBondContact O-N 3.46Å; V509-A512 PolarHBondContact O-N 3.26Å; V509-A513 WeakPolarHBondContact O-CB 3.44Å; V509-A513 PolarHBondContact O-N 3.26Å
510	G	68.2	Low	55.1	Low	37 Å²	37	121 Å²	121	38%	0.381	62%	0.622	S	S	.	*	H	α-helix	trans	-62.3	-37.8	171	0	0	0	0	0	113.6	Q506 W507 L508 A513 S514	Q506-G510 PolarHBondContact O-N 2.81Å; W507-G510 CarbonylContact O-C 3.53Å; W507-G510 PolarHBondContact O-N 3.13Å; L508-G510 VanDerWaalsContact C-N 3.32Å; L508-G510 PolarHBondContact O-N 2.96Å; G510-A513 PolarHBondContact O-N 3.33Å; G510-S514 VanDerWaalsContact O-CB 3.24Å; G510-S514 WeakPolarHBondContact O-CB 3.43Å; G510-S514 PolarHBondContact O-N 2.87Å; G510-S514 PolarHBondContact O-OG 3.4Å
511	Y	61.9	Low	55.1	Low	123 Å²	123	120.8 Å²	120.8	48%	0.482	62%	0.617	S	S	.	*	H	α-helix	trans	-72	-30.5	178.4	-148.6	-96.2	0	0	0	112.6	W507 L508 V509 S514	W507-Y511 HydrophobicContact CH2-CD2 4.06Å; W507-Y511 HydrophobicContact CH2-CE2 4.17Å; W507-Y511 AromaticContact CZ2-CD2 3.8Å; W507-Y511 HydrophobicContact CZ2-CD2 3.8Å; W507-Y511 AromaticContact CZ2-CE2 3.95Å; W507-Y511 HydrophobicContact CZ2-CE2 3.95Å; W507-Y511 WeakPolarHBondContact O-CB 3.19Å; W507-Y511 PolarHBondContact O-N 2.76Å; L508-Y511 WeakPolarHBondContact O-CB 3.35Å; L508-Y511 PolarHBondContact O-N 3.32Å; L508-Y511 VanDerWaalsContact O-N 3.13Å; V509-Y511 PolarHBondContact O-N 3.46Å; Y511-S514 PolarHBondContact O-OG 2.9Å
512	A	54.4	Low	54.8	Low	64 Å²	64	123.5 Å²	123.5	53%	0.529	63%	0.627	S	S	.	*	H	α-helix	trans	-72.6	-49.3	169.7	0	0	0	0	0	111.7	L508 V509 R515	L508-A512 PolarHBondContact O-N 3.25Å; V509-A512 PolarHBondContact O-N 3.26Å; A512-R515 PolarHBondContact O-N 2.95Å
513	A	57.5	Low	54.2	Low	63 Å²	63	126.9 Å²	126.9	52%	0.521	64%	0.644	S	S	.	*	H	α-helix	trans	-63.6	-43.5	-178.2	0	0	0	0	0	112.8	V509 G510 R515 H516	V509-A513 WeakPolarHBondContact O-CB 3.44Å; V509-A513 PolarHBondContact O-N 3.26Å; G510-A513 PolarHBondContact O-N 3.33Å; A513-R515 PolarHBondContact O-N 3.49Å; A513-R515 VanDerWaalsContact O-N 3.16Å; A513-H516 PolarHBondContact O-N 2.92Å
514	S	55.1	Low	52.9	Low	67 Å²	67	124.7 Å²	124.7	47%	0.469	65%	0.645	S	S	.	*	T	Hydrogen-bonded Turn	trans	-63.8	-19	-180	54.8	0	0	0	0	114.1	G510 Y511	G510-S514 VanDerWaalsContact O-CB 3.24Å; G510-S514 WeakPolarHBondContact O-CB 3.43Å; G510-S514 PolarHBondContact O-N 2.87Å; G510-S514 PolarHBondContact O-OG 3.4Å; Y511-S514 PolarHBondContact O-OG 2.9Å
515	R	51.1	Low	52	Low	190 Å²	190	127.3 Å²	127.3	72%	0.717	66%	0.66	S	S	*	*	T	Hydrogen-bonded Turn	trans	-81.1	-13.8	174.1	-77.3	178.9	164	-95.8	-5.7	114.4	A512 A513	A512-R515 PolarHBondContact O-N 2.95Å; A513-R515 PolarHBondContact O-N 3.49Å; A513-R515 VanDerWaalsContact O-N 3.16Å
516	H	45.4	Very low	50.2	Low	174 Å²	174	130.4 Å²	130.4	81%	0.806	68%	0.676	S	S	*	*	S	Bend	trans	-94	-8.6	-179.2	-112.3	-86.9	0	0	0	114.5	A513	A513-H516 PolarHBondContact O-N 2.92Å
517	F	37.2	Very low	48.6	Very low	187 Å²	187	129.8 Å²	129.8	82%	0.82	68%	0.678	S	S	*	*	S	Bend	trans	-111.9	43.1	-170	-142.5	-91.1	0	0	0	114.1
518	M	43.4	Very low	46.9	Very low	170 Å²	170	127.5 Å²	127.5	84%	0.837	69%	0.69	S	S	*	*			trans	-146.4	41.7	179.4	-126.6	157.9	-74.5	0	0	113.7
519	K	38.6	Very low	45	Very low	159 Å²	159	133.3 Å²	133.3	69%	0.691	71%	0.706	S	S	*	*	S	Bend	trans	-140.2	112.9	171.2	-160.4	73.2	-177.8	75.8	0	112
520	D	37.5	Very low	43.3	Very low	120 Å²	120	137.4 Å²	137.4	64%	0.642	72%	0.718	S	S	*	*			trans	52.5	91.1	162.8	-47.7	-23.6	0	0	0	119.5
521	P	41.4	Very low	41.8	Very low	123 Å²	123	141 Å²	141	80%	0.799	74%	0.737	S	S	*	*			trans	-108.9	66.5	152.1	37.2	-29.1	0	0	0	111.1
522	F	40.7	Very low	40.9	Very low	206 Å²	206	139.5 Å²	139.5	90%	0.904	74%	0.742	S	S	*	*			trans	-140.5	97	161.9	-116	-78.8	0	0	0	110.8
523	L	41.1	Very low	40.1	Very low	173 Å²	173	145.6 Å²	145.6	91%	0.906	76%	0.757	S	S	*	*			trans	-84	143	175.3	-69	167.9	0	0	0	110.4
524	G	31.7	Very low	38.9	Very low	70 Å²	70	147.2 Å²	147.2	72%	0.722	77%	0.771	S	S	*	*			trans	76.9	89.1	151.6	0	0	0	0	0	118
525	F	35.8	Very low	38.2	Very low	202 Å²	202	149.5 Å²	149.5	89%	0.886	78%	0.782	S	S	*	*				-147.5	140.1	116.4	-140.1	-94.5	0	0	0	111.6
526	T	33.5	Very low	37.5	Very low	121 Å²	121	145.7 Å²	145.7	74%	0.742	78%	0.784	S	S	*	*			trans	-111	142.7	-179.8	49.7	0	0	0	0	110.9
527	D	31	Very low	37.1	Very low	142 Å²	142	141.7 Å²	141.7	76%	0.759	78%	0.776	S	S	*	*			trans	42.2	97.8	159.1	-148.8	-55	0	0	0	117.9
528	A	36.9	Very low	37	Very low	95 Å²	95	141 Å²	141	79%	0.785	78%	0.775	S	S	*	*			trans	-143.2	107.3	161.6	0	0	0	0	0	110.8
529	R	31.7	Very low	36.7	Very low	211 Å²	211	140.8 Å²	140.8	80%	0.796	77%	0.772	S	S	*	*			trans	-71.2	123.5	-179	-52.9	154.7	72.4	-118.7	7.3	110.9
530	Q	34.6	Very low	36.7	Very low	189 Å²	189	136.7 Å²	136.7	88%	0.883	76%	0.763	S	S	*	*			trans	173	149.8	135.8	-97.1	161	23.3	0	0	113.6
531	S	36.5	Very low	36.8	Very low	113 Å²	113	137.1 Å²	137.1	79%	0.79	78%	0.776	S	S	*	*			trans	-135.6	128.9	164.3	-178	0	0	0	0	108.7
532	P	43.7	Very low	36.5	Very low	90 Å²	90	137.8 Å²	137.8	58%	0.584	77%	0.768	S	S	*	*			trans	-103.3	178.5	159.5	32.2	-21.3	0	0	0	111.4
533	F	38	Very low	36.1	Very low	192 Å²	192	134.9 Å²	134.9	84%	0.842	76%	0.762	S	S	*	*			trans	68.5	47.5	174.1	-49.1	-63.3	0	0	0	117.5
534	A	32	Very low	35.8	Very low	97 Å²	97	130.3 Å²	130.3	80%	0.802	76%	0.757	S	S	*	*			trans	-86.7	121.8	138.1	0	0	0	0	0	108.9
535	T	39.5	Very low	35.9	Very low	116 Å²	116	132.8 Å²	132.8	71%	0.712	76%	0.763	S	S	*	*			trans	-132.3	113.6	161.8	53	0	0	0	0	106
536	S	36.9	Very low	36	Very low	109 Å²	109	130.9 Å²	130.9	76%	0.762	76%	0.762	S	S	*	*				69.8	131.1	88.8	-55.4	0	0	0	0	112.9
537	S	37.5	Very low	36.2	Very low	90 Å²	90	135 Å²	135	63%	0.629	76%	0.763	S	S	*	*			cis	-174.7	156.9	-8.4	46.1	0	0	0	0	108.4
538	E	34.5	Very low	36.4	Very low	172 Å²	172	137.3 Å²	137.3	80%	0.804	77%	0.767	S	S	*	*			trans	62.6	135.6	160.8	-22.3	-165.4	107.1	0	0	115.8
539	H	38.2	Very low	36.6	Very low	167 Å²	167	138.2 Å²	138.2	77%	0.773	77%	0.768	S	S	*	*			cis	-162.5	169.9	48.6	-132.6	-77.4	0	0	0	113.5
540	S	38	Very low	37.1	Very low	73 Å²	73	134.6 Å²	134.6	51%	0.51	77%	0.769	S	S	.	*			trans	1.2	122	164.3	-56.8	0	0	0	0	120.5	E542	S540-E542 PolarHBondContact O-N 3.26Å
541	S	38.7	Very low	38	Very low	129 Å²	129	130.9 Å²	130.9	90%	0.902	76%	0.762	S	S	*	*			trans	-83.4	97	154.6	54.2	0	0	0	0	111
542	E	35.3	Very low	38.3	Very low	136 Å²	136	132.1 Å²	132.1	64%	0.636	77%	0.767	S	S	*	*			trans	-151.8	154.2	171	66.7	-179.8	98.7	0	0	115.2	S540	S540-E542 PolarHBondContact O-N 3.26Å
543	N	32.1	Very low	38.3	Very low	145 Å²	145	131.3 Å²	131.3	78%	0.775	78%	0.775	S	S	*	*			trans	50.9	94.4	149.2	-58.8	-30.2	0	0	0	119.2
544	G	35.7	Very low	38.6	Very low	78 Å²	78	129.2 Å²	129.2	80%	0.804	77%	0.773	S	S	*	*			trans	-156.5	18.2	178	0	0	0	0	0	117.9	L546	G544-L546 PolarHBondContact O-N 3.21Å; G544-L546 VanDerWaalsContact O-N 3.16Å
545	S	34	Very low	39.2	Very low	122 Å²	122	131.3 Å²	131.3	85%	0.853	77%	0.77	S	S	*	*			trans	-81.2	91.4	177.9	168.7	0	0	0	0	111.5
546	L	38.7	Very low	39.9	Very low	162 Å²	162	132.8 Å²	132.8	85%	0.848	77%	0.772	S	S	*	*			trans	-128.1	149.1	168.8	-128.1	121.4	0	0	0	112.5	G544	G544-L546 PolarHBondContact O-N 3.21Å; G544-L546 VanDerWaalsContact O-N 3.16Å
547	R	36.9	Very low	40.4	Very low	206 Å²	206	135.4 Å²	135.4	78%	0.777	78%	0.778	S	S	*	*			trans	-109.7	-171	-179.1	-51.6	179.4	88.1	148.1	2.7	108.9
548	F	35.4	Very low	40.6	Very low	192 Å²	192	134.6 Å²	134.6	84%	0.842	78%	0.784	S	S	*	*			trans	73	152.2	179.9	-49.1	-78.5	0	0	0	112.8
549	S	40.4	Very low	41.1	Very low	114 Å²	114	129.7 Å²	129.7	80%	0.797	78%	0.779	S	S	*	*			cis	-129.1	154.8	17.6	-59.2	0	0	0	0	114.9
550	T	42.8	Very low	41.9	Very low	134 Å²	134	129.7 Å²	129.7	82%	0.822	78%	0.784	S	S	*	*	S	Bend	trans	-145.6	139.4	165.2	-50.5	0	0	0	0	104.8
551	P	52.6	Low	42.2	Very low	112 Å²	112	132.2 Å²	132.2	73%	0.727	80%	0.801	S	S	*	*			trans	-75.1	161.5	-135.5	-22.3	34.9	0	0	0	116.5
552	P	43.4	Very low	42.5	Very low	139 Å²	139	129.5 Å²	129.5	90%	0.903	79%	0.793	S	S	*	*			trans	-66.9	145.8	170.3	30.2	-35.4	0	0	0	111.5
553	G	44.6	Very low	42.8	Very low	73 Å²	73	135.1 Å²	135.1	75%	0.753	81%	0.809	S	S	*	*			trans	-147.4	130.8	173.3	0	0	0	0	0	109.6
554	D	43.2	Very low	43.3	Very low	148 Å²	148	134.1 Å²	134.1	79%	0.791	81%	0.813	S	S	*	*			trans	-37.6	159.4	-167.3	-71	-107.1	0	0	0	122.7
555	L	45.4	Very low	43.7	Very low	141 Å²	141	134.1 Å²	134.1	74%	0.738	81%	0.813	S	S	*	*			trans	99.2	131.7	135.4	-118.9	72.9	0	0	0	121.3
556	L	53.6	Low	44.4	Very low	147 Å²	147	135.1 Å²	135.1	77%	0.77	81%	0.814	S	S	*	*			trans	78.1	96.8	154.9	-50.6	-177.2	0	0	0	121.4
557	D	47.3	Very low	44.7	Very low	164 Å²	164	132.4 Å²	132.4	88%	0.877	82%	0.816	S	S	*	*				59.7	139.7	115.6	-124.3	-76.1	0	0	0	124
558	G	41.9	Very low	45.5	Very low	73 Å²	73	129 Å²	129	75%	0.753	82%	0.823	S	S	*	*			trans	75	135.9	165.1	0	0	0	0	0	117.9
559	G	44.1	Very low	45.9	Very low	68 Å²	68	123.4 Å²	123.4	70%	0.701	82%	0.819	S	S	*	*			cis	153	128.1	-7.7	0	0	0	0	0	113.6
560	L	54.9	Low	45.8	Very low	168 Å²	168	121.4 Å²	121.4	88%	0.88	82%	0.817	S	S	*	*			trans	75.5	124.6	162.4	-46.3	-179.1	0	0	0	120.2
561	S	45.1	Very low	45.6	Very low	126 Å²	126	120.9 Å²	120.9	88%	0.881	82%	0.819	S	S	*	*			trans	28.9	139.9	133.5	-51.3	0	0	0	0	122.2
562	G	44.3	Very low	45.2	Very low	71 Å²	71	122 Å²	122	73%	0.732	82%	0.823	S	S	*	*			cis	150.3	-173.4	-0.2	0	0	0	0	0	113.5
563	R	42.3	Very low	45.4	Very low	254 Å²	254	120 Å²	120	96%	0.958	81%	0.81	S	S	*	*			trans	74.3	126.1	177.6	-72.6	-175.1	149.7	-160.5	-7.4	118.9
564	S	42	Very low	45.3	Very low	125 Å²	125	124.1 Å²	124.1	87%	0.874	81%	0.81	S	S	*	*			trans	-85	159.5	168.6	-39.3	0	0	0	0	112.3
565	G	44.1	Very low	45.1	Very low	78 Å²	78	125.7 Å²	125.7	80%	0.804	82%	0.818	S	S	*	*			trans	-148.2	124.6	165.5	0	0	0	0	0	110.9
566	T	48.9	Very low	44.9	Very low	142 Å²	142	122.6 Å²	122.6	87%	0.871	82%	0.82	S	S	*	*			trans	-108	127.1	-175.9	51.2	0	0	0	0	111.7
567	A	45.8	Very low	44.5	Very low	106 Å²	106	118.8 Å²	118.8	88%	0.876	82%	0.816	S	S	*	*			trans	-151.9	138.2	159.6	0	0	0	0	0	110.3
568	S	53.3	Low	44.7	Very low	134 Å²	134	117.8 Å²	117.8	94%	0.937	82%	0.818	S	S	*	*			trans	-86.9	148.5	177.3	-52	0	0	0	0	111
569	G	43.3	Very low	44.8	Very low	74 Å²	74	117 Å²	117	76%	0.763	81%	0.81	S	S	*	*			trans	154.1	104.5	163	0	0	0	0	0	116.2
570	G	39	Very low	45.6	Very low	72 Å²	72	120.3 Å²	120.3	74%	0.742	82%	0.819	S	S	*	*	S	Bend	trans	31.2	124.9	148.1	0	0	0	0	0	122
571	S	38.6	Very low	44.9	Very low	123 Å²	123	115.6 Å²	115.6	86%	0.86	81%	0.811	S	S	*	*			trans	69.9	51.4	145.7	-50.8	0	0	0	0	117.7	P573	S571-P573 WeakPolarHBondContact O-CD 3.38Å
572	T	43.3	Very low	45.2	Very low	135 Å²	135	121.1 Å²	121.1	83%	0.828	81%	0.812	S	S	*	*			trans	-68.4	127	163.3	47.7	0	0	0	0	112.2
573	P	48.5	Very low	45.4	Very low	97 Å²	97	123.6 Å²	123.6	63%	0.63	82%	0.816	S	S	*	*			trans	-87.3	-151.8	161.3	32.7	-24	0	0	0	110.1	S571	S571-P573 WeakPolarHBondContact O-CD 3.38Å
574	H	41.8	Very low	45.5	Very low	161 Å²	161	116.6 Å²	116.6	75%	0.745	81%	0.806	S	S	*	*			trans	84	107.5	172.3	-49.3	-76.9	0	0	0	118.8	G576	H574-G576 PolarHBondContact O-N 3.24Å; H574-G576 VanDerWaalsContact O-N 3.15Å
575	L	40.2	Very low	45.9	Very low	181 Å²	181	116.7 Å²	116.7	95%	0.948	81%	0.806	S	S	*	*				22.7	77.8	122.8	-56	176.7	0	0	0	118
576	G	40	Very low	46.2	Very low	76 Å²	76	122.2 Å²	122.2	78%	0.784	81%	0.808	S	S	*	*			trans	-114.2	135.6	145.7	0	0	0	0	0	107.5	H574	H574-G576 PolarHBondContact O-N 3.24Å; H574-G576 VanDerWaalsContact O-N 3.15Å
577	G	45.5	Very low	46.1	Very low	67 Å²	67	124.1 Å²	124.1	69%	0.691	81%	0.807	S	S	*	*				101.5	111.8	52.5	0	0	0	0	0	106.8	G579	G577-G579 PolarHBondContact O-N 2.9Å
578	P	52.1	Low	46.1	Very low	142 Å²	142	122 Å²	122	92%	0.922	80%	0.796	S	S	*	*			trans	-73.8	87.5	-165.6	29.2	-35.5	0	0	0	112.1
579	G	43.2	Very low	46	Very low	56 Å²	56	124.8 Å²	124.8	58%	0.577	79%	0.786	S	S	*	*			trans	-59.8	147.7	168	0	0	0	0	0	111.2	G577 G581	G577-G579 PolarHBondContact O-N 2.9Å; G579-G581 PolarHBondContact O-N 3.34Å
580	P	61	Low	46.7	Very low	139 Å²	139	132.2 Å²	132.2	90%	0.903	79%	0.791	S	S	*	*			trans	-66.6	95.6	-176.4	27.1	-34.6	0	0	0	110.7	R582	P580-R582 PolarHBondContact O-N 2.9Å
581	G	41.4	Very low	48.3	Very low	68 Å²	68	131.4 Å²	131.4	70%	0.701	77%	0.774	S	S	*	*			trans	-58.3	127.2	-177.2	0	0	0	0	0	111.8	G579	G579-G581 PolarHBondContact O-N 3.34Å
582	R	50.1	Low	50.3	Low	242 Å²	242	128 Å²	128	91%	0.913	75%	0.746	S	S	*	*			trans	-46.8	125.3	168.1	-94.3	-179.5	160.4	-154.2	-1.9	109.1	P580 S584	P580-R582 PolarHBondContact O-N 2.9Å; R582-S584 PolarHBondContact O-N 3.29Å
583	P	48.6	Very low	52.3	Low	123 Å²	123	124.7 Å²	124.7	80%	0.799	73%	0.726	S	S	*	*			trans	-63.9	105.2	173.4	25.1	-32.4	0	0	0	109	S585	P583-S585 PolarHBondContact O-N 3.35Å; P583-S585 VanDerWaalsContact O-N 3.14Å
584	S	45.5	Very low	54.2	Low	107 Å²	107	120.1 Å²	120.1	75%	0.748	70%	0.696	S	S	*	*			trans	-65.3	114.2	-178.5	-171.4	0	0	0	0	109.3	R582 K586	R582-S584 PolarHBondContact O-N 3.29Å; S584-K586 PolarHBondContact O-N 3.16Å
585	S	48.9	Very low	56.3	Low	127 Å²	127	119.8 Å²	119.8	89%	0.888	70%	0.695	S	S	*	*	T	Hydrogen-bonded Turn	trans	-76.9	53.7	-164.6	-178.3	0	0	0	0	113.6	P583	P583-S585 PolarHBondContact O-N 3.35Å; P583-S585 VanDerWaalsContact O-N 3.14Å
586	K	49.9	Very low	58.4	Low	195 Å²	195	118.1 Å²	118.1	85%	0.848	68%	0.677	S	S	*	*	T	Hydrogen-bonded Turn	trans	-126.9	-23.2	-177.9	-156.6	169.8	-177.2	-178.6	0	115.2	S584	S584-K586 PolarHBondContact O-N 3.16Å
587	E	48	Very low	60.6	Low	181 Å²	181	117 Å²	117	85%	0.846	66%	0.656	S	S	*	*	S	Bend	trans	-120.5	98.8	168.5	-163.8	57	-98.2	0	0	109.2
588	G	45.6	Very low	62.5	Low	62 Å²	62	116.1 Å²	116.1	64%	0.639	65%	0.647	S	S	*	*			trans	-161.3	26.2	-155.3	0	0	0	0	0	115.3	R590	G588-R590 PolarHBondContact O-N 2.76Å
589	R	51.7	Low	64.1	Low	193 Å²	193	115.2 Å²	115.2	73%	0.728	63%	0.629	S	S	*	*			trans	-74.8	70.6	170.6	-77.4	-119.1	-86.3	-90.2	-8.4	111.1	S591	R589-S591 PolarHBondContact O-N 2.95Å; R589-S591 PolarHBondContact O-OG 3.24Å
590	R	57	Low	66.2	Low	229 Å²	229	117.1 Å²	117.1	86%	0.864	63%	0.629	S	S	*	*			trans	-44.8	115.6	158	-87	-172.9	170	-176.3	-3.4	107	G588	G588-R590 PolarHBondContact O-N 2.76Å
591	S	72.8	Confident	67.5	Low	56 Å²	56	112.8 Å²	112.8	39%	0.392	60%	0.596	S	S	.	*			trans	-103.5	108	-174.3	-63.2	0	0	0	0	107.9	R589 T593 F601	R589-S591 PolarHBondContact O-N 2.95Å; R589-S591 PolarHBondContact O-OG 3.24Å; S591-T593 PolarHBondContact O-N 3.35Å; S591-T593 VanDerWaalsContact O-N 3.13Å; S591-T593 PolarHBondContact O-OG1 3.36Å; S591-F601 CarbonylContact C-O 3.53Å; S591-F601 VanDerWaalsContact C-O 3.3Å; S591-F601 VanDerWaalsContact CA-O 3.26Å; S591-F601 WeakPolarHBondContact CA-O 3.37Å
592	D	81.1	Confident	69.6	Low	50 Å²	50	117 Å²	117	27%	0.267	60%	0.596	S	S	.	*	E	Extended strand (participates in β ladder)	trans	-65.3	109.8	-169.3	-57.6	-85.1	0	0	0	110.5	F601 N603 C604 L607	D592-F601 PolarHBondContact N-O 3.19Å; D592-F601 WeakPolarHBondContact O-CB 3.47Å; D592-F601 PolarHBondContact O-N 3.12Å; D592-N603 WeakPolarHBondContact OD2-CA 3.42Å; D592-C604 HydrophobicContact CB-CB 4.35Å; D592-C604 VanDerWaalsContact CG-CA 3.43Å; D592-C604 VanDerWaalsContact CG-N 3.3Å; D592-C604 WeakPolarHBondContact OD1-CB 3.47Å; D592-C604 WeakPolarHBondContact OD2-CA 3.45Å; D592-C604 PolarHBondContact OD2-N 3.33Å; D592-L607 HydrophobicContact CB-CB 3.84Å; D592-L607 HydrophobicContact CB-CD2 3.72Å; D592-L607 HydrophobicContact CB-CG 4.4Å
593	T	84.9	Confident	71.2	Confident	66 Å²	66	109.5 Å²	109.5	41%	0.405	57%	0.574	S	S	.	*	E	Extended strand (participates in β ladder)	trans	-101.1	142	-170.5	-58.4	0	0	0	0	111	S591 K599 V600 L607	S591-T593 PolarHBondContact O-N 3.35Å; S591-T593 VanDerWaalsContact O-N 3.13Å; S591-T593 PolarHBondContact O-OG1 3.36Å; T593-K599 WeakPolarHBondContact CA-O 3.43Å; T593-V600 HydrophobicContact CG2-CG2 4.06Å; T593-L607 WeakPolarHBondContact O-CD2 3.43Å
594	C	89.1	Confident	72.9	Confident	1 Å²	1	107 Å²	107	1%	0.007	56%	0.558	C	S	.	*			trans	-86.5	121.4	-178.1	-167.3	0	0	0	0	112.8	Y596 C597 G598 K599 F601 L607 H614	C594-Y596 VanDerWaalsContact C-N 3.27Å; C594-Y596 PolarHBondContact O-N 3.18Å; C594-C597 PolarHBondContact O-N 2.96Å; C594-G598 WeakPolarHBondContact O-CA 3.26Å; C594-G598 PolarHBondContact O-N 3.12Å; C594-K599 PolarHBondContact N-O 2.92Å; C594-F601 HydrophobicContact CB-CE2 4.44Å; C594-L607 VanDerWaalsContact CA-CD1 3.47Å; C594-L607 HydrophobicContact CB-CD1 3.46Å; C594-L607 VanDerWaalsContact CB-CD1 3.46Å; C594-H614 VanDerWaalsContact SG-CD2 3.58Å
595	E	86.1	Confident	74.8	Confident	155 Å²	155	105.8 Å²	105.8	72%	0.724	55%	0.55	S	S	*	.	T	Hydrogen-bonded Turn	trans	-55.8	-40.6	178.3	-61.1	114.8	179.9	0	0	112.5	C597	E595-C597 VanDerWaalsContact C-N 3.34Å; E595-C597 PolarHBondContact O-N 3.34Å
596	Y	83.6	Confident	76.6	Confident	145 Å²	145	103.6 Å²	103.6	57%	0.569	53%	0.528	S	S	*	.	T	Hydrogen-bonded Turn	trans	-72.7	-16.8	-175	-62.8	-84.1	0	0	0	115.3	C594 R611 H614	C594-Y596 VanDerWaalsContact C-N 3.27Å; C594-Y596 PolarHBondContact O-N 3.18Å; Y596-R611 HydrophobicContact CD2-CG 4.44Å; Y596-R611 HydrophobicContact CE2-CG 4.09Å; Y596-H614 HydrophobicContact CD1-CB 4.34Å; Y596-H614 HydrophobicContact CD2-CB 4.08Å; Y596-H614 HydrophobicContact CG-CB 3.94Å; Y596-H614 AromaticContact CG-CG 3.86Å
597	C	86.8	Confident	78.4	Confident	52 Å²	52	95 Å²	95	35%	0.351	49%	0.491	S	S	.	.	T	Hydrogen-bonded Turn	trans	-159.1	16.4	-176.8	73.4	0	0	0	0	116.3	C594 E595 K599 H610 H614	C594-C597 PolarHBondContact O-N 2.96Å; E595-C597 VanDerWaalsContact C-N 3.34Å; E595-C597 PolarHBondContact O-N 3.34Å; C597-K599 PolarHBondContact O-N 3.14Å; C597-K599 VanDerWaalsContact SG-CG 3.57Å; C597-H610 PolarHBondContact SG-NE2 3.48Å; C597-H614 PolarHBondContact SG-NE2 3.43Å; C597-H614 VanDerWaalsContact SG-NE2 3.37Å
598	G	84.9	Confident	80.2	Confident	49 Å²	49	89 Å²	89	51%	0.505	47%	0.467	S	S	.	.			trans	64.1	6.3	177	0	0	0	0	0	116.4	C594 V600	C594-G598 WeakPolarHBondContact O-CA 3.26Å; C594-G598 PolarHBondContact O-N 3.12Å; G598-V600 PolarHBondContact O-N 3.23Å
599	K	85.7	Confident	82	Confident	123 Å²	123	88.2 Å²	88.2	54%	0.535	45%	0.449	S	S	.	.			trans	-71.5	120.9	-176	-75.5	177.6	-172.6	174.2	0	110.5	T593 C594 C597 F601	T593-K599 WeakPolarHBondContact CA-O 3.43Å; C594-K599 PolarHBondContact N-O 2.92Å; C597-K599 PolarHBondContact O-N 3.14Å; C597-K599 VanDerWaalsContact SG-CG 3.57Å; K599-F601 HydrophobicContact CB-CE2 3.61Å; K599-F601 HydrophobicContact CB-CZ 4.01Å; K599-F601 VanDerWaalsContact O-CD2 3.23Å; K599-F601 WeakPolarHBondContact O-CD2 3.43Å; K599-F601 VanDerWaalsContact O-CE2 3.26Å; K599-F601 WeakPolarHBondContact O-CE2 3.34Å
600	V	88.3	Confident	83.7	Confident	96 Å²	96	80.2 Å²	80.2	58%	0.582	42%	0.42	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-89.5	120.5	-176.4	-177.2	0	0	0	0	110.3	T593 G598	T593-V600 HydrophobicContact CG2-CG2 4.06Å; G598-V600 PolarHBondContact O-N 3.23Å
601	F	87.1	Confident	85.1	Confident	48 Å²	48	73.2 Å²	73.2	21%	0.211	39%	0.394	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-108.3	147.3	179.4	-65.5	-91	0	0	0	112.1	S591 D592 C594 K599 N603 N606 L607 H610	S591-F601 CarbonylContact C-O 3.53Å; S591-F601 VanDerWaalsContact C-O 3.3Å; S591-F601 VanDerWaalsContact CA-O 3.26Å; S591-F601 WeakPolarHBondContact CA-O 3.37Å; D592-F601 PolarHBondContact N-O 3.19Å; D592-F601 WeakPolarHBondContact O-CB 3.47Å; D592-F601 PolarHBondContact O-N 3.12Å; C594-F601 HydrophobicContact CB-CE2 4.44Å; K599-F601 HydrophobicContact CB-CE2 3.61Å; K599-F601 HydrophobicContact CB-CZ 4.01Å; K599-F601 VanDerWaalsContact O-CD2 3.23Å; K599-F601 WeakPolarHBondContact O-CD2 3.43Å; K599-F601 VanDerWaalsContact O-CE2 3.26Å; K599-F601 WeakPolarHBondContact O-CE2 3.34Å; F601-N603 PolarHBondContact O-N 3.25Å; F601-N606 HydrophobicContact CB-CB 4.19Å; F601-N606 HydrophobicContact CD1-CB 3.81Å; F601-N606 HydrophobicContact CG-CB 4.29Å; F601-L607 HydrophobicContact CB-CB 4.28Å; F601-L607 HydrophobicContact CD2-CB 4.07Å; F601-L607 HydrophobicContact CD2-CD1 4.05Å; F601-L607 HydrophobicContact CE2-CD1 4.33Å; F601-L607 HydrophobicContact CG-CB 4.32Å; F601-H610 HydrophobicContact CE1-CB 4.04Å; F601-H610 HydrophobicContact CE2-CB 3.95Å; F601-H610 AromaticContact CE2-CD2 3.2Å; F601-H610 WeakPolarHBondContact CE2-CD2 3.22Å; F601-H610 AromaticContact CE2-CG 3.71Å; F601-H610 HydrophobicContact CZ-CB 3.52Å; F601-H610 AromaticContact CZ-CD2 3.32Å; F601-H610 WeakPolarHBondContact CZ-CD2 3.37Å; F601-H610 AromaticContact CZ-CG 3.35Å
602	K	85.6	Confident	85.7	Confident	158 Å²	158	73.8 Å²	73.8	69%	0.687	39%	0.387	S	S	*	.	S	Bend	trans	-71.3	-9.4	177.6	-61.6	177.1	-179.1	176.5	0	113.7
603	N	84.5	Confident	85.8	Confident	84 Å²	84	75.2 Å²	75.2	45%	0.449	40%	0.401	S	S	.	.	S	Bend	trans	-158.6	142	-175.9	-48.9	94.5	0	0	0	112.2	D592 F601 S605 N606 L607	D592-N603 WeakPolarHBondContact OD2-CA 3.42Å; F601-N603 PolarHBondContact O-N 3.25Å; N603-S605 VanDerWaalsContact C-N 3.25Å; N603-S605 PolarHBondContact O-N 3.27Å; N603-N606 WeakPolarHBondContact O-CB 3.09Å; N603-N606 PolarHBondContact O-N 2.86Å; N603-N606 PolarHBondContact OD1-ND2 3.38Å; N603-L607 PolarHBondContact O-N 2.74Å; N603-L607 VanDerWaalsContact O-N 3.16Å
604	C	84.7	Confident	85.8	Confident	71 Å²	71	75.5 Å²	75.5	48%	0.48	40%	0.398	S	S	.	.	H	α-helix	trans	-60.2	-29.4	178.8	61.1	0	0	0	0	114	D592 N606 L607 T608	D592-C604 HydrophobicContact CB-CB 4.35Å; D592-C604 VanDerWaalsContact CG-CA 3.43Å; D592-C604 VanDerWaalsContact CG-N 3.3Å; D592-C604 WeakPolarHBondContact OD1-CB 3.47Å; D592-C604 WeakPolarHBondContact OD2-CA 3.45Å; D592-C604 PolarHBondContact OD2-N 3.33Å; C604-N606 VanDerWaalsContact C-N 3.34Å; C604-L607 PolarHBondContact O-N 3.24Å; C604-T608 VanDerWaalsContact O-CB 3.3Å; C604-T608 WeakPolarHBondContact O-CB 3.15Å; C604-T608 PolarHBondContact O-N 3.46Å; C604-T608 PolarHBondContact O-OG1 3.01Å
605	S	84.9	Confident	85.4	Confident	81 Å²	81	78.6 Å²	78.6	57%	0.566	42%	0.417	S	S	*	.	H	α-helix	trans	-64	-38.8	173.1	-44.5	0	0	0	0	112.1	N603 V609	N603-S605 VanDerWaalsContact C-N 3.25Å; N603-S605 PolarHBondContact O-N 3.27Å; S605-V609 WeakPolarHBondContact O-CG2 3.3Å; S605-V609 PolarHBondContact O-N 3.16Å; S605-V609 VanDerWaalsContact O-N 3.1Å
606	N	85.9	Confident	85.1	Confident	81 Å²	81	73.7 Å²	73.7	43%	0.433	41%	0.408	S	S	.	.	H	α-helix	trans	-73.1	-41.2	177.8	-67.8	-39.2	0	0	0	110.6	F601 N603 C604 V609 H610	F601-N606 HydrophobicContact CB-CB 4.19Å; F601-N606 HydrophobicContact CD1-CB 3.81Å; F601-N606 HydrophobicContact CG-CB 4.29Å; N603-N606 WeakPolarHBondContact O-CB 3.09Å; N603-N606 PolarHBondContact O-N 2.86Å; N603-N606 PolarHBondContact OD1-ND2 3.38Å; C604-N606 VanDerWaalsContact C-N 3.34Å; N606-V609 PolarHBondContact O-N 2.83Å; N606-H610 WeakPolarHBondContact O-CB 3.42Å; N606-H610 PolarHBondContact O-N 3.33Å
607	L	87.6	Confident	85	Confident	15 Å²	15	71.8 Å²	71.8	8%	0.079	40%	0.404	C	S	.	.	H	α-helix	trans	-57.9	-48.3	170.6	171.3	60.8	0	0	0	111.5	D592 T593 C594 F601 N603 C604 V609 H610 R611	D592-L607 HydrophobicContact CB-CB 3.84Å; D592-L607 HydrophobicContact CB-CD2 3.72Å; D592-L607 HydrophobicContact CB-CG 4.4Å; T593-L607 WeakPolarHBondContact O-CD2 3.43Å; C594-L607 VanDerWaalsContact CA-CD1 3.47Å; C594-L607 HydrophobicContact CB-CD1 3.46Å; C594-L607 VanDerWaalsContact CB-CD1 3.46Å; F601-L607 HydrophobicContact CB-CB 4.28Å; F601-L607 HydrophobicContact CD2-CB 4.07Å; F601-L607 HydrophobicContact CD2-CD1 4.05Å; F601-L607 HydrophobicContact CE2-CD1 4.33Å; F601-L607 HydrophobicContact CG-CB 4.32Å; N603-L607 PolarHBondContact O-N 2.74Å; N603-L607 VanDerWaalsContact O-N 3.16Å; C604-L607 PolarHBondContact O-N 3.24Å; L607-V609 VanDerWaalsContact C-N 3.32Å; L607-V609 PolarHBondContact O-N 2.84Å; L607-H610 CarbonylContact O-C 3.48Å; L607-H610 WeakPolarHBondContact O-CA 3.4Å; L607-H610 WeakPolarHBondContact O-CB 3.44Å; L607-H610 PolarHBondContact O-N 3.44Å; L607-R611 PolarHBondContact O-N 2.91Å
608	T	85.7	Confident	84.9	Confident	55 Å²	55	75.4 Å²	75.4	34%	0.337	41%	0.41	S	S	.	.	H	α-helix	trans	-63	-39.3	-177	-64.3	0	0	0	0	111.9	C604 R611	C604-T608 VanDerWaalsContact O-CB 3.3Å; C604-T608 WeakPolarHBondContact O-CB 3.15Å; C604-T608 PolarHBondContact O-N 3.46Å; C604-T608 PolarHBondContact O-OG1 3.01Å; T608-R611 PolarHBondContact O-N 3.14Å; T608-R611 PolarHBondContact OG1-NH2 2.71Å
609	V	84.2	Confident	84.9	Confident	44 Å²	44	77.1 Å²	77.1	27%	0.267	41%	0.413	S	S	.	.	H	α-helix	trans	-69.7	-34.2	173.3	169.4	0	0	0	0	112	S605 N606 L607 Q631	S605-V609 WeakPolarHBondContact O-CG2 3.3Å; S605-V609 PolarHBondContact O-N 3.16Å; S605-V609 VanDerWaalsContact O-N 3.1Å; N606-V609 PolarHBondContact O-N 2.83Å; L607-V609 VanDerWaalsContact C-N 3.32Å; L607-V609 PolarHBondContact O-N 2.84Å; V609-Q631 HydrophobicContact CG1-CG 3.36Å
610	H	87.5	Confident	84.9	Confident	26 Å²	26	75.2 Å²	75.2	12%	0.12	40%	0.403	C	S	.	.	H	α-helix	trans	-70.4	-34.8	173	171	51.2	0	0	0	112.9	C597 F601 N606 L607 R612 S613 H614	C597-H610 PolarHBondContact SG-NE2 3.48Å; F601-H610 HydrophobicContact CE1-CB 4.04Å; F601-H610 HydrophobicContact CE2-CB 3.95Å; F601-H610 AromaticContact CE2-CD2 3.2Å; F601-H610 WeakPolarHBondContact CE2-CD2 3.22Å; F601-H610 AromaticContact CE2-CG 3.71Å; F601-H610 HydrophobicContact CZ-CB 3.52Å; F601-H610 AromaticContact CZ-CD2 3.32Å; F601-H610 WeakPolarHBondContact CZ-CD2 3.37Å; F601-H610 AromaticContact CZ-CG 3.35Å; N606-H610 WeakPolarHBondContact O-CB 3.42Å; N606-H610 PolarHBondContact O-N 3.33Å; L607-H610 CarbonylContact O-C 3.48Å; L607-H610 WeakPolarHBondContact O-CA 3.4Å; L607-H610 WeakPolarHBondContact O-CB 3.44Å; L607-H610 PolarHBondContact O-N 3.44Å; H610-R612 PolarHBondContact O-N 2.89Å; H610-S613 PolarHBondContact CE1-OG 3.47Å; H610-S613 PolarHBondContact ND1-OG 3.43Å; H610-S613 WeakPolarHBondContact O-CA 3.41Å; H610-S613 WeakPolarHBondContact O-CB 3.32Å; H610-S613 PolarHBondContact O-N 3.15Å; H610-S613 PolarHBondContact O-OG 3.25Å; H610-H614 AromaticContact CE1-CD2 3.86Å; H610-H614 AromaticContact CE1-NE2 3.23Å; H610-H614 PolarHBondContact CE1-NE2 3.33Å; H610-H614 AromaticContact NE2-CD2 3.79Å; H610-H614 AromaticContact NE2-NE2 3.09Å; H610-H614 PolarHBondContact NE2-NE2 3.38Å
611	R	86.5	Confident	84.8	Confident	81 Å²	81	77.8 Å²	77.8	31%	0.306	41%	0.406	S	S	.	.	H	α-helix	trans	-58.4	-31.3	176.5	-171.9	164.2	55.7	-111.9	-5.5	112	Y596 L607 T608 S613 H614 T615	Y596-R611 HydrophobicContact CD2-CG 4.44Å; Y596-R611 HydrophobicContact CE2-CG 4.09Å; L607-R611 PolarHBondContact O-N 2.91Å; T608-R611 PolarHBondContact O-N 3.14Å; T608-R611 PolarHBondContact OG1-NH2 2.71Å; R611-S613 PolarHBondContact O-N 2.95Å; R611-H614 WeakPolarHBondContact O-CB 3.38Å; R611-H614 PolarHBondContact O-N 3.08Å; R611-T615 PolarHBondContact O-N 2.77Å; R611-T615 VanDerWaalsContact O-N 3.13Å
612	R	85.7	Confident	84.8	Confident	68 Å²	68	75.9 Å²	75.9	26%	0.257	40%	0.399	S	S	.	.	H	α-helix	trans	-62.3	-22.5	170.7	-62.2	179.6	-176.3	161.6	0.7	114.9	H610 H614 T615 G616 E617 A630	H610-R612 PolarHBondContact O-N 2.89Å; R612-H614 VanDerWaalsContact C-N 3.27Å; R612-T615 WeakPolarHBondContact CA-OG1 3.48Å; R612-T615 PolarHBondContact O-OG1 2.88Å; R612-G616 PolarHBondContact O-N 2.86Å; R612-E617 PolarHBondContact O-N 3.06Å; R612-A630 HydrophobicContact CB-CB 3.81Å; R612-A630 PolarHBondContact NH1-O 3.22Å
613	S	82.6	Confident	84.6	Confident	80 Å²	80	77 Å²	77	56%	0.559	41%	0.406	S	S	*	.	H	α-helix	trans	-78.8	-10	172.4	63.6	0	0	0	0	113.7	H610 R611	H610-S613 PolarHBondContact CE1-OG 3.47Å; H610-S613 PolarHBondContact ND1-OG 3.43Å; H610-S613 WeakPolarHBondContact O-CA 3.41Å; H610-S613 WeakPolarHBondContact O-CB 3.32Å; H610-S613 PolarHBondContact O-N 3.15Å; H610-S613 PolarHBondContact O-OG 3.25Å; R611-S613 PolarHBondContact O-N 2.95Å
614	H	84.3	Confident	84.4	Confident	72 Å²	72	78.1 Å²	78.1	33%	0.333	41%	0.412	S	S	.	.	H	α-helix	trans	-96.5	-39.2	169.5	-64.1	-70.2	0	0	0	112	C594 Y596 C597 H610 R611 R612 G616	C594-H614 VanDerWaalsContact SG-CD2 3.58Å; Y596-H614 HydrophobicContact CD1-CB 4.34Å; Y596-H614 HydrophobicContact CD2-CB 4.08Å; Y596-H614 HydrophobicContact CG-CB 3.94Å; Y596-H614 AromaticContact CG-CG 3.86Å; C597-H614 PolarHBondContact SG-NE2 3.43Å; C597-H614 VanDerWaalsContact SG-NE2 3.37Å; H610-H614 AromaticContact CE1-CD2 3.86Å; H610-H614 AromaticContact CE1-NE2 3.23Å; H610-H614 PolarHBondContact CE1-NE2 3.33Å; H610-H614 AromaticContact NE2-CD2 3.79Å; H610-H614 AromaticContact NE2-NE2 3.09Å; H610-H614 PolarHBondContact NE2-NE2 3.38Å; R611-H614 WeakPolarHBondContact O-CB 3.38Å; R611-H614 PolarHBondContact O-N 3.08Å; R612-H614 VanDerWaalsContact C-N 3.27Å; H614-G616 PolarHBondContact O-N 2.95Å
615	T	82.1	Confident	84.2	Confident	67 Å²	67	75.6 Å²	75.6	41%	0.411	40%	0.395	S	S	.	.	H	α-helix	trans	-72.8	-12	175.2	60.7	0	0	0	0	113.6	R611 R612 E617	R611-T615 PolarHBondContact O-N 2.77Å; R611-T615 VanDerWaalsContact O-N 3.13Å; R612-T615 WeakPolarHBondContact CA-OG1 3.48Å; R612-T615 PolarHBondContact O-OG1 2.88Å; T615-E617 PolarHBondContact O-N 3.3Å; T615-E617 VanDerWaalsContact OG1-CD 3.32Å; T615-E617 VanDerWaalsContact OG1-CG 3.32Å; T615-E617 WeakPolarHBondContact OG1-CG 3.35Å; T615-E617 PolarHBondContact OG1-OE2 3.41Å
616	G	79.8	Confident	84	Confident	51 Å²	51	78.1 Å²	78.1	53%	0.526	40%	0.402	S	S	.	.			trans	71.9	-0.4	-176.3	0	0	0	0	0	114.4	R612 H614 R618	R612-G616 PolarHBondContact O-N 2.86Å; H614-G616 PolarHBondContact O-N 2.95Å; G616-R618 WeakPolarHBondContact O-CG 3.34Å; G616-R618 PolarHBondContact O-N 3.38Å
617	E	81.1	Confident	83.8	Confident	105 Å²	105	78.3 Å²	78.3	49%	0.491	40%	0.397	S	S	.	.			trans	-63.5	122.6	-176.2	-68.8	169.9	131	0	0	111.7	R612 T615 P619 A630	R612-E617 PolarHBondContact O-N 3.06Å; T615-E617 PolarHBondContact O-N 3.3Å; T615-E617 VanDerWaalsContact OG1-CD 3.32Å; T615-E617 VanDerWaalsContact OG1-CG 3.32Å; T615-E617 WeakPolarHBondContact OG1-CG 3.35Å; T615-E617 PolarHBondContact OG1-OE2 3.41Å; E617-P619 WeakPolarHBondContact O-CD 3.42Å; E617-A630 WeakPolarHBondContact O-CB 3.3Å
618	R	85.1	Confident	83.8	Confident	129 Å²	129	78.7 Å²	78.7	49%	0.487	40%	0.402	S	S	.	.			trans	-123.7	67.9	180	-67.7	164.1	80	167.3	0.5	110.9	G616 Y620 A628 C629	G616-R618 WeakPolarHBondContact O-CG 3.34Å; G616-R618 PolarHBondContact O-N 3.38Å; R618-Y620 PolarHBondContact O-N 3.3Å; R618-Y620 VanDerWaalsContact O-N 3.14Å; R618-A628 HydrophobicContact CB-CB 3.68Å; R618-A628 PolarHBondContact NE-O 3.38Å; R618-A628 PolarHBondContact NH2-O 3.2Å; R618-C629 CarbonylContact C-O 3.49Å; R618-C629 VanDerWaalsContact C-O 3.22Å; R618-C629 WeakPolarHBondContact CA-O 3.45Å
619	P	83.6	Confident	83.8	Confident	85 Å²	85	76.3 Å²	76.3	55%	0.552	39%	0.388	S	S	*	.			trans	-65.7	-19.3	-171.4	-21.1	34.5	0	0	0	114.8	E617 K621	E617-P619 WeakPolarHBondContact O-CD 3.42Å; P619-K621 PolarHBondContact O-N 3.27Å
620	Y	85.1	Confident	83.9	Confident	82 Å²	82	75.2 Å²	75.2	32%	0.322	38%	0.383	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-97.3	84.2	-177.6	-56.9	-77.3	0	0	0	109.8	R618 A628 C629 Q631	R618-Y620 PolarHBondContact O-N 3.3Å; R618-Y620 VanDerWaalsContact O-N 3.14Å; Y620-A628 CarbonylContact O-C 3.44Å; Y620-A628 WeakPolarHBondContact O-CA 3.33Å; Y620-C629 WeakPolarHBondContact CB-O 3.48Å; Y620-C629 WeakPolarHBondContact CD2-O 3.29Å; Y620-C629 PolarHBondContact N-O 3.19Å; Y620-C629 PolarHBondContact O-N 3.41Å; Y620-Q631 VanDerWaalsContact CD2-C 3.44Å
621	K	86.5	Confident	83.8	Confident	150 Å²	150	76.9 Å²	76.9	65%	0.652	39%	0.391	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-75.1	147.6	170	62.8	176.6	-177.6	171.8	0	111.6	P619 A628 L635	P619-K621 PolarHBondContact O-N 3.27Å; K621-A628 HydrophobicContact CB-CB 4.45Å; K621-L635 WeakPolarHBondContact O-CD1 3.22Å; K621-L635 WeakPolarHBondContact O-CD2 3.43Å
622	C	87.4	Confident	83.8	Confident	9 Å²	9	76 Å²	76	6%	0.061	40%	0.397	C	S	.	.			trans	-77.5	150.6	161.7	-179.8	0	0	0	0	109.5	L624 C625 Y627 L635 M639 H642	C622-L624 PolarHBondContact SG-N 3.19Å; C622-C625 WeakPolarHBondContact CB-O 3.44Å; C622-C625 PolarHBondContact SG-N 3.31Å; C622-C625 VanDerWaalsContact SG-N 3.37Å; C622-Y627 WeakPolarHBondContact CB-O 3.47Å; C622-Y627 PolarHBondContact N-O 3.2Å; C622-L635 HydrophobicContact CB-CD1 4.07Å; C622-M639 HydrophobicContact CB-CE 3.78Å; C622-M639 WeakPolarHBondContact SG-CE 3.49Å; C622-H642 PolarHBondContact SG-NE2 2.92Å
623	E	82.1	Confident	83.9	Confident	180 Å²	180	76.1 Å²	76.1	84%	0.841	41%	0.409	S	S	*	.	S	Bend	trans	-95.5	-19.2	176.6	-71.2	157.5	-173.5	0	0	111.8
624	L	80	Confident	84	Confident	109 Å²	109	77.3 Å²	77.3	57%	0.571	40%	0.404	S	S	*	.	S	Bend	trans	-94.7	-19.1	178.4	-60.4	172.8	0	0	0	113.2	C622 H642 P658	C622-L624 PolarHBondContact SG-N 3.19Å; L624-H642 HydrophobicContact CD1-CB 3.55Å; L624-P658 WeakPolarHBondContact O-CG 3.29Å
625	C	81	Confident	84.2	Confident	18 Å²	18	75.3 Å²	75.3	12%	0.122	40%	0.396	C	S	.	.	S	Bend	trans	-154.9	170.4	179.2	83.3	0	0	0	0	113.3	C622 Y627 H638 P658	C622-C625 WeakPolarHBondContact CB-O 3.44Å; C622-C625 PolarHBondContact SG-N 3.31Å; C622-C625 VanDerWaalsContact SG-N 3.37Å; C625-Y627 PolarHBondContact O-N 3.15Å; C625-Y627 WeakPolarHBondContact SG-CB 3.48Å; C625-Y627 PolarHBondContact SG-N 3.16Å; C625-Y627 VanDerWaalsContact SG-N 3.39Å; C625-H638 PolarHBondContact SG-NE2 2.98Å; C625-P658 HydrophobicContact CB-CG 3.33Å
626	N	79.3	Confident	84.3	Confident	134 Å²	134	76 Å²	76	72%	0.717	40%	0.4	S	S	*	.	S	Bend	trans	-72.7	12.8	-179.4	-63.8	-59.6	0	0	0	115.3	A628 M657	N626-A628 PolarHBondContact O-N 3.2Å; N626-M657 HydrophobicContact CB-SD 3.72Å; N626-M657 PolarHBondContact ND2-SD 2.95Å
627	Y	82.9	Confident	84.6	Confident	85 Å²	85	82.8 Å²	82.8	33%	0.333	41%	0.409	S	S	.	.			trans	-74.4	107.3	176.1	-177.1	-90.7	0	0	0	111.6	C622 C625 C629 H638	C622-Y627 WeakPolarHBondContact CB-O 3.47Å; C622-Y627 PolarHBondContact N-O 3.2Å; C625-Y627 PolarHBondContact O-N 3.15Å; C625-Y627 WeakPolarHBondContact SG-CB 3.48Å; C625-Y627 PolarHBondContact SG-N 3.16Å; C625-Y627 VanDerWaalsContact SG-N 3.39Å; Y627-C629 HydrophobicContact CE1-CB 3.7Å; Y627-H638 WeakPolarHBondContact CB-NE2 3.14Å; Y627-H638 HydrophobicContact CD1-CB 4.2Å; Y627-H638 AromaticContact CD1-CD2 3.28Å; Y627-H638 WeakPolarHBondContact CD1-CD2 3.49Å; Y627-H638 AromaticContact CD1-CG 3.77Å; Y627-H638 AromaticContact CD1-NE2 3.98Å; Y627-H638 HydrophobicContact CE1-CB 4.09Å; Y627-H638 AromaticContact CG-CD2 3.67Å; Y627-H638 AromaticContact CG-NE2 3.9Å
628	A	86.5	Confident	84.8	Confident	22 Å²	22	79.2 Å²	79.2	18%	0.182	39%	0.393	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-102.3	153.5	166.8	0	0	0	0	0	112.1	R618 Y620 K621 N626	R618-A628 HydrophobicContact CB-CB 3.68Å; R618-A628 PolarHBondContact NE-O 3.38Å; R618-A628 PolarHBondContact NH2-O 3.2Å; Y620-A628 CarbonylContact O-C 3.44Å; Y620-A628 WeakPolarHBondContact O-CA 3.33Å; K621-A628 HydrophobicContact CB-CB 4.45Å; N626-A628 PolarHBondContact O-N 3.2Å
629	C	85.6	Confident	84.6	Confident	5 Å²	5	75.9 Å²	75.9	3%	0.034	38%	0.383	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-150.9	165	174.7	66.4	0	0	0	0	114.3	R618 Y620 Y627 Q631 K634 L635	R618-C629 CarbonylContact C-O 3.49Å; R618-C629 VanDerWaalsContact C-O 3.22Å; R618-C629 WeakPolarHBondContact CA-O 3.45Å; Y620-C629 WeakPolarHBondContact CB-O 3.48Å; Y620-C629 WeakPolarHBondContact CD2-O 3.29Å; Y620-C629 PolarHBondContact N-O 3.19Å; Y620-C629 PolarHBondContact O-N 3.41Å; Y627-C629 HydrophobicContact CE1-CB 3.7Å; C629-Q631 PolarHBondContact SG-O 3.15Å; C629-K634 HydrophobicContact CB-CB 4.23Å; C629-L635 PolarHBondContact SG-N 2.83Å; C629-L635 VanDerWaalsContact SG-N 3.41Å
630	A	86.4	Confident	84.5	Confident	21 Å²	21	79.2 Å²	79.2	17%	0.174	39%	0.389	C	S	.	.	S	Bend	trans	-84.3	-4.7	-178	0	0	0	0	0	114.9	R612 E617	R612-A630 HydrophobicContact CB-CB 3.81Å; R612-A630 PolarHBondContact NH1-O 3.22Å; E617-A630 WeakPolarHBondContact O-CB 3.3Å
631	Q	85.9	Confident	83.9	Confident	61 Å²	61	78.2 Å²	78.2	29%	0.285	39%	0.392	S	S	.	.			trans	-136.7	126.7	-174.1	-70.1	177	-72.9	0	0	112	V609 Y620 C629 S633 K634 L635	V609-Q631 HydrophobicContact CG1-CG 3.36Å; Y620-Q631 VanDerWaalsContact CD2-C 3.44Å; C629-Q631 PolarHBondContact SG-O 3.15Å; Q631-S633 PolarHBondContact O-N 3.01Å; Q631-K634 HydrophobicContact CB-CB 4.3Å; Q631-K634 HydrophobicContact CB-CD 4.43Å; Q631-K634 HydrophobicContact CB-CG 4.22Å; Q631-K634 PolarHBondContact O-N 3.46Å; Q631-L635 PolarHBondContact O-N 3.45Å
632	S	87.7	Confident	83.2	Confident	62 Å²	62	72.3 Å²	72.3	43%	0.434	37%	0.366	S	S	.	.	H	α-helix	trans	-56.4	-33.6	173.4	53	0	0	0	0	113.4	K634 L635 T636	S632-K634 VanDerWaalsContact C-N 3.32Å; S632-K634 PolarHBondContact O-N 3.29Å; S632-L635 PolarHBondContact O-N 3.32Å; S632-T636 PolarHBondContact O-N 3.11Å; S632-T636 PolarHBondContact O-OG1 3.46Å; S632-T636 VanDerWaalsContact O-OG1 3.05Å
633	S	86.8	Confident	81.8	Confident	71 Å²	71	75.1 Å²	75.1	50%	0.497	40%	0.396	S	S	.	.	H	α-helix	trans	-66.2	-30.3	176.4	55.6	0	0	0	0	113.7	Q631 R637	Q631-S633 PolarHBondContact O-N 3.01Å; S633-R637 PolarHBondContact O-N 3.34Å; S633-R637 VanDerWaalsContact O-N 3.14Å
634	K	85.8	Confident	80.5	Confident	105 Å²	105	74.5 Å²	74.5	46%	0.457	39%	0.394	S	S	.	.	H	α-helix	trans	-73.3	-41.3	171.2	-73.7	-177	173.7	172.6	0	110.7	C629 Q631 S632 R637 H638	C629-K634 HydrophobicContact CB-CB 4.23Å; Q631-K634 HydrophobicContact CB-CB 4.3Å; Q631-K634 HydrophobicContact CB-CD 4.43Å; Q631-K634 HydrophobicContact CB-CG 4.22Å; Q631-K634 PolarHBondContact O-N 3.46Å; S632-K634 VanDerWaalsContact C-N 3.32Å; S632-K634 PolarHBondContact O-N 3.29Å; K634-R637 PolarHBondContact O-N 3.14Å; K634-H638 WeakPolarHBondContact O-CB 3.4Å; K634-H638 PolarHBondContact O-N 2.99Å
635	L	86.9	Confident	79.2	Confident	31 Å²	31	71.3 Å²	71.3	16%	0.162	38%	0.377	C	S	.	.	H	α-helix	trans	-59.6	-50.4	172.9	-173.5	68.4	0	0	0	111	K621 C622 C629 Q631 S632 R637 H638 M639	K621-L635 WeakPolarHBondContact O-CD1 3.22Å; K621-L635 WeakPolarHBondContact O-CD2 3.43Å; C622-L635 HydrophobicContact CB-CD1 4.07Å; C629-L635 PolarHBondContact SG-N 2.83Å; C629-L635 VanDerWaalsContact SG-N 3.41Å; Q631-L635 PolarHBondContact O-N 3.45Å; S632-L635 PolarHBondContact O-N 3.32Å; L635-R637 VanDerWaalsContact C-N 3.32Å; L635-R637 PolarHBondContact O-N 3.18Å; L635-H638 CarbonylContact O-C 3.02Å; L635-H638 WeakPolarHBondContact O-CA 3.48Å; L635-H638 WeakPolarHBondContact O-CB 3.36Å; L635-H638 PolarHBondContact O-N 2.86Å; L635-M639 HydrophobicContact CD1-CE 3.46Å; L635-M639 VanDerWaalsContact CD1-CE 3.46Å; L635-M639 HydrophobicContact CD1-SD 4.28Å; L635-M639 HydrophobicContact CG-CE 4.04Å; L635-M639 HydrophobicContact CG-CG 4.37Å; L635-M639 HydrophobicContact CG-SD 4.43Å; L635-M639 WeakPolarHBondContact O-CG 3.49Å; L635-M639 PolarHBondContact O-N 2.81Å
636	T	85.1	Confident	77.8	Confident	81 Å²	81	74 Å²	74	50%	0.497	41%	0.408	S	S	.	.	H	α-helix	trans	-60.6	-38	179.1	-54.8	0	0	0	0	112.7	S632 M639 K640	S632-T636 PolarHBondContact O-N 3.11Å; S632-T636 PolarHBondContact O-OG1 3.46Å; S632-T636 VanDerWaalsContact O-OG1 3.05Å; T636-M639 PolarHBondContact O-N 2.86Å; T636-K640 PolarHBondContact O-N 3.48Å
637	R	84.8	Confident	76.8	Confident	193 Å²	193	77.9 Å²	77.9	73%	0.728	42%	0.418	S	S	*	.	H	α-helix	trans	-63.8	-42.4	173.2	-173.1	-176.9	-63.7	176.1	-2.9	111.3	S633 K634 L635 K640 T641	S633-R637 PolarHBondContact O-N 3.34Å; S633-R637 VanDerWaalsContact O-N 3.14Å; K634-R637 PolarHBondContact O-N 3.14Å; L635-R637 VanDerWaalsContact C-N 3.32Å; L635-R637 PolarHBondContact O-N 3.18Å; R637-K640 WeakPolarHBondContact O-CB 3.49Å; R637-K640 PolarHBondContact O-N 3.39Å; R637-T641 PolarHBondContact O-OG1 2.85Å
638	H	85.3	Confident	75.4	Confident	30 Å²	30	79.7 Å²	79.7	14%	0.139	43%	0.43	C	S	.	.	H	α-helix	trans	-68.4	-31.4	175.6	172.7	47.9	0	0	0	112.9	C625 Y627 K634 L635 K640 T641 H642	C625-H638 PolarHBondContact SG-NE2 2.98Å; Y627-H638 WeakPolarHBondContact CB-NE2 3.14Å; Y627-H638 HydrophobicContact CD1-CB 4.2Å; Y627-H638 AromaticContact CD1-CD2 3.28Å; Y627-H638 WeakPolarHBondContact CD1-CD2 3.49Å; Y627-H638 AromaticContact CD1-CG 3.77Å; Y627-H638 AromaticContact CD1-NE2 3.98Å; Y627-H638 HydrophobicContact CE1-CB 4.09Å; Y627-H638 AromaticContact CG-CD2 3.67Å; Y627-H638 AromaticContact CG-NE2 3.9Å; K634-H638 WeakPolarHBondContact O-CB 3.4Å; K634-H638 PolarHBondContact O-N 2.99Å; L635-H638 CarbonylContact O-C 3.02Å; L635-H638 WeakPolarHBondContact O-CA 3.48Å; L635-H638 WeakPolarHBondContact O-CB 3.36Å; L635-H638 PolarHBondContact O-N 2.86Å; H638-K640 VanDerWaalsContact C-N 3.27Å; H638-K640 PolarHBondContact O-N 3.13Å; H638-T641 WeakPolarHBondContact O-CA 3.16Å; H638-T641 WeakPolarHBondContact O-CB 3.48Å; H638-T641 PolarHBondContact O-N 3.5Å; H638-T641 PolarHBondContact O-OG1 2.8Å; H638-H642 AromaticContact CE1-CD2 3.93Å; H638-H642 AromaticContact CE1-CE1 3.77Å; H638-H642 AromaticContact CE1-NE2 3.14Å; H638-H642 PolarHBondContact CE1-NE2 2.76Å; H638-H642 AromaticContact NE2-CD2 3.94Å; H638-H642 AromaticContact NE2-NE2 3.11Å; H638-H642 PolarHBondContact NE2-NE2 2.88Å; H638-H642 VanDerWaalsContact NE2-NE2 3.11Å; H638-H642 PolarHBondContact O-N 2.91Å
639	M	81.5	Confident	74.6	Confident	60 Å²	60	81.1 Å²	81.1	30%	0.296	44%	0.436	S	S	.	.	H	α-helix	trans	-64.4	-32.7	173.3	-63.6	-48.4	83.6	0	0	111.7	C622 L635 T636 T641 H642 G643	C622-M639 HydrophobicContact CB-CE 3.78Å; C622-M639 WeakPolarHBondContact SG-CE 3.49Å; L635-M639 HydrophobicContact CD1-CE 3.46Å; L635-M639 VanDerWaalsContact CD1-CE 3.46Å; L635-M639 HydrophobicContact CD1-SD 4.28Å; L635-M639 HydrophobicContact CG-CE 4.04Å; L635-M639 HydrophobicContact CG-CG 4.37Å; L635-M639 HydrophobicContact CG-SD 4.43Å; L635-M639 WeakPolarHBondContact O-CG 3.49Å; L635-M639 PolarHBondContact O-N 2.81Å; T636-M639 PolarHBondContact O-N 2.86Å; M639-T641 PolarHBondContact O-N 3.24Å; M639-H642 PolarHBondContact O-N 3.44Å; M639-G643 PolarHBondContact O-N 3.48Å
640	K	80.8	Confident	74	Confident	154 Å²	154	84.7 Å²	84.7	67%	0.67	45%	0.449	S	S	*	.	H	α-helix	trans	-63.8	-30.1	170.7	-67.8	-167	166.7	-148.1	0	112.5	T636 R637 H638 H642 G643 Q644	T636-K640 PolarHBondContact O-N 3.48Å; R637-K640 WeakPolarHBondContact O-CB 3.49Å; R637-K640 PolarHBondContact O-N 3.39Å; H638-K640 VanDerWaalsContact C-N 3.27Å; H638-K640 PolarHBondContact O-N 3.13Å; K640-H642 PolarHBondContact O-N 3.39Å; K640-G643 PolarHBondContact O-N 3.23Å; K640-Q644 PolarHBondContact O-N 2.97Å
641	T	73.4	Confident	73.6	Confident	61 Å²	61	90 Å²	90	37%	0.374	47%	0.465	S	S	.	.	H	α-helix	trans	-68.6	-15.4	172.7	-41.4	0	0	0	0	112.9	R637 H638 M639 I645	R637-T641 PolarHBondContact O-OG1 2.85Å; H638-T641 WeakPolarHBondContact O-CA 3.16Å; H638-T641 WeakPolarHBondContact O-CB 3.48Å; H638-T641 PolarHBondContact O-N 3.5Å; H638-T641 PolarHBondContact O-OG1 2.8Å; M639-T641 PolarHBondContact O-N 3.24Å; T641-I645 WeakPolarHBondContact O-CD1 3.49Å
642	H	71.6	Confident	73.5	Confident	27 Å²	27	87 Å²	87	13%	0.125	45%	0.451	C	S	.	.	H	α-helix	trans	-92.3	-45	165	-60.4	-67.1	0	0	0	111	C622 L624 H638 M639 K640 Q644 I645	C622-H642 PolarHBondContact SG-NE2 2.92Å; L624-H642 HydrophobicContact CD1-CB 3.55Å; H638-H642 AromaticContact CE1-CD2 3.93Å; H638-H642 AromaticContact CE1-CE1 3.77Å; H638-H642 AromaticContact CE1-NE2 3.14Å; H638-H642 PolarHBondContact CE1-NE2 2.76Å; H638-H642 AromaticContact NE2-CD2 3.94Å; H638-H642 AromaticContact NE2-NE2 3.11Å; H638-H642 PolarHBondContact NE2-NE2 2.88Å; H638-H642 VanDerWaalsContact NE2-NE2 3.11Å; H638-H642 PolarHBondContact O-N 2.91Å; M639-H642 PolarHBondContact O-N 3.44Å; K640-H642 PolarHBondContact O-N 3.39Å; H642-Q644 VanDerWaalsContact C-N 3.27Å; H642-Q644 PolarHBondContact O-N 3.13Å; H642-I645 CarbonylContact O-C 3.58Å; H642-I645 PolarHBondContact O-N 2.94Å
643	G	57.9	Low	73.2	Confident	67 Å²	67	89.6 Å²	89.6	69%	0.691	46%	0.46	S	S	*	.	H	α-helix	trans	-65.8	-18.6	-176	0	0	0	0	0	116.3	M639 K640	M639-G643 PolarHBondContact O-N 3.48Å; K640-G643 PolarHBondContact O-N 3.23Å
644	Q	56.2	Low	72.8	Confident	168 Å²	168	90.1 Å²	90.1	79%	0.785	46%	0.456	S	S	*	.	T	Hydrogen-bonded Turn	trans	-83.7	-14.5	170.9	-151.4	77.1	37.5	0	0	112.6	K640 H642	K640-Q644 PolarHBondContact O-N 2.97Å; H642-Q644 VanDerWaalsContact C-N 3.27Å; H642-Q644 PolarHBondContact O-N 3.13Å
645	I	52.4	Low	72.6	Confident	42 Å²	42	87.1 Å²	87.1	22%	0.215	45%	0.448	C	S	.	.			trans	-104.5	75.8	177.5	-69.2	91.7	0	0	0	107.6	T641 H642 E648 V649	T641-I645 WeakPolarHBondContact O-CD1 3.49Å; H642-I645 CarbonylContact O-C 3.58Å; H642-I645 PolarHBondContact O-N 2.94Å; I645-E648 WeakPolarHBondContact CG2-O 3.34Å; I645-V649 HydrophobicContact CB-CG2 4.45Å; I645-V649 HydrophobicContact CG2-CB 4.4Å; I645-V649 HydrophobicContact CG2-CG2 3.6Å
646	G	51.6	Low	72.2	Confident	75 Å²	75	90.8 Å²	90.8	77%	0.773	46%	0.464	S	S	*	.	S	Bend	trans	-87	-2.3	177.2	0	0	0	0	0	114.9
647	K	56.8	Low	71.8	Confident	214 Å²	214	89.1 Å²	89.1	93%	0.93	45%	0.451	S	S	*	.	S	Bend	trans	-121.7	-53.6	-178.2	-65	-171.7	177.4	-177.9	0	113.7
648	E	55.2	Low	71.5	Confident	123 Å²	123	80.6 Å²	80.6	58%	0.575	42%	0.421	S	S	*	.			trans	-131.7	108.6	179.6	-68.8	-163.1	171	0	0	115.9	I645 Y650	I645-E648 WeakPolarHBondContact CG2-O 3.34Å; E648-Y650 PolarHBondContact OE2-OH 3.16Å
649	V	69.8	Low	71.1	Confident	52 Å²	52	80.8 Å²	80.8	32%	0.315	42%	0.422	S	S	.	.			trans	-96.5	102.9	170.6	-179.3	0	0	0	0	110	I645 R651 P658	I645-V649 HydrophobicContact CB-CG2 4.45Å; I645-V649 HydrophobicContact CG2-CB 4.4Å; I645-V649 HydrophobicContact CG2-CG2 3.6Å; V649-R651 PolarHBondContact O-N 2.96Å; V649-P658 HydrophobicContact CG1-CB 3.26Å
650	Y	72.4	Confident	70.8	Confident	80 Å²	80	80.2 Å²	80.2	31%	0.314	42%	0.423	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-63.3	127.7	176.3	-62.9	-70.4	0	0	0	111.3	E648 P658 F659 Y662	E648-Y650 PolarHBondContact OE2-OH 3.16Å; Y650-P658 CarbonylContact O-C 3.3Å; Y650-P658 VanDerWaalsContact O-CA 3.3Å; Y650-P658 WeakPolarHBondContact O-CA 3.38Å; Y650-F659 PolarHBondContact N-O 3Å; Y650-F659 PolarHBondContact O-N 3.3Å; Y650-Y662 HydrophobicContact CD1-CD2 4.04Å; Y650-Y662 VanDerWaalsContact CD2-N 3.27Å; Y650-Y662 HydrophobicContact CE1-CD2 4.3Å
651	R	78.4	Confident	70.6	Confident	132 Å²	132	76.3 Å²	76.3	50%	0.498	41%	0.412	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-113.3	138.2	-179.4	-63.3	177.2	-170.6	-84.9	-3.3	110.7	V649 D653 M657 L665	V649-R651 PolarHBondContact O-N 2.96Å; R651-D653 PolarHBondContact O-N 2.97Å; R651-M657 WeakPolarHBondContact CA-O 3.4Å; R651-L665 WeakPolarHBondContact O-CD1 3.39Å
652	C	83.1	Confident	70.9	Confident	0 Å²	0	79.8 Å²	79.8	0%	0	42%	0.42	C	S	.	.			trans	-71.6	113.2	170.4	159.4	0	0	0	0	110	I654 C655 Q656 M657 F659 L665 H668 H673	C652-I654 VanDerWaalsContact C-N 3.29Å; C652-I654 PolarHBondContact O-N 3.29Å; C652-C655 HydrophobicContact CB-CB 4.4Å; C652-C655 WeakPolarHBondContact CB-SG 3.5Å; C652-C655 PolarHBondContact O-N 3.42Å; C652-C655 VanDerWaalsContact O-N 3.13Å; C652-C655 WeakPolarHBondContact SG-CB 3.42Å; C652-C655 PolarHBondContact SG-N 3.06Å; C652-C655 CovalentContact SG-SG 2.05Å; C652-C655 PolarHBondContact SG-SG 2.91Å; C652-Q656 WeakPolarHBondContact O-CA 3.49Å; C652-Q656 PolarHBondContact O-N 3.16Å; C652-M657 HydrophobicContact CB-CB 4.2Å; C652-M657 PolarHBondContact N-O 3.02Å; C652-F659 HydrophobicContact CB-CE2 3.98Å; C652-L665 HydrophobicContact CB-CD1 4.02Å; C652-L665 VanDerWaalsContact N-CD1 3.29Å; C652-H668 PolarHBondContact SG-NE2 3.39Å; C652-H673 PolarHBondContact SG-NE2 3.34Å
653	D	81.2	Confident	71.5	Confident	115 Å²	115	80.8 Å²	80.8	62%	0.615	43%	0.429	S	S	*	.	T	Hydrogen-bonded Turn	trans	-59.5	-40.9	-173.2	-52.4	-70	0	0	0	112.9	R651 C655 Q656	R651-D653 PolarHBondContact O-N 2.97Å; D653-C655 VanDerWaalsContact C-N 3.32Å; D653-C655 PolarHBondContact O-N 3.42Å; D653-Q656 PolarHBondContact O-NE2 3.1Å; D653-Q656 VanDerWaalsContact O-NE2 3.08Å
654	I	79.6	Confident	72.7	Confident	83 Å²	83	80.2 Å²	80.2	43%	0.426	41%	0.413	S	S	.	.	T	Hydrogen-bonded Turn	trans	-73.4	-20.1	-176.9	-58.2	164.7	0	0	0	112.6	C652 H673 H676	C652-I654 VanDerWaalsContact C-N 3.29Å; C652-I654 PolarHBondContact O-N 3.29Å; I654-H673 HydrophobicContact CD1-CB 3.67Å; I654-H676 HydrophobicContact CD1-CB 4.06Å
655	C	79.8	Confident	74.1	Confident	42 Å²	42	72.7 Å²	72.7	28%	0.284	38%	0.378	S	S	.	.	T	Hydrogen-bonded Turn	trans	-141.7	-1.3	-167.4	75.9	0	0	0	0	115.9	C652 D653 M657 H668	C652-C655 HydrophobicContact CB-CB 4.4Å; C652-C655 WeakPolarHBondContact CB-SG 3.5Å; C652-C655 PolarHBondContact O-N 3.42Å; C652-C655 VanDerWaalsContact O-N 3.13Å; C652-C655 WeakPolarHBondContact SG-CB 3.42Å; C652-C655 PolarHBondContact SG-N 3.06Å; C652-C655 CovalentContact SG-SG 2.05Å; C652-C655 PolarHBondContact SG-SG 2.91Å; D653-C655 VanDerWaalsContact C-N 3.32Å; D653-C655 PolarHBondContact O-N 3.42Å; C655-M657 PolarHBondContact O-N 3.42Å; C655-H668 PolarHBondContact SG-NE2 3.16Å
656	Q	78.4	Confident	75.6	Confident	108 Å²	108	74.7 Å²	74.7	51%	0.505	39%	0.386	S	S	.	.			trans	47.6	20.5	-178.6	-62.8	-61	-33.8	0	0	116.2	C652 D653 P658	C652-Q656 WeakPolarHBondContact O-CA 3.49Å; C652-Q656 PolarHBondContact O-N 3.16Å; D653-Q656 PolarHBondContact O-NE2 3.1Å; D653-Q656 VanDerWaalsContact O-NE2 3.08Å; Q656-P658 WeakPolarHBondContact O-CD 3.29Å
657	M	76.9	Confident	77.1	Confident	45 Å²	45	76.8 Å²	76.8	22%	0.222	37%	0.374	C	S	.	.			trans	-67.4	125.3	170.7	-78.7	-66.3	-62.4	0	0	110.1	N626 R651 C652 C655 F659	N626-M657 HydrophobicContact CB-SD 3.72Å; N626-M657 PolarHBondContact ND2-SD 2.95Å; R651-M657 WeakPolarHBondContact CA-O 3.4Å; C652-M657 HydrophobicContact CB-CB 4.2Å; C652-M657 PolarHBondContact N-O 3.02Å; C655-M657 PolarHBondContact O-N 3.42Å; M657-F659 HydrophobicContact CB-CE2 3.57Å; M657-F659 HydrophobicContact CB-CZ 3.88Å; M657-F659 WeakPolarHBondContact O-CD2 3.41Å; M657-F659 WeakPolarHBondContact O-CE2 3.35Å
658	P	80.1	Confident	78.5	Confident	14 Å²	14	67.8 Å²	67.8	9%	0.091	34%	0.335	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-81	147.4	171.5	33.3	-36.7	0	0	0	112.3	L624 C625 V649 Y650 Q656	L624-P658 WeakPolarHBondContact O-CG 3.29Å; C625-P658 HydrophobicContact CB-CG 3.33Å; V649-P658 HydrophobicContact CG1-CB 3.26Å; Y650-P658 CarbonylContact O-C 3.3Å; Y650-P658 VanDerWaalsContact O-CA 3.3Å; Y650-P658 WeakPolarHBondContact O-CA 3.38Å; Q656-P658 WeakPolarHBondContact O-CD 3.29Å
659	F	77	Confident	79.9	Confident	34 Å²	34	63.3 Å²	63.3	15%	0.149	32%	0.315	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-132.7	141.4	-179.8	-68	-83.5	0	0	0	109.9	Y650 C652 M657 V661 L665 H668	Y650-F659 PolarHBondContact N-O 3Å; Y650-F659 PolarHBondContact O-N 3.3Å; C652-F659 HydrophobicContact CB-CE2 3.98Å; M657-F659 HydrophobicContact CB-CE2 3.57Å; M657-F659 HydrophobicContact CB-CZ 3.88Å; M657-F659 WeakPolarHBondContact O-CD2 3.41Å; M657-F659 WeakPolarHBondContact O-CE2 3.35Å; F659-V661 VanDerWaalsContact C-N 3.31Å; F659-V661 PolarHBondContact O-N 2.61Å; F659-L665 HydrophobicContact CB-CB 4.06Å; F659-L665 HydrophobicContact CD2-CB 3.98Å; F659-L665 HydrophobicContact CD2-CD1 3.61Å; F659-L665 HydrophobicContact CD2-CG 4.43Å; F659-L665 HydrophobicContact CE2-CD1 4.11Å; F659-L665 HydrophobicContact CG-CB 4.04Å; F659-L665 HydrophobicContact CG-CD1 4.47Å; F659-H668 HydrophobicContact CE1-CB 3.67Å; F659-H668 HydrophobicContact CE2-CB 4.05Å; F659-H668 AromaticContact CE2-CG 3.84Å; F659-H668 HydrophobicContact CZ-CB 3.35Å; F659-H668 AromaticContact CZ-CD2 3.89Å; F659-H668 AromaticContact CZ-CG 3.27Å; F659-H668 AromaticContact CZ-ND1 3.62Å
660	S	74.2	Confident	80.6	Confident	48 Å²	48	67.9 Å²	67.9	34%	0.336	33%	0.33	S	S	.	.	S	Bend	trans	-80	-9.8	-178.7	54.9	0	0	0	0	114.2
661	V	77	Confident	81.1	Confident	72 Å²	72	72.3 Å²	72.3	44%	0.436	35%	0.351	S	S	.	.	S	Bend	trans	-153.3	137.7	-180	-171.8	0	0	0	0	109	F659 S663 T664 L665	F659-V661 VanDerWaalsContact C-N 3.31Å; F659-V661 PolarHBondContact O-N 2.61Å; V661-S663 VanDerWaalsContact C-N 3.28Å; V661-S663 PolarHBondContact O-N 3.08Å; V661-T664 HydrophobicContact CB-CG2 4.44Å; V661-T664 PolarHBondContact O-N 3.16Å; V661-T664 PolarHBondContact O-OG1 3.32Å; V661-L665 PolarHBondContact O-N 3.38Å
662	Y	79.3	Confident	81.2	Confident	135 Å²	135	74.1 Å²	74.1	53%	0.529	36%	0.358	S	S	.	.	H	α-helix	trans	-52.8	-41.9	177.5	-175.5	-88.6	0	0	0	113	Y650 T664 L665 E666	Y650-Y662 HydrophobicContact CD1-CD2 4.04Å; Y650-Y662 VanDerWaalsContact CD2-N 3.27Å; Y650-Y662 HydrophobicContact CE1-CD2 4.3Å; Y662-T664 PolarHBondContact O-N 3.41Å; Y662-L665 HydrophobicContact CD2-CD2 3.75Å; Y662-L665 HydrophobicContact CE2-CD2 3.75Å; Y662-L665 WeakPolarHBondContact O-CA 3.25Å; Y662-L665 VanDerWaalsContact O-CB 3.28Å; Y662-L665 WeakPolarHBondContact O-CB 3.23Å; Y662-L665 PolarHBondContact O-N 3.2Å; Y662-E666 HydrophobicContact CD1-CB 4.43Å; Y662-E666 HydrophobicContact CE1-CB 4.18Å; Y662-E666 WeakPolarHBondContact O-CB 3.26Å; Y662-E666 PolarHBondContact O-N 2.92Å
663	S	83.9	Confident	81.2	Confident	47 Å²	47	75.4 Å²	75.4	33%	0.329	36%	0.364	S	S	.	.	H	α-helix	trans	-66.6	-1.9	176.9	76.1	0	0	0	0	115.1	V661 K667	V661-S663 VanDerWaalsContact C-N 3.28Å; V661-S663 PolarHBondContact O-N 3.08Å; S663-K667 WeakPolarHBondContact O-CD 3.24Å; S663-K667 WeakPolarHBondContact O-CE 3.46Å; S663-K667 VanDerWaalsContact O-CG 3.23Å; S663-K667 WeakPolarHBondContact O-CG 3.44Å; S663-K667 PolarHBondContact O-NZ 3.06Å
664	T	82.6	Confident	80.6	Confident	55 Å²	55	71 Å²	71	34%	0.337	35%	0.346	S	S	.	.	H	α-helix	trans	-103.5	-30.1	167.9	63.9	0	0	0	0	112.7	V661 Y662 H668	V661-T664 HydrophobicContact CB-CG2 4.44Å; V661-T664 PolarHBondContact O-N 3.16Å; V661-T664 PolarHBondContact O-OG1 3.32Å; Y662-T664 PolarHBondContact O-N 3.41Å; T664-H668 WeakPolarHBondContact O-CB 3.35Å; T664-H668 PolarHBondContact O-N 3.22Å
665	L	85.5	Confident	79.9	Confident	10 Å²	10	75.3 Å²	75.3	5%	0.052	36%	0.364	C	S	.	.	H	α-helix	trans	-60.1	-53.2	164.6	173	87.6	0	0	0	110.3	R651 C652 F659 V661 Y662 K667 H668 M669	R651-L665 WeakPolarHBondContact O-CD1 3.39Å; C652-L665 HydrophobicContact CB-CD1 4.02Å; C652-L665 VanDerWaalsContact N-CD1 3.29Å; F659-L665 HydrophobicContact CB-CB 4.06Å; F659-L665 HydrophobicContact CD2-CB 3.98Å; F659-L665 HydrophobicContact CD2-CD1 3.61Å; F659-L665 HydrophobicContact CD2-CG 4.43Å; F659-L665 HydrophobicContact CE2-CD1 4.11Å; F659-L665 HydrophobicContact CG-CB 4.04Å; F659-L665 HydrophobicContact CG-CD1 4.47Å; V661-L665 PolarHBondContact O-N 3.38Å; Y662-L665 HydrophobicContact CD2-CD2 3.75Å; Y662-L665 HydrophobicContact CE2-CD2 3.75Å; Y662-L665 WeakPolarHBondContact O-CA 3.25Å; Y662-L665 VanDerWaalsContact O-CB 3.28Å; Y662-L665 WeakPolarHBondContact O-CB 3.23Å; Y662-L665 PolarHBondContact O-N 3.2Å; L665-K667 PolarHBondContact O-N 2.73Å; L665-H668 CarbonylContact O-C 3.49Å; L665-H668 WeakPolarHBondContact O-CA 3.38Å; L665-H668 VanDerWaalsContact O-CB 3.26Å; L665-H668 WeakPolarHBondContact O-CB 3.27Å; L665-H668 PolarHBondContact O-N 2.92Å; L665-M669 HydrophobicContact CD1-SD 4.4Å; L665-M669 HydrophobicContact CD2-SD 4.32Å; L665-M669 HydrophobicContact CG-SD 4.07Å; L665-M669 WeakPolarHBondContact O-CG 3.48Å; L665-M669 PolarHBondContact O-N 3.49Å
666	E	84.2	Confident	78.8	Confident	85 Å²	85	78 Å²	78	40%	0.397	37%	0.373	S	S	.	.	H	α-helix	trans	-56.8	-47.6	179.8	-173.9	-144.2	166.9	0	0	111.4	Y662 H668 M669 K670	Y662-E666 HydrophobicContact CD1-CB 4.43Å; Y662-E666 HydrophobicContact CE1-CB 4.18Å; Y662-E666 WeakPolarHBondContact O-CB 3.26Å; Y662-E666 PolarHBondContact O-N 2.92Å; E666-H668 PolarHBondContact O-N 2.89Å; E666-M669 PolarHBondContact O-N 2.9Å; E666-K670 WeakPolarHBondContact O-CB 3.45Å; E666-K670 PolarHBondContact O-N 3.39Å
667	K	84.4	Confident	77.8	Confident	119 Å²	119	75.5 Å²	75.5	52%	0.517	36%	0.362	S	S	.	.	H	α-helix	trans	-67.7	-20.4	175.8	-69.2	176.2	-166	121.9	0	113.5	S663 L665 K671	S663-K667 WeakPolarHBondContact O-CD 3.24Å; S663-K667 WeakPolarHBondContact O-CE 3.46Å; S663-K667 VanDerWaalsContact O-CG 3.23Å; S663-K667 WeakPolarHBondContact O-CG 3.44Å; S663-K667 PolarHBondContact O-NZ 3.06Å; L665-K667 PolarHBondContact O-N 2.73Å; K667-K671 WeakPolarHBondContact O-CB 3.32Å; K667-K671 WeakPolarHBondContact O-CD 3.32Å; K667-K671 VanDerWaalsContact O-CG 3.26Å; K667-K671 WeakPolarHBondContact O-CG 3.41Å
668	H	86.1	Confident	76.7	Confident	24 Å²	24	78.9 Å²	78.9	11%	0.111	38%	0.381	C	S	.	.	H	α-helix	trans	-76.7	-51.4	167.6	163.1	87.5	0	0	0	110.3	C652 C655 F659 T664 L665 E666 K670 K671 W672 H673	C652-H668 PolarHBondContact SG-NE2 3.39Å; C655-H668 PolarHBondContact SG-NE2 3.16Å; F659-H668 HydrophobicContact CE1-CB 3.67Å; F659-H668 HydrophobicContact CE2-CB 4.05Å; F659-H668 AromaticContact CE2-CG 3.84Å; F659-H668 HydrophobicContact CZ-CB 3.35Å; F659-H668 AromaticContact CZ-CD2 3.89Å; F659-H668 AromaticContact CZ-CG 3.27Å; F659-H668 AromaticContact CZ-ND1 3.62Å; T664-H668 WeakPolarHBondContact O-CB 3.35Å; T664-H668 PolarHBondContact O-N 3.22Å; L665-H668 CarbonylContact O-C 3.49Å; L665-H668 WeakPolarHBondContact O-CA 3.38Å; L665-H668 VanDerWaalsContact O-CB 3.26Å; L665-H668 WeakPolarHBondContact O-CB 3.27Å; L665-H668 PolarHBondContact O-N 2.92Å; E666-H668 PolarHBondContact O-N 2.89Å; H668-K670 VanDerWaalsContact C-N 3.35Å; H668-K670 PolarHBondContact O-N 2.88Å; H668-K671 PolarHBondContact O-N 3.3Å; H668-W672 AromaticContact CE1-CD1 3.36Å; H668-W672 AromaticContact CE1-CG 3.62Å; H668-W672 AromaticContact CG-CD1 3.94Å; H668-W672 AromaticContact ND1-CD1 3.11Å; H668-W672 AromaticContact ND1-CG 3.85Å; H668-W672 AromaticContact ND1-NE1 3.74Å; H668-W672 PolarHBondContact O-N 3.24Å; H668-H673 AromaticContact CD2-CD2 3.97Å; H668-H673 AromaticContact CE1-NE2 3.9Å; H668-H673 AromaticContact NE2-CD2 3.42Å; H668-H673 PolarHBondContact NE2-CD2 3.35Å; H668-H673 AromaticContact NE2-NE2 3.07Å; H668-H673 PolarHBondContact NE2-NE2 3.16Å
669	M	84.6	Confident	75.6	Confident	30 Å²	30	81.7 Å²	81.7	15%	0.148	40%	0.398	C	S	.	.	H	α-helix	trans	-59	-45.5	-179.6	-66.3	-179.4	82.3	0	0	111	L665 E666 K671 H673 G674 L677	L665-M669 HydrophobicContact CD1-SD 4.4Å; L665-M669 HydrophobicContact CD2-SD 4.32Å; L665-M669 HydrophobicContact CG-SD 4.07Å; L665-M669 WeakPolarHBondContact O-CG 3.48Å; L665-M669 PolarHBondContact O-N 3.49Å; E666-M669 PolarHBondContact O-N 2.9Å; M669-K671 PolarHBondContact O-N 3.1Å; M669-K671 VanDerWaalsContact O-N 3.11Å; M669-H673 CarbonylContact O-C 3.51Å; M669-H673 WeakPolarHBondContact O-CA 3.33Å; M669-H673 WeakPolarHBondContact O-CB 3.31Å; M669-H673 PolarHBondContact O-N 3.37Å; M669-G674 PolarHBondContact O-N 3.25Å; M669-L677 HydrophobicContact CB-CD1 4.39Å; M669-L677 HydrophobicContact CB-CD2 4.43Å; M669-L677 HydrophobicContact CE-CD2 4.32Å
670	K	84.5	Confident	74.4	Confident	148 Å²	148	83.9 Å²	83.9	64%	0.643	41%	0.411	S	S	*	.	H	α-helix	trans	-64.4	-15.4	176.1	-164.1	160	-171.2	158.4	0	114.7	E666 H668 L677	E666-K670 WeakPolarHBondContact O-CB 3.45Å; E666-K670 PolarHBondContact O-N 3.39Å; H668-K670 VanDerWaalsContact C-N 3.35Å; H668-K670 PolarHBondContact O-N 2.88Å; K670-L677 HydrophobicContact CB-CD1 4.21Å
671	K	82.4	Confident	73.5	Confident	173 Å²	173	86 Å²	86	75%	0.752	42%	0.418	S	S	*	.	H	α-helix	trans	-106.4	-30.3	179.8	-74.6	-175.5	178.3	-173.9	0	115	K667 H668 M669	K667-K671 WeakPolarHBondContact O-CB 3.32Å; K667-K671 WeakPolarHBondContact O-CD 3.32Å; K667-K671 VanDerWaalsContact O-CG 3.26Å; K667-K671 WeakPolarHBondContact O-CG 3.41Å; H668-K671 PolarHBondContact O-N 3.3Å; M669-K671 PolarHBondContact O-N 3.1Å; M669-K671 VanDerWaalsContact O-N 3.11Å
672	W	80.2	Confident	72.5	Confident	170 Å²	170	87 Å²	87	64%	0.644	43%	0.425	S	S	*	.	H	α-helix	trans	-111.7	-17.6	-177.1	-65.7	98.6	0	0	0	113.3	A150 H668	A150-W672 HydrophobicContact CB-CZ3 4.03Å; H668-W672 AromaticContact CE1-CD1 3.36Å; H668-W672 AromaticContact CE1-CG 3.62Å; H668-W672 AromaticContact CG-CD1 3.94Å; H668-W672 AromaticContact ND1-CD1 3.11Å; H668-W672 AromaticContact ND1-CG 3.85Å; H668-W672 AromaticContact ND1-NE1 3.74Å; H668-W672 PolarHBondContact O-N 3.24Å
673	H	83.7	Confident	71.4	Confident	27 Å²	27	87.2 Å²	87.2	13%	0.125	43%	0.428	C	S	.	.	S	Bend	trans	-135.8	21.8	-176.9	-49.7	-51.9	0	0	0	111.4	C652 I654 H668 M669 E675 H676 L677	C652-H673 PolarHBondContact SG-NE2 3.34Å; I654-H673 HydrophobicContact CD1-CB 3.67Å; H668-H673 AromaticContact CD2-CD2 3.97Å; H668-H673 AromaticContact CE1-NE2 3.9Å; H668-H673 AromaticContact NE2-CD2 3.42Å; H668-H673 PolarHBondContact NE2-CD2 3.35Å; H668-H673 AromaticContact NE2-NE2 3.07Å; H668-H673 PolarHBondContact NE2-NE2 3.16Å; M669-H673 CarbonylContact O-C 3.51Å; M669-H673 WeakPolarHBondContact O-CA 3.33Å; M669-H673 WeakPolarHBondContact O-CB 3.31Å; M669-H673 PolarHBondContact O-N 3.37Å; H673-E675 VanDerWaalsContact C-N 3.29Å; H673-E675 PolarHBondContact O-N 3.29Å; H673-H676 HydrophobicContact CB-CB 4.17Å; H673-H676 CarbonylContact O-C 3.22Å; H673-H676 VanDerWaalsContact O-CA 3.32Å; H673-H676 WeakPolarHBondContact O-CA 3.33Å; H673-H676 VanDerWaalsContact O-CB 3.22Å; H673-H676 WeakPolarHBondContact O-CB 3.5Å; H673-H676 PolarHBondContact O-N 2.89Å; H673-L677 PolarHBondContact O-N 3.46Å
674	G	68.6	Low	70.2	Confident	23 Å²	23	89.4 Å²	89.4	24%	0.237	44%	0.435	C	S	.	.	H	α-helix	trans	-62.1	-35	-174.4	0	0	0	0	0	113.4	M669 H676 L677 L678	M669-G674 PolarHBondContact O-N 3.25Å; G674-H676 VanDerWaalsContact C-N 3.25Å; G674-H676 PolarHBondContact O-N 2.96Å; G674-L677 PolarHBondContact O-N 3.33Å; G674-L678 PolarHBondContact O-N 3.34Å
675	E	64	Low	69	Low	173 Å²	173	92 Å²	92	81%	0.808	44%	0.443	S	S	*	.	H	α-helix	trans	-65.1	-30.7	171.3	-60.9	170.6	152.2	0	0	111.8	H673 T679	H673-E675 VanDerWaalsContact C-N 3.29Å; H673-E675 PolarHBondContact O-N 3.29Å; E675-T679 PolarHBondContact O-N 2.73Å; E675-T679 PolarHBondContact O-OG1 3.32Å
676	H	57	Low	67.6	Low	99 Å²	99	97.5 Å²	97.5	46%	0.458	47%	0.469	S	S	.	.	H	α-helix	trans	-79.2	-29.1	177.7	-122.7	-65.8	0	0	0	113	I654 H673 G674 T679 N680	I654-H676 HydrophobicContact CD1-CB 4.06Å; H673-H676 HydrophobicContact CB-CB 4.17Å; H673-H676 CarbonylContact O-C 3.22Å; H673-H676 VanDerWaalsContact O-CA 3.32Å; H673-H676 WeakPolarHBondContact O-CA 3.33Å; H673-H676 VanDerWaalsContact O-CB 3.22Å; H673-H676 WeakPolarHBondContact O-CB 3.5Å; H673-H676 PolarHBondContact O-N 2.89Å; G674-H676 VanDerWaalsContact C-N 3.25Å; G674-H676 PolarHBondContact O-N 2.96Å; H676-T679 PolarHBondContact O-N 3.46Å; H676-N680 PolarHBondContact O-N 3.22Å; H676-N680 PolarHBondContact O-ND2 3.26Å
677	L	57.2	Low	66.6	Low	55 Å²	55	96.8 Å²	96.8	29%	0.288	48%	0.478	S	S	.	.	H	α-helix	trans	-62.5	-53.4	172.3	-65.9	178.2	0	0	0	110	M669 K670 H673 G674 T679 N680 D681	M669-L677 HydrophobicContact CB-CD1 4.39Å; M669-L677 HydrophobicContact CB-CD2 4.43Å; M669-L677 HydrophobicContact CE-CD2 4.32Å; K670-L677 HydrophobicContact CB-CD1 4.21Å; H673-L677 PolarHBondContact O-N 3.46Å; G674-L677 PolarHBondContact O-N 3.33Å; L677-T679 PolarHBondContact O-N 3.25Å; L677-N680 WeakPolarHBondContact O-CA 3.48Å; L677-N680 WeakPolarHBondContact O-CB 3.41Å; L677-N680 PolarHBondContact O-N 3.26Å; L677-D681 VanDerWaalsContact C-OD2 3.31Å; L677-D681 PolarHBondContact O-N 3.07Å; L677-D681 VanDerWaalsContact O-OD2 3.1Å
678	L	54.4	Low	65.7	Low	116 Å²	116	98.2 Å²	98.2	61%	0.607	49%	0.486	S	S	*	.	H	α-helix	trans	-53.8	-32.5	175.9	-65.3	168.7	0	0	0	113.2	G674 V682	G674-L678 PolarHBondContact O-N 3.34Å; L678-V682 VanDerWaalsContact O-CG2 3.32Å; L678-V682 WeakPolarHBondContact O-CG2 3.44Å; L678-V682 PolarHBondContact O-N 3.13Å
679	T	57.3	Low	64.9	Low	72 Å²	72	105.5 Å²	105.5	44%	0.442	51%	0.513	S	S	.	.	H	α-helix	trans	-75.9	-24.7	177.6	-54.8	0	0	0	0	113	E675 H676 L677 K683	E675-T679 PolarHBondContact O-N 2.73Å; E675-T679 PolarHBondContact O-OG1 3.32Å; H676-T679 PolarHBondContact O-N 3.46Å; L677-T679 PolarHBondContact O-N 3.25Å; T679-K683 WeakPolarHBondContact O-CG 3.33Å
680	N	51.1	Low	63.5	Low	81 Å²	81	111.5 Å²	111.5	43%	0.433	56%	0.558	S	S	.	*	H	α-helix	trans	-83.9	-42.8	172.9	-73.2	-70	0	0	0	111.2	H676 L677 V682 K683 I684	H676-N680 PolarHBondContact O-N 3.22Å; H676-N680 PolarHBondContact O-ND2 3.26Å; L677-N680 WeakPolarHBondContact O-CA 3.48Å; L677-N680 WeakPolarHBondContact O-CB 3.41Å; L677-N680 PolarHBondContact O-N 3.26Å; N680-V682 VanDerWaalsContact C-N 3.3Å; N680-V682 PolarHBondContact O-N 2.92Å; N680-K683 PolarHBondContact O-N 3.07Å; N680-I684 WeakPolarHBondContact O-CG1 3.42Å; N680-I684 PolarHBondContact O-N 3.26Å
681	D	55.1	Low	62.4	Low	92 Å²	92	109.7 Å²	109.7	49%	0.492	55%	0.553	S	S	.	*	H	α-helix	trans	-53.8	-47.7	176.8	-59.3	-43.8	0	0	0	111	L677 K683 I684 E685	L677-D681 VanDerWaalsContact C-OD2 3.31Å; L677-D681 PolarHBondContact O-N 3.07Å; L677-D681 VanDerWaalsContact O-OD2 3.1Å; D681-K683 VanDerWaalsContact C-N 3.34Å; D681-K683 PolarHBondContact O-N 2.84Å; D681-I684 PolarHBondContact O-N 3.26Å; D681-E685 PolarHBondContact O-N 2.82Å; D681-E685 VanDerWaalsContact O-N 3.14Å
682	V	56.9	Low	61.4	Low	93 Å²	93	106.4 Å²	106.4	56%	0.564	54%	0.543	S	S	*	.	H	α-helix	trans	-65.5	-32.3	176.5	171.3	0	0	0	0	112.8	L678 N680 Q686	L678-V682 VanDerWaalsContact O-CG2 3.32Å; L678-V682 WeakPolarHBondContact O-CG2 3.44Å; L678-V682 PolarHBondContact O-N 3.13Å; N680-V682 VanDerWaalsContact C-N 3.3Å; N680-V682 PolarHBondContact O-N 2.92Å; V682-Q686 VanDerWaalsContact O-CB 3.25Å; V682-Q686 WeakPolarHBondContact O-CB 3.48Å; V682-Q686 PolarHBondContact O-N 3.18Å; V682-Q686 VanDerWaalsContact O-N 3.17Å
683	K	54.7	Low	60.3	Low	140 Å²	140	102.8 Å²	102.8	61%	0.609	54%	0.537	S	S	*	.	H	α-helix	trans	-74.7	-29.9	177.1	-83.3	-175.1	172.7	-171.5	0	113	T679 N680 D681 A687	T679-K683 WeakPolarHBondContact O-CG 3.33Å; N680-K683 PolarHBondContact O-N 3.07Å; D681-K683 VanDerWaalsContact C-N 3.34Å; D681-K683 PolarHBondContact O-N 2.84Å; K683-A687 WeakPolarHBondContact O-CB 3.32Å; K683-A687 PolarHBondContact O-N 2.97Å
684	I	59.2	Low	59	Low	92 Å²	92	107.3 Å²	107.3	47%	0.472	56%	0.562	S	S	.	*	H	α-helix	trans	-70.3	-53.5	174.5	-64.9	162.8	0	0	0	109.1	N680 D681 Q686 A687 E688	N680-I684 WeakPolarHBondContact O-CG1 3.42Å; N680-I684 PolarHBondContact O-N 3.26Å; D681-I684 PolarHBondContact O-N 3.26Å; I684-Q686 PolarHBondContact O-N 3.43Å; I684-A687 PolarHBondContact O-N 3.18Å; I684-E688 HydrophobicContact CG2-CG 4.48Å; I684-E688 WeakPolarHBondContact O-CG 3.44Å; I684-E688 PolarHBondContact O-N 3.04Å
685	E	57.4	Low	58.4	Low	109 Å²	109	112.6 Å²	112.6	51%	0.509	58%	0.582	S	S	.	*	H	α-helix	trans	-61	-18.8	177	-96.5	-136.2	103.5	0	0	114.6	D681 R689	D681-E685 PolarHBondContact O-N 2.82Å; D681-E685 VanDerWaalsContact O-N 3.14Å; E685-R689 VanDerWaalsContact CD-NH1 3.29Å; E685-R689 WeakPolarHBondContact O-CG 3.42Å; E685-R689 PolarHBondContact O-NH1 3.2Å; E685-R689 IonicContact OE1-CZ 3.68Å; E685-R689 VanDerWaalsContact OE1-CZ 3.29Å; E685-R689 IonicContact OE1-NH1 3.6Å; E685-R689 PolarHBondContact OE1-NH1 2.81Å; E685-R689 IonicContact OE1-NH2 2.95Å; E685-R689 PolarHBondContact OE1-NH2 3.47Å; E685-R689 IonicContact OE2-NH1 3.38Å
686	Q	56.4	Low	58	Low	126 Å²	126	108.5 Å²	108.5	59%	0.589	57%	0.567	S	S	*	*	H	α-helix	trans	-92.2	-27.9	175	-166.9	164.4	21.2	0	0	113	V682 I684 S690	V682-Q686 VanDerWaalsContact O-CB 3.25Å; V682-Q686 WeakPolarHBondContact O-CB 3.48Å; V682-Q686 PolarHBondContact O-N 3.18Å; V682-Q686 VanDerWaalsContact O-N 3.17Å; I684-Q686 PolarHBondContact O-N 3.43Å; Q686-S690 PolarHBondContact O-OG 2.59Å
687	A	63.3	Low	58.1	Low	70 Å²	70	109.2 Å²	109.2	58%	0.579	57%	0.574	S	S	*	*	H	α-helix	trans	-73.9	-33.1	169.5	0	0	0	0	0	112	K683 I684 R689	K683-A687 WeakPolarHBondContact O-CB 3.32Å; K683-A687 PolarHBondContact O-N 2.97Å; I684-A687 PolarHBondContact O-N 3.18Å; A687-R689 PolarHBondContact O-N 2.91Å
688	E	66.6	Low	58.1	Low	149 Å²	149	113.4 Å²	113.4	70%	0.696	60%	0.596	S	S	*	*	T	Hydrogen-bonded Turn	trans	-78.9	-0.2	174.9	-64.6	178.7	133.6	0	0	113.6	I684	I684-E688 HydrophobicContact CG2-CG 4.48Å; I684-E688 WeakPolarHBondContact O-CG 3.44Å; I684-E688 PolarHBondContact O-N 3.04Å
689	R	68	Low	58.4	Low	178 Å²	178	113.2 Å²	113.2	67%	0.672	60%	0.596	S	S	*	*	T	Hydrogen-bonded Turn	trans	-117.6	3.9	175.8	-83.4	-166.5	-174.5	77.5	-0.9	114.6	E685 A687	E685-R689 VanDerWaalsContact CD-NH1 3.29Å; E685-R689 WeakPolarHBondContact O-CG 3.42Å; E685-R689 PolarHBondContact O-NH1 3.2Å; E685-R689 IonicContact OE1-CZ 3.68Å; E685-R689 VanDerWaalsContact OE1-CZ 3.29Å; E685-R689 IonicContact OE1-NH1 3.6Å; E685-R689 PolarHBondContact OE1-NH1 2.81Å; E685-R689 IonicContact OE1-NH2 2.95Å; E685-R689 PolarHBondContact OE1-NH2 3.47Å; E685-R689 IonicContact OE2-NH1 3.38Å; A687-R689 PolarHBondContact O-N 2.91Å
690	S	55.2	Low	58.5	Low	156 Å²	156	116.9 Å²	116.9	100%	1.091	61%	0.61	S	S	*	*			trans	-108.6	0	-178.4	-59.5	0	0	0	0	111.7	Q686	Q686-S690 PolarHBondContact O-OG 2.59Å

Retrieved 690 of 690 residues in 568.5 ms (Link to these results)

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