G4LXP3_SCHMA Loading...

Enhancer of polycomb-like protein

AlphaFold DB , UniProt , Accession G4LXP3, Species SCHMA (Schistosoma mansoni, Blood fluke), Gene n/a, Length 695 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	35.1	Very low	56.1	Low	250 Å²	250	172.6 Å²	172.6	100%	1.232	86%	0.862	S	S	*	*				0	107.9	0	-81.4	-156	170.1	0	0	109.2
2	S	48.6	Very low	57.8	Low	113 Å²	113	166.2 Å²	166.2	79%	0.79	83%	0.832	S	S	*	*			trans	-140.9	104.9	162.2	46.1	0	0	0	0	106.5	V4	S2-V4 PolarHBondContact O-N 3.46Å
3	K	49.8	Very low	59.2	Low	219 Å²	219	168.3 Å²	168.3	95%	0.952	83%	0.834	S	S	*	*			trans	-68.8	110.7	176.3	-79.5	178.3	175.9	176.5	0	107.7	S5	K3-S5 PolarHBondContact O-N 3.46Å
4	V	52.3	Low	60.7	Low	117 Å²	117	166.6 Å²	166.6	71%	0.709	83%	0.83	S	S	*	*			trans	-68.9	115.1	174.2	179	0	0	0	0	107.8	S2 F6	S2-V4 PolarHBondContact O-N 3.46Å; V4-F6 PolarHBondContact O-N 3.41Å
5	S	54.3	Low	61.8	Low	100 Å²	100	165.1 Å²	165.1	70%	0.699	82%	0.816	S	S	*	*			trans	-68.9	122.4	178	64.6	0	0	0	0	110.4	K3 R7	K3-S5 PolarHBondContact O-N 3.46Å; S5-R7 PolarHBondContact O-N 3.38Å
6	F	51.5	Low	62.6	Low	189 Å²	189	161.8 Å²	161.8	83%	0.829	81%	0.811	S	S	*	*			trans	-66.1	111.3	163	-77.6	-93.8	0	0	0	108.7	V4	V4-F6 PolarHBondContact O-N 3.41Å
7	R	60.8	Low	63.3	Low	233 Å²	233	161.8 Å²	161.8	88%	0.879	81%	0.812	S	S	*	*	P	Polyproline II helix	trans	-88.4	118.6	160	-113.3	-176.2	179.7	170.7	0.1	107.2	S5 R9	S5-R7 PolarHBondContact O-N 3.38Å; R7-R9 PolarHBondContact O-N 3.5Å
8	A	63	Low	63.6	Low	102 Å²	102	158.3 Å²	158.3	84%	0.843	80%	0.803	S	S	*	*	P	Polyproline II helix	trans	-56.5	123.4	169.3	0	0	0	0	0	108.8
9	R	64.6	Low	64	Low	236 Å²	236	158.2 Å²	158.2	89%	0.891	80%	0.803	S	S	*	*	P	Polyproline II helix	trans	-78.2	143.9	169.7	-60.2	-171.3	-163.5	-176.2	6.7	108.1	R7	R7-R9 PolarHBondContact O-N 3.5Å
10	Q	68.3	Low	64.2	Low	195 Å²	195	154 Å²	154	91%	0.911	78%	0.782	S	S	*	*	P	Polyproline II helix	trans	-57.8	139.5	171.1	-82.1	173.2	-33.5	0	0	110.1	D12	Q10-D12 PolarHBondContact O-N 3.06Å
11	I	68.8	Low	64.5	Low	145 Å²	145	154.1 Å²	154.1	74%	0.744	78%	0.777	S	S	*	*	P	Polyproline II helix	trans	-69	124.4	175	-59.6	168	0	0	0	107.4
12	D	76.4	Confident	65.6	Low	95 Å²	95	150.5 Å²	150.5	51%	0.508	76%	0.757	S	S	.	*			trans	-92.5	112.3	176.5	-176.2	-1.8	0	0	0	109.7	Q10 N14 K15	Q10-D12 PolarHBondContact O-N 3.06Å; D12-N14 PolarHBondContact O-N 3.3Å; D12-N14 PolarHBondContact OD1-N 2.74Å; D12-K15 HydrophobicContact CB-CB 4.28Å; D12-K15 WeakPolarHBondContact O-CB 3.48Å; D12-K15 PolarHBondContact O-N 2.76Å
13	F	76.1	Confident	66.4	Low	194 Å²	194	148.7 Å²	148.7	85%	0.851	76%	0.756	S	S	*	*	T	Hydrogen-bonded Turn	trans	-69.1	-18.1	-177.8	-37.7	-80	0	0	0	113.2
14	N	79.9	Confident	67	Low	145 Å²	145	139.9 Å²	139.9	78%	0.775	72%	0.722	S	S	*	*	T	Hydrogen-bonded Turn	trans	-89.4	-6	179.4	-64	-40.2	0	0	0	112.8	D12 P16	D12-N14 PolarHBondContact O-N 3.3Å; D12-N14 PolarHBondContact OD1-N 2.74Å; N14-P16 WeakPolarHBondContact O-CD 3.29Å
15	K	77.7	Confident	67.3	Low	143 Å²	143	140.5 Å²	140.5	62%	0.622	72%	0.717	S	S	*	*	S	Bend	trans	-77.7	118.7	-179.8	-167	177.9	-178.7	-173.7	0	109.2	D12 L17	D12-K15 HydrophobicContact CB-CB 4.28Å; D12-K15 WeakPolarHBondContact O-CB 3.48Å; D12-K15 PolarHBondContact O-N 2.76Å; K15-L17 PolarHBondContact O-N 3.11Å
16	P	74.6	Confident	67.4	Low	113 Å²	113	140.6 Å²	140.6	73%	0.734	71%	0.709	S	S	*	*	P	Polyproline II helix	trans	-60.9	132.8	178.5	24.4	-32.7	0	0	0	110.3	N14	N14-P16 WeakPolarHBondContact O-CD 3.29Å
17	L	73.7	Confident	67.9	Low	161 Å²	161	136.3 Å²	136.3	84%	0.843	69%	0.691	S	S	*	*	P	Polyproline II helix	trans	-64.8	130.6	175.1	-79.9	156.4	0	0	0	109.4	K15 I19	K15-L17 PolarHBondContact O-N 3.11Å; L17-I19 PolarHBondContact O-N 3.29Å
18	P	70.1	Confident	67.8	Low	100 Å²	100	132.3 Å²	132.3	65%	0.649	69%	0.686	S	S	*	*	P	Polyproline II helix	trans	-65.5	124.9	174.6	25.9	-31.2	0	0	0	109.7	L20	P18-L20 PolarHBondContact O-N 3.46Å
19	I	70	Confident	67.5	Low	155 Å²	155	132.9 Å²	132.9	80%	0.795	67%	0.671	S	S	*	*			trans	-78.3	108.7	173.1	-58.6	172.2	0	0	0	107.6	L17	L17-I19 PolarHBondContact O-N 3.29Å
20	L	69.3	Low	67.1	Low	75 Å²	75	126.9 Å²	126.9	39%	0.393	66%	0.655	S	S	.	*			trans	-85	119.2	175.7	-64.7	162.9	0	0	0	109.2	P18 L26 F27 I30	P18-L20 PolarHBondContact O-N 3.46Å; L20-L26 HydrophobicContact CD2-CB 3.7Å; L20-F27 HydrophobicContact CB-CD2 4.48Å; L20-I30 HydrophobicContact CD1-CD1 3.51Å; L20-I30 HydrophobicContact CD2-CD1 4.25Å
21	K	68.8	Low	66.3	Low	156 Å²	156	121.5 Å²	121.5	68%	0.678	64%	0.639	S	S	*	*			trans	-87.4	134.3	168.7	-76.6	-178.3	178.8	173.8	0	109.2	G23 S24	K21-G23 PolarHBondContact O-N 3.34Å; K21-G23 VanDerWaalsContact O-N 3.1Å; K21-S24 PolarHBondContact N-OG 3.31Å; K21-S24 WeakPolarHBondContact O-CB 3.42Å; K21-S24 PolarHBondContact O-N 3.36Å; K21-S24 PolarHBondContact O-OG 3.4Å
22	H	59.7	Low	65.5	Low	175 Å²	175	124.1 Å²	124.1	81%	0.81	65%	0.648	S	S	*	*	T	Hydrogen-bonded Turn	trans	-57.8	115.6	172	-165.7	66.4	0	0	0	108.9
23	G	65	Low	64.3	Low	74 Å²	74	125.5 Å²	125.5	76%	0.763	66%	0.656	S	S	*	*	T	Hydrogen-bonded Turn	trans	99.6	1.9	-173.4	0	0	0	0	0	116.2	K21	K21-G23 PolarHBondContact O-N 3.34Å; K21-G23 VanDerWaalsContact O-N 3.1Å
24	S	61.6	Low	63.3	Low	34 Å²	34	119 Å²	119	24%	0.238	64%	0.639	C	S	.	*			trans	-81.9	147.2	169.4	59.2	0	0	0	0	111.6	K21 L26 F27	K21-S24 PolarHBondContact N-OG 3.31Å; K21-S24 WeakPolarHBondContact O-CB 3.42Å; K21-S24 PolarHBondContact O-N 3.36Å; K21-S24 PolarHBondContact O-OG 3.4Å; S24-L26 PolarHBondContact O-N 3.15Å; S24-F27 VanDerWaalsContact O-CB 3.25Å; S24-F27 WeakPolarHBondContact O-CB 3.41Å; S24-F27 PolarHBondContact O-N 3.43Å
25	E	58.8	Low	62.1	Low	131 Å²	131	119.3 Å²	119.3	61%	0.612	64%	0.639	S	S	*	*	H	α-helix	trans	-57.3	-33.8	178.8	-72.2	163	158	0	0	112.2	F27 L28 E29	E25-F27 PolarHBondContact O-N 2.92Å; E25-F27 VanDerWaalsContact O-N 3.12Å; E25-L28 PolarHBondContact O-N 2.78Å; E25-E29 PolarHBondContact O-N 3.06Å
26	L	57.5	Low	60.9	Low	101 Å²	101	116.7 Å²	116.7	53%	0.529	64%	0.635	S	S	.	*	H	α-helix	trans	-59.5	-22.3	172.9	-71.5	169.5	0	0	0	114.1	L20 S24 I30	L20-L26 HydrophobicContact CD2-CB 3.7Å; S24-L26 PolarHBondContact O-N 3.15Å; L26-I30 WeakPolarHBondContact O-CG1 3.35Å
27	F	61.3	Low	59.8	Low	100 Å²	100	119.1 Å²	119.1	44%	0.439	64%	0.642	S	S	.	*	H	α-helix	trans	-79.1	-28	174.7	-170.6	-99.3	0	0	0	112.2	L20 S24 E25 I30	L20-F27 HydrophobicContact CB-CD2 4.48Å; S24-F27 VanDerWaalsContact O-CB 3.25Å; S24-F27 WeakPolarHBondContact O-CB 3.41Å; S24-F27 PolarHBondContact O-N 3.43Å; E25-F27 PolarHBondContact O-N 2.92Å; E25-F27 VanDerWaalsContact O-N 3.12Å; F27-I30 HydrophobicContact CD2-CD1 4.31Å
28	L	58.1	Low	58.7	Low	149 Å²	149	121.1 Å²	121.1	78%	0.78	64%	0.638	S	S	*	*	H	α-helix	trans	-84.4	-25.2	176.8	-73.7	161.5	0	0	0	112.2	E25 I30	E25-L28 PolarHBondContact O-N 2.78Å; L28-I30 VanDerWaalsContact C-N 3.3Å; L28-I30 PolarHBondContact O-N 2.65Å
29	E	56.6	Low	57.6	Low	114 Å²	114	120.4 Å²	120.4	53%	0.533	65%	0.649	S	S	.	*			trans	-83.3	2.1	178.9	-69.5	-174.3	165.8	0	0	114.8	E25 S31 A34	E25-E29 PolarHBondContact O-N 3.06Å; E29-S31 PolarHBondContact O-N 3.36Å; E29-A34 WeakPolarHBondContact O-CB 3.4Å
30	I	57.2	Low	56.8	Low	109 Å²	109	117.6 Å²	117.6	56%	0.559	64%	0.639	S	S	*	*			trans	-75.1	49.6	173.2	-42.2	177.7	0	0	0	110.4	L20 L26 F27 L28	L20-I30 HydrophobicContact CD1-CD1 3.51Å; L20-I30 HydrophobicContact CD2-CD1 4.25Å; L26-I30 WeakPolarHBondContact O-CG1 3.35Å; F27-I30 HydrophobicContact CD2-CD1 4.31Å; L28-I30 VanDerWaalsContact C-N 3.3Å; L28-I30 PolarHBondContact O-N 2.65Å
31	S	52.1	Low	56	Low	82 Å²	82	119.1 Å²	119.1	57%	0.573	65%	0.653	S	S	*	*	S	Bend	trans	-91.8	142.7	156.5	71.2	0	0	0	0	107.6	E29 N33 A34	E29-S31 PolarHBondContact O-N 3.36Å; S31-N33 PolarHBondContact O-N 2.6Å; S31-A34 PolarHBondContact O-N 3.47Å
32	E	50.7	Low	55.4	Low	200 Å²	200	119.4 Å²	119.4	94%	0.935	66%	0.657	S	S	*	*	T	Hydrogen-bonded Turn	trans	-56.5	7.5	-162.7	-64.4	177.9	147	0	0	117.3
33	N	50.9	Low	55.4	Low	124 Å²	124	116.8 Å²	116.8	66%	0.663	65%	0.648	S	S	*	*	T	Hydrogen-bonded Turn	trans	-129.2	1	-171.4	-64.7	-36.5	0	0	0	116.4	S31 L35	S31-N33 PolarHBondContact O-N 2.6Å; N33-L35 PolarHBondContact O-N 3.22Å
34	A	55.1	Low	55.1	Low	59 Å²	59	119.3 Å²	119.3	49%	0.488	65%	0.651	S	S	.	*	T	Hydrogen-bonded Turn	trans	-76.9	-8.8	-168.6	0	0	0	0	0	116.9	E29 S31 V36	E29-A34 WeakPolarHBondContact O-CB 3.4Å; S31-A34 PolarHBondContact O-N 3.47Å; A34-V36 PolarHBondContact O-N 3.39Å
35	L	56.3	Low	55	Low	151 Å²	151	120.8 Å²	120.8	79%	0.791	66%	0.661	S	S	*	*	T	Hydrogen-bonded Turn	trans	-93	19.8	-174.4	-85	109.8	0	0	0	116.1	N33 N37	N33-L35 PolarHBondContact O-N 3.22Å; L35-N37 PolarHBondContact O-N 3.02Å
36	V	52.5	Low	55.4	Low	88 Å²	88	118.7 Å²	118.7	53%	0.533	67%	0.674	S	S	.	*			trans	-96.3	83.3	-178.4	-168	0	0	0	0	111.2	A34 R38	A34-V36 PolarHBondContact O-N 3.39Å; V36-R38 HydrophobicContact CG1-CG 4.18Å; V36-R38 PolarHBondContact O-N 3.27Å
37	N	49.9	Very low	55.9	Low	164 Å²	164	116 Å²	116	88%	0.877	66%	0.66	S	S	*	*			trans	-54.5	102.2	168.2	-67.9	-11.7	0	0	0	110.4	L35	L35-N37 PolarHBondContact O-N 3.02Å
38	R	52.1	Low	56.5	Low	203 Å²	203	118 Å²	118	77%	0.766	67%	0.67	S	S	*	*			trans	-111.5	121.8	164.8	-72.2	-174.6	176.7	159.7	1.2	108	V36 V40	V36-R38 HydrophobicContact CG1-CG 4.18Å; V36-R38 PolarHBondContact O-N 3.27Å; R38-V40 PolarHBondContact O-N 3.44Å
39	G	46	Very low	57	Low	85 Å²	85	118.7 Å²	118.7	88%	0.876	67%	0.667	S	S	*	*	P	Polyproline II helix	trans	-63.8	117	174.8	0	0	0	0	0	110.6
40	V	53	Low	57.6	Low	95 Å²	95	121.1 Å²	121.1	58%	0.576	68%	0.678	S	S	*	*	P	Polyproline II helix	trans	-78.8	134.1	173.1	-179.8	0	0	0	0	108.4	R38 Q42	R38-V40 PolarHBondContact O-N 3.44Å; V40-Q42 PolarHBondContact O-N 3.28Å
41	P	52.7	Low	58	Low	108 Å²	108	120 Å²	120	70%	0.701	67%	0.671	S	S	*	*	P	Polyproline II helix	trans	-58.2	128	175.5	-21.2	31.8	0	0	0	111.5	I43	P41-I43 PolarHBondContact O-N 2.73Å
42	Q	56.9	Low	58.7	Low	161 Å²	161	117.9 Å²	117.9	75%	0.752	65%	0.652	S	S	*	*	P	Polyproline II helix	trans	-61.6	116.9	177.4	-91	-176	-40.4	0	0	111	V40	V40-Q42 PolarHBondContact O-N 3.28Å
43	I	59.3	Low	59.8	Low	121 Å²	121	113.3 Å²	113.3	62%	0.621	63%	0.634	S	S	*	*	P	Polyproline II helix	trans	-86.7	131.3	164.1	-58.3	172.4	0	0	0	106.2	P41 S45	P41-I43 PolarHBondContact O-N 2.73Å; I43-S45 PolarHBondContact O-N 3.43Å
44	P	59.2	Low	60.9	Low	127 Å²	127	112 Å²	112	83%	0.825	62%	0.623	S	S	*	*			trans	-64.5	109.6	-179.4	-4.8	15.4	0	0	0	109.8	G46	P44-G46 VanDerWaalsContact C-N 3.31Å; P44-G46 PolarHBondContact O-N 2.74Å
45	S	60	Low	61.8	Low	65 Å²	65	115.4 Å²	115.4	46%	0.455	63%	0.629	S	S	.	*			trans	-86.1	0.1	-173.9	-168.5	0	0	0	0	113.4	I43 M47 E52	I43-S45 PolarHBondContact O-N 3.43Å; S45-M47 PolarHBondContact O-N 2.7Å; S45-E52 WeakPolarHBondContact CB-OE1 3.42Å
46	G	67	Low	62.5	Low	86 Å²	86	112.9 Å²	112.9	89%	0.887	61%	0.613	S	S	*	*	S	Bend	trans	63.3	11.2	-178.4	0	0	0	0	0	114.2	P44	P44-G46 VanDerWaalsContact C-N 3.31Å; P44-G46 PolarHBondContact O-N 2.74Å
47	M	67.8	Low	63.3	Low	46 Å²	46	112 Å²	112	23%	0.227	60%	0.602	C	S	.	*	S	Bend	trans	-100.9	155.7	-177.8	-163.7	158.3	79.2	0	0	109.1	S45 E51 E52 F57	S45-M47 PolarHBondContact O-N 2.7Å; M47-E51 HydrophobicContact CE-CB 4.05Å; M47-E51 HydrophobicContact CG-CB 3.7Å; M47-E51 WeakPolarHBondContact CG-OE2 3.5Å; M47-E51 HydrophobicContact SD-CB 4.15Å; M47-E52 HydrophobicContact CB-CG 3.85Å; M47-E52 HydrophobicContact CE-CB 4.37Å; M47-E52 HydrophobicContact CE-CG 3.98Å; M47-E52 HydrophobicContact CG-CG 4.42Å; M47-F57 HydrophobicContact CE-CB 4.02Å; M47-F57 HydrophobicContact CE-CD1 3.63Å; M47-F57 HydrophobicContact CE-CE1 4.19Å; M47-F57 HydrophobicContact CE-CG 3.85Å; M47-F57 HydrophobicContact SD-CD1 3.91Å; M47-F57 HydrophobicContact SD-CE1 3.9Å
48	E	72.9	Confident	64.4	Low	141 Å²	141	107.5 Å²	107.5	66%	0.659	58%	0.578	S	S	*	*			trans	-66.3	143.5	177.2	-71.8	-168.4	170.8	0	0	110.1	E50 E51 E52	E48-E50 PolarHBondContact O-N 2.99Å; E48-E51 WeakPolarHBondContact O-CB 3.34Å; E48-E51 PolarHBondContact O-N 2.95Å; E48-E52 PolarHBondContact O-N 3.28Å
49	K	69.6	Low	65.5	Low	164 Å²	164	100.5 Å²	100.5	71%	0.713	55%	0.554	S	S	*	*	T	Hydrogen-bonded Turn	trans	-58.4	-26.1	-172.8	-171.6	178.8	177.9	-176.9	0	113.6	N53	K49-N53 PolarHBondContact O-ND2 3.34Å
50	E	67.7	Low	66.7	Low	164 Å²	164	97.9 Å²	97.9	77%	0.766	52%	0.521	S	S	*	.	T	Hydrogen-bonded Turn	trans	-75.3	-41.6	177	-74.4	175	176.5	0	0	111.6	E48 N53	E48-E50 PolarHBondContact O-N 2.99Å; E50-N53 PolarHBondContact O-N 3.49Å
51	E	67.6	Low	67.6	Low	87 Å²	87	95.7 Å²	95.7	41%	0.407	51%	0.505	S	S	.	.	G	3₁₀ helix	trans	-65.3	-38.2	174	-70.7	179	165.6	0	0	111.4	M47 E48 N53 E54	M47-E51 HydrophobicContact CE-CB 4.05Å; M47-E51 HydrophobicContact CG-CB 3.7Å; M47-E51 WeakPolarHBondContact CG-OE2 3.5Å; M47-E51 HydrophobicContact SD-CB 4.15Å; E48-E51 WeakPolarHBondContact O-CB 3.34Å; E48-E51 PolarHBondContact O-N 2.95Å; E51-N53 PolarHBondContact O-N 3Å; E51-N53 VanDerWaalsContact O-N 3.08Å; E51-E54 WeakPolarHBondContact O-CB 3.43Å; E51-E54 PolarHBondContact O-N 3.29Å; E51-E54 VanDerWaalsContact O-N 3.1Å
52	E	65.9	Low	68.7	Low	36 Å²	36	95.4 Å²	95.4	17%	0.168	50%	0.495	C	S	.	.	G	3₁₀ helix	trans	-60.5	-19.8	177.4	-70.8	-174.1	165.9	0	0	113.7	S45 M47 E48 L58	S45-E52 WeakPolarHBondContact CB-OE1 3.42Å; M47-E52 HydrophobicContact CB-CG 3.85Å; M47-E52 HydrophobicContact CE-CB 4.37Å; M47-E52 HydrophobicContact CE-CG 3.98Å; M47-E52 HydrophobicContact CG-CG 4.42Å; E48-E52 PolarHBondContact O-N 3.28Å; E52-L58 VanDerWaalsContact O-CD2 3.28Å; E52-L58 WeakPolarHBondContact O-CD2 3.45Å
53	N	72.7	Confident	69.4	Low	105 Å²	105	88.3 Å²	88.3	56%	0.561	46%	0.464	S	S	*	.	G	3₁₀ helix	trans	-94.5	-2.8	179.8	-62.8	-41.9	0	0	0	113.6	K49 E50 E51	K49-N53 PolarHBondContact O-ND2 3.34Å; E50-N53 PolarHBondContact O-N 3.49Å; E51-N53 PolarHBondContact O-N 3Å; E51-N53 VanDerWaalsContact O-N 3.08Å
54	E	74.6	Confident	70	Confident	95 Å²	95	88.8 Å²	88.8	44%	0.444	47%	0.467	S	S	.	.			trans	-69.4	132.9	178.3	-72.3	-174.5	-167.3	0	0	110.9	E51 H56 F57 L58	E51-E54 WeakPolarHBondContact O-CB 3.43Å; E51-E54 PolarHBondContact O-N 3.29Å; E51-E54 VanDerWaalsContact O-N 3.1Å; E54-H56 VanDerWaalsContact C-N 3.31Å; E54-H56 PolarHBondContact O-N 2.76Å; E54-F57 HydrophobicContact CB-CB 4.46Å; E54-F57 HydrophobicContact CB-CD2 3.68Å; E54-F57 HydrophobicContact CB-CE2 4.48Å; E54-F57 HydrophobicContact CG-CD2 4.43Å; E54-F57 PolarHBondContact O-N 2.74Å; E54-F57 VanDerWaalsContact O-N 3.09Å; E54-F57 WeakPolarHBondContact OE2-CD2 3.42Å; E54-F57 VanDerWaalsContact OE2-CE2 3.22Å; E54-F57 WeakPolarHBondContact OE2-CE2 3.34Å; E54-L58 PolarHBondContact O-N 3.39Å
55	H	74.2	Confident	70.7	Confident	131 Å²	131	86.9 Å²	86.9	61%	0.606	45%	0.447	S	S	*	.	H	α-helix	trans	-53.3	-46.7	-173.4	-177.4	-79.3	0	0	0	112.8	F57 L58 E59	H55-F57 VanDerWaalsContact C-N 3.33Å; H55-F57 PolarHBondContact O-N 2.87Å; H55-L58 PolarHBondContact O-N 3.18Å; H55-E59 IonicContact CE1-OE2 3.96Å; H55-E59 PolarHBondContact CE1-OE2 3.23Å; H55-E59 IonicContact ND1-OE2 3.52Å; H55-E59 PolarHBondContact ND1-OE2 2.92Å; H55-E59 WeakPolarHBondContact O-CB 3.45Å; H55-E59 PolarHBondContact O-N 2.91Å
56	H	71.2	Confident	71.1	Confident	99 Å²	99	89.8 Å²	89.8	46%	0.458	46%	0.457	S	S	.	.	H	α-helix	trans	-66.5	-34.6	-177.7	-59.8	-53	0	0	0	112.4	E54 E59 V60	E54-H56 VanDerWaalsContact C-N 3.31Å; E54-H56 PolarHBondContact O-N 2.76Å; H56-E59 IonicContact ND1-OE2 3.51Å; H56-E59 PolarHBondContact O-N 3.04Å; H56-V60 WeakPolarHBondContact O-CB 3.24Å; H56-V60 WeakPolarHBondContact O-CG2 3.11Å; H56-V60 PolarHBondContact O-N 3.33Å
57	F	69.3	Low	70.8	Confident	68 Å²	68	96.7 Å²	96.7	30%	0.298	46%	0.456	S	S	.	.	H	α-helix	trans	-69.7	-42.1	175.1	-77.7	-84.1	0	0	0	111.5	M47 E54 H55 E59 V60 I61	M47-F57 HydrophobicContact CE-CB 4.02Å; M47-F57 HydrophobicContact CE-CD1 3.63Å; M47-F57 HydrophobicContact CE-CE1 4.19Å; M47-F57 HydrophobicContact CE-CG 3.85Å; M47-F57 HydrophobicContact SD-CD1 3.91Å; M47-F57 HydrophobicContact SD-CE1 3.9Å; E54-F57 HydrophobicContact CB-CB 4.46Å; E54-F57 HydrophobicContact CB-CD2 3.68Å; E54-F57 HydrophobicContact CB-CE2 4.48Å; E54-F57 HydrophobicContact CG-CD2 4.43Å; E54-F57 PolarHBondContact O-N 2.74Å; E54-F57 VanDerWaalsContact O-N 3.09Å; E54-F57 WeakPolarHBondContact OE2-CD2 3.42Å; E54-F57 VanDerWaalsContact OE2-CE2 3.22Å; E54-F57 WeakPolarHBondContact OE2-CE2 3.34Å; H55-F57 VanDerWaalsContact C-N 3.33Å; H55-F57 PolarHBondContact O-N 2.87Å; F57-E59 VanDerWaalsContact C-N 3.28Å; F57-E59 PolarHBondContact O-N 2.97Å; F57-V60 PolarHBondContact O-N 3.38Å; F57-I61 WeakPolarHBondContact O-CB 3.12Å; F57-I61 WeakPolarHBondContact O-CD1 3.38Å; F57-I61 WeakPolarHBondContact O-CG1 3.36Å; F57-I61 PolarHBondContact O-N 2.88Å
58	L	73.7	Confident	70.4	Confident	70 Å²	70	97.9 Å²	97.9	37%	0.366	47%	0.466	S	S	.	.	H	α-helix	trans	-60.2	-41.1	174.3	-69.2	173.2	0	0	0	111.5	E52 E54 H55 Q62	E52-L58 VanDerWaalsContact O-CD2 3.28Å; E52-L58 WeakPolarHBondContact O-CD2 3.45Å; E54-L58 PolarHBondContact O-N 3.39Å; H55-L58 PolarHBondContact O-N 3.18Å; L58-Q62 VanDerWaalsContact O-CB 3.25Å; L58-Q62 WeakPolarHBondContact O-CB 3.46Å; L58-Q62 WeakPolarHBondContact O-CG 3.46Å; L58-Q62 PolarHBondContact O-N 3.05Å
59	E	74	Confident	69.7	Low	56 Å²	56	99.2 Å²	99.2	26%	0.262	48%	0.478	S	S	.	.	H	α-helix	trans	-66.6	-45.1	178.9	-163.4	169.9	-159.5	0	0	111.9	H55 H56 F57 Q62 A63 V72	H55-E59 IonicContact CE1-OE2 3.96Å; H55-E59 PolarHBondContact CE1-OE2 3.23Å; H55-E59 IonicContact ND1-OE2 3.52Å; H55-E59 PolarHBondContact ND1-OE2 2.92Å; H55-E59 WeakPolarHBondContact O-CB 3.45Å; H55-E59 PolarHBondContact O-N 2.91Å; H56-E59 IonicContact ND1-OE2 3.51Å; H56-E59 PolarHBondContact O-N 3.04Å; F57-E59 VanDerWaalsContact C-N 3.28Å; F57-E59 PolarHBondContact O-N 2.97Å; E59-Q62 PolarHBondContact O-N 3.01Å; E59-A63 WeakPolarHBondContact O-CB 3.35Å; E59-A63 PolarHBondContact O-N 3.06Å; E59-V72 HydrophobicContact CB-CG1 4.21Å; E59-V72 HydrophobicContact CG-CG1 3.83Å
60	V	71.2	Confident	69.1	Low	31 Å²	31	94.3 Å²	94.3	19%	0.188	46%	0.464	C	S	.	.	H	α-helix	trans	-62.6	-45.5	175	171.9	0	0	0	0	111	H56 F57 A63 L64 V72 I74	H56-V60 WeakPolarHBondContact O-CB 3.24Å; H56-V60 WeakPolarHBondContact O-CG2 3.11Å; H56-V60 PolarHBondContact O-N 3.33Å; F57-V60 PolarHBondContact O-N 3.38Å; V60-A63 PolarHBondContact O-N 3.22Å; V60-L64 HydrophobicContact CG1-CD1 3.8Å; V60-L64 HydrophobicContact CG1-CG 4.47Å; V60-L64 WeakPolarHBondContact O-CB 3.3Å; V60-L64 VanDerWaalsContact O-CG 3.3Å; V60-L64 WeakPolarHBondContact O-CG 3.48Å; V60-L64 PolarHBondContact O-N 2.82Å; V60-V72 HydrophobicContact CB-CG1 4.33Å; V60-V72 HydrophobicContact CG2-CB 4.45Å; V60-V72 HydrophobicContact CG2-CG1 3.65Å; V60-I74 HydrophobicContact CG2-CG1 4.4Å
61	I	71.8	Confident	68.7	Low	48 Å²	48	92.3 Å²	92.3	25%	0.246	46%	0.458	C	S	.	.	H	α-helix	trans	-64.2	-43	178.7	-69.7	167.2	0	0	0	110.5	F57 L64 Q65	F57-I61 WeakPolarHBondContact O-CB 3.12Å; F57-I61 WeakPolarHBondContact O-CD1 3.38Å; F57-I61 WeakPolarHBondContact O-CG1 3.36Å; F57-I61 PolarHBondContact O-N 2.88Å; I61-L64 PolarHBondContact O-N 3.47Å; I61-Q65 HydrophobicContact CG2-CG 4.34Å; I61-Q65 WeakPolarHBondContact O-CB 3.42Å; I61-Q65 WeakPolarHBondContact O-CG 3.11Å; I61-Q65 PolarHBondContact O-N 2.91Å
62	Q	75.5	Confident	68.3	Low	103 Å²	103	90.1 Å²	90.1	48%	0.481	45%	0.451	S	S	.	.	H	α-helix	trans	-63.6	-44	177.2	-76.3	172.4	36.4	0	0	111.4	L58 E59 Q65 L66	L58-Q62 VanDerWaalsContact O-CB 3.25Å; L58-Q62 WeakPolarHBondContact O-CB 3.46Å; L58-Q62 WeakPolarHBondContact O-CG 3.46Å; L58-Q62 PolarHBondContact O-N 3.05Å; E59-Q62 PolarHBondContact O-N 3.01Å; Q62-Q65 PolarHBondContact O-N 3.49Å; Q62-L66 WeakPolarHBondContact O-CB 3.33Å; Q62-L66 VanDerWaalsContact O-CG 3.22Å; Q62-L66 WeakPolarHBondContact O-CG 3.44Å; Q62-L66 PolarHBondContact O-N 3.25Å
63	A	72	Confident	68.4	Low	12 Å²	12	95.1 Å²	95.1	10%	0.099	47%	0.472	C	S	.	.	H	α-helix	trans	-63.4	-42.5	176.1	0	0	0	0	0	112.6	E59 V60 Q65 L66 R67 V72	E59-A63 WeakPolarHBondContact O-CB 3.35Å; E59-A63 PolarHBondContact O-N 3.06Å; V60-A63 PolarHBondContact O-N 3.22Å; A63-Q65 VanDerWaalsContact C-N 3.35Å; A63-Q65 PolarHBondContact O-N 3.5Å; A63-L66 PolarHBondContact O-N 3.36Å; A63-R67 PolarHBondContact O-N 3.13Å; A63-V72 HydrophobicContact CB-CB 3.76Å; A63-V72 HydrophobicContact CB-CG2 3.33Å
64	L	72.5	Confident	68.2	Low	130 Å²	130	95.3 Å²	95.3	68%	0.681	47%	0.472	S	S	*	.	H	α-helix	trans	-61.8	-41	174	-77.7	165	0	0	0	112.1	V60 I61	V60-L64 HydrophobicContact CG1-CD1 3.8Å; V60-L64 HydrophobicContact CG1-CG 4.47Å; V60-L64 WeakPolarHBondContact O-CB 3.3Å; V60-L64 VanDerWaalsContact O-CG 3.3Å; V60-L64 WeakPolarHBondContact O-CG 3.48Å; V60-L64 PolarHBondContact O-N 2.82Å; I61-L64 PolarHBondContact O-N 3.47Å
65	Q	72.8	Confident	68.2	Low	87 Å²	87	95 Å²	95	41%	0.407	48%	0.478	S	S	.	.	H	α-helix	trans	-69.9	-37.1	178.6	-76.7	174.2	-4.9	0	0	112.6	I61 Q62 A63 R67	I61-Q65 HydrophobicContact CG2-CG 4.34Å; I61-Q65 WeakPolarHBondContact O-CB 3.42Å; I61-Q65 WeakPolarHBondContact O-CG 3.11Å; I61-Q65 PolarHBondContact O-N 2.91Å; Q62-Q65 PolarHBondContact O-N 3.49Å; A63-Q65 VanDerWaalsContact C-N 3.35Å; A63-Q65 PolarHBondContact O-N 3.5Å; Q65-R67 PolarHBondContact O-N 3.25Å
66	L	70.2	Confident	68.3	Low	127 Å²	127	94.9 Å²	94.9	67%	0.665	49%	0.486	S	S	*	.	H	α-helix	trans	-78.3	-4.9	-179.4	-69.4	169.1	0	0	0	113.3	Q62 A63 T68	Q62-L66 WeakPolarHBondContact O-CB 3.33Å; Q62-L66 VanDerWaalsContact O-CG 3.22Å; Q62-L66 WeakPolarHBondContact O-CG 3.44Å; Q62-L66 PolarHBondContact O-N 3.25Å; A63-L66 PolarHBondContact O-N 3.36Å; L66-T68 HydrophobicContact CB-CG2 4.08Å; L66-T68 PolarHBondContact O-N 2.86Å; L66-T68 VanDerWaalsContact O-N 3.12Å
67	R	60.3	Low	68.9	Low	231 Å²	231	95.5 Å²	95.5	87%	0.872	50%	0.499	S	S	*	.	T	Hydrogen-bonded Turn	trans	48.1	34.4	-175.2	-63.5	-172.5	176.8	176.8	-0.8	112.4	A63 Q65	A63-R67 PolarHBondContact O-N 3.13Å; Q65-R67 PolarHBondContact O-N 3.25Å
68	T	59.7	Low	69.7	Low	70 Å²	70	100.7 Å²	100.7	43%	0.429	52%	0.524	S	S	.	.			trans	-84.3	130.2	174.5	45	0	0	0	0	107.9	L66 S70	L66-T68 HydrophobicContact CB-CG2 4.08Å; L66-T68 PolarHBondContact O-N 2.86Å; L66-T68 VanDerWaalsContact O-N 3.12Å; T68-S70 WeakPolarHBondContact CB-OG 3.45Å; T68-S70 PolarHBondContact O-N 3.5Å; T68-S70 PolarHBondContact O-OG 2.99Å; T68-S70 PolarHBondContact OG1-OG 2.96Å
69	D	56.6	Low	70.3	Confident	170 Å²	170	105.6 Å²	105.6	91%	0.909	55%	0.549	S	S	*	.			trans	-64.8	10.7	172.6	-70.9	-25.9	0	0	0	112.8	D71	D69-D71 PolarHBondContact O-N 3.45Å
70	S	58.3	Low	70.8	Confident	61 Å²	61	108.9 Å²	108.9	43%	0.427	57%	0.567	S	S	.	*			trans	-62.2	106.1	167.9	51.4	0	0	0	0	107.9	T68 V72	T68-S70 WeakPolarHBondContact CB-OG 3.45Å; T68-S70 PolarHBondContact O-N 3.5Å; T68-S70 PolarHBondContact O-OG 2.99Å; T68-S70 PolarHBondContact OG1-OG 2.96Å; S70-V72 PolarHBondContact O-N 2.83Å
71	D	58.8	Low	71.5	Confident	121 Å²	121	113.7 Å²	113.7	65%	0.647	59%	0.592	S	S	*	*			trans	-59.3	70.2	169.6	-104	-21.6	0	0	0	109.6	D69 K73	D69-D71 PolarHBondContact O-N 3.45Å; D71-K73 HydrophobicContact CB-CD 4.07Å; D71-K73 HydrophobicContact CB-CG 4.24Å; D71-K73 PolarHBondContact O-N 2.66Å; D71-K73 WeakPolarHBondContact OD1-CE 3.32Å; D71-K73 IonicContact OD1-NZ 3.11Å; D71-K73 PolarHBondContact OD1-NZ 3.17Å; D71-K73 VanDerWaalsContact OD2-CE 3.31Å; D71-K73 WeakPolarHBondContact OD2-CE 3.41Å; D71-K73 IonicContact OD2-NZ 3.05Å; D71-K73 PolarHBondContact OD2-NZ 2.92Å
72	V	59.8	Low	72.1	Confident	42 Å²	42	117.9 Å²	117.9	26%	0.255	61%	0.608	S	S	.	*			trans	-73.8	85	169.4	-175.1	0	0	0	0	106.1	E59 V60 A63 S70	E59-V72 HydrophobicContact CB-CG1 4.21Å; E59-V72 HydrophobicContact CG-CG1 3.83Å; V60-V72 HydrophobicContact CB-CG1 4.33Å; V60-V72 HydrophobicContact CG2-CB 4.45Å; V60-V72 HydrophobicContact CG2-CG1 3.65Å; A63-V72 HydrophobicContact CB-CB 3.76Å; A63-V72 HydrophobicContact CB-CG2 3.33Å; S70-V72 PolarHBondContact O-N 2.83Å
73	K	66.9	Low	72.4	Confident	140 Å²	140	117.8 Å²	117.8	61%	0.609	61%	0.608	S	S	*	*			trans	-95.6	132.6	-179.9	-74.4	170.3	169.7	160.3	0	108.1	D71	D71-K73 HydrophobicContact CB-CD 4.07Å; D71-K73 HydrophobicContact CB-CG 4.24Å; D71-K73 PolarHBondContact O-N 2.66Å; D71-K73 WeakPolarHBondContact OD1-CE 3.32Å; D71-K73 IonicContact OD1-NZ 3.11Å; D71-K73 PolarHBondContact OD1-NZ 3.17Å; D71-K73 VanDerWaalsContact OD2-CE 3.31Å; D71-K73 WeakPolarHBondContact OD2-CE 3.41Å; D71-K73 IonicContact OD2-NZ 3.05Å; D71-K73 PolarHBondContact OD2-NZ 2.92Å
74	I	69.7	Low	72.8	Confident	110 Å²	110	123.8 Å²	123.8	56%	0.564	64%	0.638	S	S	*	*			trans	-53	125	169.2	-60.2	170.5	0	0	0	107.3	V60 V76	V60-I74 HydrophobicContact CG2-CG1 4.4Å; I74-V76 PolarHBondContact O-N 3.4Å
75	P	74	Confident	73.5	Confident	89 Å²	89	122.7 Å²	122.7	58%	0.578	63%	0.633	S	S	*	*			trans	-62.7	115.4	-176.5	24.1	-32.6	0	0	0	109.6
76	V	77.1	Confident	74.1	Confident	127 Å²	127	125 Å²	125	77%	0.77	64%	0.639	S	S	*	*	P	Polyproline II helix	trans	-91.7	123.6	172.3	-178.8	0	0	0	0	107.3	I74	I74-V76 PolarHBondContact O-N 3.4Å
77	P	83.8	Confident	74.9	Confident	113 Å²	113	124.9 Å²	124.9	73%	0.734	63%	0.633	S	S	*	*	P	Polyproline II helix	trans	-55.1	140.7	175.2	-25.4	34	0	0	0	111.9
78	E	86.1	Confident	76.1	Confident	177 Å²	177	118.3 Å²	118.3	83%	0.827	62%	0.623	S	S	*	*	P	Polyproline II helix	trans	-65.3	139.6	174.8	-65.4	-178.2	175.9	0	0	110.9	I80	E78-I80 PolarHBondContact O-N 3.25Å
79	I	84.8	Confident	77.4	Confident	172 Å²	172	119.4 Å²	119.4	88%	0.882	63%	0.629	S	S	*	*			trans	-83	110.8	175.1	-57.9	172.8	0	0	0	107.9
80	I	85.7	Confident	78.9	Confident	126 Å²	126	118.1 Å²	118.1	65%	0.646	61%	0.612	S	S	*	*			trans	-93.9	117.8	176.2	-55.4	172.6	0	0	0	108.6	E78 K82	E78-I80 PolarHBondContact O-N 3.25Å; I80-K82 HydrophobicContact CG2-CG 4.18Å
81	D	84.3	Confident	80.1	Confident	132 Å²	132	120 Å²	120	71%	0.706	62%	0.623	S	S	*	*			trans	-77.3	127.6	174.9	-169	-1.8	0	0	0	110.9	E83	D81-E83 PolarHBondContact OD1-N 3.25Å
82	K	85.6	Confident	81.2	Confident	135 Å²	135	121.8 Å²	121.8	59%	0.587	63%	0.633	S	S	*	*			trans	-135.9	32.5	178.9	-65.7	-167	175.6	-172.5	0	111.8	I80 N84 D85 Y86	I80-K82 HydrophobicContact CG2-CG 4.18Å; K82-N84 VanDerWaalsContact C-N 3.27Å; K82-N84 PolarHBondContact O-N 3.05Å; K82-D85 PolarHBondContact O-N 2.91Å; K82-Y86 VanDerWaalsContact O-CB 3.3Å; K82-Y86 WeakPolarHBondContact O-CB 3.49Å; K82-Y86 PolarHBondContact O-N 3.43Å
83	E	82.2	Confident	82.4	Confident	101 Å²	101	124.7 Å²	124.7	47%	0.472	66%	0.655	S	S	.	*	H	α-helix	trans	-56.3	-38.6	-174.4	-166.3	-179	173	0	0	113.6	D81 Y86 K87	D81-E83 PolarHBondContact OD1-N 3.25Å; E83-Y86 PolarHBondContact O-N 3Å; E83-K87 PolarHBondContact O-N 2.95Å; E83-K87 VanDerWaalsContact OE1-CE 3.31Å; E83-K87 WeakPolarHBondContact OE1-CE 3.38Å; E83-K87 IonicContact OE1-NZ 2.85Å; E83-K87 PolarHBondContact OE1-NZ 3.11Å
84	N	80.9	Confident	83.3	Confident	139 Å²	139	124.9 Å²	124.9	74%	0.743	66%	0.656	S	S	*	*	H	α-helix	trans	-67.6	-45.7	-178.8	-69.1	-22.5	0	0	0	112.7	K82 Y86	K82-N84 VanDerWaalsContact C-N 3.27Å; K82-N84 PolarHBondContact O-N 3.05Å; N84-Y86 VanDerWaalsContact C-N 3.3Å
85	D	85.2	Confident	84.1	Confident	107 Å²	107	123.8 Å²	123.8	57%	0.572	66%	0.659	S	S	*	*	H	α-helix	trans	-70.8	-29.3	177.6	-62.5	-20.5	0	0	0	111.3	K82 S88 V89	K82-D85 PolarHBondContact O-N 2.91Å; D85-S88 PolarHBondContact O-OG 3.05Å; D85-V89 WeakPolarHBondContact O-CG2 3.27Å; D85-V89 PolarHBondContact O-N 3.18Å
86	Y	87.3	Confident	84.6	Confident	134 Å²	134	126.4 Å²	126.4	53%	0.525	67%	0.667	S	S	.	*	H	α-helix	trans	-66.7	-45.7	179.7	179.2	-94.4	0	0	0	112.3	K82 E83 N84 S88 V89 Y90	K82-Y86 VanDerWaalsContact O-CB 3.3Å; K82-Y86 WeakPolarHBondContact O-CB 3.49Å; K82-Y86 PolarHBondContact O-N 3.43Å; E83-Y86 PolarHBondContact O-N 3Å; N84-Y86 VanDerWaalsContact C-N 3.3Å; Y86-S88 VanDerWaalsContact C-N 3.28Å; Y86-S88 PolarHBondContact O-N 3.26Å; Y86-V89 PolarHBondContact O-N 2.97Å; Y86-Y90 AromaticContact CD2-CD2 3.83Å; Y86-Y90 HydrophobicContact CD2-CD2 3.83Å; Y86-Y90 HydrophobicContact CD2-CE2 4.41Å; Y86-Y90 AromaticContact CE2-CD2 3.77Å; Y86-Y90 HydrophobicContact CE2-CD2 3.77Å; Y86-Y90 HydrophobicContact CE2-CE2 4.39Å; Y86-Y90 HydrophobicContact CE2-CG 4.2Å; Y86-Y90 PolarHBondContact O-N 2.91Å
87	K	85.8	Confident	85	Confident	125 Å²	125	123.3 Å²	123.3	54%	0.543	65%	0.649	S	S	.	*	H	α-helix	trans	-67.9	-25.5	-178	-71.9	177.6	-174.9	164.8	0	113.5	E83	E83-K87 PolarHBondContact O-N 2.95Å; E83-K87 VanDerWaalsContact OE1-CE 3.31Å; E83-K87 WeakPolarHBondContact OE1-CE 3.38Å; E83-K87 IonicContact OE1-NZ 2.85Å; E83-K87 PolarHBondContact OE1-NZ 3.11Å
88	S	86.1	Confident	85.2	Confident	93 Å²	93	123.8 Å²	123.8	65%	0.65	64%	0.64	S	S	*	*	H	α-helix	trans	-76.4	-34.4	176	64.3	0	0	0	0	112.2	D85 Y86	D85-S88 PolarHBondContact O-OG 3.05Å; Y86-S88 VanDerWaalsContact C-N 3.28Å; Y86-S88 PolarHBondContact O-N 3.26Å
89	V	87.2	Confident	85.2	Confident	93 Å²	93	120.5 Å²	120.5	56%	0.564	62%	0.624	S	S	*	*	H	α-helix	trans	-86.2	-37.2	-177.8	-179.5	0	0	0	0	112.6	D85 Y86 P91	D85-V89 WeakPolarHBondContact O-CG2 3.27Å; D85-V89 PolarHBondContact O-N 3.18Å; Y86-V89 PolarHBondContact O-N 2.97Å; V89-P91 WeakPolarHBondContact O-CD 3.45Å
90	Y	86.9	Confident	85.3	Confident	143 Å²	143	120.4 Å²	120.4	56%	0.561	63%	0.625	S	S	*	*	S	Bend	trans	-117.7	94.3	-173.9	-63.5	-83.4	0	0	0	112	Y86	Y86-Y90 AromaticContact CD2-CD2 3.83Å; Y86-Y90 HydrophobicContact CD2-CD2 3.83Å; Y86-Y90 HydrophobicContact CD2-CE2 4.41Å; Y86-Y90 AromaticContact CE2-CD2 3.77Å; Y86-Y90 HydrophobicContact CE2-CD2 3.77Å; Y86-Y90 HydrophobicContact CE2-CE2 4.39Å; Y86-Y90 HydrophobicContact CE2-CG 4.2Å; Y86-Y90 PolarHBondContact O-N 2.91Å
91	P	84.1	Confident	85.1	Confident	100 Å²	100	119.2 Å²	119.2	65%	0.649	62%	0.619	S	S	*	*			trans	-75.4	142.2	178.3	29.4	-34.2	0	0	0	112.8	V89 S93	V89-P91 WeakPolarHBondContact O-CD 3.45Å; P91-S93 PolarHBondContact O-N 3.48Å
92	D	81.8	Confident	84.7	Confident	159 Å²	159	119.3 Å²	119.3	85%	0.85	62%	0.615	S	S	*	*	S	Bend	trans	-75.6	51.4	-177.5	-65.9	-32.8	0	0	0	114.2
93	S	84.8	Confident	84	Confident	104 Å²	104	119 Å²	119	73%	0.727	62%	0.619	S	S	*	*			trans	-90.8	-8.5	-175.1	63.3	0	0	0	0	114.9	P91	P91-S93 PolarHBondContact O-N 3.48Å
94	F	85.8	Confident	82.9	Confident	143 Å²	143	124 Å²	124	63%	0.627	63%	0.633	S	S	*	*			trans	-78.2	129.7	-175.9	-180	-102.3	0	0	0	112.3	L96 L101	F94-L96 HydrophobicContact CE1-CB 4.46Å; F94-L96 HydrophobicContact CE1-CD1 4.16Å; F94-L101 HydrophobicContact CZ-CD1 4.23Å
95	S	86.6	Confident	81.9	Confident	88 Å²	88	122.1 Å²	122.1	62%	0.615	63%	0.627	S	S	*	*			trans	-112	124.5	173.6	58.8	0	0	0	0	110.9	P97	S95-P97 VanDerWaalsContact O-CD 3.28Å; S95-P97 WeakPolarHBondContact O-CD 3.47Å
96	L	85.1	Confident	80.4	Confident	144 Å²	144	124.7 Å²	124.7	75%	0.754	64%	0.639	S	S	*	*			trans	-67.7	121.7	-175.3	-173.7	69.4	0	0	0	111.2	F94	F94-L96 HydrophobicContact CE1-CB 4.46Å; F94-L96 HydrophobicContact CE1-CD1 4.16Å
97	P	86.1	Confident	78.7	Confident	62 Å²	62	121.7 Å²	121.7	40%	0.403	64%	0.635	S	S	.	*			trans	-67.6	151.1	174.6	-21.9	36	0	0	0	112	S95 Q99 L101	S95-P97 VanDerWaalsContact O-CD 3.28Å; S95-P97 WeakPolarHBondContact O-CD 3.47Å; P97-Q99 PolarHBondContact O-N 2.74Å; P97-L101 HydrophobicContact CG-CD2 3.75Å
98	K	86	Confident	77	Confident	122 Å²	122	124.8 Å²	124.8	53%	0.53	65%	0.649	S	S	.	*	S	Bend	trans	-62.8	-21.6	175.5	-73.8	176.6	169.6	176.5	0	113.3	P479 V480 E482	K98-P479 HydrophobicContact CB-CB 4.25Å; K98-P479 HydrophobicContact CB-CG 4.2Å; K98-P479 HydrophobicContact CD-CB 3.98Å; K98-V480 PolarHBondContact NZ-O 3.36Å; K98-E482 VanDerWaalsContact NZ-CD 3.31Å; K98-E482 IonicContact NZ-OE2 2.7Å; K98-E482 PolarHBondContact NZ-OE2 3.32Å
99	Q	86.2	Confident	75.5	Confident	108 Å²	108	125 Å²	125	51%	0.505	65%	0.65	S	S	.	*	S	Bend	trans	-106.7	153.5	177.7	-70.9	175.9	-17.4	0	0	110	P97 P479	P97-Q99 PolarHBondContact O-N 2.74Å; Q99-P479 HydrophobicContact CG-CG 3.93Å
100	L	87.5	Confident	73.9	Confident	170 Å²	170	130.3 Å²	130.3	89%	0.89	67%	0.669	S	S	*	*			trans	-57.3	140.5	172	-63.7	175	0	0	0	110.2	H102	L100-H102 PolarHBondContact O-N 3.45Å
101	L	81.2	Confident	72.5	Confident	102 Å²	102	131.1 Å²	131.1	53%	0.534	68%	0.678	S	S	.	*			trans	-64.1	118.2	178.7	-66.9	174.8	0	0	0	109.9	F94 P97 I103	F94-L101 HydrophobicContact CZ-CD1 4.23Å; P97-L101 HydrophobicContact CG-CD2 3.75Å; L101-I103 HydrophobicContact CB-CG1 4.27Å; L101-I103 PolarHBondContact O-N 3.07Å
102	H	75.7	Confident	71.6	Confident	133 Å²	133	132.2 Å²	132.2	62%	0.616	67%	0.674	S	S	*	*			trans	-92	77.7	177.1	-163.5	76.7	0	0	0	110.2	L100 R104	L100-H102 PolarHBondContact O-N 3.45Å; H102-R104 VanDerWaalsContact NE2-CD 3.26Å; H102-R104 WeakPolarHBondContact NE2-CD 3.31Å; H102-R104 WeakPolarHBondContact NE2-CG 3.43Å; H102-R104 PolarHBondContact NE2-NE 2.9Å; H102-R104 PolarHBondContact NE2-NH2 3.39Å; H102-R104 PolarHBondContact O-N 2.76Å
103	I	71.5	Confident	71.2	Confident	130 Å²	130	129.1 Å²	129.1	67%	0.667	66%	0.663	S	S	*	*			trans	-76.9	104	179.8	-54.6	173.7	0	0	0	108.8	L101 I106	L101-I103 HydrophobicContact CB-CG1 4.27Å; L101-I103 PolarHBondContact O-N 3.07Å; I103-I106 HydrophobicContact CG2-CG1 4.33Å
104	R	60.2	Low	71.2	Confident	204 Å²	204	127.6 Å²	127.6	77%	0.77	65%	0.645	S	S	*	*			trans	-94.1	-34.9	177	-92.4	176.7	174.6	150.2	17.2	114	H102	H102-R104 VanDerWaalsContact NE2-CD 3.26Å; H102-R104 WeakPolarHBondContact NE2-CD 3.31Å; H102-R104 WeakPolarHBondContact NE2-CG 3.43Å; H102-R104 PolarHBondContact NE2-NE 2.9Å; H102-R104 PolarHBondContact NE2-NH2 3.39Å; H102-R104 PolarHBondContact O-N 2.76Å
105	T	58.1	Low	71.2	Confident	101 Å²	101	126.1 Å²	126.1	62%	0.62	64%	0.641	S	S	*	*			trans	-177.4	137.8	171.4	-13	0	0	0	0	108.6	V107	T105-V107 HydrophobicContact CG2-CG2 4.48Å; T105-V107 PolarHBondContact O-N 3.35Å
106	I	53.7	Low	71.5	Confident	160 Å²	160	122.5 Å²	122.5	82%	0.821	61%	0.614	S	S	*	*	S	Bend	trans	-78.2	22.8	-174.8	-65.2	163.9	0	0	0	112.4	I103	I103-I106 HydrophobicContact CG2-CG1 4.33Å
107	V	52.8	Low	71.9	Confident	72 Å²	72	121.7 Å²	121.7	44%	0.436	61%	0.61	S	S	.	*			trans	-127.8	52.8	-163.3	-160.8	0	0	0	0	113.8	T105	T105-V107 HydrophobicContact CG2-CG2 4.48Å; T105-V107 PolarHBondContact O-N 3.35Å
108	F	50.7	Low	72.2	Confident	190 Å²	190	120 Å²	120	83%	0.833	60%	0.597	S	S	*	*			trans	-143.5	54.7	167.2	-65.4	-72.2	0	0	0	111.8
109	S	53.2	Low	72.5	Confident	97 Å²	97	117.3 Å²	117.3	68%	0.678	59%	0.588	S	S	*	*			trans	-77.8	130.7	139.5	-79.9	0	0	0	0	106.4	E111	S109-E111 CarbonylContact C-O 3.54Å; S109-E111 VanDerWaalsContact CB-O 3.26Å; S109-E111 WeakPolarHBondContact CB-O 3.18Å; S109-E111 PolarHBondContact O-N 3.49Å
110	E	54.2	Low	72.9	Confident	205 Å²	205	116.4 Å²	116.4	96%	0.958	59%	0.594	S	S	*	*	S	Bend	trans	-62.8	-19.1	175	-63.8	-172.4	166.1	0	0	111.4
111	E	57.8	Low	73.1	Confident	160 Å²	160	112.6 Å²	112.6	75%	0.748	57%	0.572	S	S	*	*	S	Bend	trans	-92.8	127	168.5	-66.2	178.6	163.6	0	0	109.4	S109	S109-E111 CarbonylContact C-O 3.54Å; S109-E111 VanDerWaalsContact CB-O 3.26Å; S109-E111 WeakPolarHBondContact CB-O 3.18Å; S109-E111 PolarHBondContact O-N 3.49Å
112	E	65.1	Low	73.8	Confident	122 Å²	122	107.7 Å²	107.7	57%	0.57	55%	0.546	S	S	*	.	P	Polyproline II helix	trans	-55	122.2	171.2	-158	163.3	-167.6	0	0	106.7	I114 R147	E112-I114 PolarHBondContact O-N 2.99Å; E112-I114 VanDerWaalsContact O-N 3.13Å; E112-R147 VanDerWaalsContact CG-NH1 3.3Å; E112-R147 IonicContact OE2-NH1 3.21Å
113	P	73.6	Confident	74.6	Confident	95 Å²	95	106.1 Å²	106.1	62%	0.617	54%	0.539	S	S	*	.	P	Polyproline II helix	trans	-54.1	129.2	-176.9	22.3	-32.1	0	0	0	108	E115 R147	P113-E115 PolarHBondContact O-N 3.36Å; P113-R147 PolarHBondContact O-NH1 3.04Å; P113-R147 PolarHBondContact O-NH2 3.47Å
114	I	84.4	Confident	75.6	Confident	71 Å²	71	105 Å²	105	36%	0.364	53%	0.531	S	S	.	.	P	Polyproline II helix	trans	-60.5	120.4	172.3	-59.4	168.4	0	0	0	105.1	E112 E139 D143	E112-I114 PolarHBondContact O-N 2.99Å; E112-I114 VanDerWaalsContact O-N 3.13Å; I114-E139 HydrophobicContact CG2-CB 3.81Å; I114-D143 HydrophobicContact CG2-CB 4.17Å
115	E	86.6	Confident	77.2	Confident	113 Å²	113	98.3 Å²	98.3	53%	0.528	51%	0.506	S	S	.	.			trans	-101.3	-14	-176.3	-172.4	173.6	-171.9	0	0	111.4	P113 D143 R147 L189	P113-E115 PolarHBondContact O-N 3.36Å; E115-D143 PolarHBondContact N-OD1 3.11Å; E115-D143 VanDerWaalsContact N-OD1 3.1Å; E115-R147 IonicContact OE2-CZ 3.28Å; E115-R147 IonicContact OE2-NE 3.99Å; E115-R147 IonicContact OE2-NH2 3.05Å; E115-R147 PolarHBondContact OE2-NH2 3.21Å; E115-L189 HydrophobicContact CB-CD2 4.12Å; E115-L189 HydrophobicContact CG-CD2 4.18Å
116	Y	92.3	Very high	78.8	Confident	11 Å²	11	95.2 Å²	95.2	4%	0.043	48%	0.484	C	S	.	.			trans	-83.4	121.2	175.2	-167.4	-89.1	0	0	0	110.4	D122 E139 I142 K180 L188 L189	Y116-D122 VanDerWaalsContact CE1-OD2 3.32Å; Y116-D122 WeakPolarHBondContact CE1-OD2 3.34Å; Y116-D122 VanDerWaalsContact CZ-OD2 3.3Å; Y116-D122 PolarHBondContact OH-OD1 3.46Å; Y116-D122 PolarHBondContact OH-OD2 2.87Å; Y116-E139 HydrophobicContact CD1-CB 4.48Å; Y116-E139 HydrophobicContact CD1-CG 4.34Å; Y116-E139 WeakPolarHBondContact O-CB 3.41Å; Y116-I142 HydrophobicContact CD1-CB 3.89Å; Y116-I142 HydrophobicContact CD1-CG2 3.87Å; Y116-I142 HydrophobicContact CD2-CB 4.35Å; Y116-I142 HydrophobicContact CD2-CG2 3.53Å; Y116-I142 HydrophobicContact CE1-CB 4.03Å; Y116-I142 HydrophobicContact CE1-CG1 4.28Å; Y116-I142 HydrophobicContact CE1-CG2 3.78Å; Y116-I142 HydrophobicContact CE2-CB 4.47Å; Y116-I142 HydrophobicContact CE2-CG2 3.42Å; Y116-I142 VanDerWaalsContact CE2-CG2 3.42Å; Y116-I142 HydrophobicContact CG-CB 4.05Å; Y116-I142 HydrophobicContact CG-CG2 3.74Å; Y116-K180 PolarHBondContact OH-NZ 3.11Å; Y116-K180 VanDerWaalsContact OH-NZ 3.14Å; Y116-L188 HydrophobicContact CE2-CB 3.82Å; Y116-L188 HydrophobicContact CE2-CD1 4.43Å; Y116-L189 HydrophobicContact CD2-CD2 4Å; Y116-L189 HydrophobicContact CG-CD2 4.48Å
117	D	92.6	Very high	80.5	Confident	127 Å²	127	94.4 Å²	94.4	68%	0.679	48%	0.477	S	S	*	.			trans	-107	135.8	169.9	-62.2	-34.8	0	0	0	108.6	D119	D117-D119 PolarHBondContact O-N 2.83Å
118	M	92.7	Very high	82.4	Confident	28 Å²	28	98.5 Å²	98.5	14%	0.138	49%	0.489	C	S	.	.			trans	-60.7	131.8	175.6	-70.9	176.6	66.1	0	0	111.6	D122 E123 F126 P135 F138 E139	M118-D122 HydrophobicContact CB-CB 3.86Å; M118-D122 HydrophobicContact CE-CB 3.91Å; M118-D122 HydrophobicContact CG-CB 4.02Å; M118-E123 HydrophobicContact CB-CG 4.42Å; M118-E123 HydrophobicContact CE-CG 4.19Å; M118-F126 HydrophobicContact CE-CB 3.57Å; M118-F126 HydrophobicContact CE-CD1 4.27Å; M118-F126 HydrophobicContact CE-CD2 4.32Å; M118-F126 HydrophobicContact CE-CG 3.83Å; M118-P135 HydrophobicContact SD-CB 3.93Å; M118-F138 HydrophobicContact CE-CD1 3.94Å; M118-F138 HydrophobicContact CE-CE1 4.1Å; M118-F138 HydrophobicContact CG-CD1 3.72Å; M118-F138 HydrophobicContact CG-CE1 3.93Å; M118-F138 HydrophobicContact SD-CD1 3.58Å; M118-F138 VanDerWaalsContact SD-CD1 3.58Å; M118-F138 HydrophobicContact SD-CE1 4.18Å; M118-E139 HydrophobicContact CG-CG 3.57Å; M118-E139 PolarHBondContact N-OE1 3.19Å; M118-E139 VanDerWaalsContact N-OE1 3.1Å; M118-E139 HydrophobicContact SD-CG 4.2Å
119	D	93.2	Very high	84	Confident	64 Å²	64	91 Å²	91	34%	0.342	46%	0.46	S	S	.	.			trans	-91.5	179.1	168.3	67.4	17.4	0	0	0	112.1	D117 E121 D122 E123 K180	D117-D119 PolarHBondContact O-N 2.83Å; D119-E121 PolarHBondContact O-N 2.85Å; D119-E121 WeakPolarHBondContact OD1-CB 3.13Å; D119-E121 PolarHBondContact OD1-N 3.49Å; D119-E121 VanDerWaalsContact OD1-N 3.09Å; D119-D122 PolarHBondContact N-OD2 3.15Å; D119-D122 VanDerWaalsContact N-OD2 3.1Å; D119-D122 WeakPolarHBondContact O-CB 3.49Å; D119-D122 PolarHBondContact O-N 3.48Å; D119-D122 VanDerWaalsContact O-N 3.14Å; D119-D122 VanDerWaalsContact OD1-CG 3.25Å; D119-D122 PolarHBondContact OD1-N 3.34Å; D119-E123 WeakPolarHBondContact O-CG 3.49Å; D119-E123 PolarHBondContact O-N 2.91Å; D119-K180 IonicContact OD1-NZ 3.53Å; D119-K180 PolarHBondContact OD1-NZ 2.75Å; D119-K180 WeakPolarHBondContact OD2-CE 3.26Å; D119-K180 IonicContact OD2-NZ 3.58Å; D119-K180 PolarHBondContact OD2-NZ 2.95Å
120	S	93.3	Very high	85.4	Confident	89 Å²	89	93.5 Å²	93.5	62%	0.622	47%	0.466	S	S	*	.	H	α-helix	trans	-61.8	-28.6	-179.4	-53.7	0	0	0	0	113.4	E124	S120-E124 WeakPolarHBondContact O-CG 3.32Å; S120-E124 PolarHBondContact O-N 2.83Å
121	E	93	Very high	86.8	Confident	90 Å²	90	86.4 Å²	86.4	42%	0.421	43%	0.434	S	S	.	.	H	α-helix	trans	-73.1	-40	176.2	-171.9	-175.2	176.4	0	0	110.9	D119 E124 W125 Y176	D119-E121 PolarHBondContact O-N 2.85Å; D119-E121 WeakPolarHBondContact OD1-CB 3.13Å; D119-E121 PolarHBondContact OD1-N 3.49Å; D119-E121 VanDerWaalsContact OD1-N 3.09Å; E121-E124 PolarHBondContact O-N 2.96Å; E121-W125 WeakPolarHBondContact O-CB 3.3Å; E121-W125 PolarHBondContact O-N 2.91Å; E121-Y176 PolarHBondContact O-OH 2.94Å
122	D	94.5	Very high	88.1	Confident	0 Å²	0	82.5 Å²	82.5	0%	0	44%	0.436	C	S	.	.	H	α-helix	trans	-62.3	-46	174.8	-67.4	-34.8	0	0	0	111.4	Y116 M118 D119 E124 W125 F126 F138 Y176 K180	Y116-D122 VanDerWaalsContact CE1-OD2 3.32Å; Y116-D122 WeakPolarHBondContact CE1-OD2 3.34Å; Y116-D122 VanDerWaalsContact CZ-OD2 3.3Å; Y116-D122 PolarHBondContact OH-OD1 3.46Å; Y116-D122 PolarHBondContact OH-OD2 2.87Å; M118-D122 HydrophobicContact CB-CB 3.86Å; M118-D122 HydrophobicContact CE-CB 3.91Å; M118-D122 HydrophobicContact CG-CB 4.02Å; D119-D122 PolarHBondContact N-OD2 3.15Å; D119-D122 VanDerWaalsContact N-OD2 3.1Å; D119-D122 WeakPolarHBondContact O-CB 3.49Å; D119-D122 PolarHBondContact O-N 3.48Å; D119-D122 VanDerWaalsContact O-N 3.14Å; D119-D122 VanDerWaalsContact OD1-CG 3.25Å; D119-D122 PolarHBondContact OD1-N 3.34Å; D122-E124 VanDerWaalsContact C-N 3.33Å; D122-E124 PolarHBondContact O-N 3.37Å; D122-W125 PolarHBondContact O-N 3.35Å; D122-F126 WeakPolarHBondContact O-CB 3.46Å; D122-F126 PolarHBondContact O-N 3.04Å; D122-F138 HydrophobicContact CB-CE1 4Å; D122-Y176 WeakPolarHBondContact CA-OH 3.47Å; D122-Y176 PolarHBondContact N-OH 2.9Å; D122-Y176 VanDerWaalsContact OD1-CE1 3.22Å; D122-Y176 WeakPolarHBondContact OD1-CE1 3.4Å; D122-Y176 PolarHBondContact OD1-OH 2.67Å; D122-K180 IonicContact OD1-NZ 3.89Å; D122-K180 PolarHBondContact OD1-NZ 3.48Å; D122-K180 IonicContact OD2-NZ 3.69Å; D122-K180 PolarHBondContact OD2-NZ 3.19Å
123	E	93.1	Very high	89.2	Confident	99 Å²	99	78 Å²	78	46%	0.463	42%	0.416	S	S	.	.	H	α-helix	trans	-59.7	-44.2	178.8	-72.3	178.4	178.1	0	0	111.7	M118 D119 Q127	M118-E123 HydrophobicContact CB-CG 4.42Å; M118-E123 HydrophobicContact CE-CG 4.19Å; D119-E123 WeakPolarHBondContact O-CG 3.49Å; D119-E123 PolarHBondContact O-N 2.91Å; E123-Q127 WeakPolarHBondContact O-CB 3.39Å; E123-Q127 VanDerWaalsContact O-CG 3.25Å; E123-Q127 WeakPolarHBondContact O-CG 3.27Å; E123-Q127 PolarHBondContact O-N 3Å
124	E	93.2	Very high	90.1	Very high	108 Å²	108	77.2 Å²	77.2	51%	0.505	41%	0.41	S	S	.	.	H	α-helix	trans	-64.5	-44	176.6	-80.5	-165.2	-155.2	0	0	112.7	S120 E121 D122 K128	S120-E124 WeakPolarHBondContact O-CG 3.32Å; S120-E124 PolarHBondContact O-N 2.83Å; E121-E124 PolarHBondContact O-N 2.96Å; D122-E124 VanDerWaalsContact C-N 3.33Å; D122-E124 PolarHBondContact O-N 3.37Å; E124-K128 WeakPolarHBondContact O-CD 3.42Å; E124-K128 VanDerWaalsContact O-CG 3.25Å; E124-K128 WeakPolarHBondContact O-CG 3.28Å; E124-K128 PolarHBondContact O-N 3.45Å; E124-K128 IonicContact OE2-NZ 3.43Å; E124-K128 PolarHBondContact OE2-NZ 3.25Å
125	W	93.6	Very high	90.4	Very high	62 Å²	62	77 Å²	77	24%	0.235	41%	0.413	C	S	.	.	H	α-helix	trans	-65.9	-44.1	178.1	179.5	86.8	0	0	0	111.1	E121 D122 Q127 K128 S129 L131 F138 V173 Y176	E121-W125 WeakPolarHBondContact O-CB 3.3Å; E121-W125 PolarHBondContact O-N 2.91Å; D122-W125 PolarHBondContact O-N 3.35Å; W125-Q127 PolarHBondContact O-N 3.36Å; W125-K128 PolarHBondContact O-N 3.14Å; W125-K128 VanDerWaalsContact O-N 3.14Å; W125-S129 VanDerWaalsContact O-CB 3.32Å; W125-S129 WeakPolarHBondContact O-CB 3.4Å; W125-S129 PolarHBondContact O-N 2.93Å; W125-S129 PolarHBondContact O-OG 3.33Å; W125-L131 HydrophobicContact CH2-CD1 3.59Å; W125-L131 HydrophobicContact CZ3-CD1 3.95Å; W125-F138 AromaticContact CE3-CE2 3.87Å; W125-F138 HydrophobicContact CE3-CE2 3.87Å; W125-F138 HydrophobicContact CE3-CZ 4.1Å; W125-F138 HydrophobicContact CH2-CE2 4.25Å; W125-F138 AromaticContact CZ3-CD2 4Å; W125-F138 HydrophobicContact CZ3-CD2 4Å; W125-F138 AromaticContact CZ3-CE2 3.35Å; W125-F138 HydrophobicContact CZ3-CE2 3.35Å; W125-F138 HydrophobicContact CZ3-CZ 4.06Å; W125-V173 HydrophobicContact CH2-CG2 4.27Å; W125-Y176 HydrophobicContact CB-CD2 4.16Å; W125-Y176 HydrophobicContact CB-CE2 3.57Å; W125-Y176 AromaticContact CD1-CD2 3.25Å; W125-Y176 AromaticContact CD1-CE2 3.48Å; W125-Y176 VanDerWaalsContact CD1-CE2 3.48Å; W125-Y176 HydrophobicContact CD2-CD1 4.01Å; W125-Y176 AromaticContact CD2-CD2 3.55Å; W125-Y176 HydrophobicContact CD2-CD2 3.55Å; W125-Y176 HydrophobicContact CD2-CE1 4.3Å; W125-Y176 AromaticContact CD2-CE2 3.86Å; W125-Y176 HydrophobicContact CD2-CE2 3.86Å; W125-Y176 AromaticContact CD2-CG 3.61Å; W125-Y176 HydrophobicContact CD2-CG 3.61Å; W125-Y176 AromaticContact CE2-CD2 3.52Å; W125-Y176 AromaticContact CE2-CG 3.51Å; W125-Y176 HydrophobicContact CE3-CD1 4.04Å; W125-Y176 HydrophobicContact CE3-CD2 4.39Å; W125-Y176 HydrophobicContact CE3-CE1 4.3Å; W125-Y176 HydrophobicContact CE3-CG 4.08Å; W125-Y176 HydrophobicContact CG-CD1 4.48Å; W125-Y176 AromaticContact CG-CD2 3.38Å; W125-Y176 HydrophobicContact CG-CD2 3.38Å; W125-Y176 HydrophobicContact CG-CE1 4.44Å; W125-Y176 AromaticContact CG-CE2 3.32Å; W125-Y176 HydrophobicContact CG-CE2 3.32Å; W125-Y176 AromaticContact CG-CG 3.99Å; W125-Y176 HydrophobicContact CG-CG 3.99Å; W125-Y176 AromaticContact CG-CZ 3.89Å; W125-Y176 HydrophobicContact CH2-CG 4.3Å; W125-Y176 VanDerWaalsContact CZ2-CB 3.47Å; W125-Y176 HydrophobicContact CZ2-CD2 4.32Å; W125-Y176 AromaticContact CZ2-CG 3.87Å; W125-Y176 HydrophobicContact CZ2-CG 3.87Å; W125-Y176 HydrophobicContact CZ3-CD1 4.35Å; W125-Y176 HydrophobicContact CZ3-CG 4.42Å; W125-Y176 AromaticContact NE1-CD2 3.32Å; W125-Y176 VanDerWaalsContact NE1-CD2 3.32Å; W125-Y176 AromaticContact NE1-CG 3.79Å
126	F	91.2	Very high	90.6	Very high	36 Å²	36	78.2 Å²	78.2	16%	0.158	42%	0.419	C	S	.	.	H	α-helix	trans	-60	-45.9	-179.9	-175.9	-99.2	0	0	0	111.3	M118 D122 K128 S129 I133 P135 F138	M118-F126 HydrophobicContact CE-CB 3.57Å; M118-F126 HydrophobicContact CE-CD1 4.27Å; M118-F126 HydrophobicContact CE-CD2 4.32Å; M118-F126 HydrophobicContact CE-CG 3.83Å; D122-F126 WeakPolarHBondContact O-CB 3.46Å; D122-F126 PolarHBondContact O-N 3.04Å; F126-K128 VanDerWaalsContact C-N 3.32Å; F126-K128 PolarHBondContact O-N 2.61Å; F126-S129 PolarHBondContact O-N 3.15Å; F126-S129 PolarHBondContact O-OG 3.11Å; F126-I133 HydrophobicContact CE2-CB 4.34Å; F126-I133 VanDerWaalsContact CZ-O 3.29Å; F126-I133 WeakPolarHBondContact CZ-O 3.19Å; F126-P135 HydrophobicContact CE1-CG 4.12Å; F126-P135 HydrophobicContact CZ-CG 4.32Å; F126-F138 HydrophobicContact CD2-CB 4.03Å; F126-F138 HydrophobicContact CD2-CD1 4.45Å; F126-F138 HydrophobicContact CD2-CD2 4.21Å; F126-F138 AromaticContact CD2-CG 3.97Å; F126-F138 HydrophobicContact CD2-CG 3.97Å; F126-F138 HydrophobicContact CE2-CB 3.79Å; F126-F138 HydrophobicContact CE2-CG 4.24Å
127	Q	89.9	Confident	90.6	Very high	144 Å²	144	81.2 Å²	81.2	67%	0.673	43%	0.432	S	S	*	.	H	α-helix	trans	-61.5	-36.7	175.4	-73.8	176	18.8	0	0	113.2	E123 W125	E123-Q127 WeakPolarHBondContact O-CB 3.39Å; E123-Q127 VanDerWaalsContact O-CG 3.25Å; E123-Q127 WeakPolarHBondContact O-CG 3.27Å; E123-Q127 PolarHBondContact O-N 3Å; W125-Q127 PolarHBondContact O-N 3.36Å
128	K	91.3	Very high	90.6	Very high	158 Å²	158	75.1 Å²	75.1	69%	0.687	40%	0.399	S	S	*	.	H	α-helix	trans	-76.8	-26.9	179.3	-69.1	165.4	-167.8	158.9	0	112.9	E124 W125 F126	E124-K128 WeakPolarHBondContact O-CD 3.42Å; E124-K128 VanDerWaalsContact O-CG 3.25Å; E124-K128 WeakPolarHBondContact O-CG 3.28Å; E124-K128 PolarHBondContact O-N 3.45Å; E124-K128 IonicContact OE2-NZ 3.43Å; E124-K128 PolarHBondContact OE2-NZ 3.25Å; W125-K128 PolarHBondContact O-N 3.14Å; W125-K128 VanDerWaalsContact O-N 3.14Å; F126-K128 VanDerWaalsContact C-N 3.32Å; F126-K128 PolarHBondContact O-N 2.61Å
129	S	85	Confident	90.7	Very high	33 Å²	33	75.6 Å²	75.6	23%	0.231	40%	0.401	C	S	.	.	H	α-helix	trans	-77.9	-22.8	-170.3	71.1	0	0	0	0	115.1	W125 F126 L131	W125-S129 VanDerWaalsContact O-CB 3.32Å; W125-S129 WeakPolarHBondContact O-CB 3.4Å; W125-S129 PolarHBondContact O-N 2.93Å; W125-S129 PolarHBondContact O-OG 3.33Å; F126-S129 PolarHBondContact O-N 3.15Å; F126-S129 PolarHBondContact O-OG 3.11Å; S129-L131 VanDerWaalsContact C-N 3.25Å; S129-L131 PolarHBondContact O-N 3.41Å; S129-L131 WeakPolarHBondContact OG-CG 3.41Å
130	D	83.4	Confident	90.6	Very high	149 Å²	149	73.6 Å²	73.6	80%	0.797	39%	0.392	S	S	*	.			trans	43.5	45.1	-178.5	-161.2	19.6	0	0	0	114.3	G132	D130-G132 VanDerWaalsContact C-N 3.27Å; D130-G132 PolarHBondContact O-N 2.91Å
131	L	82.8	Confident	90.6	Very high	55 Å²	55	69.6 Å²	69.6	29%	0.288	36%	0.364	S	S	.	.			trans	-79.3	-4.4	-174.5	-65.3	171.3	0	0	0	114.3	W125 S129 I133 L169 A172 V173	W125-L131 HydrophobicContact CH2-CD1 3.59Å; W125-L131 HydrophobicContact CZ3-CD1 3.95Å; S129-L131 VanDerWaalsContact C-N 3.25Å; S129-L131 PolarHBondContact O-N 3.41Å; S129-L131 WeakPolarHBondContact OG-CG 3.41Å; L131-I133 VanDerWaalsContact C-N 3.31Å; L131-I133 HydrophobicContact CB-CD1 3.8Å; L131-I133 HydrophobicContact CB-CG1 3.81Å; L131-I133 HydrophobicContact CD1-CD1 4.18Å; L131-I133 PolarHBondContact O-N 3.12Å; L131-L169 HydrophobicContact CB-CD1 4.22Å; L131-L169 HydrophobicContact CD1-CD1 3.97Å; L131-L169 HydrophobicContact CD2-CD1 4.36Å; L131-L169 HydrophobicContact CG-CD1 4.42Å; L131-A172 HydrophobicContact CD1-CB 4.5Å; L131-A172 HydrophobicContact CD2-CB 4.13Å; L131-V173 HydrophobicContact CD1-CG2 4.23Å
132	G	85.6	Confident	90.6	Very high	78 Å²	78	65.3 Å²	65.3	80%	0.804	34%	0.344	S	S	*	.			trans	64.2	29.9	-179.1	0	0	0	0	0	114.7	D130	D130-G132 VanDerWaalsContact C-N 3.27Å; D130-G132 PolarHBondContact O-N 2.91Å
133	I	88.1	Confident	90.4	Very high	27 Å²	27	65.7 Å²	65.7	14%	0.138	35%	0.346	C	S	.	.			trans	-107.3	161.7	-179.8	-42	168.1	0	0	0	110.4	F126 L131 K137 M141 L169	F126-I133 HydrophobicContact CE2-CB 4.34Å; F126-I133 VanDerWaalsContact CZ-O 3.29Å; F126-I133 WeakPolarHBondContact CZ-O 3.19Å; L131-I133 VanDerWaalsContact C-N 3.31Å; L131-I133 HydrophobicContact CB-CD1 3.8Å; L131-I133 HydrophobicContact CB-CG1 3.81Å; L131-I133 HydrophobicContact CD1-CD1 4.18Å; L131-I133 PolarHBondContact O-N 3.12Å; I133-K137 HydrophobicContact CG2-CB 3.44Å; I133-K137 VanDerWaalsContact CG2-CB 3.44Å; I133-K137 HydrophobicContact CG2-CD 3.56Å; I133-K137 HydrophobicContact CG2-CG 3.44Å; I133-K137 VanDerWaalsContact CG2-CG 3.44Å; I133-M141 HydrophobicContact CD1-SD 4.46Å; I133-L169 HydrophobicContact CD1-CD1 3.09Å; I133-L169 HydrophobicContact CD1-CD2 3.85Å; I133-L169 HydrophobicContact CD1-CG 4.06Å; I133-L169 HydrophobicContact CG1-CD1 3.91Å; I133-L169 HydrophobicContact CG1-CD2 4.12Å
134	T	91.2	Very high	90.3	Very high	79 Å²	79	66.8 Å²	66.8	49%	0.485	35%	0.346	S	S	.	.			trans	-82.5	149.2	166.5	55.8	0	0	0	0	111.1	E136 K137 F138	T134-E136 VanDerWaalsContact C-N 3.29Å; T134-E136 PolarHBondContact O-N 2.91Å; T134-K137 PolarHBondContact O-N 3.41Å; T134-K137 WeakPolarHBondContact OG1-CB 3.34Å; T134-K137 PolarHBondContact OG1-N 3.4Å; T134-F138 PolarHBondContact O-N 2.89Å; T134-F138 VanDerWaalsContact O-N 3.15Å
135	P	91.7	Very high	90.2	Very high	67 Å²	67	61.6 Å²	61.6	44%	0.435	32%	0.322	S	S	.	.	H	α-helix	trans	-51.8	-45.4	175.3	-28	35.5	0	0	0	112.9	M118 F126 K137 F138 E139	M118-P135 HydrophobicContact SD-CB 3.93Å; F126-P135 HydrophobicContact CE1-CG 4.12Å; F126-P135 HydrophobicContact CZ-CG 4.32Å; P135-K137 VanDerWaalsContact C-N 3.26Å; P135-K137 PolarHBondContact O-N 2.87Å; P135-F138 WeakPolarHBondContact O-CA 3.33Å; P135-F138 WeakPolarHBondContact O-CB 3.28Å; P135-F138 PolarHBondContact O-N 3.45Å; P135-E139 WeakPolarHBondContact O-CG 3.45Å; P135-E139 PolarHBondContact O-N 3.32Å
136	E	90.9	Very high	90.1	Very high	139 Å²	139	59.1 Å²	59.1	65%	0.65	31%	0.313	S	S	*	.	H	α-helix	trans	-56.5	-37.4	177.6	-60.8	174.7	175.5	0	0	113.2	T134 S140	T134-E136 VanDerWaalsContact C-N 3.29Å; T134-E136 PolarHBondContact O-N 2.91Å; E136-S140 WeakPolarHBondContact O-CB 3.29Å; E136-S140 PolarHBondContact O-N 2.86Å
137	K	91.9	Very high	89.8	Confident	73 Å²	73	61.2 Å²	61.2	32%	0.317	32%	0.32	S	S	.	.	H	α-helix	trans	-74.3	-36.8	178	174.4	171.9	178.2	176.2	0	110.7	I133 T134 P135 S140 M141 D165	I133-K137 HydrophobicContact CG2-CB 3.44Å; I133-K137 VanDerWaalsContact CG2-CB 3.44Å; I133-K137 HydrophobicContact CG2-CD 3.56Å; I133-K137 HydrophobicContact CG2-CG 3.44Å; I133-K137 VanDerWaalsContact CG2-CG 3.44Å; T134-K137 PolarHBondContact O-N 3.41Å; T134-K137 WeakPolarHBondContact OG1-CB 3.34Å; T134-K137 PolarHBondContact OG1-N 3.4Å; P135-K137 VanDerWaalsContact C-N 3.26Å; P135-K137 PolarHBondContact O-N 2.87Å; K137-S140 PolarHBondContact O-N 2.99Å; K137-M141 HydrophobicContact CG-SD 4.44Å; K137-M141 VanDerWaalsContact O-CG 3.23Å; K137-M141 WeakPolarHBondContact O-CG 3.2Å; K137-M141 PolarHBondContact O-N 2.85Å; K137-D165 WeakPolarHBondContact CE-OD2 3.4Å; K137-D165 VanDerWaalsContact NZ-CG 3.26Å; K137-D165 IonicContact NZ-OD1 3Å; K137-D165 PolarHBondContact NZ-OD1 2.78Å; K137-D165 IonicContact NZ-OD2 2.97Å; K137-D165 PolarHBondContact NZ-OD2 3.02Å
138	F	93.9	Very high	89.6	Confident	0 Å²	0	56.3 Å²	56.3	0%	0	31%	0.308	C	S	.	.	H	α-helix	trans	-61.5	-48.1	172.8	173.3	-98.4	0	0	0	111.2	M118 D122 W125 F126 T134 P135 S140 M141 I142 V173 Y176	M118-F138 HydrophobicContact CE-CD1 3.94Å; M118-F138 HydrophobicContact CE-CE1 4.1Å; M118-F138 HydrophobicContact CG-CD1 3.72Å; M118-F138 HydrophobicContact CG-CE1 3.93Å; M118-F138 HydrophobicContact SD-CD1 3.58Å; M118-F138 VanDerWaalsContact SD-CD1 3.58Å; M118-F138 HydrophobicContact SD-CE1 4.18Å; D122-F138 HydrophobicContact CB-CE1 4Å; W125-F138 AromaticContact CE3-CE2 3.87Å; W125-F138 HydrophobicContact CE3-CE2 3.87Å; W125-F138 HydrophobicContact CE3-CZ 4.1Å; W125-F138 HydrophobicContact CH2-CE2 4.25Å; W125-F138 AromaticContact CZ3-CD2 4Å; W125-F138 HydrophobicContact CZ3-CD2 4Å; W125-F138 AromaticContact CZ3-CE2 3.35Å; W125-F138 HydrophobicContact CZ3-CE2 3.35Å; W125-F138 HydrophobicContact CZ3-CZ 4.06Å; F126-F138 HydrophobicContact CD2-CB 4.03Å; F126-F138 HydrophobicContact CD2-CD1 4.45Å; F126-F138 HydrophobicContact CD2-CD2 4.21Å; F126-F138 AromaticContact CD2-CG 3.97Å; F126-F138 HydrophobicContact CD2-CG 3.97Å; F126-F138 HydrophobicContact CE2-CB 3.79Å; F126-F138 HydrophobicContact CE2-CG 4.24Å; T134-F138 PolarHBondContact O-N 2.89Å; T134-F138 VanDerWaalsContact O-N 3.15Å; P135-F138 WeakPolarHBondContact O-CA 3.33Å; P135-F138 WeakPolarHBondContact O-CB 3.28Å; P135-F138 PolarHBondContact O-N 3.45Å; F138-S140 VanDerWaalsContact C-N 3.34Å; F138-S140 PolarHBondContact O-N 3.44Å; F138-M141 WeakPolarHBondContact O-CB 3.48Å; F138-M141 PolarHBondContact O-N 3.21Å; F138-I142 HydrophobicContact CD1-CG1 4.37Å; F138-I142 HydrophobicContact CD2-CG1 4.48Å; F138-I142 HydrophobicContact CE1-CG1 3.93Å; F138-I142 HydrophobicContact CE2-CD1 4.03Å; F138-I142 HydrophobicContact CE2-CG1 4.03Å; F138-I142 HydrophobicContact CZ-CD1 3.95Å; F138-I142 HydrophobicContact CZ-CG1 3.76Å; F138-I142 WeakPolarHBondContact O-CG1 3.32Å; F138-I142 PolarHBondContact O-N 3Å; F138-V173 HydrophobicContact CD2-CG1 4.39Å; F138-V173 HydrophobicContact CD2-CG2 4.27Å; F138-V173 HydrophobicContact CE2-CG1 4.19Å; F138-V173 HydrophobicContact CE2-CG2 4.43Å; F138-Y176 HydrophobicContact CE2-CD1 4.35Å; F138-Y176 HydrophobicContact CZ-CD1 4.02Å; F138-Y176 AromaticContact CZ-CE1 3.89Å; F138-Y176 HydrophobicContact CZ-CE1 3.89Å
139	E	93.9	Very high	89.2	Confident	37 Å²	37	49 Å²	49	17%	0.173	28%	0.276	C	S	.	.	H	α-helix	trans	-56.9	-46.2	174.6	-70.3	172	158.1	0	0	111.8	I114 Y116 M118 P135 M141 I142 D143	I114-E139 HydrophobicContact CG2-CB 3.81Å; Y116-E139 HydrophobicContact CD1-CB 4.48Å; Y116-E139 HydrophobicContact CD1-CG 4.34Å; Y116-E139 WeakPolarHBondContact O-CB 3.41Å; M118-E139 HydrophobicContact CG-CG 3.57Å; M118-E139 PolarHBondContact N-OE1 3.19Å; M118-E139 VanDerWaalsContact N-OE1 3.1Å; M118-E139 HydrophobicContact SD-CG 4.2Å; P135-E139 WeakPolarHBondContact O-CG 3.45Å; P135-E139 PolarHBondContact O-N 3.32Å; E139-M141 VanDerWaalsContact C-N 3.27Å; E139-M141 PolarHBondContact O-N 3.14Å; E139-I142 PolarHBondContact O-N 3.4Å; E139-D143 VanDerWaalsContact O-CB 3.32Å; E139-D143 WeakPolarHBondContact O-CB 3.36Å; E139-D143 PolarHBondContact O-N 3.45Å
140	S	91.8	Very high	88.7	Confident	23 Å²	23	50.3 Å²	50.3	16%	0.161	29%	0.294	C	S	.	.	H	α-helix	trans	-59.8	-36.4	175.3	-178.5	0	0	0	0	112.8	E136 K137 F138 R144	E136-S140 WeakPolarHBondContact O-CB 3.29Å; E136-S140 PolarHBondContact O-N 2.86Å; K137-S140 PolarHBondContact O-N 2.99Å; F138-S140 VanDerWaalsContact C-N 3.34Å; F138-S140 PolarHBondContact O-N 3.44Å; S140-R144 WeakPolarHBondContact O-CB 3.5Å; S140-R144 WeakPolarHBondContact O-CG 3.29Å; S140-R144 PolarHBondContact O-N 3.05Å; S140-R144 VanDerWaalsContact O-N 3.14Å
141	M	92.5	Very high	88	Confident	4 Å²	4	53.4 Å²	53.4	2%	0.02	30%	0.304	C	S	.	.	H	α-helix	trans	-68	-48	177.6	-70.1	174.3	72.9	0	0	110.6	I133 K137 F138 E139 R144 L145 L163 L169 V173	I133-M141 HydrophobicContact CD1-SD 4.46Å; K137-M141 HydrophobicContact CG-SD 4.44Å; K137-M141 VanDerWaalsContact O-CG 3.23Å; K137-M141 WeakPolarHBondContact O-CG 3.2Å; K137-M141 PolarHBondContact O-N 2.85Å; F138-M141 WeakPolarHBondContact O-CB 3.48Å; F138-M141 PolarHBondContact O-N 3.21Å; E139-M141 VanDerWaalsContact C-N 3.27Å; E139-M141 PolarHBondContact O-N 3.14Å; M141-R144 PolarHBondContact O-N 2.98Å; M141-L145 VanDerWaalsContact O-CG 3.26Å; M141-L145 WeakPolarHBondContact O-CG 3.45Å; M141-L145 PolarHBondContact O-N 3.34Å; M141-L163 HydrophobicContact CB-CD1 4.47Å; M141-L163 HydrophobicContact CB-CD2 3.95Å; M141-L163 HydrophobicContact CE-CD1 3.7Å; M141-L163 HydrophobicContact CG-CD2 3.96Å; M141-L169 HydrophobicContact CE-CD1 4.36Å; M141-L169 HydrophobicContact CE-CD2 4.3Å; M141-L169 HydrophobicContact CE-CG 3.93Å; M141-L169 HydrophobicContact SD-CD2 4.23Å; M141-L169 HydrophobicContact SD-CG 4.37Å; M141-V173 HydrophobicContact CB-CG1 4.12Å; M141-V173 HydrophobicContact CE-CB 3.83Å; M141-V173 HydrophobicContact CE-CG1 4.04Å; M141-V173 HydrophobicContact CE-CG2 3.73Å; M141-V173 HydrophobicContact SD-CG2 4.23Å
142	I	92.5	Very high	87.5	Confident	1 Å²	1	56.7 Å²	56.7	1%	0.005	32%	0.316	C	S	.	.	H	α-helix	trans	-63.3	-43.9	178.5	-58.7	-63.8	0	0	0	111.4	Y116 F138 E139 R144 L145 E146 V173 W177 L188	Y116-I142 HydrophobicContact CD1-CB 3.89Å; Y116-I142 HydrophobicContact CD1-CG2 3.87Å; Y116-I142 HydrophobicContact CD2-CB 4.35Å; Y116-I142 HydrophobicContact CD2-CG2 3.53Å; Y116-I142 HydrophobicContact CE1-CB 4.03Å; Y116-I142 HydrophobicContact CE1-CG1 4.28Å; Y116-I142 HydrophobicContact CE1-CG2 3.78Å; Y116-I142 HydrophobicContact CE2-CB 4.47Å; Y116-I142 HydrophobicContact CE2-CG2 3.42Å; Y116-I142 VanDerWaalsContact CE2-CG2 3.42Å; Y116-I142 HydrophobicContact CG-CB 4.05Å; Y116-I142 HydrophobicContact CG-CG2 3.74Å; F138-I142 HydrophobicContact CD1-CG1 4.37Å; F138-I142 HydrophobicContact CD2-CG1 4.48Å; F138-I142 HydrophobicContact CE1-CG1 3.93Å; F138-I142 HydrophobicContact CE2-CD1 4.03Å; F138-I142 HydrophobicContact CE2-CG1 4.03Å; F138-I142 HydrophobicContact CZ-CD1 3.95Å; F138-I142 HydrophobicContact CZ-CG1 3.76Å; F138-I142 WeakPolarHBondContact O-CG1 3.32Å; F138-I142 PolarHBondContact O-N 3Å; E139-I142 PolarHBondContact O-N 3.4Å; I142-R144 VanDerWaalsContact C-N 3.33Å; I142-R144 PolarHBondContact O-N 3.29Å; I142-L145 PolarHBondContact O-N 3.07Å; I142-L145 VanDerWaalsContact O-N 3.11Å; I142-E146 PolarHBondContact O-N 3.37Å; I142-V173 HydrophobicContact CD1-CG1 3.74Å; I142-W177 HydrophobicContact CD1-CB 3.83Å; I142-W177 HydrophobicContact CD1-CG 4.33Å; I142-L188 HydrophobicContact CG2-CD1 4.42Å
143	D	91.8	Very high	87.1	Confident	7 Å²	7	57.2 Å²	57.2	4%	0.037	30%	0.303	C	S	.	.	H	α-helix	trans	-55.4	-47.1	176.1	179.4	87.5	0	0	0	111.6	I114 E115 E139 L145 E146 R147	I114-D143 HydrophobicContact CG2-CB 4.17Å; E115-D143 PolarHBondContact N-OD1 3.11Å; E115-D143 VanDerWaalsContact N-OD1 3.1Å; E139-D143 VanDerWaalsContact O-CB 3.32Å; E139-D143 WeakPolarHBondContact O-CB 3.36Å; E139-D143 PolarHBondContact O-N 3.45Å; D143-L145 VanDerWaalsContact C-N 3.34Å; D143-L145 PolarHBondContact O-N 2.88Å; D143-E146 PolarHBondContact O-N 2.95Å; D143-R147 WeakPolarHBondContact O-CB 3.42Å; D143-R147 WeakPolarHBondContact O-CG 3.4Å; D143-R147 PolarHBondContact O-N 3.31Å; D143-R147 IonicContact OD1-CZ 3.6Å; D143-R147 IonicContact OD1-NE 3.96Å; D143-R147 IonicContact OD1-NH1 2.81Å; D143-R147 IonicContact OD1-NH2 2.84Å; D143-R147 WeakPolarHBondContact OD2-CD 3.5Å; D143-R147 IonicContact OD2-CZ 3.32Å; D143-R147 IonicContact OD2-NE 2.81Å; D143-R147 IonicContact OD2-NH1 3.03Å; D143-R147 PolarHBondContact OD2-NH1 3.45Å
144	R	90.2	Very high	86.8	Confident	122 Å²	122	56 Å²	56	46%	0.46	30%	0.297	S	S	.	.	H	α-helix	trans	-64.3	-38.6	177	-73.7	175.4	-172.4	-166.4	8.4	112.3	S140 M141 I142 G148 L163	S140-R144 WeakPolarHBondContact O-CB 3.5Å; S140-R144 WeakPolarHBondContact O-CG 3.29Å; S140-R144 PolarHBondContact O-N 3.05Å; S140-R144 VanDerWaalsContact O-N 3.14Å; M141-R144 PolarHBondContact O-N 2.98Å; I142-R144 VanDerWaalsContact C-N 3.33Å; I142-R144 PolarHBondContact O-N 3.29Å; R144-G148 PolarHBondContact O-N 2.86Å; R144-L163 HydrophobicContact CB-CD2 4.05Å
145	L	91.2	Very high	86.6	Confident	0 Å²	0	55.9 Å²	55.9	0%	0	29%	0.294	C	S	.	.	H	α-helix	trans	-66.3	-45	178	-69.7	174.9	0	0	0	111.3	M141 I142 D143 G148 C149 M154 A159 L163 V173 Y174 W177	M141-L145 VanDerWaalsContact O-CG 3.26Å; M141-L145 WeakPolarHBondContact O-CG 3.45Å; M141-L145 PolarHBondContact O-N 3.34Å; I142-L145 PolarHBondContact O-N 3.07Å; I142-L145 VanDerWaalsContact O-N 3.11Å; D143-L145 VanDerWaalsContact C-N 3.34Å; D143-L145 PolarHBondContact O-N 2.88Å; L145-G148 PolarHBondContact O-N 3.34Å; L145-C149 WeakPolarHBondContact O-CB 3.46Å; L145-C149 PolarHBondContact O-N 3.47Å; L145-M154 HydrophobicContact CB-CE 3.61Å; L145-M154 HydrophobicContact CD2-CE 3.23Å; L145-M154 HydrophobicContact CD2-SD 3.94Å; L145-M154 HydrophobicContact CG-CE 3.95Å; L145-M154 WeakPolarHBondContact O-CE 3.35Å; L145-A159 HydrophobicContact CD2-CB 3.68Å; L145-L163 HydrophobicContact CD1-CD1 4.33Å; L145-L163 HydrophobicContact CD2-CD1 3.86Å; L145-L163 HydrophobicContact CD2-CG 4.24Å; L145-L163 HydrophobicContact CG-CD1 4.19Å; L145-V173 HydrophobicContact CD1-CG1 4.2Å; L145-Y174 HydrophobicContact CD2-CD2 4.45Å; L145-W177 HydrophobicContact CB-CD2 3.95Å; L145-W177 HydrophobicContact CB-CE3 4.46Å; L145-W177 HydrophobicContact CB-CG 4.21Å; L145-W177 HydrophobicContact CB-CZ2 4.31Å; L145-W177 HydrophobicContact CD1-CB 3.95Å; L145-W177 HydrophobicContact CD1-CD2 4.09Å; L145-W177 HydrophobicContact CD1-CE3 4.38Å; L145-W177 HydrophobicContact CD1-CG 3.9Å
146	E	90.3	Very high	86.4	Confident	10 Å²	10	54.8 Å²	54.8	5%	0.047	28%	0.284	C	S	.	.	H	α-helix	trans	-65.4	-47.4	176.9	-84.4	-57.5	152.4	0	0	112.7	I142 D143 G148 C149 G150 W177 R181 L188 L189	I142-E146 PolarHBondContact O-N 3.37Å; D143-E146 PolarHBondContact O-N 2.95Å; E146-G148 VanDerWaalsContact C-N 3.28Å; E146-G148 PolarHBondContact O-N 3.13Å; E146-C149 PolarHBondContact O-N 3.09Å; E146-G150 PolarHBondContact O-N 3.11Å; E146-W177 PolarHBondContact OE1-NE1 2.72Å; E146-R181 VanDerWaalsContact OE1-CD 3.24Å; E146-R181 WeakPolarHBondContact OE1-CD 3.35Å; E146-R181 IonicContact OE1-CZ 3.79Å; E146-R181 IonicContact OE1-NE 2.88Å; E146-R181 PolarHBondContact OE1-NE 3.2Å; E146-R181 IonicContact OE2-CZ 2.77Å; E146-R181 IonicContact OE2-NE 3.36Å; E146-R181 PolarHBondContact OE2-NE 3.39Å; E146-R181 VanDerWaalsContact OE2-NE 3.11Å; E146-R181 IonicContact OE2-NH2 3.39Å; E146-R181 PolarHBondContact OE2-NH2 3.21Å; E146-L188 HydrophobicContact CG-CB 4.06Å; E146-L188 HydrophobicContact CG-CD1 4.44Å; E146-L188 HydrophobicContact CG-CG 4.46Å; E146-L188 WeakPolarHBondContact OE1-CD1 3.44Å; E146-L188 VanDerWaalsContact OE1-CG 3.31Å; E146-L188 WeakPolarHBondContact OE1-CG 3.4Å; E146-L189 HydrophobicContact CB-CD1 3.75Å; E146-L189 HydrophobicContact CB-CG 4.01Å; E146-L189 HydrophobicContact CG-CG 4.3Å
147	R	86.9	Confident	86.3	Confident	80 Å²	80	54.2 Å²	54.2	30%	0.302	28%	0.281	S	S	.	.	H	α-helix	trans	-64	-34.5	177.3	-72.6	179.1	171.6	163.8	-3.5	112.2	E112 P113 E115 D143 C149 L189	E112-R147 VanDerWaalsContact CG-NH1 3.3Å; E112-R147 IonicContact OE2-NH1 3.21Å; P113-R147 PolarHBondContact O-NH1 3.04Å; P113-R147 PolarHBondContact O-NH2 3.47Å; E115-R147 IonicContact OE2-CZ 3.28Å; E115-R147 IonicContact OE2-NE 3.99Å; E115-R147 IonicContact OE2-NH2 3.05Å; E115-R147 PolarHBondContact OE2-NH2 3.21Å; D143-R147 WeakPolarHBondContact O-CB 3.42Å; D143-R147 WeakPolarHBondContact O-CG 3.4Å; D143-R147 PolarHBondContact O-N 3.31Å; D143-R147 IonicContact OD1-CZ 3.6Å; D143-R147 IonicContact OD1-NE 3.96Å; D143-R147 IonicContact OD1-NH1 2.81Å; D143-R147 IonicContact OD1-NH2 2.84Å; D143-R147 WeakPolarHBondContact OD2-CD 3.5Å; D143-R147 IonicContact OD2-CZ 3.32Å; D143-R147 IonicContact OD2-NE 2.81Å; D143-R147 IonicContact OD2-NH1 3.03Å; D143-R147 PolarHBondContact OD2-NH1 3.45Å; R147-C149 VanDerWaalsContact C-N 3.35Å; R147-L189 HydrophobicContact CG-CD1 4.11Å
148	G	84.2	Confident	86.1	Confident	41 Å²	41	54.2 Å²	54.2	42%	0.423	28%	0.282	S	S	.	.	H	α-helix	trans	-68.3	-32.2	175.3	0	0	0	0	0	113.3	R144 L145 E146	R144-G148 PolarHBondContact O-N 2.86Å; L145-G148 PolarHBondContact O-N 3.34Å; E146-G148 VanDerWaalsContact C-N 3.28Å; E146-G148 PolarHBondContact O-N 3.13Å
149	C	83.5	Confident	85.8	Confident	5 Å²	5	54.2 Å²	54.2	3%	0.034	28%	0.282	C	S	.	.	H	α-helix	trans	-72.7	-40.3	-176	-167.9	0	0	0	0	113.2	L145 E146 R147 Q151 K152 M154 W177 R181	L145-C149 WeakPolarHBondContact O-CB 3.46Å; L145-C149 PolarHBondContact O-N 3.47Å; E146-C149 PolarHBondContact O-N 3.09Å; R147-C149 VanDerWaalsContact C-N 3.35Å; C149-Q151 PolarHBondContact O-N 2.62Å; C149-K152 PolarHBondContact O-N 2.91Å; C149-K152 PolarHBondContact SG-O 3.42Å; C149-M154 HydrophobicContact CB-CB 4.37Å; C149-W177 HydrophobicContact CB-CH2 4.04Å; C149-W177 HydrophobicContact CB-CZ2 4Å; C149-R181 PolarHBondContact SG-NH1 3.21Å; C149-R181 PolarHBondContact SG-NH2 3.4Å; C149-R181 VanDerWaalsContact SG-NH2 3.36Å
150	G	74	Confident	85.7	Confident	59 Å²	59	56.4 Å²	56.4	61%	0.608	29%	0.291	S	S	*	.	T	Hydrogen-bonded Turn	trans	49.7	-108.1	178.2	0	0	0	0	0	112.9	E146	E146-G150 PolarHBondContact O-N 3.11Å
151	Q	68.3	Low	85.5	Confident	215 Å²	215	63.7 Å²	63.7	100%	1.005	32%	0.316	S	S	*	.	T	Hydrogen-bonded Turn	trans	-103.9	-13.7	178.6	-71.5	173.1	-34.6	0	0	114.9	C149	C149-Q151 PolarHBondContact O-N 2.62Å
152	K	73.8	Confident	85.3	Confident	124 Å²	124	66.8 Å²	66.8	54%	0.539	33%	0.333	S	S	.	.	S	Bend	trans	-114.4	130.8	-174.5	-177.2	-161.1	167.5	-160.5	0	108.9	C149 M154 E158	C149-K152 PolarHBondContact O-N 2.91Å; C149-K152 PolarHBondContact SG-O 3.42Å; K152-M154 PolarHBondContact O-N 3.25Å; K152-M154 VanDerWaalsContact O-N 3.13Å; K152-E158 IonicContact NZ-OE1 2.94Å; K152-E158 PolarHBondContact NZ-OE1 3.38Å; K152-E158 IonicContact NZ-OE2 3.41Å
153	V	75.7	Confident	85.1	Confident	88 Å²	88	67 Å²	67	53%	0.533	33%	0.334	S	S	.	.	P	Polyproline II helix	trans	-54.1	123.4	171.9	-176.3	0	0	0	0	108.9	L178	V153-L178 HydrophobicContact CG1-CD1 4.43Å
154	M	82.2	Confident	84.8	Confident	2 Å²	2	73.9 Å²	73.9	1%	0.01	37%	0.366	C	S	.	.	P	Polyproline II helix	trans	-76.7	136.9	-178.3	179.3	173.1	48	0	0	109.5	L145 C149 K152 E158 A159 L162 Y174 W177	L145-M154 HydrophobicContact CB-CE 3.61Å; L145-M154 HydrophobicContact CD2-CE 3.23Å; L145-M154 HydrophobicContact CD2-SD 3.94Å; L145-M154 HydrophobicContact CG-CE 3.95Å; L145-M154 WeakPolarHBondContact O-CE 3.35Å; C149-M154 HydrophobicContact CB-CB 4.37Å; K152-M154 PolarHBondContact O-N 3.25Å; K152-M154 VanDerWaalsContact O-N 3.13Å; M154-E158 WeakPolarHBondContact CA-OE2 3.46Å; M154-E158 HydrophobicContact CG-CB 3.82Å; M154-A159 HydrophobicContact CE-CB 4.39Å; M154-A159 HydrophobicContact CG-CB 4.45Å; M154-A159 HydrophobicContact SD-CB 4.14Å; M154-L162 HydrophobicContact SD-CD1 3.45Å; M154-L162 WeakPolarHBondContact SD-CD1 3.5Å; M154-Y174 HydrophobicContact CE-CE2 4.46Å; M154-Y174 PolarHBondContact O-OH 3.35Å; M154-W177 HydrophobicContact CB-CH2 4.12Å; M154-W177 HydrophobicContact CB-CZ3 4.4Å; M154-W177 HydrophobicContact CE-CE3 4.09Å; M154-W177 HydrophobicContact CE-CH2 3.39Å; M154-W177 HydrophobicContact CE-CZ2 3.98Å; M154-W177 HydrophobicContact CE-CZ3 3.45Å; M154-W177 VanDerWaalsContact CE-CZ3 3.45Å
155	N	87.1	Confident	84.7	Confident	77 Å²	77	70.8 Å²	70.8	41%	0.412	36%	0.358	S	S	.	.	P	Polyproline II helix	trans	-88	163.2	175.8	-70.4	-0	0	0	0	111.8	E157 E158 A159	N155-E157 VanDerWaalsContact C-N 3.28Å; N155-E157 PolarHBondContact O-N 3.05Å; N155-E158 HydrophobicContact CB-CG 4.41Å; N155-E158 PolarHBondContact N-OE2 3Å; N155-E158 VanDerWaalsContact N-OE2 3.07Å; N155-E158 WeakPolarHBondContact O-CB 3.33Å; N155-E158 PolarHBondContact O-N 3.01Å; N155-E158 VanDerWaalsContact O-N 3.12Å; N155-A159 PolarHBondContact O-N 3.25Å
156	L	88.4	Confident	84.6	Confident	43 Å²	43	77.7 Å²	77.7	23%	0.225	39%	0.39	C	S	.	.	H	α-helix	trans	-58.4	-37.3	177.5	-172.3	77.9	0	0	0	112.5	A159 K160 I171 Y174	L156-A159 PolarHBondContact O-N 3.05Å; L156-K160 HydrophobicContact CG-CD 4.46Å; L156-K160 VanDerWaalsContact O-CG 3.32Å; L156-K160 WeakPolarHBondContact O-CG 3.31Å; L156-K160 PolarHBondContact O-N 3.19Å; L156-I171 HydrophobicContact CD1-CG1 4.11Å; L156-I171 HydrophobicContact CD2-CG1 4.46Å; L156-Y174 HydrophobicContact CB-CE1 4.16Å; L156-Y174 HydrophobicContact CD1-CD1 3.37Å; L156-Y174 HydrophobicContact CD1-CE1 3.79Å; L156-Y174 HydrophobicContact CD1-CG 3.86Å; L156-Y174 PolarHBondContact N-OH 3.44Å
157	E	87.8	Confident	84.5	Confident	127 Å²	127	80.9 Å²	80.9	59%	0.593	41%	0.412	S	S	*	.	H	α-helix	trans	-67.2	-38.7	177.7	-62	74.2	-154.3	0	0	112	N155 K160 Y161	N155-E157 VanDerWaalsContact C-N 3.28Å; N155-E157 PolarHBondContact O-N 3.05Å; E157-K160 PolarHBondContact O-N 3.44Å; E157-Y161 PolarHBondContact O-N 2.83Å; E157-Y161 VanDerWaalsContact O-N 3.1Å
158	E	88.1	Confident	84.6	Confident	73 Å²	73	81.6 Å²	81.6	34%	0.341	43%	0.43	S	S	.	.	H	α-helix	trans	-66.5	-42.5	176.4	-65.9	173	168	0	0	109.8	K152 M154 N155 Y161 L162	K152-E158 IonicContact NZ-OE1 2.94Å; K152-E158 PolarHBondContact NZ-OE1 3.38Å; K152-E158 IonicContact NZ-OE2 3.41Å; M154-E158 WeakPolarHBondContact CA-OE2 3.46Å; M154-E158 HydrophobicContact CG-CB 3.82Å; N155-E158 HydrophobicContact CB-CG 4.41Å; N155-E158 PolarHBondContact N-OE2 3Å; N155-E158 VanDerWaalsContact N-OE2 3.07Å; N155-E158 WeakPolarHBondContact O-CB 3.33Å; N155-E158 PolarHBondContact O-N 3.01Å; N155-E158 VanDerWaalsContact O-N 3.12Å; E158-Y161 PolarHBondContact O-N 3.16Å; E158-L162 VanDerWaalsContact O-CG 3.31Å; E158-L162 WeakPolarHBondContact O-CG 3.18Å; E158-L162 PolarHBondContact O-N 2.96Å
159	A	88.6	Confident	85	Confident	0 Å²	0	80.6 Å²	80.6	0%	0	41%	0.414	C	S	.	.	H	α-helix	trans	-62.1	-43.4	175.1	0	0	0	0	0	112.7	L145 M154 N155 L156 Y161 L162 L163 Y174	L145-A159 HydrophobicContact CD2-CB 3.68Å; M154-A159 HydrophobicContact CE-CB 4.39Å; M154-A159 HydrophobicContact CG-CB 4.45Å; M154-A159 HydrophobicContact SD-CB 4.14Å; N155-A159 PolarHBondContact O-N 3.25Å; L156-A159 PolarHBondContact O-N 3.05Å; A159-Y161 VanDerWaalsContact C-N 3.3Å; A159-Y161 PolarHBondContact O-N 2.87Å; A159-L162 PolarHBondContact O-N 3.06Å; A159-L163 PolarHBondContact O-N 3.4Å; A159-Y174 HydrophobicContact CB-CD2 3.5Å; A159-Y174 HydrophobicContact CB-CE2 3.95Å; A159-Y174 HydrophobicContact CB-CG 4.28Å
160	K	90.3	Very high	85.4	Confident	83 Å²	83	80.5 Å²	80.5	36%	0.361	41%	0.413	S	S	.	.	H	α-helix	trans	-58.7	-40.9	174.1	-76.3	172.1	179.8	172.6	0	112.2	L156 E157 Q164 V170	L156-K160 HydrophobicContact CG-CD 4.46Å; L156-K160 VanDerWaalsContact O-CG 3.32Å; L156-K160 WeakPolarHBondContact O-CG 3.31Å; L156-K160 PolarHBondContact O-N 3.19Å; E157-K160 PolarHBondContact O-N 3.44Å; K160-Q164 PolarHBondContact O-N 3.27Å; K160-V170 HydrophobicContact CG-CG1 3.87Å
161	Y	87.7	Confident	86.3	Confident	176 Å²	176	80.4 Å²	80.4	69%	0.69	40%	0.399	S	S	*	.	H	α-helix	trans	-70	-35.7	177.5	-178.1	-98.1	0	0	0	113.1	E157 E158 A159 Q164	E157-Y161 PolarHBondContact O-N 2.83Å; E157-Y161 VanDerWaalsContact O-N 3.1Å; E158-Y161 PolarHBondContact O-N 3.16Å; A159-Y161 VanDerWaalsContact C-N 3.3Å; A159-Y161 PolarHBondContact O-N 2.87Å; Y161-Q164 WeakPolarHBondContact O-CG 3.25Å; Y161-Q164 PolarHBondContact O-NE2 3.05Å
162	L	87.8	Confident	87.5	Confident	70 Å²	70	71.7 Å²	71.7	37%	0.366	36%	0.363	S	S	.	.	H	α-helix	trans	-74.2	-42.2	-178.9	-75.7	167.9	0	0	0	112.9	M154 E158 A159	M154-L162 HydrophobicContact SD-CD1 3.45Å; M154-L162 WeakPolarHBondContact SD-CD1 3.5Å; E158-L162 VanDerWaalsContact O-CG 3.31Å; E158-L162 WeakPolarHBondContact O-CG 3.18Å; E158-L162 PolarHBondContact O-N 2.96Å; A159-L162 PolarHBondContact O-N 3.06Å
163	L	88.6	Confident	88.4	Confident	6 Å²	6	65.8 Å²	65.8	3%	0.031	34%	0.337	C	S	.	.	H	α-helix	trans	-83.1	-34.1	-175.7	-66.6	176.5	0	0	0	112.8	M141 R144 L145 A159 D165 V170	M141-L163 HydrophobicContact CB-CD1 4.47Å; M141-L163 HydrophobicContact CB-CD2 3.95Å; M141-L163 HydrophobicContact CE-CD1 3.7Å; M141-L163 HydrophobicContact CG-CD2 3.96Å; R144-L163 HydrophobicContact CB-CD2 4.05Å; L145-L163 HydrophobicContact CD1-CD1 4.33Å; L145-L163 HydrophobicContact CD2-CD1 3.86Å; L145-L163 HydrophobicContact CD2-CG 4.24Å; L145-L163 HydrophobicContact CG-CD1 4.19Å; A159-L163 PolarHBondContact O-N 3.4Å; L163-D165 PolarHBondContact O-N 2.84Å; L163-D165 VanDerWaalsContact O-N 3.12Å; L163-V170 HydrophobicContact CB-CG2 3.91Å; L163-V170 HydrophobicContact CD1-CB 4.48Å; L163-V170 HydrophobicContact CD1-CG1 4.04Å; L163-V170 HydrophobicContact CD1-CG2 4.11Å
164	Q	86.1	Confident	89.3	Confident	151 Å²	151	62.5 Å²	62.5	71%	0.706	32%	0.315	S	S	*	.			trans	52.6	30.2	179.4	-53.5	-175.4	6.6	0	0	114.2	K160 Y161	K160-Q164 PolarHBondContact O-N 3.27Å; Y161-Q164 WeakPolarHBondContact O-CG 3.25Å; Y161-Q164 PolarHBondContact O-NE2 3.05Å
165	D	89.1	Confident	89.8	Confident	56 Å²	56	66 Å²	66	30%	0.299	33%	0.334	S	S	.	.	S	Bend	trans	-107.6	-177.6	-178.8	-107.6	-51	0	0	0	111.5	K137 L163 V170	K137-D165 WeakPolarHBondContact CE-OD2 3.4Å; K137-D165 VanDerWaalsContact NZ-CG 3.26Å; K137-D165 IonicContact NZ-OD1 3Å; K137-D165 PolarHBondContact NZ-OD1 2.78Å; K137-D165 IonicContact NZ-OD2 2.97Å; K137-D165 PolarHBondContact NZ-OD2 3.02Å; L163-D165 PolarHBondContact O-N 2.84Å; L163-D165 VanDerWaalsContact O-N 3.12Å; D165-V170 HydrophobicContact CB-CG2 3.92Å
166	H	87.9	Confident	90.1	Very high	145 Å²	145	63.2 Å²	63.2	67%	0.671	32%	0.318	S	S	*	.			trans	-54.4	133.4	177	-76.7	-69.1	0	0	0	112	S168 L169 V170	H166-S168 PolarHBondContact O-N 3.33Å; H166-L169 HydrophobicContact CB-CB 4.25Å; H166-L169 WeakPolarHBondContact O-CB 3.3Å; H166-L169 PolarHBondContact O-N 3.38Å; H166-L169 VanDerWaalsContact O-N 3.13Å; H166-V170 WeakPolarHBondContact O-CG2 3.49Å; H166-V170 PolarHBondContact O-N 3.23Å
167	P	89.4	Confident	90.4	Very high	77 Å²	77	61.1 Å²	61.1	50%	0.5	31%	0.307	S	S	.	.	H	α-helix	trans	-62.9	-39.9	-169.7	23.6	-34.1	0	0	0	113.1	L169 V170 I171	P167-L169 VanDerWaalsContact C-N 3.3Å; P167-L169 PolarHBondContact O-N 3.06Å; P167-V170 PolarHBondContact O-N 3.31Å; P167-I171 WeakPolarHBondContact O-CD1 3.4Å; P167-I171 WeakPolarHBondContact O-CG1 3.49Å; P167-I171 PolarHBondContact O-N 3.28Å
168	S	88.9	Confident	90.6	Very high	96 Å²	96	57.3 Å²	57.3	67%	0.671	29%	0.291	S	S	*	.	H	α-helix	trans	-63	-40.1	178.1	-47	0	0	0	0	111.8	H166 I171 A172	H166-S168 PolarHBondContact O-N 3.33Å; S168-I171 PolarHBondContact O-N 2.89Å; S168-A172 PolarHBondContact O-N 3.21Å; S168-A172 VanDerWaalsContact O-N 3.08Å
169	L	91.9	Very high	90.8	Very high	20 Å²	20	58.4 Å²	58.4	11%	0.105	30%	0.299	C	S	.	.	H	α-helix	trans	-66.3	-47.4	178.1	168.6	58.9	0	0	0	111.1	L131 I133 M141 H166 P167 I171 A172 V173	L131-L169 HydrophobicContact CB-CD1 4.22Å; L131-L169 HydrophobicContact CD1-CD1 3.97Å; L131-L169 HydrophobicContact CD2-CD1 4.36Å; L131-L169 HydrophobicContact CG-CD1 4.42Å; I133-L169 HydrophobicContact CD1-CD1 3.09Å; I133-L169 HydrophobicContact CD1-CD2 3.85Å; I133-L169 HydrophobicContact CD1-CG 4.06Å; I133-L169 HydrophobicContact CG1-CD1 3.91Å; I133-L169 HydrophobicContact CG1-CD2 4.12Å; M141-L169 HydrophobicContact CE-CD1 4.36Å; M141-L169 HydrophobicContact CE-CD2 4.3Å; M141-L169 HydrophobicContact CE-CG 3.93Å; M141-L169 HydrophobicContact SD-CD2 4.23Å; M141-L169 HydrophobicContact SD-CG 4.37Å; H166-L169 HydrophobicContact CB-CB 4.25Å; H166-L169 WeakPolarHBondContact O-CB 3.3Å; H166-L169 PolarHBondContact O-N 3.38Å; H166-L169 VanDerWaalsContact O-N 3.13Å; P167-L169 VanDerWaalsContact C-N 3.3Å; P167-L169 PolarHBondContact O-N 3.06Å; L169-I171 VanDerWaalsContact C-N 3.29Å; L169-I171 PolarHBondContact O-N 3.08Å; L169-A172 PolarHBondContact O-N 2.95Å; L169-V173 HydrophobicContact CD1-CG2 3.84Å; L169-V173 WeakPolarHBondContact O-CG2 3.33Å; L169-V173 PolarHBondContact O-N 2.92Å
170	V	91.9	Very high	90.9	Very high	2 Å²	2	58.9 Å²	58.9	1%	0.012	30%	0.301	C	S	.	.	H	α-helix	trans	-58.3	-43.2	177.6	169.4	0	0	0	0	111.2	K160 L163 D165 H166 P167 Y174	K160-V170 HydrophobicContact CG-CG1 3.87Å; L163-V170 HydrophobicContact CB-CG2 3.91Å; L163-V170 HydrophobicContact CD1-CB 4.48Å; L163-V170 HydrophobicContact CD1-CG1 4.04Å; L163-V170 HydrophobicContact CD1-CG2 4.11Å; D165-V170 HydrophobicContact CB-CG2 3.92Å; H166-V170 WeakPolarHBondContact O-CG2 3.49Å; H166-V170 PolarHBondContact O-N 3.23Å; P167-V170 PolarHBondContact O-N 3.31Å; V170-Y174 WeakPolarHBondContact O-CB 3.49Å; V170-Y174 PolarHBondContact O-N 2.99Å
171	I	92.3	Very high	90.8	Very high	58 Å²	58	57.1 Å²	57.1	30%	0.297	29%	0.292	S	S	.	.	H	α-helix	trans	-62.3	-50.1	178.5	-67.7	160.7	0	0	0	110.5	L156 P167 S168 L169 V173 Y174 D175	L156-I171 HydrophobicContact CD1-CG1 4.11Å; L156-I171 HydrophobicContact CD2-CG1 4.46Å; P167-I171 WeakPolarHBondContact O-CD1 3.4Å; P167-I171 WeakPolarHBondContact O-CG1 3.49Å; P167-I171 PolarHBondContact O-N 3.28Å; S168-I171 PolarHBondContact O-N 2.89Å; L169-I171 VanDerWaalsContact C-N 3.29Å; L169-I171 PolarHBondContact O-N 3.08Å; I171-V173 PolarHBondContact O-N 3.24Å; I171-Y174 PolarHBondContact O-N 3.31Å; I171-D175 WeakPolarHBondContact O-CB 3.44Å; I171-D175 VanDerWaalsContact O-CG 3.27Å; I171-D175 PolarHBondContact O-N 3.05Å
172	A	93.1	Very high	90.9	Very high	31 Å²	31	53.5 Å²	53.5	26%	0.256	29%	0.288	S	S	.	.	H	α-helix	trans	-59.4	-45.9	-178.6	0	0	0	0	0	112.7	L131 S168 L169 Y176	L131-A172 HydrophobicContact CD1-CB 4.5Å; L131-A172 HydrophobicContact CD2-CB 4.13Å; S168-A172 PolarHBondContact O-N 3.21Å; S168-A172 VanDerWaalsContact O-N 3.08Å; L169-A172 PolarHBondContact O-N 2.95Å; A172-Y176 PolarHBondContact O-N 3.43Å
173	V	93.6	Very high	91	Very high	0 Å²	0	56.5 Å²	56.5	0%	0	30%	0.3	C	S	.	.	H	α-helix	trans	-69.3	-40.3	178.8	175.8	0	0	0	0	111.3	W125 L131 F138 M141 I142 L145 L169 I171 Y176 W177	W125-V173 HydrophobicContact CH2-CG2 4.27Å; L131-V173 HydrophobicContact CD1-CG2 4.23Å; F138-V173 HydrophobicContact CD2-CG1 4.39Å; F138-V173 HydrophobicContact CD2-CG2 4.27Å; F138-V173 HydrophobicContact CE2-CG1 4.19Å; F138-V173 HydrophobicContact CE2-CG2 4.43Å; M141-V173 HydrophobicContact CB-CG1 4.12Å; M141-V173 HydrophobicContact CE-CB 3.83Å; M141-V173 HydrophobicContact CE-CG1 4.04Å; M141-V173 HydrophobicContact CE-CG2 3.73Å; M141-V173 HydrophobicContact SD-CG2 4.23Å; I142-V173 HydrophobicContact CD1-CG1 3.74Å; L145-V173 HydrophobicContact CD1-CG1 4.2Å; L169-V173 HydrophobicContact CD1-CG2 3.84Å; L169-V173 WeakPolarHBondContact O-CG2 3.33Å; L169-V173 PolarHBondContact O-N 2.92Å; I171-V173 PolarHBondContact O-N 3.24Å; V173-Y176 PolarHBondContact O-N 2.97Å; V173-W177 VanDerWaalsContact O-CB 3.25Å; V173-W177 WeakPolarHBondContact O-CB 3.48Å; V173-W177 PolarHBondContact O-N 2.99Å
174	Y	93.5	Very high	90.9	Very high	19 Å²	19	58.7 Å²	58.7	8%	0.075	32%	0.316	C	S	.	.	H	α-helix	trans	-63.6	-43.6	177.3	172.8	-92.3	0	0	0	112.1	L145 M154 L156 A159 V170 I171 Y176 W177 L178	L145-Y174 HydrophobicContact CD2-CD2 4.45Å; M154-Y174 HydrophobicContact CE-CE2 4.46Å; M154-Y174 PolarHBondContact O-OH 3.35Å; L156-Y174 HydrophobicContact CB-CE1 4.16Å; L156-Y174 HydrophobicContact CD1-CD1 3.37Å; L156-Y174 HydrophobicContact CD1-CE1 3.79Å; L156-Y174 HydrophobicContact CD1-CG 3.86Å; L156-Y174 PolarHBondContact N-OH 3.44Å; A159-Y174 HydrophobicContact CB-CD2 3.5Å; A159-Y174 HydrophobicContact CB-CE2 3.95Å; A159-Y174 HydrophobicContact CB-CG 4.28Å; V170-Y174 WeakPolarHBondContact O-CB 3.49Å; V170-Y174 PolarHBondContact O-N 2.99Å; I171-Y174 PolarHBondContact O-N 3.31Å; Y174-Y176 VanDerWaalsContact C-N 3.34Å; Y174-Y176 PolarHBondContact O-N 3.12Å; Y174-W177 AromaticContact CD2-CE3 3.95Å; Y174-W177 HydrophobicContact CD2-CE3 3.95Å; Y174-W177 HydrophobicContact CD2-CZ3 4.12Å; Y174-W177 HydrophobicContact CE2-CE3 4.09Å; Y174-W177 AromaticContact CE2-CZ3 3.81Å; Y174-W177 HydrophobicContact CE2-CZ3 3.81Å; Y174-W177 PolarHBondContact O-N 3.26Å; Y174-L178 HydrophobicContact CE1-CD2 3.98Å; Y174-L178 WeakPolarHBondContact O-CB 3.43Å; Y174-L178 PolarHBondContact O-N 2.85Å
175	D	93.7	Very high	90.7	Very high	75 Å²	75	62.5 Å²	62.5	40%	0.401	32%	0.324	S	S	.	.	H	α-helix	trans	-63.8	-42.2	179	-71.8	-16.1	0	0	0	110.9	I171 N179	I171-D175 WeakPolarHBondContact O-CB 3.44Å; I171-D175 VanDerWaalsContact O-CG 3.27Å; I171-D175 PolarHBondContact O-N 3.05Å; D175-N179 WeakPolarHBondContact O-CB 3.38Å; D175-N179 PolarHBondContact O-N 3.39Å; D175-N179 PolarHBondContact O-ND2 3.18Å
176	Y	93.8	Very high	90.4	Very high	19 Å²	19	66.3 Å²	66.3	8%	0.075	34%	0.34	C	S	.	.	H	α-helix	trans	-62	-52.6	173.8	176	-105.4	0	0	0	112.1	E121 D122 W125 F138 A172 V173 Y174 L178 N179 K180	E121-Y176 PolarHBondContact O-OH 2.94Å; D122-Y176 WeakPolarHBondContact CA-OH 3.47Å; D122-Y176 PolarHBondContact N-OH 2.9Å; D122-Y176 VanDerWaalsContact OD1-CE1 3.22Å; D122-Y176 WeakPolarHBondContact OD1-CE1 3.4Å; D122-Y176 PolarHBondContact OD1-OH 2.67Å; W125-Y176 HydrophobicContact CB-CD2 4.16Å; W125-Y176 HydrophobicContact CB-CE2 3.57Å; W125-Y176 AromaticContact CD1-CD2 3.25Å; W125-Y176 AromaticContact CD1-CE2 3.48Å; W125-Y176 VanDerWaalsContact CD1-CE2 3.48Å; W125-Y176 HydrophobicContact CD2-CD1 4.01Å; W125-Y176 AromaticContact CD2-CD2 3.55Å; W125-Y176 HydrophobicContact CD2-CD2 3.55Å; W125-Y176 HydrophobicContact CD2-CE1 4.3Å; W125-Y176 AromaticContact CD2-CE2 3.86Å; W125-Y176 HydrophobicContact CD2-CE2 3.86Å; W125-Y176 AromaticContact CD2-CG 3.61Å; W125-Y176 HydrophobicContact CD2-CG 3.61Å; W125-Y176 AromaticContact CE2-CD2 3.52Å; W125-Y176 AromaticContact CE2-CG 3.51Å; W125-Y176 HydrophobicContact CE3-CD1 4.04Å; W125-Y176 HydrophobicContact CE3-CD2 4.39Å; W125-Y176 HydrophobicContact CE3-CE1 4.3Å; W125-Y176 HydrophobicContact CE3-CG 4.08Å; W125-Y176 HydrophobicContact CG-CD1 4.48Å; W125-Y176 AromaticContact CG-CD2 3.38Å; W125-Y176 HydrophobicContact CG-CD2 3.38Å; W125-Y176 HydrophobicContact CG-CE1 4.44Å; W125-Y176 AromaticContact CG-CE2 3.32Å; W125-Y176 HydrophobicContact CG-CE2 3.32Å; W125-Y176 AromaticContact CG-CG 3.99Å; W125-Y176 HydrophobicContact CG-CG 3.99Å; W125-Y176 AromaticContact CG-CZ 3.89Å; W125-Y176 HydrophobicContact CH2-CG 4.3Å; W125-Y176 VanDerWaalsContact CZ2-CB 3.47Å; W125-Y176 HydrophobicContact CZ2-CD2 4.32Å; W125-Y176 AromaticContact CZ2-CG 3.87Å; W125-Y176 HydrophobicContact CZ2-CG 3.87Å; W125-Y176 HydrophobicContact CZ3-CD1 4.35Å; W125-Y176 HydrophobicContact CZ3-CG 4.42Å; W125-Y176 AromaticContact NE1-CD2 3.32Å; W125-Y176 VanDerWaalsContact NE1-CD2 3.32Å; W125-Y176 AromaticContact NE1-CG 3.79Å; F138-Y176 HydrophobicContact CE2-CD1 4.35Å; F138-Y176 HydrophobicContact CZ-CD1 4.02Å; F138-Y176 AromaticContact CZ-CE1 3.89Å; F138-Y176 HydrophobicContact CZ-CE1 3.89Å; A172-Y176 PolarHBondContact O-N 3.43Å; V173-Y176 PolarHBondContact O-N 2.97Å; Y174-Y176 VanDerWaalsContact C-N 3.34Å; Y174-Y176 PolarHBondContact O-N 3.12Å; Y176-L178 VanDerWaalsContact C-N 3.32Å; Y176-L178 PolarHBondContact O-N 3.22Å; Y176-N179 PolarHBondContact O-N 2.88Å; Y176-K180 HydrophobicContact CE1-CD 4.15Å; Y176-K180 WeakPolarHBondContact O-CB 3.41Å; Y176-K180 PolarHBondContact O-N 3.4Å
177	W	93.4	Very high	90.3	Very high	0 Å²	0	63.4 Å²	63.4	0%	0	33%	0.334	C	S	.	.	H	α-helix	trans	-55.4	-46.8	178.2	169.1	73	0	0	0	112	I142 L145 E146 C149 M154 V173 Y174 N179 K180 R181	I142-W177 HydrophobicContact CD1-CB 3.83Å; I142-W177 HydrophobicContact CD1-CG 4.33Å; L145-W177 HydrophobicContact CB-CD2 3.95Å; L145-W177 HydrophobicContact CB-CE3 4.46Å; L145-W177 HydrophobicContact CB-CG 4.21Å; L145-W177 HydrophobicContact CB-CZ2 4.31Å; L145-W177 HydrophobicContact CD1-CB 3.95Å; L145-W177 HydrophobicContact CD1-CD2 4.09Å; L145-W177 HydrophobicContact CD1-CE3 4.38Å; L145-W177 HydrophobicContact CD1-CG 3.9Å; E146-W177 PolarHBondContact OE1-NE1 2.72Å; C149-W177 HydrophobicContact CB-CH2 4.04Å; C149-W177 HydrophobicContact CB-CZ2 4Å; M154-W177 HydrophobicContact CB-CH2 4.12Å; M154-W177 HydrophobicContact CB-CZ3 4.4Å; M154-W177 HydrophobicContact CE-CE3 4.09Å; M154-W177 HydrophobicContact CE-CH2 3.39Å; M154-W177 HydrophobicContact CE-CZ2 3.98Å; M154-W177 HydrophobicContact CE-CZ3 3.45Å; M154-W177 VanDerWaalsContact CE-CZ3 3.45Å; V173-W177 VanDerWaalsContact O-CB 3.25Å; V173-W177 WeakPolarHBondContact O-CB 3.48Å; V173-W177 PolarHBondContact O-N 2.99Å; Y174-W177 AromaticContact CD2-CE3 3.95Å; Y174-W177 HydrophobicContact CD2-CE3 3.95Å; Y174-W177 HydrophobicContact CD2-CZ3 4.12Å; Y174-W177 HydrophobicContact CE2-CE3 4.09Å; Y174-W177 AromaticContact CE2-CZ3 3.81Å; Y174-W177 HydrophobicContact CE2-CZ3 3.81Å; Y174-W177 PolarHBondContact O-N 3.26Å; W177-N179 PolarHBondContact O-N 3.04Å; W177-K180 PolarHBondContact O-N 3.03Å; W177-R181 VanDerWaalsContact O-CB 3.29Å; W177-R181 WeakPolarHBondContact O-CB 3.4Å; W177-R181 PolarHBondContact O-N 3.33Å
178	L	91.8	Very high	90.3	Very high	47 Å²	47	60.8 Å²	60.8	25%	0.246	32%	0.315	C	S	.	.	H	α-helix	trans	-62.1	-45.2	-179.8	-177.8	63.9	0	0	0	111	V153 Y174 Y176 R181 V182	V153-L178 HydrophobicContact CG1-CD1 4.43Å; Y174-L178 HydrophobicContact CE1-CD2 3.98Å; Y174-L178 WeakPolarHBondContact O-CB 3.43Å; Y174-L178 PolarHBondContact O-N 2.85Å; Y176-L178 VanDerWaalsContact C-N 3.32Å; Y176-L178 PolarHBondContact O-N 3.22Å; L178-R181 PolarHBondContact O-N 3.37Å; L178-V182 VanDerWaalsContact O-CG2 3.28Å; L178-V182 WeakPolarHBondContact O-CG2 3.32Å; L178-V182 PolarHBondContact O-N 3.49Å
179	N	92.5	Very high	90.3	Very high	95 Å²	95	57.6 Å²	57.6	51%	0.508	29%	0.29	S	S	.	.	H	α-helix	trans	-61.1	-47.4	176.3	-73.9	-29.4	0	0	0	111.5	D175 Y176 W177 R181 V182 Q183	D175-N179 WeakPolarHBondContact O-CB 3.38Å; D175-N179 PolarHBondContact O-N 3.39Å; D175-N179 PolarHBondContact O-ND2 3.18Å; Y176-N179 PolarHBondContact O-N 2.88Å; W177-N179 PolarHBondContact O-N 3.04Å; N179-R181 VanDerWaalsContact C-N 3.3Å; N179-R181 PolarHBondContact O-N 2.82Å; N179-V182 PolarHBondContact O-N 2.75Å; N179-Q183 WeakPolarHBondContact O-CG 3.42Å; N179-Q183 PolarHBondContact O-N 3.18Å
180	K	91.7	Very high	90	Very high	11 Å²	11	66.7 Å²	66.7	5%	0.048	33%	0.325	C	S	.	.	H	α-helix	trans	-60.9	-39.7	178.8	-164.4	177.1	-171.6	179.2	0	112.1	Y116 D119 D122 Y176 W177 Q183 S184 L188	Y116-K180 PolarHBondContact OH-NZ 3.11Å; Y116-K180 VanDerWaalsContact OH-NZ 3.14Å; D119-K180 IonicContact OD1-NZ 3.53Å; D119-K180 PolarHBondContact OD1-NZ 2.75Å; D119-K180 WeakPolarHBondContact OD2-CE 3.26Å; D119-K180 IonicContact OD2-NZ 3.58Å; D119-K180 PolarHBondContact OD2-NZ 2.95Å; D122-K180 IonicContact OD1-NZ 3.89Å; D122-K180 PolarHBondContact OD1-NZ 3.48Å; D122-K180 IonicContact OD2-NZ 3.69Å; D122-K180 PolarHBondContact OD2-NZ 3.19Å; Y176-K180 HydrophobicContact CE1-CD 4.15Å; Y176-K180 WeakPolarHBondContact O-CB 3.41Å; Y176-K180 PolarHBondContact O-N 3.4Å; W177-K180 PolarHBondContact O-N 3.03Å; K180-Q183 PolarHBondContact O-N 3.08Å; K180-S184 WeakPolarHBondContact O-CB 3.5Å; K180-S184 PolarHBondContact O-N 3.38Å; K180-S184 PolarHBondContact O-OG 3.47Å; K180-L188 HydrophobicContact CB-CD1 4.45Å; K180-L188 HydrophobicContact CD-CD1 4.22Å; K180-L188 HydrophobicContact CD-CD2 4.19Å; K180-L188 HydrophobicContact CG-CD1 4.4Å; K180-L188 HydrophobicContact CG-CD2 3.91Å
181	R	88.9	Confident	89.6	Confident	46 Å²	46	71 Å²	71	17%	0.174	36%	0.361	C	S	.	.	H	α-helix	trans	-68.8	-36.8	177.9	-162.1	167.5	-158.8	-109.8	9.5	113.3	E146 C149 W177 L178 N179 S184 R185	E146-R181 VanDerWaalsContact OE1-CD 3.24Å; E146-R181 WeakPolarHBondContact OE1-CD 3.35Å; E146-R181 IonicContact OE1-CZ 3.79Å; E146-R181 IonicContact OE1-NE 2.88Å; E146-R181 PolarHBondContact OE1-NE 3.2Å; E146-R181 IonicContact OE2-CZ 2.77Å; E146-R181 IonicContact OE2-NE 3.36Å; E146-R181 PolarHBondContact OE2-NE 3.39Å; E146-R181 VanDerWaalsContact OE2-NE 3.11Å; E146-R181 IonicContact OE2-NH2 3.39Å; E146-R181 PolarHBondContact OE2-NH2 3.21Å; C149-R181 PolarHBondContact SG-NH1 3.21Å; C149-R181 PolarHBondContact SG-NH2 3.4Å; C149-R181 VanDerWaalsContact SG-NH2 3.36Å; W177-R181 VanDerWaalsContact O-CB 3.29Å; W177-R181 WeakPolarHBondContact O-CB 3.4Å; W177-R181 PolarHBondContact O-N 3.33Å; L178-R181 PolarHBondContact O-N 3.37Å; N179-R181 VanDerWaalsContact C-N 3.3Å; N179-R181 PolarHBondContact O-N 2.82Å; R181-S184 WeakPolarHBondContact CA-OG 3.33Å; R181-S184 PolarHBondContact O-OG 3.02Å; R181-R185 PolarHBondContact O-N 2.78Å
182	V	89.2	Confident	89.4	Confident	100 Å²	100	71.9 Å²	71.9	61%	0.606	37%	0.369	S	S	*	.	H	α-helix	trans	-67.3	-40	174.5	170.4	0	0	0	0	110.8	L178 N179	L178-V182 VanDerWaalsContact O-CG2 3.28Å; L178-V182 WeakPolarHBondContact O-CG2 3.32Å; L178-V182 PolarHBondContact O-N 3.49Å; N179-V182 PolarHBondContact O-N 2.75Å
183	Q	90.4	Very high	89.1	Confident	133 Å²	133	77.1 Å²	77.1	62%	0.621	38%	0.382	S	S	*	.	H	α-helix	trans	-69.7	-47.1	179.8	-70.1	177.5	30.1	0	0	112.8	N179 K180 R185	N179-Q183 WeakPolarHBondContact O-CG 3.42Å; N179-Q183 PolarHBondContact O-N 3.18Å; K180-Q183 PolarHBondContact O-N 3.08Å; Q183-R185 VanDerWaalsContact C-N 3.31Å; Q183-R185 PolarHBondContact O-N 3.08Å
184	S	86.1	Confident	88.6	Confident	52 Å²	52	83.1 Å²	83.1	36%	0.364	41%	0.41	S	S	.	.	H	α-helix	trans	-68.2	-26.1	-178.8	54.3	0	0	0	0	113.8	K180 R181 Q186 L188	K180-S184 WeakPolarHBondContact O-CB 3.5Å; K180-S184 PolarHBondContact O-N 3.38Å; K180-S184 PolarHBondContact O-OG 3.47Å; R181-S184 WeakPolarHBondContact CA-OG 3.33Å; R181-S184 PolarHBondContact O-OG 3.02Å; S184-Q186 PolarHBondContact O-N 2.76Å; S184-Q186 PolarHBondContact OG-O 2.79Å; S184-L188 WeakPolarHBondContact OG-CD2 3.32Å
185	R	82.2	Confident	88	Confident	231 Å²	231	85.6 Å²	85.6	87%	0.872	42%	0.422	S	S	*	.			trans	55.7	13.5	-175.4	-55.3	-178.6	179.8	177.9	0.5	114.3	R181 Q183	R181-R185 PolarHBondContact O-N 2.78Å; Q183-R185 VanDerWaalsContact C-N 3.31Å; Q183-R185 PolarHBondContact O-N 3.08Å
186	Q	82.4	Confident	87.3	Confident	136 Å²	136	90.1 Å²	90.1	64%	0.636	43%	0.434	S	S	*	.	S	Bend	trans	-137.2	157.3	179.3	-64	-170	12.1	0	0	108.8	S184 L188	S184-Q186 PolarHBondContact O-N 2.76Å; S184-Q186 PolarHBondContact OG-O 2.79Å; Q186-L188 PolarHBondContact O-N 2.83Å
187	P	85.7	Confident	86.3	Confident	83 Å²	83	101.2 Å²	101.2	54%	0.539	48%	0.475	S	S	.	.			trans	-55.7	137.2	169.5	-20.7	32.8	0	0	0	109.9	L189	P187-L189 PolarHBondContact O-N 2.95Å
188	L	88.9	Confident	85.1	Confident	22 Å²	22	107.4 Å²	107.4	12%	0.115	51%	0.509	C	S	.	.	S	Bend	trans	-70.4	-25.6	-179.8	-54.5	174.1	0	0	0	112.1	Y116 I142 E146 K180 S184 Q186 Y190	Y116-L188 HydrophobicContact CE2-CB 3.82Å; Y116-L188 HydrophobicContact CE2-CD1 4.43Å; I142-L188 HydrophobicContact CG2-CD1 4.42Å; E146-L188 HydrophobicContact CG-CB 4.06Å; E146-L188 HydrophobicContact CG-CD1 4.44Å; E146-L188 HydrophobicContact CG-CG 4.46Å; E146-L188 WeakPolarHBondContact OE1-CD1 3.44Å; E146-L188 VanDerWaalsContact OE1-CG 3.31Å; E146-L188 WeakPolarHBondContact OE1-CG 3.4Å; K180-L188 HydrophobicContact CB-CD1 4.45Å; K180-L188 HydrophobicContact CD-CD1 4.22Å; K180-L188 HydrophobicContact CD-CD2 4.19Å; K180-L188 HydrophobicContact CG-CD1 4.4Å; K180-L188 HydrophobicContact CG-CD2 3.91Å; S184-L188 WeakPolarHBondContact OG-CD2 3.32Å; Q186-L188 PolarHBondContact O-N 2.83Å; L188-Y190 PolarHBondContact O-N 2.74Å
189	L	88.4	Confident	83.9	Confident	29 Å²	29	108.4 Å²	108.4	15%	0.152	53%	0.53	C	S	.	.	S	Bend	trans	-77.6	115.4	170.5	-69.8	174.1	0	0	0	110.3	E115 Y116 E146 R147 P187 A191	E115-L189 HydrophobicContact CB-CD2 4.12Å; E115-L189 HydrophobicContact CG-CD2 4.18Å; Y116-L189 HydrophobicContact CD2-CD2 4Å; Y116-L189 HydrophobicContact CG-CD2 4.48Å; E146-L189 HydrophobicContact CB-CD1 3.75Å; E146-L189 HydrophobicContact CB-CG 4.01Å; E146-L189 HydrophobicContact CG-CG 4.3Å; R147-L189 HydrophobicContact CG-CD1 4.11Å; P187-L189 PolarHBondContact O-N 2.95Å; L189-A191 PolarHBondContact O-N 3.45Å
190	Y	85.7	Confident	82.8	Confident	211 Å²	211	106.9 Å²	106.9	83%	0.827	53%	0.527	S	S	*	.			trans	-65.7	123.7	176.4	-68.2	-67.4	0	0	0	111.1	L188	L188-Y190 PolarHBondContact O-N 2.74Å
191	A	84.8	Confident	81.5	Confident	93 Å²	93	111.4 Å²	111.4	77%	0.769	56%	0.56	S	S	*	*			trans	-119.1	139.4	176.7	0	0	0	0	0	110.9	L189 R193	L189-A191 PolarHBondContact O-N 3.45Å; A191-R193 PolarHBondContact O-N 3.22Å
192	V	87.5	Confident	80.4	Confident	77 Å²	77	110.6 Å²	110.6	47%	0.467	56%	0.559	S	S	.	*	P	Polyproline II helix	trans	-62.8	130.5	171.5	-179.3	0	0	0	0	109.4	Q194 A208 F209	V192-Q194 PolarHBondContact O-N 3.14Å; V192-A208 HydrophobicContact CG1-CB 3.75Å; V192-F209 HydrophobicContact CB-CD2 4.35Å; V192-F209 HydrophobicContact CB-CE2 4.3Å; V192-F209 HydrophobicContact CG1-CD2 3.73Å; V192-F209 HydrophobicContact CG1-CE2 3.77Å; V192-F209 HydrophobicContact CG2-CE2 4.12Å
193	R	86.1	Confident	80	Confident	140 Å²	140	112.3 Å²	112.3	53%	0.528	57%	0.57	S	S	.	*	P	Polyproline II helix	trans	-65.8	118.3	-178.3	-166.2	173	-178.5	166.1	-7.8	110.3	A191 D204 V207 A208	A191-R193 PolarHBondContact O-N 3.22Å; R193-D204 VanDerWaalsContact CD-OD2 3.32Å; R193-D204 WeakPolarHBondContact CD-OD2 3.32Å; R193-D204 IonicContact CZ-OD2 3.35Å; R193-D204 IonicContact NE-OD2 2.65Å; R193-D204 PolarHBondContact NE-OD2 2.97Å; R193-D204 IonicContact NH1-OD2 3.41Å; R193-D204 PolarHBondContact NH1-OD2 3.34Å; R193-D204 IonicContact NH2-OD2 3.83Å; R193-D204 PolarHBondContact NH2-OD2 3.44Å; R193-V207 HydrophobicContact CG-CG2 4.17Å; R193-V207 WeakPolarHBondContact O-CA 3.23Å; R193-A208 PolarHBondContact O-N 3.29Å; R193-A208 VanDerWaalsContact O-N 3.08Å
194	Q	84.6	Confident	79.8	Confident	127 Å²	127	107.5 Å²	107.5	59%	0.593	55%	0.549	S	S	*	.	P	Polyproline II helix	trans	-100.5	156	179.4	-66.4	-178.1	12.8	0	0	111.5	V192 R196	V192-Q194 PolarHBondContact O-N 3.14Å; Q194-R196 PolarHBondContact O-N 3.01Å
195	E	81.1	Confident	79.9	Confident	71 Å²	71	110.8 Å²	110.8	33%	0.332	57%	0.569	S	S	.	*	P	Polyproline II helix	trans	-59.6	131.3	174.4	165	156.3	-106.8	0	0	111.2	N202 V207 R210	E195-N202 WeakPolarHBondContact CG-ND2 3.25Å; E195-N202 PolarHBondContact OE1-ND2 3.44Å; E195-V207 HydrophobicContact CB-CG1 4.05Å; E195-R210 IonicContact OE1-NH1 2.67Å
196	R	77.9	Confident	80.2	Confident	170 Å²	170	108.4 Å²	108.4	64%	0.642	56%	0.561	S	S	*	*	P	Polyproline II helix	trans	-63.6	145	172.2	-68.2	-167.9	175.6	-173.5	0.9	109.8	Q194 D198	Q194-R196 PolarHBondContact O-N 3.01Å; R196-D198 PolarHBondContact O-N 3.4Å; R196-D198 VanDerWaalsContact O-N 3.07Å
197	R	73	Confident	80.5	Confident	251 Å²	251	102.6 Å²	102.6	95%	0.947	54%	0.535	S	S	*	.	T	Hydrogen-bonded Turn	trans	-65.3	-10.6	179	-97.3	-166.2	-92	-154.2	-3.7	114	G199	R197-G199 PolarHBondContact O-N 2.79Å
198	D	68.7	Low	80.5	Confident	130 Å²	130	100.3 Å²	100.3	70%	0.695	52%	0.523	S	S	*	.	T	Hydrogen-bonded Turn	trans	-77.4	-0.6	-171.9	-48.9	-37.2	0	0	0	113.5	R196 S200	R196-D198 PolarHBondContact O-N 3.4Å; R196-D198 VanDerWaalsContact O-N 3.07Å; D198-S200 PolarHBondContact O-N 3.23Å; D198-S200 VanDerWaalsContact O-N 3.13Å
199	G	65.4	Low	80.4	Confident	68 Å²	68	107.1 Å²	107.1	70%	0.701	55%	0.552	S	S	*	*			trans	69.9	7.8	170.8	0	0	0	0	0	115.2	R197	R197-G199 PolarHBondContact O-N 2.79Å
200	S	69.5	Low	80.1	Confident	64 Å²	64	109.2 Å²	109.2	45%	0.448	56%	0.558	S	S	.	*			trans	-67.7	143	173	56.3	0	0	0	0	110.7	D198 N202	D198-S200 PolarHBondContact O-N 3.23Å; D198-S200 VanDerWaalsContact O-N 3.13Å; S200-N202 PolarHBondContact O-N 3.4Å; S200-N202 PolarHBondContact O-ND2 2.88Å
201	S	64.8	Low	79.6	Confident	105 Å²	105	106.8 Å²	106.8	73%	0.734	55%	0.547	S	S	*	.			trans	-61.5	107.3	176.4	57.9	0	0	0	0	109.7	T203	S201-T203 PolarHBondContact O-N 3.44Å; S201-T203 VanDerWaalsContact O-N 3.13Å
202	N	66.1	Low	78.9	Confident	30 Å²	30	111.9 Å²	111.9	16%	0.16	55%	0.546	C	S	.	.			trans	-74.7	102.7	173.8	-63.9	-66.6	0	0	0	109	E195 S200 V207 R210	E195-N202 WeakPolarHBondContact CG-ND2 3.25Å; E195-N202 PolarHBondContact OE1-ND2 3.44Å; S200-N202 PolarHBondContact O-N 3.4Å; S200-N202 PolarHBondContact O-ND2 2.88Å; N202-V207 HydrophobicContact CB-CB 4.37Å; N202-V207 HydrophobicContact CB-CG1 4.31Å; N202-V207 HydrophobicContact CB-CG2 4.17Å; N202-R210 PolarHBondContact O-NH1 3.2Å; N202-R210 PolarHBondContact O-NH2 2.85Å
203	T	81.4	Confident	77.6	Confident	136 Å²	136	111.8 Å²	111.8	83%	0.834	55%	0.55	S	S	*	.			trans	-81.6	-2.1	167.7	47.3	0	0	0	0	112.6	S201	S201-T203 PolarHBondContact O-N 3.44Å; S201-T203 VanDerWaalsContact O-N 3.13Å
204	D	84.9	Confident	76.1	Confident	32 Å²	32	112 Å²	112	17%	0.171	56%	0.556	C	S	.	*			trans	-72.4	120.2	179.7	-179.5	1.8	0	0	0	111.6	R193 Y206 V207	R193-D204 VanDerWaalsContact CD-OD2 3.32Å; R193-D204 WeakPolarHBondContact CD-OD2 3.32Å; R193-D204 IonicContact CZ-OD2 3.35Å; R193-D204 IonicContact NE-OD2 2.65Å; R193-D204 PolarHBondContact NE-OD2 2.97Å; R193-D204 IonicContact NH1-OD2 3.41Å; R193-D204 PolarHBondContact NH1-OD2 3.34Å; R193-D204 IonicContact NH2-OD2 3.83Å; R193-D204 PolarHBondContact NH2-OD2 3.44Å; D204-Y206 PolarHBondContact O-N 3.33Å; D204-Y206 PolarHBondContact OD1-N 3.03Å; D204-V207 HydrophobicContact CB-CG2 3.93Å; D204-V207 PolarHBondContact O-N 2.9Å
205	P	88.3	Confident	74.9	Confident	120 Å²	120	115.1 Å²	115.1	78%	0.779	57%	0.568	S	S	*	*	T	Hydrogen-bonded Turn	trans	-66.9	-18.9	180	28.3	-35.7	0	0	0	113.7	V207	P205-V207 VanDerWaalsContact C-N 3.29Å; P205-V207 PolarHBondContact O-N 2.93Å
206	Y	88.9	Confident	73.7	Confident	181 Å²	181	118.3 Å²	118.3	71%	0.71	59%	0.585	S	S	*	*	T	Hydrogen-bonded Turn	trans	-78.9	-10.1	178.3	-70.6	-83	0	0	0	113.7	D204 A208	D204-Y206 PolarHBondContact O-N 3.33Å; D204-Y206 PolarHBondContact OD1-N 3.03Å; Y206-A208 PolarHBondContact O-N 3.36Å
207	V	87.9	Confident	73	Confident	15 Å²	15	119.3 Å²	119.3	9%	0.091	60%	0.596	C	S	.	*			trans	-78.6	106.5	-179.4	176.6	0	0	0	0	110.9	R193 E195 N202 D204 P205 R210	R193-V207 HydrophobicContact CG-CG2 4.17Å; R193-V207 WeakPolarHBondContact O-CA 3.23Å; E195-V207 HydrophobicContact CB-CG1 4.05Å; N202-V207 HydrophobicContact CB-CB 4.37Å; N202-V207 HydrophobicContact CB-CG1 4.31Å; N202-V207 HydrophobicContact CB-CG2 4.17Å; D204-V207 HydrophobicContact CB-CG2 3.93Å; D204-V207 PolarHBondContact O-N 2.9Å; P205-V207 VanDerWaalsContact C-N 3.29Å; P205-V207 PolarHBondContact O-N 2.93Å; V207-R210 HydrophobicContact CG1-CG 4.24Å
208	A	87.4	Confident	72.4	Confident	35 Å²	35	112 Å²	112	29%	0.289	58%	0.58	S	S	.	*			trans	-111.5	169.8	-179.5	0	0	0	0	0	112.9	V192 R193 Y206 R210	V192-A208 HydrophobicContact CG1-CB 3.75Å; R193-A208 PolarHBondContact O-N 3.29Å; R193-A208 VanDerWaalsContact O-N 3.08Å; Y206-A208 PolarHBondContact O-N 3.36Å; A208-R210 VanDerWaalsContact C-N 3.32Å; A208-R210 PolarHBondContact O-N 2.96Å
209	F	85.5	Confident	72	Confident	165 Å²	165	115.3 Å²	115.3	72%	0.724	58%	0.583	S	S	*	*	S	Bend	trans	53.2	39.9	174.9	-49.4	-62.6	0	0	0	115.3	V192 R211	V192-F209 HydrophobicContact CB-CD2 4.35Å; V192-F209 HydrophobicContact CB-CE2 4.3Å; V192-F209 HydrophobicContact CG1-CD2 3.73Å; V192-F209 HydrophobicContact CG1-CE2 3.77Å; V192-F209 HydrophobicContact CG2-CE2 4.12Å; F209-R211 PolarHBondContact O-N 3.31Å
210	R	82.3	Confident	72	Confident	73 Å²	73	121.8 Å²	121.8	28%	0.275	59%	0.592	S	S	.	*			trans	-54.3	128.9	178.6	-61.6	-175.4	-169.4	-141.3	6	111.1	E195 N202 V207 A208 R212	E195-R210 IonicContact OE1-NH1 2.67Å; N202-R210 PolarHBondContact O-NH1 3.2Å; N202-R210 PolarHBondContact O-NH2 2.85Å; V207-R210 HydrophobicContact CG1-CG 4.24Å; A208-R210 VanDerWaalsContact C-N 3.32Å; A208-R210 PolarHBondContact O-N 2.96Å; R210-R212 VanDerWaalsContact C-N 3.25Å; R210-R212 HydrophobicContact CB-CG 4.43Å; R210-R212 PolarHBondContact O-N 2.98Å
211	R	75.3	Confident	71.5	Confident	159 Å²	159	126.4 Å²	126.4	60%	0.6	61%	0.611	S	S	*	*			trans	-79.1	76.3	177.5	-68.9	179.1	131.3	137.6	0.1	110	F209 S213 V600	F209-R211 PolarHBondContact O-N 3.31Å; R211-S213 PolarHBondContact O-N 3.46Å; R211-S213 VanDerWaalsContact O-N 3.1Å; R211-V600 VanDerWaalsContact NH2-CG2 3.32Å
212	R	70.7	Confident	71.5	Confident	200 Å²	200	129 Å²	129	76%	0.755	61%	0.605	S	S	*	*			trans	-81.3	33.4	167.4	-58.9	-165.1	-172.6	98.5	-4.2	111.8	R210 E214	R210-R212 VanDerWaalsContact C-N 3.25Å; R210-R212 HydrophobicContact CB-CG 4.43Å; R210-R212 PolarHBondContact O-N 2.98Å; R212-E214 VanDerWaalsContact C-N 3.33Å; R212-E214 PolarHBondContact O-N 3.1Å
213	S	59	Low	71.7	Confident	76 Å²	76	136.6 Å²	136.6	53%	0.531	64%	0.637	S	S	.	*			trans	-64.3	101.5	177	55.2	0	0	0	0	107.7	R211 K215	R211-S213 PolarHBondContact O-N 3.46Å; R211-S213 VanDerWaalsContact O-N 3.1Å; S213-K215 PolarHBondContact O-N 3.47Å
214	E	55.7	Low	71.1	Confident	143 Å²	143	135.5 Å²	135.5	67%	0.668	64%	0.635	S	S	*	*			trans	-15.7	108.6	148.6	-170.3	171.3	-162.5	0	0	108.5	R212 M216 N597	R212-E214 VanDerWaalsContact C-N 3.33Å; R212-E214 PolarHBondContact O-N 3.1Å; E214-M216 VanDerWaalsContact C-N 3.31Å; E214-M216 PolarHBondContact O-N 3.17Å; E214-N597 PolarHBondContact OE2-ND2 3.29Å
215	K	59.8	Low	70.9	Confident	194 Å²	194	136.5 Å²	136.5	84%	0.843	64%	0.64	S	S	*	*			trans	-51.7	106.5	174	-74.5	175.9	179.6	170.2	0	104.8	S213 Q217	S213-K215 PolarHBondContact O-N 3.47Å; K215-Q217 VanDerWaalsContact C-N 3.33Å; K215-Q217 PolarHBondContact O-N 3.03Å
216	M	56	Low	70.8	Confident	138 Å²	138	137.7 Å²	137.7	68%	0.68	64%	0.635	S	S	*	*			trans	-49.8	106.7	176.6	-106.3	165.2	61.1	0	0	105.8	E214 T218 L663	E214-M216 VanDerWaalsContact C-N 3.31Å; E214-M216 PolarHBondContact O-N 3.17Å; M216-T218 PolarHBondContact O-N 3.37Å; M216-L663 HydrophobicContact CE-CD1 4.35Å
217	Q	61.8	Low	70.7	Confident	190 Å²	190	133.9 Å²	133.9	89%	0.888	62%	0.624	S	S	*	*			trans	-70.2	91.6	176.3	-93.7	-179.9	-5	0	0	105	K215 R219	K215-Q217 VanDerWaalsContact C-N 3.33Å; K215-Q217 PolarHBondContact O-N 3.03Å; Q217-R219 PolarHBondContact O-N 3.45Å; Q217-R219 VanDerWaalsContact O-N 3.08Å
218	T	61.4	Low	70.7	Confident	99 Å²	99	135.1 Å²	135.1	61%	0.607	63%	0.633	S	S	*	*			trans	-54.7	120.1	168.1	51.7	0	0	0	0	106.4	M216 K220	M216-T218 PolarHBondContact O-N 3.37Å; T218-K220 PolarHBondContact O-N 2.96Å
219	R	59.6	Low	70.8	Confident	199 Å²	199	139.5 Å²	139.5	75%	0.751	64%	0.643	S	S	*	*			trans	-60.9	94.3	169.1	-79.4	-175.6	167.8	-159.4	-1.1	106.6	Q217 N221 R222	Q217-R219 PolarHBondContact O-N 3.45Å; Q217-R219 VanDerWaalsContact O-N 3.08Å; R219-N221 PolarHBondContact O-N 3.11Å; R219-R222 HydrophobicContact CB-CB 4.2Å; R219-R222 PolarHBondContact O-N 2.97Å
220	K	65.2	Low	71.1	Confident	204 Å²	204	136.6 Å²	136.6	89%	0.887	63%	0.632	S	S	*	*	T	Hydrogen-bonded Turn	trans	-58.7	-5	-175.1	-71.5	-172.1	177	-179.4	0	114.1	T218	T218-K220 PolarHBondContact O-N 2.96Å
221	N	59.9	Low	71.7	Confident	161 Å²	161	138.7 Å²	138.7	86%	0.861	64%	0.64	S	S	*	*	T	Hydrogen-bonded Turn	trans	-126.4	13.2	-176.4	-143.9	-4.2	0	0	0	114.9	R219	R219-N221 PolarHBondContact O-N 3.11Å
222	R	65	Low	72.5	Confident	159 Å²	159	134.7 Å²	134.7	60%	0.6	63%	0.628	S	S	*	*			trans	-92.9	107.5	171.5	-164.3	174.2	179	167.7	0.6	108.5	R219 D225	R219-R222 HydrophobicContact CB-CB 4.2Å; R219-R222 PolarHBondContact O-N 2.97Å; R222-D225 IonicContact NH2-OD2 2.83Å
223	K	69	Low	73.7	Confident	190 Å²	190	128.8 Å²	128.8	83%	0.826	61%	0.611	S	S	*	*	P	Polyproline II helix	trans	-55.7	142.1	164.7	-67.5	-178.4	180	178.7	0	107.9	D225	K223-D225 PolarHBondContact O-N 3.08Å
224	S	70.7	Confident	75.3	Confident	113 Å²	113	129.2 Å²	129.2	79%	0.79	61%	0.607	S	S	*	*	P	Polyproline II helix	trans	-50.9	117.5	172.2	48.7	0	0	0	0	108.4	E226	S224-E226 PolarHBondContact O-N 3.29Å
225	D	79	Confident	77.2	Confident	53 Å²	53	126.3 Å²	126.3	28%	0.283	60%	0.596	S	S	.	*	P	Polyproline II helix	trans	-66.4	120.3	-174.9	-168.9	-7.8	0	0	0	108.1	R222 K223 Q227 S228 Y229	R222-D225 IonicContact NH2-OD2 2.83Å; K223-D225 PolarHBondContact O-N 3.08Å; D225-Q227 PolarHBondContact O-N 2.97Å; D225-Q227 PolarHBondContact OD1-N 3.22Å; D225-S228 WeakPolarHBondContact O-CA 3.06Å; D225-S228 WeakPolarHBondContact O-CB 3.49Å; D225-S228 PolarHBondContact O-N 3.4Å; D225-S228 PolarHBondContact O-OG 3.46Å; D225-Y229 PolarHBondContact O-N 3.17Å; D225-Y229 VanDerWaalsContact O-N 3.15Å
226	E	87.4	Confident	78.9	Confident	145 Å²	145	124.4 Å²	124.4	68%	0.678	58%	0.583	S	S	*	*	H	α-helix	trans	-54.4	-39.9	179.6	-177.2	172.2	-163.9	0	0	110.4	S224 S228 Y229 E230	S224-E226 PolarHBondContact O-N 3.29Å; E226-S228 VanDerWaalsContact C-N 3.25Å; E226-S228 PolarHBondContact O-N 3.25Å; E226-Y229 WeakPolarHBondContact O-CB 3.43Å; E226-Y229 PolarHBondContact O-N 3.29Å; E226-E230 PolarHBondContact O-N 3.23Å
227	Q	86.8	Confident	80.7	Confident	101 Å²	101	124.7 Å²	124.7	47%	0.472	58%	0.583	S	S	.	*	H	α-helix	trans	-61.4	-32	173.9	-59.6	-174.5	4	0	0	112.9	D225 R231	D225-Q227 PolarHBondContact O-N 2.97Å; D225-Q227 PolarHBondContact OD1-N 3.22Å; Q227-R231 WeakPolarHBondContact O-CB 3.35Å; Q227-R231 WeakPolarHBondContact O-CG 3.47Å; Q227-R231 PolarHBondContact O-N 3.1Å; Q227-R231 VanDerWaalsContact O-N 3.14Å
228	S	87.1	Confident	82.3	Confident	40 Å²	40	121.2 Å²	121.2	28%	0.28	57%	0.567	S	S	.	*	H	α-helix	trans	-72	-35	176.5	75.3	0	0	0	0	111.7	D225 E226 M232	D225-S228 WeakPolarHBondContact O-CA 3.06Å; D225-S228 WeakPolarHBondContact O-CB 3.49Å; D225-S228 PolarHBondContact O-N 3.4Å; D225-S228 PolarHBondContact O-OG 3.46Å; E226-S228 VanDerWaalsContact C-N 3.25Å; E226-S228 PolarHBondContact O-N 3.25Å; S228-M232 PolarHBondContact O-N 2.74Å; S228-M232 VanDerWaalsContact O-N 3.11Å
229	Y	89.4	Confident	83.9	Confident	128 Å²	128	121.2 Å²	121.2	50%	0.502	56%	0.561	S	S	.	*	H	α-helix	trans	-70.1	-46.1	176.2	-178.2	-103.8	0	0	0	111.5	D225 E226 R231 M232 L233	D225-Y229 PolarHBondContact O-N 3.17Å; D225-Y229 VanDerWaalsContact O-N 3.15Å; E226-Y229 WeakPolarHBondContact O-CB 3.43Å; E226-Y229 PolarHBondContact O-N 3.29Å; Y229-R231 PolarHBondContact O-N 3.19Å; Y229-M232 HydrophobicContact CD2-CE 3.46Å; Y229-M232 VanDerWaalsContact CD2-CE 3.46Å; Y229-M232 HydrophobicContact CE2-CE 4.02Å; Y229-M232 HydrophobicContact CG-CE 4.37Å; Y229-M232 WeakPolarHBondContact O-CA 3.43Å; Y229-M232 VanDerWaalsContact O-CB 3.27Å; Y229-M232 WeakPolarHBondContact O-CB 2.86Å; Y229-M232 PolarHBondContact O-N 3.29Å; Y229-L233 HydrophobicContact CD1-CD1 4.09Å; Y229-L233 HydrophobicContact CE1-CD1 3.59Å; Y229-L233 HydrophobicContact CE1-CG 4.16Å; Y229-L233 PolarHBondContact O-N 3.49Å
230	E	92.4	Very high	85.5	Confident	104 Å²	104	116.3 Å²	116.3	49%	0.486	55%	0.55	S	S	.	.	H	α-helix	trans	-57.7	-46.8	173.6	-70.1	180	159.4	0	0	111.9	E226 M232 L233 I234	E226-E230 PolarHBondContact O-N 3.23Å; E230-M232 PolarHBondContact O-N 3.32Å; E230-L233 PolarHBondContact O-N 3.21Å; E230-L233 VanDerWaalsContact O-N 3.11Å; E230-I234 WeakPolarHBondContact O-CG1 3.26Å; E230-I234 PolarHBondContact O-N 2.75Å
231	R	93.7	Very high	86.8	Confident	117 Å²	117	109.7 Å²	109.7	44%	0.442	53%	0.529	S	S	.	.	H	α-helix	trans	-61.2	-31.1	175.6	-71.8	177.6	-168.2	122.5	-0.3	112.6	Q227 Y229 L235	Q227-R231 WeakPolarHBondContact O-CB 3.35Å; Q227-R231 WeakPolarHBondContact O-CG 3.47Å; Q227-R231 PolarHBondContact O-N 3.1Å; Q227-R231 VanDerWaalsContact O-N 3.14Å; Y229-R231 PolarHBondContact O-N 3.19Å; R231-L235 WeakPolarHBondContact O-CB 3.31Å; R231-L235 PolarHBondContact O-N 2.92Å
232	M	93.7	Very high	88.4	Confident	74 Å²	74	105.8 Å²	105.8	37%	0.365	51%	0.508	S	S	.	.	H	α-helix	trans	-70.6	-40.2	175	-170	-158.7	-16.3	0	0	111.4	S228 Y229 E230 L235 R236	S228-M232 PolarHBondContact O-N 2.74Å; S228-M232 VanDerWaalsContact O-N 3.11Å; Y229-M232 HydrophobicContact CD2-CE 3.46Å; Y229-M232 VanDerWaalsContact CD2-CE 3.46Å; Y229-M232 HydrophobicContact CE2-CE 4.02Å; Y229-M232 HydrophobicContact CG-CE 4.37Å; Y229-M232 WeakPolarHBondContact O-CA 3.43Å; Y229-M232 VanDerWaalsContact O-CB 3.27Å; Y229-M232 WeakPolarHBondContact O-CB 2.86Å; Y229-M232 PolarHBondContact O-N 3.29Å; E230-M232 PolarHBondContact O-N 3.32Å; M232-L235 PolarHBondContact O-N 3.44Å; M232-R236 WeakPolarHBondContact O-CB 3.23Å; M232-R236 PolarHBondContact O-N 3.14Å
233	L	94.3	Very high	89.7	Confident	76 Å²	76	100.1 Å²	100.1	40%	0.398	50%	0.499	S	S	.	.	H	α-helix	trans	-64.3	-44.7	175.7	-67.6	178.2	0	0	0	111.2	Y229 E230 L235 R236 E237	Y229-L233 HydrophobicContact CD1-CD1 4.09Å; Y229-L233 HydrophobicContact CE1-CD1 3.59Å; Y229-L233 HydrophobicContact CE1-CG 4.16Å; Y229-L233 PolarHBondContact O-N 3.49Å; E230-L233 PolarHBondContact O-N 3.21Å; E230-L233 VanDerWaalsContact O-N 3.11Å; L233-L235 VanDerWaalsContact C-N 3.33Å; L233-L235 PolarHBondContact O-N 2.95Å; L233-R236 WeakPolarHBondContact O-CB 3.3Å; L233-R236 PolarHBondContact O-N 3.33Å; L233-E237 PolarHBondContact O-N 2.81Å
234	I	94.5	Very high	90.6	Very high	86 Å²	86	96.7 Å²	96.7	44%	0.441	49%	0.486	S	S	.	.	H	α-helix	trans	-59.1	-45.8	173.9	-65.2	166.7	0	0	0	110.6	E230 R236 E237 Q238	E230-I234 WeakPolarHBondContact O-CG1 3.26Å; E230-I234 PolarHBondContact O-N 2.75Å; I234-R236 VanDerWaalsContact C-N 3.31Å; I234-R236 PolarHBondContact O-N 3.08Å; I234-E237 PolarHBondContact O-N 3.42Å; I234-Q238 HydrophobicContact CG2-CG 4.39Å; I234-Q238 WeakPolarHBondContact O-CB 3.45Å; I234-Q238 VanDerWaalsContact O-CG 3.28Å; I234-Q238 WeakPolarHBondContact O-CG 3.4Å; I234-Q238 PolarHBondContact O-N 2.99Å
235	L	95.2	Very high	91.5	Very high	82 Å²	82	95.7 Å²	95.7	43%	0.429	47%	0.47	S	S	.	.	H	α-helix	trans	-60.4	-41.6	177.2	-179.8	64.2	0	0	0	111.5	R231 M232 L233 Q238 M239	R231-L235 WeakPolarHBondContact O-CB 3.31Å; R231-L235 PolarHBondContact O-N 2.92Å; M232-L235 PolarHBondContact O-N 3.44Å; L233-L235 VanDerWaalsContact C-N 3.33Å; L233-L235 PolarHBondContact O-N 2.95Å; L235-Q238 PolarHBondContact O-N 3.47Å; L235-M239 HydrophobicContact CD1-CE 3.68Å; L235-M239 HydrophobicContact CD1-CG 4.38Å; L235-M239 HydrophobicContact CG-CG 4.48Å; L235-M239 WeakPolarHBondContact O-CB 3.45Å; L235-M239 WeakPolarHBondContact O-CG 3.19Å; L235-M239 PolarHBondContact O-N 2.98Å
236	R	94.8	Very high	92.1	Very high	154 Å²	154	97.5 Å²	97.5	58%	0.581	48%	0.479	S	S	*	.	H	α-helix	trans	-61.7	-48.8	176.9	-178.8	-178.4	177.8	-177.9	0.9	111.4	M232 L233 I234 Q238 M239 D240	M232-R236 WeakPolarHBondContact O-CB 3.23Å; M232-R236 PolarHBondContact O-N 3.14Å; L233-R236 WeakPolarHBondContact O-CB 3.3Å; L233-R236 PolarHBondContact O-N 3.33Å; I234-R236 VanDerWaalsContact C-N 3.31Å; I234-R236 PolarHBondContact O-N 3.08Å; R236-Q238 VanDerWaalsContact C-N 3.31Å; R236-Q238 PolarHBondContact O-N 3.33Å; R236-M239 PolarHBondContact O-N 2.81Å; R236-M239 VanDerWaalsContact O-N 3.12Å; R236-D240 PolarHBondContact O-N 2.83Å
237	E	94.2	Very high	91.9	Very high	143 Å²	143	92.6 Å²	92.6	67%	0.668	47%	0.468	S	S	*	.	H	α-helix	trans	-60.1	-41.4	177.6	-174.4	-179.8	-175.4	0	0	111.7	L233 I234 M239 D240 S241	L233-E237 PolarHBondContact O-N 2.81Å; I234-E237 PolarHBondContact O-N 3.42Å; E237-M239 VanDerWaalsContact C-N 3.34Å; E237-M239 PolarHBondContact O-N 3.24Å; E237-D240 PolarHBondContact O-N 3.25Å; E237-S241 WeakPolarHBondContact O-CB 3.46Å; E237-S241 PolarHBondContact O-N 3.37Å
238	Q	95.3	Very high	91.8	Very high	118 Å²	118	96 Å²	96	55%	0.551	48%	0.476	S	S	*	.	H	α-helix	trans	-63.6	-38	174.4	-72.4	176.5	-6.1	0	0	112.5	I234 L235 R236 L242	I234-Q238 HydrophobicContact CG2-CG 4.39Å; I234-Q238 WeakPolarHBondContact O-CB 3.45Å; I234-Q238 VanDerWaalsContact O-CG 3.28Å; I234-Q238 WeakPolarHBondContact O-CG 3.4Å; I234-Q238 PolarHBondContact O-N 2.99Å; L235-Q238 PolarHBondContact O-N 3.47Å; R236-Q238 VanDerWaalsContact C-N 3.31Å; R236-Q238 PolarHBondContact O-N 3.33Å; Q238-L242 WeakPolarHBondContact O-CB 3.41Å; Q238-L242 PolarHBondContact O-N 2.85Å
239	M	94.1	Very high	91.6	Very high	98 Å²	98	97.3 Å²	97.3	48%	0.483	48%	0.48	S	S	.	.	H	α-helix	trans	-70.3	-38.4	175.9	-70.3	-66.2	158.6	0	0	112.1	L235 R236 E237 L242 G243	L235-M239 HydrophobicContact CD1-CE 3.68Å; L235-M239 HydrophobicContact CD1-CG 4.38Å; L235-M239 HydrophobicContact CG-CG 4.48Å; L235-M239 WeakPolarHBondContact O-CB 3.45Å; L235-M239 WeakPolarHBondContact O-CG 3.19Å; L235-M239 PolarHBondContact O-N 2.98Å; R236-M239 PolarHBondContact O-N 2.81Å; R236-M239 VanDerWaalsContact O-N 3.12Å; E237-M239 VanDerWaalsContact C-N 3.34Å; E237-M239 PolarHBondContact O-N 3.24Å; M239-L242 PolarHBondContact O-N 3Å; M239-L242 HydrophobicContact SD-CD2 4.19Å; M239-G243 PolarHBondContact O-N 3.23Å
240	D	93.5	Very high	91.4	Very high	97 Å²	97	96.1 Å²	96.1	52%	0.519	49%	0.486	S	S	.	.	H	α-helix	trans	-64.3	-44.9	174.2	-70.6	-24.6	0	0	0	110.4	R236 E237 L242 G243 E244	R236-D240 PolarHBondContact O-N 2.83Å; E237-D240 PolarHBondContact O-N 3.25Å; D240-L242 VanDerWaalsContact C-N 3.35Å; D240-L242 PolarHBondContact O-N 3.08Å; D240-G243 PolarHBondContact O-N 2.95Å; D240-E244 PolarHBondContact O-N 3.21Å
241	S	93.2	Very high	90.9	Very high	64 Å²	64	98.3 Å²	98.3	45%	0.448	49%	0.494	S	S	.	.	H	α-helix	trans	-62.6	-38.7	173.7	-178.3	0	0	0	0	112.6	E237 G243 E244 I245	E237-S241 WeakPolarHBondContact O-CB 3.46Å; E237-S241 PolarHBondContact O-N 3.37Å; S241-G243 VanDerWaalsContact C-N 3.35Å; S241-E244 PolarHBondContact O-N 2.88Å; S241-I245 WeakPolarHBondContact O-CG1 3.49Å; S241-I245 PolarHBondContact O-N 2.97Å; S241-I245 VanDerWaalsContact O-N 3.14Å
242	L	93.9	Very high	90.4	Very high	80 Å²	80	98.9 Å²	98.9	42%	0.419	50%	0.496	S	S	.	.	H	α-helix	trans	-63.8	-42.3	174.2	178	62.6	0	0	0	110.7	Q238 M239 D240 E244 I245 L246	Q238-L242 WeakPolarHBondContact O-CB 3.41Å; Q238-L242 PolarHBondContact O-N 2.85Å; M239-L242 PolarHBondContact O-N 3Å; M239-L242 HydrophobicContact SD-CD2 4.19Å; D240-L242 VanDerWaalsContact C-N 3.35Å; D240-L242 PolarHBondContact O-N 3.08Å; L242-E244 VanDerWaalsContact C-N 3.33Å; L242-E244 PolarHBondContact O-N 3.34Å; L242-I245 PolarHBondContact O-N 2.81Å; L242-L246 HydrophobicContact CD1-CD1 4.2Å; L242-L246 HydrophobicContact CD1-CG 4.18Å; L242-L246 HydrophobicContact CG-CD1 3.95Å; L242-L246 HydrophobicContact CG-CG 4.36Å; L242-L246 WeakPolarHBondContact O-CB 3.29Å; L242-L246 WeakPolarHBondContact O-CG 3.35Å; L242-L246 PolarHBondContact O-N 3.09Å
243	G	90.5	Very high	89.9	Confident	40 Å²	40	99.1 Å²	99.1	41%	0.412	50%	0.496	S	S	.	.	H	α-helix	trans	-58.4	-41.9	174.8	0	0	0	0	0	112.6	M239 D240 S241 G247	M239-G243 PolarHBondContact O-N 3.23Å; D240-G243 PolarHBondContact O-N 2.95Å; S241-G243 VanDerWaalsContact C-N 3.35Å; G243-G247 PolarHBondContact O-N 3.12Å
244	E	89.8	Confident	89.1	Confident	118 Å²	118	98 Å²	98	55%	0.551	50%	0.497	S	S	*	.	H	α-helix	trans	-63	-44.2	173.9	-72.1	-165.1	-168.6	0	0	112.9	D240 S241 L242 G247 R248	D240-E244 PolarHBondContact O-N 3.21Å; S241-E244 PolarHBondContact O-N 2.88Å; L242-E244 VanDerWaalsContact C-N 3.33Å; L242-E244 PolarHBondContact O-N 3.34Å; E244-G247 PolarHBondContact O-N 3.28Å; E244-R248 VanDerWaalsContact O-CG 3.29Å; E244-R248 WeakPolarHBondContact O-CG 3.49Å; E244-R248 PolarHBondContact O-N 3.12Å; E244-R248 IonicContact OE2-NH2 2.77Å; E244-R248 PolarHBondContact OE2-NH2 2.98Å
245	I	89.4	Confident	88	Confident	91 Å²	91	97.3 Å²	97.3	47%	0.467	50%	0.498	S	S	.	.	H	α-helix	trans	-64.1	-46.2	179.5	-66.8	166.7	0	0	0	110	S241 L242 R248 L249	S241-I245 WeakPolarHBondContact O-CG1 3.49Å; S241-I245 PolarHBondContact O-N 2.97Å; S241-I245 VanDerWaalsContact O-N 3.14Å; L242-I245 PolarHBondContact O-N 2.81Å; I245-R248 PolarHBondContact O-N 2.94Å; I245-L249 HydrophobicContact CG2-CD1 4.21Å; I245-L249 WeakPolarHBondContact O-CG 3.43Å; I245-L249 PolarHBondContact O-N 2.81Å
246	L	90.4	Very high	87.3	Confident	91 Å²	91	97.7 Å²	97.7	48%	0.476	50%	0.496	S	S	.	.	H	α-helix	trans	-62.4	-44.1	176.4	-71	173.9	0	0	0	111.5	L242 R248 L249 V250	L242-L246 HydrophobicContact CD1-CD1 4.2Å; L242-L246 HydrophobicContact CD1-CG 4.18Å; L242-L246 HydrophobicContact CG-CD1 3.95Å; L242-L246 HydrophobicContact CG-CG 4.36Å; L242-L246 WeakPolarHBondContact O-CB 3.29Å; L242-L246 WeakPolarHBondContact O-CG 3.35Å; L242-L246 PolarHBondContact O-N 3.09Å; L246-R248 VanDerWaalsContact C-N 3.3Å; L246-R248 PolarHBondContact O-N 3.43Å; L246-L249 HydrophobicContact CD2-CD1 4.35Å; L246-L249 WeakPolarHBondContact O-CA 3.11Å; L246-L249 WeakPolarHBondContact O-CB 3.26Å; L246-L249 PolarHBondContact O-N 3.45Å; L246-V250 WeakPolarHBondContact O-CG2 3.38Å; L246-V250 PolarHBondContact O-N 3.07Å
247	G	84.4	Confident	86.4	Confident	42 Å²	42	96.1 Å²	96.1	43%	0.433	50%	0.495	S	S	.	.	H	α-helix	trans	-60.5	-37.6	175.9	0	0	0	0	0	113	G243 E244 K251	G243-G247 PolarHBondContact O-N 3.12Å; E244-G247 PolarHBondContact O-N 3.28Å; G247-K251 WeakPolarHBondContact O-CB 3.48Å; G247-K251 PolarHBondContact O-N 2.96Å; G247-K251 VanDerWaalsContact O-N 3.09Å
248	R	84.2	Confident	85.4	Confident	173 Å²	173	92 Å²	92	65%	0.653	49%	0.486	S	S	*	.	H	α-helix	trans	-68.1	-37.1	172.6	-69.2	175.3	-163.5	-162.7	10.6	112.2	E244 I245 L246 R252	E244-R248 VanDerWaalsContact O-CG 3.29Å; E244-R248 WeakPolarHBondContact O-CG 3.49Å; E244-R248 PolarHBondContact O-N 3.12Å; E244-R248 IonicContact OE2-NH2 2.77Å; E244-R248 PolarHBondContact OE2-NH2 2.98Å; I245-R248 PolarHBondContact O-N 2.94Å; L246-R248 VanDerWaalsContact C-N 3.3Å; L246-R248 PolarHBondContact O-N 3.43Å; R248-R252 WeakPolarHBondContact O-CB 3.4Å; R248-R252 PolarHBondContact O-N 3.03Å
249	L	82.9	Confident	84.2	Confident	67 Å²	67	88.9 Å²	88.9	35%	0.351	47%	0.472	S	S	.	.	H	α-helix	trans	-64.8	-48.4	175.3	-76.2	168.2	0	0	0	111.5	I245 L246 K251 R252 E253	I245-L249 HydrophobicContact CG2-CD1 4.21Å; I245-L249 WeakPolarHBondContact O-CG 3.43Å; I245-L249 PolarHBondContact O-N 2.81Å; L246-L249 HydrophobicContact CD2-CD1 4.35Å; L246-L249 WeakPolarHBondContact O-CA 3.11Å; L246-L249 WeakPolarHBondContact O-CB 3.26Å; L246-L249 PolarHBondContact O-N 3.45Å; L249-K251 VanDerWaalsContact C-N 3.33Å; L249-K251 PolarHBondContact O-N 2.99Å; L249-R252 WeakPolarHBondContact O-CA 3.23Å; L249-R252 WeakPolarHBondContact O-CB 3.32Å; L249-R252 PolarHBondContact O-N 3.38Å; L249-E253 PolarHBondContact O-N 3.45Å
250	V	85	Confident	83.2	Confident	103 Å²	103	87 Å²	87	62%	0.624	47%	0.466	S	S	*	.	H	α-helix	trans	-56.8	-48	175.9	173.2	0	0	0	0	110.6	L246 R252 E253 A254	L246-V250 WeakPolarHBondContact O-CG2 3.38Å; L246-V250 PolarHBondContact O-N 3.07Å; V250-R252 VanDerWaalsContact C-N 3.28Å; V250-R252 PolarHBondContact O-N 3.13Å; V250-E253 PolarHBondContact O-N 3.06Å; V250-A254 WeakPolarHBondContact O-CB 3.14Å; V250-A254 PolarHBondContact O-N 2.77Å
251	K	81.3	Confident	82.3	Confident	151 Å²	151	85.8 Å²	85.8	66%	0.657	46%	0.46	S	S	*	.	H	α-helix	trans	-59.6	-38	176.3	-175.1	173.6	-177.4	172.1	0	112.7	G247 L249 T255	G247-K251 WeakPolarHBondContact O-CB 3.48Å; G247-K251 PolarHBondContact O-N 2.96Å; G247-K251 VanDerWaalsContact O-N 3.09Å; L249-K251 VanDerWaalsContact C-N 3.33Å; L249-K251 PolarHBondContact O-N 2.99Å; K251-T255 WeakPolarHBondContact O-CB 2.99Å; K251-T255 PolarHBondContact O-N 3.31Å; K251-T255 PolarHBondContact O-OG1 3.26Å
252	R	84.4	Confident	81.2	Confident	129 Å²	129	86 Å²	86	49%	0.487	46%	0.46	S	S	.	.	H	α-helix	trans	-64	-48.9	177	-175.1	-172.8	73.6	176.2	0.8	110.8	R248 L249 V250 T255 K256	R248-R252 WeakPolarHBondContact O-CB 3.4Å; R248-R252 PolarHBondContact O-N 3.03Å; L249-R252 WeakPolarHBondContact O-CA 3.23Å; L249-R252 WeakPolarHBondContact O-CB 3.32Å; L249-R252 PolarHBondContact O-N 3.38Å; V250-R252 VanDerWaalsContact C-N 3.28Å; V250-R252 PolarHBondContact O-N 3.13Å; R252-T255 PolarHBondContact O-N 2.82Å; R252-K256 WeakPolarHBondContact O-CG 3.23Å; R252-K256 PolarHBondContact O-N 2.99Å
253	E	82.5	Confident	80.1	Confident	78 Å²	78	83.9 Å²	83.9	36%	0.364	45%	0.449	S	S	.	.	H	α-helix	trans	-66.6	-43.5	-179.7	-58.3	-42.7	130.3	0	0	111.8	L249 V250 T255 K256 E257	L249-E253 PolarHBondContact O-N 3.45Å; V250-E253 PolarHBondContact O-N 3.06Å; E253-T255 VanDerWaalsContact C-N 3.27Å; E253-T255 PolarHBondContact O-N 3.23Å; E253-K256 WeakPolarHBondContact O-CB 3.35Å; E253-K256 PolarHBondContact O-N 3.19Å; E253-K256 VanDerWaalsContact O-N 3.08Å; E253-K256 IonicContact OE1-NZ 2.76Å; E253-K256 PolarHBondContact OE1-NZ 2.96Å; E253-K256 WeakPolarHBondContact OE2-CD 3.2Å; E253-K256 IonicContact OE2-NZ 3.43Å; E253-K256 PolarHBondContact OE2-NZ 3.07Å; E253-E257 PolarHBondContact O-N 3.2Å
254	A	77.3	Confident	79.4	Confident	52 Å²	52	88 Å²	88	43%	0.43	45%	0.453	S	S	.	.	H	α-helix	trans	-59.5	-36	174.1	0	0	0	0	0	112.8	V250 A258	V250-A254 WeakPolarHBondContact O-CB 3.14Å; V250-A254 PolarHBondContact O-N 2.77Å; A254-A258 WeakPolarHBondContact O-CB 3.1Å; A254-A258 PolarHBondContact O-N 3.05Å
255	T	72.5	Confident	78.7	Confident	73 Å²	73	90.3 Å²	90.3	45%	0.448	46%	0.457	S	S	.	.	H	α-helix	trans	-69.3	-40	175.4	-55.3	0	0	0	0	111.6	K251 R252 E253 A258 I259	K251-T255 WeakPolarHBondContact O-CB 2.99Å; K251-T255 PolarHBondContact O-N 3.31Å; K251-T255 PolarHBondContact O-OG1 3.26Å; R252-T255 PolarHBondContact O-N 2.82Å; E253-T255 VanDerWaalsContact C-N 3.27Å; E253-T255 PolarHBondContact O-N 3.23Å; T255-A258 PolarHBondContact O-N 2.88Å; T255-I259 HydrophobicContact CG2-CD1 4.18Å; T255-I259 WeakPolarHBondContact O-CD1 3.43Å; T255-I259 VanDerWaalsContact O-CG1 3.26Å; T255-I259 WeakPolarHBondContact O-CG1 3.26Å; T255-I259 PolarHBondContact O-N 3.42Å
256	K	79.3	Confident	77.9	Confident	89 Å²	89	89 Å²	89	39%	0.387	46%	0.455	S	S	.	.	H	α-helix	trans	-64.1	-42.7	174.9	-70.6	176.8	-171.2	164.4	0	111.3	R252 E253 I259 V260	R252-K256 WeakPolarHBondContact O-CG 3.23Å; R252-K256 PolarHBondContact O-N 2.99Å; E253-K256 WeakPolarHBondContact O-CB 3.35Å; E253-K256 PolarHBondContact O-N 3.19Å; E253-K256 VanDerWaalsContact O-N 3.08Å; E253-K256 IonicContact OE1-NZ 2.76Å; E253-K256 PolarHBondContact OE1-NZ 2.96Å; E253-K256 WeakPolarHBondContact OE2-CD 3.2Å; E253-K256 IonicContact OE2-NZ 3.43Å; E253-K256 PolarHBondContact OE2-NZ 3.07Å; K256-I259 WeakPolarHBondContact O-CB 3.32Å; K256-I259 PolarHBondContact O-N 3.31Å; K256-V260 WeakPolarHBondContact O-CG2 3.18Å; K256-V260 PolarHBondContact O-N 3.48Å
257	E	77.2	Confident	77.1	Confident	121 Å²	121	89.6 Å²	89.6	57%	0.565	45%	0.454	S	S	*	.	H	α-helix	trans	-58.9	-47.3	174.6	-170.7	-163.8	159.1	0	0	110.9	E253 I259 V260 N261	E253-E257 PolarHBondContact O-N 3.2Å; E257-I259 VanDerWaalsContact C-N 3.27Å; E257-I259 PolarHBondContact O-N 2.85Å; E257-V260 PolarHBondContact O-N 3.49Å; E257-N261 WeakPolarHBondContact O-CB 3.33Å; E257-N261 PolarHBondContact O-N 3.22Å
258	A	73	Confident	76.9	Confident	58 Å²	58	91.3 Å²	91.3	48%	0.479	45%	0.451	S	S	.	.	H	α-helix	trans	-59.7	-36.9	176.3	0	0	0	0	0	112.9	A254 T255 C262	A254-A258 WeakPolarHBondContact O-CB 3.1Å; A254-A258 PolarHBondContact O-N 3.05Å; T255-A258 PolarHBondContact O-N 2.88Å; A258-C262 WeakPolarHBondContact O-CB 3.47Å; A258-C262 PolarHBondContact O-N 3.24Å
259	I	69.8	Low	76.6	Confident	51 Å²	51	86.9 Å²	86.9	26%	0.262	44%	0.44	S	S	.	.	H	α-helix	trans	-64.6	-49.6	174.3	-73.1	164.3	0	0	0	110.7	T255 K256 E257 N261 C262 D263 L387	T255-I259 HydrophobicContact CG2-CD1 4.18Å; T255-I259 WeakPolarHBondContact O-CD1 3.43Å; T255-I259 VanDerWaalsContact O-CG1 3.26Å; T255-I259 WeakPolarHBondContact O-CG1 3.26Å; T255-I259 PolarHBondContact O-N 3.42Å; K256-I259 WeakPolarHBondContact O-CB 3.32Å; K256-I259 PolarHBondContact O-N 3.31Å; E257-I259 VanDerWaalsContact C-N 3.27Å; E257-I259 PolarHBondContact O-N 2.85Å; I259-N261 VanDerWaalsContact C-N 3.33Å; I259-N261 PolarHBondContact O-N 3.13Å; I259-C262 WeakPolarHBondContact O-CB 3.42Å; I259-C262 PolarHBondContact O-N 3.2Å; I259-C262 VanDerWaalsContact O-N 3.12Å; I259-D263 PolarHBondContact O-N 2.89Å; I259-L387 HydrophobicContact CD1-CD1 4.33Å; I259-L387 HydrophobicContact CD1-CD2 4.47Å; I259-L387 HydrophobicContact CG1-CD1 4.35Å; I259-L387 HydrophobicContact CG2-CD1 3.77Å; I259-L387 HydrophobicContact CG2-CD2 3.53Å; I259-L387 HydrophobicContact CG2-CG 4.2Å
260	V	72.2	Confident	76.3	Confident	59 Å²	59	87.3 Å²	87.3	36%	0.358	44%	0.437	S	S	.	.	H	α-helix	trans	-61.7	-42.4	178.9	173.5	0	0	0	0	111	K256 E257 C262 D263 Y264	K256-V260 WeakPolarHBondContact O-CG2 3.18Å; K256-V260 PolarHBondContact O-N 3.48Å; E257-V260 PolarHBondContact O-N 3.49Å; V260-C262 VanDerWaalsContact C-N 3.31Å; V260-C262 PolarHBondContact O-N 3.39Å; V260-D263 PolarHBondContact O-N 2.94Å; V260-Y264 WeakPolarHBondContact O-CB 3.22Å; V260-Y264 PolarHBondContact O-N 3.43Å
261	N	75.4	Confident	75.9	Confident	72 Å²	72	84.4 Å²	84.4	39%	0.385	42%	0.42	S	S	.	.	H	α-helix	trans	-62.8	-37.5	174.9	-79.5	-24.7	0	0	0	112.1	E257 I259 R265	E257-N261 WeakPolarHBondContact O-CB 3.33Å; E257-N261 PolarHBondContact O-N 3.22Å; I259-N261 VanDerWaalsContact C-N 3.33Å; I259-N261 PolarHBondContact O-N 3.13Å; N261-R265 VanDerWaalsContact O-CG 3.29Å; N261-R265 WeakPolarHBondContact O-CG 3.32Å; N261-R265 PolarHBondContact O-N 2.92Å
262	C	69.9	Low	76	Confident	68 Å²	68	84.1 Å²	84.1	46%	0.459	42%	0.419	S	S	.	.	H	α-helix	trans	-65.1	-46.6	173.8	-169.5	0	0	0	0	111.2	A258 I259 V260 Y264 R265 C266	A258-C262 WeakPolarHBondContact O-CB 3.47Å; A258-C262 PolarHBondContact O-N 3.24Å; I259-C262 WeakPolarHBondContact O-CB 3.42Å; I259-C262 PolarHBondContact O-N 3.2Å; I259-C262 VanDerWaalsContact O-N 3.12Å; V260-C262 VanDerWaalsContact C-N 3.31Å; V260-C262 PolarHBondContact O-N 3.39Å; C262-Y264 VanDerWaalsContact C-N 3.33Å; C262-Y264 PolarHBondContact O-N 3.14Å; C262-R265 PolarHBondContact O-N 3.18Å; C262-C266 WeakPolarHBondContact O-CB 3.33Å; C262-C266 PolarHBondContact O-N 2.94Å; C262-C266 PolarHBondContact O-SG 2.9Å; C262-C266 VanDerWaalsContact O-SG 3.33Å
263	D	70.8	Confident	75.5	Confident	35 Å²	35	80 Å²	80	19%	0.187	41%	0.406	C	S	.	.	H	α-helix	trans	-61.1	-42.7	178.5	-72.6	-13.6	0	0	0	111.4	I259 V260 C266 F267 C388	I259-D263 PolarHBondContact O-N 2.89Å; V260-D263 PolarHBondContact O-N 2.94Å; D263-C266 PolarHBondContact O-N 3.42Å; D263-F267 WeakPolarHBondContact O-CB 3.45Å; D263-F267 PolarHBondContact O-N 3.46Å; D263-C388 PolarHBondContact OD1-SG 3.38Å
264	Y	75.1	Confident	75.5	Confident	127 Å²	127	80.2 Å²	80.2	50%	0.498	42%	0.416	S	S	.	.	H	α-helix	trans	-60.4	-46	174.7	179.6	-108.3	0	0	0	111.9	V260 C262 F267 Q268	V260-Y264 WeakPolarHBondContact O-CB 3.22Å; V260-Y264 PolarHBondContact O-N 3.43Å; C262-Y264 VanDerWaalsContact C-N 3.33Å; C262-Y264 PolarHBondContact O-N 3.14Å; Y264-F267 WeakPolarHBondContact O-CB 3.31Å; Y264-F267 PolarHBondContact O-N 3.35Å; Y264-Q268 HydrophobicContact CD1-CG 4.47Å; Y264-Q268 HydrophobicContact CE1-CG 4.11Å; Y264-Q268 HydrophobicContact CE2-CG 4.38Å; Y264-Q268 WeakPolarHBondContact O-CG 3.4Å; Y264-Q268 PolarHBondContact O-N 3.38Å; Y264-Q268 PolarHBondContact OH-NE2 2.94Å
265	R	76.5	Confident	75.4	Confident	166 Å²	166	78.2 Å²	78.2	63%	0.626	40%	0.398	S	S	*	.	H	α-helix	trans	-62.8	-43.5	175.4	-74.1	176.1	-176.2	177.6	2.4	112.1	N261 C262 F267 Q268 L269	N261-R265 VanDerWaalsContact O-CG 3.29Å; N261-R265 WeakPolarHBondContact O-CG 3.32Å; N261-R265 PolarHBondContact O-N 2.92Å; C262-R265 PolarHBondContact O-N 3.18Å; R265-F267 VanDerWaalsContact C-N 3.3Å; R265-F267 PolarHBondContact O-N 3.41Å; R265-Q268 PolarHBondContact O-N 3.41Å; R265-L269 WeakPolarHBondContact O-CB 3.49Å; R265-L269 WeakPolarHBondContact O-CG 3.46Å; R265-L269 PolarHBondContact O-N 3.13Å
266	C	71.5	Confident	75.5	Confident	64 Å²	64	83.2 Å²	83.2	43%	0.432	41%	0.409	S	S	.	.	H	α-helix	trans	-59.4	-42.8	175.6	-73.3	0	0	0	0	111.3	C262 D263 L269 R270	C262-C266 WeakPolarHBondContact O-CB 3.33Å; C262-C266 PolarHBondContact O-N 2.94Å; C262-C266 PolarHBondContact O-SG 2.9Å; C262-C266 VanDerWaalsContact O-SG 3.33Å; D263-C266 PolarHBondContact O-N 3.42Å; C266-L269 PolarHBondContact O-N 2.96Å; C266-R270 WeakPolarHBondContact O-CG 3.47Å; C266-R270 PolarHBondContact O-N 3.36Å
267	F	74.3	Confident	75.3	Confident	104 Å²	104	87 Å²	87	46%	0.456	43%	0.428	S	S	.	.	H	α-helix	trans	-62.2	-50	175.5	177.4	-99.7	0	0	0	112	D263 Y264 R265 L269 R270 C271	D263-F267 WeakPolarHBondContact O-CB 3.45Å; D263-F267 PolarHBondContact O-N 3.46Å; Y264-F267 WeakPolarHBondContact O-CB 3.31Å; Y264-F267 PolarHBondContact O-N 3.35Å; R265-F267 VanDerWaalsContact C-N 3.3Å; R265-F267 PolarHBondContact O-N 3.41Å; F267-L269 VanDerWaalsContact C-N 3.29Å; F267-L269 PolarHBondContact O-N 3.03Å; F267-R270 PolarHBondContact O-N 2.9Å; F267-C271 VanDerWaalsContact CZ-SG 3.59Å; F267-C271 PolarHBondContact O-N 3.11Å; F267-C271 PolarHBondContact O-SG 3.02Å; F267-C271 VanDerWaalsContact O-SG 3.36Å
268	Q	79.9	Confident	74.9	Confident	77 Å²	77	81.5 Å²	81.5	36%	0.36	40%	0.404	S	S	.	.	H	α-helix	trans	-56	-43.1	177.1	-74.4	-175.8	-32.4	0	0	112.3	Y264 R265 C271 K272	Y264-Q268 HydrophobicContact CD1-CG 4.47Å; Y264-Q268 HydrophobicContact CE1-CG 4.11Å; Y264-Q268 HydrophobicContact CE2-CG 4.38Å; Y264-Q268 WeakPolarHBondContact O-CG 3.4Å; Y264-Q268 PolarHBondContact O-N 3.38Å; Y264-Q268 PolarHBondContact OH-NE2 2.94Å; R265-Q268 PolarHBondContact O-N 3.41Å; Q268-C271 PolarHBondContact O-N 3.06Å; Q268-K272 WeakPolarHBondContact O-CG 3.17Å; Q268-K272 PolarHBondContact O-N 3.14Å
269	L	77.3	Confident	75	Confident	80 Å²	80	81.7 Å²	81.7	42%	0.419	40%	0.402	S	S	.	.	H	α-helix	trans	-65.9	-45.1	178.1	-73	169.9	0	0	0	111.6	R265 C266 F267 C271 K272 L273 L431	R265-L269 WeakPolarHBondContact O-CB 3.49Å; R265-L269 WeakPolarHBondContact O-CG 3.46Å; R265-L269 PolarHBondContact O-N 3.13Å; C266-L269 PolarHBondContact O-N 2.96Å; F267-L269 VanDerWaalsContact C-N 3.29Å; F267-L269 PolarHBondContact O-N 3.03Å; L269-C271 VanDerWaalsContact C-N 3.3Å; L269-C271 PolarHBondContact O-N 3.2Å; L269-K272 PolarHBondContact O-N 2.85Å; L269-K272 VanDerWaalsContact O-N 3.17Å; L269-L273 HydrophobicContact CB-CD1 4.5Å; L269-L273 WeakPolarHBondContact O-CB 3.43Å; L269-L273 VanDerWaalsContact O-CD1 3.23Å; L269-L273 WeakPolarHBondContact O-CD1 3.01Å; L269-L273 WeakPolarHBondContact O-CG 3.08Å; L269-L273 PolarHBondContact O-N 2.99Å; L269-L431 HydrophobicContact CD2-CD2 4.12Å
270	R	76.6	Confident	74.9	Confident	77 Å²	77	80.5 Å²	80.5	29%	0.291	40%	0.398	S	S	.	.	H	α-helix	trans	-59.5	-40.2	176	-74.8	-179.2	65.8	-174.3	-0.9	112.4	C266 F267 L273 C274 D275 W276	C266-R270 WeakPolarHBondContact O-CG 3.47Å; C266-R270 PolarHBondContact O-N 3.36Å; F267-R270 PolarHBondContact O-N 2.9Å; R270-L273 CarbonylContact O-C 3.55Å; R270-L273 PolarHBondContact O-N 3.28Å; R270-C274 PolarHBondContact O-N 3.13Å; R270-C274 VanDerWaalsContact O-N 3.08Å; R270-D275 PolarHBondContact NE-O 3.04Å; R270-D275 VanDerWaalsContact NE-O 3.11Å; R270-D275 PolarHBondContact NH2-O 2.99Å; R270-D275 PolarHBondContact O-N 2.79Å; R270-W276 PolarHBondContact NH2-O 3.48Å
271	C	77.4	Confident	74.7	Confident	41 Å²	41	81.7 Å²	81.7	28%	0.277	40%	0.402	S	S	.	.	H	α-helix	trans	-63.1	-45.6	174.5	-69.2	0	0	0	0	111.8	F267 Q268 L269 L273 C274	F267-C271 VanDerWaalsContact CZ-SG 3.59Å; F267-C271 PolarHBondContact O-N 3.11Å; F267-C271 PolarHBondContact O-SG 3.02Å; F267-C271 VanDerWaalsContact O-SG 3.36Å; Q268-C271 PolarHBondContact O-N 3.06Å; L269-C271 VanDerWaalsContact C-N 3.3Å; L269-C271 PolarHBondContact O-N 3.2Å; C271-L273 PolarHBondContact O-N 2.9Å; C271-C274 PolarHBondContact O-N 3.46Å; C271-C274 VanDerWaalsContact O-N 3.17Å
272	K	82.2	Confident	74.5	Confident	145 Å²	145	81.4 Å²	81.4	63%	0.63	40%	0.403	S	S	*	.	H	α-helix	trans	-61.4	-29.7	175.8	-74.2	179.6	179.1	-175.8	0	113	Q268 L269	Q268-K272 WeakPolarHBondContact O-CG 3.17Å; Q268-K272 PolarHBondContact O-N 3.14Å; L269-K272 PolarHBondContact O-N 2.85Å; L269-K272 VanDerWaalsContact O-N 3.17Å
273	L	75.5	Confident	74.7	Confident	42 Å²	42	83 Å²	83	22%	0.22	40%	0.403	C	S	.	.	T	Hydrogen-bonded Turn	trans	-90.1	-3.4	-179.4	-75.1	154.5	0	0	0	113.7	L269 R270 C271 D275 Y427 L431	L269-L273 HydrophobicContact CB-CD1 4.5Å; L269-L273 WeakPolarHBondContact O-CB 3.43Å; L269-L273 VanDerWaalsContact O-CD1 3.23Å; L269-L273 WeakPolarHBondContact O-CD1 3.01Å; L269-L273 WeakPolarHBondContact O-CG 3.08Å; L269-L273 PolarHBondContact O-N 2.99Å; R270-L273 CarbonylContact O-C 3.55Å; R270-L273 PolarHBondContact O-N 3.28Å; C271-L273 PolarHBondContact O-N 2.9Å; L273-D275 HydrophobicContact CB-CB 4.27Å; L273-D275 PolarHBondContact O-N 3.31Å; L273-D275 VanDerWaalsContact O-N 3.11Å; L273-Y427 HydrophobicContact CD1-CE1 3.46Å; L273-Y427 VanDerWaalsContact CD1-CE1 3.46Å; L273-Y427 VanDerWaalsContact CD1-CZ 3.49Å; L273-Y427 WeakPolarHBondContact CD1-OH 3.41Å; L273-Y427 HydrophobicContact CD2-CE1 4.28Å; L273-Y427 HydrophobicContact CD2-CE2 4.36Å; L273-Y427 HydrophobicContact CG-CE1 4.49Å; L273-L431 HydrophobicContact CD1-CD1 3.55Å; L273-L431 HydrophobicContact CD1-CG 4.38Å; L273-L431 HydrophobicContact CD2-CD1 3.6Å; L273-L431 HydrophobicContact CD2-CG 3.88Å; L273-L431 HydrophobicContact CG-CD1 3.86Å; L273-L431 HydrophobicContact CG-CG 4.21Å
274	C	81.2	Confident	74.6	Confident	83 Å²	83	82.2 Å²	82.2	56%	0.561	40%	0.402	S	S	*	.	T	Hydrogen-bonded Turn	trans	52.1	28.2	-170.2	-61.8	0	0	0	0	112.8	R270 C271 W276	R270-C274 PolarHBondContact O-N 3.13Å; R270-C274 VanDerWaalsContact O-N 3.08Å; C271-C274 PolarHBondContact O-N 3.46Å; C271-C274 VanDerWaalsContact O-N 3.17Å; C274-W276 VanDerWaalsContact C-N 3.31Å; C274-W276 HydrophobicContact CB-CZ2 4.4Å; C274-W276 PolarHBondContact O-N 3.41Å; C274-W276 VanDerWaalsContact O-N 3.1Å; C274-W276 PolarHBondContact O-NE1 2.88Å
275	D	76.2	Confident	74.1	Confident	11 Å²	11	77.2 Å²	77.2	6%	0.059	38%	0.383	C	S	.	.			trans	-89	69	-178.9	-172.2	16	0	0	0	111.2	R270 L273 G278 S279 S280	R270-D275 PolarHBondContact NE-O 3.04Å; R270-D275 VanDerWaalsContact NE-O 3.11Å; R270-D275 PolarHBondContact NH2-O 2.99Å; R270-D275 PolarHBondContact O-N 2.79Å; L273-D275 HydrophobicContact CB-CB 4.27Å; L273-D275 PolarHBondContact O-N 3.31Å; L273-D275 VanDerWaalsContact O-N 3.11Å; D275-G278 PolarHBondContact O-N 3.38Å; D275-G278 VanDerWaalsContact OD1-C 3.32Å; D275-G278 VanDerWaalsContact OD1-CA 3.25Å; D275-G278 WeakPolarHBondContact OD1-CA 3.38Å; D275-G278 PolarHBondContact OD1-N 3.48Å; D275-G278 WeakPolarHBondContact OD2-CA 3.32Å; D275-S279 PolarHBondContact OD1-N 2.96Å; D275-S279 PolarHBondContact OD2-N 3.3Å; D275-S280 VanDerWaalsContact OD2-CB 3.32Å; D275-S280 WeakPolarHBondContact OD2-CB 3.39Å; D275-S280 PolarHBondContact OD2-N 3.33Å; D275-S280 VanDerWaalsContact OD2-N 3.11Å; D275-S280 PolarHBondContact OD2-OG 3.08Å
276	W	73.9	Confident	74	Confident	177 Å²	177	70.8 Å²	70.8	67%	0.67	37%	0.365	S	S	*	.	S	Bend	trans	-68	-35.7	-176.3	-49.7	113	0	0	0	112.7	R270 C274	R270-W276 PolarHBondContact NH2-O 3.48Å; C274-W276 VanDerWaalsContact C-N 3.31Å; C274-W276 HydrophobicContact CB-CZ2 4.4Å; C274-W276 PolarHBondContact O-N 3.41Å; C274-W276 VanDerWaalsContact O-N 3.1Å; C274-W276 PolarHBondContact O-NE1 2.88Å
277	E	74.7	Confident	73.9	Confident	168 Å²	168	70.4 Å²	70.4	79%	0.785	36%	0.358	S	S	*	.	S	Bend	trans	-87.4	-14.3	-178.1	-60.8	-167.3	158.2	0	0	112.5	S279	E277-S279 VanDerWaalsContact C-N 3.34Å
278	G	69.6	Low	73.3	Confident	6 Å²	6	66 Å²	66	6%	0.062	34%	0.34	C	S	.	.			trans	77.5	25.2	-174.2	0	0	0	0	0	111.8	D275 S280 L281 V282	D275-G278 PolarHBondContact O-N 3.38Å; D275-G278 VanDerWaalsContact OD1-C 3.32Å; D275-G278 VanDerWaalsContact OD1-CA 3.25Å; D275-G278 WeakPolarHBondContact OD1-CA 3.38Å; D275-G278 PolarHBondContact OD1-N 3.48Å; D275-G278 WeakPolarHBondContact OD2-CA 3.32Å; G278-S280 VanDerWaalsContact C-N 3.3Å; G278-S280 PolarHBondContact O-N 3.05Å; G278-L281 WeakPolarHBondContact O-CB 3.47Å; G278-L281 PolarHBondContact O-N 2.94Å; G278-L281 VanDerWaalsContact O-N 3.13Å; G278-V282 WeakPolarHBondContact O-CG2 3.41Å; G278-V282 PolarHBondContact O-N 3.1Å
279	S	74.2	Confident	72.7	Confident	63 Å²	63	68.9 Å²	68.9	44%	0.441	35%	0.348	S	S	.	.	H	α-helix	trans	-60.2	-39.6	-176.3	-62.5	0	0	0	0	111.5	D275 E277 L281 V282 E283	D275-S279 PolarHBondContact OD1-N 2.96Å; D275-S279 PolarHBondContact OD2-N 3.3Å; E277-S279 VanDerWaalsContact C-N 3.34Å; S279-L281 VanDerWaalsContact C-N 3.31Å; S279-L281 PolarHBondContact O-N 3.45Å; S279-V282 PolarHBondContact O-N 2.89Å; S279-E283 VanDerWaalsContact O-CB 3.31Å; S279-E283 WeakPolarHBondContact O-CB 3.45Å; S279-E283 PolarHBondContact O-N 3.28Å
280	S	69.4	Low	72	Confident	26 Å²	26	68.8 Å²	68.8	18%	0.182	35%	0.348	C	S	.	.	H	α-helix	trans	-67.3	-35.7	177.1	-52.6	0	0	0	0	112	D275 G278 A284 Y423 Y427	D275-S280 VanDerWaalsContact OD2-CB 3.32Å; D275-S280 WeakPolarHBondContact OD2-CB 3.39Å; D275-S280 PolarHBondContact OD2-N 3.33Å; D275-S280 VanDerWaalsContact OD2-N 3.11Å; D275-S280 PolarHBondContact OD2-OG 3.08Å; G278-S280 VanDerWaalsContact C-N 3.3Å; G278-S280 PolarHBondContact O-N 3.05Å; S280-A284 WeakPolarHBondContact O-CB 3.34Å; S280-A284 PolarHBondContact O-N 3.2Å; S280-Y423 PolarHBondContact O-OH 3.34Å; S280-Y427 WeakPolarHBondContact CB-OH 3.41Å; S280-Y427 VanDerWaalsContact OG-CE2 3.25Å; S280-Y427 WeakPolarHBondContact OG-CE2 3.38Å; S280-Y427 PolarHBondContact OG-OH 2.91Å
281	L	67.2	Low	71.3	Confident	84 Å²	84	68.3 Å²	68.3	44%	0.44	35%	0.349	S	S	.	.	H	α-helix	trans	-70.4	-42.3	175.3	-174	146.3	0	0	0	111.1	G278 S279 E283 A284 E285	G278-L281 WeakPolarHBondContact O-CB 3.47Å; G278-L281 PolarHBondContact O-N 2.94Å; G278-L281 VanDerWaalsContact O-N 3.13Å; S279-L281 VanDerWaalsContact C-N 3.31Å; S279-L281 PolarHBondContact O-N 3.45Å; L281-E283 VanDerWaalsContact C-N 3.33Å; L281-E283 PolarHBondContact O-N 3.21Å; L281-A284 PolarHBondContact O-N 3.07Å; L281-E285 HydrophobicContact CD2-CG 4.27Å; L281-E285 WeakPolarHBondContact CD2-OE1 3.02Å; L281-E285 WeakPolarHBondContact O-CG 3.23Å; L281-E285 PolarHBondContact O-N 3.1Å
282	V	71.9	Confident	70.2	Confident	66 Å²	66	72.7 Å²	72.7	40%	0.4	37%	0.365	S	S	.	.	H	α-helix	trans	-63.7	-39.5	176	171.7	0	0	0	0	111.4	G278 S279 E285 A286	G278-V282 WeakPolarHBondContact O-CG2 3.41Å; G278-V282 PolarHBondContact O-N 3.1Å; S279-V282 PolarHBondContact O-N 2.89Å; V282-E285 WeakPolarHBondContact O-CB 3.42Å; V282-E285 PolarHBondContact O-N 2.99Å; V282-A286 WeakPolarHBondContact O-CB 3.44Å; V282-A286 PolarHBondContact O-N 2.85Å
283	E	73.5	Confident	68.8	Low	101 Å²	101	71.8 Å²	71.8	47%	0.472	36%	0.363	S	S	.	.	H	α-helix	trans	-65.3	-45.6	175.4	-174.9	-179	-169.6	0	0	111.3	S279 L281 E285 A286 L287 Y423	S279-E283 VanDerWaalsContact O-CB 3.31Å; S279-E283 WeakPolarHBondContact O-CB 3.45Å; S279-E283 PolarHBondContact O-N 3.28Å; L281-E283 VanDerWaalsContact C-N 3.33Å; L281-E283 PolarHBondContact O-N 3.21Å; E283-E285 VanDerWaalsContact C-N 3.31Å; E283-E285 PolarHBondContact O-N 3.01Å; E283-A286 PolarHBondContact O-N 3.27Å; E283-A286 VanDerWaalsContact O-N 3.11Å; E283-L287 WeakPolarHBondContact O-CG 3.26Å; E283-L287 PolarHBondContact O-N 3.31Å; E283-Y423 VanDerWaalsContact CD-OH 3.29Å; E283-Y423 HydrophobicContact CG-CE2 3.79Å; E283-Y423 WeakPolarHBondContact OE1-CE2 3.45Å; E283-Y423 VanDerWaalsContact OE2-CE2 3.3Å; E283-Y423 WeakPolarHBondContact OE2-CE2 3.47Å; E283-Y423 PolarHBondContact OE2-OH 3.27Å
284	A	68.5	Low	67.6	Low	19 Å²	19	74.7 Å²	74.7	16%	0.157	38%	0.379	C	S	.	.	H	α-helix	trans	-57.5	-43.6	172.4	0	0	0	0	0	111.7	S280 L281 A286 L287 V288 L420 Y423	S280-A284 WeakPolarHBondContact O-CB 3.34Å; S280-A284 PolarHBondContact O-N 3.2Å; L281-A284 PolarHBondContact O-N 3.07Å; A284-A286 VanDerWaalsContact C-N 3.34Å; A284-A286 PolarHBondContact O-N 3.2Å; A284-L287 PolarHBondContact O-N 3.31Å; A284-V288 WeakPolarHBondContact O-CG2 3.08Å; A284-V288 PolarHBondContact O-N 3.09Å; A284-L420 HydrophobicContact CB-CD1 4.2Å; A284-Y423 HydrophobicContact CB-CD1 4.15Å; A284-Y423 HydrophobicContact CB-CE1 3.81Å
285	E	65	Low	66.1	Low	22 Å²	22	77 Å²	77	10%	0.103	38%	0.381	C	S	.	.	H	α-helix	trans	-64.4	-36.3	174.9	-74	179.2	-178.2	0	0	112.9	L281 V282 E283 V288 R289 Y395	L281-E285 HydrophobicContact CD2-CG 4.27Å; L281-E285 WeakPolarHBondContact CD2-OE1 3.02Å; L281-E285 WeakPolarHBondContact O-CG 3.23Å; L281-E285 PolarHBondContact O-N 3.1Å; V282-E285 WeakPolarHBondContact O-CB 3.42Å; V282-E285 PolarHBondContact O-N 2.99Å; E283-E285 VanDerWaalsContact C-N 3.31Å; E283-E285 PolarHBondContact O-N 3.01Å; E285-V288 PolarHBondContact O-N 2.93Å; E285-R289 WeakPolarHBondContact O-CG 3.44Å; E285-R289 PolarHBondContact O-N 3.11Å; E285-R289 PolarHBondContact O-NE 3.15Å; E285-Y395 VanDerWaalsContact CD-CE2 3.46Å; E285-Y395 HydrophobicContact CG-CD2 3.93Å; E285-Y395 HydrophobicContact CG-CE2 3.72Å; E285-Y395 WeakPolarHBondContact OE1-CD2 3.41Å; E285-Y395 WeakPolarHBondContact OE1-CE2 3.45Å
286	A	73.5	Confident	64.6	Low	31 Å²	31	78.2 Å²	78.2	26%	0.256	40%	0.397	S	S	.	.	H	α-helix	trans	-70.1	-43	178	0	0	0	0	0	111.5	V282 E283 A284 V288 R289 N290	V282-A286 WeakPolarHBondContact O-CB 3.44Å; V282-A286 PolarHBondContact O-N 2.85Å; E283-A286 PolarHBondContact O-N 3.27Å; E283-A286 VanDerWaalsContact O-N 3.11Å; A284-A286 VanDerWaalsContact C-N 3.34Å; A284-A286 PolarHBondContact O-N 3.2Å; A286-V288 PolarHBondContact O-N 3.05Å; A286-R289 PolarHBondContact O-N 2.89Å; A286-R289 VanDerWaalsContact O-N 3.13Å; A286-N290 WeakPolarHBondContact O-CB 3.5Å; A286-N290 PolarHBondContact O-N 3.12Å; A286-N290 PolarHBondContact O-ND2 2.95Å
287	L	70.6	Confident	63.3	Low	55 Å²	55	73.3 Å²	73.3	29%	0.288	39%	0.386	S	S	.	.	H	α-helix	trans	-56.9	-37.2	174.5	-74	171.7	0	0	0	111.8	E283 A284 H291 Y423	E283-L287 WeakPolarHBondContact O-CG 3.26Å; E283-L287 PolarHBondContact O-N 3.31Å; A284-L287 PolarHBondContact O-N 3.31Å; L287-H291 PolarHBondContact O-N 3.36Å; L287-Y423 HydrophobicContact CD1-CD1 3.99Å; L287-Y423 HydrophobicContact CD1-CD2 3.39Å; L287-Y423 HydrophobicContact CD1-CE2 4.05Å; L287-Y423 HydrophobicContact CD1-CG 3.34Å
288	V	62	Low	61.9	Low	13 Å²	13	72.4 Å²	72.4	8%	0.079	38%	0.382	C	S	.	.	H	α-helix	trans	-72	-42.7	176.2	176.8	0	0	0	0	112.5	A284 E285 A286 H291 L381 Y398 L420	A284-V288 WeakPolarHBondContact O-CG2 3.08Å; A284-V288 PolarHBondContact O-N 3.09Å; E285-V288 PolarHBondContact O-N 2.93Å; A286-V288 PolarHBondContact O-N 3.05Å; V288-H291 PolarHBondContact O-N 2.83Å; V288-L381 HydrophobicContact CB-CD1 4.26Å; V288-L381 HydrophobicContact CG1-CD1 3.35Å; V288-Y398 HydrophobicContact CG1-CE1 4.37Å; V288-Y398 WeakPolarHBondContact CG1-OH 3.22Å; V288-Y398 WeakPolarHBondContact CG2-OH 3.39Å; V288-L420 HydrophobicContact CG2-CB 4.43Å; V288-L420 HydrophobicContact CG2-CD1 4Å; V288-L420 HydrophobicContact CG2-CD2 3.66Å; V288-L420 HydrophobicContact CG2-CG 4.24Å
289	R	65.6	Low	60.7	Low	137 Å²	137	76.1 Å²	76.1	52%	0.517	40%	0.403	S	S	.	.	H	α-helix	trans	-63.3	-44.4	176.5	-77.9	-175.6	-82.4	177.4	-6.1	111.7	E285 A286 H291 H292 E293	E285-R289 WeakPolarHBondContact O-CG 3.44Å; E285-R289 PolarHBondContact O-N 3.11Å; E285-R289 PolarHBondContact O-NE 3.15Å; A286-R289 PolarHBondContact O-N 2.89Å; A286-R289 VanDerWaalsContact O-N 3.13Å; R289-H291 VanDerWaalsContact C-N 3.27Å; R289-H291 PolarHBondContact O-N 2.83Å; R289-H292 WeakPolarHBondContact O-CB 3.45Å; R289-H292 PolarHBondContact O-N 2.91Å; R289-E293 PolarHBondContact O-N 3Å
290	N	63.3	Low	59.1	Low	77 Å²	77	79.7 Å²	79.7	41%	0.412	41%	0.414	S	S	.	.	H	α-helix	trans	-65.1	-30.6	179.6	-67	-14.9	0	0	0	112.3	A286 H292 E293 N294	A286-N290 WeakPolarHBondContact O-CB 3.5Å; A286-N290 PolarHBondContact O-N 3.12Å; A286-N290 PolarHBondContact O-ND2 2.95Å; N290-H292 PolarHBondContact O-N 3.31Å; N290-E293 PolarHBondContact O-N 3.48Å; N290-N294 PolarHBondContact O-N 2.9Å
291	H	61	Low	57.8	Low	67 Å²	67	87.8 Å²	87.8	31%	0.31	44%	0.441	S	S	.	.	H	α-helix	trans	-63.2	-32.8	173.3	-141.1	-59.4	0	0	0	112.8	L287 V288 R289 P419	L287-H291 PolarHBondContact O-N 3.36Å; V288-H291 PolarHBondContact O-N 2.83Å; R289-H291 VanDerWaalsContact C-N 3.27Å; R289-H291 PolarHBondContact O-N 2.83Å; H291-P419 WeakPolarHBondContact CD2-CG 3.32Å; H291-P419 WeakPolarHBondContact NE2-CD 3.28Å; H291-P419 WeakPolarHBondContact NE2-CG 3.39Å
292	H	55.2	Low	56.9	Low	134 Å²	134	87.7 Å²	87.7	62%	0.62	45%	0.447	S	S	*	.	H	α-helix	trans	-76.6	-29.8	174.9	-90.9	-69.6	0	0	0	112.9	R289 N290	R289-H292 WeakPolarHBondContact O-CB 3.45Å; R289-H292 PolarHBondContact O-N 2.91Å; N290-H292 PolarHBondContact O-N 3.31Å
293	E	52.7	Low	55.8	Low	125 Å²	125	90.5 Å²	90.5	58%	0.584	46%	0.46	S	S	*	.	H	α-helix	trans	-80.4	-40.9	179.7	-67.3	-173.4	175.9	0	0	112.7	R289 N290 E295 G296 V297	R289-E293 PolarHBondContact O-N 3Å; N290-E293 PolarHBondContact O-N 3.48Å; E293-E295 PolarHBondContact O-N 3.39Å; E293-G296 WeakPolarHBondContact O-CA 3.47Å; E293-G296 PolarHBondContact O-N 2.88Å; E293-V297 WeakPolarHBondContact O-CG2 3.24Å; E293-V297 PolarHBondContact O-N 3.5Å
294	N	51	Low	54.3	Low	104 Å²	104	94.1 Å²	94.1	56%	0.556	47%	0.474	S	S	*	.	H	α-helix	trans	-67.7	-36.4	179.2	-79	-18.5	0	0	0	112.5	N290 G296 V297 E298	N290-N294 PolarHBondContact O-N 2.9Å; N294-G296 PolarHBondContact O-N 3.45Å; N294-V297 PolarHBondContact O-N 3.18Å; N294-E298 PolarHBondContact O-N 3.07Å
295	E	49.9	Very low	53.5	Low	131 Å²	131	100 Å²	100	61%	0.612	50%	0.503	S	S	*	.	H	α-helix	trans	-65.3	-26.8	169.9	-72.2	-147.8	164.7	0	0	112.2	E293 T299	E293-E295 PolarHBondContact O-N 3.39Å; E295-T299 WeakPolarHBondContact O-CB 3.47Å; E295-T299 PolarHBondContact O-OG1 3.22Å
296	G	43.2	Very low	52.6	Low	37 Å²	37	105.9 Å²	105.9	38%	0.381	54%	0.535	S	S	.	.	H	α-helix	trans	-74.5	-39	175.4	0	0	0	0	0	114.1	E293 N294 M300	E293-G296 WeakPolarHBondContact O-CA 3.47Å; E293-G296 PolarHBondContact O-N 2.88Å; N294-G296 PolarHBondContact O-N 3.45Å; G296-M300 WeakPolarHBondContact O-CG 3.31Å; G296-M300 PolarHBondContact O-N 3.39Å
297	V	47.9	Very low	51	Low	73 Å²	73	113.3 Å²	113.3	44%	0.442	56%	0.561	S	S	.	*	H	α-helix	trans	-83.6	-37.1	-172.4	177.8	0	0	0	0	112.8	E293 N294 T299 M300 R301	E293-V297 WeakPolarHBondContact O-CG2 3.24Å; E293-V297 PolarHBondContact O-N 3.5Å; N294-V297 PolarHBondContact O-N 3.18Å; V297-T299 VanDerWaalsContact C-N 3.28Å; V297-T299 PolarHBondContact O-N 3.18Å; V297-M300 PolarHBondContact O-N 3.13Å; V297-R301 PolarHBondContact O-N 3.13Å
298	E	45.6	Very low	49.5	Very low	150 Å²	150	122.2 Å²	122.2	70%	0.701	59%	0.591	S	S	*	*	H	α-helix	trans	-65.8	-35.7	174	-72.1	-176.5	161.2	0	0	111.5	N294 M300 R301 S302	N294-E298 PolarHBondContact O-N 3.07Å; E298-M300 PolarHBondContact O-N 3.22Å; E298-R301 PolarHBondContact O-N 3.07Å; E298-S302 PolarHBondContact O-N 3.37Å
299	T	43.6	Very low	48.5	Very low	83 Å²	83	133.2 Å²	133.2	51%	0.509	63%	0.631	S	S	.	*	H	α-helix	trans	-65.8	-36.7	176.7	-56.1	0	0	0	0	112.1	E295 V297 L303	E295-T299 WeakPolarHBondContact O-CB 3.47Å; E295-T299 PolarHBondContact O-OG1 3.22Å; V297-T299 VanDerWaalsContact C-N 3.28Å; V297-T299 PolarHBondContact O-N 3.18Å; T299-L303 HydrophobicContact CG2-CD1 4.16Å; T299-L303 WeakPolarHBondContact O-CD1 3.49Å; T299-L303 PolarHBondContact O-N 2.93Å
300	M	39.5	Very low	47.2	Very low	138 Å²	138	132.6 Å²	132.6	68%	0.68	65%	0.645	S	S	*	*	H	α-helix	trans	-73.7	-29.3	179.4	-77.2	-77.7	-77	0	0	114	G296 V297 E298	G296-M300 WeakPolarHBondContact O-CG 3.31Å; G296-M300 PolarHBondContact O-N 3.39Å; V297-M300 PolarHBondContact O-N 3.13Å; E298-M300 PolarHBondContact O-N 3.22Å
301	R	43.3	Very low	45.8	Very low	197 Å²	197	137 Å²	137	74%	0.743	67%	0.668	S	S	*	*	H	α-helix	trans	-75.2	-34.5	176.8	-70	-179.3	-177.8	-175	1.3	112	V297 E298	V297-R301 PolarHBondContact O-N 3.13Å; E298-R301 PolarHBondContact O-N 3.07Å
302	S	47.2	Very low	44.9	Very low	82 Å²	82	145.6 Å²	145.6	57%	0.573	70%	0.698	S	S	*	*	H	α-helix	trans	-73.2	-27.7	177.3	-170	0	0	0	0	113.7	E298 K304	E298-S302 PolarHBondContact O-N 3.37Å; S302-K304 VanDerWaalsContact C-N 3.32Å; S302-K304 PolarHBondContact O-N 3.44Å
303	L	49	Very low	44.2	Very low	125 Å²	125	149 Å²	149	65%	0.654	71%	0.711	S	S	*	*	T	Hydrogen-bonded Turn	trans	-73.1	-17.3	180	-92.6	153.3	0	0	0	114.5	T299	T299-L303 HydrophobicContact CG2-CD1 4.16Å; T299-L303 WeakPolarHBondContact O-CD1 3.49Å; T299-L303 PolarHBondContact O-N 2.93Å
304	K	43.2	Very low	43.8	Very low	176 Å²	176	155.1 Å²	155.1	77%	0.765	73%	0.729	S	S	*	*	T	Hydrogen-bonded Turn	trans	-84.6	-17.4	-174.1	-142.2	171.7	-176.9	-179.9	0	114	S302	S302-K304 VanDerWaalsContact C-N 3.32Å; S302-K304 PolarHBondContact O-N 3.44Å
305	D	52.1	Low	43.3	Very low	144 Å²	144	159.3 Å²	159.3	77%	0.77	74%	0.742	S	S	*	*	S	Bend	trans	-97.4	-1.9	-176.2	-73.1	-28.9	0	0	0	115
306	N	45.7	Very low	42.7	Very low	144 Å²	144	161.7 Å²	161.7	77%	0.77	76%	0.758	S	S	*	*			trans	-104.8	53.9	178.8	-80.9	-42	0	0	0	113.3
307	K	39.5	Very low	42.6	Very low	188 Å²	188	164.9 Å²	164.9	82%	0.817	77%	0.77	S	S	*	*			trans	-89	102.4	161.1	-85.6	-178	177.9	176	0	109.1
308	R	38.6	Very low	42.2	Very low	241 Å²	241	169.9 Å²	169.9	91%	0.909	79%	0.786	S	S	*	*			trans	151.2	87	150.7	-84.5	163.9	-173.3	-145.5	3.6	110.5
309	R	42.1	Very low	41.8	Very low	244 Å²	244	172.7 Å²	172.7	92%	0.921	79%	0.79	S	S	*	*			trans	-147.1	136.2	149	-75.3	-158.3	170.8	-175.5	-3.3	111.4
310	P	38.1	Very low	41.5	Very low	125 Å²	125	178.9 Å²	178.9	81%	0.812	81%	0.81	S	S	*	*			trans	-87.8	151.9	-165.2	34.9	-34.9	0	0	0	113.8	R312	P310-R312 PolarHBondContact O-N 2.97Å
311	N	32.9	Very low	41.4	Very low	168 Å²	168	177.3 Å²	177.3	90%	0.898	81%	0.813	S	S	*	*			trans	-59.9	122.9	176.5	-74.7	-40.7	0	0	0	112.8
312	R	43.6	Very low	41.2	Very low	248 Å²	248	175.3 Å²	175.3	94%	0.936	82%	0.817	S	S	*	*			trans	-115.6	104.9	163	-111	-179.7	168.2	174.4	-3.3	110	P310	P310-R312 PolarHBondContact O-N 2.97Å
313	K	39.9	Very low	40.8	Very low	206 Å²	206	179.3 Å²	179.3	90%	0.896	83%	0.831	S	S	*	*			trans	-60.3	126.2	168.8	-69	176.1	175.4	176.8	0	109.8
314	R	44.2	Very low	40.2	Very low	253 Å²	253	178.5 Å²	178.5	96%	0.955	83%	0.833	S	S	*	*			trans	-103.5	112	162.5	-99.7	-179.8	159.3	140.4	-5.1	109
315	K	39.5	Very low	39.7	Very low	192 Å²	192	177.7 Å²	177.7	84%	0.835	84%	0.837	S	S	*	*			trans	-69.6	129.3	166.1	-88.2	176.3	172.2	175.9	0	109	V317	K315-V317 HydrophobicContact CB-CG2 4.32Å; K315-V317 HydrophobicContact CG-CG2 4.41Å
316	L	37.6	Very low	39	Very low	181 Å²	181	176.8 Å²	176.8	95%	0.948	84%	0.839	S	S	*	*			trans	-117.3	114.5	153.8	-158.6	86.4	0	0	0	105.8
317	V	41	Very low	38.6	Very low	105 Å²	105	175.9 Å²	175.9	64%	0.636	84%	0.839	S	S	*	*			trans	-133.8	147.6	-179.5	-172.3	0	0	0	0	107.4	K315	K315-V317 HydrophobicContact CB-CG2 4.32Å; K315-V317 HydrophobicContact CG-CG2 4.41Å
318	K	40.5	Very low	38.4	Very low	178 Å²	178	172 Å²	172	77%	0.774	84%	0.835	S	S	*	*			trans	86.1	126.7	166.9	-55.4	-169.1	179.8	179.1	0	113
319	R	37.1	Very low	38.3	Very low	208 Å²	208	165 Å²	165	79%	0.785	82%	0.824	S	S	*	*			cis	-148.3	147.8	15.7	-85.9	130.9	171.9	-170.1	-2	105.2
320	F	37.4	Very low	38.1	Very low	214 Å²	214	160.2 Å²	160.2	94%	0.939	82%	0.816	S	S	*	*				-161.5	119.9	85.6	-83.1	-83.8	0	0	0	109.5
321	S	37.2	Very low	38.2	Very low	104 Å²	104	162.9 Å²	162.9	73%	0.727	82%	0.818	S	S	*	*			trans	-156.1	119.4	163.6	57.6	0	0	0	0	106.1
322	N	39.7	Very low	38.4	Very low	155 Å²	155	159.6 Å²	159.6	83%	0.829	81%	0.814	S	S	*	*			trans	163.3	93.7	158.6	-78.3	-13.9	0	0	0	106
323	L	37.1	Very low	38.2	Very low	166 Å²	166	152.8 Å²	152.8	87%	0.869	80%	0.804	S	S	*	*				72.8	149.1	105.5	-116.6	78.2	0	0	0	113.8
324	P	37	Very low	38.1	Very low	109 Å²	109	149.3 Å²	149.3	71%	0.708	80%	0.795	S	S	*	*			cis	-133.1	171.3	2.2	34.7	-13.5	0	0	0	115.8
325	N	32.2	Very low	38.1	Very low	159 Å²	159	144.9 Å²	144.9	85%	0.85	79%	0.791	S	S	*	*			trans	-54.8	150.2	171	-72.9	-10	0	0	0	112.6
326	P	39	Very low	38.3	Very low	125 Å²	125	141.7 Å²	141.7	81%	0.812	78%	0.783	S	S	*	*				-137.6	148.1	125.7	31.7	-15.7	0	0	0	113.6
327	T	36.6	Very low	38.8	Very low	124 Å²	124	140.9 Å²	140.9	76%	0.761	78%	0.78	S	S	*	*			trans	-76.4	145.8	176.1	40.4	0	0	0	0	113.1
328	S	35.4	Very low	39.2	Very low	106 Å²	106	143.3 Å²	143.3	74%	0.741	79%	0.789	S	S	*	*			trans	66.3	137.4	148.2	75	0	0	0	0	121.5
329	S	36.5	Very low	39.6	Very low	96 Å²	96	144.4 Å²	144.4	67%	0.671	80%	0.797	S	S	*	*			trans	75	111	154.1	60.4	0	0	0	0	118.9
330	D	38.6	Very low	40.2	Very low	143 Å²	143	136.7 Å²	136.7	77%	0.765	78%	0.782	S	S	*	*			trans	75.2	141	136.4	-57.9	-26.3	0	0	0	120.5
331	E	38.2	Very low	41.1	Very low	181 Å²	181	128.7 Å²	128.7	85%	0.846	76%	0.76	S	S	*	*			trans	90.5	123.5	165	-54.3	-58.5	138	0	0	118.3
332	A	37.6	Very low	42.1	Very low	98 Å²	98	130 Å²	130	81%	0.81	77%	0.766	S	S	*	*			trans	-56	142.8	-177.7	0	0	0	0	0	114.7
333	S	38.9	Very low	42.9	Very low	105 Å²	105	131.4 Å²	131.4	73%	0.734	77%	0.765	S	S	*	*			trans	-153	126.4	140.7	80.5	0	0	0	0	111.1
334	D	38.4	Very low	43.8	Very low	133 Å²	133	126.6 Å²	126.6	71%	0.711	75%	0.746	S	S	*	*			trans	-34.7	133.6	164.1	-83.7	-43.7	0	0	0	113.6
335	N	43.7	Very low	45	Very low	160 Å²	160	126.7 Å²	126.7	86%	0.856	74%	0.735	S	S	*	*			trans	-121.1	93.4	144	-79.4	-71.6	0	0	0	106.9	D337	N335-D337 PolarHBondContact O-N 2.83Å
336	D	45	Very low	46.9	Very low	126 Å²	126	124.7 Å²	124.7	67%	0.674	73%	0.728	S	S	*	*			trans	-59.8	120	163.6	-72.7	-60.7	0	0	0	110.4
337	D	48.4	Very low	48.4	Very low	164 Å²	164	127.2 Å²	127.2	88%	0.877	72%	0.722	S	S	*	*			trans	-148.1	48.2	147.5	-111.9	-19.2	0	0	0	109	N335	N335-D337 PolarHBondContact O-N 2.83Å
338	D	48.7	Very low	50	Low	156 Å²	156	125 Å²	125	83%	0.834	71%	0.708	S	S	*	*			trans	-104.3	95	170.1	-88.7	-34.5	0	0	0	110.1
339	Q	49.6	Very low	51.4	Low	201 Å²	201	126.1 Å²	126.1	94%	0.939	71%	0.713	S	S	*	*			trans	-121.9	26.1	164	-76.2	-169.5	49.4	0	0	112.9
340	G	48.6	Very low	53.1	Low	46 Å²	46	125.9 Å²	125.9	47%	0.474	73%	0.725	S	S	.	*			trans	-92	98.8	170.4	0	0	0	0	0	111.1	S344	G340-S344 WeakPolarHBondContact CA-OG 3.39Å; G340-S344 PolarHBondContact O-OG 3.45Å
341	G	56.2	Low	54	Low	46 Å²	46	122.6 Å²	122.6	47%	0.474	71%	0.713	S	S	.	*			trans	-51.9	168.1	170.9	0	0	0	0	0	112.5	F343 S344	G341-F343 PolarHBondContact O-N 3.18Å; G341-S344 VanDerWaalsContact O-CB 3.29Å; G341-S344 WeakPolarHBondContact O-CB 3.47Å; G341-S344 PolarHBondContact O-N 3.36Å; G341-S344 PolarHBondContact O-OG 3.32Å; G341-S344 VanDerWaalsContact O-OG 3.11Å
342	P	58.6	Low	55.1	Low	132 Å²	132	121.4 Å²	121.4	86%	0.857	70%	0.701	S	S	*	*	T	Hydrogen-bonded Turn	trans	-59.1	-5	-173.2	21	-32.3	0	0	0	115.4
343	F	56.4	Low	56.3	Low	183 Å²	183	120.9 Å²	120.9	80%	0.803	68%	0.678	S	S	*	*	T	Hydrogen-bonded Turn	trans	-112.9	14.9	174.8	-54.3	-71.7	0	0	0	113.8	G341	G341-F343 PolarHBondContact O-N 3.18Å
344	S	56.8	Low	56.9	Low	66 Å²	66	119.2 Å²	119.2	46%	0.462	66%	0.661	S	S	.	*			trans	-68.1	133	177.1	65.2	0	0	0	0	110.3	G340 G341 V346	G340-S344 WeakPolarHBondContact CA-OG 3.39Å; G340-S344 PolarHBondContact O-OG 3.45Å; G341-S344 VanDerWaalsContact O-CB 3.29Å; G341-S344 WeakPolarHBondContact O-CB 3.47Å; G341-S344 PolarHBondContact O-N 3.36Å; G341-S344 PolarHBondContact O-OG 3.32Å; G341-S344 VanDerWaalsContact O-OG 3.11Å; S344-V346 PolarHBondContact O-N 3.44Å
345	F	60.7	Low	57.7	Low	110 Å²	110	121.8 Å²	121.8	48%	0.482	67%	0.665	S	S	.	*			trans	-82.2	108.8	-173.1	168.4	-103.1	0	0	0	110.2	R347 Y353	F345-R347 HydrophobicContact CD1-CG 4.35Å; F345-R347 HydrophobicContact CE1-CG 3.53Å; F345-R347 HydrophobicContact CZ-CG 4.04Å; F345-Y353 HydrophobicContact CE2-CD1 4.49Å; F345-Y353 AromaticContact CE2-CE1 3.83Å; F345-Y353 HydrophobicContact CE2-CE1 3.83Å; F345-Y353 AromaticContact CE2-CZ 3.93Å; F345-Y353 AromaticContact CZ-CD1 3.89Å; F345-Y353 HydrophobicContact CZ-CD1 3.89Å; F345-Y353 HydrophobicContact CZ-CD2 4.17Å; F345-Y353 AromaticContact CZ-CE1 3.52Å; F345-Y353 HydrophobicContact CZ-CE1 3.52Å; F345-Y353 AromaticContact CZ-CE2 3.83Å; F345-Y353 HydrophobicContact CZ-CE2 3.83Å; F345-Y353 HydrophobicContact CZ-CG 4.19Å; F345-Y353 AromaticContact CZ-CZ 3.47Å; F345-Y353 VanDerWaalsContact CZ-CZ 3.47Å
346	V	72.1	Confident	57.7	Low	118 Å²	118	118.2 Å²	118.2	72%	0.715	65%	0.651	S	S	*	*	P	Polyproline II helix	trans	-90.3	124.7	170	-174.6	0	0	0	0	109	S344 T348	S344-V346 PolarHBondContact O-N 3.44Å; V346-T348 PolarHBondContact O-N 3.44Å
347	R	71.8	Confident	57.8	Low	178 Å²	178	117.8 Å²	117.8	67%	0.672	64%	0.64	S	S	*	*	P	Polyproline II helix	trans	-69.5	123.7	175.2	-71.5	178.6	178.3	-128.1	1.1	109.2	F345 P349 Y353	F345-R347 HydrophobicContact CD1-CG 4.35Å; F345-R347 HydrophobicContact CE1-CG 3.53Å; F345-R347 HydrophobicContact CZ-CG 4.04Å; R347-P349 WeakPolarHBondContact O-CD 3.29Å; R347-Y353 HydrophobicContact CB-CE2 3.98Å; R347-Y353 HydrophobicContact CG-CD2 4.27Å; R347-Y353 HydrophobicContact CG-CE2 3.97Å
348	T	70.1	Confident	57.5	Low	78 Å²	78	114.1 Å²	114.1	48%	0.479	63%	0.627	S	S	.	*	P	Polyproline II helix	trans	-68.2	126.2	175.5	-13.6	0	0	0	0	109.7	V346 G350 C351 Y353	V346-T348 PolarHBondContact O-N 3.44Å; T348-G350 PolarHBondContact O-N 3.42Å; T348-C351 PolarHBondContact O-N 3.1Å; T348-Y353 PolarHBondContact N-OH 3.41Å; T348-Y353 VanDerWaalsContact N-OH 3.15Å; T348-Y353 PolarHBondContact OG1-OH 3Å
349	P	64	Low	57.1	Low	129 Å²	129	114.4 Å²	114.4	84%	0.838	63%	0.628	S	S	*	*	T	Hydrogen-bonded Turn	trans	-54.1	130	172.6	-22.2	31.7	0	0	0	110	R347	R347-P349 WeakPolarHBondContact O-CD 3.29Å
350	G	73	Confident	56.5	Low	90 Å²	90	112.7 Å²	112.7	93%	0.928	62%	0.624	S	S	*	*	T	Hydrogen-bonded Turn	trans	90.4	-9	-176.8	0	0	0	0	0	116	T348	T348-G350 PolarHBondContact O-N 3.42Å
351	C	58.1	Low	55.8	Low	74 Å²	74	118.1 Å²	118.1	50%	0.5	64%	0.637	S	S	.	*			trans	-94.5	133.8	175.9	-71.3	0	0	0	0	112.9	T348 Y353	T348-C351 PolarHBondContact O-N 3.1Å; C351-Y353 HydrophobicContact CB-CE2 3.94Å
352	R	61	Low	54.7	Low	157 Å²	157	123.6 Å²	123.6	59%	0.592	65%	0.651	S	S	*	*			trans	-106.9	100.4	179.7	-154	175.7	-172.7	176.9	1.2	111
353	Y	61.4	Low	53.3	Low	86 Å²	86	123.1 Å²	123.1	34%	0.337	65%	0.649	S	S	.	*			trans	-81	134.9	179.2	-55.7	-87.5	0	0	0	111.6	F345 R347 T348 C351	F345-Y353 HydrophobicContact CE2-CD1 4.49Å; F345-Y353 AromaticContact CE2-CE1 3.83Å; F345-Y353 HydrophobicContact CE2-CE1 3.83Å; F345-Y353 AromaticContact CE2-CZ 3.93Å; F345-Y353 AromaticContact CZ-CD1 3.89Å; F345-Y353 HydrophobicContact CZ-CD1 3.89Å; F345-Y353 HydrophobicContact CZ-CD2 4.17Å; F345-Y353 AromaticContact CZ-CE1 3.52Å; F345-Y353 HydrophobicContact CZ-CE1 3.52Å; F345-Y353 AromaticContact CZ-CE2 3.83Å; F345-Y353 HydrophobicContact CZ-CE2 3.83Å; F345-Y353 HydrophobicContact CZ-CG 4.19Å; F345-Y353 AromaticContact CZ-CZ 3.47Å; F345-Y353 VanDerWaalsContact CZ-CZ 3.47Å; R347-Y353 HydrophobicContact CB-CE2 3.98Å; R347-Y353 HydrophobicContact CG-CD2 4.27Å; R347-Y353 HydrophobicContact CG-CE2 3.97Å; T348-Y353 PolarHBondContact N-OH 3.41Å; T348-Y353 VanDerWaalsContact N-OH 3.15Å; T348-Y353 PolarHBondContact OG1-OH 3Å; C351-Y353 HydrophobicContact CB-CE2 3.94Å
354	L	53.3	Low	52	Low	71 Å²	71	119.5 Å²	119.5	37%	0.372	65%	0.646	S	S	.	*			trans	-122	132	-173.4	-59	169.6	0	0	0	111.9	R402	L354-R402 PolarHBondContact O-NH1 3.23Å
355	K	54.2	Low	50.7	Low	186 Å²	186	121.8 Å²	121.8	81%	0.809	66%	0.658	S	S	*	*	P	Polyproline II helix	trans	-63.2	139.9	179.4	-170.3	-178.3	175.5	-178.6	0	111.9
356	P	44.4	Very low	49.2	Very low	86 Å²	86	123.7 Å²	123.7	56%	0.558	67%	0.672	S	S	*	*	P	Polyproline II helix	trans	-62	142.1	168.9	-16.2	28.6	0	0	0	111.9
357	R	46.9	Very low	47.2	Very low	117 Å²	117	125.9 Å²	125.9	44%	0.442	68%	0.679	S	S	.	*	P	Polyproline II helix	trans	-89.7	134.4	167.4	-84.8	-170.8	158.8	-154.6	-15.6	109.6	E362	R357-E362 IonicContact CZ-OE1 3.53Å; R357-E362 IonicContact NH1-OE1 2.65Å; R357-E362 PolarHBondContact NH1-OE1 3.28Å; R357-E362 IonicContact NH2-OE1 3.88Å
358	S	41.9	Very low	45.2	Very low	87 Å²	87	122.9 Å²	122.9	61%	0.608	69%	0.685	S	S	*	*	P	Polyproline II helix	trans	-67.2	125.5	169.1	33.1	0	0	0	0	108.9	L360	S358-L360 PolarHBondContact O-N 2.84Å
359	L	40.6	Very low	43.5	Very low	161 Å²	161	124.1 Å²	124.1	84%	0.843	69%	0.694	S	S	*	*	T	Hydrogen-bonded Turn	trans	-75.1	21	-173.6	-160.2	104.9	0	0	0	113.7
360	L	35.7	Very low	42	Very low	165 Å²	165	126.8 Å²	126.8	86%	0.864	70%	0.696	S	S	*	*	T	Hydrogen-bonded Turn	trans	-130.7	8.2	-165.2	-151.6	69.1	0	0	0	116.2	S358	S358-L360 PolarHBondContact O-N 2.84Å
361	E	33.9	Very low	40	Very low	161 Å²	161	127.7 Å²	127.7	75%	0.752	69%	0.685	S	S	*	*			trans	-117.3	-1.7	-173.7	-85.2	177.1	153.4	0	0	116.5	C363	E361-C363 PolarHBondContact O-N 2.96Å
362	E	34.8	Very low	38.8	Very low	161 Å²	161	129.9 Å²	129.9	75%	0.752	70%	0.701	S	S	*	*			trans	-99.6	56.1	-176.9	-70.4	180	174.4	0	0	111.6	R357	R357-E362 IonicContact CZ-OE1 3.53Å; R357-E362 IonicContact NH1-OE1 2.65Å; R357-E362 PolarHBondContact NH1-OE1 3.28Å; R357-E362 IonicContact NH2-OE1 3.88Å
363	C	28.2	Very low	37.5	Very low	122 Å²	122	131.5 Å²	131.5	82%	0.824	71%	0.707	S	S	*	*	S	Bend	trans	-150.2	62.4	168.3	-148.8	0	0	0	0	110	E361	E361-C363 PolarHBondContact O-N 2.96Å
364	S	29	Very low	36.2	Very low	106 Å²	106	130 Å²	130	74%	0.741	71%	0.709	S	S	*	*	S	Bend	trans	-174.5	113	158.9	-84	0	0	0	0	110.3
365	T	30.1	Very low	35.5	Very low	114 Å²	114	131.7 Å²	131.7	70%	0.699	72%	0.724	S	S	*	*			trans	47.1	116.6	138.3	53.9	0	0	0	0	120
366	L	29.4	Very low	35.3	Very low	150 Å²	150	129.8 Å²	129.8	79%	0.785	71%	0.713	S	S	*	*				69	127.7	127.2	-61.9	171.3	0	0	0	119.5
367	L	29.7	Very low	35.5	Very low	165 Å²	165	128.2 Å²	128.2	86%	0.864	70%	0.704	S	S	*	*			trans	62.5	98.5	148.5	-72.4	148.6	0	0	0	117.5
368	S	29.6	Very low	35.6	Very low	114 Å²	114	126.9 Å²	126.9	80%	0.797	71%	0.712	S	S	*	*				-167.3	136.5	128.8	-166.4	0	0	0	0	113.2
369	P	33.8	Very low	36.2	Very low	104 Å²	104	125.6 Å²	125.6	68%	0.675	69%	0.694	S	S	*	*			trans	-98.6	128.5	-173.3	35.4	-26	0	0	0	111.5
370	H	33.1	Very low	36.6	Very low	186 Å²	186	122.6 Å²	122.6	86%	0.861	68%	0.682	S	S	*	*			trans	-153.7	141.6	152.6	-92	-25.4	0	0	0	114.6
371	P	31.1	Very low	37.5	Very low	108 Å²	108	117 Å²	117	70%	0.701	65%	0.653	S	S	*	*			trans	-82.9	158.1	-169.8	35.7	-33.6	0	0	0	111.3
372	S	32	Very low	38.5	Very low	120 Å²	120	110.1 Å²	110.1	84%	0.839	62%	0.624	S	S	*	*			trans	93.9	87.4	179.8	79.7	0	0	0	0	115.8
373	R	33.6	Very low	39.2	Very low	191 Å²	191	105 Å²	105	72%	0.721	60%	0.603	S	S	*	*			trans	-130	121.3	155.3	-92.9	-171	175.5	-172.4	2	112.1
374	S	35.1	Very low	40.1	Very low	54 Å²	54	101.8 Å²	101.8	38%	0.378	58%	0.578	S	S	.	*			trans	-68.4	152.9	176.2	59.3	0	0	0	0	112.6	Y376	S374-Y376 PolarHBondContact O-N 2.66Å
375	P	39.4	Very low	40.9	Very low	107 Å²	107	101.3 Å²	101.3	70%	0.695	57%	0.572	S	S	*	*	S	Bend	trans	-65.7	16	-168.8	25.3	-35.8	0	0	0	117.8
376	Y	48.5	Very low	41.7	Very low	147 Å²	147	104.8 Å²	104.8	58%	0.576	57%	0.572	S	S	*	*			trans	-112.1	21.8	-172.4	-57	-82.6	0	0	0	114	S374	S374-Y376 PolarHBondContact O-N 2.66Å
377	S	49.1	Very low	42.3	Very low	52 Å²	52	99.8 Å²	99.8	36%	0.364	55%	0.546	S	S	.	.			trans	-110.6	13	179.1	60.5	0	0	0	0	114.8
378	C	49.3	Very low	42.8	Very low	89 Å²	89	94.1 Å²	94.1	60%	0.601	52%	0.52	S	S	*	.			trans	-85.4	119.5	-175	-52.7	0	0	0	0	111.1
379	Y	54	Low	43.4	Very low	61 Å²	61	92.9 Å²	92.9	24%	0.239	50%	0.501	C	S	.	.			trans	-63.2	137.4	158.6	-70.3	-91.7	0	0	0	107.7	R400 D412 A414	Y379-R400 HydrophobicContact CD1-CB 3.54Å; Y379-R400 HydrophobicContact CE1-CB 3.63Å; Y379-R400 HydrophobicContact CG-CB 4.16Å; Y379-D412 HydrophobicContact CE1-CB 3.89Å; Y379-A414 HydrophobicContact CD1-CB 3.87Å; Y379-A414 HydrophobicContact CD2-CB 4.35Å; Y379-A414 HydrophobicContact CE1-CB 3.87Å; Y379-A414 HydrophobicContact CE2-CB 4.32Å; Y379-A414 HydrophobicContact CG-CB 4.14Å
380	T	50.1	Low	43.9	Very low	97 Å²	97	90.9 Å²	90.9	60%	0.595	49%	0.487	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-112.9	143.2	174.4	9	0	0	0	0	108.1	A382 I399	T380-A382 PolarHBondContact O-N 2.77Å; T380-I399 PolarHBondContact N-O 3.49Å; T380-I399 PolarHBondContact O-N 2.9Å
381	L	54.2	Low	44.5	Very low	47 Å²	47	90.9 Å²	90.9	25%	0.246	49%	0.485	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-60.1	111.8	168	-121	158.6	0	0	0	107.3	V288 T383 Y395 Y398	V288-L381 HydrophobicContact CB-CD1 4.26Å; V288-L381 HydrophobicContact CG1-CD1 3.35Å; L381-T383 VanDerWaalsContact C-N 3.33Å; L381-T383 PolarHBondContact O-N 3.14Å; L381-Y395 HydrophobicContact CB-CD1 3.75Å; L381-Y395 HydrophobicContact CB-CE1 3.99Å; L381-Y395 HydrophobicContact CD1-CD1 4.18Å; L381-Y395 HydrophobicContact CD1-CE1 4.38Å; L381-Y395 HydrophobicContact CD2-CD1 3.18Å; L381-Y395 HydrophobicContact CD2-CE1 4.11Å; L381-Y395 HydrophobicContact CD2-CG 3.47Å; L381-Y395 VanDerWaalsContact CD2-CG 3.47Å; L381-Y395 HydrophobicContact CG-CD1 3.88Å; L381-Y395 HydrophobicContact CG-CE1 4.39Å; L381-Y398 HydrophobicContact CD1-CE1 4.32Å; L381-Y398 HydrophobicContact CG-CE1 4.3Å
382	A	54.3	Low	45	Very low	18 Å²	18	90.3 Å²	90.3	15%	0.149	47%	0.473	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-71.4	98	-179	0	0	0	0	0	108.1	T380 I384 Y395 T396 G397 I399	T380-A382 PolarHBondContact O-N 2.77Å; A382-I384 PolarHBondContact O-N 2.83Å; A382-Y395 CarbonylContact O-C 3.54Å; A382-T396 PolarHBondContact O-N 3.38Å; A382-T396 PolarHBondContact O-OG1 3.37Å; A382-T396 VanDerWaalsContact O-OG1 3.07Å; A382-G397 PolarHBondContact N-O 2.97Å; A382-I399 HydrophobicContact CB-CB 3.9Å; A382-I399 HydrophobicContact CB-CD1 3.49Å; A382-I399 VanDerWaalsContact CB-CD1 3.49Å; A382-I399 HydrophobicContact CB-CG1 3.68Å
383	T	50.1	Low	45.8	Very low	52 Å²	52	88.5 Å²	88.5	32%	0.319	45%	0.453	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-72.3	123.3	167.5	38.9	0	0	0	0	108.4	L381 P385 L393 T394 Y395	L381-T383 VanDerWaalsContact C-N 3.33Å; L381-T383 PolarHBondContact O-N 3.14Å; T383-P385 WeakPolarHBondContact O-CD 3.46Å; T383-L393 HydrophobicContact CG2-CB 3.49Å; T383-L393 VanDerWaalsContact CG2-CB 3.49Å; T383-L393 HydrophobicContact CG2-CD1 4.15Å; T383-L393 HydrophobicContact CG2-CD2 4.31Å; T383-L393 HydrophobicContact CG2-CG 4.18Å; T383-T394 CarbonylContact C-O 3.59Å; T383-T394 VanDerWaalsContact CA-O 3.31Å; T383-T394 WeakPolarHBondContact CA-O 3.25Å; T383-Y395 HydrophobicContact CG2-CD1 3.31Å; T383-Y395 HydrophobicContact CG2-CE1 3.07Å; T383-Y395 HydrophobicContact CG2-CG 4.29Å
384	I	47.7	Very low	46.4	Very low	56 Å²	56	81.2 Å²	81.2	29%	0.287	43%	0.43	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-81.2	120.6	158.3	-52.2	178.3	0	0	0	106.5	A382 R386 L387 T394 T396	A382-I384 PolarHBondContact O-N 2.83Å; I384-R386 PolarHBondContact O-N 2.86Å; I384-R386 VanDerWaalsContact O-N 3.07Å; I384-L387 HydrophobicContact CB-CD1 3.8Å; I384-L387 HydrophobicContact CB-CG 4.37Å; I384-L387 HydrophobicContact CD1-CD1 3.65Å; I384-L387 HydrophobicContact CG1-CD1 4.32Å; I384-L387 HydrophobicContact CG2-CD1 3.29Å; I384-L387 HydrophobicContact CG2-CG 3.63Å; I384-T394 PolarHBondContact N-O 2.55Å; I384-T394 PolarHBondContact O-N 3.1Å; I384-T396 HydrophobicContact CD1-CG2 3.29Å; I384-T396 HydrophobicContact CG1-CG2 3.75Å
385	P	43.9	Very low	47.3	Very low	96 Å²	96	82.9 Å²	82.9	62%	0.623	43%	0.429	S	S	*	.	T	Hydrogen-bonded Turn	trans	-61.2	116.8	176.2	-18.6	30.9	0	0	0	110.1	T383 L387	T383-P385 WeakPolarHBondContact O-CD 3.46Å; P385-L387 PolarHBondContact O-N 3.33Å
386	R	46.8	Very low	47.9	Very low	186 Å²	186	80.9 Å²	80.9	70%	0.702	42%	0.415	S	S	*	.	T	Hydrogen-bonded Turn	trans	57.2	44.3	158	-55.3	-177.7	177.2	-179.3	-0.9	116.7	I384	I384-R386 PolarHBondContact O-N 2.86Å; I384-R386 VanDerWaalsContact O-N 3.07Å
387	L	42	Very low	48.4	Very low	45 Å²	45	75.9 Å²	75.9	24%	0.236	41%	0.407	C	S	.	.	S	Bend	trans	-75.9	-37.3	172.8	-81	173.6	0	0	0	113.1	I259 I384 P385	I259-L387 HydrophobicContact CD1-CD1 4.33Å; I259-L387 HydrophobicContact CD1-CD2 4.47Å; I259-L387 HydrophobicContact CG1-CD1 4.35Å; I259-L387 HydrophobicContact CG2-CD1 3.77Å; I259-L387 HydrophobicContact CG2-CD2 3.53Å; I259-L387 HydrophobicContact CG2-CG 4.2Å; I384-L387 HydrophobicContact CB-CD1 3.8Å; I384-L387 HydrophobicContact CB-CG 4.37Å; I384-L387 HydrophobicContact CD1-CD1 3.65Å; I384-L387 HydrophobicContact CG1-CD1 4.32Å; I384-L387 HydrophobicContact CG2-CD1 3.29Å; I384-L387 HydrophobicContact CG2-CG 3.63Å; P385-L387 PolarHBondContact O-N 3.33Å
388	C	40.7	Very low	48.9	Very low	47 Å²	47	74.5 Å²	74.5	32%	0.318	39%	0.394	S	S	.	.	S	Bend	trans	-129	-17	-167	-26.4	0	0	0	0	113.8	D263 T394	D263-C388 PolarHBondContact OD1-SG 3.38Å; C388-T394 HydrophobicContact CB-CG2 4.15Å; C388-T394 VanDerWaalsContact SG-CG2 3.51Å
389	H	41.9	Very low	49.6	Very low	87 Å²	87	71.2 Å²	71.2	40%	0.403	37%	0.37	S	S	.	.			trans	-138.7	131.9	-180	-117.6	-93.9	0	0	0	109.7	K391 H392	H389-K391 PolarHBondContact O-N 3.02Å; H389-H392 HydrophobicContact CB-CB 3.78Å; H389-H392 VanDerWaalsContact O-O 3.1Å
390	T	44.8	Very low	49.8	Very low	62 Å²	62	69.9 Å²	69.9	38%	0.38	37%	0.365	S	S	.	.	S	Bend	trans	-72.7	-11.3	175.7	46.2	0	0	0	0	114.4	R461	T390-R461 PolarHBondContact OG1-NH1 3.25Å; T390-R461 PolarHBondContact OG1-NH2 3Å
391	K	45.3	Very low	50.4	Low	186 Å²	186	74.1 Å²	74.1	81%	0.809	37%	0.37	S	S	*	.	S	Bend	trans	-115.9	-15.8	-179.3	-63.1	-172.7	178.4	-176.2	0	113.7	H389	H389-K391 PolarHBondContact O-N 3.02Å
392	H	42.8	Very low	50.8	Low	96 Å²	96	73.5 Å²	73.5	44%	0.444	37%	0.365	S	S	.	.	S	Bend	trans	-123.8	137.1	-176.4	-76	-92.9	0	0	0	111.3	H389	H389-H392 HydrophobicContact CB-CB 3.78Å; H389-H392 VanDerWaalsContact O-O 3.1Å
393	L	48.1	Very low	51	Low	82 Å²	82	78.9 Å²	78.9	43%	0.429	39%	0.39	S	S	.	.			trans	-82.3	128.8	177.2	-66	148.3	0	0	0	107.9	T383 Y395	T383-L393 HydrophobicContact CG2-CB 3.49Å; T383-L393 VanDerWaalsContact CG2-CB 3.49Å; T383-L393 HydrophobicContact CG2-CD1 4.15Å; T383-L393 HydrophobicContact CG2-CD2 4.31Å; T383-L393 HydrophobicContact CG2-CG 4.18Å; L393-Y395 WeakPolarHBondContact O-CD2 3.29Å; L393-Y395 WeakPolarHBondContact O-CE2 3.22Å
394	T	46.1	Very low	51.6	Low	38 Å²	38	77.8 Å²	77.8	23%	0.233	39%	0.389	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-86.2	139.6	173.4	29.6	0	0	0	0	110.6	T383 I384 C388	T383-T394 CarbonylContact C-O 3.59Å; T383-T394 VanDerWaalsContact CA-O 3.31Å; T383-T394 WeakPolarHBondContact CA-O 3.25Å; I384-T394 PolarHBondContact N-O 2.55Å; I384-T394 PolarHBondContact O-N 3.1Å; C388-T394 HydrophobicContact CB-CG2 4.15Å; C388-T394 VanDerWaalsContact SG-CG2 3.51Å
395	Y	54.5	Low	51.9	Low	90 Å²	90	85 Å²	85	35%	0.353	41%	0.412	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-106.6	130.5	-168.7	-72.7	-71.8	0	0	0	111.9	E285 L381 A382 T383 L393	E285-Y395 VanDerWaalsContact CD-CE2 3.46Å; E285-Y395 HydrophobicContact CG-CD2 3.93Å; E285-Y395 HydrophobicContact CG-CE2 3.72Å; E285-Y395 WeakPolarHBondContact OE1-CD2 3.41Å; E285-Y395 WeakPolarHBondContact OE1-CE2 3.45Å; L381-Y395 HydrophobicContact CB-CD1 3.75Å; L381-Y395 HydrophobicContact CB-CE1 3.99Å; L381-Y395 HydrophobicContact CD1-CD1 4.18Å; L381-Y395 HydrophobicContact CD1-CE1 4.38Å; L381-Y395 HydrophobicContact CD2-CD1 3.18Å; L381-Y395 HydrophobicContact CD2-CE1 4.11Å; L381-Y395 HydrophobicContact CD2-CG 3.47Å; L381-Y395 VanDerWaalsContact CD2-CG 3.47Å; L381-Y395 HydrophobicContact CG-CD1 3.88Å; L381-Y395 HydrophobicContact CG-CE1 4.39Å; A382-Y395 CarbonylContact O-C 3.54Å; T383-Y395 HydrophobicContact CG2-CD1 3.31Å; T383-Y395 HydrophobicContact CG2-CE1 3.07Å; T383-Y395 HydrophobicContact CG2-CG 4.29Å; L393-Y395 WeakPolarHBondContact O-CD2 3.29Å; L393-Y395 WeakPolarHBondContact O-CE2 3.22Å
396	T	51.1	Low	52.8	Low	65 Å²	65	84.2 Å²	84.2	40%	0.399	42%	0.422	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-120.8	68.9	-179.2	54.4	0	0	0	0	111.4	A382 I384 I399	A382-T396 PolarHBondContact O-N 3.38Å; A382-T396 PolarHBondContact O-OG1 3.37Å; A382-T396 VanDerWaalsContact O-OG1 3.07Å; I384-T396 HydrophobicContact CD1-CG2 3.29Å; I384-T396 HydrophobicContact CG1-CG2 3.75Å; T396-I399 WeakPolarHBondContact O-CD1 3.44Å
397	G	59.6	Low	53.6	Low	41 Å²	41	78 Å²	78	42%	0.423	42%	0.416	S	S	.	.	E	Extended strand (participates in β ladder)	trans	65	177.2	174.4	0	0	0	0	0	115.1	A382 I399	A382-G397 PolarHBondContact N-O 2.97Å; G397-I399 PolarHBondContact O-N 3.21Å
398	Y	60.4	Low	54.3	Low	24 Å²	24	85.1 Å²	85.1	9%	0.094	44%	0.44	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-83.4	113.7	178.3	-67.3	-87.1	0	0	0	109.3	V288 L381 R413 A414 A416 P417 L420	V288-Y398 HydrophobicContact CG1-CE1 4.37Å; V288-Y398 WeakPolarHBondContact CG1-OH 3.22Å; V288-Y398 WeakPolarHBondContact CG2-OH 3.39Å; L381-Y398 HydrophobicContact CD1-CE1 4.32Å; L381-Y398 HydrophobicContact CG-CE1 4.3Å; Y398-R413 WeakPolarHBondContact O-CA 3.49Å; Y398-A414 PolarHBondContact O-N 3.48Å; Y398-A416 HydrophobicContact CE2-CB 4.43Å; Y398-P417 HydrophobicContact CE2-CG 4.19Å; Y398-P417 VanDerWaalsContact OH-CD 3.3Å; Y398-P417 WeakPolarHBondContact OH-CD 3.45Å; Y398-P417 WeakPolarHBondContact OH-CG 3.49Å; Y398-L420 HydrophobicContact CE2-CD2 4.23Å
399	I	62.9	Low	55.3	Low	19 Å²	19	88.3 Å²	88.3	10%	0.097	45%	0.452	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-124.4	138.5	-177.8	-53.6	-172.5	0	0	0	110.6	T380 A382 T396 G397 C411 D412 R413	T380-I399 PolarHBondContact N-O 3.49Å; T380-I399 PolarHBondContact O-N 2.9Å; A382-I399 HydrophobicContact CB-CB 3.9Å; A382-I399 HydrophobicContact CB-CD1 3.49Å; A382-I399 VanDerWaalsContact CB-CD1 3.49Å; A382-I399 HydrophobicContact CB-CG1 3.68Å; T396-I399 WeakPolarHBondContact O-CD1 3.44Å; G397-I399 PolarHBondContact O-N 3.21Å; I399-C411 HydrophobicContact CG2-CB 3.5Å; I399-C411 VanDerWaalsContact CG2-CB 3.5Å; I399-D412 CarbonylContact C-O 3.53Å; I399-D412 VanDerWaalsContact CA-O 3.24Å; I399-D412 WeakPolarHBondContact CA-O 3.32Å; I399-R413 HydrophobicContact CG1-CG 4.44Å
400	R	59.1	Low	56.2	Low	34 Å²	34	86.8 Å²	86.8	13%	0.128	45%	0.449	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-112.5	121	164.1	175.8	-176.8	177.5	-137.1	13.9	109.1	Y379 R402 C411 D412	Y379-R400 HydrophobicContact CD1-CB 3.54Å; Y379-R400 HydrophobicContact CE1-CB 3.63Å; Y379-R400 HydrophobicContact CG-CB 4.16Å; R400-R402 HydrophobicContact CG-CG 4.48Å; R400-C411 WeakPolarHBondContact O-CA 3.28Å; R400-D412 HydrophobicContact CB-CB 4.25Å; R400-D412 PolarHBondContact N-O 2.93Å; R400-D412 IonicContact NH1-OD2 2.66Å; R400-D412 PolarHBondContact NH1-OD2 3.14Å; R400-D412 PolarHBondContact O-N 3.48Å
401	R	62.4	Low	57.3	Low	186 Å²	186	86.9 Å²	86.9	70%	0.702	45%	0.452	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-83	134.5	174.9	-68.5	-178.5	174.1	-179.6	-0.3	110.5	I409 V410	R401-I409 HydrophobicContact CB-CG2 4.31Å; R401-I409 HydrophobicContact CG-CG2 4.3Å; R401-V410 CarbonylContact C-O 3.51Å; R401-V410 WeakPolarHBondContact CA-O 3.43Å
402	R	62.8	Low	58	Low	34 Å²	34	79.2 Å²	79.2	13%	0.128	42%	0.419	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-131.3	149.5	172.3	-63.7	-169.1	-75.3	136.4	3.4	109.8	L354 R400 I409 V410 D412	L354-R402 PolarHBondContact O-NH1 3.23Å; R400-R402 HydrophobicContact CG-CG 4.48Å; R402-I409 CarbonylContact O-C 3.49Å; R402-I409 WeakPolarHBondContact O-CA 3.22Å; R402-V410 HydrophobicContact CB-CB 4.41Å; R402-V410 PolarHBondContact N-O 3.28Å; R402-V410 PolarHBondContact O-N 2.81Å; R402-D412 IonicContact CZ-OD1 3.48Å; R402-D412 IonicContact CZ-OD2 2.89Å; R402-D412 IonicContact NE-OD1 2.74Å; R402-D412 PolarHBondContact NE-OD1 2.79Å; R402-D412 IonicContact NE-OD2 2.96Å; R402-D412 PolarHBondContact NE-OD2 3.23Å; R402-D412 IonicContact NH2-OD1 3.52Å; R402-D412 PolarHBondContact NH2-OD1 3.29Å; R402-D412 IonicContact NH2-OD2 3.67Å
403	L	58.3	Low	58.9	Low	131 Å²	131	83.9 Å²	83.9	69%	0.686	43%	0.433	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-87.1	114.7	166.9	-81.5	158.9	0	0	0	108.7	I409	L403-I409 HydrophobicContact CD2-CG1 4.4Å
404	G	62.5	Low	59.4	Low	28 Å²	28	81.8 Å²	81.8	29%	0.289	43%	0.427	S	S	.	.			trans	-85.7	175.1	173.9	0	0	0	0	0	112.8	G406 G407 R408	G404-G406 PolarHBondContact O-N 3.44Å; G404-G407 PolarHBondContact O-N 3.01Å; G404-R408 WeakPolarHBondContact CA-O 3.32Å; G404-R408 PolarHBondContact N-O 3.44Å
405	R	54.8	Low	59.9	Low	208 Å²	208	84.4 Å²	84.4	79%	0.785	45%	0.453	S	S	*	.	G	3₁₀ helix	trans	-56.4	133.9	176.4	-145.9	176.4	-179.6	-171.1	-1.3	109.7
406	G	61.2	Low	60.2	Low	79 Å²	79	82.1 Å²	82.1	81%	0.814	45%	0.452	S	S	*	.	G	3₁₀ helix	trans	77.2	22	-177.9	0	0	0	0	0	115.8	G404 R408	G404-G406 PolarHBondContact O-N 3.44Å; G406-R408 VanDerWaalsContact C-N 3.26Å; G406-R408 PolarHBondContact O-N 3.39Å
407	G	65.1	Low	60.8	Low	57 Å²	57	80.9 Å²	80.9	59%	0.588	45%	0.446	S	S	*	.	G	3₁₀ helix	trans	76.8	6.1	176.1	0	0	0	0	0	115.1	G404	G404-G407 PolarHBondContact O-N 3.01Å
408	R	56.9	Low	61.2	Low	194 Å²	194	84.2 Å²	84.2	73%	0.732	46%	0.458	S	S	*	.	P	Polyproline II helix	trans	-68.7	133.8	178.7	-63.9	179.1	179.9	173.7	0.3	110.4	G404 G406	G404-R408 WeakPolarHBondContact CA-O 3.32Å; G404-R408 PolarHBondContact N-O 3.44Å; G406-R408 VanDerWaalsContact C-N 3.26Å; G406-R408 PolarHBondContact O-N 3.39Å
409	I	61.7	Low	61.5	Low	113 Å²	113	85.7 Å²	85.7	58%	0.579	47%	0.47	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-83.3	116.5	171.6	-57.9	173.5	0	0	0	108.2	R401 R402 L403	R401-I409 HydrophobicContact CB-CG2 4.31Å; R401-I409 HydrophobicContact CG-CG2 4.3Å; R402-I409 CarbonylContact O-C 3.49Å; R402-I409 WeakPolarHBondContact O-CA 3.22Å; L403-I409 HydrophobicContact CD2-CG1 4.4Å
410	V	60.4	Low	61.4	Low	56 Å²	56	85.8 Å²	85.8	34%	0.339	47%	0.471	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-97.9	130.4	176.4	-177.9	0	0	0	0	108.9	R401 R402	R401-V410 CarbonylContact C-O 3.51Å; R401-V410 WeakPolarHBondContact CA-O 3.43Å; R402-V410 HydrophobicContact CB-CB 4.41Å; R402-V410 PolarHBondContact N-O 3.28Å; R402-V410 PolarHBondContact O-N 2.81Å
411	C	66.5	Low	61.6	Low	64 Å²	64	86 Å²	86	43%	0.432	48%	0.478	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-110.7	109.6	179.2	-71.1	0	0	0	0	109.7	I399 R400	I399-C411 HydrophobicContact CG2-CB 3.5Å; I399-C411 VanDerWaalsContact CG2-CB 3.5Å; R400-C411 WeakPolarHBondContact O-CA 3.28Å
412	D	61.8	Low	61.9	Low	24 Å²	24	79.5 Å²	79.5	13%	0.128	46%	0.464	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-80.9	126.2	171.8	-54.2	-33	0	0	0	108.6	Y379 I399 R400 R402	Y379-D412 HydrophobicContact CE1-CB 3.89Å; I399-D412 CarbonylContact C-O 3.53Å; I399-D412 VanDerWaalsContact CA-O 3.24Å; I399-D412 WeakPolarHBondContact CA-O 3.32Å; R400-D412 HydrophobicContact CB-CB 4.25Å; R400-D412 PolarHBondContact N-O 2.93Å; R400-D412 IonicContact NH1-OD2 2.66Å; R400-D412 PolarHBondContact NH1-OD2 3.14Å; R400-D412 PolarHBondContact O-N 3.48Å; R402-D412 IonicContact CZ-OD1 3.48Å; R402-D412 IonicContact CZ-OD2 2.89Å; R402-D412 IonicContact NE-OD1 2.74Å; R402-D412 PolarHBondContact NE-OD1 2.79Å; R402-D412 IonicContact NE-OD2 2.96Å; R402-D412 PolarHBondContact NE-OD2 3.23Å; R402-D412 IonicContact NH2-OD1 3.52Å; R402-D412 PolarHBondContact NH2-OD1 3.29Å; R402-D412 IonicContact NH2-OD2 3.67Å
413	R	60.2	Low	62.2	Low	195 Å²	195	79.3 Å²	79.3	74%	0.736	46%	0.463	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-97.5	133.6	175.6	-68.3	-177.6	176.3	178.9	-1.3	110.5	Y398 I399	Y398-R413 WeakPolarHBondContact O-CA 3.49Å; I399-R413 HydrophobicContact CG1-CG 4.44Å
414	A	59.6	Low	62.5	Low	37 Å²	37	76.6 Å²	76.6	31%	0.306	45%	0.449	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-109.1	151.6	171.8	0	0	0	0	0	111.3	Y379 Y398	Y379-A414 HydrophobicContact CD1-CB 3.87Å; Y379-A414 HydrophobicContact CD2-CB 4.35Å; Y379-A414 HydrophobicContact CE1-CB 3.87Å; Y379-A414 HydrophobicContact CE2-CB 4.32Å; Y379-A414 HydrophobicContact CG-CB 4.14Å; Y398-A414 PolarHBondContact O-N 3.48Å
415	A	56.1	Low	62.7	Low	94 Å²	94	81.7 Å²	81.7	78%	0.777	47%	0.465	S	S	*	.	P	Polyproline II helix	trans	-64.2	151.9	172.8	0	0	0	0	0	111
416	A	60.3	Low	63.4	Low	41 Å²	41	74.4 Å²	74.4	34%	0.339	45%	0.446	S	S	.	.	P	Polyproline II helix	trans	-64.1	141	175.6	0	0	0	0	0	111	Y398 L420	Y398-A416 HydrophobicContact CE2-CB 4.43Å; A416-L420 HydrophobicContact CB-CD2 3.91Å; A416-L420 HydrophobicContact CB-CG 4.35Å
417	P	64.3	Low	63.5	Low	39 Å²	39	72.8 Å²	72.8	25%	0.253	42%	0.416	S	S	.	.	P	Polyproline II helix	trans	-52.7	143.9	170.6	-26.4	33.5	0	0	0	111.8	Y398 P419 L420 S421	Y398-P417 HydrophobicContact CE2-CG 4.19Å; Y398-P417 VanDerWaalsContact OH-CD 3.3Å; Y398-P417 WeakPolarHBondContact OH-CD 3.45Å; Y398-P417 WeakPolarHBondContact OH-CG 3.49Å; P417-P419 VanDerWaalsContact C-CD 3.47Å; P417-L420 WeakPolarHBondContact O-CB 3.32Å; P417-L420 PolarHBondContact O-N 3.13Å; P417-S421 PolarHBondContact O-N 2.76Å
418	T	67.3	Low	63.4	Low	112 Å²	112	74.4 Å²	74.4	69%	0.687	41%	0.411	S	S	*	.	H	α-helix	trans	-47	-46.6	-175.7	-45.3	0	0	0	0	114.6	L420 S421 A422	T418-L420 PolarHBondContact O-N 3.3Å; T418-S421 WeakPolarHBondContact CA-OG 3.41Å; T418-S421 PolarHBondContact O-N 2.94Å; T418-S421 VanDerWaalsContact O-N 3.17Å; T418-S421 PolarHBondContact O-OG 2.97Å; T418-A422 WeakPolarHBondContact O-CB 3.49Å; T418-A422 PolarHBondContact O-N 2.96Å
419	P	66.8	Low	63.8	Low	54 Å²	54	67.8 Å²	67.8	35%	0.351	40%	0.398	S	S	.	.	H	α-helix	trans	-71.1	-28.7	179.9	27	-35.4	0	0	0	113.8	H291 P417 Y423	H291-P419 WeakPolarHBondContact CD2-CG 3.32Å; H291-P419 WeakPolarHBondContact NE2-CD 3.28Å; H291-P419 WeakPolarHBondContact NE2-CG 3.39Å; P417-P419 VanDerWaalsContact C-CD 3.47Å; P419-Y423 WeakPolarHBondContact O-CB 3.11Å; P419-Y423 PolarHBondContact O-N 3.3Å
420	L	62.4	Low	63.8	Low	22 Å²	22	67 Å²	67	12%	0.115	40%	0.395	C	S	.	.	H	α-helix	trans	-67.7	-42.1	169.5	178.7	65	0	0	0	109.9	A284 V288 Y398 A416 P417 T418 A422 Y423 L424	A284-L420 HydrophobicContact CB-CD1 4.2Å; V288-L420 HydrophobicContact CG2-CB 4.43Å; V288-L420 HydrophobicContact CG2-CD1 4Å; V288-L420 HydrophobicContact CG2-CD2 3.66Å; V288-L420 HydrophobicContact CG2-CG 4.24Å; Y398-L420 HydrophobicContact CE2-CD2 4.23Å; A416-L420 HydrophobicContact CB-CD2 3.91Å; A416-L420 HydrophobicContact CB-CG 4.35Å; P417-L420 WeakPolarHBondContact O-CB 3.32Å; P417-L420 PolarHBondContact O-N 3.13Å; T418-L420 PolarHBondContact O-N 3.3Å; L420-A422 VanDerWaalsContact C-N 3.34Å; L420-A422 PolarHBondContact O-N 3.25Å; L420-Y423 PolarHBondContact O-N 3.08Å; L420-L424 HydrophobicContact CD1-CD1 4.37Å; L420-L424 HydrophobicContact CD1-CG 4.29Å; L420-L424 HydrophobicContact CG-CD1 4.11Å; L420-L424 HydrophobicContact CG-CG 4.44Å; L420-L424 WeakPolarHBondContact O-CB 3.42Å; L420-L424 VanDerWaalsContact O-CG 3.27Å; L420-L424 WeakPolarHBondContact O-CG 3.25Å; L420-L424 PolarHBondContact O-N 3.21Å
421	S	63.1	Low	63.6	Low	38 Å²	38	66.5 Å²	66.5	27%	0.266	39%	0.39	S	S	.	.	H	α-helix	trans	-63.9	-38.8	177	74.4	0	0	0	0	112.5	P417 T418 L424 Q425	P417-S421 PolarHBondContact O-N 2.76Å; T418-S421 WeakPolarHBondContact CA-OG 3.41Å; T418-S421 PolarHBondContact O-N 2.94Å; T418-S421 VanDerWaalsContact O-N 3.17Å; T418-S421 PolarHBondContact O-OG 2.97Å; S421-L424 PolarHBondContact O-N 2.86Å; S421-Q425 WeakPolarHBondContact O-CB 3.45Å; S421-Q425 VanDerWaalsContact O-CG 3.28Å; S421-Q425 WeakPolarHBondContact O-CG 3.46Å; S421-Q425 PolarHBondContact O-N 3.14Å
422	A	68.6	Low	63.3	Low	50 Å²	50	71.9 Å²	71.9	41%	0.413	41%	0.406	S	S	.	.	H	α-helix	trans	-67.5	-41.2	175.4	0	0	0	0	0	111.7	T418 L420 Q425 S426	T418-A422 WeakPolarHBondContact O-CB 3.49Å; T418-A422 PolarHBondContact O-N 2.96Å; L420-A422 VanDerWaalsContact C-N 3.34Å; L420-A422 PolarHBondContact O-N 3.25Å; A422-Q425 PolarHBondContact O-N 3.09Å; A422-S426 PolarHBondContact O-N 3.28Å
423	Y	69	Low	63.1	Low	29 Å²	29	74.3 Å²	74.3	11%	0.114	43%	0.425	C	S	.	.	H	α-helix	trans	-59.3	-50.9	172.9	178.9	-98.4	0	0	0	111.3	S280 E283 A284 L287 P419 L420 Q425 S426 Y427	S280-Y423 PolarHBondContact O-OH 3.34Å; E283-Y423 VanDerWaalsContact CD-OH 3.29Å; E283-Y423 HydrophobicContact CG-CE2 3.79Å; E283-Y423 WeakPolarHBondContact OE1-CE2 3.45Å; E283-Y423 VanDerWaalsContact OE2-CE2 3.3Å; E283-Y423 WeakPolarHBondContact OE2-CE2 3.47Å; E283-Y423 PolarHBondContact OE2-OH 3.27Å; A284-Y423 HydrophobicContact CB-CD1 4.15Å; A284-Y423 HydrophobicContact CB-CE1 3.81Å; L287-Y423 HydrophobicContact CD1-CD1 3.99Å; L287-Y423 HydrophobicContact CD1-CD2 3.39Å; L287-Y423 HydrophobicContact CD1-CE2 4.05Å; L287-Y423 HydrophobicContact CD1-CG 3.34Å; P419-Y423 WeakPolarHBondContact O-CB 3.11Å; P419-Y423 PolarHBondContact O-N 3.3Å; L420-Y423 PolarHBondContact O-N 3.08Å; Y423-Q425 VanDerWaalsContact C-N 3.31Å; Y423-Q425 PolarHBondContact O-N 3.24Å; Y423-S426 PolarHBondContact O-N 3.44Å; Y423-S426 VanDerWaalsContact O-N 3.15Å; Y423-S426 PolarHBondContact O-OG 3Å; Y423-Y427 WeakPolarHBondContact O-CB 3.25Å; Y423-Y427 PolarHBondContact O-N 3.39Å
424	L	63.3	Low	62.7	Low	75 Å²	75	67.9 Å²	67.9	39%	0.393	41%	0.41	S	S	.	.	H	α-helix	trans	-61.8	-37.2	177.9	-67.4	174.1	0	0	0	112.4	L420 S421 Y427 D428	L420-L424 HydrophobicContact CD1-CD1 4.37Å; L420-L424 HydrophobicContact CD1-CG 4.29Å; L420-L424 HydrophobicContact CG-CD1 4.11Å; L420-L424 HydrophobicContact CG-CG 4.44Å; L420-L424 WeakPolarHBondContact O-CB 3.42Å; L420-L424 VanDerWaalsContact O-CG 3.27Å; L420-L424 WeakPolarHBondContact O-CG 3.25Å; L420-L424 PolarHBondContact O-N 3.21Å; S421-L424 PolarHBondContact O-N 2.86Å; L424-Y427 VanDerWaalsContact O-CB 3.3Å; L424-Y427 WeakPolarHBondContact O-CB 3.36Å; L424-Y427 PolarHBondContact O-N 3.43Å; L424-D428 PolarHBondContact O-N 3.36Å
425	Q	66.7	Low	62.1	Low	134 Å²	134	69.5 Å²	69.5	63%	0.626	43%	0.43	S	S	*	.	H	α-helix	trans	-65.2	-41.5	173.5	-77.8	174.7	7.3	0	0	112.5	S421 A422 Y423 Y427 D428 A429	S421-Q425 WeakPolarHBondContact O-CB 3.45Å; S421-Q425 VanDerWaalsContact O-CG 3.28Å; S421-Q425 WeakPolarHBondContact O-CG 3.46Å; S421-Q425 PolarHBondContact O-N 3.14Å; A422-Q425 PolarHBondContact O-N 3.09Å; Y423-Q425 VanDerWaalsContact C-N 3.31Å; Y423-Q425 PolarHBondContact O-N 3.24Å; Q425-Y427 PolarHBondContact O-N 3.47Å; Q425-D428 PolarHBondContact O-N 3.25Å; Q425-A429 WeakPolarHBondContact O-CB 3.31Å; Q425-A429 PolarHBondContact O-N 2.96Å
426	S	69.3	Low	61.4	Low	55 Å²	55	70.3 Å²	70.3	39%	0.385	43%	0.43	S	S	.	.	H	α-helix	trans	-64.6	-33.6	173.8	75	0	0	0	0	111.6	A422 Y423 A429 N430	A422-S426 PolarHBondContact O-N 3.28Å; Y423-S426 PolarHBondContact O-N 3.44Å; Y423-S426 VanDerWaalsContact O-N 3.15Å; Y423-S426 PolarHBondContact O-OG 3Å; S426-A429 PolarHBondContact O-N 3Å; S426-N430 VanDerWaalsContact O-CG 3.25Å; S426-N430 PolarHBondContact O-N 2.98Å; S426-N430 PolarHBondContact O-ND2 3.04Å
427	Y	63.3	Low	60.4	Low	45 Å²	45	72 Å²	72	18%	0.176	44%	0.444	C	S	.	.	H	α-helix	trans	-66.9	-45.8	176.6	-161	-106.8	0	0	0	112.1	L273 S280 Y423 L424 Q425 A429 N430 L431	L273-Y427 HydrophobicContact CD1-CE1 3.46Å; L273-Y427 VanDerWaalsContact CD1-CE1 3.46Å; L273-Y427 VanDerWaalsContact CD1-CZ 3.49Å; L273-Y427 WeakPolarHBondContact CD1-OH 3.41Å; L273-Y427 HydrophobicContact CD2-CE1 4.28Å; L273-Y427 HydrophobicContact CD2-CE2 4.36Å; L273-Y427 HydrophobicContact CG-CE1 4.49Å; S280-Y427 WeakPolarHBondContact CB-OH 3.41Å; S280-Y427 VanDerWaalsContact OG-CE2 3.25Å; S280-Y427 WeakPolarHBondContact OG-CE2 3.38Å; S280-Y427 PolarHBondContact OG-OH 2.91Å; Y423-Y427 WeakPolarHBondContact O-CB 3.25Å; Y423-Y427 PolarHBondContact O-N 3.39Å; L424-Y427 VanDerWaalsContact O-CB 3.3Å; L424-Y427 WeakPolarHBondContact O-CB 3.36Å; L424-Y427 PolarHBondContact O-N 3.43Å; Q425-Y427 PolarHBondContact O-N 3.47Å; Y427-A429 VanDerWaalsContact C-N 3.3Å; Y427-A429 PolarHBondContact O-N 3.25Å; Y427-N430 PolarHBondContact O-N 3.46Å; Y427-L431 HydrophobicContact CD1-CD1 4.12Å; Y427-L431 HydrophobicContact CE1-CD1 4.08Å; Y427-L431 PolarHBondContact O-N 2.96Å
428	D	63.5	Low	59	Low	92 Å²	92	74 Å²	74	49%	0.492	46%	0.459	S	S	.	.	H	α-helix	trans	-64.4	-34.1	174.3	-75.8	-22.5	0	0	0	112.3	L424 Q425 L431 K432	L424-D428 PolarHBondContact O-N 3.36Å; Q425-D428 PolarHBondContact O-N 3.25Å; D428-L431 WeakPolarHBondContact O-CB 3.3Å; D428-L431 PolarHBondContact O-N 3.43Å; D428-K432 WeakPolarHBondContact O-CG 3.5Å; D428-K432 PolarHBondContact O-N 3.03Å
429	A	65.3	Low	57.7	Low	54 Å²	54	75 Å²	75	45%	0.446	47%	0.468	S	S	.	.	H	α-helix	trans	-66	-42.2	174	0	0	0	0	0	111.7	Q425 S426 Y427 L431 K432 S433	Q425-A429 WeakPolarHBondContact O-CB 3.31Å; Q425-A429 PolarHBondContact O-N 2.96Å; S426-A429 PolarHBondContact O-N 3Å; Y427-A429 VanDerWaalsContact C-N 3.3Å; Y427-A429 PolarHBondContact O-N 3.25Å; A429-L431 VanDerWaalsContact C-N 3.34Å; A429-L431 PolarHBondContact O-N 2.84Å; A429-K432 PolarHBondContact O-N 3.29Å; A429-S433 PolarHBondContact O-N 3.32Å; A429-S433 VanDerWaalsContact O-N 3.08Å
430	N	61.3	Low	56.4	Low	96 Å²	96	76.7 Å²	76.7	51%	0.513	48%	0.481	S	S	.	.	H	α-helix	trans	-63.5	-39.6	176.1	-70	-21.3	0	0	0	111.8	S426 Y427 K432 S433 S434	S426-N430 VanDerWaalsContact O-CG 3.25Å; S426-N430 PolarHBondContact O-N 2.98Å; S426-N430 PolarHBondContact O-ND2 3.04Å; Y427-N430 PolarHBondContact O-N 3.46Å; N430-K432 VanDerWaalsContact C-N 3.3Å; N430-K432 PolarHBondContact O-N 2.67Å; N430-S433 WeakPolarHBondContact CA-OG 3.13Å; N430-S433 PolarHBondContact O-N 3.23Å; N430-S433 PolarHBondContact O-OG 3.07Å; N430-S434 PolarHBondContact O-N 3.29Å
431	L	57.9	Low	55.2	Low	47 Å²	47	83.1 Å²	83.1	25%	0.246	51%	0.514	C	S	.	.	H	α-helix	trans	-59.5	-37.4	174	-118	123.7	0	0	0	113.2	L269 L273 Y427 D428 A429 S434	L269-L431 HydrophobicContact CD2-CD2 4.12Å; L273-L431 HydrophobicContact CD1-CD1 3.55Å; L273-L431 HydrophobicContact CD1-CG 4.38Å; L273-L431 HydrophobicContact CD2-CD1 3.6Å; L273-L431 HydrophobicContact CD2-CG 3.88Å; L273-L431 HydrophobicContact CG-CD1 3.86Å; L273-L431 HydrophobicContact CG-CG 4.21Å; Y427-L431 HydrophobicContact CD1-CD1 4.12Å; Y427-L431 HydrophobicContact CE1-CD1 4.08Å; Y427-L431 PolarHBondContact O-N 2.96Å; D428-L431 WeakPolarHBondContact O-CB 3.3Å; D428-L431 PolarHBondContact O-N 3.43Å; A429-L431 VanDerWaalsContact C-N 3.34Å; A429-L431 PolarHBondContact O-N 2.84Å; L431-S434 PolarHBondContact O-OG 3.02Å
432	K	59.4	Low	54.2	Low	176 Å²	176	87.7 Å²	87.7	77%	0.765	53%	0.534	S	S	*	.	H	α-helix	trans	-74.8	-31.5	177.4	-70.7	174.6	-176.7	177.3	0	111.9	D428 A429 N430	D428-K432 WeakPolarHBondContact O-CG 3.5Å; D428-K432 PolarHBondContact O-N 3.03Å; A429-K432 PolarHBondContact O-N 3.29Å; N430-K432 VanDerWaalsContact C-N 3.3Å; N430-K432 PolarHBondContact O-N 2.67Å
433	S	56.7	Low	52.6	Low	75 Å²	75	90.2 Å²	90.2	52%	0.524	55%	0.547	S	S	.	.	H	α-helix	trans	-76.5	-29.3	176.9	67.9	0	0	0	0	114.2	A429 N430 G435	A429-S433 PolarHBondContact O-N 3.32Å; A429-S433 VanDerWaalsContact O-N 3.08Å; N430-S433 WeakPolarHBondContact CA-OG 3.13Å; N430-S433 PolarHBondContact O-N 3.23Å; N430-S433 PolarHBondContact O-OG 3.07Å; S433-G435 VanDerWaalsContact C-N 3.3Å; S433-G435 PolarHBondContact O-N 3.1Å
434	S	52.7	Low	51.1	Low	60 Å²	60	93 Å²	93	42%	0.42	57%	0.57	S	S	.	*	H	α-helix	trans	-77.5	-16	177.1	65.6	0	0	0	0	113.3	N430 L431 S436 A437	N430-S434 PolarHBondContact O-N 3.29Å; L431-S434 PolarHBondContact O-OG 3.02Å; S434-S436 PolarHBondContact O-N 3.03Å; S434-A437 PolarHBondContact O-N 3.08Å
435	G	46.5	Very low	49.9	Very low	71 Å²	71	96.2 Å²	96.2	73%	0.732	59%	0.588	S	S	*	*	T	Hydrogen-bonded Turn	trans	-70.3	-5	178.6	0	0	0	0	0	115.8	S433	S433-G435 VanDerWaalsContact C-N 3.3Å; S433-G435 PolarHBondContact O-N 3.1Å
436	S	42.8	Very low	48.4	Very low	111 Å²	111	99.1 Å²	99.1	78%	0.776	60%	0.599	S	S	*	*	T	Hydrogen-bonded Turn	trans	-105.6	3.5	174.9	81.4	0	0	0	0	114.2	S434	S434-S436 PolarHBondContact O-N 3.03Å
437	A	37.7	Very low	46.8	Very low	77 Å²	77	101 Å²	101	64%	0.636	61%	0.611	S	S	*	*	S	Bend	trans	-91.8	118.4	172.8	0	0	0	0	0	109.6	S434	S434-A437 PolarHBondContact O-N 3.08Å
438	S	35.9	Very low	45.4	Very low	80 Å²	80	107.4 Å²	107.4	56%	0.559	64%	0.635	S	S	*	*			trans	-45.3	143.3	178.4	45.7	0	0	0	0	113.9	S440	S438-S440 PolarHBondContact O-N 3.42Å; S438-S440 PolarHBondContact OG-OG 3.06Å
439	P	39.9	Very low	44.2	Very low	135 Å²	135	113.9 Å²	113.9	88%	0.877	65%	0.653	S	S	*	*	S	Bend	trans	-74.3	39.5	-177.4	32.5	-35.9	0	0	0	113.8
440	S	39.7	Very low	43	Very low	89 Å²	89	119.1 Å²	119.1	62%	0.622	67%	0.668	S	S	*	*			trans	-109.5	7.7	-169.5	59.3	0	0	0	0	115.1	S438	S438-S440 PolarHBondContact O-N 3.42Å; S438-S440 PolarHBondContact OG-OG 3.06Å
441	L	37.7	Very low	42	Very low	156 Å²	156	116.1 Å²	116.1	82%	0.817	66%	0.655	S	S	*	*			trans	-122.2	61.4	179.1	-79.6	143.9	0	0	0	110.9	P443	L441-P443 WeakPolarHBondContact O-CD 3.37Å
442	I	40.2	Very low	41.2	Very low	134 Å²	134	119.9 Å²	119.9	69%	0.687	67%	0.671	S	S	*	*			trans	-95.2	109.7	157.7	-59.2	175.2	0	0	0	105.9	S444	I442-S444 PolarHBondContact O-N 3.31Å
443	P	35.7	Very low	40.5	Very low	104 Å²	104	116.3 Å²	116.3	68%	0.675	66%	0.664	S	S	*	*			trans	-63.5	103.8	170.5	-15.1	28.9	0	0	0	108.2	L441 N445	L441-P443 WeakPolarHBondContact O-CD 3.37Å; P443-N445 PolarHBondContact O-N 3.49Å
444	S	38.5	Very low	40	Very low	87 Å²	87	120.4 Å²	120.4	61%	0.608	67%	0.672	S	S	*	*	T	Hydrogen-bonded Turn	trans	-65.2	-6.4	-171	50.3	0	0	0	0	114.8	I442	I442-S444 PolarHBondContact O-N 3.31Å
445	N	36.5	Very low	39.8	Very low	142 Å²	142	121.3 Å²	121.3	76%	0.759	67%	0.672	S	S	*	*	T	Hydrogen-bonded Turn	trans	-136	12.1	-165.8	-73.4	-40.2	0	0	0	117.3	P443	P443-N445 PolarHBondContact O-N 3.49Å
446	F	35.4	Very low	39.9	Very low	195 Å²	195	121.4 Å²	121.4	86%	0.855	66%	0.658	S	S	*	*	S	Bend	trans	-146.7	46.8	-170	-127	-92.2	0	0	0	116.7
447	C	37.3	Very low	40.4	Very low	96 Å²	96	117.9 Å²	117.9	65%	0.649	64%	0.636	S	S	*	*	S	Bend	trans	-163.1	-2	162.5	-152.7	0	0	0	0	116	R449	C447-R449 VanDerWaalsContact C-N 3.31Å; C447-R449 PolarHBondContact O-N 3.21Å
448	W	32.9	Very low	40.9	Very low	178 Å²	178	117.4 Å²	117.4	67%	0.674	62%	0.623	S	S	*	*	H	α-helix	trans	-73.9	-13.3	-168	-71.3	95.6	0	0	0	115.8
449	R	37.5	Very low	41.6	Very low	229 Å²	229	118.3 Å²	118.3	86%	0.864	62%	0.621	S	S	*	*	H	α-helix	trans	-90.9	-20.9	-173.5	-121.4	-165.1	-76.9	-124.8	4.5	115.1	C447	C447-R449 VanDerWaalsContact C-N 3.31Å; C447-R449 PolarHBondContact O-N 3.21Å
450	Q	41.5	Very low	42.2	Very low	164 Å²	164	115.6 Å²	115.6	77%	0.766	60%	0.599	S	S	*	*	H	α-helix	trans	-99.2	-25.1	179.4	-74.2	-178	2	0	0	113.1	T453	Q450-T453 PolarHBondContact O-OG1 3.29Å; Q450-T453 VanDerWaalsContact O-OG1 3.09Å
451	S	39.9	Very low	42.7	Very low	33 Å²	33	116.4 Å²	116.4	23%	0.231	59%	0.588	C	S	.	*	H	α-helix	trans	-71.1	-32.1	175.8	60.7	0	0	0	0	113.1	T453 K454 D455	S451-T453 PolarHBondContact O-N 3.37Å; S451-T453 VanDerWaalsContact O-N 3.08Å; S451-K454 PolarHBondContact O-N 3.04Å; S451-D455 WeakPolarHBondContact CB-OD2 3.43Å; S451-D455 WeakPolarHBondContact O-CB 3.28Å; S451-D455 PolarHBondContact O-N 3.42Å
452	Q	40.3	Very low	43.1	Very low	125 Å²	125	111.8 Å²	111.8	58%	0.584	56%	0.564	S	S	*	*	H	α-helix	trans	-51.4	-37.9	176.5	-83.4	-174.5	2.7	0	0	113.1	V456	Q452-V456 WeakPolarHBondContact O-CB 3.22Å; Q452-V456 WeakPolarHBondContact O-CG2 3.37Å; Q452-V456 PolarHBondContact O-N 3.4Å
453	T	45.9	Very low	43.5	Very low	101 Å²	101	108.8 Å²	108.8	62%	0.62	55%	0.546	S	S	*	.	H	α-helix	trans	-73.5	-32.9	-179.2	62.9	0	0	0	0	113.3	Q450 S451 A457	Q450-T453 PolarHBondContact O-OG1 3.29Å; Q450-T453 VanDerWaalsContact O-OG1 3.09Å; S451-T453 PolarHBondContact O-N 3.37Å; S451-T453 VanDerWaalsContact O-N 3.08Å; T453-A457 WeakPolarHBondContact O-CB 3.47Å; T453-A457 PolarHBondContact O-N 3.43Å
454	K	45.9	Very low	43.9	Very low	161 Å²	161	107.8 Å²	107.8	70%	0.7	54%	0.538	S	S	*	.	H	α-helix	trans	-83	-37.3	-179.8	-68.3	179.9	-177.8	173.8	0	111.3	S451 A457 L458	S451-K454 PolarHBondContact O-N 3.04Å; K454-A457 PolarHBondContact O-N 3.24Å; K454-L458 WeakPolarHBondContact O-CB 3.18Å; K454-L458 PolarHBondContact O-N 2.95Å
455	D	47	Very low	44.2	Very low	79 Å²	79	107.6 Å²	107.6	42%	0.422	54%	0.537	S	S	.	.	H	α-helix	trans	-76.8	-37.8	179.5	-62.5	-27.2	0	0	0	111.7	S451 A457 L458 L459	S451-D455 WeakPolarHBondContact CB-OD2 3.43Å; S451-D455 WeakPolarHBondContact O-CB 3.28Å; S451-D455 PolarHBondContact O-N 3.42Å; D455-A457 VanDerWaalsContact C-N 3.3Å; D455-A457 PolarHBondContact O-N 3.09Å; D455-L458 PolarHBondContact O-N 3.45Å; D455-L459 WeakPolarHBondContact O-CB 3.35Å; D455-L459 PolarHBondContact O-N 3.35Å
456	V	50.3	Low	44.4	Very low	73 Å²	73	105.8 Å²	105.8	44%	0.442	53%	0.526	S	S	.	.	H	α-helix	trans	-65.7	-35.1	169.2	172.8	0	0	0	0	110.7	Q452 N460	Q452-V456 WeakPolarHBondContact O-CB 3.22Å; Q452-V456 WeakPolarHBondContact O-CG2 3.37Å; Q452-V456 PolarHBondContact O-N 3.4Å; V456-N460 WeakPolarHBondContact CG1-ND2 3.45Å; V456-N460 WeakPolarHBondContact O-CB 3.15Å; V456-N460 PolarHBondContact O-N 3.24Å; V456-N460 PolarHBondContact O-ND2 2.92Å
457	A	52.5	Low	44.7	Very low	37 Å²	37	101.6 Å²	101.6	31%	0.306	51%	0.507	S	S	.	.	H	α-helix	trans	-69.1	-33.1	173.2	0	0	0	0	0	112.7	T453 K454 D455 R461	T453-A457 WeakPolarHBondContact O-CB 3.47Å; T453-A457 PolarHBondContact O-N 3.43Å; K454-A457 PolarHBondContact O-N 3.24Å; D455-A457 VanDerWaalsContact C-N 3.3Å; D455-A457 PolarHBondContact O-N 3.09Å; A457-R461 VanDerWaalsContact O-CB 3.23Å; A457-R461 WeakPolarHBondContact O-CB 3.22Å; A457-R461 WeakPolarHBondContact O-CG 3.3Å; A457-R461 PolarHBondContact O-N 2.87Å
458	L	47.8	Very low	44.7	Very low	68 Å²	68	100.1 Å²	100.1	36%	0.356	50%	0.498	S	S	.	.	H	α-helix	trans	-70.7	-44.1	174.2	-135.4	167.1	0	0	0	110.6	K454 D455 R461 L462	K454-L458 WeakPolarHBondContact O-CB 3.18Å; K454-L458 PolarHBondContact O-N 2.95Å; D455-L458 PolarHBondContact O-N 3.45Å; L458-R461 CarbonylContact O-C 3.57Å; L458-R461 WeakPolarHBondContact O-CB 3.34Å; L458-R461 PolarHBondContact O-N 3.39Å; L458-R461 VanDerWaalsContact O-N 3.14Å; L458-L462 HydrophobicContact CD2-CD1 4.04Å; L458-L462 HydrophobicContact CD2-CG 4.22Å; L458-L462 WeakPolarHBondContact O-CG 3.25Å; L458-L462 PolarHBondContact O-N 3.42Å
459	L	51.1	Low	44.8	Very low	99 Å²	99	96.6 Å²	96.6	52%	0.518	50%	0.501	S	S	.	.	H	α-helix	trans	-64.3	-42.6	175.3	-161.9	75.6	0	0	0	111.8	D455 R461 L462 K463	D455-L459 WeakPolarHBondContact O-CB 3.35Å; D455-L459 PolarHBondContact O-N 3.35Å; L459-R461 VanDerWaalsContact C-N 3.28Å; L459-R461 PolarHBondContact O-N 3.06Å; L459-L462 PolarHBondContact O-N 2.88Å; L459-K463 WeakPolarHBondContact O-CG 3.34Å; L459-K463 PolarHBondContact O-N 3.39Å
460	N	53.3	Low	44.7	Very low	77 Å²	77	93.4 Å²	93.4	41%	0.412	50%	0.495	S	S	.	.	H	α-helix	trans	-68.8	-26	173.4	-73.7	-23.3	0	0	0	112.6	V456 T464	V456-N460 WeakPolarHBondContact CG1-ND2 3.45Å; V456-N460 WeakPolarHBondContact O-CB 3.15Å; V456-N460 PolarHBondContact O-N 3.24Å; V456-N460 PolarHBondContact O-ND2 2.92Å; N460-T464 WeakPolarHBondContact O-CG2 3.31Å; N460-T464 PolarHBondContact O-N 2.83Å; N460-T464 PolarHBondContact O-OG1 3.41Å
461	R	50	Low	44.5	Very low	107 Å²	107	97.7 Å²	97.7	40%	0.404	50%	0.504	S	S	.	.	H	α-helix	trans	-77.8	-38.1	172.2	-85	178.6	-174.6	155.1	11.3	113.6	T390 A457 L458 L459 K463 T464 S465	T390-R461 PolarHBondContact OG1-NH1 3.25Å; T390-R461 PolarHBondContact OG1-NH2 3Å; A457-R461 VanDerWaalsContact O-CB 3.23Å; A457-R461 WeakPolarHBondContact O-CB 3.22Å; A457-R461 WeakPolarHBondContact O-CG 3.3Å; A457-R461 PolarHBondContact O-N 2.87Å; L458-R461 CarbonylContact O-C 3.57Å; L458-R461 WeakPolarHBondContact O-CB 3.34Å; L458-R461 PolarHBondContact O-N 3.39Å; L458-R461 VanDerWaalsContact O-N 3.14Å; L459-R461 VanDerWaalsContact C-N 3.28Å; L459-R461 PolarHBondContact O-N 3.06Å; R461-K463 VanDerWaalsContact C-N 3.3Å; R461-T464 VanDerWaalsContact CA-OG1 3.31Å; R461-T464 WeakPolarHBondContact CA-OG1 3.2Å; R461-T464 CarbonylContact O-C 3.55Å; R461-T464 PolarHBondContact O-N 2.9Å; R461-T464 PolarHBondContact O-OG1 3.03Å; R461-S465 VanDerWaalsContact O-CB 3.26Å; R461-S465 WeakPolarHBondContact O-CB 3.41Å; R461-S465 PolarHBondContact O-N 3.33Å
462	L	45.5	Very low	44.2	Very low	58 Å²	58	99.5 Å²	99.5	30%	0.304	53%	0.528	S	S	.	.	H	α-helix	trans	-62.3	-43.1	170.3	-75.1	167.4	0	0	0	109.5	L458 L459 T464 S465 I466	L458-L462 HydrophobicContact CD2-CD1 4.04Å; L458-L462 HydrophobicContact CD2-CG 4.22Å; L458-L462 WeakPolarHBondContact O-CG 3.25Å; L458-L462 PolarHBondContact O-N 3.42Å; L459-L462 PolarHBondContact O-N 2.88Å; L462-T464 PolarHBondContact O-N 2.9Å; L462-S465 PolarHBondContact O-N 3.36Å; L462-I466 HydrophobicContact CB-CD1 4.37Å; L462-I466 VanDerWaalsContact O-CB 3.23Å; L462-I466 WeakPolarHBondContact O-CB 3.49Å; L462-I466 WeakPolarHBondContact O-CD1 3.12Å; L462-I466 WeakPolarHBondContact O-CG1 3.37Å; L462-I466 PolarHBondContact O-N 3.28Å
463	K	48.6	Very low	43.6	Very low	72 Å²	72	105.6 Å²	105.6	31%	0.313	55%	0.546	S	S	.	.	H	α-helix	trans	-54.5	-50.8	169.6	-73.7	176.4	-179.5	-177.7	0	111.7	L459 R461 S465 F467	L459-K463 WeakPolarHBondContact O-CG 3.34Å; L459-K463 PolarHBondContact O-N 3.39Å; R461-K463 VanDerWaalsContact C-N 3.3Å; K463-S465 PolarHBondContact O-N 3.3Å; K463-F467 HydrophobicContact CB-CD2 4.32Å; K463-F467 WeakPolarHBondContact O-CB 3.35Å; K463-F467 WeakPolarHBondContact O-CD2 3.35Å; K463-F467 VanDerWaalsContact O-CG 3.32Å; K463-F467 WeakPolarHBondContact O-CG 3.22Å; K463-F467 PolarHBondContact O-N 3.39Å
464	T	45	Very low	42.8	Very low	83 Å²	83	106.4 Å²	106.4	51%	0.509	55%	0.553	S	S	.	*	H	α-helix	trans	-72	-24.4	179.3	48.7	0	0	0	0	114.2	N460 R461 L462 S468	N460-T464 WeakPolarHBondContact O-CG2 3.31Å; N460-T464 PolarHBondContact O-N 2.83Å; N460-T464 PolarHBondContact O-OG1 3.41Å; R461-T464 VanDerWaalsContact CA-OG1 3.31Å; R461-T464 WeakPolarHBondContact CA-OG1 3.2Å; R461-T464 CarbonylContact O-C 3.55Å; R461-T464 PolarHBondContact O-N 2.9Å; R461-T464 PolarHBondContact O-OG1 3.03Å; L462-T464 PolarHBondContact O-N 2.9Å; T464-S468 VanDerWaalsContact O-CA 3.3Å; T464-S468 WeakPolarHBondContact O-CA 3.34Å; T464-S468 WeakPolarHBondContact O-CB 3.25Å; T464-S468 PolarHBondContact O-N 2.9Å
465	S	43.1	Very low	42	Very low	83 Å²	83	104 Å²	104	58%	0.58	56%	0.556	S	S	*	*	H	α-helix	trans	-79.9	-35.8	176	-165.9	0	0	0	0	112.1	R461 L462 K463 F467	R461-S465 VanDerWaalsContact O-CB 3.26Å; R461-S465 WeakPolarHBondContact O-CB 3.41Å; R461-S465 PolarHBondContact O-N 3.33Å; L462-S465 PolarHBondContact O-N 3.36Å; K463-S465 PolarHBondContact O-N 3.3Å; S465-F467 VanDerWaalsContact C-N 3.34Å
466	I	41.9	Very low	41.4	Very low	104 Å²	104	109.4 Å²	109.4	53%	0.533	58%	0.576	S	S	.	*	H	α-helix	trans	-72.3	-30.3	173.6	-64.4	165.8	0	0	0	110.4	L462	L462-I466 HydrophobicContact CB-CD1 4.37Å; L462-I466 VanDerWaalsContact O-CB 3.23Å; L462-I466 WeakPolarHBondContact O-CB 3.49Å; L462-I466 WeakPolarHBondContact O-CD1 3.12Å; L462-I466 WeakPolarHBondContact O-CG1 3.37Å; L462-I466 PolarHBondContact O-N 3.28Å
467	F	40.5	Very low	40.6	Very low	106 Å²	106	111.2 Å²	111.2	47%	0.465	59%	0.592	S	S	.	*	H	α-helix	trans	-116	-7	-171.4	-59.5	-49.9	0	0	0	117	K463 S465 V480	K463-F467 HydrophobicContact CB-CD2 4.32Å; K463-F467 WeakPolarHBondContact O-CB 3.35Å; K463-F467 WeakPolarHBondContact O-CD2 3.35Å; K463-F467 VanDerWaalsContact O-CG 3.32Å; K463-F467 WeakPolarHBondContact O-CG 3.22Å; K463-F467 PolarHBondContact O-N 3.39Å; S465-F467 VanDerWaalsContact C-N 3.34Å; F467-V480 HydrophobicContact CB-CG1 3.84Å; F467-V480 HydrophobicContact CD1-CB 4.08Å; F467-V480 HydrophobicContact CD1-CG1 2.99Å; F467-V480 HydrophobicContact CD1-CG2 3.95Å; F467-V480 HydrophobicContact CD2-CG1 4.33Å; F467-V480 HydrophobicContact CE1-CG1 3.45Å; F467-V480 VanDerWaalsContact CE1-CG1 3.45Å; F467-V480 HydrophobicContact CG-CG1 3.48Å; F467-V480 VanDerWaalsContact CG-CG1 3.48Å; F467-V480 HydrophobicContact CZ-CG1 4.31Å
468	S	37.4	Very low	39.7	Very low	66 Å²	66	119.8 Å²	119.8	46%	0.462	62%	0.617	S	S	.	*			trans	-110.9	81.5	179.1	-166.1	0	0	0	0	111.7	T464 H470	T464-S468 VanDerWaalsContact O-CA 3.3Å; T464-S468 WeakPolarHBondContact O-CA 3.34Å; T464-S468 WeakPolarHBondContact O-CB 3.25Å; T464-S468 PolarHBondContact O-N 2.9Å; S468-H470 PolarHBondContact O-N 3.39Å; S468-H470 VanDerWaalsContact O-N 3.16Å
469	S	36.2	Very low	39.3	Very low	104 Å²	104	119.4 Å²	119.4	73%	0.727	62%	0.619	S	S	*	*			trans	-81.1	71.1	156.4	74.7	0	0	0	0	109.6
470	H	35.5	Very low	38.5	Very low	162 Å²	162	117.5 Å²	117.5	75%	0.75	61%	0.611	S	S	*	*			trans	-128.6	88.3	172.1	-82.4	-37	0	0	0	111.1	S468	S468-H470 PolarHBondContact O-N 3.39Å; S468-H470 VanDerWaalsContact O-N 3.16Å
471	R	36.5	Very low	37.4	Very low	253 Å²	253	117 Å²	117	96%	0.955	61%	0.613	S	S	*	*	S	Bend	trans	-154.3	114.4	132.4	-71.4	-151.6	-177.1	-138.3	-3.4	110
472	G	34.8	Very low	36.7	Very low	71 Å²	71	119.3 Å²	119.3	73%	0.732	63%	0.629	S	S	*	*	S	Bend	trans	102	101.5	172.1	0	0	0	0	0	113.5	P474	G472-P474 VanDerWaalsContact O-CD 3.29Å; G472-P474 WeakPolarHBondContact O-CD 3.42Å
473	R	27.6	Very low	36.3	Very low	254 Å²	254	122.2 Å²	122.2	96%	0.958	65%	0.649	S	S	*	*			trans	-47.3	131.1	172.9	-77.2	178	170.9	-131.4	-0.2	110.9
474	P	28.5	Very low	35.6	Very low	118 Å²	118	125 Å²	125	77%	0.766	67%	0.666	S	S	*	*				-119.5	146.7	114	5.4	14.2	0	0	0	109.8	G472 F476	G472-P474 VanDerWaalsContact O-CD 3.29Å; G472-P474 WeakPolarHBondContact O-CD 3.42Å; P474-F476 PolarHBondContact O-N 3.28Å
475	S	29.3	Very low	35	Very low	109 Å²	109	126.3 Å²	126.3	76%	0.762	68%	0.677	S	S	*	*	S	Bend	trans	-54.4	104.5	174.2	48.1	0	0	0	0	111.2
476	F	33.6	Very low	34.6	Very low	193 Å²	193	127.4 Å²	127.4	85%	0.846	68%	0.682	S	S	*	*			trans	174.3	106.5	149	-99.1	-72.7	0	0	0	107.5	P474	P474-F476 PolarHBondContact O-N 3.28Å
477	S	34.2	Very low	34.1	Very low	111 Å²	111	128.2 Å²	128.2	78%	0.776	69%	0.694	S	S	*	*			trans	-87.7	110.4	-179.5	52.6	0	0	0	0	110.9
478	W	33.9	Very low	33.8	Very low	218 Å²	218	130.3 Å²	130.3	83%	0.826	71%	0.709	S	S	*	*	P	Polyproline II helix	trans	-87.3	131.1	164.7	-71.1	89.4	0	0	0	109.3
479	P	38.2	Very low	33.5	Very low	60 Å²	60	132.6 Å²	132.6	39%	0.39	72%	0.722	S	S	.	*	P	Polyproline II helix	trans	-85.2	126.1	179.4	30.4	-28	0	0	0	111.3	K98 Q99	K98-P479 HydrophobicContact CB-CB 4.25Å; K98-P479 HydrophobicContact CB-CG 4.2Å; K98-P479 HydrophobicContact CD-CB 3.98Å; Q99-P479 HydrophobicContact CG-CG 3.93Å
480	V	35.3	Very low	33.3	Very low	59 Å²	59	137.3 Å²	137.3	36%	0.358	73%	0.73	S	S	.	*	P	Polyproline II helix	trans	-80.7	140.3	171.8	162.3	0	0	0	0	110.4	K98 F467	K98-V480 PolarHBondContact NZ-O 3.36Å; F467-V480 HydrophobicContact CB-CG1 3.84Å; F467-V480 HydrophobicContact CD1-CB 4.08Å; F467-V480 HydrophobicContact CD1-CG1 2.99Å; F467-V480 HydrophobicContact CD1-CG2 3.95Å; F467-V480 HydrophobicContact CD2-CG1 4.33Å; F467-V480 HydrophobicContact CE1-CG1 3.45Å; F467-V480 VanDerWaalsContact CE1-CG1 3.45Å; F467-V480 HydrophobicContact CG-CG1 3.48Å; F467-V480 VanDerWaalsContact CG-CG1 3.48Å; F467-V480 HydrophobicContact CZ-CG1 4.31Å
481	S	30.5	Very low	33.2	Very low	66 Å²	66	137.6 Å²	137.6	46%	0.462	73%	0.731	S	S	.	*	P	Polyproline II helix	trans	-70.3	133.5	174.6	-164	0	0	0	0	111.7	T483	S481-T483 PolarHBondContact OG-OG1 3.47Å
482	E	35	Very low	33	Very low	156 Å²	156	131 Å²	131	73%	0.729	72%	0.722	S	S	*	*			trans	-109.7	9.1	-176.3	-76.2	168.5	155.6	0	0	113.1	K98 I484	K98-E482 VanDerWaalsContact NZ-CD 3.31Å; K98-E482 IonicContact NZ-OE2 2.7Å; K98-E482 PolarHBondContact NZ-OE2 3.32Å; E482-I484 PolarHBondContact O-N 3.28Å
483	T	36.4	Very low	32.8	Very low	118 Å²	118	135.6 Å²	135.6	72%	0.724	73%	0.728	S	S	*	*			trans	-82.7	117.2	179.1	40.1	0	0	0	0	111.5	S481	S481-T483 PolarHBondContact OG-OG1 3.47Å
484	I	34.3	Very low	33	Very low	131 Å²	131	131.1 Å²	131.1	67%	0.672	72%	0.723	S	S	*	*			trans	-90.6	106.7	178.7	-60.8	170.2	0	0	0	108	E482	E482-I484 PolarHBondContact O-N 3.28Å
485	C	32.8	Very low	33.3	Very low	110 Å²	110	132.7 Å²	132.7	74%	0.743	72%	0.723	S	S	*	*	P	Polyproline II helix	trans	-68	142.2	160.9	-66.6	0	0	0	0	109.3
486	P	33.4	Very low	33.2	Very low	106 Å²	106	136.2 Å²	136.2	69%	0.688	73%	0.727	S	S	*	*	P	Polyproline II helix	trans	-61.3	152.2	174.1	26.8	-33	0	0	0	110.6	I488	P486-I488 PolarHBondContact O-N 2.89Å
487	P	32.7	Very low	33.2	Very low	122 Å²	122	132 Å²	132	79%	0.792	72%	0.722	S	S	*	*	P	Polyproline II helix	trans	-61.9	122.8	178.1	26.5	-31.9	0	0	0	109.4
488	I	33.1	Very low	33	Very low	149 Å²	149	137 Å²	137	76%	0.764	73%	0.73	S	S	*	*	P	Polyproline II helix	trans	-54.8	132	168.6	-60.5	168.9	0	0	0	107.3	P486 F490	P486-I488 PolarHBondContact O-N 2.89Å; I488-F490 PolarHBondContact O-N 2.88Å
489	P	31.9	Very low	32.8	Very low	115 Å²	115	129.8 Å²	129.8	75%	0.747	72%	0.723	S	S	*	*	P	Polyproline II helix	trans	-57.1	123.8	173.8	-18	29.4	0	0	0	109.2	E491	P489-E491 PolarHBondContact O-N 3.4Å
490	F	32.7	Very low	32.3	Very low	202 Å²	202	132.5 Å²	132.5	89%	0.886	74%	0.743	S	S	*	*			trans	-69.9	93.8	171.3	-113.8	-92.6	0	0	0	108	I488	I488-F490 PolarHBondContact O-N 2.88Å
491	E	33.2	Very low	32.1	Very low	168 Å²	168	135.8 Å²	135.8	79%	0.785	76%	0.764	S	S	*	*			trans	-76.8	135.5	155.8	-91.9	-164.3	157.7	0	0	108.8	P489 L493	P489-E491 PolarHBondContact O-N 3.4Å; E491-L493 PolarHBondContact O-N 2.93Å; E491-L493 VanDerWaalsContact O-N 3.09Å
492	P	31.9	Very low	32	Very low	115 Å²	115	139.2 Å²	139.2	75%	0.747	78%	0.777	S	S	*	*			trans	-68.3	111	176.5	27.5	-29.6	0	0	0	108.9	L494	P492-L494 PolarHBondContact O-N 3.36Å
493	L	31.2	Very low	31.8	Very low	167 Å²	167	140.8 Å²	140.8	87%	0.874	78%	0.784	S	S	*	*			trans	-59.7	103.8	165.1	-71.7	168.4	0	0	0	108.4	E491 I495	E491-L493 PolarHBondContact O-N 2.93Å; E491-L493 VanDerWaalsContact O-N 3.09Å; L493-I495 PolarHBondContact O-N 2.71Å; L493-I495 VanDerWaalsContact O-N 3.14Å
494	L	31.7	Very low	31.4	Very low	160 Å²	160	146.5 Å²	146.5	84%	0.838	79%	0.792	S	S	*	*			trans	-58	112.2	163.1	-104.9	126.3	0	0	0	107.6	P492 E496	P492-L494 PolarHBondContact O-N 3.36Å; L494-E496 PolarHBondContact O-N 2.85Å; L494-E496 VanDerWaalsContact O-N 3.12Å
495	I	33.3	Very low	31.2	Very low	152 Å²	152	146.1 Å²	146.1	78%	0.779	80%	0.801	S	S	*	*			trans	-74	98.9	169.7	-63.6	170.8	0	0	0	106	L493 S497	L493-I495 PolarHBondContact O-N 2.71Å; L493-I495 VanDerWaalsContact O-N 3.14Å; I495-S497 PolarHBondContact O-N 2.65Å; I495-S497 VanDerWaalsContact O-N 3.13Å
496	E	28.9	Very low	31	Very low	182 Å²	182	146.3 Å²	146.3	85%	0.85	80%	0.803	S	S	*	*			trans	-66.9	109.4	165.5	-75.6	-170.3	164.3	0	0	108.8	L494 K498	L494-E496 PolarHBondContact O-N 2.85Å; L494-E496 VanDerWaalsContact O-N 3.12Å; E496-K498 PolarHBondContact O-N 3.02Å
497	S	33	Very low	30.8	Very low	104 Å²	104	146.6 Å²	146.6	73%	0.727	81%	0.805	S	S	*	*			trans	-62.1	127.5	169.3	51.8	0	0	0	0	109.6	I495 G499	I495-S497 PolarHBondContact O-N 2.65Å; I495-S497 VanDerWaalsContact O-N 3.13Å; S497-G499 PolarHBondContact O-N 3.43Å
498	K	29.2	Very low	30.7	Very low	218 Å²	218	147.9 Å²	147.9	95%	0.948	80%	0.804	S	S	*	*			trans	-46.3	107.9	166	-69.5	-178.4	174.3	-175.4	0	110.2	E496	E496-K498 PolarHBondContact O-N 3.02Å
499	G	29.6	Very low	30.4	Very low	65 Å²	65	149.7 Å²	149.7	67%	0.67	81%	0.806	S	S	*	*			trans	-150.9	106.1	176	0	0	0	0	0	108.7	S497 T501	S497-G499 PolarHBondContact O-N 3.43Å; G499-T501 PolarHBondContact O-N 3.45Å
500	S	28.4	Very low	30.5	Very low	118 Å²	118	154.4 Å²	154.4	83%	0.825	81%	0.811	S	S	*	*			trans	-52.5	118.6	171	162.2	0	0	0	0	111.1
501	T	30.9	Very low	30.4	Very low	128 Å²	128	149.5 Å²	149.5	79%	0.785	80%	0.802	S	S	*	*			trans	179.7	140	137.2	33.4	0	0	0	0	109.6	G499	G499-T501 PolarHBondContact O-N 3.45Å
502	D	27.8	Very low	30.4	Very low	138 Å²	138	151.6 Å²	151.6	74%	0.738	81%	0.808	S	S	*	*			trans	-30.9	136.9	171.5	-60.6	-60.1	0	0	0	114.5
503	H	31.6	Very low	30.5	Very low	188 Å²	188	152.4 Å²	152.4	87%	0.87	81%	0.811	S	S	*	*				176.8	123.6	125.4	-84.5	-53.5	0	0	0	111.2
504	R	27.9	Very low	30.4	Very low	239 Å²	239	152 Å²	152	90%	0.902	81%	0.81	S	S	*	*			trans	-19.6	128.8	161.9	-73.6	171.8	164.5	-162.8	-5.6	115.5
505	S	30.2	Very low	30.3	Very low	123 Å²	123	150.5 Å²	150.5	86%	0.86	81%	0.811	S	S	*	*			trans	-166.9	130.6	140.2	-73.9	0	0	0	0	111
506	S	28.4	Very low	30.1	Very low	113 Å²	113	148.4 Å²	148.4	79%	0.79	81%	0.808	S	S	*	*			trans	-70.6	156.7	-160.3	-36.4	0	0	0	0	117.6
507	P	29.8	Very low	30.1	Very low	112 Å²	112	146 Å²	146	73%	0.727	81%	0.805	S	S	*	*			trans	-91.9	141.1	148.2	30.9	-19.3	0	0	0	110.9	F509	P507-F509 PolarHBondContact O-N 3.23Å
508	I	29.1	Very low	30	Very low	149 Å²	149	148 Å²	148	76%	0.764	81%	0.814	S	S	*	*			trans	-67.7	111.8	-174.2	-66.6	163.6	0	0	0	109.8	Y510	I508-Y510 HydrophobicContact CG2-CD2 4.01Å; I508-Y510 HydrophobicContact CG2-CE2 3.94Å
509	F	28.1	Very low	30	Very low	187 Å²	187	142.5 Å²	142.5	82%	0.82	80%	0.802	S	S	*	*			trans	-79.6	123	164.2	-85.9	-93.1	0	0	0	109.1	P507	P507-F509 PolarHBondContact O-N 3.23Å
510	Y	33.3	Very low	30	Very low	215 Å²	215	150.6 Å²	150.6	84%	0.843	81%	0.813	S	S	*	*			trans	-88.3	111.6	160.5	-94	-83.4	0	0	0	109.2	I508	I508-Y510 HydrophobicContact CG2-CD2 4.01Å; I508-Y510 HydrophobicContact CG2-CE2 3.94Å
511	S	30.1	Very low	30.2	Very low	99 Å²	99	153.6 Å²	153.6	69%	0.692	81%	0.811	S	S	*	*	P	Polyproline II helix	trans	-58.7	128.9	171.2	48.2	0	0	0	0	111.7	T513	S511-T513 PolarHBondContact O-N 3.43Å
512	K	32.9	Very low	30.1	Very low	211 Å²	211	155.8 Å²	155.8	92%	0.917	81%	0.812	S	S	*	*	P	Polyproline II helix	trans	-56.8	120.8	163.9	-82.9	176.8	174.6	171.5	0	109.5
513	T	35.7	Very low	30.7	Very low	132 Å²	132	154.6 Å²	154.6	81%	0.81	81%	0.812	S	S	*	*	P	Polyproline II helix	trans	-79.3	132.7	167.8	44.1	0	0	0	0	110.6	S511	S511-T513 PolarHBondContact O-N 3.43Å
514	D	28.7	Very low	30.9	Very low	158 Å²	158	152 Å²	152	85%	0.845	81%	0.805	S	S	*	*	P	Polyproline II helix	trans	-53.4	142.4	173.6	-62.7	-59.6	0	0	0	113.8
515	C	28.9	Very low	31	Very low	129 Å²	129	147.6 Å²	147.6	87%	0.872	80%	0.799	S	S	*	*			trans	-147.1	150.2	152.1	-95.2	0	0	0	0	110.9
516	P	30.3	Very low	31.2	Very low	109 Å²	109	148.3 Å²	148.3	71%	0.708	80%	0.798	S	S	*	*			trans	-101.7	150.4	-143.8	0.3	22.2	0	0	0	113.9
517	T	27.9	Very low	31.3	Very low	130 Å²	130	148.7 Å²	148.7	80%	0.798	80%	0.795	S	S	*	*			trans	40.4	120.8	142.7	2.6	0	0	0	0	119.3
518	T	32	Very low	31.6	Very low	148 Å²	148	149.3 Å²	149.3	91%	0.908	80%	0.797	S	S	*	*				-157.5	127.8	121.2	9	0	0	0	0	112.6
519	S	27.6	Very low	32	Very low	101 Å²	101	149.1 Å²	149.1	71%	0.706	80%	0.797	S	S	*	*			trans	-67.3	137.6	179.5	172.4	0	0	0	0	113.1
520	R	30.6	Very low	32.1	Very low	235 Å²	235	148.9 Å²	148.9	89%	0.887	80%	0.799	S	S	*	*			trans	-151	91.6	156.8	-138.3	176.1	-170.2	173	6	108.1
521	K	32.9	Very low	32.3	Very low	182 Å²	182	145.5 Å²	145.5	79%	0.791	80%	0.8	S	S	*	*				53.9	102.4	95.1	-70.8	-166.7	177.6	-175.5	0	113.6
522	H	28.5	Very low	32.3	Very low	173 Å²	173	145.1 Å²	145.1	80%	0.801	80%	0.803	S	S	*	*			trans	-47.9	152.1	159.4	-129.8	-90.4	0	0	0	111.8
523	P	40.7	Very low	32.6	Very low	113 Å²	113	143.7 Å²	143.7	73%	0.734	80%	0.804	S	S	*	*				-135.3	126.2	128.7	33.6	-19.7	0	0	0	112.8
524	D	34.8	Very low	32.5	Very low	135 Å²	135	144.6 Å²	144.6	72%	0.722	80%	0.804	S	S	*	*			trans	9.8	140.9	136.3	-50.1	-26.2	0	0	0	122
525	D	30.6	Very low	33	Very low	145 Å²	145	143.6 Å²	143.6	78%	0.775	80%	0.803	S	S	*	*			trans	56.5	107.8	141.8	-81.1	-12.2	0	0	0	120.7
526	V	35.1	Very low	33.2	Very low	139 Å²	139	140.5 Å²	140.5	84%	0.842	79%	0.794	S	S	*	*				-137.4	118.3	128.6	-178.4	0	0	0	0	109.7
527	T	30	Very low	33.3	Very low	120 Å²	120	146.9 Å²	146.9	74%	0.736	80%	0.803	S	S	*	*			trans	-61.8	133.8	168.4	37.3	0	0	0	0	113
528	V	36.6	Very low	33.7	Very low	125 Å²	125	148.8 Å²	148.8	76%	0.758	80%	0.803	S	S	*	*			trans	-149.7	110.5	149.7	-158.5	0	0	0	0	110.9
529	D	36.5	Very low	33.8	Very low	145 Å²	145	148.8 Å²	148.8	78%	0.775	80%	0.797	S	S	*	*			trans	44.8	110.9	147.8	-58.9	-21.2	0	0	0	123.2
530	E	31	Very low	34.1	Very low	183 Å²	183	151.2 Å²	151.2	86%	0.855	80%	0.802	S	S	*	*			trans	3.3	119.4	134.1	-81.4	-175	136	0	0	118.1
531	V	37.2	Very low	34.3	Very low	144 Å²	144	146.6 Å²	146.6	87%	0.873	80%	0.795	S	S	*	*				-146.1	112.1	120.2	-175.9	0	0	0	0	108.4
532	A	30.6	Very low	34.5	Very low	90 Å²	90	143.8 Å²	143.8	74%	0.744	79%	0.793	S	S	*	*			trans	-77.5	135.1	172.6	0	0	0	0	0	111.3
533	L	39.2	Very low	34.7	Very low	181 Å²	181	140 Å²	140	95%	0.948	79%	0.786	S	S	*	*			trans	-146.2	134.4	146.4	-88.9	178.7	0	0	0	110.1
534	D	33.2	Very low	34.6	Very low	152 Å²	152	140.6 Å²	140.6	81%	0.813	78%	0.783	S	S	*	*			trans	-92.9	-179.2	-161.1	-158.3	-1.4	0	0	0	112.3
535	V	38.2	Very low	34.7	Very low	136 Å²	136	140.8 Å²	140.8	82%	0.824	78%	0.784	S	S	*	*			trans	109.5	100.3	164.6	-170.2	0	0	0	0	115
536	G	33	Very low	34.8	Very low	65 Å²	65	137.3 Å²	137.3	67%	0.67	78%	0.783	S	S	*	*			trans	-95.3	-171.6	174.1	0	0	0	0	0	116.1
537	R	33.8	Very low	34.8	Very low	242 Å²	242	139.4 Å²	139.4	91%	0.913	79%	0.788	S	S	*	*			trans	-172.1	118.9	150.3	-109.3	-179.6	-175.6	-160.3	-0.3	111.7
538	E	34.8	Very low	34.7	Very low	170 Å²	170	140 Å²	140	79%	0.794	79%	0.786	S	S	*	*			trans	34.8	118.2	137.5	-61.2	-158.1	158.6	0	0	120.6
539	L	34.1	Very low	34.5	Very low	148 Å²	148	142.2 Å²	142.2	78%	0.775	79%	0.792	S	S	*	*				85	123.1	71.4	-92.2	170.5	0	0	0	114.7
540	N	35.6	Very low	34	Very low	152 Å²	152	142.3 Å²	142.3	81%	0.813	79%	0.788	S	S	*	*			trans	148.9	142.3	140.7	-73.9	-15.8	0	0	0	110.2
541	D	33.4	Very low	34.1	Very low	139 Å²	139	142.4 Å²	142.4	74%	0.743	79%	0.788	S	S	*	*			cis	-177.7	159.1	-19.6	-162.6	5.2	0	0	0	106.6
542	V	36.6	Very low	33.7	Very low	122 Å²	122	143.8 Å²	143.8	74%	0.739	78%	0.783	S	S	*	*			trans	75.1	144.3	157.5	-160.7	0	0	0	0	120.9
543	S	34.1	Very low	33.9	Very low	94 Å²	94	148.3 Å²	148.3	66%	0.657	79%	0.788	S	S	*	*			cis	173.8	164.6	-38.9	-156.1	0	0	0	0	108.8
544	N	37.6	Very low	33.5	Very low	126 Å²	126	144.9 Å²	144.9	67%	0.674	78%	0.779	S	S	*	*			trans	83.8	140.2	156.3	-69.7	28.1	0	0	0	119.4
545	D	37	Very low	33.5	Very low	138 Å²	138	143.4 Å²	143.4	74%	0.738	78%	0.778	S	S	*	*			cis	-163.1	141.1	-0.1	-96.2	-33	0	0	0	107.5
546	G	33.9	Very low	33.3	Very low	73 Å²	73	145.7 Å²	145.7	75%	0.753	78%	0.784	S	S	*	*				75.6	120.6	102.2	0	0	0	0	0	114.2
547	L	34.6	Very low	33.2	Very low	182 Å²	182	151 Å²	151	95%	0.953	79%	0.791	S	S	*	*				-175.6	153.5	61.1	-111.9	151.1	0	0	0	112.3
548	L	26.9	Very low	33.4	Very low	133 Å²	133	143.8 Å²	143.8	70%	0.696	78%	0.776	S	S	*	*			trans	-93.4	145	-173.2	173.8	78.8	0	0	0	112.7	Q550	L548-Q550 HydrophobicContact CD1-CG 4.49Å
549	I	33.3	Very low	33.2	Very low	172 Å²	172	143.1 Å²	143.1	88%	0.882	77%	0.773	S	S	*	*			trans	-147.4	126.8	141.2	-60.8	-170.5	0	0	0	110.6
550	Q	27	Very low	33.1	Very low	146 Å²	146	142 Å²	142	68%	0.682	77%	0.767	S	S	*	*			trans	-88.6	156.5	169.5	-73.5	173.6	-42.8	0	0	111.6	L548	L548-Q550 HydrophobicContact CD1-CG 4.49Å
551	E	32.6	Very low	32.9	Very low	186 Å²	186	140.4 Å²	140.4	87%	0.869	76%	0.759	S	S	*	*			trans	-177.5	106.8	132.6	-101.9	175.7	-175.1	0	0	109.1
552	K	29.2	Very low	32.9	Very low	173 Å²	173	140.5 Å²	140.5	75%	0.752	76%	0.759	S	S	*	*				51.5	115.6	94.4	-77.3	-175.2	178.3	174.3	0	115.5
553	H	34.6	Very low	32.7	Very low	184 Å²	184	140.6 Å²	140.6	85%	0.852	76%	0.76	S	S	*	*				-179	163.2	113.3	-93.6	-67.1	0	0	0	112.3
554	S	30.4	Very low	32.8	Very low	110 Å²	110	141.4 Å²	141.4	77%	0.769	76%	0.763	S	S	*	*			trans	-99.2	174.2	-140	-48.9	0	0	0	0	115.7
555	P	33.8	Very low	32.7	Very low	120 Å²	120	145.8 Å²	145.8	78%	0.779	78%	0.776	S	S	*	*			trans	-100	162.7	-173.4	37.9	-29.7	0	0	0	113.8
556	L	32.3	Very low	32.3	Very low	184 Å²	184	148.5 Å²	148.5	96%	0.963	78%	0.781	S	S	*	*			trans	-133.5	141.6	166.8	-79	172.3	0	0	0	111.8
557	H	31.2	Very low	32.1	Very low	177 Å²	177	150.3 Å²	150.3	82%	0.819	78%	0.782	S	S	*	*			trans	-108.5	-162.5	-166.6	-157.3	-11.7	0	0	0	109
558	P	38	Very low	32.1	Very low	90 Å²	90	148 Å²	148	58%	0.584	78%	0.775	S	S	*	*				-106.7	-179.7	-114.4	37.3	-19.9	0	0	0	115.8
559	Q	30.9	Very low	32.1	Very low	157 Å²	157	148.6 Å²	148.6	73%	0.734	78%	0.779	S	S	*	*				150	152.4	119.3	-80.6	-142.7	-18.1	0	0	114.2
560	N	32.9	Very low	32.2	Very low	123 Å²	123	148.8 Å²	148.8	66%	0.658	78%	0.781	S	S	*	*			trans	85.7	140.3	151.1	-67.6	-25.6	0	0	0	118
561	N	30	Very low	32.2	Very low	119 Å²	119	147.1 Å²	147.1	64%	0.636	79%	0.785	S	S	*	*			cis	173.6	146.6	-19.4	-125.7	-29.5	0	0	0	105.4
562	L	33.7	Very low	32.2	Very low	142 Å²	142	144.3 Å²	144.3	74%	0.743	79%	0.786	S	S	*	*			trans	65.2	137	148.6	-60.8	156.3	0	0	0	117.2
563	T	32.3	Very low	32.3	Very low	124 Å²	124	140.1 Å²	140.1	76%	0.761	78%	0.784	S	S	*	*			cis	-175.9	168.7	23	20.4	0	0	0	0	109.8
564	P	35.7	Very low	32.2	Very low	110 Å²	110	138.5 Å²	138.5	71%	0.714	79%	0.787	S	S	*	*			trans	-105.2	155.9	-159.9	38.6	-31.4	0	0	0	114.4
565	K	35.6	Very low	32.1	Very low	218 Å²	218	141.2 Å²	141.2	95%	0.948	79%	0.789	S	S	*	*			trans	-151.1	148.3	155.9	-75.7	-162.4	-179.6	168.3	0	114
566	K	29.2	Very low	32.1	Very low	196 Å²	196	143.4 Å²	143.4	85%	0.852	79%	0.793	S	S	*	*			trans	-71.9	160.9	-167.7	-72.7	170.3	166	175.1	0	116.3
567	S	29	Very low	32	Very low	110 Å²	110	139.9 Å²	139.9	77%	0.769	78%	0.781	S	S	*	*			trans	68.2	126.8	142.2	61.8	0	0	0	0	119.2
568	V	34.8	Very low	31.9	Very low	134 Å²	134	137.9 Å²	137.9	81%	0.812	78%	0.781	S	S	*	*				-165.7	130.8	102.2	155.4	0	0	0	0	109
569	N	27.8	Very low	31.7	Very low	145 Å²	145	140.2 Å²	140.2	78%	0.775	79%	0.793	S	S	*	*			trans	-68.2	149	171.8	-77.3	-26.6	0	0	0	111.9
570	L	34.4	Very low	31.6	Very low	176 Å²	176	139.9 Å²	139.9	92%	0.921	80%	0.797	S	S	*	*			trans	-145	105.8	147.4	-95.8	161	0	0	0	109.1
571	S	27.9	Very low	31.8	Very low	111 Å²	111	138.9 Å²	138.9	78%	0.776	80%	0.797	S	S	*	*			trans	-81.1	145.5	169.1	-55.8	0	0	0	0	110.3
572	S	32.2	Very low	31.8	Very low	127 Å²	127	140.3 Å²	140.3	89%	0.888	81%	0.805	S	S	*	*			trans	-131.3	116.1	153.4	-163.5	0	0	0	0	108.4
573	A	30.8	Very low	31.7	Very low	85 Å²	85	141.5 Å²	141.5	70%	0.702	81%	0.808	S	S	*	*			trans	-97.6	144.4	-179.8	0	0	0	0	0	109.8
574	V	32.9	Very low	31.6	Very low	151 Å²	151	140 Å²	140	92%	0.915	80%	0.802	S	S	*	*			trans	-127.6	119	157.8	176.8	0	0	0	0	107.9
575	M	29.3	Very low	31.3	Very low	166 Å²	166	143.4 Å²	143.4	82%	0.818	81%	0.808	S	S	*	*			trans	-82.8	148.8	-176.8	-70.3	-147.2	-101.7	0	0	112.9
576	I	33.2	Very low	31	Very low	167 Å²	167	137.4 Å²	137.4	86%	0.856	80%	0.799	S	S	*	*			trans	-142.1	136.2	140.8	-58.7	-174.6	0	0	0	108.2
577	P	31.2	Very low	31.2	Very low	109 Å²	109	133.6 Å²	133.6	71%	0.708	80%	0.797	S	S	*	*			trans	-99.7	157.4	-151	37.2	-33.1	0	0	0	116.1
578	V	27.4	Very low	31.2	Very low	136 Å²	136	137.1 Å²	137.1	82%	0.824	80%	0.802	S	S	*	*			trans	-89.1	132.3	166.2	172.7	0	0	0	0	109.6
579	T	34.5	Very low	30.9	Very low	138 Å²	138	135.6 Å²	135.6	85%	0.847	80%	0.803	S	S	*	*			trans	-141.6	128.6	156.4	46.4	0	0	0	0	111.7
580	N	28.7	Very low	31	Very low	150 Å²	150	137.1 Å²	137.1	80%	0.802	81%	0.808	S	S	*	*			trans	-54.9	-172.9	171.9	-98.4	-18.5	0	0	0	115.3
581	P	38.1	Very low	30.8	Very low	103 Å²	103	136.4 Å²	136.4	67%	0.669	80%	0.804	S	S	*	*			cis	-139.4	177.3	-17.9	27	-2.9	0	0	0	115.3
582	N	29.2	Very low	30.9	Very low	149 Å²	149	137.2 Å²	137.2	80%	0.797	80%	0.804	S	S	*	*			trans	13.3	127.7	148.9	-66.2	-23.1	0	0	0	121
583	M	31.3	Very low	30.8	Very low	166 Å²	166	136.5 Å²	136.5	82%	0.818	80%	0.796	S	S	*	*				-173.5	124.9	124.7	-93.3	-82.3	88.4	0	0	112.5
584	C	31.1	Very low	30.8	Very low	92 Å²	92	141.6 Å²	141.6	62%	0.622	80%	0.803	S	S	*	*			trans	36.3	116.2	146.1	-66.4	0	0	0	0	123.9
585	Q	28.5	Very low	30.8	Very low	183 Å²	183	140.9 Å²	140.9	86%	0.855	80%	0.801	S	S	*	*				66.4	128.8	118.2	-68.2	-176.3	-4.9	0	0	122.5
586	A	29.8	Very low	30.9	Very low	91 Å²	91	137.7 Å²	137.7	75%	0.752	80%	0.795	S	S	*	*			trans	78.3	103.2	146.5	0	0	0	0	0	118.1
587	S	32.4	Very low	30.8	Very low	116 Å²	116	135.2 Å²	135.2	81%	0.811	78%	0.784	S	S	*	*				-177.1	116.3	112	-78.2	0	0	0	0	112.9
588	Q	30.3	Very low	30.7	Very low	185 Å²	185	133.8 Å²	133.8	86%	0.864	78%	0.776	S	S	*	*			trans	56.3	107.5	145.6	-65.6	-176.8	5.6	0	0	120.2	M590	Q588-M590 PolarHBondContact O-N 2.71Å
589	A	28	Very low	30.9	Very low	102 Å²	102	136 Å²	136	84%	0.843	78%	0.782	S	S	*	*			trans	-51.3	112.8	154.9	0	0	0	0	0	111.8
590	M	29.8	Very low	31.1	Very low	177 Å²	177	133.2 Å²	133.2	87%	0.872	77%	0.765	S	S	*	*			trans	-91.6	107.7	155.1	-78.9	-114.1	87.2	0	0	107.8	Q588 V592	Q588-M590 PolarHBondContact O-N 2.71Å; M590-V592 PolarHBondContact O-N 2.9Å; M590-V592 VanDerWaalsContact O-N 3.13Å
591	L	29.6	Very low	31.3	Very low	160 Å²	160	130.2 Å²	130.2	84%	0.838	76%	0.756	S	S	*	*			trans	-48.7	111	167.2	-85.3	137	0	0	0	110.7
592	V	31	Very low	31.2	Very low	129 Å²	129	130.5 Å²	130.5	78%	0.782	76%	0.756	S	S	*	*	P	Polyproline II helix	trans	-72.8	121.7	160.6	177.8	0	0	0	0	107.1	M590 K594	M590-V592 PolarHBondContact O-N 2.9Å; M590-V592 VanDerWaalsContact O-N 3.13Å; V592-K594 PolarHBondContact O-N 2.93Å
593	P	29.2	Very low	31.7	Very low	112 Å²	112	128.6 Å²	128.6	73%	0.727	74%	0.742	S	S	*	*	P	Polyproline II helix	trans	-70.1	125.4	177.6	-4.7	19.5	0	0	0	109.4
594	K	31.3	Very low	32	Very low	192 Å²	192	131.4 Å²	131.4	84%	0.835	74%	0.743	S	S	*	*	P	Polyproline II helix	trans	-51.9	133.3	163.5	-68.6	177.1	175.7	177.9	0	108.9	V592 S596	V592-K594 PolarHBondContact O-N 2.93Å; K594-S596 PolarHBondContact O-N 3.1Å
595	P	32.7	Very low	32.1	Very low	136 Å²	136	131.5 Å²	131.5	88%	0.883	74%	0.737	S	S	*	*			trans	-71.6	98	168.3	28.8	-29.5	0	0	0	108.1
596	S	31.2	Very low	32.5	Very low	98 Å²	98	131.9 Å²	131.9	69%	0.685	73%	0.731	S	S	*	*			trans	-77.3	129.3	166.9	54.9	0	0	0	0	110.2	K594	K594-S596 PolarHBondContact O-N 3.1Å
597	N	31.7	Very low	32.9	Very low	116 Å²	116	135.9 Å²	135.9	62%	0.62	73%	0.726	S	S	*	*	S	Bend	trans	74.1	115.8	147.7	-68.2	-9.9	0	0	0	120.8	E214	E214-N597 PolarHBondContact OE2-ND2 3.29Å
598	S	29.4	Very low	33	Very low	79 Å²	79	139.3 Å²	139.3	55%	0.552	73%	0.727	S	S	*	*			trans	59.4	95.8	140.5	76.6	0	0	0	0	118.6
599	L	31.9	Very low	33.1	Very low	183 Å²	183	136.8 Å²	136.8	96%	0.958	72%	0.719	S	S	*	*			trans	-116.6	84.9	152.4	-72.1	172.6	0	0	0	109	S601	L599-S601 PolarHBondContact O-N 3.31Å
600	V	37	Very low	33.4	Very low	79 Å²	79	135.9 Å²	135.9	48%	0.479	71%	0.711	S	S	.	*			trans	-78.5	112.1	159.5	167.9	0	0	0	0	107.1	R211 T602	R211-V600 VanDerWaalsContact NH2-CG2 3.32Å; V600-T602 PolarHBondContact O-N 3.12Å; V600-T602 VanDerWaalsContact O-N 3.08Å
601	S	34.6	Very low	33.5	Very low	87 Å²	87	138.1 Å²	138.1	61%	0.608	71%	0.709	S	S	*	*			trans	-41.8	106.1	175.7	175.7	0	0	0	0	113.3	L599 H603	L599-S601 PolarHBondContact O-N 3.31Å; S601-H603 VanDerWaalsContact C-N 3.33Å; S601-H603 PolarHBondContact O-N 3.45Å; S601-H603 PolarHBondContact OG-CD2 3.24Å
602	T	34.6	Very low	33.8	Very low	109 Å²	109	136.2 Å²	136.2	67%	0.669	71%	0.707	S	S	*	*			trans	-89.2	65.8	167.9	52.1	0	0	0	0	109.9	V600 R604	V600-T602 PolarHBondContact O-N 3.12Å; V600-T602 VanDerWaalsContact O-N 3.08Å; T602-R604 VanDerWaalsContact C-N 3.33Å; T602-R604 PolarHBondContact O-N 3.34Å
603	H	39.6	Very low	33.8	Very low	109 Å²	109	141.9 Å²	141.9	51%	0.505	72%	0.716	S	S	.	*	T	Hydrogen-bonded Turn	trans	-82.3	6.1	-176.9	-105.9	-107.9	0	0	0	115.6	S601	S601-H603 VanDerWaalsContact C-N 3.33Å; S601-H603 PolarHBondContact O-N 3.45Å; S601-H603 PolarHBondContact OG-CD2 3.24Å
604	R	37.6	Very low	33.7	Very low	225 Å²	225	139.8 Å²	139.8	85%	0.849	71%	0.714	S	S	*	*	T	Hydrogen-bonded Turn	trans	-98.9	-20.9	-175.2	-80.1	-173.2	176.2	-168.7	-1.4	116.2	T602	T602-R604 VanDerWaalsContact C-N 3.33Å; T602-R604 PolarHBondContact O-N 3.34Å
605	L	34.1	Very low	33.7	Very low	93 Å²	93	136.6 Å²	136.6	49%	0.487	71%	0.711	S	S	.	*	S	Bend	trans	-87.1	-29.1	-173.7	-82.9	163.1	0	0	0	114.2	V660	L605-V660 HydrophobicContact CD2-CG1 4.03Å
606	W	35.8	Very low	33.4	Very low	191 Å²	191	137 Å²	137	72%	0.723	71%	0.711	S	S	*	*	G	3₁₀ helix	trans	-79	-22.6	-176.2	-71.7	98.5	0	0	0	114.1	K608 L609	W606-K608 PolarHBondContact O-N 3.4Å; W606-L609 PolarHBondContact O-N 2.78Å
607	R	38.3	Very low	33.2	Very low	175 Å²	175	139.7 Å²	139.7	66%	0.66	72%	0.717	S	S	*	*	G	3₁₀ helix	trans	-62.3	-13.7	178.2	-96.3	-168.8	-94	-169.9	-14	115.1
608	K	35.2	Very low	33	Very low	189 Å²	189	142.4 Å²	142.4	82%	0.822	73%	0.726	S	S	*	*	G	3₁₀ helix	trans	-98.3	-12.2	-179.5	-77.8	-165.6	175.2	-173.2	0	115.3	W606	W606-K608 PolarHBondContact O-N 3.4Å
609	L	33.6	Very low	33	Very low	132 Å²	132	144.2 Å²	144.2	69%	0.691	74%	0.736	S	S	*	*	T	Hydrogen-bonded Turn	trans	-104.5	-18.7	-175.6	-70	172.8	0	0	0	114.1	W606	W606-L609 PolarHBondContact O-N 2.78Å
610	A	33.8	Very low	32.9	Very low	82 Å²	82	140.7 Å²	140.7	68%	0.678	73%	0.727	S	S	*	*			trans	-103.8	84.6	174.5	0	0	0	0	0	110.1
611	R	32.4	Very low	32.5	Very low	224 Å²	224	145.6 Å²	145.6	85%	0.845	74%	0.744	S	S	*	*			trans	-94.2	123.4	161.7	-82.5	-168.8	-179.3	-159.5	-0.2	108.5	Y613	R611-Y613 PolarHBondContact O-N 3.07Å
612	P	34.9	Very low	32.3	Very low	120 Å²	120	150.8 Å²	150.8	78%	0.779	76%	0.756	S	S	*	*			trans	-68.1	130.1	171.2	-11.9	26.4	0	0	0	110	G614	P612-G614 PolarHBondContact O-N 3.45Å
613	Y	30	Very low	32.1	Very low	248 Å²	248	151 Å²	151	97%	0.973	76%	0.76	S	S	*	*	S	Bend	trans	-67.2	105.7	159.6	-91	-93.6	0	0	0	107.9	R611	R611-Y613 PolarHBondContact O-N 3.07Å
614	G	28.2	Very low	31.5	Very low	68 Å²	68	158 Å²	158	70%	0.701	78%	0.781	S	S	*	*			trans	179.4	32.8	-178	0	0	0	0	0	117.6	P612	P612-G614 PolarHBondContact O-N 3.45Å
615	V	30.8	Very low	31.1	Very low	126 Å²	126	152.7 Å²	152.7	76%	0.764	78%	0.779	S	S	*	*			trans	-137.4	118.9	157.6	-178	0	0	0	0	108.4	L617	V615-L617 PolarHBondContact O-N 2.95Å
616	T	25.9	Very low	31	Very low	143 Å²	143	153.9 Å²	153.9	88%	0.877	79%	0.792	S	S	*	*			trans	-64.4	91.2	174.9	-38.8	0	0	0	0	109.1
617	L	28.4	Very low	30.7	Very low	155 Å²	155	150.2 Å²	150.2	81%	0.812	80%	0.795	S	S	*	*			trans	-84.7	110	164.7	-74.5	171.4	0	0	0	108.6	V615	V615-L617 PolarHBondContact O-N 2.95Å
618	Q	26.3	Very low	30.5	Very low	174 Å²	174	148 Å²	148	81%	0.813	80%	0.801	S	S	*	*			trans	-53.5	125.5	156.8	-83.9	-102.8	-2.9	0	0	109
619	P	29.4	Very low	30.1	Very low	116 Å²	116	146.5 Å²	146.5	75%	0.753	80%	0.802	S	S	*	*			trans	-84.6	111.8	166.8	29.8	-23.5	0	0	0	108.5
620	S	30.5	Very low	30.1	Very low	110 Å²	110	146.5 Å²	146.5	77%	0.769	81%	0.807	S	S	*	*			trans	-76.6	127.9	163.1	72	0	0	0	0	109.3
621	E	27.8	Very low	29.7	Very low	182 Å²	182	147.2 Å²	147.2	85%	0.85	81%	0.808	S	S	*	*			trans	-70.2	123.8	171.4	-62.1	175.8	157	0	0	109.1
622	F	31.1	Very low	29.7	Very low	195 Å²	195	145.8 Å²	145.8	86%	0.855	81%	0.808	S	S	*	*			trans	-140	137.5	148.7	-95.3	-80.9	0	0	0	109.5
623	P	30.3	Very low	29.5	Very low	115 Å²	115	145.1 Å²	145.1	75%	0.747	81%	0.806	S	S	*	*			trans	-85.3	152.1	-163.1	35.1	-33	0	0	0	112.3
624	R	26.5	Very low	29.3	Very low	255 Å²	255	141.3 Å²	141.3	96%	0.962	80%	0.802	S	S	*	*			trans	-67.4	139.2	171.6	-61.8	179	-173.3	-155.3	0.2	110.9
625	S	30.9	Very low	29.6	Very low	113 Å²	113	143.7 Å²	143.7	79%	0.79	81%	0.808	S	S	*	*			trans	-125.4	144.5	150.5	56.4	0	0	0	0	109.4
626	P	30.5	Very low	29.5	Very low	119 Å²	119	145.5 Å²	145.5	77%	0.773	81%	0.814	S	S	*	*			trans	-101.6	169.9	-175.7	38.2	-31.3	0	0	0	113.4
627	S	29.7	Very low	29.9	Very low	113 Å²	113	142.4 Å²	142.4	79%	0.79	81%	0.81	S	S	*	*			trans	80.2	121.4	164.4	72.9	0	0	0	0	117.8
628	V	33.9	Very low	30	Very low	129 Å²	129	143.2 Å²	143.2	78%	0.782	82%	0.815	S	S	*	*				179.5	129.2	92.7	164	0	0	0	0	108.6
629	D	27.9	Very low	30.4	Very low	157 Å²	157	138.1 Å²	138.1	84%	0.84	81%	0.81	S	S	*	*			trans	-72.9	135.6	170	-68.7	-55.8	0	0	0	111.6
630	V	32.9	Very low	30.6	Very low	132 Å²	132	140.6 Å²	140.6	80%	0.8	82%	0.816	S	S	*	*			trans	-148.2	126.9	148	-176	0	0	0	0	109.4
631	S	25.1	Very low	30.6	Very low	98 Å²	98	140.5 Å²	140.5	69%	0.685	82%	0.815	S	S	*	*			trans	-108.8	144.8	171.8	28.8	0	0	0	0	108.9
632	F	32	Very low	31	Very low	193 Å²	193	137.6 Å²	137.6	85%	0.846	82%	0.815	S	S	*	*			trans	179.5	105.1	155	-87.8	-60.2	0	0	0	107.6
633	S	31	Very low	31.3	Very low	106 Å²	106	133.6 Å²	133.6	74%	0.741	81%	0.807	S	S	*	*				84.6	119.1	90.8	67.1	0	0	0	0	115.5
634	N	26.5	Very low	31.6	Very low	168 Å²	168	134.2 Å²	134.2	90%	0.898	80%	0.803	S	S	*	*			trans	-67.3	149.6	173.5	-84.2	-11.7	0	0	0	113.5
635	S	34.4	Very low	32.1	Very low	118 Å²	118	129 Å²	129	83%	0.825	80%	0.795	S	S	*	*			trans	-144	126.3	156	58.1	0	0	0	0	111.2
636	N	29.2	Very low	32.4	Very low	164 Å²	164	135.3 Å²	135.3	88%	0.877	80%	0.801	S	S	*	*			trans	-69.6	152.1	173.1	-72.9	-28.5	0	0	0	112.3
637	G	34.3	Very low	32.6	Very low	78 Å²	78	137 Å²	137	80%	0.804	80%	0.801	S	S	*	*			trans	-152.6	115.4	166.4	0	0	0	0	0	111.4
638	N	30.4	Very low	32.8	Very low	172 Å²	172	137.9 Å²	137.9	92%	0.92	80%	0.796	S	S	*	*			trans	-73.8	159	-179.8	-76.5	-17.8	0	0	0	113.8
639	G	33.8	Very low	32.8	Very low	67 Å²	67	139.4 Å²	139.4	69%	0.691	80%	0.799	S	S	*	*			trans	172	93.8	155.6	0	0	0	0	0	117.5
640	L	34.9	Very low	33.2	Very low	168 Å²	168	136.4 Å²	136.4	88%	0.88	80%	0.796	S	S	*	*			trans	51.2	106.4	136	-63.2	148.5	0	0	0	119.5
641	S	30.4	Very low	33.2	Very low	109 Å²	109	136 Å²	136	76%	0.762	79%	0.789	S	S	*	*				78.4	110.3	80.4	87.1	0	0	0	0	117.6
642	S	36.1	Very low	33.6	Very low	120 Å²	120	137.6 Å²	137.6	84%	0.839	80%	0.797	S	S	*	*			trans	-163	139.2	138.4	-168.7	0	0	0	0	110.8
643	T	36	Very low	33.8	Very low	112 Å²	112	132.4 Å²	132.4	69%	0.687	79%	0.785	S	S	*	*			trans	-70.9	155.9	-174.5	56	0	0	0	0	112.1
644	D	37.8	Very low	34	Very low	127 Å²	127	133.6 Å²	133.6	68%	0.679	79%	0.787	S	S	*	*				-166.9	133	55.7	-94.8	-62	0	0	0	113.5
645	N	36	Very low	34.2	Very low	147 Å²	147	133.5 Å²	133.5	79%	0.786	79%	0.786	S	S	*	*			trans	40.9	103.1	135.5	-64.8	-48.3	0	0	0	123
646	R	38	Very low	34.3	Very low	245 Å²	245	133 Å²	133	93%	0.925	78%	0.78	S	S	*	*				-169.9	105.5	116	-139	170.2	171.8	162.4	-4.4	114.4
647	M	34.6	Very low	34.6	Very low	155 Å²	155	130.5 Å²	130.5	76%	0.764	77%	0.773	S	S	*	*			trans	40	106.6	142.2	-67.2	-173.2	79.3	0	0	123.8
648	L	34.5	Very low	34.7	Very low	130 Å²	130	132.9 Å²	132.9	68%	0.681	77%	0.774	S	S	*	*				82.3	102.2	124.2	-51.9	-177.3	0	0	0	122.4
649	L	32.8	Very low	34.8	Very low	161 Å²	161	134 Å²	134	84%	0.843	77%	0.77	S	S	*	*				53.7	123.6	125.3	-70.7	139.2	0	0	0	118.4
650	A	36.5	Very low	34.6	Very low	94 Å²	94	136.1 Å²	136.1	78%	0.777	77%	0.77	S	S	*	*			cis	-157.9	141.9	47.5	0	0	0	0	0	113
651	D	32.3	Very low	34.5	Very low	125 Å²	125	138.8 Å²	138.8	67%	0.668	77%	0.768	S	S	*	*			trans	-80.5	129.4	177.4	-176.4	-14.2	0	0	0	111.3	S653	D651-S653 VanDerWaalsContact CG-OG 3.27Å; D651-S653 PolarHBondContact O-N 3.12Å; D651-S653 WeakPolarHBondContact OD1-CB 3.35Å; D651-S653 PolarHBondContact OD1-N 3.39Å; D651-S653 PolarHBondContact OD1-OG 3.22Å; D651-S653 PolarHBondContact OD2-OG 2.66Å
652	P	34.2	Very low	34.5	Very low	131 Å²	131	137.5 Å²	137.5	85%	0.851	76%	0.759	S	S	*	*	S	Bend	trans	-93.5	63.1	179.3	38.3	-32.1	0	0	0	111.1
653	S	36.7	Very low	34.3	Very low	83 Å²	83	139 Å²	139	58%	0.58	76%	0.756	S	S	*	*			trans	-130	7.4	177.6	58.3	0	0	0	0	115	D651	D651-S653 VanDerWaalsContact CG-OG 3.27Å; D651-S653 PolarHBondContact O-N 3.12Å; D651-S653 WeakPolarHBondContact OD1-CB 3.35Å; D651-S653 PolarHBondContact OD1-N 3.39Å; D651-S653 PolarHBondContact OD1-OG 3.22Å; D651-S653 PolarHBondContact OD2-OG 2.66Å
654	V	34.6	Very low	34.2	Very low	131 Å²	131	139.4 Å²	139.4	79%	0.794	76%	0.759	S	S	*	*			trans	-126.2	72.7	178.2	-167.8	0	0	0	0	111.2
655	L	31.7	Very low	34.1	Very low	166 Å²	166	140.6 Å²	140.6	87%	0.869	75%	0.754	S	S	*	*			trans	-130.4	123.8	162.1	-74.6	176.9	0	0	0	110.4
656	P	36.5	Very low	34	Very low	107 Å²	107	140.9 Å²	140.9	70%	0.695	76%	0.755	S	S	*	*	P	Polyproline II helix	trans	-70.9	152.4	177.9	30.7	-32.7	0	0	0	110.3
657	P	35.1	Very low	33.8	Very low	113 Å²	113	135.4 Å²	135.4	73%	0.734	75%	0.753	S	S	*	*	P	Polyproline II helix	trans	-62.6	134.3	-178.9	25.8	-33	0	0	0	110.5	K659	P657-K659 PolarHBondContact O-N 3.18Å
658	P	36	Very low	33.9	Very low	127 Å²	127	131.6 Å²	131.6	83%	0.825	75%	0.753	S	S	*	*	P	Polyproline II helix	trans	-73.1	119.3	-177.4	27.8	-30.5	0	0	0	110.3
659	K	33.2	Very low	34	Very low	195 Å²	195	131.3 Å²	131.3	85%	0.848	76%	0.762	S	S	*	*	P	Polyproline II helix	trans	-61.1	129	171	-69.3	175.6	178	173.8	0	110.3	P657 R661	P657-K659 PolarHBondContact O-N 3.18Å; K659-R661 PolarHBondContact O-N 3.28Å
660	V	29.4	Very low	34.2	Very low	112 Å²	112	135.3 Å²	135.3	68%	0.679	77%	0.766	S	S	*	*	P	Polyproline II helix	trans	-62.7	120.4	171	178.9	0	0	0	0	109.4	L605	L605-V660 HydrophobicContact CD2-CG1 4.03Å
661	R	32.9	Very low	34.2	Very low	224 Å²	224	138.8 Å²	138.8	85%	0.845	77%	0.771	S	S	*	*			trans	-133.8	118.8	167.5	-86.2	-172.1	171.4	170.1	-2.3	110.3	K659	K659-R661 PolarHBondContact O-N 3.28Å
662	C	29.1	Very low	34.3	Very low	83 Å²	83	137.8 Å²	137.8	56%	0.561	78%	0.775	S	S	*	*			trans	-77.5	139.2	174.9	-51.5	0	0	0	0	110.5
663	L	32.3	Very low	34.5	Very low	151 Å²	151	141.4 Å²	141.4	79%	0.791	78%	0.777	S	S	*	*			trans	-139.8	115	165	-73.4	176.5	0	0	0	109.8	M216	M216-L663 HydrophobicContact CE-CD1 4.35Å
664	T	33.6	Very low	34.6	Very low	121 Å²	121	144.1 Å²	144.1	74%	0.742	79%	0.789	S	S	*	*			trans	-135.7	118.1	160.2	28.8	0	0	0	0	107.8
665	R	35.8	Very low	34.8	Very low	151 Å²	151	143.8 Å²	143.8	57%	0.57	79%	0.79	S	S	*	*			trans	160.2	132.2	142.5	-97	179.2	169.1	124.9	4.9	110.4
666	D	34.3	Very low	34.7	Very low	154 Å²	154	139.3 Å²	139.3	82%	0.824	78%	0.784	S	S	*	*				-149.3	135.4	120.5	-81	-38.5	0	0	0	104.5
667	C	34	Very low	35.1	Very low	130 Å²	130	140.4 Å²	140.4	88%	0.878	79%	0.791	S	S	*	*				-145.6	135.1	77.3	-64.4	0	0	0	0	113.2
668	G	36.6	Very low	34.9	Very low	74 Å²	74	143.3 Å²	143.3	76%	0.763	80%	0.795	S	S	*	*				71.8	94.1	119.4	0	0	0	0	0	118.9
669	S	35.5	Very low	34.7	Very low	124 Å²	124	143.6 Å²	143.6	87%	0.867	79%	0.789	S	S	*	*			trans	-70.2	134.1	162.6	179.6	0	0	0	0	110.8
670	R	38	Very low	34.8	Very low	246 Å²	246	142.2 Å²	142.2	93%	0.928	79%	0.785	S	S	*	*			trans	-107.2	134.1	162.4	-100.4	-176.5	167.7	179.3	-3.4	108.8
671	D	36.1	Very low	34.8	Very low	166 Å²	166	143.1 Å²	143.1	89%	0.888	79%	0.79	S	S	*	*			trans	-52.8	139.8	-179	-94.8	-46	0	0	0	114
672	S	34.4	Very low	35	Very low	105 Å²	105	138.7 Å²	138.7	73%	0.734	79%	0.788	S	S	*	*			trans	-88.8	111.6	174.1	51.9	0	0	0	0	110.6
673	K	38.1	Very low	35.2	Very low	207 Å²	207	142.4 Å²	142.4	90%	0.9	80%	0.803	S	S	*	*			trans	-175	60.6	157.3	-108.2	175.1	-169.7	-172.7	0	113.1
674	V	39.6	Very low	35.3	Very low	139 Å²	139	138.5 Å²	138.5	84%	0.842	80%	0.799	S	S	*	*			trans	-147.5	125.7	154.9	-172.8	0	0	0	0	108.8
675	P	38.2	Very low	35.4	Very low	125 Å²	125	139.3 Å²	139.3	81%	0.812	80%	0.803	S	S	*	*			trans	-73.8	135.8	178.5	-5.6	22.5	0	0	0	111.1
676	G	30.6	Very low	35.3	Very low	72 Å²	72	136.7 Å²	136.7	74%	0.742	81%	0.808	S	S	*	*			trans	-82	-178.9	177.3	0	0	0	0	0	113.9
677	P	43.8	Very low	35.5	Very low	130 Å²	130	134.4 Å²	134.4	84%	0.844	80%	0.802	S	S	*	*			trans	-113.9	126.7	150.1	21.3	-3.3	0	0	0	110.5
678	Q	30.8	Very low	35.4	Very low	173 Å²	173	134.1 Å²	134.1	81%	0.808	80%	0.796	S	S	*	*			trans	-54.5	153.9	152.9	-71.6	176.8	-15.7	0	0	109.2
679	L	32.9	Very low	35.3	Very low	133 Å²	133	138.8 Å²	138.8	70%	0.696	80%	0.798	S	S	*	*				165.9	134.3	108.2	-82.6	174.3	0	0	0	112.4
680	H	34.3	Very low	35.2	Very low	167 Å²	167	138.2 Å²	138.2	77%	0.773	78%	0.784	S	S	*	*			trans	69.2	114.1	144.5	-72.5	-70	0	0	0	123
681	V	29.9	Very low	34.8	Very low	130 Å²	130	135.2 Å²	135.2	79%	0.788	78%	0.778	S	S	*	*			trans	-59	129.5	152.7	-176.2	0	0	0	0	110.6
682	T	36.2	Very low	34.7	Very low	131 Å²	131	135 Å²	135	80%	0.804	77%	0.772	S	S	*	*			trans	-163.9	126.1	139.5	45.6	0	0	0	0	112.2
683	N	33.7	Very low	34.4	Very low	162 Å²	162	138.3 Å²	138.3	87%	0.866	78%	0.78	S	S	*	*			trans	-0.7	141.5	149.8	-56.2	-31.6	0	0	0	119.9
684	G	34.4	Very low	34.6	Very low	68 Å²	68	133.3 Å²	133.3	70%	0.701	77%	0.769	S	S	*	*			trans	143.3	98.3	142.6	0	0	0	0	0	116.8
685	V	36.9	Very low	34.5	Very low	138 Å²	138	137.1 Å²	137.1	84%	0.836	79%	0.793	S	S	*	*			trans	46.6	110.5	135.4	-165.4	0	0	0	0	119.2
686	S	33.3	Very low	34.3	Very low	97 Å²	97	137.8 Å²	137.8	68%	0.678	79%	0.792	S	S	*	*			trans	-22.7	178.8	146.8	61.4	0	0	0	0	119.3
687	P	37.2	Very low	34.5	Very low	105 Å²	105	141.2 Å²	141.2	68%	0.682	80%	0.795	S	S	*	*			cis	-137.8	-177.6	-28	26.5	-3.5	0	0	0	113.7
688	T	33.6	Very low	33.9	Very low	125 Å²	125	141.8 Å²	141.8	77%	0.767	79%	0.792	S	S	*	*			trans	83.5	142.8	145	3.7	0	0	0	0	118.7
689	Q	34.3	Very low	34.1	Very low	171 Å²	171	140 Å²	140	80%	0.799	79%	0.791	S	S	*	*			trans	83.7	137.8	166.4	-61.7	-169.6	-23.9	0	0	116
690	I	32.8	Very low	34.2	Very low	112 Å²	112	140.4 Å²	140.4	57%	0.574	80%	0.797	S	S	*	*			cis	177.7	148.2	-13.8	-112.3	166.6	0	0	0	101.6
691	F	29.7	Very low	34.2	Very low	183 Å²	183	138.7 Å²	138.7	80%	0.803	80%	0.799	S	S	*	*			trans	63.4	155.2	169	-66.5	-53	0	0	0	114.8
692	Q	34.4	Very low	34.5	Very low	163 Å²	163	139.3 Å²	139.3	76%	0.762	80%	0.799	S	S	*	*			cis	-164.6	136.4	9.8	-129.1	158.2	-50.3	0	0	103.6	P694	Q692-P694 WeakPolarHBondContact O-CD 3.14Å
693	L	27.7	Very low	34.4	Very low	173 Å²	173	139.9 Å²	139.9	91%	0.906	80%	0.799	S	S	*	*			trans	-71.9	142.2	159.2	-82.3	160	0	0	0	108.5
694	P	41.7	Very low	34.4	Very low	103 Å²	103	138.1 Å²	138.1	67%	0.669	79%	0.793	S	S	*	*			trans	-125.3	144.2	149.4	29.6	-13.9	0	0	0	112	Q692	Q692-P694 WeakPolarHBondContact O-CD 3.14Å
695	T	37	Very low	34.4	Very low	219 Å²	219	144.5 Å²	144.5	100%	1.344	80%	0.802	S	S	*	*			trans	70	0	171.2	60.7	0	0	0	0	118.1

Retrieved 695 of 695 residues in 259.5 ms (Link to these results)

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