A0A3Q0KN91_SCHMA Loading...

Neural gene activation protein

AlphaFold DB , UniProt , Accession A0A3Q0KN91, Species SCHMA (Schistosoma mansoni, Blood fluke), Gene n/a, Length 650 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	47.1	Very low	47.6	Very low	176 Å²	176	94.7 Å²	94.7	87%	0.867	52%	0.516	S	S	*	.				0	141.7	0	-73.1	168.9	171.2	0	0	107.7	I6	M1-I6 HydrophobicContact CB-CD1 4.27Å; M1-I6 HydrophobicContact CB-CG1 3.87Å
2	D	51.6	Low	47.7	Very low	95 Å²	95	91.5 Å²	91.5	51%	0.508	50%	0.502	S	S	.	.			trans	-80.1	170.7	167.2	50.2	32.7	0	0	0	110.4	F4 S5 I6	D2-F4 PolarHBondContact O-N 3.15Å; D2-F4 PolarHBondContact OD1-N 3.36Å; D2-S5 PolarHBondContact O-N 3.44Å; D2-S5 WeakPolarHBondContact OD1-CB 3.48Å; D2-S5 PolarHBondContact OD1-N 3.34Å; D2-S5 PolarHBondContact OD1-OG 2.74Å; D2-I6 WeakPolarHBondContact O-CG1 3.41Å; D2-I6 PolarHBondContact O-N 2.92Å; D2-I6 VanDerWaalsContact O-N 3.11Å
3	S	40	Very low	47.3	Very low	104 Å²	104	92.5 Å²	92.5	73%	0.727	50%	0.501	S	S	*	.	H	α-helix	trans	-61.1	-27	179	46.6	0	0	0	0	113	A7	S3-A7 PolarHBondContact O-N 3.1Å
4	F	43.2	Very low	46.8	Very low	146 Å²	146	90.6 Å²	90.6	64%	0.64	50%	0.497	S	S	*	.	H	α-helix	trans	-73.4	-43	178.4	-161.1	-100.8	0	0	0	111.8	D2 I6 A7 N8	D2-F4 PolarHBondContact O-N 3.15Å; D2-F4 PolarHBondContact OD1-N 3.36Å; F4-I6 VanDerWaalsContact C-N 3.29Å; F4-I6 PolarHBondContact O-N 3.22Å; F4-A7 PolarHBondContact O-N 3.43Å; F4-N8 PolarHBondContact O-N 2.86Å; F4-N8 PolarHBondContact O-ND2 3Å
5	S	60.2	Low	46.2	Very low	48 Å²	48	93.5 Å²	93.5	34%	0.336	51%	0.506	S	S	.	.	H	α-helix	trans	-62.9	-36.5	172.2	-58.3	0	0	0	0	112	D2 L9	D2-S5 PolarHBondContact O-N 3.44Å; D2-S5 WeakPolarHBondContact OD1-CB 3.48Å; D2-S5 PolarHBondContact OD1-N 3.34Å; D2-S5 PolarHBondContact OD1-OG 2.74Å; S5-L9 WeakPolarHBondContact O-CB 3.39Å; S5-L9 PolarHBondContact O-N 3.08Å
6	I	45.9	Very low	45.7	Very low	83 Å²	83	98.2 Å²	98.2	43%	0.426	51%	0.514	S	S	.	.	H	α-helix	trans	-70.2	-42.7	178.5	-66.4	166.6	0	0	0	110.8	M1 D2 F4 L9 I10	M1-I6 HydrophobicContact CB-CD1 4.27Å; M1-I6 HydrophobicContact CB-CG1 3.87Å; D2-I6 WeakPolarHBondContact O-CG1 3.41Å; D2-I6 PolarHBondContact O-N 2.92Å; D2-I6 VanDerWaalsContact O-N 3.11Å; F4-I6 VanDerWaalsContact C-N 3.29Å; F4-I6 PolarHBondContact O-N 3.22Å; I6-L9 PolarHBondContact O-N 2.96Å; I6-I10 HydrophobicContact CG2-CD1 3.95Å; I6-I10 WeakPolarHBondContact O-CG1 3.37Å; I6-I10 PolarHBondContact O-N 3.13Å
7	A	42.2	Very low	45.2	Very low	42 Å²	42	100.2 Å²	100.2	35%	0.347	52%	0.524	S	S	.	.	H	α-helix	trans	-58.1	-53.6	173.1	0	0	0	0	0	111.3	S3 F4 L9 I10 D11	S3-A7 PolarHBondContact O-N 3.1Å; F4-A7 PolarHBondContact O-N 3.43Å; A7-L9 PolarHBondContact O-N 3.09Å; A7-L9 VanDerWaalsContact O-N 3.16Å; A7-I10 WeakPolarHBondContact O-CA 3.5Å; A7-I10 WeakPolarHBondContact O-CB 3.39Å; A7-I10 PolarHBondContact O-N 3.17Å; A7-D11 PolarHBondContact O-N 3.09Å
8	N	45.1	Very low	44.7	Very low	75 Å²	75	102.1 Å²	102.1	40%	0.401	54%	0.535	S	S	.	.	H	α-helix	trans	-58.7	-31.4	177.8	-69.5	-19.4	0	0	0	113.3	F4 T12	F4-N8 PolarHBondContact O-N 2.86Å; F4-N8 PolarHBondContact O-ND2 3Å; N8-T12 WeakPolarHBondContact O-CB 3.11Å; N8-T12 WeakPolarHBondContact O-CG2 3.49Å; N8-T12 PolarHBondContact O-N 3.23Å; N8-T12 PolarHBondContact O-OG1 3.23Å
9	L	53.9	Low	44.1	Very low	85 Å²	85	104.4 Å²	104.4	45%	0.445	55%	0.548	S	S	.	.	H	α-helix	trans	-73.3	-35	175.9	-153.5	85.3	0	0	0	112.1	S5 I6 A7 H13	S5-L9 WeakPolarHBondContact O-CB 3.39Å; S5-L9 PolarHBondContact O-N 3.08Å; I6-L9 PolarHBondContact O-N 2.96Å; A7-L9 PolarHBondContact O-N 3.09Å; A7-L9 VanDerWaalsContact O-N 3.16Å; L9-H13 WeakPolarHBondContact O-CB 3.43Å; L9-H13 PolarHBondContact O-CD2 3.5Å; L9-H13 VanDerWaalsContact O-CD2 3.29Å; L9-H13 PolarHBondContact O-N 3.06Å
10	I	49.6	Very low	43.5	Very low	100 Å²	100	107.7 Å²	107.7	51%	0.513	56%	0.56	S	S	.	*	H	α-helix	trans	-69.1	-48.9	174.3	-69.1	165.7	0	0	0	109.3	I6 A7 T12 H13 S14	I6-I10 HydrophobicContact CG2-CD1 3.95Å; I6-I10 WeakPolarHBondContact O-CG1 3.37Å; I6-I10 PolarHBondContact O-N 3.13Å; A7-I10 WeakPolarHBondContact O-CA 3.5Å; A7-I10 WeakPolarHBondContact O-CB 3.39Å; A7-I10 PolarHBondContact O-N 3.17Å; I10-T12 PolarHBondContact O-N 3.12Å; I10-H13 CarbonylContact O-C 3.58Å; I10-H13 PolarHBondContact O-N 2.99Å; I10-H13 VanDerWaalsContact O-N 3.08Å; I10-S14 PolarHBondContact O-N 2.68Å; I10-S14 PolarHBondContact O-OG 3.49Å
11	D	44.8	Very low	42.9	Very low	88 Å²	88	110.7 Å²	110.7	47%	0.471	58%	0.577	S	S	.	*	H	α-helix	trans	-59.5	-48	179.1	-63.3	-32.1	0	0	0	111.5	A7 H13 S14 E15	A7-D11 PolarHBondContact O-N 3.09Å; D11-H13 PolarHBondContact O-N 3.39Å; D11-S14 PolarHBondContact O-N 2.84Å; D11-S14 VanDerWaalsContact O-N 3.08Å; D11-E15 PolarHBondContact O-N 3.46Å
12	T	48.6	Very low	42.1	Very low	56 Å²	56	110.2 Å²	110.2	34%	0.344	57%	0.572	S	S	.	*	H	α-helix	trans	-71	-10.1	177.2	53.9	0	0	0	0	114.8	N8 I10 R16	N8-T12 WeakPolarHBondContact O-CB 3.11Å; N8-T12 WeakPolarHBondContact O-CG2 3.49Å; N8-T12 PolarHBondContact O-N 3.23Å; N8-T12 PolarHBondContact O-OG1 3.23Å; I10-T12 PolarHBondContact O-N 3.12Å; T12-R16 WeakPolarHBondContact O-CD 3.49Å; T12-R16 WeakPolarHBondContact O-CG 3.5Å
13	H	43	Very low	41.1	Very low	105 Å²	105	113.4 Å²	113.4	49%	0.486	58%	0.582	S	S	.	*	H	α-helix	trans	-92.2	-30.9	166	-91.1	-86.7	0	0	0	112.6	L9 I10 D11 I17	L9-H13 WeakPolarHBondContact O-CB 3.43Å; L9-H13 PolarHBondContact O-CD2 3.5Å; L9-H13 VanDerWaalsContact O-CD2 3.29Å; L9-H13 PolarHBondContact O-N 3.06Å; I10-H13 CarbonylContact O-C 3.58Å; I10-H13 PolarHBondContact O-N 2.99Å; I10-H13 VanDerWaalsContact O-N 3.08Å; D11-H13 PolarHBondContact O-N 3.39Å; H13-I17 WeakPolarHBondContact O-CD1 3.4Å; H13-I17 WeakPolarHBondContact O-CG1 3.36Å
14	S	40.3	Very low	40.5	Very low	65 Å²	65	114.3 Å²	114.3	46%	0.455	58%	0.578	S	S	.	*	H	α-helix	trans	-70	-37.9	172.6	-70.7	0	0	0	0	112.9	I10 D11 I17 N18	I10-S14 PolarHBondContact O-N 2.68Å; I10-S14 PolarHBondContact O-OG 3.49Å; D11-S14 PolarHBondContact O-N 2.84Å; D11-S14 VanDerWaalsContact O-N 3.08Å; S14-I17 PolarHBondContact O-N 2.94Å; S14-N18 PolarHBondContact O-ND2 3.17Å
15	E	37.1	Very low	39.7	Very low	134 Å²	134	116.6 Å²	116.6	63%	0.626	59%	0.588	S	S	*	*	H	α-helix	trans	-64.2	-43.8	175.4	-71.5	-178.6	146.6	0	0	111.5	D11 I17 N18	D11-E15 PolarHBondContact O-N 3.46Å; E15-I17 PolarHBondContact O-N 3.38Å; E15-I17 VanDerWaalsContact O-N 3.11Å; E15-N18 PolarHBondContact O-N 3.41Å; E15-N18 VanDerWaalsContact O-N 3.17Å
16	R	37.9	Very low	38	Very low	169 Å²	169	118.2 Å²	118.2	64%	0.638	61%	0.613	S	S	*	*	T	Hydrogen-bonded Turn	trans	-67.3	-11.3	-178.2	-73.4	179.4	-175.6	161.6	5.3	115.5	T12	T12-R16 WeakPolarHBondContact O-CD 3.49Å; T12-R16 WeakPolarHBondContact O-CG 3.5Å
17	I	37.7	Very low	37.1	Very low	132 Å²	132	119.2 Å²	119.2	68%	0.677	63%	0.627	S	S	*	*	T	Hydrogen-bonded Turn	trans	-91.7	-14.4	179	-69.9	169.1	0	0	0	111.6	H13 S14 E15	H13-I17 WeakPolarHBondContact O-CD1 3.4Å; H13-I17 WeakPolarHBondContact O-CG1 3.36Å; S14-I17 PolarHBondContact O-N 2.94Å; E15-I17 PolarHBondContact O-N 3.38Å; E15-I17 VanDerWaalsContact O-N 3.11Å
18	N	36.1	Very low	36.4	Very low	135 Å²	135	126.3 Å²	126.3	72%	0.722	65%	0.653	S	S	*	*	T	Hydrogen-bonded Turn	trans	-99	-7.8	-177.2	-70.8	-73.2	0	0	0	114.8	S14 E15	S14-N18 PolarHBondContact O-ND2 3.17Å; E15-N18 PolarHBondContact O-N 3.41Å; E15-N18 VanDerWaalsContact O-N 3.17Å
19	D	32.7	Very low	35.6	Very low	146 Å²	146	130.5 Å²	130.5	78%	0.781	67%	0.67	S	S	*	*	S	Bend	trans	-97.7	10.1	-175.2	-92.7	-20.7	0	0	0	114.6
20	Q	32.5	Very low	34.3	Very low	169 Å²	169	133.1 Å²	133.1	79%	0.79	69%	0.69	S	S	*	*			trans	-135.9	82.8	-180	-65	-166.9	-89.5	0	0	113.1
21	D	31.9	Very low	33.4	Very low	171 Å²	171	135.7 Å²	135.7	91%	0.914	70%	0.704	S	S	*	*			trans	-152.2	91.1	151.3	-122	-24.4	0	0	0	112.5
22	H	29.1	Very low	32.8	Very low	166 Å²	166	136 Å²	136	77%	0.769	71%	0.705	S	S	*	*			trans	-124.7	128.5	173.9	-150.3	-46.6	0	0	0	107.4
23	F	30.3	Very low	32.1	Very low	162 Å²	162	139.6 Å²	139.6	71%	0.711	72%	0.723	S	S	*	*			trans	86.9	98.5	-179.2	-71.5	-98.3	0	0	0	119.4
24	N	27.6	Very low	31.8	Very low	123 Å²	123	137.8 Å²	137.8	66%	0.658	72%	0.719	S	S	*	*				59.4	123.9	118.9	-88.1	-60.3	0	0	0	121.4
25	K	27.7	Very low	32	Very low	194 Å²	194	137.7 Å²	137.7	84%	0.843	72%	0.719	S	S	*	*			trans	66	92.9	142.1	-63.7	-178.2	178.4	-177.5	0	118.2
26	G	24.1	Very low	32.1	Very low	83 Å²	83	135.8 Å²	135.8	86%	0.856	72%	0.716	S	S	*	*				77.7	78.8	105.1	0	0	0	0	0	117.4
27	S	27.7	Very low	32.2	Very low	103 Å²	103	133 Å²	133	72%	0.72	71%	0.713	S	S	*	*			trans	-149.3	158.5	148.2	55.7	0	0	0	0	109.6	Q29	S27-Q29 PolarHBondContact O-N 3.35Å
28	E	26	Very low	32.5	Very low	191 Å²	191	130.9 Å²	130.9	89%	0.893	70%	0.703	S	S	*	*			trans	-69.2	123.8	171.6	-64.8	154.6	111.5	0	0	109.6
29	Q	28.4	Very low	33.2	Very low	163 Å²	163	128.5 Å²	128.5	76%	0.762	69%	0.694	S	S	*	*			trans	-153.5	107.8	158.2	-127.4	151	97.4	0	0	110.5	S27 L31	S27-Q29 PolarHBondContact O-N 3.35Å; Q29-L31 VanDerWaalsContact C-N 3.34Å; Q29-L31 PolarHBondContact O-N 3.5Å
30	T	27.5	Very low	33.4	Very low	141 Å²	141	127.9 Å²	127.9	87%	0.865	68%	0.684	S	S	*	*			trans	-69.5	89.1	171.4	49.1	0	0	0	0	108.9	D32	T30-D32 PolarHBondContact O-N 2.97Å
31	L	29.8	Very low	34	Very low	154 Å²	154	124.9 Å²	124.9	81%	0.806	67%	0.673	S	S	*	*			trans	-70.1	119.1	175.7	-139.5	77.1	0	0	0	109	Q29 N33	Q29-L31 VanDerWaalsContact C-N 3.34Å; Q29-L31 PolarHBondContact O-N 3.5Å; L31-N33 PolarHBondContact O-N 2.97Å
32	D	32.5	Very low	34.6	Very low	93 Å²	93	119.8 Å²	119.8	50%	0.497	65%	0.65	S	S	.	*			trans	-83.1	117.9	-154.9	-174.7	5.3	0	0	0	112.6	T30 T34 S35	T30-D32 PolarHBondContact O-N 2.97Å; D32-T34 VanDerWaalsContact CG-CB 3.48Å; D32-T34 VanDerWaalsContact CG-OG1 3.3Å; D32-T34 PolarHBondContact O-N 3.23Å; D32-T34 VanDerWaalsContact O-N 3.12Å; D32-T34 WeakPolarHBondContact OD1-CB 3.49Å; D32-T34 PolarHBondContact OD1-N 2.93Å; D32-T34 PolarHBondContact OD1-OG1 3.22Å; D32-T34 VanDerWaalsContact OD2-CB 3.3Å; D32-T34 WeakPolarHBondContact OD2-CB 3.49Å; D32-T34 PolarHBondContact OD2-OG1 2.82Å; D32-S35 VanDerWaalsContact O-CB 3.24Å; D32-S35 WeakPolarHBondContact O-CB 3.32Å; D32-S35 PolarHBondContact O-N 3.14Å; D32-S35 PolarHBondContact O-OG 2.95Å
33	N	33.9	Very low	35.1	Very low	133 Å²	133	117.1 Å²	117.1	71%	0.711	64%	0.641	S	S	*	*	T	Hydrogen-bonded Turn	trans	-59.2	-20.1	173.4	-81	-32.1	0	0	0	112.9	L31 S35 V36	L31-N33 PolarHBondContact O-N 2.97Å; N33-S35 PolarHBondContact O-N 2.84Å; N33-V36 PolarHBondContact O-N 2.93Å
34	T	37.1	Very low	35.6	Very low	66 Å²	66	113.6 Å²	113.6	41%	0.405	63%	0.633	S	S	.	*	H	α-helix	trans	-61.5	-21.6	171.5	-40.8	0	0	0	0	111.9	D32 N38	D32-T34 VanDerWaalsContact CG-CB 3.48Å; D32-T34 VanDerWaalsContact CG-OG1 3.3Å; D32-T34 PolarHBondContact O-N 3.23Å; D32-T34 VanDerWaalsContact O-N 3.12Å; D32-T34 WeakPolarHBondContact OD1-CB 3.49Å; D32-T34 PolarHBondContact OD1-N 2.93Å; D32-T34 PolarHBondContact OD1-OG1 3.22Å; D32-T34 VanDerWaalsContact OD2-CB 3.3Å; D32-T34 WeakPolarHBondContact OD2-CB 3.49Å; D32-T34 PolarHBondContact OD2-OG1 2.82Å; T34-N38 WeakPolarHBondContact O-CB 3.4Å; T34-N38 PolarHBondContact O-N 3.49Å; T34-N38 PolarHBondContact O-ND2 2.96Å
35	S	43.8	Very low	36.2	Very low	64 Å²	64	111.6 Å²	111.6	45%	0.448	63%	0.629	S	S	.	*	H	α-helix	trans	-62	-50.6	174.8	62.4	0	0	0	0	112.9	D32 N33 L37 N38 T39	D32-S35 VanDerWaalsContact O-CB 3.24Å; D32-S35 WeakPolarHBondContact O-CB 3.32Å; D32-S35 PolarHBondContact O-N 3.14Å; D32-S35 PolarHBondContact O-OG 2.95Å; N33-S35 PolarHBondContact O-N 2.84Å; S35-L37 VanDerWaalsContact C-N 3.35Å; S35-L37 PolarHBondContact O-N 2.96Å; S35-N38 PolarHBondContact O-N 3.48Å; S35-T39 PolarHBondContact O-N 2.91Å; S35-T39 PolarHBondContact O-OG1 3.1Å; S35-T39 VanDerWaalsContact O-OG1 3.13Å
36	V	40.3	Very low	36.6	Very low	93 Å²	93	108.8 Å²	108.8	56%	0.564	62%	0.622	S	S	*	*	H	α-helix	trans	-63.3	-42.3	179.8	-179.4	0	0	0	0	110.8	N33 T39 F40	N33-V36 PolarHBondContact O-N 2.93Å; V36-T39 PolarHBondContact O-N 3.27Å; V36-F40 PolarHBondContact O-N 3.11Å
37	L	40.2	Very low	37.1	Very low	111 Å²	111	109 Å²	109	58%	0.581	61%	0.61	S	S	*	*	H	α-helix	trans	-64.8	-41.1	175.2	-73	168.6	0	0	0	112.1	S35 T39 F40 L41	S35-L37 VanDerWaalsContact C-N 3.35Å; S35-L37 PolarHBondContact O-N 2.96Å; L37-T39 PolarHBondContact O-N 3.45Å; L37-F40 WeakPolarHBondContact O-CB 3.28Å; L37-F40 PolarHBondContact O-N 3.12Å; L37-L41 WeakPolarHBondContact O-CB 3.44Å; L37-L41 WeakPolarHBondContact O-CG 3.37Å; L37-L41 PolarHBondContact O-N 3.34Å
38	N	43.5	Very low	37.4	Very low	88 Å²	88	109.1 Å²	109.1	47%	0.471	61%	0.611	S	S	.	*	H	α-helix	trans	-66.1	-34.3	174.5	-79.4	-28.5	0	0	0	112.5	T34 S35 S42	T34-N38 WeakPolarHBondContact O-CB 3.4Å; T34-N38 PolarHBondContact O-N 3.49Å; T34-N38 PolarHBondContact O-ND2 2.96Å; S35-N38 PolarHBondContact O-N 3.48Å; N38-S42 VanDerWaalsContact O-CB 3.27Å; N38-S42 WeakPolarHBondContact O-CB 3.23Å; N38-S42 PolarHBondContact O-N 3.42Å; N38-S42 PolarHBondContact O-OG 3.17Å
39	T	49.9	Very low	37.9	Very low	85 Å²	85	109.3 Å²	109.3	52%	0.521	61%	0.609	S	S	.	*	H	α-helix	trans	-64.7	-43.8	170.4	-56.5	0	0	0	0	111.1	S35 V36 L37 S42 L43	S35-T39 PolarHBondContact O-N 2.91Å; S35-T39 PolarHBondContact O-OG1 3.1Å; S35-T39 VanDerWaalsContact O-OG1 3.13Å; V36-T39 PolarHBondContact O-N 3.27Å; L37-T39 PolarHBondContact O-N 3.45Å; T39-S42 PolarHBondContact O-N 2.89Å; T39-L43 HydrophobicContact CG2-CD1 4.33Å; T39-L43 WeakPolarHBondContact O-CG 3.47Å; T39-L43 PolarHBondContact O-N 3.32Å
40	F	38.4	Very low	38.2	Very low	133 Å²	133	108.4 Å²	108.4	58%	0.583	61%	0.61	S	S	*	*	H	α-helix	trans	-60.1	-47.7	175.2	-120.6	-97.3	0	0	0	112.4	V36 L37 S42 L43 T44	V36-F40 PolarHBondContact O-N 3.11Å; L37-F40 WeakPolarHBondContact O-CB 3.28Å; L37-F40 PolarHBondContact O-N 3.12Å; F40-S42 PolarHBondContact O-N 3.33Å; F40-L43 PolarHBondContact O-N 2.88Å; F40-T44 PolarHBondContact O-N 3.29Å
41	L	44.2	Very low	38.5	Very low	106 Å²	106	108.4 Å²	108.4	56%	0.555	60%	0.604	S	S	*	*	H	α-helix	trans	-62.8	-40.9	177	-71.9	166.5	0	0	0	111.6	L37 L43 T44 S45	L37-L41 WeakPolarHBondContact O-CB 3.44Å; L37-L41 WeakPolarHBondContact O-CG 3.37Å; L37-L41 PolarHBondContact O-N 3.34Å; L41-L43 PolarHBondContact O-N 3.49Å; L41-T44 WeakPolarHBondContact CA-OG1 3.37Å; L41-T44 PolarHBondContact O-N 2.85Å; L41-T44 PolarHBondContact O-OG1 3.08Å; L41-S45 PolarHBondContact O-N 3.38Å
42	S	45.7	Very low	38.9	Very low	63 Å²	63	108.5 Å²	108.5	44%	0.441	61%	0.606	S	S	.	*	H	α-helix	trans	-60.3	-43.6	174.8	-62.1	0	0	0	0	112	N38 T39 F40 T44 S45 L46	N38-S42 VanDerWaalsContact O-CB 3.27Å; N38-S42 WeakPolarHBondContact O-CB 3.23Å; N38-S42 PolarHBondContact O-N 3.42Å; N38-S42 PolarHBondContact O-OG 3.17Å; T39-S42 PolarHBondContact O-N 2.89Å; F40-S42 PolarHBondContact O-N 3.33Å; S42-T44 VanDerWaalsContact C-N 3.34Å; S42-T44 PolarHBondContact O-N 3.47Å; S42-S45 PolarHBondContact O-N 3.47Å; S42-S45 PolarHBondContact O-OG 3.15Å; S42-L46 WeakPolarHBondContact O-CG 3.49Å; S42-L46 PolarHBondContact O-N 3.46Å
43	L	37.8	Very low	39.1	Very low	111 Å²	111	109.5 Å²	109.5	58%	0.581	61%	0.611	S	S	*	*	H	α-helix	trans	-63.4	-36.8	175.8	-70.6	167.4	0	0	0	112.4	T39 F40 L41	T39-L43 HydrophobicContact CG2-CD1 4.33Å; T39-L43 WeakPolarHBondContact O-CG 3.47Å; T39-L43 PolarHBondContact O-N 3.32Å; F40-L43 PolarHBondContact O-N 2.88Å; L41-L43 PolarHBondContact O-N 3.49Å
44	T	41	Very low	39.4	Very low	88 Å²	88	110.6 Å²	110.6	54%	0.54	61%	0.612	S	S	.	*	H	α-helix	trans	-67.7	-39.9	173	56.1	0	0	0	0	113	F40 L41 S42 L46 S47	F40-T44 PolarHBondContact O-N 3.29Å; L41-T44 WeakPolarHBondContact CA-OG1 3.37Å; L41-T44 PolarHBondContact O-N 2.85Å; L41-T44 PolarHBondContact O-OG1 3.08Å; S42-T44 VanDerWaalsContact C-N 3.34Å; S42-T44 PolarHBondContact O-N 3.47Å; T44-L46 VanDerWaalsContact C-N 3.29Å; T44-L46 PolarHBondContact O-N 2.86Å; T44-S47 PolarHBondContact O-N 3.46Å
45	S	40.5	Very low	39.6	Very low	81 Å²	81	114.1 Å²	114.1	57%	0.566	63%	0.628	S	S	*	*	H	α-helix	trans	-64	-32.7	179.2	77.4	0	0	0	0	113.5	L41 S42 S47 S48	L41-S45 PolarHBondContact O-N 3.38Å; S42-S45 PolarHBondContact O-N 3.47Å; S42-S45 PolarHBondContact O-OG 3.15Å; S45-S47 VanDerWaalsContact C-N 3.26Å; S45-S47 PolarHBondContact O-N 3.43Å; S45-S48 PolarHBondContact O-N 3.4Å
46	L	36.2	Very low	39.5	Very low	134 Å²	134	116 Å²	116	70%	0.702	63%	0.633	S	S	*	*	T	Hydrogen-bonded Turn	trans	-70	-17.4	-178.9	-79	164.1	0	0	0	113.9	S42 T44	S42-L46 WeakPolarHBondContact O-CG 3.49Å; S42-L46 PolarHBondContact O-N 3.46Å; T44-L46 VanDerWaalsContact C-N 3.29Å; T44-L46 PolarHBondContact O-N 2.86Å
47	S	35.8	Very low	39.4	Very low	87 Å²	87	114.5 Å²	114.5	61%	0.608	62%	0.624	S	S	*	*	T	Hydrogen-bonded Turn	trans	-80.5	-19.4	179	-151.5	0	0	0	0	113.7	T44 S45 K49 N50	T44-S47 PolarHBondContact O-N 3.46Å; S45-S47 VanDerWaalsContact C-N 3.26Å; S45-S47 PolarHBondContact O-N 3.43Å; S47-K49 PolarHBondContact O-N 3.43Å; S47-N50 PolarHBondContact O-N 3.35Å
48	S	33.2	Very low	39.4	Very low	106 Å²	106	112.3 Å²	112.3	74%	0.741	62%	0.618	S	S	*	*	T	Hydrogen-bonded Turn	trans	-73.4	23.4	-173.4	-158.7	0	0	0	0	115.2	S45	S45-S48 PolarHBondContact O-N 3.4Å
49	K	37.4	Very low	39.2	Very low	195 Å²	195	113 Å²	113	85%	0.848	62%	0.618	S	S	*	*	T	Hydrogen-bonded Turn	trans	-130.5	7.7	-178.6	-76.6	-175.1	175.9	175.3	0	114.6	S47	S47-K49 PolarHBondContact O-N 3.43Å
50	N	34.5	Very low	38.8	Very low	145 Å²	145	114.1 Å²	114.1	78%	0.775	62%	0.621	S	S	*	*			trans	-130.1	80	-177.4	-139.8	-12.2	0	0	0	112.3	S47 N52	S47-N50 PolarHBondContact O-N 3.35Å; N50-N52 PolarHBondContact O-N 3.48Å
51	N	32.7	Very low	38.8	Very low	140 Å²	140	112.8 Å²	112.8	75%	0.749	62%	0.616	S	S	*	*	T	Hydrogen-bonded Turn	trans	-57.8	116.2	174.4	-62.5	-15	0	0	0	110
52	N	37.7	Very low	38.9	Very low	157 Å²	157	110.2 Å²	110.2	84%	0.84	61%	0.607	S	S	*	*	T	Hydrogen-bonded Turn	trans	171.6	-10.1	152.2	-91	-27.6	0	0	0	115	N50	N50-N52 PolarHBondContact O-N 3.48Å
53	N	38.2	Very low	38.9	Very low	114 Å²	114	112.5 Å²	112.5	61%	0.61	61%	0.609	S	S	*	*			trans	-116	32.9	-167.9	-88.1	-36.1	0	0	0	116.4	N55 N56	N53-N55 PolarHBondContact O-N 2.85Å; N53-N56 PolarHBondContact O-N 3.19Å; N53-N56 VanDerWaalsContact O-N 3.1Å
54	H	38.9	Very low	38.9	Very low	155 Å²	155	111.7 Å²	111.7	72%	0.718	61%	0.605	S	S	*	*	H	α-helix	trans	-51.3	-35.2	-174.8	-95.4	-63.3	0	0	0	115.5	N56 V57 S58	H54-N56 VanDerWaalsContact C-N 3.26Å; H54-N56 PolarHBondContact O-N 3.07Å; H54-V57 PolarHBondContact O-N 3.38Å; H54-S58 PolarHBondContact O-N 3.4Å
55	N	41.3	Very low	39	Very low	141 Å²	141	111.8 Å²	111.8	75%	0.754	60%	0.601	S	S	*	*	H	α-helix	trans	-70.2	-18.3	-176.6	-64.5	-4.4	0	0	0	114.2	N53	N53-N55 PolarHBondContact O-N 2.85Å
56	N	41.4	Very low	39.1	Very low	103 Å²	103	112.1 Å²	112.1	55%	0.551	60%	0.597	S	S	*	*	H	α-helix	trans	-91.6	-26.1	175.6	-70.8	-28.5	0	0	0	112.2	N53 H54 H59 L60	N53-N56 PolarHBondContact O-N 3.19Å; N53-N56 VanDerWaalsContact O-N 3.1Å; H54-N56 VanDerWaalsContact C-N 3.26Å; H54-N56 PolarHBondContact O-N 3.07Å; N56-H59 PolarHBondContact O-N 3.01Å; N56-L60 PolarHBondContact O-N 2.77Å
57	V	38.8	Very low	39.1	Very low	62 Å²	62	110.4 Å²	110.4	38%	0.376	59%	0.588	S	S	.	*	H	α-helix	trans	-67.9	-48.3	-179.9	-179.6	0	0	0	0	110.1	H54 H59 L60 E61	H54-V57 PolarHBondContact O-N 3.38Å; V57-H59 PolarHBondContact O-N 3.13Å; V57-L60 CarbonylContact O-C 3.56Å; V57-L60 WeakPolarHBondContact O-CA 3.42Å; V57-L60 WeakPolarHBondContact O-CB 3.41Å; V57-L60 PolarHBondContact O-N 2.84Å; V57-E61 HydrophobicContact CG1-CG 4.14Å; V57-E61 WeakPolarHBondContact O-CG 3.38Å; V57-E61 PolarHBondContact O-N 3.05Å
58	S	40.4	Very low	39	Very low	64 Å²	64	109.3 Å²	109.3	45%	0.448	58%	0.58	S	S	.	*	H	α-helix	trans	-62.7	-27.7	178.6	58.1	0	0	0	0	114	H54 E61 S62	H54-S58 PolarHBondContact O-N 3.4Å; S58-E61 WeakPolarHBondContact CA-OE2 3.24Å; S58-S62 WeakPolarHBondContact O-CB 3.22Å; S58-S62 PolarHBondContact O-N 3.22Å; S58-S62 PolarHBondContact O-OG 2.97Å
59	H	39.8	Very low	39.2	Very low	104 Å²	104	110.9 Å²	110.9	48%	0.481	57%	0.573	S	S	.	*	H	α-helix	trans	-78.2	-25.2	173.3	-167.6	61	0	0	0	113.3	N56 V57 S62 K63	N56-H59 PolarHBondContact O-N 3.01Å; V57-H59 PolarHBondContact O-N 3.13Å; H59-S62 WeakPolarHBondContact CA-OG 3.42Å; H59-S62 PolarHBondContact O-OG 3.44Å; H59-K63 WeakPolarHBondContact NE2-CE 3.19Å; H59-K63 PolarHBondContact NE2-NZ 3.31Å; H59-K63 WeakPolarHBondContact O-CG 3.49Å; H59-K63 PolarHBondContact O-N 3.28Å
60	L	41.1	Very low	39.2	Very low	108 Å²	108	108.2 Å²	108.2	57%	0.565	57%	0.568	S	S	*	*	H	α-helix	trans	-79.5	-43	169.9	-82.5	163.3	0	0	0	111.4	N56 V57 K63 L64	N56-L60 PolarHBondContact O-N 2.77Å; V57-L60 CarbonylContact O-C 3.56Å; V57-L60 WeakPolarHBondContact O-CA 3.42Å; V57-L60 WeakPolarHBondContact O-CB 3.41Å; V57-L60 PolarHBondContact O-N 2.84Å; L60-K63 CarbonylContact O-C 3.55Å; L60-K63 PolarHBondContact O-N 2.96Å; L60-L64 WeakPolarHBondContact O-CB 3.27Å; L60-L64 WeakPolarHBondContact O-CG 3.31Å; L60-L64 PolarHBondContact O-N 3.19Å
61	E	39	Very low	39.1	Very low	104 Å²	104	107.2 Å²	107.2	49%	0.486	56%	0.562	S	S	.	*	H	α-helix	trans	-59	-48.5	174.6	-71	170.7	147.2	0	0	111.1	V57 S58 K63 L64 I65	V57-E61 HydrophobicContact CG1-CG 4.14Å; V57-E61 WeakPolarHBondContact O-CG 3.38Å; V57-E61 PolarHBondContact O-N 3.05Å; S58-E61 WeakPolarHBondContact CA-OE2 3.24Å; E61-K63 VanDerWaalsContact C-N 3.26Å; E61-K63 PolarHBondContact O-N 3.41Å; E61-L64 PolarHBondContact O-N 2.84Å; E61-I65 VanDerWaalsContact O-CB 3.28Å; E61-I65 WeakPolarHBondContact O-CB 3.41Å; E61-I65 WeakPolarHBondContact O-CD1 3.36Å; E61-I65 WeakPolarHBondContact O-CG1 3.49Å; E61-I65 PolarHBondContact O-N 3.43Å
62	S	44.7	Very low	39	Very low	53 Å²	53	105.3 Å²	105.3	37%	0.371	56%	0.559	S	S	.	*	H	α-helix	trans	-65.3	-25.4	176.9	51.1	0	0	0	0	113.9	S58 H59 N66	S58-S62 WeakPolarHBondContact O-CB 3.22Å; S58-S62 PolarHBondContact O-N 3.22Å; S58-S62 PolarHBondContact O-OG 2.97Å; H59-S62 WeakPolarHBondContact CA-OG 3.42Å; H59-S62 PolarHBondContact O-OG 3.44Å; S62-N66 VanDerWaalsContact O-CG 3.3Å; S62-N66 PolarHBondContact O-N 2.67Å; S62-N66 PolarHBondContact O-ND2 3.11Å
63	K	46.6	Very low	38.7	Very low	111 Å²	111	105.6 Å²	105.6	48%	0.483	56%	0.56	S	S	.	*	H	α-helix	trans	-77.7	-41.7	169.9	-83.1	172.7	168	165.6	0	112.4	H59 L60 E61 I65 N66 L67	H59-K63 WeakPolarHBondContact NE2-CE 3.19Å; H59-K63 PolarHBondContact NE2-NZ 3.31Å; H59-K63 WeakPolarHBondContact O-CG 3.49Å; H59-K63 PolarHBondContact O-N 3.28Å; L60-K63 CarbonylContact O-C 3.55Å; L60-K63 PolarHBondContact O-N 2.96Å; E61-K63 VanDerWaalsContact C-N 3.26Å; E61-K63 PolarHBondContact O-N 3.41Å; K63-I65 VanDerWaalsContact C-N 3.35Å; K63-N66 PolarHBondContact O-N 3.12Å; K63-L67 VanDerWaalsContact O-CD1 3.26Å; K63-L67 WeakPolarHBondContact O-CD1 3.47Å; K63-L67 PolarHBondContact O-N 3.24Å
64	L	37.5	Very low	38.1	Very low	94 Å²	94	108.1 Å²	108.1	49%	0.492	57%	0.57	S	S	.	*	H	α-helix	trans	-67.4	-33.5	176.5	-74	165	0	0	0	112.2	L60 E61 N66 S68	L60-L64 WeakPolarHBondContact O-CB 3.27Å; L60-L64 WeakPolarHBondContact O-CG 3.31Å; L60-L64 PolarHBondContact O-N 3.19Å; E61-L64 PolarHBondContact O-N 2.84Å; L64-N66 VanDerWaalsContact C-N 3.28Å; L64-S68 VanDerWaalsContact O-CB 3.28Å; L64-S68 WeakPolarHBondContact O-CB 3.49Å; L64-S68 PolarHBondContact O-N 2.83Å; L64-S68 PolarHBondContact O-OG 2.87Å
65	I	43.6	Very low	37.7	Very low	90 Å²	90	108 Å²	108	46%	0.462	58%	0.575	S	S	.	*	H	α-helix	trans	-71.5	-22.3	173.3	-71.8	165.2	0	0	0	112	E61 K63 S68 K69	E61-I65 VanDerWaalsContact O-CB 3.28Å; E61-I65 WeakPolarHBondContact O-CB 3.41Å; E61-I65 WeakPolarHBondContact O-CD1 3.36Å; E61-I65 WeakPolarHBondContact O-CG1 3.49Å; E61-I65 PolarHBondContact O-N 3.43Å; K63-I65 VanDerWaalsContact C-N 3.35Å; I65-S68 WeakPolarHBondContact CA-OG 3.4Å; I65-S68 PolarHBondContact O-OG 3.46Å; I65-K69 VanDerWaalsContact O-CD 3.24Å; I65-K69 WeakPolarHBondContact O-CD 3.41Å; I65-K69 WeakPolarHBondContact O-CE 3.42Å; I65-K69 VanDerWaalsContact O-CG 3.25Å; I65-K69 WeakPolarHBondContact O-CG 3.37Å
66	N	41.7	Very low	36.9	Very low	88 Å²	88	106.8 Å²	106.8	47%	0.471	57%	0.568	S	S	.	*	H	α-helix	trans	-85	-46.1	170.7	-71.1	-13.6	0	0	0	110.6	S62 K63 L64 S68 K69 D70	S62-N66 VanDerWaalsContact O-CG 3.3Å; S62-N66 PolarHBondContact O-N 2.67Å; S62-N66 PolarHBondContact O-ND2 3.11Å; K63-N66 PolarHBondContact O-N 3.12Å; L64-N66 VanDerWaalsContact C-N 3.28Å; N66-S68 VanDerWaalsContact C-N 3.27Å; N66-S68 PolarHBondContact O-N 3.03Å; N66-K69 WeakPolarHBondContact O-CB 3.28Å; N66-K69 PolarHBondContact O-N 2.93Å; N66-K69 VanDerWaalsContact O-N 3.1Å; N66-D70 PolarHBondContact O-N 3.11Å; N66-D70 VanDerWaalsContact O-N 3.07Å
67	L	37	Very low	36.2	Very low	98 Å²	98	110.4 Å²	110.4	51%	0.513	58%	0.582	S	S	.	*	H	α-helix	trans	-59.4	-34.9	172.7	-90.5	82.7	0	0	0	112.8	K63 K69 D70 I71	K63-L67 VanDerWaalsContact O-CD1 3.26Å; K63-L67 WeakPolarHBondContact O-CD1 3.47Å; K63-L67 PolarHBondContact O-N 3.24Å; L67-K69 VanDerWaalsContact C-N 3.34Å; L67-D70 CarbonylContact O-C 3.58Å; L67-D70 PolarHBondContact O-N 3.46Å; L67-I71 WeakPolarHBondContact O-CB 3.25Å; L67-I71 WeakPolarHBondContact O-CD1 3.1Å; L67-I71 WeakPolarHBondContact O-CG1 3.32Å; L67-I71 PolarHBondContact O-N 2.97Å
68	S	33.7	Very low	35.9	Very low	64 Å²	64	116.2 Å²	116.2	45%	0.448	61%	0.605	S	S	.	*	H	α-helix	trans	-71.4	-28.3	177.4	68.2	0	0	0	0	113.1	L64 I65 N66 I71 S72	L64-S68 VanDerWaalsContact O-CB 3.28Å; L64-S68 WeakPolarHBondContact O-CB 3.49Å; L64-S68 PolarHBondContact O-N 2.83Å; L64-S68 PolarHBondContact O-OG 2.87Å; I65-S68 WeakPolarHBondContact CA-OG 3.4Å; I65-S68 PolarHBondContact O-OG 3.46Å; N66-S68 VanDerWaalsContact C-N 3.27Å; N66-S68 PolarHBondContact O-N 3.03Å; S68-I71 PolarHBondContact O-N 3.26Å; S68-S72 WeakPolarHBondContact O-CB 3.39Å; S68-S72 PolarHBondContact O-N 3.03Å
69	K	38	Very low	35.3	Very low	139 Å²	139	120.5 Å²	120.5	60%	0.604	62%	0.621	S	S	*	*	H	α-helix	trans	-69.6	-34.8	169	-70.1	165.9	-169.3	168.3	0	111.6	I65 N66 L67 I71	I65-K69 VanDerWaalsContact O-CD 3.24Å; I65-K69 WeakPolarHBondContact O-CD 3.41Å; I65-K69 WeakPolarHBondContact O-CE 3.42Å; I65-K69 VanDerWaalsContact O-CG 3.25Å; I65-K69 WeakPolarHBondContact O-CG 3.37Å; N66-K69 WeakPolarHBondContact O-CB 3.28Å; N66-K69 PolarHBondContact O-N 2.93Å; N66-K69 VanDerWaalsContact O-N 3.1Å; L67-K69 VanDerWaalsContact C-N 3.34Å; K69-I71 VanDerWaalsContact C-N 3.26Å; K69-I71 PolarHBondContact O-N 3.14Å
70	D	35.8	Very low	34.6	Very low	138 Å²	138	122 Å²	122	74%	0.738	63%	0.632	S	S	*	*	H	α-helix	trans	-75.9	-11.4	175.8	-59.7	-27.7	0	0	0	113.2	N66 L67	N66-D70 PolarHBondContact O-N 3.11Å; N66-D70 VanDerWaalsContact O-N 3.07Å; L67-D70 CarbonylContact O-C 3.58Å; L67-D70 PolarHBondContact O-N 3.46Å
71	I	34	Very low	33.9	Very low	124 Å²	124	126.6 Å²	126.6	64%	0.636	65%	0.648	S	S	*	*	H	α-helix	trans	-103.4	-20.5	-179.6	-72.3	166.1	0	0	0	112.5	L67 S68 K69 L73	L67-I71 WeakPolarHBondContact O-CB 3.25Å; L67-I71 WeakPolarHBondContact O-CD1 3.1Å; L67-I71 WeakPolarHBondContact O-CG1 3.32Å; L67-I71 PolarHBondContact O-N 2.97Å; S68-I71 PolarHBondContact O-N 3.26Å; K69-I71 VanDerWaalsContact C-N 3.26Å; K69-I71 PolarHBondContact O-N 3.14Å; I71-L73 VanDerWaalsContact C-N 3.33Å; I71-L73 PolarHBondContact O-N 3.46Å
72	S	29.2	Very low	33.3	Very low	100 Å²	100	124.8 Å²	124.8	70%	0.699	66%	0.658	S	S	*	*	T	Hydrogen-bonded Turn	trans	-87.4	51.3	-171.6	-164.5	0	0	0	0	115	S68	S68-S72 WeakPolarHBondContact O-CB 3.39Å; S68-S72 PolarHBondContact O-N 3.03Å
73	L	31.5	Very low	32.4	Very low	163 Å²	163	130.9 Å²	130.9	85%	0.853	69%	0.686	S	S	*	*	T	Hydrogen-bonded Turn	trans	-149.3	35.9	165.1	-124.1	163.7	0	0	0	113.6	I71 D75	I71-L73 VanDerWaalsContact C-N 3.33Å; I71-L73 PolarHBondContact O-N 3.46Å; L73-D75 PolarHBondContact O-N 3.06Å
74	M	25.8	Very low	31.4	Very low	167 Å²	167	133.3 Å²	133.3	82%	0.823	70%	0.701	S	S	*	*			trans	-85.5	94.3	157.8	-78.7	-160.1	71.6	0	0	109.8
75	D	30.3	Very low	30.9	Very low	153 Å²	153	136.2 Å²	136.2	82%	0.818	72%	0.716	S	S	*	*			trans	-141	148	156.4	-115.5	-37.6	0	0	0	110.1	L73	L73-D75 PolarHBondContact O-N 3.06Å
76	N	25.7	Very low	30.2	Very low	116 Å²	116	141.1 Å²	141.1	62%	0.62	74%	0.737	S	S	*	*			trans	-102.1	118.7	-162.9	-58.6	-89.2	0	0	0	111.2
77	E	26.7	Very low	29.6	Very low	179 Å²	179	142 Å²	142	84%	0.836	75%	0.75	S	S	*	*	S	Bend	trans	-178.1	56.1	145	-106.2	175.8	-162.2	0	0	114.7
78	Q	31.8	Very low	29.1	Very low	184 Å²	184	146.6 Å²	146.6	86%	0.86	77%	0.766	S	S	*	*			trans	-162.6	31.2	152.5	-115.5	145.5	111.5	0	0	115.1	L80	Q78-L80 PolarHBondContact O-N 3.23Å
79	I	27.1	Very low	28.9	Very low	153 Å²	153	153.9 Å²	153.9	79%	0.785	79%	0.785	S	S	*	*			trans	-81.6	56.5	171.7	-48.5	179.8	0	0	0	109.8
80	L	26.4	Very low	28.3	Very low	135 Å²	135	154.7 Å²	154.7	71%	0.707	79%	0.791	S	S	*	*	S	Bend	trans	-163.9	150.9	169.9	-139.7	67.2	0	0	0	110.2	Q78	Q78-L80 PolarHBondContact O-N 3.23Å
81	F	24.8	Very low	28	Very low	205 Å²	205	157.4 Å²	157.4	90%	0.899	80%	0.797	S	S	*	*	S	Bend	trans	63.6	92.1	-175.7	-63.1	-85.8	0	0	0	115.9
82	G	26.6	Very low	27.5	Very low	67 Å²	67	159.1 Å²	159.1	69%	0.691	81%	0.806	S	S	*	*	S	Bend	trans	173.1	-50.3	167.5	0	0	0	0	0	112.8	M84	G82-M84 VanDerWaalsContact C-N 3.32Å; G82-M84 PolarHBondContact O-N 2.81Å
83	N	26.7	Very low	27.6	Very low	180 Å²	180	159 Å²	159	96%	0.963	80%	0.803	S	S	*	*	S	Bend	trans	-93.2	40.1	-174.1	-66.7	-21.4	0	0	0	113.7
84	M	26.5	Very low	27.4	Very low	162 Å²	162	159 Å²	159	80%	0.798	80%	0.799	S	S	*	*	S	Bend	trans	-147.8	132.6	176	-159.6	170.5	72.5	0	0	109.1	G82	G82-M84 VanDerWaalsContact C-N 3.32Å; G82-M84 PolarHBondContact O-N 2.81Å
85	L	26.8	Very low	27.6	Very low	155 Å²	155	158.3 Å²	158.3	81%	0.812	80%	0.799	S	S	*	*	S	Bend	trans	79.7	61.4	-176.2	-50.4	174.7	0	0	0	117.9
86	E	28.7	Very low	27.4	Very low	193 Å²	193	158.2 Å²	158.2	90%	0.902	80%	0.796	S	S	*	*			trans	-141.6	19.1	141.5	-140.3	173.9	-153.5	0	0	114.8	K88	E86-K88 PolarHBondContact O-N 2.74Å
87	S	28	Very low	27.6	Very low	107 Å²	107	159.3 Å²	159.3	75%	0.748	80%	0.802	S	S	*	*	S	Bend	trans	-72.4	107.7	165.3	54.5	0	0	0	0	110.1	Y89	S87-Y89 PolarHBondContact O-N 2.96Å
88	K	28	Very low	27.9	Very low	194 Å²	194	159.4 Å²	159.4	84%	0.843	80%	0.803	S	S	*	*			trans	-59.6	101.6	171.4	-68.5	178.8	177.7	178.5	0	111.5	E86	E86-K88 PolarHBondContact O-N 2.74Å
89	Y	29.3	Very low	27.7	Very low	218 Å²	218	159.3 Å²	159.3	86%	0.855	81%	0.807	S	S	*	*			trans	-154.1	164.7	150.1	-92	-64.2	0	0	0	109.7	S87	S87-Y89 PolarHBondContact O-N 2.96Å
90	E	25.4	Very low	27.9	Very low	155 Å²	155	161.6 Å²	161.6	72%	0.724	81%	0.811	S	S	*	*			trans	-91.1	177.9	-159.5	-66.2	153.5	103.3	0	0	114.9
91	F	28.5	Very low	28.1	Very low	196 Å²	196	160.5 Å²	160.5	86%	0.86	82%	0.815	S	S	*	*			trans	89	98.7	168.3	-62.1	-83	0	0	0	119.5
92	L	24.3	Very low	28.4	Very low	160 Å²	160	156.8 Å²	156.8	84%	0.838	82%	0.815	S	S	*	*			trans	-61.2	179	147.4	-101	90.8	0	0	0	111.7
93	P	30.2	Very low	28.6	Very low	98 Å²	98	162.8 Å²	162.8	64%	0.636	82%	0.822	S	S	*	*			cis	-142.8	-167.8	18.9	20.7	8.9	0	0	0	117.5
94	Q	27.6	Very low	28.7	Very low	161 Å²	161	162.9 Å²	162.9	75%	0.752	82%	0.816	S	S	*	*			trans	97.4	149.1	155.3	-105.5	82.9	31.5	0	0	121.2
95	N	29.4	Very low	28.9	Very low	154 Å²	154	160.6 Å²	160.6	82%	0.824	82%	0.816	S	S	*	*			trans	69.9	57.3	169.1	-63.3	0.2	0	0	0	119.4
96	I	27.5	Very low	29	Very low	150 Å²	150	160.3 Å²	160.3	77%	0.769	81%	0.814	S	S	*	*			trans	-53	133.4	144.6	-60.2	156.8	0	0	0	110
97	N	30.1	Very low	28.9	Very low	140 Å²	140	156.6 Å²	156.6	75%	0.749	81%	0.809	S	S	*	*				172.2	-32.7	127.6	-92.8	-48.5	0	0	0	115.6
98	E	32	Very low	29	Very low	180 Å²	180	160.4 Å²	160.4	84%	0.841	81%	0.813	S	S	*	*	G	3₁₀ helix	trans	-80.7	-28.2	-155.8	-61.2	-170.2	145	0	0	116.4	K100	E98-K100 VanDerWaalsContact C-N 3.32Å; E98-K100 PolarHBondContact O-N 2.82Å; E98-K100 VanDerWaalsContact O-N 3.15Å
99	L	28.2	Very low	29.2	Very low	182 Å²	182	159 Å²	159	95%	0.953	81%	0.813	S	S	*	*	G	3₁₀ helix	trans	-90.1	32.6	-169.5	-140.4	76.4	0	0	0	115.6
100	K	31.8	Very low	29.3	Very low	201 Å²	201	154.7 Å²	154.7	87%	0.874	81%	0.81	S	S	*	*	G	3₁₀ helix	trans	-114.4	5.4	178	-117.3	175.8	-176.3	175.5	0	115	E98	E98-K100 VanDerWaalsContact C-N 3.32Å; E98-K100 PolarHBondContact O-N 2.82Å; E98-K100 VanDerWaalsContact O-N 3.15Å
101	S	29.6	Very low	29.5	Very low	112 Å²	112	154.4 Å²	154.4	78%	0.783	81%	0.813	S	S	*	*			trans	-114.8	14.2	-166.1	-56.4	0	0	0	0	115.6
102	S	31.1	Very low	29.8	Very low	128 Å²	128	151.5 Å²	151.5	90%	0.895	81%	0.807	S	S	*	*			trans	-118.5	93.7	173.5	-162.2	0	0	0	0	111.7
103	K	29.9	Very low	30.3	Very low	192 Å²	192	150.6 Å²	150.6	84%	0.835	80%	0.803	S	S	*	*			trans	-144.6	152.8	172.7	-163.6	179.9	-172.6	-179.8	0	106
104	Q	29	Very low	30.3	Very low	183 Å²	183	152.9 Å²	152.9	86%	0.855	81%	0.809	S	S	*	*			trans	81.4	68.7	179.4	-49.2	174.1	-28.4	0	0	116.8
105	S	30.9	Very low	30.5	Very low	114 Å²	114	152.5 Å²	152.5	80%	0.797	81%	0.813	S	S	*	*			trans	-170.4	134	150.1	-82.6	0	0	0	0	107.4
106	I	30.2	Very low	30.7	Very low	148 Å²	148	150.3 Å²	150.3	76%	0.759	81%	0.805	S	S	*	*			cis	-125.2	140.2	3	-72.8	100.3	0	0	0	109.7
107	S	26.8	Very low	30.9	Very low	115 Å²	115	149.9 Å²	149.9	80%	0.804	80%	0.804	S	S	*	*			trans	-136.4	87.3	166.6	54.3	0	0	0	0	111
108	K	30	Very low	30.8	Very low	188 Å²	188	151 Å²	151	82%	0.817	81%	0.81	S	S	*	*			trans	-179.1	162	171.7	-97.6	142.3	-171.2	-179.8	0	107.7
109	L	30.6	Very low	30.5	Very low	164 Å²	164	147.4 Å²	147.4	86%	0.859	81%	0.805	S	S	*	*			trans	76.1	119.4	-167.5	-50.8	166.2	0	0	0	112.4
110	T	32.5	Very low	30.5	Very low	127 Å²	127	146.9 Å²	146.9	78%	0.779	80%	0.795	S	S	*	*			cis	-146	151.2	-13.7	31.3	0	0	0	0	109.2
111	N	29.2	Very low	30.4	Very low	149 Å²	149	145.2 Å²	145.2	80%	0.797	79%	0.788	S	S	*	*			trans	-82.5	-175.2	174.5	-65.9	-20.7	0	0	0	111.8
112	N	34.2	Very low	30.1	Very low	136 Å²	136	145.8 Å²	145.8	73%	0.727	79%	0.787	S	S	*	*			trans	96.9	132.9	168.4	-63.3	31.8	0	0	0	114
113	D	35.2	Very low	29.8	Very low	140 Å²	140	146.4 Å²	146.4	75%	0.749	79%	0.785	S	S	*	*			cis	-134	177.1	3.3	-87.7	-47.4	0	0	0	113.2
114	N	30.3	Very low	29.6	Very low	146 Å²	146	143.1 Å²	143.1	78%	0.781	78%	0.782	S	S	*	*			trans	-98.3	-165.6	-173	-67.4	-80.3	0	0	0	113.3
115	D	32.9	Very low	29.3	Very low	153 Å²	153	139.7 Å²	139.7	82%	0.818	77%	0.773	S	S	*	*			trans	88.1	135.9	166.1	-65.2	-10.5	0	0	0	116.9
116	V	33.5	Very low	29.1	Very low	109 Å²	109	142 Å²	142	66%	0.661	77%	0.771	S	S	*	*			cis	-155.6	150.3	-0.1	100.6	0	0	0	0	115.1
117	N	31.1	Very low	28.9	Very low	141 Å²	141	142.9 Å²	142.9	75%	0.754	77%	0.772	S	S	*	*			trans	53.9	115.5	156.6	-62.3	-30.1	0	0	0	124.6
118	N	27.8	Very low	28.9	Very low	163 Å²	163	142.6 Å²	142.6	87%	0.872	77%	0.767	S	S	*	*			trans	-31.7	147.2	142.2	-66.2	-58.4	0	0	0	117.2
119	S	26.4	Very low	28.6	Very low	104 Å²	104	141.2 Å²	141.2	73%	0.727	77%	0.768	S	S	*	*			trans	-161	98.8	149.3	-170.2	0	0	0	0	115.9
120	F	27.8	Very low	28.3	Very low	172 Å²	172	140.4 Å²	140.4	75%	0.754	76%	0.764	S	S	*	*			trans	56.5	132.9	140.4	-72.5	-70.2	0	0	0	126.1
121	K	29.2	Very low	27.8	Very low	166 Å²	166	139.8 Å²	139.8	72%	0.722	76%	0.764	S	S	*	*			trans	69.1	123.1	141.8	-68.9	158.5	-174	162.4	0	118
122	T	23.1	Very low	27.6	Very low	124 Å²	124	140 Å²	140	76%	0.761	76%	0.76	S	S	*	*			cis	64.4	116.3	43.5	77.9	0	0	0	0	115.9
123	T	26.2	Very low	27	Very low	140 Å²	140	142.7 Å²	142.7	86%	0.859	77%	0.766	S	S	*	*			trans	-169.4	150.2	133.1	-72.8	0	0	0	0	110
124	T	23.7	Very low	26.6	Very low	124 Å²	124	143.3 Å²	143.3	76%	0.761	77%	0.768	S	S	*	*			trans	-81.5	174.3	-177.1	42.5	0	0	0	0	114.4
125	V	24.6	Very low	26.3	Very low	111 Å²	111	140.3 Å²	140.3	67%	0.673	76%	0.758	S	S	*	*				157.5	122.6	123.4	158.5	0	0	0	0	113.1
126	Q	26.2	Very low	26	Very low	162 Å²	162	137.8 Å²	137.8	76%	0.757	74%	0.74	S	S	*	*			trans	47.7	154.9	147.4	-62.1	169.1	-19.4	0	0	120.9
127	Q	25.1	Very low	25.9	Very low	167 Å²	167	140.3 Å²	140.3	78%	0.78	74%	0.742	S	S	*	*			cis	-156.9	173.6	-12.2	-115.8	179.2	-20.6	0	0	108.9
128	P	27.3	Very low	26	Very low	109 Å²	109	136.3 Å²	136.3	71%	0.708	73%	0.725	S	S	*	*			trans	-93.4	-174.6	-164.8	38.1	-38.4	0	0	0	116.2
129	L	22.8	Very low	26.2	Very low	158 Å²	158	132.4 Å²	132.4	83%	0.827	70%	0.704	S	S	*	*			trans	98.7	94.6	167.5	-54.9	174.5	0	0	0	117.7
130	L	24.4	Very low	26.5	Very low	148 Å²	148	130.2 Å²	130.2	78%	0.775	69%	0.687	S	S	*	*				-168.9	122.9	106.9	-127.7	72.7	0	0	0	111.5	H132	L130-H132 PolarHBondContact O-N 2.56Å
131	S	23	Very low	26.6	Very low	113 Å²	113	126 Å²	126	79%	0.79	67%	0.672	S	S	*	*			trans	-76.9	110.5	178.4	52.6	0	0	0	0	111.9
132	H	24.2	Very low	26.9	Very low	154 Å²	154	120.8 Å²	120.8	71%	0.713	65%	0.652	S	S	*	*			trans	-108.7	125.5	169.1	-84.3	85.8	0	0	0	110.6	L130 I134	L130-H132 PolarHBondContact O-N 2.56Å; H132-I134 PolarHBondContact O-N 3.06Å; H132-I134 VanDerWaalsContact O-N 3.11Å
133	F	23.1	Very low	27.3	Very low	193 Å²	193	117.4 Å²	117.4	85%	0.846	63%	0.628	S	S	*	*			trans	-65.1	105.7	179.3	-74.6	-100.5	0	0	0	111.4	S135	F133-S135 PolarHBondContact O-N 3.32Å
134	I	25.1	Very low	27.7	Very low	153 Å²	153	115.1 Å²	115.1	79%	0.785	61%	0.61	S	S	*	*			trans	-88.1	106	167.8	-60.8	-178	0	0	0	108	H132	H132-I134 PolarHBondContact O-N 3.06Å; H132-I134 VanDerWaalsContact O-N 3.11Å
135	S	25.2	Very low	28.3	Very low	83 Å²	83	116.8 Å²	116.8	58%	0.58	61%	0.61	S	S	*	*			trans	-66.1	140	-178.3	180	0	0	0	0	112.1	F133 K137	F133-S135 PolarHBondContact O-N 3.32Å; S135-K137 PolarHBondContact O-N 2.86Å
136	F	27.4	Very low	28.6	Very low	99 Å²	99	115.6 Å²	115.6	43%	0.434	60%	0.6	S	S	.	*	T	Hydrogen-bonded Turn	trans	-59.3	14	178.2	-86.3	-85.5	0	0	0	116.9	S138 I139 H182	F136-S138 PolarHBondContact O-N 2.91Å; F136-I139 HydrophobicContact CD1-CD1 3.8Å; F136-I139 HydrophobicContact CE1-CD1 4.2Å; F136-H182 AromaticContact CE2-CD2 3.76Å; F136-H182 AromaticContact CE2-NE2 3.83Å; F136-H182 AromaticContact CZ-CD2 3.6Å; F136-H182 AromaticContact CZ-NE2 3.83Å
137	K	29.7	Very low	28.8	Very low	163 Å²	163	112.5 Å²	112.5	71%	0.709	60%	0.596	S	S	*	*	T	Hydrogen-bonded Turn	trans	-60.1	-22.6	178.2	-84.8	-173	169.3	-174.5	0	114.9	S135 P140	S135-K137 PolarHBondContact O-N 2.86Å; K137-P140 WeakPolarHBondContact O-CD 3.43Å
138	S	33.5	Very low	29.3	Very low	57 Å²	57	110.2 Å²	110.2	40%	0.399	59%	0.589	S	S	.	*	H	α-helix	trans	-75.9	-19.4	-174.2	45.1	0	0	0	0	114.9	F136 D141 I142	F136-S138 PolarHBondContact O-N 2.91Å; S138-D141 PolarHBondContact O-N 3.02Å; S138-I142 VanDerWaalsContact O-CG1 3.3Å; S138-I142 WeakPolarHBondContact O-CG1 3.34Å; S138-I142 PolarHBondContact O-N 2.77Å
139	I	32.9	Very low	29.6	Very low	81 Å²	81	106.8 Å²	106.8	42%	0.415	57%	0.566	S	S	.	*	H	α-helix	trans	-66.4	-47.1	178.7	-61.7	-178.6	0	0	0	111.7	F136 D141 I142 L143	F136-I139 HydrophobicContact CD1-CD1 3.8Å; F136-I139 HydrophobicContact CE1-CD1 4.2Å; I139-D141 VanDerWaalsContact C-N 3.28Å; I139-D141 PolarHBondContact O-N 2.89Å; I139-I142 PolarHBondContact O-N 3.42Å; I139-L143 HydrophobicContact CG2-CD1 4.38Å; I139-L143 WeakPolarHBondContact O-CG 3.37Å; I139-L143 PolarHBondContact O-N 2.81Å
140	P	31.9	Very low	30.1	Very low	57 Å²	57	103.5 Å²	103.5	37%	0.37	55%	0.549	S	S	.	.	H	α-helix	trans	-53.2	-40.2	167.8	-29.8	34.7	0	0	0	114.4	K137 L143 L144	K137-P140 WeakPolarHBondContact O-CD 3.43Å; P140-L143 PolarHBondContact O-N 3.33Å; P140-L144 WeakPolarHBondContact O-CB 3.18Å; P140-L144 WeakPolarHBondContact O-CG 3.23Å; P140-L144 PolarHBondContact O-N 3.14Å
141	D	30.7	Very low	30.5	Very low	83 Å²	83	101.6 Å²	101.6	44%	0.444	54%	0.536	S	S	.	.	H	α-helix	trans	-68.9	-39.9	-178.6	-66.7	-30.4	0	0	0	112.1	S138 I139 L143 L144 Q145	S138-D141 PolarHBondContact O-N 3.02Å; I139-D141 VanDerWaalsContact C-N 3.28Å; I139-D141 PolarHBondContact O-N 2.89Å; D141-L143 VanDerWaalsContact C-N 3.3Å; D141-L143 PolarHBondContact O-N 3.36Å; D141-L144 PolarHBondContact O-N 3.45Å; D141-Q145 WeakPolarHBondContact O-CB 3.41Å; D141-Q145 VanDerWaalsContact O-CG 3.32Å; D141-Q145 WeakPolarHBondContact O-CG 3.19Å; D141-Q145 PolarHBondContact O-N 3.06Å
142	I	34.1	Very low	30.9	Very low	58 Å²	58	100.9 Å²	100.9	30%	0.297	52%	0.523	S	S	.	.	H	α-helix	trans	-62.2	-38.2	174.1	-68.5	162.2	0	0	0	111.1	S138 I139 N146	S138-I142 VanDerWaalsContact O-CG1 3.3Å; S138-I142 WeakPolarHBondContact O-CG1 3.34Å; S138-I142 PolarHBondContact O-N 2.77Å; I139-I142 PolarHBondContact O-N 3.42Å; I142-N146 PolarHBondContact O-ND2 3.18Å
143	L	32.8	Very low	31.4	Very low	52 Å²	52	99 Å²	99	27%	0.272	51%	0.51	S	S	.	.	H	α-helix	trans	-71.6	-30	175.5	-67.2	171.1	0	0	0	112.7	I139 P140 D141 M220	I139-L143 HydrophobicContact CG2-CD1 4.38Å; I139-L143 WeakPolarHBondContact O-CG 3.37Å; I139-L143 PolarHBondContact O-N 2.81Å; P140-L143 PolarHBondContact O-N 3.33Å; D141-L143 VanDerWaalsContact C-N 3.3Å; D141-L143 PolarHBondContact O-N 3.36Å; L143-M220 HydrophobicContact CD2-CE 3.84Å
144	L	34.9	Very low	31.9	Very low	92 Å²	92	97.3 Å²	97.3	48%	0.482	50%	0.502	S	S	.	.	H	α-helix	trans	-79	-33	176.3	-77.8	165.6	0	0	0	113.4	P140 D141 N146	P140-L144 WeakPolarHBondContact O-CB 3.18Å; P140-L144 WeakPolarHBondContact O-CG 3.23Å; P140-L144 PolarHBondContact O-N 3.14Å; D141-L144 PolarHBondContact O-N 3.45Å; L144-N146 VanDerWaalsContact C-N 3.28Å; L144-N146 PolarHBondContact O-N 3.35Å
145	Q	35.8	Very low	32.3	Very low	159 Å²	159	96 Å²	96	74%	0.743	49%	0.493	S	S	*	.	H	α-helix	trans	-69	-24.3	177.1	-75.1	176.4	11.6	0	0	113.1	D141 S147	D141-Q145 WeakPolarHBondContact O-CB 3.41Å; D141-Q145 VanDerWaalsContact O-CG 3.32Å; D141-Q145 WeakPolarHBondContact O-CG 3.19Å; D141-Q145 PolarHBondContact O-N 3.06Å; Q145-S147 PolarHBondContact O-N 3.44Å; Q145-S147 VanDerWaalsContact O-N 3.15Å
146	N	30.4	Very low	32.5	Very low	87 Å²	87	98.4 Å²	98.4	47%	0.465	50%	0.495	S	S	.	.			trans	-78.1	97.7	175.3	-82.1	-84.4	0	0	0	111.2	I142 L144 N148 V149	I142-N146 PolarHBondContact O-ND2 3.18Å; L144-N146 VanDerWaalsContact C-N 3.28Å; L144-N146 PolarHBondContact O-N 3.35Å; N146-N148 PolarHBondContact O-N 3.17Å; N146-N148 VanDerWaalsContact O-N 3.13Å; N146-V149 HydrophobicContact CB-CB 4.38Å; N146-V149 HydrophobicContact CB-CG2 3.7Å; N146-V149 WeakPolarHBondContact O-CB 3.37Å; N146-V149 PolarHBondContact O-N 3.45Å
147	S	31	Very low	32.6	Very low	97 Å²	97	100.5 Å²	100.5	68%	0.678	51%	0.511	S	S	*	.	T	Hydrogen-bonded Turn	trans	-50.6	-37	179.1	52.4	0	0	0	0	113.9	Q145 V149 N150	Q145-S147 PolarHBondContact O-N 3.44Å; Q145-S147 VanDerWaalsContact O-N 3.15Å; S147-V149 PolarHBondContact O-N 3.49Å; S147-N150 PolarHBondContact O-N 2.98Å
148	N	34.9	Very low	32.6	Very low	118 Å²	118	101.4 Å²	101.4	63%	0.631	52%	0.515	S	S	*	.	T	Hydrogen-bonded Turn	trans	-65.1	-31.2	177	-78.7	-12.6	0	0	0	113.8	N146 N150 H151 L152	N146-N148 PolarHBondContact O-N 3.17Å; N146-N148 VanDerWaalsContact O-N 3.13Å; N148-N150 VanDerWaalsContact C-N 3.33Å; N148-N150 PolarHBondContact O-N 2.95Å; N148-H151 WeakPolarHBondContact O-CB 3.41Å; N148-H151 PolarHBondContact O-N 2.88Å; N148-L152 WeakPolarHBondContact O-CG 3.32Å; N148-L152 PolarHBondContact O-N 3.04Å
149	V	34.4	Very low	32.1	Very low	37 Å²	37	103.6 Å²	103.6	22%	0.224	53%	0.53	C	S	.	.	H	α-helix	trans	-65.7	-39.5	180	178.2	0	0	0	0	110.6	N146 S147 H151 L152 Y153	N146-V149 HydrophobicContact CB-CB 4.38Å; N146-V149 HydrophobicContact CB-CG2 3.7Å; N146-V149 WeakPolarHBondContact O-CB 3.37Å; N146-V149 PolarHBondContact O-N 3.45Å; S147-V149 PolarHBondContact O-N 3.49Å; V149-H151 PolarHBondContact O-N 3.25Å; V149-L152 PolarHBondContact O-N 3.43Å; V149-Y153 HydrophobicContact CG1-CD2 3.88Å; V149-Y153 HydrophobicContact CG1-CE2 3.8Å; V149-Y153 WeakPolarHBondContact O-CD2 3.29Å; V149-Y153 PolarHBondContact O-N 3.17Å
150	N	32.5	Very low	31.7	Very low	90 Å²	90	106.9 Å²	106.9	48%	0.481	55%	0.547	S	S	.	.	H	α-helix	trans	-69.4	-14.2	174	-75	-67.5	0	0	0	113.8	S147 N148	S147-N150 PolarHBondContact O-N 2.98Å; N148-N150 VanDerWaalsContact C-N 3.33Å; N148-N150 PolarHBondContact O-N 2.95Å
151	H	33.5	Very low	31.5	Very low	107 Å²	107	110.5 Å²	110.5	50%	0.495	56%	0.562	S	S	.	*	H	α-helix	trans	-92.2	-42	173.5	-145.8	-85.1	0	0	0	111.9	N148 V149 Y153 K154 Q155	N148-H151 WeakPolarHBondContact O-CB 3.41Å; N148-H151 PolarHBondContact O-N 2.88Å; V149-H151 PolarHBondContact O-N 3.25Å; H151-Y153 PolarHBondContact O-N 3.15Å; H151-K154 WeakPolarHBondContact O-CB 3.36Å; H151-K154 PolarHBondContact O-N 3.13Å; H151-Q155 PolarHBondContact CE1-OE1 3.19Å; H151-Q155 PolarHBondContact ND1-OE1 3.44Å; H151-Q155 PolarHBondContact O-N 3.05Å
152	L	31.5	Very low	31.2	Very low	98 Å²	98	111.9 Å²	111.9	51%	0.513	57%	0.573	S	S	.	*	H	α-helix	trans	-53.5	-49.4	174.6	-77.6	160.6	0	0	0	111.7	N148 V149 K154 Q155 Q156	N148-L152 WeakPolarHBondContact O-CG 3.32Å; N148-L152 PolarHBondContact O-N 3.04Å; V149-L152 PolarHBondContact O-N 3.43Å; L152-K154 PolarHBondContact O-N 3.45Å; L152-K154 VanDerWaalsContact O-N 3.09Å; L152-Q155 PolarHBondContact O-N 2.87Å; L152-Q156 PolarHBondContact O-N 2.88Å
153	Y	33.8	Very low	30.9	Very low	116 Å²	116	115.9 Å²	115.9	46%	0.455	60%	0.595	S	S	.	*	T	Hydrogen-bonded Turn	trans	-73.3	5.3	177.3	-72	-65.9	0	0	0	115.2	V149 H151	V149-Y153 HydrophobicContact CG1-CD2 3.88Å; V149-Y153 HydrophobicContact CG1-CE2 3.8Å; V149-Y153 WeakPolarHBondContact O-CD2 3.29Å; V149-Y153 PolarHBondContact O-N 3.17Å; H151-Y153 PolarHBondContact O-N 3.15Å
154	K	34.9	Very low	30.5	Very low	156 Å²	156	120.6 Å²	120.6	68%	0.678	62%	0.62	S	S	*	*	T	Hydrogen-bonded Turn	trans	-106	-6.3	167.3	-91.3	-178.1	174.2	177.4	0	113.7	H151 L152	H151-K154 WeakPolarHBondContact O-CB 3.36Å; H151-K154 PolarHBondContact O-N 3.13Å; L152-K154 PolarHBondContact O-N 3.45Å; L152-K154 VanDerWaalsContact O-N 3.09Å
155	Q	33	Very low	30	Very low	125 Å²	125	121.9 Å²	121.9	58%	0.584	63%	0.632	S	S	*	*	T	Hydrogen-bonded Turn	trans	-121.7	5.7	-174.8	-67.6	-177.6	-63.7	0	0	113.9	H151 L152 D157	H151-Q155 PolarHBondContact CE1-OE1 3.19Å; H151-Q155 PolarHBondContact ND1-OE1 3.44Å; H151-Q155 PolarHBondContact O-N 3.05Å; L152-Q155 PolarHBondContact O-N 2.87Å; Q155-D157 PolarHBondContact O-N 3.3Å
156	Q	29.6	Very low	29.6	Very low	135 Å²	135	122 Å²	122	63%	0.631	64%	0.638	S	S	*	*			trans	-73.6	56.6	170.9	-74.6	-174.7	-22.8	0	0	112.7	L152	L152-Q156 PolarHBondContact O-N 2.88Å
157	D	28.5	Very low	29.2	Very low	143 Å²	143	127.1 Å²	127.1	77%	0.765	66%	0.659	S	S	*	*	S	Bend	trans	-142.4	89.9	164	-135.1	-24.2	0	0	0	107.3	Q155	Q155-D157 PolarHBondContact O-N 3.3Å
158	K	29.1	Very low	28.8	Very low	182 Å²	182	128.1 Å²	128.1	79%	0.791	67%	0.665	S	S	*	*	S	Bend	trans	98.5	142.3	-162.9	-57.9	144	-162.9	162.6	0	114.5
159	S	24.6	Very low	28.3	Very low	102 Å²	102	128.4 Å²	128.4	71%	0.713	67%	0.671	S	S	*	*			trans	-71.1	149.9	-179.2	52.9	0	0	0	0	113.9
160	I	24.4	Very low	27.8	Very low	150 Å²	150	132.8 Å²	132.8	77%	0.769	69%	0.692	S	S	*	*				165.9	132.1	126	-88.8	157.4	0	0	0	112
161	I	26.8	Very low	27.3	Very low	133 Å²	133	135 Å²	135	68%	0.682	70%	0.704	S	S	*	*			trans	38.9	120.5	153.3	-59.3	168.8	0	0	0	119.7	N163	I161-N163 WeakPolarHBondContact CG2-OD1 3.45Å
162	V	24.9	Very low	26.8	Very low	113 Å²	113	139.9 Å²	139.9	69%	0.685	72%	0.719	S	S	*	*			trans	-82.4	113.7	160.1	177.4	0	0	0	0	109.9
163	N	27.2	Very low	26.5	Very low	141 Å²	141	140.5 Å²	140.5	75%	0.754	73%	0.731	S	S	*	*			trans	-102.8	123.8	167.6	-87.9	-13	0	0	0	110.7	I161 T165	I161-N163 WeakPolarHBondContact CG2-OD1 3.45Å; N163-T165 PolarHBondContact O-N 2.62Å
164	N	25.6	Very low	26.1	Very low	151 Å²	151	141.7 Å²	141.7	81%	0.807	75%	0.745	S	S	*	*			trans	-87.7	97.8	-176.3	-75.6	-34.6	0	0	0	112.6
165	T	24.6	Very low	25.6	Very low	119 Å²	119	141 Å²	141	73%	0.73	75%	0.749	S	S	*	*			trans	-148.2	107.2	156.6	31.9	0	0	0	0	111.3	N163	N163-T165 PolarHBondContact O-N 2.62Å
166	N	25.5	Very low	25.4	Very low	163 Å²	163	143.7 Å²	143.7	87%	0.872	76%	0.761	S	S	*	*				168.6	112.1	126.7	-83.5	-25.4	0	0	0	110.5
167	H	22.5	Very low	25.5	Very low	194 Å²	194	143.3 Å²	143.3	90%	0.898	76%	0.759	S	S	*	*			trans	-68.5	140.1	171.2	-77.9	-103.1	0	0	0	110.9
168	C	24	Very low	25.8	Very low	118 Å²	118	140 Å²	140	80%	0.797	74%	0.741	S	S	*	*			trans	-152.9	105	145.6	-121.4	0	0	0	0	112.3
169	T	24.2	Very low	26	Very low	124 Å²	124	135.2 Å²	135.2	76%	0.761	73%	0.725	S	S	*	*			trans	43.7	74.4	151.1	58.4	0	0	0	0	118.8
170	L	22.7	Very low	26.5	Very low	129 Å²	129	133.5 Å²	133.5	68%	0.675	71%	0.707	S	S	*	*			trans	-92.6	82.3	149.1	-119.2	170.1	0	0	0	108.7
171	N	21.7	Very low	27	Very low	135 Å²	135	132.1 Å²	132.1	72%	0.722	70%	0.701	S	S	*	*			trans	-111.3	148	165.1	-98.3	-20.6	0	0	0	107.8
172	Y	23.8	Very low	27.6	Very low	210 Å²	210	129 Å²	129	82%	0.824	68%	0.683	S	S	*	*			trans	70.6	60.7	-175.6	-53.9	-77.4	0	0	0	116.6
173	C	25.9	Very low	28.3	Very low	112 Å²	112	124 Å²	124	76%	0.757	65%	0.653	S	S	*	*			trans	-129.7	132.4	131.8	-85.9	0	0	0	0	107.4
174	N	25	Very low	28.8	Very low	141 Å²	141	121.2 Å²	121.2	75%	0.754	64%	0.637	S	S	*	*			trans	-82.6	158.6	-167.7	-70.7	-30	0	0	0	112.6	E176	N174-E176 PolarHBondContact O-N 2.9Å
175	N	24.2	Very low	29.6	Very low	142 Å²	142	118.6 Å²	118.6	76%	0.759	62%	0.62	S	S	*	*			trans	-64.4	94.7	-177.4	-48.2	-70.9	0	0	0	112.3
176	E	29.1	Very low	30.3	Very low	180 Å²	180	115.1 Å²	115.1	84%	0.841	60%	0.597	S	S	*	*			trans	-126.8	147	166.5	-67.2	-167.5	165.7	0	0	110.9	N174 L178	N174-E176 PolarHBondContact O-N 2.9Å; E176-L178 PolarHBondContact O-N 3.36Å
177	H	32.1	Very low	31.1	Very low	127 Å²	127	108.5 Å²	108.5	59%	0.588	56%	0.563	S	S	*	*			trans	-84.2	116.4	-160.8	-131.4	50.1	0	0	0	111.7	D179	H177-D179 IonicContact CD2-OD2 3.14Å; H177-D179 PolarHBondContact O-N 3.12Å
178	L	33.2	Very low	32	Very low	73 Å²	73	103.9 Å²	103.9	38%	0.382	55%	0.552	S	S	.	*			trans	-76.7	72.6	164	-81	170.1	0	0	0	109.5	E176 Y215	E176-L178 PolarHBondContact O-N 3.36Å; L178-Y215 HydrophobicContact CB-CE1 4.07Å; L178-Y215 HydrophobicContact CD1-CD1 4.48Å; L178-Y215 HydrophobicContact CD1-CE1 4.17Å
179	D	34.2	Very low	32.8	Very low	83 Å²	83	102.4 Å²	102.4	44%	0.444	54%	0.536	S	S	.	.			trans	-68.5	161.7	178.7	-143.2	-36.3	0	0	0	112.1	H177 D181 H182	H177-D179 IonicContact CD2-OD2 3.14Å; H177-D179 PolarHBondContact O-N 3.12Å; D179-D181 PolarHBondContact O-N 3.19Å; D179-D181 VanDerWaalsContact O-N 3.12Å; D179-H182 PolarHBondContact O-N 3.21Å
180	I	35.7	Very low	34.1	Very low	66 Å²	66	96.7 Å²	96.7	34%	0.338	50%	0.501	S	S	.	.	H	α-helix	trans	-57.5	-32.8	-174	-66.2	172.6	0	0	0	111.6	H182 M183 N184 K206	I180-H182 VanDerWaalsContact C-N 3.33Å; I180-H182 PolarHBondContact O-N 2.92Å; I180-M183 WeakPolarHBondContact O-CB 3.47Å; I180-M183 PolarHBondContact O-N 2.64Å; I180-M183 VanDerWaalsContact O-N 3.09Å; I180-N184 PolarHBondContact O-N 3.09Å; I180-K206 HydrophobicContact CD1-CD 4.45Å; I180-K206 HydrophobicContact CD1-CG 3.95Å
181	D	33.4	Very low	35.7	Very low	121 Å²	121	96.9 Å²	96.9	65%	0.647	50%	0.503	S	S	*	.	H	α-helix	trans	-65.2	-31.3	179.8	-67.1	-31.4	0	0	0	113.5	D179 M183 N184 E185	D179-D181 PolarHBondContact O-N 3.19Å; D179-D181 VanDerWaalsContact O-N 3.12Å; D181-M183 VanDerWaalsContact C-N 3.3Å; D181-M183 PolarHBondContact O-N 2.99Å; D181-N184 WeakPolarHBondContact O-CB 3.3Å; D181-N184 PolarHBondContact O-N 3.38Å; D181-E185 PolarHBondContact O-N 3.11Å
182	H	39.7	Very low	37.7	Very low	67 Å²	67	91 Å²	91	31%	0.31	47%	0.471	S	S	.	.	H	α-helix	trans	-66.1	-31.9	172.6	-88.8	117.1	0	0	0	112.2	F136 D179 I180 E185 I186	F136-H182 AromaticContact CE2-CD2 3.76Å; F136-H182 AromaticContact CE2-NE2 3.83Å; F136-H182 AromaticContact CZ-CD2 3.6Å; F136-H182 AromaticContact CZ-NE2 3.83Å; D179-H182 PolarHBondContact O-N 3.21Å; I180-H182 VanDerWaalsContact C-N 3.33Å; I180-H182 PolarHBondContact O-N 2.92Å; H182-E185 IonicContact CD2-OE2 3.22Å; H182-E185 WeakPolarHBondContact O-CB 3.42Å; H182-E185 PolarHBondContact O-N 3.26Å; H182-I186 WeakPolarHBondContact O-CG1 3.49Å; H182-I186 PolarHBondContact O-N 3.5Å
183	M	40.5	Very low	39.9	Very low	9 Å²	9	84.8 Å²	84.8	4%	0.044	45%	0.452	C	S	.	.	H	α-helix	trans	-74.4	-34.6	176.7	-60	-57.9	-62	0	0	111.6	I180 D181 E185 I186 S187 F205 L219	I180-M183 WeakPolarHBondContact O-CB 3.47Å; I180-M183 PolarHBondContact O-N 2.64Å; I180-M183 VanDerWaalsContact O-N 3.09Å; D181-M183 VanDerWaalsContact C-N 3.3Å; D181-M183 PolarHBondContact O-N 2.99Å; M183-E185 VanDerWaalsContact C-N 3.31Å; M183-I186 HydrophobicContact CE-CD1 4.34Å; M183-I186 PolarHBondContact O-N 3.25Å; M183-I186 HydrophobicContact SD-CD1 3.88Å; M183-S187 PolarHBondContact O-N 2.88Å; M183-S187 VanDerWaalsContact O-N 3.12Å; M183-F205 HydrophobicContact CB-CD2 4.36Å; M183-F205 HydrophobicContact CB-CE2 4.22Å; M183-F205 HydrophobicContact CE-CD1 4.25Å; M183-F205 HydrophobicContact CE-CE1 3.61Å; M183-F205 HydrophobicContact CE-CE2 4.44Å; M183-F205 HydrophobicContact CE-CZ 3.73Å; M183-L219 HydrophobicContact CE-CD1 3.95Å; M183-L219 HydrophobicContact CE-CD2 4.41Å; M183-L219 HydrophobicContact SD-CD2 4.47Å
184	N	37.8	Very low	42	Very low	81 Å²	81	86.8 Å²	86.8	43%	0.433	45%	0.452	S	S	.	.	H	α-helix	trans	-61.7	-41.2	168.3	-68.5	-37.7	0	0	0	110.9	I180 D181 I186 S187 C188	I180-N184 PolarHBondContact O-N 3.09Å; D181-N184 WeakPolarHBondContact O-CB 3.3Å; D181-N184 PolarHBondContact O-N 3.38Å; N184-I186 VanDerWaalsContact C-N 3.35Å; N184-I186 PolarHBondContact O-N 2.97Å; N184-S187 WeakPolarHBondContact O-CB 3.3Å; N184-S187 PolarHBondContact O-N 2.83Å; N184-S187 VanDerWaalsContact O-N 3.17Å; N184-C188 PolarHBondContact O-N 2.91Å; N184-C188 PolarHBondContact O-SG 2.93Å; N184-C188 VanDerWaalsContact O-SG 3.4Å
185	E	41	Very low	44.2	Very low	97 Å²	97	87.1 Å²	87.1	45%	0.453	45%	0.449	S	S	.	.	H	α-helix	trans	-61.2	-40.8	175.3	-138.7	-160.5	141	0	0	112.3	D181 H182 M183 S187 C188 N189	D181-E185 PolarHBondContact O-N 3.11Å; H182-E185 IonicContact CD2-OE2 3.22Å; H182-E185 WeakPolarHBondContact O-CB 3.42Å; H182-E185 PolarHBondContact O-N 3.26Å; M183-E185 VanDerWaalsContact C-N 3.31Å; E185-S187 VanDerWaalsContact C-N 3.35Å; E185-S187 PolarHBondContact O-N 3.26Å; E185-C188 PolarHBondContact O-N 2.78Å; E185-N189 VanDerWaalsContact O-CB 3.28Å; E185-N189 WeakPolarHBondContact O-CB 3.32Å; E185-N189 VanDerWaalsContact O-CG 3.28Å; E185-N189 PolarHBondContact O-N 3.09Å; E185-N189 PolarHBondContact O-ND2 3.25Å; E185-N189 PolarHBondContact OE1-ND2 3.41Å
186	I	39.8	Very low	46.3	Very low	45 Å²	45	82.3 Å²	82.3	23%	0.231	42%	0.422	C	S	.	.	H	α-helix	trans	-60.9	-41.8	173.7	-70.1	165.4	0	0	0	111.2	H182 M183 N184 C188 N189 T190 M200	H182-I186 WeakPolarHBondContact O-CG1 3.49Å; H182-I186 PolarHBondContact O-N 3.5Å; M183-I186 HydrophobicContact CE-CD1 4.34Å; M183-I186 PolarHBondContact O-N 3.25Å; M183-I186 HydrophobicContact SD-CD1 3.88Å; N184-I186 VanDerWaalsContact C-N 3.35Å; N184-I186 PolarHBondContact O-N 2.97Å; I186-C188 VanDerWaalsContact C-N 3.31Å; I186-C188 PolarHBondContact O-N 3.07Å; I186-N189 PolarHBondContact O-N 2.97Å; I186-T190 HydrophobicContact CG2-CG2 4.2Å; I186-T190 WeakPolarHBondContact O-CB 3.5Å; I186-T190 WeakPolarHBondContact O-CG2 3.45Å; I186-T190 PolarHBondContact O-N 3.5Å; I186-T190 VanDerWaalsContact O-N 3.12Å; I186-T190 PolarHBondContact O-OG1 3.25Å; I186-M200 HydrophobicContact CG2-CE 4.01Å; I186-M200 HydrophobicContact CG2-SD 4.19Å
187	S	43	Very low	48.1	Very low	24 Å²	24	77 Å²	77	17%	0.168	40%	0.396	C	S	.	.	H	α-helix	trans	-65.4	-33	176.3	-168.7	0	0	0	0	112.9	M183 N184 E185 K197 M200	M183-S187 PolarHBondContact O-N 2.88Å; M183-S187 VanDerWaalsContact O-N 3.12Å; N184-S187 WeakPolarHBondContact O-CB 3.3Å; N184-S187 PolarHBondContact O-N 2.83Å; N184-S187 VanDerWaalsContact O-N 3.17Å; E185-S187 VanDerWaalsContact C-N 3.35Å; E185-S187 PolarHBondContact O-N 3.26Å; S187-K197 WeakPolarHBondContact O-CE 3.2Å; S187-K197 PolarHBondContact O-NZ 2.81Å; S187-M200 VanDerWaalsContact CA-SD 3.51Å; S187-M200 VanDerWaalsContact CB-SD 3.52Å
188	C	40.3	Very low	50	Low	98 Å²	98	78.5 Å²	78.5	66%	0.662	40%	0.397	S	S	*	.	H	α-helix	trans	-74.1	-44.6	174.4	-67.7	0	0	0	0	112.5	N184 E185 I186	N184-C188 PolarHBondContact O-N 2.91Å; N184-C188 PolarHBondContact O-SG 2.93Å; N184-C188 VanDerWaalsContact O-SG 3.4Å; E185-C188 PolarHBondContact O-N 2.78Å; I186-C188 VanDerWaalsContact C-N 3.31Å; I186-C188 PolarHBondContact O-N 3.07Å
189	N	42.1	Very low	51.7	Low	87 Å²	87	77 Å²	77	47%	0.465	39%	0.391	S	S	.	.	H	α-helix	trans	-81.8	-15	-171	-70.7	-26.1	0	0	0	114.6	E185 I186 M239	E185-N189 VanDerWaalsContact O-CB 3.28Å; E185-N189 WeakPolarHBondContact O-CB 3.32Å; E185-N189 VanDerWaalsContact O-CG 3.28Å; E185-N189 PolarHBondContact O-N 3.09Å; E185-N189 PolarHBondContact O-ND2 3.25Å; E185-N189 PolarHBondContact OE1-ND2 3.41Å; I186-N189 PolarHBondContact O-N 2.97Å; N189-M239 HydrophobicContact CB-CE 4.39Å; N189-M239 VanDerWaalsContact O-SD 3.39Å
190	T	51.4	Low	53.2	Low	3 Å²	3	73.3 Å²	73.3	2%	0.018	37%	0.371	C	S	.	.	S	Bend	trans	-97	144	-178.1	52.7	0	0	0	0	114.3	I186 L192 K197 S235 M239	I186-T190 HydrophobicContact CG2-CG2 4.2Å; I186-T190 WeakPolarHBondContact O-CB 3.5Å; I186-T190 WeakPolarHBondContact O-CG2 3.45Å; I186-T190 PolarHBondContact O-N 3.5Å; I186-T190 VanDerWaalsContact O-N 3.12Å; I186-T190 PolarHBondContact O-OG1 3.25Å; T190-L192 PolarHBondContact O-N 3.05Å; T190-L192 WeakPolarHBondContact OG1-CD1 3.48Å; T190-L192 WeakPolarHBondContact OG1-CG 3.24Å; T190-K197 WeakPolarHBondContact O-CE 3.24Å; T190-K197 PolarHBondContact O-NZ 3.07Å; T190-S235 VanDerWaalsContact CA-OG 3.23Å; T190-S235 WeakPolarHBondContact CA-OG 3.46Å; T190-S235 WeakPolarHBondContact CB-OG 3.45Å; T190-M239 HydrophobicContact CG2-SD 4.03Å
191	D	56	Low	54.6	Low	134 Å²	134	77 Å²	77	72%	0.717	39%	0.386	S	S	*	.			trans	-75.8	42.5	171.8	-76.6	-42.8	0	0	0	112.3	S235	D191-S235 PolarHBondContact N-OG 3.44Å
192	L	63.1	Low	56.2	Low	12 Å²	12	76.4 Å²	76.4	6%	0.063	38%	0.383	C	S	.	.			trans	-72.5	144.6	170.7	-66	177.2	0	0	0	110.6	T190 E196 K197 M200 L228 I232	T190-L192 PolarHBondContact O-N 3.05Å; T190-L192 WeakPolarHBondContact OG1-CD1 3.48Å; T190-L192 WeakPolarHBondContact OG1-CG 3.24Å; L192-E196 WeakPolarHBondContact CA-OE2 3.45Å; L192-E196 HydrophobicContact CB-CB 3.82Å; L192-E196 HydrophobicContact CD2-CB 4.12Å; L192-E196 HydrophobicContact CG-CB 4.36Å; L192-K197 HydrophobicContact CB-CD 4.42Å; L192-K197 HydrophobicContact CB-CG 3.65Å; L192-K197 WeakPolarHBondContact O-CE 3.16Å; L192-M200 HydrophobicContact CD1-CE 3.47Å; L192-M200 VanDerWaalsContact CD1-CE 3.47Å; L192-M200 HydrophobicContact CD1-SD 3.77Å; L192-L228 HydrophobicContact CD1-CD2 4.35Å; L192-I232 HydrophobicContact CD1-CG1 4.33Å; L192-I232 HydrophobicContact CD2-CG1 4.31Å
193	N	70.7	Confident	57.4	Low	78 Å²	78	73.4 Å²	73.4	42%	0.417	37%	0.37	S	S	.	.			trans	-73	169.3	177	79.9	55.9	0	0	0	112.1	E195 E196 K197	N193-E195 PolarHBondContact O-N 3.33Å; N193-E195 VanDerWaalsContact O-N 3.13Å; N193-E195 WeakPolarHBondContact OD1-CA 3.35Å; N193-E195 VanDerWaalsContact OD1-CB 3.31Å; N193-E195 WeakPolarHBondContact OD1-CB 3.31Å; N193-E195 PolarHBondContact OD1-N 3.44Å; N193-E196 PolarHBondContact N-OE2 3.41Å; N193-E196 WeakPolarHBondContact ND2-CG 3.48Å; N193-E196 PolarHBondContact ND2-OE1 3.37Å; N193-E196 PolarHBondContact ND2-OE2 2.96Å; N193-E196 PolarHBondContact O-N 3.28Å; N193-E196 PolarHBondContact OD1-N 3.41Å; N193-K197 WeakPolarHBondContact O-CG 3.35Å; N193-K197 PolarHBondContact O-N 2.86Å
194	M	69	Low	58.2	Low	154 Å²	154	76.5 Å²	76.5	76%	0.759	39%	0.386	S	S	*	.	T	Hydrogen-bonded Turn	trans	-60	-23.3	-176.2	-82	-96.7	-75.1	0	0	115.1	R198	M194-R198 WeakPolarHBondContact O-CD 3.28Å; M194-R198 WeakPolarHBondContact O-CG 3.48Å
195	E	71	Confident	59.3	Low	149 Å²	149	73.8 Å²	73.8	70%	0.696	37%	0.371	S	S	*	.	T	Hydrogen-bonded Turn	trans	-88.8	-40.2	177.8	-163	163.5	-171.9	0	0	110.4	N193 K197 R198 T199	N193-E195 PolarHBondContact O-N 3.33Å; N193-E195 VanDerWaalsContact O-N 3.13Å; N193-E195 WeakPolarHBondContact OD1-CA 3.35Å; N193-E195 VanDerWaalsContact OD1-CB 3.31Å; N193-E195 WeakPolarHBondContact OD1-CB 3.31Å; N193-E195 PolarHBondContact OD1-N 3.44Å; E195-K197 PolarHBondContact O-N 3.07Å; E195-R198 WeakPolarHBondContact O-CB 3.25Å; E195-R198 PolarHBondContact O-N 3.4Å; E195-R198 VanDerWaalsContact O-N 3.14Å; E195-T199 PolarHBondContact O-N 3.17Å; E195-T199 PolarHBondContact O-OG1 3.44Å
196	E	69.4	Low	59.9	Low	41 Å²	41	77 Å²	77	19%	0.192	38%	0.383	C	S	.	.	H	α-helix	trans	-63.1	-36.8	171.3	-70.7	166.7	166.3	0	0	112.9	L192 N193 R198 T199 M200 L228 S231	L192-E196 WeakPolarHBondContact CA-OE2 3.45Å; L192-E196 HydrophobicContact CB-CB 3.82Å; L192-E196 HydrophobicContact CD2-CB 4.12Å; L192-E196 HydrophobicContact CG-CB 4.36Å; N193-E196 PolarHBondContact N-OE2 3.41Å; N193-E196 WeakPolarHBondContact ND2-CG 3.48Å; N193-E196 PolarHBondContact ND2-OE1 3.37Å; N193-E196 PolarHBondContact ND2-OE2 2.96Å; N193-E196 PolarHBondContact O-N 3.28Å; N193-E196 PolarHBondContact OD1-N 3.41Å; E196-R198 VanDerWaalsContact C-N 3.3Å; E196-R198 PolarHBondContact O-N 3.44Å; E196-T199 WeakPolarHBondContact CA-OG1 3.35Å; E196-T199 PolarHBondContact O-N 2.81Å; E196-T199 PolarHBondContact O-OG1 3.46Å; E196-T199 VanDerWaalsContact O-OG1 3.1Å; E196-M200 VanDerWaalsContact O-CB 3.28Å; E196-M200 WeakPolarHBondContact O-CB 3.33Å; E196-M200 PolarHBondContact O-N 2.96Å; E196-L228 HydrophobicContact CB-CD2 3.71Å; E196-L228 HydrophobicContact CG-CD2 4.01Å; E196-L228 WeakPolarHBondContact O-CD2 3.36Å; E196-S231 WeakPolarHBondContact OE1-CB 3.49Å; E196-S231 PolarHBondContact OE1-OG 3.05Å
197	K	67.6	Low	60.8	Low	67 Å²	67	79.9 Å²	79.9	29%	0.291	40%	0.399	S	S	.	.	H	α-helix	trans	-71.1	-24.7	173.9	-67.5	-161.9	-180	-154.9	0	112.8	S187 T190 L192 N193 E195 H201	S187-K197 WeakPolarHBondContact O-CE 3.2Å; S187-K197 PolarHBondContact O-NZ 2.81Å; T190-K197 WeakPolarHBondContact O-CE 3.24Å; T190-K197 PolarHBondContact O-NZ 3.07Å; L192-K197 HydrophobicContact CB-CD 4.42Å; L192-K197 HydrophobicContact CB-CG 3.65Å; L192-K197 WeakPolarHBondContact O-CE 3.16Å; N193-K197 WeakPolarHBondContact O-CG 3.35Å; N193-K197 PolarHBondContact O-N 2.86Å; E195-K197 PolarHBondContact O-N 3.07Å; K197-H201 WeakPolarHBondContact O-CB 3.35Å; K197-H201 PolarHBondContact O-N 3.22Å
198	R	70.3	Confident	61.5	Low	160 Å²	160	79.1 Å²	79.1	60%	0.604	39%	0.393	S	S	*	.	H	α-helix	trans	-73.5	-51.8	169.7	-72.8	165.8	-179.4	-108	-0.3	110.7	M194 E195 E196 M200 H201 D202	M194-R198 WeakPolarHBondContact O-CD 3.28Å; M194-R198 WeakPolarHBondContact O-CG 3.48Å; E195-R198 WeakPolarHBondContact O-CB 3.25Å; E195-R198 PolarHBondContact O-N 3.4Å; E195-R198 VanDerWaalsContact O-N 3.14Å; E196-R198 VanDerWaalsContact C-N 3.3Å; E196-R198 PolarHBondContact O-N 3.44Å; R198-M200 PolarHBondContact O-N 3.1Å; R198-H201 CarbonylContact O-C 3.59Å; R198-H201 WeakPolarHBondContact O-CA 3.45Å; R198-H201 WeakPolarHBondContact O-CB 3.33Å; R198-H201 PolarHBondContact O-N 3.28Å; R198-D202 WeakPolarHBondContact O-CB 3.44Å; R198-D202 PolarHBondContact O-N 3.38Å
199	T	70.7	Confident	62.2	Low	42 Å²	42	78.5 Å²	78.5	26%	0.258	39%	0.388	S	S	.	.	H	α-helix	trans	-61.3	-31.3	178	55.5	0	0	0	0	112.8	E195 E196 L203	E195-T199 PolarHBondContact O-N 3.17Å; E195-T199 PolarHBondContact O-OG1 3.44Å; E196-T199 WeakPolarHBondContact CA-OG1 3.35Å; E196-T199 PolarHBondContact O-N 2.81Å; E196-T199 PolarHBondContact O-OG1 3.46Å; E196-T199 VanDerWaalsContact O-OG1 3.1Å; T199-L203 WeakPolarHBondContact O-CG 3.21Å; T199-L203 PolarHBondContact O-N 3.32Å; T199-L203 VanDerWaalsContact O-N 3.13Å
200	M	65.8	Low	62.5	Low	4 Å²	4	80 Å²	80	2%	0.02	40%	0.396	C	S	.	.	H	α-helix	trans	-69.1	-34.9	171.3	-179.3	167	-77.7	0	0	113.7	I186 S187 L192 E196 R198 F205 L228 I232	I186-M200 HydrophobicContact CG2-CE 4.01Å; I186-M200 HydrophobicContact CG2-SD 4.19Å; S187-M200 VanDerWaalsContact CA-SD 3.51Å; S187-M200 VanDerWaalsContact CB-SD 3.52Å; L192-M200 HydrophobicContact CD1-CE 3.47Å; L192-M200 VanDerWaalsContact CD1-CE 3.47Å; L192-M200 HydrophobicContact CD1-SD 3.77Å; E196-M200 VanDerWaalsContact O-CB 3.28Å; E196-M200 WeakPolarHBondContact O-CB 3.33Å; E196-M200 PolarHBondContact O-N 2.96Å; R198-M200 PolarHBondContact O-N 3.1Å; M200-F205 WeakPolarHBondContact O-CE2 3.46Å; M200-L228 HydrophobicContact CB-CD1 4.06Å; M200-I232 HydrophobicContact CE-CD1 3.45Å; M200-I232 VanDerWaalsContact CE-CD1 3.45Å; M200-I232 HydrophobicContact CE-CG1 3.8Å
201	H	64.8	Low	62.3	Low	144 Å²	144	85.4 Å²	85.4	67%	0.667	43%	0.425	S	S	*	.	H	α-helix	trans	-75.6	-35.5	175.3	175.1	-82.5	0	0	0	112.2	K197 R198 L203	K197-H201 WeakPolarHBondContact O-CB 3.35Å; K197-H201 PolarHBondContact O-N 3.22Å; R198-H201 CarbonylContact O-C 3.59Å; R198-H201 WeakPolarHBondContact O-CA 3.45Å; R198-H201 WeakPolarHBondContact O-CB 3.33Å; R198-H201 PolarHBondContact O-N 3.28Å; H201-L203 VanDerWaalsContact C-N 3.29Å; H201-L203 PolarHBondContact O-N 2.89Å
202	D	66	Low	61.9	Low	108 Å²	108	85.2 Å²	85.2	58%	0.578	42%	0.424	S	S	*	.	H	α-helix	trans	-81.4	-9.7	-178.5	-59.8	-22.5	0	0	0	112.5	R198 N204	R198-D202 WeakPolarHBondContact O-CB 3.44Å; R198-D202 PolarHBondContact O-N 3.38Å; D202-N204 PolarHBondContact O-N 3.22Å; D202-N204 VanDerWaalsContact O-N 3.08Å
203	L	64.5	Low	61.1	Low	5 Å²	5	91.7 Å²	91.7	3%	0.026	46%	0.458	C	S	.	.			trans	-65.4	103.7	168.7	-92.6	174.2	0	0	0	110.6	T199 H201 F205 K222 L223 Y226 L228	T199-L203 WeakPolarHBondContact O-CG 3.21Å; T199-L203 PolarHBondContact O-N 3.32Å; T199-L203 VanDerWaalsContact O-N 3.13Å; H201-L203 VanDerWaalsContact C-N 3.29Å; H201-L203 PolarHBondContact O-N 2.89Å; L203-F205 VanDerWaalsContact C-N 3.34Å; L203-F205 HydrophobicContact CB-CD2 4.4Å; L203-F205 HydrophobicContact CB-CE1 3.97Å; L203-F205 HydrophobicContact CB-CE2 3.79Å; L203-F205 HydrophobicContact CB-CZ 3.55Å; L203-F205 HydrophobicContact CD1-CE1 3.98Å; L203-F205 HydrophobicContact CD1-CZ 3.78Å; L203-F205 HydrophobicContact CG-CZ 4.3Å; L203-F205 WeakPolarHBondContact O-CD2 3.31Å; L203-F205 WeakPolarHBondContact O-CE2 3.46Å; L203-F205 PolarHBondContact O-N 2.85Å; L203-K222 HydrophobicContact CD2-CB 3.96Å; L203-K222 HydrophobicContact CD2-CD 4.22Å; L203-K222 HydrophobicContact CD2-CG 4.41Å; L203-L223 HydrophobicContact CD1-CD2 3.88Å; L203-Y226 HydrophobicContact CD2-CD1 4.18Å; L203-Y226 HydrophobicContact CD2-CD2 3.7Å; L203-Y226 HydrophobicContact CD2-CE1 4.07Å; L203-Y226 HydrophobicContact CD2-CE2 3.58Å; L203-Y226 HydrophobicContact CD2-CG 4Å; L203-Y226 HydrophobicContact CG-CD1 4.17Å; L203-Y226 HydrophobicContact CG-CD2 4.46Å; L203-Y226 HydrophobicContact CG-CE1 4.25Å; L203-Y226 HydrophobicContact CG-CG 4.27Å; L203-L228 HydrophobicContact CD1-CD1 3.71Å
204	N	58.8	Low	60.1	Low	73 Å²	73	89.4 Å²	89.4	39%	0.39	45%	0.453	S	S	.	.			trans	-71	89.7	172.3	-167.2	17.9	0	0	0	111	D202 K206 D207 K222	D202-N204 PolarHBondContact O-N 3.22Å; D202-N204 VanDerWaalsContact O-N 3.08Å; N204-K206 PolarHBondContact O-N 3.26Å; N204-K206 WeakPolarHBondContact OD1-CB 3.38Å; N204-K206 PolarHBondContact OD1-N 3.03Å; N204-D207 WeakPolarHBondContact CB-OD2 3.46Å; N204-D207 PolarHBondContact ND2-OD1 2.85Å; N204-D207 PolarHBondContact ND2-OD2 3.2Å; N204-D207 PolarHBondContact O-N 3.49Å; N204-K222 PolarHBondContact O-NZ 3.13Å
205	F	60.1	Low	59.7	Low	25 Å²	25	83.8 Å²	83.8	11%	0.11	42%	0.424	C	S	.	.	G	3₁₀ helix	trans	-65.6	-21.1	176.1	-61.6	-70.5	0	0	0	112.7	M183 M200 L203 D207 I208 L219	M183-F205 HydrophobicContact CB-CD2 4.36Å; M183-F205 HydrophobicContact CB-CE2 4.22Å; M183-F205 HydrophobicContact CE-CD1 4.25Å; M183-F205 HydrophobicContact CE-CE1 3.61Å; M183-F205 HydrophobicContact CE-CE2 4.44Å; M183-F205 HydrophobicContact CE-CZ 3.73Å; M200-F205 WeakPolarHBondContact O-CE2 3.46Å; L203-F205 VanDerWaalsContact C-N 3.34Å; L203-F205 HydrophobicContact CB-CD2 4.4Å; L203-F205 HydrophobicContact CB-CE1 3.97Å; L203-F205 HydrophobicContact CB-CE2 3.79Å; L203-F205 HydrophobicContact CB-CZ 3.55Å; L203-F205 HydrophobicContact CD1-CE1 3.98Å; L203-F205 HydrophobicContact CD1-CZ 3.78Å; L203-F205 HydrophobicContact CG-CZ 4.3Å; L203-F205 WeakPolarHBondContact O-CD2 3.31Å; L203-F205 WeakPolarHBondContact O-CE2 3.46Å; L203-F205 PolarHBondContact O-N 2.85Å; F205-D207 PolarHBondContact O-N 3.49Å; F205-I208 HydrophobicContact CB-CD1 4.44Å; F205-I208 HydrophobicContact CD1-CD1 3.91Å; F205-I208 WeakPolarHBondContact O-CB 3.43Å; F205-I208 WeakPolarHBondContact O-CG1 3.28Å; F205-I208 PolarHBondContact O-N 2.83Å; F205-I208 VanDerWaalsContact O-N 3.09Å; F205-L219 HydrophobicContact CD1-CD1 3.89Å; F205-L219 HydrophobicContact CE1-CD1 3.64Å
206	K	54.6	Low	59	Low	163 Å²	163	81.1 Å²	81.1	71%	0.709	41%	0.414	S	S	*	.	G	3₁₀ helix	trans	-64.9	-21.1	177.2	-59.2	178.8	178.9	175.7	0	113.3	I180 N204 I208	I180-K206 HydrophobicContact CD1-CD 4.45Å; I180-K206 HydrophobicContact CD1-CG 3.95Å; N204-K206 PolarHBondContact O-N 3.26Å; N204-K206 WeakPolarHBondContact OD1-CB 3.38Å; N204-K206 PolarHBondContact OD1-N 3.03Å; K206-I208 VanDerWaalsContact C-N 3.25Å; K206-I208 PolarHBondContact O-N 2.97Å
207	D	57.6	Low	58.6	Low	106 Å²	106	82.9 Å²	82.9	57%	0.567	43%	0.427	S	S	*	.	G	3₁₀ helix	trans	-85.6	9.8	176.3	-53.5	-28.3	0	0	0	112.8	N204 F205	N204-D207 WeakPolarHBondContact CB-OD2 3.46Å; N204-D207 PolarHBondContact ND2-OD1 2.85Å; N204-D207 PolarHBondContact ND2-OD2 3.2Å; N204-D207 PolarHBondContact O-N 3.49Å; F205-D207 PolarHBondContact O-N 3.49Å
208	I	56.9	Low	58.4	Low	9 Å²	9	82.9 Å²	82.9	5%	0.046	43%	0.429	C	S	.	.	S	Bend	trans	-90	120.8	175.8	-57.6	177.9	0	0	0	109.2	F205 K206 N210 Y215 E218 L219 K222	F205-I208 HydrophobicContact CB-CD1 4.44Å; F205-I208 HydrophobicContact CD1-CD1 3.91Å; F205-I208 WeakPolarHBondContact O-CB 3.43Å; F205-I208 WeakPolarHBondContact O-CG1 3.28Å; F205-I208 PolarHBondContact O-N 2.83Å; F205-I208 VanDerWaalsContact O-N 3.09Å; K206-I208 VanDerWaalsContact C-N 3.25Å; K206-I208 PolarHBondContact O-N 2.97Å; I208-N210 PolarHBondContact O-N 2.88Å; I208-N210 VanDerWaalsContact O-N 3.1Å; I208-Y215 HydrophobicContact CB-CD2 3.89Å; I208-Y215 HydrophobicContact CB-CE2 3.78Å; I208-Y215 HydrophobicContact CD1-CE2 4.15Å; I208-Y215 HydrophobicContact CG2-CD2 3.28Å; I208-Y215 HydrophobicContact CG2-CE2 3.65Å; I208-Y215 HydrophobicContact CG2-CG 3.95Å; I208-E218 HydrophobicContact CG2-CB 4.05Å; I208-E218 HydrophobicContact CG2-CG 4.5Å; I208-L219 HydrophobicContact CD1-CB 4.13Å; I208-L219 HydrophobicContact CD1-CD1 4.03Å; I208-K222 HydrophobicContact CD1-CD 4.08Å; I208-K222 HydrophobicContact CG1-CD 3.94Å
209	P	55.1	Low	58.4	Low	85 Å²	85	75.9 Å²	75.9	55%	0.552	40%	0.403	S	S	*	.			trans	-61.5	115.2	179.5	-24.3	35.2	0	0	0	112.1	N211	P209-N211 PolarHBondContact O-N 3.28Å
210	N	49.3	Very low	58.3	Low	119 Å²	119	76.4 Å²	76.4	64%	0.636	40%	0.403	S	S	*	.			trans	-79.3	66.8	-176.4	-159.3	-0.4	0	0	0	111.4	I208	I208-N210 PolarHBondContact O-N 2.88Å; I208-N210 VanDerWaalsContact O-N 3.1Å
211	N	46.8	Very low	58.5	Low	116 Å²	116	81.3 Å²	81.3	62%	0.62	43%	0.425	S	S	*	.			trans	-126.3	139.6	-179.2	-167.9	-2.9	0	0	0	109.5	P209 N213 G214 Y215	P209-N211 PolarHBondContact O-N 3.28Å; N211-N213 VanDerWaalsContact C-N 3.26Å; N211-N213 PolarHBondContact O-N 2.9Å; N211-G214 PolarHBondContact O-N 3.44Å; N211-Y215 PolarHBondContact O-N 3.4Å
212	N	47	Very low	58.9	Low	130 Å²	130	76.3 Å²	76.3	70%	0.695	40%	0.401	S	S	*	.	T	Hydrogen-bonded Turn	trans	-60	-22.8	-148.8	-64.4	4.6	0	0	0	116.7
213	N	46.4	Very low	59.2	Low	147 Å²	147	71.8 Å²	71.8	79%	0.786	38%	0.377	S	S	*	.	T	Hydrogen-bonded Turn	trans	-114.5	-2.5	176.4	-66.7	-33.1	0	0	0	113.7	N211 T217	N211-N213 VanDerWaalsContact C-N 3.26Å; N211-N213 PolarHBondContact O-N 2.9Å; N213-T217 PolarHBondContact O-OG1 2.91Å
214	G	51.6	Low	59.5	Low	31 Å²	31	76.8 Å²	76.8	32%	0.32	40%	0.4	S	S	.	.	T	Hydrogen-bonded Turn	trans	-93.7	-39.9	-175.2	0	0	0	0	0	114	N211 L216 T217 E218	N211-G214 PolarHBondContact O-N 3.44Å; G214-L216 PolarHBondContact O-N 3.5Å; G214-T217 PolarHBondContact O-N 2.83Å; G214-E218 PolarHBondContact O-N 3.06Å
215	Y	59.7	Low	60.2	Low	35 Å²	35	77.3 Å²	77.3	14%	0.137	41%	0.414	C	S	.	.	H	α-helix	trans	-55.2	-50.9	-170	-176.6	-90.8	0	0	0	113.1	L178 I208 N211 T217 E218 L219	L178-Y215 HydrophobicContact CB-CE1 4.07Å; L178-Y215 HydrophobicContact CD1-CD1 4.48Å; L178-Y215 HydrophobicContact CD1-CE1 4.17Å; I208-Y215 HydrophobicContact CB-CD2 3.89Å; I208-Y215 HydrophobicContact CB-CE2 3.78Å; I208-Y215 HydrophobicContact CD1-CE2 4.15Å; I208-Y215 HydrophobicContact CG2-CD2 3.28Å; I208-Y215 HydrophobicContact CG2-CE2 3.65Å; I208-Y215 HydrophobicContact CG2-CG 3.95Å; N211-Y215 PolarHBondContact O-N 3.4Å; Y215-T217 PolarHBondContact O-N 3.09Å; Y215-E218 PolarHBondContact O-N 2.77Å; Y215-L219 HydrophobicContact CE1-CD2 4.03Å; Y215-L219 WeakPolarHBondContact O-CB 3.26Å; Y215-L219 PolarHBondContact O-N 3.38Å
216	L	56.9	Low	60.7	Low	93 Å²	93	81.7 Å²	81.7	49%	0.487	43%	0.431	S	S	.	.	H	α-helix	trans	-63	-42.6	-179.9	-176.9	65.1	0	0	0	112.1	G214 E218 L219 M220	G214-L216 PolarHBondContact O-N 3.5Å; L216-E218 PolarHBondContact O-N 3.49Å; L216-L219 PolarHBondContact O-N 3.33Å; L216-M220 HydrophobicContact CD1-CG 4.44Å; L216-M220 WeakPolarHBondContact O-CB 3.4Å; L216-M220 WeakPolarHBondContact O-CG 3.36Å; L216-M220 PolarHBondContact O-N 2.88Å
217	T	60.1	Low	61.8	Low	78 Å²	78	76.2 Å²	76.2	48%	0.479	42%	0.421	S	S	.	.	H	α-helix	trans	-62.2	-44.3	179.2	-53.7	0	0	0	0	111.3	N213 G214 Y215 M220 K221	N213-T217 PolarHBondContact O-OG1 2.91Å; G214-T217 PolarHBondContact O-N 2.83Å; Y215-T217 PolarHBondContact O-N 3.09Å; T217-M220 PolarHBondContact O-N 2.79Å; T217-K221 WeakPolarHBondContact O-CG 3.34Å; T217-K221 PolarHBondContact O-N 3.18Å; T217-K221 VanDerWaalsContact O-N 3.08Å
218	E	62.7	Low	62.6	Low	67 Å²	67	71.2 Å²	71.2	31%	0.313	39%	0.394	S	S	.	.	H	α-helix	trans	-77.4	-31.8	-178.3	-156.9	63.8	-150	0	0	112.3	I208 G214 Y215 L216 K221 K222	I208-E218 HydrophobicContact CG2-CB 4.05Å; I208-E218 HydrophobicContact CG2-CG 4.5Å; G214-E218 PolarHBondContact O-N 3.06Å; Y215-E218 PolarHBondContact O-N 2.77Å; L216-E218 PolarHBondContact O-N 3.49Å; E218-K221 IonicContact OE1-NZ 3.39Å; E218-K221 WeakPolarHBondContact OE2-CD 3.42Å; E218-K221 WeakPolarHBondContact OE2-CE 3.28Å; E218-K221 IonicContact OE2-NZ 2.71Å; E218-K221 PolarHBondContact OE2-NZ 3.11Å; E218-K222 WeakPolarHBondContact O-CG 3.48Å; E218-K222 PolarHBondContact O-N 3.17Å
219	L	70.8	Confident	63.3	Low	13 Å²	13	72 Å²	72	7%	0.068	40%	0.398	C	S	.	.	H	α-helix	trans	-61.5	-47.5	167.7	176.6	61.2	0	0	0	111.1	M183 F205 I208 Y215 L216 K221 K222 L223	M183-L219 HydrophobicContact CE-CD1 3.95Å; M183-L219 HydrophobicContact CE-CD2 4.41Å; M183-L219 HydrophobicContact SD-CD2 4.47Å; F205-L219 HydrophobicContact CD1-CD1 3.89Å; F205-L219 HydrophobicContact CE1-CD1 3.64Å; I208-L219 HydrophobicContact CD1-CB 4.13Å; I208-L219 HydrophobicContact CD1-CD1 4.03Å; Y215-L219 HydrophobicContact CE1-CD2 4.03Å; Y215-L219 WeakPolarHBondContact O-CB 3.26Å; Y215-L219 PolarHBondContact O-N 3.38Å; L216-L219 PolarHBondContact O-N 3.33Å; L219-K221 PolarHBondContact O-N 3.42Å; L219-K222 PolarHBondContact O-N 3.18Å; L219-K222 VanDerWaalsContact O-N 3.15Å; L219-L223 HydrophobicContact CD1-CD1 4.18Å; L219-L223 HydrophobicContact CD1-CG 4.15Å; L219-L223 HydrophobicContact CG-CD1 4.15Å; L219-L223 HydrophobicContact CG-CG 4.48Å; L219-L223 WeakPolarHBondContact O-CG 3.21Å; L219-L223 PolarHBondContact O-N 2.74Å
220	M	68.6	Low	63.6	Low	54 Å²	54	74.1 Å²	74.1	27%	0.266	40%	0.396	S	S	.	.	H	α-helix	trans	-59.7	-44.8	177.4	-74.6	-71.3	-67.5	0	0	111.6	L143 L216 T217 K222 L223 E224 L229	L143-M220 HydrophobicContact CD2-CE 3.84Å; L216-M220 HydrophobicContact CD1-CG 4.44Å; L216-M220 WeakPolarHBondContact O-CB 3.4Å; L216-M220 WeakPolarHBondContact O-CG 3.36Å; L216-M220 PolarHBondContact O-N 2.88Å; T217-M220 PolarHBondContact O-N 2.79Å; M220-K222 PolarHBondContact O-N 3.49Å; M220-L223 PolarHBondContact O-N 3.07Å; M220-E224 WeakPolarHBondContact O-CB 3.46Å; M220-E224 PolarHBondContact O-N 3.26Å; M220-L229 HydrophobicContact CE-CD1 3.71Å; M220-L229 HydrophobicContact CE-CD2 3.89Å; M220-L229 HydrophobicContact CE-CG 4.47Å; M220-L229 HydrophobicContact SD-CD1 3.79Å
221	K	70.6	Confident	64.2	Low	107 Å²	107	69.4 Å²	69.4	47%	0.465	37%	0.372	S	S	.	.	H	α-helix	trans	-58.2	-44.2	172.2	-70.2	176.7	-163.6	164.4	0	112.6	T217 E218 L219 E224 A225	T217-K221 WeakPolarHBondContact O-CG 3.34Å; T217-K221 PolarHBondContact O-N 3.18Å; T217-K221 VanDerWaalsContact O-N 3.08Å; E218-K221 IonicContact OE1-NZ 3.39Å; E218-K221 WeakPolarHBondContact OE2-CD 3.42Å; E218-K221 WeakPolarHBondContact OE2-CE 3.28Å; E218-K221 IonicContact OE2-NZ 2.71Å; E218-K221 PolarHBondContact OE2-NZ 3.11Å; L219-K221 PolarHBondContact O-N 3.42Å; K221-E224 PolarHBondContact O-N 3.21Å; K221-A225 VanDerWaalsContact O-CB 3.24Å; K221-A225 WeakPolarHBondContact O-CB 3.27Å; K221-A225 PolarHBondContact O-N 3.48Å
222	K	72.6	Confident	64.8	Low	39 Å²	39	65 Å²	65	17%	0.17	35%	0.348	C	S	.	.	H	α-helix	trans	-63.1	-43.2	177.3	-78.8	-173.2	178.1	-177.9	0	111.4	L203 N204 I208 E218 L219 M220 A225 Y226	L203-K222 HydrophobicContact CD2-CB 3.96Å; L203-K222 HydrophobicContact CD2-CD 4.22Å; L203-K222 HydrophobicContact CD2-CG 4.41Å; N204-K222 PolarHBondContact O-NZ 3.13Å; I208-K222 HydrophobicContact CD1-CD 4.08Å; I208-K222 HydrophobicContact CG1-CD 3.94Å; E218-K222 WeakPolarHBondContact O-CG 3.48Å; E218-K222 PolarHBondContact O-N 3.17Å; L219-K222 PolarHBondContact O-N 3.18Å; L219-K222 VanDerWaalsContact O-N 3.15Å; M220-K222 PolarHBondContact O-N 3.49Å; K222-A225 PolarHBondContact O-N 2.77Å; K222-Y226 WeakPolarHBondContact O-CB 3.28Å; K222-Y226 VanDerWaalsContact O-CD2 3.23Å; K222-Y226 WeakPolarHBondContact O-CD2 3.42Å; K222-Y226 PolarHBondContact O-N 3.34Å; K222-Y226 VanDerWaalsContact O-N 3.11Å
223	L	72.5	Confident	65.3	Low	13 Å²	13	64.4 Å²	64.4	7%	0.068	34%	0.337	C	S	.	.	H	α-helix	trans	-67.8	-33.4	177.1	-66	178.3	0	0	0	112.8	L203 L219 M220 G227 L228 L229 I232	L203-L223 HydrophobicContact CD1-CD2 3.88Å; L219-L223 HydrophobicContact CD1-CD1 4.18Å; L219-L223 HydrophobicContact CD1-CG 4.15Å; L219-L223 HydrophobicContact CG-CD1 4.15Å; L219-L223 HydrophobicContact CG-CG 4.48Å; L219-L223 WeakPolarHBondContact O-CG 3.21Å; L219-L223 PolarHBondContact O-N 2.74Å; M220-L223 PolarHBondContact O-N 3.07Å; L223-G227 CarbonylContact O-C 3.6Å; L223-G227 PolarHBondContact O-N 3.45Å; L223-L228 HydrophobicContact CD2-CB 4.12Å; L223-L228 HydrophobicContact CD2-CD1 4.27Å; L223-L228 PolarHBondContact O-N 3Å; L223-L229 HydrophobicContact CB-CB 4.17Å; L223-L229 HydrophobicContact CB-CD1 4.47Å; L223-L229 PolarHBondContact O-N 3.44Å; L223-I232 HydrophobicContact CD1-CD1 3.93Å; L223-I232 HydrophobicContact CD2-CD1 3.65Å; L223-I232 HydrophobicContact CG-CD1 4.3Å
224	E	71.6	Confident	65.7	Low	109 Å²	109	61.7 Å²	61.7	51%	0.509	32%	0.318	S	S	.	.	H	α-helix	trans	-69.7	-48.9	173.3	-175.7	172.3	-155.2	0	0	111.5	M220 K221 Y226 G227 L229	M220-E224 WeakPolarHBondContact O-CB 3.46Å; M220-E224 PolarHBondContact O-N 3.26Å; K221-E224 PolarHBondContact O-N 3.21Å; E224-Y226 VanDerWaalsContact C-N 3.26Å; E224-Y226 PolarHBondContact O-N 2.9Å; E224-G227 PolarHBondContact O-N 3.2Å; E224-L229 HydrophobicContact CB-CD2 4.26Å
225	A	73	Confident	65.6	Low	84 Å²	84	60.4 Å²	60.4	69%	0.694	30%	0.304	S	S	*	.	H	α-helix	trans	-63	-29	-179.4	0	0	0	0	0	113.8	K221 K222	K221-A225 VanDerWaalsContact O-CB 3.24Å; K221-A225 WeakPolarHBondContact O-CB 3.27Å; K221-A225 PolarHBondContact O-N 3.48Å; K222-A225 PolarHBondContact O-N 2.77Å
226	Y	71.3	Confident	64.8	Low	118 Å²	118	61.8 Å²	61.8	46%	0.463	31%	0.314	S	S	.	.	T	Hydrogen-bonded Turn	trans	-92.5	5.8	174.9	-76.8	-112.9	0	0	0	112.9	L203 K222 E224 L228	L203-Y226 HydrophobicContact CD2-CD1 4.18Å; L203-Y226 HydrophobicContact CD2-CD2 3.7Å; L203-Y226 HydrophobicContact CD2-CE1 4.07Å; L203-Y226 HydrophobicContact CD2-CE2 3.58Å; L203-Y226 HydrophobicContact CD2-CG 4Å; L203-Y226 HydrophobicContact CG-CD1 4.17Å; L203-Y226 HydrophobicContact CG-CD2 4.46Å; L203-Y226 HydrophobicContact CG-CE1 4.25Å; L203-Y226 HydrophobicContact CG-CG 4.27Å; K222-Y226 WeakPolarHBondContact O-CB 3.28Å; K222-Y226 VanDerWaalsContact O-CD2 3.23Å; K222-Y226 WeakPolarHBondContact O-CD2 3.42Å; K222-Y226 PolarHBondContact O-N 3.34Å; K222-Y226 VanDerWaalsContact O-N 3.11Å; E224-Y226 VanDerWaalsContact C-N 3.26Å; E224-Y226 PolarHBondContact O-N 2.9Å; Y226-L228 PolarHBondContact O-N 2.71Å
227	G	77.1	Confident	64	Low	48 Å²	48	62.7 Å²	62.7	50%	0.495	31%	0.314	S	S	.	.	S	Bend	trans	71.2	-8.7	-178.8	0	0	0	0	0	115.5	L223 E224 L229	L223-G227 CarbonylContact O-C 3.6Å; L223-G227 PolarHBondContact O-N 3.45Å; E224-G227 PolarHBondContact O-N 3.2Å; G227-L229 VanDerWaalsContact C-N 3.29Å; G227-L229 PolarHBondContact O-N 2.98Å
228	L	74.8	Confident	62.7	Low	1 Å²	1	64.6 Å²	64.6	1%	0.005	32%	0.321	C	S	.	.	H	α-helix	trans	-63.8	-26.9	-174.8	-72.8	171.7	0	0	0	114	L192 E196 M200 L203 L223 Y226 Y230 S231 I232	L192-L228 HydrophobicContact CD1-CD2 4.35Å; E196-L228 HydrophobicContact CB-CD2 3.71Å; E196-L228 HydrophobicContact CG-CD2 4.01Å; E196-L228 WeakPolarHBondContact O-CD2 3.36Å; M200-L228 HydrophobicContact CB-CD1 4.06Å; L203-L228 HydrophobicContact CD1-CD1 3.71Å; L223-L228 HydrophobicContact CD2-CB 4.12Å; L223-L228 HydrophobicContact CD2-CD1 4.27Å; L223-L228 PolarHBondContact O-N 3Å; Y226-L228 PolarHBondContact O-N 2.71Å; L228-Y230 VanDerWaalsContact C-N 3.26Å; L228-Y230 PolarHBondContact O-N 2.88Å; L228-S231 PolarHBondContact O-N 2.91Å; L228-S231 VanDerWaalsContact O-N 3.11Å; L228-I232 HydrophobicContact CB-CD1 3.98Å; L228-I232 HydrophobicContact CB-CG1 4.5Å; L228-I232 WeakPolarHBondContact O-CB 3.4Å; L228-I232 VanDerWaalsContact O-CG1 3.25Å; L228-I232 WeakPolarHBondContact O-CG1 3.46Å; L228-I232 PolarHBondContact O-N 3.2Å
229	L	70.3	Confident	61.2	Low	24 Å²	24	64.6 Å²	64.6	13%	0.126	32%	0.323	C	S	.	.	H	α-helix	trans	-56.4	-40.1	-176.6	-175	62.7	0	0	0	112.5	M220 L223 E224 G227 Y233	M220-L229 HydrophobicContact CE-CD1 3.71Å; M220-L229 HydrophobicContact CE-CD2 3.89Å; M220-L229 HydrophobicContact CE-CG 4.47Å; M220-L229 HydrophobicContact SD-CD1 3.79Å; L223-L229 HydrophobicContact CB-CB 4.17Å; L223-L229 HydrophobicContact CB-CD1 4.47Å; L223-L229 PolarHBondContact O-N 3.44Å; E224-L229 HydrophobicContact CB-CD2 4.26Å; G227-L229 VanDerWaalsContact C-N 3.29Å; G227-L229 PolarHBondContact O-N 2.98Å; L229-Y233 VanDerWaalsContact O-CB 3.29Å; L229-Y233 WeakPolarHBondContact O-CB 3.42Å; L229-Y233 PolarHBondContact O-N 3.31Å
230	Y	61.9	Low	59.2	Low	131 Å²	131	68.3 Å²	68.3	51%	0.514	35%	0.349	S	S	.	.	H	α-helix	trans	-68.9	-43.6	176.7	177.8	-95.6	0	0	0	112.1	L228 Y233 K234	L228-Y230 VanDerWaalsContact C-N 3.26Å; L228-Y230 PolarHBondContact O-N 2.88Å; Y230-Y233 PolarHBondContact O-N 3.2Å; Y230-K234 HydrophobicContact CE1-CD 3.87Å; Y230-K234 VanDerWaalsContact O-CB 3.32Å; Y230-K234 WeakPolarHBondContact O-CB 3.32Å; Y230-K234 PolarHBondContact O-N 3.18Å
231	S	61.8	Low	57.2	Low	19 Å²	19	70.4 Å²	70.4	13%	0.133	36%	0.361	C	S	.	.	H	α-helix	trans	-72.7	-35.6	-176.9	-55.1	0	0	0	0	112.3	E196 L228 K234 S235	E196-S231 WeakPolarHBondContact OE1-CB 3.49Å; E196-S231 PolarHBondContact OE1-OG 3.05Å; L228-S231 PolarHBondContact O-N 2.91Å; L228-S231 VanDerWaalsContact O-N 3.11Å; S231-K234 PolarHBondContact O-N 3.49Å; S231-S235 WeakPolarHBondContact O-CB 3.41Å; S231-S235 PolarHBondContact O-N 3.13Å
232	I	59.7	Low	55	Low	24 Å²	24	71.8 Å²	71.8	12%	0.123	37%	0.374	C	S	.	.	H	α-helix	trans	-63.1	-45.6	169.2	-66.4	166.6	0	0	0	110.2	L192 M200 L223 L228 N236	L192-I232 HydrophobicContact CD1-CG1 4.33Å; L192-I232 HydrophobicContact CD2-CG1 4.31Å; M200-I232 HydrophobicContact CE-CD1 3.45Å; M200-I232 VanDerWaalsContact CE-CD1 3.45Å; M200-I232 HydrophobicContact CE-CG1 3.8Å; L223-I232 HydrophobicContact CD1-CD1 3.93Å; L223-I232 HydrophobicContact CD2-CD1 3.65Å; L223-I232 HydrophobicContact CG-CD1 4.3Å; L228-I232 HydrophobicContact CB-CD1 3.98Å; L228-I232 HydrophobicContact CB-CG1 4.5Å; L228-I232 WeakPolarHBondContact O-CB 3.4Å; L228-I232 VanDerWaalsContact O-CG1 3.25Å; L228-I232 WeakPolarHBondContact O-CG1 3.46Å; L228-I232 PolarHBondContact O-N 3.2Å; I232-N236 WeakPolarHBondContact O-CB 3.5Å; I232-N236 PolarHBondContact O-N 2.94Å; I232-N236 PolarHBondContact O-ND2 3.18Å
233	Y	58.4	Low	52.9	Low	117 Å²	117	76.2 Å²	76.2	46%	0.459	40%	0.404	S	S	.	.	H	α-helix	trans	-61.8	-44.1	175.6	173.3	-94.6	0	0	0	112	L229 Y230 N236 K237	L229-Y233 VanDerWaalsContact O-CB 3.29Å; L229-Y233 WeakPolarHBondContact O-CB 3.42Å; L229-Y233 PolarHBondContact O-N 3.31Å; Y230-Y233 PolarHBondContact O-N 3.2Å; Y233-N236 PolarHBondContact O-N 3.3Å; Y233-K237 HydrophobicContact CE1-CD 3.93Å; Y233-K237 VanDerWaalsContact O-CB 3.31Å; Y233-K237 WeakPolarHBondContact O-CB 3.35Å; Y233-K237 PolarHBondContact O-N 3.19Å; Y233-K237 VanDerWaalsContact O-N 3.07Å; Y233-K237 PolarHBondContact OH-NZ 3.38Å
234	K	54.5	Low	50.7	Low	90 Å²	90	82.7 Å²	82.7	39%	0.391	44%	0.439	S	S	.	.	H	α-helix	trans	-60.3	-52.1	177.3	-174.2	168.7	-178.4	170.5	0	110.8	Y230 S231 N236 K237 D238 E461	Y230-K234 HydrophobicContact CE1-CD 3.87Å; Y230-K234 VanDerWaalsContact O-CB 3.32Å; Y230-K234 WeakPolarHBondContact O-CB 3.32Å; Y230-K234 PolarHBondContact O-N 3.18Å; S231-K234 PolarHBondContact O-N 3.49Å; K234-N236 PolarHBondContact O-N 3.12Å; K234-K237 WeakPolarHBondContact O-CB 3.34Å; K234-K237 PolarHBondContact O-N 3.35Å; K234-D238 PolarHBondContact O-N 2.95Å; K234-E461 IonicContact NZ-OE1 3.87Å
235	S	49.6	Very low	48.5	Very low	4 Å²	4	81.1 Å²	81.1	3%	0.028	44%	0.439	C	S	.	.	H	α-helix	trans	-62.3	-44.6	177.5	170.7	0	0	0	0	113.1	T190 D191 S231 K237 D238 M239	T190-S235 VanDerWaalsContact CA-OG 3.23Å; T190-S235 WeakPolarHBondContact CA-OG 3.46Å; T190-S235 WeakPolarHBondContact CB-OG 3.45Å; D191-S235 PolarHBondContact N-OG 3.44Å; S231-S235 WeakPolarHBondContact O-CB 3.41Å; S231-S235 PolarHBondContact O-N 3.13Å; S235-K237 PolarHBondContact O-N 3.37Å; S235-D238 PolarHBondContact O-N 3.37Å; S235-D238 VanDerWaalsContact O-N 3.11Å; S235-M239 WeakPolarHBondContact O-CG 3.46Å; S235-M239 PolarHBondContact O-N 3.01Å
236	N	41.6	Very low	46.4	Very low	65 Å²	65	83.2 Å²	83.2	35%	0.348	45%	0.448	S	S	.	.	H	α-helix	trans	-67.1	-24.1	-179.8	-81.7	-88.5	0	0	0	112.7	I232 Y233 K234	I232-N236 WeakPolarHBondContact O-CB 3.5Å; I232-N236 PolarHBondContact O-N 2.94Å; I232-N236 PolarHBondContact O-ND2 3.18Å; Y233-N236 PolarHBondContact O-N 3.3Å; K234-N236 PolarHBondContact O-N 3.12Å
237	K	40.3	Very low	44.4	Very low	111 Å²	111	82.2 Å²	82.2	48%	0.483	46%	0.459	S	S	.	.	H	α-helix	trans	-70.8	-37.1	173	-164.8	167.9	-171.3	163.3	0	112	Y233 K234 S235 S240	Y233-K237 HydrophobicContact CE1-CD 3.93Å; Y233-K237 VanDerWaalsContact O-CB 3.31Å; Y233-K237 WeakPolarHBondContact O-CB 3.35Å; Y233-K237 PolarHBondContact O-N 3.19Å; Y233-K237 VanDerWaalsContact O-N 3.07Å; Y233-K237 PolarHBondContact OH-NZ 3.38Å; K234-K237 WeakPolarHBondContact O-CB 3.34Å; K234-K237 PolarHBondContact O-N 3.35Å; S235-K237 PolarHBondContact O-N 3.37Å; K237-S240 PolarHBondContact O-OG 3.08Å
238	D	32.9	Very low	42.1	Very low	118 Å²	118	83.8 Å²	83.8	63%	0.631	46%	0.461	S	S	*	.	H	α-helix	trans	-84.2	-25.5	177.1	-66.2	-37.5	0	0	0	113	K234 S235 S240	K234-D238 PolarHBondContact O-N 2.95Å; S235-D238 PolarHBondContact O-N 3.37Å; S235-D238 VanDerWaalsContact O-N 3.11Å; D238-S240 PolarHBondContact O-N 2.9Å; D238-S240 VanDerWaalsContact O-N 3.09Å
239	M	31.3	Very low	39.7	Very low	68 Å²	68	88.9 Å²	88.9	34%	0.335	50%	0.497	S	S	.	.	S	Bend	trans	-60.6	-15.8	171.2	-80.2	166.8	56.2	0	0	113.8	N189 T190 S235 L241	N189-M239 HydrophobicContact CB-CE 4.39Å; N189-M239 VanDerWaalsContact O-SD 3.39Å; T190-M239 HydrophobicContact CG2-SD 4.03Å; S235-M239 WeakPolarHBondContact O-CG 3.46Å; S235-M239 PolarHBondContact O-N 3.01Å; M239-L241 PolarHBondContact O-N 3.46Å
240	S	28.3	Very low	37.7	Very low	90 Å²	90	95.8 Å²	95.8	63%	0.629	53%	0.534	S	S	*	.	T	Hydrogen-bonded Turn	trans	-72.4	52.2	-178.6	68.8	0	0	0	0	114.3	K237 D238	K237-S240 PolarHBondContact O-OG 3.08Å; D238-S240 PolarHBondContact O-N 2.9Å; D238-S240 VanDerWaalsContact O-N 3.09Å
241	L	27.2	Very low	35.8	Very low	99 Å²	99	94.7 Å²	94.7	52%	0.518	55%	0.545	S	S	.	.	T	Hydrogen-bonded Turn	trans	-170.9	11.6	158.3	-105.9	165.4	0	0	0	117.6	M239 Y389	M239-L241 PolarHBondContact O-N 3.46Å; L241-Y389 HydrophobicContact CD1-CD1 3.96Å; L241-Y389 HydrophobicContact CD1-CD2 3.63Å; L241-Y389 HydrophobicContact CD1-CE1 3.79Å; L241-Y389 HydrophobicContact CD1-CE2 3.5Å; L241-Y389 VanDerWaalsContact CD1-CE2 3.5Å; L241-Y389 HydrophobicContact CD1-CG 3.86Å; L241-Y389 HydrophobicContact CD2-CD2 3.93Å; L241-Y389 HydrophobicContact CD2-CE2 3.23Å; L241-Y389 HydrophobicContact CG-CD2 4.42Å; L241-Y389 HydrophobicContact CG-CE2 3.93Å
242	N	24.6	Very low	34.3	Very low	136 Å²	136	102.7 Å²	102.7	73%	0.727	58%	0.583	S	S	*	*			trans	-134.8	82.6	-175.3	-166.7	23.5	0	0	0	114.8
243	T	28.6	Very low	32.7	Very low	132 Å²	132	107.2 Å²	107.2	81%	0.81	61%	0.612	S	S	*	*			trans	-135	56.1	175.5	48.5	0	0	0	0	113	C245	T243-C245 PolarHBondContact O-N 3.21Å
244	N	26.2	Very low	30.9	Very low	149 Å²	149	108 Å²	108	80%	0.797	63%	0.629	S	S	*	*			trans	-69.7	82.9	161.3	-81	-17.7	0	0	0	109.4	S246	N244-S246 PolarHBondContact O-N 2.85Å
245	C	25.9	Very low	29.6	Very low	75 Å²	75	110.1 Å²	110.1	51%	0.507	65%	0.649	S	S	.	*			trans	-66.3	106.3	177.1	-172.4	0	0	0	0	110.4	T243 S247 C248	T243-C245 PolarHBondContact O-N 3.21Å; C245-S247 PolarHBondContact O-N 3.08Å; C245-S247 PolarHBondContact SG-OG 2.87Å; C245-C248 PolarHBondContact O-N 2.98Å
246	S	28.4	Very low	28.3	Very low	128 Å²	128	116.2 Å²	116.2	90%	0.895	69%	0.686	S	S	*	*	T	Hydrogen-bonded Turn	trans	-67.6	-5.1	-168.5	-46.6	0	0	0	0	115.6	N244	N244-S246 PolarHBondContact O-N 2.85Å
247	S	29.6	Very low	27.7	Very low	98 Å²	98	119.1 Å²	119.1	69%	0.685	71%	0.709	S	S	*	*	T	Hydrogen-bonded Turn	trans	-109.4	-11.9	-177	51.7	0	0	0	0	114.3	C245 S249	C245-S247 PolarHBondContact O-N 3.08Å; C245-S247 PolarHBondContact SG-OG 2.87Å; S247-S249 PolarHBondContact O-N 3.24Å; S247-S249 VanDerWaalsContact O-N 3.14Å
248	C	28.6	Very low	26.9	Very low	80 Å²	80	119.8 Å²	119.8	54%	0.541	72%	0.723	S	S	.	*			trans	-90.6	70.7	-174.1	-65.5	0	0	0	0	112	C245 D250	C245-C248 PolarHBondContact O-N 2.98Å; C248-D250 PolarHBondContact O-N 3.03Å
249	S	25	Very low	26.5	Very low	108 Å²	108	121.8 Å²	121.8	76%	0.755	73%	0.728	S	S	*	*			trans	-82.4	98.7	168.8	-65.5	0	0	0	0	111.1	S247	S247-S249 PolarHBondContact O-N 3.24Å; S247-S249 VanDerWaalsContact O-N 3.14Å
250	D	27.4	Very low	26.2	Very low	169 Å²	169	125.3 Å²	125.3	90%	0.904	76%	0.758	S	S	*	*			trans	-171.4	151.5	136.3	-102.2	-25.1	0	0	0	112.2	C248	C248-D250 PolarHBondContact O-N 3.03Å
251	S	23	Very low	25.9	Very low	108 Å²	108	130.8 Å²	130.8	76%	0.755	77%	0.765	S	S	*	*			trans	-107.1	125.4	-172.7	59.6	0	0	0	0	112.8
252	M	28.4	Very low	26	Very low	188 Å²	188	134.2 Å²	134.2	93%	0.926	78%	0.782	S	S	*	*			trans	-131.9	145.7	168.8	-91.3	-65.4	176.3	0	0	113.2
253	T	25.9	Very low	26	Very low	118 Å²	118	133.9 Å²	133.9	72%	0.724	78%	0.78	S	S	*	*			trans	-84.8	148.9	-166.3	35.9	0	0	0	0	115.3
254	T	22.5	Very low	25.9	Very low	135 Å²	135	132.1 Å²	132.1	83%	0.828	78%	0.779	S	S	*	*			trans	-8.1	120.6	156.1	50.2	0	0	0	0	118.3
255	V	27	Very low	25.9	Very low	134 Å²	134	133.2 Å²	133.2	81%	0.812	78%	0.784	S	S	*	*			trans	-138.3	133.8	152.1	-178.7	0	0	0	0	108.9
256	T	21.5	Very low	26	Very low	131 Å²	131	134.8 Å²	134.8	80%	0.804	79%	0.793	S	S	*	*			trans	-110.5	120.3	172.6	49.9	0	0	0	0	110.4
257	P	28.7	Very low	26.1	Very low	126 Å²	126	136.7 Å²	136.7	82%	0.818	79%	0.793	S	S	*	*			trans	-98.9	121.2	175.9	33.6	-27.9	0	0	0	112.1
258	T	23.8	Very low	26.1	Very low	126 Å²	126	138.7 Å²	138.7	77%	0.773	80%	0.796	S	S	*	*			trans	-97.1	154.1	162.5	-31.5	0	0	0	0	109.2
259	Q	25	Very low	26.3	Very low	159 Å²	159	141.6 Å²	141.6	74%	0.743	81%	0.806	S	S	*	*			trans	71.3	92.6	157.3	-140	74.9	-10.1	0	0	118.1
260	C	25	Very low	26.8	Very low	143 Å²	143	143 Å²	143	97%	0.966	81%	0.806	S	S	*	*			trans	-132.1	118.6	144.6	-94	0	0	0	0	109.4
261	R	22.3	Very low	27	Very low	204 Å²	204	141.5 Å²	141.5	77%	0.77	80%	0.796	S	S	*	*			trans	-136.9	120.5	176.6	173.2	-170.5	178.7	-179.7	2.2	107.8
262	I	28.2	Very low	27.5	Very low	172 Å²	172	143.1 Å²	143.1	88%	0.882	80%	0.796	S	S	*	*			trans	-154.1	147.2	160.9	-98.3	143.8	0	0	0	106.3
263	N	24.8	Very low	27.7	Very low	129 Å²	129	141.2 Å²	141.2	69%	0.69	79%	0.785	S	S	*	*			trans	-119.1	147.7	-174.7	8.2	-95.3	0	0	0	110.5
264	A	25.8	Very low	28.1	Very low	95 Å²	95	141.3 Å²	141.3	79%	0.785	78%	0.78	S	S	*	*			trans	-161.1	118.9	158.1	0	0	0	0	0	111.7
265	L	26.9	Very low	28.5	Very low	171 Å²	171	144.6 Å²	144.6	90%	0.895	78%	0.777	S	S	*	*			trans	-165.4	110.9	150.8	-114.7	159.6	0	0	0	107.3
266	P	28.9	Very low	29	Very low	108 Å²	108	141.8 Å²	141.8	70%	0.701	77%	0.768	S	S	*	*			trans	-83.7	158.5	179.3	34.6	-34.4	0	0	0	111.2
267	N	30.7	Very low	29.5	Very low	169 Å²	169	142.9 Å²	142.9	90%	0.904	77%	0.769	S	S	*	*			trans	-130.9	137.8	161.7	-117.3	-6.4	0	0	0	108.2
268	N	29	Very low	29.7	Very low	140 Å²	140	141.1 Å²	141.1	75%	0.749	76%	0.76	S	S	*	*			trans	-83.3	146.6	-177.3	-56.8	-30.4	0	0	0	110.9
269	N	32.8	Very low	30.3	Very low	140 Å²	140	142.1 Å²	142.1	75%	0.749	76%	0.759	S	S	*	*				165.9	168.4	118.1	-81.2	-10.7	0	0	0	110.7
270	D	34.4	Very low	30.9	Very low	138 Å²	138	140 Å²	140	74%	0.738	75%	0.753	S	S	*	*			trans	62.5	92.3	169.9	-49.4	-26.3	0	0	0	115.3
271	I	33.1	Very low	31.4	Very low	137 Å²	137	138.7 Å²	138.7	70%	0.703	74%	0.737	S	S	*	*				85.9	128.6	60.7	-65.8	168.2	0	0	0	112.3
272	D	33.6	Very low	32	Very low	143 Å²	143	135 Å²	135	77%	0.765	73%	0.732	S	S	*	*			trans	65.7	146.6	166.7	-66.3	-15.1	0	0	0	119.4
273	E	33	Very low	32.2	Very low	148 Å²	148	133.5 Å²	133.5	69%	0.692	73%	0.726	S	S	*	*			cis	-165.8	155.5	-14.6	169.2	-179.1	-156.9	0	0	109
274	I	33.6	Very low	32.4	Very low	119 Å²	119	132.7 Å²	132.7	61%	0.61	73%	0.73	S	S	*	*			trans	65.2	140.2	160.5	-83.4	165.8	0	0	0	116.9
275	R	31.5	Very low	32.7	Very low	205 Å²	205	132.6 Å²	132.6	77%	0.774	72%	0.724	S	S	*	*			cis	-178.7	143.9	-5	161.2	-179.9	-75.2	177.2	-1.4	109
276	A	35.7	Very low	32.8	Very low	74 Å²	74	131 Å²	131	61%	0.612	72%	0.716	S	S	*	*			trans	66.8	149.9	155.9	0	0	0	0	0	119.5
277	N	33	Very low	32.8	Very low	154 Å²	154	132 Å²	132	82%	0.824	72%	0.716	S	S	*	*			cis	-163.8	166.8	-16.3	-109.9	-11.1	0	0	0	111.5
278	S	33.7	Very low	32.7	Very low	90 Å²	90	131.2 Å²	131.2	63%	0.629	71%	0.711	S	S	*	*			trans	77	106.3	139.4	175.9	0	0	0	0	120.9
279	L	35.8	Very low	32.6	Very low	146 Å²	146	128.1 Å²	128.1	76%	0.764	71%	0.713	S	S	*	*				64.6	149	127.6	-51.6	-179.5	0	0	0	118.8
280	D	36.8	Very low	32.3	Very low	116 Å²	116	129.6 Å²	129.6	62%	0.62	72%	0.715	S	S	*	*			cis	-153.3	157.5	-2.7	-129.6	-27.1	0	0	0	115.1
281	N	35.6	Very low	31.9	Very low	115 Å²	115	129.7 Å²	129.7	62%	0.615	71%	0.714	S	S	*	*			trans	17.9	122.2	150.3	-82.2	-65	0	0	0	123.2
282	N	34.4	Very low	31.6	Very low	126 Å²	126	128.2 Å²	128.2	67%	0.674	71%	0.711	S	S	*	*				86.6	132.5	122.3	-67.4	-22.8	0	0	0	124.8
283	N	33.3	Very low	31.4	Very low	141 Å²	141	128.4 Å²	128.4	75%	0.754	71%	0.712	S	S	*	*			trans	70.7	89.4	137.2	-67.3	-20.3	0	0	0	121.8
284	S	29.4	Very low	31.2	Very low	112 Å²	112	127.6 Å²	127.6	78%	0.783	71%	0.712	S	S	*	*				77.1	151.4	107.8	-158.5	0	0	0	0	120.9
285	S	31.2	Very low	31.2	Very low	93 Å²	93	129.3 Å²	129.3	65%	0.65	72%	0.722	S	S	*	*			trans	72.8	112.2	169.4	73.5	0	0	0	0	118.5
286	N	29.5	Very low	31	Very low	137 Å²	137	124.8 Å²	124.8	73%	0.733	71%	0.713	S	S	*	*				73.8	115.7	128.8	-61.8	-5.8	0	0	0	121.1
287	N	29.6	Very low	30.8	Very low	129 Å²	129	129.1 Å²	129.1	69%	0.69	73%	0.726	S	S	*	*				87.9	123.8	129	-64.7	-8.7	0	0	0	120.8
288	N	27.9	Very low	30.7	Very low	152 Å²	152	128.4 Å²	128.4	81%	0.813	72%	0.718	S	S	*	*			trans	76.4	113.7	136.5	-62.2	-11.1	0	0	0	120.2
289	G	27.4	Very low	30.5	Very low	75 Å²	75	130.3 Å²	130.3	77%	0.773	73%	0.725	S	S	*	*			trans	77.5	172.7	159.4	0	0	0	0	0	114.3
290	H	25.4	Very low	30.1	Very low	171 Å²	171	131.1 Å²	131.1	79%	0.792	72%	0.719	S	S	*	*			cis	-170	175.1	-23.3	-154.1	-80.5	0	0	0	104.7
291	I	26.8	Very low	29.7	Very low	140 Å²	140	134.4 Å²	134.4	72%	0.718	73%	0.728	S	S	*	*			trans	71.3	93.9	165.1	-55.5	160.4	0	0	0	112.6
292	V	27.3	Very low	29.3	Very low	106 Å²	106	133.1 Å²	133.1	64%	0.642	73%	0.728	S	S	*	*				77.2	121.8	72.8	173.9	0	0	0	0	113.5
293	N	28.9	Very low	28.8	Very low	148 Å²	148	134.3 Å²	134.3	79%	0.791	73%	0.733	S	S	*	*			trans	166.7	94.5	142.9	-82.9	-24.5	0	0	0	106.7
294	D	28.4	Very low	28.5	Very low	130 Å²	130	134.8 Å²	134.8	70%	0.695	74%	0.736	S	S	*	*				62.4	117.8	86	-84.5	-25.4	0	0	0	115.3
295	L	32.8	Very low	28.5	Very low	155 Å²	155	134.3 Å²	134.3	81%	0.812	73%	0.732	S	S	*	*				-175.1	105.3	107.6	-96.2	168.2	0	0	0	113.5
296	N	28.6	Very low	28.1	Very low	111 Å²	111	137.8 Å²	137.8	59%	0.594	74%	0.742	S	S	*	*			trans	29.3	126.4	142.1	-66.4	-43.2	0	0	0	121.7
297	N	30.9	Very low	28	Very low	164 Å²	164	140 Å²	140	88%	0.877	75%	0.745	S	S	*	*				-152.6	158.5	95.5	-121.9	-30.5	0	0	0	113.8
298	Q	30.3	Very low	28.1	Very low	140 Å²	140	140.4 Å²	140.4	65%	0.654	75%	0.747	S	S	*	*			trans	-97.7	178	-166.6	-50.1	-175.4	-4.7	0	0	112.4
299	V	31.1	Very low	28	Very low	129 Å²	129	143.1 Å²	143.1	78%	0.782	75%	0.747	S	S	*	*				-155.7	158.5	57.2	171.1	0	0	0	0	113.1
300	Y	26.8	Very low	28.1	Very low	164 Å²	164	146.8 Å²	146.8	64%	0.643	75%	0.749	S	S	*	*			trans	-64.2	173.6	-176.8	-85.2	-109	0	0	0	116.6
301	F	28.7	Very low	28.5	Very low	185 Å²	185	143.4 Å²	143.4	81%	0.811	74%	0.742	S	S	*	*			cis	-151.2	135	38.1	-82.6	-85.6	0	0	0	119
302	S	26.7	Very low	28.5	Very low	87 Å²	87	145.8 Å²	145.8	61%	0.608	75%	0.747	S	S	*	*			trans	22.9	112.8	138.7	-48.7	0	0	0	0	126.3
303	I	24.1	Very low	28.7	Very low	152 Å²	152	146.3 Å²	146.3	78%	0.779	75%	0.75	S	S	*	*				21.6	131.8	116	-54.1	162.8	0	0	0	120.9
304	N	26.3	Very low	29	Very low	151 Å²	151	144.9 Å²	144.9	81%	0.807	75%	0.749	S	S	*	*			trans	171.8	145.6	134.9	-91.7	-28.2	0	0	0	110.1
305	S	29.2	Very low	29.1	Very low	102 Å²	102	146.5 Å²	146.5	71%	0.713	75%	0.754	S	S	*	*			cis	-151.4	159.1	-3	-76.2	0	0	0	0	111
306	I	24.4	Very low	29.3	Very low	166 Å²	166	146.1 Å²	146.1	85%	0.851	76%	0.759	S	S	*	*			trans	-104.3	145.9	165.4	-67.7	166.7	0	0	0	109.2
307	K	27.5	Very low	29.5	Very low	182 Å²	182	144.7 Å²	144.7	79%	0.791	76%	0.762	S	S	*	*			trans	158.6	146.1	158.1	-91.9	172.7	-179.6	-172.3	0	109.5
308	D	30.5	Very low	29.8	Very low	138 Å²	138	144.2 Å²	144.2	74%	0.738	77%	0.765	S	S	*	*			cis	-149	175.1	8.2	-103.9	-44.3	0	0	0	113.6
309	Y	26.9	Very low	30	Very low	209 Å²	209	140.8 Å²	140.8	82%	0.82	77%	0.768	S	S	*	*			trans	-87	175.8	-177.3	-86.6	-60.8	0	0	0	114.6
310	L	28.1	Very low	30.1	Very low	153 Å²	153	139.8 Å²	139.8	80%	0.801	77%	0.766	S	S	*	*			cis	-150.9	-166.5	4	-111.5	156.8	0	0	0	107.1
311	P	34.3	Very low	30.5	Very low	99 Å²	99	138.3 Å²	138.3	64%	0.643	78%	0.775	S	S	*	*			trans	-126.4	-158.2	-157.2	32.8	-8.2	0	0	0	116.7
312	F	27.4	Very low	30.9	Very low	191 Å²	191	135.8 Å²	135.8	84%	0.838	77%	0.774	S	S	*	*			trans	85.6	169.2	170.7	-82.3	-127.7	0	0	0	119
313	V	30.7	Very low	31.2	Very low	116 Å²	116	137.2 Å²	137.2	70%	0.703	78%	0.779	S	S	*	*			cis	171.7	154.9	-49.4	118	0	0	0	0	110.1
314	P	35.4	Very low	31.7	Very low	118 Å²	118	136.2 Å²	136.2	77%	0.766	78%	0.78	S	S	*	*			cis	-131	-137.2	-23.7	43.3	-23.7	0	0	0	113.1
315	M	30.6	Very low	32	Very low	164 Å²	164	134 Å²	134	81%	0.808	77%	0.772	S	S	*	*			trans	-66.5	155.9	-173.9	-65.4	175.5	73.8	0	0	118.2
316	T	36.3	Very low	32.3	Very low	148 Å²	148	137.6 Å²	137.6	91%	0.908	78%	0.778	S	S	*	*			trans	-144.1	172.4	131.3	37.4	0	0	0	0	110.4
317	A	33	Very low	32.7	Very low	80 Å²	80	134.9 Å²	134.9	66%	0.661	77%	0.769	S	S	*	*			trans	-124.2	-161.9	-163.6	0	0	0	0	0	115
318	T	37.5	Very low	33	Very low	154 Å²	154	131.8 Å²	131.8	95%	0.945	77%	0.765	S	S	*	*			trans	84.5	137.4	-172.3	73.6	0	0	0	0	115.5
319	G	34.9	Very low	33	Very low	68 Å²	68	130.9 Å²	130.9	70%	0.701	77%	0.765	S	S	*	*			cis	-175.5	154.8	-10.8	0	0	0	0	0	114.8
320	S	32.8	Very low	33.4	Very low	108 Å²	108	129.1 Å²	129.1	76%	0.755	77%	0.768	S	S	*	*			trans	51.3	106.4	150.1	-59.4	0	0	0	0	120.7
321	T	35.8	Very low	33.6	Very low	134 Å²	134	128.5 Å²	128.5	82%	0.822	77%	0.77	S	S	*	*				73.3	155.9	97	66.5	0	0	0	0	115.8
322	V	35.8	Very low	33.4	Very low	131 Å²	131	127.2 Å²	127.2	79%	0.794	78%	0.775	S	S	*	*			cis	-137.5	156.2	14.9	-172.7	0	0	0	0	111.4
323	V	33.1	Very low	33.5	Very low	118 Å²	118	121.8 Å²	121.8	72%	0.715	77%	0.773	S	S	*	*			trans	-48.6	147.6	165.9	176.7	0	0	0	0	114.9
324	T	36	Very low	33.8	Very low	130 Å²	130	123 Å²	123	80%	0.798	78%	0.78	S	S	*	*				-174.5	158.8	122.7	-71.5	0	0	0	0	110.9
325	T	32.7	Very low	33.8	Very low	106 Å²	106	126.6 Å²	126.6	65%	0.65	78%	0.784	S	S	*	*			trans	-112.2	177.4	-160.9	49	0	0	0	0	114.1
326	Q	34.4	Very low	34.2	Very low	177 Å²	177	126.8 Å²	126.8	83%	0.827	79%	0.788	S	S	*	*			trans	86	154	164.2	-52.5	179.9	62.5	0	0	117.9
327	T	33.1	Very low	34.3	Very low	108 Å²	108	129.3 Å²	129.3	66%	0.663	79%	0.787	S	S	*	*			cis	-167	160.3	-31.6	-82.9	0	0	0	0	107.1
328	T	33.4	Very low	34.5	Very low	117 Å²	117	129.6 Å²	129.6	72%	0.718	79%	0.789	S	S	*	*			trans	67	120.8	163	33.1	0	0	0	0	121.4
329	T	30.6	Very low	34.6	Very low	119 Å²	119	129.7 Å²	129.7	73%	0.73	78%	0.783	S	S	*	*			trans	34.1	132.2	138.4	50.4	0	0	0	0	122.1
330	I	35.1	Very low	34.8	Very low	173 Å²	173	133.7 Å²	133.7	89%	0.887	79%	0.787	S	S	*	*				-154.9	160.9	108.1	-102.5	159.2	0	0	0	109.9
331	V	32.3	Very low	35.1	Very low	139 Å²	139	132.6 Å²	132.6	84%	0.842	78%	0.779	S	S	*	*			trans	-107.6	135.5	-173.3	172.8	0	0	0	0	111.9
332	G	30.7	Very low	35.4	Very low	72 Å²	72	137.2 Å²	137.2	74%	0.742	78%	0.781	S	S	*	*			trans	103.3	143.3	142.1	0	0	0	0	0	118.1
333	G	28.9	Very low	35.8	Very low	77 Å²	77	137.6 Å²	137.6	79%	0.794	78%	0.777	S	S	*	*			trans	79.4	164.2	171.4	0	0	0	0	0	115.1
334	V	37	Very low	36.3	Very low	142 Å²	142	137.6 Å²	137.6	86%	0.861	78%	0.778	S	S	*	*			cis	-137.6	150.3	-9.9	-172.7	0	0	0	0	108.4
335	K	36.4	Very low	36.6	Very low	193 Å²	193	136.8 Å²	136.8	84%	0.839	78%	0.778	S	S	*	*			trans	-68.9	142.8	176.2	-56.5	165.8	-174.6	170.1	0	110.4
336	N	38.4	Very low	37	Very low	168 Å²	168	139 Å²	139	90%	0.898	79%	0.785	S	S	*	*			trans	-138.9	150.3	152.7	-101.1	-36.5	0	0	0	111.5
337	K	38.1	Very low	37.4	Very low	201 Å²	201	142.1 Å²	142.1	87%	0.874	79%	0.789	S	S	*	*			trans	-117.7	149.2	-172.2	-52.7	163.9	178.1	172.2	0	109.6
338	A	38.5	Very low	38	Very low	86 Å²	86	141.9 Å²	141.9	71%	0.711	79%	0.791	S	S	*	*			trans	-177.4	165.9	137.8	0	0	0	0	0	111
339	L	38.6	Very low	38.5	Very low	157 Å²	157	141.8 Å²	141.8	82%	0.822	80%	0.796	S	S	*	*			trans	64.5	107.1	167.1	-48.3	-177.6	0	0	0	115.5
340	I	39.5	Very low	39.8	Very low	152 Å²	152	142 Å²	142	78%	0.779	80%	0.799	S	S	*	*			cis	64.5	121.2	15.5	-51.7	177.1	0	0	0	112.4
341	S	38.9	Very low	40.9	Very low	85 Å²	85	139.2 Å²	139.2	59%	0.594	79%	0.792	S	S	*	*			cis	-167.5	165.3	-8.6	55.7	0	0	0	0	112
342	R	41.3	Very low	41.9	Very low	231 Å²	231	138.1 Å²	138.1	87%	0.872	79%	0.788	S	S	*	*			trans	179.5	126.2	141.1	-93.6	149.4	-170.1	-158	1.3	108.6
343	I	44.4	Very low	43.5	Very low	138 Å²	138	140.8 Å²	140.8	71%	0.708	79%	0.792	S	S	*	*				77.3	119.8	61.9	-69.6	167.4	0	0	0	109.9
344	T	44.3	Very low	44.1	Very low	119 Å²	119	143.2 Å²	143.2	73%	0.73	79%	0.792	S	S	*	*			cis	-160.1	175.1	6.4	6.4	0	0	0	0	113.1
345	S	42.7	Very low	44.6	Very low	113 Å²	113	143.2 Å²	143.2	79%	0.79	79%	0.793	S	S	*	*			trans	106.9	125.7	157.4	-158.7	0	0	0	0	115.9
346	L	40.4	Very low	44.8	Very low	153 Å²	153	139 Å²	139	80%	0.801	78%	0.783	S	S	*	*			cis	161.8	156.4	-33.6	-94.5	169.5	0	0	0	106.4
347	R	43.3	Very low	44.9	Very low	242 Å²	242	142.1 Å²	142.1	91%	0.913	78%	0.782	S	S	*	*			trans	76.1	127.2	171.7	-145.5	170.6	-164.4	-105	2.9	114.8
348	S	45.3	Very low	45.1	Very low	102 Å²	102	138.9 Å²	138.9	71%	0.713	78%	0.78	S	S	*	*			cis	-160.5	153.5	-9	41	0	0	0	0	112.2
349	S	43.5	Very low	45.1	Very low	116 Å²	116	139.5 Å²	139.5	81%	0.811	78%	0.778	S	S	*	*			trans	-81.7	-170.8	-177.1	-24.9	0	0	0	0	113.4
350	P	57.8	Low	45.1	Very low	123 Å²	123	138.2 Å²	138.2	80%	0.799	78%	0.777	S	S	*	*			cis	-142.5	-144.3	37.3	45.5	-20.5	0	0	0	115.2
351	P	58.3	Low	45.1	Very low	114 Å²	114	136.8 Å²	136.8	74%	0.74	78%	0.781	S	S	*	*				-131.7	178	-118.3	38.2	-15.3	0	0	0	117.8
352	P	53.5	Low	45.3	Very low	116 Å²	116	137.7 Å²	137.7	75%	0.753	79%	0.794	S	S	*	*			trans	-101.9	155.7	175.7	38.1	-33.6	0	0	0	115.1
353	P	65.2	Low	45.7	Very low	129 Å²	129	133.6 Å²	133.6	84%	0.838	79%	0.794	S	S	*	*			trans	-92.9	159.6	171.3	36.3	-33.5	0	0	0	113.7
354	T	41	Very low	45.6	Very low	127 Å²	127	130.2 Å²	130.2	78%	0.779	79%	0.793	S	S	*	*			trans	-117.3	132.2	-174.3	-57.8	0	0	0	0	112.3
355	T	47.8	Very low	46.2	Very low	143 Å²	143	132.2 Å²	132.2	88%	0.877	80%	0.798	S	S	*	*			trans	-140.2	157.8	166.5	-31.4	0	0	0	0	110.4
356	T	41	Very low	46.9	Very low	105 Å²	105	132.8 Å²	132.8	64%	0.644	80%	0.797	S	S	*	*			trans	-128.5	151.4	-155.7	53.8	0	0	0	0	115.1
357	R	39.8	Very low	47.9	Very low	233 Å²	233	136.2 Å²	136.2	88%	0.879	80%	0.799	S	S	*	*			trans	69.8	155.3	172.1	-51.3	148.8	68.4	-175.4	1.8	112.8
358	T	41.8	Very low	48.9	Very low	133 Å²	133	136.1 Å²	136.1	82%	0.816	80%	0.799	S	S	*	*			cis	-128.1	-166.2	12.8	42.2	0	0	0	0	112.9
359	S	39.5	Very low	49.8	Very low	98 Å²	98	140.7 Å²	140.7	69%	0.685	81%	0.806	S	S	*	*			trans	-74.5	166.4	-166.8	49.3	0	0	0	0	117.7
360	T	39	Very low	51.1	Low	130 Å²	130	146.9 Å²	146.9	80%	0.798	81%	0.812	S	S	*	*			trans	63.3	96.8	155.2	46.4	0	0	0	0	119.6
361	S	39.6	Very low	51.9	Low	122 Å²	122	147.3 Å²	147.3	85%	0.853	81%	0.812	S	S	*	*				-171.6	150.4	129.9	39.5	0	0	0	0	114
362	A	43	Very low	53	Low	105 Å²	105	153 Å²	153	87%	0.868	82%	0.819	S	S	*	*			trans	13.1	95.4	163.1	0	0	0	0	0	121
363	T	48.3	Very low	54.4	Low	144 Å²	144	152 Å²	152	88%	0.883	82%	0.82	S	S	*	*			trans	-97.9	100.6	151.9	32	0	0	0	0	110.5	I365	T363-I365 PolarHBondContact O-N 3.29Å
364	G	41.8	Very low	55.7	Low	67 Å²	67	150.2 Å²	150.2	69%	0.691	82%	0.816	S	S	*	*			trans	-71.4	126.8	-172.7	0	0	0	0	0	114.2	T366	G364-T366 PolarHBondContact O-N 3.29Å
365	I	57.2	Low	58.3	Low	162 Å²	162	147.2 Å²	147.2	83%	0.831	79%	0.792	S	S	*	*			trans	-64.7	102.9	168.4	-60.6	175.5	0	0	0	108.5	T363 R367	T363-I365 PolarHBondContact O-N 3.29Å; I365-R367 VanDerWaalsContact C-N 3.3Å; I365-R367 PolarHBondContact O-N 3.17Å
366	T	58.2	Low	60.6	Low	124 Å²	124	143.6 Å²	143.6	76%	0.761	77%	0.773	S	S	*	*			trans	-70.5	84.9	177.3	45.1	0	0	0	0	110.2	G364 R368	G364-T366 PolarHBondContact O-N 3.29Å; T366-R368 VanDerWaalsContact C-N 3.3Å; T366-R368 PolarHBondContact O-N 3.46Å
367	R	61.4	Low	63.3	Low	226 Å²	226	146 Å²	146	85%	0.853	78%	0.776	S	S	*	*			trans	-57	92.3	170.5	-78	-167.8	-83.2	-177.3	-7	109.3	I365 K369	I365-R367 VanDerWaalsContact C-N 3.3Å; I365-R367 PolarHBondContact O-N 3.17Å; R367-K369 PolarHBondContact O-N 3.46Å
368	R	63.8	Low	66	Low	239 Å²	239	137 Å²	137	90%	0.902	76%	0.756	S	S	*	*			trans	-53.4	110.2	177.7	-71.1	-172.9	176.9	-169.4	-1.1	108.3	T366 R370	T366-R368 VanDerWaalsContact C-N 3.3Å; T366-R368 PolarHBondContact O-N 3.46Å; R368-R370 PolarHBondContact O-N 2.69Å; R368-R370 VanDerWaalsContact O-N 3.13Å
369	K	64.2	Low	68.7	Low	199 Å²	199	132.5 Å²	132.5	87%	0.865	73%	0.726	S	S	*	*			trans	-58.6	118.8	178.3	-70.7	176.6	178.6	174.3	0	107.7	R367 T371	R367-K369 PolarHBondContact O-N 3.46Å; K369-T371 PolarHBondContact O-N 2.79Å
370	R	70.1	Confident	71.5	Confident	246 Å²	246	129.8 Å²	129.8	93%	0.928	71%	0.705	S	S	*	*			trans	-65.9	104.4	177.6	-166.7	178.4	-160.2	151.9	4.7	108.1	R368 R372	R368-R370 PolarHBondContact O-N 2.69Å; R368-R370 VanDerWaalsContact O-N 3.13Å; R370-R372 PolarHBondContact O-N 3.02Å
371	T	74.9	Confident	74.3	Confident	131 Å²	131	128.7 Å²	128.7	80%	0.804	69%	0.687	S	S	*	*	P	Polyproline II helix	trans	-54	131.3	178.2	-50.1	0	0	0	0	109.4	K369 A373	K369-T371 PolarHBondContact O-N 2.79Å; T371-A373 PolarHBondContact O-N 2.96Å
372	R	81.9	Confident	77.1	Confident	235 Å²	235	126 Å²	126	89%	0.887	66%	0.661	S	S	*	*	P	Polyproline II helix	trans	-69.4	122.6	171.8	-72.6	178.7	174.1	-108	2.4	107.8	R370 A374	R370-R372 PolarHBondContact O-N 3.02Å; R372-A374 PolarHBondContact O-N 3.21Å
373	A	82.9	Confident	79.7	Confident	93 Å²	93	121 Å²	121	77%	0.769	62%	0.619	S	S	*	*	P	Polyproline II helix	trans	-63	132.3	166.4	0	0	0	0	0	109	T371	T371-A373 PolarHBondContact O-N 2.96Å
374	A	92.4	Very high	82.1	Confident	92 Å²	92	117.1 Å²	117.1	76%	0.76	59%	0.591	S	S	*	*	P	Polyproline II helix	trans	-81.9	157	166.7	0	0	0	0	0	109.8	R372	R372-A374 PolarHBondContact O-N 3.21Å
375	F	96	Very high	84.8	Confident	64 Å²	64	118.8 Å²	118.8	28%	0.281	58%	0.58	S	S	.	*	P	Polyproline II helix	trans	-78	148.3	165.3	-57.1	-57.8	0	0	0	109.2	Q379 V380 L407 Q411 W415	F375-Q379 HydrophobicContact CB-CB 4.08Å; F375-V380 HydrophobicContact CB-CG2 3.95Å; F375-L407 HydrophobicContact CD1-CD1 3.98Å; F375-L407 HydrophobicContact CD1-CD2 3.73Å; F375-L407 HydrophobicContact CE1-CD1 3.92Å; F375-L407 HydrophobicContact CE1-CD2 3.71Å; F375-L407 HydrophobicContact CE1-CG 4.47Å; F375-Q411 HydrophobicContact CE1-CB 4.14Å; F375-Q411 HydrophobicContact CE1-CG 4.28Å; F375-Q411 HydrophobicContact CZ-CB 4.09Å; F375-Q411 HydrophobicContact CZ-CG 4.35Å; F375-W415 AromaticContact CD2-CD1 3.89Å; F375-W415 HydrophobicContact CE2-CB 4.44Å; F375-W415 AromaticContact CE2-CD1 3.73Å; F375-W415 HydrophobicContact CE2-CG 4.44Å
376	S	96.7	Very high	86.7	Confident	67 Å²	67	113.7 Å²	113.7	47%	0.469	55%	0.55	S	S	.	.	P	Polyproline II helix	trans	-68.9	159.8	173.6	74.2	0	0	0	0	110.9	G378 Q379 V380	S376-G378 VanDerWaalsContact C-N 3.31Å; S376-G378 PolarHBondContact O-N 2.81Å; S376-Q379 WeakPolarHBondContact O-CB 3.36Å; S376-Q379 PolarHBondContact O-N 3.25Å; S376-Q379 WeakPolarHBondContact OG-CG 3.42Å; S376-Q379 PolarHBondContact OG-N 3.3Å; S376-V380 PolarHBondContact O-N 3.4Å
377	H	96.6	Very high	88.6	Confident	155 Å²	155	107.9 Å²	107.9	72%	0.718	51%	0.514	S	S	*	.	H	α-helix	trans	-57.1	-43.8	179.6	-178.7	50.7	0	0	0	112.1	Q379 V380 Y381	H377-Q379 VanDerWaalsContact C-N 3.35Å; H377-Q379 PolarHBondContact O-N 3.34Å; H377-V380 PolarHBondContact O-N 3.46Å; H377-V380 VanDerWaalsContact O-N 3.12Å; H377-Y381 PolarHBondContact O-N 3.2Å
378	G	97.4	Very high	90.3	Very high	44 Å²	44	101.8 Å²	101.8	45%	0.454	50%	0.499	S	S	.	.	H	α-helix	trans	-64.5	-32.2	174.4	0	0	0	0	0	114.5	S376 E382	S376-G378 VanDerWaalsContact C-N 3.31Å; S376-G378 PolarHBondContact O-N 2.81Å; G378-E382 PolarHBondContact O-N 3.31Å
379	Q	98	Very high	91.8	Very high	39 Å²	39	96.4 Å²	96.4	18%	0.182	48%	0.479	C	S	.	.	H	α-helix	trans	-66.8	-40.6	170.8	-75.8	173.6	-27.1	0	0	111.3	F375 S376 H377 L383 L405	F375-Q379 HydrophobicContact CB-CB 4.08Å; S376-Q379 WeakPolarHBondContact O-CB 3.36Å; S376-Q379 PolarHBondContact O-N 3.25Å; S376-Q379 WeakPolarHBondContact OG-CG 3.42Å; S376-Q379 PolarHBondContact OG-N 3.3Å; H377-Q379 VanDerWaalsContact C-N 3.35Å; H377-Q379 PolarHBondContact O-N 3.34Å; Q379-L383 WeakPolarHBondContact O-CB 3.5Å; Q379-L383 VanDerWaalsContact O-CD1 3.29Å; Q379-L383 WeakPolarHBondContact O-CD1 3.42Å; Q379-L383 WeakPolarHBondContact O-CG 3.46Å; Q379-L383 PolarHBondContact O-N 3.24Å; Q379-L383 VanDerWaalsContact O-N 3.15Å; Q379-L405 HydrophobicContact CG-CB 4.41Å; Q379-L405 PolarHBondContact NE2-O 3.28Å
380	V	98	Very high	93.4	Very high	41 Å²	41	88.9 Å²	88.9	25%	0.248	45%	0.447	C	S	.	.	H	α-helix	trans	-65.6	-45	176.3	177.4	0	0	0	0	110.9	F375 S376 H377 L383 E384	F375-V380 HydrophobicContact CB-CG2 3.95Å; S376-V380 PolarHBondContact O-N 3.4Å; H377-V380 PolarHBondContact O-N 3.46Å; H377-V380 VanDerWaalsContact O-N 3.12Å; V380-L383 WeakPolarHBondContact O-CB 3.34Å; V380-L383 PolarHBondContact O-N 3.31Å; V380-E384 HydrophobicContact CG1-CG 4.26Å; V380-E384 WeakPolarHBondContact O-CG 3.46Å; V380-E384 PolarHBondContact O-N 3.33Å
381	Y	98	Very high	94.6	Very high	107 Å²	107	83 Å²	83	42%	0.42	43%	0.425	S	S	.	.	H	α-helix	trans	-55	-54.7	178.6	176.9	-96.4	0	0	0	112.4	H377 L383 E384 K385	H377-Y381 PolarHBondContact O-N 3.2Å; Y381-L383 VanDerWaalsContact C-N 3.32Å; Y381-L383 PolarHBondContact O-N 3.03Å; Y381-E384 PolarHBondContact O-N 2.87Å; Y381-K385 HydrophobicContact CE1-CD 3.85Å; Y381-K385 VanDerWaalsContact O-CB 3.27Å; Y381-K385 WeakPolarHBondContact O-CB 3.27Å; Y381-K385 PolarHBondContact O-N 3.15Å
382	E	98.1	Very high	95.7	Very high	65 Å²	65	84.7 Å²	84.7	30%	0.304	42%	0.418	S	S	.	.	H	α-helix	trans	-67.2	-30.7	179.2	-71.7	-62.5	140	0	0	112.9	G378 K385 R386 L405	G378-E382 PolarHBondContact O-N 3.31Å; E382-K385 IonicContact OE1-NZ 3.85Å; E382-K385 PolarHBondContact OE1-NZ 3.48Å; E382-K385 IonicContact OE2-NZ 2.68Å; E382-K385 PolarHBondContact OE2-NZ 2.99Å; E382-R386 VanDerWaalsContact O-CB 3.31Å; E382-R386 WeakPolarHBondContact O-CB 3.3Å; E382-R386 PolarHBondContact O-N 3.14Å; E382-L405 HydrophobicContact CB-CD1 4.23Å; E382-L405 HydrophobicContact CB-CD2 3.63Å; E382-L405 HydrophobicContact CG-CD2 4.08Å
383	L	98.5	Very high	96.4	Very high	0 Å²	0	74.5 Å²	74.5	0%	0	38%	0.381	C	S	.	.	H	α-helix	trans	-65.3	-41.5	171.6	-74.7	166.9	0	0	0	111.8	Q379 V380 Y381 F387 L401 L405 L407 V412 W415 F416	Q379-L383 WeakPolarHBondContact O-CB 3.5Å; Q379-L383 VanDerWaalsContact O-CD1 3.29Å; Q379-L383 WeakPolarHBondContact O-CD1 3.42Å; Q379-L383 WeakPolarHBondContact O-CG 3.46Å; Q379-L383 PolarHBondContact O-N 3.24Å; Q379-L383 VanDerWaalsContact O-N 3.15Å; V380-L383 WeakPolarHBondContact O-CB 3.34Å; V380-L383 PolarHBondContact O-N 3.31Å; Y381-L383 VanDerWaalsContact C-N 3.32Å; Y381-L383 PolarHBondContact O-N 3.03Å; L383-F387 WeakPolarHBondContact O-CB 3.49Å; L383-F387 PolarHBondContact O-N 2.94Å; L383-L401 HydrophobicContact CD2-CD2 3.96Å; L383-L401 HydrophobicContact CD2-CG 4.48Å; L383-L405 HydrophobicContact CD1-CD1 4.46Å; L383-L405 HydrophobicContact CD2-CD1 3.85Å; L383-L405 HydrophobicContact CG-CD1 3.66Å; L383-L407 HydrophobicContact CD1-CD1 4.15Å; L383-V412 HydrophobicContact CD2-CG1 4.3Å; L383-V412 HydrophobicContact CD2-CG2 4.49Å; L383-W415 VanDerWaalsContact C-CH2 3.48Å; L383-W415 HydrophobicContact CB-CD2 3.92Å; L383-W415 HydrophobicContact CB-CE3 3.95Å; L383-W415 HydrophobicContact CB-CH2 3.79Å; L383-W415 HydrophobicContact CB-CZ2 3.71Å; L383-W415 HydrophobicContact CB-CZ3 3.91Å; L383-W415 HydrophobicContact CD1-CD2 3.93Å; L383-W415 HydrophobicContact CD1-CG 3.86Å; L383-W415 HydrophobicContact CD2-CD2 4.28Å; L383-W415 HydrophobicContact CD2-CE3 4.12Å; L383-W415 HydrophobicContact CG-CD2 4.26Å; L383-W415 HydrophobicContact CG-CE3 4.43Å; L383-W415 WeakPolarHBondContact O-CH2 3.17Å; L383-W415 WeakPolarHBondContact O-CZ3 3.28Å; L383-F416 HydrophobicContact CD2-CD2 4.44Å; L383-F416 HydrophobicContact CD2-CE2 3.9Å
384	E	98.3	Very high	97.1	Very high	63 Å²	63	72.5 Å²	72.5	29%	0.294	36%	0.361	S	S	.	.	H	α-helix	trans	-73.4	-42.2	178.3	-67.4	-155.9	107.1	0	0	112.6	V380 Y381 R386 F387 N388 W415 R419	V380-E384 HydrophobicContact CG1-CG 4.26Å; V380-E384 WeakPolarHBondContact O-CG 3.46Å; V380-E384 PolarHBondContact O-N 3.33Å; Y381-E384 PolarHBondContact O-N 2.87Å; E384-R386 PolarHBondContact O-N 3.4Å; E384-F387 WeakPolarHBondContact O-CB 3.33Å; E384-F387 PolarHBondContact O-N 2.94Å; E384-F387 VanDerWaalsContact O-N 3.15Å; E384-N388 WeakPolarHBondContact O-CB 3.44Å; E384-N388 PolarHBondContact O-N 2.98Å; E384-N388 PolarHBondContact O-ND2 2.82Å; E384-N388 PolarHBondContact O-OD1 2.86Å; E384-W415 HydrophobicContact CB-CH2 4.46Å; E384-W415 HydrophobicContact CG-CH2 3.71Å; E384-W415 HydrophobicContact CG-CZ2 3.5Å; E384-R419 IonicContact OE1-CZ 3.71Å; E384-R419 IonicContact OE1-NE 2.72Å; E384-R419 PolarHBondContact OE1-NE 2.87Å; E384-R419 IonicContact OE1-NH2 3.77Å; E384-R419 PolarHBondContact OE1-NH2 3.21Å
385	K	97.8	Very high	97.3	Very high	103 Å²	103	71.1 Å²	71.1	45%	0.448	35%	0.35	S	S	.	.	H	α-helix	trans	-53.9	-51.1	170.8	177.9	178.5	164	-147.9	0	111.9	Y381 E382 F387 N388 Y389	Y381-K385 HydrophobicContact CE1-CD 3.85Å; Y381-K385 VanDerWaalsContact O-CB 3.27Å; Y381-K385 WeakPolarHBondContact O-CB 3.27Å; Y381-K385 PolarHBondContact O-N 3.15Å; E382-K385 IonicContact OE1-NZ 3.85Å; E382-K385 PolarHBondContact OE1-NZ 3.48Å; E382-K385 IonicContact OE2-NZ 2.68Å; E382-K385 PolarHBondContact OE2-NZ 2.99Å; K385-F387 VanDerWaalsContact C-N 3.34Å; K385-F387 PolarHBondContact O-N 2.95Å; K385-N388 PolarHBondContact O-N 2.85Å; K385-Y389 PolarHBondContact O-N 3.49Å
386	R	97.8	Very high	97.4	Very high	54 Å²	54	72.4 Å²	72.4	20%	0.204	36%	0.363	C	S	.	.	H	α-helix	trans	-69.9	-28.1	177.1	-165	66.7	162.2	109.3	9.6	112.6	E382 E384 Q390 L393 E397 L401 F416	E382-R386 VanDerWaalsContact O-CB 3.31Å; E382-R386 WeakPolarHBondContact O-CB 3.3Å; E382-R386 PolarHBondContact O-N 3.14Å; E384-R386 PolarHBondContact O-N 3.4Å; R386-Q390 PolarHBondContact O-N 2.61Å; R386-L393 HydrophobicContact CG-CD2 4.18Å; R386-E397 IonicContact CZ-OE1 3.22Å; R386-E397 IonicContact NH1-OE1 3.29Å; R386-E397 IonicContact NH2-OE1 2.67Å; R386-E397 PolarHBondContact NH2-OE1 2.96Å; R386-L401 HydrophobicContact CB-CD1 4.4Å; R386-L401 HydrophobicContact CB-CD2 4.17Å; R386-L401 HydrophobicContact CG-CD1 4.37Å; R386-L401 HydrophobicContact CG-CD2 3.95Å; R386-F416 HydrophobicContact CB-CZ 4.43Å; R386-F416 HydrophobicContact CG-CZ 4.49Å
387	F	98.2	Very high	97.4	Very high	2 Å²	2	71.1 Å²	71.1	1%	0.009	35%	0.35	C	S	.	.	H	α-helix	trans	-71.3	-38.3	174.2	180	-98	0	0	0	113.9	L383 E384 K385 Q390 R391 W415 F416 R419 R420	L383-F387 WeakPolarHBondContact O-CB 3.49Å; L383-F387 PolarHBondContact O-N 2.94Å; E384-F387 WeakPolarHBondContact O-CB 3.33Å; E384-F387 PolarHBondContact O-N 2.94Å; E384-F387 VanDerWaalsContact O-N 3.15Å; K385-F387 VanDerWaalsContact C-N 3.34Å; K385-F387 PolarHBondContact O-N 2.95Å; F387-Q390 CarbonylContact O-C 3.56Å; F387-Q390 PolarHBondContact O-N 2.98Å; F387-R391 HydrophobicContact CD2-CB 4.47Å; F387-R391 HydrophobicContact CD2-CG 4.43Å; F387-R391 HydrophobicContact CE1-CG 4.09Å; F387-R391 HydrophobicContact CE2-CB 3.84Å; F387-R391 HydrophobicContact CE2-CG 3.89Å; F387-R391 HydrophobicContact CZ-CB 4.08Å; F387-R391 HydrophobicContact CZ-CG 3.72Å; F387-R391 WeakPolarHBondContact O-CG 3.26Å; F387-W415 HydrophobicContact CB-CH2 3.91Å; F387-W415 HydrophobicContact CB-CZ3 3.82Å; F387-W415 HydrophobicContact CD2-CZ3 4.26Å; F387-W415 HydrophobicContact CG-CH2 4.31Å; F387-W415 HydrophobicContact CG-CZ3 4.18Å; F387-F416 HydrophobicContact CB-CE1 4.04Å; F387-F416 HydrophobicContact CB-CZ 4.16Å; F387-F416 AromaticContact CD2-CD1 3.76Å; F387-F416 HydrophobicContact CD2-CD1 3.76Å; F387-F416 AromaticContact CD2-CE1 3.79Å; F387-F416 HydrophobicContact CD2-CE1 3.79Å; F387-F416 HydrophobicContact CE2-CD1 4.48Å; F387-F416 HydrophobicContact CG-CE1 4.43Å; F387-R419 HydrophobicContact CD1-CG 3.51Å; F387-R419 HydrophobicContact CD2-CB 4.13Å; F387-R419 HydrophobicContact CD2-CG 3.84Å; F387-R419 HydrophobicContact CE1-CG 3.55Å; F387-R419 HydrophobicContact CE2-CB 4.07Å; F387-R419 HydrophobicContact CE2-CG 3.89Å; F387-R419 HydrophobicContact CG-CB 4.41Å; F387-R419 HydrophobicContact CG-CG 3.67Å; F387-R419 HydrophobicContact CZ-CB 4.28Å; F387-R419 HydrophobicContact CZ-CG 3.74Å; F387-R420 HydrophobicContact CE2-CG 3.75Å; F387-R420 HydrophobicContact CZ-CG 4.1Å
388	N	96.6	Very high	97.5	Very high	99 Å²	99	66.1 Å²	66.1	53%	0.529	32%	0.324	S	S	.	.	H	α-helix	trans	-67.8	-40.6	177.7	-68.2	-13.2	0	0	0	110.1	E384 K385	E384-N388 WeakPolarHBondContact O-CB 3.44Å; E384-N388 PolarHBondContact O-N 2.98Å; E384-N388 PolarHBondContact O-ND2 2.82Å; E384-N388 PolarHBondContact O-OD1 2.86Å; K385-N388 PolarHBondContact O-N 2.85Å
389	Y	96.4	Very high	97.6	Very high	125 Å²	125	65.2 Å²	65.2	49%	0.49	31%	0.312	S	S	.	.	H	α-helix	trans	-59.6	-49	169.3	-174.4	-72.9	0	0	0	112.1	L241 K385	L241-Y389 HydrophobicContact CD1-CD1 3.96Å; L241-Y389 HydrophobicContact CD1-CD2 3.63Å; L241-Y389 HydrophobicContact CD1-CE1 3.79Å; L241-Y389 HydrophobicContact CD1-CE2 3.5Å; L241-Y389 VanDerWaalsContact CD1-CE2 3.5Å; L241-Y389 HydrophobicContact CD1-CG 3.86Å; L241-Y389 HydrophobicContact CD2-CD2 3.93Å; L241-Y389 HydrophobicContact CD2-CE2 3.23Å; L241-Y389 HydrophobicContact CG-CD2 4.42Å; L241-Y389 HydrophobicContact CG-CE2 3.93Å; K385-Y389 PolarHBondContact O-N 3.49Å
390	Q	95.9	Very high	97.6	Very high	42 Å²	42	67.7 Å²	67.7	20%	0.196	32%	0.324	C	S	.	.			trans	-151.6	115.6	-173.3	170.9	-173.4	10.1	0	0	111.5	R386 F387 Y392 L393 E397 F416	R386-Q390 PolarHBondContact O-N 2.61Å; F387-Q390 CarbonylContact O-C 3.56Å; F387-Q390 PolarHBondContact O-N 2.98Å; Q390-Y392 VanDerWaalsContact C-N 3.27Å; Q390-Y392 VanDerWaalsContact CG-O 3.3Å; Q390-Y392 WeakPolarHBondContact CG-O 3.42Å; Q390-Y392 PolarHBondContact NE2-O 2.91Å; Q390-Y392 PolarHBondContact O-N 3.31Å; Q390-L393 HydrophobicContact CG-CD2 4.24Å; Q390-E397 VanDerWaalsContact NE2-CD 3.31Å; Q390-E397 PolarHBondContact NE2-OE1 3.21Å; Q390-E397 PolarHBondContact NE2-OE2 3.27Å; Q390-E397 PolarHBondContact OE1-OE1 3.46Å; Q390-F416 WeakPolarHBondContact O-CE1 3.47Å
391	R	96.4	Very high	97.6	Very high	123 Å²	123	66.3 Å²	66.3	46%	0.464	32%	0.315	S	S	.	.	S	Bend	trans	-78.1	-10.1	-173.8	-62.1	177.1	179.9	147.3	2.6	113.9	F387 R420	F387-R391 HydrophobicContact CD2-CB 4.47Å; F387-R391 HydrophobicContact CD2-CG 4.43Å; F387-R391 HydrophobicContact CE1-CG 4.09Å; F387-R391 HydrophobicContact CE2-CB 3.84Å; F387-R391 HydrophobicContact CE2-CG 3.89Å; F387-R391 HydrophobicContact CZ-CB 4.08Å; F387-R391 HydrophobicContact CZ-CG 3.72Å; F387-R391 WeakPolarHBondContact O-CG 3.26Å; R391-R420 WeakPolarHBondContact O-CD 3.38Å
392	Y	98	Very high	97.6	Very high	165 Å²	165	61.5 Å²	61.5	65%	0.647	30%	0.297	S	S	*	.	S	Bend	trans	-138.2	105.1	-176.3	-66.8	-105.8	0	0	0	110.6	Q390	Q390-Y392 VanDerWaalsContact C-N 3.27Å; Q390-Y392 VanDerWaalsContact CG-O 3.3Å; Q390-Y392 WeakPolarHBondContact CG-O 3.42Å; Q390-Y392 PolarHBondContact NE2-O 2.91Å; Q390-Y392 PolarHBondContact O-N 3.31Å
393	L	96.8	Very high	97.6	Very high	22 Å²	22	66.6 Å²	66.6	12%	0.115	31%	0.314	C	S	.	.			trans	-85.8	136.4	177.1	-59.2	179.1	0	0	0	112.5	R386 Q390 E397 R398 L401 V412 F416	R386-L393 HydrophobicContact CG-CD2 4.18Å; Q390-L393 HydrophobicContact CG-CD2 4.24Å; L393-E397 HydrophobicContact CB-CB 4.47Å; L393-E397 HydrophobicContact CD2-CB 4.27Å; L393-R398 HydrophobicContact CB-CB 4.31Å; L393-R398 HydrophobicContact CD1-CB 4.45Å; L393-R398 PolarHBondContact O-NH2 3.41Å; L393-R398 VanDerWaalsContact O-NH2 3.15Å; L393-L401 HydrophobicContact CD1-CD2 3.7Å; L393-V412 HydrophobicContact CD1-CG1 3.98Å; L393-F416 HydrophobicContact CD1-CD1 4.29Å; L393-F416 HydrophobicContact CD1-CD2 4.03Å; L393-F416 HydrophobicContact CD1-CE1 3.88Å; L393-F416 HydrophobicContact CD1-CE2 3.62Å; L393-F416 HydrophobicContact CD1-CG 4.38Å; L393-F416 HydrophobicContact CD1-CZ 3.55Å; L393-F416 HydrophobicContact CD2-CE1 4.18Å; L393-F416 HydrophobicContact CD2-CZ 4.29Å; L393-F416 HydrophobicContact CG-CD1 4.06Å; L393-F416 HydrophobicContact CG-CE1 3.68Å; L393-F416 HydrophobicContact CG-CE2 4.36Å; L393-F416 HydrophobicContact CG-CZ 3.87Å
394	S	97.4	Very high	97.5	Very high	51 Å²	51	70.5 Å²	70.5	36%	0.357	34%	0.341	S	S	.	.			trans	-61.9	-176.2	166.6	69.5	0	0	0	0	112.3	E397 R398	S394-E397 WeakPolarHBondContact CB-OE2 3.39Å; S394-E397 PolarHBondContact N-OE2 2.92Å; S394-E397 VanDerWaalsContact OG-CD 3.31Å; S394-E397 VanDerWaalsContact OG-CG 3.27Å; S394-E397 WeakPolarHBondContact OG-CG 3.36Å; S394-E397 PolarHBondContact OG-N 3.31Å; S394-E397 PolarHBondContact OG-OE2 2.97Å; S394-R398 VanDerWaalsContact O-CB 3.27Å; S394-R398 WeakPolarHBondContact O-CB 3.34Å; S394-R398 VanDerWaalsContact O-CZ 3.29Å; S394-R398 PolarHBondContact O-NH2 2.85Å
395	A	96.9	Very high	97.5	Very high	62 Å²	62	68.5 Å²	68.5	51%	0.512	33%	0.332	S	S	.	.	H	α-helix	trans	-67.4	-51.1	173.1	0	0	0	0	0	111.9	R398 A399	A395-R398 WeakPolarHBondContact O-CB 3.36Å; A395-R398 PolarHBondContact O-N 3.34Å; A395-A399 PolarHBondContact O-N 2.98Å
396	T	97.5	Very high	97.5	Very high	92 Å²	92	74.5 Å²	74.5	56%	0.564	35%	0.352	S	S	*	.	H	α-helix	trans	-59.8	-52.4	-175.2	-44.9	0	0	0	0	112	R398 A399 E400	T396-R398 PolarHBondContact O-N 3.46Å; T396-A399 WeakPolarHBondContact O-CB 3.29Å; T396-A399 PolarHBondContact O-N 2.89Å; T396-E400 WeakPolarHBondContact O-CG 3.4Å; T396-E400 PolarHBondContact O-N 3.39Å
397	E	97.8	Very high	97.5	Very high	40 Å²	40	73 Å²	73	19%	0.187	35%	0.348	C	S	.	.	H	α-helix	trans	-63	-30.4	-178.5	-61.1	167.8	105.9	0	0	112.9	R386 Q390 L393 S394 L401	R386-E397 IonicContact CZ-OE1 3.22Å; R386-E397 IonicContact NH1-OE1 3.29Å; R386-E397 IonicContact NH2-OE1 2.67Å; R386-E397 PolarHBondContact NH2-OE1 2.96Å; Q390-E397 VanDerWaalsContact NE2-CD 3.31Å; Q390-E397 PolarHBondContact NE2-OE1 3.21Å; Q390-E397 PolarHBondContact NE2-OE2 3.27Å; Q390-E397 PolarHBondContact OE1-OE1 3.46Å; L393-E397 HydrophobicContact CB-CB 4.47Å; L393-E397 HydrophobicContact CD2-CB 4.27Å; S394-E397 WeakPolarHBondContact CB-OE2 3.39Å; S394-E397 PolarHBondContact N-OE2 2.92Å; S394-E397 VanDerWaalsContact OG-CD 3.31Å; S394-E397 VanDerWaalsContact OG-CG 3.27Å; S394-E397 WeakPolarHBondContact OG-CG 3.36Å; S394-E397 PolarHBondContact OG-N 3.31Å; S394-E397 PolarHBondContact OG-OE2 2.97Å; E397-L401 VanDerWaalsContact O-CB 3.31Å; E397-L401 WeakPolarHBondContact O-CB 3.49Å; E397-L401 PolarHBondContact O-N 3.3Å
398	R	98.3	Very high	97.4	Very high	50 Å²	50	75.4 Å²	75.4	19%	0.189	37%	0.365	C	S	.	.	H	α-helix	trans	-73.5	-40	176	-169.3	-164.7	-46.7	116.4	10.3	111.2	L393 S394 A395 T396 E400 A402 E409 V412	L393-R398 HydrophobicContact CB-CB 4.31Å; L393-R398 HydrophobicContact CD1-CB 4.45Å; L393-R398 PolarHBondContact O-NH2 3.41Å; L393-R398 VanDerWaalsContact O-NH2 3.15Å; S394-R398 VanDerWaalsContact O-CB 3.27Å; S394-R398 WeakPolarHBondContact O-CB 3.34Å; S394-R398 VanDerWaalsContact O-CZ 3.29Å; S394-R398 PolarHBondContact O-NH2 2.85Å; A395-R398 WeakPolarHBondContact O-CB 3.36Å; A395-R398 PolarHBondContact O-N 3.34Å; T396-R398 PolarHBondContact O-N 3.46Å; R398-E400 VanDerWaalsContact C-N 3.32Å; R398-A402 WeakPolarHBondContact O-CB 3.39Å; R398-A402 PolarHBondContact O-N 3.2Å; R398-E409 HydrophobicContact CG-CB 4.35Å; R398-E409 HydrophobicContact CG-CG 4.17Å; R398-E409 IonicContact NH1-OE2 3.85Å; R398-E409 PolarHBondContact NH1-OE2 3.43Å; R398-E409 VanDerWaalsContact NH1-OE2 3.15Å; R398-V412 HydrophobicContact CG-CB 4.02Å; R398-V412 HydrophobicContact CG-CG1 3.81Å
399	A	98.3	Very high	97.5	Very high	24 Å²	24	74.5 Å²	74.5	20%	0.198	36%	0.358	C	S	.	.	H	α-helix	trans	-65.1	-37	174	0	0	0	0	0	111.5	A395 T396 R403 E409	A395-A399 PolarHBondContact O-N 2.98Å; T396-A399 WeakPolarHBondContact O-CB 3.29Å; T396-A399 PolarHBondContact O-N 2.89Å; A399-R403 VanDerWaalsContact O-CB 3.3Å; A399-R403 WeakPolarHBondContact O-CB 3.46Å; A399-R403 PolarHBondContact O-N 3.38Å; A399-E409 HydrophobicContact CB-CG 4.22Å
400	E	98	Very high	97.6	Very high	91 Å²	91	72.8 Å²	72.8	43%	0.425	36%	0.361	S	S	.	.	H	α-helix	trans	-65.8	-51.1	173.4	-70.8	164	175.9	0	0	112.5	T396 R398 A402 R403 S404	T396-E400 WeakPolarHBondContact O-CG 3.4Å; T396-E400 PolarHBondContact O-N 3.39Å; R398-E400 VanDerWaalsContact C-N 3.32Å; E400-A402 VanDerWaalsContact C-N 3.3Å; E400-A402 PolarHBondContact O-N 2.78Å; E400-R403 WeakPolarHBondContact O-CB 3.39Å; E400-R403 PolarHBondContact O-N 2.68Å; E400-R403 VanDerWaalsContact O-N 3.12Å; E400-S404 PolarHBondContact O-N 3.48Å; E400-S404 PolarHBondContact O-OG 3.16Å
401	L	98.2	Very high	97.6	Very high	13 Å²	13	74.3 Å²	74.3	7%	0.068	37%	0.368	C	S	.	.	H	α-helix	trans	-65.4	-34	178.4	-170.1	65.6	0	0	0	112.2	L383 R386 L393 E397 S404 L405 V412 F416	L383-L401 HydrophobicContact CD2-CD2 3.96Å; L383-L401 HydrophobicContact CD2-CG 4.48Å; R386-L401 HydrophobicContact CB-CD1 4.4Å; R386-L401 HydrophobicContact CB-CD2 4.17Å; R386-L401 HydrophobicContact CG-CD1 4.37Å; R386-L401 HydrophobicContact CG-CD2 3.95Å; L393-L401 HydrophobicContact CD1-CD2 3.7Å; E397-L401 VanDerWaalsContact O-CB 3.31Å; E397-L401 WeakPolarHBondContact O-CB 3.49Å; E397-L401 PolarHBondContact O-N 3.3Å; L401-S404 PolarHBondContact O-OG 3.03Å; L401-L405 HydrophobicContact CD1-CD1 3.8Å; L401-L405 HydrophobicContact CD1-CG 4.09Å; L401-L405 HydrophobicContact CG-CD1 3.96Å; L401-L405 HydrophobicContact CG-CG 4.43Å; L401-L405 WeakPolarHBondContact O-CB 3.4Å; L401-L405 VanDerWaalsContact O-CG 3.29Å; L401-L405 WeakPolarHBondContact O-CG 3.4Å; L401-L405 PolarHBondContact O-N 3.41Å; L401-L405 VanDerWaalsContact O-N 3.15Å; L401-V412 HydrophobicContact CD2-CG1 3.95Å; L401-F416 HydrophobicContact CD2-CE2 3.75Å; L401-F416 HydrophobicContact CD2-CZ 4.1Å
402	A	98.3	Very high	97.7	Very high	5 Å²	5	68.5 Å²	68.5	4%	0.041	35%	0.346	C	S	.	.	H	α-helix	trans	-61.9	-46.7	170.9	0	0	0	0	0	111	R398 E400 R406 L407 E409 V412	R398-A402 WeakPolarHBondContact O-CB 3.39Å; R398-A402 PolarHBondContact O-N 3.2Å; E400-A402 VanDerWaalsContact C-N 3.3Å; E400-A402 PolarHBondContact O-N 2.78Å; A402-R406 PolarHBondContact O-N 3.02Å; A402-L407 CarbonylContact C-O 3.58Å; A402-L407 WeakPolarHBondContact CB-O 3.36Å; A402-L407 PolarHBondContact O-N 3.03Å; A402-L407 VanDerWaalsContact O-O 3.04Å; A402-E409 HydrophobicContact CB-CG 4.07Å; A402-V412 HydrophobicContact CB-CG2 4.01Å
403	R	98	Very high	97.7	Very high	172 Å²	172	66.4 Å²	66.4	65%	0.649	34%	0.34	S	S	*	.	H	α-helix	trans	-63.7	-47.2	179.8	-165.6	-172.3	-52.5	114.7	4.6	112.4	A399 E400 R406	A399-R403 VanDerWaalsContact O-CB 3.3Å; A399-R403 WeakPolarHBondContact O-CB 3.46Å; A399-R403 PolarHBondContact O-N 3.38Å; E400-R403 WeakPolarHBondContact O-CB 3.39Å; E400-R403 PolarHBondContact O-N 2.68Å; E400-R403 VanDerWaalsContact O-N 3.12Å; R403-R406 PolarHBondContact O-N 2.7Å
404	S	97.7	Very high	97.8	Very high	83 Å²	83	69.4 Å²	69.4	58%	0.58	36%	0.355	S	S	*	.	H	α-helix	trans	-66	-42.1	-179.2	62.8	0	0	0	0	112.3	E400 L401 R406	E400-S404 PolarHBondContact O-N 3.48Å; E400-S404 PolarHBondContact O-OG 3.16Å; L401-S404 PolarHBondContact O-OG 3.03Å; S404-R406 VanDerWaalsContact C-N 3.3Å; S404-R406 PolarHBondContact O-N 2.86Å
405	L	97.5	Very high	97.8	Very high	20 Å²	20	68.4 Å²	68.4	11%	0.105	34%	0.344	C	S	.	.	H	α-helix	trans	-84.2	-0.6	-179	-57	-174.3	0	0	0	114.2	Q379 E382 L383 L401 L407	Q379-L405 HydrophobicContact CG-CB 4.41Å; Q379-L405 PolarHBondContact NE2-O 3.28Å; E382-L405 HydrophobicContact CB-CD1 4.23Å; E382-L405 HydrophobicContact CB-CD2 3.63Å; E382-L405 HydrophobicContact CG-CD2 4.08Å; L383-L405 HydrophobicContact CD1-CD1 4.46Å; L383-L405 HydrophobicContact CD2-CD1 3.85Å; L383-L405 HydrophobicContact CG-CD1 3.66Å; L401-L405 HydrophobicContact CD1-CD1 3.8Å; L401-L405 HydrophobicContact CD1-CG 4.09Å; L401-L405 HydrophobicContact CG-CD1 3.96Å; L401-L405 HydrophobicContact CG-CG 4.43Å; L401-L405 WeakPolarHBondContact O-CB 3.4Å; L401-L405 VanDerWaalsContact O-CG 3.29Å; L401-L405 WeakPolarHBondContact O-CG 3.4Å; L401-L405 PolarHBondContact O-N 3.41Å; L401-L405 VanDerWaalsContact O-N 3.15Å; L405-L407 VanDerWaalsContact C-N 3.28Å; L405-L407 HydrophobicContact CB-CD1 4.15Å; L405-L407 HydrophobicContact CB-CG 4.08Å; L405-L407 PolarHBondContact O-N 3.11Å
406	R	97.6	Very high	97.9	Very high	230 Å²	230	65.8 Å²	65.8	87%	0.868	32%	0.321	S	S	*	.	T	Hydrogen-bonded Turn	trans	54.9	42	-174.2	-53.9	-177.6	-177.7	-175.4	0.4	112.6	A402 R403 S404	A402-R406 PolarHBondContact O-N 3.02Å; R403-R406 PolarHBondContact O-N 2.7Å; S404-R406 VanDerWaalsContact C-N 3.3Å; S404-R406 PolarHBondContact O-N 2.86Å
407	L	97.1	Very high	97.9	Very high	22 Å²	22	66.8 Å²	66.8	12%	0.115	32%	0.319	C	S	.	.			trans	-112.1	165.7	175.4	-63.3	-178	0	0	0	110.4	F375 L383 A402 L405 Q411 V412	F375-L407 HydrophobicContact CD1-CD1 3.98Å; F375-L407 HydrophobicContact CD1-CD2 3.73Å; F375-L407 HydrophobicContact CE1-CD1 3.92Å; F375-L407 HydrophobicContact CE1-CD2 3.71Å; F375-L407 HydrophobicContact CE1-CG 4.47Å; L383-L407 HydrophobicContact CD1-CD1 4.15Å; A402-L407 CarbonylContact C-O 3.58Å; A402-L407 WeakPolarHBondContact CB-O 3.36Å; A402-L407 PolarHBondContact O-N 3.03Å; A402-L407 VanDerWaalsContact O-O 3.04Å; L405-L407 VanDerWaalsContact C-N 3.28Å; L405-L407 HydrophobicContact CB-CD1 4.15Å; L405-L407 HydrophobicContact CB-CG 4.08Å; L405-L407 PolarHBondContact O-N 3.11Å; L407-Q411 HydrophobicContact CB-CB 4.39Å; L407-V412 HydrophobicContact CB-CG2 4.23Å; L407-V412 HydrophobicContact CD1-CG2 4.44Å
408	S	97.7	Very high	97.9	Very high	52 Å²	52	69.1 Å²	69.1	36%	0.364	33%	0.333	S	S	.	.			trans	-81.4	150.2	164.4	61.3	0	0	0	0	111.2	T410 Q411 V412	S408-T410 PolarHBondContact O-N 3.19Å; S408-T410 VanDerWaalsContact O-N 3.14Å; S408-Q411 WeakPolarHBondContact O-CB 3.38Å; S408-Q411 PolarHBondContact O-N 3.5Å; S408-Q411 WeakPolarHBondContact OG-CG 3.43Å; S408-Q411 PolarHBondContact OG-N 3.27Å; S408-Q411 PolarHBondContact OG-OE1 3.49Å; S408-V412 PolarHBondContact O-N 3.48Å; S408-V412 VanDerWaalsContact O-N 3.1Å
409	E	98.2	Very high	97.9	Very high	80 Å²	80	68.7 Å²	68.7	37%	0.374	33%	0.331	S	S	.	.	H	α-helix	trans	-51.4	-36	169.9	-84	-167	-110.5	0	0	112.7	R398 A399 A402 V412 K413	R398-E409 HydrophobicContact CG-CB 4.35Å; R398-E409 HydrophobicContact CG-CG 4.17Å; R398-E409 IonicContact NH1-OE2 3.85Å; R398-E409 PolarHBondContact NH1-OE2 3.43Å; R398-E409 VanDerWaalsContact NH1-OE2 3.15Å; A399-E409 HydrophobicContact CB-CG 4.22Å; A402-E409 HydrophobicContact CB-CG 4.07Å; E409-V412 PolarHBondContact O-N 2.84Å; E409-K413 VanDerWaalsContact O-CB 3.24Å; E409-K413 WeakPolarHBondContact O-CB 3.12Å; E409-K413 PolarHBondContact O-N 3.44Å
410	T	97.7	Very high	97.8	Very high	90 Å²	90	71.1 Å²	71.1	55%	0.552	34%	0.335	S	S	*	.	H	α-helix	trans	-64.8	-39.4	177.2	-53.6	0	0	0	0	111.9	S408 I414	S408-T410 PolarHBondContact O-N 3.19Å; S408-T410 VanDerWaalsContact O-N 3.14Å; T410-I414 HydrophobicContact CG2-CD1 3.9Å; T410-I414 WeakPolarHBondContact O-CB 3.34Å; T410-I414 WeakPolarHBondContact O-CD1 3.3Å; T410-I414 VanDerWaalsContact O-CG1 3.22Å; T410-I414 WeakPolarHBondContact O-CG1 3.48Å; T410-I414 PolarHBondContact O-N 3.43Å
411	Q	97.4	Very high	97.7	Very high	74 Å²	74	74.8 Å²	74.8	35%	0.346	35%	0.346	S	S	.	.	H	α-helix	trans	-65	-44.7	173.2	-77.2	161.3	-64.7	0	0	111.3	F375 L407 S408 I414 W415	F375-Q411 HydrophobicContact CE1-CB 4.14Å; F375-Q411 HydrophobicContact CE1-CG 4.28Å; F375-Q411 HydrophobicContact CZ-CB 4.09Å; F375-Q411 HydrophobicContact CZ-CG 4.35Å; L407-Q411 HydrophobicContact CB-CB 4.39Å; S408-Q411 WeakPolarHBondContact O-CB 3.38Å; S408-Q411 PolarHBondContact O-N 3.5Å; S408-Q411 WeakPolarHBondContact OG-CG 3.43Å; S408-Q411 PolarHBondContact OG-N 3.27Å; S408-Q411 PolarHBondContact OG-OE1 3.49Å; Q411-I414 PolarHBondContact O-N 3.24Å; Q411-W415 WeakPolarHBondContact O-CB 3.39Å; Q411-W415 PolarHBondContact O-N 2.88Å
412	V	98.1	Very high	97.5	Very high	0 Å²	0	80.6 Å²	80.6	0%	0	37%	0.371	C	S	.	.	H	α-helix	trans	-61.4	-48.1	176	-179.8	0	0	0	0	110.6	L383 L393 R398 L401 A402 L407 S408 E409 I414 W415 F416	L383-V412 HydrophobicContact CD2-CG1 4.3Å; L383-V412 HydrophobicContact CD2-CG2 4.49Å; L393-V412 HydrophobicContact CD1-CG1 3.98Å; R398-V412 HydrophobicContact CG-CB 4.02Å; R398-V412 HydrophobicContact CG-CG1 3.81Å; L401-V412 HydrophobicContact CD2-CG1 3.95Å; A402-V412 HydrophobicContact CB-CG2 4.01Å; L407-V412 HydrophobicContact CB-CG2 4.23Å; L407-V412 HydrophobicContact CD1-CG2 4.44Å; S408-V412 PolarHBondContact O-N 3.48Å; S408-V412 VanDerWaalsContact O-N 3.1Å; E409-V412 PolarHBondContact O-N 2.84Å; V412-I414 PolarHBondContact O-N 2.7Å; V412-W415 PolarHBondContact O-N 3.42Å; V412-F416 HydrophobicContact CG1-CD2 3.76Å; V412-F416 HydrophobicContact CG1-CE2 3.95Å; V412-F416 WeakPolarHBondContact O-CD2 3.3Å; V412-F416 PolarHBondContact O-N 2.78Å
413	K	97.9	Very high	97.3	Very high	121 Å²	121	82.1 Å²	82.1	53%	0.526	38%	0.38	S	S	.	.	H	α-helix	trans	-55.2	-48.6	176.8	-174.6	177.9	-175.4	178.8	0	112.1	E409 F416 Q417	E409-K413 VanDerWaalsContact O-CB 3.24Å; E409-K413 WeakPolarHBondContact O-CB 3.12Å; E409-K413 PolarHBondContact O-N 3.44Å; K413-F416 PolarHBondContact O-N 2.93Å; K413-Q417 WeakPolarHBondContact O-CB 3.5Å; K413-Q417 PolarHBondContact O-N 2.93Å
414	I	97.5	Very high	97.1	Very high	85 Å²	85	80.4 Å²	80.4	44%	0.436	38%	0.377	S	S	.	.	H	α-helix	trans	-66.1	-41.9	178.7	-71.7	169.1	0	0	0	110.8	T410 Q411 V412 Q417 N418	T410-I414 HydrophobicContact CG2-CD1 3.9Å; T410-I414 WeakPolarHBondContact O-CB 3.34Å; T410-I414 WeakPolarHBondContact O-CD1 3.3Å; T410-I414 VanDerWaalsContact O-CG1 3.22Å; T410-I414 WeakPolarHBondContact O-CG1 3.48Å; T410-I414 PolarHBondContact O-N 3.43Å; Q411-I414 PolarHBondContact O-N 3.24Å; V412-I414 PolarHBondContact O-N 2.7Å; I414-Q417 PolarHBondContact O-N 3.27Å; I414-N418 WeakPolarHBondContact CG2-ND2 3.35Å; I414-N418 WeakPolarHBondContact O-CB 3.17Å; I414-N418 PolarHBondContact O-N 2.91Å; I414-N418 PolarHBondContact O-ND2 3.46Å
415	W	98.2	Very high	96.7	Very high	31 Å²	31	83.1 Å²	83.1	12%	0.117	38%	0.378	C	S	.	.	H	α-helix	trans	-63	-47.1	177.2	-174	103.7	0	0	0	111	F375 L383 E384 F387 Q411 V412 Q417 N418 R419	F375-W415 AromaticContact CD2-CD1 3.89Å; F375-W415 HydrophobicContact CE2-CB 4.44Å; F375-W415 AromaticContact CE2-CD1 3.73Å; F375-W415 HydrophobicContact CE2-CG 4.44Å; L383-W415 VanDerWaalsContact C-CH2 3.48Å; L383-W415 HydrophobicContact CB-CD2 3.92Å; L383-W415 HydrophobicContact CB-CE3 3.95Å; L383-W415 HydrophobicContact CB-CH2 3.79Å; L383-W415 HydrophobicContact CB-CZ2 3.71Å; L383-W415 HydrophobicContact CB-CZ3 3.91Å; L383-W415 HydrophobicContact CD1-CD2 3.93Å; L383-W415 HydrophobicContact CD1-CG 3.86Å; L383-W415 HydrophobicContact CD2-CD2 4.28Å; L383-W415 HydrophobicContact CD2-CE3 4.12Å; L383-W415 HydrophobicContact CG-CD2 4.26Å; L383-W415 HydrophobicContact CG-CE3 4.43Å; L383-W415 WeakPolarHBondContact O-CH2 3.17Å; L383-W415 WeakPolarHBondContact O-CZ3 3.28Å; E384-W415 HydrophobicContact CB-CH2 4.46Å; E384-W415 HydrophobicContact CG-CH2 3.71Å; E384-W415 HydrophobicContact CG-CZ2 3.5Å; F387-W415 HydrophobicContact CB-CH2 3.91Å; F387-W415 HydrophobicContact CB-CZ3 3.82Å; F387-W415 HydrophobicContact CD2-CZ3 4.26Å; F387-W415 HydrophobicContact CG-CH2 4.31Å; F387-W415 HydrophobicContact CG-CZ3 4.18Å; Q411-W415 WeakPolarHBondContact O-CB 3.39Å; Q411-W415 PolarHBondContact O-N 2.88Å; V412-W415 PolarHBondContact O-N 3.42Å; W415-Q417 VanDerWaalsContact C-N 3.31Å; W415-Q417 PolarHBondContact O-N 2.93Å; W415-N418 PolarHBondContact O-N 3.44Å; W415-R419 HydrophobicContact CE3-CB 4.16Å; W415-R419 HydrophobicContact CH2-CB 3.86Å; W415-R419 HydrophobicContact CH2-CG 3.62Å; W415-R419 HydrophobicContact CZ2-CB 4.33Å; W415-R419 HydrophobicContact CZ2-CG 4.21Å; W415-R419 HydrophobicContact CZ3-CB 3.77Å; W415-R419 HydrophobicContact CZ3-CG 3.96Å; W415-R419 WeakPolarHBondContact O-CB 3.49Å; W415-R419 PolarHBondContact O-N 3.04Å
416	F	98.3	Very high	96.2	Very high	6 Å²	6	88.7 Å²	88.7	3%	0.026	40%	0.398	C	S	.	.	H	α-helix	trans	-64.7	-32.2	177.1	-91.1	-102.5	0	0	0	112.9	L383 R386 F387 Q390 L393 L401 V412 K413 R420	L383-F416 HydrophobicContact CD2-CD2 4.44Å; L383-F416 HydrophobicContact CD2-CE2 3.9Å; R386-F416 HydrophobicContact CB-CZ 4.43Å; R386-F416 HydrophobicContact CG-CZ 4.49Å; F387-F416 HydrophobicContact CB-CE1 4.04Å; F387-F416 HydrophobicContact CB-CZ 4.16Å; F387-F416 AromaticContact CD2-CD1 3.76Å; F387-F416 HydrophobicContact CD2-CD1 3.76Å; F387-F416 AromaticContact CD2-CE1 3.79Å; F387-F416 HydrophobicContact CD2-CE1 3.79Å; F387-F416 HydrophobicContact CE2-CD1 4.48Å; F387-F416 HydrophobicContact CG-CE1 4.43Å; Q390-F416 WeakPolarHBondContact O-CE1 3.47Å; L393-F416 HydrophobicContact CD1-CD1 4.29Å; L393-F416 HydrophobicContact CD1-CD2 4.03Å; L393-F416 HydrophobicContact CD1-CE1 3.88Å; L393-F416 HydrophobicContact CD1-CE2 3.62Å; L393-F416 HydrophobicContact CD1-CG 4.38Å; L393-F416 HydrophobicContact CD1-CZ 3.55Å; L393-F416 HydrophobicContact CD2-CE1 4.18Å; L393-F416 HydrophobicContact CD2-CZ 4.29Å; L393-F416 HydrophobicContact CG-CD1 4.06Å; L393-F416 HydrophobicContact CG-CE1 3.68Å; L393-F416 HydrophobicContact CG-CE2 4.36Å; L393-F416 HydrophobicContact CG-CZ 3.87Å; L401-F416 HydrophobicContact CD2-CE2 3.75Å; L401-F416 HydrophobicContact CD2-CZ 4.1Å; V412-F416 HydrophobicContact CG1-CD2 3.76Å; V412-F416 HydrophobicContact CG1-CE2 3.95Å; V412-F416 WeakPolarHBondContact O-CD2 3.3Å; V412-F416 PolarHBondContact O-N 2.78Å; K413-F416 PolarHBondContact O-N 2.93Å; F416-R420 WeakPolarHBondContact O-CG 3.45Å; F416-R420 PolarHBondContact O-N 2.95Å; F416-R420 PolarHBondContact O-NE 3.28Å
417	Q	97.6	Very high	95.8	Very high	114 Å²	114	79.8 Å²	79.8	53%	0.533	37%	0.367	S	S	.	.	H	α-helix	trans	-67.7	-47	171.5	-175.4	174.5	-0.6	0	0	111.5	K413 I414 W415 R419 R420 Y421	K413-Q417 WeakPolarHBondContact O-CB 3.5Å; K413-Q417 PolarHBondContact O-N 2.93Å; I414-Q417 PolarHBondContact O-N 3.27Å; W415-Q417 VanDerWaalsContact C-N 3.31Å; W415-Q417 PolarHBondContact O-N 2.93Å; Q417-R419 PolarHBondContact O-N 3.15Å; Q417-R420 PolarHBondContact O-N 3.17Å; Q417-Y421 PolarHBondContact O-N 3.15Å
418	N	97.9	Very high	95.3	Very high	89 Å²	89	82.1 Å²	82.1	48%	0.476	38%	0.379	S	S	.	.	H	α-helix	trans	-64.7	-37.3	177.5	-70.3	-26.3	0	0	0	112.3	I414 W415 Y421 K422	I414-N418 WeakPolarHBondContact CG2-ND2 3.35Å; I414-N418 WeakPolarHBondContact O-CB 3.17Å; I414-N418 PolarHBondContact O-N 2.91Å; I414-N418 PolarHBondContact O-ND2 3.46Å; W415-N418 PolarHBondContact O-N 3.44Å; N418-Y421 PolarHBondContact O-N 3.09Å; N418-K422 PolarHBondContact O-N 3.01Å
419	R	98	Very high	94.5	Very high	40 Å²	40	82.7 Å²	82.7	15%	0.151	38%	0.383	C	S	.	.	H	α-helix	trans	-67.9	-44.8	178.3	-168.3	58.7	165.3	75.6	-2.1	111.6	E384 F387 W415 Q417 Y421 K422 T423	E384-R419 IonicContact OE1-CZ 3.71Å; E384-R419 IonicContact OE1-NE 2.72Å; E384-R419 PolarHBondContact OE1-NE 2.87Å; E384-R419 IonicContact OE1-NH2 3.77Å; E384-R419 PolarHBondContact OE1-NH2 3.21Å; F387-R419 HydrophobicContact CD1-CG 3.51Å; F387-R419 HydrophobicContact CD2-CB 4.13Å; F387-R419 HydrophobicContact CD2-CG 3.84Å; F387-R419 HydrophobicContact CE1-CG 3.55Å; F387-R419 HydrophobicContact CE2-CB 4.07Å; F387-R419 HydrophobicContact CE2-CG 3.89Å; F387-R419 HydrophobicContact CG-CB 4.41Å; F387-R419 HydrophobicContact CG-CG 3.67Å; F387-R419 HydrophobicContact CZ-CB 4.28Å; F387-R419 HydrophobicContact CZ-CG 3.74Å; W415-R419 HydrophobicContact CE3-CB 4.16Å; W415-R419 HydrophobicContact CH2-CB 3.86Å; W415-R419 HydrophobicContact CH2-CG 3.62Å; W415-R419 HydrophobicContact CZ2-CB 4.33Å; W415-R419 HydrophobicContact CZ2-CG 4.21Å; W415-R419 HydrophobicContact CZ3-CB 3.77Å; W415-R419 HydrophobicContact CZ3-CG 3.96Å; W415-R419 WeakPolarHBondContact O-CB 3.49Å; W415-R419 PolarHBondContact O-N 3.04Å; Q417-R419 PolarHBondContact O-N 3.15Å; R419-Y421 VanDerWaalsContact C-N 3.33Å; R419-Y421 PolarHBondContact O-N 3.27Å; R419-K422 PolarHBondContact O-N 2.94Å; R419-T423 PolarHBondContact NH1-OG1 3.4Å; R419-T423 PolarHBondContact O-N 3.06Å; R419-T423 PolarHBondContact O-OG1 3.14Å; R419-T423 VanDerWaalsContact O-OG1 3.11Å
420	R	97.7	Very high	93.7	Very high	76 Å²	76	83.7 Å²	83.7	29%	0.287	38%	0.383	S	S	.	.	H	α-helix	trans	-57	-44.6	170.3	-75.5	176.7	-74.3	171.4	0.7	112.2	F387 R391 F416 Q417 T423 K424	F387-R420 HydrophobicContact CE2-CG 3.75Å; F387-R420 HydrophobicContact CZ-CG 4.1Å; R391-R420 WeakPolarHBondContact O-CD 3.38Å; F416-R420 WeakPolarHBondContact O-CG 3.45Å; F416-R420 PolarHBondContact O-N 2.95Å; F416-R420 PolarHBondContact O-NE 3.28Å; Q417-R420 PolarHBondContact O-N 3.17Å; R420-T423 PolarHBondContact O-N 3.39Å; R420-K424 PolarHBondContact O-N 3.15Å
421	Y	96.2	Very high	93.1	Very high	168 Å²	168	83.1 Å²	83.1	66%	0.659	38%	0.376	S	S	*	.	H	α-helix	trans	-63.3	-42.9	178.1	-176.2	-105.9	0	0	0	112.4	Q417 N418 R419 K424 K425	Q417-Y421 PolarHBondContact O-N 3.15Å; N418-Y421 PolarHBondContact O-N 3.09Å; R419-Y421 VanDerWaalsContact C-N 3.33Å; R419-Y421 PolarHBondContact O-N 3.27Å; Y421-K424 PolarHBondContact O-N 3.25Å; Y421-K425 WeakPolarHBondContact O-CB 3.1Å; Y421-K425 PolarHBondContact O-N 3.34Å
422	K	94.1	Very high	92.2	Very high	135 Å²	135	84.8 Å²	84.8	59%	0.587	39%	0.387	S	S	*	.	H	α-helix	trans	-58.8	-46.9	171.9	-78.5	-173.2	173.8	-169.8	0	111.9	N418 R419 K425 R426	N418-K422 PolarHBondContact O-N 3.01Å; R419-K422 PolarHBondContact O-N 2.94Å; K422-K425 PolarHBondContact O-N 2.93Å; K422-R426 PolarHBondContact O-N 3.33Å
423	T	93.8	Very high	90.9	Very high	36 Å²	36	88.8 Å²	88.8	22%	0.221	41%	0.408	C	S	.	.	H	α-helix	trans	-60.8	-48.8	178.1	-56.6	0	0	0	0	111.6	R419 R420 K425 R426 L427	R419-T423 PolarHBondContact NH1-OG1 3.4Å; R419-T423 PolarHBondContact O-N 3.06Å; R419-T423 PolarHBondContact O-OG1 3.14Å; R419-T423 VanDerWaalsContact O-OG1 3.11Å; R420-T423 PolarHBondContact O-N 3.39Å; T423-K425 VanDerWaalsContact C-N 3.33Å; T423-K425 PolarHBondContact O-N 3.28Å; T423-R426 PolarHBondContact O-N 3Å; T423-L427 PolarHBondContact O-N 2.97Å; T423-L427 VanDerWaalsContact O-N 3.08Å
424	K	93	Very high	89.3	Confident	136 Å²	136	87.3 Å²	87.3	59%	0.591	41%	0.411	S	S	*	.	H	α-helix	trans	-61.8	-38.5	176.5	-178.8	164.5	179.7	167.4	0	112	R420 Y421 L427 I428	R420-K424 PolarHBondContact O-N 3.15Å; Y421-K424 PolarHBondContact O-N 3.25Å; K424-L427 PolarHBondContact O-N 2.91Å; K424-I428 HydrophobicContact CD-CD1 4.36Å; K424-I428 HydrophobicContact CG-CD1 3.77Å; K424-I428 HydrophobicContact CG-CG1 4.4Å; K424-I428 WeakPolarHBondContact O-CG1 3.27Å; K424-I428 PolarHBondContact O-N 2.9Å
425	K	89.4	Confident	87.4	Confident	140 Å²	140	88 Å²	88	61%	0.609	42%	0.423	S	S	*	.	H	α-helix	trans	-65.7	-42.5	176.1	-169	-176.1	176.9	-168.1	0	112.3	Y421 K422 T423 I428 S429	Y421-K425 WeakPolarHBondContact O-CB 3.1Å; Y421-K425 PolarHBondContact O-N 3.34Å; K422-K425 PolarHBondContact O-N 2.93Å; T423-K425 VanDerWaalsContact C-N 3.33Å; T423-K425 PolarHBondContact O-N 3.28Å; K425-I428 PolarHBondContact O-N 2.91Å; K425-S429 WeakPolarHBondContact O-CB 3.31Å; K425-S429 PolarHBondContact O-N 3.12Å
426	R	87.9	Confident	85.1	Confident	138 Å²	138	92.2 Å²	92.2	52%	0.521	45%	0.448	S	S	.	.	H	α-helix	trans	-59	-47.6	175.6	-79	-177.5	171.7	171.5	-4.6	111.3	K422 T423 S429 R430	K422-R426 PolarHBondContact O-N 3.33Å; T423-R426 PolarHBondContact O-N 3Å; R426-S429 PolarHBondContact O-N 3.2Å; R426-R430 PolarHBondContact O-N 3.42Å
427	L	87.9	Confident	82.6	Confident	43 Å²	43	100 Å²	100	23%	0.225	48%	0.484	C	S	.	.	H	α-helix	trans	-56.7	-54.6	176.3	179.5	64.8	0	0	0	112.1	T423 K424 S429 R430 I431 V454 L455	T423-L427 PolarHBondContact O-N 2.97Å; T423-L427 VanDerWaalsContact O-N 3.08Å; K424-L427 PolarHBondContact O-N 2.91Å; L427-S429 VanDerWaalsContact C-N 3.27Å; L427-S429 PolarHBondContact O-N 2.95Å; L427-R430 PolarHBondContact O-N 2.97Å; L427-R430 VanDerWaalsContact O-N 3.16Å; L427-I431 HydrophobicContact CD1-CD1 4.13Å; L427-I431 HydrophobicContact CG-CD1 3.9Å; L427-I431 WeakPolarHBondContact O-CG1 3.4Å; L427-I431 PolarHBondContact O-N 3.29Å; L427-I431 VanDerWaalsContact O-N 3.17Å; L427-V454 HydrophobicContact CD1-CB 4.19Å; L427-V454 HydrophobicContact CD2-CB 4.06Å; L427-V454 HydrophobicContact CD2-CG1 3.91Å; L427-V454 WeakPolarHBondContact CD2-O 3.4Å; L427-L455 HydrophobicContact CD1-CG 4.44Å
428	I	86.5	Confident	79.9	Confident	71 Å²	71	99 Å²	99	36%	0.364	49%	0.49	S	S	.	.	H	α-helix	trans	-59.3	-38.9	179	-68.9	170.1	0	0	0	111.5	K424 K425 R430 I431 L432	K424-I428 HydrophobicContact CD-CD1 4.36Å; K424-I428 HydrophobicContact CG-CD1 3.77Å; K424-I428 HydrophobicContact CG-CG1 4.4Å; K424-I428 WeakPolarHBondContact O-CG1 3.27Å; K424-I428 PolarHBondContact O-N 2.9Å; K425-I428 PolarHBondContact O-N 2.91Å; I428-R430 VanDerWaalsContact C-N 3.27Å; I428-R430 PolarHBondContact O-N 3.15Å; I428-I431 PolarHBondContact O-N 3.48Å; I428-L432 HydrophobicContact CG2-CD1 3.61Å; I428-L432 HydrophobicContact CG2-CG 4.07Å; I428-L432 WeakPolarHBondContact O-CG 3.4Å; I428-L432 PolarHBondContact O-N 2.87Å
429	S	82.1	Confident	77.5	Confident	63 Å²	63	100.8 Å²	100.8	44%	0.441	51%	0.509	S	S	.	.	H	α-helix	trans	-63.4	-31.2	-180	-162.3	0	0	0	0	113.3	K425 R426 L427 N433	K425-S429 WeakPolarHBondContact O-CB 3.31Å; K425-S429 PolarHBondContact O-N 3.12Å; R426-S429 PolarHBondContact O-N 3.2Å; L427-S429 VanDerWaalsContact C-N 3.27Å; L427-S429 PolarHBondContact O-N 2.95Å; S429-N433 PolarHBondContact O-N 3.18Å
430	R	80.8	Confident	74.7	Confident	101 Å²	101	105.9 Å²	105.9	38%	0.381	54%	0.54	S	S	.	.	H	α-helix	trans	-79.3	-33.9	175.9	-65.6	176.8	-172.2	134.8	-6.3	112.4	R426 L427 I428 E451	R426-R430 PolarHBondContact O-N 3.42Å; L427-R430 PolarHBondContact O-N 2.97Å; L427-R430 VanDerWaalsContact O-N 3.16Å; I428-R430 VanDerWaalsContact C-N 3.27Å; I428-R430 PolarHBondContact O-N 3.15Å; R430-E451 VanDerWaalsContact CZ-CD 3.47Å; R430-E451 IonicContact CZ-OE1 2.91Å; R430-E451 IonicContact CZ-OE2 3.82Å; R430-E451 VanDerWaalsContact CZ-OE2 3.22Å; R430-E451 IonicContact NH1-OE1 3.9Å; R430-E451 PolarHBondContact NH1-OE1 3.03Å; R430-E451 IonicContact NH1-OE2 3.73Å; R430-E451 PolarHBondContact NH1-OE2 3Å; R430-E451 VanDerWaalsContact NH2-CD 3.25Å; R430-E451 IonicContact NH2-OE1 3.85Å; R430-E451 PolarHBondContact NH2-OE1 3.47Å; R430-E451 IonicContact NH2-OE2 2.67Å; R430-E451 PolarHBondContact NH2-OE2 3.49Å
431	I	84.6	Confident	72	Confident	78 Å²	78	110.2 Å²	110.2	40%	0.4	57%	0.569	S	S	.	*	H	α-helix	trans	-67.4	-42.7	175.6	-63.9	163	0	0	0	110.9	L427 I428 L455	L427-I431 HydrophobicContact CD1-CD1 4.13Å; L427-I431 HydrophobicContact CG-CD1 3.9Å; L427-I431 WeakPolarHBondContact O-CG1 3.4Å; L427-I431 PolarHBondContact O-N 3.29Å; L427-I431 VanDerWaalsContact O-N 3.17Å; I428-I431 PolarHBondContact O-N 3.48Å; I431-L455 HydrophobicContact CD1-CD2 3.66Å; I431-L455 HydrophobicContact CD1-CG 4.11Å; I431-L455 HydrophobicContact CG1-CD1 4.28Å; I431-L455 HydrophobicContact CG1-CD2 4.1Å; I431-L455 HydrophobicContact CG1-CG 4.38Å
432	L	79	Confident	69	Low	109 Å²	109	106.6 Å²	106.6	57%	0.571	57%	0.568	S	S	*	*	H	α-helix	trans	-80.1	-32.5	-177.3	-66.1	178.9	0	0	0	113.8	I428 P434	I428-L432 HydrophobicContact CG2-CD1 3.61Å; I428-L432 HydrophobicContact CG2-CG 4.07Å; I428-L432 WeakPolarHBondContact O-CG 3.4Å; I428-L432 PolarHBondContact O-N 2.87Å; L432-P434 VanDerWaalsContact C-CD 3.44Å; L432-P434 WeakPolarHBondContact O-CD 3.43Å
433	N	70.6	Confident	66.3	Low	85 Å²	85	107.3 Å²	107.3	46%	0.455	58%	0.576	S	S	.	*			trans	-123.8	66.2	179.7	-65.7	-18.3	0	0	0	111.5	S429 S435 N436	S429-N433 PolarHBondContact O-N 3.18Å; N433-S435 PolarHBondContact O-N 3.11Å; N433-S435 VanDerWaalsContact O-N 3.12Å; N433-N436 PolarHBondContact O-N 3.23Å
434	P	64.7	Low	63.8	Low	89 Å²	89	114.1 Å²	114.1	58%	0.578	61%	0.606	S	S	*	*	T	Hydrogen-bonded Turn	trans	-66.6	-11.3	-179.9	29.3	-36.6	0	0	0	113.6	L432 H437	L432-P434 VanDerWaalsContact C-CD 3.44Å; L432-P434 WeakPolarHBondContact O-CD 3.43Å; P434-H437 PolarHBondContact O-CD2 3.46Å
435	S	57.4	Low	60.7	Low	100 Å²	100	115.1 Å²	115.1	70%	0.699	62%	0.618	S	S	*	*	T	Hydrogen-bonded Turn	trans	-90.4	-9.9	-178.5	44.9	0	0	0	0	115	N433 H437	N433-S435 PolarHBondContact O-N 3.11Å; N433-S435 VanDerWaalsContact O-N 3.12Å; S435-H437 VanDerWaalsContact C-N 3.32Å; S435-H437 PolarHBondContact O-N 3.4Å
436	N	49.4	Very low	58.1	Low	120 Å²	120	114.3 Å²	114.3	64%	0.642	62%	0.616	S	S	*	*			trans	-92.3	49.6	-175.8	-75.1	11.8	0	0	0	113	N433 S438	N433-N436 PolarHBondContact O-N 3.23Å; N436-S438 VanDerWaalsContact C-N 3.29Å; N436-S438 PolarHBondContact O-N 3.27Å; N436-S438 VanDerWaalsContact O-N 3.15Å
437	H	47	Very low	55.6	Low	168 Å²	168	113.9 Å²	113.9	78%	0.778	63%	0.629	S	S	*	*			trans	-85.5	57.9	176.5	-88.4	-75.4	0	0	0	112.8	P434 S435	P434-H437 PolarHBondContact O-CD2 3.46Å; S435-H437 VanDerWaalsContact C-N 3.32Å; S435-H437 PolarHBondContact O-N 3.4Å
438	S	40.6	Very low	52.9	Low	94 Å²	94	120.3 Å²	120.3	66%	0.657	66%	0.658	S	S	*	*	S	Bend	trans	-158.9	138.5	171.3	51	0	0	0	0	115.4	N436	N436-S438 VanDerWaalsContact C-N 3.29Å; N436-S438 PolarHBondContact O-N 3.27Å; N436-S438 VanDerWaalsContact O-N 3.15Å
439	S	46.7	Very low	50.2	Low	126 Å²	126	123.6 Å²	123.6	88%	0.881	68%	0.675	S	S	*	*	S	Bend	trans	76.4	11.6	146.7	63.8	0	0	0	0	123.6
440	D	39.3	Very low	47.8	Very low	147 Å²	147	127.7 Å²	127.7	79%	0.786	69%	0.692	S	S	*	*			trans	-121.8	-3.5	175.1	-154.5	32.9	0	0	0	116.1	S442	D440-S442 VanDerWaalsContact C-N 3.33Å; D440-S442 PolarHBondContact O-N 3.08Å
441	D	40.6	Very low	45.8	Very low	168 Å²	168	129.2 Å²	129.2	90%	0.898	70%	0.703	S	S	*	*			trans	-83.5	72	174.7	-85.3	-52.1	0	0	0	111.7
442	S	34.3	Very low	43.4	Very low	92 Å²	92	134.7 Å²	134.7	64%	0.643	73%	0.725	S	S	*	*			trans	-126.9	147.5	167.9	72.8	0	0	0	0	112.2	D440	D440-S442 VanDerWaalsContact C-N 3.33Å; D440-S442 PolarHBondContact O-N 3.08Å
443	I	37.3	Very low	41.3	Very low	149 Å²	149	136.1 Å²	136.1	76%	0.764	73%	0.733	S	S	*	*	S	Bend	trans	68	57.1	-179.1	-36.8	177.8	0	0	0	115.2
444	Q	40	Very low	39.9	Very low	180 Å²	180	135.1 Å²	135.1	84%	0.841	73%	0.73	S	S	*	*			trans	-159.9	109.2	137.7	-116.1	136.4	103.3	0	0	110.7
445	N	28.9	Very low	38.7	Very low	157 Å²	157	136.1 Å²	136.1	84%	0.84	73%	0.73	S	S	*	*			trans	-70.2	145.8	170.1	-59.2	-12.9	0	0	0	109.9
446	E	33.8	Very low	37.6	Very low	123 Å²	123	137.2 Å²	137.2	58%	0.575	73%	0.728	S	S	*	*			trans	164.8	115.5	143.4	-87.9	-77.5	93.8	0	0	108.1
447	T	36.8	Very low	36.8	Very low	128 Å²	128	136 Å²	136	79%	0.785	73%	0.728	S	S	*	*			trans	27.2	99.7	165.9	59.6	0	0	0	0	119.4
448	H	30.1	Very low	36.4	Very low	179 Å²	179	134.4 Å²	134.4	83%	0.829	73%	0.731	S	S	*	*			trans	-69.1	123.4	162.2	160.5	-70.2	0	0	0	111.7
449	L	31.3	Very low	36.1	Very low	139 Å²	139	134.5 Å²	134.5	73%	0.728	74%	0.737	S	S	*	*			trans	-164.8	153.7	149	-101.2	171.6	0	0	0	109.7
450	D	31.2	Very low	35.3	Very low	150 Å²	150	136.2 Å²	136.2	80%	0.802	74%	0.735	S	S	*	*			trans	58.6	54.6	165.1	-53.6	-18.9	0	0	0	120
451	E	37.2	Very low	34.9	Very low	132 Å²	132	136 Å²	136	62%	0.617	73%	0.73	S	S	*	*			trans	-104	71.6	170.7	-169	154.8	-128.7	0	0	114	R430	R430-E451 VanDerWaalsContact CZ-CD 3.47Å; R430-E451 IonicContact CZ-OE1 2.91Å; R430-E451 IonicContact CZ-OE2 3.82Å; R430-E451 VanDerWaalsContact CZ-OE2 3.22Å; R430-E451 IonicContact NH1-OE1 3.9Å; R430-E451 PolarHBondContact NH1-OE1 3.03Å; R430-E451 IonicContact NH1-OE2 3.73Å; R430-E451 PolarHBondContact NH1-OE2 3Å; R430-E451 VanDerWaalsContact NH2-CD 3.25Å; R430-E451 IonicContact NH2-OE1 3.85Å; R430-E451 PolarHBondContact NH2-OE1 3.47Å; R430-E451 IonicContact NH2-OE2 2.67Å; R430-E451 PolarHBondContact NH2-OE2 3.49Å
452	F	34.5	Very low	34.6	Very low	194 Å²	194	137.6 Å²	137.6	85%	0.851	73%	0.732	S	S	*	*			trans	-140.8	-24.8	173.7	-142.7	-106.3	0	0	0	117	V454	F452-V454 PolarHBondContact O-N 2.86Å
453	N	35.2	Very low	34.4	Very low	138 Å²	138	138.3 Å²	138.3	74%	0.738	74%	0.736	S	S	*	*			trans	-99.2	43.3	-161.1	-79.9	-27.8	0	0	0	117
454	V	41.5	Very low	34.2	Very low	64 Å²	64	140.2 Å²	140.2	39%	0.388	74%	0.739	S	S	.	*			trans	-123.5	9.8	-174.7	-149.6	0	0	0	0	115.2	L427 F452	L427-V454 HydrophobicContact CD1-CB 4.19Å; L427-V454 HydrophobicContact CD2-CB 4.06Å; L427-V454 HydrophobicContact CD2-CG1 3.91Å; L427-V454 WeakPolarHBondContact CD2-O 3.4Å; F452-V454 PolarHBondContact O-N 2.86Å
455	L	39.4	Very low	33.6	Very low	111 Å²	111	143.3 Å²	143.3	58%	0.581	75%	0.745	S	S	*	*	S	Bend	trans	-92.7	-21	-179.1	-107.8	161	0	0	0	114.9	L427 I431	L427-L455 HydrophobicContact CD1-CG 4.44Å; I431-L455 HydrophobicContact CD1-CD2 3.66Å; I431-L455 HydrophobicContact CD1-CG 4.11Å; I431-L455 HydrophobicContact CG1-CD1 4.28Å; I431-L455 HydrophobicContact CG1-CD2 4.1Å; I431-L455 HydrophobicContact CG1-CG 4.38Å
456	N	34.2	Very low	33.6	Very low	123 Å²	123	140.8 Å²	140.8	66%	0.658	74%	0.739	S	S	*	*	S	Bend	trans	-108.5	31	-168.5	-70.3	18.4	0	0	0	114.3
457	S	33.3	Very low	33.2	Very low	94 Å²	94	141.7 Å²	141.7	66%	0.657	75%	0.747	S	S	*	*	S	Bend	trans	-137.8	25.5	-170.6	-52.8	0	0	0	0	115.6
458	T	39.2	Very low	33	Very low	135 Å²	135	145.2 Å²	145.2	83%	0.828	75%	0.752	S	S	*	*	S	Bend	trans	-143	23.3	176.9	60.4	0	0	0	0	114.1
459	A	32.7	Very low	32.9	Very low	95 Å²	95	142.8 Å²	142.8	79%	0.785	74%	0.741	S	S	*	*	S	Bend	trans	-110.6	-9	-172.2	0	0	0	0	0	115.2
460	L	30.9	Very low	33	Very low	162 Å²	162	145.2 Å²	145.2	85%	0.848	75%	0.75	S	S	*	*	S	Bend	trans	-140.5	174.8	-178.6	-136.1	64.9	0	0	0	110.4
461	E	31.6	Very low	33	Very low	143 Å²	143	143.8 Å²	143.8	67%	0.668	74%	0.743	S	S	*	*			trans	64.3	54.6	-177.2	-59.3	-174.3	-171.4	0	0	116.2	K234	K234-E461 IonicContact NZ-OE1 3.87Å
462	H	33.3	Very low	32.6	Very low	202 Å²	202	142.7 Å²	142.7	94%	0.935	75%	0.75	S	S	*	*	S	Bend	trans	-137.7	45.3	154.4	-85.3	87.7	0	0	0	111.8
463	S	29.1	Very low	32.8	Very low	107 Å²	107	139 Å²	139	75%	0.748	75%	0.745	S	S	*	*	S	Bend	trans	-152	149.3	168.2	-177.2	0	0	0	0	108
464	K	33.6	Very low	32.6	Very low	188 Å²	188	138.5 Å²	138.5	82%	0.817	75%	0.747	S	S	*	*			trans	67.2	61.6	-171.7	-51.7	178	178.8	178.4	0	116.8
465	Y	28.4	Very low	32	Very low	246 Å²	246	142.8 Å²	142.8	97%	0.965	76%	0.763	S	S	*	*			trans	-143.9	111.3	136.5	-91.1	-66.9	0	0	0	109
466	S	27.6	Very low	31.6	Very low	103 Å²	103	147.5 Å²	147.5	72%	0.72	77%	0.774	S	S	*	*			trans	-135.4	128.6	-177.4	-172.4	0	0	0	0	108.8
467	I	26.4	Very low	31.4	Very low	142 Å²	142	151 Å²	151	73%	0.728	78%	0.78	S	S	*	*			trans	55.4	108.4	165	-55.8	160.2	0	0	0	115.8
468	F	32.1	Very low	31.2	Very low	203 Å²	203	150.9 Å²	150.9	89%	0.89	78%	0.778	S	S	*	*				-149	151.4	126.6	-112.9	-73.9	0	0	0	110.1
469	E	28.4	Very low	30.9	Very low	128 Å²	128	151.5 Å²	151.5	60%	0.598	78%	0.777	S	S	*	*			trans	-84.4	154.3	-167.9	-59.7	170.8	84.6	0	0	114	N471	E469-N471 PolarHBondContact OE1-ND2 2.72Å
470	M	32.7	Very low	31.1	Very low	190 Å²	190	154 Å²	154	94%	0.936	77%	0.772	S	S	*	*			trans	-141.7	135.4	134.3	-83.3	-56.8	149.9	0	0	109.3
471	N	31.6	Very low	31.6	Very low	119 Å²	119	153.4 Å²	153.4	64%	0.636	77%	0.765	S	S	*	*			trans	-101.6	121.1	-165	-92.3	-65.7	0	0	0	114.8	E469	E469-N471 PolarHBondContact OE1-ND2 2.72Å
472	S	28.4	Very low	31.9	Very low	109 Å²	109	154 Å²	154	76%	0.762	77%	0.767	S	S	*	*			trans	66.4	161.1	137.6	-71.9	0	0	0	0	122.6
473	P	39.9	Very low	32.3	Very low	117 Å²	117	151.8 Å²	151.8	76%	0.76	76%	0.757	S	S	*	*			trans	-133.1	-177.3	-160.7	43.1	-25.1	0	0	0	115.2
474	V	29.5	Very low	32.7	Very low	127 Å²	127	155.8 Å²	155.8	77%	0.77	76%	0.756	S	S	*	*			trans	-171.7	141	161.4	136.5	0	0	0	0	105.4
475	Q	29.1	Very low	33	Very low	155 Å²	155	154 Å²	154	72%	0.724	75%	0.75	S	S	*	*			cis	-145.2	170.5	-7.5	-107.9	168.5	23.6	0	0	106.4
476	Y	31.4	Very low	33.3	Very low	210 Å²	210	151.3 Å²	151.3	82%	0.824	74%	0.739	S	S	*	*				-167.4	147	61.4	-154.7	-107.9	0	0	0	110.1
477	Y	29.7	Very low	33.8	Very low	197 Å²	197	149 Å²	149	77%	0.773	72%	0.72	S	S	*	*			trans	-81.9	176.9	170.8	-89.4	-113.6	0	0	0	109.7
478	S	30.1	Very low	34.4	Very low	90 Å²	90	149 Å²	149	63%	0.629	72%	0.717	S	S	*	*			cis	-158	135.7	9.7	-144.1	0	0	0	0	108.4
479	D	31.6	Very low	34.6	Very low	149 Å²	149	147.2 Å²	147.2	80%	0.797	71%	0.712	S	S	*	*	S	Bend	trans	179.4	133.6	152.8	-115.8	25.1	0	0	0	110.2
480	H	36.9	Very low	35.1	Very low	148 Å²	148	147.4 Å²	147.4	69%	0.685	71%	0.713	S	S	*	*			cis	-141	144.6	-23.8	-142.2	-58.7	0	0	0	107	H482	H480-H482 PolarHBondContact O-N 3.45Å
481	Q	41.5	Very low	35.1	Very low	148 Å²	148	144.1 Å²	144.1	69%	0.692	70%	0.695	S	S	*	*	T	Hydrogen-bonded Turn	trans	-66	-3.1	-159.9	-66.9	-147.9	-3.4	0	0	118	Q483	Q481-Q483 PolarHBondContact O-N 2.71Å
482	H	39.6	Very low	35.2	Very low	157 Å²	157	140.2 Å²	140.2	73%	0.727	68%	0.683	S	S	*	*	T	Hydrogen-bonded Turn	trans	-85.5	-0.8	-177.3	-72.3	-6.1	0	0	0	116	H480	H480-H482 PolarHBondContact O-N 3.45Å
483	Q	41	Very low	35.3	Very low	154 Å²	154	140.9 Å²	140.9	72%	0.72	67%	0.674	S	S	*	*	S	Bend	trans	-87.7	-29.8	173	-160.3	152.3	-0.6	0	0	113	Q481 Q485 R486 T487	Q481-Q483 PolarHBondContact O-N 2.71Å; Q483-Q485 VanDerWaalsContact C-N 3.35Å; Q483-Q485 PolarHBondContact O-N 3.29Å; Q483-R486 PolarHBondContact O-N 3.22Å; Q483-T487 PolarHBondContact O-N 3.17Å; Q483-T487 PolarHBondContact O-OG1 3.25Å
484	R	37.9	Very low	35	Very low	192 Å²	192	137.2 Å²	137.2	73%	0.725	66%	0.658	S	S	*	*	H	α-helix	trans	-62.4	-34	-176	-71.9	-170.7	176.4	-131.6	0.8	114.3	R486 T487 Q488	R484-R486 PolarHBondContact O-N 3.29Å; R484-T487 PolarHBondContact O-N 3.16Å; R484-T487 VanDerWaalsContact O-N 3.13Å; R484-T487 PolarHBondContact O-OG1 2.95Å; R484-Q488 PolarHBondContact O-N 3.31Å
485	Q	38.3	Very low	35.2	Very low	149 Å²	149	137.3 Å²	137.3	70%	0.696	65%	0.649	S	S	*	*	H	α-helix	trans	-68.6	-16.1	175.3	-72.2	-178.6	-10.6	0	0	113.8	Q483	Q483-Q485 VanDerWaalsContact C-N 3.35Å; Q483-Q485 PolarHBondContact O-N 3.29Å
486	R	35.8	Very low	35.5	Very low	191 Å²	191	133 Å²	133	72%	0.721	63%	0.631	S	S	*	*	H	α-helix	trans	-90.4	-23.1	170.3	-58	-169.6	-146.4	-158.7	5.5	112.7	Q483 R484	Q483-R486 PolarHBondContact O-N 3.22Å; R484-R486 PolarHBondContact O-N 3.29Å
487	T	38	Very low	35.6	Very low	55 Å²	55	127.3 Å²	127.3	34%	0.337	61%	0.614	S	S	.	*	H	α-helix	trans	-72.5	-38.6	177.6	-23.4	0	0	0	0	112.2	Q483 R484 Q489 Q490 E491	Q483-T487 PolarHBondContact O-N 3.17Å; Q483-T487 PolarHBondContact O-OG1 3.25Å; R484-T487 PolarHBondContact O-N 3.16Å; R484-T487 VanDerWaalsContact O-N 3.13Å; R484-T487 PolarHBondContact O-OG1 2.95Å; T487-Q489 PolarHBondContact O-N 3.23Å; T487-Q489 VanDerWaalsContact O-N 3.15Å; T487-Q490 CarbonylContact O-C 3.6Å; T487-Q490 WeakPolarHBondContact O-CA 3.34Å; T487-Q490 PolarHBondContact O-N 3.32Å; T487-E491 HydrophobicContact CG2-CG 4.43Å; T487-E491 WeakPolarHBondContact O-CG 3.48Å; T487-E491 PolarHBondContact O-N 2.67Å
488	Q	39.4	Very low	36	Very low	141 Å²	141	122.1 Å²	122.1	66%	0.659	60%	0.6	S	S	*	*	H	α-helix	trans	-61.8	-24.3	-179.6	-72.2	178.9	-22.1	0	0	114	R484 E491	R484-Q488 PolarHBondContact O-N 3.31Å; Q488-E491 WeakPolarHBondContact CA-OE2 3.31Å
489	Q	36.4	Very low	36.2	Very low	166 Å²	166	122.1 Å²	122.1	78%	0.776	59%	0.59	S	S	*	*	H	α-helix	trans	-85.3	-8.2	171.9	-68.5	-170.5	-7.3	0	0	114.1	T487	T487-Q489 PolarHBondContact O-N 3.23Å; T487-Q489 VanDerWaalsContact O-N 3.15Å
490	Q	38	Very low	36.3	Very low	132 Å²	132	118.5 Å²	118.5	62%	0.617	57%	0.569	S	S	*	*	H	α-helix	trans	-104.8	-26	176.3	-65.2	-172.1	-4.5	0	0	112.7	T487 G492 Q493 G494	T487-Q490 CarbonylContact O-C 3.6Å; T487-Q490 WeakPolarHBondContact O-CA 3.34Å; T487-Q490 PolarHBondContact O-N 3.32Å; Q490-G492 VanDerWaalsContact C-N 3.29Å; Q490-G492 PolarHBondContact O-N 2.78Å; Q490-Q493 WeakPolarHBondContact O-CA 3.39Å; Q490-Q493 WeakPolarHBondContact O-CB 3.47Å; Q490-Q493 PolarHBondContact O-N 3.19Å; Q490-G494 PolarHBondContact O-N 3.47Å; Q490-G494 VanDerWaalsContact O-N 3.16Å
491	E	33.6	Very low	36.3	Very low	120 Å²	120	117.6 Å²	117.6	56%	0.561	56%	0.563	S	S	*	*	H	α-helix	trans	-60.4	-37.7	175.5	-75.5	160.2	170.5	0	0	111.9	T487 Q488 Q493 G494 H495	T487-E491 HydrophobicContact CG2-CG 4.43Å; T487-E491 WeakPolarHBondContact O-CG 3.48Å; T487-E491 PolarHBondContact O-N 2.67Å; Q488-E491 WeakPolarHBondContact CA-OE2 3.31Å; E491-Q493 VanDerWaalsContact C-N 3.28Å; E491-Q493 PolarHBondContact O-N 3.39Å; E491-G494 PolarHBondContact O-N 3.39Å; E491-H495 PolarHBondContact O-N 3.12Å
492	G	32.6	Very low	36.1	Very low	38 Å²	38	115.3 Å²	115.3	39%	0.392	56%	0.556	S	S	.	*	H	α-helix	trans	-60.7	-32.1	170.2	0	0	0	0	0	114.1	Q490 G494 H495 I496	Q490-G492 VanDerWaalsContact C-N 3.29Å; Q490-G492 PolarHBondContact O-N 2.78Å; G492-G494 VanDerWaalsContact C-N 3.34Å; G492-H495 PolarHBondContact O-N 3.3Å; G492-I496 WeakPolarHBondContact O-CD1 3.34Å; G492-I496 VanDerWaalsContact O-CG1 3.27Å; G492-I496 WeakPolarHBondContact O-CG1 3.41Å; G492-I496 PolarHBondContact O-N 3.45Å; G492-I496 VanDerWaalsContact O-N 3.13Å
493	Q	31.3	Very low	35.9	Very low	123 Å²	123	109.7 Å²	109.7	58%	0.575	53%	0.531	S	S	*	.	H	α-helix	trans	-75.9	-23	174.5	-64.5	-172.6	-13.7	0	0	112.6	Q490 E491 N497	Q490-Q493 WeakPolarHBondContact O-CA 3.39Å; Q490-Q493 WeakPolarHBondContact O-CB 3.47Å; Q490-Q493 PolarHBondContact O-N 3.19Å; E491-Q493 VanDerWaalsContact C-N 3.28Å; E491-Q493 PolarHBondContact O-N 3.39Å; Q493-N497 WeakPolarHBondContact O-CB 3.19Å; Q493-N497 PolarHBondContact O-N 3.1Å; Q493-N497 PolarHBondContact O-ND2 3.5Å
494	G	34.2	Very low	35.5	Very low	40 Å²	40	109.7 Å²	109.7	41%	0.412	53%	0.529	S	S	.	.	H	α-helix	trans	-65.1	-46.3	169.2	0	0	0	0	0	111.7	Q490 E491 G492 N497 N498	Q490-G494 PolarHBondContact O-N 3.47Å; Q490-G494 VanDerWaalsContact O-N 3.16Å; E491-G494 PolarHBondContact O-N 3.39Å; G492-G494 VanDerWaalsContact C-N 3.34Å; G494-N497 PolarHBondContact O-N 3.28Å; G494-N498 PolarHBondContact O-N 3.24Å
495	H	32.8	Very low	35.6	Very low	129 Å²	129	105.7 Å²	105.7	60%	0.597	52%	0.521	S	S	*	.	H	α-helix	trans	-62	-51.9	178.2	-144.3	-80.7	0	0	0	111.6	E491 G492 N497 N498 E499	E491-H495 PolarHBondContact O-N 3.12Å; G492-H495 PolarHBondContact O-N 3.3Å; H495-N497 PolarHBondContact O-N 3.06Å; H495-N497 VanDerWaalsContact O-N 3.13Å; H495-N498 PolarHBondContact O-N 3.19Å; H495-E499 IonicContact CE1-OE2 2.86Å; H495-E499 IonicContact CG-OE2 2.68Å; H495-E499 IonicContact ND1-OE2 2.78Å; H495-E499 PolarHBondContact ND1-OE2 2.64Å; H495-E499 PolarHBondContact O-N 2.91Å
496	I	34.8	Very low	35.8	Very low	65 Å²	65	101.5 Å²	101.5	33%	0.333	50%	0.501	S	S	.	.	H	α-helix	trans	-57	-31.4	177.4	-68.9	165.4	0	0	0	112.3	G492 M500	G492-I496 WeakPolarHBondContact O-CD1 3.34Å; G492-I496 VanDerWaalsContact O-CG1 3.27Å; G492-I496 WeakPolarHBondContact O-CG1 3.41Å; G492-I496 PolarHBondContact O-N 3.45Å; G492-I496 VanDerWaalsContact O-N 3.13Å; I496-M500 HydrophobicContact CG2-CE 3.58Å; I496-M500 VanDerWaalsContact O-CB 3.29Å; I496-M500 WeakPolarHBondContact O-CB 3.35Å; I496-M500 WeakPolarHBondContact O-CG 3.27Å; I496-M500 PolarHBondContact O-N 2.97Å
497	N	34.3	Very low	36	Very low	89 Å²	89	98.4 Å²	98.4	48%	0.476	50%	0.498	S	S	.	.	H	α-helix	trans	-79	-20.4	176.3	-86.2	-72.8	0	0	0	114.2	Q493 G494 H495 K501	Q493-N497 WeakPolarHBondContact O-CB 3.19Å; Q493-N497 PolarHBondContact O-N 3.1Å; Q493-N497 PolarHBondContact O-ND2 3.5Å; G494-N497 PolarHBondContact O-N 3.28Å; H495-N497 PolarHBondContact O-N 3.06Å; H495-N497 VanDerWaalsContact O-N 3.13Å; N497-K501 WeakPolarHBondContact O-CG 3.19Å; N497-K501 PolarHBondContact O-N 3.19Å
498	N	37.3	Very low	36.6	Very low	88 Å²	88	100.8 Å²	100.8	47%	0.471	51%	0.505	S	S	.	.	H	α-helix	trans	-85.3	-37.3	169.3	-75.7	-16	0	0	0	111	G494 H495 M500 K501 N502	G494-N498 PolarHBondContact O-N 3.24Å; H495-N498 PolarHBondContact O-N 3.19Å; N498-M500 VanDerWaalsContact C-N 3.33Å; N498-M500 PolarHBondContact O-N 3.26Å; N498-K501 WeakPolarHBondContact O-CB 3.45Å; N498-K501 PolarHBondContact O-N 3.31Å; N498-K501 VanDerWaalsContact O-N 3.14Å; N498-K501 PolarHBondContact OD1-NZ 3.15Å; N498-N502 PolarHBondContact O-N 3.02Å
499	E	35.4	Very low	36.8	Very low	90 Å²	90	95.6 Å²	95.6	42%	0.421	48%	0.481	S	S	.	.	H	α-helix	trans	-61.6	-39.9	168.6	-70.6	171.5	104	0	0	111.5	H495 K501 N502 I503	H495-E499 IonicContact CE1-OE2 2.86Å; H495-E499 IonicContact CG-OE2 2.68Å; H495-E499 IonicContact ND1-OE2 2.78Å; H495-E499 PolarHBondContact ND1-OE2 2.64Å; H495-E499 PolarHBondContact O-N 2.91Å; E499-K501 PolarHBondContact O-N 2.75Å; E499-N502 WeakPolarHBondContact O-CB 3.37Å; E499-N502 PolarHBondContact O-N 3.44Å; E499-N502 VanDerWaalsContact O-N 3.15Å; E499-I503 WeakPolarHBondContact O-CG1 3.45Å; E499-I503 PolarHBondContact O-N 2.9Å
500	M	32.2	Very low	37.1	Very low	73 Å²	73	90.4 Å²	90.4	36%	0.36	46%	0.462	S	S	.	.	H	α-helix	trans	-66.5	-30.3	172.3	-83	-160.8	-94	0	0	113.9	I496 N498 N502 I503 F504	I496-M500 HydrophobicContact CG2-CE 3.58Å; I496-M500 VanDerWaalsContact O-CB 3.29Å; I496-M500 WeakPolarHBondContact O-CB 3.35Å; I496-M500 WeakPolarHBondContact O-CG 3.27Å; I496-M500 PolarHBondContact O-N 2.97Å; N498-M500 VanDerWaalsContact C-N 3.33Å; N498-M500 PolarHBondContact O-N 3.26Å; M500-N502 VanDerWaalsContact C-N 3.34Å; M500-I503 HydrophobicContact CG-CD1 4.36Å; M500-I503 PolarHBondContact O-N 3.14Å; M500-F504 WeakPolarHBondContact O-CD2 3.44Å; M500-F504 PolarHBondContact O-N 2.91Å; M500-F504 VanDerWaalsContact O-N 3.14Å
501	K	36.9	Very low	37.4	Very low	129 Å²	129	89.6 Å²	89.6	56%	0.561	46%	0.458	S	S	*	.	H	α-helix	trans	-66.1	-39.5	169.9	-73.3	166.6	-160.9	159.9	0	111.2	N497 N498 E499 F504	N497-K501 WeakPolarHBondContact O-CG 3.19Å; N497-K501 PolarHBondContact O-N 3.19Å; N498-K501 WeakPolarHBondContact O-CB 3.45Å; N498-K501 PolarHBondContact O-N 3.31Å; N498-K501 VanDerWaalsContact O-N 3.14Å; N498-K501 PolarHBondContact OD1-NZ 3.15Å; E499-K501 PolarHBondContact O-N 2.75Å; K501-F504 PolarHBondContact O-N 3.34Å
502	N	39.1	Very low	37.9	Very low	100 Å²	100	88.2 Å²	88.2	54%	0.535	45%	0.454	S	S	.	.	H	α-helix	trans	-61.5	-49	172.7	-68.5	-5.7	0	0	0	109.9	N498 E499 M500 F504 N505 F506	N498-N502 PolarHBondContact O-N 3.02Å; E499-N502 WeakPolarHBondContact O-CB 3.37Å; E499-N502 PolarHBondContact O-N 3.44Å; E499-N502 VanDerWaalsContact O-N 3.15Å; M500-N502 VanDerWaalsContact C-N 3.34Å; N502-F504 PolarHBondContact O-N 2.86Å; N502-F504 VanDerWaalsContact O-N 3.13Å; N502-N505 WeakPolarHBondContact O-CB 3.33Å; N502-N505 PolarHBondContact O-N 3.47Å; N502-F506 HydrophobicContact CB-CE2 4.45Å; N502-F506 WeakPolarHBondContact O-CD2 3.45Å; N502-F506 WeakPolarHBondContact O-CE2 3.4Å
503	I	34.3	Very low	38.5	Very low	39 Å²	39	89 Å²	89	20%	0.2	45%	0.448	C	S	.	.	H	α-helix	trans	-53.3	-34.4	178.1	-69.8	165.3	0	0	0	112.6	E499 M500 N505 F506 Y538	E499-I503 WeakPolarHBondContact O-CG1 3.45Å; E499-I503 PolarHBondContact O-N 2.9Å; M500-I503 HydrophobicContact CG-CD1 4.36Å; M500-I503 PolarHBondContact O-N 3.14Å; I503-N505 PolarHBondContact O-N 3.39Å; I503-F506 WeakPolarHBondContact O-CB 3.44Å; I503-F506 PolarHBondContact O-N 3.33Å; I503-F506 VanDerWaalsContact O-N 3.08Å; I503-Y538 HydrophobicContact CD1-CD1 3.73Å; I503-Y538 HydrophobicContact CD1-CE1 3.53Å
504	F	32.7	Very low	39.3	Very low	155 Å²	155	87 Å²	87	68%	0.68	45%	0.449	S	S	*	.	T	Hydrogen-bonded Turn	trans	-66.4	-18.4	175.9	-93.7	-74.8	0	0	0	115	M500 K501 N502	M500-F504 WeakPolarHBondContact O-CD2 3.44Å; M500-F504 PolarHBondContact O-N 2.91Å; M500-F504 VanDerWaalsContact O-N 3.14Å; K501-F504 PolarHBondContact O-N 3.34Å; N502-F504 PolarHBondContact O-N 2.86Å; N502-F504 VanDerWaalsContact O-N 3.13Å
505	N	41	Very low	40.2	Very low	107 Å²	107	91.6 Å²	91.6	57%	0.572	46%	0.457	S	S	*	.	T	Hydrogen-bonded Turn	trans	-81.2	-13.5	171.9	-65.9	2.3	0	0	0	112.9	N502 I503 I507 E508	N502-N505 WeakPolarHBondContact O-CB 3.33Å; N502-N505 PolarHBondContact O-N 3.47Å; I503-N505 PolarHBondContact O-N 3.39Å; N505-I507 PolarHBondContact O-N 2.88Å; N505-E508 PolarHBondContact O-N 2.78Å
506	F	41.8	Very low	40.6	Very low	61 Å²	61	88.6 Å²	88.6	27%	0.268	44%	0.444	S	S	.	.	G	3₁₀ helix	trans	-74.4	-8.1	-171.7	-76	-116.2	0	0	0	113.6	N502 I503 E508 I509 N531 N535	N502-F506 HydrophobicContact CB-CE2 4.45Å; N502-F506 WeakPolarHBondContact O-CD2 3.45Å; N502-F506 WeakPolarHBondContact O-CE2 3.4Å; I503-F506 WeakPolarHBondContact O-CB 3.44Å; I503-F506 PolarHBondContact O-N 3.33Å; I503-F506 VanDerWaalsContact O-N 3.08Å; F506-E508 PolarHBondContact O-N 2.97Å; F506-I509 HydrophobicContact CB-CD1 3.89Å; F506-I509 HydrophobicContact CD1-CD1 3.23Å; F506-I509 HydrophobicContact CE1-CD1 3.84Å; F506-I509 HydrophobicContact CG-CD1 3.67Å; F506-I509 PolarHBondContact O-N 3.43Å; F506-N531 HydrophobicContact CE1-CB 4.34Å; F506-N535 WeakPolarHBondContact CD1-ND2 3.47Å
507	I	39.8	Very low	40.8	Very low	127 Å²	127	87.5 Å²	87.5	65%	0.651	44%	0.441	S	S	*	.	G	3₁₀ helix	trans	-66.5	-27	176.7	-57.7	177.4	0	0	0	111.3	N505	N505-I507 PolarHBondContact O-N 2.88Å
508	E	50	Low	41.3	Very low	105 Å²	105	88 Å²	88	49%	0.491	45%	0.45	S	S	.	.	G	3₁₀ helix	trans	-86	-12.8	-175.8	-62.7	179.9	151.9	0	0	113.7	N505 F506 H511 L512	N505-E508 PolarHBondContact O-N 2.78Å; F506-E508 PolarHBondContact O-N 2.97Å; E508-H511 CarbonylContact O-C 3.43Å; E508-H511 WeakPolarHBondContact O-CA 3.33Å; E508-H511 PolarHBondContact O-N 3.4Å; E508-L512 HydrophobicContact CB-CD1 3.87Å; E508-L512 HydrophobicContact CB-CG 4.24Å; E508-L512 PolarHBondContact O-N 3.36Å
509	I	44.6	Very low	41.6	Very low	31 Å²	31	88.4 Å²	88.4	16%	0.159	46%	0.459	C	S	.	.	H	α-helix	trans	-54.5	-45.7	-169.5	-72.2	175.1	0	0	0	114.2	F506 H511 L512 I513	F506-I509 HydrophobicContact CB-CD1 3.89Å; F506-I509 HydrophobicContact CD1-CD1 3.23Å; F506-I509 HydrophobicContact CE1-CD1 3.84Å; F506-I509 HydrophobicContact CG-CD1 3.67Å; F506-I509 PolarHBondContact O-N 3.43Å; I509-H511 PolarHBondContact O-N 2.97Å; I509-L512 PolarHBondContact O-N 3.14Å; I509-I513 HydrophobicContact CG2-CD1 3.6Å; I509-I513 HydrophobicContact CG2-CG1 4.23Å; I509-I513 WeakPolarHBondContact O-CB 3.34Å; I509-I513 WeakPolarHBondContact O-CG1 3.4Å; I509-I513 PolarHBondContact O-N 3.08Å
510	P	42.8	Very low	42.2	Very low	57 Å²	57	88.7 Å²	88.7	37%	0.37	46%	0.46	S	S	.	.	H	α-helix	trans	-60.2	-28.6	176.5	-24.8	35.5	0	0	0	113.8
511	H	43.8	Very low	43	Very low	115 Å²	115	87.2 Å²	87.2	53%	0.532	45%	0.454	S	S	.	.	H	α-helix	trans	-93.3	-15.9	-179.1	-161.4	38.7	0	0	0	113.5	E508 I509 S514 K515	E508-H511 CarbonylContact O-C 3.43Å; E508-H511 WeakPolarHBondContact O-CA 3.33Å; E508-H511 PolarHBondContact O-N 3.4Å; I509-H511 PolarHBondContact O-N 2.97Å; H511-S514 PolarHBondContact O-OG 3.5Å; H511-K515 PolarHBondContact CD2-NZ 3.49Å; H511-K515 WeakPolarHBondContact CE1-CE 3.43Å; H511-K515 PolarHBondContact CE1-NZ 3.38Å; H511-K515 WeakPolarHBondContact NE2-CE 3.38Å; H511-K515 PolarHBondContact NE2-NZ 2.83Å; H511-K515 WeakPolarHBondContact O-CD 3.22Å; H511-K515 WeakPolarHBondContact O-CG 3.35Å
512	L	44.8	Very low	43.4	Very low	91 Å²	91	86.2 Å²	86.2	48%	0.476	45%	0.454	S	S	.	.	H	α-helix	trans	-80	-43.9	167.4	-70.4	165.4	0	0	0	110.7	E508 I509 S514 K515 M516	E508-L512 HydrophobicContact CB-CD1 3.87Å; E508-L512 HydrophobicContact CB-CG 4.24Å; E508-L512 PolarHBondContact O-N 3.36Å; I509-L512 PolarHBondContact O-N 3.14Å; L512-S514 PolarHBondContact O-N 3.28Å; L512-K515 PolarHBondContact O-N 2.89Å; L512-M516 PolarHBondContact O-N 3.43Å; L512-M516 VanDerWaalsContact O-N 3.12Å
513	I	45.1	Very low	43.8	Very low	54 Å²	54	84.8 Å²	84.8	28%	0.277	46%	0.462	S	S	.	.	H	α-helix	trans	-57.1	-37.8	175.1	-71.5	169.9	0	0	0	111	I509 K515 L521 V528	I509-I513 HydrophobicContact CG2-CD1 3.6Å; I509-I513 HydrophobicContact CG2-CG1 4.23Å; I509-I513 WeakPolarHBondContact O-CB 3.34Å; I509-I513 WeakPolarHBondContact O-CG1 3.4Å; I509-I513 PolarHBondContact O-N 3.08Å; I513-K515 PolarHBondContact O-N 3.13Å; I513-L521 HydrophobicContact CG2-CD2 4.38Å; I513-V528 HydrophobicContact CD1-CG1 4.37Å
514	S	48.1	Very low	44.7	Very low	83 Å²	83	86.5 Å²	86.5	58%	0.58	47%	0.472	S	S	*	.	T	Hydrogen-bonded Turn	trans	-76.4	7.8	176.6	88.5	0	0	0	0	115	H511 L512	H511-S514 PolarHBondContact O-OG 3.5Å; L512-S514 PolarHBondContact O-N 3.28Å
515	K	51.6	Low	45.5	Very low	135 Å²	135	81.5 Å²	81.5	59%	0.587	45%	0.45	S	S	*	.	T	Hydrogen-bonded Turn	trans	-133	-10.5	-177.7	-66.8	-179	-169.3	175.5	0	114.2	H511 L512 I513	H511-K515 PolarHBondContact CD2-NZ 3.49Å; H511-K515 WeakPolarHBondContact CE1-CE 3.43Å; H511-K515 PolarHBondContact CE1-NZ 3.38Å; H511-K515 WeakPolarHBondContact NE2-CE 3.38Å; H511-K515 PolarHBondContact NE2-NZ 2.83Å; H511-K515 WeakPolarHBondContact O-CD 3.22Å; H511-K515 WeakPolarHBondContact O-CG 3.35Å; L512-K515 PolarHBondContact O-N 2.89Å; I513-K515 PolarHBondContact O-N 3.13Å
516	M	41.6	Very low	46.1	Very low	67 Å²	67	81.5 Å²	81.5	33%	0.33	45%	0.45	S	S	.	.	S	Bend	trans	-73	138.1	175.2	-75.2	-179.2	123	0	0	110.7	L512 L521	L512-M516 PolarHBondContact O-N 3.43Å; L512-M516 VanDerWaalsContact O-N 3.12Å; M516-L521 HydrophobicContact CB-CD1 4.22Å; M516-L521 HydrophobicContact CB-CG 3.88Å
517	P	40.5	Very low	46.9	Very low	41 Å²	41	81.4 Å²	81.4	27%	0.266	46%	0.457	S	S	.	.			trans	-65.9	150.2	171.1	29.3	-34.1	0	0	0	110.4	S519 E520 L521	P517-S519 PolarHBondContact O-N 3.21Å; P517-E520 HydrophobicContact CG-CB 4.03Å; P517-E520 VanDerWaalsContact CG-CD 3.4Å; P517-E520 HydrophobicContact CG-CG 3.8Å; P517-E520 VanDerWaalsContact CG-OE1 3.28Å; P517-E520 WeakPolarHBondContact CG-OE1 3.24Å; P517-E520 PolarHBondContact O-N 3.33Å; P517-L521 PolarHBondContact O-N 3.03Å
518	P	44.3	Very low	47.5	Very low	101 Å²	101	77.6 Å²	77.6	66%	0.656	44%	0.44	S	S	*	.	H	α-helix	trans	-55.1	-30.9	-177	-28.9	36.1	0	0	0	114.7	L521 L522	P518-L521 PolarHBondContact O-N 2.94Å; P518-L522 PolarHBondContact O-N 3.42Å; P518-L522 VanDerWaalsContact O-N 3.13Å
519	S	43.5	Very low	47.9	Very low	95 Å²	95	75.4 Å²	75.4	66%	0.664	43%	0.431	S	S	*	.	H	α-helix	trans	-62.9	-37.3	175.5	46.3	0	0	0	0	113.8	P517	P517-S519 PolarHBondContact O-N 3.21Å
520	E	48.3	Very low	48.7	Very low	96 Å²	96	76.3 Å²	76.3	45%	0.449	44%	0.44	S	S	.	.	H	α-helix	trans	-82.9	-32.4	178.3	-72.9	170.1	-148.6	0	0	112.2	P517 N524	P517-E520 HydrophobicContact CG-CB 4.03Å; P517-E520 VanDerWaalsContact CG-CD 3.4Å; P517-E520 HydrophobicContact CG-CG 3.8Å; P517-E520 VanDerWaalsContact CG-OE1 3.28Å; P517-E520 WeakPolarHBondContact CG-OE1 3.24Å; P517-E520 PolarHBondContact O-N 3.33Å; E520-N524 WeakPolarHBondContact O-CB 3.36Å; E520-N524 PolarHBondContact O-N 3.06Å; E520-N524 PolarHBondContact O-ND2 2.87Å
521	L	47.7	Very low	49.3	Very low	42 Å²	42	76.3 Å²	76.3	22%	0.22	44%	0.437	C	S	.	.	H	α-helix	trans	-59.6	-46.5	173.2	-91.2	161.3	0	0	0	111.6	I513 M516 P517 P518 N524 F525	I513-L521 HydrophobicContact CG2-CD2 4.38Å; M516-L521 HydrophobicContact CB-CD1 4.22Å; M516-L521 HydrophobicContact CB-CG 3.88Å; P517-L521 PolarHBondContact O-N 3.03Å; P518-L521 PolarHBondContact O-N 2.94Å; L521-N524 PolarHBondContact O-N 3.43Å; L521-F525 WeakPolarHBondContact O-CB 3.37Å; L521-F525 PolarHBondContact O-N 2.67Å
522	L	45.1	Very low	49.9	Very low	109 Å²	109	72.9 Å²	72.9	57%	0.571	42%	0.422	S	S	*	.	H	α-helix	trans	-68.5	-38.5	-175.5	-157.1	70.4	0	0	0	112.4	P518	P518-L522 PolarHBondContact O-N 3.42Å; P518-L522 VanDerWaalsContact O-N 3.13Å
523	G	49.1	Very low	50.7	Low	69 Å²	69	75.1 Å²	75.1	71%	0.711	43%	0.43	S	S	*	.	H	α-helix	trans	-74.6	-23.9	178	0	0	0	0	0	114.9
524	N	53	Low	51.7	Low	75 Å²	75	79.5 Å²	79.5	40%	0.401	44%	0.443	S	S	.	.	H	α-helix	trans	-105.4	-3	-178.1	-70.5	-74.4	0	0	0	114.3	E520 L521 D526 S527 V528	E520-N524 WeakPolarHBondContact O-CB 3.36Å; E520-N524 PolarHBondContact O-N 3.06Å; E520-N524 PolarHBondContact O-ND2 2.87Å; L521-N524 PolarHBondContact O-N 3.43Å; N524-D526 PolarHBondContact O-N 3.37Å; N524-S527 WeakPolarHBondContact O-CA 3.46Å; N524-S527 WeakPolarHBondContact O-CB 3.32Å; N524-S527 PolarHBondContact O-N 3.36Å; N524-V528 PolarHBondContact O-N 3.15Å
525	F	49.5	Very low	52	Low	50 Å²	50	76.9 Å²	76.9	22%	0.219	42%	0.422	C	S	.	.	H	α-helix	trans	-54.7	-52.1	-168.5	-153.5	-104.1	0	0	0	113	L521 S527 V528 I529 V566 L569	L521-F525 WeakPolarHBondContact O-CB 3.37Å; L521-F525 PolarHBondContact O-N 2.67Å; F525-S527 VanDerWaalsContact C-N 3.27Å; F525-S527 PolarHBondContact O-N 2.8Å; F525-V528 PolarHBondContact O-N 2.86Å; F525-V528 VanDerWaalsContact O-N 3.15Å; F525-I529 HydrophobicContact CD1-CG1 3.94Å; F525-I529 HydrophobicContact CE1-CD1 4.09Å; F525-I529 HydrophobicContact CE1-CG1 3.95Å; F525-I529 HydrophobicContact CZ-CD1 4.49Å; F525-I529 VanDerWaalsContact O-CG1 3.28Å; F525-I529 WeakPolarHBondContact O-CG1 3.11Å; F525-I529 PolarHBondContact O-N 3.2Å; F525-V566 HydrophobicContact CE1-CG1 4.16Å; F525-V566 HydrophobicContact CZ-CB 4.46Å; F525-V566 HydrophobicContact CZ-CG1 4.19Å; F525-V566 HydrophobicContact CZ-CG2 3.96Å; F525-L569 HydrophobicContact CE2-CD1 3.81Å; F525-L569 HydrophobicContact CZ-CD1 4.06Å
526	D	53	Low	52.5	Low	107 Å²	107	76.4 Å²	76.4	57%	0.572	42%	0.417	S	S	*	.	H	α-helix	trans	-66	-28.6	180	-68.2	-38	0	0	0	113.1	N524 S530	N524-D526 PolarHBondContact O-N 3.37Å; D526-S530 WeakPolarHBondContact O-CB 3.46Å; D526-S530 PolarHBondContact O-N 3.19Å; D526-S530 PolarHBondContact O-OG 3.02Å
527	S	58.5	Low	53.7	Low	60 Å²	60	77.6 Å²	77.6	42%	0.42	42%	0.422	S	S	.	.	H	α-helix	trans	-69.1	-44.3	173.1	-173.9	0	0	0	0	111	N524 F525 S530 N531	N524-S527 WeakPolarHBondContact O-CA 3.46Å; N524-S527 WeakPolarHBondContact O-CB 3.32Å; N524-S527 PolarHBondContact O-N 3.36Å; F525-S527 VanDerWaalsContact C-N 3.27Å; F525-S527 PolarHBondContact O-N 2.8Å; S527-S530 PolarHBondContact O-N 2.9Å; S527-N531 WeakPolarHBondContact O-CB 3.39Å; S527-N531 VanDerWaalsContact O-CG 3.28Å; S527-N531 PolarHBondContact O-N 3.43Å; S527-N531 PolarHBondContact O-ND2 2.93Å
528	V	53.1	Low	54.7	Low	46 Å²	46	78.3 Å²	78.3	28%	0.279	42%	0.419	S	S	.	.	H	α-helix	trans	-63.5	-49.7	175.7	174.4	0	0	0	0	110.6	I513 N524 F525 S530 N531 L532	I513-V528 HydrophobicContact CD1-CG1 4.37Å; N524-V528 PolarHBondContact O-N 3.15Å; F525-V528 PolarHBondContact O-N 2.86Å; F525-V528 VanDerWaalsContact O-N 3.15Å; V528-S530 PolarHBondContact O-N 3.47Å; V528-N531 PolarHBondContact O-N 3.38Å; V528-L532 HydrophobicContact CG1-CD1 3.86Å; V528-L532 HydrophobicContact CG1-CG 4.49Å; V528-L532 WeakPolarHBondContact O-CB 3.44Å; V528-L532 VanDerWaalsContact O-CG 3.3Å; V528-L532 WeakPolarHBondContact O-CG 3.36Å; V528-L532 PolarHBondContact O-N 3.18Å
529	I	58.1	Low	55.3	Low	59 Å²	59	77.3 Å²	77.3	30%	0.303	41%	0.406	S	S	.	.	H	α-helix	trans	-57.5	-47.2	175.7	-65.8	-69.1	0	0	0	111.1	F525 N531 L532 H533 V566	F525-I529 HydrophobicContact CD1-CG1 3.94Å; F525-I529 HydrophobicContact CE1-CD1 4.09Å; F525-I529 HydrophobicContact CE1-CG1 3.95Å; F525-I529 HydrophobicContact CZ-CD1 4.49Å; F525-I529 VanDerWaalsContact O-CG1 3.28Å; F525-I529 WeakPolarHBondContact O-CG1 3.11Å; F525-I529 PolarHBondContact O-N 3.2Å; I529-N531 VanDerWaalsContact C-N 3.35Å; I529-N531 PolarHBondContact O-N 3.38Å; I529-L532 PolarHBondContact O-N 2.88Å; I529-H533 PolarHBondContact O-N 3.48Å; I529-V566 HydrophobicContact CD1-CG1 4.09Å; I529-V566 HydrophobicContact CD1-CG2 3.65Å
530	S	60.2	Low	56.3	Low	50 Å²	50	78.4 Å²	78.4	35%	0.35	40%	0.4	S	S	.	.	H	α-helix	trans	-62.9	-39.3	178.6	-66	0	0	0	0	112.6	D526 S527 V528 R534	D526-S530 WeakPolarHBondContact O-CB 3.46Å; D526-S530 PolarHBondContact O-N 3.19Å; D526-S530 PolarHBondContact O-OG 3.02Å; S527-S530 PolarHBondContact O-N 2.9Å; V528-S530 PolarHBondContact O-N 3.47Å; S530-R534 WeakPolarHBondContact O-CB 3.34Å; S530-R534 WeakPolarHBondContact O-CG 3.44Å; S530-R534 PolarHBondContact O-N 2.95Å
531	N	57.1	Low	56.9	Low	58 Å²	58	79.4 Å²	79.4	31%	0.31	41%	0.405	S	S	.	.	H	α-helix	trans	-69.1	-40.4	176.8	-77	-41.6	0	0	0	112.1	F506 S527 V528 I529 R534 N535	F506-N531 HydrophobicContact CE1-CB 4.34Å; S527-N531 WeakPolarHBondContact O-CB 3.39Å; S527-N531 VanDerWaalsContact O-CG 3.28Å; S527-N531 PolarHBondContact O-N 3.43Å; S527-N531 PolarHBondContact O-ND2 2.93Å; V528-N531 PolarHBondContact O-N 3.38Å; I529-N531 VanDerWaalsContact C-N 3.35Å; I529-N531 PolarHBondContact O-N 3.38Å; N531-R534 PolarHBondContact OD1-NE 3.15Å; N531-R534 PolarHBondContact OD1-NH2 2.91Å; N531-N535 WeakPolarHBondContact O-CB 3.33Å; N531-N535 PolarHBondContact O-N 2.94Å
532	L	56	Low	57.3	Low	42 Å²	42	80 Å²	80	22%	0.22	41%	0.407	C	S	.	.	H	α-helix	trans	-61.1	-45.1	172.9	-72	163.5	0	0	0	111.5	V528 I529 N535 R536 I562	V528-L532 HydrophobicContact CG1-CD1 3.86Å; V528-L532 HydrophobicContact CG1-CG 4.49Å; V528-L532 WeakPolarHBondContact O-CB 3.44Å; V528-L532 VanDerWaalsContact O-CG 3.3Å; V528-L532 WeakPolarHBondContact O-CG 3.36Å; V528-L532 PolarHBondContact O-N 3.18Å; I529-L532 PolarHBondContact O-N 2.88Å; L532-N535 PolarHBondContact O-N 3.3Å; L532-R536 WeakPolarHBondContact O-CB 3.29Å; L532-R536 PolarHBondContact O-N 3.22Å; L532-I562 HydrophobicContact CD1-CG2 3.82Å; L532-I562 HydrophobicContact CD2-CD1 4.04Å
533	H	62	Low	57.4	Low	139 Å²	139	78.2 Å²	78.2	64%	0.644	40%	0.395	S	S	*	.	H	α-helix	trans	-65.8	-43	178.7	-164.9	80.4	0	0	0	112.5	I529 N535 R536 Q537	I529-H533 PolarHBondContact O-N 3.48Å; H533-N535 VanDerWaalsContact C-N 3.33Å; H533-N535 PolarHBondContact O-N 2.91Å; H533-R536 PolarHBondContact O-N 3.38Å; H533-Q537 PolarHBondContact NE2-NE2 3.12Å; H533-Q537 PolarHBondContact O-N 3.42Å
534	R	66.1	Low	57.7	Low	145 Å²	145	82.5 Å²	82.5	55%	0.547	40%	0.396	S	S	.	.	H	α-helix	trans	-57.3	-44.8	172	-78.6	-173.3	-75.6	-102.7	5.1	111.7	S530 N531 Q537 Y538	S530-R534 WeakPolarHBondContact O-CB 3.34Å; S530-R534 WeakPolarHBondContact O-CG 3.44Å; S530-R534 PolarHBondContact O-N 2.95Å; N531-R534 PolarHBondContact OD1-NE 3.15Å; N531-R534 PolarHBondContact OD1-NH2 2.91Å; R534-Q537 PolarHBondContact O-N 3.28Å; R534-Y538 PolarHBondContact O-N 2.96Å
535	N	54	Low	57.6	Low	28 Å²	28	87.9 Å²	87.9	15%	0.15	41%	0.411	C	S	.	.	H	α-helix	trans	-68.4	-39.2	-179.5	-155.9	-3.1	0	0	0	111.9	F506 N531 L532 H533 Q537 Y538 H539	F506-N535 WeakPolarHBondContact CD1-ND2 3.47Å; N531-N535 WeakPolarHBondContact O-CB 3.33Å; N531-N535 PolarHBondContact O-N 2.94Å; L532-N535 PolarHBondContact O-N 3.3Å; H533-N535 VanDerWaalsContact C-N 3.33Å; H533-N535 PolarHBondContact O-N 2.91Å; N535-Q537 PolarHBondContact O-N 3.27Å; N535-Y538 PolarHBondContact O-N 2.7Å; N535-H539 PolarHBondContact O-N 2.93Å; N535-H539 PolarHBondContact OD1-CD2 3.46Å; N535-H539 VanDerWaalsContact OD1-CD2 3.31Å
536	R	62.3	Low	57.1	Low	125 Å²	125	90.7 Å²	90.7	47%	0.472	43%	0.428	S	S	.	.	H	α-helix	trans	-58.6	-43.5	171.7	-174	171.9	178.1	159.9	-2.6	111.7	L532 H533 H540 S559 D563	L532-R536 WeakPolarHBondContact O-CB 3.29Å; L532-R536 PolarHBondContact O-N 3.22Å; H533-R536 PolarHBondContact O-N 3.38Å; R536-H540 WeakPolarHBondContact O-CB 3.29Å; R536-H540 PolarHBondContact O-N 3.13Å; R536-H540 VanDerWaalsContact O-N 3.07Å; R536-S559 PolarHBondContact NH1-OG 3.21Å; R536-S559 VanDerWaalsContact NH1-OG 3.15Å; R536-D563 IonicContact CZ-OD2 3.95Å; R536-D563 IonicContact NH1-OD1 2.7Å; R536-D563 IonicContact NH1-OD2 2.85Å; R536-D563 PolarHBondContact NH1-OD2 3.44Å
537	Q	66	Low	57	Low	92 Å²	92	95.1 Å²	95.1	43%	0.43	45%	0.445	S	S	.	.	H	α-helix	trans	-67.5	-43.1	174.9	-70	-159.1	14.9	0	0	113.1	H533 R534 N535 H539 H540 Q541	H533-Q537 PolarHBondContact NE2-NE2 3.12Å; H533-Q537 PolarHBondContact O-N 3.42Å; R534-Q537 PolarHBondContact O-N 3.28Å; N535-Q537 PolarHBondContact O-N 3.27Å; Q537-H539 PolarHBondContact O-N 3.05Å; Q537-H540 PolarHBondContact O-N 2.87Å; Q537-Q541 WeakPolarHBondContact O-CG 3.35Å; Q537-Q541 PolarHBondContact O-N 3.24Å
538	Y	62.7	Low	56.7	Low	57 Å²	57	102 Å²	102	22%	0.224	46%	0.462	C	S	.	.	H	α-helix	trans	-58.1	-47.7	176.5	177.2	-99.7	0	0	0	111.8	I503 R534 N535 H540 Q541 Q542	I503-Y538 HydrophobicContact CD1-CD1 3.73Å; I503-Y538 HydrophobicContact CD1-CE1 3.53Å; R534-Y538 PolarHBondContact O-N 2.96Å; N535-Y538 PolarHBondContact O-N 2.7Å; Y538-H540 VanDerWaalsContact C-N 3.33Å; Y538-H540 PolarHBondContact O-N 3.38Å; Y538-Q541 PolarHBondContact O-N 3.04Å; Y538-Q542 HydrophobicContact CD1-CG 4.41Å; Y538-Q542 HydrophobicContact CE1-CG 4.02Å; Y538-Q542 HydrophobicContact CE2-CG 4.3Å; Y538-Q542 WeakPolarHBondContact O-CG 3.49Å; Y538-Q542 PolarHBondContact O-N 3.3Å; Y538-Q542 PolarHBondContact OH-NE2 2.95Å
539	H	55.5	Low	56.6	Low	79 Å²	79	106.7 Å²	106.7	37%	0.366	48%	0.48	S	S	.	.	H	α-helix	trans	-63.7	-35.8	176.2	-88.3	-81.9	0	0	0	113	N535 Q537 Q542 H543	N535-H539 PolarHBondContact O-N 2.93Å; N535-H539 PolarHBondContact OD1-CD2 3.46Å; N535-H539 VanDerWaalsContact OD1-CD2 3.31Å; Q537-H539 PolarHBondContact O-N 3.05Å; H539-Q542 PolarHBondContact O-N 3.19Å; H539-H543 PolarHBondContact O-N 3.15Å
540	H	64.6	Low	56.1	Low	119 Å²	119	110.7 Å²	110.7	55%	0.551	50%	0.502	S	S	*	.	H	α-helix	trans	-65.1	-42.5	174.4	-164.1	76.4	0	0	0	112.1	R536 Q537 Y538 Q542 H543	R536-H540 WeakPolarHBondContact O-CB 3.29Å; R536-H540 PolarHBondContact O-N 3.13Å; R536-H540 VanDerWaalsContact O-N 3.07Å; Q537-H540 PolarHBondContact O-N 2.87Å; Y538-H540 VanDerWaalsContact C-N 3.33Å; Y538-H540 PolarHBondContact O-N 3.38Å; H540-Q542 PolarHBondContact O-N 3.13Å; H540-H543 WeakPolarHBondContact O-CB 3.12Å; H540-H543 PolarHBondContact O-N 3.33Å; H540-H543 VanDerWaalsContact O-N 3.12Å
541	Q	61.5	Low	55.6	Low	116 Å²	116	115.4 Å²	115.4	54%	0.542	52%	0.519	S	S	.	.	H	α-helix	trans	-64	-38.4	175.4	-68.7	176.1	22.1	0	0	112.6	Q537 Y538 H543	Q537-Q541 WeakPolarHBondContact O-CG 3.35Å; Q537-Q541 PolarHBondContact O-N 3.24Å; Y538-Q541 PolarHBondContact O-N 3.04Å; Q541-H543 VanDerWaalsContact C-N 3.27Å; Q541-H543 PolarHBondContact O-N 2.87Å
542	Q	55.4	Low	55	Low	55 Å²	55	117.7 Å²	117.7	26%	0.257	52%	0.524	S	S	.	.	H	α-helix	trans	-71.5	-21.3	174.6	-62.8	-67.2	12.1	0	0	113	Y538 H539 H540 H544 R545 N546	Y538-Q542 HydrophobicContact CD1-CG 4.41Å; Y538-Q542 HydrophobicContact CE1-CG 4.02Å; Y538-Q542 HydrophobicContact CE2-CG 4.3Å; Y538-Q542 WeakPolarHBondContact O-CG 3.49Å; Y538-Q542 PolarHBondContact O-N 3.3Å; Y538-Q542 PolarHBondContact OH-NE2 2.95Å; H539-Q542 PolarHBondContact O-N 3.19Å; H540-Q542 PolarHBondContact O-N 3.13Å; Q542-H544 VanDerWaalsContact C-N 3.28Å; Q542-H544 PolarHBondContact O-N 3.28Å; Q542-R545 PolarHBondContact O-N 2.78Å; Q542-N546 PolarHBondContact O-N 2.92Å
543	H	48.6	Very low	54.9	Low	71 Å²	71	119.6 Å²	119.6	33%	0.329	54%	0.54	S	S	.	.	H	α-helix	trans	-64.2	-32	178.2	-138.9	-94.7	0	0	0	112.6	H539 H540 Q541 R545 Y552	H539-H543 PolarHBondContact O-N 3.15Å; H540-H543 WeakPolarHBondContact O-CB 3.12Å; H540-H543 PolarHBondContact O-N 3.33Å; H540-H543 VanDerWaalsContact O-N 3.12Å; Q541-H543 VanDerWaalsContact C-N 3.27Å; Q541-H543 PolarHBondContact O-N 2.87Å; H543-R545 PolarHBondContact O-N 3.3Å; H543-Y552 AromaticContact CD2-CD2 3.9Å; H543-Y552 AromaticContact NE2-CD2 3.35Å; H543-Y552 WeakPolarHBondContact NE2-CD2 3.41Å; H543-Y552 AromaticContact NE2-CG 3.86Å
544	H	53.5	Low	54.6	Low	159 Å²	159	120.1 Å²	120.1	74%	0.736	54%	0.541	S	S	*	.	T	Hydrogen-bonded Turn	trans	-70.1	-3.1	172.2	-70.2	-74.7	0	0	0	114.2	Q542	Q542-H544 VanDerWaalsContact C-N 3.28Å; Q542-H544 PolarHBondContact O-N 3.28Å
545	R	50.9	Low	53.8	Low	188 Å²	188	116.6 Å²	116.6	71%	0.709	53%	0.533	S	S	*	.	T	Hydrogen-bonded Turn	trans	-117.8	-14	-177.4	-67.7	-179.8	173	144.2	-0.7	114.9	Q542 H543	Q542-R545 PolarHBondContact O-N 2.78Å; H543-R545 PolarHBondContact O-N 3.3Å
546	N	41	Very low	54	Low	109 Å²	109	119.9 Å²	119.9	58%	0.583	55%	0.547	S	S	*	.			trans	-144.3	114.2	-175.2	-69.5	-80.6	0	0	0	113.3	Q542 R548	Q542-N546 PolarHBondContact O-N 2.92Å; N546-R548 PolarHBondContact O-N 2.98Å
547	H	50.3	Low	54	Low	200 Å²	200	117.3 Å²	117.3	93%	0.926	55%	0.548	S	S	*	.			trans	-76.1	85.7	171.3	-70.8	-21.1	0	0	0	112.1
548	R	50.9	Low	53.2	Low	205 Å²	205	116 Å²	116	77%	0.774	54%	0.542	S	S	*	.			trans	-141.6	104	166	-74.6	-169.3	169.1	-178.6	-5.9	111.3	N546	N546-R548 PolarHBondContact O-N 2.98Å
549	H	51.1	Low	52.8	Low	144 Å²	144	114.8 Å²	114.8	67%	0.667	54%	0.541	S	S	*	.			trans	-71.5	-34.5	-176.8	-84	-22.6	0	0	0	114.5	H551 Y552	H549-H551 PolarHBondContact O-N 3.29Å; H549-Y552 VanDerWaalsContact O-CB 3.26Å; H549-Y552 WeakPolarHBondContact O-CB 3.33Å; H549-Y552 PolarHBondContact O-N 3.44Å
550	D	49.4	Very low	53.2	Low	143 Å²	143	113.4 Å²	113.4	77%	0.765	54%	0.544	S	S	*	.	H	α-helix	trans	-61.5	-29.1	-163.9	-41.5	-40.9	0	0	0	113.9
551	H	47.7	Very low	52.9	Low	149 Å²	149	113.9 Å²	113.9	69%	0.69	55%	0.546	S	S	*	.	H	α-helix	trans	-78.4	-22.6	176.4	-119.9	-74.8	0	0	0	113.5	H549 L555	H549-H551 PolarHBondContact O-N 3.29Å; H551-L555 WeakPolarHBondContact O-CD1 3.5Å; H551-L555 WeakPolarHBondContact O-CG 3.46Å
552	Y	44.7	Very low	52.5	Low	107 Å²	107	109.6 Å²	109.6	42%	0.42	53%	0.527	S	S	.	.	H	α-helix	trans	-71.1	-50	-178.3	-177.9	-94.8	0	0	0	111	H543 H549 K554 L555 H556	H543-Y552 AromaticContact CD2-CD2 3.9Å; H543-Y552 AromaticContact NE2-CD2 3.35Å; H543-Y552 WeakPolarHBondContact NE2-CD2 3.41Å; H543-Y552 AromaticContact NE2-CG 3.86Å; H549-Y552 VanDerWaalsContact O-CB 3.26Å; H549-Y552 WeakPolarHBondContact O-CB 3.33Å; H549-Y552 PolarHBondContact O-N 3.44Å; Y552-K554 VanDerWaalsContact C-N 3.3Å; Y552-K554 PolarHBondContact O-N 3.33Å; Y552-L555 PolarHBondContact O-N 3.34Å; Y552-L555 VanDerWaalsContact O-N 3.11Å; Y552-H556 HydrophobicContact CD1-CB 4.33Å; Y552-H556 HydrophobicContact CE1-CB 4.09Å; Y552-H556 AromaticContact CE1-ND1 3.96Å; Y552-H556 AromaticContact CZ-ND1 3.77Å; Y552-H556 WeakPolarHBondContact O-CB 3.41Å; Y552-H556 PolarHBondContact O-N 2.97Å; Y552-H556 PolarHBondContact OH-ND1 2.85Å
553	S	55.2	Low	52.6	Low	81 Å²	81	110.4 Å²	110.4	57%	0.566	53%	0.533	S	S	*	.	H	α-helix	trans	-58	-39.8	-174.2	-52.2	0	0	0	0	113.2	S557	S553-S557 PolarHBondContact O-N 3.15Å; S553-S557 VanDerWaalsContact O-N 3.11Å; S553-S557 PolarHBondContact O-OG 2.73Å
554	K	54.3	Low	53.4	Low	150 Å²	150	110.9 Å²	110.9	65%	0.652	54%	0.535	S	S	*	.	H	α-helix	trans	-74	-30.5	179.6	-169.2	170.4	-177.8	175.6	0	113.4	Y552 S557 Q558	Y552-K554 VanDerWaalsContact C-N 3.3Å; Y552-K554 PolarHBondContact O-N 3.33Å; K554-S557 PolarHBondContact O-OG 2.98Å; K554-Q558 VanDerWaalsContact O-CG 3.3Å; K554-Q558 WeakPolarHBondContact O-CG 3.44Å; K554-Q558 PolarHBondContact O-N 3.46Å; K554-Q558 PolarHBondContact O-OE1 3.22Å
555	L	51	Low	53.2	Low	72 Å²	72	106 Å²	106	38%	0.377	52%	0.517	S	S	.	.	H	α-helix	trans	-80.5	-31.3	173.8	-69.9	167.8	0	0	0	111.7	H551 Y552 Q558 S559	H551-L555 WeakPolarHBondContact O-CD1 3.5Å; H551-L555 WeakPolarHBondContact O-CG 3.46Å; Y552-L555 PolarHBondContact O-N 3.34Å; Y552-L555 VanDerWaalsContact O-N 3.11Å; L555-Q558 PolarHBondContact O-N 2.83Å; L555-S559 WeakPolarHBondContact O-CB 3.46Å; L555-S559 PolarHBondContact O-N 3.31Å
556	H	57.1	Low	53.4	Low	97 Å²	97	98 Å²	98	45%	0.449	49%	0.489	S	S	.	.	H	α-helix	trans	-68.6	-42.2	176.9	-164.9	78.4	0	0	0	111.6	Y552 S559 A560	Y552-H556 HydrophobicContact CD1-CB 4.33Å; Y552-H556 HydrophobicContact CE1-CB 4.09Å; Y552-H556 AromaticContact CE1-ND1 3.96Å; Y552-H556 AromaticContact CZ-ND1 3.77Å; Y552-H556 WeakPolarHBondContact O-CB 3.41Å; Y552-H556 PolarHBondContact O-N 2.97Å; Y552-H556 PolarHBondContact OH-ND1 2.85Å; H556-S559 PolarHBondContact O-N 3.1Å; H556-A560 WeakPolarHBondContact O-CB 3.27Å; H556-A560 PolarHBondContact O-N 2.97Å
557	S	62.1	Low	54.6	Low	70 Å²	70	98.2 Å²	98.2	49%	0.49	48%	0.484	S	S	.	.	H	α-helix	trans	-65.3	-39.8	173.4	60.2	0	0	0	0	112.6	S553 K554 A560 Q561	S553-S557 PolarHBondContact O-N 3.15Å; S553-S557 VanDerWaalsContact O-N 3.11Å; S553-S557 PolarHBondContact O-OG 2.73Å; K554-S557 PolarHBondContact O-OG 2.98Å; S557-A560 PolarHBondContact O-N 3.14Å; S557-Q561 WeakPolarHBondContact O-CB 3.36Å; S557-Q561 PolarHBondContact O-N 3.48Å
558	Q	49.9	Very low	55	Low	65 Å²	65	94 Å²	94	30%	0.304	47%	0.465	S	S	.	.	H	α-helix	trans	-64.1	-41.1	173.4	-74.3	178.7	-38.7	0	0	112.2	K554 L555 Q561 I562	K554-Q558 VanDerWaalsContact O-CG 3.3Å; K554-Q558 WeakPolarHBondContact O-CG 3.44Å; K554-Q558 PolarHBondContact O-N 3.46Å; K554-Q558 PolarHBondContact O-OE1 3.22Å; L555-Q558 PolarHBondContact O-N 2.83Å; Q558-Q561 PolarHBondContact O-N 2.87Å; Q558-I562 VanDerWaalsContact O-CG1 3.32Å; Q558-I562 WeakPolarHBondContact O-CG1 3.44Å; Q558-I562 PolarHBondContact O-N 2.93Å
559	S	53.7	Low	55	Low	31 Å²	31	87.2 Å²	87.2	22%	0.217	44%	0.444	C	S	.	.	H	α-helix	trans	-62.9	-41.7	173.8	-171.4	0	0	0	0	111.8	R536 L555 H556 I562 D563	R536-S559 PolarHBondContact NH1-OG 3.21Å; R536-S559 VanDerWaalsContact NH1-OG 3.15Å; L555-S559 WeakPolarHBondContact O-CB 3.46Å; L555-S559 PolarHBondContact O-N 3.31Å; H556-S559 PolarHBondContact O-N 3.1Å; S559-I562 PolarHBondContact O-N 3.33Å; S559-D563 WeakPolarHBondContact O-CB 3.4Å; S559-D563 VanDerWaalsContact O-CG 3.24Å; S559-D563 PolarHBondContact O-N 3.42Å
560	A	63.4	Low	55.3	Low	50 Å²	50	86.9 Å²	86.9	41%	0.413	44%	0.44	S	S	.	.	H	α-helix	trans	-65.8	-39	177.6	0	0	0	0	0	112.1	H556 S557 I562 D563 E564	H556-A560 WeakPolarHBondContact O-CB 3.27Å; H556-A560 PolarHBondContact O-N 2.97Å; S557-A560 PolarHBondContact O-N 3.14Å; A560-I562 VanDerWaalsContact C-N 3.34Å; A560-D563 PolarHBondContact O-N 3.21Å; A560-E564 WeakPolarHBondContact O-CB 3.29Å; A560-E564 PolarHBondContact O-N 3.41Å
561	Q	59	Low	55.6	Low	130 Å²	130	85.3 Å²	85.3	61%	0.607	44%	0.436	S	S	*	.	H	α-helix	trans	-64	-38.7	174.8	-171.8	177.2	9.7	0	0	112	S557 Q558 T565	S557-Q561 WeakPolarHBondContact O-CB 3.36Å; S557-Q561 PolarHBondContact O-N 3.48Å; Q558-Q561 PolarHBondContact O-N 2.87Å; Q561-T565 WeakPolarHBondContact O-CG2 3.44Å; Q561-T565 PolarHBondContact O-N 3.31Å; Q561-T565 PolarHBondContact O-OG1 3.34Å
562	I	53.9	Low	55.6	Low	25 Å²	25	80 Å²	80	13%	0.128	42%	0.416	C	S	.	.	H	α-helix	trans	-70.5	-46.2	174.7	-65.1	164.7	0	0	0	110.9	L532 Q558 S559 A560 E564 T565 V566	L532-I562 HydrophobicContact CD1-CG2 3.82Å; L532-I562 HydrophobicContact CD2-CD1 4.04Å; Q558-I562 VanDerWaalsContact O-CG1 3.32Å; Q558-I562 WeakPolarHBondContact O-CG1 3.44Å; Q558-I562 PolarHBondContact O-N 2.93Å; S559-I562 PolarHBondContact O-N 3.33Å; A560-I562 VanDerWaalsContact C-N 3.34Å; I562-E564 PolarHBondContact O-N 3.36Å; I562-T565 PolarHBondContact O-N 3.11Å; I562-T565 PolarHBondContact O-OG1 3.03Å; I562-V566 HydrophobicContact CG2-CG2 4.2Å; I562-V566 WeakPolarHBondContact O-CB 3.47Å; I562-V566 WeakPolarHBondContact O-CG2 3.47Å; I562-V566 PolarHBondContact O-N 2.88Å
563	D	57.2	Low	55.7	Low	72 Å²	72	82.3 Å²	82.3	39%	0.385	43%	0.43	S	S	.	.	H	α-helix	trans	-57.2	-33.8	176.3	-72.3	-26.2	0	0	0	110.7	R536 S559 A560 K567	R536-D563 IonicContact CZ-OD2 3.95Å; R536-D563 IonicContact NH1-OD1 2.7Å; R536-D563 IonicContact NH1-OD2 2.85Å; R536-D563 PolarHBondContact NH1-OD2 3.44Å; S559-D563 WeakPolarHBondContact O-CB 3.4Å; S559-D563 VanDerWaalsContact O-CG 3.24Å; S559-D563 PolarHBondContact O-N 3.42Å; A560-D563 PolarHBondContact O-N 3.21Å; D563-K567 WeakPolarHBondContact O-CG 3.49Å; D563-K567 PolarHBondContact O-N 3.49Å
564	E	64.5	Low	55.1	Low	82 Å²	82	85.6 Å²	85.6	38%	0.383	44%	0.437	S	S	.	.	H	α-helix	trans	-76.4	-44.8	176.2	-163.5	60.4	-148.4	0	0	113.7	A560 I562 V566 K567 Q568	A560-E564 WeakPolarHBondContact O-CB 3.29Å; A560-E564 PolarHBondContact O-N 3.41Å; I562-E564 PolarHBondContact O-N 3.36Å; E564-V566 PolarHBondContact O-N 3.31Å; E564-K567 WeakPolarHBondContact O-CB 3.22Å; E564-K567 PolarHBondContact O-N 3.45Å; E564-K567 VanDerWaalsContact O-N 3.09Å; E564-K567 WeakPolarHBondContact OE2-CE 3.4Å; E564-K567 IonicContact OE2-NZ 3.15Å; E564-K567 PolarHBondContact OE2-NZ 3.23Å; E564-Q568 WeakPolarHBondContact O-CG 3.36Å; E564-Q568 PolarHBondContact O-N 3.16Å
565	T	50.9	Low	54.6	Low	56 Å²	56	80.9 Å²	80.9	34%	0.344	42%	0.418	S	S	.	.	H	α-helix	trans	-64.4	-31.6	175	54.5	0	0	0	0	111.8	Q561 I562 Q568 L569	Q561-T565 WeakPolarHBondContact O-CG2 3.44Å; Q561-T565 PolarHBondContact O-N 3.31Å; Q561-T565 PolarHBondContact O-OG1 3.34Å; I562-T565 PolarHBondContact O-N 3.11Å; I562-T565 PolarHBondContact O-OG1 3.03Å; T565-Q568 PolarHBondContact O-N 2.82Å; T565-L569 WeakPolarHBondContact O-CB 3.49Å; T565-L569 VanDerWaalsContact O-CG 3.26Å; T565-L569 WeakPolarHBondContact O-CG 3.3Å; T565-L569 PolarHBondContact O-N 3.38Å
566	V	54.3	Low	54.4	Low	21 Å²	21	81.4 Å²	81.4	13%	0.127	42%	0.421	C	S	.	.	H	α-helix	trans	-65.4	-36.5	172.2	171.6	0	0	0	0	111.9	F525 I529 I562 E564 K570	F525-V566 HydrophobicContact CE1-CG1 4.16Å; F525-V566 HydrophobicContact CZ-CB 4.46Å; F525-V566 HydrophobicContact CZ-CG1 4.19Å; F525-V566 HydrophobicContact CZ-CG2 3.96Å; I529-V566 HydrophobicContact CD1-CG1 4.09Å; I529-V566 HydrophobicContact CD1-CG2 3.65Å; I562-V566 HydrophobicContact CG2-CG2 4.2Å; I562-V566 WeakPolarHBondContact O-CB 3.47Å; I562-V566 WeakPolarHBondContact O-CG2 3.47Å; I562-V566 PolarHBondContact O-N 2.88Å; E564-V566 PolarHBondContact O-N 3.31Å; V566-K570 HydrophobicContact CG1-CD 4.49Å; V566-K570 WeakPolarHBondContact O-CG 3.43Å; V566-K570 PolarHBondContact O-N 3.33Å; V566-K570 VanDerWaalsContact O-N 3.14Å
567	K	65.2	Low	53.7	Low	113 Å²	113	80.9 Å²	80.9	49%	0.491	42%	0.422	S	S	.	.	H	α-helix	trans	-64.4	-50.5	170	-67.9	173.3	-154.8	162	0	110.9	D563 E564 L569 K570 T571	D563-K567 WeakPolarHBondContact O-CG 3.49Å; D563-K567 PolarHBondContact O-N 3.49Å; E564-K567 WeakPolarHBondContact O-CB 3.22Å; E564-K567 PolarHBondContact O-N 3.45Å; E564-K567 VanDerWaalsContact O-N 3.09Å; E564-K567 WeakPolarHBondContact OE2-CE 3.4Å; E564-K567 IonicContact OE2-NZ 3.15Å; E564-K567 PolarHBondContact OE2-NZ 3.23Å; K567-L569 VanDerWaalsContact C-N 3.28Å; K567-L569 PolarHBondContact O-N 3.28Å; K567-K570 CarbonylContact O-C 3.34Å; K567-K570 WeakPolarHBondContact O-CA 3.36Å; K567-K570 WeakPolarHBondContact O-CB 3.42Å; K567-K570 PolarHBondContact O-N 3.01Å; K567-T571 PolarHBondContact O-N 3.15Å; K567-T571 PolarHBondContact O-OG1 2.96Å; K567-T571 VanDerWaalsContact O-OG1 3.14Å
568	Q	59.5	Low	52.6	Low	111 Å²	111	84.3 Å²	84.3	52%	0.519	43%	0.428	S	S	.	.	H	α-helix	trans	-58.1	-40.2	-177.7	-69.4	172.6	-1.8	0	0	112	E564 T565 T571 S572	E564-Q568 WeakPolarHBondContact O-CG 3.36Å; E564-Q568 PolarHBondContact O-N 3.16Å; T565-Q568 PolarHBondContact O-N 2.82Å; Q568-T571 PolarHBondContact O-N 2.94Å; Q568-T571 PolarHBondContact O-OG1 3.13Å; Q568-S572 WeakPolarHBondContact O-CB 3.47Å; Q568-S572 PolarHBondContact O-N 2.83Å
569	L	51.9	Low	52.1	Low	62 Å²	62	85.4 Å²	85.4	33%	0.325	44%	0.435	S	S	.	.	H	α-helix	trans	-64.2	-43.4	172.6	-71	166.1	0	0	0	111.9	F525 T565 K567 T571 S572 I575	F525-L569 HydrophobicContact CE2-CD1 3.81Å; F525-L569 HydrophobicContact CZ-CD1 4.06Å; T565-L569 WeakPolarHBondContact O-CB 3.49Å; T565-L569 VanDerWaalsContact O-CG 3.26Å; T565-L569 WeakPolarHBondContact O-CG 3.3Å; T565-L569 PolarHBondContact O-N 3.38Å; K567-L569 VanDerWaalsContact C-N 3.28Å; K567-L569 PolarHBondContact O-N 3.28Å; L569-T571 PolarHBondContact O-N 3.16Å; L569-S572 WeakPolarHBondContact O-CB 3.44Å; L569-S572 PolarHBondContact O-N 3.07Å; L569-I575 HydrophobicContact CB-CD1 4.04Å; L569-I575 HydrophobicContact CD2-CD1 3.61Å; L569-I575 HydrophobicContact CG-CD1 4.45Å; L569-I575 WeakPolarHBondContact O-CD1 3.39Å
570	K	55.9	Low	51.6	Low	137 Å²	137	90.9 Å²	90.9	60%	0.596	46%	0.455	S	S	*	.	H	α-helix	trans	-66.5	-33.3	176.7	-75.9	-179.2	175	-170.8	0	113.7	V566 K567	V566-K570 HydrophobicContact CG1-CD 4.49Å; V566-K570 WeakPolarHBondContact O-CG 3.43Å; V566-K570 PolarHBondContact O-N 3.33Å; V566-K570 VanDerWaalsContact O-N 3.14Å; K567-K570 CarbonylContact O-C 3.34Å; K567-K570 WeakPolarHBondContact O-CA 3.36Å; K567-K570 WeakPolarHBondContact O-CB 3.42Å; K567-K570 PolarHBondContact O-N 3.01Å
571	T	57.3	Low	50.4	Low	110 Å²	110	93 Å²	93	68%	0.675	46%	0.459	S	S	*	.	H	α-helix	trans	-88.3	-6.8	177.5	57.5	0	0	0	0	113.5	K567 Q568 L569 Q573	K567-T571 PolarHBondContact O-N 3.15Å; K567-T571 PolarHBondContact O-OG1 2.96Å; K567-T571 VanDerWaalsContact O-OG1 3.14Å; Q568-T571 PolarHBondContact O-N 2.94Å; Q568-T571 PolarHBondContact O-OG1 3.13Å; L569-T571 PolarHBondContact O-N 3.16Å; T571-Q573 PolarHBondContact O-N 2.93Å
572	S	47.2	Very low	49.3	Very low	37 Å²	37	89.2 Å²	89.2	26%	0.259	46%	0.455	S	S	.	.			trans	-65.8	122.7	-177.9	-178	0	0	0	0	111.5	Q568 L569 H574 I575 N576	Q568-S572 WeakPolarHBondContact O-CB 3.47Å; Q568-S572 PolarHBondContact O-N 2.83Å; L569-S572 WeakPolarHBondContact O-CB 3.44Å; L569-S572 PolarHBondContact O-N 3.07Å; S572-H574 PolarHBondContact O-N 3.28Å; S572-H574 PolarHBondContact OG-N 3.18Å; S572-I575 PolarHBondContact O-N 3.46Å; S572-N576 PolarHBondContact O-N 3.07Å; S572-N576 PolarHBondContact O-ND2 3.39Å
573	Q	47.2	Very low	48.5	Very low	157 Å²	157	94.9 Å²	94.9	73%	0.734	49%	0.486	S	S	*	.	H	α-helix	trans	-62.6	-31.1	172.6	-73.1	-176.3	-12.9	0	0	111.7	T571 I575 N576 N577	T571-Q573 PolarHBondContact O-N 2.93Å; Q573-I575 VanDerWaalsContact C-N 3.31Å; Q573-I575 PolarHBondContact O-N 3.42Å; Q573-N576 PolarHBondContact O-N 3.04Å; Q573-N577 VanDerWaalsContact O-CB 3.31Å; Q573-N577 WeakPolarHBondContact O-CB 3.44Å; Q573-N577 PolarHBondContact O-N 2.85Å; Q573-N577 PolarHBondContact O-ND2 3.24Å
574	H	41	Very low	47.5	Very low	150 Å²	150	98.5 Å²	98.5	69%	0.694	50%	0.5	S	S	*	.	H	α-helix	trans	-60.1	-39.7	174.3	-81.1	-66.4	0	0	0	112.5	S572 N577 F578	S572-H574 PolarHBondContact O-N 3.28Å; S572-H574 PolarHBondContact OG-N 3.18Å; H574-N577 PolarHBondContact O-N 2.82Å; H574-F578 WeakPolarHBondContact O-CB 3.4Å; H574-F578 PolarHBondContact O-N 3.45Å
575	I	44.9	Very low	46	Very low	51 Å²	51	99.6 Å²	99.6	26%	0.262	51%	0.508	S	S	.	.	H	α-helix	trans	-73.9	-39	178.5	-70.4	176.4	0	0	0	110.9	L569 S572 Q573 N577 F578 L579	L569-I575 HydrophobicContact CB-CD1 4.04Å; L569-I575 HydrophobicContact CD2-CD1 3.61Å; L569-I575 HydrophobicContact CG-CD1 4.45Å; L569-I575 WeakPolarHBondContact O-CD1 3.39Å; S572-I575 PolarHBondContact O-N 3.46Å; Q573-I575 VanDerWaalsContact C-N 3.31Å; Q573-I575 PolarHBondContact O-N 3.42Å; I575-N577 VanDerWaalsContact C-N 3.31Å; I575-N577 PolarHBondContact O-N 3.11Å; I575-F578 PolarHBondContact O-N 3.47Å; I575-L579 HydrophobicContact CG2-CD1 3.98Å; I575-L579 HydrophobicContact CG2-CG 4.44Å; I575-L579 WeakPolarHBondContact O-CB 3.47Å; I575-L579 VanDerWaalsContact O-CG 3.28Å; I575-L579 WeakPolarHBondContact O-CG 3.35Å; I575-L579 PolarHBondContact O-N 3.43Å
576	N	45.7	Very low	45.1	Very low	83 Å²	83	106.4 Å²	106.4	44%	0.444	53%	0.533	S	S	.	.	H	α-helix	trans	-64.5	-35.3	173.7	-74.3	-81.6	0	0	0	112.4	S572 Q573 L579 K580	S572-N576 PolarHBondContact O-N 3.07Å; S572-N576 PolarHBondContact O-ND2 3.39Å; Q573-N576 PolarHBondContact O-N 3.04Å; N576-L579 PolarHBondContact O-N 3.02Å; N576-K580 PolarHBondContact O-N 3.12Å
577	N	42.6	Very low	44	Very low	86 Å²	86	114.1 Å²	114.1	46%	0.46	57%	0.565	S	S	.	*	H	α-helix	trans	-71.8	-38.6	173.6	-69.5	-16.1	0	0	0	111.9	Q573 H574 I575 L579 K580 L581	Q573-N577 VanDerWaalsContact O-CB 3.31Å; Q573-N577 WeakPolarHBondContact O-CB 3.44Å; Q573-N577 PolarHBondContact O-N 2.85Å; Q573-N577 PolarHBondContact O-ND2 3.24Å; H574-N577 PolarHBondContact O-N 2.82Å; I575-N577 VanDerWaalsContact C-N 3.31Å; I575-N577 PolarHBondContact O-N 3.11Å; N577-L579 VanDerWaalsContact C-N 3.34Å; N577-L579 PolarHBondContact O-N 3.45Å; N577-K580 WeakPolarHBondContact O-CB 3.16Å; N577-K580 PolarHBondContact O-N 3.4Å; N577-L581 WeakPolarHBondContact O-CG 3.35Å; N577-L581 PolarHBondContact O-N 3Å
578	F	39.1	Very low	42.3	Very low	142 Å²	142	113.7 Å²	113.7	62%	0.623	57%	0.573	S	S	*	*	H	α-helix	trans	-61.6	-39.9	171.2	-111.9	-92.1	0	0	0	112.4	H574 I575 K580 L581 G582	H574-F578 WeakPolarHBondContact O-CB 3.4Å; H574-F578 PolarHBondContact O-N 3.45Å; I575-F578 PolarHBondContact O-N 3.47Å; F578-K580 VanDerWaalsContact C-N 3.35Å; F578-L581 PolarHBondContact O-N 3.39Å; F578-G582 PolarHBondContact O-N 3.36Å
579	L	39.7	Very low	40.8	Very low	87 Å²	87	115.9 Å²	115.9	46%	0.455	59%	0.589	S	S	.	*	H	α-helix	trans	-71.5	-27.1	176.6	-70.2	169.1	0	0	0	112.6	I575 N576 N577 N583	I575-L579 HydrophobicContact CG2-CD1 3.98Å; I575-L579 HydrophobicContact CG2-CG 4.44Å; I575-L579 WeakPolarHBondContact O-CB 3.47Å; I575-L579 VanDerWaalsContact O-CG 3.28Å; I575-L579 WeakPolarHBondContact O-CG 3.35Å; I575-L579 PolarHBondContact O-N 3.43Å; N576-L579 PolarHBondContact O-N 3.02Å; N577-L579 VanDerWaalsContact C-N 3.34Å; N577-L579 PolarHBondContact O-N 3.45Å; L579-N583 PolarHBondContact O-ND2 3.07Å
580	K	43.9	Very low	39.8	Very low	146 Å²	146	121.2 Å²	121.2	64%	0.635	62%	0.617	S	S	*	*	H	α-helix	trans	-65.7	-55.5	165.1	-89	-174.7	169.2	-176.6	0	111.4	N576 N577 F578 G582 N583	N576-K580 PolarHBondContact O-N 3.12Å; N577-K580 WeakPolarHBondContact O-CB 3.16Å; N577-K580 PolarHBondContact O-N 3.4Å; F578-K580 VanDerWaalsContact C-N 3.35Å; K580-G582 VanDerWaalsContact C-N 3.26Å; K580-G582 PolarHBondContact O-N 3.06Å; K580-N583 PolarHBondContact O-N 3.41Å
581	L	37.3	Very low	38.6	Very low	95 Å²	95	124 Å²	124	50%	0.497	63%	0.629	S	S	.	*	H	α-helix	trans	-56.1	-39.3	-179.6	-75.8	161	0	0	0	112.4	N577 F578 N583 E584 I585	N577-L581 WeakPolarHBondContact O-CG 3.35Å; N577-L581 PolarHBondContact O-N 3Å; F578-L581 PolarHBondContact O-N 3.39Å; L581-N583 PolarHBondContact O-N 3.18Å; L581-E584 PolarHBondContact O-N 3Å; L581-E584 VanDerWaalsContact O-N 3.09Å; L581-I585 PolarHBondContact O-N 3.35Å
582	G	36	Very low	37.3	Very low	51 Å²	51	128.6 Å²	128.6	53%	0.526	64%	0.642	S	S	.	*	H	α-helix	trans	-61.6	-21.7	176.8	0	0	0	0	0	115.1	F578 K580	F578-G582 PolarHBondContact O-N 3.36Å; K580-G582 VanDerWaalsContact C-N 3.26Å; K580-G582 PolarHBondContact O-N 3.06Å
583	N	36.8	Very low	36.4	Very low	143 Å²	143	132 Å²	132	77%	0.765	67%	0.666	S	S	*	*	H	α-helix	trans	-90	-13.7	176.1	-73.4	-57.1	0	0	0	113.5	L579 K580 L581	L579-N583 PolarHBondContact O-ND2 3.07Å; K580-N583 PolarHBondContact O-N 3.41Å; L581-N583 PolarHBondContact O-N 3.18Å
584	E	35.9	Very low	35.3	Very low	149 Å²	149	132.9 Å²	132.9	70%	0.696	67%	0.672	S	S	*	*	H	α-helix	trans	-91.9	-20.2	180	-66	179.8	158.6	0	0	112.3	L581 K586	L581-E584 PolarHBondContact O-N 3Å; L581-E584 VanDerWaalsContact O-N 3.09Å; E584-K586 PolarHBondContact O-N 3.13Å
585	I	33.4	Very low	34.7	Very low	105 Å²	105	131.9 Å²	131.9	54%	0.538	68%	0.682	S	S	.	*			trans	-79.5	87	178.9	-57.1	168.5	0	0	0	110.6	L581 F587	L581-I585 PolarHBondContact O-N 3.35Å; I585-F587 HydrophobicContact CB-CE2 4.42Å; I585-F587 HydrophobicContact CG2-CD2 3.98Å; I585-F587 HydrophobicContact CG2-CE2 3.58Å; I585-F587 HydrophobicContact CG2-CZ 3.96Å; I585-F587 PolarHBondContact O-N 2.98Å; I585-F587 VanDerWaalsContact O-N 3.14Å
586	K	32.5	Very low	33.9	Very low	199 Å²	199	134.5 Å²	134.5	87%	0.865	71%	0.705	S	S	*	*			trans	-66.4	105.2	167.3	-74.5	178.1	178.1	172.5	0	110.7	E584 P588	E584-K586 PolarHBondContact O-N 3.13Å; K586-P588 VanDerWaalsContact O-CD 3.27Å; K586-P588 WeakPolarHBondContact O-CD 3.26Å
587	F	30.6	Very low	33.2	Very low	182 Å²	182	135.6 Å²	135.6	80%	0.798	72%	0.719	S	S	*	*			trans	-78.2	115.5	164.3	-73	-88	0	0	0	110.6	I585	I585-F587 HydrophobicContact CB-CE2 4.42Å; I585-F587 HydrophobicContact CG2-CD2 3.98Å; I585-F587 HydrophobicContact CG2-CE2 3.58Å; I585-F587 HydrophobicContact CG2-CZ 3.96Å; I585-F587 PolarHBondContact O-N 2.98Å; I585-F587 VanDerWaalsContact O-N 3.14Å
588	P	29.3	Very low	32.7	Very low	104 Å²	104	138 Å²	138	68%	0.675	73%	0.731	S	S	*	*			trans	-73.7	169.4	168.4	32.4	-34.6	0	0	0	111.5	K586	K586-P588 VanDerWaalsContact O-CD 3.27Å; K586-P588 WeakPolarHBondContact O-CD 3.26Å
589	N	29.2	Very low	32.5	Very low	158 Å²	158	138.3 Å²	138.3	85%	0.845	74%	0.735	S	S	*	*	S	Bend	trans	83.9	17.5	171.8	-51.3	-18.6	0	0	0	118.8
590	L	30.8	Very low	32.2	Very low	174 Å²	174	142.3 Å²	142.3	91%	0.911	75%	0.751	S	S	*	*			trans	-130.2	45.1	168.7	-86.9	172.5	0	0	0	114.1
591	K	29.9	Very low	31.9	Very low	196 Å²	196	141.6 Å²	141.6	85%	0.852	75%	0.754	S	S	*	*			trans	-145.8	83.3	172	-71.8	-163.7	176.1	-169.6	0	113.5
592	H	30.5	Very low	31.7	Very low	205 Å²	205	143.6 Å²	143.6	95%	0.949	77%	0.765	S	S	*	*			trans	-146.2	61.7	165.4	-91.8	-57.2	0	0	0	113.2
593	S	27.3	Very low	31.8	Very low	108 Å²	108	148.1 Å²	148.1	76%	0.755	78%	0.778	S	S	*	*	S	Bend	trans	-155.8	136.4	154.2	54.7	0	0	0	0	109.5
594	M	25.2	Very low	31.6	Very low	176 Å²	176	149.4 Å²	149.4	87%	0.867	78%	0.779	S	S	*	*	S	Bend	trans	56.2	83.3	174.7	-57.6	-71.6	91.3	0	0	116.7
595	S	27.4	Very low	31.8	Very low	129 Å²	129	145.1 Å²	145.1	90%	0.902	77%	0.769	S	S	*	*			trans	-160.3	101.4	153.7	-77.7	0	0	0	0	111.3
596	S	29.6	Very low	32	Very low	107 Å²	107	149.5 Å²	149.5	75%	0.748	78%	0.784	S	S	*	*			trans	-141.4	117.2	162.7	52	0	0	0	0	105.5
597	S	30	Very low	32.1	Very low	105 Å²	105	143.2 Å²	143.2	73%	0.734	78%	0.776	S	S	*	*				67	116.2	77	-63.4	0	0	0	0	110.9
598	L	32.9	Very low	32.3	Very low	136 Å²	136	140.9 Å²	140.9	71%	0.712	78%	0.776	S	S	*	*			cis	-143.5	177.8	7.9	-70.9	109.8	0	0	0	112.8
599	E	34.7	Very low	32.5	Very low	150 Å²	150	147.2 Å²	147.2	70%	0.701	79%	0.787	S	S	*	*			trans	2.4	151.2	137.4	-63.5	133.7	-145.8	0	0	118.9
600	E	33.2	Very low	32.7	Very low	170 Å²	170	145 Å²	145	79%	0.794	78%	0.781	S	S	*	*			cis	-161.8	-165.9	-4.1	-116.5	173.4	171.2	0	0	109.7
601	D	36.6	Very low	32.7	Very low	131 Å²	131	144.2 Å²	144.2	70%	0.701	78%	0.776	S	S	*	*			trans	69.8	93	161.4	-73.8	-35.6	0	0	0	122.3
602	N	34.5	Very low	32.6	Very low	137 Å²	137	140.3 Å²	140.3	73%	0.733	77%	0.765	S	S	*	*				69.9	157.4	110.4	-70.9	-47.1	0	0	0	124.7
603	D	36.8	Very low	32.5	Very low	147 Å²	147	138 Å²	138	79%	0.786	75%	0.752	S	S	*	*			trans	74.5	83.3	158.1	-62.2	-10.7	0	0	0	123.9
604	E	34.4	Very low	32.6	Very low	170 Å²	170	140.1 Å²	140.1	79%	0.794	76%	0.755	S	S	*	*				77.1	153	117.9	-126.2	-145.5	126.3	0	0	124.4
605	A	39.6	Very low	32.9	Very low	59 Å²	59	140.4 Å²	140.4	49%	0.488	75%	0.754	S	S	.	*			trans	84.6	92.1	145.5	0	0	0	0	0	122.9
606	K	37.5	Very low	33.1	Very low	197 Å²	197	141.7 Å²	141.7	86%	0.857	75%	0.745	S	S	*	*			trans	74.9	141.8	134.9	-56.6	149.9	-168.3	148.1	0	118.4
607	G	34.2	Very low	33.1	Very low	67 Å²	67	142.7 Å²	142.7	69%	0.691	74%	0.742	S	S	*	*			trans	179.9	-21.8	174.3	0	0	0	0	0	121.6
608	T	34.9	Very low	33.2	Very low	132 Å²	132	145.8 Å²	145.8	81%	0.81	75%	0.75	S	S	*	*			trans	49.6	104.5	168.6	46.5	0	0	0	0	121.5
609	R	33.3	Very low	32.9	Very low	238 Å²	238	147 Å²	147	90%	0.898	76%	0.756	S	S	*	*			trans	83.4	154.4	136.3	-63.1	-172.4	178.7	-152.5	-0.5	121
610	P	33.2	Very low	32.7	Very low	112 Å²	112	145.6 Å²	145.6	73%	0.727	76%	0.763	S	S	*	*			trans	-131.2	-149.5	-157.4	40.3	-18	0	0	0	113.7
611	I	30.1	Very low	32.3	Very low	156 Å²	156	144.5 Å²	144.5	80%	0.8	76%	0.762	S	S	*	*			trans	94.1	125.3	172.7	-58.9	169.4	0	0	0	113.7
612	D	29.4	Very low	31.7	Very low	114 Å²	114	144.2 Å²	144.2	61%	0.61	77%	0.765	S	S	*	*			cis	-167.7	174.8	-14	-153.9	-16	0	0	0	111.4
613	F	27.9	Very low	31.4	Very low	158 Å²	158	142.7 Å²	142.7	69%	0.693	77%	0.765	S	S	*	*			trans	63.6	96.1	163.7	-52.9	-63.1	0	0	0	120.3
614	N	28.5	Very low	31.2	Very low	152 Å²	152	142.9 Å²	142.9	81%	0.813	77%	0.766	S	S	*	*				167.7	118.3	103.7	-86.1	-56.4	0	0	0	113.6
615	H	32.2	Very low	30.7	Very low	182 Å²	182	142 Å²	142	84%	0.843	77%	0.766	S	S	*	*			trans	-146.9	128.7	158.1	-108.6	48.8	0	0	0	105.8
616	H	32.5	Very low	30.2	Very low	156 Å²	156	148.4 Å²	148.4	72%	0.722	78%	0.783	S	S	*	*				55.7	100.3	55.5	-92.2	-61.5	0	0	0	114.3
617	D	28.9	Very low	29.8	Very low	128 Å²	128	146.5 Å²	146.5	68%	0.684	78%	0.782	S	S	*	*			trans	32.3	108.5	143.8	-46.4	-50.1	0	0	0	118.4
618	N	31.9	Very low	29.5	Very low	169 Å²	169	149 Å²	149	90%	0.904	79%	0.787	S	S	*	*				-161.4	161.1	128.1	-111.7	-66.7	0	0	0	113.2
619	I	26.8	Very low	29	Very low	162 Å²	162	150.5 Å²	150.5	83%	0.831	79%	0.787	S	S	*	*			trans	-100.2	129	-175.7	-62.8	164	0	0	0	109.8
620	S	29.9	Very low	28.9	Very low	120 Å²	120	145.8 Å²	145.8	84%	0.839	78%	0.78	S	S	*	*			trans	-155.5	160.9	149.8	-160.6	0	0	0	0	112
621	L	25.6	Very low	28.7	Very low	148 Å²	148	148.4 Å²	148.4	78%	0.775	79%	0.788	S	S	*	*			trans	-108.9	171.2	-171.5	-104.3	150.8	0	0	0	111.8
622	T	24.5	Very low	28.6	Very low	125 Å²	125	146 Å²	146	77%	0.767	79%	0.785	S	S	*	*			trans	60.1	107.3	163.5	51	0	0	0	0	119.1
623	S	28.2	Very low	28.5	Very low	104 Å²	104	148.8 Å²	148.8	73%	0.727	80%	0.795	S	S	*	*			trans	-173.4	164.6	130.2	42.1	0	0	0	0	112.1
624	N	30.8	Very low	28.5	Very low	151 Å²	151	148.6 Å²	148.6	81%	0.807	80%	0.8	S	S	*	*			trans	73.8	44.6	158.9	-53.3	-31.2	0	0	0	119.7	F626	N624-F626 PolarHBondContact O-N 2.76Å
625	L	25.9	Very low	28.6	Very low	153 Å²	153	146.9 Å²	146.9	80%	0.801	80%	0.8	S	S	*	*			trans	-86.5	51.5	162.3	-137.3	-179.4	0	0	0	112
626	F	27.7	Very low	28.4	Very low	193 Å²	193	146.2 Å²	146.2	85%	0.846	80%	0.797	S	S	*	*			trans	-156.9	62.5	176.7	-133.8	-78.6	0	0	0	114.2	N624	N624-F626 PolarHBondContact O-N 2.76Å
627	N	29.5	Very low	28.4	Very low	156 Å²	156	147.4 Å²	147.4	83%	0.834	80%	0.802	S	S	*	*			trans	-160.3	166.9	161.4	-111.9	-41	0	0	0	112.4	M629	N627-M629 PolarHBondContact O-N 2.84Å
628	C	27.7	Very low	28.4	Very low	119 Å²	119	148.1 Å²	148.1	80%	0.804	80%	0.801	S	S	*	*			trans	64.3	28	174.7	-62.3	0	0	0	0	117.5	N630	C628-N630 PolarHBondContact O-N 3.49Å
629	M	25.5	Very low	28.2	Very low	164 Å²	164	149.4 Å²	149.4	81%	0.808	79%	0.793	S	S	*	*			trans	-84.4	61.9	144.7	-132.6	-162.5	82	0	0	109.4	N627	N627-M629 PolarHBondContact O-N 2.84Å
630	N	29.3	Very low	28.2	Very low	140 Å²	140	149 Å²	149	75%	0.749	79%	0.787	S	S	*	*			trans	-177.5	99.9	167.7	-96.8	-19.3	0	0	0	109.4	C628	C628-N630 PolarHBondContact O-N 3.49Å
631	N	31	Very low	28.2	Very low	166 Å²	166	150.2 Å²	150.2	89%	0.888	78%	0.78	S	S	*	*			trans	-178.6	113.1	133.9	-93.1	-12.2	0	0	0	108.8
632	S	27	Very low	28.5	Very low	107 Å²	107	150.3 Å²	150.3	75%	0.748	78%	0.776	S	S	*	*			trans	-77.6	179.8	171.3	43.5	0	0	0	0	111.9
633	E	27.6	Very low	28.7	Very low	172 Å²	172	151.7 Å²	151.7	80%	0.804	77%	0.774	S	S	*	*			trans	99.4	152.9	155	-50.7	-153.2	120.9	0	0	120.4
634	L	27.9	Very low	28.8	Very low	154 Å²	154	152.7 Å²	152.7	81%	0.806	77%	0.77	S	S	*	*			trans	65.5	86.8	160	-95.1	64.6	0	0	0	120.9
635	S	31.3	Very low	28.8	Very low	116 Å²	116	154.1 Å²	154.1	81%	0.811	77%	0.772	S	S	*	*				115.6	141	101.1	-156.9	0	0	0	0	118.9
636	H	27.9	Very low	29.2	Very low	167 Å²	167	151.8 Å²	151.8	77%	0.773	77%	0.768	S	S	*	*			trans	-80.8	140.1	166.4	-63.8	-60.1	0	0	0	111.6
637	H	31.9	Very low	29.3	Very low	181 Å²	181	147.3 Å²	147.3	84%	0.838	76%	0.761	S	S	*	*				-155	133	126.6	-107.7	64.8	0	0	0	107.9
638	H	28.3	Very low	29.3	Very low	144 Å²	144	146.5 Å²	146.5	67%	0.667	76%	0.761	S	S	*	*			cis	88.5	100	29.5	-135.7	71.3	0	0	0	114.7
639	R	27.4	Very low	29.4	Very low	195 Å²	195	145.3 Å²	145.3	74%	0.736	76%	0.76	S	S	*	*			trans	71.4	127.2	149.9	-62.5	-176.5	-171.4	174	5.2	122.1
640	H	28.1	Very low	29.8	Very low	153 Å²	153	150.9 Å²	150.9	71%	0.708	78%	0.78	S	S	*	*				80.6	149.7	127.8	-88.7	-118.2	0	0	0	124
641	H	29.3	Very low	29.9	Very low	146 Å²	146	151.5 Å²	151.5	68%	0.676	78%	0.782	S	S	*	*			trans	86.6	139.9	147.1	-83.9	-66.7	0	0	0	123.2
642	H	31	Very low	29.8	Very low	151 Å²	151	150.7 Å²	150.7	70%	0.699	78%	0.776	S	S	*	*			trans	41.4	114.4	160.4	-65.9	-66.3	0	0	0	120.9
643	H	29.5	Very low	30	Very low	154 Å²	154	153.1 Å²	153.1	71%	0.713	78%	0.777	S	S	*	*				74.9	113.8	60.2	-164.3	61.1	0	0	0	114.5
644	L	30	Very low	30.1	Very low	125 Å²	125	152 Å²	152	65%	0.654	78%	0.776	S	S	*	*			trans	72.6	136.2	161.5	-73.2	171.3	0	0	0	121
645	Q	31.6	Very low	30.2	Very low	181 Å²	181	151.9 Å²	151.9	85%	0.846	77%	0.774	S	S	*	*			trans	67.3	148.8	152.6	-74.4	178.5	1.7	0	0	117.7
646	S	33.5	Very low	30.2	Very low	104 Å²	104	154.3 Å²	154.3	73%	0.727	77%	0.772	S	S	*	*			cis	-154.4	155.8	-15.4	-167.8	0	0	0	0	110.8
647	S	29.6	Very low	30.3	Very low	99 Å²	99	153.4 Å²	153.4	69%	0.692	77%	0.771	S	S	*	*			trans	5.2	133.4	159.8	-71.5	0	0	0	0	122.8
648	V	30.3	Very low	30.2	Very low	138 Å²	138	151.2 Å²	151.2	84%	0.836	77%	0.766	S	S	*	*			trans	83.5	147.9	130.5	171.2	0	0	0	0	118.5	K650	V648-K650 PolarHBondContact O-N 2.97Å
649	A	30.7	Very low	30.4	Very low	95 Å²	95	151.8 Å²	151.8	79%	0.785	78%	0.775	S	S	*	*			trans	-51.4	122.4	-178.6	0	0	0	0	0	114.6
650	K	33.7	Very low	30.6	Very low	281 Å²	281	147.9 Å²	147.9	100%	1.222	78%	0.778	S	S	*	*				-139.2	0	124.2	-130.3	-178.2	-176.7	-176.9	0	109.9	V648	V648-K650 PolarHBondContact O-N 2.97Å

Retrieved 650 of 650 residues in 973.8 ms (Link to these results)

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