A0A096MUP3_PAPAN Loading...

T-box transcription factor 5

AlphaFold DB (A0A2K5LIE8), UniProt , Accession A0A096MUP3, Species PAPAN (Papio anubis, Olive baboon), Gene TBX5, Length 518 aa.

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(Predicted Aligned Error values between residue pairs)

Download Structure PDB PAE Table

Site	Residue	pLDDT	pLDDT confidence	pLDDT₁₀	pLDDT10 confidence	SASA	SASA [Å²]	SASA₁₀	SASA10 [Å²]	RSA	RSA unformatted	RSA₁₀	RSA10 unformatted	Surface	Surface10 (not used)	Disorder (not used)	Disorder	Sec. str.	Secondary structure	Isomer	Phi (φ)	Psi (ψ)	Omega (ω)	Chi 1 (χ₁)	Chi 2 (χ₂)	Chi 3 (χ₃)	Chi 4 (χ₄)	Chi 5 (χ₅)	Tau (τ)	Contacts (colored by PAE)	Contact details
1	M	36.6	Very low	35.8	Very low	238 Å²	238	141.9 Å²	141.9	100%	1.172	85%	0.853	S	S	*	*				0	106.5	0	-68.1	153.5	174.9	0	0	104.5
2	A	38	Very low	35.5	Very low	89 Å²	89	145.3 Å²	145.3	74%	0.736	85%	0.852	S	S	*	*				68.8	126.8	63.3	0	0	0	0	0	110
3	D	39.7	Very low	35.3	Very low	155 Å²	155	144.2 Å²	144.2	83%	0.829	85%	0.848	S	S	*	*			cis	-158.2	-178.6	1.2	-138.7	-55.8	0	0	0	111
4	A	41.4	Very low	36.8	Very low	81 Å²	81	141.5 Å²	141.5	67%	0.669	84%	0.837	S	S	*	*			trans	60.4	113.4	153.7	0	0	0	0	0	122
5	D	39.5	Very low	36.4	Very low	159 Å²	159	143.8 Å²	143.8	85%	0.85	84%	0.843	S	S	*	*				91.8	153.6	126	-114.9	-37.8	0	0	0	125
6	E	39.6	Very low	36.3	Very low	188 Å²	188	145.1 Å²	145.1	88%	0.879	84%	0.838	S	S	*	*			trans	48.7	122.8	171.2	-59.1	-154.5	102.3	0	0	120.8
7	G	33.3	Very low	37.7	Very low	78 Å²	78	143 Å²	143	80%	0.804	83%	0.831	S	S	*	*			trans	154.6	25.8	168.6	0	0	0	0	0	118.6	G9	G7-G9 PolarHBondContact O-N 3.27Å
8	F	31.7	Very low	37.4	Very low	226 Å²	226	143.6 Å²	143.6	99%	0.991	83%	0.83	S	S	*	*			trans	-78.7	109.2	-173	-91.7	-78.9	0	0	0	114.9
9	G	28.7	Very low	37.2	Very low	65 Å²	65	139.8 Å²	139.8	67%	0.67	82%	0.818	S	S	*	*			trans	-102.6	123.5	168.9	0	0	0	0	0	113.4	G7	G7-G9 PolarHBondContact O-N 3.27Å
10	L	32.4	Very low	37.1	Very low	182 Å²	182	142.9 Å²	142.9	95%	0.953	82%	0.821	S	S	*	*			trans	53.5	120.9	150.1	-60.9	171.6	0	0	0	120.4
11	A	32.6	Very low	36.9	Very low	100 Å²	100	143.5 Å²	143.5	83%	0.826	82%	0.821	S	S	*	*			trans	-136.9	148	151.6	0	0	0	0	0	110.2
12	H	32.6	Very low	36.9	Very low	183 Å²	183	140 Å²	140	85%	0.847	81%	0.806	S	S	*	*			trans	-81.8	172.3	171.2	-51.6	-106.2	0	0	0	110.2
13	T	33.1	Very low	37.3	Very low	130 Å²	130	141.3 Å²	141.3	80%	0.798	81%	0.807	S	S	*	*			cis	-136.6	-144.3	12.1	40.1	0	0	0	0	110.3
14	P	56	Low	36.7	Very low	107 Å²	107	139.9 Å²	139.9	70%	0.695	81%	0.808	S	S	*	*				-127.3	168.2	-99.1	40.9	-24.1	0	0	0	115.8
15	L	30.5	Very low	36.4	Very low	176 Å²	176	142.4 Å²	142.4	92%	0.921	81%	0.81	S	S	*	*			trans	-177.1	153.4	142.9	-102	157.2	0	0	0	112.2
16	E	35.7	Very low	36	Very low	165 Å²	165	140 Å²	140	77%	0.771	81%	0.806	S	S	*	*			trans	-70.3	167.9	167.2	-85.6	-83.9	132.4	0	0	111.5
17	P	59.9	Low	35.8	Very low	109 Å²	109	138.3 Å²	138.3	71%	0.708	80%	0.796	S	S	*	*			cis	-144.9	-176.8	23.3	42.3	-22.3	0	0	0	119
18	D	31.5	Very low	36	Very low	153 Å²	153	140.5 Å²	140.5	82%	0.818	80%	0.796	S	S	*	*			trans	92.1	151.9	140.7	-147.1	-3.3	0	0	0	121.2
19	A	33.4	Very low	36.4	Very low	72 Å²	72	137.2 Å²	137.2	60%	0.595	78%	0.784	S	S	*	*			trans	80.4	95.5	154.5	0	0	0	0	0	122.8
20	K	36	Very low	36.4	Very low	202 Å²	202	139.6 Å²	139.6	88%	0.878	79%	0.79	S	S	*	*				90.7	118.8	127.2	-67.7	175.1	179	171.8	0	121.7
21	D	31.7	Very low	36.3	Very low	156 Å²	156	135.2 Å²	135.2	83%	0.834	78%	0.78	S	S	*	*			trans	-72.8	153	162.3	-51.9	-96.5	0	0	0	115.3
22	L	36.9	Very low	36.6	Very low	163 Å²	163	139.6 Å²	139.6	85%	0.853	79%	0.789	S	S	*	*			trans	-121.6	155.7	140	-77.7	175	0	0	0	105.1
23	P	47.7	Very low	36.5	Very low	118 Å²	118	134 Å²	134	77%	0.766	78%	0.78	S	S	*	*			cis	-158.8	-176.2	49.4	43.7	-21.8	0	0	0	119.3
24	C	27	Very low	36.7	Very low	125 Å²	125	132.4 Å²	132.4	85%	0.845	78%	0.781	S	S	*	*			trans	83.3	144.3	143.9	-138.8	0	0	0	0	120.6
25	D	35	Very low	36	Very low	133 Å²	133	133 Å²	133	71%	0.711	78%	0.784	S	S	*	*			trans	-92.8	144.1	-179	-169.7	-55.6	0	0	0	110.8	K27	D25-K27 PolarHBondContact OD1-N 3.04Å
26	S	31.6	Very low	36.9	Very low	110 Å²	110	126.3 Å²	126.3	77%	0.769	75%	0.752	S	S	*	*			trans	-156.5	91	150	36.4	0	0	0	0	111.7	P28	S26-P28 WeakPolarHBondContact O-CD 3.5Å
27	K	35.2	Very low	38.3	Very low	151 Å²	151	125.1 Å²	125.1	66%	0.657	74%	0.744	S	S	*	*			trans	-51.8	138.3	168.1	-160.4	-165.7	-171.3	-165.9	0	111.9	D25 E29	D25-K27 PolarHBondContact OD1-N 3.04Å; K27-E29 IonicContact NZ-OE2 2.62Å; K27-E29 PolarHBondContact NZ-OE2 3.19Å
28	P	36.1	Very low	38.6	Very low	125 Å²	125	124.5 Å²	124.5	81%	0.812	74%	0.743	S	S	*	*				-126.5	169.7	122.2	37	-32.7	0	0	0	113	S26	S26-P28 WeakPolarHBondContact O-CD 3.5Å
29	E	40.7	Very low	40.7	Very low	157 Å²	157	118.1 Å²	118.1	73%	0.734	71%	0.71	S	S	*	*			trans	-108.1	126.3	-162.6	-173.6	167.5	109	0	0	112.2	K27	K27-E29 IonicContact NZ-OE2 2.62Å; K27-E29 PolarHBondContact NZ-OE2 3.19Å
30	S	28.1	Very low	42.2	Very low	114 Å²	114	120.8 Å²	120.8	80%	0.797	72%	0.724	S	S	*	*			trans	-161.5	138.7	172.4	-169	0	0	0	0	114
31	A	31.1	Very low	44	Very low	90 Å²	90	114.5 Å²	114.5	74%	0.744	71%	0.705	S	S	*	*			trans	35	109.6	157.6	0	0	0	0	0	120.2	G33	A31-G33 PolarHBondContact O-N 2.74Å
32	L	38.2	Very low	46.1	Very low	193 Å²	193	112.4 Å²	112.4	100%	1.01	70%	0.7	S	S	*	*			trans	-67.4	91.2	163.7	-75.2	167.7	0	0	0	111.8
33	G	30.6	Very low	48	Very low	65 Å²	65	109 Å²	109	67%	0.67	68%	0.68	S	S	*	*			trans	-117.9	97.2	168.3	0	0	0	0	0	111.2	A31	A31-G33 PolarHBondContact O-N 2.74Å
34	A	37.7	Very low	49.5	Very low	97 Å²	97	106 Å²	106	80%	0.802	67%	0.665	S	S	*	*	P	Polyproline II helix	trans	-65.5	126.7	173.8	0	0	0	0	0	110.1	S36	A34-S36 PolarHBondContact O-N 3.38Å
35	P	42	Very low	52	Low	119 Å²	119	103 Å²	103	77%	0.773	65%	0.65	S	S	*	*	P	Polyproline II helix	trans	-70.8	122.7	-178.3	27.1	-33.3	0	0	0	110.9	K37	P35-K37 PolarHBondContact O-N 2.96Å
36	S	48.8	Very low	54.2	Low	35 Å²	35	102.5 Å²	102.5	25%	0.245	64%	0.641	C	S	.	*	P	Polyproline II helix	trans	-50.5	121.8	173.8	-41.7	0	0	0	0	110.1	A34 S38 E62	A34-S36 PolarHBondContact O-N 3.38Å; S36-S38 PolarHBondContact O-N 2.81Å; S36-E62 PolarHBondContact OG-OE2 3.35Å
37	K	64.6	Low	56.6	Low	140 Å²	140	99.9 Å²	99.9	61%	0.609	62%	0.621	S	S	*	*	P	Polyproline II helix	trans	-63.9	127.1	-178.5	-67.8	-173.3	-172.3	109.2	0	110.9	P35 E69	P35-K37 PolarHBondContact O-N 2.96Å; K37-E69 WeakPolarHBondContact CD-OE1 3.4Å; K37-E69 WeakPolarHBondContact CE-OE1 3.28Å; K37-E69 IonicContact NZ-OE1 2.71Å; K37-E69 PolarHBondContact NZ-OE1 2.98Å
38	S	67.1	Low	58.6	Low	97 Å²	97	95.8 Å²	95.8	68%	0.678	60%	0.604	S	S	*	*	P	Polyproline II helix	trans	-66	145.5	172.8	52	0	0	0	0	111	S36	S36-S38 PolarHBondContact O-N 2.81Å
39	P	75.1	Confident	60.3	Low	19 Å²	19	98.5 Å²	98.5	12%	0.123	61%	0.606	C	S	.	*	P	Polyproline II helix	trans	-60.2	144.8	174.6	27.1	-35.4	0	0	0	110.9	S41 P207 E208	P39-S41 VanDerWaalsContact C-N 3.28Å; P39-S41 PolarHBondContact O-N 3.48Å; P39-P207 HydrophobicContact CB-CB 3.98Å; P39-P207 HydrophobicContact CG-CB 4.26Å; P39-E208 HydrophobicContact CG-CB 4.39Å
40	S	64.6	Low	61.8	Low	128 Å²	128	92.3 Å²	92.3	90%	0.895	58%	0.584	S	S	*	*	S	Bend	trans	-71.4	-22	178.1	51.8	0	0	0	0	113.5
41	S	75.1	Confident	64.4	Low	69 Å²	69	87.1 Å²	87.1	48%	0.483	55%	0.547	S	S	.	.	S	Bend	trans	-87	135.8	171.7	-57.1	0	0	0	0	110.8	P39	P39-S41 VanDerWaalsContact C-N 3.28Å; P39-S41 PolarHBondContact O-N 3.48Å
42	P	74.9	Confident	66.4	Low	113 Å²	113	89.6 Å²	89.6	73%	0.734	54%	0.544	S	S	*	.			trans	-68.5	154.6	174	29.7	-35.2	0	0	0	111.6	A44 P207	P42-A44 PolarHBondContact O-N 2.93Å; P42-A44 VanDerWaalsContact O-N 3.14Å; P42-P207 WeakPolarHBondContact O-CG 3.41Å
43	Q	77.4	Confident	68.7	Low	90 Å²	90	82.5 Å²	82.5	42%	0.421	52%	0.518	S	S	.	.			trans	-65.7	111.9	170.3	-70.7	-177.7	-12.4	0	0	109.6	R61 F206 E208	Q43-R61 VanDerWaalsContact NE2-NH2 3.16Å; Q43-F206 HydrophobicContact CG-CD1 4.07Å; Q43-E208 PolarHBondContact NE2-OE1 3.47Å
44	A	78.8	Confident	71.7	Confident	55 Å²	55	80.1 Å²	80.1	46%	0.455	49%	0.489	S	S	.	.			trans	-90.5	137.6	-177.6	0	0	0	0	0	111.1	P42 V205	P42-A44 PolarHBondContact O-N 2.93Å; P42-A44 VanDerWaalsContact O-N 3.14Å; A44-V205 HydrophobicContact CB-CB 4.3Å; A44-V205 PolarHBondContact N-O 3.45Å; A44-V205 PolarHBondContact O-N 3.33Å
45	A	78.8	Confident	74.5	Confident	64 Å²	64	81.9 Å²	81.9	53%	0.529	48%	0.479	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-132.9	133.9	169.9	0	0	0	0	0	110.1	T203	A45-T203 CarbonylContact C-O 3.59Å; A45-T203 VanDerWaalsContact CA-O 3.27Å; A45-T203 WeakPolarHBondContact CA-O 3.32Å
46	F	82.5	Confident	77.1	Confident	121 Å²	121	76.9 Å²	76.9	53%	0.531	45%	0.446	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-111.4	124.1	167.5	175.3	-93.9	0	0	0	108.1	Q48 F201 C202 T203	F46-Q48 HydrophobicContact CE1-CG 3.88Å; F46-Q48 HydrophobicContact CZ-CG 4.33Å; F46-F201 AromaticContact CD1-CE2 3.88Å; F46-F201 HydrophobicContact CD1-CE2 3.88Å; F46-F201 HydrophobicContact CD1-CZ 4.44Å; F46-F201 AromaticContact CE1-CE2 3.81Å; F46-F201 HydrophobicContact CE1-CE2 3.81Å; F46-F201 AromaticContact CE1-CZ 3.92Å; F46-F201 HydrophobicContact CE1-CZ 3.92Å; F46-C202 CarbonylContact O-C 3.46Å; F46-C202 WeakPolarHBondContact O-CA 3.37Å; F46-C202 WeakPolarHBondContact O-CB 3.44Å; F46-T203 PolarHBondContact N-O 3.32Å; F46-T203 PolarHBondContact O-N 2.98Å
47	T	81.2	Confident	79.4	Confident	55 Å²	55	80.5 Å²	80.5	34%	0.337	46%	0.458	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-134.3	118.7	-170	-58.3	0	0	0	0	109.4	M51 C202	T47-M51 HydrophobicContact CG2-CB 3.66Å; T47-C202 HydrophobicContact CG2-CB 4.11Å
48	Q	77.4	Confident	81	Confident	65 Å²	65	74.7 Å²	74.7	30%	0.304	43%	0.433	S	S	.	.			trans	-75.6	162.4	172.1	-69.3	-175.2	-35.6	0	0	111.9	F46 M51 A200 F201	F46-Q48 HydrophobicContact CE1-CG 3.88Å; F46-Q48 HydrophobicContact CZ-CG 4.33Å; Q48-M51 WeakPolarHBondContact O-CB 3.43Å; Q48-M51 PolarHBondContact O-N 2.93Å; Q48-A200 HydrophobicContact CB-CB 4.18Å; Q48-F201 WeakPolarHBondContact CB-O 3.19Å; Q48-F201 WeakPolarHBondContact CG-O 3.45Å; Q48-F201 PolarHBondContact N-O 2.59Å; Q48-F201 VanDerWaalsContact NE2-CE1 3.32Å
49	Q	71.6	Confident	82.5	Confident	183 Å²	183	73 Å²	73	86%	0.855	41%	0.414	S	S	*	.	T	Hydrogen-bonded Turn	trans	-61.6	139.9	-179.3	-163.8	173.2	10.9	0	0	111.9
50	G	72.3	Confident	83.5	Confident	27 Å²	27	75.9 Å²	75.9	28%	0.278	43%	0.426	S	S	.	.	T	Hydrogen-bonded Turn	trans	83.8	18	-171.6	0	0	0	0	0	114	E52 K187	G50-E52 VanDerWaalsContact CA-OE1 3.28Å; G50-E52 WeakPolarHBondContact CA-OE1 3.36Å; G50-E52 WeakPolarHBondContact CA-OE2 3.39Å; G50-E52 PolarHBondContact N-OE1 2.78Å; G50-E52 PolarHBondContact N-OE2 3.47Å; G50-K187 PolarHBondContact O-NZ 2.81Å
51	M	82.9	Confident	85.1	Confident	4 Å²	4	74.4 Å²	74.4	2%	0.02	40%	0.401	C	S	.	.			trans	-137	-1.5	178.9	-62.4	-169.2	73.5	0	0	114	T47 Q48 G53 I54 I185 K187 A200 F201 C202	T47-M51 HydrophobicContact CG2-CB 3.66Å; Q48-M51 WeakPolarHBondContact O-CB 3.43Å; Q48-M51 PolarHBondContact O-N 2.93Å; M51-G53 PolarHBondContact O-N 2.86Å; M51-I54 HydrophobicContact CB-CD1 3.95Å; M51-I54 HydrophobicContact CE-CD1 3.44Å; M51-I54 VanDerWaalsContact CE-CD1 3.44Å; M51-I54 HydrophobicContact CG-CD1 4.19Å; M51-I54 WeakPolarHBondContact O-CB 3.47Å; M51-I54 WeakPolarHBondContact O-CG1 3.45Å; M51-I54 PolarHBondContact O-N 3.1Å; M51-I185 HydrophobicContact CE-CB 4.21Å; M51-I185 HydrophobicContact CE-CG2 3.88Å; M51-K187 HydrophobicContact CE-CB 4.24Å; M51-K187 HydrophobicContact CG-CD 4.12Å; M51-K187 HydrophobicContact SD-CB 4.12Å; M51-A200 HydrophobicContact CG-CB 3.95Å; M51-A200 HydrophobicContact SD-CB 3.65Å; M51-F201 WeakPolarHBondContact SD-CA 3.23Å; M51-F201 PolarHBondContact SD-N 3.18Å; M51-C202 HydrophobicContact CE-CB 3.95Å; M51-C202 HydrophobicContact SD-CB 4.31Å
52	E	73.1	Confident	86.2	Confident	142 Å²	142	75.9 Å²	75.9	66%	0.664	40%	0.4	S	S	*	.	T	Hydrogen-bonded Turn	trans	-53.8	-13.2	-179.5	51.9	-73.1	154.1	0	0	116.9	G50	G50-E52 VanDerWaalsContact CA-OE1 3.28Å; G50-E52 WeakPolarHBondContact CA-OE1 3.36Å; G50-E52 WeakPolarHBondContact CA-OE2 3.39Å; G50-E52 PolarHBondContact N-OE1 2.78Å; G50-E52 PolarHBondContact N-OE2 3.47Å
53	G	86.3	Confident	87.3	Confident	45 Å²	45	71.8 Å²	71.8	46%	0.464	37%	0.372	S	S	.	.	T	Hydrogen-bonded Turn	trans	-87.6	-12.6	172.7	0	0	0	0	0	115.6	M51	M51-G53 PolarHBondContact O-N 2.86Å
54	I	94	Very high	88.3	Confident	15 Å²	15	67.5 Å²	67.5	8%	0.077	35%	0.352	C	S	.	.			trans	-81	126.1	-166.6	-62.7	170.9	0	0	0	111.4	M51 V56 V91 T92 L94 Y100 I185	M51-I54 HydrophobicContact CB-CD1 3.95Å; M51-I54 HydrophobicContact CE-CD1 3.44Å; M51-I54 VanDerWaalsContact CE-CD1 3.44Å; M51-I54 HydrophobicContact CG-CD1 4.19Å; M51-I54 WeakPolarHBondContact O-CB 3.47Å; M51-I54 WeakPolarHBondContact O-CG1 3.45Å; M51-I54 PolarHBondContact O-N 3.1Å; I54-V56 HydrophobicContact CG2-CG2 4.48Å; I54-V91 HydrophobicContact CG2-CG1 4.3Å; I54-T92 WeakPolarHBondContact CA-O 3.3Å; I54-L94 HydrophobicContact CD1-CD2 3.62Å; I54-L94 HydrophobicContact CG1-CD2 3.93Å; I54-L94 HydrophobicContact CG2-CD2 4.19Å; I54-Y100 HydrophobicContact CD1-CE1 4.31Å; I54-I185 HydrophobicContact CG2-CD1 3.84Å
55	K	94.9	Very high	89.2	Confident	134 Å²	134	65.2 Å²	65.2	58%	0.583	33%	0.332	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-125.7	133	176.5	-61.3	179.7	-176.8	-179.9	0	110.7	F57 T92	K55-F57 HydrophobicContact CB-CE2 4.03Å; K55-F57 HydrophobicContact CB-CZ 4.1Å; K55-T92 PolarHBondContact N-O 3.05Å; K55-T92 PolarHBondContact O-N 3.03Å; K55-T92 PolarHBondContact O-OG1 2.79Å; K55-T92 VanDerWaalsContact O-OG1 3.1Å
56	V	97.4	Very high	90.2	Very high	13 Å²	13	67.4 Å²	67.4	8%	0.079	33%	0.33	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-119.5	132.8	-178.9	-178.1	0	0	0	0	108.9	I54 V89 K90 V91 L183 I185 H204 F206	I54-V56 HydrophobicContact CG2-CG2 4.48Å; V56-V89 HydrophobicContact CG1-CB 3.7Å; V56-V89 HydrophobicContact CG1-CG1 3.71Å; V56-V89 HydrophobicContact CG1-CG2 4.14Å; V56-K90 WeakPolarHBondContact CA-O 3.39Å; V56-V91 HydrophobicContact CG2-CG1 4.26Å; V56-V91 HydrophobicContact CG2-CG2 4.37Å; V56-L183 HydrophobicContact CB-CD2 4.48Å; V56-L183 HydrophobicContact CG1-CD2 3.62Å; V56-L183 HydrophobicContact CG2-CD2 4.09Å; V56-I185 HydrophobicContact CG2-CD1 3.82Å; V56-H204 HydrophobicContact CB-CB 4.49Å; V56-H204 VanDerWaalsContact CG2-CD2 3.46Å; V56-H204 WeakPolarHBondContact CG2-CD2 3.3Å; V56-F206 HydrophobicContact CB-CZ 4.33Å; V56-F206 HydrophobicContact CG1-CE2 4.05Å; V56-F206 HydrophobicContact CG1-CZ 3.89Å
57	F	97.7	Very high	90.9	Very high	112 Å²	112	61.7 Å²	61.7	49%	0.491	30%	0.304	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-120.2	124.5	179.3	-54.7	-88.3	0	0	0	110	K55 H59 V89 K90 T92	K55-F57 HydrophobicContact CB-CE2 4.03Å; K55-F57 HydrophobicContact CB-CZ 4.1Å; F57-H59 PolarHBondContact O-N 3.37Å; F57-V89 CarbonylContact O-C 3.55Å; F57-V89 VanDerWaalsContact O-CA 3.27Å; F57-V89 WeakPolarHBondContact O-CA 3.4Å; F57-K90 HydrophobicContact CB-CB 4.44Å; F57-K90 PolarHBondContact N-O 3.02Å; F57-K90 PolarHBondContact O-N 3.14Å; F57-T92 HydrophobicContact CE2-CG2 4.26Å
58	L	98.3	Very high	91.7	Very high	17 Å²	17	61.9 Å²	61.9	9%	0.089	30%	0.301	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-66	124.8	172.8	-175.8	65	0	0	0	110.1	R61 W64 Y87 F206 E208 T209	L58-R61 HydrophobicContact CD2-CG 4.4Å; L58-W64 HydrophobicContact CD2-CB 4.16Å; L58-W64 HydrophobicContact CD2-CG 3.97Å; L58-Y87 HydrophobicContact CD1-CD2 4.44Å; L58-Y87 HydrophobicContact CD1-CE2 4.36Å; L58-F206 HydrophobicContact CB-CD1 4.3Å; L58-F206 HydrophobicContact CB-CD2 3.94Å; L58-F206 HydrophobicContact CB-CE1 4.29Å; L58-F206 HydrophobicContact CB-CE2 3.94Å; L58-F206 HydrophobicContact CB-CG 4.14Å; L58-F206 HydrophobicContact CB-CZ 4.13Å; L58-F206 HydrophobicContact CD1-CD2 4.02Å; L58-F206 HydrophobicContact CD1-CE2 4.43Å; L58-F206 HydrophobicContact CD2-CB 4.21Å; L58-F206 HydrophobicContact CD2-CD2 4.47Å; L58-F206 HydrophobicContact CD2-CG 4.29Å; L58-F206 HydrophobicContact CG-CD2 4.37Å; L58-E208 HydrophobicContact CD2-CG 3.66Å; L58-T209 HydrophobicContact CD1-CG2 3.86Å; L58-T209 HydrophobicContact CD2-CG2 3.51Å; L58-T209 HydrophobicContact CG-CG2 4.36Å
59	H	98.1	Very high	92.7	Very high	62 Å²	62	63.2 Å²	63.2	29%	0.287	31%	0.307	S	S	.	.	T	Hydrogen-bonded Turn	trans	-84.8	150.6	175.7	177.5	86.2	0	0	0	110.7	F57 R61 K88 L152	F57-H59 PolarHBondContact O-N 3.37Å; H59-R61 PolarHBondContact O-N 2.89Å; H59-K88 HydrophobicContact CB-CB 3.93Å; H59-K88 VanDerWaalsContact CD2-CD 3.45Å; H59-K88 WeakPolarHBondContact CD2-CD 3.43Å; H59-K88 PolarHBondContact N-O 2.83Å; H59-L152 HydrophobicContact CB-CD2 3.94Å; H59-L152 VanDerWaalsContact CE1-CD1 3.45Å; H59-L152 WeakPolarHBondContact CE1-CD1 3.45Å; H59-L152 WeakPolarHBondContact ND1-CD1 3.17Å
60	E	96.9	Very high	93.9	Very high	79 Å²	79	56.5 Å²	56.5	37%	0.369	28%	0.279	S	S	.	.	T	Hydrogen-bonded Turn	trans	54.4	35.8	-172.3	-69.3	154.8	158.6	0	0	112.9	E62 L63 W64 K88	E60-E62 VanDerWaalsContact C-N 3.3Å; E60-E62 PolarHBondContact O-N 3.25Å; E60-L63 HydrophobicContact CB-CB 4.3Å; E60-L63 WeakPolarHBondContact O-CB 3.24Å; E60-L63 PolarHBondContact O-N 2.98Å; E60-W64 PolarHBondContact O-N 3.36Å; E60-K88 IonicContact OE1-NZ 3.28Å; E60-K88 PolarHBondContact OE1-NZ 3.2Å; E60-K88 WeakPolarHBondContact OE2-CD 3.31Å; E60-K88 IonicContact OE2-NZ 3.68Å; E60-K88 PolarHBondContact OE2-NZ 2.99Å
61	R	97.5	Very high	95.1	Very high	98 Å²	98	56.3 Å²	56.3	37%	0.37	28%	0.277	S	S	.	.	H	α-helix	trans	-50.9	-43.8	-177	-170	-177.5	-167.1	-149.8	-1.5	113.5	Q43 L58 H59 L63 W64 L65 E208	Q43-R61 VanDerWaalsContact NE2-NH2 3.16Å; L58-R61 HydrophobicContact CD2-CG 4.4Å; H59-R61 PolarHBondContact O-N 2.89Å; R61-L63 VanDerWaalsContact C-N 3.26Å; R61-L63 PolarHBondContact O-N 2.9Å; R61-W64 CarbonylContact O-C 3.59Å; R61-W64 WeakPolarHBondContact O-CA 3.44Å; R61-W64 WeakPolarHBondContact O-CB 3.48Å; R61-W64 PolarHBondContact O-N 2.94Å; R61-L65 HydrophobicContact CG-CD1 4.32Å; R61-L65 HydrophobicContact CG-CG 4.43Å; R61-L65 WeakPolarHBondContact O-CG 3.42Å; R61-L65 PolarHBondContact O-N 3.46Å; R61-E208 IonicContact CZ-OE1 3.19Å; R61-E208 IonicContact NE-OE1 3.86Å; R61-E208 PolarHBondContact NE-OE1 3.49Å; R61-E208 IonicContact NH2-OE1 2.77Å; R61-E208 PolarHBondContact NH2-OE1 3.42Å
62	E	97.9	Very high	95.8	Very high	99 Å²	99	56.3 Å²	56.3	46%	0.463	28%	0.278	S	S	.	.	H	α-helix	trans	-62.9	-30.6	178.2	-62.5	-46.7	118.9	0	0	113.5	S36 E60 K66	S36-E62 PolarHBondContact OG-OE2 3.35Å; E60-E62 VanDerWaalsContact C-N 3.3Å; E60-E62 PolarHBondContact O-N 3.25Å; E62-K66 WeakPolarHBondContact O-CG 3.49Å; E62-K66 PolarHBondContact O-N 2.77Å; E62-K66 VanDerWaalsContact O-N 3.1Å
63	L	98.1	Very high	97.1	Very high	28 Å²	28	49.6 Å²	49.6	15%	0.147	25%	0.246	C	C	.	.	H	α-helix	trans	-70.8	-40.1	173.3	-176.5	61.5	0	0	0	110.6	E60 R61 K66 F67 F84 P85 N229	E60-L63 HydrophobicContact CB-CB 4.3Å; E60-L63 WeakPolarHBondContact O-CB 3.24Å; E60-L63 PolarHBondContact O-N 2.98Å; R61-L63 VanDerWaalsContact C-N 3.26Å; R61-L63 PolarHBondContact O-N 2.9Å; L63-K66 PolarHBondContact O-N 2.85Å; L63-F67 HydrophobicContact CD1-CD2 4.22Å; L63-F67 HydrophobicContact CD1-CE2 3.83Å; L63-F67 HydrophobicContact CG-CD2 4.23Å; L63-F67 HydrophobicContact CG-CE2 4.07Å; L63-F67 VanDerWaalsContact O-CD2 3.28Å; L63-F67 WeakPolarHBondContact O-CD2 3.42Å; L63-F67 PolarHBondContact O-N 3.1Å; L63-F84 HydrophobicContact CD2-CZ 4.22Å; L63-P85 HydrophobicContact CD2-CB 4.13Å; L63-P85 HydrophobicContact CD2-CG 3.97Å; L63-P85 HydrophobicContact CG-CB 4.48Å; L63-P85 HydrophobicContact CG-CG 3.88Å; L63-N229 HydrophobicContact CD1-CB 3.88Å; L63-N229 WeakPolarHBondContact CD1-OD1 3.48Å; L63-N229 HydrophobicContact CD2-CB 4.42Å
64	W	98.6	Very high	97.7	Very high	0 Å²	0	47.6 Å²	47.6	0%	0	23%	0.225	C	C	.	.	H	α-helix	trans	-61.8	-43.8	172.7	-77.2	101.4	0	0	0	112.3	L58 E60 R61 K66 F67 H68 M74 P85 Y87 E208 T209	L58-W64 HydrophobicContact CD2-CB 4.16Å; L58-W64 HydrophobicContact CD2-CG 3.97Å; E60-W64 PolarHBondContact O-N 3.36Å; R61-W64 CarbonylContact O-C 3.59Å; R61-W64 WeakPolarHBondContact O-CA 3.44Å; R61-W64 WeakPolarHBondContact O-CB 3.48Å; R61-W64 PolarHBondContact O-N 2.94Å; W64-K66 PolarHBondContact O-N 2.99Å; W64-F67 PolarHBondContact O-N 3.09Å; W64-H68 WeakPolarHBondContact O-CB 3.37Å; W64-H68 PolarHBondContact O-N 2.87Å; W64-M74 HydrophobicContact CH2-CE 3.65Å; W64-M74 HydrophobicContact CZ3-CE 3.75Å; W64-P85 HydrophobicContact CD2-CB 4.18Å; W64-P85 HydrophobicContact CD2-CG 4.16Å; W64-P85 HydrophobicContact CE3-CG 4.43Å; W64-P85 WeakPolarHBondContact CH2-O 3.27Å; W64-P85 HydrophobicContact CZ2-CB 3.89Å; W64-P85 VanDerWaalsContact CZ2-O 3.28Å; W64-P85 WeakPolarHBondContact CZ2-O 3.37Å; W64-Y87 HydrophobicContact CZ2-CD2 4.46Å; W64-E208 HydrophobicContact CB-CG 4.47Å; W64-T209 HydrophobicContact CD2-CG2 3.81Å; W64-T209 HydrophobicContact CE3-CG2 3.89Å; W64-T209 HydrophobicContact CG-CG2 4.27Å; W64-T209 HydrophobicContact CH2-CG2 4.4Å; W64-T209 HydrophobicContact CZ2-CG2 4.35Å; W64-T209 HydrophobicContact CZ3-CG2 4.18Å
65	L	98.3	Very high	97.9	Very high	7 Å²	7	48.2 Å²	48.2	4%	0.037	23%	0.228	C	C	.	.	H	α-helix	trans	-61.1	-41.6	176.7	-67.8	172.8	0	0	0	112.2	R61 F67 H68 E69 E208	R61-L65 HydrophobicContact CG-CD1 4.32Å; R61-L65 HydrophobicContact CG-CG 4.43Å; R61-L65 WeakPolarHBondContact O-CG 3.42Å; R61-L65 PolarHBondContact O-N 3.46Å; L65-F67 VanDerWaalsContact C-N 3.33Å; L65-F67 PolarHBondContact O-N 2.91Å; L65-H68 PolarHBondContact O-N 3.46Å; L65-H68 VanDerWaalsContact O-N 3.13Å; L65-E69 PolarHBondContact O-N 3.43Å; L65-E208 HydrophobicContact CD2-CB 3.72Å; L65-E208 HydrophobicContact CD2-CG 4.41Å
66	K	98.2	Very high	98.1	Very high	110 Å²	110	41.9 Å²	41.9	48%	0.478	20%	0.201	S	C	.	.	H	α-helix	trans	-60.6	-37.8	174	-73.9	175.4	-179.1	-172.5	0	113.4	E62 L63 W64 V70	E62-K66 WeakPolarHBondContact O-CG 3.49Å; E62-K66 PolarHBondContact O-N 2.77Å; E62-K66 VanDerWaalsContact O-N 3.1Å; L63-K66 PolarHBondContact O-N 2.85Å; W64-K66 PolarHBondContact O-N 2.99Å; K66-V70 WeakPolarHBondContact O-CG2 3.35Å
67	F	98.4	Very high	98.1	Very high	0 Å²	0	43.8 Å²	43.8	0%	0	21%	0.212	C	C	.	.	H	α-helix	trans	-72.1	-38.4	172	-81.7	-71.5	0	0	0	112.2	L63 W64 L65 V70 G71 T72 F84 P85 I222 L225 K226	L63-F67 HydrophobicContact CD1-CD2 4.22Å; L63-F67 HydrophobicContact CD1-CE2 3.83Å; L63-F67 HydrophobicContact CG-CD2 4.23Å; L63-F67 HydrophobicContact CG-CE2 4.07Å; L63-F67 VanDerWaalsContact O-CD2 3.28Å; L63-F67 WeakPolarHBondContact O-CD2 3.42Å; L63-F67 PolarHBondContact O-N 3.1Å; W64-F67 PolarHBondContact O-N 3.09Å; L65-F67 VanDerWaalsContact C-N 3.33Å; L65-F67 PolarHBondContact O-N 2.91Å; F67-V70 PolarHBondContact O-N 3.18Å; F67-G71 CarbonylContact O-C 3.51Å; F67-G71 PolarHBondContact O-N 3.07Å; F67-G71 VanDerWaalsContact O-N 3.08Å; F67-T72 VanDerWaalsContact C-OG1 3.23Å; F67-T72 HydrophobicContact CB-CG2 4.12Å; F67-T72 PolarHBondContact O-N 2.9Å; F67-T72 PolarHBondContact O-OG1 3.45Å; F67-F84 HydrophobicContact CE2-CD1 4.33Å; F67-F84 AromaticContact CE2-CE1 3.94Å; F67-F84 HydrophobicContact CE2-CE1 3.94Å; F67-F84 HydrophobicContact CZ-CD1 4.17Å; F67-F84 AromaticContact CZ-CE1 3.97Å; F67-F84 HydrophobicContact CZ-CE1 3.97Å; F67-P85 HydrophobicContact CD2-CG 3.4Å; F67-P85 VanDerWaalsContact CD2-CG 3.4Å; F67-P85 HydrophobicContact CE2-CG 3.57Å; F67-P85 HydrophobicContact CG-CG 4.43Å; F67-I222 HydrophobicContact CD1-CD1 3.96Å; F67-I222 HydrophobicContact CD1-CG2 4.3Å; F67-I222 HydrophobicContact CE1-CG2 4.21Å; F67-L225 HydrophobicContact CD1-CB 4.17Å; F67-L225 HydrophobicContact CD1-CD1 4.19Å; F67-L225 HydrophobicContact CE1-CB 3.43Å; F67-L225 VanDerWaalsContact CE1-CB 3.43Å; F67-L225 HydrophobicContact CE1-CD1 4.28Å; F67-L225 HydrophobicContact CE2-CB 4.5Å; F67-L225 HydrophobicContact CZ-CB 3.63Å; F67-K226 HydrophobicContact CE1-CD 3.6Å; F67-K226 HydrophobicContact CE1-CG 3.94Å; F67-K226 HydrophobicContact CZ-CD 3.77Å; F67-K226 HydrophobicContact CZ-CG 4.25Å
68	H	98.1	Very high	98.1	Very high	59 Å²	59	46 Å²	46	27%	0.273	22%	0.222	S	C	.	.	H	α-helix	trans	-64.1	-45.2	-178.8	-172.3	82.9	0	0	0	112.4	W64 L65 V70 G71 T72 P207	W64-H68 WeakPolarHBondContact O-CB 3.37Å; W64-H68 PolarHBondContact O-N 2.87Å; L65-H68 PolarHBondContact O-N 3.46Å; L65-H68 VanDerWaalsContact O-N 3.13Å; H68-V70 PolarHBondContact O-N 3.2Å; H68-G71 PolarHBondContact O-N 3.1Å; H68-T72 WeakPolarHBondContact CA-OG1 3.34Å; H68-T72 PolarHBondContact N-OG1 3.38Å; H68-P207 PolarHBondContact CE1-O 3.49Å; H68-P207 PolarHBondContact ND1-O 2.62Å
69	E	97.6	Very high	98.1	Very high	93 Å²	93	48.3 Å²	48.3	44%	0.435	24%	0.243	S	C	.	.	H	α-helix	trans	-62.4	-29.2	178.7	-179.3	162.1	-156.3	0	0	113	K37 L65	K37-E69 WeakPolarHBondContact CD-OE1 3.4Å; K37-E69 WeakPolarHBondContact CE-OE1 3.28Å; K37-E69 IonicContact NZ-OE1 2.71Å; K37-E69 PolarHBondContact NZ-OE1 2.98Å; L65-E69 PolarHBondContact O-N 3.43Å
70	V	97.3	Very high	98.1	Very high	42 Å²	42	45.8 Å²	45.8	26%	0.255	23%	0.234	S	C	.	.	H	α-helix	trans	-88.3	-12.5	176.2	-177.3	0	0	0	0	112.3	K66 F67 H68 N219 K221 I222 L225	K66-V70 WeakPolarHBondContact O-CG2 3.35Å; F67-V70 PolarHBondContact O-N 3.18Å; H68-V70 PolarHBondContact O-N 3.2Å; V70-N219 WeakPolarHBondContact CG1-ND2 3.27Å; V70-N219 PolarHBondContact O-ND2 3.27Å; V70-K221 HydrophobicContact CG1-CB 3.58Å; V70-I222 HydrophobicContact CB-CD1 3.74Å; V70-I222 HydrophobicContact CG1-CD1 3.53Å; V70-I222 HydrophobicContact CG1-CG1 3.84Å; V70-L225 HydrophobicContact CB-CD1 4.37Å; V70-L225 HydrophobicContact CG2-CD1 3.96Å
71	G	97.4	Very high	98.2	Very high	24 Å²	24	48 Å²	48	25%	0.247	24%	0.239	C	C	.	.			trans	87.7	87.8	-174.1	0	0	0	0	0	112.1	F67 H68 E73 I222	F67-G71 CarbonylContact O-C 3.51Å; F67-G71 PolarHBondContact O-N 3.07Å; F67-G71 VanDerWaalsContact O-N 3.08Å; H68-G71 PolarHBondContact O-N 3.1Å; G71-E73 PolarHBondContact O-N 3.11Å; G71-I222 VanDerWaalsContact O-CD1 3.29Å; G71-I222 WeakPolarHBondContact O-CD1 3.46Å
72	T	98.7	Very high	98.2	Very high	4 Å²	4	50.3 Å²	50.3	3%	0.025	25%	0.247	C	C	.	.			trans	-54.6	126.3	-173.8	-49.2	0	0	0	0	113.1	F67 H68 M74 A210 F211 I212	F67-T72 VanDerWaalsContact C-OG1 3.23Å; F67-T72 HydrophobicContact CB-CG2 4.12Å; F67-T72 PolarHBondContact O-N 2.9Å; F67-T72 PolarHBondContact O-OG1 3.45Å; H68-T72 WeakPolarHBondContact CA-OG1 3.34Å; H68-T72 PolarHBondContact N-OG1 3.38Å; T72-M74 HydrophobicContact CG2-CE 4.09Å; T72-A210 WeakPolarHBondContact CB-O 3.02Å; T72-A210 PolarHBondContact OG1-O 2.93Å; T72-F211 HydrophobicContact CG2-CB 3.68Å; T72-F211 CarbonylContact O-C 3.55Å; T72-F211 WeakPolarHBondContact O-CA 3.31Å; T72-F211 WeakPolarHBondContact O-CB 3.4Å; T72-I212 PolarHBondContact O-N 3.3Å
73	E	98.8	Very high	98.2	Very high	0 Å²	0	46.1 Å²	46.1	0%	0	23%	0.228	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-110.3	145.9	169.3	-59.5	173	-159.1	0	0	111.5	G71 W121 I212 V214 Y217 Q218 N219 I222 K226	G71-E73 PolarHBondContact O-N 3.11Å; E73-W121 HydrophobicContact CG-CZ2 3.95Å; E73-I212 WeakPolarHBondContact CA-O 3.25Å; E73-V214 HydrophobicContact CB-CG2 4Å; E73-Y217 HydrophobicContact CB-CD1 4.07Å; E73-Y217 HydrophobicContact CB-CE1 4.41Å; E73-Y217 WeakPolarHBondContact OE2-CA 3.33Å; E73-Y217 WeakPolarHBondContact OE2-CD1 3.34Å; E73-Q218 PolarHBondContact OE2-N 3.48Å; E73-N219 WeakPolarHBondContact OE1-CB 3.48Å; E73-N219 PolarHBondContact OE1-N 2.98Å; E73-I222 HydrophobicContact CB-CG2 4.08Å; E73-I222 HydrophobicContact CG-CG1 4.31Å; E73-I222 HydrophobicContact CG-CG2 4.49Å; E73-K226 VanDerWaalsContact O-CE 3.27Å; E73-K226 WeakPolarHBondContact O-CE 3.31Å; E73-K226 PolarHBondContact O-NZ 3.45Å
74	M	98.8	Very high	98.3	Very high	4 Å²	4	46.1 Å²	46.1	2%	0.02	23%	0.227	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-127.5	126.4	171.5	-66	-68	-176.8	0	0	111.1	W64 T72 M83 F84 L160 F211 I212 V214	W64-M74 HydrophobicContact CH2-CE 3.65Å; W64-M74 HydrophobicContact CZ3-CE 3.75Å; T72-M74 HydrophobicContact CG2-CE 4.09Å; M74-M83 HydrophobicContact CE-CB 4.05Å; M74-M83 HydrophobicContact CE-CG 4.42Å; M74-M83 HydrophobicContact SD-CB 3.94Å; M74-M83 HydrophobicContact SD-CG 4.18Å; M74-F84 WeakPolarHBondContact CE-O 3.48Å; M74-L160 HydrophobicContact CB-CD1 3.92Å; M74-L160 HydrophobicContact CG-CD1 4.45Å; M74-F211 HydrophobicContact CB-CD2 3.56Å; M74-F211 HydrophobicContact CB-CE2 3.7Å; M74-F211 HydrophobicContact CB-CG 4.1Å; M74-F211 HydrophobicContact CB-CZ 4.31Å; M74-F211 HydrophobicContact CG-CB 3.91Å; M74-F211 HydrophobicContact CG-CD1 3.79Å; M74-F211 HydrophobicContact CG-CD2 3.47Å; M74-F211 VanDerWaalsContact CG-CD2 3.47Å; M74-F211 HydrophobicContact CG-CE1 4.11Å; M74-F211 HydrophobicContact CG-CE2 3.85Å; M74-F211 HydrophobicContact CG-CG 3.45Å; M74-F211 VanDerWaalsContact CG-CG 3.45Å; M74-F211 HydrophobicContact CG-CZ 4.15Å; M74-I212 PolarHBondContact N-O 2.88Å; M74-V214 PolarHBondContact O-N 3.14Å
75	I	98.7	Very high	98.2	Very high	27 Å²	27	46.1 Å²	46.1	14%	0.138	23%	0.227	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-69.4	130.9	176.5	-61.3	-70.5	0	0	0	110.4	T77 R81 V214 Y217	I75-T77 HydrophobicContact CG2-CG2 3.83Å; I75-R81 HydrophobicContact CB-CG 4.08Å; I75-R81 HydrophobicContact CG2-CG 4.03Å; I75-R81 WeakPolarHBondContact O-CB 3.33Å; I75-R81 WeakPolarHBondContact O-CG 3.11Å; I75-V214 CarbonylContact C-O 3.59Å; I75-V214 VanDerWaalsContact CA-O 3.25Å; I75-V214 WeakPolarHBondContact CA-O 3.46Å; I75-V214 HydrophobicContact CD1-CG2 4.19Å; I75-Y217 HydrophobicContact CD1-CD1 3.81Å; I75-Y217 HydrophobicContact CD1-CD2 4.11Å; I75-Y217 HydrophobicContact CD1-CE1 3.82Å; I75-Y217 HydrophobicContact CD1-CE2 4.12Å; I75-Y217 HydrophobicContact CD1-CG 3.95Å; I75-Y217 HydrophobicContact CG1-CD1 4.12Å; I75-Y217 HydrophobicContact CG1-CD2 4.45Å; I75-Y217 HydrophobicContact CG1-CE1 3.56Å; I75-Y217 HydrophobicContact CG1-CE2 3.95Å; I75-Y217 VanDerWaalsContact CG1-CZ 3.46Å
76	I	98.6	Very high	98.2	Very high	2 Å²	2	47 Å²	47	1%	0.01	23%	0.233	C	C	.	.			trans	-114.5	139.7	170.6	65.8	177.7	0	0	0	110.6	L160 N162 L173 A213 V214 T215	I76-L160 HydrophobicContact CG2-CB 3.73Å; I76-L160 HydrophobicContact CG2-CD1 4.36Å; I76-N162 HydrophobicContact CD1-CB 3.7Å; I76-N162 HydrophobicContact CG1-CB 3.99Å; I76-L173 HydrophobicContact CD1-CB 4.47Å; I76-L173 WeakPolarHBondContact CD1-O 3.37Å; I76-L173 HydrophobicContact CG2-CB 4.48Å; I76-L173 HydrophobicContact CG2-CD1 4.26Å; I76-A213 HydrophobicContact CD1-CB 4.22Å; I76-A213 HydrophobicContact CG2-CB 4.01Å; I76-V214 PolarHBondContact N-O 3.01Å; I76-T215 HydrophobicContact CG1-CG2 4.47Å
77	T	98.5	Very high	98.2	Very high	52 Å²	52	41.7 Å²	41.7	32%	0.319	21%	0.21	S	C	.	.			trans	-144.4	156.6	-179.5	71.8	0	0	0	0	112.3	I75 A79 G80 R81 T161	I75-T77 HydrophobicContact CG2-CG2 3.83Å; T77-A79 PolarHBondContact O-N 2.83Å; T77-G80 PolarHBondContact O-N 2.89Å; T77-R81 HydrophobicContact CG2-CB 4.31Å; T77-T161 WeakPolarHBondContact O-CA 3.29Å; T77-T161 WeakPolarHBondContact O-CB 3.38Å; T77-T161 PolarHBondContact O-OG1 2.99Å
78	K	97.8	Very high	98.2	Very high	159 Å²	159	43.6 Å²	43.6	69%	0.691	22%	0.218	S	C	*	.	T	Hydrogen-bonded Turn	trans	-52.8	-30.4	-178.3	-176.1	173.7	-176.9	176.6	0	114.5	T161 N162 N163	K78-T161 PolarHBondContact O-OG1 2.83Å; K78-N162 PolarHBondContact N-OD1 2.83Å; K78-N163 HydrophobicContact CG-CB 4.16Å
79	A	97.8	Very high	98.3	Very high	65 Å²	65	40.8 Å²	40.8	54%	0.537	21%	0.205	S	C	.	.	T	Hydrogen-bonded Turn	trans	-94.9	2.7	-179.7	0	0	0	0	0	114.1	T77 K159 H170	T77-A79 PolarHBondContact O-N 2.83Å; A79-K159 PolarHBondContact O-NZ 2.96Å; A79-H170 PolarHBondContact O-CE1 3.28Å
80	G	98.1	Very high	98.3	Very high	9 Å²	9	42 Å²	42	9%	0.093	21%	0.209	C	C	.	.			trans	78	122.5	-177.7	0	0	0	0	0	113.7	T77 K159 L160	T77-G80 PolarHBondContact O-N 2.89Å; G80-K159 WeakPolarHBondContact O-CD 3.34Å; G80-K159 WeakPolarHBondContact O-CE 3.47Å; G80-L160 CarbonylContact C-O 3.48Å; G80-L160 WeakPolarHBondContact CA-O 3.32Å
81	R	98.5	Very high	98.3	Very high	127 Å²	127	40 Å²	40	48%	0.479	20%	0.197	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-112.8	136.2	-179.1	-177.7	65.1	174.4	177.3	-2.2	111.1	I75 T77 K159 L160	I75-R81 HydrophobicContact CB-CG 4.08Å; I75-R81 HydrophobicContact CG2-CG 4.03Å; I75-R81 WeakPolarHBondContact O-CB 3.33Å; I75-R81 WeakPolarHBondContact O-CG 3.11Å; T77-R81 HydrophobicContact CG2-CB 4.31Å; R81-K159 CarbonylContact O-C 3.57Å; R81-K159 VanDerWaalsContact O-CA 3.3Å; R81-K159 WeakPolarHBondContact O-CA 3.17Å; R81-L160 PolarHBondContact N-O 2.8Å; R81-L160 PolarHBondContact O-N 3.1Å
82	R	98.4	Very high	98.3	Very high	145 Å²	145	41 Å²	41	55%	0.547	20%	0.198	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-72.9	144.1	175.9	-68.9	173.6	178.5	167	3.7	111.1	Q156 L158 K159	R82-Q156 WeakPolarHBondContact CD-O 3.47Å; R82-Q156 WeakPolarHBondContact CG-O 3.48Å; R82-L158 WeakPolarHBondContact CA-O 3.32Å; R82-K159 HydrophobicContact CG-CG 4.16Å
83	M	98.5	Very high	98.2	Very high	11 Å²	11	42.9 Å²	42.9	5%	0.054	22%	0.219	C	C	.	.			trans	-64.7	147.5	173.2	-65.2	-170.6	-68	0	0	111.8	M74 P85 M104 I106 L158 L160 F211	M74-M83 HydrophobicContact CE-CB 4.05Å; M74-M83 HydrophobicContact CE-CG 4.42Å; M74-M83 HydrophobicContact SD-CB 3.94Å; M74-M83 HydrophobicContact SD-CG 4.18Å; M83-P85 CarbonylContact C-O 3.59Å; M83-M104 HydrophobicContact CE-SD 4.2Å; M83-I106 HydrophobicContact SD-CD1 4.24Å; M83-L158 HydrophobicContact CE-CD1 4.26Å; M83-L158 HydrophobicContact CE-CD2 4.16Å; M83-L160 HydrophobicContact CG-CD1 3.73Å; M83-L160 HydrophobicContact CG-CD2 4.4Å; M83-L160 HydrophobicContact CG-CG 4.04Å; M83-L160 HydrophobicContact SD-CD1 4.28Å; M83-L160 HydrophobicContact SD-CD2 4.5Å; M83-F211 HydrophobicContact SD-CE1 4.12Å
84	F	98.4	Very high	98	Very high	29 Å²	29	43.1 Å²	43.1	13%	0.127	22%	0.22	C	C	.	.	S	Bend	trans	-141.3	124	163.3	-174.8	-88.9	0	0	0	109.7	L63 F67 M74 K226 N229 N230	L63-F84 HydrophobicContact CD2-CZ 4.22Å; F67-F84 HydrophobicContact CE2-CD1 4.33Å; F67-F84 AromaticContact CE2-CE1 3.94Å; F67-F84 HydrophobicContact CE2-CE1 3.94Å; F67-F84 HydrophobicContact CZ-CD1 4.17Å; F67-F84 AromaticContact CZ-CE1 3.97Å; F67-F84 HydrophobicContact CZ-CE1 3.97Å; M74-F84 WeakPolarHBondContact CE-O 3.48Å; F84-K226 HydrophobicContact CD1-CD 3.82Å; F84-K226 PolarHBondContact O-NZ 3.05Å; F84-N229 HydrophobicContact CE1-CB 3.97Å; F84-N229 VanDerWaalsContact CZ-C 3.43Å; F84-N229 HydrophobicContact CZ-CB 3.91Å; F84-N229 WeakPolarHBondContact CZ-O 3.5Å; F84-N230 HydrophobicContact CD1-CB 3.98Å; F84-N230 HydrophobicContact CD2-CB 3.91Å; F84-N230 HydrophobicContact CE1-CB 3.85Å; F84-N230 HydrophobicContact CE2-CB 3.79Å; F84-N230 HydrophobicContact CG-CB 4.02Å; F84-N230 VanDerWaalsContact CZ-CA 3.48Å; F84-N230 HydrophobicContact CZ-CB 3.77Å
85	P	98.3	Very high	97.9	Very high	0 Å²	0	46.7 Å²	46.7	0%	0	24%	0.239	C	C	.	.	S	Bend	cis	-61.1	155.4	2	-21	33.5	0	0	0	113.2	L63 W64 F67 M83	L63-P85 HydrophobicContact CD2-CB 4.13Å; L63-P85 HydrophobicContact CD2-CG 3.97Å; L63-P85 HydrophobicContact CG-CB 4.48Å; L63-P85 HydrophobicContact CG-CG 3.88Å; W64-P85 HydrophobicContact CD2-CB 4.18Å; W64-P85 HydrophobicContact CD2-CG 4.16Å; W64-P85 HydrophobicContact CE3-CG 4.43Å; W64-P85 WeakPolarHBondContact CH2-O 3.27Å; W64-P85 HydrophobicContact CZ2-CB 3.89Å; W64-P85 VanDerWaalsContact CZ2-O 3.28Å; W64-P85 WeakPolarHBondContact CZ2-O 3.37Å; F67-P85 HydrophobicContact CD2-CG 3.4Å; F67-P85 VanDerWaalsContact CD2-CG 3.4Å; F67-P85 HydrophobicContact CE2-CG 3.57Å; F67-P85 HydrophobicContact CG-CG 4.43Å; M83-P85 CarbonylContact C-O 3.59Å
86	S	98	Very high	97.8	Very high	24 Å²	24	49 Å²	49	17%	0.168	26%	0.256	C	S	.	.	P	Polyproline II helix	trans	-76.5	126.4	177.7	-63.4	0	0	0	0	109.2	K88	S86-K88 PolarHBondContact O-N 2.95Å; S86-K88 VanDerWaalsContact O-N 3.16Å
87	Y	98.6	Very high	97.6	Very high	0 Å²	0	57.4 Å²	57.4	0%	0	29%	0.293	C	S	.	.	P	Polyproline II helix	trans	-66.6	117.4	175.7	-165.9	-77	0	0	0	109.9	L58 W64 V89 M104 F155 P181 L183 F206 T209	L58-Y87 HydrophobicContact CD1-CD2 4.44Å; L58-Y87 HydrophobicContact CD1-CE2 4.36Å; W64-Y87 HydrophobicContact CZ2-CD2 4.46Å; Y87-V89 HydrophobicContact CD1-CG1 4.28Å; Y87-V89 HydrophobicContact CE1-CG1 3.63Å; Y87-M104 HydrophobicContact CD1-CE 3.36Å; Y87-M104 HydrophobicContact CD1-SD 4.47Å; Y87-M104 HydrophobicContact CD2-CE 3.78Å; Y87-M104 HydrophobicContact CE1-CE 3.29Å; Y87-M104 HydrophobicContact CE2-CE 3.7Å; Y87-M104 HydrophobicContact CG-CE 3.59Å; Y87-M104 HydrophobicContact CG-SD 4.4Å; Y87-M104 VanDerWaalsContact CZ-CE 3.44Å; Y87-F155 HydrophobicContact CD1-CD2 4Å; Y87-F155 HydrophobicContact CD1-CG 4.49Å; Y87-F155 WeakPolarHBondContact O-CB 3.4Å; Y87-F155 PolarHBondContact O-N 2.97Å; Y87-P181 HydrophobicContact CD2-CB 4.26Å; Y87-P181 HydrophobicContact CE2-CB 4.06Å; Y87-L183 HydrophobicContact CE1-CB 4.42Å; Y87-F206 HydrophobicContact CE2-CD2 4.21Å; Y87-F206 AromaticContact CZ-CD2 3.9Å; Y87-F206 VanDerWaalsContact OH-CD2 3.27Å; Y87-F206 WeakPolarHBondContact OH-CD2 3.48Å; Y87-T209 HydrophobicContact CD2-CG2 4.05Å; Y87-T209 HydrophobicContact CE2-CG2 3.9Å
88	K	98.4	Very high	97.4	Very high	39 Å²	39	56.1 Å²	56.1	17%	0.17	29%	0.285	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-138.7	140.8	-175.8	-66.7	162.9	178.7	173.3	0	108.5	H59 E60 S86 V153	H59-K88 HydrophobicContact CB-CB 3.93Å; H59-K88 VanDerWaalsContact CD2-CD 3.45Å; H59-K88 WeakPolarHBondContact CD2-CD 3.43Å; H59-K88 PolarHBondContact N-O 2.83Å; E60-K88 IonicContact OE1-NZ 3.28Å; E60-K88 PolarHBondContact OE1-NZ 3.2Å; E60-K88 WeakPolarHBondContact OE2-CD 3.31Å; E60-K88 IonicContact OE2-NZ 3.68Å; E60-K88 PolarHBondContact OE2-NZ 2.99Å; S86-K88 PolarHBondContact O-N 2.95Å; S86-K88 VanDerWaalsContact O-N 3.16Å; K88-V153 CarbonylContact C-O 3.54Å; K88-V153 VanDerWaalsContact CA-O 3.28Å; K88-V153 WeakPolarHBondContact CA-O 3.5Å
89	V	98.6	Very high	97.4	Very high	0 Å²	0	52.2 Å²	52.2	0%	0	27%	0.268	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-136.8	149.7	178.7	-65	0	0	0	0	112.8	V56 F57 Y87 V91 V153 L183 F206	V56-V89 HydrophobicContact CG1-CB 3.7Å; V56-V89 HydrophobicContact CG1-CG1 3.71Å; V56-V89 HydrophobicContact CG1-CG2 4.14Å; F57-V89 CarbonylContact O-C 3.55Å; F57-V89 VanDerWaalsContact O-CA 3.27Å; F57-V89 WeakPolarHBondContact O-CA 3.4Å; Y87-V89 HydrophobicContact CD1-CG1 4.28Å; Y87-V89 HydrophobicContact CE1-CG1 3.63Å; V89-V91 HydrophobicContact CG2-CG2 3.98Å; V89-V153 HydrophobicContact CG2-CB 3.95Å; V89-V153 PolarHBondContact N-O 3.46Å; V89-V153 PolarHBondContact O-N 3.22Å; V89-L183 HydrophobicContact CG1-CD2 4.44Å; V89-L183 HydrophobicContact CG2-CD2 3.99Å; V89-F206 HydrophobicContact CG1-CE2 3.98Å
90	K	98.1	Very high	97.4	Very high	118 Å²	118	49.4 Å²	49.4	51%	0.513	24%	0.243	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-97.3	129.7	160.2	-174.6	178.5	-179.3	179.8	0	108.2	V56 F57 L152	V56-K90 WeakPolarHBondContact CA-O 3.39Å; F57-K90 HydrophobicContact CB-CB 4.44Å; F57-K90 PolarHBondContact N-O 3.02Å; F57-K90 PolarHBondContact O-N 3.14Å; K90-L152 HydrophobicContact CB-CD2 3.95Å
91	V	97.8	Very high	97.4	Very high	1 Å²	1	50.8 Å²	50.8	1%	0.006	25%	0.248	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-111.2	144	177.5	-170.1	0	0	0	0	109.5	I54 V56 V89 L94 L102 M149 V153 I185	I54-V91 HydrophobicContact CG2-CG1 4.3Å; V56-V91 HydrophobicContact CG2-CG1 4.26Å; V56-V91 HydrophobicContact CG2-CG2 4.37Å; V89-V91 HydrophobicContact CG2-CG2 3.98Å; V91-L94 HydrophobicContact CB-CD1 4.4Å; V91-L94 HydrophobicContact CG1-CD1 3.72Å; V91-L94 HydrophobicContact CG1-CD2 4.23Å; V91-L94 HydrophobicContact CG1-CG 3.84Å; V91-L102 HydrophobicContact CG2-CD2 4.33Å; V91-M149 WeakPolarHBondContact O-CG 3.41Å; V91-V153 HydrophobicContact CG2-CG2 4.24Å; V91-I185 HydrophobicContact CG1-CD1 4.04Å
92	T	97.2	Very high	97.4	Very high	44 Å²	44	44.7 Å²	44.7	27%	0.27	23%	0.225	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-143.8	158.5	178.3	57.6	0	0	0	0	110.1	I54 K55 F57	I54-T92 WeakPolarHBondContact CA-O 3.3Å; K55-T92 PolarHBondContact N-O 3.05Å; K55-T92 PolarHBondContact O-N 3.03Å; K55-T92 PolarHBondContact O-OG1 2.79Å; K55-T92 VanDerWaalsContact O-OG1 3.1Å; F57-T92 HydrophobicContact CE2-CG2 4.26Å
93	G	95.6	Very high	97.3	Very high	44 Å²	44	38.8 Å²	38.8	45%	0.454	20%	0.204	S	C	.	.	S	Bend	trans	81	10.3	178.6	0	0	0	0	0	115.5	M149	G93-M149 PolarHBondContact N-SD 2.71Å; G93-M149 VanDerWaalsContact N-SD 3.45Å
94	L	96.1	Very high	97.3	Very high	6 Å²	6	38.3 Å²	38.3	3%	0.031	20%	0.202	C	C	.	.			trans	-74.4	146.8	169.2	-59.9	174.1	0	0	0	110.2	I54 V91 P96 Y100 W148 M149 I185	I54-L94 HydrophobicContact CD1-CD2 3.62Å; I54-L94 HydrophobicContact CG1-CD2 3.93Å; I54-L94 HydrophobicContact CG2-CD2 4.19Å; V91-L94 HydrophobicContact CB-CD1 4.4Å; V91-L94 HydrophobicContact CG1-CD1 3.72Å; V91-L94 HydrophobicContact CG1-CD2 4.23Å; V91-L94 HydrophobicContact CG1-CG 3.84Å; L94-P96 WeakPolarHBondContact O-CD 3.21Å; L94-Y100 HydrophobicContact CB-CD2 4.44Å; L94-Y100 HydrophobicContact CB-CE2 3.84Å; L94-Y100 HydrophobicContact CD1-CD2 4.46Å; L94-Y100 HydrophobicContact CD2-CD1 3.89Å; L94-Y100 HydrophobicContact CD2-CD2 4.24Å; L94-Y100 HydrophobicContact CD2-CE1 3.64Å; L94-Y100 HydrophobicContact CD2-CE2 4.03Å; L94-Y100 HydrophobicContact CD2-CG 4.18Å; L94-Y100 HydrophobicContact CG-CE2 4.39Å; L94-W148 HydrophobicContact CD1-CB 3.51Å; L94-W148 HydrophobicContact CD1-CG 4.22Å; L94-M149 HydrophobicContact CB-CE 4.16Å; L94-M149 HydrophobicContact CB-CG 4.15Å; L94-M149 HydrophobicContact CB-SD 3.92Å; L94-M149 HydrophobicContact CD1-CG 4.06Å; L94-M149 HydrophobicContact CG-CG 4.28Å; L94-M149 HydrophobicContact CG-SD 4.45Å; L94-M149 PolarHBondContact N-SD 2.94Å; L94-M149 WeakPolarHBondContact O-CE 3.36Å; L94-I185 HydrophobicContact CD2-CG2 4.11Å
95	N	95.2	Very high	97.3	Very high	78 Å²	78	37.6 Å²	37.6	42%	0.417	20%	0.199	S	C	.	.			trans	-66.4	122.9	169.6	-179.9	-38.8	0	0	0	108.8	K97 T98 Y100 G145	N95-K97 PolarHBondContact O-N 3.27Å; N95-K97 VanDerWaalsContact O-N 3.09Å; N95-K97 PolarHBondContact OD1-N 3.42Å; N95-T98 WeakPolarHBondContact CB-OG1 3.23Å; N95-T98 VanDerWaalsContact CG-OG1 3.24Å; N95-T98 PolarHBondContact ND2-OG1 2.74Å; N95-T98 PolarHBondContact O-N 3.25Å; N95-T98 PolarHBondContact OD1-N 2.92Å; N95-Y100 PolarHBondContact N-OH 3.43Å; N95-G145 WeakPolarHBondContact O-CA 3.31Å
96	P	96.5	Very high	97.3	Very high	75 Å²	75	38.2 Å²	38.2	49%	0.487	20%	0.202	S	C	.	.	S	Bend	trans	-57	-28.3	-175.9	-29.1	37	0	0	0	115.2	L94 T144 A146 M149	L94-P96 WeakPolarHBondContact O-CD 3.21Å; P96-T144 WeakPolarHBondContact O-CB 3.36Å; P96-A146 HydrophobicContact CB-CB 4.12Å; P96-A146 VanDerWaalsContact O-CB 3.27Å; P96-A146 WeakPolarHBondContact O-CB 3.18Å; P96-A146 PolarHBondContact O-N 3.44Å; P96-A146 VanDerWaalsContact O-N 3.1Å; P96-M149 HydrophobicContact CG-CE 4.27Å
97	K	95.6	Very high	97.2	Very high	180 Å²	180	38.9 Å²	38.9	78%	0.783	21%	0.205	S	C	*	.	S	Bend	trans	-96.1	-32.1	-174	-61.7	-177.4	-179.8	-179.6	0	113.8	N95	N95-K97 PolarHBondContact O-N 3.27Å; N95-K97 VanDerWaalsContact O-N 3.09Å; N95-K97 PolarHBondContact OD1-N 3.42Å
98	T	94.9	Very high	97.2	Very high	24 Å²	24	42 Å²	42	15%	0.147	23%	0.226	C	C	.	.	S	Bend	trans	-67.6	141.5	179	-50.5	0	0	0	0	111.1	N95 Y100 T144 G145 K187 A188	N95-T98 WeakPolarHBondContact CB-OG1 3.23Å; N95-T98 VanDerWaalsContact CG-OG1 3.24Å; N95-T98 PolarHBondContact ND2-OG1 2.74Å; N95-T98 PolarHBondContact O-N 3.25Å; N95-T98 PolarHBondContact OD1-N 2.92Å; T98-Y100 HydrophobicContact CG2-CE2 4.29Å; T98-Y100 WeakPolarHBondContact O-CD2 3.25Å; T98-Y100 WeakPolarHBondContact O-CE2 3.28Å; T98-T144 CarbonylContact O-C 3.52Å; T98-T144 VanDerWaalsContact O-CA 3.31Å; T98-T144 WeakPolarHBondContact O-CA 3.2Å; T98-G145 PolarHBondContact O-N 2.86Å; T98-K187 HydrophobicContact CG2-CG 4.08Å; T98-A188 HydrophobicContact CG2-CB 4.26Å
99	K	96.7	Very high	97.1	Very high	78 Å²	78	42.2 Å²	42.2	34%	0.339	24%	0.235	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-77.3	148	169.7	-71.6	170.7	-172.8	171.5	0	111.4	A143 A188 N192 F194	K99-A143 CarbonylContact C-O 3.55Å; K99-A143 WeakPolarHBondContact CA-O 3.27Å; K99-A188 HydrophobicContact CB-CB 3.99Å; K99-A188 WeakPolarHBondContact O-CB 3.39Å; K99-A188 PolarHBondContact O-N 3.07Å; K99-N192 WeakPolarHBondContact CB-OD1 3.48Å; K99-N192 VanDerWaalsContact CG-OD1 3.25Å; K99-N192 WeakPolarHBondContact CG-OD1 3.12Å; K99-N192 PolarHBondContact N-OD1 2.95Å; K99-F194 HydrophobicContact CB-CE2 4.31Å; K99-F194 HydrophobicContact CB-CZ 3.98Å
100	Y	97.5	Very high	97	Very high	5 Å²	5	44.2 Å²	44.2	2%	0.02	25%	0.246	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-134.7	144.3	172.3	-60.8	-97.2	0	0	0	109.8	I54 L94 N95 T98 A143 W148 I185 V186 K187	I54-Y100 HydrophobicContact CD1-CE1 4.31Å; L94-Y100 HydrophobicContact CB-CD2 4.44Å; L94-Y100 HydrophobicContact CB-CE2 3.84Å; L94-Y100 HydrophobicContact CD1-CD2 4.46Å; L94-Y100 HydrophobicContact CD2-CD1 3.89Å; L94-Y100 HydrophobicContact CD2-CD2 4.24Å; L94-Y100 HydrophobicContact CD2-CE1 3.64Å; L94-Y100 HydrophobicContact CD2-CE2 4.03Å; L94-Y100 HydrophobicContact CD2-CG 4.18Å; L94-Y100 HydrophobicContact CG-CE2 4.39Å; N95-Y100 PolarHBondContact N-OH 3.43Å; T98-Y100 HydrophobicContact CG2-CE2 4.29Å; T98-Y100 WeakPolarHBondContact O-CD2 3.25Å; T98-Y100 WeakPolarHBondContact O-CE2 3.28Å; Y100-A143 PolarHBondContact N-O 3.18Å; Y100-A143 PolarHBondContact O-N 2.87Å; Y100-A143 VanDerWaalsContact O-N 3.14Å; Y100-W148 PolarHBondContact O-NE1 3.1Å; Y100-I185 HydrophobicContact CD1-CG2 3.65Å; Y100-I185 HydrophobicContact CE1-CG2 4.35Å; Y100-I185 HydrophobicContact CG-CG2 4.36Å; Y100-V186 CarbonylContact C-O 3.53Å; Y100-V186 WeakPolarHBondContact CA-O 3.43Å; Y100-K187 HydrophobicContact CD1-CB 3.9Å; Y100-K187 HydrophobicContact CD1-CG 4.28Å; Y100-K187 HydrophobicContact CE1-CB 3.66Å; Y100-K187 HydrophobicContact CE1-CD 4.43Å; Y100-K187 HydrophobicContact CE1-CG 3.65Å
101	I	98	Very high	97	Very high	38 Å²	38	42.9 Å²	42.9	20%	0.195	24%	0.244	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-98	129.7	162.6	-66.9	167.8	0	0	0	106.9	L103 V137 P142 V186 F194	I101-L103 HydrophobicContact CG2-CD2 4.17Å; I101-V137 HydrophobicContact CG2-CG1 4Å; I101-P142 HydrophobicContact CG1-CB 3.86Å; I101-V186 HydrophobicContact CB-CB 4.38Å; I101-V186 PolarHBondContact N-O 2.86Å; I101-V186 PolarHBondContact O-N 3.02Å; I101-F194 HydrophobicContact CB-CE1 4.41Å; I101-F194 HydrophobicContact CD1-CD1 3.79Å; I101-F194 HydrophobicContact CD1-CD2 4.04Å; I101-F194 HydrophobicContact CD1-CE1 3.79Å; I101-F194 HydrophobicContact CD1-CE2 4.05Å; I101-F194 HydrophobicContact CD1-CG 3.91Å; I101-F194 HydrophobicContact CD1-CZ 3.92Å; I101-F194 HydrophobicContact CG1-CD1 4.31Å; I101-F194 HydrophobicContact CG1-CE1 3.77Å; I101-F194 HydrophobicContact CG1-CE2 4.14Å; I101-F194 HydrophobicContact CG1-CZ 3.68Å
102	L	98.3	Very high	97	Very high	0 Å²	0	46.6 Å²	46.6	0%	0	26%	0.261	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-107.1	127	170	-94.8	67	0	0	0	108.7	V91 H138 S141 W148 V153 F155 I185	V91-L102 HydrophobicContact CG2-CD2 4.33Å; L102-H138 HydrophobicContact CB-CB 4.29Å; L102-H138 VanDerWaalsContact O-CB 3.23Å; L102-H138 WeakPolarHBondContact O-CB 3.27Å; L102-H138 PolarHBondContact O-N 3.34Å; L102-S141 PolarHBondContact N-OG 2.99Å; L102-S141 PolarHBondContact O-OG 3.12Å; L102-W148 HydrophobicContact CB-CH2 3.95Å; L102-W148 HydrophobicContact CB-CZ2 4.09Å; L102-W148 HydrophobicContact CB-CZ3 4.21Å; L102-W148 HydrophobicContact CD1-CD2 3.96Å; L102-W148 HydrophobicContact CD1-CG 4.17Å; L102-W148 HydrophobicContact CD1-CZ2 4.25Å; L102-W148 HydrophobicContact CD2-CD2 4.12Å; L102-W148 HydrophobicContact CD2-CE3 3.9Å; L102-W148 HydrophobicContact CD2-CZ3 4.21Å; L102-W148 HydrophobicContact CG-CD2 4.48Å; L102-V153 HydrophobicContact CD2-CB 4.39Å; L102-V153 HydrophobicContact CD2-CG1 3.9Å; L102-V153 HydrophobicContact CD2-CG2 4.01Å; L102-F155 HydrophobicContact CB-CZ 4.45Å; L102-I185 HydrophobicContact CD1-CB 4.35Å; L102-I185 HydrophobicContact CD1-CG1 4.01Å; L102-I185 HydrophobicContact CD1-CG2 3.96Å; L102-I185 HydrophobicContact CG-CG1 4Å
103	L	97.9	Very high	97	Very high	21 Å²	21	49 Å²	49	11%	0.11	27%	0.265	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-140.9	160.8	179.3	67.2	87.1	0	0	0	110.9	I101 L135 Y136 V137 H184 V186	I101-L103 HydrophobicContact CG2-CD2 4.17Å; L103-L135 HydrophobicContact CD1-CB 4.4Å; L103-L135 HydrophobicContact CD1-CD1 4.21Å; L103-L135 HydrophobicContact CD1-CD2 4.15Å; L103-L135 HydrophobicContact CD1-CG 4.49Å; L103-L135 HydrophobicContact CD2-CD1 4.44Å; L103-Y136 CarbonylContact C-O 3.58Å; L103-Y136 VanDerWaalsContact CA-O 3.25Å; L103-Y136 WeakPolarHBondContact CA-O 3.37Å; L103-Y136 WeakPolarHBondContact CB-O 3.48Å; L103-V137 HydrophobicContact CB-CB 4.46Å; L103-V137 HydrophobicContact CB-CG2 4.14Å; L103-H184 HydrophobicContact CD1-CB 3.7Å; L103-H184 HydrophobicContact CG-CB 4.02Å; L103-H184 PolarHBondContact N-O 2.9Å; L103-H184 PolarHBondContact O-N 3.11Å; L103-V186 HydrophobicContact CD2-CG2 4.45Å
104	M	98.3	Very high	97.2	Very high	0 Å²	0	48.5 Å²	48.5	0%	0	25%	0.25	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-128.4	139.9	-179	166.2	160.2	-76.7	0	0	110.2	M83 Y87 Y136 F155 L158 P181 R182	M83-M104 HydrophobicContact CE-SD 4.2Å; Y87-M104 HydrophobicContact CD1-CE 3.36Å; Y87-M104 HydrophobicContact CD1-SD 4.47Å; Y87-M104 HydrophobicContact CD2-CE 3.78Å; Y87-M104 HydrophobicContact CE1-CE 3.29Å; Y87-M104 HydrophobicContact CE2-CE 3.7Å; Y87-M104 HydrophobicContact CG-CE 3.59Å; Y87-M104 HydrophobicContact CG-SD 4.4Å; Y87-M104 VanDerWaalsContact CZ-CE 3.44Å; M104-Y136 PolarHBondContact N-O 3.14Å; M104-Y136 PolarHBondContact O-N 3.19Å; M104-F155 HydrophobicContact CB-CD1 3.73Å; M104-F155 HydrophobicContact CB-CE1 3.7Å; M104-F155 HydrophobicContact SD-CB 4.42Å; M104-F155 HydrophobicContact SD-CD1 4.34Å; M104-F155 HydrophobicContact SD-CG 4.4Å; M104-L158 HydrophobicContact CB-CD1 4.19Å; M104-L158 HydrophobicContact CG-CD1 3.74Å; M104-L158 HydrophobicContact SD-CD1 3.49Å; M104-L158 WeakPolarHBondContact SD-CD1 3.41Å; M104-P181 HydrophobicContact CE-CB 4.15Å; M104-P181 HydrophobicContact SD-CB 4.48Å; M104-R182 WeakPolarHBondContact CA-O 3.47Å
105	D	97.5	Very high	97.2	Very high	15 Å²	15	53 Å²	53	8%	0.08	27%	0.269	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-121	172.2	161.1	86.7	2.2	0	0	0	111.3	L135 R182 H184	D105-L135 HydrophobicContact CB-CD2 3.72Å; D105-R182 PolarHBondContact N-O 2.97Å; D105-R182 VanDerWaalsContact N-O 3.17Å; D105-R182 PolarHBondContact O-N 3.38Å; D105-R182 WeakPolarHBondContact OD1-CB 3.49Å; D105-R182 WeakPolarHBondContact OD1-CG 3.27Å; D105-R182 IonicContact OD1-CZ 3.77Å; D105-R182 IonicContact OD1-NE 3.56Å; D105-R182 PolarHBondContact OD1-NE 3.49Å; D105-R182 IonicContact OD1-NH2 3.6Å; D105-R182 IonicContact OD2-CZ 2.74Å; D105-R182 IonicContact OD2-NE 2.68Å; D105-R182 PolarHBondContact OD2-NE 3.09Å; D105-R182 IonicContact OD2-NH2 3.49Å; D105-R182 PolarHBondContact OD2-NH2 2.79Å; D105-H184 IonicContact OD1-NE2 2.72Å; D105-H184 PolarHBondContact OD1-NE2 3.42Å; D105-H184 IonicContact OD2-NE2 3.05Å
106	I	98.2	Very high	97.4	Very high	12 Å²	12	51.1 Å²	51.1	6%	0.062	26%	0.257	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-136.9	107.8	176.8	-60.6	179.3	0	0	0	106.2	M83 L158 L160 I171 L173 Y179 P181 F211	M83-I106 HydrophobicContact SD-CD1 4.24Å; I106-L158 HydrophobicContact CD1-CD2 4.34Å; I106-L160 HydrophobicContact CD1-CD2 3.42Å; I106-L160 VanDerWaalsContact CD1-CD2 3.42Å; I106-I171 HydrophobicContact CB-CG2 4.27Å; I106-I171 HydrophobicContact CD1-CD1 4.03Å; I106-I171 HydrophobicContact CD1-CG2 4.39Å; I106-I171 HydrophobicContact CG1-CD1 4.05Å; I106-L173 HydrophobicContact CB-CD2 4.37Å; I106-L173 HydrophobicContact CG2-CD1 4.45Å; I106-L173 HydrophobicContact CG2-CD2 3.87Å; I106-Y179 HydrophobicContact CG2-CD1 4.02Å; I106-Y179 HydrophobicContact CG2-CG 4.02Å; I106-P181 HydrophobicContact CG1-CB 4.46Å; I106-F211 HydrophobicContact CD1-CE1 4.42Å; I106-F211 HydrophobicContact CD1-CZ 4.28Å; I106-F211 HydrophobicContact CG2-CE1 4.36Å; I106-F211 HydrophobicContact CG2-CZ 4.08Å
107	V	97.2	Very high	97.4	Very high	38 Å²	38	49.4 Å²	49.4	23%	0.23	25%	0.25	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-99.9	153.7	-179	-66.8	0	0	0	0	111.1	A109 Y179 Q180 R182	V107-A109 PolarHBondContact O-N 2.82Å; V107-Y179 CarbonylContact O-C 3.59Å; V107-Y179 VanDerWaalsContact O-CA 3.32Å; V107-Y179 WeakPolarHBondContact O-CA 3.28Å; V107-Y179 WeakPolarHBondContact O-CD1 3.49Å; V107-Q180 HydrophobicContact CG2-CB 4.31Å; V107-Q180 PolarHBondContact N-O 2.88Å; V107-Q180 VanDerWaalsContact N-O 3.1Å; V107-Q180 PolarHBondContact O-N 3.37Å; V107-R182 HydrophobicContact CG2-CG 4.15Å
108	P	97.4	Very high	97.3	Very high	67 Å²	67	48.4 Å²	48.4	44%	0.435	25%	0.253	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-52.8	137.1	166	-23.6	34	0	0	0	110.6	A130 Y179	P108-A130 HydrophobicContact CG-CB 3.93Å; P108-Y179 HydrophobicContact CG-CE1 4.19Å
109	A	97	Very high	97.3	Very high	43 Å²	43	52.5 Å²	52.5	36%	0.355	27%	0.274	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-85.7	-23.1	176.8	0	0	0	0	0	112.4	V107 K178 Q180	V107-A109 PolarHBondContact O-N 2.82Å; A109-K178 HydrophobicContact CB-CB 4.24Å; A109-K178 HydrophobicContact CB-CD 3.91Å; A109-K178 HydrophobicContact CB-CG 3.94Å; A109-K178 PolarHBondContact N-O 3.44Å; A109-Q180 HydrophobicContact CB-CB 4.35Å
110	D	96.7	Very high	97.3	Very high	42 Å²	42	56.1 Å²	56.1	23%	0.225	29%	0.29	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-162.1	174.2	178.9	49.9	68.4	0	0	0	110.3	H112 Y114 K178	D110-H112 VanDerWaalsContact C-N 3.32Å; D110-H112 PolarHBondContact O-N 3.47Å; D110-H112 WeakPolarHBondContact OD1-CB 3.48Å; D110-H112 IonicContact OD1-CG 3.41Å; D110-H112 PolarHBondContact OD1-N 2.95Å; D110-H112 IonicContact OD1-ND1 3.6Å; D110-H112 PolarHBondContact OD1-ND1 3.31Å; D110-Y114 WeakPolarHBondContact OD1-CE2 3.36Å; D110-Y114 PolarHBondContact OD1-OH 2.68Å; D110-Y114 PolarHBondContact OD2-OH 3.34Å; D110-K178 WeakPolarHBondContact OD2-CD 3.43Å; D110-K178 IonicContact OD2-NZ 3.34Å
111	D	96.9	Very high	97.3	Very high	89 Å²	89	58.1 Å²	58.1	48%	0.476	30%	0.297	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-95.8	35.4	-177.7	-166.5	14.5	0	0	0	111.9	K126 A127	D111-K126 CarbonylContact O-C 3.58Å; D111-K126 WeakPolarHBondContact O-CA 3.34Å; D111-K126 WeakPolarHBondContact OD1-CE 3.25Å; D111-K126 WeakPolarHBondContact OD2-CE 3.46Å; D111-K126 IonicContact OD2-NZ 2.8Å; D111-A127 VanDerWaalsContact C-CB 3.48Å; D111-A127 PolarHBondContact O-N 3.33Å
112	H	97.9	Very high	97.3	Very high	79 Å²	79	58.2 Å²	58.2	37%	0.366	30%	0.301	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-116.1	146.5	-177.5	-52.8	111.4	0	0	0	114.1	D110 Y114 V123 H177	D110-H112 VanDerWaalsContact C-N 3.32Å; D110-H112 PolarHBondContact O-N 3.47Å; D110-H112 WeakPolarHBondContact OD1-CB 3.48Å; D110-H112 IonicContact OD1-CG 3.41Å; D110-H112 PolarHBondContact OD1-N 2.95Å; D110-H112 IonicContact OD1-ND1 3.6Å; D110-H112 PolarHBondContact OD1-ND1 3.31Å; H112-Y114 HydrophobicContact CB-CD2 4.37Å; H112-Y114 HydrophobicContact CB-CE2 3.77Å; H112-V123 HydrophobicContact CB-CG1 4.04Å; H112-V123 HydrophobicContact CB-CG2 4Å; H112-H177 PolarHBondContact O-CD2 3.43Å
113	R	98	Very high	97.3	Very high	96 Å²	96	61.6 Å²	61.6	36%	0.362	32%	0.322	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-102.1	133.1	164.8	-170.9	179.2	-163.8	-87.7	6.2	109	T124 G125 K126 E128	R113-T124 HydrophobicContact CG-CG2 4.28Å; R113-T124 PolarHBondContact O-N 3.02Å; R113-G125 PolarHBondContact N-O 3.19Å; R113-G125 PolarHBondContact O-N 2.83Å; R113-K126 VanDerWaalsContact CB-O 3.27Å; R113-K126 WeakPolarHBondContact CB-O 3.48Å; R113-E128 IonicContact CZ-OE1 3.01Å; R113-E128 IonicContact NE-OE1 3.65Å; R113-E128 PolarHBondContact NE-OE1 3.01Å; R113-E128 IonicContact NH2-OE1 3.48Å; R113-E128 PolarHBondContact NH2-OE1 3.28Å
114	Y	98.4	Very high	97.2	Very high	32 Å²	32	63.9 Å²	63.9	13%	0.125	34%	0.336	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-106.3	161.1	-172.4	-73.7	-87.8	0	0	0	113.2	D110 H112 W121 S122 V123 M176 K178 I212	D110-Y114 WeakPolarHBondContact OD1-CE2 3.36Å; D110-Y114 PolarHBondContact OD1-OH 2.68Å; D110-Y114 PolarHBondContact OD2-OH 3.34Å; H112-Y114 HydrophobicContact CB-CD2 4.37Å; H112-Y114 HydrophobicContact CB-CE2 3.77Å; Y114-W121 HydrophobicContact CG-CE3 4.48Å; Y114-S122 CarbonylContact C-O 3.57Å; Y114-S122 WeakPolarHBondContact CA-O 3.38Å; Y114-S122 WeakPolarHBondContact CD1-O 3.44Å; Y114-V123 HydrophobicContact CD1-CG2 4.26Å; Y114-V123 HydrophobicContact CE1-CG2 3.7Å; Y114-M176 WeakPolarHBondContact CB-O 3.33Å; Y114-M176 PolarHBondContact N-O 3.35Å; Y114-M176 WeakPolarHBondContact O-CB 3.49Å; Y114-K178 HydrophobicContact CD2-CB 4.35Å; Y114-K178 HydrophobicContact CE2-CB 3.81Å; Y114-I212 HydrophobicContact CD1-CD1 4.42Å; Y114-I212 HydrophobicContact CD2-CD1 4.39Å; Y114-I212 HydrophobicContact CG-CD1 4.15Å
115	K	97.9	Very high	97.1	Very high	100 Å²	100	65.5 Å²	65.5	44%	0.435	35%	0.353	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-136.4	153.1	161.9	68	-177.9	175.2	-179.2	0	109.8	S122 T124	K115-S122 WeakPolarHBondContact CE-OG 3.25Å; K115-S122 WeakPolarHBondContact CG-OG 3.33Å; K115-S122 PolarHBondContact N-O 3.17Å; K115-S122 PolarHBondContact O-N 2.99Å; K115-S122 PolarHBondContact O-OG 2.94Å; K115-T124 HydrophobicContact CB-CG2 4.25Å; K115-T124 HydrophobicContact CG-CG2 4.5Å
116	F	98.1	Very high	97.1	Very high	39 Å²	39	71.9 Å²	71.9	17%	0.171	38%	0.38	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-109.4	122.5	171.8	-169.5	-103.5	0	0	0	108.8	N119 K120 W121 Q218 N219	F116-N119 VanDerWaalsContact CE2-C 3.48Å; F116-N119 VanDerWaalsContact CZ-C 3.43Å; F116-N119 VanDerWaalsContact CZ-CA 3.48Å; F116-N119 HydrophobicContact CZ-CB 4.39Å; F116-K120 WeakPolarHBondContact CA-O 3.46Å; F116-W121 HydrophobicContact CB-CD2 4.24Å; F116-W121 HydrophobicContact CB-CE3 4.04Å; F116-W121 HydrophobicContact CB-CH2 4.17Å; F116-W121 HydrophobicContact CB-CZ2 4.3Å; F116-W121 HydrophobicContact CB-CZ3 4.03Å; F116-W121 AromaticContact CD2-CD1 3.8Å; F116-W121 AromaticContact CD2-CD2 3.76Å; F116-W121 HydrophobicContact CD2-CD2 3.76Å; F116-W121 AromaticContact CD2-CE2 3.7Å; F116-W121 HydrophobicContact CD2-CE3 4.4Å; F116-W121 AromaticContact CD2-CG 3.85Å; F116-W121 HydrophobicContact CD2-CG 3.85Å; F116-W121 HydrophobicContact CD2-CZ2 4.31Å; F116-W121 AromaticContact CD2-NE1 3.69Å; F116-W121 HydrophobicContact CE2-CG 4.46Å; F116-W121 AromaticContact CE2-NE1 4Å; F116-W121 HydrophobicContact CG-CD2 4.47Å; F116-Q218 HydrophobicContact CB-CB 3.67Å; F116-Q218 HydrophobicContact CB-CG 4.19Å; F116-Q218 HydrophobicContact CD1-CB 3.72Å; F116-Q218 HydrophobicContact CD2-CB 4.5Å; F116-Q218 HydrophobicContact CE1-CB 4.46Å; F116-Q218 WeakPolarHBondContact CE1-O 3.11Å; F116-Q218 HydrophobicContact CG-CB 3.72Å; F116-N219 HydrophobicContact CE1-CB 4.18Å; F116-N219 HydrophobicContact CE2-CB 3.89Å; F116-N219 HydrophobicContact CZ-CB 3.56Å
117	A	96.7	Very high	97	Very high	40 Å²	40	72.3 Å²	72.3	33%	0.331	39%	0.385	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-149.8	152.2	177.1	0	0	0	0	0	108.1	N119 K120	A117-N119 PolarHBondContact O-N 3.5Å; A117-N119 VanDerWaalsContact O-N 3.11Å; A117-K120 PolarHBondContact N-O 3.45Å; A117-K120 VanDerWaalsContact N-O 3.09Å; A117-K120 CarbonylContact O-C 3.57Å; A117-K120 WeakPolarHBondContact O-CA 3.14Å; A117-K120 PolarHBondContact O-N 2.8Å
118	D	94.8	Very high	96.8	Very high	159 Å²	159	74.1 Å²	74.1	85%	0.85	39%	0.391	S	S	*	.	T	Hydrogen-bonded Turn	trans	54.4	36.1	175.2	-44	-44.3	0	0	0	113.6	K120	D118-K120 PolarHBondContact O-N 3.41Å
119	N	94.2	Very high	96.5	Very high	110 Å²	110	76.6 Å²	76.6	59%	0.588	41%	0.408	S	S	*	.	T	Hydrogen-bonded Turn	trans	57.1	21.3	-171.4	-64.9	-76	0	0	0	115.5	F116 A117 H220	F116-N119 VanDerWaalsContact CE2-C 3.48Å; F116-N119 VanDerWaalsContact CZ-C 3.43Å; F116-N119 VanDerWaalsContact CZ-CA 3.48Å; F116-N119 HydrophobicContact CZ-CB 4.39Å; A117-N119 PolarHBondContact O-N 3.5Å; A117-N119 VanDerWaalsContact O-N 3.11Å; N119-H220 PolarHBondContact OD1-CE1 2.87Å
120	K	95.8	Very high	95.8	Very high	153 Å²	153	77.4 Å²	77.4	67%	0.665	41%	0.414	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-129.8	137.8	-173.5	-173.5	175.1	178.9	-179.2	0	112.2	F116 A117 D118	F116-K120 WeakPolarHBondContact CA-O 3.46Å; A117-K120 PolarHBondContact N-O 3.45Å; A117-K120 VanDerWaalsContact N-O 3.09Å; A117-K120 CarbonylContact O-C 3.57Å; A117-K120 WeakPolarHBondContact O-CA 3.14Å; A117-K120 PolarHBondContact O-N 2.8Å; D118-K120 PolarHBondContact O-N 3.41Å
121	W	97.6	Very high	95.3	Very high	48 Å²	48	78.9 Å²	78.9	18%	0.182	42%	0.42	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-77.3	130	167.7	-77.6	108.3	0	0	0	110.6	E73 Y114 F116 M176 I212 V214 Q218	E73-W121 HydrophobicContact CG-CZ2 3.95Å; Y114-W121 HydrophobicContact CG-CE3 4.48Å; F116-W121 HydrophobicContact CB-CD2 4.24Å; F116-W121 HydrophobicContact CB-CE3 4.04Å; F116-W121 HydrophobicContact CB-CH2 4.17Å; F116-W121 HydrophobicContact CB-CZ2 4.3Å; F116-W121 HydrophobicContact CB-CZ3 4.03Å; F116-W121 AromaticContact CD2-CD1 3.8Å; F116-W121 AromaticContact CD2-CD2 3.76Å; F116-W121 HydrophobicContact CD2-CD2 3.76Å; F116-W121 AromaticContact CD2-CE2 3.7Å; F116-W121 HydrophobicContact CD2-CE3 4.4Å; F116-W121 AromaticContact CD2-CG 3.85Å; F116-W121 HydrophobicContact CD2-CG 3.85Å; F116-W121 HydrophobicContact CD2-CZ2 4.31Å; F116-W121 AromaticContact CD2-NE1 3.69Å; F116-W121 HydrophobicContact CE2-CG 4.46Å; F116-W121 AromaticContact CE2-NE1 4Å; F116-W121 HydrophobicContact CG-CD2 4.47Å; W121-M176 HydrophobicContact CH2-CE 3.87Å; W121-M176 HydrophobicContact CZ3-CE 3.76Å; W121-I212 HydrophobicContact CD2-CD1 3.54Å; W121-I212 HydrophobicContact CE3-CD1 3.66Å; W121-I212 HydrophobicContact CG-CD1 4.04Å; W121-I212 HydrophobicContact CH2-CB 4.31Å; W121-I212 HydrophobicContact CH2-CD1 4.13Å; W121-I212 HydrophobicContact CH2-CG2 3.71Å; W121-I212 HydrophobicContact CZ2-CB 4.34Å; W121-I212 HydrophobicContact CZ2-CD1 4.07Å; W121-I212 HydrophobicContact CZ2-CG2 4.24Å; W121-I212 HydrophobicContact CZ3-CD1 3.94Å; W121-I212 HydrophobicContact CZ3-CG2 4.03Å; W121-V214 HydrophobicContact CH2-CG1 4.02Å; W121-V214 HydrophobicContact CZ2-CG1 4.47Å; W121-Q218 HydrophobicContact CH2-CB 4.26Å; W121-Q218 HydrophobicContact CH2-CG 3.78Å; W121-Q218 HydrophobicContact CZ2-CB 4.07Å; W121-Q218 HydrophobicContact CZ2-CG 4.02Å
122	S	97.6	Very high	94.7	Very high	39 Å²	39	80 Å²	80	27%	0.273	43%	0.432	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-135.2	148	177	56	0	0	0	0	111.2	Y114 K115	Y114-S122 CarbonylContact C-O 3.57Å; Y114-S122 WeakPolarHBondContact CA-O 3.38Å; Y114-S122 WeakPolarHBondContact CD1-O 3.44Å; K115-S122 WeakPolarHBondContact CE-OG 3.25Å; K115-S122 WeakPolarHBondContact CG-OG 3.33Å; K115-S122 PolarHBondContact N-O 3.17Å; K115-S122 PolarHBondContact O-N 2.99Å; K115-S122 PolarHBondContact O-OG 2.94Å
123	V	98.3	Very high	93.9	Very high	72 Å²	72	79.3 Å²	79.3	44%	0.436	45%	0.447	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-71.9	136.5	170.9	175.2	0	0	0	0	108.5	H112 Y114	H112-V123 HydrophobicContact CB-CG1 4.04Å; H112-V123 HydrophobicContact CB-CG2 4Å; Y114-V123 HydrophobicContact CD1-CG2 4.26Å; Y114-V123 HydrophobicContact CE1-CG2 3.7Å
124	T	97.3	Very high	93.7	Very high	68 Å²	68	78.2 Å²	78.2	42%	0.417	44%	0.443	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-123.5	0.2	178.7	-162.9	0	0	0	0	113.8	R113 K115	R113-T124 HydrophobicContact CG-CG2 4.28Å; R113-T124 PolarHBondContact O-N 3.02Å; K115-T124 HydrophobicContact CB-CG2 4.25Å; K115-T124 HydrophobicContact CG-CG2 4.5Å
125	G	96.4	Very high	93.6	Very high	34 Å²	34	81.4 Å²	81.4	35%	0.351	46%	0.461	S	S	.	.	E	Extended strand (participates in β ladder)	trans	165.1	-177.2	178	0	0	0	0	0	112.1	R113	R113-G125 PolarHBondContact N-O 3.19Å; R113-G125 PolarHBondContact O-N 2.83Å
126	K	96.8	Very high	93.7	Very high	150 Å²	150	78.8 Å²	78.8	65%	0.652	45%	0.449	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-66.7	153.2	169.8	-163.4	-174.8	-177	-173.1	0	110.8	D111 R113	D111-K126 CarbonylContact O-C 3.58Å; D111-K126 WeakPolarHBondContact O-CA 3.34Å; D111-K126 WeakPolarHBondContact OD1-CE 3.25Å; D111-K126 WeakPolarHBondContact OD2-CE 3.46Å; D111-K126 IonicContact OD2-NZ 2.8Å; R113-K126 VanDerWaalsContact CB-O 3.27Å; R113-K126 WeakPolarHBondContact CB-O 3.48Å
127	A	96.1	Very high	93.7	Very high	20 Å²	20	80.5 Å²	80.5	17%	0.165	46%	0.462	C	S	.	.	P	Polyproline II helix	trans	-61.7	147.4	171.3	0	0	0	0	0	113.1	D111 H177	D111-A127 VanDerWaalsContact C-CB 3.48Å; D111-A127 PolarHBondContact O-N 3.33Å; A127-H177 WeakPolarHBondContact CA-NE2 3.48Å
128	E	93.3	Very high	93.7	Very high	77 Å²	77	79 Å²	79	36%	0.36	45%	0.449	S	S	.	.	P	Polyproline II helix	trans	-71.9	135.8	164.2	-67	161.6	-158.2	0	0	108.9	R113 A130 N174 H177	R113-E128 IonicContact CZ-OE1 3.01Å; R113-E128 IonicContact NE-OE1 3.65Å; R113-E128 PolarHBondContact NE-OE1 3.01Å; R113-E128 IonicContact NH2-OE1 3.48Å; R113-E128 PolarHBondContact NH2-OE1 3.28Å; E128-A130 PolarHBondContact O-N 3.17Å; E128-N174 PolarHBondContact O-ND2 3.34Å; E128-H177 PolarHBondContact N-NE2 3.09Å; E128-H177 IonicContact OE1-CE1 3.78Å; E128-H177 IonicContact OE2-CE1 3.99Å
129	P	90.8	Very high	93.9	Very high	119 Å²	119	74.8 Å²	74.8	77%	0.773	43%	0.43	S	S	*	.	P	Polyproline II helix	trans	-49.3	129.6	-179.3	-29.9	35.8	0	0	0	113	N174	P129-N174 PolarHBondContact O-ND2 3.13Å; P129-N174 VanDerWaalsContact O-ND2 3.08Å
130	A	83.3	Confident	94.1	Very high	59 Å²	59	72.7 Å²	72.7	49%	0.488	42%	0.418	S	S	.	.	P	Polyproline II helix	trans	-71	134.1	179.4	0	0	0	0	0	110.7	P108 E128	P108-A130 HydrophobicContact CG-CB 3.93Å; E128-A130 PolarHBondContact O-N 3.17Å
131	M	85.3	Confident	94.2	Very high	74 Å²	74	66.6 Å²	66.6	37%	0.365	40%	0.395	S	S	.	.	P	Polyproline II helix	trans	-61.4	152.1	167.7	-68.2	-62	-70.2	0	0	110.3	G133 H164 I172	M131-G133 PolarHBondContact O-N 2.67Å; M131-H164 HydrophobicContact CE-CB 4.22Å; M131-H164 HydrophobicContact SD-CB 4.49Å; M131-I172 HydrophobicContact CB-CG2 4.18Å; M131-I172 HydrophobicContact CG-CG2 4.04Å
132	P	83.4	Confident	94.2	Very high	112 Å²	112	67.6 Å²	67.6	73%	0.727	41%	0.408	S	S	*	.	P	Polyproline II helix	trans	-50.5	125.9	179.1	-29.3	36.1	0	0	0	112.6	R134	P132-R134 PolarHBondContact O-N 2.89Å; P132-R134 VanDerWaalsContact O-N 3.09Å
133	G	81.4	Confident	94.2	Very high	65 Å²	65	66.2 Å²	66.2	67%	0.67	40%	0.399	S	S	*	.			trans	-60	110.9	-171	0	0	0	0	0	112.6	M131	M131-G133 PolarHBondContact O-N 2.67Å
134	R	95.1	Very high	94.2	Very high	73 Å²	73	65.3 Å²	65.3	28%	0.275	39%	0.393	S	S	.	.			trans	-80	129.7	175.5	-73.6	178.7	170	-166.3	-4.4	110.6	P132 D166 H170 I172	P132-R134 PolarHBondContact O-N 2.89Å; P132-R134 VanDerWaalsContact O-N 3.09Å; R134-D166 PolarHBondContact NH1-O 2.85Å; R134-D166 VanDerWaalsContact NH1-O 3.1Å; R134-D166 IonicContact NH1-OD2 3.61Å; R134-D166 PolarHBondContact NH1-OD2 3.32Å; R134-D166 PolarHBondContact NH2-O 3.28Å; R134-H170 WeakPolarHBondContact CD-O 3.28Å; R134-H170 PolarHBondContact NH1-O 3.45Å; R134-I172 VanDerWaalsContact CZ-CD1 3.47Å
135	L	96.5	Very high	94.1	Very high	98 Å²	98	62 Å²	62	51%	0.513	37%	0.374	S	S	.	.			trans	-87.4	133.1	175.5	-54	-177.6	0	0	0	110.6	L103 D105	L103-L135 HydrophobicContact CD1-CB 4.4Å; L103-L135 HydrophobicContact CD1-CD1 4.21Å; L103-L135 HydrophobicContact CD1-CD2 4.15Å; L103-L135 HydrophobicContact CD1-CG 4.49Å; L103-L135 HydrophobicContact CD2-CD1 4.44Å; D105-L135 HydrophobicContact CB-CD2 3.72Å
136	Y	98.2	Very high	94.2	Very high	46 Å²	46	62.6 Å²	62.6	18%	0.18	38%	0.375	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-97.2	106.5	166.2	-179.6	-89.7	0	0	0	109.7	L103 M104 F155 K157 L158	L103-Y136 CarbonylContact C-O 3.58Å; L103-Y136 VanDerWaalsContact CA-O 3.25Å; L103-Y136 WeakPolarHBondContact CA-O 3.37Å; L103-Y136 WeakPolarHBondContact CB-O 3.48Å; M104-Y136 PolarHBondContact N-O 3.14Å; M104-Y136 PolarHBondContact O-N 3.19Å; Y136-F155 AromaticContact CD1-CD1 3.67Å; Y136-F155 HydrophobicContact CD1-CD1 3.67Å; Y136-F155 HydrophobicContact CD1-CE1 4.16Å; Y136-F155 AromaticContact CE1-CD1 3.88Å; Y136-F155 HydrophobicContact CE1-CD1 3.88Å; Y136-F155 HydrophobicContact CE1-CE1 4.47Å; Y136-K157 WeakPolarHBondContact OH-CB 3.23Å; Y136-L158 HydrophobicContact CD1-CB 4.09Å; Y136-L158 HydrophobicContact CD1-CD1 3.95Å; Y136-L158 HydrophobicContact CD1-CG 4.2Å; Y136-L158 HydrophobicContact CD2-CB 4Å; Y136-L158 HydrophobicContact CD2-CG 3.96Å; Y136-L158 HydrophobicContact CE1-CB 4.22Å; Y136-L158 HydrophobicContact CE2-CB 4.15Å; Y136-L158 HydrophobicContact CG-CB 3.98Å; Y136-L158 HydrophobicContact CG-CD1 3.78Å; Y136-L158 HydrophobicContact CG-CG 3.73Å
137	V	98.3	Very high	94.3	Very high	74 Å²	74	58 Å²	58	45%	0.448	36%	0.355	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-78.3	131.8	172.1	-178.1	0	0	0	0	109.4	I101 L103	I101-V137 HydrophobicContact CG2-CG1 4Å; L103-V137 HydrophobicContact CB-CB 4.46Å; L103-V137 HydrophobicContact CB-CG2 4.14Å
138	H	98.4	Very high	94.4	Very high	10 Å²	10	57.2 Å²	57.2	5%	0.046	35%	0.348	C	S	.	.			trans	-65.6	130	175.6	-169	-84.1	0	0	0	109.3	L102 D140 S141 W148 V153 S154 F155	L102-H138 HydrophobicContact CB-CB 4.29Å; L102-H138 VanDerWaalsContact O-CB 3.23Å; L102-H138 WeakPolarHBondContact O-CB 3.27Å; L102-H138 PolarHBondContact O-N 3.34Å; H138-D140 IonicContact CE1-OD1 3.55Å; H138-D140 IonicContact CE1-OD2 3.97Å; H138-D140 PolarHBondContact CE1-OD2 2.86Å; H138-D140 VanDerWaalsContact CE1-OD2 3.28Å; H138-D140 IonicContact ND1-OD2 3.22Å; H138-D140 PolarHBondContact O-N 2.91Å; H138-S141 WeakPolarHBondContact O-CB 3.19Å; H138-S141 PolarHBondContact O-N 3.13Å; H138-S141 PolarHBondContact O-OG 3.41Å; H138-W148 HydrophobicContact CB-CH2 4.03Å; H138-W148 HydrophobicContact CB-CZ3 4.41Å; H138-W148 AromaticContact CE1-CZ3 3.89Å; H138-W148 AromaticContact CG-CH2 3.96Å; H138-W148 AromaticContact CG-CZ3 3.93Å; H138-W148 AromaticContact ND1-CH2 3.5Å; H138-W148 AromaticContact ND1-CZ3 3.41Å; H138-W148 WeakPolarHBondContact ND1-CZ3 3.5Å; H138-V153 VanDerWaalsContact CD2-CG1 3.5Å; H138-V153 WeakPolarHBondContact CD2-CG1 2.81Å; H138-V153 WeakPolarHBondContact NE2-CG1 3.21Å; H138-S154 PolarHBondContact NE2-N 2.87Å; H138-S154 PolarHBondContact NE2-O 3.48Å; H138-F155 HydrophobicContact CB-CE1 4.05Å; H138-F155 HydrophobicContact CB-CZ 4.19Å
139	P	98	Very high	94.6	Very high	69 Å²	69	56.3 Å²	56.3	45%	0.448	35%	0.345	S	S	.	.	T	Hydrogen-bonded Turn	trans	-62.2	-23.4	-167.4	23.7	-35.5	0	0	0	114.4	S141 K157	P139-S141 PolarHBondContact O-N 2.83Å; P139-K157 HydrophobicContact CG-CD 4.48Å
140	D	97.9	Very high	95	Very high	66 Å²	66	57.7 Å²	57.7	35%	0.353	34%	0.335	S	S	.	.	T	Hydrogen-bonded Turn	trans	-78.6	2.2	177.4	-49.4	-5.5	0	0	0	112.5	H138 A143 H147 W148	H138-D140 IonicContact CE1-OD1 3.55Å; H138-D140 IonicContact CE1-OD2 3.97Å; H138-D140 PolarHBondContact CE1-OD2 2.86Å; H138-D140 VanDerWaalsContact CE1-OD2 3.28Å; H138-D140 IonicContact ND1-OD2 3.22Å; H138-D140 PolarHBondContact O-N 2.91Å; D140-A143 VanDerWaalsContact O-CB 3.27Å; D140-A143 WeakPolarHBondContact O-CB 3.42Å; D140-H147 IonicContact OD2-NE2 3.5Å; D140-W148 HydrophobicContact CB-CH2 3.99Å; D140-W148 HydrophobicContact CB-CZ3 4.24Å
141	S	97.6	Very high	95.6	Very high	25 Å²	25	59.9 Å²	59.9	18%	0.175	34%	0.335	C	S	.	.			trans	-84.1	143.1	179.3	-55	0	0	0	0	112.6	L102 H138 P139 W148	L102-S141 PolarHBondContact N-OG 2.99Å; L102-S141 PolarHBondContact O-OG 3.12Å; H138-S141 WeakPolarHBondContact O-CB 3.19Å; H138-S141 PolarHBondContact O-N 3.13Å; H138-S141 PolarHBondContact O-OG 3.41Å; P139-S141 PolarHBondContact O-N 2.83Å; S141-W148 WeakPolarHBondContact OG-CH2 3.28Å; S141-W148 WeakPolarHBondContact OG-CZ2 3.49Å
142	P	97.4	Very high	96.2	Very high	70 Å²	70	59.8 Å²	59.8	46%	0.455	34%	0.336	S	S	.	.	S	Bend	cis	-85	131.2	-4.8	32.2	-32.7	0	0	0	112.5	I101 F194	I101-P142 HydrophobicContact CG1-CB 3.86Å; P142-F194 HydrophobicContact CB-CE2 3.55Å; P142-F194 HydrophobicContact CB-CZ 3.81Å; P142-F194 HydrophobicContact CG-CE2 4.14Å
143	A	98	Very high	96.9	Very high	10 Å²	10	54.8 Å²	54.8	8%	0.083	30%	0.303	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-128.5	162.7	176.4	0	0	0	0	0	112.3	K99 Y100 D140 H147 W148	K99-A143 CarbonylContact C-O 3.55Å; K99-A143 WeakPolarHBondContact CA-O 3.27Å; Y100-A143 PolarHBondContact N-O 3.18Å; Y100-A143 PolarHBondContact O-N 2.87Å; Y100-A143 VanDerWaalsContact O-N 3.14Å; D140-A143 VanDerWaalsContact O-CB 3.27Å; D140-A143 WeakPolarHBondContact O-CB 3.42Å; A143-H147 HydrophobicContact CB-CB 3.85Å; A143-W148 HydrophobicContact CB-CZ2 4.09Å; A143-W148 PolarHBondContact O-NE1 3.06Å
144	T	97.8	Very high	97.7	Very high	52 Å²	52	53 Å²	53	32%	0.319	28%	0.28	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-70.7	156.5	-178.2	58.4	0	0	0	0	112.6	P96 T98 A146 H147 W148	P96-T144 WeakPolarHBondContact O-CB 3.36Å; T98-T144 CarbonylContact O-C 3.52Å; T98-T144 VanDerWaalsContact O-CA 3.31Å; T98-T144 WeakPolarHBondContact O-CA 3.2Å; T144-A146 PolarHBondContact O-N 3Å; T144-H147 WeakPolarHBondContact O-CA 3.39Å; T144-H147 VanDerWaalsContact O-CB 3.28Å; T144-H147 WeakPolarHBondContact O-CB 3.46Å; T144-H147 PolarHBondContact O-N 3.16Å; T144-H147 PolarHBondContact OG1-N 2.94Å; T144-W148 PolarHBondContact O-N 3.35Å; T144-W148 VanDerWaalsContact O-N 3.12Å
145	G	97.2	Very high	97.9	Very high	0 Å²	0	49.6 Å²	49.6	0%	0	27%	0.268	C	S	.	.	H	α-helix	trans	-56.2	-33.4	173.2	0	0	0	0	0	113.1	N95 T98 H147 W148 M149	N95-G145 WeakPolarHBondContact O-CA 3.31Å; T98-G145 PolarHBondContact O-N 2.86Å; G145-H147 VanDerWaalsContact C-N 3.3Å; G145-H147 PolarHBondContact O-N 2.9Å; G145-W148 PolarHBondContact O-N 3.42Å; G145-M149 WeakPolarHBondContact O-CB 3.36Å; G145-M149 WeakPolarHBondContact O-CG 3.34Å; G145-M149 PolarHBondContact O-N 3.21Å
146	A	98.1	Very high	97.9	Very high	46 Å²	46	49.5 Å²	49.5	38%	0.38	26%	0.264	S	S	.	.	H	α-helix	trans	-63.1	-33.7	172.2	0	0	0	0	0	112.9	P96 T144 R150	P96-A146 HydrophobicContact CB-CB 4.12Å; P96-A146 VanDerWaalsContact O-CB 3.27Å; P96-A146 WeakPolarHBondContact O-CB 3.18Å; P96-A146 PolarHBondContact O-N 3.44Å; P96-A146 VanDerWaalsContact O-N 3.1Å; T144-A146 PolarHBondContact O-N 3Å; A146-R150 WeakPolarHBondContact O-CB 3.5Å; A146-R150 PolarHBondContact O-N 3.22Å
147	H	98.4	Very high	97.9	Very high	52 Å²	52	53.2 Å²	53.2	24%	0.241	28%	0.281	C	S	.	.	H	α-helix	trans	-67.8	-50.7	173.4	-172.3	124.2	0	0	0	111	D140 A143 T144 G145 M149 R150	D140-H147 IonicContact OD2-NE2 3.5Å; A143-H147 HydrophobicContact CB-CB 3.85Å; T144-H147 WeakPolarHBondContact O-CA 3.39Å; T144-H147 VanDerWaalsContact O-CB 3.28Å; T144-H147 WeakPolarHBondContact O-CB 3.46Å; T144-H147 PolarHBondContact O-N 3.16Å; T144-H147 PolarHBondContact OG1-N 2.94Å; G145-H147 VanDerWaalsContact C-N 3.3Å; G145-H147 PolarHBondContact O-N 2.9Å; H147-M149 PolarHBondContact O-N 3.31Å; H147-R150 PolarHBondContact CD2-NH2 3.5Å; H147-R150 PolarHBondContact CE1-NH2 3.34Å; H147-R150 VanDerWaalsContact CE1-NH2 3.34Å; H147-R150 PolarHBondContact ND1-NH2 3.21Å; H147-R150 PolarHBondContact NE2-NH2 3.45Å; H147-R150 WeakPolarHBondContact O-CB 3.45Å; H147-R150 PolarHBondContact O-N 3.32Å
148	W	98.4	Very high	97.9	Very high	4 Å²	4	49.8 Å²	49.8	2%	0.015	26%	0.26	C	S	.	.	H	α-helix	trans	-67	-31.2	-175.4	-65.6	119.9	0	0	0	114.1	L94 Y100 L102 H138 D140 S141 A143 T144 G145 V153	L94-W148 HydrophobicContact CD1-CB 3.51Å; L94-W148 HydrophobicContact CD1-CG 4.22Å; Y100-W148 PolarHBondContact O-NE1 3.1Å; L102-W148 HydrophobicContact CB-CH2 3.95Å; L102-W148 HydrophobicContact CB-CZ2 4.09Å; L102-W148 HydrophobicContact CB-CZ3 4.21Å; L102-W148 HydrophobicContact CD1-CD2 3.96Å; L102-W148 HydrophobicContact CD1-CG 4.17Å; L102-W148 HydrophobicContact CD1-CZ2 4.25Å; L102-W148 HydrophobicContact CD2-CD2 4.12Å; L102-W148 HydrophobicContact CD2-CE3 3.9Å; L102-W148 HydrophobicContact CD2-CZ3 4.21Å; L102-W148 HydrophobicContact CG-CD2 4.48Å; H138-W148 HydrophobicContact CB-CH2 4.03Å; H138-W148 HydrophobicContact CB-CZ3 4.41Å; H138-W148 AromaticContact CE1-CZ3 3.89Å; H138-W148 AromaticContact CG-CH2 3.96Å; H138-W148 AromaticContact CG-CZ3 3.93Å; H138-W148 AromaticContact ND1-CH2 3.5Å; H138-W148 AromaticContact ND1-CZ3 3.41Å; H138-W148 WeakPolarHBondContact ND1-CZ3 3.5Å; D140-W148 HydrophobicContact CB-CH2 3.99Å; D140-W148 HydrophobicContact CB-CZ3 4.24Å; S141-W148 WeakPolarHBondContact OG-CH2 3.28Å; S141-W148 WeakPolarHBondContact OG-CZ2 3.49Å; A143-W148 HydrophobicContact CB-CZ2 4.09Å; A143-W148 PolarHBondContact O-NE1 3.06Å; T144-W148 PolarHBondContact O-N 3.35Å; T144-W148 VanDerWaalsContact O-N 3.12Å; G145-W148 PolarHBondContact O-N 3.42Å; W148-V153 HydrophobicContact CE3-CG1 4.13Å; W148-V153 HydrophobicContact CE3-CG2 3.81Å; W148-V153 HydrophobicContact CZ3-CG1 3.86Å; W148-V153 HydrophobicContact CZ3-CG2 4.38Å
149	M	98.1	Very high	97.9	Very high	59 Å²	59	52.4 Å²	52.4	29%	0.291	27%	0.272	S	S	.	.	H	α-helix	trans	-84.8	-13.1	178.2	-63.3	-170	-65.6	0	0	114	V91 G93 L94 P96 G145 H147	V91-M149 WeakPolarHBondContact O-CG 3.41Å; G93-M149 PolarHBondContact N-SD 2.71Å; G93-M149 VanDerWaalsContact N-SD 3.45Å; L94-M149 HydrophobicContact CB-CE 4.16Å; L94-M149 HydrophobicContact CB-CG 4.15Å; L94-M149 HydrophobicContact CB-SD 3.92Å; L94-M149 HydrophobicContact CD1-CG 4.06Å; L94-M149 HydrophobicContact CG-CG 4.28Å; L94-M149 HydrophobicContact CG-SD 4.45Å; L94-M149 PolarHBondContact N-SD 2.94Å; L94-M149 WeakPolarHBondContact O-CE 3.36Å; P96-M149 HydrophobicContact CG-CE 4.27Å; G145-M149 WeakPolarHBondContact O-CB 3.36Å; G145-M149 WeakPolarHBondContact O-CG 3.34Å; G145-M149 PolarHBondContact O-N 3.21Å; H147-M149 PolarHBondContact O-N 3.31Å
150	R	97.8	Very high	97.9	Very high	147 Å²	147	49.1 Å²	49.1	56%	0.555	25%	0.25	S	S	*	.	H	α-helix	trans	-68.9	-31.7	-177	-178.8	-178.4	62.7	-113	-13.2	113.4	A146 H147	A146-R150 WeakPolarHBondContact O-CB 3.5Å; A146-R150 PolarHBondContact O-N 3.22Å; H147-R150 PolarHBondContact CD2-NH2 3.5Å; H147-R150 PolarHBondContact CE1-NH2 3.34Å; H147-R150 VanDerWaalsContact CE1-NH2 3.34Å; H147-R150 PolarHBondContact ND1-NH2 3.21Å; H147-R150 PolarHBondContact NE2-NH2 3.45Å; H147-R150 WeakPolarHBondContact O-CB 3.45Å; H147-R150 PolarHBondContact O-N 3.32Å
151	Q	95.9	Very high	97.9	Very high	105 Å²	105	46 Å²	46	49%	0.491	23%	0.234	S	C	.	.	S	Bend	trans	-148.8	175	-173.4	69.1	-173.7	16.8	0	0	111.8	V153	Q151-V153 PolarHBondContact O-N 3.35Å
152	L	97.8	Very high	97.9	Very high	73 Å²	73	47.9 Å²	47.9	38%	0.382	24%	0.242	S	C	.	.			trans	-68.3	129.5	172.9	-71.2	167.4	0	0	0	111	H59 K90	H59-L152 HydrophobicContact CB-CD2 3.94Å; H59-L152 VanDerWaalsContact CE1-CD1 3.45Å; H59-L152 WeakPolarHBondContact CE1-CD1 3.45Å; H59-L152 WeakPolarHBondContact ND1-CD1 3.17Å; K90-L152 HydrophobicContact CB-CD2 3.95Å
153	V	98.5	Very high	97.8	Very high	6 Å²	6	46.2 Å²	46.2	4%	0.036	23%	0.229	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-81.8	131	171.3	-170.4	0	0	0	0	108.3	K88 V89 V91 L102 H138 W148 Q151 F155	K88-V153 CarbonylContact C-O 3.54Å; K88-V153 VanDerWaalsContact CA-O 3.28Å; K88-V153 WeakPolarHBondContact CA-O 3.5Å; V89-V153 HydrophobicContact CG2-CB 3.95Å; V89-V153 PolarHBondContact N-O 3.46Å; V89-V153 PolarHBondContact O-N 3.22Å; V91-V153 HydrophobicContact CG2-CG2 4.24Å; L102-V153 HydrophobicContact CD2-CB 4.39Å; L102-V153 HydrophobicContact CD2-CG1 3.9Å; L102-V153 HydrophobicContact CD2-CG2 4.01Å; H138-V153 VanDerWaalsContact CD2-CG1 3.5Å; H138-V153 WeakPolarHBondContact CD2-CG1 2.81Å; H138-V153 WeakPolarHBondContact NE2-CG1 3.21Å; W148-V153 HydrophobicContact CE3-CG1 4.13Å; W148-V153 HydrophobicContact CE3-CG2 3.81Å; W148-V153 HydrophobicContact CZ3-CG1 3.86Å; W148-V153 HydrophobicContact CZ3-CG2 4.38Å; Q151-V153 PolarHBondContact O-N 3.35Å; V153-F155 HydrophobicContact CG1-CD2 4.44Å; V153-F155 HydrophobicContact CG1-CE2 3.73Å; V153-F155 HydrophobicContact CG1-CZ 4.27Å
154	S	98.4	Very high	97.6	Very high	29 Å²	29	49.9 Å²	49.9	20%	0.203	24%	0.244	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-132.7	103.5	-164.4	-174	0	0	0	0	112.7	H138 Q156	H138-S154 PolarHBondContact NE2-N 2.87Å; H138-S154 PolarHBondContact NE2-O 3.48Å; S154-Q156 PolarHBondContact O-N 3.45Å; S154-Q156 VanDerWaalsContact O-N 3.11Å; S154-Q156 WeakPolarHBondContact OG-CG 3.43Å
155	F	98.4	Very high	97.5	Very high	1 Å²	1	54.6 Å²	54.6	0%	0.004	27%	0.267	C	S	.	.			trans	-79.7	15.5	179	-66.8	-96.9	0	0	0	112.6	Y87 L102 M104 Y136 H138 V153 K157 L158 L183	Y87-F155 HydrophobicContact CD1-CD2 4Å; Y87-F155 HydrophobicContact CD1-CG 4.49Å; Y87-F155 WeakPolarHBondContact O-CB 3.4Å; Y87-F155 PolarHBondContact O-N 2.97Å; L102-F155 HydrophobicContact CB-CZ 4.45Å; M104-F155 HydrophobicContact CB-CD1 3.73Å; M104-F155 HydrophobicContact CB-CE1 3.7Å; M104-F155 HydrophobicContact SD-CB 4.42Å; M104-F155 HydrophobicContact SD-CD1 4.34Å; M104-F155 HydrophobicContact SD-CG 4.4Å; Y136-F155 AromaticContact CD1-CD1 3.67Å; Y136-F155 HydrophobicContact CD1-CD1 3.67Å; Y136-F155 HydrophobicContact CD1-CE1 4.16Å; Y136-F155 AromaticContact CE1-CD1 3.88Å; Y136-F155 HydrophobicContact CE1-CD1 3.88Å; Y136-F155 HydrophobicContact CE1-CE1 4.47Å; H138-F155 HydrophobicContact CB-CE1 4.05Å; H138-F155 HydrophobicContact CB-CZ 4.19Å; V153-F155 HydrophobicContact CG1-CD2 4.44Å; V153-F155 HydrophobicContact CG1-CE2 3.73Å; V153-F155 HydrophobicContact CG1-CZ 4.27Å; F155-K157 PolarHBondContact O-N 2.88Å; F155-L158 WeakPolarHBondContact O-CB 3.47Å; F155-L158 PolarHBondContact O-N 2.84Å; F155-L183 HydrophobicContact CE1-CD1 4.42Å; F155-L183 HydrophobicContact CE2-CD1 3.63Å; F155-L183 HydrophobicContact CZ-CD1 3.43Å; F155-L183 VanDerWaalsContact CZ-CD1 3.43Å
156	Q	97.4	Very high	97.4	Very high	96 Å²	96	54.7 Å²	54.7	45%	0.449	27%	0.267	S	S	.	.	T	Hydrogen-bonded Turn	trans	-57.8	-16.8	-177.9	69.1	179.6	-7.2	0	0	115.6	R82 S154	R82-Q156 WeakPolarHBondContact CD-O 3.47Å; R82-Q156 WeakPolarHBondContact CG-O 3.48Å; S154-Q156 PolarHBondContact O-N 3.45Å; S154-Q156 VanDerWaalsContact O-N 3.11Å; S154-Q156 WeakPolarHBondContact OG-CG 3.43Å
157	K	97.7	Very high	97.3	Very high	123 Å²	123	57.5 Å²	57.5	54%	0.535	28%	0.282	S	S	.	.	T	Hydrogen-bonded Turn	trans	-84.1	-18.1	176.5	-72.9	177.7	-179	174.2	0	112.7	Y136 P139 F155	Y136-K157 WeakPolarHBondContact OH-CB 3.23Å; P139-K157 HydrophobicContact CG-CD 4.48Å; F155-K157 PolarHBondContact O-N 2.88Å
158	L	98.4	Very high	97.1	Very high	2 Å²	2	62.2 Å²	62.2	1%	0.01	30%	0.302	C	S	.	.			trans	-59.1	137.9	176.4	-170.5	166.8	0	0	0	110.4	R82 M83 M104 I106 Y136 F155 L160 I171	R82-L158 WeakPolarHBondContact CA-O 3.32Å; M83-L158 HydrophobicContact CE-CD1 4.26Å; M83-L158 HydrophobicContact CE-CD2 4.16Å; M104-L158 HydrophobicContact CB-CD1 4.19Å; M104-L158 HydrophobicContact CG-CD1 3.74Å; M104-L158 HydrophobicContact SD-CD1 3.49Å; M104-L158 WeakPolarHBondContact SD-CD1 3.41Å; I106-L158 HydrophobicContact CD1-CD2 4.34Å; Y136-L158 HydrophobicContact CD1-CB 4.09Å; Y136-L158 HydrophobicContact CD1-CD1 3.95Å; Y136-L158 HydrophobicContact CD1-CG 4.2Å; Y136-L158 HydrophobicContact CD2-CB 4Å; Y136-L158 HydrophobicContact CD2-CG 3.96Å; Y136-L158 HydrophobicContact CE1-CB 4.22Å; Y136-L158 HydrophobicContact CE2-CB 4.15Å; Y136-L158 HydrophobicContact CG-CB 3.98Å; Y136-L158 HydrophobicContact CG-CD1 3.78Å; Y136-L158 HydrophobicContact CG-CG 3.73Å; F155-L158 WeakPolarHBondContact O-CB 3.47Å; F155-L158 PolarHBondContact O-N 2.84Å; L158-L160 HydrophobicContact CD2-CD2 3.57Å; L158-L160 HydrophobicContact CD2-CG 4.46Å; L158-I171 HydrophobicContact CD1-CD1 3.99Å; L158-I171 HydrophobicContact CD2-CD1 4.03Å; L158-I171 HydrophobicContact CD2-CG1 4.37Å; L158-I171 HydrophobicContact CG-CD1 4.17Å
159	K	98.4	Very high	97	Very high	65 Å²	65	64.2 Å²	64.2	28%	0.283	32%	0.324	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-125.4	143.8	179.3	-81.6	172.8	157	-160.4	0	111.7	A79 G80 R81 R82 H170 I171	A79-K159 PolarHBondContact O-NZ 2.96Å; G80-K159 WeakPolarHBondContact O-CD 3.34Å; G80-K159 WeakPolarHBondContact O-CE 3.47Å; R81-K159 CarbonylContact O-C 3.57Å; R81-K159 VanDerWaalsContact O-CA 3.3Å; R81-K159 WeakPolarHBondContact O-CA 3.17Å; R82-K159 HydrophobicContact CG-CG 4.16Å; K159-H170 HydrophobicContact CB-CB 4.34Å; K159-H170 VanDerWaalsContact CD-CD2 3.48Å; K159-H170 WeakPolarHBondContact CD-CD2 3.48Å; K159-H170 WeakPolarHBondContact CD-NE2 3.48Å; K159-H170 PolarHBondContact NZ-NE2 2.68Å; K159-I171 PolarHBondContact O-N 2.96Å
160	L	98.5	Very high	97	Very high	0 Å²	0	62.7 Å²	62.7	0%	0	32%	0.316	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-106.8	133.8	175.8	-48.1	-177.6	0	0	0	110.3	M74 I76 G80 R81 M83 I106 L158 I171 L173 F211	M74-L160 HydrophobicContact CB-CD1 3.92Å; M74-L160 HydrophobicContact CG-CD1 4.45Å; I76-L160 HydrophobicContact CG2-CB 3.73Å; I76-L160 HydrophobicContact CG2-CD1 4.36Å; G80-L160 CarbonylContact C-O 3.48Å; G80-L160 WeakPolarHBondContact CA-O 3.32Å; R81-L160 PolarHBondContact N-O 2.8Å; R81-L160 PolarHBondContact O-N 3.1Å; M83-L160 HydrophobicContact CG-CD1 3.73Å; M83-L160 HydrophobicContact CG-CD2 4.4Å; M83-L160 HydrophobicContact CG-CG 4.04Å; M83-L160 HydrophobicContact SD-CD1 4.28Å; M83-L160 HydrophobicContact SD-CD2 4.5Å; I106-L160 HydrophobicContact CD1-CD2 3.42Å; I106-L160 VanDerWaalsContact CD1-CD2 3.42Å; L158-L160 HydrophobicContact CD2-CD2 3.57Å; L158-L160 HydrophobicContact CD2-CG 4.46Å; L160-I171 CarbonylContact C-O 3.57Å; L160-I171 WeakPolarHBondContact CA-O 3.48Å; L160-I171 HydrophobicContact CD2-CB 4.26Å; L160-L173 HydrophobicContact CB-CD1 4.24Å; L160-L173 HydrophobicContact CD1-CD1 3.91Å; L160-L173 HydrophobicContact CD2-CD1 4.04Å; L160-L173 HydrophobicContact CG-CD1 4.29Å; L160-F211 HydrophobicContact CD1-CE2 4.04Å; L160-F211 HydrophobicContact CD1-CZ 3.73Å
161	T	98.3	Very high	97	Very high	0 Å²	0	56 Å²	56	0%	0	29%	0.291	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-131.6	151.2	-178.6	-172.8	0	0	0	0	111.7	T77 K78 N163 D166 H170 I171 I172 L173	T77-T161 WeakPolarHBondContact O-CA 3.29Å; T77-T161 WeakPolarHBondContact O-CB 3.38Å; T77-T161 PolarHBondContact O-OG1 2.99Å; K78-T161 PolarHBondContact O-OG1 2.83Å; T161-N163 WeakPolarHBondContact OG1-CB 3.49Å; T161-N163 PolarHBondContact OG1-N 3.18Å; T161-N163 VanDerWaalsContact OG1-N 3.08Å; T161-D166 HydrophobicContact CG2-CB 3.8Å; T161-H170 HydrophobicContact CG2-CB 3.81Å; T161-I171 PolarHBondContact N-O 3.29Å; T161-I172 HydrophobicContact CG2-CB 4.39Å; T161-I172 HydrophobicContact CG2-CG1 3.79Å; T161-I172 WeakPolarHBondContact O-CA 3.49Å; T161-L173 PolarHBondContact O-N 2.9Å
162	N	96.7	Very high	97	Very high	65 Å²	65	52 Å²	52	35%	0.348	27%	0.273	S	S	.	.			trans	-97.1	1.3	167	68.6	-37	0	0	0	112.7	I76 K78 H164	I76-N162 HydrophobicContact CD1-CB 3.7Å; I76-N162 HydrophobicContact CG1-CB 3.99Å; K78-N162 PolarHBondContact N-OD1 2.83Å; N162-H164 PolarHBondContact O-N 3.47Å
163	N	96.3	Very high	97.1	Very high	36 Å²	36	48.7 Å²	48.7	19%	0.193	26%	0.256	C	S	.	.			trans	-82	104.7	177.4	-178.3	18.5	0	0	0	110.3	K78 T161 L165 D166	K78-N163 HydrophobicContact CG-CB 4.16Å; T161-N163 WeakPolarHBondContact OG1-CB 3.49Å; T161-N163 PolarHBondContact OG1-N 3.18Å; T161-N163 VanDerWaalsContact OG1-N 3.08Å; N163-L165 PolarHBondContact ND2-O 3.34Å; N163-L165 PolarHBondContact O-N 3.29Å; N163-L165 VanDerWaalsContact O-N 3.17Å; N163-L165 PolarHBondContact OD1-N 3.32Å; N163-D166 HydrophobicContact CB-CB 4.21Å; N163-D166 WeakPolarHBondContact ND2-CA 3.47Å; N163-D166 PolarHBondContact ND2-N 3.08Å; N163-D166 VanDerWaalsContact O-CB 3.31Å; N163-D166 WeakPolarHBondContact O-CB 3.46Å; N163-D166 PolarHBondContact O-N 3.07Å; N163-D166 VanDerWaalsContact O-N 3.14Å
164	H	94.1	Very high	97	Very high	86 Å²	86	48.8 Å²	48.8	40%	0.398	26%	0.256	S	S	.	.	T	Hydrogen-bonded Turn	trans	-58.9	-24.1	174.6	-67.5	-179.9	0	0	0	113.1	M131 N162 I172 N174	M131-H164 HydrophobicContact CE-CB 4.22Å; M131-H164 HydrophobicContact SD-CB 4.49Å; N162-H164 PolarHBondContact O-N 3.47Å; H164-I172 WeakPolarHBondContact O-CD1 3.38Å; H164-N174 PolarHBondContact NE2-OD1 3.47Å
165	L	94.1	Very high	97	Very high	151 Å²	151	48.7 Å²	48.7	79%	0.791	26%	0.255	S	S	*	.	T	Hydrogen-bonded Turn	trans	-105.8	39.9	176.7	-55	179.3	0	0	0	111.7	N163 P167	N163-L165 PolarHBondContact ND2-O 3.34Å; N163-L165 PolarHBondContact O-N 3.29Å; N163-L165 VanDerWaalsContact O-N 3.17Å; N163-L165 PolarHBondContact OD1-N 3.32Å; L165-P167 WeakPolarHBondContact O-CD 3.28Å
166	D	95.6	Very high	97	Very high	2 Å²	2	50 Å²	50	1%	0.011	26%	0.262	C	S	.	.			trans	-71.5	118.5	178.3	175.1	91.9	0	0	0	112	R134 T161 N163 F168 G169 H170 I172	R134-D166 PolarHBondContact NH1-O 2.85Å; R134-D166 VanDerWaalsContact NH1-O 3.1Å; R134-D166 IonicContact NH1-OD2 3.61Å; R134-D166 PolarHBondContact NH1-OD2 3.32Å; R134-D166 PolarHBondContact NH2-O 3.28Å; T161-D166 HydrophobicContact CG2-CB 3.8Å; N163-D166 HydrophobicContact CB-CB 4.21Å; N163-D166 WeakPolarHBondContact ND2-CA 3.47Å; N163-D166 PolarHBondContact ND2-N 3.08Å; N163-D166 VanDerWaalsContact O-CB 3.31Å; N163-D166 WeakPolarHBondContact O-CB 3.46Å; N163-D166 PolarHBondContact O-N 3.07Å; N163-D166 VanDerWaalsContact O-N 3.14Å; D166-F168 VanDerWaalsContact C-N 3.32Å; D166-F168 PolarHBondContact O-N 3.18Å; D166-F168 PolarHBondContact OD2-N 2.91Å; D166-G169 PolarHBondContact OD2-N 2.93Å; D166-G169 VanDerWaalsContact OD2-N 3.14Å; D166-H170 IonicContact OD1-CE1 2.96Å; D166-H170 IonicContact OD1-CG 2.68Å; D166-H170 IonicContact OD1-ND1 3.68Å; D166-H170 PolarHBondContact OD1-ND1 3.4Å; D166-H170 IonicContact OD2-CG 2.75Å; D166-H170 PolarHBondContact OD2-N 3.06Å; D166-H170 IonicContact OD2-ND1 3.69Å; D166-H170 PolarHBondContact OD2-ND1 3.36Å; D166-I172 HydrophobicContact CB-CG1 4.49Å
167	P	96	Very high	97	Very high	106 Å²	106	45.8 Å²	45.8	69%	0.688	24%	0.242	S	C	*	.	T	Hydrogen-bonded Turn	trans	-83.8	-4.5	-176.1	35.2	-36.9	0	0	0	113.7	L165	L165-P167 WeakPolarHBondContact O-CD 3.28Å
168	F	95.6	Very high	97.1	Very high	151 Å²	151	43.5 Å²	43.5	66%	0.662	23%	0.232	S	C	*	.	T	Hydrogen-bonded Turn	trans	-97.8	2.3	-171.4	-60.7	-71.2	0	0	0	113.6	D166 H170	D166-F168 VanDerWaalsContact C-N 3.32Å; D166-F168 PolarHBondContact O-N 3.18Å; D166-F168 PolarHBondContact OD2-N 2.91Å; F168-H170 WeakPolarHBondContact CB-CE1 3.47Å; F168-H170 AromaticContact CD2-CE1 3.66Å; F168-H170 AromaticContact CG-CE1 3.73Å; F168-H170 PolarHBondContact O-N 3.11Å
169	G	94.7	Very high	97.1	Very high	46 Å²	46	43.9 Å²	43.9	47%	0.474	23%	0.233	S	C	.	.			trans	70.6	15.7	-175.9	0	0	0	0	0	114.3	D166	D166-G169 PolarHBondContact OD2-N 2.93Å; D166-G169 VanDerWaalsContact OD2-N 3.14Å
170	H	97.7	Very high	97.1	Very high	27 Å²	27	42 Å²	42	13%	0.125	23%	0.226	C	C	.	.	P	Polyproline II helix	trans	-62.4	152.1	174.6	-56.5	135.5	0	0	0	110.7	A79 R134 K159 T161 D166 F168 I172	A79-H170 PolarHBondContact O-CE1 3.28Å; R134-H170 WeakPolarHBondContact CD-O 3.28Å; R134-H170 PolarHBondContact NH1-O 3.45Å; K159-H170 HydrophobicContact CB-CB 4.34Å; K159-H170 VanDerWaalsContact CD-CD2 3.48Å; K159-H170 WeakPolarHBondContact CD-CD2 3.48Å; K159-H170 WeakPolarHBondContact CD-NE2 3.48Å; K159-H170 PolarHBondContact NZ-NE2 2.68Å; T161-H170 HydrophobicContact CG2-CB 3.81Å; D166-H170 IonicContact OD1-CE1 2.96Å; D166-H170 IonicContact OD1-CG 2.68Å; D166-H170 IonicContact OD1-ND1 3.68Å; D166-H170 PolarHBondContact OD1-ND1 3.4Å; D166-H170 IonicContact OD2-CG 2.75Å; D166-H170 PolarHBondContact OD2-N 3.06Å; D166-H170 IonicContact OD2-ND1 3.69Å; D166-H170 PolarHBondContact OD2-ND1 3.36Å; F168-H170 WeakPolarHBondContact CB-CE1 3.47Å; F168-H170 AromaticContact CD2-CE1 3.66Å; F168-H170 AromaticContact CG-CE1 3.73Å; F168-H170 PolarHBondContact O-N 3.11Å; H170-I172 PolarHBondContact O-N 3.08Å
171	I	97.8	Very high	97.1	Very high	6 Å²	6	42 Å²	42	3%	0.031	23%	0.226	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-71.2	121.7	177.7	-59.2	-170.8	0	0	0	109.1	I106 L158 K159 L160 T161 L173	I106-I171 HydrophobicContact CB-CG2 4.27Å; I106-I171 HydrophobicContact CD1-CD1 4.03Å; I106-I171 HydrophobicContact CD1-CG2 4.39Å; I106-I171 HydrophobicContact CG1-CD1 4.05Å; L158-I171 HydrophobicContact CD1-CD1 3.99Å; L158-I171 HydrophobicContact CD2-CD1 4.03Å; L158-I171 HydrophobicContact CD2-CG1 4.37Å; L158-I171 HydrophobicContact CG-CD1 4.17Å; K159-I171 PolarHBondContact O-N 2.96Å; L160-I171 CarbonylContact C-O 3.57Å; L160-I171 WeakPolarHBondContact CA-O 3.48Å; L160-I171 HydrophobicContact CD2-CB 4.26Å; T161-I171 PolarHBondContact N-O 3.29Å; I171-L173 HydrophobicContact CG2-CD2 4Å; I171-L173 HydrophobicContact CG2-CG 4.38Å
172	I	97.9	Very high	97.1	Very high	21 Å²	21	45.6 Å²	45.6	11%	0.108	24%	0.239	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-87.4	128.7	-179.5	-60.6	165.4	0	0	0	108.7	M131 R134 T161 H164 D166 H170	M131-I172 HydrophobicContact CB-CG2 4.18Å; M131-I172 HydrophobicContact CG-CG2 4.04Å; R134-I172 VanDerWaalsContact CZ-CD1 3.47Å; T161-I172 HydrophobicContact CG2-CB 4.39Å; T161-I172 HydrophobicContact CG2-CG1 3.79Å; T161-I172 WeakPolarHBondContact O-CA 3.49Å; H164-I172 WeakPolarHBondContact O-CD1 3.38Å; D166-I172 HydrophobicContact CB-CG1 4.49Å; H170-I172 PolarHBondContact O-N 3.08Å
173	L	97.9	Very high	97.1	Very high	4 Å²	4	42.5 Å²	42.5	2%	0.021	22%	0.223	C	C	.	.			trans	-130.9	147.6	175.5	-55.9	178.3	0	0	0	110.3	I76 I106 L160 T161 I171 Y179 F211 A213	I76-L173 HydrophobicContact CD1-CB 4.47Å; I76-L173 WeakPolarHBondContact CD1-O 3.37Å; I76-L173 HydrophobicContact CG2-CB 4.48Å; I76-L173 HydrophobicContact CG2-CD1 4.26Å; I106-L173 HydrophobicContact CB-CD2 4.37Å; I106-L173 HydrophobicContact CG2-CD1 4.45Å; I106-L173 HydrophobicContact CG2-CD2 3.87Å; L160-L173 HydrophobicContact CB-CD1 4.24Å; L160-L173 HydrophobicContact CD1-CD1 3.91Å; L160-L173 HydrophobicContact CD2-CD1 4.04Å; L160-L173 HydrophobicContact CG-CD1 4.29Å; T161-L173 PolarHBondContact O-N 2.9Å; I171-L173 HydrophobicContact CG2-CD2 4Å; I171-L173 HydrophobicContact CG2-CG 4.38Å; L173-Y179 HydrophobicContact CB-CE2 3.88Å; L173-Y179 HydrophobicContact CD1-CD2 4.18Å; L173-Y179 HydrophobicContact CD1-CE2 4.35Å; L173-Y179 HydrophobicContact CD1-CG 4.48Å; L173-Y179 HydrophobicContact CD2-CD1 3.73Å; L173-Y179 HydrophobicContact CD2-CD2 4.24Å; L173-Y179 HydrophobicContact CD2-CE1 3.62Å; L173-Y179 HydrophobicContact CD2-CE2 4.11Å; L173-Y179 HydrophobicContact CD2-CG 4.06Å; L173-Y179 HydrophobicContact CG-CE2 4.34Å; L173-F211 HydrophobicContact CD1-CE2 3.84Å; L173-F211 HydrophobicContact CD1-CZ 3.83Å; L173-A213 HydrophobicContact CB-CB 4.13Å; L173-A213 HydrophobicContact CD1-CB 4.01Å
174	N	97.6	Very high	97.2	Very high	7 Å²	7	41.8 Å²	41.8	4%	0.037	22%	0.218	C	C	.	.			trans	-83.7	137.9	170.7	-64	-19.1	0	0	0	108.6	E128 P129 H164 H177 Y179	E128-N174 PolarHBondContact O-ND2 3.34Å; P129-N174 PolarHBondContact O-ND2 3.13Å; P129-N174 VanDerWaalsContact O-ND2 3.08Å; H164-N174 PolarHBondContact NE2-OD1 3.47Å; N174-H177 WeakPolarHBondContact CB-ND1 3.27Å; N174-Y179 PolarHBondContact N-OH 2.85Å; N174-Y179 PolarHBondContact O-OH 2.83Å
175	S	98	Very high	97.4	Very high	27 Å²	27	37.7 Å²	37.7	19%	0.189	20%	0.199	C	C	.	.	T	Hydrogen-bonded Turn	trans	-69.4	152.2	178.7	-165.4	0	0	0	0	110.8	H177 A213 T215	S175-H177 VanDerWaalsContact C-N 3.25Å; S175-H177 PolarHBondContact O-CE1 3.22Å; S175-H177 PolarHBondContact O-N 2.96Å; S175-H177 PolarHBondContact O-ND1 3.28Å; S175-A213 CarbonylContact C-O 3.55Å; S175-T215 PolarHBondContact OG-N 3.05Å
176	M	98.1	Very high	97.5	Very high	30 Å²	30	32.1 Å²	32.1	15%	0.148	17%	0.171	C	C	.	.	T	Hydrogen-bonded Turn	trans	63.7	24.2	-179.4	-42.8	-52.7	-75.5	0	0	114.8	Y114 W121 A213 V214 Q218	Y114-M176 WeakPolarHBondContact CB-O 3.33Å; Y114-M176 PolarHBondContact N-O 3.35Å; Y114-M176 WeakPolarHBondContact O-CB 3.49Å; W121-M176 HydrophobicContact CH2-CE 3.87Å; W121-M176 HydrophobicContact CZ3-CE 3.76Å; M176-A213 PolarHBondContact N-O 2.83Å; M176-V214 HydrophobicContact SD-CG1 4.02Å; M176-Q218 HydrophobicContact CE-CG 4.24Å
177	H	98.4	Very high	97.4	Very high	7 Å²	7	34.7 Å²	34.7	3%	0.032	18%	0.182	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-116.6	150.9	174.6	-64.7	82.9	0	0	0	110.5	H112 A127 E128 N174 S175 Y179 I212 A213	H112-H177 PolarHBondContact O-CD2 3.43Å; A127-H177 WeakPolarHBondContact CA-NE2 3.48Å; E128-H177 PolarHBondContact N-NE2 3.09Å; E128-H177 IonicContact OE1-CE1 3.78Å; E128-H177 IonicContact OE2-CE1 3.99Å; N174-H177 WeakPolarHBondContact CB-ND1 3.27Å; S175-H177 VanDerWaalsContact C-N 3.25Å; S175-H177 PolarHBondContact O-CE1 3.22Å; S175-H177 PolarHBondContact O-N 2.96Å; S175-H177 PolarHBondContact O-ND1 3.28Å; H177-Y179 HydrophobicContact CB-CE2 3.66Å; H177-Y179 VanDerWaalsContact O-CD2 3.26Å; H177-Y179 WeakPolarHBondContact O-CD2 3.39Å; H177-Y179 WeakPolarHBondContact O-CE2 3.26Å; H177-I212 WeakPolarHBondContact O-CA 3.2Å; H177-A213 PolarHBondContact O-N 3.4Å
178	K	98.4	Very high	97.3	Very high	75 Å²	75	29.7 Å²	29.7	33%	0.326	15%	0.15	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-95.4	138.6	-178.3	-164	-166.4	-177.3	-172.1	0	111	A109 D110 Y114 F211 I212	A109-K178 HydrophobicContact CB-CB 4.24Å; A109-K178 HydrophobicContact CB-CD 3.91Å; A109-K178 HydrophobicContact CB-CG 3.94Å; A109-K178 PolarHBondContact N-O 3.44Å; D110-K178 WeakPolarHBondContact OD2-CD 3.43Å; D110-K178 IonicContact OD2-NZ 3.34Å; Y114-K178 HydrophobicContact CD2-CB 4.35Å; Y114-K178 HydrophobicContact CE2-CB 3.81Å; K178-F211 CarbonylContact C-O 3.58Å; K178-F211 WeakPolarHBondContact CA-O 3.34Å; K178-I212 HydrophobicContact CB-CG1 4.08Å; K178-I212 HydrophobicContact CG-CG1 4.02Å
179	Y	98.6	Very high	97	Very high	10 Å²	10	23.7 Å²	23.7	4%	0.039	13%	0.125	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-134.9	150.9	-171.5	-69.1	-76.9	0	0	0	112.6	I106 V107 P108 L173 N174 H177 A210 F211 A213	I106-Y179 HydrophobicContact CG2-CD1 4.02Å; I106-Y179 HydrophobicContact CG2-CG 4.02Å; V107-Y179 CarbonylContact O-C 3.59Å; V107-Y179 VanDerWaalsContact O-CA 3.32Å; V107-Y179 WeakPolarHBondContact O-CA 3.28Å; V107-Y179 WeakPolarHBondContact O-CD1 3.49Å; P108-Y179 HydrophobicContact CG-CE1 4.19Å; L173-Y179 HydrophobicContact CB-CE2 3.88Å; L173-Y179 HydrophobicContact CD1-CD2 4.18Å; L173-Y179 HydrophobicContact CD1-CE2 4.35Å; L173-Y179 HydrophobicContact CD1-CG 4.48Å; L173-Y179 HydrophobicContact CD2-CD1 3.73Å; L173-Y179 HydrophobicContact CD2-CD2 4.24Å; L173-Y179 HydrophobicContact CD2-CE1 3.62Å; L173-Y179 HydrophobicContact CD2-CE2 4.11Å; L173-Y179 HydrophobicContact CD2-CG 4.06Å; L173-Y179 HydrophobicContact CG-CE2 4.34Å; N174-Y179 PolarHBondContact N-OH 2.85Å; N174-Y179 PolarHBondContact O-OH 2.83Å; H177-Y179 HydrophobicContact CB-CE2 3.66Å; H177-Y179 VanDerWaalsContact O-CD2 3.26Å; H177-Y179 WeakPolarHBondContact O-CD2 3.39Å; H177-Y179 WeakPolarHBondContact O-CE2 3.26Å; Y179-A210 CarbonylContact O-C 3.51Å; Y179-A210 VanDerWaalsContact O-CA 3.25Å; Y179-A210 WeakPolarHBondContact O-CA 3.48Å; Y179-F211 HydrophobicContact CD2-CE2 4.3Å; Y179-F211 PolarHBondContact N-O 2.93Å; Y179-F211 PolarHBondContact O-N 2.74Å; Y179-A213 HydrophobicContact CD2-CB 3.78Å; Y179-A213 HydrophobicContact CE2-CB 3.7Å
180	Q	98.4	Very high	96.5	Very high	25 Å²	25	30.2 Å²	30.2	12%	0.117	14%	0.143	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-122.2	112.8	176.1	176.8	60.8	70.7	0	0	109.6	V107 A109 V205 F206 T209	V107-Q180 HydrophobicContact CG2-CB 4.31Å; V107-Q180 PolarHBondContact N-O 2.88Å; V107-Q180 VanDerWaalsContact N-O 3.1Å; V107-Q180 PolarHBondContact O-N 3.37Å; A109-Q180 HydrophobicContact CB-CB 4.35Å; Q180-V205 HydrophobicContact CG-CG1 3.47Å; Q180-V205 VanDerWaalsContact CG-CG1 3.47Å; Q180-F206 PolarHBondContact NE2-O 2.8Å; Q180-T209 PolarHBondContact NE2-OG1 2.99Å
181	P	98.4	Very high	95.9	Very high	0 Å²	0	36.1 Å²	36.1	0%	0	18%	0.176	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-62.5	141.8	166.9	-22.5	34.4	0	0	0	111.6	Y87 M104 I106 T209 F211	Y87-P181 HydrophobicContact CD2-CB 4.26Å; Y87-P181 HydrophobicContact CE2-CB 4.06Å; M104-P181 HydrophobicContact CE-CB 4.15Å; M104-P181 HydrophobicContact SD-CB 4.48Å; I106-P181 HydrophobicContact CG1-CB 4.46Å; P181-T209 WeakPolarHBondContact CD-O 3.4Å; P181-F211 HydrophobicContact CG-CD1 4.16Å; P181-F211 HydrophobicContact CG-CE1 3.86Å
182	R	98.1	Very high	95.3	Very high	76 Å²	76	38.3 Å²	38.3	29%	0.287	19%	0.187	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-129.7	136.4	172.6	-46.3	-170.3	-64.4	-179.1	2.1	110	M104 D105 V107 T203 V205	M104-R182 WeakPolarHBondContact CA-O 3.47Å; D105-R182 PolarHBondContact N-O 2.97Å; D105-R182 VanDerWaalsContact N-O 3.17Å; D105-R182 PolarHBondContact O-N 3.38Å; D105-R182 WeakPolarHBondContact OD1-CB 3.49Å; D105-R182 WeakPolarHBondContact OD1-CG 3.27Å; D105-R182 IonicContact OD1-CZ 3.77Å; D105-R182 IonicContact OD1-NE 3.56Å; D105-R182 PolarHBondContact OD1-NE 3.49Å; D105-R182 IonicContact OD1-NH2 3.6Å; D105-R182 IonicContact OD2-CZ 2.74Å; D105-R182 IonicContact OD2-NE 2.68Å; D105-R182 PolarHBondContact OD2-NE 3.09Å; D105-R182 IonicContact OD2-NH2 3.49Å; D105-R182 PolarHBondContact OD2-NH2 2.79Å; V107-R182 HydrophobicContact CG2-CG 4.15Å; R182-T203 HydrophobicContact CB-CG2 4.11Å; R182-V205 HydrophobicContact CB-CG2 4.45Å; R182-V205 HydrophobicContact CG-CG2 4.1Å
183	L	98.4	Very high	94.4	Very high	0 Å²	0	38.5 Å²	38.5	0%	0	20%	0.195	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-95.2	129.9	169.7	176	72.4	0	0	0	108.9	V56 Y87 V89 F155 I185 T203 H204	V56-L183 HydrophobicContact CB-CD2 4.48Å; V56-L183 HydrophobicContact CG1-CD2 3.62Å; V56-L183 HydrophobicContact CG2-CD2 4.09Å; Y87-L183 HydrophobicContact CE1-CB 4.42Å; V89-L183 HydrophobicContact CG1-CD2 4.44Å; V89-L183 HydrophobicContact CG2-CD2 3.99Å; F155-L183 HydrophobicContact CE1-CD1 4.42Å; F155-L183 HydrophobicContact CE2-CD1 3.63Å; F155-L183 HydrophobicContact CZ-CD1 3.43Å; F155-L183 VanDerWaalsContact CZ-CD1 3.43Å; L183-I185 HydrophobicContact CD2-CD1 4.48Å; L183-I185 HydrophobicContact CD2-CG1 4.46Å; L183-T203 CarbonylContact O-C 3.46Å; L183-T203 VanDerWaalsContact O-CA 3.31Å; L183-T203 WeakPolarHBondContact O-CA 3.49Å; L183-H204 PolarHBondContact N-O 3.23Å; L183-H204 PolarHBondContact O-N 2.88Å
184	H	97.4	Very high	94	Very high	21 Å²	21	41.8 Å²	41.8	10%	0.097	21%	0.209	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-113.7	135.1	171.4	-53.2	-89.7	0	0	0	110.1	L103 D105 C202 T203	L103-H184 HydrophobicContact CD1-CB 3.7Å; L103-H184 HydrophobicContact CG-CB 4.02Å; L103-H184 PolarHBondContact N-O 2.9Å; L103-H184 PolarHBondContact O-N 3.11Å; D105-H184 IonicContact OD1-NE2 2.72Å; D105-H184 PolarHBondContact OD1-NE2 3.42Å; D105-H184 IonicContact OD2-NE2 3.05Å; H184-C202 WeakPolarHBondContact CA-O 3.42Å; H184-T203 WeakPolarHBondContact CE1-CG2 3.47Å; H184-T203 PolarHBondContact CE1-OG1 3.14Å; H184-T203 WeakPolarHBondContact ND1-CG2 3.46Å; H184-T203 PolarHBondContact ND1-OG1 2.87Å
185	I	97.3	Very high	93.1	Very high	0 Å²	0	45.1 Å²	45.1	0%	0	25%	0.245	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-115.6	122.3	171.8	-60.4	171.1	0	0	0	106.1	M51 I54 V56 V91 L94 Y100 L102 L183 F201 C202	M51-I185 HydrophobicContact CE-CB 4.21Å; M51-I185 HydrophobicContact CE-CG2 3.88Å; I54-I185 HydrophobicContact CG2-CD1 3.84Å; V56-I185 HydrophobicContact CG2-CD1 3.82Å; V91-I185 HydrophobicContact CG1-CD1 4.04Å; L94-I185 HydrophobicContact CD2-CG2 4.11Å; Y100-I185 HydrophobicContact CD1-CG2 3.65Å; Y100-I185 HydrophobicContact CE1-CG2 4.35Å; Y100-I185 HydrophobicContact CG-CG2 4.36Å; L102-I185 HydrophobicContact CD1-CB 4.35Å; L102-I185 HydrophobicContact CD1-CG1 4.01Å; L102-I185 HydrophobicContact CD1-CG2 3.96Å; L102-I185 HydrophobicContact CG-CG1 4Å; L183-I185 HydrophobicContact CD2-CD1 4.48Å; L183-I185 HydrophobicContact CD2-CG1 4.46Å; I185-F201 VanDerWaalsContact O-CA 3.24Å; I185-F201 WeakPolarHBondContact O-CA 3.35Å; I185-C202 PolarHBondContact N-O 2.88Å; I185-C202 PolarHBondContact O-N 3.31Å
186	V	96.4	Very high	92.4	Very high	34 Å²	34	45.8 Å²	45.8	21%	0.206	25%	0.25	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-110.1	122.7	175.7	-174.6	0	0	0	0	108.6	Y100 I101 L103 F194 F201	Y100-V186 CarbonylContact C-O 3.53Å; Y100-V186 WeakPolarHBondContact CA-O 3.43Å; I101-V186 HydrophobicContact CB-CB 4.38Å; I101-V186 PolarHBondContact N-O 2.86Å; I101-V186 PolarHBondContact O-N 3.02Å; L103-V186 HydrophobicContact CD2-CG2 4.45Å; V186-F194 HydrophobicContact CG1-CD1 4.31Å; V186-F201 HydrophobicContact CG2-CB 4.2Å
187	K	94.8	Very high	91.5	Very high	55 Å²	55	54.1 Å²	54.1	24%	0.239	29%	0.285	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-89.1	129.6	-179.7	-178	-172	170	-170.4	0	109.8	G50 M51 T98 Y100 T199 A200	G50-K187 PolarHBondContact O-NZ 2.81Å; M51-K187 HydrophobicContact CE-CB 4.24Å; M51-K187 HydrophobicContact CG-CD 4.12Å; M51-K187 HydrophobicContact SD-CB 4.12Å; T98-K187 HydrophobicContact CG2-CG 4.08Å; Y100-K187 HydrophobicContact CD1-CB 3.9Å; Y100-K187 HydrophobicContact CD1-CG 4.28Å; Y100-K187 HydrophobicContact CE1-CB 3.66Å; Y100-K187 HydrophobicContact CE1-CD 4.43Å; Y100-K187 HydrophobicContact CE1-CG 3.65Å; K187-T199 WeakPolarHBondContact O-CA 3.47Å; K187-T199 WeakPolarHBondContact O-CB 3.39Å; K187-A200 WeakPolarHBondContact CB-O 3.43Å; K187-A200 HydrophobicContact CD-CB 4.46Å; K187-A200 PolarHBondContact N-O 2.85Å
188	A	93.1	Very high	90.5	Very high	2 Å²	2	58.8 Å²	58.8	2%	0.017	31%	0.31	C	S	.	.			trans	-65.5	157.2	170.4	0	0	0	0	0	111.8	T98 K99 G193 F194	T98-A188 HydrophobicContact CG2-CB 4.26Å; K99-A188 HydrophobicContact CB-CB 3.99Å; K99-A188 WeakPolarHBondContact O-CB 3.39Å; K99-A188 PolarHBondContact O-N 3.07Å; A188-G193 VanDerWaalsContact CA-O 3.23Å; A188-G193 WeakPolarHBondContact CA-O 3.36Å; A188-G193 VanDerWaalsContact CB-O 3.31Å; A188-G193 WeakPolarHBondContact CB-O 3.36Å; A188-F194 HydrophobicContact CB-CD1 4.29Å; A188-F194 HydrophobicContact CB-CE1 3.76Å; A188-F194 HydrophobicContact CB-CE2 4.2Å; A188-F194 HydrophobicContact CB-CZ 3.71Å
189	D	89.9	Confident	89.9	Confident	24 Å²	24	57 Å²	57	13%	0.128	31%	0.306	C	S	.	.			trans	-72.7	-176.6	172.5	60.7	37	0	0	0	113.1	N191 N192 G193 S196 N198	D189-N191 VanDerWaalsContact C-N 3.26Å; D189-N191 PolarHBondContact O-N 3.05Å; D189-N191 WeakPolarHBondContact OD1-CA 3.27Å; D189-N191 WeakPolarHBondContact OD1-CB 3.47Å; D189-N191 PolarHBondContact OD1-N 2.78Å; D189-N192 WeakPolarHBondContact O-CA 3.21Å; D189-N192 PolarHBondContact O-N 2.83Å; D189-N192 PolarHBondContact OD1-N 2.94Å; D189-N192 VanDerWaalsContact OD1-N 3.1Å; D189-G193 PolarHBondContact N-O 3.23Å; D189-G193 PolarHBondContact OD1-N 2.98Å; D189-S196 WeakPolarHBondContact CB-OG 3.43Å; D189-S196 VanDerWaalsContact OD2-CB 3.3Å; D189-S196 WeakPolarHBondContact OD2-CB 3.38Å; D189-S196 PolarHBondContact OD2-OG 3.09Å; D189-N198 HydrophobicContact CB-CB 4.23Å
190	E	84.7	Confident	89.4	Confident	184 Å²	184	57 Å²	57	86%	0.86	31%	0.308	S	S	*	.	T	Hydrogen-bonded Turn	trans	-64.3	-29.6	-179.2	-62	179	176.2	0	0	112.8	N192	E190-N192 PolarHBondContact O-N 3.11Å
191	N	85.1	Confident	89	Confident	151 Å²	151	59.6 Å²	59.6	81%	0.807	32%	0.319	S	S	*	.	T	Hydrogen-bonded Turn	trans	-80.8	4.1	171.8	-61.6	101.9	0	0	0	112.6	D189 G193	D189-N191 VanDerWaalsContact C-N 3.26Å; D189-N191 PolarHBondContact O-N 3.05Å; D189-N191 WeakPolarHBondContact OD1-CA 3.27Å; D189-N191 WeakPolarHBondContact OD1-CB 3.47Å; D189-N191 PolarHBondContact OD1-N 2.78Å; N191-G193 PolarHBondContact O-N 3.48Å
192	N	83.3	Confident	88.7	Confident	51 Å²	51	59.6 Å²	59.6	27%	0.273	32%	0.319	S	S	.	.	S	Bend	trans	64.5	25.8	-179.9	-140.2	8.2	0	0	0	113.1	K99 D189 E190	K99-N192 WeakPolarHBondContact CB-OD1 3.48Å; K99-N192 VanDerWaalsContact CG-OD1 3.25Å; K99-N192 WeakPolarHBondContact CG-OD1 3.12Å; K99-N192 PolarHBondContact N-OD1 2.95Å; D189-N192 WeakPolarHBondContact O-CA 3.21Å; D189-N192 PolarHBondContact O-N 2.83Å; D189-N192 PolarHBondContact OD1-N 2.94Å; D189-N192 VanDerWaalsContact OD1-N 3.1Å; E190-N192 PolarHBondContact O-N 3.11Å
193	G	81	Confident	88.7	Confident	26 Å²	26	56.6 Å²	56.6	27%	0.268	31%	0.309	S	S	.	.			trans	-98.9	174.3	176.9	0	0	0	0	0	113.6	A188 D189 N191	A188-G193 VanDerWaalsContact CA-O 3.23Å; A188-G193 WeakPolarHBondContact CA-O 3.36Å; A188-G193 VanDerWaalsContact CB-O 3.31Å; A188-G193 WeakPolarHBondContact CB-O 3.36Å; D189-G193 PolarHBondContact N-O 3.23Å; D189-G193 PolarHBondContact OD1-N 2.98Å; N191-G193 PolarHBondContact O-N 3.48Å
194	F	88.8	Confident	88.6	Confident	72 Å²	72	57.4 Å²	57.4	32%	0.316	31%	0.313	S	S	.	.	S	Bend	trans	-131.6	148.9	177.1	-60.8	-84.3	0	0	0	109.9	K99 I101 P142 V186 A188	K99-F194 HydrophobicContact CB-CE2 4.31Å; K99-F194 HydrophobicContact CB-CZ 3.98Å; I101-F194 HydrophobicContact CB-CE1 4.41Å; I101-F194 HydrophobicContact CD1-CD1 3.79Å; I101-F194 HydrophobicContact CD1-CD2 4.04Å; I101-F194 HydrophobicContact CD1-CE1 3.79Å; I101-F194 HydrophobicContact CD1-CE2 4.05Å; I101-F194 HydrophobicContact CD1-CG 3.91Å; I101-F194 HydrophobicContact CD1-CZ 3.92Å; I101-F194 HydrophobicContact CG1-CD1 4.31Å; I101-F194 HydrophobicContact CG1-CE1 3.77Å; I101-F194 HydrophobicContact CG1-CE2 4.14Å; I101-F194 HydrophobicContact CG1-CZ 3.68Å; P142-F194 HydrophobicContact CB-CE2 3.55Å; P142-F194 HydrophobicContact CB-CZ 3.81Å; P142-F194 HydrophobicContact CG-CE2 4.14Å; V186-F194 HydrophobicContact CG1-CD1 4.31Å; A188-F194 HydrophobicContact CB-CD1 4.29Å; A188-F194 HydrophobicContact CB-CE1 3.76Å; A188-F194 HydrophobicContact CB-CE2 4.2Å; A188-F194 HydrophobicContact CB-CZ 3.71Å
195	G	79	Confident	88.6	Confident	77 Å²	77	57.6 Å²	57.6	79%	0.794	32%	0.315	S	S	*	.	S	Bend	trans	94.9	-2.2	-179.2	0	0	0	0	0	115.1
196	S	81.9	Confident	88.6	Confident	42 Å²	42	57.8 Å²	57.8	29%	0.294	32%	0.316	S	S	.	.	S	Bend	trans	-80.5	156.2	167.4	73.6	0	0	0	0	111.2	D189 N198 T199	D189-S196 WeakPolarHBondContact CB-OG 3.43Å; D189-S196 VanDerWaalsContact OD2-CB 3.3Å; D189-S196 WeakPolarHBondContact OD2-CB 3.38Å; D189-S196 PolarHBondContact OD2-OG 3.09Å; S196-N198 PolarHBondContact O-N 2.94Å; S196-T199 PolarHBondContact O-N 2.75Å; S196-T199 VanDerWaalsContact O-N 3.11Å; S196-T199 PolarHBondContact O-OG1 3.19Å; S196-T199 VanDerWaalsContact O-OG1 3.07Å
197	K	79.3	Confident	88.7	Confident	205 Å²	205	56.7 Å²	56.7	89%	0.891	31%	0.31	S	S	*	.	T	Hydrogen-bonded Turn	trans	-61.8	-8.3	176.1	68.9	179.4	-177.2	177.5	0	114.7
198	N	78.2	Confident	88.9	Confident	104 Å²	104	54.1 Å²	54.1	56%	0.556	30%	0.298	S	S	*	.	T	Hydrogen-bonded Turn	trans	-96.1	-3.2	179.7	-68.3	10.8	0	0	0	112.7	D189 S196	D189-N198 HydrophobicContact CB-CB 4.23Å; S196-N198 PolarHBondContact O-N 2.94Å
199	T	85.2	Confident	89.1	Confident	39 Å²	39	54 Å²	54	24%	0.239	30%	0.298	C	S	.	.			trans	-70	130.1	170.2	60	0	0	0	0	110.2	K187 S196	K187-T199 WeakPolarHBondContact O-CA 3.47Å; K187-T199 WeakPolarHBondContact O-CB 3.39Å; S196-T199 PolarHBondContact O-N 2.75Å; S196-T199 VanDerWaalsContact O-N 3.11Å; S196-T199 PolarHBondContact O-OG1 3.19Å; S196-T199 VanDerWaalsContact O-OG1 3.07Å
200	A	87.9	Confident	89.5	Confident	9 Å²	9	53.4 Å²	53.4	7%	0.074	30%	0.296	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-107.7	153	175.8	0	0	0	0	0	110.8	Q48 M51 K187	Q48-A200 HydrophobicContact CB-CB 4.18Å; M51-A200 HydrophobicContact CG-CB 3.95Å; M51-A200 HydrophobicContact SD-CB 3.65Å; K187-A200 WeakPolarHBondContact CB-O 3.43Å; K187-A200 HydrophobicContact CD-CB 4.46Å; K187-A200 PolarHBondContact N-O 2.85Å
201	F	90.7	Very high	90.2	Very high	79 Å²	79	44.8 Å²	44.8	35%	0.346	26%	0.256	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-129.5	151.4	170.6	72.6	-90.5	0	0	0	113.3	F46 Q48 M51 I185 V186	F46-F201 AromaticContact CD1-CE2 3.88Å; F46-F201 HydrophobicContact CD1-CE2 3.88Å; F46-F201 HydrophobicContact CD1-CZ 4.44Å; F46-F201 AromaticContact CE1-CE2 3.81Å; F46-F201 HydrophobicContact CE1-CE2 3.81Å; F46-F201 AromaticContact CE1-CZ 3.92Å; F46-F201 HydrophobicContact CE1-CZ 3.92Å; Q48-F201 WeakPolarHBondContact CB-O 3.19Å; Q48-F201 WeakPolarHBondContact CG-O 3.45Å; Q48-F201 PolarHBondContact N-O 2.59Å; Q48-F201 VanDerWaalsContact NE2-CE1 3.32Å; M51-F201 WeakPolarHBondContact SD-CA 3.23Å; M51-F201 PolarHBondContact SD-N 3.18Å; I185-F201 VanDerWaalsContact O-CA 3.24Å; I185-F201 WeakPolarHBondContact O-CA 3.35Å; V186-F201 HydrophobicContact CG2-CB 4.2Å
202	C	93	Very high	90.9	Very high	0 Å²	0	38.3 Å²	38.3	0%	0	22%	0.221	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-123.4	154.5	162.3	75.1	0	0	0	0	110.7	F46 T47 M51 H184 I185 H204	F46-C202 CarbonylContact O-C 3.46Å; F46-C202 WeakPolarHBondContact O-CA 3.37Å; F46-C202 WeakPolarHBondContact O-CB 3.44Å; T47-C202 HydrophobicContact CG2-CB 4.11Å; M51-C202 HydrophobicContact CE-CB 3.95Å; M51-C202 HydrophobicContact SD-CB 4.31Å; H184-C202 WeakPolarHBondContact CA-O 3.42Å; I185-C202 PolarHBondContact N-O 2.88Å; I185-C202 PolarHBondContact O-N 3.31Å; C202-H204 PolarHBondContact SG-NE2 3.24Å
203	T	96.3	Very high	91.6	Very high	13 Å²	13	35.9 Å²	35.9	8%	0.08	21%	0.208	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-128.2	124.3	-179.6	-56.8	0	0	0	0	108.5	A45 F46 R182 L183 H184 V205	A45-T203 CarbonylContact C-O 3.59Å; A45-T203 VanDerWaalsContact CA-O 3.27Å; A45-T203 WeakPolarHBondContact CA-O 3.32Å; F46-T203 PolarHBondContact N-O 3.32Å; F46-T203 PolarHBondContact O-N 2.98Å; R182-T203 HydrophobicContact CB-CG2 4.11Å; L183-T203 CarbonylContact O-C 3.46Å; L183-T203 VanDerWaalsContact O-CA 3.31Å; L183-T203 WeakPolarHBondContact O-CA 3.49Å; H184-T203 WeakPolarHBondContact CE1-CG2 3.47Å; H184-T203 PolarHBondContact CE1-OG1 3.14Å; H184-T203 WeakPolarHBondContact ND1-CG2 3.46Å; H184-T203 PolarHBondContact ND1-OG1 2.87Å; T203-V205 HydrophobicContact CG2-CG2 4.37Å
204	H	96.6	Very high	92.4	Very high	17 Å²	17	34.7 Å²	34.7	8%	0.079	20%	0.195	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-115.1	134	178.1	-65.1	-86.8	0	0	0	110.5	V56 L183 C202	V56-H204 HydrophobicContact CB-CB 4.49Å; V56-H204 VanDerWaalsContact CG2-CD2 3.46Å; V56-H204 WeakPolarHBondContact CG2-CD2 3.3Å; L183-H204 PolarHBondContact N-O 3.23Å; L183-H204 PolarHBondContact O-N 2.88Å; C202-H204 PolarHBondContact SG-NE2 3.24Å
205	V	98	Very high	92.9	Very high	25 Å²	25	34.9 Å²	34.9	15%	0.152	20%	0.203	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-125.7	127.7	-176.1	-172.4	0	0	0	0	109.8	A44 Q180 R182 T203	A44-V205 HydrophobicContact CB-CB 4.3Å; A44-V205 PolarHBondContact N-O 3.45Å; A44-V205 PolarHBondContact O-N 3.33Å; Q180-V205 HydrophobicContact CG-CG1 3.47Å; Q180-V205 VanDerWaalsContact CG-CG1 3.47Å; R182-V205 HydrophobicContact CB-CG2 4.45Å; R182-V205 HydrophobicContact CG-CG2 4.1Å; T203-V205 HydrophobicContact CG2-CG2 4.37Å
206	F	98.2	Very high	93.8	Very high	5 Å²	5	34.3 Å²	34.3	2%	0.022	19%	0.187	C	C	.	.			trans	-111.7	101.3	175.6	-63.3	-55.8	0	0	0	109.2	Q43 V56 L58 Y87 V89 Q180 E208 T209	Q43-F206 HydrophobicContact CG-CD1 4.07Å; V56-F206 HydrophobicContact CB-CZ 4.33Å; V56-F206 HydrophobicContact CG1-CE2 4.05Å; V56-F206 HydrophobicContact CG1-CZ 3.89Å; L58-F206 HydrophobicContact CB-CD1 4.3Å; L58-F206 HydrophobicContact CB-CD2 3.94Å; L58-F206 HydrophobicContact CB-CE1 4.29Å; L58-F206 HydrophobicContact CB-CE2 3.94Å; L58-F206 HydrophobicContact CB-CG 4.14Å; L58-F206 HydrophobicContact CB-CZ 4.13Å; L58-F206 HydrophobicContact CD1-CD2 4.02Å; L58-F206 HydrophobicContact CD1-CE2 4.43Å; L58-F206 HydrophobicContact CD2-CB 4.21Å; L58-F206 HydrophobicContact CD2-CD2 4.47Å; L58-F206 HydrophobicContact CD2-CG 4.29Å; L58-F206 HydrophobicContact CG-CD2 4.37Å; Y87-F206 HydrophobicContact CE2-CD2 4.21Å; Y87-F206 AromaticContact CZ-CD2 3.9Å; Y87-F206 VanDerWaalsContact OH-CD2 3.27Å; Y87-F206 WeakPolarHBondContact OH-CD2 3.48Å; V89-F206 HydrophobicContact CG1-CE2 3.98Å; Q180-F206 PolarHBondContact NE2-O 2.8Å; F206-E208 VanDerWaalsContact CA-OE2 3.28Å; F206-E208 WeakPolarHBondContact CA-OE2 3.4Å; F206-E208 HydrophobicContact CB-CG 4.38Å; F206-E208 WeakPolarHBondContact CB-OE2 3.45Å; F206-E208 PolarHBondContact O-N 2.97Å; F206-T209 HydrophobicContact CB-CG2 3.79Å; F206-T209 WeakPolarHBondContact O-CB 3.41Å; F206-T209 PolarHBondContact O-N 3.46Å; F206-T209 PolarHBondContact O-OG1 3.05Å
207	P	98.1	Very high	94.6	Very high	11 Å²	11	35.6 Å²	35.6	7%	0.071	19%	0.185	C	C	.	.	G	3₁₀ helix	trans	-57.2	-28.9	-179.8	-28	37.5	0	0	0	114.2	P39 P42 H68 T209 A210	P39-P207 HydrophobicContact CB-CB 3.98Å; P39-P207 HydrophobicContact CG-CB 4.26Å; P42-P207 WeakPolarHBondContact O-CG 3.41Å; H68-P207 PolarHBondContact CE1-O 3.49Å; H68-P207 PolarHBondContact ND1-O 2.62Å; P207-T209 PolarHBondContact O-N 3Å; P207-A210 WeakPolarHBondContact O-CB 3.4Å; P207-A210 PolarHBondContact O-N 2.72Å; P207-A210 VanDerWaalsContact O-N 3.13Å
208	E	97.9	Very high	95.5	Very high	0 Å²	0	28.8 Å²	28.8	0%	0	16%	0.157	C	C	.	.	G	3₁₀ helix	trans	-64.1	-14.7	172.9	59.6	-91	-107	0	0	113.7	P39 Q43 L58 R61 W64 L65 F206	P39-E208 HydrophobicContact CG-CB 4.39Å; Q43-E208 PolarHBondContact NE2-OE1 3.47Å; L58-E208 HydrophobicContact CD2-CG 3.66Å; R61-E208 IonicContact CZ-OE1 3.19Å; R61-E208 IonicContact NE-OE1 3.86Å; R61-E208 PolarHBondContact NE-OE1 3.49Å; R61-E208 IonicContact NH2-OE1 2.77Å; R61-E208 PolarHBondContact NH2-OE1 3.42Å; W64-E208 HydrophobicContact CB-CG 4.47Å; L65-E208 HydrophobicContact CD2-CB 3.72Å; L65-E208 HydrophobicContact CD2-CG 4.41Å; F206-E208 VanDerWaalsContact CA-OE2 3.28Å; F206-E208 WeakPolarHBondContact CA-OE2 3.4Å; F206-E208 HydrophobicContact CB-CG 4.38Å; F206-E208 WeakPolarHBondContact CB-OE2 3.45Å; F206-E208 PolarHBondContact O-N 2.97Å
209	T	98.6	Very high	96.4	Very high	0 Å²	0	24.4 Å²	24.4	0%	0	13%	0.133	C	C	.	.	G	3₁₀ helix	trans	-94.7	-1.9	175.4	68.6	0	0	0	0	114.3	L58 W64 Y87 Q180 P181 F206 P207	L58-T209 HydrophobicContact CD1-CG2 3.86Å; L58-T209 HydrophobicContact CD2-CG2 3.51Å; L58-T209 HydrophobicContact CG-CG2 4.36Å; W64-T209 HydrophobicContact CD2-CG2 3.81Å; W64-T209 HydrophobicContact CE3-CG2 3.89Å; W64-T209 HydrophobicContact CG-CG2 4.27Å; W64-T209 HydrophobicContact CH2-CG2 4.4Å; W64-T209 HydrophobicContact CZ2-CG2 4.35Å; W64-T209 HydrophobicContact CZ3-CG2 4.18Å; Y87-T209 HydrophobicContact CD2-CG2 4.05Å; Y87-T209 HydrophobicContact CE2-CG2 3.9Å; Q180-T209 PolarHBondContact NE2-OG1 2.99Å; P181-T209 WeakPolarHBondContact CD-O 3.4Å; F206-T209 HydrophobicContact CB-CG2 3.79Å; F206-T209 WeakPolarHBondContact O-CB 3.41Å; F206-T209 PolarHBondContact O-N 3.46Å; F206-T209 PolarHBondContact O-OG1 3.05Å; P207-T209 PolarHBondContact O-N 3Å
210	A	98.7	Very high	97	Very high	11 Å²	11	27.7 Å²	27.7	9%	0.091	15%	0.146	C	C	.	.			trans	-62.9	144.8	174.4	0	0	0	0	0	111.5	T72 Y179 P207	T72-A210 WeakPolarHBondContact CB-O 3.02Å; T72-A210 PolarHBondContact OG1-O 2.93Å; Y179-A210 CarbonylContact O-C 3.51Å; Y179-A210 VanDerWaalsContact O-CA 3.25Å; Y179-A210 WeakPolarHBondContact O-CA 3.48Å; P207-A210 WeakPolarHBondContact O-CB 3.4Å; P207-A210 PolarHBondContact O-N 2.72Å; P207-A210 VanDerWaalsContact O-N 3.13Å
211	F	98.8	Very high	97.5	Very high	4 Å²	4	33.1 Å²	33.1	2%	0.018	17%	0.167	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-149.9	162.5	-176.1	67.1	-99.6	0	0	0	113	T72 M74 M83 I106 L160 L173 K178 Y179 P181 A213	T72-F211 HydrophobicContact CG2-CB 3.68Å; T72-F211 CarbonylContact O-C 3.55Å; T72-F211 WeakPolarHBondContact O-CA 3.31Å; T72-F211 WeakPolarHBondContact O-CB 3.4Å; M74-F211 HydrophobicContact CB-CD2 3.56Å; M74-F211 HydrophobicContact CB-CE2 3.7Å; M74-F211 HydrophobicContact CB-CG 4.1Å; M74-F211 HydrophobicContact CB-CZ 4.31Å; M74-F211 HydrophobicContact CG-CB 3.91Å; M74-F211 HydrophobicContact CG-CD1 3.79Å; M74-F211 HydrophobicContact CG-CD2 3.47Å; M74-F211 VanDerWaalsContact CG-CD2 3.47Å; M74-F211 HydrophobicContact CG-CE1 4.11Å; M74-F211 HydrophobicContact CG-CE2 3.85Å; M74-F211 HydrophobicContact CG-CG 3.45Å; M74-F211 VanDerWaalsContact CG-CG 3.45Å; M74-F211 HydrophobicContact CG-CZ 4.15Å; M83-F211 HydrophobicContact SD-CE1 4.12Å; I106-F211 HydrophobicContact CD1-CE1 4.42Å; I106-F211 HydrophobicContact CD1-CZ 4.28Å; I106-F211 HydrophobicContact CG2-CE1 4.36Å; I106-F211 HydrophobicContact CG2-CZ 4.08Å; L160-F211 HydrophobicContact CD1-CE2 4.04Å; L160-F211 HydrophobicContact CD1-CZ 3.73Å; L173-F211 HydrophobicContact CD1-CE2 3.84Å; L173-F211 HydrophobicContact CD1-CZ 3.83Å; K178-F211 CarbonylContact C-O 3.58Å; K178-F211 WeakPolarHBondContact CA-O 3.34Å; Y179-F211 HydrophobicContact CD2-CE2 4.3Å; Y179-F211 PolarHBondContact N-O 2.93Å; Y179-F211 PolarHBondContact O-N 2.74Å; P181-F211 HydrophobicContact CG-CD1 4.16Å; P181-F211 HydrophobicContact CG-CE1 3.86Å; F211-A213 HydrophobicContact CE2-CB 4.12Å
212	I	98.8	Very high	97.8	Very high	15 Å²	15	29.3 Å²	29.3	8%	0.077	15%	0.151	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-98.3	129.1	166	-62.2	174.4	0	0	0	109	T72 E73 M74 Y114 W121 H177 K178 V214	T72-I212 PolarHBondContact O-N 3.3Å; E73-I212 WeakPolarHBondContact CA-O 3.25Å; M74-I212 PolarHBondContact N-O 2.88Å; Y114-I212 HydrophobicContact CD1-CD1 4.42Å; Y114-I212 HydrophobicContact CD2-CD1 4.39Å; Y114-I212 HydrophobicContact CG-CD1 4.15Å; W121-I212 HydrophobicContact CD2-CD1 3.54Å; W121-I212 HydrophobicContact CE3-CD1 3.66Å; W121-I212 HydrophobicContact CG-CD1 4.04Å; W121-I212 HydrophobicContact CH2-CB 4.31Å; W121-I212 HydrophobicContact CH2-CD1 4.13Å; W121-I212 HydrophobicContact CH2-CG2 3.71Å; W121-I212 HydrophobicContact CZ2-CB 4.34Å; W121-I212 HydrophobicContact CZ2-CD1 4.07Å; W121-I212 HydrophobicContact CZ2-CG2 4.24Å; W121-I212 HydrophobicContact CZ3-CD1 3.94Å; W121-I212 HydrophobicContact CZ3-CG2 4.03Å; H177-I212 WeakPolarHBondContact O-CA 3.2Å; K178-I212 HydrophobicContact CB-CG1 4.08Å; K178-I212 HydrophobicContact CG-CG1 4.02Å; I212-V214 HydrophobicContact CG2-CG1 4Å
213	A	98.6	Very high	98	Very high	0 Å²	0	31.5 Å²	31.5	0%	0	16%	0.164	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-80.1	130.4	177.4	0	0	0	0	0	109.7	I76 L173 S175 M176 H177 Y179 F211	I76-A213 HydrophobicContact CD1-CB 4.22Å; I76-A213 HydrophobicContact CG2-CB 4.01Å; L173-A213 HydrophobicContact CB-CB 4.13Å; L173-A213 HydrophobicContact CD1-CB 4.01Å; S175-A213 CarbonylContact C-O 3.55Å; M176-A213 PolarHBondContact N-O 2.83Å; H177-A213 PolarHBondContact O-N 3.4Å; Y179-A213 HydrophobicContact CD2-CB 3.78Å; Y179-A213 HydrophobicContact CE2-CB 3.7Å; F211-A213 HydrophobicContact CE2-CB 4.12Å
214	V	98.8	Very high	98	Very high	0 Å²	0	34.9 Å²	34.9	0%	0	18%	0.179	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-140.5	150.3	-174.1	-60.7	0	0	0	0	111.8	E73 M74 I75 I76 W121 M176 I212 S216 Q218	E73-V214 HydrophobicContact CB-CG2 4Å; M74-V214 PolarHBondContact O-N 3.14Å; I75-V214 CarbonylContact C-O 3.59Å; I75-V214 VanDerWaalsContact CA-O 3.25Å; I75-V214 WeakPolarHBondContact CA-O 3.46Å; I75-V214 HydrophobicContact CD1-CG2 4.19Å; I76-V214 PolarHBondContact N-O 3.01Å; W121-V214 HydrophobicContact CH2-CG1 4.02Å; W121-V214 HydrophobicContact CZ2-CG1 4.47Å; M176-V214 HydrophobicContact SD-CG1 4.02Å; I212-V214 HydrophobicContact CG2-CG1 4Å; V214-S216 VanDerWaalsContact CB-O 3.31Å; V214-S216 WeakPolarHBondContact CB-O 3.4Å; V214-S216 WeakPolarHBondContact CG2-O 3.36Å; V214-Q218 HydrophobicContact CG1-CG 4.11Å
215	T	98.4	Very high	98.1	Very high	77 Å²	77	35.3 Å²	35.3	47%	0.472	18%	0.182	S	C	.	.	S	Bend	trans	-80.5	-30.7	174.7	46.6	0	0	0	0	112.8	I76 S175	I76-T215 HydrophobicContact CG1-CG2 4.47Å; S175-T215 PolarHBondContact OG-N 3.05Å
216	S	98.3	Very high	98	Very high	65 Å²	65	34.4 Å²	34.4	46%	0.455	18%	0.176	S	C	.	.	S	Bend	trans	-137	154.3	170.5	55.9	0	0	0	0	109.4	V214 Q218	V214-S216 VanDerWaalsContact CB-O 3.31Å; V214-S216 WeakPolarHBondContact CB-O 3.4Å; V214-S216 WeakPolarHBondContact CG2-O 3.36Å; S216-Q218 PolarHBondContact O-NE2 2.97Å; S216-Q218 PolarHBondContact OG-NE2 2.75Å
217	Y	98.6	Very high	97.9	Very high	69 Å²	69	35.4 Å²	35.4	27%	0.271	18%	0.181	S	C	.	.			trans	-64.7	141.7	175.7	-65.7	-56.4	0	0	0	111.1	E73 I75 I222 T223 K226	E73-Y217 HydrophobicContact CB-CD1 4.07Å; E73-Y217 HydrophobicContact CB-CE1 4.41Å; E73-Y217 WeakPolarHBondContact OE2-CA 3.33Å; E73-Y217 WeakPolarHBondContact OE2-CD1 3.34Å; I75-Y217 HydrophobicContact CD1-CD1 3.81Å; I75-Y217 HydrophobicContact CD1-CD2 4.11Å; I75-Y217 HydrophobicContact CD1-CE1 3.82Å; I75-Y217 HydrophobicContact CD1-CE2 4.12Å; I75-Y217 HydrophobicContact CD1-CG 3.95Å; I75-Y217 HydrophobicContact CG1-CD1 4.12Å; I75-Y217 HydrophobicContact CG1-CD2 4.45Å; I75-Y217 HydrophobicContact CG1-CE1 3.56Å; I75-Y217 HydrophobicContact CG1-CE2 3.95Å; I75-Y217 VanDerWaalsContact CG1-CZ 3.46Å; Y217-I222 HydrophobicContact CD1-CG2 4.17Å; Y217-I222 HydrophobicContact CE1-CG2 4.25Å; Y217-T223 VanDerWaalsContact CB-OG1 3.26Å; Y217-T223 WeakPolarHBondContact CB-OG1 3.36Å; Y217-T223 HydrophobicContact CD2-CG2 4.24Å; Y217-K226 HydrophobicContact CE1-CD 4.36Å; Y217-K226 HydrophobicContact CE1-CG 4.14Å; Y217-K226 HydrophobicContact CE2-CG 4.2Å; Y217-K226 WeakPolarHBondContact OH-CD 3.39Å; Y217-K226 WeakPolarHBondContact OH-CE 3.4Å; Y217-K226 WeakPolarHBondContact OH-CG 2.97Å
218	Q	98.4	Very high	97.8	Very high	62 Å²	62	39.8 Å²	39.8	29%	0.29	20%	0.201	S	C	.	.			trans	-103.9	-51.2	-178.7	-50.2	-65.9	-72.5	0	0	110.4	E73 F116 W121 M176 V214 S216	E73-Q218 PolarHBondContact OE2-N 3.48Å; F116-Q218 HydrophobicContact CB-CB 3.67Å; F116-Q218 HydrophobicContact CB-CG 4.19Å; F116-Q218 HydrophobicContact CD1-CB 3.72Å; F116-Q218 HydrophobicContact CD2-CB 4.5Å; F116-Q218 HydrophobicContact CE1-CB 4.46Å; F116-Q218 WeakPolarHBondContact CE1-O 3.11Å; F116-Q218 HydrophobicContact CG-CB 3.72Å; W121-Q218 HydrophobicContact CH2-CB 4.26Å; W121-Q218 HydrophobicContact CH2-CG 3.78Å; W121-Q218 HydrophobicContact CZ2-CB 4.07Å; W121-Q218 HydrophobicContact CZ2-CG 4.02Å; M176-Q218 HydrophobicContact CE-CG 4.24Å; V214-Q218 HydrophobicContact CG1-CG 4.11Å; S216-Q218 PolarHBondContact O-NE2 2.97Å; S216-Q218 PolarHBondContact OG-NE2 2.75Å
219	N	97.5	Very high	97.7	Very high	12 Å²	12	42.7 Å²	42.7	6%	0.064	22%	0.216	C	C	.	.			trans	-86	113	177.3	-172.7	-10.9	0	0	0	111.1	V70 E73 F116 K221 I222 T223	V70-N219 WeakPolarHBondContact CG1-ND2 3.27Å; V70-N219 PolarHBondContact O-ND2 3.27Å; E73-N219 WeakPolarHBondContact OE1-CB 3.48Å; E73-N219 PolarHBondContact OE1-N 2.98Å; F116-N219 HydrophobicContact CE1-CB 4.18Å; F116-N219 HydrophobicContact CE2-CB 3.89Å; F116-N219 HydrophobicContact CZ-CB 3.56Å; N219-K221 PolarHBondContact O-N 3.4Å; N219-K221 VanDerWaalsContact O-N 3.11Å; N219-K221 WeakPolarHBondContact OD1-CB 3.34Å; N219-K221 PolarHBondContact OD1-N 2.87Å; N219-I222 HydrophobicContact CB-CB 4.47Å; N219-I222 HydrophobicContact CB-CG1 3.98Å; N219-I222 WeakPolarHBondContact O-CB 3.2Å; N219-I222 PolarHBondContact O-N 2.94Å; N219-T223 PolarHBondContact O-N 3.1Å
220	H	96.8	Very high	97.6	Very high	107 Å²	107	43.5 Å²	43.5	50%	0.495	22%	0.221	S	C	.	.	H	α-helix	trans	-55.8	-29.5	178.2	66.5	-92.7	0	0	0	113.4	N119 I222 T223 Q224	N119-H220 PolarHBondContact OD1-CE1 2.87Å; H220-I222 VanDerWaalsContact C-N 3.32Å; H220-I222 PolarHBondContact O-N 2.88Å; H220-T223 WeakPolarHBondContact O-CB 3.21Å; H220-T223 PolarHBondContact O-N 3.48Å; H220-T223 VanDerWaalsContact O-N 3.16Å; H220-Q224 PolarHBondContact O-N 3.41Å
221	K	97.7	Very high	97.3	Very high	123 Å²	123	47.4 Å²	47.4	54%	0.535	25%	0.245	S	C	.	.	H	α-helix	trans	-66.2	-35.1	176.3	-58.7	-174	-180	-177.9	0	112	V70 N219 L225	V70-K221 HydrophobicContact CG1-CB 3.58Å; N219-K221 PolarHBondContact O-N 3.4Å; N219-K221 VanDerWaalsContact O-N 3.11Å; N219-K221 WeakPolarHBondContact OD1-CB 3.34Å; N219-K221 PolarHBondContact OD1-N 2.87Å; K221-L225 WeakPolarHBondContact O-CG 3.38Å; K221-L225 PolarHBondContact O-N 3.16Å; K221-L225 VanDerWaalsContact O-N 3.09Å
222	I	97.9	Very high	97	Very high	0 Å²	0	56.2 Å²	56.2	0%	0	28%	0.284	C	S	.	.	H	α-helix	trans	-64.5	-48	170.6	-61.6	-67.2	0	0	0	109.1	F67 V70 G71 E73 Y217 N219 H220 Q224 L225 K226	F67-I222 HydrophobicContact CD1-CD1 3.96Å; F67-I222 HydrophobicContact CD1-CG2 4.3Å; F67-I222 HydrophobicContact CE1-CG2 4.21Å; V70-I222 HydrophobicContact CB-CD1 3.74Å; V70-I222 HydrophobicContact CG1-CD1 3.53Å; V70-I222 HydrophobicContact CG1-CG1 3.84Å; G71-I222 VanDerWaalsContact O-CD1 3.29Å; G71-I222 WeakPolarHBondContact O-CD1 3.46Å; E73-I222 HydrophobicContact CB-CG2 4.08Å; E73-I222 HydrophobicContact CG-CG1 4.31Å; E73-I222 HydrophobicContact CG-CG2 4.49Å; Y217-I222 HydrophobicContact CD1-CG2 4.17Å; Y217-I222 HydrophobicContact CE1-CG2 4.25Å; N219-I222 HydrophobicContact CB-CB 4.47Å; N219-I222 HydrophobicContact CB-CG1 3.98Å; N219-I222 WeakPolarHBondContact O-CB 3.2Å; N219-I222 PolarHBondContact O-N 2.94Å; H220-I222 VanDerWaalsContact C-N 3.32Å; H220-I222 PolarHBondContact O-N 2.88Å; I222-Q224 VanDerWaalsContact C-N 3.32Å; I222-Q224 PolarHBondContact O-N 2.87Å; I222-L225 PolarHBondContact O-N 3Å; I222-K226 HydrophobicContact CG2-CD 4.42Å; I222-K226 HydrophobicContact CG2-CG 4.1Å; I222-K226 VanDerWaalsContact O-CG 3.23Å; I222-K226 WeakPolarHBondContact O-CG 3.47Å; I222-K226 PolarHBondContact O-N 2.82Å
223	T	97.1	Very high	96.7	Very high	45 Å²	45	56.1 Å²	56.1	28%	0.276	29%	0.285	S	S	.	.	H	α-helix	trans	-52.6	-47.4	178.1	-54.2	0	0	0	0	112.3	Y217 N219 H220 K226 I227	Y217-T223 VanDerWaalsContact CB-OG1 3.26Å; Y217-T223 WeakPolarHBondContact CB-OG1 3.36Å; Y217-T223 HydrophobicContact CD2-CG2 4.24Å; N219-T223 PolarHBondContact O-N 3.1Å; H220-T223 WeakPolarHBondContact O-CB 3.21Å; H220-T223 PolarHBondContact O-N 3.48Å; H220-T223 VanDerWaalsContact O-N 3.16Å; T223-K226 WeakPolarHBondContact O-CB 3.5Å; T223-K226 PolarHBondContact O-N 2.99Å; T223-I227 HydrophobicContact CG2-CD1 3.98Å; T223-I227 WeakPolarHBondContact O-CG1 3.49Å; T223-I227 PolarHBondContact O-N 3.37Å
224	Q	96.8	Very high	96.3	Very high	84 Å²	84	63.3 Å²	63.3	39%	0.393	32%	0.316	S	S	.	.	H	α-helix	trans	-64.5	-47.2	177.5	-64.5	-65.8	26.9	0	0	112.3	H220 I222 K226 I227 E228	H220-Q224 PolarHBondContact O-N 3.41Å; I222-Q224 VanDerWaalsContact C-N 3.32Å; I222-Q224 PolarHBondContact O-N 2.87Å; Q224-K226 PolarHBondContact O-N 2.8Å; Q224-I227 WeakPolarHBondContact O-CA 3.34Å; Q224-I227 WeakPolarHBondContact O-CB 3.3Å; Q224-I227 PolarHBondContact O-N 3.48Å; Q224-E228 WeakPolarHBondContact O-CB 3.39Å; Q224-E228 WeakPolarHBondContact O-CG 3.26Å; Q224-E228 PolarHBondContact O-N 3.28Å
225	L	97.1	Very high	95.9	Very high	26 Å²	26	67.1 Å²	67.1	14%	0.136	36%	0.356	C	S	.	.	H	α-helix	trans	-55.9	-36.7	173.7	-75.1	173.7	0	0	0	112.4	F67 V70 K221 I222 N229	F67-L225 HydrophobicContact CD1-CB 4.17Å; F67-L225 HydrophobicContact CD1-CD1 4.19Å; F67-L225 HydrophobicContact CE1-CB 3.43Å; F67-L225 VanDerWaalsContact CE1-CB 3.43Å; F67-L225 HydrophobicContact CE1-CD1 4.28Å; F67-L225 HydrophobicContact CE2-CB 4.5Å; F67-L225 HydrophobicContact CZ-CB 3.63Å; V70-L225 HydrophobicContact CB-CD1 4.37Å; V70-L225 HydrophobicContact CG2-CD1 3.96Å; K221-L225 WeakPolarHBondContact O-CG 3.38Å; K221-L225 PolarHBondContact O-N 3.16Å; K221-L225 VanDerWaalsContact O-N 3.09Å; I222-L225 PolarHBondContact O-N 3Å; L225-N229 VanDerWaalsContact O-CB 3.3Å; L225-N229 WeakPolarHBondContact O-CB 3.35Å; L225-N229 PolarHBondContact O-N 2.96Å; L225-N229 VanDerWaalsContact O-N 3.14Å; L225-N229 PolarHBondContact O-ND2 2.94Å
226	K	97.6	Very high	95.4	Very high	7 Å²	7	70 Å²	70	3%	0.03	36%	0.362	C	S	.	.	H	α-helix	trans	-67	-42.8	173.7	-56.5	-75.2	-169.4	-147.9	0	110.9	F67 E73 F84 Y217 I222 T223 Q224 N230	F67-K226 HydrophobicContact CE1-CD 3.6Å; F67-K226 HydrophobicContact CE1-CG 3.94Å; F67-K226 HydrophobicContact CZ-CD 3.77Å; F67-K226 HydrophobicContact CZ-CG 4.25Å; E73-K226 VanDerWaalsContact O-CE 3.27Å; E73-K226 WeakPolarHBondContact O-CE 3.31Å; E73-K226 PolarHBondContact O-NZ 3.45Å; F84-K226 HydrophobicContact CD1-CD 3.82Å; F84-K226 PolarHBondContact O-NZ 3.05Å; Y217-K226 HydrophobicContact CE1-CD 4.36Å; Y217-K226 HydrophobicContact CE1-CG 4.14Å; Y217-K226 HydrophobicContact CE2-CG 4.2Å; Y217-K226 WeakPolarHBondContact OH-CD 3.39Å; Y217-K226 WeakPolarHBondContact OH-CE 3.4Å; Y217-K226 WeakPolarHBondContact OH-CG 2.97Å; I222-K226 HydrophobicContact CG2-CD 4.42Å; I222-K226 HydrophobicContact CG2-CG 4.1Å; I222-K226 VanDerWaalsContact O-CG 3.23Å; I222-K226 WeakPolarHBondContact O-CG 3.47Å; I222-K226 PolarHBondContact O-N 2.82Å; T223-K226 WeakPolarHBondContact O-CB 3.5Å; T223-K226 PolarHBondContact O-N 2.99Å; Q224-K226 PolarHBondContact O-N 2.8Å; K226-N230 WeakPolarHBondContact O-CB 3.48Å; K226-N230 PolarHBondContact O-N 2.79Å
227	I	96.3	Very high	95.1	Very high	26 Å²	26	72 Å²	72	13%	0.133	36%	0.359	C	S	.	.	H	α-helix	trans	-63.8	-49.9	179.4	-72.4	166.7	0	0	0	111.3	T223 Q224 N229 A233 F236 R237	T223-I227 HydrophobicContact CG2-CD1 3.98Å; T223-I227 WeakPolarHBondContact O-CG1 3.49Å; T223-I227 PolarHBondContact O-N 3.37Å; Q224-I227 WeakPolarHBondContact O-CA 3.34Å; Q224-I227 WeakPolarHBondContact O-CB 3.3Å; Q224-I227 PolarHBondContact O-N 3.48Å; I227-N229 PolarHBondContact O-N 3.25Å; I227-A233 HydrophobicContact CG1-CB 4.49Å; I227-F236 HydrophobicContact CD1-CB 4Å; I227-F236 HydrophobicContact CG1-CB 4.03Å; I227-F236 HydrophobicContact CG2-CB 3.87Å; I227-R237 HydrophobicContact CG2-CB 4.45Å; I227-R237 HydrophobicContact CG2-CG 3.66Å; I227-R237 PolarHBondContact O-NE 3.45Å; I227-R237 PolarHBondContact O-NH2 3.02Å
228	E	96.1	Very high	93.8	Very high	102 Å²	102	70.8 Å²	70.8	48%	0.477	37%	0.369	S	S	.	.	H	α-helix	trans	-62.1	-39.6	-180	-70.9	164.6	-163.2	0	0	113.7	Q224 R237	Q224-E228 WeakPolarHBondContact O-CB 3.39Å; Q224-E228 WeakPolarHBondContact O-CG 3.26Å; Q224-E228 PolarHBondContact O-N 3.28Å; E228-R237 PolarHBondContact O-NE 3.07Å; E228-R237 PolarHBondContact O-NH1 3.27Å; E228-R237 PolarHBondContact O-NH2 3.45Å
229	N	95.8	Very high	91.9	Very high	61 Å²	61	70.4 Å²	70.4	33%	0.326	37%	0.373	S	S	.	.	H	α-helix	trans	-103	-26.8	-169.7	-64.4	-88.8	0	0	0	113.1	L63 F84 L225 I227 P231	L63-N229 HydrophobicContact CD1-CB 3.88Å; L63-N229 WeakPolarHBondContact CD1-OD1 3.48Å; L63-N229 HydrophobicContact CD2-CB 4.42Å; F84-N229 HydrophobicContact CE1-CB 3.97Å; F84-N229 VanDerWaalsContact CZ-C 3.43Å; F84-N229 HydrophobicContact CZ-CB 3.91Å; F84-N229 WeakPolarHBondContact CZ-O 3.5Å; L225-N229 VanDerWaalsContact O-CB 3.3Å; L225-N229 WeakPolarHBondContact O-CB 3.35Å; L225-N229 PolarHBondContact O-N 2.96Å; L225-N229 VanDerWaalsContact O-N 3.14Å; L225-N229 PolarHBondContact O-ND2 2.94Å; I227-N229 PolarHBondContact O-N 3.25Å; N229-P231 WeakPolarHBondContact O-CD 3.31Å
230	N	94.7	Very high	90.1	Very high	18 Å²	18	75.4 Å²	75.4	10%	0.096	40%	0.399	C	S	.	.			trans	-82.1	121.8	-179.9	-169.1	-21	0	0	0	111.3	F84 K226 F232 A233 R237	F84-N230 HydrophobicContact CD1-CB 3.98Å; F84-N230 HydrophobicContact CD2-CB 3.91Å; F84-N230 HydrophobicContact CE1-CB 3.85Å; F84-N230 HydrophobicContact CE2-CB 3.79Å; F84-N230 HydrophobicContact CG-CB 4.02Å; F84-N230 VanDerWaalsContact CZ-CA 3.48Å; F84-N230 HydrophobicContact CZ-CB 3.77Å; K226-N230 WeakPolarHBondContact O-CB 3.48Å; K226-N230 PolarHBondContact O-N 2.79Å; N230-F232 PolarHBondContact O-N 3.27Å; N230-F232 WeakPolarHBondContact OD1-CB 3.45Å; N230-F232 WeakPolarHBondContact OD1-CD2 3.45Å; N230-F232 PolarHBondContact OD1-N 3.04Å; N230-A233 HydrophobicContact CB-CB 4.06Å; N230-A233 PolarHBondContact O-N 3.07Å; N230-R237 PolarHBondContact O-NH2 3.01Å
231	P	93.8	Very high	88.2	Confident	93 Å²	93	75.3 Å²	75.3	60%	0.604	40%	0.403	S	S	*	.	G	3₁₀ helix	trans	-58.2	-34.9	176.3	-25.3	35.6	0	0	0	113.2	N229 A233 K234	N229-P231 WeakPolarHBondContact O-CD 3.31Å; P231-A233 PolarHBondContact O-N 3.17Å; P231-K234 WeakPolarHBondContact O-CB 3.43Å; P231-K234 PolarHBondContact O-N 3.2Å
232	F	92.3	Very high	86.3	Confident	188 Å²	188	75.6 Å²	75.6	83%	0.825	41%	0.408	S	S	*	.	G	3₁₀ helix	trans	-74.1	-5.5	179	-58.4	-73	0	0	0	113.8	N230	N230-F232 PolarHBondContact O-N 3.27Å; N230-F232 WeakPolarHBondContact OD1-CB 3.45Å; N230-F232 WeakPolarHBondContact OD1-CD2 3.45Å; N230-F232 PolarHBondContact OD1-N 3.04Å
233	A	92.4	Very high	84.5	Confident	14 Å²	14	80.5 Å²	80.5	12%	0.116	43%	0.43	C	S	.	.	G	3₁₀ helix	trans	-108.7	7.3	174.8	0	0	0	0	0	113	I227 N230 P231 G235 F236	I227-A233 HydrophobicContact CG1-CB 4.49Å; N230-A233 HydrophobicContact CB-CB 4.06Å; N230-A233 PolarHBondContact O-N 3.07Å; P231-A233 PolarHBondContact O-N 3.17Å; A233-G235 PolarHBondContact O-N 3.33Å; A233-G235 VanDerWaalsContact O-N 3.07Å; A233-F236 PolarHBondContact O-N 3.41Å
234	K	89.4	Confident	82.7	Confident	150 Å²	150	82.8 Å²	82.8	65%	0.652	44%	0.44	S	S	*	.	G	3₁₀ helix	trans	-53.3	-33.3	-176.1	-174.3	-180	176.9	-175.9	0	113.9	P231 F236 R237	P231-K234 WeakPolarHBondContact O-CB 3.43Å; P231-K234 PolarHBondContact O-N 3.2Å; K234-F236 PolarHBondContact O-N 3.14Å; K234-F236 VanDerWaalsContact O-N 3.16Å; K234-R237 WeakPolarHBondContact O-CB 3.38Å; K234-R237 PolarHBondContact O-N 3.08Å
235	G	90.3	Very high	80.9	Confident	80 Å²	80	85 Å²	85	83%	0.825	45%	0.45	S	S	*	.	G	3₁₀ helix	trans	-67.4	-6	179.4	0	0	0	0	0	116.2	A233	A233-G235 PolarHBondContact O-N 3.33Å; A233-G235 VanDerWaalsContact O-N 3.07Å
236	F	89.7	Confident	79.2	Confident	139 Å²	139	91.8 Å²	91.8	61%	0.61	47%	0.474	S	S	*	.	G	3₁₀ helix	trans	-104.5	-0.5	175.2	-60.7	-80	0	0	0	113.2	I227 A233 K234	I227-F236 HydrophobicContact CD1-CB 4Å; I227-F236 HydrophobicContact CG1-CB 4.03Å; I227-F236 HydrophobicContact CG2-CB 3.87Å; A233-F236 PolarHBondContact O-N 3.41Å; K234-F236 PolarHBondContact O-N 3.14Å; K234-F236 VanDerWaalsContact O-N 3.16Å
237	R	91.1	Very high	77.3	Confident	105 Å²	105	95.3 Å²	95.3	40%	0.396	49%	0.492	S	S	.	.	T	Hydrogen-bonded Turn	trans	-78.2	132.9	178.8	-60.8	176.6	-166.4	-168.7	4.6	109.9	I227 E228 N230 K234 S239	I227-R237 HydrophobicContact CG2-CB 4.45Å; I227-R237 HydrophobicContact CG2-CG 3.66Å; I227-R237 PolarHBondContact O-NE 3.45Å; I227-R237 PolarHBondContact O-NH2 3.02Å; E228-R237 PolarHBondContact O-NE 3.07Å; E228-R237 PolarHBondContact O-NH1 3.27Å; E228-R237 PolarHBondContact O-NH2 3.45Å; N230-R237 PolarHBondContact O-NH2 3.01Å; K234-R237 WeakPolarHBondContact O-CB 3.38Å; K234-R237 PolarHBondContact O-N 3.08Å; R237-S239 VanDerWaalsContact C-N 3.33Å
238	G	71.3	Confident	75.5	Confident	45 Å²	45	97.6 Å²	97.6	46%	0.464	51%	0.51	S	S	.	.	T	Hydrogen-bonded Turn	trans	71.6	24.1	178.9	0	0	0	0	0	114.3	D240 D241	G238-D240 PolarHBondContact O-N 2.89Å; G238-D241 PolarHBondContact O-N 2.8Å
239	S	59	Low	73.7	Confident	54 Å²	54	102.5 Å²	102.5	38%	0.378	52%	0.524	S	S	.	.	H	α-helix	trans	-61.5	-28.3	177.2	-163.2	0	0	0	0	112.4	R237 M242 E243	R237-S239 VanDerWaalsContact C-N 3.33Å; S239-M242 CarbonylContact O-C 3.6Å; S239-M242 WeakPolarHBondContact O-CB 3.33Å; S239-M242 PolarHBondContact O-N 3.2Å; S239-M242 VanDerWaalsContact O-N 3.13Å; S239-E243 WeakPolarHBondContact O-CB 3.42Å; S239-E243 PolarHBondContact O-N 3.5Å
240	D	58.5	Low	71.8	Confident	116 Å²	116	105.4 Å²	105.4	62%	0.62	54%	0.537	S	S	*	.	H	α-helix	trans	-63.9	-43.7	-176.1	-49.4	-20.6	0	0	0	111.3	G238 M242 E243 L244	G238-D240 PolarHBondContact O-N 2.89Å; D240-M242 VanDerWaalsContact C-N 3.34Å; D240-M242 PolarHBondContact O-N 3.04Å; D240-E243 PolarHBondContact O-N 3.48Å; D240-L244 WeakPolarHBondContact O-CB 3.12Å; D240-L244 VanDerWaalsContact O-CG 3.29Å; D240-L244 WeakPolarHBondContact O-CG 3.29Å; D240-L244 PolarHBondContact O-N 2.75Å
241	D	57.3	Low	69.8	Low	106 Å²	106	112.3 Å²	112.3	57%	0.567	57%	0.569	S	S	*	*	H	α-helix	trans	-63.4	-38.2	172.3	-80.2	-40.1	0	0	0	112.2	G238 L244 H245	G238-D241 PolarHBondContact O-N 2.8Å; D241-L244 PolarHBondContact O-N 3.46Å; D241-H245 WeakPolarHBondContact O-CB 3.49Å; D241-H245 PolarHBondContact O-N 2.9Å; D241-H245 PolarHBondContact O-ND1 2.81Å
242	M	58.4	Low	67.8	Low	129 Å²	129	112.7 Å²	112.7	64%	0.635	57%	0.574	S	S	*	*	H	α-helix	trans	-70.1	-35.9	177.9	-77.6	-176.7	54.6	0	0	112.6	S239 D240 R246	S239-M242 CarbonylContact O-C 3.6Å; S239-M242 WeakPolarHBondContact O-CB 3.33Å; S239-M242 PolarHBondContact O-N 3.2Å; S239-M242 VanDerWaalsContact O-N 3.13Å; D240-M242 VanDerWaalsContact C-N 3.34Å; D240-M242 PolarHBondContact O-N 3.04Å; M242-R246 WeakPolarHBondContact O-CB 3.47Å; M242-R246 PolarHBondContact O-N 3.16Å
243	E	59.4	Low	65.7	Low	103 Å²	103	111.1 Å²	111.1	48%	0.481	57%	0.567	S	S	.	*	H	α-helix	trans	-65	-47.7	173.1	-161.1	77	-129.5	0	0	109.7	S239 D240 R246 M247	S239-E243 WeakPolarHBondContact O-CB 3.42Å; S239-E243 PolarHBondContact O-N 3.5Å; D240-E243 PolarHBondContact O-N 3.48Å; E243-R246 WeakPolarHBondContact O-CB 3.47Å; E243-R246 PolarHBondContact O-N 2.98Å; E243-R246 VanDerWaalsContact O-N 3.16Å; E243-M247 HydrophobicContact CB-CE 4.4Å; E243-M247 HydrophobicContact CG-CE 3.81Å; E243-M247 WeakPolarHBondContact O-CG 3.49Å; E243-M247 PolarHBondContact O-N 3.37Å
244	L	58.8	Low	63.2	Low	92 Å²	92	119 Å²	119	48%	0.482	60%	0.601	S	S	.	*	H	α-helix	trans	-58.6	-49.3	175	-72.4	169.2	0	0	0	111.9	D240 D241 R246 M247 S248	D240-L244 WeakPolarHBondContact O-CB 3.12Å; D240-L244 VanDerWaalsContact O-CG 3.29Å; D240-L244 WeakPolarHBondContact O-CG 3.29Å; D240-L244 PolarHBondContact O-N 2.75Å; D241-L244 PolarHBondContact O-N 3.46Å; L244-R246 VanDerWaalsContact C-N 3.25Å; L244-R246 PolarHBondContact O-N 3.27Å; L244-M247 HydrophobicContact CD2-CE 4.29Å; L244-M247 HydrophobicContact CD2-SD 4.07Å; L244-M247 VanDerWaalsContact O-CG 3.24Å; L244-M247 WeakPolarHBondContact O-CG 3.24Å; L244-M247 PolarHBondContact O-N 3.13Å; L244-S248 WeakPolarHBondContact O-CB 3.21Å; L244-S248 PolarHBondContact O-N 3.5Å; L244-S248 PolarHBondContact O-OG 3.16Å; L244-S248 VanDerWaalsContact O-OG 3.08Å
245	H	60.4	Low	60.7	Low	131 Å²	131	121.1 Å²	121.1	61%	0.606	61%	0.607	S	S	*	*	H	α-helix	trans	-64	-30.4	176.7	-79.1	59.8	0	0	0	112.7	D241 R249	D241-H245 WeakPolarHBondContact O-CB 3.49Å; D241-H245 PolarHBondContact O-N 2.9Å; D241-H245 PolarHBondContact O-ND1 2.81Å; H245-R249 WeakPolarHBondContact O-CB 3.48Å; H245-R249 PolarHBondContact O-N 2.86Å; H245-R249 VanDerWaalsContact O-N 3.16Å
246	R	60.4	Low	58.4	Low	168 Å²	168	122.7 Å²	122.7	63%	0.634	60%	0.602	S	S	*	*	H	α-helix	trans	-71.3	-45.7	175.5	-169	-177.2	-135.1	131.4	2.6	111.3	M242 E243 L244 R249 M250	M242-R246 WeakPolarHBondContact O-CB 3.47Å; M242-R246 PolarHBondContact O-N 3.16Å; E243-R246 WeakPolarHBondContact O-CB 3.47Å; E243-R246 PolarHBondContact O-N 2.98Å; E243-R246 VanDerWaalsContact O-N 3.16Å; L244-R246 VanDerWaalsContact C-N 3.25Å; L244-R246 PolarHBondContact O-N 3.27Å; R246-R249 PolarHBondContact O-N 3.3Å; R246-M250 WeakPolarHBondContact O-CG 3.49Å; R246-M250 PolarHBondContact O-N 2.96Å
247	M	57.8	Low	56.1	Low	82 Å²	82	122.4 Å²	122.4	40%	0.404	61%	0.611	S	S	.	*	H	α-helix	trans	-69.2	-37.8	177.9	66	-177.1	78.6	0	0	112.3	E243 L244 R249 M250 Q251	E243-M247 HydrophobicContact CB-CE 4.4Å; E243-M247 HydrophobicContact CG-CE 3.81Å; E243-M247 WeakPolarHBondContact O-CG 3.49Å; E243-M247 PolarHBondContact O-N 3.37Å; L244-M247 HydrophobicContact CD2-CE 4.29Å; L244-M247 HydrophobicContact CD2-SD 4.07Å; L244-M247 VanDerWaalsContact O-CG 3.24Å; L244-M247 WeakPolarHBondContact O-CG 3.24Å; L244-M247 PolarHBondContact O-N 3.13Å; M247-R249 VanDerWaalsContact C-N 3.3Å; M247-R249 PolarHBondContact O-N 3.37Å; M247-M250 CarbonylContact O-C 3.6Å; M247-M250 WeakPolarHBondContact O-CA 3.36Å; M247-M250 PolarHBondContact O-N 3.08Å; M247-Q251 PolarHBondContact O-N 2.93Å
248	S	59.3	Low	53.8	Low	74 Å²	74	123.2 Å²	123.2	52%	0.517	63%	0.628	S	S	.	*	H	α-helix	trans	-59.5	-38.9	171.1	-61.3	0	0	0	0	112.3	L244 M250 S252	L244-S248 WeakPolarHBondContact O-CB 3.21Å; L244-S248 PolarHBondContact O-N 3.5Å; L244-S248 PolarHBondContact O-OG 3.16Å; L244-S248 VanDerWaalsContact O-OG 3.08Å; S248-M250 VanDerWaalsContact C-N 3.31Å; S248-M250 PolarHBondContact O-N 3.31Å; S248-S252 PolarHBondContact O-N 2.87Å
249	R	57.8	Low	52.2	Low	204 Å²	204	126.4 Å²	126.4	77%	0.77	64%	0.64	S	S	*	*	H	α-helix	trans	-70.9	-19.8	172.2	-82.7	-175.5	167.7	-176.8	-2.5	114.5	H245 R246 M247	H245-R249 WeakPolarHBondContact O-CB 3.48Å; H245-R249 PolarHBondContact O-N 2.86Å; H245-R249 VanDerWaalsContact O-N 3.16Å; R246-R249 PolarHBondContact O-N 3.3Å; M247-R249 VanDerWaalsContact C-N 3.3Å; M247-R249 PolarHBondContact O-N 3.37Å
250	M	55.6	Low	51.6	Low	122 Å²	122	135.9 Å²	135.9	60%	0.601	67%	0.668	S	S	*	*	H	α-helix	trans	-86.8	-32.5	174.1	-68.1	-68.2	93.6	0	0	112.7	R246 M247 S248 S252	R246-M250 WeakPolarHBondContact O-CG 3.49Å; R246-M250 PolarHBondContact O-N 2.96Å; M247-M250 CarbonylContact O-C 3.6Å; M247-M250 WeakPolarHBondContact O-CA 3.36Å; M247-M250 PolarHBondContact O-N 3.08Å; S248-M250 VanDerWaalsContact C-N 3.31Å; S248-M250 PolarHBondContact O-N 3.31Å; M250-S252 VanDerWaalsContact C-N 3.27Å; M250-S252 PolarHBondContact O-N 3.16Å
251	Q	52.8	Low	50.8	Low	163 Å²	163	135.1 Å²	135.1	76%	0.762	67%	0.671	S	S	*	*	H	α-helix	trans	-69.4	-23.1	173.8	-70.3	-177.8	7.4	0	0	112.9	M247 K253	M247-Q251 PolarHBondContact O-N 2.93Å; Q251-K253 PolarHBondContact O-N 3.3Å
252	S	52	Low	49.9	Very low	101 Å²	101	136 Å²	136	71%	0.706	68%	0.68	S	S	*	*	T	Hydrogen-bonded Turn	trans	-70.2	14.1	176	-170.8	0	0	0	0	115.3	S248 M250 E254	S248-S252 PolarHBondContact O-N 2.87Å; M250-S252 VanDerWaalsContact C-N 3.27Å; M250-S252 PolarHBondContact O-N 3.16Å; S252-E254 PolarHBondContact O-N 3.45Å
253	K	47.1	Very low	48.8	Very low	155 Å²	155	136.7 Å²	136.7	67%	0.674	69%	0.692	S	S	*	*			trans	-97.5	69	175.2	-84.5	-168.4	169.5	-173.8	0	112.2	Q251 Y255	Q251-K253 PolarHBondContact O-N 3.3Å; K253-Y255 PolarHBondContact O-N 3.36Å
254	E	40.9	Very low	48.2	Very low	180 Å²	180	142.9 Å²	142.9	84%	0.841	71%	0.711	S	S	*	*			trans	-56.9	132.5	153.8	-164.9	72.3	-103.5	0	0	108.5	S252	S252-E254 PolarHBondContact O-N 3.45Å
255	Y	37.5	Very low	47.1	Very low	195 Å²	195	147.9 Å²	147.9	77%	0.765	73%	0.732	S	S	*	*			trans	-80.8	126.5	179.6	-94.9	-108.9	0	0	0	110.3	K253 V257	K253-Y255 PolarHBondContact O-N 3.36Å; Y255-V257 PolarHBondContact O-N 2.89Å
256	P	40.4	Very low	46.1	Very low	113 Å²	113	150.2 Å²	150.2	73%	0.734	74%	0.74	S	S	*	*			trans	-70.2	100.1	170.4	28.6	-32.7	0	0	0	109.7	V258	P256-V258 PolarHBondContact O-N 2.97Å
257	V	41.5	Very low	44.7	Very low	132 Å²	132	148.9 Å²	148.9	80%	0.8	75%	0.75	S	S	*	*			trans	-66.9	113.1	171.9	176.9	0	0	0	0	108.6	Y255 P259	Y255-V257 PolarHBondContact O-N 2.89Å; V257-P259 WeakPolarHBondContact O-CD 3.46Å
258	V	42.4	Very low	43.4	Very low	123 Å²	123	149.2 Å²	149.2	75%	0.745	77%	0.766	S	S	*	*			trans	-88.3	116.8	178.9	179.9	0	0	0	0	109.8	P256	P256-V258 PolarHBondContact O-N 2.97Å
259	P	38.2	Very low	42	Very low	111 Å²	111	150.6 Å²	150.6	72%	0.721	78%	0.776	S	S	*	*			trans	-66.6	135.5	172.7	-19.1	33.4	0	0	0	111.1	V257 S261	V257-P259 WeakPolarHBondContact O-CD 3.46Å; P259-S261 PolarHBondContact O-N 3.06Å
260	R	45.8	Very low	40.7	Very low	254 Å²	254	147.1 Å²	147.1	96%	0.958	77%	0.773	S	S	*	*			trans	-81.3	109.7	172.2	-83.6	178.2	163.8	156.1	-6	110.7
261	S	41.7	Very low	39.8	Very low	99 Å²	99	149.2 Å²	149.2	69%	0.692	78%	0.781	S	S	*	*			trans	-149.2	125.4	152	55.9	0	0	0	0	114	P259	P259-S261 PolarHBondContact O-N 3.06Å
262	T	38.9	Very low	39.3	Very low	124 Å²	124	146.8 Å²	146.8	76%	0.761	78%	0.782	S	S	*	*			trans	52.2	116.9	141.8	52.9	0	0	0	0	122.4
263	V	36.2	Very low	38.7	Very low	144 Å²	144	147.5 Å²	147.5	87%	0.873	78%	0.784	S	S	*	*			trans	89.6	138.2	131.2	175.4	0	0	0	0	118.4
264	R	45.8	Very low	38.3	Very low	233 Å²	233	150 Å²	150	88%	0.879	80%	0.795	S	S	*	*			trans	-110	124.3	-170.8	169.7	-159.3	-161.6	-179	8.7	108.4
265	Q	36.6	Very low	37.6	Very low	197 Å²	197	147.3 Å²	147.3	92%	0.921	80%	0.796	S	S	*	*			trans	-132.7	149.4	158.7	-150.8	162.8	-4.2	0	0	110.4
266	K	38.6	Very low	37.2	Very low	180 Å²	180	142.4 Å²	142.4	78%	0.783	79%	0.79	S	S	*	*			trans	-132.5	134.4	-168.4	171.5	-167.1	178.7	-172.1	0	107.5
267	V	31.9	Very low	36.8	Very low	140 Å²	140	145.4 Å²	145.4	85%	0.848	80%	0.795	S	S	*	*			trans	177.8	153.3	139.8	144.8	0	0	0	0	109.9
268	A	29.9	Very low	36.2	Very low	89 Å²	89	143.5 Å²	143.5	74%	0.736	79%	0.787	S	S	*	*			trans	-33.9	-177.6	175.4	0	0	0	0	0	119
269	S	30.5	Very low	35.6	Very low	103 Å²	103	149.2 Å²	149.2	72%	0.72	80%	0.795	S	S	*	*			cis	-156.7	161.2	13.9	54.2	0	0	0	0	114.7
270	N	31.1	Very low	35.2	Very low	132 Å²	132	148.8 Å²	148.8	71%	0.706	80%	0.801	S	S	*	*			trans	28	125.6	139.9	-66.1	19.1	0	0	0	123.4
271	H	35.9	Very low	34.6	Very low	166 Å²	166	144.5 Å²	144.5	77%	0.769	80%	0.797	S	S	*	*			trans	64.1	108	135	-58.3	-53.3	0	0	0	122.7
272	S	42.1	Very low	34	Very low	112 Å²	112	144.5 Å²	144.5	78%	0.783	80%	0.797	S	S	*	*				33.4	112.4	121.3	-175.4	0	0	0	0	120.1
273	P	40.4	Very low	33.4	Very low	116 Å²	116	144.5 Å²	144.5	75%	0.753	80%	0.796	S	S	*	*			trans	-109.2	122.3	165.9	35.3	-24.7	0	0	0	113.4
274	F	36.9	Very low	33.2	Very low	207 Å²	207	142.8 Å²	142.8	91%	0.908	79%	0.791	S	S	*	*			trans	-157	97.3	141.7	-124.4	-72.7	0	0	0	112
275	S	27.3	Very low	32.6	Very low	123 Å²	123	136 Å²	136	86%	0.86	78%	0.78	S	S	*	*			trans	-144.6	148	149.6	-169.5	0	0	0	0	106.6
276	S	28.7	Very low	32.3	Very low	93 Å²	93	133.7 Å²	133.7	65%	0.65	77%	0.773	S	S	*	*			trans	-106.2	147.9	-162	50.6	0	0	0	0	112.3
277	E	32.3	Very low	32.2	Very low	176 Å²	176	132.6 Å²	132.6	82%	0.822	78%	0.775	S	S	*	*				177.7	173.5	81.1	-92.8	-153.5	93.1	0	0	113.3
278	S	28.1	Very low	32	Very low	92 Å²	92	129.4 Å²	129.4	64%	0.643	77%	0.77	S	S	*	*			trans	78.9	112.8	148.9	-81.9	0	0	0	0	122.8
279	R	31.5	Very low	32	Very low	242 Å²	242	129.7 Å²	129.7	91%	0.913	77%	0.767	S	S	*	*			trans	60.5	111.6	141	-57.2	179.4	-177.7	177.2	1.1	120.4
280	A	28	Very low	31.9	Very low	103 Å²	103	131 Å²	131	85%	0.851	76%	0.762	S	S	*	*				-174.9	164.6	97.1	0	0	0	0	0	112.2
281	L	33.3	Very low	31.7	Very low	164 Å²	164	133.8 Å²	133.8	86%	0.859	76%	0.764	S	S	*	*			trans	-94.1	155.6	165.3	-73.4	158.9	0	0	0	108.6
282	S	29.3	Very low	31.2	Very low	99 Å²	99	134.5 Å²	134.5	69%	0.692	77%	0.767	S	S	*	*				-176.9	154.6	78.9	-63.6	0	0	0	0	114.6
283	T	26.5	Very low	30.5	Very low	123 Å²	123	134.8 Å²	134.8	76%	0.755	77%	0.768	S	S	*	*			trans	60.6	110.7	142.9	51.6	0	0	0	0	123.4
284	S	31.8	Very low	29.9	Very low	108 Å²	108	138.2 Å²	138.2	76%	0.755	77%	0.774	S	S	*	*				56	156.6	126.1	63.5	0	0	0	0	123.7
285	S	33.3	Very low	29.7	Very low	92 Å²	92	135.8 Å²	135.8	64%	0.643	77%	0.771	S	S	*	*			cis	-178.6	154.9	-29	58.2	0	0	0	0	110.8
286	N	31.4	Very low	29.9	Very low	148 Å²	148	133.5 Å²	133.5	79%	0.791	77%	0.766	S	S	*	*			trans	64.3	168.5	163.8	-60.7	-39.7	0	0	0	117.3
287	L	36.5	Very low	30.1	Very low	157 Å²	157	135.6 Å²	135.6	82%	0.822	78%	0.775	S	S	*	*			cis	-155.2	150.5	-1	-158	71.5	0	0	0	111.7
288	G	28	Very low	30.2	Very low	72 Å²	72	133.1 Å²	133.1	74%	0.742	78%	0.777	S	S	*	*			trans	62.1	173	145.7	0	0	0	0	0	121.5
289	S	30.2	Very low	30.3	Very low	96 Å²	96	132.3 Å²	132.3	67%	0.671	78%	0.783	S	S	*	*			cis	-168.9	153.8	-16	-154.1	0	0	0	0	113.5
290	Q	27.2	Very low	31.8	Very low	130 Å²	130	126.6 Å²	126.6	61%	0.607	78%	0.777	S	S	*	*			trans	67.8	131.6	142.3	-81.1	160	-54.2	0	0	126.4
291	Y	28	Very low	32.1	Very low	190 Å²	190	126.8 Å²	126.8	75%	0.745	77%	0.773	S	S	*	*			trans	66	162.1	142.7	-53.5	-34.7	0	0	0	120.1
292	Q	24.9	Very low	32.3	Very low	181 Å²	181	127.6 Å²	127.6	85%	0.846	77%	0.772	S	S	*	*			cis	-149.4	-174.1	-3.4	-136.9	162.7	-10.6	0	0	111.9
293	C	26.2	Very low	32.6	Very low	119 Å²	119	129.6 Å²	129.6	80%	0.804	78%	0.775	S	S	*	*			trans	-113	160.5	-177.8	-46.7	0	0	0	0	112.7
294	E	29.8	Very low	32.9	Very low	188 Å²	188	131.8 Å²	131.8	88%	0.879	78%	0.781	S	S	*	*				-169.8	-176.2	127.6	-119.2	-164.3	87.1	0	0	115.8
295	N	32.1	Very low	33.1	Very low	156 Å²	156	134.4 Å²	134.4	83%	0.834	79%	0.786	S	S	*	*			trans	-100.5	172.1	-167.2	-68.6	-54.7	0	0	0	115.3
296	G	30.4	Very low	34	Very low	74 Å²	74	135.7 Å²	135.7	76%	0.763	79%	0.792	S	S	*	*			trans	-170.5	145.1	165.4	0	0	0	0	0	113.1
297	V	33.6	Very low	35.2	Very low	138 Å²	138	134 Å²	134	84%	0.836	79%	0.789	S	S	*	*			trans	-145.1	156.2	-166.6	-175.1	0	0	0	0	113.2
298	S	34.2	Very low	36	Very low	124 Å²	124	131.7 Å²	131.7	87%	0.867	78%	0.783	S	S	*	*			trans	95	150.9	156.7	80.2	0	0	0	0	121.4
299	G	31.4	Very low	36.2	Very low	74 Å²	74	135.2 Å²	135.2	76%	0.763	79%	0.785	S	S	*	*			trans	133.9	122.1	163.8	0	0	0	0	0	117.8
300	P	61.1	Low	37.4	Very low	123 Å²	123	136.3 Å²	136.3	80%	0.799	79%	0.79	S	S	*	*			trans	-130.2	-174.6	-177.3	43.3	-30.1	0	0	0	118
301	S	35.1	Very low	37.6	Very low	107 Å²	107	140 Å²	140	75%	0.748	80%	0.8	S	S	*	*			trans	84.9	156.5	166.2	-51.7	0	0	0	0	117.7
302	Q	36.9	Very low	38.5	Very low	181 Å²	181	137 Å²	137	85%	0.846	80%	0.804	S	S	*	*			cis	-156.2	-172.6	1	-135.3	173.4	9.3	0	0	113.5
303	D	35.9	Very low	39	Very low	141 Å²	141	135.7 Å²	135.7	75%	0.754	80%	0.802	S	S	*	*			trans	-81.9	174.4	-168.5	-49.6	-95.9	0	0	0	119.4
304	L	32.5	Very low	40	Very low	169 Å²	169	135.1 Å²	135.1	89%	0.885	80%	0.796	S	S	*	*			trans	170.4	169.9	132.2	-89.9	167.2	0	0	0	116.4
305	L	36.3	Very low	40.1	Very low	163 Å²	163	134.6 Å²	134.6	85%	0.853	79%	0.794	S	S	*	*			trans	-147.8	-160.2	-172	-63.9	177	0	0	0	110.8
306	P	53.2	Low	40	Very low	118 Å²	118	132.2 Å²	132.2	77%	0.766	78%	0.778	S	S	*	*			cis	-130.4	-96.2	-6.2	28.8	-2.1	0	0	0	122.8
307	P	54.8	Low	40	Very low	112 Å²	112	137 Å²	137	73%	0.727	78%	0.78	S	S	*	*				-115.2	-116.8	-123.1	33.1	-9.2	0	0	0	123.2
308	P	55.3	Low	39.7	Very low	110 Å²	110	134.9 Å²	134.9	71%	0.714	77%	0.771	S	S	*	*				-141.2	165.2	-114.6	45.1	-26.4	0	0	0	123.5
309	N	31.5	Very low	39.6	Very low	146 Å²	146	138.1 Å²	138.1	78%	0.781	77%	0.773	S	S	*	*			trans	67.4	169.2	148.4	-105.1	7.2	0	0	0	122.1
310	P	54.1	Low	39.6	Very low	119 Å²	119	140.9 Å²	140.9	77%	0.773	77%	0.768	S	S	*	*			cis	-135.6	-163	6.6	43.5	-23.4	0	0	0	118.2
311	Y	32.5	Very low	38.1	Very low	207 Å²	207	144.7 Å²	144.7	81%	0.812	77%	0.768	S	S	*	*			trans	-95.6	165.8	-174.2	-86.4	-86.7	0	0	0	117
312	P	45.8	Very low	37.9	Very low	127 Å²	127	147.6 Å²	147.6	83%	0.825	77%	0.77	S	S	*	*				-150.5	-170.1	99	38.9	-18.8	0	0	0	117.4
313	L	35.5	Very low	37.7	Very low	154 Å²	154	144.4 Å²	144.4	81%	0.806	77%	0.766	S	S	*	*			trans	-139.7	158.6	-173.9	-115.3	175.4	0	0	0	112
314	P	48.1	Very low	37.5	Very low	106 Å²	106	144.7 Å²	144.7	69%	0.688	77%	0.773	S	S	*	*				-161.5	166.6	96.5	41.9	-22	0	0	0	119.9
315	Q	32.2	Very low	37.5	Very low	177 Å²	177	145.9 Å²	145.9	83%	0.827	77%	0.771	S	S	*	*			trans	47.9	156.9	150.1	-79.2	179.2	-74.7	0	0	123
316	E	30.4	Very low	37.1	Very low	107 Å²	107	149.7 Å²	149.7	50%	0.5	77%	0.774	S	S	.	*			cis	-146.6	158.9	-20.4	-149.8	-141.6	117.3	0	0	106.7	S318	E316-S318 PolarHBondContact OE1-N 3.23Å; E316-S318 PolarHBondContact OE1-OG 3.48Å
317	H	29.3	Very low	35.9	Very low	175 Å²	175	151.8 Å²	151.8	81%	0.81	77%	0.771	S	S	*	*				-169.1	160.6	87.5	-97.9	-47.7	0	0	0	114.9
318	S	28	Very low	34.5	Very low	93 Å²	93	153 Å²	153	65%	0.65	77%	0.767	S	S	*	*			trans	-91.5	154.1	-161.1	-62.6	0	0	0	0	118.3	E316	E316-S318 PolarHBondContact OE1-N 3.23Å; E316-S318 PolarHBondContact OE1-OG 3.48Å
319	Q	31.6	Very low	33.3	Very low	192 Å²	192	155.6 Å²	155.6	90%	0.897	77%	0.77	S	S	*	*			trans	146.5	148.8	131.4	-74.7	-167.2	-5.1	0	0	115.2
320	I	32.5	Very low	33.2	Very low	131 Å²	131	157.3 Å²	157.3	67%	0.672	77%	0.773	S	S	*	*			trans	-145.9	172	-157.7	-58.9	174.1	0	0	0	110.8
321	Y	29.1	Very low	31.8	Very low	203 Å²	203	156.4 Å²	156.4	80%	0.796	77%	0.769	S	S	*	*			trans	94	149.4	162	-57.9	-79.1	0	0	0	118.2
322	H	31	Very low	31.5	Very low	168 Å²	168	151 Å²	151	78%	0.778	76%	0.761	S	S	*	*			cis	-166.4	158.7	-43.1	-127.9	-88.9	0	0	0	108.8
323	C	31.6	Very low	30.6	Very low	115 Å²	115	151.2 Å²	151.2	78%	0.777	76%	0.76	S	S	*	*			trans	-93.4	138.1	-179.9	177.3	0	0	0	0	113.7
324	T	31.4	Very low	30.2	Very low	146 Å²	146	149.4 Å²	149.4	90%	0.896	76%	0.756	S	S	*	*			trans	-146.2	167.7	164.1	44.7	0	0	0	0	113.6
325	K	32.7	Very low	29.2	Very low	195 Å²	195	150.4 Å²	150.4	85%	0.848	76%	0.755	S	S	*	*			trans	-128.6	144.4	-161.7	159.7	-165.4	176.6	-175.6	0	111.7
326	R	29.1	Very low	29.3	Very low	242 Å²	242	150.1 Å²	150.1	91%	0.913	75%	0.753	S	S	*	*			trans	163.8	172.5	158.8	-92	149.6	-165.1	-151.5	6.7	110.2
327	K	26.7	Very low	30.2	Very low	163 Å²	163	150 Å²	150	71%	0.709	76%	0.762	S	S	*	*			cis	-176.4	136.6	-34.8	176.4	-179.1	-179.3	-74.4	0	108.5
328	E	26.4	Very low	30.1	Very low	136 Å²	136	152.5 Å²	152.5	64%	0.636	77%	0.766	S	S	*	*			trans	36.9	143.9	157.9	-70.7	158.8	172.6	0	0	125.9
329	E	30.2	Very low	30.3	Very low	165 Å²	165	156.6 Å²	156.6	77%	0.771	77%	0.772	S	S	*	*			trans	83.5	134.7	141.3	-76.9	170.1	147.6	0	0	125.2
330	E	28.7	Very low	30.5	Very low	183 Å²	183	156.5 Å²	156.5	86%	0.855	77%	0.769	S	S	*	*			trans	49.7	159	153.9	-66.6	-155.3	110.6	0	0	122.9
331	C	25	Very low	31.3	Very low	100 Å²	100	155.7 Å²	155.7	68%	0.676	77%	0.772	S	S	*	*			cis	-171.6	131.5	-29.4	-174.1	0	0	0	0	107.5
332	S	25.2	Very low	31.1	Very low	93 Å²	93	156.4 Å²	156.4	65%	0.65	77%	0.774	S	S	*	*				148	153.7	101.1	53.1	0	0	0	0	112.6
333	T	26.8	Very low	31.3	Very low	132 Å²	132	155 Å²	155	81%	0.81	77%	0.77	S	S	*	*			trans	61.7	152	164.3	53.3	0	0	0	0	118.9
334	T	28.6	Very low	31.5	Very low	116 Å²	116	157.1 Å²	157.1	71%	0.712	77%	0.769	S	S	*	*			cis	-149.2	160	23.1	-37.2	0	0	0	0	112.6
335	D	27	Very low	31.4	Very low	127 Å²	127	156.6 Å²	156.6	68%	0.679	77%	0.765	S	S	*	*			trans	3.1	131.4	165.4	-72.5	-88.1	0	0	0	122.5
336	H	34.8	Very low	31.4	Very low	170 Å²	170	152.6 Å²	152.6	79%	0.787	76%	0.762	S	S	*	*				83.9	162	62.3	-74	-0.7	0	0	0	115
337	P	47.7	Very low	32.2	Very low	104 Å²	104	146.7 Å²	146.7	68%	0.675	76%	0.755	S	S	*	*			cis	-137.4	-178.5	-47.5	40.9	-25.6	0	0	0	113.5
338	Y	27.9	Very low	32.4	Very low	228 Å²	228	143.7 Å²	143.7	89%	0.894	75%	0.754	S	S	*	*			trans	-172.9	165.6	132.7	-119.1	-86.6	0	0	0	112.8
339	K	32.5	Very low	32.5	Very low	179 Å²	179	145.5 Å²	145.5	78%	0.778	76%	0.763	S	S	*	*			trans	-153.5	139.6	-170.1	-96.2	179.1	177.9	170.8	0	115
340	K	35.4	Very low	32.4	Very low	191 Å²	191	147 Å²	147	83%	0.83	77%	0.77	S	S	*	*			trans	57.6	-176.4	141.5	-75.5	-164	171.3	-164.1	0	118.3
341	P	48.9	Very low	32.5	Very low	113 Å²	113	143.8 Å²	143.8	73%	0.734	76%	0.758	S	S	*	*			cis	-127.9	178.3	-26.2	24.6	-2.9	0	0	0	113.8
342	Y	25.2	Very low	32.7	Very low	218 Å²	218	144.8 Å²	144.8	86%	0.855	77%	0.766	S	S	*	*				-168.7	-176.9	117.7	-163	-112.1	0	0	0	111
343	M	36.3	Very low	33	Very low	138 Å²	138	148.3 Å²	148.3	68%	0.68	77%	0.77	S	S	*	*			trans	-112.6	167.2	-163.3	-81.6	-159.7	68.8	0	0	117.3
344	E	35.4	Very low	33.3	Very low	161 Å²	161	151 Å²	151	75%	0.752	77%	0.767	S	S	*	*			trans	-53.2	144.8	168.7	172.3	177	-140.8	0	0	116.6
345	T	29.6	Very low	33.3	Very low	134 Å²	134	155.1 Å²	155.1	82%	0.822	77%	0.77	S	S	*	*			trans	-147.3	151.9	157.2	50.1	0	0	0	0	111
346	S	32.3	Very low	33.6	Very low	111 Å²	111	154.7 Å²	154.7	78%	0.776	78%	0.776	S	S	*	*			trans	-129.3	146.9	163.8	-64.9	0	0	0	0	108.7
347	P	46.6	Very low	33.3	Very low	118 Å²	118	149.9 Å²	149.9	77%	0.766	77%	0.773	S	S	*	*				-134.3	-170.5	110.6	34.9	-18.3	0	0	0	110.1
348	S	29.6	Very low	32.7	Very low	100 Å²	100	155.8 Å²	155.8	70%	0.699	78%	0.784	S	S	*	*			cis	-151	179.8	17.4	-48.6	0	0	0	0	112.1
349	E	28.8	Very low	33.5	Very low	175 Å²	175	150.9 Å²	150.9	82%	0.818	78%	0.779	S	S	*	*			trans	-57.7	167.6	153.5	-62	109.4	148.6	0	0	112.3
350	E	29.1	Very low	33.5	Very low	195 Å²	195	150.3 Å²	150.3	91%	0.911	78%	0.78	S	S	*	*			cis	-157.7	172.7	44.3	-171.2	166.1	83.9	0	0	114.1
351	D	29.6	Very low	33.4	Very low	116 Å²	116	148 Å²	148	62%	0.62	77%	0.772	S	S	*	*			trans	-72.2	156.5	-174.2	-143.3	-35.1	0	0	0	114.9
352	S	30.4	Very low	32.6	Very low	121 Å²	121	151 Å²	151	85%	0.846	78%	0.776	S	S	*	*			trans	-169.2	133.1	151.3	-91.7	0	0	0	0	113.8
353	F	31	Very low	32.8	Very low	167 Å²	167	144 Å²	144	73%	0.732	77%	0.77	S	S	*	*			trans	-87.2	157.2	-163.5	-80.6	-112.7	0	0	0	116.3
354	Y	32.5	Very low	32.7	Very low	190 Å²	190	146.1 Å²	146.1	75%	0.745	78%	0.784	S	S	*	*			trans	78.6	121.9	143.6	-100.2	-63.6	0	0	0	122.9
355	R	29.2	Very low	32.5	Very low	202 Å²	202	142.2 Å²	142.2	76%	0.762	79%	0.786	S	S	*	*			trans	96.8	93.4	130.7	-154	171.7	-67.8	-124.4	0.1	120.2
356	S	33.2	Very low	32.5	Very low	117 Å²	117	140.8 Å²	140.8	82%	0.818	79%	0.788	S	S	*	*			trans	17.8	122.2	130.5	-179.9	0	0	0	0	119.6
357	G	27.7	Very low	32.5	Very low	70 Å²	70	141.3 Å²	141.3	72%	0.722	79%	0.792	S	S	*	*			trans	-163	108.9	157.6	0	0	0	0	0	112.5
358	Y	35.8	Very low	31.8	Very low	228 Å²	228	146.8 Å²	146.8	89%	0.894	80%	0.799	S	S	*	*			trans	-73.9	146.6	160.2	-93.8	-82.8	0	0	0	109.1
359	P	43.4	Very low	31.7	Very low	124 Å²	124	152.8 Å²	152.8	81%	0.805	81%	0.806	S	S	*	*				-127.4	168	119	36.7	-32	0	0	0	113.4
360	Q	33	Very low	32	Very low	168 Å²	168	150.3 Å²	150.3	79%	0.785	80%	0.803	S	S	*	*			trans	-111.3	131.3	-177	172.3	-161.2	-3.5	0	0	108.8
361	Q	34.6	Very low	31.9	Very low	143 Å²	143	148.5 Å²	148.5	67%	0.668	80%	0.795	S	S	*	*				165.7	155.3	127.5	-93.4	-158.5	25.9	0	0	113.9
362	Q	30.6	Very low	32.3	Very low	174 Å²	174	148.4 Å²	148.4	81%	0.813	80%	0.803	S	S	*	*			trans	56.8	133.8	158.9	-64.9	170.2	42.5	0	0	118.5
363	G	30	Very low	32.4	Very low	72 Å²	72	146.3 Å²	146.3	74%	0.742	79%	0.793	S	S	*	*			cis	136.3	110.7	-8.7	0	0	0	0	0	113.4
364	L	35.2	Very low	32.7	Very low	183 Å²	183	145.9 Å²	145.9	96%	0.958	79%	0.794	S	S	*	*			trans	-147	130.8	158.9	-89.7	179.5	0	0	0	108.8
365	G	29.7	Very low	33	Very low	78 Å²	78	148.7 Å²	148.7	80%	0.804	80%	0.803	S	S	*	*			trans	-101.8	147.1	174.7	0	0	0	0	0	111.6
366	A	31	Very low	33.3	Very low	105 Å²	105	146.6 Å²	146.6	87%	0.868	80%	0.802	S	S	*	*			trans	-117.7	138.8	167.2	0	0	0	0	0	109.4
367	S	31.1	Very low	33.3	Very low	122 Å²	122	145.3 Å²	145.3	85%	0.853	80%	0.798	S	S	*	*			trans	-80.4	156.8	-160.8	-58.2	0	0	0	0	115.1
368	Y	32	Very low	33.9	Very low	233 Å²	233	148.4 Å²	148.4	91%	0.914	81%	0.808	S	S	*	*			trans	-52.7	142	165.2	-83.4	-111.4	0	0	0	111.7
369	R	27.9	Very low	34	Very low	225 Å²	225	145.3 Å²	145.3	85%	0.849	80%	0.803	S	S	*	*			trans	-129.3	120.6	156.9	-156.2	-175.2	-149.6	-150.2	10.3	109.5
370	T	34.8	Very low	33.5	Very low	123 Å²	123	150.2 Å²	150.2	76%	0.755	81%	0.807	S	S	*	*			trans	-85	127.3	176.5	-50.4	0	0	0	0	109.4
371	E	27.9	Very low	33.5	Very low	157 Å²	157	147.2 Å²	147.2	73%	0.734	81%	0.811	S	S	*	*			trans	-140.2	106	165.7	-156.5	167.8	134.6	0	0	111.2
372	S	36.6	Very low	33.3	Very low	115 Å²	115	145.9 Å²	145.9	80%	0.804	82%	0.818	S	S	*	*			trans	-101.6	88.7	-178	54.5	0	0	0	0	110.3
373	A	33.9	Very low	33.5	Very low	77 Å²	77	143.4 Å²	143.4	64%	0.636	82%	0.819	S	S	*	*			trans	-116.6	92.7	-178.5	0	0	0	0	0	112.7	R375	A373-R375 PolarHBondContact O-N 2.97Å
374	Q	36.8	Very low	33.9	Very low	157 Å²	157	144.4 Å²	144.4	73%	0.734	82%	0.821	S	S	*	*			trans	28	93.8	135.2	-172.6	166.6	-30.5	0	0	117.7	Q376	Q374-Q376 HydrophobicContact CG-CG 4.19Å
375	R	37.7	Very low	34.4	Very low	250 Å²	250	141.8 Å²	141.8	94%	0.943	82%	0.815	S	S	*	*			trans	-99	106.8	158.4	-71.6	-169.5	176.2	-138.1	-2.9	109.7	A373	A373-R375 PolarHBondContact O-N 2.97Å
376	Q	35.9	Very low	35.2	Very low	157 Å²	157	144.1 Å²	144.1	73%	0.734	82%	0.816	S	S	*	*			trans	-73.1	150.7	173.2	-73.3	166.1	-37.5	0	0	110.9	Q374	Q374-Q376 HydrophobicContact CG-CG 4.19Å
377	A	34.3	Very low	35.3	Very low	91 Å²	91	144.6 Å²	144.6	75%	0.752	81%	0.813	S	S	*	*			trans	-88.4	128.2	172.5	0	0	0	0	0	110.1	M379	A377-M379 PolarHBondContact O-N 3.44Å
378	C	39	Very low	35.4	Very low	135 Å²	135	146.4 Å²	146.4	91%	0.912	81%	0.808	S	S	*	*			trans	-82.3	96.1	173.1	-61.8	0	0	0	0	109.8
379	M	37.5	Very low	36.1	Very low	162 Å²	162	140.7 Å²	140.7	80%	0.798	80%	0.799	S	S	*	*			trans	-125.5	91.9	170.9	-82.5	-68.8	-68.3	0	0	109.4	A377	A377-M379 PolarHBondContact O-N 3.44Å
380	Y	34.7	Very low	36.5	Very low	227 Å²	227	135.4 Å²	135.4	89%	0.89	79%	0.792	S	S	*	*			trans	-141.5	112.4	165.6	-83.4	-74.4	0	0	0	109.7
381	A	31.6	Very low	36.7	Very low	105 Å²	105	135.6 Å²	135.6	87%	0.868	80%	0.795	S	S	*	*			trans	-137	102.6	162.6	0	0	0	0	0	105.9
382	S	31.9	Very low	36.9	Very low	116 Å²	116	133.3 Å²	133.3	81%	0.811	80%	0.796	S	S	*	*			trans	-75.2	137.6	-173.5	-55.7	0	0	0	0	111.3
383	S	33.3	Very low	36.6	Very low	121 Å²	121	135.4 Å²	135.4	85%	0.846	80%	0.798	S	S	*	*			trans	-78.9	156.9	169	46.6	0	0	0	0	111.6
384	A	39.2	Very low	36.7	Very low	94 Å²	94	139.8 Å²	139.8	78%	0.777	81%	0.805	S	S	*	*			trans	-133.1	136.9	170	0	0	0	0	0	109.5
385	P	46	Very low	36.5	Very low	127 Å²	127	139.6 Å²	139.6	83%	0.825	81%	0.809	S	S	*	*			trans	-87.3	164	-179	34.9	-35.1	0	0	0	113.4
386	P	46.7	Very low	36.3	Very low	128 Å²	128	135.7 Å²	135.7	83%	0.831	81%	0.805	S	S	*	*			trans	-106.2	163.5	-172.6	40.1	-34.9	0	0	0	115.1
387	S	31.8	Very low	36.1	Very low	115 Å²	115	133.4 Å²	133.4	80%	0.804	81%	0.806	S	S	*	*			trans	-161.5	117.3	158.8	57.2	0	0	0	0	113.3
388	E	33.5	Very low	35.9	Very low	160 Å²	160	134.8 Å²	134.8	75%	0.748	81%	0.809	S	S	*	*			trans	6.9	162	137.4	-68.4	-62.4	117.3	0	0	121.4
389	P	46.6	Very low	35.8	Very low	112 Å²	112	136.1 Å²	136.1	73%	0.727	81%	0.807	S	S	*	*			cis	-133.1	174.6	13.8	41.6	-25	0	0	0	117.9
390	V	37.4	Very low	35.5	Very low	115 Å²	115	134.3 Å²	134.3	70%	0.697	81%	0.805	S	S	*	*			trans	-90	154.1	170.4	178.1	0	0	0	0	111.9
391	P	37.9	Very low	35.6	Very low	127 Å²	127	135 Å²	135	83%	0.825	81%	0.806	S	S	*	*			trans	-127.2	149.6	137.7	37.1	-29.7	0	0	0	113.3
392	S	32.9	Very low	36.1	Very low	108 Å²	108	136 Å²	136	76%	0.755	80%	0.804	S	S	*	*			trans	-109.9	148.2	-176.4	54.2	0	0	0	0	112.9
393	L	29.9	Very low	36.2	Very low	160 Å²	160	135.5 Å²	135.5	84%	0.838	80%	0.801	S	S	*	*			trans	-150.8	165.9	137.9	-157.6	51.5	0	0	0	110.7
394	E	36.1	Very low	36.2	Very low	168 Å²	168	137.2 Å²	137.2	79%	0.785	80%	0.797	S	S	*	*			trans	-95.5	177.9	-164	-64.9	160.9	114.6	0	0	113.6
395	D	32	Very low	36.3	Very low	153 Å²	153	139 Å²	139	82%	0.818	80%	0.801	S	S	*	*			trans	59.1	119.5	171.6	-70.2	-37.4	0	0	0	119.4
396	I	33.5	Very low	35.6	Very low	169 Å²	169	136.6 Å²	136.6	87%	0.867	79%	0.787	S	S	*	*				-171.1	131.1	112.3	-93.7	152.9	0	0	0	108.6
397	S	31.6	Very low	34.8	Very low	109 Å²	109	141.9 Å²	141.9	76%	0.762	79%	0.792	S	S	*	*			trans	-100	141.6	166.3	71	0	0	0	0	110.1
398	C	31.4	Very low	34.9	Very low	119 Å²	119	141 Å²	141	80%	0.804	79%	0.787	S	S	*	*			trans	-171.2	145.9	142.6	-102.2	0	0	0	0	112.1
399	N	36.1	Very low	34.8	Very low	164 Å²	164	138.4 Å²	138.4	88%	0.877	79%	0.786	S	S	*	*			trans	-99.9	131.2	168.2	-61.4	-76.6	0	0	0	108.8
400	T	31.9	Very low	34.1	Very low	123 Å²	123	139 Å²	139	76%	0.755	79%	0.791	S	S	*	*			trans	-141.8	100.1	168.8	-48.9	0	0	0	0	111.8
401	W	37	Very low	33.7	Very low	241 Å²	241	140.4 Å²	140.4	91%	0.913	80%	0.8	S	S	*	*			trans	-128.1	132.5	155.2	-74.9	93.5	0	0	0	107.8
402	P	40.7	Very low	33.6	Very low	126 Å²	126	140.7 Å²	140.7	82%	0.818	80%	0.799	S	S	*	*			trans	-75	153.7	-171.4	30	-35.2	0	0	0	112.9
403	S	33.9	Very low	33.5	Very low	107 Å²	107	141.7 Å²	141.7	75%	0.748	80%	0.801	S	S	*	*			trans	-126.1	131.4	-167.2	-67.1	0	0	0	0	114.9
404	M	33.5	Very low	33.8	Very low	157 Å²	157	140 Å²	140	77%	0.773	80%	0.797	S	S	*	*			trans	62.7	163.4	153	-62.1	-166.4	137.2	0	0	117.6	S406	M404-S406 WeakPolarHBondContact CE-OG 3.36Å; M404-S406 PolarHBondContact SD-OG 3.5Å
405	P	41.2	Very low	33.7	Very low	130 Å²	130	139.3 Å²	139.3	84%	0.844	81%	0.805	S	S	*	*				-120	161.9	69.1	36.2	-27.2	0	0	0	115.2
406	S	31.7	Very low	33.9	Very low	78 Å²	78	140.9 Å²	140.9	55%	0.545	81%	0.807	S	S	.	*			trans	-102.4	159.9	176.1	-58.7	0	0	0	0	112.2	M404	M404-S406 WeakPolarHBondContact CE-OG 3.36Å; M404-S406 PolarHBondContact SD-OG 3.5Å
407	Y	31	Very low	34.2	Very low	238 Å²	238	138.6 Å²	138.6	93%	0.933	80%	0.803	S	S	*	*			trans	-142	168.6	162.7	-110	-85.7	0	0	0	112.1
408	S	33.5	Very low	34.4	Very low	98 Å²	98	142.1 Å²	142.1	69%	0.685	81%	0.809	S	S	*	*			trans	-112.1	150.5	-146.3	-46.5	0	0	0	0	116.9
409	S	31.8	Very low	34.6	Very low	104 Å²	104	143.9 Å²	143.9	73%	0.727	81%	0.811	S	S	*	*			trans	45.9	107.5	141	61.4	0	0	0	0	121.8
410	C	30.3	Very low	34.8	Very low	125 Å²	125	147.5 Å²	147.5	85%	0.845	81%	0.812	S	S	*	*			trans	40.3	122.3	131.3	-59.4	0	0	0	0	122.7
411	T	30.5	Very low	35.2	Very low	144 Å²	144	149.7 Å²	149.7	88%	0.883	82%	0.819	S	S	*	*			trans	-141.8	150.1	133.4	48.1	0	0	0	0	110.2
412	V	34.5	Very low	35.4	Very low	134 Å²	134	143.9 Å²	143.9	81%	0.812	81%	0.812	S	S	*	*			trans	-127.6	125	179.8	172.7	0	0	0	0	110.5
413	T	30.8	Very low	35	Very low	128 Å²	128	148.8 Å²	148.8	79%	0.785	82%	0.816	S	S	*	*			trans	-163.1	113.7	152.7	16.8	0	0	0	0	113.2
414	T	36.3	Very low	35.2	Very low	124 Å²	124	151.8 Å²	151.8	76%	0.761	82%	0.818	S	S	*	*			trans	34.9	115.9	135.3	58.5	0	0	0	0	121.9
415	V	34.3	Very low	35.2	Very low	155 Å²	155	152.9 Å²	152.9	94%	0.939	82%	0.821	S	S	*	*				-139.8	166.9	128.8	-142.3	0	0	0	0	109.3
416	Q	36.6	Very low	34.8	Very low	186 Å²	186	156.3 Å²	156.3	87%	0.869	82%	0.823	S	S	*	*	P	Polyproline II helix	trans	-91.4	166.1	-164.1	-95.5	179.8	-21.9	0	0	115.7
417	P	40.6	Very low	34.8	Very low	120 Å²	120	156.8 Å²	156.8	78%	0.779	83%	0.826	S	S	*	*	P	Polyproline II helix	trans	-79.8	161.5	-172.4	33.6	-37.3	0	0	0	114.2
418	M	35.7	Very low	34.9	Very low	183 Å²	183	150.2 Å²	150.2	90%	0.901	82%	0.821	S	S	*	*	P	Polyproline II helix	trans	-97.6	139.8	168.9	-119.4	-71.3	-166.3	0	0	110.2
419	D	35.2	Very low	35	Very low	156 Å²	156	153.1 Å²	153.1	83%	0.834	82%	0.823	S	S	*	*	P	Polyproline II helix	trans	-70.1	145.3	-171.2	-78.6	-63.1	0	0	0	114.9
420	R	41	Very low	35	Very low	240 Å²	240	158 Å²	158	91%	0.906	83%	0.832	S	S	*	*			trans	-92.1	115.7	169.5	-82.7	-176.6	168.2	177.2	-3.3	110.6
421	L	39.8	Very low	35.1	Very low	170 Å²	170	158.2 Å²	158.2	89%	0.89	83%	0.83	S	S	*	*	P	Polyproline II helix	trans	-63.6	131.4	165.7	-66.7	172.4	0	0	0	110.4
422	P	40.5	Very low	35.2	Very low	118 Å²	118	157.3 Å²	157.3	77%	0.766	83%	0.829	S	S	*	*	P	Polyproline II helix	trans	-77.2	130	177.9	30.1	-33.5	0	0	0	111.6	Q424	P422-Q424 PolarHBondContact O-N 3.46Å
423	Y	33.1	Very low	35.2	Very low	229 Å²	229	154.1 Å²	154.1	90%	0.898	82%	0.823	S	S	*	*	P	Polyproline II helix	trans	-73.4	122.6	176.3	-168.2	-92	0	0	0	110.3
424	Q	37.2	Very low	35.5	Very low	171 Å²	171	153.9 Å²	153.9	80%	0.799	82%	0.824	S	S	*	*	P	Polyproline II helix	trans	-75	146.5	-178	-79.9	-163.9	-12.6	0	0	113.2	P422	P422-Q424 PolarHBondContact O-N 3.46Å
425	H	32.6	Very low	35.4	Very low	180 Å²	180	156.4 Å²	156.4	83%	0.833	83%	0.832	S	S	*	*	P	Polyproline II helix	trans	-89.2	129.3	177	-137	-90.8	0	0	0	109.9	S427	H425-S427 PolarHBondContact O-N 2.97Å
426	F	33.9	Very low	35.6	Very low	202 Å²	202	155.2 Å²	155.2	89%	0.886	83%	0.825	S	S	*	*	P	Polyproline II helix	trans	-76.1	119.6	170.2	-89	-87.7	0	0	0	110.5
427	S	31.8	Very low	36	Very low	87 Å²	87	152 Å²	152	61%	0.608	82%	0.82	S	S	*	*			trans	-91.6	112.6	173.1	-70.2	0	0	0	0	110.8	H425 H429	H425-S427 PolarHBondContact O-N 2.97Å; S427-H429 PolarHBondContact O-CD2 3.44Å; S427-H429 PolarHBondContact O-N 3.21Å
428	A	32.7	Very low	35.5	Very low	101 Å²	101	158.5 Å²	158.5	84%	0.835	83%	0.829	S	S	*	*			trans	-78.9	95.3	173.2	0	0	0	0	0	110.6	F430	A428-F430 PolarHBondContact O-N 2.8Å
429	H	36.3	Very low	35.4	Very low	158 Å²	158	158.4 Å²	158.4	73%	0.731	83%	0.831	S	S	*	*			trans	-79.7	101.6	176.6	-70.7	-90.8	0	0	0	111.5	S427	S427-H429 PolarHBondContact O-CD2 3.44Å; S427-H429 PolarHBondContact O-N 3.21Å
430	F	30.6	Very low	35.1	Very low	207 Å²	207	155.9 Å²	155.9	91%	0.908	83%	0.832	S	S	*	*			trans	-119.4	103.5	161.1	-102.4	-84.8	0	0	0	109.4	A428	A428-F430 PolarHBondContact O-N 2.8Å
431	T	33	Very low	34.6	Very low	130 Å²	130	147.6 Å²	147.6	80%	0.798	82%	0.821	S	S	*	*			trans	-102.4	99.5	-178.3	53.2	0	0	0	0	110.9	G433	T431-G433 PolarHBondContact O-N 3.26Å
432	S	33.2	Very low	34.2	Very low	125 Å²	125	148.7 Å²	148.7	87%	0.874	82%	0.824	S	S	*	*			trans	-75.3	106.5	169.7	55.4	0	0	0	0	110.6
433	G	33.9	Very low	33.7	Very low	66 Å²	66	146.8 Å²	146.8	68%	0.68	82%	0.818	S	S	*	*			trans	-84.9	148.4	172	0	0	0	0	0	112.8	T431	T431-G433 PolarHBondContact O-N 3.26Å
434	P	37.5	Very low	33.6	Very low	123 Å²	123	142.8 Å²	142.8	80%	0.799	81%	0.812	S	S	*	*			trans	-84.1	150.6	-177.3	33.7	-35.4	0	0	0	113.3
435	L	33.6	Very low	33.4	Very low	177 Å²	177	144 Å²	144	93%	0.927	82%	0.818	S	S	*	*			trans	-113.4	124.5	166.5	-70.7	174.4	0	0	0	110
436	V	38.8	Very low	33.2	Very low	131 Å²	131	139.3 Å²	139.3	79%	0.794	82%	0.817	S	S	*	*			trans	-138.6	135	176	-178.5	0	0	0	0	107.1
437	P	44.8	Very low	33	Very low	119 Å²	119	135 Å²	135	77%	0.773	81%	0.812	S	S	*	*			trans	-86.6	166	-156.5	33.8	-38.3	0	0	0	114.9
438	R	30.6	Very low	33.8	Very low	255 Å²	255	136.9 Å²	136.9	96%	0.962	82%	0.823	S	S	*	*			trans	-134.3	150.5	160.1	-81.6	-161	166.7	-136.3	-4.1	112.5
439	L	32.6	Very low	33.8	Very low	181 Å²	181	140.3 Å²	140.3	95%	0.948	82%	0.821	S	S	*	*			trans	-112.7	129	-175.3	-106.1	163.5	0	0	0	110.8
440	A	30.1	Very low	33.4	Very low	103 Å²	103	141.2 Å²	141.2	85%	0.851	83%	0.831	S	S	*	*			trans	-170.3	146.4	153.4	0	0	0	0	0	107.1
441	G	29.7	Very low	33.3	Very low	66 Å²	66	134.4 Å²	134.4	68%	0.68	82%	0.819	S	S	*	*			cis	153.1	147.7	-3.3	0	0	0	0	0	110.1
442	M	32	Very low	33.2	Very low	194 Å²	194	138.2 Å²	138.2	96%	0.956	83%	0.828	S	S	*	*			trans	73.8	143.1	-179.9	-52.3	176.4	74.7	0	0	115.3
443	A	30.7	Very low	33.1	Very low	77 Å²	77	136 Å²	136	64%	0.636	82%	0.824	S	S	*	*			cis	-160	153.4	-15.6	0	0	0	0	0	113.1
444	N	29.9	Very low	33	Very low	146 Å²	146	140.7 Å²	140.7	78%	0.781	83%	0.831	S	S	*	*			trans	48.6	155.3	146	-67.9	-3.3	0	0	0	124.9
445	H	33	Very low	32.9	Very low	197 Å²	197	144.3 Å²	144.3	91%	0.912	83%	0.834	S	S	*	*			trans	99.7	124.7	170.6	-55.3	-66.8	0	0	0	114.2
446	G	28.8	Very low	32.9	Very low	80 Å²	80	143.2 Å²	143.2	83%	0.825	82%	0.824	S	S	*	*			cis	179.5	142.6	-8.3	0	0	0	0	0	109.5
447	S	30.5	Very low	32.7	Very low	112 Å²	112	146.5 Å²	146.5	78%	0.783	83%	0.831	S	S	*	*			trans	-89.2	159.3	-179	-152.7	0	0	0	0	111.3
448	P	47.5	Very low	32	Very low	127 Å²	127	149.1 Å²	149.1	83%	0.825	83%	0.833	S	S	*	*				-144.2	-164.4	81.8	39.2	-20.5	0	0	0	115.2
449	Q	32.3	Very low	32.2	Very low	172 Å²	172	144 Å²	144	80%	0.804	83%	0.83	S	S	*	*			trans	-98.9	158.2	-165.1	-48.8	169.8	15.7	0	0	114.9
450	L	29.3	Very low	32.2	Very low	177 Å²	177	140.4 Å²	140.4	93%	0.927	82%	0.82	S	S	*	*				173.6	155.9	127.5	-113.3	67.7	0	0	0	107.9
451	G	28.3	Very low	32.4	Very low	64 Å²	64	141.6 Å²	141.6	66%	0.66	82%	0.816	S	S	*	*			cis	173.1	145.5	-8	0	0	0	0	0	111.1
452	E	29.5	Very low	32.5	Very low	211 Å²	211	142 Å²	142	99%	0.986	81%	0.813	S	S	*	*			trans	58.7	155.7	165.7	-56.1	-163.8	113.3	0	0	121.4
453	G	30.8	Very low	32.5	Very low	78 Å²	78	141.1 Å²	141.1	80%	0.804	81%	0.807	S	S	*	*			trans	148.4	92.4	174.6	0	0	0	0	0	114.5
454	M	32.4	Very low	32.6	Very low	165 Å²	165	145.8 Å²	145.8	81%	0.813	82%	0.815	S	S	*	*			trans	-78.7	152.2	176	-72.9	-160.1	-76.2	0	0	112.9
455	F	35	Very low	33.7	Very low	198 Å²	198	143.4 Å²	143.4	87%	0.868	81%	0.807	S	S	*	*				-161.6	162	110	-118.2	-82.6	0	0	0	112.6
456	Q	33.7	Very low	33.6	Very low	154 Å²	154	140.1 Å²	140.1	72%	0.72	80%	0.801	S	S	*	*			trans	-94.7	148.4	-168.6	-57.8	163.1	-43.1	0	0	113.4
457	H	35.2	Very low	33.7	Very low	201 Å²	201	143 Å²	143	93%	0.931	80%	0.802	S	S	*	*				-148.2	158.9	125	-116.9	63.4	0	0	0	111.8
458	Q	31	Very low	33.7	Very low	174 Å²	174	148 Å²	148	81%	0.813	80%	0.804	S	S	*	*			trans	-135.2	127.6	-157.6	175.4	-172.7	68.4	0	0	112
459	T	32.9	Very low	32.9	Very low	147 Å²	147	150.2 Å²	150.2	90%	0.902	80%	0.803	S	S	*	*			trans	-154.3	135.1	150.1	-3.6	0	0	0	0	110.4
460	S	33	Very low	32.8	Very low	105 Å²	105	147.8 Å²	147.8	73%	0.734	80%	0.804	S	S	*	*			trans	-90	174	178.3	49.2	0	0	0	0	110.5
461	V	34.7	Very low	32.8	Very low	128 Å²	128	142.9 Å²	142.9	78%	0.776	80%	0.796	S	S	*	*				-160.5	144.3	55.4	169	0	0	0	0	112.3
462	A	31.4	Very low	34	Very low	76 Å²	76	145.4 Å²	145.4	63%	0.628	80%	0.801	S	S	*	*			trans	47.1	120.3	161	0	0	0	0	0	120.4
463	H	32.2	Very low	34.2	Very low	175 Å²	175	143.9 Å²	143.9	81%	0.81	79%	0.794	S	S	*	*				65.4	108.7	61.4	-63	-69.9	0	0	0	113.9
464	Q	33.2	Very low	34.2	Very low	174 Å²	174	146.5 Å²	146.5	81%	0.813	79%	0.794	S	S	*	*				86.7	159.1	58.6	-85.1	-139.4	-5.5	0	0	114.7
465	P	52.4	Low	34.1	Very low	96 Å²	96	141.9 Å²	141.9	62%	0.623	79%	0.789	S	S	*	*			cis	-143	-160.8	-28.6	33.9	-10.4	0	0	0	115.2
466	V	31.5	Very low	34	Very low	128 Å²	128	140.3 Å²	140.3	78%	0.776	79%	0.789	S	S	*	*			trans	70.1	158.1	161.3	-122.4	0	0	0	0	116.9
467	V	29.8	Very low	33.9	Very low	140 Å²	140	141.9 Å²	141.9	85%	0.848	80%	0.796	S	S	*	*			cis	-142	170.5	14.7	-163.1	0	0	0	0	113.9
468	R	31.8	Very low	33.8	Very low	218 Å²	218	137.5 Å²	137.5	82%	0.823	79%	0.788	S	S	*	*			trans	-93.3	174.4	177.2	-74.6	174	158.2	175.1	-5.8	114.9
469	Q	31.4	Very low	34.9	Very low	173 Å²	173	135.5 Å²	135.5	81%	0.808	79%	0.79	S	S	*	*			trans	106.6	169.9	134	-109.5	168.6	-10.4	0	0	120.8
470	C	29	Very low	34.7	Very low	122 Å²	122	131.3 Å²	131.3	82%	0.824	78%	0.776	S	S	*	*			trans	-117.7	153.8	-138.9	-46.2	0	0	0	0	117.7
471	G	29.8	Very low	34.7	Very low	74 Å²	74	133.1 Å²	133.1	76%	0.763	78%	0.783	S	S	*	*			trans	79.7	-174.2	147.7	0	0	0	0	0	118.3
472	P	53.8	Low	34.7	Very low	116 Å²	116	135.1 Å²	135.1	75%	0.753	79%	0.789	S	S	*	*			cis	-143.4	165.1	-7.8	43.4	-26.5	0	0	0	117.8
473	Q	32.9	Very low	34.9	Very low	179 Å²	179	140.4 Å²	140.4	84%	0.836	80%	0.8	S	S	*	*			trans	60.8	-179.1	164.7	-51.1	-154.5	75.1	0	0	117.5
474	T	31.9	Very low	35.8	Very low	133 Å²	133	136.9 Å²	136.9	82%	0.816	79%	0.793	S	S	*	*			cis	-158.4	168.2	4.8	-25.6	0	0	0	0	111.3
475	G	29	Very low	37	Very low	68 Å²	68	133.9 Å²	133.9	70%	0.701	79%	0.788	S	S	*	*			trans	131.1	75.1	139.5	0	0	0	0	0	124
476	L	33.5	Very low	36.1	Very low	165 Å²	165	135.4 Å²	135.4	86%	0.864	79%	0.787	S	S	*	*			trans	32.6	115.1	138.1	-65.9	166.8	0	0	0	123.6
477	Q	31.5	Very low	36.2	Very low	188 Å²	188	137.3 Å²	137.3	88%	0.879	79%	0.785	S	S	*	*				172.5	164	109.4	-96.7	177.9	80.3	0	0	115.3
478	S	32.7	Very low	36.4	Very low	109 Å²	109	136.1 Å²	136.1	76%	0.762	77%	0.774	S	S	*	*			trans	-137.9	175.2	175.6	-40.6	0	0	0	0	108.5
479	P	53.3	Low	36.5	Very low	132 Å²	132	135.2 Å²	135.2	86%	0.857	77%	0.772	S	S	*	*			cis	-137.6	-175.5	47	34.4	-11.8	0	0	0	114.4
480	G	30.2	Very low	36.5	Very low	59 Å²	59	131.2 Å²	131.2	61%	0.608	76%	0.763	S	S	*	*			cis	160.7	-177.4	-8.6	0	0	0	0	0	113.1
481	T	31.7	Very low	36.7	Very low	142 Å²	142	134.8 Å²	134.8	87%	0.871	77%	0.767	S	S	*	*			trans	66.8	141.6	175.5	14.3	0	0	0	0	116.4
482	L	34.5	Very low	36.7	Very low	171 Å²	171	134.1 Å²	134.1	90%	0.895	76%	0.76	S	S	*	*			cis	-124.8	-174.8	17.3	-88.4	161	0	0	0	114.1
483	Q	36.3	Very low	35.8	Very low	186 Å²	186	135.6 Å²	135.6	87%	0.869	77%	0.767	S	S	*	*			trans	-122.6	174.3	-164.2	-101.2	-135.9	-32.6	0	0	116.4
484	P	51.1	Low	37	Very low	102 Å²	102	132.4 Å²	132.4	66%	0.662	76%	0.762	S	S	*	*			trans	-112.6	-121.9	-165.2	41.3	-24.8	0	0	0	111.5
485	P	58.5	Low	37	Very low	110 Å²	110	138 Å²	138	71%	0.714	77%	0.768	S	S	*	*			cis	-118.2	-155.6	-28.1	30	-5.2	0	0	0	111.7
486	E	34	Very low	37.3	Very low	129 Å²	129	141.1 Å²	141.1	60%	0.603	77%	0.774	S	S	*	*			cis	-127.8	-159.8	0.3	-69.7	-168.8	66.9	0	0	109.5	L488	E486-L488 WeakPolarHBondContact OE1-CD1 3.38Å
487	F	33.1	Very low	37.2	Very low	168 Å²	168	141.1 Å²	141.1	74%	0.737	77%	0.774	S	S	*	*			cis	-142.3	169.8	9.4	-70.1	-74	0	0	0	108.5
488	L	34.5	Very low	37.1	Very low	115 Å²	115	137.2 Å²	137.2	60%	0.602	77%	0.767	S	S	*	*			cis	78.4	142.4	27.3	-54	179.7	0	0	0	114.9	E486	E486-L488 WeakPolarHBondContact OE1-CD1 3.38Å
489	Y	34.3	Very low	38.2	Very low	198 Å²	198	137.3 Å²	137.3	78%	0.776	77%	0.765	S	S	*	*			cis	-147.7	-172.6	2.4	-127.2	-50.4	0	0	0	112.9
490	S	31.1	Very low	37.1	Very low	90 Å²	90	138.8 Å²	138.8	63%	0.629	76%	0.76	S	S	*	*			trans	-94.8	175.7	-168	-45.3	0	0	0	0	115.2
491	H	33.2	Very low	37.2	Very low	196 Å²	196	144.2 Å²	144.2	91%	0.907	77%	0.77	S	S	*	*				169	177.9	123.6	-93	-71.3	0	0	0	112.7
492	G	30.2	Very low	37.2	Very low	60 Å²	60	147.4 Å²	147.4	62%	0.619	77%	0.767	S	S	*	*			trans	-174.5	179	178.3	0	0	0	0	0	116.1
493	V	34	Very low	37	Very low	148 Å²	148	148.2 Å²	148.2	90%	0.897	77%	0.766	S	S	*	*			trans	57.2	163.8	177.2	-82	0	0	0	0	118.4
494	P	58.8	Low	36.8	Very low	112 Å²	112	144.2 Å²	144.2	73%	0.727	76%	0.759	S	S	*	*			cis	-133.3	179.2	-35.3	37.2	-22	0	0	0	113.3
495	R	32.1	Very low	35.9	Very low	250 Å²	250	145.7 Å²	145.7	94%	0.943	77%	0.765	S	S	*	*			trans	-169.6	167.3	136.8	-108.7	166.5	-165.3	-149.8	1.7	114.8
496	T	34.7	Very low	34.6	Very low	134 Å²	134	149.4 Å²	149.4	82%	0.822	77%	0.773	S	S	*	*			trans	-115.8	161.8	-167.1	49	0	0	0	0	112.8
497	L	30.7	Very low	34.5	Very low	165 Å²	165	146.1 Å²	146.1	86%	0.864	77%	0.774	S	S	*	*			trans	-164.3	151.2	146.5	-107.3	176	0	0	0	112.8
498	S	30.8	Very low	34.4	Very low	106 Å²	106	145.6 Å²	145.6	74%	0.741	78%	0.784	S	S	*	*			trans	-166.8	-179.8	174.6	-58.9	0	0	0	0	106.7
499	P	55.1	Low	34.1	Very low	111 Å²	111	142.9 Å²	142.9	72%	0.721	78%	0.784	S	S	*	*			cis	-127.7	-162.5	-6.6	43.3	-26.2	0	0	0	112.4
500	H	31.3	Very low	33.9	Very low	163 Å²	163	142 Å²	142	76%	0.755	79%	0.789	S	S	*	*			trans	156.2	141.8	151.5	-87.6	-71.8	0	0	0	108.3
501	Q	31.9	Very low	34	Very low	172 Å²	172	143.4 Å²	143.4	80%	0.804	79%	0.793	S	S	*	*			cis	-157.2	167.7	-12.8	-163.4	159.5	-6.1	0	0	109.5
502	Y	30.4	Very low	34.9	Very low	210 Å²	210	138.8 Å²	138.8	82%	0.824	78%	0.781	S	S	*	*			trans	-74	153.6	-177.9	-98.9	-112.3	0	0	0	114.5
503	H	30.2	Very low	34.9	Very low	187 Å²	187	143.2 Å²	143.2	87%	0.866	79%	0.785	S	S	*	*				-160.5	154.5	121.9	-105.4	-71.3	0	0	0	111.8
504	S	32.1	Very low	34.9	Very low	103 Å²	103	147.6 Å²	147.6	72%	0.72	79%	0.786	S	S	*	*			trans	-153.7	140.7	178.8	178.2	0	0	0	0	109.7
505	V	32.2	Very low	33.6	Very low	132 Å²	132	147.2 Å²	147.2	80%	0.8	79%	0.786	S	S	*	*			trans	-146.4	145.5	173.3	-166.4	0	0	0	0	110.1
506	H	32.3	Very low	33.9	Very low	189 Å²	189	142.6 Å²	142.6	88%	0.875	78%	0.78	S	S	*	*			trans	-63.8	168.8	171.2	-57.2	-101.5	0	0	0	111.5
507	G	30.7	Very low	34.1	Very low	60 Å²	60	143.6 Å²	143.6	62%	0.619	78%	0.78	S	S	*	*			cis	148.3	-171.3	7.6	0	0	0	0	0	109.7
508	V	32.2	Very low	34.7	Very low	157 Å²	157	144.6 Å²	144.6	95%	0.952	80%	0.801	S	S	*	*			trans	71.8	142.6	-175.9	-166.6	0	0	0	0	113.2
509	G	28.5	Very low	34.9	Very low	58 Å²	58	146.5 Å²	146.5	60%	0.598	80%	0.804	S	S	*	*			cis	149.3	111.3	-10.6	0	0	0	0	0	113.9
510	M	29.2	Very low	33.8	Very low	179 Å²	179	148.4 Å²	148.4	88%	0.882	81%	0.808	S	S	*	*			trans	64.5	122.8	154.4	-46.1	-151.2	90.3	0	0	119
511	V	32.7	Very low	34	Very low	119 Å²	119	147.6 Å²	147.6	72%	0.721	81%	0.811	S	S	*	*				87.7	143	94.6	159.2	0	0	0	0	114.2
512	P	53.5	Low	34.1	Very low	99 Å²	99	146.1 Å²	146.1	64%	0.643	81%	0.812	S	S	*	*			cis	-141.1	-125.1	-26.9	42.6	-20	0	0	0	112.1
513	E	30.5	Very low	34.3	Very low	154 Å²	154	142.1 Å²	142.1	72%	0.72	81%	0.811	S	S	*	*			trans	68.5	125.5	170.1	-97	145.2	103.9	0	0	116.6
514	W	32.7	Very low	34.6	Very low	239 Å²	239	139.1 Å²	139.1	91%	0.905	81%	0.807	S	S	*	*				66.1	140.1	51.9	-56.8	-14.2	0	0	0	111.7
515	S	31.7	Very low	34.8	Very low	105 Å²	105	141.7 Å²	141.7	73%	0.734	81%	0.813	S	S	*	*			cis	-146.9	-176.3	25.2	-52.3	0	0	0	0	113.5
516	D	37.7	Very low	35	Very low	153 Å²	153	142.5 Å²	142.5	82%	0.818	82%	0.815	S	S	*	*			trans	-49.5	161.4	170.6	-59.4	-99.6	0	0	0	116.5
517	N	39.5	Very low	35.2	Very low	155 Å²	155	138.6 Å²	138.6	83%	0.829	81%	0.809	S	S	*	*				-158	129.1	128.7	-127.8	-37.1	0	0	0	114.7
518	S	43.8	Very low	35.6	Very low	185 Å²	185	145.7 Å²	145.7	100%	1.294	83%	0.827	S	S	*	*			trans	64.3	0	160.3	-57.1	0	0	0	0	119.5

Retrieved 518 of 518 residues in 123.1 ms (Link to these results)

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