A0A5K4F5C9_SCHMA Loading...

PDZ domain-containing protein

AlphaFold DB , UniProt , Accession A0A5K4F5C9, Species SCHMA (Schistosoma mansoni, Blood fluke), Gene n/a, Length 709 aa.

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(Predicted Aligned Error values between residue pairs)

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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	40.6	Very low	35.9	Very low	235 Å²	235	146.5 Å²	146.5	100%	1.158	79%	0.791	S	S	*	*				0	127.8	0	-78.8	161.9	168.8	0	0	106.4
2	N	35.4	Very low	36	Very low	137 Å²	137	147.8 Å²	147.8	73%	0.733	79%	0.788	S	S	*	*			trans	-152.2	160.7	-140.5	-67.3	70.3	0	0	0	106.6
3	D	35.7	Very low	35.9	Very low	123 Å²	123	149.7 Å²	149.7	66%	0.658	79%	0.788	S	S	*	*			cis	-168.2	168.1	-13	-115.7	-45.6	0	0	0	107.7
4	L	39.2	Very low	35.7	Very low	139 Å²	139	153 Å²	153	73%	0.728	79%	0.794	S	S	*	*			trans	61	139.3	170.1	-81.5	61.1	0	0	0	115.5
5	K	36.8	Very low	35.6	Very low	175 Å²	175	155.1 Å²	155.1	76%	0.761	80%	0.798	S	S	*	*			cis	92.4	148.5	28	-75.5	-169.7	163.8	-158.2	0	115.7
6	D	36.2	Very low	35.3	Very low	123 Å²	123	149.8 Å²	149.8	66%	0.658	79%	0.793	S	S	*	*			trans	68.5	112.7	158.5	-48.2	-29.2	0	0	0	117.9
7	I	40.7	Very low	35	Very low	173 Å²	173	148.6 Å²	148.6	89%	0.887	79%	0.794	S	S	*	*				-163.7	129.1	118.4	-96.1	154.6	0	0	0	108.1
8	D	34.4	Very low	35	Very low	153 Å²	153	146.1 Å²	146.1	82%	0.818	79%	0.785	S	S	*	*			trans	-98.2	154.5	-175.7	-87.8	-55	0	0	0	113.2
9	G	29.6	Very low	35.2	Very low	70 Å²	70	140.7 Å²	140.7	72%	0.722	76%	0.758	S	S	*	*			trans	39.9	100.3	140.3	0	0	0	0	0	120.4
10	I	32.8	Very low	35.8	Very low	166 Å²	166	137.1 Å²	137.1	85%	0.851	74%	0.738	S	S	*	*			trans	-101.7	110.8	150.2	-57.5	177.5	0	0	0	107.3
11	T	33.9	Very low	36.3	Very low	118 Å²	118	133.3 Å²	133.3	72%	0.724	72%	0.719	S	S	*	*			trans	-103.8	116	171.3	-61.4	0	0	0	0	108.3	H13	T11-H13 PolarHBondContact O-N 3.3Å
12	E	37.1	Very low	36.9	Very low	162 Å²	162	123.1 Å²	123.1	76%	0.757	67%	0.67	S	S	*	*			trans	-68.9	121.4	-179.1	-65.8	-178.4	160.9	0	0	111.3	F14	E12-F14 PolarHBondContact O-N 2.75Å
13	H	33.8	Very low	37.3	Very low	172 Å²	172	119.3 Å²	119.3	80%	0.796	65%	0.652	S	S	*	*			trans	-87.5	90.3	175.7	-95	-97.6	0	0	0	110.6	T11 Q15	T11-H13 PolarHBondContact O-N 3.3Å; H13-Q15 PolarHBondContact O-N 3.32Å; H13-Q15 VanDerWaalsContact O-N 3.16Å
14	F	33.9	Very low	38	Very low	196 Å²	196	114.8 Å²	114.8	86%	0.86	63%	0.627	S	S	*	*			trans	-63.5	113.4	164.6	-102.1	-95.2	0	0	0	110.2	E12	E12-F14 PolarHBondContact O-N 2.75Å
15	Q	34.4	Very low	37.8	Very low	185 Å²	185	114.8 Å²	114.8	86%	0.864	62%	0.623	S	S	*	*			trans	-81	121.8	169.6	-70.3	175.6	-21.1	0	0	108.9	H13	H13-Q15 PolarHBondContact O-N 3.32Å; H13-Q15 VanDerWaalsContact O-N 3.16Å
16	G	30.9	Very low	37.6	Very low	70 Å²	70	110 Å²	110	72%	0.722	62%	0.624	S	S	*	*			trans	-83.3	131.1	-172.7	0	0	0	0	0	113.5	T18	G16-T18 PolarHBondContact O-N 3.47Å
17	T	30.1	Very low	37.5	Very low	130 Å²	130	110.1 Å²	110.1	80%	0.798	62%	0.624	S	S	*	*			trans	-76.8	105.4	169.5	36.2	0	0	0	0	110.9	T19	T17-T19 PolarHBondContact O-N 3.07Å
18	T	33.8	Very low	37	Very low	103 Å²	103	109.4 Å²	109.4	63%	0.632	62%	0.617	S	S	*	*			trans	-75.4	95.4	178.8	-55.6	0	0	0	0	111.2	G16	G16-T18 PolarHBondContact O-N 3.47Å
19	T	40.4	Very low	37.2	Very low	44 Å²	44	107.4 Å²	107.4	27%	0.27	61%	0.605	S	S	.	*			trans	-76.4	127.7	168.5	-55.1	0	0	0	0	109.9	T17 T21 Y403	T17-T19 PolarHBondContact O-N 3.07Å; T19-T21 PolarHBondContact O-N 3.19Å; T19-Y403 HydrophobicContact CG2-CE2 3.87Å
20	L	45.7	Very low	37.4	Very low	68 Å²	68	110.3 Å²	110.3	36%	0.356	60%	0.604	S	S	.	*			trans	-77.3	87.9	177.7	-64.9	176.7	0	0	0	110.9	Y447	L20-Y447 HydrophobicContact CB-CE1 4.2Å; L20-Y447 PolarHBondContact O-OH 2.98Å
21	T	46.2	Very low	37.4	Very low	58 Å²	58	106.1 Å²	106.1	36%	0.356	59%	0.59	S	S	.	*			trans	-106.3	100.2	165.5	-59.2	0	0	0	0	109.2	T19 T23	T19-T21 PolarHBondContact O-N 3.19Å; T21-T23 PolarHBondContact O-N 3.32Å
22	T	54.2	Low	37.9	Very low	21 Å²	21	105.8 Å²	105.8	13%	0.129	59%	0.587	C	S	.	*			trans	-76	105.1	175.6	-58.9	0	0	0	0	109.3	F24 S401 Y447 K451	T22-F24 HydrophobicContact CG2-CD1 4.2Å; T22-F24 HydrophobicContact CG2-CE1 4.15Å; T22-F24 HydrophobicContact CG2-CZ 4.45Å; T22-S401 VanDerWaalsContact O-CB 3.29Å; T22-S401 WeakPolarHBondContact O-CB 3.29Å; T22-S401 PolarHBondContact O-OG 3.24Å; T22-Y447 WeakPolarHBondContact CB-OH 3.43Å; T22-Y447 PolarHBondContact N-OH 3.04Å; T22-Y447 PolarHBondContact OG1-OH 3.19Å; T22-K451 HydrophobicContact CG2-CD 4.14Å; T22-K451 HydrophobicContact CG2-CG 4.5Å
23	T	42.6	Very low	38.1	Very low	57 Å²	57	103 Å²	103	35%	0.35	57%	0.574	S	S	.	*			trans	-72.7	128.2	149.8	37.9	0	0	0	0	108.1	T21 E25 S401	T21-T23 PolarHBondContact O-N 3.32Å; T23-E25 PolarHBondContact O-N 2.75Å; T23-S401 WeakPolarHBondContact CA-OG 3.5Å
24	F	51.8	Low	38.5	Very low	28 Å²	28	101.4 Å²	101.4	12%	0.123	57%	0.572	C	S	.	*			trans	-75.7	67	172.9	-68.8	-75.2	0	0	0	110.1	T22 H397 F400 F402 K451 I454 L455	T22-F24 HydrophobicContact CG2-CD1 4.2Å; T22-F24 HydrophobicContact CG2-CE1 4.15Å; T22-F24 HydrophobicContact CG2-CZ 4.45Å; F24-H397 WeakPolarHBondContact O-CB 3.39Å; F24-F400 WeakPolarHBondContact CD2-O 3.4Å; F24-F400 HydrophobicContact CE2-CE2 4.26Å; F24-F400 HydrophobicContact CE2-CZ 4.25Å; F24-F402 HydrophobicContact CE2-CD1 4.16Å; F24-F402 HydrophobicContact CE2-CE1 4.34Å; F24-F402 HydrophobicContact CZ-CD1 4.25Å; F24-F402 AromaticContact CZ-CE1 3.97Å; F24-F402 HydrophobicContact CZ-CE1 3.97Å; F24-K451 HydrophobicContact CE1-CG 4.37Å; F24-I454 HydrophobicContact CD1-CG2 4.27Å; F24-I454 HydrophobicContact CE1-CB 4.08Å; F24-I454 HydrophobicContact CE1-CG2 3.6Å; F24-I454 HydrophobicContact CE2-CD1 4.16Å; F24-I454 HydrophobicContact CE2-CG2 3.88Å; F24-I454 HydrophobicContact CZ-CB 3.79Å; F24-I454 HydrophobicContact CZ-CD1 3.76Å; F24-I454 HydrophobicContact CZ-CG1 4.37Å; F24-I454 HydrophobicContact CZ-CG2 3.38Å; F24-L455 HydrophobicContact CD1-CD2 4.14Å; F24-L455 HydrophobicContact CE1-CD2 4.22Å; F24-L455 HydrophobicContact CE1-CG 4.37Å
25	E	33.8	Very low	38.9	Very low	138 Å²	138	100.6 Å²	100.6	65%	0.645	56%	0.564	S	S	*	*			trans	-122	108.2	-169.7	-177	174.5	-170.8	0	0	110.5	T23 D27	T23-E25 PolarHBondContact O-N 2.75Å; E25-D27 PolarHBondContact O-N 3.05Å
26	G	33.1	Very low	39.4	Very low	76 Å²	76	96.8 Å²	96.8	78%	0.784	55%	0.549	S	S	*	.			trans	78.9	-2	159.8	0	0	0	0	0	118.8	Q28	G26-Q28 VanDerWaalsContact C-N 3.32Å; G26-Q28 PolarHBondContact O-N 3.28Å
27	D	33.7	Very low	40	Very low	125 Å²	125	96.9 Å²	96.9	67%	0.668	54%	0.535	S	S	*	.			trans	-67.1	87.8	174.6	-83.7	-18.9	0	0	0	111.4	E25 I29	E25-D27 PolarHBondContact O-N 3.05Å; D27-I29 VanDerWaalsContact C-N 3.3Å; D27-I29 HydrophobicContact CB-CG1 4.28Å; D27-I29 PolarHBondContact O-N 3.33Å
28	Q	31.3	Very low	40.7	Very low	157 Å²	157	96.2 Å²	96.2	73%	0.734	53%	0.527	S	S	*	.			trans	-75.3	82	168.4	-174.9	-173.1	-23.6	0	0	109	G26 D30	G26-Q28 VanDerWaalsContact C-N 3.32Å; G26-Q28 PolarHBondContact O-N 3.28Å; Q28-D30 PolarHBondContact NE2-OD1 3.27Å; Q28-D30 PolarHBondContact O-N 3.27Å
29	I	37.4	Very low	41.1	Very low	111 Å²	111	99 Å²	99	57%	0.569	53%	0.53	S	S	*	.			trans	-79.6	95.2	173.7	-43.9	178.5	0	0	0	108.5	D27 S31 L455	D27-I29 VanDerWaalsContact C-N 3.3Å; D27-I29 HydrophobicContact CB-CG1 4.28Å; D27-I29 PolarHBondContact O-N 3.33Å; I29-S31 WeakPolarHBondContact CG2-O 3.27Å; I29-S31 PolarHBondContact O-N 2.95Å; I29-L455 HydrophobicContact CD1-CD1 4.49Å
30	D	33.6	Very low	41.4	Very low	131 Å²	131	100.5 Å²	100.5	70%	0.701	54%	0.539	S	S	*	.			trans	-69.6	118.7	166	-70.8	-28.2	0	0	0	108.5	Q28	Q28-D30 PolarHBondContact NE2-OD1 3.27Å; Q28-D30 PolarHBondContact O-N 3.27Å
31	S	34.7	Very low	41.4	Very low	79 Å²	79	102.3 Å²	102.3	55%	0.552	55%	0.546	S	S	*	.			trans	70.9	138.6	-175.9	-110.1	0	0	0	0	117	I29 E33	I29-S31 WeakPolarHBondContact CG2-O 3.27Å; I29-S31 PolarHBondContact O-N 2.95Å; S31-E33 WeakPolarHBondContact CA-OE2 3.47Å; S31-E33 WeakPolarHBondContact CB-OE2 3.32Å; S31-E33 PolarHBondContact OG-OE2 3.28Å
32	V	42.6	Very low	41.2	Very low	110 Å²	110	105.8 Å²	105.8	67%	0.667	56%	0.56	S	S	*	*	S	Bend	trans	-87.2	-15.5	177	176.2	0	0	0	0	111.2	D34 Y35	V32-D34 PolarHBondContact O-N 3.13Å; V32-Y35 PolarHBondContact O-N 2.93Å
33	E	42.8	Very low	40.8	Very low	104 Å²	104	109 Å²	109	49%	0.486	57%	0.573	S	S	.	*	T	Hydrogen-bonded Turn	trans	-65	-32.8	-167	-73.4	61.2	-141.5	0	0	114.1	S31 Y35 I36	S31-E33 WeakPolarHBondContact CA-OE2 3.47Å; S31-E33 WeakPolarHBondContact CB-OE2 3.32Å; S31-E33 PolarHBondContact OG-OE2 3.28Å; E33-Y35 VanDerWaalsContact C-N 3.3Å; E33-Y35 PolarHBondContact O-N 3.31Å; E33-I36 WeakPolarHBondContact O-CB 3.46Å; E33-I36 PolarHBondContact O-N 3.34Å; E33-I36 VanDerWaalsContact O-N 3.09Å
34	D	42.5	Very low	40.9	Very low	138 Å²	138	112 Å²	112	74%	0.738	58%	0.583	S	S	*	*	H	α-helix	trans	-62	-33.8	-177.2	-93	10.7	0	0	0	112.8	V32 I36 V37	V32-D34 PolarHBondContact O-N 3.13Å; D34-I36 PolarHBondContact O-N 3.16Å; D34-V37 PolarHBondContact O-N 2.91Å
35	Y	40.8	Very low	40.6	Very low	179 Å²	179	116.1 Å²	116.1	70%	0.702	61%	0.607	S	S	*	*	H	α-helix	trans	-72.9	-15.8	179.3	-158.4	-94.4	0	0	0	113.2	V32 E33	V32-Y35 PolarHBondContact O-N 2.93Å; E33-Y35 VanDerWaalsContact C-N 3.3Å; E33-Y35 PolarHBondContact O-N 3.31Å
36	I	44.9	Very low	41.2	Very low	106 Å²	106	118 Å²	118	54%	0.544	61%	0.608	S	S	.	*	H	α-helix	trans	-80	-31.3	178.1	-55.3	179.1	0	0	0	110.3	E33 D34 T40	E33-I36 WeakPolarHBondContact O-CB 3.46Å; E33-I36 PolarHBondContact O-N 3.34Å; E33-I36 VanDerWaalsContact O-N 3.09Å; D34-I36 PolarHBondContact O-N 3.16Å; I36-T40 PolarHBondContact O-OG1 2.79Å
37	V	45	Very low	41.9	Very low	71 Å²	71	122.3 Å²	122.3	43%	0.43	61%	0.608	S	S	.	*	H	α-helix	trans	-68.5	-43.5	-174.3	178.6	0	0	0	0	112.8	D34 K39 T40 Q41	D34-V37 PolarHBondContact O-N 2.91Å; V37-K39 VanDerWaalsContact C-N 3.27Å; V37-K39 PolarHBondContact O-N 3.11Å; V37-T40 PolarHBondContact O-N 3.13Å; V37-T40 VanDerWaalsContact O-N 3.14Å; V37-Q41 PolarHBondContact O-N 3.39Å; V37-Q41 VanDerWaalsContact O-N 3.17Å
38	D	43.3	Very low	42.1	Very low	117 Å²	117	120.6 Å²	120.6	63%	0.626	61%	0.605	S	S	*	*	H	α-helix	trans	-61.8	-36	-179.2	-101.1	4.9	0	0	0	112.1	T40 Q41 M42	D38-T40 VanDerWaalsContact C-N 3.29Å; D38-T40 PolarHBondContact O-N 3.15Å; D38-Q41 PolarHBondContact O-N 3.23Å; D38-M42 PolarHBondContact O-N 3.29Å
39	K	43.1	Very low	42.4	Very low	160 Å²	160	118.1 Å²	118.1	70%	0.696	61%	0.606	S	S	*	*	H	α-helix	trans	-65.8	-32.6	178.2	-154.9	179.2	-175.8	-172.1	0	112.1	V37	V37-K39 VanDerWaalsContact C-N 3.27Å; V37-K39 PolarHBondContact O-N 3.11Å
40	T	47.2	Very low	42.5	Very low	77 Å²	77	118 Å²	118	47%	0.472	61%	0.611	S	S	.	*	H	α-helix	trans	-73.9	-37.6	175	-48.7	0	0	0	0	112.2	I36 V37 D38 Q44	I36-T40 PolarHBondContact O-OG1 2.79Å; V37-T40 PolarHBondContact O-N 3.13Å; V37-T40 VanDerWaalsContact O-N 3.14Å; D38-T40 VanDerWaalsContact C-N 3.29Å; D38-T40 PolarHBondContact O-N 3.15Å; T40-Q44 PolarHBondContact O-N 2.91Å
41	Q	44.9	Very low	42.4	Very low	106 Å²	106	120.3 Å²	120.3	50%	0.495	62%	0.616	S	S	.	*	H	α-helix	trans	-73.7	-33.3	178.5	-71.4	-171.7	54.3	0	0	113.3	V37 D38 N45	V37-Q41 PolarHBondContact O-N 3.39Å; V37-Q41 VanDerWaalsContact O-N 3.17Å; D38-Q41 PolarHBondContact O-N 3.23Å; Q41-N45 PolarHBondContact O-N 2.71Å; Q41-N45 PolarHBondContact O-ND2 3.07Å
42	M	42.3	Very low	42.7	Very low	130 Å²	130	123 Å²	123	64%	0.64	62%	0.622	S	S	*	*	H	α-helix	trans	-64.4	-41	174.2	-83.8	-162.6	165.5	0	0	112.7	D38 N45 R46	D38-M42 PolarHBondContact O-N 3.29Å; M42-N45 PolarHBondContact O-N 2.78Å; M42-R46 PolarHBondContact O-N 2.87Å
43	E	45.6	Very low	42.3	Very low	89 Å²	89	124.8 Å²	124.8	42%	0.416	62%	0.624	S	S	.	*	H	α-helix	trans	-70.9	-41	-178.5	-132.3	63.3	-107.2	0	0	112.3	N45 R46 Q47	E43-N45 VanDerWaalsContact C-N 3.31Å; E43-N45 PolarHBondContact O-N 3.08Å; E43-R46 PolarHBondContact O-N 3.22Å; E43-R46 VanDerWaalsContact O-N 3.16Å; E43-R46 IonicContact OE1-NH1 3.9Å; E43-R46 PolarHBondContact OE1-NH1 3.12Å; E43-R46 VanDerWaalsContact OE1-NH1 3.14Å; E43-R46 IonicContact OE2-NH1 3.06Å; E43-Q47 PolarHBondContact O-N 3.32Å
44	Q	45.4	Very low	42.3	Very low	120 Å²	120	127.7 Å²	127.7	56%	0.561	64%	0.637	S	S	*	*	H	α-helix	trans	-64	-34.7	176.4	-72.5	-176.5	-7.9	0	0	112.8	T40 R46 Q47 S48	T40-Q44 PolarHBondContact O-N 2.91Å; Q44-R46 VanDerWaalsContact C-N 3.31Å; Q44-R46 PolarHBondContact O-N 3.02Å; Q44-Q47 PolarHBondContact O-N 2.93Å; Q44-S48 WeakPolarHBondContact O-CB 3.38Å; Q44-S48 PolarHBondContact O-OG 3.02Å
45	N	45.3	Very low	42	Very low	115 Å²	115	128.4 Å²	128.4	62%	0.615	64%	0.641	S	S	*	*	H	α-helix	trans	-71.4	-23	176.2	-77.7	-53.9	0	0	0	113.2	Q41 M42 E43	Q41-N45 PolarHBondContact O-N 2.71Å; Q41-N45 PolarHBondContact O-ND2 3.07Å; M42-N45 PolarHBondContact O-N 2.78Å; E43-N45 VanDerWaalsContact C-N 3.31Å; E43-N45 PolarHBondContact O-N 3.08Å
46	R	45	Very low	42.3	Very low	176 Å²	176	126.1 Å²	126.1	66%	0.664	65%	0.645	S	S	*	*	H	α-helix	trans	-75.4	-28.5	173.3	-76.6	179.7	173.5	144.1	-1.3	113.7	M42 E43 Q44 S48	M42-R46 PolarHBondContact O-N 2.87Å; E43-R46 PolarHBondContact O-N 3.22Å; E43-R46 VanDerWaalsContact O-N 3.16Å; E43-R46 IonicContact OE1-NH1 3.9Å; E43-R46 PolarHBondContact OE1-NH1 3.12Å; E43-R46 VanDerWaalsContact OE1-NH1 3.14Å; E43-R46 IonicContact OE2-NH1 3.06Å; Q44-R46 VanDerWaalsContact C-N 3.31Å; Q44-R46 PolarHBondContact O-N 3.02Å; R46-S48 VanDerWaalsContact C-N 3.26Å; R46-S48 PolarHBondContact O-N 3.1Å
47	Q	47.8	Very low	42.2	Very low	168 Å²	168	128.9 Å²	128.9	79%	0.785	66%	0.661	S	S	*	*	T	Hydrogen-bonded Turn	trans	-84.3	2.4	177.5	-65.4	178.8	-25.8	0	0	113.2	E43 Q44	E43-Q47 PolarHBondContact O-N 3.32Å; Q44-Q47 PolarHBondContact O-N 2.93Å
48	S	39	Very low	41.9	Very low	89 Å²	89	135 Å²	135	62%	0.622	69%	0.685	S	S	*	*			trans	-121.3	42.6	-166	-59.8	0	0	0	0	114	Q44 R46	Q44-S48 WeakPolarHBondContact O-CB 3.38Å; Q44-S48 PolarHBondContact O-OG 3.02Å; R46-S48 VanDerWaalsContact C-N 3.26Å; R46-S48 PolarHBondContact O-N 3.1Å
49	S	37	Very low	41.9	Very low	105 Å²	105	133 Å²	133	73%	0.734	69%	0.692	S	S	*	*			trans	-131.2	119.4	174.6	-162.9	0	0	0	0	111.1
50	P	39.2	Very low	41.7	Very low	107 Å²	107	134.9 Å²	134.9	70%	0.695	70%	0.703	S	S	*	*			trans	-76.1	133.3	-177.7	30.3	-33.6	0	0	0	111.5
51	F	32.6	Very low	41.4	Very low	180 Å²	180	140.1 Å²	140.1	79%	0.789	72%	0.723	S	S	*	*			trans	-66	133.4	169.9	-143.6	-116.3	0	0	0	109.1	E53	F51-E53 HydrophobicContact CD1-CG 3.75Å; F51-E53 HydrophobicContact CE1-CG 3.76Å; F51-E53 WeakPolarHBondContact CE1-OE1 3.27Å
52	I	40.5	Very low	40.8	Very low	135 Å²	135	141.1 Å²	141.1	69%	0.692	74%	0.736	S	S	*	*			trans	-123.7	94.5	171.9	-60.5	179.7	0	0	0	106.9
53	E	34.3	Very low	40.8	Very low	149 Å²	149	141.3 Å²	141.3	70%	0.696	74%	0.744	S	S	*	*			trans	-70.1	142.5	162.4	-73.2	157.2	161.8	0	0	108.7	F51	F51-E53 HydrophobicContact CD1-CG 3.75Å; F51-E53 HydrophobicContact CE1-CG 3.76Å; F51-E53 WeakPolarHBondContact CE1-OE1 3.27Å
54	H	43.5	Very low	40.4	Very low	164 Å²	164	144.1 Å²	144.1	76%	0.759	76%	0.762	S	S	*	*			trans	-140.9	83.9	179	-122.5	-53.5	0	0	0	109.4
55	D	35.6	Very low	40.4	Very low	154 Å²	154	147.9 Å²	147.9	82%	0.824	78%	0.78	S	S	*	*			trans	-64.8	131.5	169.8	-51.6	-58.7	0	0	0	110
56	V	47	Very low	40.1	Very low	131 Å²	131	151.5 Å²	151.5	79%	0.794	79%	0.793	S	S	*	*			trans	-144.6	127.1	163.5	-175.1	0	0	0	0	108
57	D	43.4	Very low	40	Very low	163 Å²	163	152.8 Å²	152.8	87%	0.872	81%	0.806	S	S	*	*			trans	-66.3	161	-176.1	-71.9	-68.2	0	0	0	114.9
58	E	37.7	Very low	39.6	Very low	199 Å²	199	154 Å²	154	93%	0.93	81%	0.812	S	S	*	*			trans	-65.5	154.8	172	-60.5	-177.1	146.3	0	0	113.3
59	G	43.8	Very low	39.8	Very low	76 Å²	76	159.2 Å²	159.2	78%	0.784	83%	0.827	S	S	*	*			trans	-170.7	86	173.9	0	0	0	0	0	112.7	Q61	G59-Q61 PolarHBondContact O-N 3.12Å
60	E	38.8	Very low	40.1	Very low	199 Å²	199	163.1 Å²	163.1	93%	0.93	83%	0.833	S	S	*	*			trans	-62.6	129	176	-61.7	-176.9	125.4	0	0	112.3
61	Q	40.1	Very low	40.2	Very low	188 Å²	188	166.5 Å²	166.5	88%	0.879	84%	0.84	S	S	*	*			trans	-152.2	116	145.9	-165.5	124.6	76.9	0	0	111.7	G59	G59-Q61 PolarHBondContact O-N 3.12Å
62	T	33	Very low	40.6	Very low	126 Å²	126	163.9 Å²	163.9	77%	0.773	84%	0.838	S	S	*	*			trans	-77.6	132.3	171.5	52.1	0	0	0	0	111.9
63	V	43.2	Very low	40.5	Very low	135 Å²	135	162.6 Å²	162.6	82%	0.818	84%	0.836	S	S	*	*			trans	-148	131.8	141	179.5	0	0	0	0	107.5
64	D	36	Very low	40.9	Very low	147 Å²	147	162.2 Å²	162.2	79%	0.786	84%	0.835	S	S	*	*			trans	-79.5	141.6	173.5	-36.8	-98.4	0	0	0	111.1
65	E	45.4	Very low	40.4	Very low	199 Å²	199	161.9 Å²	161.9	93%	0.93	84%	0.839	S	S	*	*			trans	-157.1	136.9	146.1	-117.8	161.7	-145.4	0	0	109.9
66	E	39.6	Very low	40.6	Very low	192 Å²	192	163.7 Å²	163.7	90%	0.897	84%	0.835	S	S	*	*			trans	-93.3	137.4	-173.5	-55.9	168.1	138.8	0	0	110.4
67	E	43.2	Very low	40.2	Very low	202 Å²	202	163.1 Å²	163.1	94%	0.944	83%	0.832	S	S	*	*			trans	-158.7	149.8	143.8	-119.9	170.2	-154.6	0	0	111.2
68	E	39	Very low	39.9	Very low	193 Å²	193	162.7 Å²	162.7	90%	0.902	83%	0.83	S	S	*	*			trans	-97.9	134.5	-167.6	-56.4	172.5	127.1	0	0	111.6
69	E	42.4	Very low	40	Very low	200 Å²	200	159.5 Å²	159.5	94%	0.935	81%	0.814	S	S	*	*			trans	-120.5	130.5	159.8	-72.5	-160.3	158.7	0	0	110.2
70	E	43.7	Very low	39.5	Very low	187 Å²	187	163.3 Å²	163.3	87%	0.874	82%	0.817	S	S	*	*			trans	-74	125.4	-165.6	-61.2	177.8	118.4	0	0	113.3	V72	E70-V72 PolarHBondContact O-N 2.8Å
71	E	41.1	Very low	39.3	Very low	178 Å²	178	164 Å²	164	83%	0.832	81%	0.812	S	S	*	*			trans	-72.7	107.5	170.5	-173.2	173.6	-143.1	0	0	110.5	V73	E71-V73 HydrophobicContact CG-CG2 4.4Å; E71-V73 PolarHBondContact O-N 2.78Å
72	V	41.4	Very low	39.1	Very low	124 Å²	124	159.8 Å²	159.8	75%	0.752	81%	0.81	S	S	*	*			trans	-76.1	89.5	176.3	-177.4	0	0	0	0	109.9	E70 E74	E70-V72 PolarHBondContact O-N 2.8Å; V72-E74 PolarHBondContact O-N 3.25Å; V72-E74 VanDerWaalsContact O-N 3.07Å
73	V	38.3	Very low	39.5	Very low	108 Å²	108	159 Å²	159	66%	0.655	79%	0.793	S	S	*	*			trans	-69.7	98.5	174.8	-170	0	0	0	0	110	E71 D75	E71-V73 HydrophobicContact CG-CG2 4.4Å; E71-V73 PolarHBondContact O-N 2.78Å; V73-D75 PolarHBondContact O-N 3.49Å
74	E	42.7	Very low	39.5	Very low	141 Å²	141	157.7 Å²	157.7	66%	0.659	78%	0.781	S	S	*	*			trans	-74.9	119.3	166	-73.5	-158.6	161.6	0	0	110.1	V72 Y76	V72-E74 PolarHBondContact O-N 3.25Å; V72-E74 VanDerWaalsContact O-N 3.07Å; E74-Y76 HydrophobicContact CB-CD2 4.22Å; E74-Y76 PolarHBondContact O-N 2.9Å; E74-Y76 WeakPolarHBondContact OE2-CE2 3.26Å
75	D	32.9	Very low	40.1	Very low	158 Å²	158	154.6 Å²	154.6	85%	0.845	77%	0.771	S	S	*	*			trans	-65.7	67.6	175.8	-85.5	-38.2	0	0	0	112.7	V73 V77	V73-D75 PolarHBondContact O-N 3.49Å; D75-V77 PolarHBondContact O-N 3.48Å
76	Y	39.6	Very low	40.2	Very low	191 Å²	191	149.8 Å²	149.8	75%	0.749	75%	0.751	S	S	*	*			trans	-74.3	111.2	161.4	-90.4	-91.6	0	0	0	109.2	E74 N78	E74-Y76 HydrophobicContact CB-CD2 4.22Å; E74-Y76 PolarHBondContact O-N 2.9Å; E74-Y76 WeakPolarHBondContact OE2-CE2 3.26Å; Y76-N78 PolarHBondContact O-N 3.49Å
77	V	39.3	Very low	41.1	Very low	120 Å²	120	143.9 Å²	143.9	73%	0.727	73%	0.726	S	S	*	*			trans	-66.4	83	174.2	-177.2	0	0	0	0	109.6	D75 H79	D75-V77 PolarHBondContact O-N 3.48Å; V77-H79 PolarHBondContact O-N 2.88Å
78	N	36.1	Very low	41.8	Very low	154 Å²	154	136.7 Å²	136.7	82%	0.824	69%	0.694	S	S	*	*			trans	-82.7	79.4	-174.5	-162.5	17.5	0	0	0	109.5	Y76	Y76-N78 PolarHBondContact O-N 3.49Å
79	H	40.8	Very low	42.9	Very low	132 Å²	132	133.7 Å²	133.7	61%	0.611	68%	0.677	S	S	*	*			trans	-52.8	139.3	179.2	-88.8	-59.3	0	0	0	112.2	V77 Y81	V77-H79 PolarHBondContact O-N 2.88Å; H79-Y81 VanDerWaalsContact O-CD2 3.27Å; H79-Y81 WeakPolarHBondContact O-CD2 3.37Å; H79-Y81 PolarHBondContact O-N 3.48Å
80	D	33.8	Very low	44.2	Very low	155 Å²	155	128.7 Å²	128.7	83%	0.829	66%	0.657	S	S	*	*	S	Bend	trans	-60.2	96.2	-166.1	-54.8	-90.2	0	0	0	114.5
81	Y	34.8	Very low	45.4	Very low	214 Å²	214	120.4 Å²	120.4	84%	0.839	62%	0.619	S	S	*	*			trans	-114	6.5	168.1	-74.8	-74.4	0	0	0	113.8	H79 R83	H79-Y81 VanDerWaalsContact O-CD2 3.27Å; H79-Y81 WeakPolarHBondContact O-CD2 3.37Å; H79-Y81 PolarHBondContact O-N 3.48Å; Y81-R83 PolarHBondContact O-N 2.97Å
82	A	34.9	Very low	46.6	Very low	100 Å²	100	115.7 Å²	115.7	83%	0.826	60%	0.596	S	S	*	*			trans	-77.2	52.6	170.3	0	0	0	0	0	112.1	D84	A82-D84 PolarHBondContact O-N 3.13Å
83	R	41.6	Very low	48.1	Very low	109 Å²	109	114.9 Å²	114.9	41%	0.411	58%	0.584	S	S	.	*			trans	-72.7	114.3	172.2	-175.6	172.5	174.5	-177.3	-7.4	108.3	Y81 S85 D91	Y81-R83 PolarHBondContact O-N 2.97Å; R83-S85 PolarHBondContact O-N 3.47Å; R83-D91 IonicContact CZ-OD2 3.97Å; R83-D91 IonicContact NH2-OD2 2.99Å; R83-D91 PolarHBondContact NH2-OD2 3.44Å
84	D	42.8	Very low	49.7	Very low	107 Å²	107	112.3 Å²	112.3	57%	0.572	57%	0.568	S	S	*	*			trans	-41.8	133.9	-171.1	-81	-63.2	0	0	0	114.9	A82 N86 N87 I88	A82-D84 PolarHBondContact O-N 3.13Å; D84-N86 HydrophobicContact CB-CB 4.39Å; D84-N86 PolarHBondContact O-N 3.44Å; D84-N86 VanDerWaalsContact O-N 3.13Å; D84-N87 HydrophobicContact CB-CB 4.16Å; D84-N87 WeakPolarHBondContact O-CA 3.11Å; D84-N87 VanDerWaalsContact O-CB 3.3Å; D84-N87 WeakPolarHBondContact O-CB 3.38Å; D84-N87 PolarHBondContact O-N 3.01Å; D84-I88 PolarHBondContact O-N 3.49Å
85	S	48.7	Very low	51	Low	82 Å²	82	105.8 Å²	105.8	57%	0.573	54%	0.538	S	S	*	.	H	α-helix	trans	-53.4	-33.7	170.1	-175	0	0	0	0	111.7	R83 N87 I88 K89	R83-S85 PolarHBondContact O-N 3.47Å; S85-N87 PolarHBondContact O-N 3.19Å; S85-I88 PolarHBondContact O-N 2.84Å; S85-K89 WeakPolarHBondContact O-CG 3.48Å; S85-K89 PolarHBondContact O-N 3.24Å
86	N	48.5	Very low	52.8	Low	98 Å²	98	102.9 Å²	102.9	52%	0.524	52%	0.519	S	S	.	.	H	α-helix	trans	-63.8	-37.7	174.8	-60	-30.8	0	0	0	112.5	D84 K89 N90	D84-N86 HydrophobicContact CB-CB 4.39Å; D84-N86 PolarHBondContact O-N 3.44Å; D84-N86 VanDerWaalsContact O-N 3.13Å; N86-K89 PolarHBondContact O-N 2.89Å; N86-N90 PolarHBondContact O-N 3.43Å; N86-N90 PolarHBondContact O-OD1 3.27Å
87	N	56.8	Low	54.6	Low	68 Å²	68	98.1 Å²	98.1	36%	0.364	50%	0.503	S	S	.	.	H	α-helix	trans	-67.7	-39.2	176.7	-162	-7.2	0	0	0	110.8	D84 S85 N90 D91	D84-N87 HydrophobicContact CB-CB 4.16Å; D84-N87 WeakPolarHBondContact O-CA 3.11Å; D84-N87 VanDerWaalsContact O-CB 3.3Å; D84-N87 WeakPolarHBondContact O-CB 3.38Å; D84-N87 PolarHBondContact O-N 3.01Å; S85-N87 PolarHBondContact O-N 3.19Å; N87-N90 PolarHBondContact O-N 2.95Å; N87-D91 WeakPolarHBondContact O-CB 3.38Å; N87-D91 PolarHBondContact O-N 2.63Å
88	I	58.2	Low	56.2	Low	51 Å²	51	96.4 Å²	96.4	26%	0.262	49%	0.486	S	S	.	.	H	α-helix	trans	-66.3	-36	174.5	-60.3	173.5	0	0	0	111.8	D84 S85 K92	D84-I88 PolarHBondContact O-N 3.49Å; S85-I88 PolarHBondContact O-N 2.84Å; I88-K92 HydrophobicContact CG2-CD 4.27Å; I88-K92 WeakPolarHBondContact O-CB 3.41Å; I88-K92 WeakPolarHBondContact O-CD 3.49Å; I88-K92 VanDerWaalsContact O-CG 3.28Å; I88-K92 WeakPolarHBondContact O-CG 3.34Å; I88-K92 PolarHBondContact O-N 2.74Å; I88-K92 VanDerWaalsContact O-N 3.14Å
89	K	61.8	Low	58	Low	130 Å²	130	89.3 Å²	89.3	57%	0.565	45%	0.448	S	S	*	.	H	α-helix	trans	-62.7	-46.6	171.6	-72	176.8	-179.7	-179.1	0	111.1	S85 N86 K92 Q93	S85-K89 WeakPolarHBondContact O-CG 3.48Å; S85-K89 PolarHBondContact O-N 3.24Å; N86-K89 PolarHBondContact O-N 2.89Å; K89-K92 WeakPolarHBondContact O-CB 3.47Å; K89-K92 PolarHBondContact O-N 3.2Å; K89-Q93 PolarHBondContact O-N 3.42Å
90	N	71.2	Confident	59.7	Low	96 Å²	96	88.5 Å²	88.5	51%	0.513	44%	0.443	S	S	.	.	H	α-helix	trans	-63.8	-46.1	179.2	-64.7	-5.3	0	0	0	111.9	N86 N87 K92 Q93 V94	N86-N90 PolarHBondContact O-N 3.43Å; N86-N90 PolarHBondContact O-OD1 3.27Å; N87-N90 PolarHBondContact O-N 2.95Å; N90-K92 VanDerWaalsContact C-N 3.26Å; N90-K92 PolarHBondContact O-N 2.99Å; N90-Q93 PolarHBondContact O-N 3.23Å; N90-V94 WeakPolarHBondContact O-CB 3.42Å; N90-V94 WeakPolarHBondContact O-CG2 3.47Å; N90-V94 PolarHBondContact O-N 3.13Å
91	D	67.3	Low	61.7	Low	12 Å²	12	85.5 Å²	85.5	6%	0.064	43%	0.427	C	S	.	.	H	α-helix	trans	-55.2	-41.7	174.3	-101.9	-41.7	0	0	0	111.5	R83 N87 F95 H371 S374	R83-D91 IonicContact CZ-OD2 3.97Å; R83-D91 IonicContact NH2-OD2 2.99Å; R83-D91 PolarHBondContact NH2-OD2 3.44Å; N87-D91 WeakPolarHBondContact O-CB 3.38Å; N87-D91 PolarHBondContact O-N 2.63Å; D91-F95 WeakPolarHBondContact O-CB 3.3Å; D91-F95 PolarHBondContact O-N 3.12Å; D91-H371 IonicContact OD2-CE1 2.71Å; D91-H371 PolarHBondContact OD2-CE1 2.81Å; D91-S374 WeakPolarHBondContact OD1-CB 3.45Å; D91-S374 PolarHBondContact OD1-N 3.21Å; D91-S374 PolarHBondContact OD1-OG 2.87Å
92	K	66.9	Low	63.3	Low	79 Å²	79	77 Å²	77	34%	0.343	40%	0.395	S	S	.	.	H	α-helix	trans	-67.2	-42.4	176.4	-76.4	168.6	175.6	174.2	0	113.1	I88 K89 N90 F95 Q96 A406	I88-K92 HydrophobicContact CG2-CD 4.27Å; I88-K92 WeakPolarHBondContact O-CB 3.41Å; I88-K92 WeakPolarHBondContact O-CD 3.49Å; I88-K92 VanDerWaalsContact O-CG 3.28Å; I88-K92 WeakPolarHBondContact O-CG 3.34Å; I88-K92 PolarHBondContact O-N 2.74Å; I88-K92 VanDerWaalsContact O-N 3.14Å; K89-K92 WeakPolarHBondContact O-CB 3.47Å; K89-K92 PolarHBondContact O-N 3.2Å; N90-K92 VanDerWaalsContact C-N 3.26Å; N90-K92 PolarHBondContact O-N 2.99Å; K92-F95 PolarHBondContact O-N 2.84Å; K92-Q96 WeakPolarHBondContact O-CG 3.47Å; K92-Q96 PolarHBondContact O-N 3.32Å; K92-A406 WeakPolarHBondContact CE-O 3.29Å
93	Q	73.1	Confident	64.9	Low	107 Å²	107	74.1 Å²	74.1	50%	0.5	37%	0.366	S	S	.	.	H	α-helix	trans	-66.7	-50	178.5	179.8	172.3	-11.5	0	0	111.1	K89 N90 F95 Q96 E97	K89-Q93 PolarHBondContact O-N 3.42Å; N90-Q93 PolarHBondContact O-N 3.23Å; Q93-F95 PolarHBondContact O-N 2.92Å; Q93-Q96 PolarHBondContact O-N 3.25Å; Q93-E97 HydrophobicContact CG-CG 4.38Å; Q93-E97 WeakPolarHBondContact CG-OE1 3.47Å; Q93-E97 PolarHBondContact NE2-OE1 3.27Å; Q93-E97 WeakPolarHBondContact O-CG 3.35Å; Q93-E97 PolarHBondContact O-N 3.14Å
94	V	72.8	Confident	66.6	Low	54 Å²	54	74.6 Å²	74.6	33%	0.327	37%	0.373	S	S	.	.	H	α-helix	trans	-58.4	-35.5	176.5	171.5	0	0	0	0	111.4	N90 K98	N90-V94 WeakPolarHBondContact O-CB 3.42Å; N90-V94 WeakPolarHBondContact O-CG2 3.47Å; N90-V94 PolarHBondContact O-N 3.13Å; V94-K98 HydrophobicContact CG1-CD 4.19Å; V94-K98 WeakPolarHBondContact O-CB 3.37Å; V94-K98 VanDerWaalsContact O-CG 3.28Å; V94-K98 WeakPolarHBondContact O-CG 3.46Å; V94-K98 PolarHBondContact O-N 3.03Å; V94-K98 VanDerWaalsContact O-N 3.09Å
95	F	68.1	Low	68	Low	4 Å²	4	73.3 Å²	73.3	2%	0.018	36%	0.364	C	S	.	.	H	α-helix	trans	-66.3	-46.4	172.1	169.1	-122	0	0	0	112.9	D91 K92 Q93 M99 I377 P411	D91-F95 WeakPolarHBondContact O-CB 3.3Å; D91-F95 PolarHBondContact O-N 3.12Å; K92-F95 PolarHBondContact O-N 2.84Å; Q93-F95 PolarHBondContact O-N 2.92Å; F95-M99 HydrophobicContact CD2-CG 3.77Å; F95-M99 HydrophobicContact CE2-CG 3.16Å; F95-M99 HydrophobicContact CE2-SD 3.83Å; F95-M99 HydrophobicContact CZ-CG 3.63Å; F95-M99 HydrophobicContact CZ-SD 4.39Å; F95-M99 WeakPolarHBondContact O-CB 3.3Å; F95-M99 WeakPolarHBondContact O-CG 3.45Å; F95-M99 PolarHBondContact O-N 3.16Å; F95-I377 HydrophobicContact CD2-CD1 3.9Å; F95-P411 HydrophobicContact CE2-CB 3.57Å; F95-P411 VanDerWaalsContact CE2-CD 3.49Å; F95-P411 HydrophobicContact CE2-CG 3.92Å; F95-P411 HydrophobicContact CZ-CB 3.93Å
96	Q	71.7	Confident	68.8	Low	98 Å²	98	70.8 Å²	70.8	46%	0.458	34%	0.343	S	S	.	.	H	α-helix	trans	-63.8	-42	178.5	-74.3	179.6	18.9	0	0	112.1	K92 Q93 M99 K100 V443	K92-Q96 WeakPolarHBondContact O-CG 3.47Å; K92-Q96 PolarHBondContact O-N 3.32Å; Q93-Q96 PolarHBondContact O-N 3.25Å; Q96-M99 PolarHBondContact O-N 3.27Å; Q96-K100 VanDerWaalsContact O-CB 3.29Å; Q96-K100 WeakPolarHBondContact O-CB 3.49Å; Q96-K100 PolarHBondContact O-N 3.33Å; Q96-V443 HydrophobicContact CG-CG1 4.12Å
97	E	77.7	Confident	69.8	Low	90 Å²	90	70.1 Å²	70.1	42%	0.421	34%	0.335	S	S	.	.	H	α-helix	trans	-61.2	-52.9	175.9	-72	169.8	178.8	0	0	110.7	Q93 M99 K100 D101	Q93-E97 HydrophobicContact CG-CG 4.38Å; Q93-E97 WeakPolarHBondContact CG-OE1 3.47Å; Q93-E97 PolarHBondContact NE2-OE1 3.27Å; Q93-E97 WeakPolarHBondContact O-CG 3.35Å; Q93-E97 PolarHBondContact O-N 3.14Å; E97-M99 VanDerWaalsContact C-N 3.32Å; E97-M99 PolarHBondContact O-N 3Å; E97-K100 WeakPolarHBondContact O-CB 3.21Å; E97-K100 PolarHBondContact O-N 2.87Å; E97-K100 VanDerWaalsContact O-N 3.08Å; E97-D101 VanDerWaalsContact O-CG 3.25Å; E97-D101 PolarHBondContact O-N 3.19Å
98	K	73.4	Confident	70.5	Confident	84 Å²	84	71.9 Å²	71.9	37%	0.365	34%	0.343	S	S	.	.	H	α-helix	trans	-57.1	-41.2	175.8	-74.2	176.1	178.6	-179.8	0	113.3	V94 D101 I102 I377	V94-K98 HydrophobicContact CG1-CD 4.19Å; V94-K98 WeakPolarHBondContact O-CB 3.37Å; V94-K98 VanDerWaalsContact O-CG 3.28Å; V94-K98 WeakPolarHBondContact O-CG 3.46Å; V94-K98 PolarHBondContact O-N 3.03Å; V94-K98 VanDerWaalsContact O-N 3.09Å; K98-D101 PolarHBondContact O-N 3.31Å; K98-I102 WeakPolarHBondContact O-CD1 3.5Å; K98-I102 VanDerWaalsContact O-CG1 3.25Å; K98-I102 WeakPolarHBondContact O-CG1 3.25Å; K98-I102 PolarHBondContact O-N 2.97Å; K98-I102 VanDerWaalsContact O-N 3.07Å; K98-I377 HydrophobicContact CD-CD1 4.19Å
99	M	73	Confident	71	Confident	6 Å²	6	73.9 Å²	73.9	3%	0.03	35%	0.35	C	S	.	.	H	α-helix	trans	-68.1	-37.2	176.9	-75.9	-63	-63.8	0	0	112.8	F95 Q96 E97 L103 V433 V435 V443	F95-M99 HydrophobicContact CD2-CG 3.77Å; F95-M99 HydrophobicContact CE2-CG 3.16Å; F95-M99 HydrophobicContact CE2-SD 3.83Å; F95-M99 HydrophobicContact CZ-CG 3.63Å; F95-M99 HydrophobicContact CZ-SD 4.39Å; F95-M99 WeakPolarHBondContact O-CB 3.3Å; F95-M99 WeakPolarHBondContact O-CG 3.45Å; F95-M99 PolarHBondContact O-N 3.16Å; Q96-M99 PolarHBondContact O-N 3.27Å; E97-M99 VanDerWaalsContact C-N 3.32Å; E97-M99 PolarHBondContact O-N 3Å; M99-L103 WeakPolarHBondContact O-CB 3.46Å; M99-L103 VanDerWaalsContact O-CG 3.3Å; M99-L103 WeakPolarHBondContact O-CG 3.2Å; M99-L103 PolarHBondContact O-N 3.41Å; M99-V433 HydrophobicContact SD-CG1 4.45Å; M99-V435 HydrophobicContact CE-CB 4.43Å; M99-V435 HydrophobicContact CE-CG1 4.1Å; M99-V435 HydrophobicContact CE-CG2 4.31Å; M99-V443 HydrophobicContact CB-CG1 4.21Å; M99-V443 HydrophobicContact CB-CG2 3.75Å; M99-V443 HydrophobicContact CE-CG2 3.9Å; M99-V443 HydrophobicContact CG-CG2 4.25Å
100	K	75.7	Confident	71.1	Confident	114 Å²	114	70.6 Å²	70.6	50%	0.496	34%	0.336	S	S	.	.	H	α-helix	trans	-64.3	-43	174.5	179.8	-163.6	168.9	-149.5	0	110.7	Q96 E97 L103 Q104	Q96-K100 VanDerWaalsContact O-CB 3.29Å; Q96-K100 WeakPolarHBondContact O-CB 3.49Å; Q96-K100 PolarHBondContact O-N 3.33Å; E97-K100 WeakPolarHBondContact O-CB 3.21Å; E97-K100 PolarHBondContact O-N 2.87Å; E97-K100 VanDerWaalsContact O-N 3.08Å; K100-L103 PolarHBondContact O-N 3.06Å; K100-Q104 WeakPolarHBondContact O-CB 3.47Å; K100-Q104 PolarHBondContact O-N 3.35Å
101	D	76.7	Confident	70.9	Confident	93 Å²	93	69.9 Å²	69.9	50%	0.497	33%	0.332	S	S	.	.	H	α-helix	trans	-63	-44.3	178.1	-64.9	-19.4	0	0	0	111.3	E97 K98 L103 Q104 E105	E97-D101 VanDerWaalsContact O-CG 3.25Å; E97-D101 PolarHBondContact O-N 3.19Å; K98-D101 PolarHBondContact O-N 3.31Å; D101-L103 PolarHBondContact O-N 2.99Å; D101-Q104 WeakPolarHBondContact O-CB 3.48Å; D101-Q104 PolarHBondContact O-N 3.31Å; D101-E105 WeakPolarHBondContact O-CB 3.47Å; D101-E105 PolarHBondContact O-N 3.33Å
102	I	67.3	Low	70.9	Confident	34 Å²	34	73.2 Å²	73.2	17%	0.174	35%	0.349	C	S	.	.	H	α-helix	trans	-65.5	-39.7	176.1	-61.1	159.3	0	0	0	111.3	K98 Q104 E105 M106 I466	K98-I102 WeakPolarHBondContact O-CD1 3.5Å; K98-I102 VanDerWaalsContact O-CG1 3.25Å; K98-I102 WeakPolarHBondContact O-CG1 3.25Å; K98-I102 PolarHBondContact O-N 2.97Å; K98-I102 VanDerWaalsContact O-N 3.07Å; I102-Q104 VanDerWaalsContact C-N 3.31Å; I102-Q104 PolarHBondContact O-N 3.24Å; I102-E105 PolarHBondContact O-N 3.24Å; I102-M106 HydrophobicContact CG2-SD 4.2Å; I102-M106 WeakPolarHBondContact O-CB 3.26Å; I102-M106 VanDerWaalsContact O-CG 3.24Å; I102-M106 WeakPolarHBondContact O-CG 3.5Å; I102-M106 PolarHBondContact O-N 3.06Å; I102-I466 HydrophobicContact CB-CD1 4.49Å; I102-I466 HydrophobicContact CD1-CD1 4.16Å; I102-I466 HydrophobicContact CG2-CD1 3.61Å; I102-I466 HydrophobicContact CG2-CG1 4.03Å
103	L	70.2	Confident	70.8	Confident	40 Å²	40	76.1 Å²	76.1	21%	0.209	36%	0.357	C	S	.	.	H	α-helix	trans	-63.1	-36.5	173.1	-78.7	167.5	0	0	0	112.4	M99 K100 D101 M106 K107 V435 L441 V443	M99-L103 WeakPolarHBondContact O-CB 3.46Å; M99-L103 VanDerWaalsContact O-CG 3.3Å; M99-L103 WeakPolarHBondContact O-CG 3.2Å; M99-L103 PolarHBondContact O-N 3.41Å; K100-L103 PolarHBondContact O-N 3.06Å; D101-L103 PolarHBondContact O-N 2.99Å; L103-M106 HydrophobicContact CD2-CE 4.24Å; L103-M106 HydrophobicContact CD2-SD 4.37Å; L103-K107 WeakPolarHBondContact O-CB 3.47Å; L103-K107 PolarHBondContact O-N 3.36Å; L103-V435 HydrophobicContact CD2-CG1 3.54Å; L103-V435 HydrophobicContact CG-CG1 4.13Å; L103-L441 HydrophobicContact CD1-CD1 3.86Å; L103-L441 HydrophobicContact CD1-CD2 4.02Å; L103-L441 HydrophobicContact CD2-CD2 3.81Å; L103-V443 HydrophobicContact CD1-CG2 4.04Å
104	Q	76.1	Confident	70.5	Confident	120 Å²	120	74.8 Å²	74.8	56%	0.561	35%	0.354	S	S	*	.	H	α-helix	trans	-70.1	-39.7	175.1	-178.8	167	-36.3	0	0	111.6	K100 D101 I102 K107 M108	K100-Q104 WeakPolarHBondContact O-CB 3.47Å; K100-Q104 PolarHBondContact O-N 3.35Å; D101-Q104 WeakPolarHBondContact O-CB 3.48Å; D101-Q104 PolarHBondContact O-N 3.31Å; I102-Q104 VanDerWaalsContact C-N 3.31Å; I102-Q104 PolarHBondContact O-N 3.24Å; Q104-K107 PolarHBondContact O-N 3.19Å; Q104-M108 WeakPolarHBondContact O-CB 3.28Å; Q104-M108 PolarHBondContact O-N 3.2Å
105	E	72.3	Confident	70.2	Confident	79 Å²	79	77.6 Å²	77.6	37%	0.369	36%	0.362	S	S	.	.	H	α-helix	trans	-64.1	-41.7	173.4	-162.3	-161	163.2	0	0	111.8	D101 I102 M108 K109	D101-E105 WeakPolarHBondContact O-CB 3.47Å; D101-E105 PolarHBondContact O-N 3.33Å; I102-E105 PolarHBondContact O-N 3.24Å; E105-M108 HydrophobicContact CG-CE 4.41Å; E105-M108 PolarHBondContact O-N 3.25Å; E105-K109 HydrophobicContact CG-CD 4.32Å; E105-K109 WeakPolarHBondContact O-CB 3.26Å; E105-K109 WeakPolarHBondContact O-CG 3.2Å; E105-K109 PolarHBondContact O-N 3.29Å; E105-K109 WeakPolarHBondContact OE1-CE 3.24Å; E105-K109 IonicContact OE1-NZ 2.82Å; E105-K109 PolarHBondContact OE1-NZ 3.31Å
106	M	66.5	Low	69.8	Low	30 Å²	30	81.8 Å²	81.8	15%	0.148	38%	0.384	C	S	.	.	H	α-helix	trans	-58.5	-50.8	172.7	-75.8	168.8	50.3	0	0	111.4	I102 L103 M108 K109 E110 V435 I464	I102-M106 HydrophobicContact CG2-SD 4.2Å; I102-M106 WeakPolarHBondContact O-CB 3.26Å; I102-M106 VanDerWaalsContact O-CG 3.24Å; I102-M106 WeakPolarHBondContact O-CG 3.5Å; I102-M106 PolarHBondContact O-N 3.06Å; L103-M106 HydrophobicContact CD2-CE 4.24Å; L103-M106 HydrophobicContact CD2-SD 4.37Å; M106-M108 VanDerWaalsContact C-N 3.3Å; M106-M108 PolarHBondContact O-N 3.15Å; M106-K109 PolarHBondContact O-N 3.03Å; M106-E110 PolarHBondContact O-N 2.93Å; M106-V435 HydrophobicContact CE-CG1 4.42Å; M106-V435 HydrophobicContact SD-CG1 4.37Å; M106-I464 HydrophobicContact CE-CG2 3.63Å
107	K	69.9	Low	69	Low	83 Å²	83	80.9 Å²	80.9	36%	0.361	39%	0.385	S	S	.	.	H	α-helix	trans	-58.2	-41.7	176.4	-175.9	-179.9	178.3	-178.1	0	111.5	L103 Q104 E110 I111 V249	L103-K107 WeakPolarHBondContact O-CB 3.47Å; L103-K107 PolarHBondContact O-N 3.36Å; Q104-K107 PolarHBondContact O-N 3.19Å; K107-E110 PolarHBondContact O-N 3.06Å; K107-I111 HydrophobicContact CG-CD1 4.09Å; K107-I111 WeakPolarHBondContact O-CD1 3.43Å; K107-I111 VanDerWaalsContact O-CG1 3.27Å; K107-I111 WeakPolarHBondContact O-CG1 3.39Å; K107-I111 PolarHBondContact O-N 2.75Å; K107-V249 HydrophobicContact CD-CG2 4.09Å; K107-V249 HydrophobicContact CG-CG2 4.32Å; K107-V249 VanDerWaalsContact NZ-CG1 3.35Å
108	M	69.8	Low	67.4	Low	106 Å²	106	80 Å²	80	52%	0.522	39%	0.389	S	S	.	.	H	α-helix	trans	-64.2	-46.1	175.7	-176.5	175.4	68.6	0	0	112.2	Q104 E105 M106 E110 I111 I112	Q104-M108 WeakPolarHBondContact O-CB 3.28Å; Q104-M108 PolarHBondContact O-N 3.2Å; E105-M108 HydrophobicContact CG-CE 4.41Å; E105-M108 PolarHBondContact O-N 3.25Å; M106-M108 VanDerWaalsContact C-N 3.3Å; M106-M108 PolarHBondContact O-N 3.15Å; M108-E110 VanDerWaalsContact C-N 3.29Å; M108-E110 PolarHBondContact O-N 2.92Å; M108-I111 PolarHBondContact O-N 3.29Å; M108-I112 HydrophobicContact CG-CD1 3.92Å; M108-I112 VanDerWaalsContact O-CG1 3.29Å; M108-I112 WeakPolarHBondContact O-CG1 3.34Å; M108-I112 PolarHBondContact O-N 3.4Å
109	K	68.8	Low	66.3	Low	93 Å²	93	79.9 Å²	79.9	40%	0.404	40%	0.395	S	S	.	.	H	α-helix	trans	-63.7	-31.5	177.2	-78.5	170.9	166.5	171.5	0	112.8	E105 M106 R113	E105-K109 HydrophobicContact CG-CD 4.32Å; E105-K109 WeakPolarHBondContact O-CB 3.26Å; E105-K109 WeakPolarHBondContact O-CG 3.2Å; E105-K109 PolarHBondContact O-N 3.29Å; E105-K109 WeakPolarHBondContact OE1-CE 3.24Å; E105-K109 IonicContact OE1-NZ 2.82Å; E105-K109 PolarHBondContact OE1-NZ 3.31Å; M106-K109 PolarHBondContact O-N 3.03Å; K109-R113 PolarHBondContact O-N 2.82Å; K109-R113 VanDerWaalsContact O-N 3.17Å
110	E	64.2	Low	64.9	Low	61 Å²	61	85.2 Å²	85.2	29%	0.285	42%	0.424	S	S	.	.	H	α-helix	trans	-70.4	-48.6	172.8	-166.2	167.3	-172.7	0	0	111.7	M106 K107 M108 I112 R113 D114 T245	M106-E110 PolarHBondContact O-N 2.93Å; K107-E110 PolarHBondContact O-N 3.06Å; M108-E110 VanDerWaalsContact C-N 3.29Å; M108-E110 PolarHBondContact O-N 2.92Å; E110-I112 VanDerWaalsContact C-N 3.28Å; E110-I112 PolarHBondContact O-N 3.33Å; E110-R113 WeakPolarHBondContact O-CB 3.31Å; E110-R113 PolarHBondContact O-N 2.86Å; E110-D114 PolarHBondContact O-N 3.48Å; E110-T245 HydrophobicContact CG-CG2 4.33Å; E110-T245 WeakPolarHBondContact OE1-CG2 3.36Å; E110-T245 PolarHBondContact OE1-OG1 3.3Å; E110-T245 WeakPolarHBondContact OE2-CG2 3.45Å
111	I	67.5	Low	63.3	Low	81 Å²	81	85.9 Å²	85.9	42%	0.415	43%	0.432	S	S	.	.	H	α-helix	trans	-57.6	-38.6	175.1	-68.5	163.6	0	0	0	112.1	K107 M108 K115	K107-I111 HydrophobicContact CG-CD1 4.09Å; K107-I111 WeakPolarHBondContact O-CD1 3.43Å; K107-I111 VanDerWaalsContact O-CG1 3.27Å; K107-I111 WeakPolarHBondContact O-CG1 3.39Å; K107-I111 PolarHBondContact O-N 2.75Å; M108-I111 PolarHBondContact O-N 3.29Å; I111-K115 HydrophobicContact CG2-CD 4.34Å; I111-K115 WeakPolarHBondContact O-CB 3.38Å; I111-K115 VanDerWaalsContact O-CG 3.32Å; I111-K115 WeakPolarHBondContact O-CG 3.28Å; I111-K115 PolarHBondContact O-N 2.99Å; I111-K115 VanDerWaalsContact O-N 3.12Å
112	I	67.4	Low	61.8	Low	82 Å²	82	90.1 Å²	90.1	42%	0.421	45%	0.446	S	S	.	.	H	α-helix	trans	-66.5	-41.3	175.7	-69.2	164.6	0	0	0	111.1	M108 E110 K115 N116	M108-I112 HydrophobicContact CG-CD1 3.92Å; M108-I112 VanDerWaalsContact O-CG1 3.29Å; M108-I112 WeakPolarHBondContact O-CG1 3.34Å; M108-I112 PolarHBondContact O-N 3.4Å; E110-I112 VanDerWaalsContact C-N 3.28Å; E110-I112 PolarHBondContact O-N 3.33Å; I112-K115 PolarHBondContact O-N 2.99Å; I112-N116 PolarHBondContact O-N 3.28Å
113	R	64.6	Low	60.5	Low	139 Å²	139	96.1 Å²	96.1	53%	0.525	47%	0.474	S	S	.	.	H	α-helix	trans	-61.1	-47.7	177.5	-168.8	-174.3	-58.2	110.2	2.1	111.3	K109 E110 K115 N116 V117	K109-R113 PolarHBondContact O-N 2.82Å; K109-R113 VanDerWaalsContact O-N 3.17Å; E110-R113 WeakPolarHBondContact O-CB 3.31Å; E110-R113 PolarHBondContact O-N 2.86Å; R113-K115 PolarHBondContact O-N 2.86Å; R113-N116 PolarHBondContact O-N 3.07Å; R113-V117 WeakPolarHBondContact O-CG2 3.24Å; R113-V117 PolarHBondContact O-N 3.45Å
114	D	66.1	Low	58.7	Low	80 Å²	80	98.9 Å²	98.9	43%	0.428	50%	0.497	S	S	.	.	H	α-helix	trans	-67.6	-36.1	-177.8	-68.3	-9.5	0	0	0	112.2	E110 S118	E110-D114 PolarHBondContact O-N 3.48Å; D114-S118 VanDerWaalsContact O-CB 3.31Å; D114-S118 WeakPolarHBondContact O-CB 3.46Å; D114-S118 PolarHBondContact O-N 3.08Å; D114-S118 PolarHBondContact O-OG 2.84Å
115	K	67	Low	56.7	Low	112 Å²	112	102.6 Å²	102.6	49%	0.487	51%	0.507	S	S	.	.	H	α-helix	trans	-60.8	-46.3	170.1	-77.4	177.3	177.9	-175.4	0	111.7	I111 I112 R113 V117 S118 T119	I111-K115 HydrophobicContact CG2-CD 4.34Å; I111-K115 WeakPolarHBondContact O-CB 3.38Å; I111-K115 VanDerWaalsContact O-CG 3.32Å; I111-K115 WeakPolarHBondContact O-CG 3.28Å; I111-K115 PolarHBondContact O-N 2.99Å; I111-K115 VanDerWaalsContact O-N 3.12Å; I112-K115 PolarHBondContact O-N 2.99Å; R113-K115 PolarHBondContact O-N 2.86Å; K115-V117 PolarHBondContact O-N 2.88Å; K115-S118 CarbonylContact O-C 3.56Å; K115-S118 WeakPolarHBondContact O-CA 3.25Å; K115-S118 WeakPolarHBondContact O-CB 3.4Å; K115-S118 PolarHBondContact O-N 2.97Å; K115-S118 VanDerWaalsContact O-N 3.09Å; K115-T119 PolarHBondContact O-N 3.41Å; K115-T119 PolarHBondContact O-OG1 3.06Å
116	N	59.6	Low	54.9	Low	92 Å²	92	104.6 Å²	104.6	49%	0.492	53%	0.526	S	S	.	.	H	α-helix	trans	-69.2	-29.9	-178.8	-75.4	-11.9	0	0	0	113.6	I112 R113 T119 N120	I112-N116 PolarHBondContact O-N 3.28Å; R113-N116 PolarHBondContact O-N 3.07Å; N116-T119 PolarHBondContact O-OG1 2.88Å; N116-T119 VanDerWaalsContact O-OG1 3.11Å; N116-N120 PolarHBondContact O-N 2.81Å; N116-N120 PolarHBondContact O-ND2 2.88Å
117	V	56	Low	53.5	Low	80 Å²	80	113.5 Å²	113.5	49%	0.485	56%	0.56	S	S	.	*	H	α-helix	trans	-67.5	-43.3	167.3	174.5	0	0	0	0	110.4	R113 K115 T119 N120 L121	R113-V117 WeakPolarHBondContact O-CG2 3.24Å; R113-V117 PolarHBondContact O-N 3.45Å; K115-V117 PolarHBondContact O-N 2.88Å; V117-T119 VanDerWaalsContact C-N 3.34Å; V117-T119 PolarHBondContact O-N 3.43Å; V117-N120 PolarHBondContact O-N 3.18Å; V117-L121 HydrophobicContact CG1-CD1 3.94Å; V117-L121 WeakPolarHBondContact O-CD1 3.4Å; V117-L121 PolarHBondContact O-N 3.02Å
118	S	43.7	Very low	52	Low	70 Å²	70	114 Å²	114	49%	0.49	58%	0.58	S	S	.	*	H	α-helix	trans	-68.3	-25.3	-178	-59.8	0	0	0	0	114.7	D114 K115	D114-S118 VanDerWaalsContact O-CB 3.31Å; D114-S118 WeakPolarHBondContact O-CB 3.46Å; D114-S118 PolarHBondContact O-N 3.08Å; D114-S118 PolarHBondContact O-OG 2.84Å; K115-S118 CarbonylContact O-C 3.56Å; K115-S118 WeakPolarHBondContact O-CA 3.25Å; K115-S118 WeakPolarHBondContact O-CB 3.4Å; K115-S118 PolarHBondContact O-N 2.97Å; K115-S118 VanDerWaalsContact O-N 3.09Å
119	T	50.3	Low	50.1	Low	82 Å²	82	116.6 Å²	116.6	50%	0.503	59%	0.592	S	S	.	*	H	α-helix	trans	-80.4	-42	173.5	50.2	0	0	0	0	111.9	K115 N116 V117 L121 K122	K115-T119 PolarHBondContact O-N 3.41Å; K115-T119 PolarHBondContact O-OG1 3.06Å; N116-T119 PolarHBondContact O-OG1 2.88Å; N116-T119 VanDerWaalsContact O-OG1 3.11Å; V117-T119 VanDerWaalsContact C-N 3.34Å; V117-T119 PolarHBondContact O-N 3.43Å; T119-L121 VanDerWaalsContact C-N 3.33Å; T119-L121 PolarHBondContact O-N 2.97Å; T119-K122 PolarHBondContact O-N 3.27Å; T119-K122 VanDerWaalsContact O-N 3.09Å
120	N	42.3	Very low	48.7	Very low	118 Å²	118	120.2 Å²	120.2	63%	0.631	62%	0.616	S	S	*	*	H	α-helix	trans	-62.9	-35.9	178.6	-84.3	-88.2	0	0	0	112.8	N116 V117 K122	N116-N120 PolarHBondContact O-N 2.81Å; N116-N120 PolarHBondContact O-ND2 2.88Å; V117-N120 PolarHBondContact O-N 3.18Å; N120-K122 PolarHBondContact O-N 3.09Å; N120-K122 VanDerWaalsContact O-N 3.11Å
121	L	42.7	Very low	47.3	Very low	129 Å²	129	124.6 Å²	124.6	68%	0.675	64%	0.641	S	S	*	*	T	Hydrogen-bonded Turn	trans	-68.3	-3.2	175.1	-93.2	90.2	0	0	0	115	V117 T119	V117-L121 HydrophobicContact CG1-CD1 3.94Å; V117-L121 WeakPolarHBondContact O-CD1 3.4Å; V117-L121 PolarHBondContact O-N 3.02Å; T119-L121 VanDerWaalsContact C-N 3.33Å; T119-L121 PolarHBondContact O-N 2.97Å
122	K	44.8	Very low	45.8	Very low	182 Å²	182	131.1 Å²	131.1	79%	0.791	66%	0.661	S	S	*	*	T	Hydrogen-bonded Turn	trans	-102.7	5.4	-178.3	-72.5	-176.4	177.6	178.3	0	115.5	T119 N120	T119-K122 PolarHBondContact O-N 3.27Å; T119-K122 VanDerWaalsContact O-N 3.09Å; N120-K122 PolarHBondContact O-N 3.09Å; N120-K122 VanDerWaalsContact O-N 3.11Å
123	Q	40.8	Very low	44.2	Very low	159 Å²	159	132.8 Å²	132.8	74%	0.743	68%	0.677	S	S	*	*			trans	-106.3	-3.7	177.2	-72.9	-172.1	-16.7	0	0	115.2	Y125	Q123-Y125 PolarHBondContact O-N 3.24Å; Q123-Y125 VanDerWaalsContact O-N 3.1Å
124	S	32.6	Very low	43	Very low	99 Å²	99	133.8 Å²	133.8	69%	0.692	69%	0.692	S	S	*	*			trans	-80.6	88	177.2	58.2	0	0	0	0	112.6
125	Y	34.6	Very low	41.8	Very low	198 Å²	198	136.4 Å²	136.4	78%	0.776	71%	0.711	S	S	*	*			trans	-66.8	133.4	172.2	-77.4	-88.2	0	0	0	112.1	Q123 Y127	Q123-Y125 PolarHBondContact O-N 3.24Å; Q123-Y125 VanDerWaalsContact O-N 3.1Å; Y125-Y127 PolarHBondContact O-N 3.46Å
126	P	34.2	Very low	40.4	Very low	120 Å²	120	136.8 Å²	136.8	78%	0.779	73%	0.725	S	S	*	*			trans	-86.5	112.2	179	32.5	-32.3	0	0	0	111.7
127	Y	36	Very low	39.6	Very low	218 Å²	218	141.3 Å²	141.3	86%	0.855	74%	0.743	S	S	*	*			trans	-124.5	142.4	166.9	-85.3	-76.4	0	0	0	112.6	Y125	Y125-Y127 PolarHBondContact O-N 3.46Å
128	A	38.3	Very low	39	Very low	94 Å²	94	142.6 Å²	142.6	78%	0.777	76%	0.756	S	S	*	*			trans	-80.2	147.9	-154.7	0	0	0	0	0	115.4
129	M	30.6	Very low	39.1	Very low	159 Å²	159	146.9 Å²	146.9	78%	0.783	77%	0.772	S	S	*	*			trans	10.3	117.9	142.1	-69.2	-79.6	-173.1	0	0	117.3
130	N	39.2	Very low	38.6	Very low	169 Å²	169	149.3 Å²	149.3	90%	0.904	78%	0.781	S	S	*	*			trans	-161.8	129.2	131.2	-100.5	-46.2	0	0	0	111.7
131	N	35.3	Very low	38.6	Very low	153 Å²	153	151 Å²	151	82%	0.818	79%	0.786	S	S	*	*			trans	-96.6	119.4	-174	-67.4	-44.5	0	0	0	112.3
132	R	35	Very low	38.3	Very low	219 Å²	219	150.1 Å²	150.1	83%	0.826	79%	0.785	S	S	*	*			trans	-164	120	147.8	-173.4	165.8	-96.1	-107.2	1.3	112.5
133	P	33.7	Very low	38.1	Very low	117 Å²	117	150.5 Å²	150.5	76%	0.76	79%	0.787	S	S	*	*			trans	-96.7	147.9	171.4	36	-31.8	0	0	0	112.6
134	L	39.6	Very low	38	Very low	160 Å²	160	148.4 Å²	148.4	84%	0.838	78%	0.782	S	S	*	*			trans	-145.4	163.3	158.8	-79.1	-176.2	0	0	0	110.1
135	T	42	Very low	38.6	Very low	134 Å²	134	150.7 Å²	150.7	82%	0.822	78%	0.781	S	S	*	*			trans	-89.4	156.1	-158.2	45.7	0	0	0	0	115.9
136	P	38	Very low	38.9	Very low	121 Å²	121	146.7 Å²	146.7	79%	0.786	78%	0.782	S	S	*	*			trans	-97.6	148.5	173.8	37.6	-32.6	0	0	0	113.6
137	E	41.8	Very low	39.2	Very low	187 Å²	187	146 Å²	146	87%	0.874	78%	0.779	S	S	*	*			trans	-153.1	154.5	164.2	-103.1	-170.4	167.1	0	0	111.9
138	S	43.1	Very low	39.5	Very low	107 Å²	107	142.1 Å²	142.1	75%	0.748	77%	0.773	S	S	*	*			trans	65.4	130.7	180	65.3	0	0	0	0	117.2
139	I	45.5	Very low	39.8	Very low	160 Å²	160	144.7 Å²	144.7	82%	0.821	77%	0.773	S	S	*	*			cis	77	125.1	29	-55.4	164.7	0	0	0	111.7
140	D	41.3	Very low	40.3	Very low	132 Å²	132	142.1 Å²	142.1	71%	0.706	77%	0.771	S	S	*	*			cis	-172	-172.1	-9.9	-179.5	21.4	0	0	0	107.7
141	Q	40.9	Very low	40.3	Very low	155 Å²	155	143.6 Å²	143.6	72%	0.724	77%	0.765	S	S	*	*			trans	92.7	84.4	156.1	-59.6	173.4	19.7	0	0	121.3
142	T	37	Very low	40.4	Very low	109 Å²	109	142 Å²	142	67%	0.669	76%	0.755	S	S	*	*				56.1	149.7	115	60.2	0	0	0	0	124.9
143	F	39.5	Very low	40.7	Very low	190 Å²	190	140.7 Å²	140.7	83%	0.833	76%	0.756	S	S	*	*			trans	73	144	168.3	-66.7	-86.8	0	0	0	116.9
144	D	39.7	Very low	41	Very low	116 Å²	116	141.4 Å²	141.4	62%	0.62	75%	0.753	S	S	*	*			cis	-169.5	177.8	-21.2	-160.9	-16.5	0	0	0	108.7
145	H	44.5	Very low	41.1	Very low	147 Å²	147	143 Å²	143	68%	0.681	76%	0.756	S	S	*	*			trans	87.5	91.7	155.9	-55.8	-18.3	0	0	0	120.8
146	S	41.7	Very low	41.1	Very low	113 Å²	113	144.9 Å²	144.9	79%	0.79	76%	0.756	S	S	*	*				74.5	151.8	117.5	69.5	0	0	0	0	123.8
147	C	40.2	Very low	41.1	Very low	106 Å²	106	145.1 Å²	145.1	72%	0.716	76%	0.755	S	S	*	*			trans	88.2	109.8	161.4	-82.8	0	0	0	0	121
148	D	42.1	Very low	40.7	Very low	137 Å²	137	142.3 Å²	142.3	73%	0.733	74%	0.744	S	S	*	*				87.8	109.5	125	-54.4	-2.6	0	0	0	122
149	D	44.9	Very low	40.4	Very low	148 Å²	148	145.5 Å²	145.5	79%	0.791	75%	0.747	S	S	*	*				67.5	100.2	127.7	-72.4	3.4	0	0	0	123.1
150	S	41.7	Very low	40	Very low	104 Å²	104	145.1 Å²	145.1	73%	0.727	74%	0.742	S	S	*	*				113	162.4	106.3	78.2	0	0	0	0	119.9
151	Y	38.2	Very low	39.7	Very low	201 Å²	201	146.1 Å²	146.1	79%	0.788	74%	0.743	S	S	*	*			trans	73.1	75.3	170.6	-92.1	-83.7	0	0	0	120.5
152	I	38.7	Very low	39.5	Very low	119 Å²	119	143.8 Å²	143.8	61%	0.61	73%	0.734	S	S	*	*				38.1	122.2	111.4	-56.5	168.1	0	0	0	117.4
153	K	40.6	Very low	39.2	Very low	191 Å²	191	145.2 Å²	145.2	83%	0.83	73%	0.733	S	S	*	*			trans	-160.1	93.9	132.1	-113.3	173.3	-175	-174	0	113
154	D	39.9	Very low	39	Very low	132 Å²	132	142.1 Å²	142.1	71%	0.706	73%	0.73	S	S	*	*			trans	26.8	103.8	133.6	-37.1	-43.7	0	0	0	117.4	E156	D154-E156 PolarHBondContact O-N 2.8Å
155	E	42	Very low	38.7	Very low	194 Å²	194	147 Å²	147	91%	0.907	74%	0.739	S	S	*	*			trans	-79.8	106.2	156.1	-75.1	-169.6	143.1	0	0	108.8	V157	E155-V157 PolarHBondContact O-N 3.01Å
156	E	41.9	Very low	38.2	Very low	173 Å²	173	147.6 Å²	147.6	81%	0.808	74%	0.743	S	S	*	*			trans	-71.9	110.6	179.2	-173.2	168.3	-149.8	0	0	110.2	D154 I158	D154-E156 PolarHBondContact O-N 2.8Å; E156-I158 PolarHBondContact O-N 2.89Å
157	V	37.7	Very low	37.8	Very low	126 Å²	126	148.2 Å²	148.2	76%	0.764	74%	0.741	S	S	*	*			trans	-73.1	99.1	175.2	179.6	0	0	0	0	108.8	E155 E159	E155-V157 PolarHBondContact O-N 3.01Å; V157-E159 HydrophobicContact CG1-CG 4.3Å; V157-E159 PolarHBondContact O-N 3.35Å
158	I	33.5	Very low	37.5	Very low	128 Å²	128	147.8 Å²	147.8	66%	0.656	73%	0.731	S	S	*	*			trans	-74.9	92.9	177.2	-56.1	177.6	0	0	0	109.3	E156 E160	E156-I158 PolarHBondContact O-N 2.89Å; I158-E160 VanDerWaalsContact C-N 3.29Å; I158-E160 HydrophobicContact CG2-CB 4.49Å; I158-E160 HydrophobicContact CG2-CG 4.02Å; I158-E160 PolarHBondContact O-N 3.24Å
159	E	36.6	Very low	37.1	Very low	174 Å²	174	148.3 Å²	148.3	81%	0.813	73%	0.733	S	S	*	*			trans	-73.7	80.9	165.3	-66	-170.1	158.6	0	0	109.8	V157 E161	V157-E159 HydrophobicContact CG1-CG 4.3Å; V157-E159 PolarHBondContact O-N 3.35Å; E159-E161 PolarHBondContact O-N 2.97Å
160	E	37.2	Very low	36.4	Very low	153 Å²	153	150 Å²	150	72%	0.715	73%	0.734	S	S	*	*			trans	-69.4	95.1	172.3	-106.9	-175.4	-159.2	0	0	110.6	I158 I162	I158-E160 VanDerWaalsContact C-N 3.29Å; I158-E160 HydrophobicContact CG2-CB 4.49Å; I158-E160 HydrophobicContact CG2-CG 4.02Å; I158-E160 PolarHBondContact O-N 3.24Å; E160-I162 VanDerWaalsContact C-N 3.32Å; E160-I162 PolarHBondContact O-N 3.42Å
161	E	36.1	Very low	36	Very low	152 Å²	152	153.4 Å²	153.4	71%	0.71	74%	0.738	S	S	*	*			trans	-68.4	83.6	172.4	-168.2	-161.6	133.1	0	0	110.7	E159 Q163	E159-E161 PolarHBondContact O-N 2.97Å; E161-Q163 VanDerWaalsContact C-N 3.33Å; E161-Q163 HydrophobicContact CG-CG 4.38Å; E161-Q163 PolarHBondContact O-N 3.2Å; E161-Q163 VanDerWaalsContact OE1-CG 3.24Å; E161-Q163 WeakPolarHBondContact OE1-CG 3.33Å; E161-Q163 PolarHBondContact OE1-NE2 3.03Å
162	I	34.9	Very low	35.9	Very low	107 Å²	107	150.7 Å²	150.7	55%	0.549	74%	0.737	S	S	.	*			trans	-72.6	87.3	178.3	-53.4	-178.2	0	0	0	110.1	E160 V164	E160-I162 VanDerWaalsContact C-N 3.32Å; E160-I162 PolarHBondContact O-N 3.42Å; I162-V164 VanDerWaalsContact C-N 3.32Å; I162-V164 HydrophobicContact CG2-CG2 3.97Å; I162-V164 PolarHBondContact O-N 3.05Å
163	Q	32.5	Very low	35.5	Very low	139 Å²	139	154.4 Å²	154.4	65%	0.65	75%	0.749	S	S	*	*			trans	-65.9	85.7	169.7	-67.1	-173.5	3.9	0	0	111.2	E161 R165	E161-Q163 VanDerWaalsContact C-N 3.33Å; E161-Q163 HydrophobicContact CG-CG 4.38Å; E161-Q163 PolarHBondContact O-N 3.2Å; E161-Q163 VanDerWaalsContact OE1-CG 3.24Å; E161-Q163 WeakPolarHBondContact OE1-CG 3.33Å; E161-Q163 PolarHBondContact OE1-NE2 3.03Å; Q163-R165 PolarHBondContact O-N 2.9Å
164	V	34	Very low	35	Very low	125 Å²	125	151.5 Å²	151.5	76%	0.758	74%	0.741	S	S	*	*			trans	-69.7	98.1	170.5	-177.3	0	0	0	0	108.7	I162 E166	I162-V164 VanDerWaalsContact C-N 3.32Å; I162-V164 HydrophobicContact CG2-CG2 3.97Å; I162-V164 PolarHBondContact O-N 3.05Å; V164-E166 PolarHBondContact O-N 3.12Å
165	R	33.6	Very low	34.4	Very low	217 Å²	217	151 Å²	151	82%	0.819	74%	0.743	S	S	*	*			trans	-63.8	118	172.5	-75	-173.5	173.6	-163.8	-2.6	110.2	Q163 V167	Q163-R165 PolarHBondContact O-N 2.9Å; R165-V167 PolarHBondContact O-N 2.87Å
166	E	35.1	Very low	33.7	Very low	161 Å²	161	149.3 Å²	149.3	75%	0.752	74%	0.737	S	S	*	*			trans	-65.7	110.2	170.7	-163	177	-154	0	0	109.3	V164 I168	V164-E166 PolarHBondContact O-N 3.12Å; E166-I168 HydrophobicContact CB-CG1 4.37Å; E166-I168 HydrophobicContact CG-CD1 4.38Å; E166-I168 HydrophobicContact CG-CG1 3.79Å; E166-I168 PolarHBondContact O-N 3.03Å
167	V	33	Very low	33.1	Very low	126 Å²	126	151.3 Å²	151.3	76%	0.764	74%	0.737	S	S	*	*			trans	-78.6	80.9	173.4	-176.3	0	0	0	0	107.8	R165 D169	R165-V167 PolarHBondContact O-N 2.87Å; V167-D169 PolarHBondContact O-N 2.91Å
168	I	34	Very low	32.7	Very low	97 Å²	97	151.7 Å²	151.7	50%	0.497	74%	0.739	S	S	.	*			trans	-78.9	113	166.6	-54.8	178.6	0	0	0	107.2	E166 K170	E166-I168 HydrophobicContact CB-CG1 4.37Å; E166-I168 HydrophobicContact CG-CD1 4.38Å; E166-I168 HydrophobicContact CG-CG1 3.79Å; E166-I168 PolarHBondContact O-N 3.03Å; I168-K170 HydrophobicContact CG2-CG 4.36Å; I168-K170 PolarHBondContact O-N 3.02Å; I168-K170 VanDerWaalsContact O-N 3.15Å
169	D	33.8	Very low	32.7	Very low	147 Å²	147	152.3 Å²	152.3	79%	0.786	74%	0.744	S	S	*	*			trans	-63.4	113.2	174.1	-67	-43.4	0	0	0	110.3	V167	V167-D169 PolarHBondContact O-N 2.91Å
170	K	30	Very low	32.5	Very low	183 Å²	183	149 Å²	149	80%	0.796	73%	0.732	S	S	*	*			trans	-105	38.1	-172.4	-80	-179.6	179.6	178.5	0	113.4	I168	I168-K170 HydrophobicContact CG2-CG 4.36Å; I168-K170 PolarHBondContact O-N 3.02Å; I168-K170 VanDerWaalsContact O-N 3.15Å
171	E	33.5	Very low	32.3	Very low	177 Å²	177	151.2 Å²	151.2	83%	0.827	73%	0.734	S	S	*	*			trans	-124.6	84.9	-179.7	-65.4	-160.1	150.2	0	0	113.3
172	N	35.4	Very low	32	Very low	143 Å²	143	153.1 Å²	153.1	77%	0.765	74%	0.743	S	S	*	*			trans	-170	89.2	130.2	-104.9	-46	0	0	0	112.3	I174	N172-I174 WeakPolarHBondContact OD1-CD1 3.14Å
173	K	29.3	Very low	31.9	Very low	198 Å²	198	153.4 Å²	153.4	86%	0.861	75%	0.754	S	S	*	*			trans	-108.4	75.1	164.3	-172.7	-172.8	175.4	179	0	109.3
174	I	30.8	Very low	31.8	Very low	129 Å²	129	152.8 Å²	152.8	66%	0.662	77%	0.765	S	S	*	*			trans	-105.4	98	176.8	-61.9	-177.7	0	0	0	109.3	N172 M176	N172-I174 WeakPolarHBondContact OD1-CD1 3.14Å; I174-M176 HydrophobicContact CG2-CG 3.8Å; I174-M176 PolarHBondContact O-N 2.82Å
175	T	26.6	Very low	31.6	Very low	122 Å²	122	153 Å²	153	75%	0.748	77%	0.766	S	S	*	*			trans	-73.6	106.4	165.5	46.8	0	0	0	0	109.5
176	M	27.2	Very low	31.4	Very low	158 Å²	158	151.2 Å²	151.2	78%	0.778	77%	0.767	S	S	*	*			trans	-121.2	158.4	166.7	-79.2	-66.1	-79	0	0	110.6	I174	I174-M176 HydrophobicContact CG2-CG 3.8Å; I174-M176 PolarHBondContact O-N 2.82Å
177	R	29.9	Very low	31.4	Very low	215 Å²	215	154.8 Å²	154.8	81%	0.811	78%	0.776	S	S	*	*			trans	-84.7	151.5	-159.9	-70.3	174.5	170.2	74.4	1.4	113
178	V	30.2	Very low	31.5	Very low	134 Å²	134	157.9 Å²	157.9	81%	0.812	78%	0.782	S	S	*	*			trans	-65.3	127.3	157.7	179	0	0	0	0	108.3
179	D	33.3	Very low	31.4	Very low	142 Å²	142	162.6 Å²	162.6	76%	0.759	80%	0.799	S	S	*	*			trans	-164.4	106.6	153	-94.1	-39.2	0	0	0	109.3
180	D	31.6	Very low	31.8	Very low	105 Å²	105	164.4 Å²	164.4	56%	0.561	80%	0.803	S	S	*	*			trans	43.6	137.5	140.9	-76.6	2.2	0	0	0	124.9
181	R	33	Very low	32	Very low	198 Å²	198	160.8 Å²	160.8	75%	0.747	80%	0.798	S	S	*	*			trans	83.2	105.5	149.4	-69.5	168.4	-165	82.8	29.3	120
182	E	31.2	Very low	32.2	Very low	193 Å²	193	161 Å²	161	90%	0.902	80%	0.799	S	S	*	*				19.5	113.2	125.9	-58.9	179.1	147.4	0	0	118.2
183	S	32.9	Very low	32.4	Very low	112 Å²	112	159.6 Å²	159.6	78%	0.783	80%	0.798	S	S	*	*			trans	-152.8	117.4	148.7	-163.3	0	0	0	0	111.1	V185	S183-V185 PolarHBondContact O-N 3.21Å
184	S	28.6	Very low	32.5	Very low	126 Å²	126	159 Å²	159	88%	0.881	80%	0.798	S	S	*	*			trans	-70.6	125.2	172.9	-54	0	0	0	0	110.3
185	V	31.3	Very low	32.9	Very low	129 Å²	129	160.1 Å²	160.1	78%	0.782	81%	0.806	S	S	*	*			trans	-117.7	131.4	169.9	-175.9	0	0	0	0	108.9	S183	S183-V185 PolarHBondContact O-N 3.21Å
186	Q	29	Very low	33.3	Very low	180 Å²	180	159.7 Å²	159.7	84%	0.841	80%	0.799	S	S	*	*			trans	-83.1	146.5	-178.4	-64.3	178.1	-25.7	0	0	110.5	E188	Q186-E188 PolarHBondContact O-N 2.76Å
187	Y	34.2	Very low	33.9	Very low	237 Å²	237	159.7 Å²	159.7	93%	0.929	79%	0.794	S	S	*	*			trans	-73.9	105.9	163.1	-88.1	-91.2	0	0	0	108.9
188	E	35.7	Very low	33.9	Very low	191 Å²	191	158.7 Å²	158.7	89%	0.893	80%	0.796	S	S	*	*			trans	-75.6	135.6	170.7	-167	158.6	-160.5	0	0	109.5	Q186	Q186-E188 PolarHBondContact O-N 2.76Å
189	F	33	Very low	34	Very low	196 Å²	196	159.5 Å²	159.5	86%	0.86	80%	0.795	S	S	*	*			trans	-99.7	105.7	-164.7	-158.6	-80.5	0	0	0	110
190	E	40.4	Very low	33.8	Very low	184 Å²	184	159.8 Å²	159.8	86%	0.86	79%	0.791	S	S	*	*	P	Polyproline II helix	trans	-73.2	128.1	-175.9	-152.7	169	-144.9	0	0	111
191	P	33.9	Very low	33.9	Very low	108 Å²	108	160.8 Å²	160.8	70%	0.701	80%	0.801	S	S	*	*	P	Polyproline II helix	trans	-92.4	136.4	-167.4	33.7	-35	0	0	0	114.8
192	E	37.7	Very low	33.6	Very low	181 Å²	181	157.9 Å²	157.9	85%	0.846	80%	0.796	S	S	*	*	P	Polyproline II helix	trans	-59.2	129.7	166	-81.6	-82.8	164.1	0	0	111.8	E194	E192-E194 PolarHBondContact O-N 3.21Å
193	P	41.4	Very low	33.6	Very low	114 Å²	114	154.7 Å²	154.7	74%	0.74	79%	0.79	S	S	*	*			trans	-88.3	94.3	179.4	33.6	-33.3	0	0	0	112.6	N195	P193-N195 PolarHBondContact O-N 3.06Å
194	E	31.6	Very low	33.5	Very low	185 Å²	185	157.9 Å²	157.9	86%	0.864	79%	0.793	S	S	*	*			trans	-60.4	131.6	162.4	-68.3	-169.4	155.4	0	0	110.8	E192	E192-E194 PolarHBondContact O-N 3.21Å
195	N	38.6	Very low	33.5	Very low	153 Å²	153	160.2 Å²	160.2	82%	0.818	79%	0.791	S	S	*	*			trans	-159.1	84.3	155	-105.5	-66	0	0	0	113.8	P193	P193-N195 PolarHBondContact O-N 3.06Å
196	D	34.8	Very low	33.7	Very low	113 Å²	113	163.5 Å²	163.5	60%	0.604	80%	0.795	S	S	*	*				66.5	135.9	115.6	-140.4	2.9	0	0	0	122.6
197	K	39.3	Very low	33.7	Very low	158 Å²	158	161.1 Å²	161.1	69%	0.687	79%	0.788	S	S	*	*			trans	68	104.6	158.3	-75.5	142.5	-168.1	158	0	122.7
198	F	29.9	Very low	33.9	Very low	194 Å²	194	156.7 Å²	156.7	85%	0.851	78%	0.781	S	S	*	*				28.1	122.8	110.4	-79.1	-94.9	0	0	0	118.9
199	I	33.5	Very low	33.7	Very low	151 Å²	151	154.6 Å²	154.6	77%	0.774	77%	0.771	S	S	*	*				-160.8	129.1	104.2	-98.2	154.7	0	0	0	109.6	T201	I199-T201 WeakPolarHBondContact CG2-OG1 3.4Å
200	E	28.9	Very low	33.8	Very low	148 Å²	148	154.5 Å²	154.5	69%	0.692	77%	0.771	S	S	*	*			trans	-91.2	132	165.4	-177.4	-173.2	166.7	0	0	108.5	Q202	E200-Q202 HydrophobicContact CG-CG 4.42Å; E200-Q202 WeakPolarHBondContact OE1-CG 3.46Å; E200-Q202 PolarHBondContact OE1-NE2 3.42Å
201	T	33.7	Very low	33.3	Very low	125 Å²	125	152.1 Å²	152.1	77%	0.767	76%	0.76	S	S	*	*			trans	-134.4	114.9	164.6	-40.7	0	0	0	0	109.7	I199	I199-T201 WeakPolarHBondContact CG2-OG1 3.4Å
202	Q	27.1	Very low	33.3	Very low	138 Å²	138	157.6 Å²	157.6	65%	0.645	77%	0.768	S	S	*	*			trans	-84.1	-175	174.5	-59	-177.5	8.7	0	0	111.4	E200	E200-Q202 HydrophobicContact CG-CG 4.42Å; E200-Q202 WeakPolarHBondContact OE1-CG 3.46Å; E200-Q202 PolarHBondContact OE1-NE2 3.42Å
203	T	30.2	Very low	33.3	Very low	126 Å²	126	155.9 Å²	155.9	77%	0.773	76%	0.76	S	S	*	*			trans	69.5	149.2	-177.6	56.8	0	0	0	0	115.5
204	Q	30	Very low	33	Very low	179 Å²	179	153.6 Å²	153.6	84%	0.836	76%	0.756	S	S	*	*			cis	-140.7	145.3	15.5	-147.4	152.8	92.8	0	0	113.1
205	M	28.7	Very low	33.3	Very low	174 Å²	174	150.2 Å²	150.2	86%	0.857	75%	0.751	S	S	*	*			trans	-67.7	147.4	170.9	-66.2	168.2	164.3	0	0	110.9
206	K	35.5	Very low	33	Very low	199 Å²	199	150.2 Å²	150.2	87%	0.865	75%	0.75	S	S	*	*			trans	-146.7	141.6	135.6	-145.7	177.3	-179.4	-168.4	0	111.5
207	N	30	Very low	33	Very low	129 Å²	129	149.5 Å²	149.5	69%	0.69	75%	0.754	S	S	*	*			trans	-87.5	166.2	176.8	-45.4	-38.2	0	0	0	110
208	D	38	Very low	32.9	Very low	145 Å²	145	150.3 Å²	150.3	78%	0.775	76%	0.76	S	S	*	*			trans	-175.8	91.9	135.3	-80.6	-23.4	0	0	0	104.2
209	E	32.5	Very low	33.1	Very low	146 Å²	146	149.1 Å²	149.1	68%	0.682	76%	0.763	S	S	*	*				65	106.4	88.5	-173.9	169.4	-159.7	0	0	113.8
210	F	34.8	Very low	33	Very low	195 Å²	195	147.5 Å²	147.5	86%	0.855	76%	0.76	S	S	*	*				-165.8	145.6	125.3	-109.3	-71.1	0	0	0	111.1
211	Q	30.1	Very low	33.3	Very low	134 Å²	134	147.2 Å²	147.2	63%	0.626	77%	0.768	S	S	*	*			trans	-89.5	161.2	-177.1	-60.7	164.5	-98.6	0	0	112.3
212	Y	34	Very low	33	Very low	222 Å²	222	151.4 Å²	151.4	87%	0.871	77%	0.771	S	S	*	*				-166.3	140.4	109.5	-115.9	-83.6	0	0	0	113.7
213	E	36.5	Very low	33.1	Very low	146 Å²	146	156.2 Å²	156.2	68%	0.682	78%	0.783	S	S	*	*			trans	-41	162	164.2	-43.8	-59.8	134.9	0	0	114.4
214	G	35.8	Very low	33.2	Very low	65 Å²	65	154.9 Å²	154.9	67%	0.67	78%	0.78	S	S	*	*			cis	178.3	-174	17.9	0	0	0	0	0	111.9
215	P	36.9	Very low	33.5	Very low	114 Å²	114	154.7 Å²	154.7	74%	0.74	78%	0.778	S	S	*	*			trans	-136.9	172.8	-134	43.9	-29.9	0	0	0	120.1
216	L	32.3	Very low	33.8	Very low	153 Å²	153	153.6 Å²	153.6	80%	0.801	78%	0.776	S	S	*	*			trans	82.9	158.6	139	-87.8	164.9	0	0	0	124.1
217	S	34.8	Very low	33.9	Very low	99 Å²	99	149.9 Å²	149.9	69%	0.692	78%	0.775	S	S	*	*			trans	64.7	120.4	175.8	58.3	0	0	0	0	116.8
218	E	37.6	Very low	34	Very low	175 Å²	175	151.9 Å²	151.9	82%	0.818	79%	0.786	S	S	*	*			cis	72.1	121.6	48.6	-64.9	-166.9	125.1	0	0	115.2
219	N	34.5	Very low	34.1	Very low	169 Å²	169	150.6 Å²	150.6	90%	0.904	79%	0.788	S	S	*	*				-168.9	143.3	126.1	-98.3	-55.5	0	0	0	110.9
220	V	30.6	Very low	34.1	Very low	117 Å²	117	153.6 Å²	153.6	71%	0.709	80%	0.802	S	S	*	*			trans	-99.4	147.9	-178.1	173.5	0	0	0	0	110.5	Y222	V220-Y222 HydrophobicContact CG1-CD2 4.17Å; V220-Y222 HydrophobicContact CG1-CE2 4.34Å
221	T	35.9	Very low	34	Very low	142 Å²	142	147.6 Å²	147.6	87%	0.871	80%	0.795	S	S	*	*			trans	-146.9	129.8	162.2	-69.7	0	0	0	0	110.8
222	Y	27.4	Very low	33.9	Very low	212 Å²	212	152.7 Å²	152.7	83%	0.831	81%	0.809	S	S	*	*			trans	-98.1	133.3	169.8	-85.4	-104	0	0	0	110	V220	V220-Y222 HydrophobicContact CG1-CD2 4.17Å; V220-Y222 HydrophobicContact CG1-CE2 4.34Å
223	R	29.9	Very low	33.9	Very low	239 Å²	239	149.4 Å²	149.4	90%	0.902	81%	0.806	S	S	*	*			trans	-168.5	148.7	133.5	-114	179.2	-177.6	-135.7	-1.7	112.3
224	S	30.9	Very low	33.8	Very low	99 Å²	99	148.9 Å²	148.9	69%	0.692	81%	0.806	S	S	*	*			trans	-78	152.9	168.8	-44.8	0	0	0	0	110.9
225	E	37	Very low	33.6	Very low	174 Å²	174	156.5 Å²	156.5	81%	0.813	82%	0.816	S	S	*	*				-178.8	161.1	109	-96.1	161.1	-135.7	0	0	111.4
226	D	34.4	Very low	33.5	Very low	151 Å²	151	158 Å²	158	81%	0.807	82%	0.818	S	S	*	*			trans	-65.7	150.6	-155.4	-45.4	-46.4	0	0	0	117.3
227	S	37.9	Very low	33.6	Very low	121 Å²	121	159.9 Å²	159.9	85%	0.846	82%	0.823	S	S	*	*			trans	-171.6	140	145.1	-81.5	0	0	0	0	112.6
228	D	33.3	Very low	33.6	Very low	171 Å²	171	161.6 Å²	161.6	91%	0.914	83%	0.829	S	S	*	*			trans	-68.1	138.6	-178.7	-70.6	-70.7	0	0	0	114.7
229	S	39	Very low	33.5	Very low	118 Å²	118	158.7 Å²	158.7	83%	0.825	83%	0.825	S	S	*	*			trans	-157.7	141.3	150.4	53.5	0	0	0	0	111.2	G231	S229-G231 PolarHBondContact O-N 3.05Å
230	Q	31.6	Very low	33.5	Very low	209 Å²	209	154.4 Å²	154.4	98%	0.977	81%	0.813	S	S	*	*			trans	-75.5	112.2	-177.6	-72.2	-169	-10.8	0	0	112
231	G	33.4	Very low	33.7	Very low	69 Å²	69	155.2 Å²	155.2	71%	0.711	81%	0.811	S	S	*	*			trans	-114.5	96.6	175.7	0	0	0	0	0	113	S229 L233	S229-G231 PolarHBondContact O-N 3.05Å; G231-L233 PolarHBondContact O-N 3.02Å
232	R	27.9	Very low	33.9	Very low	242 Å²	242	154.1 Å²	154.1	91%	0.913	80%	0.8	S	S	*	*			trans	-75.7	98.9	-178.6	179.4	-176.3	179.1	-118.1	6.2	112.1
233	L	33.8	Very low	34.7	Very low	153 Å²	153	147.6 Å²	147.6	80%	0.801	79%	0.785	S	S	*	*			trans	-129	99	168.7	-64.3	173.6	0	0	0	108.2	G231	G231-L233 PolarHBondContact O-N 3.02Å
234	I	34.3	Very low	35.2	Very low	135 Å²	135	142.5 Å²	142.5	69%	0.692	77%	0.77	S	S	*	*				63.6	105.9	96.5	-63.6	173.8	0	0	0	111.6
235	Y	31.9	Very low	35.6	Very low	224 Å²	224	139.6 Å²	139.6	88%	0.878	75%	0.747	S	S	*	*	P	Polyproline II helix	trans	-69.6	136.3	168.3	-79	-101.7	0	0	0	109.9
236	N	35.5	Very low	35.7	Very low	147 Å²	147	135.6 Å²	135.6	79%	0.786	73%	0.732	S	S	*	*	P	Polyproline II helix	trans	-86.9	143.9	159	-69.9	-23.8	0	0	0	109
237	E	34.6	Very low	36.2	Very low	192 Å²	192	133.5 Å²	133.5	90%	0.897	72%	0.72	S	S	*	*	P	Polyproline II helix	trans	-71.5	144	-170.4	-62.1	172.6	129.4	0	0	112.8
238	V	33.3	Very low	36.5	Very low	135 Å²	135	130.8 Å²	130.8	82%	0.818	70%	0.696	S	S	*	*	P	Polyproline II helix	trans	-86.2	125	173.7	179.8	0	0	0	0	108.9	A240	V238-A240 PolarHBondContact O-N 2.99Å
239	P	36.4	Very low	37	Very low	113 Å²	113	124.2 Å²	124.2	73%	0.734	66%	0.662	S	S	*	*	P	Polyproline II helix	trans	-60.7	129.4	176.9	-24.5	34.8	0	0	0	112.2
240	A	35.1	Very low	37.2	Very low	80 Å²	80	123.2 Å²	123.2	66%	0.661	65%	0.647	S	S	*	*	P	Polyproline II helix	trans	-65.4	133.1	-179.7	0	0	0	0	0	111.8	V238 N242	V238-A240 PolarHBondContact O-N 2.99Å; A240-N242 PolarHBondContact O-N 2.73Å
241	M	33.6	Very low	37.8	Very low	133 Å²	133	118.2 Å²	118.2	66%	0.655	62%	0.623	S	S	*	*			trans	-82.1	12.2	-173.1	-71.6	177	53.7	0	0	115.2	S243 K244	M241-S243 PolarHBondContact O-N 2.89Å; M241-K244 PolarHBondContact O-N 2.87Å
242	N	41.2	Very low	38.4	Very low	120 Å²	120	117.2 Å²	117.2	64%	0.642	60%	0.603	S	S	*	*	T	Hydrogen-bonded Turn	trans	-66.1	-10.3	-163.7	66.4	-4.2	0	0	0	116.6	A240 N246	A240-N242 PolarHBondContact O-N 2.73Å; N242-N246 PolarHBondContact O-ND2 2.58Å; N242-N246 VanDerWaalsContact O-ND2 3.09Å
243	S	43.4	Very low	39	Very low	74 Å²	74	111 Å²	111	52%	0.517	58%	0.584	S	S	.	*	T	Hydrogen-bonded Turn	trans	-80.5	-42	173.3	55.5	0	0	0	0	113.2	M241 T245 N246	M241-S243 PolarHBondContact O-N 2.89Å; S243-T245 PolarHBondContact O-N 3.09Å; S243-N246 PolarHBondContact O-N 2.87Å
244	K	41	Very low	39.5	Very low	133 Å²	133	110.1 Å²	110.1	58%	0.578	58%	0.575	S	S	*	*	H	α-helix	trans	-73.7	-26.6	-163.6	-65.7	-175.2	176.8	-177.1	0	115	M241 N246	M241-K244 PolarHBondContact O-N 2.87Å; K244-N246 VanDerWaalsContact C-N 3.3Å; K244-N246 PolarHBondContact O-N 3.05Å
245	T	39.4	Very low	40.1	Very low	37 Å²	37	107.8 Å²	107.8	23%	0.227	56%	0.562	C	S	.	*	H	α-helix	trans	-64.2	-36.7	176.5	-61.7	0	0	0	0	111.5	E110 S243 D247 I248 V249	E110-T245 HydrophobicContact CG-CG2 4.33Å; E110-T245 WeakPolarHBondContact OE1-CG2 3.36Å; E110-T245 PolarHBondContact OE1-OG1 3.3Å; E110-T245 WeakPolarHBondContact OE2-CG2 3.45Å; S243-T245 PolarHBondContact O-N 3.09Å; T245-D247 PolarHBondContact O-N 3.35Å; T245-I248 PolarHBondContact O-N 2.93Å; T245-V249 WeakPolarHBondContact O-CG2 3.46Å; T245-V249 PolarHBondContact O-N 2.7Å; T245-V249 VanDerWaalsContact O-N 3.13Å
246	N	38.7	Very low	40.6	Very low	91 Å²	91	100.5 Å²	100.5	49%	0.487	54%	0.54	S	S	.	.	H	α-helix	trans	-67.4	-36.4	-177.2	-65.2	-64.5	0	0	0	112.3	N242 S243 K244 I248 V249 N250	N242-N246 PolarHBondContact O-ND2 2.58Å; N242-N246 VanDerWaalsContact O-ND2 3.09Å; S243-N246 PolarHBondContact O-N 2.87Å; K244-N246 VanDerWaalsContact C-N 3.3Å; K244-N246 PolarHBondContact O-N 3.05Å; N246-I248 PolarHBondContact O-N 2.86Å; N246-V249 PolarHBondContact O-N 3.32Å; N246-N250 VanDerWaalsContact O-CG 3.27Å; N246-N250 PolarHBondContact O-N 3.2Å; N246-N250 PolarHBondContact O-ND2 3.07Å
247	D	44.5	Very low	40.7	Very low	106 Å²	106	99.5 Å²	99.5	57%	0.567	53%	0.531	S	S	*	.	H	α-helix	trans	-62.9	-42.4	177.4	-59.8	-33.5	0	0	0	111.6	T245 N250 F251	T245-D247 PolarHBondContact O-N 3.35Å; D247-N250 PolarHBondContact O-N 3.5Å; D247-F251 WeakPolarHBondContact O-CB 3.39Å; D247-F251 PolarHBondContact O-N 2.85Å
248	I	44.7	Very low	41.1	Very low	64 Å²	64	94.8 Å²	94.8	33%	0.328	52%	0.515	S	S	.	.	H	α-helix	trans	-64.5	-42.1	176.8	-60.8	172.3	0	0	0	110.4	T245 N246 V252	T245-I248 PolarHBondContact O-N 2.93Å; N246-I248 PolarHBondContact O-N 2.86Å; I248-V252 WeakPolarHBondContact O-CG2 3.47Å; I248-V252 PolarHBondContact O-N 3.46Å
249	V	43.6	Very low	41.3	Very low	34 Å²	34	95.2 Å²	95.2	21%	0.206	51%	0.512	C	S	.	.	H	α-helix	trans	-60.9	-45.2	176.9	162.7	0	0	0	0	111.8	K107 T245 N246 Q253	K107-V249 HydrophobicContact CD-CG2 4.09Å; K107-V249 HydrophobicContact CG-CG2 4.32Å; K107-V249 VanDerWaalsContact NZ-CG1 3.35Å; T245-V249 WeakPolarHBondContact O-CG2 3.46Å; T245-V249 PolarHBondContact O-N 2.7Å; T245-V249 VanDerWaalsContact O-N 3.13Å; N246-V249 PolarHBondContact O-N 3.32Å; V249-Q253 PolarHBondContact O-N 2.83Å
250	N	43.7	Very low	41.6	Very low	96 Å²	96	98.4 Å²	98.4	51%	0.513	51%	0.514	S	S	.	.	H	α-helix	trans	-68	-44.2	-179.3	-67.9	-22.2	0	0	0	111.8	N246 D247 V252 Q253 E254	N246-N250 VanDerWaalsContact O-CG 3.27Å; N246-N250 PolarHBondContact O-N 3.2Å; N246-N250 PolarHBondContact O-ND2 3.07Å; D247-N250 PolarHBondContact O-N 3.5Å; N250-V252 VanDerWaalsContact C-N 3.33Å; N250-V252 PolarHBondContact O-N 3.11Å; N250-Q253 WeakPolarHBondContact O-CB 3.46Å; N250-Q253 PolarHBondContact O-N 2.92Å; N250-E254 PolarHBondContact O-N 3.29Å; N250-E254 VanDerWaalsContact O-N 3.11Å
251	F	44.5	Very low	41.6	Very low	105 Å²	105	101.8 Å²	101.8	46%	0.461	52%	0.521	S	S	.	.	H	α-helix	trans	-58	-42.7	178.2	179.2	-93.2	0	0	0	112.6	D247 Q253 H255	D247-F251 WeakPolarHBondContact O-CB 3.39Å; D247-F251 PolarHBondContact O-N 2.85Å; F251-Q253 VanDerWaalsContact C-N 3.31Å; F251-Q253 PolarHBondContact O-N 2.89Å; F251-H255 AromaticContact CD2-CE1 3.83Å; F251-H255 AromaticContact CD2-ND1 4Å; F251-H255 AromaticContact CE1-CE1 3.87Å; F251-H255 AromaticContact CE1-ND1 3.83Å; F251-H255 AromaticContact CE2-CE1 3.23Å; F251-H255 WeakPolarHBondContact CE2-CE1 3.33Å; F251-H255 AromaticContact CE2-ND1 3.79Å; F251-H255 AromaticContact CE2-NE2 4Å; F251-H255 AromaticContact CZ-CE1 3.25Å; F251-H255 WeakPolarHBondContact CZ-CE1 3.3Å; F251-H255 AromaticContact CZ-ND1 3.69Å; F251-H255 AromaticContact CZ-NE2 3.64Å; F251-H255 PolarHBondContact O-N 3.06Å; F251-H255 PolarHBondContact O-ND1 3.42Å
252	V	45.1	Very low	41.6	Very low	48 Å²	48	101.8 Å²	101.8	29%	0.291	53%	0.528	S	S	.	.	H	α-helix	trans	-66.2	-34.8	176.3	172.6	0	0	0	0	111.5	I248 N250 H255 V256 L441	I248-V252 WeakPolarHBondContact O-CG2 3.47Å; I248-V252 PolarHBondContact O-N 3.46Å; N250-V252 VanDerWaalsContact C-N 3.33Å; N250-V252 PolarHBondContact O-N 3.11Å; V252-H255 PolarHBondContact O-N 3.14Å; V252-V256 HydrophobicContact CG1-CG2 4.42Å; V252-V256 WeakPolarHBondContact O-CG2 3.35Å; V252-V256 PolarHBondContact O-N 3.41Å; V252-L441 HydrophobicContact CG2-CD1 3.79Å
253	Q	41.6	Very low	41.5	Very low	111 Å²	111	105.5 Å²	105.5	52%	0.519	54%	0.542	S	S	.	.	H	α-helix	trans	-67.5	-46.6	179.3	-163.6	158	-43.1	0	0	111.6	V249 N250 F251 H255 V256 Q257	V249-Q253 PolarHBondContact O-N 2.83Å; N250-Q253 WeakPolarHBondContact O-CB 3.46Å; N250-Q253 PolarHBondContact O-N 2.92Å; F251-Q253 VanDerWaalsContact C-N 3.31Å; F251-Q253 PolarHBondContact O-N 2.89Å; Q253-H255 VanDerWaalsContact C-N 3.31Å; Q253-H255 PolarHBondContact O-N 2.9Å; Q253-V256 PolarHBondContact O-N 2.8Å; Q253-Q257 PolarHBondContact O-N 3.12Å; Q253-Q257 PolarHBondContact O-OE1 2.99Å
254	E	44.5	Very low	41.3	Very low	134 Å²	134	109.5 Å²	109.5	63%	0.626	55%	0.552	S	S	*	*	H	α-helix	trans	-59.7	-38.1	173.8	-69.7	-169.4	133.3	0	0	113.2	N250 Q257 T258	N250-E254 PolarHBondContact O-N 3.29Å; N250-E254 VanDerWaalsContact O-N 3.11Å; E254-Q257 WeakPolarHBondContact O-CB 3.3Å; E254-Q257 PolarHBondContact O-N 2.83Å; E254-T258 PolarHBondContact O-N 2.65Å; E254-T258 PolarHBondContact O-OG1 3.05Å
255	H	46.2	Very low	40.9	Very low	87 Å²	87	109 Å²	109	40%	0.403	56%	0.563	S	S	.	*	H	α-helix	trans	-72.7	-29.8	179.2	-77.4	71.7	0	0	0	113	F251 V252 Q253 T258 L259	F251-H255 AromaticContact CD2-CE1 3.83Å; F251-H255 AromaticContact CD2-ND1 4Å; F251-H255 AromaticContact CE1-CE1 3.87Å; F251-H255 AromaticContact CE1-ND1 3.83Å; F251-H255 AromaticContact CE2-CE1 3.23Å; F251-H255 WeakPolarHBondContact CE2-CE1 3.33Å; F251-H255 AromaticContact CE2-ND1 3.79Å; F251-H255 AromaticContact CE2-NE2 4Å; F251-H255 AromaticContact CZ-CE1 3.25Å; F251-H255 WeakPolarHBondContact CZ-CE1 3.3Å; F251-H255 AromaticContact CZ-ND1 3.69Å; F251-H255 AromaticContact CZ-NE2 3.64Å; F251-H255 PolarHBondContact O-N 3.06Å; F251-H255 PolarHBondContact O-ND1 3.42Å; V252-H255 PolarHBondContact O-N 3.14Å; Q253-H255 VanDerWaalsContact C-N 3.31Å; Q253-H255 PolarHBondContact O-N 2.9Å; H255-T258 WeakPolarHBondContact CA-OG1 3.28Å; H255-T258 PolarHBondContact O-OG1 2.75Å; H255-L259 WeakPolarHBondContact O-CD1 3.49Å; H255-L259 VanDerWaalsContact O-CG 3.32Å; H255-L259 WeakPolarHBondContact O-CG 2.97Å; H255-L259 PolarHBondContact O-N 3.04Å
256	V	42.4	Very low	40.6	Very low	71 Å²	71	115 Å²	115	43%	0.43	59%	0.588	S	S	.	*	H	α-helix	trans	-74.8	-31	170.6	171.7	0	0	0	0	111.6	V252 Q253	V252-V256 HydrophobicContact CG1-CG2 4.42Å; V252-V256 WeakPolarHBondContact O-CG2 3.35Å; V252-V256 PolarHBondContact O-N 3.41Å; Q253-V256 PolarHBondContact O-N 2.8Å
257	Q	37.3	Very low	40.4	Very low	126 Å²	126	114.6 Å²	114.6	59%	0.589	60%	0.598	S	S	*	*	H	α-helix	trans	-65.4	-45.4	173	-122.7	78.8	21.5	0	0	112.1	Q253 E254	Q253-Q257 PolarHBondContact O-N 3.12Å; Q253-Q257 PolarHBondContact O-OE1 2.99Å; E254-Q257 WeakPolarHBondContact O-CB 3.3Å; E254-Q257 PolarHBondContact O-N 2.83Å
258	T	42.5	Very low	39.7	Very low	92 Å²	92	117.7 Å²	117.7	56%	0.564	61%	0.614	S	S	*	*	H	α-helix	trans	-74	-28.3	-175.2	41.9	0	0	0	0	114	E254 H255 K260	E254-T258 PolarHBondContact O-N 2.65Å; E254-T258 PolarHBondContact O-OG1 3.05Å; H255-T258 WeakPolarHBondContact CA-OG1 3.28Å; H255-T258 PolarHBondContact O-OG1 2.75Å; T258-K260 PolarHBondContact O-N 3.33Å
259	L	38.6	Very low	39.3	Very low	145 Å²	145	120.1 Å²	120.1	76%	0.759	63%	0.632	S	S	*	*	T	Hydrogen-bonded Turn	trans	-75.3	-0.1	177	-72.1	172.8	0	0	0	114.8	H255	H255-L259 WeakPolarHBondContact O-CD1 3.49Å; H255-L259 VanDerWaalsContact O-CG 3.32Å; H255-L259 WeakPolarHBondContact O-CG 2.97Å; H255-L259 PolarHBondContact O-N 3.04Å
260	K	41.1	Very low	38.6	Very low	179 Å²	179	127.4 Å²	127.4	78%	0.778	66%	0.664	S	S	*	*	T	Hydrogen-bonded Turn	trans	-93.4	9.6	177	-84	-168.8	169.9	-172.1	0	115.1	T258	T258-K260 PolarHBondContact O-N 3.33Å
261	L	36.6	Very low	38	Very low	151 Å²	151	132.9 Å²	132.9	79%	0.791	68%	0.679	S	S	*	*	S	Bend	trans	-127.8	45.1	-172.1	-73.3	169.1	0	0	0	113.4
262	T	33.5	Very low	37.5	Very low	133 Å²	133	133.4 Å²	133.4	82%	0.816	70%	0.695	S	S	*	*			trans	-152.3	60.1	171.1	-39.5	0	0	0	0	112.5
263	E	39.3	Very low	36.8	Very low	198 Å²	198	140.4 Å²	140.4	93%	0.925	73%	0.725	S	S	*	*			trans	-101.3	128.4	162.7	-71.4	-167.8	136.4	0	0	110
264	E	39.4	Very low	36.4	Very low	158 Å²	158	144.7 Å²	144.7	74%	0.738	75%	0.745	S	S	*	*			trans	-89.5	131.6	-174.9	-175.1	-179.7	-123.7	0	0	110.4	Q266	E264-Q266 PolarHBondContact O-N 3.19Å
265	P	31.4	Very low	35.8	Very low	124 Å²	124	143.2 Å²	143.2	81%	0.805	75%	0.749	S	S	*	*			trans	-78.9	93.3	-172.7	31.2	-35.1	0	0	0	112.2
266	Q	33.5	Very low	35.3	Very low	161 Å²	161	148.9 Å²	148.9	75%	0.752	77%	0.773	S	S	*	*			trans	-77.7	136.9	167.5	-73.6	-67	-37.6	0	0	111.1	E264	E264-Q266 PolarHBondContact O-N 3.19Å
267	A	33.5	Very low	34.8	Very low	84 Å²	84	153.2 Å²	153.2	69%	0.694	79%	0.788	S	S	*	*			trans	-84.5	135.9	-168.3	0	0	0	0	0	113.4	V269	A267-V269 PolarHBondContact O-N 2.85Å
268	N	31.7	Very low	34.5	Very low	170 Å²	170	153.5 Å²	153.5	91%	0.909	80%	0.802	S	S	*	*			trans	-74.6	112.4	165.9	-77.2	-17	0	0	0	109.6
269	V	34.4	Very low	34	Very low	116 Å²	116	157 Å²	157	70%	0.703	81%	0.812	S	S	*	*			trans	-88.6	117.5	168.6	-179	0	0	0	0	108.9	A267 Y271	A267-V269 PolarHBondContact O-N 2.85Å; V269-Y271 HydrophobicContact CG1-CD2 3.75Å; V269-Y271 HydrophobicContact CG1-CE2 3.59Å
270	E	29.2	Very low	33.7	Very low	186 Å²	186	158.4 Å²	158.4	87%	0.869	82%	0.817	S	S	*	*			trans	-85.9	122.1	178.1	-175.6	175.6	-168.8	0	0	110.5
271	Y	31.6	Very low	33.5	Very low	212 Å²	212	154.6 Å²	154.6	83%	0.831	81%	0.811	S	S	*	*			trans	-128.2	140.2	166.8	-87.3	-71	0	0	0	110.7	V269	V269-Y271 HydrophobicContact CG1-CD2 3.75Å; V269-Y271 HydrophobicContact CG1-CE2 3.59Å
272	S	33.7	Very low	33.4	Very low	116 Å²	116	153.3 Å²	153.3	81%	0.811	81%	0.809	S	S	*	*			trans	-89	154	-159.9	44.4	0	0	0	0	114.8
273	E	30.2	Very low	33.5	Very low	194 Å²	194	155.5 Å²	155.5	91%	0.907	81%	0.808	S	S	*	*			trans	-65	137.3	-179.3	-57.3	-176.3	128.3	0	0	112.9
274	Q	34.4	Very low	33	Very low	201 Å²	201	155.6 Å²	155.6	94%	0.939	80%	0.801	S	S	*	*			trans	-142.2	122.4	149.3	-119.1	178	45.4	0	0	112.8
275	S	31.5	Very low	32.9	Very low	103 Å²	103	155.6 Å²	155.6	72%	0.72	81%	0.806	S	S	*	*			trans	-61.1	141.9	-170.5	174.7	0	0	0	0	115.5
276	K	36.3	Very low	32.9	Very low	207 Å²	207	158.4 Å²	158.4	90%	0.9	81%	0.808	S	S	*	*			trans	-154.7	131.6	140.6	-102.3	139.4	-171.7	172	0	112
277	H	31.3	Very low	33.2	Very low	161 Å²	161	155.2 Å²	155.2	75%	0.745	81%	0.809	S	S	*	*			trans	-67.7	147.7	176.6	-88.4	-76.7	0	0	0	113.5
278	C	30.5	Very low	33.4	Very low	132 Å²	132	158.6 Å²	158.6	89%	0.892	81%	0.814	S	S	*	*			trans	-149.1	157.5	131.3	-98.3	0	0	0	0	110.5
279	H	33.1	Very low	33.8	Very low	167 Å²	167	156.3 Å²	156.3	77%	0.773	81%	0.806	S	S	*	*			trans	-97.3	145.6	-171.2	-81	-80.7	0	0	0	113.8
280	M	31.1	Very low	33.9	Very low	173 Å²	173	157 Å²	157	85%	0.852	81%	0.806	S	S	*	*			trans	-84.6	136	156.8	-71.2	-65.5	-72.5	0	0	110.1
281	P	36.5	Very low	34.4	Very low	100 Å²	100	155.7 Å²	155.7	65%	0.649	80%	0.799	S	S	*	*			trans	-90.7	114.1	179.8	32.9	-32	0	0	0	112.8	F283	P281-F283 HydrophobicContact CB-CD2 4.43Å; P281-F283 HydrophobicContact CB-CE2 4.13Å
282	T	34.5	Very low	34.9	Very low	124 Å²	124	150.4 Å²	150.4	76%	0.761	80%	0.8	S	S	*	*			trans	-90.6	120.5	165.2	-56.7	0	0	0	0	109.6	Y284	T282-Y284 HydrophobicContact CG2-CD2 4.3Å
283	F	35.7	Very low	35.1	Very low	178 Å²	178	150.5 Å²	150.5	78%	0.781	79%	0.791	S	S	*	*			trans	-103.2	96.2	173.2	-83	-77.3	0	0	0	111.8	P281	P281-F283 HydrophobicContact CB-CD2 4.43Å; P281-F283 HydrophobicContact CB-CE2 4.13Å
284	Y	30.1	Very low	35.5	Very low	201 Å²	201	150.8 Å²	150.8	79%	0.788	78%	0.784	S	S	*	*			trans	-83.8	148	147.8	-93.2	-99.9	0	0	0	108.9	T282	T282-Y284 HydrophobicContact CG2-CD2 4.3Å
285	N	36.6	Very low	35.8	Very low	157 Å²	157	147.5 Å²	147.5	84%	0.84	78%	0.778	S	S	*	*			trans	-151.4	117	152.8	-96.1	-46.6	0	0	0	108.6
286	E	31.6	Very low	36.3	Very low	183 Å²	183	150.3 Å²	150.3	86%	0.855	78%	0.784	S	S	*	*			trans	-109.5	127.3	-177.7	-179.4	177.3	-142.4	0	0	108.7
287	A	39.9	Very low	36.6	Very low	94 Å²	94	145.1 Å²	145.1	78%	0.777	77%	0.771	S	S	*	*			trans	-147.3	76.5	-171.5	0	0	0	0	0	114
288	I	36.7	Very low	36.8	Very low	155 Å²	155	144.2 Å²	144.2	80%	0.795	77%	0.772	S	S	*	*			trans	51.4	92.7	131	-55.1	177.1	0	0	0	117.5
289	V	40.9	Very low	37.1	Very low	123 Å²	123	142.9 Å²	142.9	75%	0.745	76%	0.764	S	S	*	*				60.9	104.4	116.1	175.6	0	0	0	0	119.8
290	D	37	Very low	37.2	Very low	129 Å²	129	140.4 Å²	140.4	69%	0.69	77%	0.766	S	S	*	*				111.2	145.2	124.7	-106.7	-29	0	0	0	125.9
291	H	40.1	Very low	37.7	Very low	159 Å²	159	140 Å²	140	74%	0.736	77%	0.765	S	S	*	*			trans	62.6	103.3	149.6	-75.7	15.6	0	0	0	122.1
292	A	40.5	Very low	37.4	Very low	102 Å²	102	140.4 Å²	140.4	84%	0.843	77%	0.77	S	S	*	*				61.7	153	129.1	0	0	0	0	0	120.1
293	D	38	Very low	37.7	Very low	117 Å²	117	139.8 Å²	139.8	63%	0.626	77%	0.768	S	S	*	*			cis	-153.9	167.5	12.9	-164.2	4	0	0	0	110.8
294	R	39.3	Very low	37.6	Very low	201 Å²	201	137 Å²	137	76%	0.758	77%	0.766	S	S	*	*			trans	66.4	134	155.7	-81.1	163.4	-140.9	-99	-17.7	123.8
295	T	41.1	Very low	37.8	Very low	132 Å²	132	135.6 Å²	135.6	81%	0.81	77%	0.769	S	S	*	*			trans	74.6	84.4	140.5	51.1	0	0	0	0	122
296	L	40.9	Very low	37.6	Very low	161 Å²	161	133.5 Å²	133.5	84%	0.843	76%	0.762	S	S	*	*				-24.4	166.1	121.2	-72.6	172.7	0	0	0	116.8
297	P	42.7	Very low	37.6	Very low	98 Å²	98	130.5 Å²	130.5	64%	0.636	76%	0.756	S	S	*	*			cis	-142.7	-167.9	-14.5	34.5	-12.2	0	0	0	115.9
298	N	36.8	Very low	37.5	Very low	142 Å²	142	133.7 Å²	133.7	76%	0.759	76%	0.758	S	S	*	*			trans	102.4	143.5	139.7	-81.1	-8	0	0	0	122.5
299	S	36.8	Very low	37.2	Very low	105 Å²	105	135 Å²	135	73%	0.734	76%	0.761	S	S	*	*			trans	58.5	115.8	168.2	36.3	0	0	0	0	116.3
300	S	34.5	Very low	37.1	Very low	114 Å²	114	135.9 Å²	135.9	80%	0.797	77%	0.767	S	S	*	*			cis	61.8	99.7	47.8	-163.4	0	0	0	0	113.7
301	I	40.9	Very low	36.9	Very low	166 Å²	166	135.4 Å²	135.4	85%	0.851	77%	0.773	S	S	*	*			trans	-168.8	120.8	151.9	-97.7	148.4	0	0	0	107.4
302	S	30.8	Very low	36.8	Very low	107 Å²	107	133.4 Å²	133.4	75%	0.748	78%	0.777	S	S	*	*			trans	-85.9	162.1	157.7	-48.3	0	0	0	0	107.6
303	P	40.6	Very low	36.7	Very low	111 Å²	111	137.2 Å²	137.2	72%	0.721	78%	0.778	S	S	*	*			cis	-159	-168.8	37.5	42.8	-18.4	0	0	0	117.9
304	T	34.2	Very low	36.7	Very low	121 Å²	121	139.6 Å²	139.6	74%	0.742	79%	0.791	S	S	*	*			trans	57.3	116.5	135.5	-66.6	0	0	0	0	122.3
305	M	32.9	Very low	36.5	Very low	170 Å²	170	135.2 Å²	135.2	84%	0.837	79%	0.791	S	S	*	*			trans	92	149.4	138.7	-78.6	-76.8	178.9	0	0	124.3
306	T	33.2	Very low	36.4	Very low	114 Å²	114	134 Å²	134	70%	0.699	79%	0.788	S	S	*	*			trans	84.7	102.6	150.5	-57	0	0	0	0	120.5
307	V	32.5	Very low	36.2	Very low	119 Å²	119	133.8 Å²	133.8	72%	0.721	79%	0.787	S	S	*	*				37.6	132.9	124.6	-176.7	0	0	0	0	120
308	I	37	Very low	35.9	Very low	162 Å²	162	134.6 Å²	134.6	83%	0.831	80%	0.795	S	S	*	*			trans	-159.4	140.6	130.6	-101.4	149.5	0	0	0	110.4
309	E	31.2	Very low	35.7	Very low	182 Å²	182	139.2 Å²	139.2	85%	0.85	80%	0.802	S	S	*	*			trans	-89.9	150.5	174.2	-58.6	169.1	106.4	0	0	111.1
310	T	37.9	Very low	35.7	Very low	141 Å²	141	140 Å²	140	87%	0.865	81%	0.808	S	S	*	*			trans	-137.2	121.5	161.3	54.4	0	0	0	0	111.3
311	S	33.1	Very low	36.1	Very low	119 Å²	119	144.6 Å²	144.6	83%	0.832	81%	0.808	S	S	*	*			trans	-109.5	137	-174.2	60.6	0	0	0	0	113.2
312	S	37.9	Very low	35.7	Very low	117 Å²	117	143.2 Å²	143.2	82%	0.818	81%	0.809	S	S	*	*			trans	-160.2	95	153.7	59.4	0	0	0	0	113.8
313	Q	39.4	Very low	36.1	Very low	183 Å²	183	145.1 Å²	145.1	86%	0.855	81%	0.81	S	S	*	*			trans	5.4	130.6	142.3	-57.3	172.9	0.3	0	0	119.1
314	N	37	Very low	35.9	Very low	167 Å²	167	150.4 Å²	150.4	89%	0.893	82%	0.815	S	S	*	*				-155.6	164.7	117.2	-111.7	-37.1	0	0	0	111.5
315	S	35.5	Very low	36.1	Very low	109 Å²	109	150.8 Å²	150.8	76%	0.762	82%	0.82	S	S	*	*			trans	-132.5	139.7	-154.7	61.1	0	0	0	0	116.3
316	S	39.6	Very low	36	Very low	106 Å²	106	148.7 Å²	148.7	74%	0.741	81%	0.811	S	S	*	*			trans	-161.3	121.4	143	56.6	0	0	0	0	113.1
317	N	36.4	Very low	35.9	Very low	156 Å²	156	152.5 Å²	152.5	83%	0.834	81%	0.813	S	S	*	*				30.2	133.9	130	-58.3	-12.4	0	0	0	119.2
318	S	35.3	Very low	35.8	Very low	115 Å²	115	154.3 Å²	154.3	80%	0.804	81%	0.814	S	S	*	*			cis	-149.8	157.4	18.7	-90.7	0	0	0	0	113.7
319	R	34.1	Very low	35.6	Very low	239 Å²	239	152 Å²	152	90%	0.902	81%	0.813	S	S	*	*			trans	-82.8	136.4	166.7	-72.4	168.1	160.7	160.5	-7.8	110.8
320	S	35.3	Very low	35.8	Very low	123 Å²	123	148.3 Å²	148.3	86%	0.86	81%	0.807	S	S	*	*			trans	-116.8	144	154.6	-74.3	0	0	0	0	110.1
321	R	43.4	Very low	35.8	Very low	210 Å²	210	148.1 Å²	148.1	79%	0.792	81%	0.805	S	S	*	*			trans	-101.5	158.5	177.8	-69.4	177.4	175	-132.6	2	109.3	I323	R321-I323 PolarHBondContact O-N 2.85Å
322	P	32.8	Very low	36	Very low	136 Å²	136	148.7 Å²	148.7	88%	0.883	80%	0.804	S	S	*	*			trans	-62.3	126.3	169.6	26.9	-34.4	0	0	0	110.1
323	I	38.8	Very low	35.6	Very low	148 Å²	148	151.7 Å²	151.7	76%	0.759	81%	0.809	S	S	*	*			trans	-120.7	131.6	178.8	-68.3	172.9	0	0	0	108.1	R321	R321-I323 PolarHBondContact O-N 2.85Å
324	R	35.9	Very low	35.5	Very low	222 Å²	222	148.7 Å²	148.7	84%	0.838	81%	0.809	S	S	*	*			trans	-84.3	132.3	170.9	-62.2	179.9	177.8	-157.7	-1.5	109.9
325	P	39	Very low	35.5	Very low	128 Å²	128	146.5 Å²	146.5	83%	0.831	81%	0.806	S	S	*	*			trans	-73.5	143.8	157.9	-15.2	31.4	0	0	0	111
326	I	31.3	Very low	35.7	Very low	127 Å²	127	149.1 Å²	149.1	65%	0.651	81%	0.806	S	S	*	*			trans	-142.5	159	166.7	-47.7	177	0	0	0	105.2
327	Y	30.1	Very low	35.5	Very low	193 Å²	193	149.6 Å²	149.6	76%	0.757	80%	0.801	S	S	*	*			trans	75.1	147.5	-179.4	-61.3	-88	0	0	0	113.1
328	Q	31.6	Very low	35.7	Very low	157 Å²	157	150 Å²	150	73%	0.734	80%	0.798	S	S	*	*			cis	147.2	160.1	-12.9	-106	-168.2	-9.4	0	0	104.9
329	S	32.5	Very low	35.9	Very low	115 Å²	115	148.7 Å²	148.7	80%	0.804	79%	0.788	S	S	*	*			trans	70.8	147.2	172.2	80.5	0	0	0	0	115.6
330	S	35.5	Very low	36.5	Very low	103 Å²	103	143.5 Å²	143.5	72%	0.72	78%	0.783	S	S	*	*			cis	-173.4	144.7	-19.9	47.1	0	0	0	0	110.9
331	V	38.5	Very low	36.7	Very low	137 Å²	137	143 Å²	143	83%	0.83	78%	0.777	S	S	*	*			trans	-141.2	109.4	155.7	-102.2	0	0	0	0	112.7
332	T	35.8	Very low	36.5	Very low	132 Å²	132	141.3 Å²	141.3	81%	0.81	78%	0.778	S	S	*	*			trans	48.8	114.9	145.2	56.1	0	0	0	0	121.4
333	L	30.8	Very low	36.7	Very low	179 Å²	179	141.7 Å²	141.7	94%	0.937	77%	0.772	S	S	*	*			trans	-84.4	134.9	156.2	-63.5	91.7	0	0	0	111.6
334	S	35.7	Very low	36.5	Very low	121 Å²	121	139.1 Å²	139.1	85%	0.846	77%	0.767	S	S	*	*			trans	-159.1	153.7	136.6	69.3	0	0	0	0	108.5
335	S	38.4	Very low	36.9	Very low	120 Å²	120	138.1 Å²	138.1	84%	0.839	77%	0.769	S	S	*	*			cis	-134.7	179.7	8.5	65.1	0	0	0	0	112.8
336	H	39.2	Very low	36.8	Very low	164 Å²	164	137 Å²	137	76%	0.759	76%	0.764	S	S	*	*			trans	-96.7	133.7	-157.1	-157.6	55.9	0	0	0	113.2
337	N	35.9	Very low	37.4	Very low	116 Å²	116	136.9 Å²	136.9	62%	0.62	77%	0.769	S	S	*	*			trans	64.1	162.4	154.6	-62.7	-16.4	0	0	0	117.5
338	Q	40.1	Very low	38	Very low	166 Å²	166	135 Å²	135	78%	0.776	77%	0.769	S	S	*	*			cis	-155.5	156.7	21.8	-152.8	162.3	103	0	0	114
339	S	40.4	Very low	38.5	Very low	86 Å²	86	136 Å²	136	60%	0.601	77%	0.773	S	S	*	*			trans	59.5	108.7	151.1	54.5	0	0	0	0	122.6
340	T	45.9	Very low	39	Very low	131 Å²	131	140 Å²	140	80%	0.804	77%	0.773	S	S	*	*			trans	85.1	149.9	130.1	60.7	0	0	0	0	121.9
341	P	39.8	Very low	39.8	Very low	111 Å²	111	141.1 Å²	141.1	72%	0.721	78%	0.777	S	S	*	*			trans	-131	127.2	-156.6	36.1	-15.7	0	0	0	115.6
342	H	39.2	Very low	40	Very low	176 Å²	176	141 Å²	141	82%	0.815	78%	0.777	S	S	*	*			trans	-164.4	123.4	156.4	32.9	-83.7	0	0	0	115.8
343	N	35.4	Very low	40.2	Very low	143 Å²	143	145 Å²	145	77%	0.765	78%	0.777	S	S	*	*				64	109.7	129.7	-160.9	15.1	0	0	0	120.8
344	S	36.6	Very low	40.7	Very low	94 Å²	94	147.5 Å²	147.5	66%	0.657	77%	0.774	S	S	*	*			trans	57.4	110.4	148.3	-63.8	0	0	0	0	120
345	K	43.2	Very low	41.1	Very low	202 Å²	202	148.2 Å²	148.2	88%	0.878	77%	0.773	S	S	*	*				-166.6	154.4	97.8	-96.6	144.1	-166.9	169	0	113.5
346	S	37.8	Very low	41	Very low	103 Å²	103	152.6 Å²	152.6	72%	0.72	77%	0.773	S	S	*	*			trans	-53.8	133.5	176.4	-179.8	0	0	0	0	113
347	V	42.2	Very low	41.2	Very low	126 Å²	126	149.6 Å²	149.6	76%	0.764	77%	0.77	S	S	*	*			trans	-128	121.5	158.7	179.1	0	0	0	0	107.1	H349	V347-H349 PolarHBondContact O-N 2.78Å
348	M	43.2	Very low	41.7	Very low	152 Å²	152	149.5 Å²	149.5	75%	0.749	78%	0.776	S	S	*	*	P	Polyproline II helix	trans	-67	118.5	-174.8	-65.2	-73.7	-75.3	0	0	110.8
349	H	42.7	Very low	41.7	Very low	178 Å²	178	153.1 Å²	153.1	82%	0.824	78%	0.782	S	S	*	*	P	Polyproline II helix	trans	-80.4	120.1	163.2	-94.3	57.3	0	0	0	109.5	V347	V347-H349 PolarHBondContact O-N 2.78Å
350	Y	41.7	Very low	41.7	Very low	201 Å²	201	157.9 Å²	157.9	79%	0.788	80%	0.795	S	S	*	*	P	Polyproline II helix	trans	-69.3	133.3	164.7	-61	-88.1	0	0	0	108.4	V352	Y350-V352 PolarHBondContact O-N 3.37Å
351	P	52.4	Low	41.3	Very low	125 Å²	125	159.1 Å²	159.1	81%	0.812	79%	0.792	S	S	*	*	P	Polyproline II helix	trans	-64.9	121.3	176.7	26.2	-32.7	0	0	0	109.5
352	V	43.8	Very low	41.2	Very low	136 Å²	136	159 Å²	159	82%	0.824	79%	0.791	S	S	*	*	P	Polyproline II helix	trans	-56.9	142.9	174.7	177.4	0	0	0	0	109.2	Y350 R354	Y350-V352 PolarHBondContact O-N 3.37Å; V352-R354 PolarHBondContact O-N 2.88Å
353	R	39.6	Very low	41.1	Very low	216 Å²	216	155.9 Å²	155.9	82%	0.815	79%	0.785	S	S	*	*	P	Polyproline II helix	trans	-51.5	124.4	178.8	-69	178.9	175.6	-121.8	2.4	109.5	T355	R353-T355 PolarHBondContact O-N 3.28Å
354	R	42.1	Very low	41.1	Very low	231 Å²	231	153.1 Å²	153.1	87%	0.872	78%	0.776	S	S	*	*	P	Polyproline II helix	trans	-60.5	131.1	163.7	-69.9	-173.8	179.9	-132.7	-0	107.4	V352	V352-R354 PolarHBondContact O-N 2.88Å
355	T	44.1	Very low	41.4	Very low	136 Å²	136	154.8 Å²	154.8	83%	0.834	79%	0.785	S	S	*	*	P	Polyproline II helix	trans	-55	138.3	162.9	37.2	0	0	0	0	108.6	R353 S357	R353-T355 PolarHBondContact O-N 3.28Å; T355-S357 PolarHBondContact O-N 3.43Å; T355-S357 VanDerWaalsContact O-N 3.15Å
356	Y	36.8	Very low	41.5	Very low	212 Å²	212	148.8 Å²	148.8	83%	0.831	77%	0.765	S	S	*	*			trans	-71.8	110.2	176.1	-71.6	-93.5	0	0	0	107.7
357	S	41.9	Very low	42.1	Very low	100 Å²	100	154.9 Å²	154.9	70%	0.699	77%	0.772	S	S	*	*			trans	-54.8	139.6	162.2	-172.9	0	0	0	0	108.2	T355 R359	T355-S357 PolarHBondContact O-N 3.43Å; T355-S357 VanDerWaalsContact O-N 3.15Å; S357-R359 PolarHBondContact O-N 2.87Å
358	P	46.6	Very low	42.9	Very low	114 Å²	114	153 Å²	153	74%	0.74	76%	0.762	S	S	*	*			trans	-47.5	130.7	169	-28.3	36	0	0	0	109.9	E360	P358-E360 PolarHBondContact O-N 3.36Å
359	R	39.8	Very low	43.9	Very low	243 Å²	243	147 Å²	147	92%	0.917	74%	0.735	S	S	*	*			trans	-74.1	109.3	179.3	179.7	179.2	-178.8	174.8	-2.6	107.1	S357 E361	S357-R359 PolarHBondContact O-N 2.87Å; R359-E361 PolarHBondContact O-N 2.9Å
360	E	39.9	Very low	45.5	Very low	185 Å²	185	141.6 Å²	141.6	86%	0.864	71%	0.712	S	S	*	*			trans	-55.2	114.8	175.5	-66.6	178.4	168.7	0	0	109.5	P358	P358-E360 PolarHBondContact O-N 3.36Å
361	E	38.9	Very low	47.6	Very low	158 Å²	158	134 Å²	134	74%	0.738	68%	0.683	S	S	*	*			trans	-55.9	140.2	165.8	-99.3	-70.5	109.4	0	0	108.9	R359 T363	R359-E361 PolarHBondContact O-N 2.9Å; E361-T363 VanDerWaalsContact C-N 3.27Å; E361-T363 PolarHBondContact O-N 3.08Å
362	P	37.2	Very low	49.2	Very low	108 Å²	108	128 Å²	128	70%	0.701	65%	0.645	S	S	*	*			trans	-71.4	82.5	-177.4	30.1	-35.1	0	0	0	110.8	S364	P362-S364 PolarHBondContact O-N 2.99Å
363	T	38	Very low	51.2	Low	111 Å²	111	121.5 Å²	121.5	68%	0.681	61%	0.606	S	S	*	*			trans	-52.9	123.7	-175.7	60.3	0	0	0	0	111.2	E361	E361-T363 VanDerWaalsContact C-N 3.27Å; E361-T363 PolarHBondContact O-N 3.08Å
364	S	34.5	Very low	53.3	Low	85 Å²	85	111.9 Å²	111.9	59%	0.594	57%	0.571	S	S	*	*			trans	-50.2	136.4	-174.6	-48.6	0	0	0	0	112.6	P362 T366	P362-S364 PolarHBondContact O-N 2.99Å; S364-T366 PolarHBondContact O-N 3.27Å
365	P	42.4	Very low	55.4	Low	129 Å²	129	104.4 Å²	104.4	84%	0.838	55%	0.546	S	S	*	.	T	Hydrogen-bonded Turn	trans	-67.9	8.4	-173.7	27.9	-36.1	0	0	0	115.2
366	T	46.9	Very low	57.6	Low	75 Å²	75	97.9 Å²	97.9	46%	0.46	51%	0.506	S	S	.	.	T	Hydrogen-bonded Turn	trans	-89.1	-13.1	-174.8	-33.5	0	0	0	0	113.9	S364 T368 A369 E407	S364-T366 PolarHBondContact O-N 3.27Å; T366-T368 PolarHBondContact O-N 3.36Å; T366-A369 WeakPolarHBondContact O-CB 3.24Å; T366-A369 PolarHBondContact O-N 3.17Å; T366-E407 HydrophobicContact CG2-CB 3.87Å; T366-E407 HydrophobicContact CG2-CG 4.07Å
367	R	48.8	Very low	60.1	Low	232 Å²	232	88.9 Å²	88.9	88%	0.875	47%	0.472	S	S	*	.	T	Hydrogen-bonded Turn	trans	-66.7	0.4	-167.6	-160.9	179.9	162.9	-160.6	-5.6	115.5
368	T	58.8	Low	62.3	Low	87 Å²	87	85.5 Å²	85.5	53%	0.534	45%	0.448	S	S	.	.	T	Hydrogen-bonded Turn	trans	-101.8	-7.5	174	53.9	0	0	0	0	114.2	T366 I370	T366-T368 PolarHBondContact O-N 3.36Å; T368-I370 PolarHBondContact O-N 2.86Å
369	A	64.3	Low	64.1	Low	24 Å²	24	88 Å²	88	20%	0.198	45%	0.45	C	S	.	.			trans	-71.7	120.9	178.7	0	0	0	0	0	111	T366 H371 E407 Y408	T366-A369 WeakPolarHBondContact O-CB 3.24Å; T366-A369 PolarHBondContact O-N 3.17Å; A369-H371 PolarHBondContact O-N 2.93Å; A369-H371 VanDerWaalsContact O-N 3.16Å; A369-E407 HydrophobicContact CB-CG 4.16Å; A369-Y408 HydrophobicContact CB-CD1 4.09Å; A369-Y408 HydrophobicContact CB-CE1 3.58Å; A369-Y408 HydrophobicContact CB-CE2 4.2Å
370	I	78	Confident	66.2	Low	65 Å²	65	84.9 Å²	84.9	33%	0.333	45%	0.446	S	S	.	.			trans	-80.7	100	178.6	-68	169.8	0	0	0	108.4	T368 I372 Y403 Y408 A479 H481	T368-I370 PolarHBondContact O-N 2.86Å; I370-I372 PolarHBondContact O-N 3Å; I370-Y403 PolarHBondContact O-OH 3.46Å; I370-Y408 WeakPolarHBondContact O-CD1 3.41Å; I370-A479 HydrophobicContact CG2-CB 4.5Å; I370-H481 WeakPolarHBondContact CD1-CE1 3.2Å
371	H	84.7	Confident	68.4	Low	41 Å²	41	78.5 Å²	78.5	19%	0.19	42%	0.422	C	S	.	.			trans	-67.3	102.1	-179	-178.1	-76.8	0	0	0	111.1	D91 A369	D91-H371 IonicContact OD2-CE1 2.71Å; D91-H371 PolarHBondContact OD2-CE1 2.81Å; A369-H371 PolarHBondContact O-N 2.93Å; A369-H371 VanDerWaalsContact O-N 3.16Å
372	I	86.3	Confident	70.7	Confident	0 Å²	0	72.2 Å²	72.2	0%	0	40%	0.399	C	S	.	.			trans	-70.5	-52.1	176.5	-57.8	-177.5	0	0	0	109.8	I370 Q375 V376 Y403 Y408 F413 V475 I478 A479 I482	I370-I372 PolarHBondContact O-N 3Å; I372-Q375 PolarHBondContact O-NE2 3.32Å; I372-Q375 PolarHBondContact O-OE1 3.43Å; I372-V376 HydrophobicContact CG2-CB 4.11Å; I372-V376 HydrophobicContact CG2-CG1 3.31Å; I372-V376 HydrophobicContact CG2-CG2 3.65Å; I372-Y403 HydrophobicContact CD1-CD1 3.93Å; I372-Y403 HydrophobicContact CD1-CE1 3.57Å; I372-Y403 HydrophobicContact CG1-CE1 4.11Å; I372-Y408 PolarHBondContact N-O 2.71Å; I372-F413 HydrophobicContact CD1-CE1 4.48Å; I372-V475 HydrophobicContact CD1-CG1 4.31Å; I372-I478 HydrophobicContact CG2-CD1 4.16Å; I372-I478 HydrophobicContact CG2-CG2 4.11Å; I372-A479 HydrophobicContact CD1-CB 4.49Å; I372-A479 HydrophobicContact CG1-CB 4.46Å; I372-I482 HydrophobicContact CD1-CD1 3.62Å; I372-I482 HydrophobicContact CG1-CD1 4.41Å
373	G	85	Confident	73.2	Confident	0 Å²	0	71.5 Å²	71.5	0%	0	40%	0.395	C	S	.	.			trans	92.3	174.4	-171.7	0	0	0	0	0	114.1	Q375 Y408 G409	G373-Q375 VanDerWaalsContact C-N 3.27Å; G373-Q375 VanDerWaalsContact CA-OE1 3.3Å; G373-Q375 PolarHBondContact O-N 3.39Å; G373-Q375 PolarHBondContact O-OE1 3.31Å; G373-Y408 PolarHBondContact N-O 3.39Å; G373-Y408 VanDerWaalsContact N-O 3.13Å; G373-G409 CarbonylContact C-O 3.49Å; G373-G409 WeakPolarHBondContact CA-O 3.15Å
374	S	84.9	Confident	75.7	Confident	13 Å²	13	68.2 Å²	68.2	9%	0.091	38%	0.376	C	S	.	.	G	3₁₀ helix	trans	-75.4	-12.9	-168.7	67.3	0	0	0	0	114.1	D91 V376 I377 G409	D91-S374 WeakPolarHBondContact OD1-CB 3.45Å; D91-S374 PolarHBondContact OD1-N 3.21Å; D91-S374 PolarHBondContact OD1-OG 2.87Å; S374-V376 PolarHBondContact O-N 2.91Å; S374-I377 WeakPolarHBondContact O-CB 3.44Å; S374-I377 WeakPolarHBondContact O-CD1 3.48Å; S374-I377 VanDerWaalsContact O-CG1 3.3Å; S374-I377 WeakPolarHBondContact O-CG1 3.24Å; S374-I377 PolarHBondContact O-N 3.21Å; S374-G409 WeakPolarHBondContact CA-O 3.41Å; S374-G409 PolarHBondContact N-O 3.21Å; S374-G409 VanDerWaalsContact N-O 3.12Å
375	Q	85.6	Confident	78.4	Confident	74 Å²	74	66.7 Å²	66.7	35%	0.346	36%	0.359	S	S	.	.	G	3₁₀ helix	trans	-70	-13.9	-173.2	74.5	-77.8	11.3	0	0	114.7	I372 G373 K474 I478	I372-Q375 PolarHBondContact O-NE2 3.32Å; I372-Q375 PolarHBondContact O-OE1 3.43Å; G373-Q375 VanDerWaalsContact C-N 3.27Å; G373-Q375 VanDerWaalsContact CA-OE1 3.3Å; G373-Q375 PolarHBondContact O-N 3.39Å; G373-Q375 PolarHBondContact O-OE1 3.31Å; Q375-K474 WeakPolarHBondContact O-CD 3.4Å; Q375-K474 PolarHBondContact O-NZ 3.4Å; Q375-I478 HydrophobicContact CG-CD1 4.09Å; Q375-I478 VanDerWaalsContact NE2-CD1 3.32Å
376	V	90.1	Very high	80.9	Confident	0 Å²	0	64.1 Å²	64.1	0%	0	34%	0.341	C	S	.	.	G	3₁₀ helix	trans	-83.8	-7.4	175.4	-62	0	0	0	0	114.2	I372 S374 S378 C410 V470 D471 K474 V475 I478	I372-V376 HydrophobicContact CG2-CB 4.11Å; I372-V376 HydrophobicContact CG2-CG1 3.31Å; I372-V376 HydrophobicContact CG2-CG2 3.65Å; S374-V376 PolarHBondContact O-N 2.91Å; V376-S378 PolarHBondContact O-N 3.17Å; V376-C410 HydrophobicContact CG2-CB 3.95Å; V376-V470 HydrophobicContact CB-CG1 4.38Å; V376-V470 HydrophobicContact CG2-CG1 4.44Å; V376-V470 CarbonylContact O-C 3.54Å; V376-V470 WeakPolarHBondContact O-CA 3.41Å; V376-D471 PolarHBondContact O-N 3.46Å; V376-K474 HydrophobicContact CB-CB 4.4Å; V376-K474 HydrophobicContact CG1-CB 3.9Å; V376-V475 HydrophobicContact CB-CG2 3.72Å; V376-V475 HydrophobicContact CG1-CG2 3.78Å; V376-V475 HydrophobicContact CG2-CG2 4.13Å; V376-I478 HydrophobicContact CG1-CD1 3.57Å
377	I	88.7	Confident	83.3	Confident	23 Å²	23	61.1 Å²	61.1	12%	0.118	32%	0.322	C	S	.	.	B	Isolated β-bridge	trans	-63	133	173.2	-60.2	168.2	0	0	0	108.3	F95 K98 S374 P411	F95-I377 HydrophobicContact CD2-CD1 3.9Å; K98-I377 HydrophobicContact CD-CD1 4.19Å; S374-I377 WeakPolarHBondContact O-CB 3.44Å; S374-I377 WeakPolarHBondContact O-CD1 3.48Å; S374-I377 VanDerWaalsContact O-CG1 3.3Å; S374-I377 WeakPolarHBondContact O-CG1 3.24Å; S374-I377 PolarHBondContact O-N 3.21Å; I377-P411 HydrophobicContact CG1-CG 4.13Å
378	S	88.2	Confident	85.5	Confident	28 Å²	28	55.5 Å²	55.5	20%	0.196	30%	0.304	C	S	.	.			trans	-70.7	130.8	179.3	-174.6	0	0	0	0	110.7	V376 Q380 R468 G469	V376-S378 PolarHBondContact O-N 3.17Å; S378-Q380 PolarHBondContact O-N 2.92Å; S378-Q380 PolarHBondContact OG-N 3.28Å; S378-Q380 PolarHBondContact OG-O 3.17Å; S378-R468 WeakPolarHBondContact CB-O 3.28Å; S378-G469 PolarHBondContact N-O 3.48Å
379	E	84.6	Confident	87.3	Confident	167 Å²	167	51.5 Å²	51.5	78%	0.78	28%	0.279	S	S	*	.	S	Bend	trans	-70.8	-21.9	170.2	-68.4	147	-120	0	0	111.8	K474	E379-K474 IonicContact OE1-NZ 2.71Å; E379-K474 PolarHBondContact OE1-NZ 2.98Å
380	Q	84.4	Confident	88.8	Confident	178 Å²	178	54.6 Å²	54.6	83%	0.832	29%	0.286	S	S	*	.	S	Bend	trans	-122.6	75.2	176.6	-63.9	-178.6	24.6	0	0	108.6	S378	S378-Q380 PolarHBondContact O-N 2.92Å; S378-Q380 PolarHBondContact OG-N 3.28Å; S378-Q380 PolarHBondContact OG-O 3.17Å
381	S	85.8	Confident	89.5	Confident	51 Å²	51	53.7 Å²	53.7	36%	0.357	28%	0.278	S	S	.	.			trans	-77.8	150.5	172.4	75.8	0	0	0	0	111.2
382	G	88.5	Confident	89.7	Confident	25 Å²	25	57.2 Å²	57.2	26%	0.258	31%	0.305	S	S	.	.			trans	-83.3	-175.1	174.8	0	0	0	0	0	112.8	R467	G382-R467 VanDerWaalsContact CA-O 3.26Å; G382-R467 WeakPolarHBondContact CA-O 3.24Å; G382-R467 PolarHBondContact N-O 3.47Å
383	P	89.8	Confident	89.7	Confident	93 Å²	93	60 Å²	60	60%	0.604	32%	0.32	S	S	*	.			trans	-63.1	148.6	-177.5	26.9	-35.3	0	0	0	112.9	R467	P383-R467 WeakPolarHBondContact O-CB 3.48Å; P383-R467 PolarHBondContact O-N 3.39Å
384	S	89.3	Confident	89.9	Confident	42 Å²	42	63.7 Å²	63.7	29%	0.294	35%	0.346	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-71.6	136.8	164.2	58.7	0	0	0	0	110.9	L465	S384-L465 CarbonylContact C-O 3.59Å; S384-L465 VanDerWaalsContact CA-O 3.24Å; S384-L465 WeakPolarHBondContact CA-O 3.42Å
385	F	92.4	Very high	90	Very high	54 Å²	54	71.1 Å²	71.1	24%	0.237	38%	0.379	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-150.6	150.5	-178.4	68.8	-63.6	0	0	0	111.9	I387 D432 L465 R467	F385-I387 HydrophobicContact CD2-CD1 4.3Å; F385-I387 HydrophobicContact CD2-CG1 4.05Å; F385-I387 HydrophobicContact CE2-CD1 3.59Å; F385-I387 HydrophobicContact CE2-CG1 3.85Å; F385-I387 HydrophobicContact CZ-CD1 4.18Å; F385-D432 WeakPolarHBondContact CZ-OD2 3.23Å; F385-L465 HydrophobicContact CD1-CB 4.06Å; F385-L465 WeakPolarHBondContact CD1-O 3.44Å; F385-L465 HydrophobicContact CE1-CB 3.54Å; F385-L465 HydrophobicContact CE1-CD1 4.38Å; F385-L465 HydrophobicContact CE2-CD1 4.49Å; F385-L465 HydrophobicContact CZ-CB 3.9Å; F385-L465 HydrophobicContact CZ-CD1 3.88Å; F385-L465 HydrophobicContact CZ-CG 4.47Å; F385-L465 PolarHBondContact N-O 3.23Å; F385-L465 PolarHBondContact O-N 3.33Å; F385-R467 HydrophobicContact CD1-CB 4.29Å; F385-R467 HydrophobicContact CE1-CB 3.93Å
386	T	94.5	Very high	90.1	Very high	74 Å²	74	71.9 Å²	71.9	45%	0.454	38%	0.379	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-104.5	138.3	-177.5	-50.6	0	0	0	0	110.5	F388 L463 I464	T386-F388 HydrophobicContact CG2-CE1 4.17Å; T386-F388 HydrophobicContact CG2-CE2 3.94Å; T386-F388 HydrophobicContact CG2-CZ 3.64Å; T386-L463 CarbonylContact C-O 3.57Å; T386-L463 WeakPolarHBondContact CA-O 3.44Å; T386-I464 HydrophobicContact CG2-CG1 4.14Å
387	I	95.7	Very high	90.1	Very high	12 Å²	12	75.6 Å²	75.6	6%	0.062	40%	0.396	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-125.1	136.1	176.8	-58.4	-179.6	0	0	0	110.2	F385 L389 A426 I428 D462 L463 L465	F385-I387 HydrophobicContact CD2-CD1 4.3Å; F385-I387 HydrophobicContact CD2-CG1 4.05Å; F385-I387 HydrophobicContact CE2-CD1 3.59Å; F385-I387 HydrophobicContact CE2-CG1 3.85Å; F385-I387 HydrophobicContact CZ-CD1 4.18Å; I387-L389 HydrophobicContact CG2-CD2 3.77Å; I387-L389 HydrophobicContact CG2-CG 3.92Å; I387-A426 HydrophobicContact CG2-CB 3.65Å; I387-I428 HydrophobicContact CD1-CD1 3.93Å; I387-I428 HydrophobicContact CD1-CG1 3.28Å; I387-D462 WeakPolarHBondContact O-CA 3.28Å; I387-L463 PolarHBondContact N-O 2.93Å; I387-L463 PolarHBondContact O-N 2.83Å; I387-L465 HydrophobicContact CD1-CD1 3.63Å; I387-L465 HydrophobicContact CG1-CD1 4.46Å
388	F	96.2	Very high	90.4	Very high	115 Å²	115	74.7 Å²	74.7	50%	0.504	39%	0.391	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-108.6	95.9	174.9	-55.6	-83.2	0	0	0	109.1	T386 D462	T386-F388 HydrophobicContact CG2-CE1 4.17Å; T386-F388 HydrophobicContact CG2-CE2 3.94Å; T386-F388 HydrophobicContact CG2-CZ 3.64Å; F388-D462 HydrophobicContact CD1-CB 4.43Å; F388-D462 WeakPolarHBondContact CD1-OD1 3.48Å
389	L	96.2	Very high	90.8	Very high	3 Å²	3	73.6 Å²	73.6	2%	0.016	38%	0.384	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-85.2	129	174.8	-62.4	179.2	0	0	0	109.6	I387 W398 F400 L422 A426 I428 L461 L463	I387-L389 HydrophobicContact CG2-CD2 3.77Å; I387-L389 HydrophobicContact CG2-CG 3.92Å; L389-W398 HydrophobicContact CB-CE3 3.74Å; L389-W398 HydrophobicContact CB-CH2 4.38Å; L389-W398 HydrophobicContact CB-CZ3 3.57Å; L389-W398 HydrophobicContact CD1-CE3 4.23Å; L389-F400 HydrophobicContact CD1-CE1 4.18Å; L389-L422 HydrophobicContact CD2-CB 4.46Å; L389-A426 HydrophobicContact CD2-CB 3.45Å; L389-A426 VanDerWaalsContact CD2-CB 3.45Å; L389-I428 HydrophobicContact CD1-CD1 4.07Å; L389-L461 HydrophobicContact CB-CB 4.2Å; L389-L461 WeakPolarHBondContact CB-O 3.38Å; L389-L461 HydrophobicContact CD1-CD2 4.01Å; L389-L461 PolarHBondContact N-O 3.45Å; L389-L461 PolarHBondContact O-N 2.85Å; L389-L463 HydrophobicContact CD1-CD1 4.18Å
390	R	95.3	Very high	91.3	Very high	89 Å²	89	65.9 Å²	65.9	34%	0.336	35%	0.347	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-131.1	134.6	-179.7	-64	-64.3	176.6	-79.4	10.3	110.3	E460 D462	R390-E460 VanDerWaalsContact CD-CG 3.5Å; R390-E460 IonicContact CZ-OE2 3.76Å; R390-E460 VanDerWaalsContact NE-CD 3.28Å; R390-E460 IonicContact NE-OE2 2.87Å; R390-E460 PolarHBondContact NE-OE2 3.01Å; R390-E460 IonicContact NH2-OE2 2.58Å; R390-E460 PolarHBondContact NH2-OE2 3.39Å; R390-D462 IonicContact CZ-OD1 3.02Å; R390-D462 IonicContact NH1-OD1 2.72Å; R390-D462 PolarHBondContact NH1-OD1 3.15Å; R390-D462 IonicContact NH2-OD1 3.5Å; R390-D462 PolarHBondContact NH2-OD1 2.99Å; R390-D462 IonicContact NH2-OD2 3.37Å; R390-D462 PolarHBondContact NH2-OD2 2.86Å
391	R	93.2	Very high	91.9	Very high	46 Å²	46	57.4 Å²	57.4	17%	0.174	31%	0.308	C	S	.	.			trans	-128.6	139	177.8	60.8	-178.6	179.5	160.2	3.7	111.8	N393 S394 R396 W398 L422 G458 N459	R391-N393 VanDerWaalsContact C-N 3.31Å; R391-N393 WeakPolarHBondContact CD-O 3.46Å; R391-N393 PolarHBondContact O-N 3.39Å; R391-S394 PolarHBondContact NH1-O 2.9Å; R391-R396 WeakPolarHBondContact CD-O 3.47Å; R391-R396 PolarHBondContact NH1-O 3.22Å; R391-W398 HydrophobicContact CB-CH2 4.41Å; R391-W398 HydrophobicContact CB-CZ3 4.07Å; R391-W398 HydrophobicContact CG-CH2 3.7Å; R391-W398 HydrophobicContact CG-CZ2 4.24Å; R391-W398 HydrophobicContact CG-CZ3 3.84Å; R391-L422 HydrophobicContact CB-CD1 3.72Å; R391-G458 VanDerWaalsContact CZ-O 3.27Å; R391-G458 PolarHBondContact NE-O 2.96Å; R391-G458 PolarHBondContact NH2-O 3.39Å; R391-N459 HydrophobicContact CG-CB 3.88Å; R391-N459 WeakPolarHBondContact CG-OD1 3.35Å; R391-N459 PolarHBondContact N-O 3.11Å; R391-N459 PolarHBondContact NE-OD1 3.15Å
392	P	88.2	Confident	92.3	Very high	114 Å²	114	55 Å²	55	74%	0.74	29%	0.291	S	S	*	.	S	Bend	trans	-74.9	-21.6	-177.3	31.4	-36.1	0	0	0	113
393	N	87.9	Confident	92.6	Very high	59 Å²	59	53.8 Å²	53.8	32%	0.316	28%	0.279	S	S	.	.	S	Bend	trans	-148.5	157.2	177.8	62.5	-6.2	0	0	0	110.6	R391 E395 R396	R391-N393 VanDerWaalsContact C-N 3.31Å; R391-N393 WeakPolarHBondContact CD-O 3.46Å; R391-N393 PolarHBondContact O-N 3.39Å; N393-E395 PolarHBondContact ND2-OE2 2.96Å; N393-E395 PolarHBondContact O-N 3.12Å; N393-R396 PolarHBondContact O-N 3.21Å; N393-R396 PolarHBondContact OD1-N 3.3Å
394	S	87.9	Confident	92.7	Very high	78 Å²	78	49.4 Å²	49.4	55%	0.545	25%	0.25	S	S	.	.	T	Hydrogen-bonded Turn	trans	-69	-17.7	-179.9	-45	0	0	0	0	113.3	R391 N459	R391-S394 PolarHBondContact NH1-O 2.9Å; S394-N459 PolarHBondContact OG-ND2 3.39Å; S394-N459 PolarHBondContact OG-OD1 2.84Å
395	E	87.3	Confident	92.9	Very high	169 Å²	169	47.4 Å²	47.4	79%	0.79	24%	0.237	S	C	*	.	T	Hydrogen-bonded Turn	trans	-65.5	-35.2	175.9	-55.7	174.4	164.6	0	0	112.3	N393 H397	N393-E395 PolarHBondContact ND2-OE2 2.96Å; N393-E395 PolarHBondContact O-N 3.12Å; E395-H397 PolarHBondContact O-N 3.23Å
396	R	88	Confident	92.8	Very high	90 Å²	90	45.6 Å²	45.6	34%	0.34	23%	0.232	S	C	.	.	S	Bend	trans	-75.3	111.7	179.2	-170.2	171.8	-176.6	-158.1	-7.7	109.7	R391 N393 L422	R391-R396 WeakPolarHBondContact CD-O 3.47Å; R391-R396 PolarHBondContact NH1-O 3.22Å; N393-R396 PolarHBondContact O-N 3.21Å; N393-R396 PolarHBondContact OD1-N 3.3Å; R396-L422 HydrophobicContact CG-CD1 4.09Å; R396-L422 VanDerWaalsContact CZ-CD2 3.47Å
397	H	90.4	Very high	92.5	Very high	78 Å²	78	43.9 Å²	43.9	36%	0.361	22%	0.218	S	C	.	.			trans	-63.1	148.6	175.7	55.3	51	0	0	0	112.6	F24 E395 G399	F24-H397 WeakPolarHBondContact O-CB 3.39Å; E395-H397 PolarHBondContact O-N 3.23Å; H397-G399 PolarHBondContact O-N 3.36Å
398	W	95.5	Very high	92.2	Very high	4 Å²	4	43.5 Å²	43.5	2%	0.015	22%	0.216	C	C	.	.			trans	-60.2	-28.4	172.7	-61.9	127.3	0	0	0	112.8	L389 R391 F400 L422 A423 G458 N459 L461	L389-W398 HydrophobicContact CB-CE3 3.74Å; L389-W398 HydrophobicContact CB-CH2 4.38Å; L389-W398 HydrophobicContact CB-CZ3 3.57Å; L389-W398 HydrophobicContact CD1-CE3 4.23Å; R391-W398 HydrophobicContact CB-CH2 4.41Å; R391-W398 HydrophobicContact CB-CZ3 4.07Å; R391-W398 HydrophobicContact CG-CH2 3.7Å; R391-W398 HydrophobicContact CG-CZ2 4.24Å; R391-W398 HydrophobicContact CG-CZ3 3.84Å; W398-F400 HydrophobicContact CB-CD1 3.76Å; W398-F400 HydrophobicContact CB-CE1 3.71Å; W398-F400 HydrophobicContact CG-CE1 4.29Å; W398-L422 HydrophobicContact CE3-CD1 3.92Å; W398-L422 HydrophobicContact CZ3-CD1 4.19Å; W398-L422 WeakPolarHBondContact O-CB 3.42Å; W398-L422 PolarHBondContact O-N 2.96Å; W398-A423 WeakPolarHBondContact O-CB 3.37Å; W398-A423 PolarHBondContact O-N 3.04Å; W398-G458 WeakPolarHBondContact CZ2-O 3.3Å; W398-N459 WeakPolarHBondContact CH2-O 3.18Å; W398-L461 HydrophobicContact CD2-CB 4.33Å; W398-L461 HydrophobicContact CD2-CD2 3.8Å; W398-L461 HydrophobicContact CE3-CB 4.48Å; W398-L461 HydrophobicContact CE3-CD2 4.45Å; W398-L461 HydrophobicContact CG-CD2 3.89Å; W398-L461 HydrophobicContact CH2-CB 3.59Å; W398-L461 HydrophobicContact CZ2-CB 3.4Å; W398-L461 VanDerWaalsContact CZ2-CB 3.4Å; W398-L461 HydrophobicContact CZ2-CD2 4.2Å; W398-L461 HydrophobicContact CZ2-CG 4.44Å; W398-L461 HydrophobicContact CZ3-CB 4.16Å
399	G	95.1	Very high	91.9	Very high	4 Å²	4	38 Å²	38	4%	0.041	19%	0.192	C	C	.	.			trans	77.8	29.8	175.3	0	0	0	0	0	114.1	H397 T418	H397-G399 PolarHBondContact O-N 3.36Å; G399-T418 WeakPolarHBondContact O-CB 3.29Å; G399-T418 PolarHBondContact O-N 3.47Å
400	F	96.4	Very high	91.6	Very high	5 Å²	5	37.9 Å²	37.9	2%	0.022	19%	0.191	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-135.6	164.8	164.1	73.6	-80.1	0	0	0	110.4	F24 L389 W398 V414 K416 A423 I434 I454 L461 L463	F24-F400 WeakPolarHBondContact CD2-O 3.4Å; F24-F400 HydrophobicContact CE2-CE2 4.26Å; F24-F400 HydrophobicContact CE2-CZ 4.25Å; L389-F400 HydrophobicContact CD1-CE1 4.18Å; W398-F400 HydrophobicContact CB-CD1 3.76Å; W398-F400 HydrophobicContact CB-CE1 3.71Å; W398-F400 HydrophobicContact CG-CE1 4.29Å; F400-V414 HydrophobicContact CB-CG1 4.26Å; F400-V414 HydrophobicContact CD2-CG2 4.18Å; F400-K416 CarbonylContact C-O 3.6Å; F400-K416 VanDerWaalsContact CA-O 3.24Å; F400-K416 WeakPolarHBondContact CA-O 3.35Å; F400-A423 HydrophobicContact CB-CB 3.81Å; F400-A423 HydrophobicContact CD1-CB 3.92Å; F400-A423 HydrophobicContact CG-CB 4.27Å; F400-I434 HydrophobicContact CE2-CD1 4.16Å; F400-I454 HydrophobicContact CE2-CD1 4.34Å; F400-I454 HydrophobicContact CZ-CD1 4.16Å; F400-I454 HydrophobicContact CZ-CG2 4.5Å; F400-L461 HydrophobicContact CE1-CD2 3.97Å; F400-L461 HydrophobicContact CZ-CD2 4.21Å; F400-L463 HydrophobicContact CE1-CD1 4.43Å; F400-L463 HydrophobicContact CZ-CD1 4.2Å
401	S	95.6	Very high	91.4	Very high	1 Å²	1	33.7 Å²	33.7	1%	0.007	18%	0.176	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-126.3	155.7	160.7	-67.6	0	0	0	0	108.7	T22 T23 V414 N415 K416	T22-S401 VanDerWaalsContact O-CB 3.29Å; T22-S401 WeakPolarHBondContact O-CB 3.29Å; T22-S401 PolarHBondContact O-OG 3.24Å; T23-S401 WeakPolarHBondContact CA-OG 3.5Å; S401-V414 WeakPolarHBondContact O-CA 3.36Å; S401-N415 VanDerWaalsContact CB-OD1 3.3Å; S401-N415 WeakPolarHBondContact CB-OD1 3.49Å; S401-N415 PolarHBondContact O-N 3Å; S401-N415 PolarHBondContact O-OD1 3.26Å; S401-N415 VanDerWaalsContact O-OD1 3.12Å; S401-K416 PolarHBondContact N-O 3.09Å; S401-K416 PolarHBondContact O-N 2.94Å
402	F	95.3	Very high	91.5	Very high	0 Å²	0	31.6 Å²	31.6	0%	0	17%	0.168	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-123.6	162.3	173.3	78.4	-79.8	0	0	0	110.3	F24 P412 F413 N415 I434 Y447 V450 K451 I454	F24-F402 HydrophobicContact CE2-CD1 4.16Å; F24-F402 HydrophobicContact CE2-CE1 4.34Å; F24-F402 HydrophobicContact CZ-CD1 4.25Å; F24-F402 AromaticContact CZ-CE1 3.97Å; F24-F402 HydrophobicContact CZ-CE1 3.97Å; F402-P412 HydrophobicContact CD2-CB 3.78Å; F402-P412 HydrophobicContact CE2-CB 4.14Å; F402-F413 CarbonylContact C-O 3.02Å; F402-F413 WeakPolarHBondContact CA-O 3.31Å; F402-F413 WeakPolarHBondContact CB-O 3.33Å; F402-N415 PolarHBondContact N-OD1 3.04Å; F402-I434 HydrophobicContact CB-CD1 3.91Å; F402-I434 HydrophobicContact CG-CD1 4.29Å; F402-Y447 HydrophobicContact CD2-CD2 4.08Å; F402-Y447 AromaticContact CD2-CE2 3.92Å; F402-Y447 HydrophobicContact CD2-CE2 3.92Å; F402-Y447 HydrophobicContact CE1-CE2 4.11Å; F402-Y447 AromaticContact CE2-CD2 3.33Å; F402-Y447 HydrophobicContact CE2-CD2 3.33Å; F402-Y447 AromaticContact CE2-CE2 3.42Å; F402-Y447 HydrophobicContact CE2-CE2 3.42Å; F402-Y447 VanDerWaalsContact CE2-CE2 3.42Å; F402-Y447 HydrophobicContact CE2-CG 4.14Å; F402-Y447 HydrophobicContact CG-CE2 4.45Å; F402-Y447 AromaticContact CZ-CD2 3.69Å; F402-Y447 HydrophobicContact CZ-CD2 3.69Å; F402-Y447 HydrophobicContact CZ-CE1 4.46Å; F402-Y447 AromaticContact CZ-CE2 3.53Å; F402-Y447 HydrophobicContact CZ-CE2 3.53Å; F402-Y447 HydrophobicContact CZ-CG 4.22Å; F402-Y447 AromaticContact CZ-CZ 3.93Å; F402-V450 HydrophobicContact CD2-CG1 4.09Å; F402-V450 HydrophobicContact CE1-CG1 4.35Å; F402-V450 HydrophobicContact CE2-CB 3.87Å; F402-V450 HydrophobicContact CE2-CG1 3.49Å; F402-V450 VanDerWaalsContact CE2-CG1 3.49Å; F402-V450 HydrophobicContact CZ-CB 3.94Å; F402-V450 HydrophobicContact CZ-CG1 3.65Å; F402-K451 HydrophobicContact CE1-CB 4.21Å; F402-K451 HydrophobicContact CZ-CB 4.03Å; F402-I454 HydrophobicContact CD1-CD1 3.98Å; F402-I454 HydrophobicContact CE1-CD1 3.9Å
403	Y	94.3	Very high	91.9	Very high	0 Å²	0	26.1 Å²	26.1	0%	0	13%	0.133	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-133.7	157.3	169.1	-168.6	-84.7	0	0	0	108.6	T19 I370 I372 Y408 P412 F413 I482	T19-Y403 HydrophobicContact CG2-CE2 3.87Å; I370-Y403 PolarHBondContact O-OH 3.46Å; I372-Y403 HydrophobicContact CD1-CD1 3.93Å; I372-Y403 HydrophobicContact CD1-CE1 3.57Å; I372-Y403 HydrophobicContact CG1-CE1 4.11Å; Y403-Y408 HydrophobicContact CD1-CD1 4.34Å; Y403-Y408 AromaticContact CE1-CD1 3.35Å; Y403-Y408 HydrophobicContact CE1-CD1 3.35Å; Y403-Y408 AromaticContact CE1-CE1 3.86Å; Y403-Y408 HydrophobicContact CE1-CE1 3.86Å; Y403-Y408 AromaticContact CE1-CG 3.99Å; Y403-Y408 HydrophobicContact CE1-CG 3.99Å; Y403-Y408 HydrophobicContact CE2-CD1 4.34Å; Y403-Y408 AromaticContact CE2-CE1 3.99Å; Y403-Y408 HydrophobicContact CE2-CE1 3.99Å; Y403-Y408 AromaticContact CZ-CD1 3.39Å; Y403-Y408 AromaticContact CZ-CE1 3.42Å; Y403-Y408 VanDerWaalsContact CZ-CE1 3.42Å; Y403-Y408 VanDerWaalsContact OH-CD1 3.26Å; Y403-Y408 WeakPolarHBondContact OH-CD1 3.05Å; Y403-Y408 VanDerWaalsContact OH-CE1 3.25Å; Y403-Y408 WeakPolarHBondContact OH-CE1 3.45Å; Y403-P412 CarbonylContact O-C 3.56Å; Y403-P412 VanDerWaalsContact O-CA 3.28Å; Y403-P412 WeakPolarHBondContact O-CA 3.38Å; Y403-F413 HydrophobicContact CD1-CE1 4.06Å; Y403-F413 HydrophobicContact CD1-CZ 4.16Å; Y403-F413 HydrophobicContact CG-CZ 4.39Å; Y403-F413 PolarHBondContact N-O 3.47Å; Y403-F413 WeakPolarHBondContact O-CD1 3.27Å; Y403-F413 PolarHBondContact O-N 3.11Å; Y403-I482 HydrophobicContact CD1-CD1 3.71Å; Y403-I482 HydrophobicContact CD1-CG2 4.36Å; Y403-I482 HydrophobicContact CD2-CD1 3.94Å; Y403-I482 HydrophobicContact CD2-CG1 3.99Å; Y403-I482 HydrophobicContact CD2-CG2 3.86Å; Y403-I482 HydrophobicContact CE1-CD1 3.41Å; Y403-I482 VanDerWaalsContact CE1-CD1 3.41Å; Y403-I482 HydrophobicContact CE1-CG1 4.43Å; Y403-I482 HydrophobicContact CE2-CD1 3.61Å; Y403-I482 HydrophobicContact CE2-CG1 3.75Å; Y403-I482 HydrophobicContact CE2-CG2 4.5Å; Y403-I482 HydrophobicContact CG-CD1 3.97Å; Y403-I482 HydrophobicContact CG-CG1 4.38Å; Y403-I482 HydrophobicContact CG-CG2 3.75Å
404	G	93.1	Very high	92.3	Very high	0 Å²	0	23.4 Å²	23.4	0%	0	12%	0.118	C	C	.	.	E	Extended strand (participates in β ladder)	trans	101.7	173.6	176.9	0	0	0	0	0	113.8	Y447	G404-Y447 WeakPolarHBondContact O-CD2 3.42Å
405	G	92.7	Very high	92.6	Very high	1 Å²	1	20.1 Å²	20.1	1%	0.01	10%	0.095	C	C	.	.	E	Extended strand (participates in β ladder)	trans	143	166.6	-163.1	0	0	0	0	0	110.6	E407 Y408 G409 C410	G405-E407 VanDerWaalsContact C-OE2 3.25Å; G405-E407 PolarHBondContact O-N 2.92Å; G405-E407 VanDerWaalsContact O-N 3.12Å; G405-Y408 WeakPolarHBondContact O-CA 3.39Å; G405-Y408 PolarHBondContact O-N 2.99Å; G405-G409 PolarHBondContact O-N 3.14Å; G405-C410 CarbonylContact C-O 3.41Å; G405-C410 PolarHBondContact N-O 3.01Å
406	A	90.1	Very high	93	Very high	16 Å²	16	15 Å²	15	13%	0.132	7%	0.07	C	C	.	.	T	Hydrogen-bonded Turn	trans	-60.2	-24	-174.2	0	0	0	0	0	114.5	K92 G444 K445	K92-A406 WeakPolarHBondContact CE-O 3.29Å; A406-G444 WeakPolarHBondContact CB-O 3.5Å; A406-K445 WeakPolarHBondContact CB-O 3.32Å; A406-K445 PolarHBondContact N-O 3.15Å
407	E	88.9	Confident	93.3	Very high	37 Å²	37	12.1 Å²	12.1	17%	0.173	6%	0.062	C	C	.	.	T	Hydrogen-bonded Turn	trans	-80.8	-21.3	173.5	74.2	-80.7	-125.3	0	0	113.6	T366 A369 G405 T446 Y447	T366-E407 HydrophobicContact CG2-CB 3.87Å; T366-E407 HydrophobicContact CG2-CG 4.07Å; A369-E407 HydrophobicContact CB-CG 4.16Å; G405-E407 VanDerWaalsContact C-OE2 3.25Å; G405-E407 PolarHBondContact O-N 2.92Å; G405-E407 VanDerWaalsContact O-N 3.12Å; E407-T446 WeakPolarHBondContact OE1-CB 3.37Å; E407-T446 VanDerWaalsContact OE2-CA 3.3Å; E407-T446 WeakPolarHBondContact OE2-CA 3.48Å; E407-Y447 WeakPolarHBondContact OE1-CB 3.48Å; E407-Y447 PolarHBondContact OE1-N 2.95Å; E407-Y447 PolarHBondContact OE2-N 3.45Å
408	Y	89.7	Confident	93.5	Very high	4 Å²	4	11 Å²	11	2%	0.016	6%	0.06	C	C	.	.	T	Hydrogen-bonded Turn	trans	-91.1	-3.7	176.9	-63.9	-89.9	0	0	0	113.1	A369 I370 I372 G373 Y403 G405 C410 Y447	A369-Y408 HydrophobicContact CB-CD1 4.09Å; A369-Y408 HydrophobicContact CB-CE1 3.58Å; A369-Y408 HydrophobicContact CB-CE2 4.2Å; I370-Y408 WeakPolarHBondContact O-CD1 3.41Å; I372-Y408 PolarHBondContact N-O 2.71Å; G373-Y408 PolarHBondContact N-O 3.39Å; G373-Y408 VanDerWaalsContact N-O 3.13Å; Y403-Y408 HydrophobicContact CD1-CD1 4.34Å; Y403-Y408 AromaticContact CE1-CD1 3.35Å; Y403-Y408 HydrophobicContact CE1-CD1 3.35Å; Y403-Y408 AromaticContact CE1-CE1 3.86Å; Y403-Y408 HydrophobicContact CE1-CE1 3.86Å; Y403-Y408 AromaticContact CE1-CG 3.99Å; Y403-Y408 HydrophobicContact CE1-CG 3.99Å; Y403-Y408 HydrophobicContact CE2-CD1 4.34Å; Y403-Y408 AromaticContact CE2-CE1 3.99Å; Y403-Y408 HydrophobicContact CE2-CE1 3.99Å; Y403-Y408 AromaticContact CZ-CD1 3.39Å; Y403-Y408 AromaticContact CZ-CE1 3.42Å; Y403-Y408 VanDerWaalsContact CZ-CE1 3.42Å; Y403-Y408 VanDerWaalsContact OH-CD1 3.26Å; Y403-Y408 WeakPolarHBondContact OH-CD1 3.05Å; Y403-Y408 VanDerWaalsContact OH-CE1 3.25Å; Y403-Y408 WeakPolarHBondContact OH-CE1 3.45Å; G405-Y408 WeakPolarHBondContact O-CA 3.39Å; G405-Y408 PolarHBondContact O-N 2.99Å; Y408-C410 PolarHBondContact O-N 3.13Å; Y408-C410 PolarHBondContact O-SG 2.83Å; Y408-C410 VanDerWaalsContact O-SG 3.42Å; Y408-Y447 VanDerWaalsContact CE2-CB 3.49Å; Y408-Y447 HydrophobicContact CE2-CD2 4.28Å; Y408-Y447 HydrophobicContact CE2-CG 4.02Å
409	G	88.5	Confident	93.4	Very high	0 Å²	0	15.1 Å²	15.1	0%	0	9%	0.09	C	C	.	.	T	Hydrogen-bonded Turn	trans	70	8.1	-179.6	0	0	0	0	0	115.1	G373 S374 G405	G373-G409 CarbonylContact C-O 3.49Å; G373-G409 WeakPolarHBondContact CA-O 3.15Å; S374-G409 WeakPolarHBondContact CA-O 3.41Å; S374-G409 PolarHBondContact N-O 3.21Å; S374-G409 VanDerWaalsContact N-O 3.12Å; G405-G409 PolarHBondContact O-N 3.14Å
410	C	90.6	Very high	93.2	Very high	0 Å²	0	21 Å²	21	0%	0	12%	0.121	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-137.4	155.2	-174.8	54.7	0	0	0	0	110.9	V376 G405 Y408	V376-C410 HydrophobicContact CG2-CB 3.95Å; G405-C410 CarbonylContact C-O 3.41Å; G405-C410 PolarHBondContact N-O 3.01Å; Y408-C410 PolarHBondContact O-N 3.13Å; Y408-C410 PolarHBondContact O-SG 2.83Å; Y408-C410 VanDerWaalsContact O-SG 3.42Å
411	P	91.8	Very high	93	Very high	2 Å²	2	20.9 Å²	20.9	1%	0.013	12%	0.121	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-57.1	152.5	174.8	17.9	-27.9	0	0	0	112	F95 I377 F413 V433 V470	F95-P411 HydrophobicContact CE2-CB 3.57Å; F95-P411 VanDerWaalsContact CE2-CD 3.49Å; F95-P411 HydrophobicContact CE2-CG 3.92Å; F95-P411 HydrophobicContact CZ-CB 3.93Å; I377-P411 HydrophobicContact CG1-CG 4.13Å; P411-F413 WeakPolarHBondContact O-CD1 3.42Å; P411-F413 PolarHBondContact O-N 3.32Å; P411-V433 HydrophobicContact CB-CG1 3.68Å; P411-V433 HydrophobicContact CB-CG2 4.11Å; P411-V433 HydrophobicContact CG-CG1 4.24Å; P411-V433 HydrophobicContact CG-CG2 3.85Å; P411-V470 HydrophobicContact CG-CG2 4.22Å
412	P	94.9	Very high	93	Very high	1 Å²	1	21.6 Å²	21.6	1%	0.006	12%	0.124	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-63.8	117.6	163.6	27.4	-31.4	0	0	0	109.4	F402 Y403 I434 T442 V450	F402-P412 HydrophobicContact CD2-CB 3.78Å; F402-P412 HydrophobicContact CE2-CB 4.14Å; Y403-P412 CarbonylContact O-C 3.56Å; Y403-P412 VanDerWaalsContact O-CA 3.28Å; Y403-P412 WeakPolarHBondContact O-CA 3.38Å; P412-I434 HydrophobicContact CG-CB 4.36Å; P412-I434 PolarHBondContact O-N 3.37Å; P412-T442 HydrophobicContact CG-CG2 3.91Å; P412-V450 HydrophobicContact CB-CG1 3.92Å; P412-V450 HydrophobicContact CB-CG2 4.29Å; P412-V450 HydrophobicContact CG-CG1 4.24Å; P412-V450 HydrophobicContact CG-CG2 4.08Å
413	F	95.2	Very high	93	Very high	0 Å²	0	21.6 Å²	21.6	0%	0	12%	0.124	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-126.5	150.8	179.9	69.7	-94.5	0	0	0	111	I372 F402 Y403 P411 N415 D432 V433 V470 V475 I482 M483	I372-F413 HydrophobicContact CD1-CE1 4.48Å; F402-F413 CarbonylContact C-O 3.02Å; F402-F413 WeakPolarHBondContact CA-O 3.31Å; F402-F413 WeakPolarHBondContact CB-O 3.33Å; Y403-F413 HydrophobicContact CD1-CE1 4.06Å; Y403-F413 HydrophobicContact CD1-CZ 4.16Å; Y403-F413 HydrophobicContact CG-CZ 4.39Å; Y403-F413 PolarHBondContact N-O 3.47Å; Y403-F413 WeakPolarHBondContact O-CD1 3.27Å; Y403-F413 PolarHBondContact O-N 3.11Å; P411-F413 WeakPolarHBondContact O-CD1 3.42Å; P411-F413 PolarHBondContact O-N 3.32Å; F413-N415 HydrophobicContact CD2-CB 4.37Å; F413-N415 HydrophobicContact CE2-CB 3.81Å; F413-N415 PolarHBondContact O-N 3.18Å; F413-D432 CarbonylContact C-O 3.35Å; F413-D432 VanDerWaalsContact CA-O 3.31Å; F413-D432 WeakPolarHBondContact CA-O 3.41Å; F413-V433 HydrophobicContact CB-CG2 4.1Å; F413-V470 HydrophobicContact CB-CB 4.38Å; F413-V470 HydrophobicContact CB-CG2 3.86Å; F413-V470 HydrophobicContact CD1-CG1 4.37Å; F413-V470 HydrophobicContact CD1-CG2 3.88Å; F413-V470 HydrophobicContact CD2-CG1 4.44Å; F413-V470 HydrophobicContact CG-CB 4.27Å; F413-V470 HydrophobicContact CG-CG1 4.34Å; F413-V470 HydrophobicContact CG-CG2 3.91Å; F413-V475 HydrophobicContact CZ-CG1 4.23Å; F413-V475 HydrophobicContact CZ-CG2 4.32Å; F413-I482 HydrophobicContact CE2-CG2 4.49Å; F413-I482 HydrophobicContact CZ-CG2 4.21Å; F413-M483 HydrophobicContact CD2-CE 4.49Å; F413-M483 HydrophobicContact CE2-CE 3.53Å; F413-M483 HydrophobicContact CZ-CE 4.08Å
414	V	96.5	Very high	93.1	Very high	1 Å²	1	25 Å²	25	1%	0.006	14%	0.142	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-71.8	114.8	178.5	178.5	0	0	0	0	109.6	F400 S401 V417 I428 V430 G431 D432 I434	F400-V414 HydrophobicContact CB-CG1 4.26Å; F400-V414 HydrophobicContact CD2-CG2 4.18Å; S401-V414 WeakPolarHBondContact O-CA 3.36Å; V414-V417 HydrophobicContact CG1-CG2 3.53Å; V414-I428 HydrophobicContact CB-CG2 4.27Å; V414-I428 HydrophobicContact CG1-CG2 3.9Å; V414-I428 HydrophobicContact CG2-CG2 3.81Å; V414-V430 CarbonylContact O-C 3.51Å; V414-V430 WeakPolarHBondContact O-CA 3.48Å; V414-G431 PolarHBondContact O-N 3.12Å; V414-D432 PolarHBondContact N-O 3.05Å; V414-I434 HydrophobicContact CG2-CD1 4.45Å; V414-I434 HydrophobicContact CG2-CG1 4.38Å
415	N	94.5	Very high	93.2	Very high	10 Å²	10	30.9 Å²	30.9	5%	0.053	17%	0.17	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-99.4	-18.8	-179.9	78.2	-48.1	0	0	0	113.5	S401 F402 F413 I482	S401-N415 VanDerWaalsContact CB-OD1 3.3Å; S401-N415 WeakPolarHBondContact CB-OD1 3.49Å; S401-N415 PolarHBondContact O-N 3Å; S401-N415 PolarHBondContact O-OD1 3.26Å; S401-N415 VanDerWaalsContact O-OD1 3.12Å; F402-N415 PolarHBondContact N-OD1 3.04Å; F413-N415 HydrophobicContact CD2-CB 4.37Å; F413-N415 HydrophobicContact CE2-CB 3.81Å; F413-N415 PolarHBondContact O-N 3.18Å; N415-I482 HydrophobicContact CB-CG2 3.8Å; N415-I482 PolarHBondContact ND2-O 3.21Å
416	K	95.6	Very high	93.3	Very high	61 Å²	61	32.8 Å²	32.8	27%	0.265	19%	0.186	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-147.2	139.2	178	-176.8	-177.9	175.6	-176.2	0	110.3	F400 S401	F400-K416 CarbonylContact C-O 3.6Å; F400-K416 VanDerWaalsContact CA-O 3.24Å; F400-K416 WeakPolarHBondContact CA-O 3.35Å; S401-K416 PolarHBondContact N-O 3.09Å; S401-K416 PolarHBondContact O-N 2.94Å
417	V	95.7	Very high	93.5	Very high	30 Å²	30	33.7 Å²	33.7	18%	0.182	20%	0.196	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-125.4	129.7	170.7	-179.6	0	0	0	0	108.6	V414 A423 N424 I428 V430	V414-V417 HydrophobicContact CG1-CG2 3.53Å; V417-A423 HydrophobicContact CG1-CB 4.37Å; V417-N424 HydrophobicContact CG1-CB 3.71Å; V417-I428 HydrophobicContact CG2-CG2 4.04Å; V417-V430 HydrophobicContact CG2-CG2 4.08Å
418	T	94.5	Very high	93.9	Very high	53 Å²	53	32.1 Å²	32.1	33%	0.325	19%	0.189	S	C	.	.			trans	-80.4	120.2	176.7	-59	0	0	0	0	109.3	G399 N420 G421 N424	G399-T418 WeakPolarHBondContact O-CB 3.29Å; G399-T418 PolarHBondContact O-N 3.47Å; T418-N420 PolarHBondContact O-N 3.12Å; T418-G421 WeakPolarHBondContact O-CA 3.42Å; T418-G421 PolarHBondContact O-N 3.03Å; T418-N424 WeakPolarHBondContact O-CB 3.38Å
419	S	93.2	Very high	94.1	Very high	92 Å²	92	35.5 Å²	35.5	64%	0.643	21%	0.205	S	C	*	.	T	Hydrogen-bonded Turn	trans	-51	133.7	174.6	-48.8	0	0	0	0	111.3	G421	S419-G421 PolarHBondContact O-N 3.47Å; S419-G421 VanDerWaalsContact O-N 3.11Å
420	N	90.7	Very high	94.5	Very high	127 Å²	127	38 Å²	38	68%	0.679	22%	0.22	S	C	*	.	T	Hydrogen-bonded Turn	trans	62	6.7	-175.1	-49.5	-38.6	0	0	0	115.6	T418 N424	T418-N420 PolarHBondContact O-N 3.12Å; N420-N424 PolarHBondContact N-OD1 3.01Å
421	G	92	Very high	94.7	Very high	2 Å²	2	38 Å²	38	2%	0.021	22%	0.221	C	C	.	.	S	Bend	trans	-70.3	167	169.2	0	0	0	0	0	112.7	T418 S419 A423 N424 Q425	T418-G421 WeakPolarHBondContact O-CA 3.42Å; T418-G421 PolarHBondContact O-N 3.03Å; S419-G421 PolarHBondContact O-N 3.47Å; S419-G421 VanDerWaalsContact O-N 3.11Å; G421-A423 VanDerWaalsContact C-N 3.34Å; G421-A423 PolarHBondContact O-N 3.27Å; G421-N424 WeakPolarHBondContact O-CB 3.35Å; G421-N424 PolarHBondContact O-N 2.71Å; G421-N424 VanDerWaalsContact O-N 3.14Å; G421-Q425 WeakPolarHBondContact O-CG 3.44Å; G421-Q425 PolarHBondContact O-N 2.93Å
422	L	94.7	Very high	94.9	Very high	17 Å²	17	37.9 Å²	37.9	9%	0.089	22%	0.22	C	C	.	.	H	α-helix	trans	-58.4	-44.4	-179.9	-75.4	166.6	0	0	0	112.1	L389 R391 R396 W398 N424 Q425 A426	L389-L422 HydrophobicContact CD2-CB 4.46Å; R391-L422 HydrophobicContact CB-CD1 3.72Å; R396-L422 HydrophobicContact CG-CD1 4.09Å; R396-L422 VanDerWaalsContact CZ-CD2 3.47Å; W398-L422 HydrophobicContact CE3-CD1 3.92Å; W398-L422 HydrophobicContact CZ3-CD1 4.19Å; W398-L422 WeakPolarHBondContact O-CB 3.42Å; W398-L422 PolarHBondContact O-N 2.96Å; L422-N424 VanDerWaalsContact C-N 3.33Å; L422-N424 PolarHBondContact O-N 3.5Å; L422-Q425 PolarHBondContact O-N 3.24Å; L422-A426 WeakPolarHBondContact O-CB 3.49Å; L422-A426 PolarHBondContact O-N 3.18Å
423	A	96.2	Very high	94.9	Very high	0 Å²	0	38 Å²	38	0%	0	22%	0.221	C	C	.	.	H	α-helix	trans	-56	-44.4	174.1	0	0	0	0	0	113	W398 F400 V417 G421 A426 G427 I428	W398-A423 WeakPolarHBondContact O-CB 3.37Å; W398-A423 PolarHBondContact O-N 3.04Å; F400-A423 HydrophobicContact CB-CB 3.81Å; F400-A423 HydrophobicContact CD1-CB 3.92Å; F400-A423 HydrophobicContact CG-CB 4.27Å; V417-A423 HydrophobicContact CG1-CB 4.37Å; G421-A423 VanDerWaalsContact C-N 3.34Å; G421-A423 PolarHBondContact O-N 3.27Å; A423-A426 CarbonylContact O-C 3.55Å; A423-A426 PolarHBondContact O-N 3.4Å; A423-G427 PolarHBondContact O-N 2.83Å; A423-I428 HydrophobicContact CB-CB 4.1Å; A423-I428 HydrophobicContact CB-CD1 3.8Å; A423-I428 HydrophobicContact CB-CG1 4.26Å; A423-I428 WeakPolarHBondContact O-CB 3.39Å; A423-I428 PolarHBondContact O-N 3.3Å
424	N	95.4	Very high	95	Very high	70 Å²	70	38 Å²	38	37%	0.374	22%	0.221	S	C	.	.	H	α-helix	trans	-67.1	-43.1	178.2	-172.9	-115.2	0	0	0	111.6	V417 T418 N420 G421 L422 A426 G427	V417-N424 HydrophobicContact CG1-CB 3.71Å; T418-N424 WeakPolarHBondContact O-CB 3.38Å; N420-N424 PolarHBondContact N-OD1 3.01Å; G421-N424 WeakPolarHBondContact O-CB 3.35Å; G421-N424 PolarHBondContact O-N 2.71Å; G421-N424 VanDerWaalsContact O-N 3.14Å; L422-N424 VanDerWaalsContact C-N 3.33Å; L422-N424 PolarHBondContact O-N 3.5Å; N424-A426 PolarHBondContact O-N 2.96Å; N424-G427 PolarHBondContact O-N 2.84Å; N424-G427 VanDerWaalsContact O-N 3.09Å
425	Q	94.8	Very high	94.9	Very high	124 Å²	124	38 Å²	38	58%	0.579	22%	0.221	S	C	*	.	H	α-helix	trans	-64.3	-27.2	175.7	-70.7	177.1	-26.4	0	0	112.7	G421 L422	G421-Q425 WeakPolarHBondContact O-CG 3.44Å; G421-Q425 PolarHBondContact O-N 2.93Å; L422-Q425 PolarHBondContact O-N 3.24Å
426	A	94.9	Very high	94.8	Very high	41 Å²	41	38 Å²	38	34%	0.339	22%	0.221	S	C	.	.	T	Hydrogen-bonded Turn	trans	-92	4.1	174.7	0	0	0	0	0	114.2	I387 L389 L422 A423 N424	I387-A426 HydrophobicContact CG2-CB 3.65Å; L389-A426 HydrophobicContact CD2-CB 3.45Å; L389-A426 VanDerWaalsContact CD2-CB 3.45Å; L422-A426 WeakPolarHBondContact O-CB 3.49Å; L422-A426 PolarHBondContact O-N 3.18Å; A423-A426 CarbonylContact O-C 3.55Å; A423-A426 PolarHBondContact O-N 3.4Å; N424-A426 PolarHBondContact O-N 2.96Å
427	G	95	Very high	94.9	Very high	35 Å²	35	35.1 Å²	35.1	36%	0.361	21%	0.209	S	C	.	.	T	Hydrogen-bonded Turn	trans	81.1	20.4	174	0	0	0	0	0	116.3	A423 N424 R467	A423-G427 PolarHBondContact O-N 2.83Å; N424-G427 PolarHBondContact O-N 2.84Å; N424-G427 VanDerWaalsContact O-N 3.09Å; G427-R467 PolarHBondContact O-NH2 2.87Å
428	I	96.6	Very high	94.8	Very high	5 Å²	5	36 Å²	36	3%	0.026	22%	0.216	C	C	.	.			trans	-67.6	131	171.6	-63.3	-175.7	0	0	0	110.3	I387 L389 V414 V417 A423 L463 L465	I387-I428 HydrophobicContact CD1-CD1 3.93Å; I387-I428 HydrophobicContact CD1-CG1 3.28Å; L389-I428 HydrophobicContact CD1-CD1 4.07Å; V414-I428 HydrophobicContact CB-CG2 4.27Å; V414-I428 HydrophobicContact CG1-CG2 3.9Å; V414-I428 HydrophobicContact CG2-CG2 3.81Å; V417-I428 HydrophobicContact CG2-CG2 4.04Å; A423-I428 HydrophobicContact CB-CB 4.1Å; A423-I428 HydrophobicContact CB-CD1 3.8Å; A423-I428 HydrophobicContact CB-CG1 4.26Å; A423-I428 WeakPolarHBondContact O-CB 3.39Å; A423-I428 PolarHBondContact O-N 3.3Å; I428-L463 HydrophobicContact CD1-CD1 4.01Å; I428-L465 HydrophobicContact CD1-CD1 4.21Å; I428-L465 HydrophobicContact CG1-CD1 3.96Å; I428-L465 HydrophobicContact CG2-CD1 4.45Å
429	E	95.5	Very high	94.5	Very high	75 Å²	75	38.6 Å²	38.6	35%	0.35	23%	0.228	S	C	.	.			trans	-109.2	158.5	175.1	-80	172.2	-154.4	0	0	112.1	D432 R467 R468	E429-D432 PolarHBondContact N-OD2 3.43Å; E429-D432 WeakPolarHBondContact O-CB 3.42Å; E429-D432 PolarHBondContact O-N 3.49Å; E429-R467 IonicContact OE1-CZ 3.14Å; E429-R467 IonicContact OE1-NH1 3.66Å; E429-R467 PolarHBondContact OE1-NH1 2.87Å; E429-R467 IonicContact OE2-CZ 3.39Å; E429-R467 IonicContact OE2-NE 3.6Å; E429-R467 IonicContact OE2-NH1 3.92Å; E429-R467 PolarHBondContact OE2-NH1 3.39Å; E429-R468 IonicContact OE2-NE 3.48Å; E429-R468 IonicContact OE2-NH2 2.9Å; E429-R468 PolarHBondContact OE2-NH2 2.73Å
430	V	95.8	Very high	94.4	Very high	51 Å²	51	35.9 Å²	35.9	31%	0.309	21%	0.208	S	C	.	.	T	Hydrogen-bonded Turn	trans	-71.4	132.9	170.5	173.8	0	0	0	0	108.9	V414 V417 L472 M483	V414-V430 CarbonylContact O-C 3.51Å; V414-V430 WeakPolarHBondContact O-CA 3.48Å; V417-V430 HydrophobicContact CG2-CG2 4.08Å; V430-L472 HydrophobicContact CG1-CD1 4.23Å; V430-L472 HydrophobicContact CG1-CD2 3.97Å; V430-M483 HydrophobicContact CG1-SD 4.2Å
431	G	94.8	Very high	94.5	Very high	1 Å²	1	31.9 Å²	31.9	1%	0.01	19%	0.187	C	C	.	.	T	Hydrogen-bonded Turn	trans	93.7	-2.3	-172.4	0	0	0	0	0	114.8	V414 R468 G469 V470	V414-G431 PolarHBondContact O-N 3.12Å; G431-R468 CarbonylContact O-C 3.48Å; G431-R468 WeakPolarHBondContact O-CA 3.43Å; G431-G469 PolarHBondContact O-N 2.99Å; G431-V470 PolarHBondContact O-N 3.37Å
432	D	96.3	Very high	94.5	Very high	0 Å²	0	31.8 Å²	31.8	0%	0	19%	0.186	C	C	.	.			trans	-70.9	129	170.5	-71.3	-8.7	0	0	0	110.1	F385 F413 V414 E429 L465 I466 R467 R468	F385-D432 WeakPolarHBondContact CZ-OD2 3.23Å; F413-D432 CarbonylContact C-O 3.35Å; F413-D432 VanDerWaalsContact CA-O 3.31Å; F413-D432 WeakPolarHBondContact CA-O 3.41Å; V414-D432 PolarHBondContact N-O 3.05Å; E429-D432 PolarHBondContact N-OD2 3.43Å; E429-D432 WeakPolarHBondContact O-CB 3.42Å; E429-D432 PolarHBondContact O-N 3.49Å; D432-L465 HydrophobicContact CB-CD1 4.3Å; D432-I466 WeakPolarHBondContact CA-O 3.32Å; D432-R467 VanDerWaalsContact OD1-CA 3.24Å; D432-R467 WeakPolarHBondContact OD1-CA 3.41Å; D432-R467 WeakPolarHBondContact OD1-CD 3.44Å; D432-R467 IonicContact OD1-CZ 2.68Å; D432-R467 IonicContact OD1-NE 3.44Å; D432-R467 PolarHBondContact OD1-NE 3.22Å; D432-R467 IonicContact OD2-CZ 3.31Å; D432-R467 IonicContact OD2-NE 3.74Å; D432-R467 PolarHBondContact OD2-NE 3.11Å; D432-R467 IonicContact OD2-NH2 2.93Å; D432-R467 PolarHBondContact OD2-NH2 3.39Å; D432-R468 PolarHBondContact OD1-N 3.01Å
433	V	95.3	Very high	94.2	Very high	4 Å²	4	33 Å²	33	2%	0.024	19%	0.194	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-89.5	133.1	179.8	162	0	0	0	0	110.2	M99 P411 F413 L465 I466 V470	M99-V433 HydrophobicContact SD-CG1 4.45Å; P411-V433 HydrophobicContact CB-CG1 3.68Å; P411-V433 HydrophobicContact CB-CG2 4.11Å; P411-V433 HydrophobicContact CG-CG1 4.24Å; P411-V433 HydrophobicContact CG-CG2 3.85Å; F413-V433 HydrophobicContact CB-CG2 4.1Å; V433-L465 CarbonylContact O-C 3.56Å; V433-L465 WeakPolarHBondContact O-CA 3.39Å; V433-I466 HydrophobicContact CB-CB 4.3Å; V433-I466 HydrophobicContact CB-CD1 4.36Å; V433-I466 HydrophobicContact CG1-CD1 4.04Å; V433-I466 PolarHBondContact N-O 2.74Å; V433-I466 PolarHBondContact O-N 3.47Å; V433-V470 HydrophobicContact CG2-CG2 3.72Å
434	I	96.3	Very high	93.8	Very high	0 Å²	0	34.6 Å²	34.6	0%	0	21%	0.21	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-87.2	111.7	177.7	-47.9	175.3	0	0	0	109.1	F400 F402 P412 V414 I437 T442 L463 L465	F400-I434 HydrophobicContact CE2-CD1 4.16Å; F402-I434 HydrophobicContact CB-CD1 3.91Å; F402-I434 HydrophobicContact CG-CD1 4.29Å; P412-I434 HydrophobicContact CG-CB 4.36Å; P412-I434 PolarHBondContact O-N 3.37Å; V414-I434 HydrophobicContact CG2-CD1 4.45Å; V414-I434 HydrophobicContact CG2-CG1 4.38Å; I434-I437 HydrophobicContact CG2-CD1 4.01Å; I434-I437 HydrophobicContact CG2-CG1 3.73Å; I434-T442 HydrophobicContact CB-CG2 4.42Å; I434-T442 HydrophobicContact CG2-CG2 3.97Å; I434-T442 WeakPolarHBondContact O-CB 3.35Å; I434-T442 WeakPolarHBondContact O-CG2 3.05Å; I434-T442 PolarHBondContact O-OG1 3.21Å; I434-L463 HydrophobicContact CG2-CD2 4.18Å; I434-L465 HydrophobicContact CB-CD2 4.1Å; I434-L465 HydrophobicContact CG1-CD2 3.82Å; I434-L465 HydrophobicContact CG2-CD2 4.17Å
435	V	94.4	Very high	93.7	Very high	1 Å²	1	32.8 Å²	32.8	1%	0.006	20%	0.199	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-91	-40	-178.1	-175.1	0	0	0	0	111.8	M99 L103 M106 T442 I464 I466	M99-V435 HydrophobicContact CE-CB 4.43Å; M99-V435 HydrophobicContact CE-CG1 4.1Å; M99-V435 HydrophobicContact CE-CG2 4.31Å; L103-V435 HydrophobicContact CD2-CG1 3.54Å; L103-V435 HydrophobicContact CG-CG1 4.13Å; M106-V435 HydrophobicContact CE-CG1 4.42Å; M106-V435 HydrophobicContact SD-CG1 4.37Å; V435-T442 PolarHBondContact O-N 3.35Å; V435-T442 PolarHBondContact O-OG1 2.88Å; V435-T442 VanDerWaalsContact O-OG1 3.05Å; V435-I464 WeakPolarHBondContact CB-O 3.06Å; V435-I464 PolarHBondContact N-O 3.16Å; V435-I466 HydrophobicContact CG2-CD1 3.36Å; V435-I466 HydrophobicContact CG2-CG1 3.54Å
436	S	94	Very high	93.6	Very high	8 Å²	8	29.1 Å²	29.1	6%	0.056	19%	0.185	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-148.9	156.2	176	75.4	0	0	0	0	111.9	S440 L463 I464	S436-S440 CarbonylContact C-O 3.57Å; S436-S440 VanDerWaalsContact CA-O 3.23Å; S436-S440 WeakPolarHBondContact CA-O 3.46Å; S436-S440 WeakPolarHBondContact CB-O 3.43Å; S436-L463 WeakPolarHBondContact O-CA 3.47Å; S436-I464 PolarHBondContact N-O 2.83Å; S436-I464 PolarHBondContact O-N 3.39Å; S436-I464 VanDerWaalsContact O-N 3.12Å; S436-I464 WeakPolarHBondContact OG-CB 3.42Å; S436-I464 WeakPolarHBondContact OG-CD1 3.48Å; S436-I464 VanDerWaalsContact OG-CG1 3.28Å; S436-I464 WeakPolarHBondContact OG-CG1 3.45Å
437	I	96.3	Very high	93.5	Very high	1 Å²	1	27.1 Å²	27.1	1%	0.005	17%	0.169	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-132.5	118.3	177.9	-63.1	150.2	0	0	0	106.9	I434 N439 S440 T442 V450 E453 I454 L461 D462 L463	I434-I437 HydrophobicContact CG2-CD1 4.01Å; I434-I437 HydrophobicContact CG2-CG1 3.73Å; I437-N439 PolarHBondContact O-N 3.21Å; I437-S440 PolarHBondContact N-O 2.9Å; I437-S440 WeakPolarHBondContact O-CB 3.02Å; I437-S440 PolarHBondContact O-N 2.98Å; I437-T442 HydrophobicContact CD1-CG2 3.83Å; I437-T442 HydrophobicContact CG1-CG2 4.35Å; I437-V450 HydrophobicContact CD1-CG1 3.73Å; I437-E453 HydrophobicContact CB-CB 3.9Å; I437-E453 HydrophobicContact CD1-CB 3.91Å; I437-E453 HydrophobicContact CD1-CG 4.4Å; I437-E453 HydrophobicContact CG2-CB 3.62Å; I437-I454 HydrophobicContact CD1-CD1 4.15Å; I437-I454 HydrophobicContact CD1-CG1 3.8Å; I437-I454 HydrophobicContact CG1-CG1 4.22Å; I437-I454 HydrophobicContact CG2-CG1 4.19Å; I437-L461 HydrophobicContact CG2-CD1 3.69Å; I437-D462 CarbonylContact C-O 3.49Å; I437-D462 WeakPolarHBondContact CA-O 3.36Å; I437-L463 HydrophobicContact CB-CD2 4.32Å; I437-L463 HydrophobicContact CG1-CD2 3.65Å; I437-L463 HydrophobicContact CG2-CD2 4.36Å
438	C	94.3	Very high	93.5	Very high	49 Å²	49	28.9 Å²	28.9	33%	0.331	17%	0.168	S	C	.	.	T	Hydrogen-bonded Turn	trans	44.1	58	179	-59.2	0	0	0	0	112.8	S440 D462	C438-S440 PolarHBondContact O-N 3.3Å; C438-S440 VanDerWaalsContact O-N 3.12Å; C438-D462 PolarHBondContact N-O 3.47Å; C438-D462 PolarHBondContact SG-N 2.78Å; C438-D462 VanDerWaalsContact SG-N 3.4Å
439	N	87.8	Confident	93.5	Very high	108 Å²	108	33 Å²	33	58%	0.578	19%	0.187	S	C	*	.	T	Hydrogen-bonded Turn	trans	66	-6.1	-175.3	-60.6	18.5	0	0	0	116.5	I437	I437-N439 PolarHBondContact O-N 3.21Å
440	S	91	Very high	93.5	Very high	34 Å²	34	29.4 Å²	29.4	24%	0.238	17%	0.17	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-92.6	123.2	177.6	-150.6	0	0	0	0	111.7	S436 I437 C438 K445 E453	S436-S440 CarbonylContact C-O 3.57Å; S436-S440 VanDerWaalsContact CA-O 3.23Å; S436-S440 WeakPolarHBondContact CA-O 3.46Å; S436-S440 WeakPolarHBondContact CB-O 3.43Å; I437-S440 PolarHBondContact N-O 2.9Å; I437-S440 WeakPolarHBondContact O-CB 3.02Å; I437-S440 PolarHBondContact O-N 2.98Å; C438-S440 PolarHBondContact O-N 3.3Å; C438-S440 VanDerWaalsContact O-N 3.12Å; S440-K445 PolarHBondContact OG-NZ 3.38Å; S440-E453 WeakPolarHBondContact CB-OE2 3.47Å
441	L	92.3	Very high	93.5	Very high	43 Å²	43	28.9 Å²	28.9	23%	0.225	16%	0.164	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-62.8	150.1	176.1	-67.3	-178.3	0	0	0	111.9	L103 V252 K445	L103-L441 HydrophobicContact CD1-CD1 3.86Å; L103-L441 HydrophobicContact CD1-CD2 4.02Å; L103-L441 HydrophobicContact CD2-CD2 3.81Å; V252-L441 HydrophobicContact CG2-CD1 3.79Å; L441-K445 WeakPolarHBondContact O-CD 3.47Å; L441-K445 WeakPolarHBondContact O-CE 3.39Å; L441-K445 PolarHBondContact O-NZ 3.24Å
442	T	92.5	Very high	93.5	Very high	1 Å²	1	30 Å²	30	1%	0.006	17%	0.173	C	C	.	.			trans	-91	-13.2	174.4	57.3	0	0	0	0	113.8	P412 I434 V435 I437 G444 K445 V450	P412-T442 HydrophobicContact CG-CG2 3.91Å; I434-T442 HydrophobicContact CB-CG2 4.42Å; I434-T442 HydrophobicContact CG2-CG2 3.97Å; I434-T442 WeakPolarHBondContact O-CB 3.35Å; I434-T442 WeakPolarHBondContact O-CG2 3.05Å; I434-T442 PolarHBondContact O-OG1 3.21Å; V435-T442 PolarHBondContact O-N 3.35Å; V435-T442 PolarHBondContact O-OG1 2.88Å; V435-T442 VanDerWaalsContact O-OG1 3.05Å; I437-T442 HydrophobicContact CD1-CG2 3.83Å; I437-T442 HydrophobicContact CG1-CG2 4.35Å; T442-G444 PolarHBondContact O-N 3.11Å; T442-K445 WeakPolarHBondContact O-CB 3.38Å; T442-K445 PolarHBondContact O-N 3.18Å; T442-V450 HydrophobicContact CG2-CG2 4.45Å
443	V	89.4	Confident	93.5	Very high	41 Å²	41	30.9 Å²	30.9	25%	0.248	18%	0.177	C	C	.	.	T	Hydrogen-bonded Turn	trans	-56.8	128.7	-177.5	-172	0	0	0	0	110.3	Q96 M99 L103 K445	Q96-V443 HydrophobicContact CG-CG1 4.12Å; M99-V443 HydrophobicContact CB-CG1 4.21Å; M99-V443 HydrophobicContact CB-CG2 3.75Å; M99-V443 HydrophobicContact CE-CG2 3.9Å; M99-V443 HydrophobicContact CG-CG2 4.25Å; L103-V443 HydrophobicContact CD1-CG2 4.04Å; V443-K445 PolarHBondContact O-N 3.34Å
444	G	87.9	Confident	93.5	Very high	34 Å²	34	30.8 Å²	30.8	35%	0.351	18%	0.177	S	C	.	.	T	Hydrogen-bonded Turn	trans	73.7	-6.7	-178.5	0	0	0	0	0	116.1	A406 T442	A406-G444 WeakPolarHBondContact CB-O 3.5Å; T442-G444 PolarHBondContact O-N 3.11Å
445	K	91.7	Very high	93.4	Very high	32 Å²	32	34 Å²	34	14%	0.139	19%	0.194	C	C	.	.			trans	-76.8	144.5	179.3	-67	-169.6	179.5	175.9	0	112.5	A406 S440 L441 T442 V443 Q449 V450 E453	A406-K445 WeakPolarHBondContact CB-O 3.32Å; A406-K445 PolarHBondContact N-O 3.15Å; S440-K445 PolarHBondContact OG-NZ 3.38Å; L441-K445 WeakPolarHBondContact O-CD 3.47Å; L441-K445 WeakPolarHBondContact O-CE 3.39Å; L441-K445 PolarHBondContact O-NZ 3.24Å; T442-K445 WeakPolarHBondContact O-CB 3.38Å; T442-K445 PolarHBondContact O-N 3.18Å; V443-K445 PolarHBondContact O-N 3.34Å; K445-Q449 VanDerWaalsContact CA-OE1 3.28Å; K445-Q449 HydrophobicContact CB-CB 4.02Å; K445-Q449 HydrophobicContact CD-CB 4.4Å; K445-Q449 HydrophobicContact CG-CB 4.42Å; K445-V450 HydrophobicContact CB-CG2 3.8Å; K445-E453 HydrophobicContact CD-CG 4.34Å; K445-E453 IonicContact NZ-OE1 3.16Å; K445-E453 PolarHBondContact NZ-OE1 2.99Å; K445-E453 IonicContact NZ-OE2 2.8Å
446	T	93.8	Very high	93.4	Very high	47 Å²	47	41.7 Å²	41.7	29%	0.288	22%	0.222	S	C	.	.			trans	-74.3	162.9	169.6	65.2	0	0	0	0	111.4	E407 E448 Q449 V450	E407-T446 WeakPolarHBondContact OE1-CB 3.37Å; E407-T446 VanDerWaalsContact OE2-CA 3.3Å; E407-T446 WeakPolarHBondContact OE2-CA 3.48Å; T446-E448 VanDerWaalsContact C-N 3.33Å; T446-E448 PolarHBondContact O-N 3.1Å; T446-Q449 WeakPolarHBondContact O-CB 3.47Å; T446-Q449 PolarHBondContact O-N 3.28Å; T446-Q449 VanDerWaalsContact O-N 3.08Å; T446-Q449 VanDerWaalsContact OG1-CG 3.27Å; T446-Q449 WeakPolarHBondContact OG1-CG 3.3Å; T446-Q449 PolarHBondContact OG1-N 2.78Å; T446-V450 WeakPolarHBondContact O-CG2 3.15Å; T446-V450 PolarHBondContact O-N 2.79Å
447	Y	93.6	Very high	93.3	Very high	0 Å²	0	42 Å²	42	0%	0	23%	0.226	C	C	.	.	H	α-helix	trans	-55.5	-45.8	177.6	176.6	-88.7	0	0	0	112.7	L20 T22 F402 G404 E407 Y408 Q449 V450 K451	L20-Y447 HydrophobicContact CB-CE1 4.2Å; L20-Y447 PolarHBondContact O-OH 2.98Å; T22-Y447 WeakPolarHBondContact CB-OH 3.43Å; T22-Y447 PolarHBondContact N-OH 3.04Å; T22-Y447 PolarHBondContact OG1-OH 3.19Å; F402-Y447 HydrophobicContact CD2-CD2 4.08Å; F402-Y447 AromaticContact CD2-CE2 3.92Å; F402-Y447 HydrophobicContact CD2-CE2 3.92Å; F402-Y447 HydrophobicContact CE1-CE2 4.11Å; F402-Y447 AromaticContact CE2-CD2 3.33Å; F402-Y447 HydrophobicContact CE2-CD2 3.33Å; F402-Y447 AromaticContact CE2-CE2 3.42Å; F402-Y447 HydrophobicContact CE2-CE2 3.42Å; F402-Y447 VanDerWaalsContact CE2-CE2 3.42Å; F402-Y447 HydrophobicContact CE2-CG 4.14Å; F402-Y447 HydrophobicContact CG-CE2 4.45Å; F402-Y447 AromaticContact CZ-CD2 3.69Å; F402-Y447 HydrophobicContact CZ-CD2 3.69Å; F402-Y447 HydrophobicContact CZ-CE1 4.46Å; F402-Y447 AromaticContact CZ-CE2 3.53Å; F402-Y447 HydrophobicContact CZ-CE2 3.53Å; F402-Y447 HydrophobicContact CZ-CG 4.22Å; F402-Y447 AromaticContact CZ-CZ 3.93Å; G404-Y447 WeakPolarHBondContact O-CD2 3.42Å; E407-Y447 WeakPolarHBondContact OE1-CB 3.48Å; E407-Y447 PolarHBondContact OE1-N 2.95Å; E407-Y447 PolarHBondContact OE2-N 3.45Å; Y408-Y447 VanDerWaalsContact CE2-CB 3.49Å; Y408-Y447 HydrophobicContact CE2-CD2 4.28Å; Y408-Y447 HydrophobicContact CE2-CG 4.02Å; Y447-Q449 VanDerWaalsContact C-N 3.32Å; Y447-Q449 PolarHBondContact O-N 2.94Å; Y447-V450 PolarHBondContact O-N 2.94Å; Y447-K451 HydrophobicContact CE1-CD 4.17Å; Y447-K451 VanDerWaalsContact O-CB 3.31Å; Y447-K451 WeakPolarHBondContact O-CB 3.49Å; Y447-K451 PolarHBondContact O-N 3.4Å
448	E	94.4	Very high	93.2	Very high	71 Å²	71	43.3 Å²	43.3	33%	0.332	24%	0.239	S	C	.	.	H	α-helix	trans	-67.8	-30.3	177.6	-68.6	-63.4	148.5	0	0	112.3	T446 K451 A452	T446-E448 VanDerWaalsContact C-N 3.33Å; T446-E448 PolarHBondContact O-N 3.1Å; E448-K451 VanDerWaalsContact CD-NZ 3.26Å; E448-K451 IonicContact OE1-NZ 3.23Å; E448-K451 PolarHBondContact OE1-NZ 3.23Å; E448-K451 WeakPolarHBondContact OE2-CD 3.27Å; E448-K451 WeakPolarHBondContact OE2-CE 3.49Å; E448-K451 IonicContact OE2-NZ 3.89Å; E448-K451 PolarHBondContact OE2-NZ 3.3Å; E448-A452 VanDerWaalsContact O-CB 3.3Å; E448-A452 WeakPolarHBondContact O-CB 3.49Å; E448-A452 PolarHBondContact O-N 2.92Å
449	Q	95.6	Very high	93.2	Very high	92 Å²	92	43.7 Å²	43.7	43%	0.43	24%	0.238	S	C	.	.	H	α-helix	trans	-68.2	-46	170.8	-73.4	169.2	-11.4	0	0	111.7	K445 T446 Y447 K451 A452 E453	K445-Q449 VanDerWaalsContact CA-OE1 3.28Å; K445-Q449 HydrophobicContact CB-CB 4.02Å; K445-Q449 HydrophobicContact CD-CB 4.4Å; K445-Q449 HydrophobicContact CG-CB 4.42Å; T446-Q449 WeakPolarHBondContact O-CB 3.47Å; T446-Q449 PolarHBondContact O-N 3.28Å; T446-Q449 VanDerWaalsContact O-N 3.08Å; T446-Q449 VanDerWaalsContact OG1-CG 3.27Å; T446-Q449 WeakPolarHBondContact OG1-CG 3.3Å; T446-Q449 PolarHBondContact OG1-N 2.78Å; Y447-Q449 VanDerWaalsContact C-N 3.32Å; Y447-Q449 PolarHBondContact O-N 2.94Å; Q449-K451 VanDerWaalsContact C-N 3.33Å; Q449-K451 PolarHBondContact O-N 2.84Å; Q449-A452 WeakPolarHBondContact O-CB 3.36Å; Q449-A452 PolarHBondContact O-N 3.01Å; Q449-A452 VanDerWaalsContact O-N 3.15Å; Q449-E453 WeakPolarHBondContact O-CG 3.45Å; Q449-E453 PolarHBondContact O-N 2.68Å
450	V	95.9	Very high	93.6	Very high	0 Å²	0	44.2 Å²	44.2	0%	0	24%	0.237	C	C	.	.	H	α-helix	trans	-60.2	-42.7	176.3	174.6	0	0	0	0	111	F402 P412 I437 T442 K445 T446 Y447 E453 I454	F402-V450 HydrophobicContact CD2-CG1 4.09Å; F402-V450 HydrophobicContact CE1-CG1 4.35Å; F402-V450 HydrophobicContact CE2-CB 3.87Å; F402-V450 HydrophobicContact CE2-CG1 3.49Å; F402-V450 VanDerWaalsContact CE2-CG1 3.49Å; F402-V450 HydrophobicContact CZ-CB 3.94Å; F402-V450 HydrophobicContact CZ-CG1 3.65Å; P412-V450 HydrophobicContact CB-CG1 3.92Å; P412-V450 HydrophobicContact CB-CG2 4.29Å; P412-V450 HydrophobicContact CG-CG1 4.24Å; P412-V450 HydrophobicContact CG-CG2 4.08Å; I437-V450 HydrophobicContact CD1-CG1 3.73Å; T442-V450 HydrophobicContact CG2-CG2 4.45Å; K445-V450 HydrophobicContact CB-CG2 3.8Å; T446-V450 WeakPolarHBondContact O-CG2 3.15Å; T446-V450 PolarHBondContact O-N 2.79Å; Y447-V450 PolarHBondContact O-N 2.94Å; V450-E453 WeakPolarHBondContact O-CB 3.32Å; V450-E453 PolarHBondContact O-N 3.23Å; V450-I454 HydrophobicContact CG1-CD1 4.31Å; V450-I454 WeakPolarHBondContact O-CG1 3.4Å; V450-I454 PolarHBondContact O-N 2.8Å
451	K	95.7	Very high	93.8	Very high	39 Å²	39	42.6 Å²	42.6	17%	0.17	23%	0.226	C	C	.	.	H	α-helix	trans	-61.7	-42.4	173	176.8	177.3	160.8	-151.9	0	112	T22 F24 F402 Y447 E448 Q449 E453 I454 L455	T22-K451 HydrophobicContact CG2-CD 4.14Å; T22-K451 HydrophobicContact CG2-CG 4.5Å; F24-K451 HydrophobicContact CE1-CG 4.37Å; F402-K451 HydrophobicContact CE1-CB 4.21Å; F402-K451 HydrophobicContact CZ-CB 4.03Å; Y447-K451 HydrophobicContact CE1-CD 4.17Å; Y447-K451 VanDerWaalsContact O-CB 3.31Å; Y447-K451 WeakPolarHBondContact O-CB 3.49Å; Y447-K451 PolarHBondContact O-N 3.4Å; E448-K451 VanDerWaalsContact CD-NZ 3.26Å; E448-K451 IonicContact OE1-NZ 3.23Å; E448-K451 PolarHBondContact OE1-NZ 3.23Å; E448-K451 WeakPolarHBondContact OE2-CD 3.27Å; E448-K451 WeakPolarHBondContact OE2-CE 3.49Å; E448-K451 IonicContact OE2-NZ 3.89Å; E448-K451 PolarHBondContact OE2-NZ 3.3Å; Q449-K451 VanDerWaalsContact C-N 3.33Å; Q449-K451 PolarHBondContact O-N 2.84Å; K451-E453 VanDerWaalsContact C-N 3.34Å; K451-E453 PolarHBondContact O-N 2.79Å; K451-I454 PolarHBondContact O-N 2.97Å; K451-L455 HydrophobicContact CG-CD1 4.13Å; K451-L455 WeakPolarHBondContact O-CG 3.45Å; K451-L455 PolarHBondContact O-N 3.27Å
452	A	95.6	Very high	94	Very high	26 Å²	26	42.4 Å²	42.4	22%	0.215	23%	0.225	C	C	.	.	H	α-helix	trans	-64.2	-34.4	175.9	0	0	0	0	0	112.9	E448 Q449 R456	E448-A452 VanDerWaalsContact O-CB 3.3Å; E448-A452 WeakPolarHBondContact O-CB 3.49Å; E448-A452 PolarHBondContact O-N 2.92Å; Q449-A452 WeakPolarHBondContact O-CB 3.36Å; Q449-A452 PolarHBondContact O-N 3.01Å; Q449-A452 VanDerWaalsContact O-N 3.15Å; A452-R456 VanDerWaalsContact O-CB 3.28Å; A452-R456 WeakPolarHBondContact O-CB 3.48Å; A452-R456 PolarHBondContact O-N 3.16Å
453	E	95.9	Very high	94.3	Very high	18 Å²	18	42.3 Å²	42.3	8%	0.084	23%	0.225	C	C	.	.	H	α-helix	trans	-59.7	-49.5	169.3	-58.3	-58.3	140.1	0	0	111.4	I437 S440 K445 Q449 V450 K451 L455 R456 A457	I437-E453 HydrophobicContact CB-CB 3.9Å; I437-E453 HydrophobicContact CD1-CB 3.91Å; I437-E453 HydrophobicContact CD1-CG 4.4Å; I437-E453 HydrophobicContact CG2-CB 3.62Å; S440-E453 WeakPolarHBondContact CB-OE2 3.47Å; K445-E453 HydrophobicContact CD-CG 4.34Å; K445-E453 IonicContact NZ-OE1 3.16Å; K445-E453 PolarHBondContact NZ-OE1 2.99Å; K445-E453 IonicContact NZ-OE2 2.8Å; Q449-E453 WeakPolarHBondContact O-CG 3.45Å; Q449-E453 PolarHBondContact O-N 2.68Å; V450-E453 WeakPolarHBondContact O-CB 3.32Å; V450-E453 PolarHBondContact O-N 3.23Å; K451-E453 VanDerWaalsContact C-N 3.34Å; K451-E453 PolarHBondContact O-N 2.79Å; E453-L455 VanDerWaalsContact C-N 3.31Å; E453-L455 PolarHBondContact O-N 3.39Å; E453-R456 PolarHBondContact O-N 3.31Å; E453-R456 IonicContact OE1-CZ 2.66Å; E453-R456 IonicContact OE1-NH1 2.78Å; E453-R456 IonicContact OE1-NH2 3.22Å; E453-R456 PolarHBondContact OE1-NH2 3.18Å; E453-R456 IonicContact OE2-CZ 3.74Å; E453-R456 IonicContact OE2-NH1 3.71Å; E453-R456 PolarHBondContact OE2-NH1 2.81Å; E453-R456 IonicContact OE2-NH2 2.84Å; E453-R456 PolarHBondContact OE2-NH2 3.33Å; E453-A457 PolarHBondContact O-N 3.04Å; E453-A457 VanDerWaalsContact O-N 3.1Å
454	I	95.7	Very high	94.6	Very high	1 Å²	1	42.3 Å²	42.3	1%	0.005	22%	0.223	C	C	.	.	H	α-helix	trans	-65.4	-34.4	-176.9	-64	165.5	0	0	0	111.8	F24 F400 F402 I437 V450 K451 L461	F24-I454 HydrophobicContact CD1-CG2 4.27Å; F24-I454 HydrophobicContact CE1-CB 4.08Å; F24-I454 HydrophobicContact CE1-CG2 3.6Å; F24-I454 HydrophobicContact CE2-CD1 4.16Å; F24-I454 HydrophobicContact CE2-CG2 3.88Å; F24-I454 HydrophobicContact CZ-CB 3.79Å; F24-I454 HydrophobicContact CZ-CD1 3.76Å; F24-I454 HydrophobicContact CZ-CG1 4.37Å; F24-I454 HydrophobicContact CZ-CG2 3.38Å; F400-I454 HydrophobicContact CE2-CD1 4.34Å; F400-I454 HydrophobicContact CZ-CD1 4.16Å; F400-I454 HydrophobicContact CZ-CG2 4.5Å; F402-I454 HydrophobicContact CD1-CD1 3.98Å; F402-I454 HydrophobicContact CE1-CD1 3.9Å; I437-I454 HydrophobicContact CD1-CD1 4.15Å; I437-I454 HydrophobicContact CD1-CG1 3.8Å; I437-I454 HydrophobicContact CG1-CG1 4.22Å; I437-I454 HydrophobicContact CG2-CG1 4.19Å; V450-I454 HydrophobicContact CG1-CD1 4.31Å; V450-I454 WeakPolarHBondContact O-CG1 3.4Å; V450-I454 PolarHBondContact O-N 2.8Å; K451-I454 PolarHBondContact O-N 2.97Å; I454-L461 HydrophobicContact CG1-CD1 4.4Å; I454-L461 HydrophobicContact CG2-CD1 4.33Å; I454-L461 HydrophobicContact CG2-CD2 3.89Å
455	L	93.4	Very high	94.9	Very high	69 Å²	69	40.7 Å²	40.7	36%	0.361	21%	0.206	S	C	.	.	H	α-helix	trans	-71.7	-42.8	174.1	-68.6	172.4	0	0	0	111.7	F24 I29 K451 E453 A457 G458	F24-L455 HydrophobicContact CD1-CD2 4.14Å; F24-L455 HydrophobicContact CE1-CD2 4.22Å; F24-L455 HydrophobicContact CE1-CG 4.37Å; I29-L455 HydrophobicContact CD1-CD1 4.49Å; K451-L455 HydrophobicContact CG-CD1 4.13Å; K451-L455 WeakPolarHBondContact O-CG 3.45Å; K451-L455 PolarHBondContact O-N 3.27Å; E453-L455 VanDerWaalsContact C-N 3.31Å; E453-L455 PolarHBondContact O-N 3.39Å; L455-A457 PolarHBondContact O-N 3.39Å; L455-G458 PolarHBondContact O-N 3.42Å
456	R	94.2	Very high	95	Very high	161 Å²	161	39.4 Å²	39.4	61%	0.608	20%	0.2	S	C	*	.	H	α-helix	trans	-64.2	-25.6	179.4	-157.1	-165.8	-42.4	116.2	4.4	113.2	A452 E453 G458	A452-R456 VanDerWaalsContact O-CB 3.28Å; A452-R456 WeakPolarHBondContact O-CB 3.48Å; A452-R456 PolarHBondContact O-N 3.16Å; E453-R456 PolarHBondContact O-N 3.31Å; E453-R456 IonicContact OE1-CZ 2.66Å; E453-R456 IonicContact OE1-NH1 2.78Å; E453-R456 IonicContact OE1-NH2 3.22Å; E453-R456 PolarHBondContact OE1-NH2 3.18Å; E453-R456 IonicContact OE2-CZ 3.74Å; E453-R456 IonicContact OE2-NH1 3.71Å; E453-R456 PolarHBondContact OE2-NH1 2.81Å; E453-R456 IonicContact OE2-NH2 2.84Å; E453-R456 PolarHBondContact OE2-NH2 3.33Å; R456-G458 PolarHBondContact O-N 3.33Å
457	A	93.2	Very high	95	Very high	16 Å²	16	39.4 Å²	39.4	13%	0.132	20%	0.195	C	C	.	.	T	Hydrogen-bonded Turn	trans	-60.9	-18.5	172.2	0	0	0	0	0	113.8	E453 L455 N459 E460 L461	E453-A457 PolarHBondContact O-N 3.04Å; E453-A457 VanDerWaalsContact O-N 3.1Å; L455-A457 PolarHBondContact O-N 3.39Å; A457-N459 PolarHBondContact O-N 3.49Å; A457-E460 CarbonylContact O-C 3.56Å; A457-E460 PolarHBondContact O-N 2.77Å; A457-E460 VanDerWaalsContact O-O 3.1Å; A457-L461 HydrophobicContact CB-CB 4.06Å; A457-L461 HydrophobicContact CB-CD1 3.66Å; A457-L461 HydrophobicContact CB-CG 4.48Å
458	G	93.1	Very high	94.9	Very high	28 Å²	28	46.6 Å²	46.6	29%	0.289	22%	0.222	S	C	.	.	T	Hydrogen-bonded Turn	trans	63.8	-101.8	171.5	0	0	0	0	0	112.7	R391 W398 L455 R456	R391-G458 VanDerWaalsContact CZ-O 3.27Å; R391-G458 PolarHBondContact NE-O 2.96Å; R391-G458 PolarHBondContact NH2-O 3.39Å; W398-G458 WeakPolarHBondContact CZ2-O 3.3Å; L455-G458 PolarHBondContact O-N 3.42Å; R456-G458 PolarHBondContact O-N 3.33Å
459	N	94.9	Very high	94.7	Very high	56 Å²	56	43.4 Å²	43.4	30%	0.299	21%	0.209	S	C	.	.	T	Hydrogen-bonded Turn	trans	-115.2	1	-179.7	-68.8	-26.7	0	0	0	114.1	R391 S394 W398 A457	R391-N459 HydrophobicContact CG-CB 3.88Å; R391-N459 WeakPolarHBondContact CG-OD1 3.35Å; R391-N459 PolarHBondContact N-O 3.11Å; R391-N459 PolarHBondContact NE-OD1 3.15Å; S394-N459 PolarHBondContact OG-ND2 3.39Å; S394-N459 PolarHBondContact OG-OD1 2.84Å; W398-N459 WeakPolarHBondContact CH2-O 3.18Å; A457-N459 PolarHBondContact O-N 3.49Å
460	E	95.1	Very high	94.6	Very high	119 Å²	119	39.2 Å²	39.2	56%	0.556	19%	0.189	S	C	*	.	E	Extended strand (participates in β ladder)	trans	-130.6	99.7	176.8	-60.4	-151.9	-159	0	0	110.3	R390 A457	R390-E460 VanDerWaalsContact CD-CG 3.5Å; R390-E460 IonicContact CZ-OE2 3.76Å; R390-E460 VanDerWaalsContact NE-CD 3.28Å; R390-E460 IonicContact NE-OE2 2.87Å; R390-E460 PolarHBondContact NE-OE2 3.01Å; R390-E460 IonicContact NH2-OE2 2.58Å; R390-E460 PolarHBondContact NH2-OE2 3.39Å; A457-E460 CarbonylContact O-C 3.56Å; A457-E460 PolarHBondContact O-N 2.77Å; A457-E460 VanDerWaalsContact O-O 3.1Å
461	L	96.9	Very high	94.4	Very high	0 Å²	0	41.2 Å²	41.2	0%	0	20%	0.2	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-111.6	110	-176.1	174.6	64.9	0	0	0	110.4	L389 W398 F400 I437 I454 A457 L463	L389-L461 HydrophobicContact CB-CB 4.2Å; L389-L461 WeakPolarHBondContact CB-O 3.38Å; L389-L461 HydrophobicContact CD1-CD2 4.01Å; L389-L461 PolarHBondContact N-O 3.45Å; L389-L461 PolarHBondContact O-N 2.85Å; W398-L461 HydrophobicContact CD2-CB 4.33Å; W398-L461 HydrophobicContact CD2-CD2 3.8Å; W398-L461 HydrophobicContact CE3-CB 4.48Å; W398-L461 HydrophobicContact CE3-CD2 4.45Å; W398-L461 HydrophobicContact CG-CD2 3.89Å; W398-L461 HydrophobicContact CH2-CB 3.59Å; W398-L461 HydrophobicContact CZ2-CB 3.4Å; W398-L461 VanDerWaalsContact CZ2-CB 3.4Å; W398-L461 HydrophobicContact CZ2-CD2 4.2Å; W398-L461 HydrophobicContact CZ2-CG 4.44Å; W398-L461 HydrophobicContact CZ3-CB 4.16Å; F400-L461 HydrophobicContact CE1-CD2 3.97Å; F400-L461 HydrophobicContact CZ-CD2 4.21Å; I437-L461 HydrophobicContact CG2-CD1 3.69Å; I454-L461 HydrophobicContact CG1-CD1 4.4Å; I454-L461 HydrophobicContact CG2-CD1 4.33Å; I454-L461 HydrophobicContact CG2-CD2 3.89Å; A457-L461 HydrophobicContact CB-CB 4.06Å; A457-L461 HydrophobicContact CB-CD1 3.66Å; A457-L461 HydrophobicContact CB-CG 4.48Å; L461-L463 HydrophobicContact CD1-CD2 3.8Å; L461-L463 HydrophobicContact CD1-CG 4.37Å; L461-L463 HydrophobicContact CD2-CD1 4.44Å; L461-L463 HydrophobicContact CD2-CD2 4.46Å; L461-L463 HydrophobicContact CG-CD2 4.05Å; L461-L463 HydrophobicContact CG-CG 4.09Å
462	D	96.6	Very high	94.2	Very high	39 Å²	39	42.4 Å²	42.4	21%	0.209	21%	0.208	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-101.3	123.7	177.9	-68.1	-0.6	0	0	0	108.9	I387 F388 R390 I437 C438	I387-D462 WeakPolarHBondContact O-CA 3.28Å; F388-D462 HydrophobicContact CD1-CB 4.43Å; F388-D462 WeakPolarHBondContact CD1-OD1 3.48Å; R390-D462 IonicContact CZ-OD1 3.02Å; R390-D462 IonicContact NH1-OD1 2.72Å; R390-D462 PolarHBondContact NH1-OD1 3.15Å; R390-D462 IonicContact NH2-OD1 3.5Å; R390-D462 PolarHBondContact NH2-OD1 2.99Å; R390-D462 IonicContact NH2-OD2 3.37Å; R390-D462 PolarHBondContact NH2-OD2 2.86Å; I437-D462 CarbonylContact C-O 3.49Å; I437-D462 WeakPolarHBondContact CA-O 3.36Å; C438-D462 PolarHBondContact N-O 3.47Å; C438-D462 PolarHBondContact SG-N 2.78Å; C438-D462 VanDerWaalsContact SG-N 3.4Å
463	L	97	Very high	94	Very high	0 Å²	0	46.6 Å²	46.6	0%	0	23%	0.226	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-121.8	135.4	-178	-60.3	177.6	0	0	0	109.8	T386 I387 L389 F400 I428 I434 S436 I437 L461 L465	T386-L463 CarbonylContact C-O 3.57Å; T386-L463 WeakPolarHBondContact CA-O 3.44Å; I387-L463 PolarHBondContact N-O 2.93Å; I387-L463 PolarHBondContact O-N 2.83Å; L389-L463 HydrophobicContact CD1-CD1 4.18Å; F400-L463 HydrophobicContact CE1-CD1 4.43Å; F400-L463 HydrophobicContact CZ-CD1 4.2Å; I428-L463 HydrophobicContact CD1-CD1 4.01Å; I434-L463 HydrophobicContact CG2-CD2 4.18Å; S436-L463 WeakPolarHBondContact O-CA 3.47Å; I437-L463 HydrophobicContact CB-CD2 4.32Å; I437-L463 HydrophobicContact CG1-CD2 3.65Å; I437-L463 HydrophobicContact CG2-CD2 4.36Å; L461-L463 HydrophobicContact CD1-CD2 3.8Å; L461-L463 HydrophobicContact CD1-CG 4.37Å; L461-L463 HydrophobicContact CD2-CD1 4.44Å; L461-L463 HydrophobicContact CD2-CD2 4.46Å; L461-L463 HydrophobicContact CG-CD2 4.05Å; L461-L463 HydrophobicContact CG-CG 4.09Å; L463-L465 HydrophobicContact CB-CD2 4Å; L463-L465 HydrophobicContact CB-CG 4.19Å; L463-L465 HydrophobicContact CD1-CD2 4.39Å
464	I	95.5	Very high	93.8	Very high	41 Å²	41	48.1 Å²	48.1	21%	0.21	23%	0.233	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-103.7	124.1	159.5	-54	178.7	0	0	0	107.7	M106 T386 V435 S436	M106-I464 HydrophobicContact CE-CG2 3.63Å; T386-I464 HydrophobicContact CG2-CG1 4.14Å; V435-I464 WeakPolarHBondContact CB-O 3.06Å; V435-I464 PolarHBondContact N-O 3.16Å; S436-I464 PolarHBondContact N-O 2.83Å; S436-I464 PolarHBondContact O-N 3.39Å; S436-I464 VanDerWaalsContact O-N 3.12Å; S436-I464 WeakPolarHBondContact OG-CB 3.42Å; S436-I464 WeakPolarHBondContact OG-CD1 3.48Å; S436-I464 VanDerWaalsContact OG-CG1 3.28Å; S436-I464 WeakPolarHBondContact OG-CG1 3.45Å
465	L	95.5	Very high	93.6	Very high	0 Å²	0	48 Å²	48	0%	0	23%	0.232	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-119.4	152.2	-174.4	-57.7	-174.6	0	0	0	111.5	S384 F385 I387 I428 D432 V433 I434 L463	S384-L465 CarbonylContact C-O 3.59Å; S384-L465 VanDerWaalsContact CA-O 3.24Å; S384-L465 WeakPolarHBondContact CA-O 3.42Å; F385-L465 HydrophobicContact CD1-CB 4.06Å; F385-L465 WeakPolarHBondContact CD1-O 3.44Å; F385-L465 HydrophobicContact CE1-CB 3.54Å; F385-L465 HydrophobicContact CE1-CD1 4.38Å; F385-L465 HydrophobicContact CE2-CD1 4.49Å; F385-L465 HydrophobicContact CZ-CB 3.9Å; F385-L465 HydrophobicContact CZ-CD1 3.88Å; F385-L465 HydrophobicContact CZ-CG 4.47Å; F385-L465 PolarHBondContact N-O 3.23Å; F385-L465 PolarHBondContact O-N 3.33Å; I387-L465 HydrophobicContact CD1-CD1 3.63Å; I387-L465 HydrophobicContact CG1-CD1 4.46Å; I428-L465 HydrophobicContact CD1-CD1 4.21Å; I428-L465 HydrophobicContact CG1-CD1 3.96Å; I428-L465 HydrophobicContact CG2-CD1 4.45Å; D432-L465 HydrophobicContact CB-CD1 4.3Å; V433-L465 CarbonylContact O-C 3.56Å; V433-L465 WeakPolarHBondContact O-CA 3.39Å; I434-L465 HydrophobicContact CB-CD2 4.1Å; I434-L465 HydrophobicContact CG1-CD2 3.82Å; I434-L465 HydrophobicContact CG2-CD2 4.17Å; L463-L465 HydrophobicContact CB-CD2 4Å; L463-L465 HydrophobicContact CB-CG 4.19Å; L463-L465 HydrophobicContact CD1-CD2 4.39Å
466	I	93.7	Very high	93.4	Very high	4 Å²	4	46.2 Å²	46.2	2%	0.021	23%	0.23	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-105.5	121.6	163.5	-60.2	148.5	0	0	0	107.9	I102 D432 V433 V435 R468 G469	I102-I466 HydrophobicContact CB-CD1 4.49Å; I102-I466 HydrophobicContact CD1-CD1 4.16Å; I102-I466 HydrophobicContact CG2-CD1 3.61Å; I102-I466 HydrophobicContact CG2-CG1 4.03Å; D432-I466 WeakPolarHBondContact CA-O 3.32Å; V433-I466 HydrophobicContact CB-CB 4.3Å; V433-I466 HydrophobicContact CB-CD1 4.36Å; V433-I466 HydrophobicContact CG1-CD1 4.04Å; V433-I466 PolarHBondContact N-O 2.74Å; V433-I466 PolarHBondContact O-N 3.47Å; V435-I466 HydrophobicContact CG2-CD1 3.36Å; V435-I466 HydrophobicContact CG2-CG1 3.54Å; I466-R468 PolarHBondContact O-N 3.09Å; I466-G469 PolarHBondContact O-N 3.34Å
467	R	94	Very high	93.2	Very high	48 Å²	48	46.1 Å²	46.1	18%	0.181	24%	0.236	C	C	.	.	T	Hydrogen-bonded Turn	trans	-63	124.2	179.6	176	49.4	48.8	108.7	-5.2	110.2	G382 P383 F385 G427 E429 D432 G469	G382-R467 VanDerWaalsContact CA-O 3.26Å; G382-R467 WeakPolarHBondContact CA-O 3.24Å; G382-R467 PolarHBondContact N-O 3.47Å; P383-R467 WeakPolarHBondContact O-CB 3.48Å; P383-R467 PolarHBondContact O-N 3.39Å; F385-R467 HydrophobicContact CD1-CB 4.29Å; F385-R467 HydrophobicContact CE1-CB 3.93Å; G427-R467 PolarHBondContact O-NH2 2.87Å; E429-R467 IonicContact OE1-CZ 3.14Å; E429-R467 IonicContact OE1-NH1 3.66Å; E429-R467 PolarHBondContact OE1-NH1 2.87Å; E429-R467 IonicContact OE2-CZ 3.39Å; E429-R467 IonicContact OE2-NE 3.6Å; E429-R467 IonicContact OE2-NH1 3.92Å; E429-R467 PolarHBondContact OE2-NH1 3.39Å; D432-R467 VanDerWaalsContact OD1-CA 3.24Å; D432-R467 WeakPolarHBondContact OD1-CA 3.41Å; D432-R467 WeakPolarHBondContact OD1-CD 3.44Å; D432-R467 IonicContact OD1-CZ 2.68Å; D432-R467 IonicContact OD1-NE 3.44Å; D432-R467 PolarHBondContact OD1-NE 3.22Å; D432-R467 IonicContact OD2-CZ 3.31Å; D432-R467 IonicContact OD2-NE 3.74Å; D432-R467 PolarHBondContact OD2-NE 3.11Å; D432-R467 IonicContact OD2-NH2 2.93Å; D432-R467 PolarHBondContact OD2-NH2 3.39Å; R467-G469 VanDerWaalsContact C-N 3.3Å; R467-G469 PolarHBondContact O-N 3.39Å
468	R	91.5	Very high	92.9	Very high	151 Å²	151	48.7 Å²	48.7	57%	0.57	25%	0.247	S	C	*	.	T	Hydrogen-bonded Turn	trans	52.2	42.4	179.5	-59.2	173.6	-170	-171.7	1.5	114	S378 E429 G431 D432 I466 V470	S378-R468 WeakPolarHBondContact CB-O 3.28Å; E429-R468 IonicContact OE2-NE 3.48Å; E429-R468 IonicContact OE2-NH2 2.9Å; E429-R468 PolarHBondContact OE2-NH2 2.73Å; G431-R468 CarbonylContact O-C 3.48Å; G431-R468 WeakPolarHBondContact O-CA 3.43Å; D432-R468 PolarHBondContact OD1-N 3.01Å; I466-R468 PolarHBondContact O-N 3.09Å; R468-V470 PolarHBondContact O-N 3.39Å
469	G	90.2	Very high	92.6	Very high	4 Å²	4	47.3 Å²	47.3	4%	0.041	23%	0.234	C	C	.	.			trans	-67.8	-12.6	176.6	0	0	0	0	0	114.6	S378 G431 I466 R467	S378-G469 PolarHBondContact N-O 3.48Å; G431-G469 PolarHBondContact O-N 2.99Å; I466-G469 PolarHBondContact O-N 3.34Å; R467-G469 VanDerWaalsContact C-N 3.3Å; R467-G469 PolarHBondContact O-N 3.39Å
470	V	92	Very high	92.2	Very high	4 Å²	4	48.1 Å²	48.1	2%	0.024	24%	0.242	C	C	.	.	B	Isolated β-bridge	trans	-122.3	134.3	177.9	164.5	0	0	0	0	111.3	V376 P411 F413 G431 V433 R468 L472 V475	V376-V470 HydrophobicContact CB-CG1 4.38Å; V376-V470 HydrophobicContact CG2-CG1 4.44Å; V376-V470 CarbonylContact O-C 3.54Å; V376-V470 WeakPolarHBondContact O-CA 3.41Å; P411-V470 HydrophobicContact CG-CG2 4.22Å; F413-V470 HydrophobicContact CB-CB 4.38Å; F413-V470 HydrophobicContact CB-CG2 3.86Å; F413-V470 HydrophobicContact CD1-CG1 4.37Å; F413-V470 HydrophobicContact CD1-CG2 3.88Å; F413-V470 HydrophobicContact CD2-CG1 4.44Å; F413-V470 HydrophobicContact CG-CB 4.27Å; F413-V470 HydrophobicContact CG-CG1 4.34Å; F413-V470 HydrophobicContact CG-CG2 3.91Å; G431-V470 PolarHBondContact O-N 3.37Å; V433-V470 HydrophobicContact CG2-CG2 3.72Å; R468-V470 PolarHBondContact O-N 3.39Å; V470-L472 PolarHBondContact O-N 2.78Å; V470-V475 HydrophobicContact CG1-CG2 3.4Å; V470-V475 VanDerWaalsContact CG1-CG2 3.4Å
471	D	92.3	Very high	91.7	Very high	41 Å²	41	45.7 Å²	45.7	22%	0.219	23%	0.23	C	C	.	.			trans	-77.8	101.5	171.8	-175.4	-9.5	0	0	0	110.3	V376 N473 K474 V475	V376-D471 PolarHBondContact O-N 3.46Å; D471-N473 PolarHBondContact O-N 2.66Å; D471-N473 VanDerWaalsContact O-N 3.15Å; D471-N473 VanDerWaalsContact OD1-CB 3.27Å; D471-N473 WeakPolarHBondContact OD1-CB 3.33Å; D471-N473 PolarHBondContact OD1-N 3.02Å; D471-N473 PolarHBondContact OD1-ND2 2.72Å; D471-K474 HydrophobicContact CB-CB 4.29Å; D471-K474 HydrophobicContact CB-CD 3.97Å; D471-K474 HydrophobicContact CB-CG 4.06Å; D471-K474 PolarHBondContact O-N 3.13Å; D471-K474 VanDerWaalsContact O-N 3.13Å; D471-K474 VanDerWaalsContact OD2-CE 3.26Å; D471-K474 WeakPolarHBondContact OD2-CE 3.49Å; D471-K474 WeakPolarHBondContact OD2-CG 3.46Å; D471-V475 PolarHBondContact O-N 3.4Å; D471-V475 VanDerWaalsContact O-N 3.11Å
472	L	91.7	Very high	91.1	Very high	64 Å²	64	46 Å²	46	34%	0.335	23%	0.231	S	C	.	.	H	α-helix	trans	-58.2	-24.8	179.4	-57.6	179.1	0	0	0	113.3	V430 V470 G476 M483	V430-L472 HydrophobicContact CG1-CD1 4.23Å; V430-L472 HydrophobicContact CG1-CD2 3.97Å; V470-L472 PolarHBondContact O-N 2.78Å; L472-G476 PolarHBondContact O-N 3.28Å; L472-M483 HydrophobicContact CD2-CE 3.41Å; L472-M483 VanDerWaalsContact CD2-CE 3.41Å; L472-M483 HydrophobicContact CD2-SD 4.05Å
473	N	92	Very high	90.2	Very high	114 Å²	114	46.4 Å²	46.4	61%	0.61	23%	0.233	S	C	*	.	H	α-helix	trans	-72.6	-44.7	177.4	-51.9	-82.9	0	0	0	110.6	D471 G476 Q477	D471-N473 PolarHBondContact O-N 2.66Å; D471-N473 VanDerWaalsContact O-N 3.15Å; D471-N473 VanDerWaalsContact OD1-CB 3.27Å; D471-N473 WeakPolarHBondContact OD1-CB 3.33Å; D471-N473 PolarHBondContact OD1-N 3.02Å; D471-N473 PolarHBondContact OD1-ND2 2.72Å; N473-G476 PolarHBondContact O-N 3.5Å; N473-Q477 VanDerWaalsContact O-CG 3.32Å; N473-Q477 WeakPolarHBondContact O-CG 3.38Å; N473-Q477 PolarHBondContact O-N 3.02Å
474	K	91.2	Very high	88.5	Confident	50 Å²	50	50.9 Å²	50.9	22%	0.217	26%	0.26	C	S	.	.	H	α-helix	trans	-63.3	-42.7	175.3	-62.3	178	-168	176	0	110.6	Q375 V376 E379 D471 Q477 I478	Q375-K474 WeakPolarHBondContact O-CD 3.4Å; Q375-K474 PolarHBondContact O-NZ 3.4Å; V376-K474 HydrophobicContact CB-CB 4.4Å; V376-K474 HydrophobicContact CG1-CB 3.9Å; E379-K474 IonicContact OE1-NZ 2.71Å; E379-K474 PolarHBondContact OE1-NZ 2.98Å; D471-K474 HydrophobicContact CB-CB 4.29Å; D471-K474 HydrophobicContact CB-CD 3.97Å; D471-K474 HydrophobicContact CB-CG 4.06Å; D471-K474 PolarHBondContact O-N 3.13Å; D471-K474 VanDerWaalsContact O-N 3.13Å; D471-K474 VanDerWaalsContact OD2-CE 3.26Å; D471-K474 WeakPolarHBondContact OD2-CE 3.49Å; D471-K474 WeakPolarHBondContact OD2-CG 3.46Å; K474-Q477 PolarHBondContact O-N 3.33Å; K474-I478 WeakPolarHBondContact O-CD1 3.36Å; K474-I478 WeakPolarHBondContact O-CG1 3.31Å; K474-I478 PolarHBondContact O-N 3.48Å; K474-I478 VanDerWaalsContact O-N 3.08Å
475	V	90.9	Very high	86.4	Confident	0 Å²	0	53.3 Å²	53.3	0%	0	28%	0.277	C	S	.	.	H	α-helix	trans	-63.2	-42.9	173.4	-175.9	0	0	0	0	111.8	I372 V376 F413 V470 D471 Q477 I478 A479 I482 M483	I372-V475 HydrophobicContact CD1-CG1 4.31Å; V376-V475 HydrophobicContact CB-CG2 3.72Å; V376-V475 HydrophobicContact CG1-CG2 3.78Å; V376-V475 HydrophobicContact CG2-CG2 4.13Å; F413-V475 HydrophobicContact CZ-CG1 4.23Å; F413-V475 HydrophobicContact CZ-CG2 4.32Å; V470-V475 HydrophobicContact CG1-CG2 3.4Å; V470-V475 VanDerWaalsContact CG1-CG2 3.4Å; D471-V475 PolarHBondContact O-N 3.4Å; D471-V475 VanDerWaalsContact O-N 3.11Å; V475-Q477 PolarHBondContact O-N 3.47Å; V475-I478 PolarHBondContact O-N 3.04Å; V475-A479 CarbonylContact O-C 3.49Å; V475-A479 WeakPolarHBondContact O-CA 3.25Å; V475-A479 PolarHBondContact O-N 3.19Å; V475-I482 HydrophobicContact CG1-CD1 4.38Å; V475-M483 HydrophobicContact CB-CE 3.82Å; V475-M483 HydrophobicContact CG1-CE 3.56Å; V475-M483 HydrophobicContact CG1-CG 4.28Å; V475-M483 HydrophobicContact CG2-CE 4.23Å
476	G	90.2	Very high	83.6	Confident	30 Å²	30	57.2 Å²	57.2	31%	0.309	30%	0.304	S	S	.	.	H	α-helix	trans	-61.6	-29.2	178.3	0	0	0	0	0	113.9	L472 N473 P480	L472-G476 PolarHBondContact O-N 3.28Å; N473-G476 PolarHBondContact O-N 3.5Å; G476-P480 WeakPolarHBondContact O-CB 3.42Å; G476-P480 WeakPolarHBondContact O-CD 3.3Å
477	Q	89.4	Confident	80.8	Confident	159 Å²	159	61.7 Å²	61.7	74%	0.743	34%	0.336	S	S	*	.	H	α-helix	trans	-78.1	-43.3	174.3	-68.9	166.6	27.6	0	0	112.5	N473 K474 V475	N473-Q477 VanDerWaalsContact O-CG 3.32Å; N473-Q477 WeakPolarHBondContact O-CG 3.38Å; N473-Q477 PolarHBondContact O-N 3.02Å; K474-Q477 PolarHBondContact O-N 3.33Å; V475-Q477 PolarHBondContact O-N 3.47Å
478	I	88.2	Confident	77.9	Confident	70 Å²	70	68.4 Å²	68.4	36%	0.359	37%	0.367	S	S	.	.	H	α-helix	trans	-79.1	-39.9	-175.6	-65.2	158.6	0	0	0	112	I372 Q375 V376 K474 V475	I372-I478 HydrophobicContact CG2-CD1 4.16Å; I372-I478 HydrophobicContact CG2-CG2 4.11Å; Q375-I478 HydrophobicContact CG-CD1 4.09Å; Q375-I478 VanDerWaalsContact NE2-CD1 3.32Å; V376-I478 HydrophobicContact CG1-CD1 3.57Å; K474-I478 WeakPolarHBondContact O-CD1 3.36Å; K474-I478 WeakPolarHBondContact O-CG1 3.31Å; K474-I478 PolarHBondContact O-N 3.48Å; K474-I478 VanDerWaalsContact O-N 3.08Å; V475-I478 PolarHBondContact O-N 3.04Å
479	A	86.6	Confident	75	Confident	0 Å²	0	63.8 Å²	63.8	0%	0	37%	0.366	C	S	.	.			trans	-149.3	65.1	-169.3	0	0	0	0	0	111.8	I370 I372 V475 H481 I482	I370-A479 HydrophobicContact CG2-CB 4.5Å; I372-A479 HydrophobicContact CD1-CB 4.49Å; I372-A479 HydrophobicContact CG1-CB 4.46Å; V475-A479 CarbonylContact O-C 3.49Å; V475-A479 WeakPolarHBondContact O-CA 3.25Å; V475-A479 PolarHBondContact O-N 3.19Å; A479-H481 PolarHBondContact O-N 2.92Å; A479-H481 VanDerWaalsContact O-N 3.1Å; A479-I482 HydrophobicContact CB-CD1 3.39Å; A479-I482 HydrophobicContact CB-CG1 3.99Å; A479-I482 WeakPolarHBondContact O-CB 3.23Å; A479-I482 WeakPolarHBondContact O-CG1 3.44Å; A479-I482 PolarHBondContact O-N 2.81Å; A479-I482 VanDerWaalsContact O-N 3.12Å
480	P	86	Confident	72.4	Confident	72 Å²	72	72.3 Å²	72.3	47%	0.468	40%	0.404	S	S	.	.	G	3₁₀ helix	trans	-56.2	-32.4	-174.3	18.8	-31.8	0	0	0	114.1	G476 I482 M483 T484	G476-P480 WeakPolarHBondContact O-CB 3.42Å; G476-P480 WeakPolarHBondContact O-CD 3.3Å; P480-I482 PolarHBondContact O-N 3.42Å; P480-I482 VanDerWaalsContact O-N 3.12Å; P480-M483 PolarHBondContact O-N 3.49Å; P480-T484 PolarHBondContact O-N 3.27Å; P480-T484 VanDerWaalsContact O-N 3.07Å
481	H	84.4	Confident	69.6	Low	69 Å²	69	80.9 Å²	80.9	32%	0.319	44%	0.444	S	S	.	.	G	3₁₀ helix	trans	-60.9	-19.4	-179	66.3	-88.3	0	0	0	114.3	I370 A479 T484	I370-H481 WeakPolarHBondContact CD1-CE1 3.2Å; A479-H481 PolarHBondContact O-N 2.92Å; A479-H481 VanDerWaalsContact O-N 3.1Å; H481-T484 WeakPolarHBondContact CA-OG1 3.44Å; H481-T484 PolarHBondContact O-OG1 3.34Å
482	I	84.6	Confident	66.7	Low	5 Å²	5	83.7 Å²	83.7	3%	0.026	47%	0.467	C	S	.	.	G	3₁₀ helix	trans	-74.8	-31.3	176.5	-58.1	173.4	0	0	0	111.2	I372 Y403 F413 N415 V475 A479 P480	I372-I482 HydrophobicContact CD1-CD1 3.62Å; I372-I482 HydrophobicContact CG1-CD1 4.41Å; Y403-I482 HydrophobicContact CD1-CD1 3.71Å; Y403-I482 HydrophobicContact CD1-CG2 4.36Å; Y403-I482 HydrophobicContact CD2-CD1 3.94Å; Y403-I482 HydrophobicContact CD2-CG1 3.99Å; Y403-I482 HydrophobicContact CD2-CG2 3.86Å; Y403-I482 HydrophobicContact CE1-CD1 3.41Å; Y403-I482 VanDerWaalsContact CE1-CD1 3.41Å; Y403-I482 HydrophobicContact CE1-CG1 4.43Å; Y403-I482 HydrophobicContact CE2-CD1 3.61Å; Y403-I482 HydrophobicContact CE2-CG1 3.75Å; Y403-I482 HydrophobicContact CE2-CG2 4.5Å; Y403-I482 HydrophobicContact CG-CD1 3.97Å; Y403-I482 HydrophobicContact CG-CG1 4.38Å; Y403-I482 HydrophobicContact CG-CG2 3.75Å; F413-I482 HydrophobicContact CE2-CG2 4.49Å; F413-I482 HydrophobicContact CZ-CG2 4.21Å; N415-I482 HydrophobicContact CB-CG2 3.8Å; N415-I482 PolarHBondContact ND2-O 3.21Å; V475-I482 HydrophobicContact CG1-CD1 4.38Å; A479-I482 HydrophobicContact CB-CD1 3.39Å; A479-I482 HydrophobicContact CB-CG1 3.99Å; A479-I482 WeakPolarHBondContact O-CB 3.23Å; A479-I482 WeakPolarHBondContact O-CG1 3.44Å; A479-I482 PolarHBondContact O-N 2.81Å; A479-I482 VanDerWaalsContact O-N 3.12Å; P480-I482 PolarHBondContact O-N 3.42Å; P480-I482 VanDerWaalsContact O-N 3.12Å
483	M	77.4	Confident	64.2	Low	48 Å²	48	85.7 Å²	85.7	24%	0.236	49%	0.487	C	S	.	.	T	Hydrogen-bonded Turn	trans	-98.1	-17.9	-176.7	-63.2	-62.7	172.1	0	0	112.7	F413 V430 L472 V475 P480 T485	F413-M483 HydrophobicContact CD2-CE 4.49Å; F413-M483 HydrophobicContact CE2-CE 3.53Å; F413-M483 HydrophobicContact CZ-CE 4.08Å; V430-M483 HydrophobicContact CG1-SD 4.2Å; L472-M483 HydrophobicContact CD2-CE 3.41Å; L472-M483 VanDerWaalsContact CD2-CE 3.41Å; L472-M483 HydrophobicContact CD2-SD 4.05Å; V475-M483 HydrophobicContact CB-CE 3.82Å; V475-M483 HydrophobicContact CG1-CE 3.56Å; V475-M483 HydrophobicContact CG1-CG 4.28Å; V475-M483 HydrophobicContact CG2-CE 4.23Å; P480-M483 PolarHBondContact O-N 3.49Å; M483-T485 PolarHBondContact O-N 3.04Å
484	T	61.3	Low	61.6	Low	94 Å²	94	89.5 Å²	89.5	58%	0.577	50%	0.498	S	S	*	.			trans	-65.7	101	172.8	50.2	0	0	0	0	110.3	P480 H481 S486	P480-T484 PolarHBondContact O-N 3.27Å; P480-T484 VanDerWaalsContact O-N 3.07Å; H481-T484 WeakPolarHBondContact CA-OG1 3.44Å; H481-T484 PolarHBondContact O-OG1 3.34Å; T484-S486 PolarHBondContact O-N 3.39Å
485	T	51	Low	59.3	Low	93 Å²	93	95.1 Å²	95.1	57%	0.571	53%	0.531	S	S	*	.			trans	-56.9	122.8	165.2	50.8	0	0	0	0	108.6	M483 S487	M483-T485 PolarHBondContact O-N 3.04Å; T485-S487 PolarHBondContact O-N 3.48Å
486	S	36.7	Very low	56.9	Low	81 Å²	81	100.4 Å²	100.4	57%	0.566	57%	0.567	S	S	*	*			trans	-72.2	70.4	177.1	43.1	0	0	0	0	110.8	T484 F488	T484-S486 PolarHBondContact O-N 3.39Å; S486-F488 PolarHBondContact O-N 3.1Å
487	S	34.5	Very low	54.5	Low	98 Å²	98	106.6 Å²	106.6	69%	0.685	59%	0.593	S	S	*	*			trans	-69.2	69.8	175.9	-62.7	0	0	0	0	110.5	T485 G489	T485-S487 PolarHBondContact O-N 3.48Å; S487-G489 PolarHBondContact O-N 3.36Å
488	F	34.1	Very low	52.2	Low	190 Å²	190	103.4 Å²	103.4	83%	0.833	59%	0.589	S	S	*	*			trans	-60.1	104.3	166.6	-81.3	-77	0	0	0	108	S486 H490	S486-F488 PolarHBondContact O-N 3.1Å; F488-H490 PolarHBondContact O-N 3.29Å
489	G	30	Very low	49.9	Very low	53 Å²	53	105.2 Å²	105.2	55%	0.546	61%	0.607	S	S	.	*			trans	-68.2	129.1	-151.1	0	0	0	0	0	115	S487 Q491	S487-G489 PolarHBondContact O-N 3.36Å; G489-Q491 PolarHBondContact O-N 3.35Å
490	H	35.1	Very low	47.8	Very low	183 Å²	183	112.8 Å²	112.8	85%	0.847	65%	0.648	S	S	*	*			trans	-63.8	87.9	149.7	-76.2	-97.1	0	0	0	108.5	F488 S492	F488-H490 PolarHBondContact O-N 3.29Å; H490-S492 PolarHBondContact O-N 3.31Å; H490-S492 PolarHBondContact O-OG 3.09Å
491	Q	34.9	Very low	45.6	Very low	185 Å²	185	118 Å²	118	86%	0.864	67%	0.666	S	S	*	*			trans	-70.1	76.4	177.8	-72.1	177.5	86.2	0	0	110.6	G489	G489-Q491 PolarHBondContact O-N 3.35Å
492	S	31.3	Very low	43.6	Very low	99 Å²	99	125.1 Å²	125.1	69%	0.692	69%	0.69	S	S	*	*			trans	-101.2	53.2	178.2	50.2	0	0	0	0	111.2	H490	H490-S492 PolarHBondContact O-N 3.31Å; H490-S492 PolarHBondContact O-OG 3.09Å
493	S	38.9	Very low	41.4	Very low	107 Å²	107	134.5 Å²	134.5	75%	0.748	73%	0.731	S	S	*	*			trans	-100.3	98.1	170.4	57	0	0	0	0	109.8
494	F	38	Very low	40	Very low	194 Å²	194	138.9 Å²	138.9	85%	0.851	75%	0.753	S	S	*	*			trans	-69.5	124.3	162.5	-62.2	-98.4	0	0	0	108.4
495	D	41.9	Very low	38.9	Very low	168 Å²	168	139.1 Å²	139.1	90%	0.898	76%	0.759	S	S	*	*			trans	-155.6	158.2	151.9	-113.7	-37.4	0	0	0	110.6
496	S	40.3	Very low	38.3	Very low	111 Å²	111	141.4 Å²	141.4	78%	0.776	77%	0.773	S	S	*	*			trans	-116.5	155.5	-155.2	-61.6	0	0	0	0	116.4
497	D	40.5	Very low	38.5	Very low	159 Å²	159	148 Å²	148	85%	0.85	79%	0.786	S	S	*	*			trans	85.4	163.1	146.7	-153.6	19.2	0	0	0	120.4
498	S	41.3	Very low	38.6	Very low	93 Å²	93	147.9 Å²	147.9	65%	0.65	78%	0.784	S	S	*	*			trans	77.5	64.6	170.2	72.8	0	0	0	0	118.9
499	S	39.4	Very low	39.2	Very low	107 Å²	107	147.5 Å²	147.5	75%	0.748	79%	0.79	S	S	*	*				37.7	107.7	129.2	63.5	0	0	0	0	119.9
500	N	42	Very low	39.8	Very low	159 Å²	159	151 Å²	151	85%	0.85	80%	0.801	S	S	*	*			trans	-152.3	115.3	144.3	-113.6	-64	0	0	0	112	R502	N500-R502 PolarHBondContact O-N 3.46Å
501	Q	40.6	Very low	40	Very low	181 Å²	181	154.1 Å²	154.1	85%	0.846	81%	0.805	S	S	*	*			trans	-78.6	111.2	-178	-65.2	-172.7	28.9	0	0	111.6
502	R	41.7	Very low	40	Very low	220 Å²	220	148.6 Å²	148.6	83%	0.83	80%	0.798	S	S	*	*			trans	-129.7	113.6	158.7	-94.6	-172.4	-78.1	-176	-3.9	111.2	N500 I504	N500-R502 PolarHBondContact O-N 3.46Å; R502-I504 HydrophobicContact CB-CD1 3.9Å; R502-I504 PolarHBondContact O-N 3.17Å; R502-I504 VanDerWaalsContact O-N 3.13Å
503	K	38.3	Very low	40.5	Very low	201 Å²	201	154.8 Å²	154.8	87%	0.874	81%	0.806	S	S	*	*			trans	-74	95	177	-63.7	176	-179.5	176.8	0	109.9
504	I	47.9	Very low	40.6	Very low	140 Å²	140	155 Å²	155	72%	0.718	81%	0.807	S	S	*	*			trans	-101	141.2	165.7	-79	65.3	0	0	0	108.5	R502	R502-I504 HydrophobicContact CB-CD1 3.9Å; R502-I504 PolarHBondContact O-N 3.17Å; R502-I504 VanDerWaalsContact O-N 3.13Å
505	S	39.4	Very low	40.9	Very low	100 Å²	100	154.5 Å²	154.5	70%	0.699	81%	0.806	S	S	*	*			trans	-73.1	140.2	-170	-172.6	0	0	0	0	113.4	R507	S505-R507 PolarHBondContact O-N 3.14Å
506	T	36.5	Very low	41.7	Very low	140 Å²	140	156.6 Å²	156.6	86%	0.859	80%	0.801	S	S	*	*			trans	-72.2	85.2	175.6	50.7	0	0	0	0	111.5
507	R	41.1	Very low	42.2	Very low	221 Å²	221	157 Å²	157	83%	0.834	80%	0.8	S	S	*	*			trans	-136.5	108.7	170	-83.4	-168.6	158.9	176.5	-6.6	113.9	S505	S505-R507 PolarHBondContact O-N 3.14Å
508	S	38.4	Very low	43.3	Very low	94 Å²	94	157.1 Å²	157.1	66%	0.657	80%	0.8	S	S	*	*			trans	68.3	58.3	142.4	-51.8	0	0	0	0	119.2	T510	S508-T510 PolarHBondContact O-N 3.3Å
509	L	44.8	Very low	44.4	Very low	183 Å²	183	155.6 Å²	155.6	96%	0.958	78%	0.782	S	S	*	*			trans	-78.1	55	156.8	-68.2	-180	0	0	0	112
510	T	43.7	Very low	46.3	Very low	126 Å²	126	154.1 Å²	154.1	77%	0.773	77%	0.769	S	S	*	*			trans	-138.1	54.8	178.2	58.4	0	0	0	0	110.2	S508	S508-T510 PolarHBondContact O-N 3.3Å
511	R	38.3	Very low	47.8	Very low	248 Å²	248	155.1 Å²	155.1	94%	0.936	77%	0.765	S	S	*	*			trans	-144.6	69.1	-177.3	-160.8	177.2	-171.5	177.8	2.4	113.1
512	G	35.1	Very low	49.5	Very low	69 Å²	69	150.1 Å²	150.1	71%	0.711	75%	0.751	S	S	*	*	S	Bend	trans	-160.2	139.6	169.5	0	0	0	0	0	110.2
513	R	42	Very low	51.3	Low	230 Å²	230	144.8 Å²	144.8	87%	0.868	73%	0.734	S	S	*	*			trans	55	64.9	178.6	-56.6	-175.9	-174.9	-121.7	-0	115.4	F515	R513-F515 PolarHBondContact O-N 2.85Å
514	S	41.1	Very low	53.2	Low	110 Å²	110	141.9 Å²	141.9	77%	0.769	72%	0.717	S	S	*	*			trans	-71.5	107.8	150.6	170	0	0	0	0	107.8	R516	S514-R516 PolarHBondContact O-N 3.29Å
515	F	45.3	Very low	54.7	Low	185 Å²	185	139.5 Å²	139.5	81%	0.811	71%	0.705	S	S	*	*	P	Polyproline II helix	trans	-62.6	124.3	163.9	-74.3	-95.2	0	0	0	108.1	R513	R513-F515 PolarHBondContact O-N 2.85Å
516	R	57.5	Low	56.7	Low	212 Å²	212	139.5 Å²	139.5	80%	0.8	70%	0.696	S	S	*	*	P	Polyproline II helix	trans	-93.3	130.9	165.7	-62.5	-179.5	-173.9	-102.6	6.1	106.9	S514 I518	S514-R516 PolarHBondContact O-N 3.29Å; R516-I518 PolarHBondContact O-N 3.42Å
517	P	51.2	Low	58.7	Low	118 Å²	118	136.6 Å²	136.6	77%	0.766	67%	0.673	S	S	*	*	P	Polyproline II helix	trans	-61.3	123.3	172.2	25.7	-32.7	0	0	0	109	Q519	P517-Q519 VanDerWaalsContact C-N 3.32Å; P517-Q519 PolarHBondContact O-N 2.96Å
518	I	62.8	Low	60.4	Low	162 Å²	162	132.3 Å²	132.3	83%	0.831	66%	0.663	S	S	*	*			trans	-81.3	83.7	179.4	-57.5	179.2	0	0	0	107.7	R516 T520	R516-I518 PolarHBondContact O-N 3.42Å; I518-T520 PolarHBondContact O-N 3.24Å; I518-T520 VanDerWaalsContact O-N 3.13Å
519	Q	66	Low	62.2	Low	62 Å²	62	133.3 Å²	133.3	29%	0.29	66%	0.657	S	S	.	*			trans	-63.2	114.1	171	-71.6	-177.4	-35.5	0	0	109.9	P517 F523 R524 E527	P517-Q519 VanDerWaalsContact C-N 3.32Å; P517-Q519 PolarHBondContact O-N 2.96Å; Q519-F523 HydrophobicContact CB-CD1 4.33Å; Q519-F523 HydrophobicContact CG-CD1 3.83Å; Q519-F523 HydrophobicContact CG-CE1 4.31Å; Q519-F523 HydrophobicContact CG-CG 4.49Å; Q519-R524 HydrophobicContact CB-CG 4.16Å; Q519-R524 PolarHBondContact O-NE 3.44Å; Q519-R524 PolarHBondContact O-NH2 2.99Å; Q519-E527 VanDerWaalsContact NE2-CD 3.29Å; Q519-E527 PolarHBondContact NE2-OE1 3.34Å; Q519-E527 VanDerWaalsContact NE2-OE1 3.11Å; Q519-E527 PolarHBondContact NE2-OE2 3.43Å
520	T	78	Confident	63.6	Low	76 Å²	76	129.7 Å²	129.7	47%	0.466	64%	0.638	S	S	.	*			trans	-59.5	166.2	170.5	58.3	0	0	0	0	111.3	I518 S522 F523 R524	I518-T520 PolarHBondContact O-N 3.24Å; I518-T520 VanDerWaalsContact O-N 3.13Å; T520-S522 VanDerWaalsContact C-N 3.29Å; T520-S522 PolarHBondContact O-N 3.22Å; T520-S522 PolarHBondContact OG1-OG 3.1Å; T520-F523 PolarHBondContact O-N 3.44Å; T520-F523 WeakPolarHBondContact OG1-CB 3.25Å; T520-F523 PolarHBondContact OG1-N 3.37Å; T520-F523 VanDerWaalsContact OG1-N 3.15Å; T520-R524 PolarHBondContact O-N 3.02Å; T520-R524 VanDerWaalsContact O-N 3.16Å
521	K	74.4	Confident	64.5	Low	179 Å²	179	126.7 Å²	126.7	78%	0.778	62%	0.622	S	S	*	*	H	α-helix	trans	-61.6	-40.2	174.2	-69.9	-180	-178.8	173.2	0	111.1	R524 I525	K521-R524 PolarHBondContact O-N 3.49Å; K521-I525 WeakPolarHBondContact O-CD1 3.32Å; K521-I525 VanDerWaalsContact O-CG1 3.25Å; K521-I525 WeakPolarHBondContact O-CG1 3.32Å; K521-I525 PolarHBondContact O-N 2.7Å
522	S	75.9	Confident	65.5	Low	76 Å²	76	119.8 Å²	119.8	53%	0.531	60%	0.603	S	S	.	*	H	α-helix	trans	-60.9	-46.4	175.5	43.1	0	0	0	0	112.2	T520 R524 I525 L526	T520-S522 VanDerWaalsContact C-N 3.29Å; T520-S522 PolarHBondContact O-N 3.22Å; T520-S522 PolarHBondContact OG1-OG 3.1Å; S522-R524 PolarHBondContact O-N 3.23Å; S522-I525 PolarHBondContact O-N 3.03Å; S522-L526 PolarHBondContact O-N 3.09Å
523	F	79.7	Confident	66.4	Low	108 Å²	108	120 Å²	120	47%	0.474	59%	0.593	S	S	.	*	H	α-helix	trans	-59.5	-46.7	177.4	-165.4	-78.5	0	0	0	111.8	Q519 T520 I525 L526 E527	Q519-F523 HydrophobicContact CB-CD1 4.33Å; Q519-F523 HydrophobicContact CG-CD1 3.83Å; Q519-F523 HydrophobicContact CG-CE1 4.31Å; Q519-F523 HydrophobicContact CG-CG 4.49Å; T520-F523 PolarHBondContact O-N 3.44Å; T520-F523 WeakPolarHBondContact OG1-CB 3.25Å; T520-F523 PolarHBondContact OG1-N 3.37Å; T520-F523 VanDerWaalsContact OG1-N 3.15Å; F523-I525 VanDerWaalsContact C-N 3.33Å; F523-I525 PolarHBondContact O-N 2.57Å; F523-L526 PolarHBondContact O-N 3.49Å; F523-E527 HydrophobicContact CD1-CB 4.38Å; F523-E527 HydrophobicContact CE1-CB 4.32Å; F523-E527 VanDerWaalsContact O-CB 3.3Å; F523-E527 WeakPolarHBondContact O-CB 3.43Å; F523-E527 PolarHBondContact O-N 3.41Å
524	R	78.1	Confident	66.9	Low	141 Å²	141	117 Å²	117	53%	0.532	59%	0.589	S	S	.	*	H	α-helix	trans	-65.8	-32.8	178.2	-95.7	177.4	-75.8	176.7	-9	113.6	Q519 T520 K521 S522 Q528	Q519-R524 HydrophobicContact CB-CG 4.16Å; Q519-R524 PolarHBondContact O-NE 3.44Å; Q519-R524 PolarHBondContact O-NH2 2.99Å; T520-R524 PolarHBondContact O-N 3.02Å; T520-R524 VanDerWaalsContact O-N 3.16Å; K521-R524 PolarHBondContact O-N 3.49Å; S522-R524 PolarHBondContact O-N 3.23Å; R524-Q528 WeakPolarHBondContact O-CB 3.11Å; R524-Q528 PolarHBondContact O-N 2.9Å
525	I	80.3	Confident	67.6	Low	90 Å²	90	116.2 Å²	116.2	46%	0.462	58%	0.583	S	S	.	*	H	α-helix	trans	-69	-43.1	174.5	-69.8	164.3	0	0	0	110.6	K521 S522 F523 Q528 Q529	K521-I525 WeakPolarHBondContact O-CD1 3.32Å; K521-I525 VanDerWaalsContact O-CG1 3.25Å; K521-I525 WeakPolarHBondContact O-CG1 3.32Å; K521-I525 PolarHBondContact O-N 2.7Å; S522-I525 PolarHBondContact O-N 3.03Å; F523-I525 VanDerWaalsContact C-N 3.33Å; F523-I525 PolarHBondContact O-N 2.57Å; I525-Q528 PolarHBondContact O-N 3.41Å; I525-Q529 WeakPolarHBondContact O-CB 3.25Å; I525-Q529 VanDerWaalsContact O-CG 3.25Å; I525-Q529 WeakPolarHBondContact O-CG 3.5Å; I525-Q529 PolarHBondContact O-N 3.12Å
526	L	80.6	Confident	67.6	Low	99 Å²	99	111.3 Å²	111.3	52%	0.518	57%	0.569	S	S	.	*	H	α-helix	trans	-62.2	-49.4	174.1	-83.6	165.4	0	0	0	112.1	S522 F523 Q528 Q529 L530	S522-L526 PolarHBondContact O-N 3.09Å; F523-L526 PolarHBondContact O-N 3.49Å; L526-Q528 VanDerWaalsContact C-N 3.27Å; L526-Q528 PolarHBondContact O-N 2.87Å; L526-Q529 PolarHBondContact O-N 2.92Å; L526-Q529 VanDerWaalsContact O-N 3.12Å; L526-L530 WeakPolarHBondContact O-CB 3.42Å; L526-L530 VanDerWaalsContact O-CG 3.32Å; L526-L530 WeakPolarHBondContact O-CG 3.41Å; L526-L530 PolarHBondContact O-N 2.73Å
527	E	78.3	Confident	66.8	Low	80 Å²	80	105.3 Å²	105.3	37%	0.374	57%	0.573	S	S	.	*	H	α-helix	trans	-59.3	-38.4	177.9	-171.5	174.7	-119.3	0	0	111.5	Q519 F523 S531	Q519-E527 VanDerWaalsContact NE2-CD 3.29Å; Q519-E527 PolarHBondContact NE2-OE1 3.34Å; Q519-E527 VanDerWaalsContact NE2-OE1 3.11Å; Q519-E527 PolarHBondContact NE2-OE2 3.43Å; F523-E527 HydrophobicContact CD1-CB 4.38Å; F523-E527 HydrophobicContact CE1-CB 4.32Å; F523-E527 VanDerWaalsContact O-CB 3.3Å; F523-E527 WeakPolarHBondContact O-CB 3.43Å; F523-E527 PolarHBondContact O-N 3.41Å; E527-S531 VanDerWaalsContact O-CB 3.32Å; E527-S531 WeakPolarHBondContact O-CB 3.46Å; E527-S531 PolarHBondContact O-N 3.26Å; E527-S531 PolarHBondContact O-OG 3.19Å
528	Q	76.6	Confident	66.4	Low	130 Å²	130	106.2 Å²	106.2	61%	0.607	57%	0.572	S	S	*	*	H	α-helix	trans	-69.3	-40.4	173.9	-170.8	171.8	23.7	0	0	112.7	R524 I525 L526 S531 I532	R524-Q528 WeakPolarHBondContact O-CB 3.11Å; R524-Q528 PolarHBondContact O-N 2.9Å; I525-Q528 PolarHBondContact O-N 3.41Å; L526-Q528 VanDerWaalsContact C-N 3.27Å; L526-Q528 PolarHBondContact O-N 2.87Å; Q528-S531 PolarHBondContact O-N 3.49Å; Q528-I532 HydrophobicContact CG-CD1 4.37Å; Q528-I532 WeakPolarHBondContact O-CD1 3.49Å; Q528-I532 VanDerWaalsContact O-CG1 3.26Å; Q528-I532 WeakPolarHBondContact O-CG1 3.37Å; Q528-I532 PolarHBondContact O-N 2.87Å; Q528-I532 VanDerWaalsContact O-N 3.11Å
529	Q	76.8	Confident	65.4	Low	115 Å²	115	104 Å²	104	54%	0.537	57%	0.568	S	S	.	*	H	α-helix	trans	-64.8	-40.3	175.5	-74.9	171.3	3.7	0	0	112.1	I525 L526 I532 S533	I525-Q529 WeakPolarHBondContact O-CB 3.25Å; I525-Q529 VanDerWaalsContact O-CG 3.25Å; I525-Q529 WeakPolarHBondContact O-CG 3.5Å; I525-Q529 PolarHBondContact O-N 3.12Å; L526-Q529 PolarHBondContact O-N 2.92Å; L526-Q529 VanDerWaalsContact O-N 3.12Å; Q529-I532 PolarHBondContact O-N 3.05Å; Q529-S533 PolarHBondContact O-N 3.22Å
530	L	73.3	Confident	63.9	Low	107 Å²	107	109 Å²	109	56%	0.56	60%	0.595	S	S	*	*	H	α-helix	trans	-68.5	-41.2	174.6	-66.5	169	0	0	0	111.4	L526 I532 S533 E534	L526-L530 WeakPolarHBondContact O-CB 3.42Å; L526-L530 VanDerWaalsContact O-CG 3.32Å; L526-L530 WeakPolarHBondContact O-CG 3.41Å; L526-L530 PolarHBondContact O-N 2.73Å; L530-I532 PolarHBondContact O-N 3.46Å; L530-S533 PolarHBondContact O-N 3.39Å; L530-S533 PolarHBondContact O-OG 3.36Å; L530-E534 PolarHBondContact O-N 3.11Å
531	S	63.4	Low	62.2	Low	63 Å²	63	112 Å²	112	44%	0.441	61%	0.612	S	S	.	*	H	α-helix	trans	-60.1	-30.7	174.5	-60.6	0	0	0	0	113.1	E527 Q528 S535	E527-S531 VanDerWaalsContact O-CB 3.32Å; E527-S531 WeakPolarHBondContact O-CB 3.46Å; E527-S531 PolarHBondContact O-N 3.26Å; E527-S531 PolarHBondContact O-OG 3.19Å; Q528-S531 PolarHBondContact O-N 3.49Å; S531-S535 WeakPolarHBondContact O-CB 3.26Å; S531-S535 PolarHBondContact O-N 3.29Å; S531-S535 PolarHBondContact O-OG 3.41Å
532	I	59.1	Low	60.6	Low	104 Å²	104	111.6 Å²	111.6	53%	0.533	61%	0.611	S	S	.	*	H	α-helix	trans	-71.8	-31.4	174.9	-70.2	162.6	0	0	0	111.4	Q528 Q529 L530 S535 T536	Q528-I532 HydrophobicContact CG-CD1 4.37Å; Q528-I532 WeakPolarHBondContact O-CD1 3.49Å; Q528-I532 VanDerWaalsContact O-CG1 3.26Å; Q528-I532 WeakPolarHBondContact O-CG1 3.37Å; Q528-I532 PolarHBondContact O-N 2.87Å; Q528-I532 VanDerWaalsContact O-N 3.11Å; Q529-I532 PolarHBondContact O-N 3.05Å; L530-I532 PolarHBondContact O-N 3.46Å; I532-S535 PolarHBondContact O-OG 3.32Å; I532-T536 PolarHBondContact O-OG1 2.99Å
533	S	53.6	Low	58.5	Low	73 Å²	73	114.6 Å²	114.6	51%	0.51	63%	0.628	S	S	.	*	H	α-helix	trans	-79.3	-31.5	176.4	70	0	0	0	0	113.2	Q529 L530	Q529-S533 PolarHBondContact O-N 3.22Å; L530-S533 PolarHBondContact O-N 3.39Å; L530-S533 PolarHBondContact O-OG 3.36Å
534	E	53.6	Low	56.3	Low	168 Å²	168	120.6 Å²	120.6	79%	0.785	65%	0.648	S	S	*	*	H	α-helix	trans	-76.2	-27.5	176.3	-66.4	-168.3	143.2	0	0	113.8	L530	L530-E534 PolarHBondContact O-N 3.11Å
535	S	55.8	Low	54.1	Low	92 Å²	92	122.8 Å²	122.8	64%	0.643	66%	0.664	S	S	*	*	T	Hydrogen-bonded Turn	trans	-84.4	-3.3	-177.8	52.2	0	0	0	0	114.9	S531 I532	S531-S535 WeakPolarHBondContact O-CB 3.26Å; S531-S535 PolarHBondContact O-N 3.29Å; S531-S535 PolarHBondContact O-OG 3.41Å; I532-S535 PolarHBondContact O-OG 3.32Å
536	T	44.7	Very low	51.7	Low	82 Å²	82	125.8 Å²	125.8	50%	0.503	68%	0.681	S	S	.	*	S	Bend	trans	-128.8	101.8	171.6	54.4	0	0	0	0	111.3	I532 N538	I532-T536 PolarHBondContact O-OG1 2.99Å; T536-N538 PolarHBondContact O-N 3.23Å
537	G	41	Very low	49.3	Very low	87 Å²	87	126.2 Å²	126.2	90%	0.897	69%	0.688	S	S	*	*			trans	-70	51.3	-171.9	0	0	0	0	0	116.6
538	N	41.5	Very low	47.1	Very low	137 Å²	137	130.9 Å²	130.9	73%	0.733	71%	0.71	S	S	*	*			trans	-89.7	132.6	172.7	-72.6	-50.6	0	0	0	110.4	T536	T536-N538 PolarHBondContact O-N 3.23Å
539	P	41.8	Very low	45.1	Very low	116 Å²	116	133.7 Å²	133.7	75%	0.753	72%	0.723	S	S	*	*			trans	-71.6	147	-172.7	28.6	-35.3	0	0	0	113.2	V541	P539-V541 PolarHBondContact O-N 2.74Å; P539-V541 VanDerWaalsContact O-N 3.14Å
540	I	34.4	Very low	42.8	Very low	167 Å²	167	136.1 Å²	136.1	86%	0.856	74%	0.738	S	S	*	*			trans	-49.1	113.1	179.4	-63	162.3	0	0	0	111.7
541	V	42.6	Very low	41	Very low	137 Å²	137	142.7 Å²	142.7	83%	0.83	76%	0.756	S	S	*	*			trans	-84.4	117.3	169.4	-179.2	0	0	0	0	108.7	P539	P539-V541 PolarHBondContact O-N 2.74Å; P539-V541 VanDerWaalsContact O-N 3.14Å
542	K	41.5	Very low	39.5	Very low	171 Å²	171	146.6 Å²	146.6	74%	0.743	77%	0.77	S	S	*	*			trans	-63.9	141.7	179.8	-59.6	-179.3	-178.8	-176.4	0	110.7	R544	K542-R544 PolarHBondContact O-N 3.18Å
543	P	32.3	Very low	38.4	Very low	139 Å²	139	148.5 Å²	148.5	90%	0.903	79%	0.786	S	S	*	*			trans	-64.5	109.2	172.6	27.7	-33.6	0	0	0	109
544	R	31.8	Very low	37.6	Very low	235 Å²	235	150.6 Å²	150.6	89%	0.887	80%	0.796	S	S	*	*			trans	-111	113.7	179.6	-160.3	174.4	-168.2	174.5	3.6	109.6	K542 N546	K542-R544 PolarHBondContact O-N 3.18Å; R544-N546 PolarHBondContact O-N 3.09Å; R544-N546 VanDerWaalsContact O-N 3.16Å
545	Q	32.3	Very low	36.8	Very low	186 Å²	186	147.7 Å²	147.7	87%	0.869	79%	0.794	S	S	*	*			trans	-59.5	114.6	174.2	-63.5	159.2	-53.3	0	0	109.8
546	N	29.7	Very low	36	Very low	153 Å²	153	148.2 Å²	148.2	82%	0.818	80%	0.796	S	S	*	*			trans	-156.6	108.3	149.4	-121.7	-97.9	0	0	0	113.1	R544	R544-N546 PolarHBondContact O-N 3.09Å; R544-N546 VanDerWaalsContact O-N 3.16Å
547	V	31.8	Very low	35.6	Very low	108 Å²	108	149 Å²	149	66%	0.655	80%	0.804	S	S	*	*			trans	-7.9	130.7	141.9	-176.1	0	0	0	0	117.1
548	Q	32.2	Very low	35.6	Very low	179 Å²	179	156.4 Å²	156.4	84%	0.836	81%	0.807	S	S	*	*			trans	79.2	145.6	150.5	-76.8	163.8	-4.1	0	0	123.7
549	E	33.1	Very low	35.1	Very low	189 Å²	189	154.9 Å²	154.9	88%	0.883	81%	0.807	S	S	*	*			trans	75.2	135.7	165	-61.3	-153.6	143.4	0	0	122.2
550	L	30.1	Very low	35	Very low	165 Å²	165	156.2 Å²	156.2	86%	0.864	81%	0.813	S	S	*	*			trans	-100.4	150.5	-176.6	-70.7	151	0	0	0	111.1
551	R	34.9	Very low	35	Very low	245 Å²	245	153.4 Å²	153.4	93%	0.925	80%	0.804	S	S	*	*			trans	-153.3	153.2	143.8	-124.7	-177.6	-68	-161.8	0.4	113.1
552	I	30.8	Very low	34.7	Very low	145 Å²	145	155.1 Å²	155.1	74%	0.744	80%	0.801	S	S	*	*			trans	-113	143.6	-165.2	-60.6	163.8	0	0	0	110.3
553	V	37.8	Very low	34.4	Very low	144 Å²	144	153.2 Å²	153.2	87%	0.873	80%	0.804	S	S	*	*			trans	-135.6	138.2	157.5	-176.1	0	0	0	0	109.3
554	T	36.1	Very low	34.9	Very low	117 Å²	117	155.5 Å²	155.5	72%	0.718	80%	0.799	S	S	*	*			trans	-93.4	161.4	-173.4	47.5	0	0	0	0	113.3
555	S	36.9	Very low	35.2	Very low	107 Å²	107	149.5 Å²	149.5	75%	0.748	79%	0.791	S	S	*	*			cis	-157.8	-118.3	-16	50.7	0	0	0	0	107.6
556	P	38.8	Very low	34.9	Very low	104 Å²	104	151 Å²	151	68%	0.675	79%	0.79	S	S	*	*			cis	-129.1	131.3	-9.2	38.7	-19	0	0	0	116.9
557	S	36.3	Very low	35	Very low	97 Å²	97	147.1 Å²	147.1	68%	0.678	79%	0.786	S	S	*	*			trans	36	111.4	145.3	63.3	0	0	0	0	122.8
558	Y	40	Very low	35.1	Very low	243 Å²	243	150.8 Å²	150.8	95%	0.953	80%	0.796	S	S	*	*				-120	156.1	118.8	-47.5	-69.6	0	0	0	107.6
559	S	32.4	Very low	35.2	Very low	105 Å²	105	148 Å²	148	73%	0.734	79%	0.787	S	S	*	*			trans	-134.1	119.3	-163.5	174.7	0	0	0	0	115
560	T	39.2	Very low	35.1	Very low	144 Å²	144	147.1 Å²	147.1	88%	0.883	79%	0.785	S	S	*	*			trans	-136.4	110.8	151.5	49.5	0	0	0	0	109.2
561	T	35.3	Very low	35.1	Very low	108 Å²	108	145.7 Å²	145.7	66%	0.663	78%	0.778	S	S	*	*			trans	-68.9	168.4	171.5	14.3	0	0	0	0	111.3
562	F	36.6	Very low	35.1	Very low	173 Å²	173	138.9 Å²	138.9	76%	0.759	77%	0.768	S	S	*	*			cis	-145.8	150.6	21.9	-122.3	-68.1	0	0	0	112.2
563	T	34.4	Very low	35.3	Very low	132 Å²	132	141.3 Å²	141.3	81%	0.81	78%	0.776	S	S	*	*			trans	-112.8	134.9	164.8	-25.3	0	0	0	0	109.9
564	K	42	Very low	35	Very low	186 Å²	186	138.1 Å²	138.1	81%	0.809	77%	0.772	S	S	*	*			trans	-142.9	123.5	160.6	-80.8	-169.2	176.8	-178.1	0	109.6
565	P	37.8	Very low	34.9	Very low	110 Å²	110	141.9 Å²	141.9	71%	0.714	78%	0.779	S	S	*	*			trans	-86.3	-171.5	164.4	37.1	-34	0	0	0	110.8
566	Y	27.1	Very low	34.6	Very low	217 Å²	217	143.3 Å²	143.3	85%	0.851	78%	0.777	S	S	*	*			trans	72.2	121.3	-179.9	-85.6	-95.2	0	0	0	116.7
567	G	31.8	Very low	34.3	Very low	71 Å²	71	145.1 Å²	145.1	73%	0.732	79%	0.786	S	S	*	*			trans	-87.7	141.7	151.8	0	0	0	0	0	110
568	Q	33.5	Very low	34.2	Very low	186 Å²	186	147.7 Å²	147.7	87%	0.869	79%	0.793	S	S	*	*			trans	-151.9	116.7	160	-123.1	174.1	-5.9	0	0	108.2
569	N	33.7	Very low	33.9	Very low	121 Å²	121	142.6 Å²	142.6	65%	0.647	79%	0.786	S	S	*	*			trans	-70.8	131.1	172.4	174.5	-11.5	0	0	0	109
570	M	31.7	Very low	33.9	Very low	169 Å²	169	145 Å²	145	83%	0.833	79%	0.786	S	S	*	*			trans	-157.7	153.9	141.1	-91.6	-48.7	106	0	0	110.1
571	N	31.1	Very low	33.6	Very low	136 Å²	136	144.8 Å²	144.8	73%	0.727	78%	0.78	S	S	*	*			trans	-87.6	173.7	-168.1	-74.2	-44.3	0	0	0	115.4
572	S	34.7	Very low	33.4	Very low	101 Å²	101	148.7 Å²	148.7	71%	0.706	79%	0.787	S	S	*	*			trans	67.8	108.6	152	54.6	0	0	0	0	120.3
573	Q	33.1	Very low	33.6	Very low	196 Å²	196	146.3 Å²	146.3	92%	0.916	79%	0.789	S	S	*	*				38.2	112.4	122.4	-63.5	169.1	-21.7	0	0	118.8
574	G	32.1	Very low	33.7	Very low	77 Å²	77	149.1 Å²	149.1	79%	0.794	79%	0.793	S	S	*	*			trans	-162.5	133.8	167.2	0	0	0	0	0	112.8
575	F	33.5	Very low	33.3	Very low	197 Å²	197	148.4 Å²	148.4	86%	0.864	79%	0.792	S	S	*	*			trans	-88	136.3	-168	-76	-102.5	0	0	0	115.1
576	I	31.1	Very low	33.1	Very low	137 Å²	137	148.8 Å²	148.8	70%	0.703	79%	0.787	S	S	*	*			trans	25.1	119.6	134.1	-39.6	175.5	0	0	0	118.5
577	T	33.5	Very low	33.5	Very low	141 Å²	141	146.2 Å²	146.2	87%	0.865	78%	0.783	S	S	*	*				179.5	150.2	117.1	24.6	0	0	0	0	113.4
578	D	33.2	Very low	33.6	Very low	152 Å²	152	150.3 Å²	150.3	81%	0.813	78%	0.782	S	S	*	*			trans	-77.5	159.1	175.7	-70.5	-81.7	0	0	0	114
579	V	33.9	Very low	33.7	Very low	136 Å²	136	148 Å²	148	82%	0.824	78%	0.781	S	S	*	*				-175.1	111.5	113.6	149.9	0	0	0	0	112.5
580	Q	33.5	Very low	33.7	Very low	156 Å²	156	148 Å²	148	73%	0.729	79%	0.785	S	S	*	*			trans	-3.7	127.7	147.5	-175.8	-177.4	28.5	0	0	119.8
581	N	32.7	Very low	33.8	Very low	139 Å²	139	149.8 Å²	149.8	74%	0.743	79%	0.789	S	S	*	*				-170	172.2	117.8	-107	-68.4	0	0	0	116.9
582	K	30.5	Very low	33.9	Very low	190 Å²	190	148.4 Å²	148.4	83%	0.826	79%	0.79	S	S	*	*			trans	-80.5	161.7	-155.9	-65.8	170.6	175.7	172.4	0	118.3
583	P	40.5	Very low	34.1	Very low	122 Å²	122	149.9 Å²	149.9	79%	0.792	79%	0.794	S	S	*	*			trans	-112	154.8	176.6	40.7	-33.1	0	0	0	116.9
584	Q	35.8	Very low	34.2	Very low	192 Å²	192	146 Å²	146	90%	0.897	78%	0.784	S	S	*	*			trans	-151.1	126.8	154	-65.2	-171.2	-30.5	0	0	106.5
585	Q	33.8	Very low	34.5	Very low	170 Å²	170	151 Å²	151	79%	0.794	78%	0.784	S	S	*	*			cis	90.3	122.2	47.7	-162	-160	102.9	0	0	113.7
586	I	34.2	Very low	34.6	Very low	119 Å²	119	148.8 Å²	148.8	61%	0.61	78%	0.78	S	S	*	*			trans	149.5	109.7	140.4	-78.6	169	0	0	0	115.2
587	H	35	Very low	34.8	Very low	162 Å²	162	150.6 Å²	150.6	75%	0.75	79%	0.785	S	S	*	*			trans	55.6	173.8	146	-64.1	-102.8	0	0	0	120.7
588	H	35.4	Very low	35.2	Very low	157 Å²	157	148.9 Å²	148.9	73%	0.727	78%	0.776	S	S	*	*			cis	-156.2	164.5	15	-14.7	-113.8	0	0	0	116.9
589	V	34.1	Very low	35.3	Very low	139 Å²	139	150.9 Å²	150.9	84%	0.842	78%	0.778	S	S	*	*			trans	82.9	167.3	148.8	169.8	0	0	0	0	119.1
590	T	33.7	Very low	35.6	Very low	120 Å²	120	149.4 Å²	149.4	74%	0.736	77%	0.773	S	S	*	*			trans	-168.3	153.2	-159.9	-71.6	0	0	0	0	111.7
591	K	35.2	Very low	35.6	Very low	207 Å²	207	148.4 Å²	148.4	90%	0.9	77%	0.773	S	S	*	*			trans	-169.6	176	157.7	-105.5	157.2	-163.7	-176.5	0	115.8
592	S	32.9	Very low	35.8	Very low	107 Å²	107	148.7 Å²	148.7	75%	0.748	77%	0.77	S	S	*	*			trans	-138.9	176	-151.8	-18.6	0	0	0	0	115.3
593	T	39.6	Very low	35.8	Very low	131 Å²	131	144.6 Å²	144.6	80%	0.804	76%	0.757	S	S	*	*			trans	-150	156.9	165.1	-80.8	0	0	0	0	112.3
594	T	35	Very low	35.5	Very low	114 Å²	114	147 Å²	147	70%	0.699	75%	0.752	S	S	*	*			trans	-149.3	141.1	-169.4	-58.1	0	0	0	0	112.8
595	F	36.7	Very low	35.4	Very low	183 Å²	183	143.9 Å²	143.9	80%	0.803	74%	0.741	S	S	*	*			trans	-152.7	119.4	157.4	-81.4	-75.9	0	0	0	109
596	I	36.5	Very low	35.4	Very low	151 Å²	151	144 Å²	144	77%	0.774	74%	0.742	S	S	*	*				101.1	137.2	62.9	-80.9	-175.4	0	0	0	113
597	H	36.1	Very low	35.3	Very low	174 Å²	174	143.6 Å²	143.6	81%	0.806	75%	0.745	S	S	*	*			trans	-150.9	140	-168.2	-168.2	-19.7	0	0	0	111.3
598	P	40.5	Very low	35.3	Very low	105 Å²	105	144.8 Å²	144.8	68%	0.682	75%	0.751	S	S	*	*			trans	-131.4	-177.5	160.6	38.3	-24.6	0	0	0	112.3
599	K	36.6	Very low	35	Very low	194 Å²	194	142.4 Å²	142.4	84%	0.843	75%	0.752	S	S	*	*				-165	163.4	-64.6	-122.6	-178.2	-177.8	-179.8	0	110.3
600	S	38.6	Very low	35.1	Very low	105 Å²	105	141.5 Å²	141.5	73%	0.734	75%	0.752	S	S	*	*			trans	76.1	152.2	162.2	89.9	0	0	0	0	117.2
601	N	35	Very low	34.9	Very low	136 Å²	136	140.9 Å²	140.9	73%	0.727	75%	0.752	S	S	*	*			cis	-165	149.2	-17.9	-115	-1.3	0	0	0	112.6
602	Q	36.1	Very low	34.9	Very low	145 Å²	145	142.1 Å²	142.1	68%	0.678	75%	0.753	S	S	*	*			trans	44.9	146.5	132	-56.9	-81.8	-45.7	0	0	121.7
603	N	31.6	Very low	34.8	Very low	104 Å²	104	143.6 Å²	143.6	56%	0.556	75%	0.752	S	S	*	*			cis	-177.9	175.6	-15.9	-165.2	-3	0	0	0	109.6
604	Y	33.8	Very low	34.5	Very low	171 Å²	171	147.3 Å²	147.3	67%	0.671	75%	0.753	S	S	*	*			trans	95.1	112.6	155	-60.1	-62.4	0	0	0	122.9
605	N	34.2	Very low	34.4	Very low	128 Å²	128	146.6 Å²	146.6	68%	0.684	75%	0.753	S	S	*	*			trans	74.6	131.3	133.7	-59.4	-7.8	0	0	0	120.6
606	Q	32.3	Very low	34.4	Very low	171 Å²	171	147.7 Å²	147.7	80%	0.799	75%	0.753	S	S	*	*				72.2	131.2	53.7	-89.6	-165.1	7.5	0	0	113.7
607	T	32.1	Very low	34.3	Very low	112 Å²	112	146.4 Å²	146.4	69%	0.687	75%	0.753	S	S	*	*			cis	-160.8	177.5	-6.4	-22.6	0	0	0	0	109.4
608	Q	36.1	Very low	34.1	Very low	187 Å²	187	142.7 Å²	142.7	87%	0.874	75%	0.752	S	S	*	*			trans	137.4	164.4	137	-69.1	-160.9	27.4	0	0	114.5
609	S	29.2	Very low	33.7	Very low	107 Å²	107	142.5 Å²	142.5	75%	0.748	75%	0.753	S	S	*	*			trans	-130.4	155.9	-154.6	53.9	0	0	0	0	113.4
610	S	35.2	Very low	33.3	Very low	120 Å²	120	140.6 Å²	140.6	84%	0.839	75%	0.752	S	S	*	*			trans	-154.1	135.6	152.5	-73.4	0	0	0	0	109.9
611	S	30.5	Very low	33	Very low	106 Å²	106	142.3 Å²	142.3	74%	0.741	76%	0.758	S	S	*	*			trans	-114.9	146.8	172.5	52.3	0	0	0	0	109.8
612	Y	34.2	Very low	32.8	Very low	233 Å²	233	141.3 Å²	141.3	91%	0.914	76%	0.762	S	S	*	*			trans	-139.6	141.1	154.7	-80.7	-70.5	0	0	0	109.3
613	D	31.2	Very low	32.7	Very low	138 Å²	138	139.3 Å²	139.3	74%	0.738	76%	0.761	S	S	*	*			trans	-132.3	143	-177.8	-177.2	11.1	0	0	0	107.1
614	Y	33.5	Very low	32.6	Very low	209 Å²	209	142.8 Å²	142.8	82%	0.82	78%	0.78	S	S	*	*			trans	-154.8	120.8	175.9	-120.6	-79.8	0	0	0	110.2	Y616	Y614-Y616 HydrophobicContact CE1-CE2 4.26Å
615	S	33	Very low	32.5	Very low	99 Å²	99	144.4 Å²	144.4	69%	0.692	78%	0.784	S	S	*	*			trans	-118.1	146	179.8	52.3	0	0	0	0	110.7
616	Y	36.8	Very low	32.4	Very low	207 Å²	207	150.5 Å²	150.5	81%	0.812	80%	0.798	S	S	*	*			trans	-143.9	133.6	162.7	-100.8	-79.7	0	0	0	111.6	Y614	Y614-Y616 HydrophobicContact CE1-CE2 4.26Å
617	T	34.5	Very low	32.3	Very low	124 Å²	124	148.2 Å²	148.2	76%	0.761	80%	0.795	S	S	*	*			trans	-32.9	153.2	162.9	53.8	0	0	0	0	116
618	A	30.6	Very low	32.4	Very low	95 Å²	95	149.1 Å²	149.1	79%	0.785	80%	0.801	S	S	*	*			cis	-172.4	-161.3	-9.6	0	0	0	0	0	106.9
619	S	32.8	Very low	32.5	Very low	101 Å²	101	146.3 Å²	146.3	71%	0.706	80%	0.797	S	S	*	*			cis	-161.7	164.4	6.4	74.3	0	0	0	0	112.7
620	N	27.6	Very low	32.6	Very low	154 Å²	154	149.5 Å²	149.5	82%	0.824	80%	0.8	S	S	*	*			trans	13.8	94.7	154.8	-60	-12.1	0	0	0	121
621	V	32.7	Very low	32.7	Very low	141 Å²	141	149.1 Å²	149.1	86%	0.855	79%	0.794	S	S	*	*			trans	-146.8	138	130.7	-176.4	0	0	0	0	108.4
622	S	30.1	Very low	32.8	Very low	116 Å²	116	151.5 Å²	151.5	81%	0.811	80%	0.797	S	S	*	*			trans	-80.5	143.3	176.4	-50.3	0	0	0	0	112.8
623	P	35.7	Very low	32.5	Very low	102 Å²	102	151.5 Å²	151.5	66%	0.662	80%	0.796	S	S	*	*			trans	-139.9	137.9	139.6	35.4	-21.7	0	0	0	114.2	R625	P623-R625 HydrophobicContact CB-CB 4.42Å; P623-R625 PolarHBondContact O-N 3.19Å; P623-R625 VanDerWaalsContact O-N 3.1Å
624	N	28.7	Very low	32.5	Very low	178 Å²	178	151.8 Å²	151.8	95%	0.952	80%	0.796	S	S	*	*			trans	-69.5	98.8	154.7	-77.1	-29.9	0	0	0	107.9
625	R	30.9	Very low	32.2	Very low	204 Å²	204	145.9 Å²	145.9	77%	0.77	79%	0.785	S	S	*	*			trans	-145	103.4	174.4	-165.3	177.8	-165.4	-170.2	4.5	110.5	P623 V627	P623-R625 HydrophobicContact CB-CB 4.42Å; P623-R625 PolarHBondContact O-N 3.19Å; P623-R625 VanDerWaalsContact O-N 3.1Å; R625-V627 PolarHBondContact O-N 2.97Å
626	W	32.1	Very low	31.9	Very low	257 Å²	257	148.5 Å²	148.5	97%	0.973	79%	0.791	S	S	*	*			trans	-64.4	133	166.2	-73	96.3	0	0	0	109.2
627	V	30.6	Very low	31.5	Very low	122 Å²	122	144.2 Å²	144.2	74%	0.739	79%	0.787	S	S	*	*			trans	-111.7	103.7	174.9	176.9	0	0	0	0	106.8	R625 T629	R625-V627 PolarHBondContact O-N 2.97Å; V627-T629 PolarHBondContact O-N 3.25Å
628	T	34.9	Very low	31.3	Very low	131 Å²	131	147.4 Å²	147.4	80%	0.804	80%	0.795	S	S	*	*	P	Polyproline II helix	trans	-67.3	126.9	175.4	-13.7	0	0	0	0	109.3
629	T	37.7	Very low	31.2	Very low	128 Å²	128	149.3 Å²	149.3	79%	0.785	79%	0.792	S	S	*	*	P	Polyproline II helix	trans	-66.5	139	178.6	43.3	0	0	0	0	111.2	V627	V627-T629 PolarHBondContact O-N 3.25Å
630	Q	32.3	Very low	31.1	Very low	174 Å²	174	151 Å²	151	81%	0.813	80%	0.799	S	S	*	*	P	Polyproline II helix	trans	-57.9	133.2	179.2	-64.4	-73	-52.9	0	0	111.4
631	P	36	Very low	31.2	Very low	112 Å²	112	151 Å²	151	73%	0.727	80%	0.799	S	S	*	*	P	Polyproline II helix	trans	-66.5	139.1	165.4	28.9	-32.9	0	0	0	109.9	R633	P631-R633 PolarHBondContact O-N 3.36Å
632	I	33	Very low	31.2	Very low	156 Å²	156	150.5 Å²	150.5	80%	0.8	79%	0.791	S	S	*	*	P	Polyproline II helix	trans	-68.1	121.8	-176.7	-65.2	169.1	0	0	0	109.6	I634	I632-I634 PolarHBondContact O-N 3.14Å; I632-I634 VanDerWaalsContact O-N 3.12Å
633	R	28	Very low	31.2	Very low	234 Å²	234	152.4 Å²	152.4	88%	0.883	79%	0.789	S	S	*	*			trans	-69.7	106.4	170.5	-77.7	-149.6	-80.6	-167.4	-5.7	110.5	P631 S635	P631-R633 PolarHBondContact O-N 3.36Å; R633-S635 PolarHBondContact O-N 3.12Å
634	I	30.3	Very low	30.9	Very low	143 Å²	143	154.7 Å²	154.7	73%	0.733	80%	0.796	S	S	*	*			trans	-86.1	90.3	160.3	-57.4	-179.7	0	0	0	107.3	I632 N636	I632-I634 PolarHBondContact O-N 3.14Å; I632-I634 VanDerWaalsContact O-N 3.12Å; I634-N636 PolarHBondContact O-N 3.3Å
635	S	28.1	Very low	30.9	Very low	86 Å²	86	153.6 Å²	153.6	60%	0.601	79%	0.79	S	S	*	*			trans	-85.1	87.9	-177.6	54.1	0	0	0	0	111.9	R633 T637	R633-S635 PolarHBondContact O-N 3.12Å; S635-T637 PolarHBondContact O-N 2.91Å
636	N	27.1	Very low	30.9	Very low	154 Å²	154	147 Å²	147	82%	0.824	79%	0.786	S	S	*	*			trans	-79.6	59.1	168.4	-78.5	2.3	0	0	0	111.5	I634	I634-N636 PolarHBondContact O-N 3.3Å
637	T	28.9	Very low	30.7	Very low	116 Å²	116	141.2 Å²	141.2	71%	0.712	77%	0.774	S	S	*	*			trans	-111.4	81.6	172.4	51.6	0	0	0	0	109.3	S635 N639	S635-T637 PolarHBondContact O-N 2.91Å; T637-N639 PolarHBondContact O-N 2.92Å
638	M	29.3	Very low	30.5	Very low	191 Å²	191	145.6 Å²	145.6	94%	0.941	78%	0.779	S	S	*	*			trans	-68.6	115.7	169.5	-83.4	-68.8	-178.3	0	0	109.2
639	N	27.7	Very low	30.2	Very low	135 Å²	135	147.8 Å²	147.8	72%	0.722	78%	0.78	S	S	*	*			trans	-88.8	123.1	-176.8	166.7	29.6	0	0	0	111.2	T637 N641	T637-N639 PolarHBondContact O-N 2.92Å; N639-N641 PolarHBondContact OD1-N 3.31Å
640	T	31.1	Very low	29.7	Very low	138 Å²	138	146.2 Å²	146.2	85%	0.847	77%	0.774	S	S	*	*			trans	-141.8	67.5	164.8	47.6	0	0	0	0	113.1
641	N	30.7	Very low	29.5	Very low	153 Å²	153	148.7 Å²	148.7	82%	0.818	78%	0.778	S	S	*	*			trans	-90.2	108.6	153.1	-87.8	-27.4	0	0	0	109.9	N639	N639-N641 PolarHBondContact OD1-N 3.31Å
642	N	31.5	Very low	29.1	Very low	130 Å²	130	150.5 Å²	150.5	70%	0.695	78%	0.776	S	S	*	*				158.3	141.8	104.3	-161	25.4	0	0	0	114.3
643	M	30.3	Very low	28.8	Very low	156 Å²	156	155.2 Å²	155.2	77%	0.768	78%	0.784	S	S	*	*			trans	48.7	100.7	152.7	-82.6	167.6	-171.6	0	0	122.8
644	N	29.8	Very low	28.8	Very low	151 Å²	151	147.3 Å²	147.3	81%	0.807	76%	0.762	S	S	*	*				107.4	130.6	98.2	-157.7	19.4	0	0	0	120.3
645	N	29.5	Very low	28.6	Very low	155 Å²	155	149.4 Å²	149.4	83%	0.829	77%	0.768	S	S	*	*			trans	74.3	121	155.7	-155.8	17.4	0	0	0	119.5
646	G	29.6	Very low	28.6	Very low	66 Å²	66	151.9 Å²	151.9	68%	0.68	78%	0.775	S	S	*	*			trans	143.4	71.7	164.2	0	0	0	0	0	118.4
647	N	27.8	Very low	28.7	Very low	135 Å²	135	149.1 Å²	149.1	72%	0.722	76%	0.763	S	S	*	*			trans	55.5	117.9	149.1	-81	-2.2	0	0	0	122.3
648	Y	26.6	Very low	28.8	Very low	214 Å²	214	150.5 Å²	150.5	84%	0.839	77%	0.767	S	S	*	*			trans	53.3	137.4	145	-54.3	-70.7	0	0	0	119.8
649	Q	29.9	Very low	28.6	Very low	176 Å²	176	151 Å²	151	82%	0.822	76%	0.758	S	S	*	*			cis	-130.6	165.1	19.5	-71.7	-177.1	-16.4	0	0	113.5
650	S	26.1	Very low	28.9	Very low	96 Å²	96	151.6 Å²	151.6	67%	0.671	76%	0.76	S	S	*	*			trans	-87.5	133.8	-178.1	53	0	0	0	0	113.9
651	Y	28.4	Very low	28.6	Very low	226 Å²	226	151.6 Å²	151.6	89%	0.886	76%	0.755	S	S	*	*			trans	-113.6	75.9	151.8	-76.2	-75.6	0	0	0	110
652	Q	27.8	Very low	28.5	Very low	150 Å²	150	148.9 Å²	148.9	70%	0.701	75%	0.753	S	S	*	*			trans	-68.4	127.6	158.1	-68.4	-178.6	-13.9	0	0	107.5	T654	Q652-T654 HydrophobicContact CB-CG2 3.85Å; Q652-T654 PolarHBondContact O-N 2.89Å
653	R	26.3	Very low	28.6	Very low	254 Å²	254	148.8 Å²	148.8	96%	0.958	76%	0.758	S	S	*	*			trans	-78.8	74.6	160.4	-174.8	176.6	-74.8	-139.1	-0.8	107.6
654	T	28	Very low	28.4	Very low	69 Å²	69	147.4 Å²	147.4	42%	0.423	76%	0.76	S	S	.	*			trans	-65.1	146.3	172.7	47.7	0	0	0	0	110.7	Q652 N656	Q652-T654 HydrophobicContact CB-CG2 3.85Å; Q652-T654 PolarHBondContact O-N 2.89Å; T654-N656 VanDerWaalsContact C-N 3.3Å; T654-N656 PolarHBondContact O-N 3.34Å; T654-N656 PolarHBondContact OG1-OD1 3.01Å
655	E	26.7	Very low	28.5	Very low	186 Å²	186	145.6 Å²	145.6	87%	0.869	76%	0.76	S	S	*	*			trans	-65.4	86.5	165.6	-63.3	172.9	172.1	0	0	109.8	V657	E655-V657 VanDerWaalsContact C-N 3.35Å; E655-V657 PolarHBondContact O-N 3.28Å
656	N	28.2	Very low	28.3	Very low	138 Å²	138	145.1 Å²	145.1	74%	0.738	76%	0.757	S	S	*	*			trans	-88	79.8	171.3	-78.1	-8.2	0	0	0	109.8	T654 N658	T654-N656 VanDerWaalsContact C-N 3.3Å; T654-N656 PolarHBondContact O-N 3.34Å; T654-N656 PolarHBondContact OG1-OD1 3.01Å; N656-N658 PolarHBondContact O-N 3.34Å
657	V	28.4	Very low	28.5	Very low	96 Å²	96	150.2 Å²	150.2	58%	0.582	77%	0.768	S	S	*	*			trans	-54.8	118	165.7	-179.4	0	0	0	0	108.4	E655 W659	E655-V657 VanDerWaalsContact C-N 3.35Å; E655-V657 PolarHBondContact O-N 3.28Å; V657-W659 VanDerWaalsContact C-N 3.29Å; V657-W659 HydrophobicContact CG1-CD2 4.38Å; V657-W659 HydrophobicContact CG1-CG 4.18Å; V657-W659 VanDerWaalsContact O-CD1 3.3Å; V657-W659 PolarHBondContact O-N 3.02Å
658	N	30.8	Very low	28.5	Very low	146 Å²	146	151.9 Å²	151.9	78%	0.781	77%	0.771	S	S	*	*			trans	-81.7	77.3	-176.2	-155	10.6	0	0	0	110.3	N656 I660	N656-N658 PolarHBondContact O-N 3.34Å; N658-I660 PolarHBondContact O-N 3.16Å
659	W	25.6	Very low	28.8	Very low	201 Å²	201	146.9 Å²	146.9	76%	0.761	77%	0.767	S	S	*	*			trans	-66.3	84.8	-179	-75.3	93.9	0	0	0	112.2	V657 N661	V657-W659 VanDerWaalsContact C-N 3.29Å; V657-W659 HydrophobicContact CG1-CD2 4.38Å; V657-W659 HydrophobicContact CG1-CG 4.18Å; V657-W659 VanDerWaalsContact O-CD1 3.3Å; V657-W659 PolarHBondContact O-N 3.02Å; W659-N661 PolarHBondContact O-N 2.73Å
660	I	33	Very low	28.7	Very low	148 Å²	148	145.9 Å²	145.9	76%	0.759	76%	0.763	S	S	*	*			trans	-80.2	103.4	162.9	-59.9	-178.2	0	0	0	107.9	N658 A662	N658-I660 PolarHBondContact O-N 3.16Å; I660-A662 PolarHBondContact O-N 3.45Å; I660-A662 VanDerWaalsContact O-N 3.09Å
661	N	26.6	Very low	28.8	Very low	138 Å²	138	147.3 Å²	147.3	74%	0.738	76%	0.763	S	S	*	*			trans	-67	104.7	-179.6	-70.5	-50.5	0	0	0	111.8	W659	W659-N661 PolarHBondContact O-N 2.73Å
662	A	28.7	Very low	29.1	Very low	95 Å²	95	143.3 Å²	143.3	79%	0.785	76%	0.756	S	S	*	*			trans	-105.7	103.5	162.5	0	0	0	0	0	109	I660	I660-A662 PolarHBondContact O-N 3.45Å; I660-A662 VanDerWaalsContact O-N 3.09Å
663	T	31.8	Very low	29.3	Very low	129 Å²	129	142.6 Å²	142.6	79%	0.791	76%	0.757	S	S	*	*			trans	-66.7	143.8	-176.4	39	0	0	0	0	113
664	P	27.4	Very low	29.3	Very low	126 Å²	126	138.8 Å²	138.8	82%	0.818	74%	0.744	S	S	*	*			trans	-76.6	128.4	-179.6	31	-34.6	0	0	0	112
665	S	31.3	Very low	29.5	Very low	114 Å²	114	143.4 Å²	143.4	80%	0.797	77%	0.766	S	S	*	*			trans	-117.4	98.2	172.3	59.8	0	0	0	0	111
666	N	26.4	Very low	29.6	Very low	145 Å²	145	141.6 Å²	141.6	78%	0.775	76%	0.757	S	S	*	*			trans	-60.8	133.5	165.1	-86.9	-73.9	0	0	0	110.3
667	L	32.1	Very low	29.8	Very low	173 Å²	173	140.7 Å²	140.7	91%	0.906	76%	0.762	S	S	*	*			trans	-155.8	129.9	152.9	-111.8	150.7	0	0	0	110.3
668	H	27.5	Very low	30	Very low	170 Å²	170	142.3 Å²	142.3	79%	0.787	77%	0.772	S	S	*	*			trans	-84.6	138.8	179.5	-71.6	20.4	0	0	0	111.8
669	S	32.9	Very low	29.6	Very low	109 Å²	109	145.3 Å²	145.3	76%	0.762	77%	0.774	S	S	*	*			trans	-157.1	108.5	133.3	-168.4	0	0	0	0	106.3
670	Q	28.5	Very low	29.9	Very low	155 Å²	155	143.4 Å²	143.4	72%	0.724	78%	0.777	S	S	*	*				55.2	125.5	77.7	-90.7	-155.7	-16.9	0	0	115
671	N	28.8	Very low	29.7	Very low	126 Å²	126	141.5 Å²	141.5	67%	0.674	77%	0.773	S	S	*	*			trans	70.2	140.7	165.2	-44.5	-24.4	0	0	0	113
672	D	34	Very low	29.9	Very low	141 Å²	141	142.4 Å²	142.4	75%	0.754	78%	0.777	S	S	*	*			cis	-146.3	174.1	16	-88.4	-55.9	0	0	0	108.7
673	L	32.1	Very low	29.9	Very low	136 Å²	136	142.7 Å²	142.7	71%	0.712	77%	0.773	S	S	*	*			cis	-176	138.7	-25.7	-178.7	74.3	0	0	0	105.8
674	Y	27.1	Very low	29.9	Very low	174 Å²	174	147.4 Å²	147.4	68%	0.682	78%	0.778	S	S	*	*			trans	25.7	124.3	164.2	-82.3	-108.5	0	0	0	120.7
675	N	32.8	Very low	30.1	Very low	165 Å²	165	146.6 Å²	146.6	88%	0.882	77%	0.771	S	S	*	*				-153.7	147.1	106.1	-112.8	-37.9	0	0	0	113.6
676	Q	27.5	Very low	30.2	Very low	148 Å²	148	150.3 Å²	150.3	69%	0.692	78%	0.776	S	S	*	*			trans	-100.3	148.1	176.1	-63.9	176.7	1	0	0	110.2
677	S	32.8	Very low	30.7	Very low	119 Å²	119	151.2 Å²	151.2	83%	0.832	78%	0.775	S	S	*	*			trans	-153.6	81	160.8	-79.3	0	0	0	0	111.2
678	T	32.7	Very low	30.7	Very low	130 Å²	130	154.2 Å²	154.2	80%	0.798	77%	0.774	S	S	*	*			trans	33.5	115.4	141.6	-45.6	0	0	0	0	119.6
679	Y	22.5	Very low	31.3	Very low	209 Å²	209	153.5 Å²	153.5	82%	0.82	78%	0.776	S	S	*	*			trans	-61.8	149.9	163.5	-60.1	-98.9	0	0	0	112.9
680	I	31.7	Very low	31.4	Very low	161 Å²	161	154.3 Å²	154.3	83%	0.826	78%	0.777	S	S	*	*			trans	-128.3	126.2	143.2	-62.2	-177.3	0	0	0	108
681	T	28.1	Very low	31.9	Very low	109 Å²	109	153 Å²	153	67%	0.669	79%	0.785	S	S	*	*			trans	-104.3	124.2	179.8	48.9	0	0	0	0	110.5
682	N	30.5	Very low	32.3	Very low	157 Å²	157	152.5 Å²	152.5	84%	0.84	79%	0.791	S	S	*	*			trans	-98	90.8	166.8	-79.5	-7.6	0	0	0	109.8
683	S	30.2	Very low	32.4	Very low	100 Å²	100	152.4 Å²	152.4	70%	0.699	80%	0.796	S	S	*	*			trans	-81.9	116.6	166.6	52.8	0	0	0	0	109.8
684	Y	30.6	Very low	32.5	Very low	228 Å²	228	156.5 Å²	156.5	89%	0.894	80%	0.802	S	S	*	*			trans	-92.4	125.7	168.5	-117.8	-94.4	0	0	0	110
685	T	32.6	Very low	32.7	Very low	110 Å²	110	153.5 Å²	153.5	68%	0.675	81%	0.806	S	S	*	*			trans	-106.9	114.5	177.2	48.3	0	0	0	0	109.8
686	E	33.4	Very low	32.9	Very low	192 Å²	192	151.9 Å²	151.9	90%	0.897	80%	0.803	S	S	*	*			trans	-89.6	140.1	163.1	-73.1	-163.4	134.1	0	0	110.9
687	H	35.7	Very low	33.3	Very low	163 Å²	163	149.6 Å²	149.6	76%	0.755	80%	0.8	S	S	*	*			trans	-82.1	133.7	-174.4	-85.8	-119.7	0	0	0	111.9
688	R	32.7	Very low	33.6	Very low	236 Å²	236	151.7 Å²	151.7	89%	0.891	80%	0.801	S	S	*	*			trans	-86.3	104	161	-78.6	-176.2	171.7	-179.7	-1.9	109.7
689	D	39.5	Very low	33.8	Very low	155 Å²	155	154.7 Å²	154.7	83%	0.829	80%	0.799	S	S	*	*			trans	-78.8	123.4	163.3	-82.5	-35.4	0	0	0	110.5
690	T	35.9	Very low	34.5	Very low	126 Å²	126	150.5 Å²	150.5	77%	0.773	80%	0.797	S	S	*	*			trans	-102.6	130.9	176	54.3	0	0	0	0	109.8
691	S	38.7	Very low	34.9	Very low	127 Å²	127	149.5 Å²	149.5	89%	0.888	80%	0.799	S	S	*	*			trans	-148.1	126.1	169.2	-81.7	0	0	0	0	109.6
692	S	36.7	Very low	35.4	Very low	116 Å²	116	149.7 Å²	149.7	81%	0.811	81%	0.805	S	S	*	*			trans	-108.4	130	-166.5	177.3	0	0	0	0	112
693	T	36.5	Very low	35.8	Very low	140 Å²	140	153.2 Å²	153.2	86%	0.859	81%	0.808	S	S	*	*			trans	-150	100.5	157.8	-0.7	0	0	0	0	114.8
694	R	33.7	Very low	36.3	Very low	222 Å²	222	153.2 Å²	153.2	84%	0.838	81%	0.807	S	S	*	*				58.5	88.1	128.7	-162.2	-179.4	-173.5	178.2	2.6	120.4
695	S	32	Very low	37.2	Very low	110 Å²	110	147.3 Å²	147.3	77%	0.769	80%	0.797	S	S	*	*				16.5	120.9	128.5	-36.3	0	0	0	0	121
696	V	36	Very low	37.4	Very low	132 Å²	132	151 Å²	151	80%	0.8	80%	0.8	S	S	*	*			trans	-143.8	124.8	141.8	-177.9	0	0	0	0	109
697	P	36.9	Very low	38.1	Very low	100 Å²	100	153.5 Å²	153.5	65%	0.649	80%	0.801	S	S	*	*			trans	-88.3	139.1	169.6	33.9	-31.1	0	0	0	111.3
698	I	39.4	Very low	39	Very low	163 Å²	163	153.1 Å²	153.1	84%	0.836	80%	0.8	S	S	*	*			trans	-104.5	119.9	171.9	-63.8	177.9	0	0	0	108.5
699	Y	37	Very low	40.1	Very low	192 Å²	192	155.1 Å²	155.1	75%	0.753	82%	0.816	S	S	*	*			trans	-76.3	148.7	178.7	-76.1	-95.6	0	0	0	112
700	P	37.7	Very low	40.2	Very low	122 Å²	122	155.2 Å²	155.2	79%	0.792	82%	0.815	S	S	*	*			trans	-71.3	142.1	170.6	31.5	-34.6	0	0	0	110.7
701	T	40.2	Very low	40.4	Very low	140 Å²	140	156.7 Å²	156.7	86%	0.859	82%	0.817	S	S	*	*			trans	-125.2	111	172.1	41.6	0	0	0	0	110.3
702	S	38.3	Very low	40.5	Very low	113 Å²	113	158.3 Å²	158.3	79%	0.79	81%	0.813	S	S	*	*			trans	-91.1	132	168.3	50	0	0	0	0	109.7
703	Y	37.9	Very low	40.7	Very low	231 Å²	231	160.8 Å²	160.8	91%	0.906	81%	0.813	S	S	*	*			trans	-149.2	113.2	165.3	-124.6	-87.2	0	0	0	110.5
704	S	40.9	Very low	41	Very low	99 Å²	99	162.1 Å²	162.1	69%	0.692	81%	0.81	S	S	*	*			trans	-90.1	156.9	160.6	-171.6	0	0	0	0	108.1
705	P	48.8	Very low	41.4	Very low	104 Å²	104	158.1 Å²	158.1	68%	0.675	81%	0.809	S	S	*	*				-149.2	146.9	104.8	35.4	-18.4	0	0	0	116.6
706	Y	38.1	Very low	42.1	Very low	189 Å²	189	161.6 Å²	161.6	74%	0.741	81%	0.811	S	S	*	*			trans	47.3	121.7	140.3	-78.3	-105.8	0	0	0	121.1	Q708	Y706-Q708 HydrophobicContact CD1-CG 4.29Å; Y706-Q708 HydrophobicContact CE1-CG 4.46Å
707	R	48.4	Very low	42.6	Very low	244 Å²	244	163.8 Å²	163.8	92%	0.921	81%	0.812	S	S	*	*				-140.8	127.5	122.1	-121.8	177.7	-160.6	-110.8	1.4	110.6
708	Q	53.9	Low	43.1	Very low	155 Å²	155	169.2 Å²	169.2	72%	0.724	83%	0.826	S	S	*	*			trans	-91.3	136	167.3	-67.7	170.4	-53.2	0	0	108.8	Y706	Y706-Q708 HydrophobicContact CD1-CG 4.29Å; Y706-Q708 HydrophobicContact CE1-CG 4.46Å
709	F	56.2	Low	43.4	Very low	278 Å²	278	169.7 Å²	169.7	100%	1.219	83%	0.825	S	S	*	*			trans	-163.2	0	132.9	-101.4	-63.8	0	0	0	109.2

Retrieved 709 of 709 residues in 397.6 ms (Link to these results)

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