A0A3Q0KGF2_SCHMA Loading...

FHA domain-containing protein

AlphaFold DB , UniProt , Accession A0A3Q0KGF2, Species SCHMA (Schistosoma mansoni, Blood fluke), Gene n/a, Length 684 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	37.3	Very low	48.7	Very low	240 Å²	240	112 Å²	112	100%	1.182	58%	0.581	S	S	*	*				0	156	0	-67.5	75.7	169.1	0	0	110.1
2	K	39.7	Very low	49.4	Very low	198 Å²	198	106.1 Å²	106.1	86%	0.861	55%	0.548	S	S	*	.			trans	-96.8	108.7	-176.7	-68.7	178.3	-179.6	174.6	0	111.2	I4	K2-I4 PolarHBondContact O-N 3.42Å
3	Q	43.7	Very low	50.5	Low	138 Å²	138	104.4 Å²	104.4	65%	0.645	54%	0.54	S	S	*	.			trans	-84	87.6	-175.1	-170.7	179.9	34.6	0	0	112
4	I	43.5	Very low	51.3	Low	90 Å²	90	103.5 Å²	103.5	46%	0.462	54%	0.535	S	S	.	.			trans	-145.2	85.4	178.4	-46.2	176.7	0	0	0	111.7	K2	K2-I4 PolarHBondContact O-N 3.42Å
5	P	55.9	Low	52	Low	87 Å²	87	101.3 Å²	101.3	57%	0.565	52%	0.522	S	S	*	.	S	Bend	trans	-131.2	-37.3	143.7	3.7	17.6	0	0	0	114.6	A7 L8	P5-A7 PolarHBondContact O-N 3.14Å; P5-L8 PolarHBondContact O-N 3.01Å; P5-L8 VanDerWaalsContact O-N 3.16Å
6	G	47.5	Very low	52.4	Low	46 Å²	46	102.3 Å²	102.3	47%	0.474	52%	0.521	S	S	.	.	H	α-helix	trans	-61.6	-19	-165.8	0	0	0	0	0	116.4	S10	G6-S10 VanDerWaalsContact O-CB 3.29Å; G6-S10 WeakPolarHBondContact O-CB 3.41Å; G6-S10 PolarHBondContact O-N 3.19Å; G6-S10 PolarHBondContact O-OG 3.13Å
7	A	53.7	Low	52.4	Low	58 Å²	58	98.9 Å²	98.9	48%	0.479	50%	0.504	S	S	.	.	H	α-helix	trans	-64.6	-41.6	176.3	0	0	0	0	0	112.6	P5 S10 F11	P5-A7 PolarHBondContact O-N 3.14Å; A7-S10 PolarHBondContact O-OG 2.95Å; A7-F11 PolarHBondContact O-N 2.88Å
8	L	56.5	Low	52.2	Low	76 Å²	76	102.4 Å²	102.4	40%	0.398	51%	0.51	S	S	.	.	H	α-helix	trans	-74	-41.3	178.8	-69.2	171.6	0	0	0	111.6	P5 S10 F11 F12 C620	P5-L8 PolarHBondContact O-N 3.01Å; P5-L8 VanDerWaalsContact O-N 3.16Å; L8-S10 VanDerWaalsContact C-N 3.33Å; L8-S10 PolarHBondContact O-N 3.01Å; L8-F11 WeakPolarHBondContact O-CB 2.93Å; L8-F11 PolarHBondContact O-N 3.03Å; L8-F11 VanDerWaalsContact O-N 3.17Å; L8-F12 PolarHBondContact O-N 3.04Å; L8-C620 HydrophobicContact CD1-CB 3.99Å
9	W	49.6	Very low	52.3	Low	153 Å²	153	104.7 Å²	104.7	58%	0.58	52%	0.517	S	S	*	.	H	α-helix	trans	-62.5	-40.7	176.5	-135.2	69.7	0	0	0	111.7	F11 F12 L13	W9-F11 PolarHBondContact O-N 2.84Å; W9-F12 WeakPolarHBondContact O-CB 3.38Å; W9-F12 PolarHBondContact O-N 2.62Å; W9-L13 PolarHBondContact O-N 3.07Å
10	S	48.5	Very low	51.9	Low	42 Å²	42	104.5 Å²	104.5	29%	0.294	52%	0.517	S	S	.	.	H	α-helix	trans	-65.4	-35.6	174.4	72.6	0	0	0	0	113.1	G6 A7 L8 L14	G6-S10 VanDerWaalsContact O-CB 3.29Å; G6-S10 WeakPolarHBondContact O-CB 3.41Å; G6-S10 PolarHBondContact O-N 3.19Å; G6-S10 PolarHBondContact O-OG 3.13Å; A7-S10 PolarHBondContact O-OG 2.95Å; L8-S10 VanDerWaalsContact C-N 3.33Å; L8-S10 PolarHBondContact O-N 3.01Å; S10-L14 WeakPolarHBondContact O-CB 3.3Å; S10-L14 PolarHBondContact O-N 3.36Å
11	F	59.8	Low	51.6	Low	104 Å²	104	103 Å²	103	46%	0.456	52%	0.517	S	S	.	.	H	α-helix	trans	-66.9	-36.6	172.1	-179.1	-109.3	0	0	0	112.4	A7 L8 W9 L14 Q15	A7-F11 PolarHBondContact O-N 2.88Å; L8-F11 WeakPolarHBondContact O-CB 2.93Å; L8-F11 PolarHBondContact O-N 3.03Å; L8-F11 VanDerWaalsContact O-N 3.17Å; W9-F11 PolarHBondContact O-N 2.84Å; F11-L14 PolarHBondContact O-N 2.76Å; F11-Q15 HydrophobicContact CZ-CG 4.49Å; F11-Q15 PolarHBondContact O-N 3.36Å
12	F	57.2	Low	51.9	Low	41 Å²	41	98.1 Å²	98.1	18%	0.18	49%	0.491	C	S	.	.	H	α-helix	trans	-64.2	-48.9	175.1	-149.9	-111	0	0	0	111.8	L8 W9 L14 Q15 K16 H650	L8-F12 PolarHBondContact O-N 3.04Å; W9-F12 WeakPolarHBondContact O-CB 3.38Å; W9-F12 PolarHBondContact O-N 2.62Å; F12-L14 VanDerWaalsContact C-N 3.27Å; F12-L14 PolarHBondContact O-N 3.18Å; F12-Q15 PolarHBondContact O-N 2.7Å; F12-Q15 VanDerWaalsContact O-N 3.12Å; F12-K16 PolarHBondContact O-N 2.91Å; F12-H650 HydrophobicContact CE2-CB 3.82Å; F12-H650 AromaticContact CE2-CD2 3.4Å; F12-H650 WeakPolarHBondContact CE2-CD2 3.47Å; F12-H650 AromaticContact CE2-CG 3.81Å; F12-H650 HydrophobicContact CZ-CB 4.2Å; F12-H650 AromaticContact CZ-CD2 3.25Å; F12-H650 WeakPolarHBondContact CZ-CD2 3.29Å; F12-H650 AromaticContact CZ-CG 3.76Å; F12-H650 AromaticContact CZ-NE2 3.82Å
13	L	63.1	Low	51.8	Low	84 Å²	84	92.2 Å²	92.2	44%	0.44	48%	0.475	S	S	.	.	H	α-helix	trans	-59.2	-39.8	175.2	-151.7	78.5	0	0	0	111.4	W9 K16 I17	W9-L13 PolarHBondContact O-N 3.07Å; L13-K16 PolarHBondContact O-N 2.62Å; L13-I17 HydrophobicContact CD2-CD1 4.42Å; L13-I17 HydrophobicContact CG-CD1 4.14Å; L13-I17 WeakPolarHBondContact O-CB 3.31Å; L13-I17 VanDerWaalsContact O-CG1 3.29Å; L13-I17 WeakPolarHBondContact O-CG1 3.46Å; L13-I17 PolarHBondContact O-N 2.97Å
14	L	61.6	Low	51.9	Low	92 Å²	92	91.2 Å²	91.2	48%	0.482	48%	0.481	S	S	.	.	H	α-helix	trans	-67.5	-33.8	176.7	-146.7	74.9	0	0	0	112.9	S10 F11 F12 R18 L41	S10-L14 WeakPolarHBondContact O-CB 3.3Å; S10-L14 PolarHBondContact O-N 3.36Å; F11-L14 PolarHBondContact O-N 2.76Å; F12-L14 VanDerWaalsContact C-N 3.27Å; F12-L14 PolarHBondContact O-N 3.18Å; L14-R18 VanDerWaalsContact O-CB 3.23Å; L14-R18 WeakPolarHBondContact O-CB 3.39Å; L14-R18 PolarHBondContact O-N 3.46Å; L14-R18 VanDerWaalsContact O-N 3.15Å; L14-L41 HydrophobicContact CD1-CD1 3.53Å
15	Q	62.1	Low	51.8	Low	71 Å²	71	96.6 Å²	96.6	33%	0.332	50%	0.497	S	S	.	.	H	α-helix	trans	-71.6	-43.9	171.7	-80.6	-158.8	58	0	0	112.5	F11 F12 R18 K19	F11-Q15 HydrophobicContact CZ-CG 4.49Å; F11-Q15 PolarHBondContact O-N 3.36Å; F12-Q15 PolarHBondContact O-N 2.7Å; F12-Q15 VanDerWaalsContact O-N 3.12Å; Q15-R18 WeakPolarHBondContact O-CB 3.36Å; Q15-R18 PolarHBondContact O-N 3.04Å; Q15-R18 VanDerWaalsContact O-N 3.16Å; Q15-K19 PolarHBondContact O-N 2.97Å
16	K	59	Low	50.9	Low	117 Å²	117	98.7 Å²	98.7	51%	0.509	50%	0.503	S	S	.	.	H	α-helix	trans	-60.6	-50.8	179.1	-179.9	53	176.4	147.7	0	110.9	F12 L13 R18 K19 D20	F12-K16 PolarHBondContact O-N 2.91Å; L13-K16 PolarHBondContact O-N 2.62Å; K16-R18 VanDerWaalsContact C-N 3.25Å; K16-R18 PolarHBondContact O-N 2.93Å; K16-K19 PolarHBondContact O-N 3.37Å; K16-D20 WeakPolarHBondContact CD-OD2 3.28Å; K16-D20 WeakPolarHBondContact CE-OD2 3.37Å; K16-D20 VanDerWaalsContact NZ-CG 3.25Å; K16-D20 IonicContact NZ-OD1 2.65Å; K16-D20 PolarHBondContact NZ-OD1 3.16Å; K16-D20 IonicContact NZ-OD2 2.64Å; K16-D20 PolarHBondContact NZ-OD2 3.41Å; K16-D20 WeakPolarHBondContact O-CB 3.28Å; K16-D20 PolarHBondContact O-N 3.46Å
17	I	52.7	Low	50.2	Low	45 Å²	45	102 Å²	102	23%	0.231	52%	0.519	C	S	.	.	H	α-helix	trans	-63.1	-32.1	175.7	-61.8	165.7	0	0	0	111.5	L13 S21 L41	L13-I17 HydrophobicContact CD2-CD1 4.42Å; L13-I17 HydrophobicContact CG-CD1 4.14Å; L13-I17 WeakPolarHBondContact O-CB 3.31Å; L13-I17 VanDerWaalsContact O-CG1 3.29Å; L13-I17 WeakPolarHBondContact O-CG1 3.46Å; L13-I17 PolarHBondContact O-N 2.97Å; I17-S21 VanDerWaalsContact O-CB 3.26Å; I17-S21 WeakPolarHBondContact O-CB 3.31Å; I17-S21 PolarHBondContact O-N 3.26Å; I17-S21 PolarHBondContact O-OG 3.03Å; I17-L41 HydrophobicContact CB-CD2 4.44Å; I17-L41 HydrophobicContact CD1-CD2 3.79Å; I17-L41 HydrophobicContact CG2-CD2 3.78Å
18	R	48	Very low	49.4	Very low	162 Å²	162	102.9 Å²	102.9	61%	0.611	52%	0.522	S	S	*	.	H	α-helix	trans	-66.6	-46.9	174.4	-173.6	176	-176.3	126.4	2.4	112.1	L14 Q15 K16 S21 Q22	L14-R18 VanDerWaalsContact O-CB 3.23Å; L14-R18 WeakPolarHBondContact O-CB 3.39Å; L14-R18 PolarHBondContact O-N 3.46Å; L14-R18 VanDerWaalsContact O-N 3.15Å; Q15-R18 WeakPolarHBondContact O-CB 3.36Å; Q15-R18 PolarHBondContact O-N 3.04Å; Q15-R18 VanDerWaalsContact O-N 3.16Å; K16-R18 VanDerWaalsContact C-N 3.25Å; K16-R18 PolarHBondContact O-N 2.93Å; R18-S21 PolarHBondContact O-N 2.94Å; R18-S21 PolarHBondContact O-OG 3.29Å; R18-Q22 WeakPolarHBondContact O-CG 3.43Å; R18-Q22 PolarHBondContact O-N 3.36Å
19	K	54	Low	48.6	Very low	146 Å²	146	105.5 Å²	105.5	64%	0.635	54%	0.543	S	S	*	.	H	α-helix	trans	-58.6	-49	172.6	-85	-173	171.9	-177.6	0	111	Q15 K16 S21 Q22	Q15-K19 PolarHBondContact O-N 2.97Å; K16-K19 PolarHBondContact O-N 3.37Å; K19-S21 PolarHBondContact O-N 3.46Å; K19-Q22 PolarHBondContact O-N 3.42Å
20	D	44.6	Very low	48.3	Very low	100 Å²	100	103.4 Å²	103.4	54%	0.535	55%	0.547	S	S	.	.	H	α-helix	trans	-69	-16.6	-177.4	-59.4	-15.2	0	0	0	112.9	K16	K16-D20 WeakPolarHBondContact CD-OD2 3.28Å; K16-D20 WeakPolarHBondContact CE-OD2 3.37Å; K16-D20 VanDerWaalsContact NZ-CG 3.25Å; K16-D20 IonicContact NZ-OD1 2.65Å; K16-D20 PolarHBondContact NZ-OD1 3.16Å; K16-D20 IonicContact NZ-OD2 2.64Å; K16-D20 PolarHBondContact NZ-OD2 3.41Å; K16-D20 WeakPolarHBondContact O-CB 3.28Å; K16-D20 PolarHBondContact O-N 3.46Å
21	S	46.1	Very low	47.9	Very low	74 Å²	74	113.5 Å²	113.5	52%	0.517	58%	0.579	S	S	.	*	H	α-helix	trans	-84.6	-14.1	170.4	72.5	0	0	0	0	114.3	I17 R18 K19 S23	I17-S21 VanDerWaalsContact O-CB 3.26Å; I17-S21 WeakPolarHBondContact O-CB 3.31Å; I17-S21 PolarHBondContact O-N 3.26Å; I17-S21 PolarHBondContact O-OG 3.03Å; R18-S21 PolarHBondContact O-N 2.94Å; R18-S21 PolarHBondContact O-OG 3.29Å; K19-S21 PolarHBondContact O-N 3.46Å; S21-S23 VanDerWaalsContact C-N 3.28Å; S21-S23 PolarHBondContact O-N 2.98Å; S21-S23 VanDerWaalsContact O-N 3.13Å
22	Q	43	Very low	46.8	Very low	136 Å²	136	112.7 Å²	112.7	64%	0.636	58%	0.579	S	S	*	*			trans	-88.8	66.6	177.7	-69.2	-177	-100.1	0	0	110.5	R18 K19	R18-Q22 WeakPolarHBondContact O-CG 3.43Å; R18-Q22 PolarHBondContact O-N 3.36Å; K19-Q22 PolarHBondContact O-N 3.42Å
23	S	37.6	Very low	46	Very low	75 Å²	75	114.5 Å²	114.5	52%	0.524	60%	0.595	S	S	.	*			trans	-55.5	136.4	163.8	177.5	0	0	0	0	109.5	S21 Y25	S21-S23 VanDerWaalsContact C-N 3.28Å; S21-S23 PolarHBondContact O-N 2.98Å; S21-S23 VanDerWaalsContact O-N 3.13Å; S23-Y25 PolarHBondContact O-N 2.84Å
24	P	44.8	Very low	45.2	Very low	116 Å²	116	113.5 Å²	113.5	75%	0.753	60%	0.599	S	S	*	*	T	Hydrogen-bonded Turn	trans	-70.1	10	-172.4	28.4	-35.6	0	0	0	115.1
25	Y	43.1	Very low	44.4	Very low	204 Å²	204	118 Å²	118	80%	0.8	62%	0.615	S	S	*	*	T	Hydrogen-bonded Turn	trans	-110.6	-8.7	-172.2	-68.3	-76	0	0	0	115.7	S23	S23-Y25 PolarHBondContact O-N 2.84Å
26	D	36.8	Very low	43.6	Very low	131 Å²	131	117.7 Å²	117.7	70%	0.701	62%	0.62	S	S	*	*			trans	-109.4	95.4	-178.1	-164	-10.6	0	0	0	112.9	S28	D26-S28 VanDerWaalsContact C-N 3.29Å; D26-S28 PolarHBondContact O-N 2.64Å; D26-S28 VanDerWaalsContact O-N 3.08Å
27	S	33	Very low	43	Very low	116 Å²	116	116.4 Å²	116.4	81%	0.811	61%	0.614	S	S	*	*			trans	-83.1	59.3	179.6	-66.6	0	0	0	0	112.8
28	S	35.9	Very low	43	Very low	76 Å²	76	116.4 Å²	116.4	53%	0.531	62%	0.616	S	S	.	*			trans	-153.1	102.3	175.1	-87.9	0	0	0	0	114.5	D26 T30	D26-S28 VanDerWaalsContact C-N 3.29Å; D26-S28 PolarHBondContact O-N 2.64Å; D26-S28 VanDerWaalsContact O-N 3.08Å; S28-T30 PolarHBondContact O-N 2.92Å
29	P	40.6	Very low	42.9	Very low	131 Å²	131	110.5 Å²	110.5	85%	0.851	61%	0.606	S	S	*	*			trans	-77.9	66.9	177.9	33.8	-36.2	0	0	0	111.9	R31	P29-R31 PolarHBondContact O-N 3.45Å; P29-R31 VanDerWaalsContact O-N 3.08Å
30	T	42.4	Very low	42.9	Very low	109 Å²	109	110.1 Å²	110.1	67%	0.669	60%	0.604	S	S	*	*			trans	-64	110.7	176	51.5	0	0	0	0	110.4	S28 L32	S28-T30 PolarHBondContact O-N 2.92Å; T30-L32 PolarHBondContact O-N 3.28Å
31	R	39.5	Very low	43.3	Very low	253 Å²	253	107 Å²	107	96%	0.955	59%	0.587	S	S	*	*			trans	-70.2	72.8	177.4	-80.2	-174.7	167.6	-168.6	-0.5	111.4	P29	P29-R31 PolarHBondContact O-N 3.45Å; P29-R31 VanDerWaalsContact O-N 3.08Å
32	L	37.4	Very low	43.8	Very low	87 Å²	87	108.5 Å²	108.5	46%	0.455	58%	0.582	S	S	.	*			trans	-63.6	131.8	168.1	-65.5	-178.1	0	0	0	109.8	T30	T30-L32 PolarHBondContact O-N 3.28Å
33	P	40.5	Very low	44.7	Very low	79 Å²	79	107.2 Å²	107.2	51%	0.513	58%	0.579	S	S	.	*			trans	-66.3	145.5	-178.3	25.9	-33.3	0	0	0	111.2	K35 C36	P33-K35 PolarHBondContact O-N 3.35Å; P33-C36 PolarHBondContact O-N 3.03Å
34	A	46.5	Very low	45.6	Very low	64 Å²	64	108.2 Å²	108.2	53%	0.529	58%	0.575	S	S	.	*	T	Hydrogen-bonded Turn	trans	-65.4	7.1	-174.8	0	0	0	0	0	115.7	R71	A34-R71 PolarHBondContact O-NH2 3.45Å
35	K	45.5	Very low	46.2	Very low	186 Å²	186	106 Å²	106	81%	0.809	56%	0.557	S	S	*	*	T	Hydrogen-bonded Turn	trans	-80.7	-50.2	164.7	-61.4	-175.8	-179.8	180	0	110.3	P33 F37	P33-K35 PolarHBondContact O-N 3.35Å; K35-F37 PolarHBondContact O-N 3.08Å
36	C	44.1	Very low	47.1	Very low	65 Å²	65	99 Å²	99	44%	0.439	53%	0.532	S	S	.	.	H	α-helix	trans	-68.6	-32.2	-175.6	-56.2	0	0	0	0	113.6	P33 V38 G39 K40	P33-C36 PolarHBondContact O-N 3.03Å; C36-V38 VanDerWaalsContact C-N 3.26Å; C36-V38 PolarHBondContact O-N 3.48Å; C36-G39 PolarHBondContact O-N 3.16Å; C36-K40 PolarHBondContact O-N 3.11Å
37	F	47.5	Very low	48.1	Very low	89 Å²	89	101.7 Å²	101.7	39%	0.39	54%	0.538	S	S	.	.	H	α-helix	trans	-62	-32.7	-176.5	-143.3	-93.5	0	0	0	112.8	K35 L41	K35-F37 PolarHBondContact O-N 3.08Å; F37-L41 HydrophobicContact CD1-CD1 3.76Å; F37-L41 HydrophobicContact CD1-CG 4.24Å; F37-L41 HydrophobicContact CE1-CD1 4.22Å; F37-L41 HydrophobicContact CE1-CG 4.47Å; F37-L41 WeakPolarHBondContact O-CB 3.44Å; F37-L41 WeakPolarHBondContact O-CG 3.37Å; F37-L41 PolarHBondContact O-N 3.13Å
38	V	52.8	Low	49.2	Very low	46 Å²	46	103.6 Å²	103.6	28%	0.279	53%	0.527	S	S	.	.	H	α-helix	trans	-75.3	-34.3	-179.2	-179.7	0	0	0	0	112.3	C36 Y42	C36-V38 VanDerWaalsContact C-N 3.26Å; C36-V38 PolarHBondContact O-N 3.48Å; V38-Y42 WeakPolarHBondContact O-CB 3.36Å; V38-Y42 PolarHBondContact O-N 2.99Å
39	G	44.5	Very low	49.9	Very low	38 Å²	38	102.5 Å²	102.5	39%	0.392	51%	0.514	S	S	.	.	H	α-helix	trans	-66	-44.5	173	0	0	0	0	0	112.1	C36 Y42 I43	C36-G39 PolarHBondContact O-N 3.16Å; G39-Y42 PolarHBondContact O-N 3.24Å; G39-I43 WeakPolarHBondContact O-CG1 3.45Å; G39-I43 PolarHBondContact O-N 2.98Å
40	K	54.8	Low	50.1	Low	138 Å²	138	102 Å²	102	60%	0.6	50%	0.504	S	S	*	.	H	α-helix	trans	-66.3	-38.3	175.6	-68.4	-168.6	174.1	-170.1	0	112.6	C36 H44	C36-K40 PolarHBondContact O-N 3.11Å; K40-H44 VanDerWaalsContact O-CB 3.27Å; K40-H44 WeakPolarHBondContact O-CB 3.37Å; K40-H44 PolarHBondContact O-N 2.88Å
41	L	53.5	Low	50.4	Low	33 Å²	33	101 Å²	101	17%	0.173	52%	0.516	C	S	.	.	H	α-helix	trans	-59.3	-47.2	170.6	-89.4	163.7	0	0	0	112.4	L14 I17 F37 H44 L45	L14-L41 HydrophobicContact CD1-CD1 3.53Å; I17-L41 HydrophobicContact CB-CD2 4.44Å; I17-L41 HydrophobicContact CD1-CD2 3.79Å; I17-L41 HydrophobicContact CG2-CD2 3.78Å; F37-L41 HydrophobicContact CD1-CD1 3.76Å; F37-L41 HydrophobicContact CD1-CG 4.24Å; F37-L41 HydrophobicContact CE1-CD1 4.22Å; F37-L41 HydrophobicContact CE1-CG 4.47Å; F37-L41 WeakPolarHBondContact O-CB 3.44Å; F37-L41 WeakPolarHBondContact O-CG 3.37Å; F37-L41 PolarHBondContact O-N 3.13Å; L41-H44 PolarHBondContact O-N 3.27Å; L41-L45 VanDerWaalsContact O-CB 3.25Å; L41-L45 WeakPolarHBondContact O-CB 3.33Å; L41-L45 PolarHBondContact O-N 2.97Å
42	Y	56.5	Low	50.9	Low	106 Å²	106	95.6 Å²	95.6	42%	0.416	50%	0.499	S	S	.	.	H	α-helix	trans	-58.6	-50	179.3	176.9	-95.5	0	0	0	111.5	V38 G39 I46 F64	V38-Y42 WeakPolarHBondContact O-CB 3.36Å; V38-Y42 PolarHBondContact O-N 2.99Å; G39-Y42 PolarHBondContact O-N 3.24Å; Y42-I46 HydrophobicContact CD1-CD1 3.94Å; Y42-I46 HydrophobicContact CD2-CD1 3.9Å; Y42-I46 HydrophobicContact CE1-CD1 3.55Å; Y42-I46 HydrophobicContact CE2-CD1 3.52Å; Y42-I46 HydrophobicContact CG-CD1 4.1Å; Y42-I46 WeakPolarHBondContact O-CB 3.08Å; Y42-I46 WeakPolarHBondContact O-CG1 3.43Å; Y42-I46 PolarHBondContact O-N 2.83Å; Y42-I46 VanDerWaalsContact O-N 3.1Å; Y42-F64 HydrophobicContact CD2-CE1 4.4Å; Y42-F64 HydrophobicContact CD2-CE2 4.27Å; Y42-F64 HydrophobicContact CD2-CZ 4.12Å; Y42-F64 HydrophobicContact CE2-CE1 4.29Å; Y42-F64 HydrophobicContact CE2-CZ 4.46Å
43	I	61.5	Low	51.6	Low	109 Å²	109	96.4 Å²	96.4	56%	0.559	51%	0.508	S	S	*	.	H	α-helix	trans	-60.3	-49.9	176.8	-64.3	166.2	0	0	0	110.5	G39 L45 I46 F47	G39-I43 WeakPolarHBondContact O-CG1 3.45Å; G39-I43 PolarHBondContact O-N 2.98Å; I43-L45 PolarHBondContact O-N 3.02Å; I43-I46 PolarHBondContact O-N 3.48Å; I43-F47 VanDerWaalsContact O-CB 3.26Å; I43-F47 WeakPolarHBondContact O-CB 3.35Å; I43-F47 PolarHBondContact O-N 3.23Å
44	H	57.1	Low	51.6	Low	96 Å²	96	96.4 Å²	96.4	44%	0.444	50%	0.502	S	S	.	.	H	α-helix	trans	-68	-34.1	-175.8	-169.9	-92.2	0	0	0	113.2	K40 L41 R48	K40-H44 VanDerWaalsContact O-CB 3.27Å; K40-H44 WeakPolarHBondContact O-CB 3.37Å; K40-H44 PolarHBondContact O-N 2.88Å; L41-H44 PolarHBondContact O-N 3.27Å; H44-R48 WeakPolarHBondContact O-CB 3.18Å; H44-R48 PolarHBondContact O-N 3.35Å; H44-R48 VanDerWaalsContact O-N 3.11Å
45	L	57	Low	51.7	Low	71 Å²	71	100.6 Å²	100.6	37%	0.372	51%	0.508	S	S	.	.	H	α-helix	trans	-70	-44.1	176.9	-161.9	73.9	0	0	0	111	L41 I43 H49	L41-L45 VanDerWaalsContact O-CB 3.25Å; L41-L45 WeakPolarHBondContact O-CB 3.33Å; L41-L45 PolarHBondContact O-N 2.97Å; I43-L45 PolarHBondContact O-N 3.02Å; L45-H49 WeakPolarHBondContact O-CB 3.34Å; L45-H49 PolarHBondContact O-N 3Å
46	I	61.5	Low	51.8	Low	55 Å²	55	94.9 Å²	94.9	28%	0.282	50%	0.503	S	S	.	.	H	α-helix	trans	-66.1	-47.2	177.1	-71.2	174.3	0	0	0	110.9	Y42 I43 R48 N50	Y42-I46 HydrophobicContact CD1-CD1 3.94Å; Y42-I46 HydrophobicContact CD2-CD1 3.9Å; Y42-I46 HydrophobicContact CE1-CD1 3.55Å; Y42-I46 HydrophobicContact CE2-CD1 3.52Å; Y42-I46 HydrophobicContact CG-CD1 4.1Å; Y42-I46 WeakPolarHBondContact O-CB 3.08Å; Y42-I46 WeakPolarHBondContact O-CG1 3.43Å; Y42-I46 PolarHBondContact O-N 2.83Å; Y42-I46 VanDerWaalsContact O-N 3.1Å; I43-I46 PolarHBondContact O-N 3.48Å; I46-R48 VanDerWaalsContact C-N 3.27Å; I46-R48 PolarHBondContact O-N 3.3Å; I46-N50 WeakPolarHBondContact CG2-ND2 3.32Å; I46-N50 WeakPolarHBondContact O-CB 3.39Å; I46-N50 PolarHBondContact O-N 2.91Å
47	F	58.5	Low	51.8	Low	189 Å²	189	97.6 Å²	97.6	83%	0.829	50%	0.504	S	S	*	.	H	α-helix	trans	-69.2	-22.6	-178.5	-147.5	-84.5	0	0	0	113.2	I43	I43-F47 VanDerWaalsContact O-CB 3.26Å; I43-F47 WeakPolarHBondContact O-CB 3.35Å; I43-F47 PolarHBondContact O-N 3.23Å
48	R	55.7	Low	51.8	Low	156 Å²	156	97 Å²	97	59%	0.589	51%	0.51	S	S	*	.	H	α-helix	trans	-94.9	-30.8	178	-162.2	104.7	107.2	178.3	5	113.8	H44 I46	H44-R48 WeakPolarHBondContact O-CB 3.18Å; H44-R48 PolarHBondContact O-N 3.35Å; H44-R48 VanDerWaalsContact O-N 3.11Å; I46-R48 VanDerWaalsContact C-N 3.27Å; I46-R48 PolarHBondContact O-N 3.3Å
49	H	49.9	Very low	51.6	Low	52 Å²	52	97.4 Å²	97.4	24%	0.241	51%	0.512	C	S	.	.	H	α-helix	trans	-119.4	-0.3	-172.7	-64.3	-84	0	0	0	115.9	L45 G51 K52 M54	L45-H49 WeakPolarHBondContact O-CB 3.34Å; L45-H49 PolarHBondContact O-N 3Å; H49-G51 PolarHBondContact O-N 2.92Å; H49-K52 PolarHBondContact O-N 3.25Å; H49-K52 VanDerWaalsContact O-N 3.09Å; H49-M54 VanDerWaalsContact CE1-SD 3.51Å; H49-M54 WeakPolarHBondContact ND1-CG 3.43Å
50	N	44.9	Very low	51.7	Low	120 Å²	120	101.3 Å²	101.3	64%	0.642	52%	0.52	S	S	*	.	T	Hydrogen-bonded Turn	trans	-53.1	127.7	164.9	-91.6	-1.9	0	0	0	110	I46 K52	I46-N50 WeakPolarHBondContact CG2-ND2 3.32Å; I46-N50 WeakPolarHBondContact O-CB 3.39Å; I46-N50 PolarHBondContact O-N 2.91Å; N50-K52 VanDerWaalsContact C-N 3.27Å; N50-K52 PolarHBondContact O-N 3.32Å
51	G	50	Low	51.4	Low	90 Å²	90	100.9 Å²	100.9	93%	0.928	52%	0.524	S	S	*	.	T	Hydrogen-bonded Turn	trans	72.5	7.4	179.7	0	0	0	0	0	115.9	H49	H49-G51 PolarHBondContact O-N 2.92Å
52	K	49.2	Very low	51.3	Low	138 Å²	138	102.9 Å²	102.9	60%	0.6	54%	0.537	S	S	*	.			trans	-115.9	114.7	178	-70.6	-179.9	179.2	174.4	0	111.6	H49 N50 M54	H49-K52 PolarHBondContact O-N 3.25Å; H49-K52 VanDerWaalsContact O-N 3.09Å; N50-K52 VanDerWaalsContact C-N 3.27Å; N50-K52 PolarHBondContact O-N 3.32Å; K52-M54 PolarHBondContact O-N 3.42Å
53	T	52.3	Low	50.6	Low	104 Å²	104	104.7 Å²	104.7	64%	0.638	54%	0.544	S	S	*	.			trans	-62.7	113	170	36	0	0	0	0	110
54	M	40.8	Very low	49.7	Very low	79 Å²	79	102.7 Å²	102.7	39%	0.389	53%	0.531	S	S	.	.	B	Isolated β-bridge	trans	-94.3	114	169.6	-75.4	-72.1	-71.8	0	0	107.3	H49 K52 G56 Y57 V59	H49-M54 VanDerWaalsContact CE1-SD 3.51Å; H49-M54 WeakPolarHBondContact ND1-CG 3.43Å; K52-M54 PolarHBondContact O-N 3.42Å; M54-G56 PolarHBondContact O-N 3.35Å; M54-Y57 PolarHBondContact N-O 3.09Å; M54-Y57 PolarHBondContact O-N 2.95Å; M54-V59 HydrophobicContact CB-CG2 4.3Å; M54-V59 HydrophobicContact CG-CG2 4.38Å
55	F	47	Very low	49.7	Very low	152 Å²	152	106.1 Å²	106.1	67%	0.667	55%	0.545	S	S	*	.	T	Hydrogen-bonded Turn	trans	55.9	45.4	-179.6	-49.1	-74.8	0	0	0	113.6	Y57	F55-Y57 VanDerWaalsContact O-CD2 3.31Å; F55-Y57 WeakPolarHBondContact O-CD2 3.12Å; F55-Y57 PolarHBondContact O-N 2.87Å; F55-Y57 VanDerWaalsContact O-N 3.13Å
56	G	48.2	Very low	49.6	Very low	67 Å²	67	106.7 Å²	106.7	69%	0.691	55%	0.548	S	S	*	.	T	Hydrogen-bonded Turn	trans	78.5	-15.7	175.9	0	0	0	0	0	116.1	M54	M54-G56 PolarHBondContact O-N 3.35Å
57	Y	45	Very low	49.4	Very low	121 Å²	121	107.7 Å²	107.7	48%	0.475	55%	0.554	S	S	.	*	B	Isolated β-bridge	trans	-99.8	146.4	-178.4	-70.2	-83.8	0	0	0	113.2	M54 F55	M54-Y57 PolarHBondContact N-O 3.09Å; M54-Y57 PolarHBondContact O-N 2.95Å; F55-Y57 VanDerWaalsContact O-CD2 3.31Å; F55-Y57 WeakPolarHBondContact O-CD2 3.12Å; F55-Y57 PolarHBondContact O-N 2.87Å; F55-Y57 VanDerWaalsContact O-N 3.13Å
58	P	47.2	Very low	49.9	Very low	78 Å²	78	105.1 Å²	105.1	51%	0.506	54%	0.542	S	S	.	.			trans	-71.6	136.8	167.8	30.4	-33.5	0	0	0	110.6	E60	P58-E60 VanDerWaalsContact C-N 3.26Å; P58-E60 HydrophobicContact CB-CG 4.25Å; P58-E60 HydrophobicContact CG-CG 4.26Å; P58-E60 PolarHBondContact O-N 2.94Å
59	V	47.5	Very low	50.8	Low	53 Å²	53	103.8 Å²	103.8	32%	0.321	54%	0.541	S	S	.	.			trans	-81	72.9	178.5	-172.6	0	0	0	0	110	M54 W63	M54-V59 HydrophobicContact CB-CG2 4.3Å; M54-V59 HydrophobicContact CG-CG2 4.38Å; V59-W63 HydrophobicContact CG1-CZ3 4.26Å
60	E	47.2	Very low	51.1	Low	121 Å²	121	103 Å²	103	57%	0.565	54%	0.543	S	S	*	.			trans	-77	156.3	-179.6	-66.8	-158.9	160.1	0	0	113.9	P58 T62	P58-E60 VanDerWaalsContact C-N 3.26Å; P58-E60 HydrophobicContact CB-CG 4.25Å; P58-E60 HydrophobicContact CG-CG 4.26Å; P58-E60 PolarHBondContact O-N 2.94Å; E60-T62 HydrophobicContact CB-CG2 4.41Å; E60-T62 PolarHBondContact O-N 2.88Å
61	L	48.3	Very low	52	Low	129 Å²	129	101.5 Å²	101.5	68%	0.675	53%	0.528	S	S	*	.	T	Hydrogen-bonded Turn	trans	-67.2	-2.7	-176.6	-77.6	69.9	0	0	0	114.2	W63 F64	L61-W63 PolarHBondContact O-N 2.74Å; L61-F64 PolarHBondContact O-N 3.22Å
62	T	51.3	Low	52.9	Low	74 Å²	74	99.9 Å²	99.9	45%	0.454	51%	0.506	S	S	.	.	H	α-helix	trans	-56.9	-47.9	179.5	54.9	0	0	0	0	111.5	E60 F64 K65 D66	E60-T62 HydrophobicContact CB-CG2 4.41Å; E60-T62 PolarHBondContact O-N 2.88Å; T62-F64 PolarHBondContact O-N 2.67Å; T62-F64 VanDerWaalsContact O-N 3.15Å; T62-K65 WeakPolarHBondContact O-CB 3.34Å; T62-K65 PolarHBondContact O-N 2.8Å; T62-K65 VanDerWaalsContact O-N 3.1Å; T62-D66 PolarHBondContact O-N 3.49Å
63	W	42.1	Very low	53.9	Low	145 Å²	145	99.2 Å²	99.2	55%	0.549	50%	0.503	S	S	.	.	H	α-helix	trans	-60.7	-26.9	179.8	-58.3	-15.6	0	0	0	113.2	V59 L61 D66 L67	V59-W63 HydrophobicContact CG1-CZ3 4.26Å; L61-W63 PolarHBondContact O-N 2.74Å; W63-D66 PolarHBondContact O-N 3.2Å; W63-L67 VanDerWaalsContact O-CB 3.27Å; W63-L67 WeakPolarHBondContact O-CB 3.2Å; W63-L67 PolarHBondContact O-N 3.31Å
64	F	42.3	Very low	54.6	Low	67 Å²	67	98.3 Å²	98.3	29%	0.294	49%	0.493	S	S	.	.	H	α-helix	trans	-74.5	-29.7	178.6	-172.2	-116.9	0	0	0	112.9	Y42 L61 T62 K68	Y42-F64 HydrophobicContact CD2-CE1 4.4Å; Y42-F64 HydrophobicContact CD2-CE2 4.27Å; Y42-F64 HydrophobicContact CD2-CZ 4.12Å; Y42-F64 HydrophobicContact CE2-CE1 4.29Å; Y42-F64 HydrophobicContact CE2-CZ 4.46Å; L61-F64 PolarHBondContact O-N 3.22Å; T62-F64 PolarHBondContact O-N 2.67Å; T62-F64 VanDerWaalsContact O-N 3.15Å; F64-K68 HydrophobicContact CD1-CD 4.46Å; F64-K68 HydrophobicContact CE1-CD 4.04Å; F64-K68 VanDerWaalsContact CE1-CE 3.47Å; F64-K68 HydrophobicContact CE1-CG 4.48Å; F64-K68 HydrophobicContact CZ-CD 4.35Å; F64-K68 HydrophobicContact CZ-CG 4.41Å; F64-K68 WeakPolarHBondContact O-CB 3.22Å; F64-K68 PolarHBondContact O-N 3.04Å
65	K	57.1	Low	55.7	Low	168 Å²	168	100 Å²	100	73%	0.73	50%	0.496	S	S	*	.	H	α-helix	trans	-64.3	-48.1	171.2	-74.1	178.4	175.5	173.5	0	110.2	T62 K68 K69	T62-K65 WeakPolarHBondContact O-CB 3.34Å; T62-K65 PolarHBondContact O-N 2.8Å; T62-K65 VanDerWaalsContact O-N 3.1Å; K65-K68 PolarHBondContact O-N 2.61Å; K65-K69 WeakPolarHBondContact O-CB 3.48Å; K65-K69 PolarHBondContact O-N 2.72Å
66	D	56	Low	56.6	Low	82 Å²	82	96.1 Å²	96.1	44%	0.439	48%	0.48	S	S	.	.	H	α-helix	trans	-70.7	-32.6	178.1	-78.3	-35.2	0	0	0	113	T62 W63 K69 A70	T62-D66 PolarHBondContact O-N 3.49Å; W63-D66 PolarHBondContact O-N 3.2Å; D66-K69 PolarHBondContact O-N 3.03Å; D66-A70 VanDerWaalsContact O-CB 3.24Å; D66-A70 WeakPolarHBondContact O-CB 3.48Å; D66-A70 PolarHBondContact O-N 3.21Å
67	L	58	Low	57.2	Low	77 Å²	77	98.3 Å²	98.3	40%	0.403	47%	0.472	S	S	.	.	H	α-helix	trans	-64.8	-42.4	171.9	-175.9	60.7	0	0	0	111.9	W63 R71	W63-L67 VanDerWaalsContact O-CB 3.27Å; W63-L67 WeakPolarHBondContact O-CB 3.2Å; W63-L67 PolarHBondContact O-N 3.31Å; L67-R71 WeakPolarHBondContact O-CB 3.49Å; L67-R71 PolarHBondContact O-N 3.41Å
68	K	68	Low	57.7	Low	134 Å²	134	100.4 Å²	100.4	58%	0.583	48%	0.479	S	S	*	.	H	α-helix	trans	-60.2	-44.9	171.2	-86.5	-177	170	178.5	0	111.2	F64 K65 R71 A72	F64-K68 HydrophobicContact CD1-CD 4.46Å; F64-K68 HydrophobicContact CE1-CD 4.04Å; F64-K68 VanDerWaalsContact CE1-CE 3.47Å; F64-K68 HydrophobicContact CE1-CG 4.48Å; F64-K68 HydrophobicContact CZ-CD 4.35Å; F64-K68 HydrophobicContact CZ-CG 4.41Å; F64-K68 WeakPolarHBondContact O-CB 3.22Å; F64-K68 PolarHBondContact O-N 3.04Å; K65-K68 PolarHBondContact O-N 2.61Å; K68-R71 PolarHBondContact O-N 2.9Å; K68-A72 WeakPolarHBondContact O-CB 3.49Å; K68-A72 PolarHBondContact O-N 3.18Å
69	K	74	Confident	58.2	Low	129 Å²	129	104.1 Å²	104.1	56%	0.561	48%	0.483	S	S	*	.	H	α-helix	trans	-65.3	-44.4	-179.4	-166.1	177.7	-178.5	-175.1	0	112.5	K65 D66 A72 K73	K65-K69 WeakPolarHBondContact O-CB 3.48Å; K65-K69 PolarHBondContact O-N 2.72Å; D66-K69 PolarHBondContact O-N 3.03Å; K69-A72 PolarHBondContact O-N 3.4Å; K69-K73 WeakPolarHBondContact O-CB 3.43Å; K69-K73 PolarHBondContact O-N 2.97Å
70	A	57.8	Low	58.7	Low	35 Å²	35	107.2 Å²	107.2	29%	0.289	49%	0.494	S	S	.	.	H	α-helix	trans	-66.1	-42.6	175.3	0	0	0	0	0	111.9	D66 K73 M74	D66-A70 VanDerWaalsContact O-CB 3.24Å; D66-A70 WeakPolarHBondContact O-CB 3.48Å; D66-A70 PolarHBondContact O-N 3.21Å; A70-K73 PolarHBondContact O-N 3.23Å; A70-M74 WeakPolarHBondContact O-CB 3.08Å; A70-M74 PolarHBondContact O-N 3.09Å
71	R	63.5	Low	59.1	Low	88 Å²	88	106.8 Å²	106.8	33%	0.332	50%	0.499	S	S	.	.	H	α-helix	trans	-63.5	-40.9	175.3	-168.1	-178.5	-169.3	-156	5.8	111.7	A34 L67 K68 M74 Y75	A34-R71 PolarHBondContact O-NH2 3.45Å; L67-R71 WeakPolarHBondContact O-CB 3.49Å; L67-R71 PolarHBondContact O-N 3.41Å; K68-R71 PolarHBondContact O-N 2.9Å; R71-M74 PolarHBondContact O-N 3.47Å; R71-Y75 HydrophobicContact CG-CD2 3.98Å; R71-Y75 HydrophobicContact CG-CE2 3.66Å; R71-Y75 PolarHBondContact NH2-OH 2.76Å; R71-Y75 WeakPolarHBondContact O-CD2 3.47Å; R71-Y75 PolarHBondContact O-N 2.69Å; R71-Y75 VanDerWaalsContact O-N 3.09Å
72	A	67.9	Low	59.1	Low	57 Å²	57	111.1 Å²	111.1	47%	0.471	51%	0.507	S	S	.	.	H	α-helix	trans	-61.7	-48.1	173.6	0	0	0	0	0	111.3	K68 K69 M74 Y75 E76	K68-A72 WeakPolarHBondContact O-CB 3.49Å; K68-A72 PolarHBondContact O-N 3.18Å; K69-A72 PolarHBondContact O-N 3.4Å; A72-M74 PolarHBondContact O-N 2.64Å; A72-Y75 PolarHBondContact O-N 3.31Å; A72-E76 PolarHBondContact O-N 2.95Å
73	K	70.9	Confident	59	Low	123 Å²	123	117 Å²	117	54%	0.535	52%	0.521	S	S	.	.	H	α-helix	trans	-56.6	-46.6	175.5	-172.1	-176	175.6	-169.8	0	111.9	K69 A70 Y75 E76 E77	K69-K73 WeakPolarHBondContact O-CB 3.43Å; K69-K73 PolarHBondContact O-N 2.97Å; A70-K73 PolarHBondContact O-N 3.23Å; K73-Y75 VanDerWaalsContact C-N 3.33Å; K73-Y75 PolarHBondContact O-N 3.47Å; K73-E76 PolarHBondContact O-N 3.17Å; K73-E77 VanDerWaalsContact O-CB 3.31Å; K73-E77 WeakPolarHBondContact O-CB 3.39Å; K73-E77 PolarHBondContact O-N 3.41Å
74	M	67.2	Low	58.7	Low	86 Å²	86	118.6 Å²	118.6	42%	0.424	53%	0.532	S	S	.	.	H	α-helix	trans	-65.1	-33.2	180	-163.7	-135.7	75.2	0	0	113.1	A70 R71 A72 R78	A70-M74 WeakPolarHBondContact O-CB 3.08Å; A70-M74 PolarHBondContact O-N 3.09Å; R71-M74 PolarHBondContact O-N 3.47Å; A72-M74 PolarHBondContact O-N 2.64Å; M74-R78 WeakPolarHBondContact O-CB 3.2Å; M74-R78 WeakPolarHBondContact O-CG 3.32Å; M74-R78 PolarHBondContact O-N 3.1Å
75	Y	62.9	Low	58.9	Low	113 Å²	113	119.7 Å²	119.7	44%	0.443	55%	0.545	S	S	.	.	H	α-helix	trans	-73.2	-36	172.6	-79.2	-56.7	0	0	0	112.6	R71 A72 K73 R78 R79	R71-Y75 HydrophobicContact CG-CD2 3.98Å; R71-Y75 HydrophobicContact CG-CE2 3.66Å; R71-Y75 PolarHBondContact NH2-OH 2.76Å; R71-Y75 WeakPolarHBondContact O-CD2 3.47Å; R71-Y75 PolarHBondContact O-N 2.69Å; R71-Y75 VanDerWaalsContact O-N 3.09Å; A72-Y75 PolarHBondContact O-N 3.31Å; K73-Y75 VanDerWaalsContact C-N 3.33Å; K73-Y75 PolarHBondContact O-N 3.47Å; Y75-R78 PolarHBondContact O-N 2.86Å; Y75-R79 WeakPolarHBondContact O-CG 3.32Å; Y75-R79 PolarHBondContact O-N 3.02Å
76	E	66.9	Low	58.2	Low	72 Å²	72	116.8 Å²	116.8	34%	0.336	54%	0.544	S	S	.	.	H	α-helix	trans	-73.7	-37.2	178.2	-163.5	52.6	-137.8	0	0	112	A72 K73 R78 R79 Q80	A72-E76 PolarHBondContact O-N 2.95Å; K73-E76 PolarHBondContact O-N 3.17Å; E76-R78 PolarHBondContact O-N 2.91Å; E76-R79 CarbonylContact O-C 3.51Å; E76-R79 WeakPolarHBondContact O-CA 3.33Å; E76-R79 WeakPolarHBondContact O-CB 3.46Å; E76-R79 PolarHBondContact O-N 3.22Å; E76-R79 WeakPolarHBondContact OE2-CD 3.26Å; E76-R79 IonicContact OE2-CZ 3.59Å; E76-R79 IonicContact OE2-NE 3.41Å; E76-R79 IonicContact OE2-NH1 3.82Å; E76-R79 PolarHBondContact OE2-NH1 3.23Å; E76-Q80 WeakPolarHBondContact O-CG 3.25Å; E76-Q80 PolarHBondContact O-N 2.93Å
77	E	59.4	Low	57.4	Low	112 Å²	112	120.6 Å²	120.6	52%	0.523	56%	0.564	S	S	.	*	H	α-helix	trans	-60.8	-43.4	170.3	-170.9	165.4	-159.4	0	0	111.2	K73 R79 Q80 V81	K73-E77 VanDerWaalsContact O-CB 3.31Å; K73-E77 WeakPolarHBondContact O-CB 3.39Å; K73-E77 PolarHBondContact O-N 3.41Å; E77-R79 VanDerWaalsContact C-N 3.28Å; E77-R79 PolarHBondContact O-N 2.99Å; E77-Q80 PolarHBondContact O-N 3.32Å; E77-V81 WeakPolarHBondContact O-CG2 3.31Å; E77-V81 PolarHBondContact O-N 3.45Å
78	R	56.8	Low	56.7	Low	165 Å²	165	125.3 Å²	125.3	62%	0.623	58%	0.584	S	S	*	*	H	α-helix	trans	-65.8	-23.7	170.6	-80	-168.5	176.8	-125.4	-5.9	114.2	M74 Y75 E76 R82	M74-R78 WeakPolarHBondContact O-CB 3.2Å; M74-R78 WeakPolarHBondContact O-CG 3.32Å; M74-R78 PolarHBondContact O-N 3.1Å; Y75-R78 PolarHBondContact O-N 2.86Å; E76-R78 PolarHBondContact O-N 2.91Å; R78-R82 WeakPolarHBondContact O-CB 3.43Å; R78-R82 WeakPolarHBondContact O-CG 3.25Å; R78-R82 PolarHBondContact O-N 3.1Å
79	R	58	Low	55.3	Low	157 Å²	157	130.2 Å²	130.2	59%	0.592	60%	0.599	S	S	*	*	H	α-helix	trans	-76.4	-39.4	171.3	-79.5	166.7	159.2	-174.8	-5.5	111.7	Y75 E76 E77 R82 R83	Y75-R79 WeakPolarHBondContact O-CG 3.32Å; Y75-R79 PolarHBondContact O-N 3.02Å; E76-R79 CarbonylContact O-C 3.51Å; E76-R79 WeakPolarHBondContact O-CA 3.33Å; E76-R79 WeakPolarHBondContact O-CB 3.46Å; E76-R79 PolarHBondContact O-N 3.22Å; E76-R79 WeakPolarHBondContact OE2-CD 3.26Å; E76-R79 IonicContact OE2-CZ 3.59Å; E76-R79 IonicContact OE2-NE 3.41Å; E76-R79 IonicContact OE2-NH1 3.82Å; E76-R79 PolarHBondContact OE2-NH1 3.23Å; E77-R79 VanDerWaalsContact C-N 3.28Å; E77-R79 PolarHBondContact O-N 2.99Å; R79-R82 CarbonylContact O-C 3.58Å; R79-R82 PolarHBondContact O-N 2.97Å; R79-R83 WeakPolarHBondContact O-CB 3.48Å; R79-R83 WeakPolarHBondContact O-CG 3.17Å; R79-R83 PolarHBondContact O-N 3.04Å
80	Q	58.3	Low	53.4	Low	117 Å²	117	127.8 Å²	127.8	55%	0.547	61%	0.61	S	S	.	*	H	α-helix	trans	-66.1	-45.5	177.1	-68.9	175.9	23.4	0	0	111.2	E76 E77 R82 R83	E76-Q80 WeakPolarHBondContact O-CG 3.25Å; E76-Q80 PolarHBondContact O-N 2.93Å; E77-Q80 PolarHBondContact O-N 3.32Å; Q80-R82 PolarHBondContact O-N 2.94Å; Q80-R83 PolarHBondContact O-N 3.27Å
81	V	54.7	Low	52.3	Low	113 Å²	113	136.1 Å²	136.1	69%	0.685	64%	0.64	S	S	*	*	H	α-helix	trans	-61.6	-29.1	173.2	175.7	0	0	0	0	112.3	E77	E77-V81 WeakPolarHBondContact O-CG2 3.31Å; E77-V81 PolarHBondContact O-N 3.45Å
82	R	48.8	Very low	51.2	Low	219 Å²	219	141.9 Å²	141.9	83%	0.826	66%	0.662	S	S	*	*	T	Hydrogen-bonded Turn	trans	-90.6	-0.5	174.4	-74.9	-175	165.1	-149.4	-6.9	115.1	R78 R79 Q80	R78-R82 WeakPolarHBondContact O-CB 3.43Å; R78-R82 WeakPolarHBondContact O-CG 3.25Å; R78-R82 PolarHBondContact O-N 3.1Å; R79-R82 CarbonylContact O-C 3.58Å; R79-R82 PolarHBondContact O-N 2.97Å; Q80-R82 PolarHBondContact O-N 2.94Å
83	R	47.5	Very low	49.7	Very low	199 Å²	199	141 Å²	141	75%	0.751	66%	0.659	S	S	*	*	T	Hydrogen-bonded Turn	trans	-90.3	-9.7	175.3	-89.5	-179	171.4	-150.2	-2.9	113.4	R79 Q80 P85	R79-R83 WeakPolarHBondContact O-CB 3.48Å; R79-R83 WeakPolarHBondContact O-CG 3.17Å; R79-R83 PolarHBondContact O-N 3.04Å; Q80-R83 PolarHBondContact O-N 3.27Å; R83-P85 VanDerWaalsContact O-CD 3.3Å; R83-P85 WeakPolarHBondContact O-CD 3.48Å
84	F	36.5	Very low	48.6	Very low	178 Å²	178	141.3 Å²	141.3	78%	0.781	67%	0.673	S	S	*	*	S	Bend	trans	-92.9	105.2	161.4	-71.8	-82.6	0	0	0	109.2
85	P	46.1	Very low	47.2	Very low	89 Å²	89	144.1 Å²	144.1	58%	0.578	69%	0.685	S	S	*	*			trans	-64.2	152.3	159.9	30.8	-34.1	0	0	0	108.8	R83 N87	R83-P85 VanDerWaalsContact O-CD 3.3Å; R83-P85 WeakPolarHBondContact O-CD 3.48Å; P85-N87 PolarHBondContact O-N 3.28Å
86	P	43.2	Very low	46.3	Very low	107 Å²	107	148.4 Å²	148.4	70%	0.695	71%	0.706	S	S	*	*			trans	-59.3	133.6	162.8	27.7	-33.2	0	0	0	108.1	Q88	P86-Q88 PolarHBondContact O-N 3.27Å
87	N	39.4	Very low	45.1	Very low	162 Å²	162	149.7 Å²	149.7	87%	0.866	72%	0.723	S	S	*	*			trans	-74.5	60.8	-179.5	-95.6	-15.1	0	0	0	111.9	P85 R89	P85-N87 PolarHBondContact O-N 3.28Å; N87-R89 VanDerWaalsContact C-N 3.34Å; N87-R89 PolarHBondContact O-N 2.85Å
88	Q	43.3	Very low	44.4	Very low	176 Å²	176	151.6 Å²	151.6	82%	0.822	74%	0.736	S	S	*	*			trans	-95	58.9	167.3	-68.8	-170.3	-1.7	0	0	110.5	P86	P86-Q88 PolarHBondContact O-N 3.27Å
89	R	38.7	Very low	43.9	Very low	238 Å²	238	149.5 Å²	149.5	90%	0.898	74%	0.743	S	S	*	*	S	Bend	trans	-146.4	130.8	160.3	-107.8	171.6	-172.2	-152.7	-2.4	108.8	N87 F91	N87-R89 VanDerWaalsContact C-N 3.34Å; N87-R89 PolarHBondContact O-N 2.85Å; R89-F91 PolarHBondContact O-N 3.09Å
90	G	33	Very low	43.2	Very low	77 Å²	77	147 Å²	147	79%	0.794	75%	0.75	S	S	*	*			trans	-69	123.4	-158.5	0	0	0	0	0	114.1	R92	G90-R92 VanDerWaalsContact C-N 3.3Å; G90-R92 PolarHBondContact O-N 3.07Å; G90-R92 VanDerWaalsContact O-N 3.07Å
91	F	36.3	Very low	42.5	Very low	211 Å²	211	147.5 Å²	147.5	93%	0.925	76%	0.763	S	S	*	*			trans	-70.3	92.2	150.2	-114.6	-93.2	0	0	0	107.8	R89 G93	R89-F91 PolarHBondContact O-N 3.09Å; F91-G93 PolarHBondContact O-N 2.76Å
92	R	40	Very low	41.6	Very low	208 Å²	208	145.5 Å²	145.5	79%	0.785	77%	0.766	S	S	*	*			trans	-66.2	87.2	152.9	-88.2	-166.6	-179.1	-115.4	8.1	106.9	G90 E95	G90-R92 VanDerWaalsContact C-N 3.3Å; G90-R92 PolarHBondContact O-N 3.07Å; G90-R92 VanDerWaalsContact O-N 3.07Å; R92-E95 IonicContact CZ-OE2 3.16Å; R92-E95 IonicContact NH1-OE2 2.76Å; R92-E95 PolarHBondContact NH1-OE2 2.91Å
93	G	36.1	Very low	41.2	Very low	39 Å²	39	142.9 Å²	142.9	40%	0.402	77%	0.768	S	S	.	*			trans	-59.2	153.6	152.4	0	0	0	0	0	108.8	F91 E95	F91-G93 PolarHBondContact O-N 2.76Å; G93-E95 PolarHBondContact O-N 3.43Å
94	P	47.1	Very low	40.7	Very low	130 Å²	130	144.5 Å²	144.5	84%	0.844	78%	0.776	S	S	*	*			trans	-58.8	124.9	174.4	26	-33.4	0	0	0	108.8	K96	P94-K96 PolarHBondContact O-N 2.93Å
95	E	37.9	Very low	40.9	Very low	144 Å²	144	139.3 Å²	139.3	67%	0.673	77%	0.772	S	S	*	*			trans	-65.1	97.6	-175.2	-74.5	167.8	89.2	0	0	110.3	R92 G93 S97	R92-E95 IonicContact CZ-OE2 3.16Å; R92-E95 IonicContact NH1-OE2 2.76Å; R92-E95 PolarHBondContact NH1-OE2 2.91Å; G93-E95 PolarHBondContact O-N 3.43Å; E95-S97 PolarHBondContact O-N 3.46Å
96	K	45.1	Very low	40.8	Very low	203 Å²	203	142.6 Å²	142.6	88%	0.883	79%	0.785	S	S	*	*			trans	-73.6	77.8	152.1	-70.3	-166.3	178.4	-170.4	0	107.2	P94 I98	P94-K96 PolarHBondContact O-N 2.93Å; K96-I98 PolarHBondContact O-N 3.35Å
97	S	40.7	Very low	40.8	Very low	100 Å²	100	141.2 Å²	141.2	70%	0.699	78%	0.783	S	S	*	*			trans	-56.7	118.8	173.1	37.8	0	0	0	0	109.1	E95 P99	E95-S97 PolarHBondContact O-N 3.46Å; S97-P99 WeakPolarHBondContact O-CD 3.24Å
98	I	45.4	Very low	41	Very low	152 Å²	152	143.9 Å²	143.9	78%	0.779	78%	0.781	S	S	*	*			trans	-69	122.4	170	-60.6	170.9	0	0	0	106.1	K96 S100	K96-I98 PolarHBondContact O-N 3.35Å; I98-S100 PolarHBondContact O-N 2.96Å
99	P	45.9	Very low	40.8	Very low	120 Å²	120	146.3 Å²	146.3	78%	0.779	78%	0.782	S	S	*	*			trans	-72.2	102.3	175.5	28.8	-32.1	0	0	0	109	S97	S97-P99 WeakPolarHBondContact O-CD 3.24Å
100	S	43.9	Very low	40.9	Very low	104 Å²	104	142.1 Å²	142.1	73%	0.727	78%	0.776	S	S	*	*	P	Polyproline II helix	trans	-56.1	148.3	165.3	-71.2	0	0	0	0	110.3	I98	I98-S100 PolarHBondContact O-N 2.96Å
101	P	42.7	Very low	41.2	Very low	129 Å²	129	149.8 Å²	149.8	84%	0.838	78%	0.781	S	S	*	*	P	Polyproline II helix	trans	-63	146.9	-162.2	23.7	-34.6	0	0	0	113.4
102	G	35.3	Very low	41.5	Very low	71 Å²	71	146.7 Å²	146.7	73%	0.732	78%	0.78	S	S	*	*	P	Polyproline II helix	trans	-68.8	144.9	-169.7	0	0	0	0	0	114.1
103	N	40.4	Very low	41.4	Very low	164 Å²	164	140.6 Å²	140.6	88%	0.877	78%	0.781	S	S	*	*			trans	-112.3	102	164	-169.5	19.3	0	0	0	107.6	G105	N103-G105 PolarHBondContact O-N 2.67Å
104	Y	37.8	Very low	41.2	Very low	233 Å²	233	144.5 Å²	144.5	91%	0.914	80%	0.803	S	S	*	*			trans	-76.9	116.3	178.4	-90.6	-95.2	0	0	0	109.5
105	G	40.7	Very low	40.8	Very low	69 Å²	69	143.6 Å²	143.6	71%	0.711	80%	0.799	S	S	*	*			trans	-150.4	128.1	176.9	0	0	0	0	0	111.3	N103	N103-G105 PolarHBondContact O-N 2.67Å
106	D	43.6	Very low	40.8	Very low	157 Å²	157	141.8 Å²	141.8	84%	0.84	80%	0.803	S	S	*	*			trans	-31.8	134.1	-175.5	-90.3	-74.9	0	0	0	119.2
107	A	43.7	Very low	40.6	Very low	79 Å²	79	138 Å²	138	65%	0.653	80%	0.801	S	S	*	*				-165.9	100.6	119	0	0	0	0	0	115.2
108	R	43.1	Very low	40.4	Very low	218 Å²	218	137.3 Å²	137.3	82%	0.823	81%	0.81	S	S	*	*				61.6	136.3	128.7	-73	175.8	-92.8	-153.3	-8.3	122.6
109	R	39.9	Very low	40	Very low	226 Å²	226	133.2 Å²	133.2	85%	0.853	81%	0.806	S	S	*	*			trans	74.7	108.1	160.3	-65.7	179	178.2	-165.6	-1.8	116
110	I	40.1	Very low	39.7	Very low	151 Å²	151	139.9 Å²	139.9	77%	0.774	82%	0.816	S	S	*	*				69.6	85.7	57.5	-53.7	159.9	0	0	0	112.5
111	R	39.4	Very low	39.5	Very low	238 Å²	238	137.9 Å²	137.9	90%	0.898	81%	0.811	S	S	*	*				-166.3	135.5	103.4	-110.4	165.1	-167.2	177	3.1	112.5
112	T	42.2	Very low	39.7	Very low	146 Å²	146	141.5 Å²	141.5	90%	0.896	81%	0.81	S	S	*	*			trans	-76.1	155.9	162.9	42.4	0	0	0	0	110
113	G	37.9	Very low	40.1	Very low	79 Å²	79	148.3 Å²	148.3	81%	0.814	81%	0.814	S	S	*	*			trans	157.2	53.8	176	0	0	0	0	0	116.5
114	S	33	Very low	40.2	Very low	121 Å²	121	147.6 Å²	147.6	85%	0.846	81%	0.81	S	S	*	*			trans	-90.5	116.3	169.6	-57.6	0	0	0	0	110.4
115	S	37.1	Very low	40.5	Very low	111 Å²	111	144 Å²	144	78%	0.776	81%	0.806	S	S	*	*			trans	-170	138.2	151.7	-88.2	0	0	0	0	114.8
116	S	37.9	Very low	40.4	Very low	107 Å²	107	143.7 Å²	143.7	75%	0.748	80%	0.803	S	S	*	*			trans	63.5	135.4	145.6	64	0	0	0	0	123.4
117	S	41.2	Very low	40.3	Very low	122 Å²	122	147.1 Å²	147.1	85%	0.853	80%	0.804	S	S	*	*			trans	87.8	141.9	145.6	81	0	0	0	0	119.8
118	G	37.2	Very low	40.2	Very low	86 Å²	86	148.6 Å²	148.6	89%	0.887	80%	0.801	S	S	*	*			trans	83.1	116.9	178.7	0	0	0	0	0	114.6
119	G	37.4	Very low	39.9	Very low	67 Å²	67	149 Å²	149	69%	0.691	80%	0.802	S	S	*	*			cis	139.8	128.7	-10.5	0	0	0	0	0	112.5
120	R	40.2	Very low	39.8	Very low	259 Å²	259	149 Å²	149	98%	0.977	80%	0.803	S	S	*	*			trans	68.5	148.9	-174.5	-41.7	172.6	-165.7	-136.8	0.4	112.7
121	G	39.3	Very low	39.7	Very low	62 Å²	62	146.4 Å²	146.4	64%	0.639	80%	0.797	S	S	*	*			cis	166.7	157.2	-9	0	0	0	0	0	112.2
122	Y	45.6	Very low	39.9	Very low	206 Å²	206	141.2 Å²	141.2	81%	0.808	79%	0.786	S	S	*	*			trans	81.3	109.7	168.4	-59.9	-69.6	0	0	0	121.4
123	R	43.5	Very low	39.7	Very low	214 Å²	214	140.9 Å²	140.9	81%	0.808	78%	0.779	S	S	*	*			trans	68.7	104.1	138.2	-59.2	176	-174.2	-162.5	1.3	117
124	D	44.3	Very low	39.6	Very low	148 Å²	148	147.4 Å²	147.4	79%	0.791	78%	0.779	S	S	*	*				57.9	97.3	73.8	-74.9	-56	0	0	0	115.1
125	N	43.5	Very low	39.9	Very low	158 Å²	158	153.6 Å²	153.6	85%	0.845	78%	0.784	S	S	*	*			trans	-171.5	112.8	130.3	-99.9	-68.6	0	0	0	106.4
126	G	38.2	Very low	39.8	Very low	62 Å²	62	153.5 Å²	153.5	64%	0.639	78%	0.783	S	S	*	*			cis	103.8	32.4	23.6	0	0	0	0	0	112.3
127	R	41.5	Very low	39.8	Very low	229 Å²	229	156.5 Å²	156.5	86%	0.864	79%	0.79	S	S	*	*			trans	-155.7	125	156.9	-127.6	166.4	-70.7	-170.8	-0.3	115.3
128	D	41.2	Very low	39.6	Very low	110 Å²	110	158 Å²	158	59%	0.588	79%	0.789	S	S	*	*			trans	-37.3	149.8	-179.5	-73.7	-100.1	0	0	0	120.8	R130	D128-R130 PolarHBondContact O-N 2.92Å; D128-R130 VanDerWaalsContact O-N 3.14Å
129	R	38.1	Very low	39.5	Very low	226 Å²	226	166 Å²	166	85%	0.853	79%	0.792	S	S	*	*				43.6	58.7	129.8	-51	173.9	-154.3	-141.7	-0.2	116.5	S131	R129-S131 PolarHBondContact O-N 3.43Å
130	R	36.5	Very low	39.6	Very low	228 Å²	228	174 Å²	174	86%	0.86	80%	0.801	S	S	*	*			trans	-68.5	96.9	156.1	-74	-179.6	174.5	156.8	-0.1	109.3	D128 I132	D128-R130 PolarHBondContact O-N 2.92Å; D128-R130 VanDerWaalsContact O-N 3.14Å; R130-I132 PolarHBondContact O-N 3.44Å; R130-I132 VanDerWaalsContact O-N 3.13Å
131	S	38.2	Very low	39.3	Very low	95 Å²	95	166.3 Å²	166.3	66%	0.664	79%	0.788	S	S	*	*			trans	-60.5	111.6	159.9	47	0	0	0	0	108.2	R129 D133	R129-S131 PolarHBondContact O-N 3.43Å; S131-D133 PolarHBondContact O-N 3.48Å
132	I	43.8	Very low	39.2	Very low	129 Å²	129	171.5 Å²	171.5	66%	0.662	80%	0.797	S	S	*	*			trans	-84.3	65	-179.2	-69.8	164.7	0	0	0	108.8	R130 R134	R130-I132 PolarHBondContact O-N 3.44Å; R130-I132 VanDerWaalsContact O-N 3.13Å; I132-R134 HydrophobicContact CG2-CB 4.01Å; I132-R134 HydrophobicContact CG2-CG 3.85Å; I132-R134 PolarHBondContact O-N 3.28Å
133	D	37.7	Very low	38.6	Very low	139 Å²	139	169.4 Å²	169.4	74%	0.743	80%	0.8	S	S	*	*			trans	-73.3	51.8	166.6	-83.3	-59.4	0	0	0	111.1	S131 R135	S131-D133 PolarHBondContact O-N 3.48Å; D133-R135 PolarHBondContact O-N 2.96Å
134	R	36.9	Very low	38.3	Very low	217 Å²	217	171 Å²	171	82%	0.819	81%	0.806	S	S	*	*			trans	-83.9	52.7	177.4	-74.1	-174.4	-177.4	-171.4	0.5	111.8	I132	I132-R134 HydrophobicContact CG2-CB 4.01Å; I132-R134 HydrophobicContact CG2-CG 3.85Å; I132-R134 PolarHBondContact O-N 3.28Å
135	R	39.3	Very low	37.9	Very low	250 Å²	250	176.1 Å²	176.1	94%	0.943	81%	0.814	S	S	*	*			trans	-135.9	51.1	167.8	-76.8	-167.7	172.4	152.9	-0.1	112.4	D133	D133-R135 PolarHBondContact O-N 2.96Å
136	S	34	Very low	37.4	Very low	109 Å²	109	174 Å²	174	76%	0.762	81%	0.811	S	S	*	*			trans	-137.2	41.5	172.2	-162.5	0	0	0	0	112.4
137	L	38.2	Very low	37.7	Very low	170 Å²	170	177.1 Å²	177.1	89%	0.89	82%	0.818	S	S	*	*			trans	-139.1	58.5	178.1	-75.8	179.4	0	0	0	112.6
138	D	37	Very low	37.3	Very low	155 Å²	155	171.4 Å²	171.4	83%	0.829	81%	0.805	S	S	*	*			trans	-140.3	70.9	157.4	-110.1	-34.8	0	0	0	111.3
139	R	35.5	Very low	36.9	Very low	253 Å²	253	176.2 Å²	176.2	96%	0.955	82%	0.815	S	S	*	*			trans	-135.4	54.9	162.9	-71.1	-163.7	-176	-169.4	3.8	110.8
140	R	39.8	Very low	36.7	Very low	234 Å²	234	176.9 Å²	176.9	88%	0.883	82%	0.818	S	S	*	*			trans	-99.4	139.3	152.9	-67.3	170.4	172.3	164.3	-5.5	105.6
141	S	34.4	Very low	36.5	Very low	99 Å²	99	170.9 Å²	170.9	69%	0.692	81%	0.811	S	S	*	*	S	Bend	cis	-151.9	-178.7	3.5	-166.6	0	0	0	0	109.6
142	M	36.5	Very low	36.5	Very low	171 Å²	171	172.4 Å²	172.4	84%	0.842	82%	0.816	S	S	*	*			trans	69.1	53.8	167.6	-57.3	-59.9	164.4	0	0	117.9
143	D	33.7	Very low	36	Very low	162 Å²	162	173.5 Å²	173.5	87%	0.866	82%	0.818	S	S	*	*			trans	-136.4	77.9	157.4	-121.2	-31.6	0	0	0	110.7
144	R	35.4	Very low	35.7	Very low	246 Å²	246	176.9 Å²	176.9	93%	0.928	82%	0.821	S	S	*	*			trans	-179.7	92.7	167.4	-103.2	164.9	-155.9	-153.8	4.9	110.6
145	R	36.4	Very low	35.4	Very low	256 Å²	256	178 Å²	178	97%	0.966	83%	0.825	S	S	*	*			trans	-140	63.2	161.8	-136.4	174.8	-166.4	168.5	4.2	110.9
146	S	33.4	Very low	35.4	Very low	113 Å²	113	171.5 Å²	171.5	79%	0.79	82%	0.818	S	S	*	*			trans	-125.8	100.7	169.5	-170.4	0	0	0	0	108.5
147	T	43.7	Very low	35.3	Very low	128 Å²	128	173.4 Å²	173.4	79%	0.785	82%	0.824	S	S	*	*			trans	-154.4	83.4	175.3	49.5	0	0	0	0	103.8
148	D	34.5	Very low	35.2	Very low	110 Å²	110	170.5 Å²	170.5	59%	0.588	82%	0.818	S	S	*	*				61.7	123.6	65.8	-156.1	5.9	0	0	0	112.6
149	R	31.8	Very low	35.1	Very low	210 Å²	210	172.2 Å²	172.2	79%	0.792	81%	0.813	S	S	*	*			trans	48.2	88.2	168.1	-81.2	162.5	-98.2	-158.3	-2.7	119.8
150	R	35.2	Very low	35	Very low	240 Å²	240	166.5 Å²	166.5	91%	0.906	81%	0.812	S	S	*	*			trans	-149.3	127.5	137.1	-100.3	-177.1	-179.9	142.3	0.9	106.4
151	S	31.3	Very low	34.9	Very low	102 Å²	102	165.3 Å²	165.3	71%	0.713	81%	0.807	S	S	*	*			cis	57.1	113.4	30.4	-155.3	0	0	0	0	111.5
152	T	39.1	Very low	34.8	Very low	128 Å²	128	165.8 Å²	165.8	79%	0.785	81%	0.81	S	S	*	*			cis	-133	160.7	34.6	50.4	0	0	0	0	114.8
153	E	31.6	Very low	34.9	Very low	151 Å²	151	166.5 Å²	166.5	71%	0.706	81%	0.809	S	S	*	*			trans	-62.2	164.8	160	-164.6	-172.9	-122.1	0	0	112.1
154	R	31.7	Very low	35	Very low	210 Å²	210	164.9 Å²	164.9	79%	0.792	81%	0.805	S	S	*	*			trans	83.1	151.7	165.9	-50	178.8	178.4	-132.5	-6.9	118.5
155	R	32.2	Very low	34.9	Very low	242 Å²	242	156.5 Å²	156.5	91%	0.913	80%	0.795	S	S	*	*			trans	72.1	138.4	-175.2	-62.5	-176.1	169.3	100	-3.6	114.3
156	S	37.9	Very low	34.9	Very low	113 Å²	113	150.1 Å²	150.1	79%	0.79	79%	0.79	S	S	*	*			cis	-128.2	138.8	8.2	-71.1	0	0	0	0	113.2
157	V	32.5	Very low	34.9	Very low	148 Å²	148	149.8 Å²	149.8	90%	0.897	79%	0.788	S	S	*	*			trans	-85.1	118.9	170.6	172.3	0	0	0	0	109.8
158	S	36.7	Very low	34.7	Very low	109 Å²	109	148.1 Å²	148.1	76%	0.762	78%	0.781	S	S	*	*			trans	-177.2	144.5	163.9	-88.9	0	0	0	0	110.5
159	R	33	Very low	34.9	Very low	192 Å²	192	153.5 Å²	153.5	73%	0.725	79%	0.794	S	S	*	*			cis	-160.6	58.8	-10	-171.9	-179.5	169.3	112	-11.2	110.1	R161	R159-R161 PolarHBondContact O-N 3.15Å
160	S	33.7	Very low	35.1	Very low	132 Å²	132	148.8 Å²	148.8	92%	0.923	79%	0.792	S	S	*	*			trans	-74.1	82.6	-179.8	-55	0	0	0	0	112
161	R	39	Very low	35.3	Very low	210 Å²	210	141.5 Å²	141.5	79%	0.792	78%	0.784	S	S	*	*			trans	-90.9	117.8	172.3	-89.2	-170.1	169.3	-168.1	-3.6	111.1	R159	R159-R161 PolarHBondContact O-N 3.15Å
162	S	31.9	Very low	35.5	Very low	108 Å²	108	141.7 Å²	141.7	76%	0.755	79%	0.785	S	S	*	*			trans	-91.3	117.1	171.7	51.7	0	0	0	0	111.9
163	F	38.4	Very low	35.3	Very low	187 Å²	187	142.5 Å²	142.5	82%	0.82	79%	0.785	S	S	*	*			trans	-144.6	107.2	161	-97.5	-99.7	0	0	0	105.1
164	T	35.3	Very low	35.5	Very low	127 Å²	127	140.2 Å²	140.2	78%	0.779	79%	0.785	S	S	*	*				61	132.9	87.5	63.6	0	0	0	0	114.5
165	G	34.7	Very low	35.7	Very low	70 Å²	70	133.6 Å²	133.6	72%	0.722	78%	0.783	S	S	*	*			trans	109.9	82.8	-174.2	0	0	0	0	0	110.6
166	S	34.3	Very low	35.7	Very low	122 Å²	122	133.5 Å²	133.5	85%	0.853	78%	0.782	S	S	*	*			cis	90.3	128.7	49.3	-59.8	0	0	0	0	114
167	S	34	Very low	35.5	Very low	106 Å²	106	133.1 Å²	133.1	74%	0.741	78%	0.78	S	S	*	*			trans	79.3	126.6	154.5	-158.5	0	0	0	0	121.2
168	S	39.9	Very low	35.8	Very low	93 Å²	93	137.2 Å²	137.2	65%	0.65	78%	0.779	S	S	*	*			trans	62.9	151.4	141.7	50.4	0	0	0	0	120.4
169	R	39.2	Very low	35.7	Very low	224 Å²	224	136.6 Å²	136.6	85%	0.845	78%	0.775	S	S	*	*			cis	-155.5	130.2	-7.3	-110.5	159.7	-177.8	-178	-0.5	105.1
170	S	35.7	Very low	35.7	Very low	110 Å²	110	138.5 Å²	138.5	77%	0.769	78%	0.782	S	S	*	*				79.6	147.2	86	-56.2	0	0	0	0	115
171	A	38.6	Very low	35.7	Very low	88 Å²	88	137.1 Å²	137.1	73%	0.727	77%	0.772	S	S	*	*			trans	69.3	136.2	-173.5	0	0	0	0	0	114.2
172	S	36	Very low	35.8	Very low	106 Å²	106	133.5 Å²	133.5	74%	0.741	77%	0.773	S	S	*	*			cis	67.3	145	34.3	90	0	0	0	0	113
173	N	35.8	Very low	35.9	Very low	145 Å²	145	132.6 Å²	132.6	78%	0.775	77%	0.767	S	S	*	*			cis	-152.8	177.3	26.2	-155.8	7	0	0	0	114.4
174	S	35	Very low	35.7	Very low	102 Å²	102	134 Å²	134	71%	0.713	77%	0.767	S	S	*	*			trans	-17.1	145.6	161.4	60.7	0	0	0	0	120.7
175	G	35.3	Very low	35.6	Very low	72 Å²	72	134 Å²	134	74%	0.742	77%	0.766	S	S	*	*			trans	163.6	84.4	159.6	0	0	0	0	0	112.8
176	R	33.4	Very low	35.4	Very low	239 Å²	239	140 Å²	140	90%	0.902	77%	0.767	S	S	*	*				66.9	91.9	74.8	-163.4	-173.8	-168	-155.4	5.7	114.3
177	S	33.8	Very low	35.3	Very low	105 Å²	105	140.9 Å²	140.9	73%	0.734	76%	0.758	S	S	*	*			trans	39	133.3	139.7	-41.4	0	0	0	0	121.1
178	R	37.6	Very low	35.3	Very low	234 Å²	234	141 Å²	141	88%	0.883	76%	0.758	S	S	*	*				-178.1	159.1	113.7	-97.2	153.2	103.7	179.1	5.4	114.3
179	S	35.3	Very low	35.5	Very low	96 Å²	96	144.2 Å²	144.2	67%	0.671	77%	0.767	S	S	*	*			trans	41.5	117.6	151	-59.1	0	0	0	0	120.1
180	R	32.6	Very low	35.8	Very low	233 Å²	233	138.9 Å²	138.9	88%	0.879	76%	0.762	S	S	*	*				77	146.2	63.7	-80.5	-177.4	154	174.5	-6.4	114.2
181	S	35	Very low	35.8	Very low	102 Å²	102	138.8 Å²	138.8	71%	0.713	76%	0.761	S	S	*	*			trans	86.6	119.7	163.8	-48.7	0	0	0	0	113.9
182	V	39.4	Very low	36.2	Very low	134 Å²	134	142 Å²	142	81%	0.812	77%	0.766	S	S	*	*				78.1	124	92.9	165.4	0	0	0	0	111.1
183	S	34.6	Very low	36.8	Very low	90 Å²	90	142.9 Å²	142.9	63%	0.629	77%	0.769	S	S	*	*			cis	-165	164.5	5.8	-121.6	0	0	0	0	114.5
184	R	34.9	Very low	37	Very low	216 Å²	216	139 Å²	139	82%	0.815	76%	0.763	S	S	*	*			trans	52.7	128.1	141.8	-70.3	175.7	171	-174.3	-3.3	121
185	T	32.8	Very low	37.4	Very low	126 Å²	126	141.8 Å²	141.8	77%	0.773	77%	0.77	S	S	*	*			trans	65.3	147.6	136.7	54.7	0	0	0	0	119.9
186	R	31.1	Very low	37.8	Very low	196 Å²	196	143.5 Å²	143.5	74%	0.74	77%	0.771	S	S	*	*			cis	177.2	167.8	-10.2	-177.7	178	-172	-141.6	17.2	105.9
187	H	32.4	Very low	38.6	Very low	142 Å²	142	139.3 Å²	139.3	66%	0.657	76%	0.764	S	S	*	*			trans	85.3	132.8	166.2	-55.8	-73.8	0	0	0	119.6
188	S	33.6	Very low	38.9	Very low	107 Å²	107	142.5 Å²	142.5	75%	0.748	77%	0.767	S	S	*	*			trans	53.4	112	144.3	55.7	0	0	0	0	122.3
189	L	43.8	Very low	39.1	Very low	161 Å²	161	135 Å²	135	84%	0.843	75%	0.754	S	S	*	*				12	151.1	107.1	-59.6	178.5	0	0	0	117.4
190	P	44.8	Very low	39.4	Very low	113 Å²	113	135.5 Å²	135.5	73%	0.734	76%	0.758	S	S	*	*			cis	-155.2	-157.2	42.3	41.1	-17.1	0	0	0	117.5
191	S	36.5	Very low	39.8	Very low	107 Å²	107	133.1 Å²	133.1	75%	0.748	76%	0.757	S	S	*	*			trans	93.2	125.6	151.3	9.7	0	0	0	0	121.9
192	N	46.2	Very low	40.2	Very low	155 Å²	155	133 Å²	133	83%	0.829	76%	0.756	S	S	*	*			trans	-89.7	177.1	160.4	-62.3	-20.8	0	0	0	110.6
193	P	48.3	Very low	40.5	Very low	125 Å²	125	135.5 Å²	135.5	81%	0.812	76%	0.759	S	S	*	*				-130.8	170.2	90.4	25.9	-6.8	0	0	0	112.2
194	G	41.2	Very low	40.5	Very low	63 Å²	63	139.6 Å²	139.6	65%	0.649	77%	0.766	S	S	*	*				103.5	143.3	71.8	0	0	0	0	0	109.1
195	D	43	Very low	40.8	Very low	161 Å²	161	135 Å²	135	86%	0.861	76%	0.758	S	S	*	*			cis	-159.4	178.4	5.3	-82.7	-52.8	0	0	0	111.7
196	S	43.5	Very low	41	Very low	108 Å²	108	132.7 Å²	132.7	76%	0.755	76%	0.759	S	S	*	*			trans	112.4	100.5	140	-151.1	0	0	0	0	121
197	M	49.4	Very low	41.4	Very low	152 Å²	152	132 Å²	132	75%	0.749	76%	0.763	S	S	*	*			trans	78.3	110.2	130.8	-65.1	-67.1	-161.5	0	0	124.1
198	H	41.4	Very low	41.7	Very low	172 Å²	172	129.1 Å²	129.1	80%	0.796	76%	0.764	S	S	*	*				59.6	144.4	125.6	-82.2	-115.7	0	0	0	121.6
199	A	40.3	Very low	41.8	Very low	75 Å²	75	135.1 Å²	135.1	62%	0.62	77%	0.772	S	S	*	*			cis	-158.4	151.5	-2.5	0	0	0	0	0	112.4
200	S	41.7	Very low	41.6	Very low	108 Å²	108	133.9 Å²	133.9	76%	0.755	77%	0.766	S	S	*	*			trans	35.8	145.3	136.7	-36.2	0	0	0	0	121.6
201	E	40.8	Very low	41.2	Very low	182 Å²	182	135 Å²	135	85%	0.85	77%	0.766	S	S	*	*			cis	-143.1	174.4	20.2	-76.2	-173.2	115.9	0	0	114.3
202	S	44.7	Very low	41.2	Very low	100 Å²	100	140.3 Å²	140.3	70%	0.699	77%	0.769	S	S	*	*			trans	60.5	104.6	156.6	49.9	0	0	0	0	123
203	E	44.4	Very low	40.7	Very low	187 Å²	187	144.6 Å²	144.6	87%	0.874	77%	0.774	S	S	*	*				69.8	137.5	125.5	-64.9	174.3	-172.1	0	0	121.5
204	F	36.4	Very low	40	Very low	175 Å²	175	143 Å²	143	77%	0.768	77%	0.771	S	S	*	*			cis	-158.3	138.2	-16.9	175.5	-105	0	0	0	110.5
205	N	39.5	Very low	39.7	Very low	121 Å²	121	145.5 Å²	145.5	65%	0.647	78%	0.779	S	S	*	*			trans	2.6	129.8	168.5	-66.3	-22.5	0	0	0	121.1
206	G	37.3	Very low	39.3	Very low	77 Å²	77	149.7 Å²	149.7	79%	0.794	78%	0.783	S	S	*	*			trans	-166	49.3	173.6	0	0	0	0	0	116.5
207	H	39.7	Very low	39	Very low	181 Å²	181	151.9 Å²	151.9	84%	0.838	79%	0.786	S	S	*	*			trans	-53.2	153.1	170.4	-70.8	-84	0	0	0	112.9
208	A	39.1	Very low	38.6	Very low	82 Å²	82	152.6 Å²	152.6	68%	0.678	79%	0.792	S	S	*	*			cis	-165.2	-178.1	-14.3	0	0	0	0	0	108.7
209	Y	35.2	Very low	38.3	Very low	232 Å²	232	149.5 Å²	149.5	91%	0.91	79%	0.789	S	S	*	*			trans	-55	141.5	173.5	-60.8	-95.6	0	0	0	113.7
210	D	39.7	Very low	38.3	Very low	136 Å²	136	157.2 Å²	157.2	73%	0.727	80%	0.802	S	S	*	*				-153.8	155.7	121.1	-151.2	-15.2	0	0	0	110.9
211	D	36.1	Very low	38.2	Very low	135 Å²	135	163.3 Å²	163.3	72%	0.722	81%	0.809	S	S	*	*			trans	-69.6	140.4	172.1	-85.2	-58.6	0	0	0	111.3
212	R	38.4	Very low	37.8	Very low	219 Å²	219	158.8 Å²	158.8	83%	0.826	80%	0.798	S	S	*	*				-177.2	144.2	109.3	-94.9	142	-132.5	-169.2	7.5	114.9
213	R	34.5	Very low	37.7	Very low	246 Å²	246	163 Å²	163	93%	0.928	81%	0.805	S	S	*	*			trans	-73.5	145.2	170.8	-154.6	177.2	-170.2	-150.3	5.6	110.6
214	A	33.7	Very low	37.4	Very low	90 Å²	90	161.2 Å²	161.2	74%	0.744	80%	0.802	S	S	*	*			trans	86.2	144.4	168.9	0	0	0	0	0	119.2
215	S	34.1	Very low	37.6	Very low	116 Å²	116	156.7 Å²	156.7	81%	0.811	81%	0.805	S	S	*	*			trans	78.4	97.5	164.9	-53.7	0	0	0	0	119.2
216	R	36	Very low	37.5	Very low	250 Å²	250	156.2 Å²	156.2	94%	0.943	81%	0.811	S	S	*	*			trans	-153.3	116.5	134.9	-108.4	167.6	-150.4	154.4	8.8	111.1
217	N	36.3	Very low	37.5	Very low	154 Å²	154	158.1 Å²	158.1	82%	0.824	81%	0.812	S	S	*	*			trans	-95.4	179.8	162.9	-79.9	-40.8	0	0	0	109.2
218	L	42.2	Very low	37.5	Very low	167 Å²	167	154.1 Å²	154.1	87%	0.874	81%	0.805	S	S	*	*			trans	93.1	107.6	155.9	-54	176.3	0	0	0	119.3
219	S	34.2	Very low	37.6	Very low	106 Å²	106	155.6 Å²	155.6	74%	0.741	81%	0.81	S	S	*	*				74.6	109.9	120.5	-162.7	0	0	0	0	120.8
220	R	40.5	Very low	37.7	Very low	237 Å²	237	149.4 Å²	149.4	89%	0.894	80%	0.801	S	S	*	*			trans	176.2	146.6	144.3	-91.1	144.6	-164.7	-117	6.8	107.7
221	R	38.8	Very low	37.7	Very low	236 Å²	236	154.6 Å²	154.6	89%	0.891	81%	0.81	S	S	*	*			cis	-156.8	164.2	-27.4	-145	-179.7	-174.2	-153.2	2.3	107.2
222	S	33.5	Very low	37.9	Very low	88 Å²	88	153.5 Å²	153.5	62%	0.615	81%	0.813	S	S	*	*			trans	-58.3	152.7	179.9	49.3	0	0	0	0	115.7
223	H	42.4	Very low	38.2	Very low	187 Å²	187	147.2 Å²	147.2	87%	0.866	80%	0.803	S	S	*	*			trans	-159.1	149.7	132.3	-102.8	-65.8	0	0	0	112
224	D	37.9	Very low	38.8	Very low	150 Å²	150	143.9 Å²	143.9	80%	0.802	80%	0.798	S	S	*	*			trans	-86.7	170.1	-171.6	-60.6	-91.8	0	0	0	115.1
225	G	40	Very low	38.9	Very low	80 Å²	80	142.5 Å²	142.5	83%	0.825	79%	0.793	S	S	*	*			trans	-173.9	54.2	179	0	0	0	0	0	114.7
226	S	37.6	Very low	39.2	Very low	111 Å²	111	147.6 Å²	147.6	78%	0.776	79%	0.794	S	S	*	*			trans	-81.6	127.7	-172.8	-60.8	0	0	0	0	114.8
227	S	38	Very low	39.5	Very low	117 Å²	117	144.6 Å²	144.6	82%	0.818	79%	0.788	S	S	*	*			trans	-178.1	151.6	149.7	-84.9	0	0	0	0	111.4
228	S	40.3	Very low	39.6	Very low	97 Å²	97	147 Å²	147	68%	0.678	79%	0.785	S	S	*	*			cis	-169.3	166.4	-24.9	55.8	0	0	0	0	109.3
229	S	39.6	Very low	39.5	Very low	113 Å²	113	147.3 Å²	147.3	79%	0.79	78%	0.782	S	S	*	*			trans	71.5	157.8	169.2	80.5	0	0	0	0	119.7
230	S	38.5	Very low	39.7	Very low	103 Å²	103	146 Å²	146	72%	0.72	79%	0.786	S	S	*	*				-174.4	126.8	-57.8	-101.7	0	0	0	0	112.8
231	R	39.4	Very low	39.5	Very low	244 Å²	244	140.3 Å²	140.3	92%	0.921	78%	0.782	S	S	*	*			trans	63.5	165.7	162.2	-62	167.2	158.8	173.9	-9.5	114
232	S	40.7	Very low	39.5	Very low	112 Å²	112	133.3 Å²	133.3	78%	0.783	77%	0.769	S	S	*	*			cis	-153.4	165	4.9	26	0	0	0	0	107.8
233	S	44.2	Very low	39.7	Very low	87 Å²	87	137.8 Å²	137.8	61%	0.608	78%	0.778	S	S	*	*			cis	-162.4	170.9	-10.4	47.5	0	0	0	0	109.3
234	E	46	Very low	39.4	Very low	176 Å²	176	140.2 Å²	140.2	82%	0.822	78%	0.779	S	S	*	*			trans	61.6	148.6	156.6	-71.7	141.9	144.2	0	0	120.9
235	G	37.7	Very low	39.2	Very low	62 Å²	62	145 Å²	145	64%	0.639	79%	0.786	S	S	*	*			cis	-177.9	129	-7.8	0	0	0	0	0	116.8
236	R	39.9	Very low	39.3	Very low	222 Å²	222	147.1 Å²	147.1	84%	0.838	79%	0.788	S	S	*	*			trans	71.8	121.6	140.6	-64.6	178.9	174.9	-162.8	-2.7	120.6
237	K	41.5	Very low	39.3	Very low	187 Å²	187	146.7 Å²	146.7	81%	0.813	79%	0.786	S	S	*	*			trans	79.4	154.1	142.1	-66.2	171	178.5	-175.6	0	119
238	R	39.8	Very low	39.3	Very low	204 Å²	204	147.4 Å²	147.4	77%	0.77	78%	0.78	S	S	*	*			cis	-178.8	147.2	-42	-121.1	-174.4	-177.6	-163.9	2.5	109.3
239	Q	39.8	Very low	39.2	Very low	175 Å²	175	153 Å²	153	82%	0.818	79%	0.786	S	S	*	*			trans	64.6	163.2	157.4	-64.7	161.6	-47.2	0	0	116.4
240	G	36.9	Very low	39.3	Very low	79 Å²	79	155.9 Å²	155.9	81%	0.814	79%	0.793	S	S	*	*			trans	148.7	40.7	-179.6	0	0	0	0	0	116.4
241	S	36.7	Very low	39.2	Very low	117 Å²	117	157.8 Å²	157.8	82%	0.818	80%	0.795	S	S	*	*			trans	-80.1	124.7	178.4	177.3	0	0	0	0	111.9
242	S	39.2	Very low	39.3	Very low	89 Å²	89	154.9 Å²	154.9	62%	0.622	79%	0.792	S	S	*	*			trans	176.1	136.2	132.4	-89.1	0	0	0	0	116.4
243	K	38.3	Very low	39.2	Very low	181 Å²	181	156.8 Å²	156.8	79%	0.787	79%	0.788	S	S	*	*			trans	53.9	130.3	131.5	-64.7	170.9	179.9	166.3	0	121.8
244	R	35	Very low	39	Very low	238 Å²	238	162.3 Å²	162.3	90%	0.898	80%	0.797	S	S	*	*			trans	91.9	135.6	136.8	-78.4	170.9	173	-172.1	-4.2	119.8
245	R	34.9	Very low	38.7	Very low	250 Å²	250	159.1 Å²	159.1	94%	0.943	79%	0.786	S	S	*	*			trans	-48.7	141.6	164.3	-62.7	164.9	165	177.3	-8.1	111.8
246	S	40.4	Very low	39.1	Very low	125 Å²	125	163.8 Å²	163.8	87%	0.874	79%	0.791	S	S	*	*			trans	-131.2	107.7	157.2	43.6	0	0	0	0	109.8
247	S	37.7	Very low	39.1	Very low	103 Å²	103	158.3 Å²	158.3	72%	0.72	79%	0.787	S	S	*	*			trans	-106.1	126.3	160.7	54	0	0	0	0	107.5
248	N	39.5	Very low	39.1	Very low	132 Å²	132	153.1 Å²	153.1	71%	0.706	78%	0.779	S	S	*	*			trans	-168.2	128.7	155.3	-96.8	-13.3	0	0	0	107.7
249	R	37.4	Very low	39.2	Very low	213 Å²	213	150.5 Å²	150.5	80%	0.804	78%	0.78	S	S	*	*				62.2	116.7	83.4	-63.2	-178.2	-165.7	-174.3	1	112.9
250	N	42.9	Very low	39.4	Very low	174 Å²	174	149.8 Å²	149.8	93%	0.93	78%	0.777	S	S	*	*				-131.8	150.7	129.1	-89.3	-17.8	0	0	0	106.8
251	N	34.8	Very low	39.5	Very low	144 Å²	144	152.3 Å²	152.3	77%	0.77	77%	0.772	S	S	*	*			trans	-157.1	115.4	-160.2	166.9	98.2	0	0	0	110.8
252	E	41.6	Very low	39.6	Very low	182 Å²	182	152.3 Å²	152.3	85%	0.85	77%	0.772	S	S	*	*			trans	-170.7	145.8	172.1	-99.5	145.3	-144	0	0	106.3
253	Q	39.2	Very low	39.3	Very low	152 Å²	152	153.4 Å²	153.4	71%	0.71	78%	0.78	S	S	*	*			cis	-165.1	124	-11.1	177.7	178.5	-22.7	0	0	109.6
254	Y	39	Very low	39.7	Very low	203 Å²	203	150.2 Å²	150.2	80%	0.796	78%	0.778	S	S	*	*			trans	64.8	158.5	166.7	-76.8	-129.6	0	0	0	115.9
255	D	41.5	Very low	39.8	Very low	110 Å²	110	145.2 Å²	145.2	59%	0.588	77%	0.769	S	S	*	*			cis	-145.1	174.7	1.7	-144.8	-14.5	0	0	0	113.8
256	Q	44.6	Very low	39.6	Very low	159 Å²	159	143.7 Å²	143.7	74%	0.743	76%	0.764	S	S	*	*			trans	-14.7	153.8	161	-72.1	157.8	78.8	0	0	119.9
257	S	39.7	Very low	39.6	Very low	108 Å²	108	145.6 Å²	145.6	76%	0.755	76%	0.76	S	S	*	*			cis	-174.3	-176	-10.8	55.9	0	0	0	0	110.4
258	A	42.8	Very low	39.7	Very low	78 Å²	78	146.3 Å²	146.3	65%	0.645	76%	0.76	S	S	*	*			trans	78.3	86.3	163.2	0	0	0	0	0	120.6
259	D	42.1	Very low	39.3	Very low	148 Å²	148	151.3 Å²	151.3	79%	0.791	77%	0.768	S	S	*	*				74.5	105.3	111.4	-54.2	-13.5	0	0	0	123.7
260	E	42.7	Very low	39.1	Very low	160 Å²	160	152.4 Å²	152.4	75%	0.748	77%	0.773	S	S	*	*				91.8	120.8	120.4	-72.5	-149.6	169.3	0	0	124
261	N	40.5	Very low	38.7	Very low	132 Å²	132	151.6 Å²	151.6	71%	0.706	77%	0.768	S	S	*	*			trans	69.9	134.2	141.5	-58.8	-27.4	0	0	0	120.7
262	S	37.6	Very low	38.9	Very low	117 Å²	117	153.6 Å²	153.6	82%	0.818	77%	0.773	S	S	*	*			cis	-158.4	165	-20	-165.8	0	0	0	0	109.8
263	S	33.1	Very low	38.4	Very low	113 Å²	113	156.8 Å²	156.8	79%	0.79	78%	0.777	S	S	*	*			trans	-115.4	-176.2	-172.8	-120.5	0	0	0	0	112.9
264	P	46.4	Very low	38.4	Very low	114 Å²	114	156.1 Å²	156.1	74%	0.74	78%	0.783	S	S	*	*			trans	-103.8	179.8	-148.2	42.4	-40.4	0	0	0	115
265	D	37.4	Very low	38.1	Very low	133 Å²	133	151.4 Å²	151.4	71%	0.711	78%	0.78	S	S	*	*			trans	-152.9	164.4	147.8	-154.6	5.9	0	0	0	114.4	Q267	D265-Q267 PolarHBondContact OD2-NE2 3.34Å
266	Y	30.9	Very low	37.8	Very low	217 Å²	217	158 Å²	158	85%	0.851	80%	0.797	S	S	*	*			trans	-123.9	92.5	-173.7	-113.3	-89.2	0	0	0	111.6
267	Q	41.2	Very low	37.1	Very low	166 Å²	166	156 Å²	156	78%	0.776	80%	0.801	S	S	*	*			trans	-133.4	106.2	170.3	-59	-170	32.7	0	0	110.2	D265	D265-Q267 PolarHBondContact OD2-NE2 3.34Å
268	T	38.1	Very low	37.3	Very low	118 Å²	118	156.9 Å²	156.9	72%	0.724	80%	0.804	S	S	*	*				74.7	98.9	71.3	-64.6	0	0	0	0	113.9
269	R	32.3	Very low	36.9	Very low	236 Å²	236	158.1 Å²	158.1	89%	0.891	81%	0.808	S	S	*	*			trans	46.9	128.3	153	-58.4	176.6	-179.7	-143.5	1.8	118.9
270	R	33.7	Very low	36.9	Very low	237 Å²	237	157 Å²	157	89%	0.894	81%	0.805	S	S	*	*				172.8	138.3	93.5	175.4	173.7	-105.7	156.8	-9.4	111.3	Q272	R270-Q272 PolarHBondContact O-N 3.22Å
271	N	32.9	Very low	36.5	Very low	157 Å²	157	153.8 Å²	153.8	84%	0.84	80%	0.801	S	S	*	*			trans	-61.3	132.9	177.9	-52.7	-7.5	0	0	0	111.9
272	Q	39.4	Very low	36.5	Very low	185 Å²	185	154.5 Å²	154.5	86%	0.864	80%	0.8	S	S	*	*			trans	-133.7	146.1	144.3	-71.2	-156	30	0	0	109.7	R270	R270-Q272 PolarHBondContact O-N 3.22Å
273	R	32.4	Very low	36.7	Very low	250 Å²	250	156.9 Å²	156.9	94%	0.943	79%	0.791	S	S	*	*			trans	-98.8	122.2	176.5	-67.3	166.4	161.4	-133.2	1.1	108.6
274	V	38.8	Very low	36.8	Very low	138 Å²	138	158.2 Å²	158.2	84%	0.836	79%	0.789	S	S	*	*			trans	-139.1	132.4	153.3	-173.3	0	0	0	0	108.5
275	S	32.4	Very low	36.6	Very low	104 Å²	104	161 Å²	161	73%	0.727	80%	0.797	S	S	*	*			trans	-77.7	140.8	178.7	49.7	0	0	0	0	112.8
276	R	35.3	Very low	36.5	Very low	248 Å²	248	158.6 Å²	158.6	94%	0.936	80%	0.795	S	S	*	*			trans	-167.6	125.4	146.3	-109.3	157.1	-179	-170.2	-1.9	111.2
277	S	29.4	Very low	36.7	Very low	118 Å²	118	158.9 Å²	158.9	83%	0.825	80%	0.796	S	S	*	*			trans	-97	149.3	167.7	-48.7	0	0	0	0	109.7
278	P	44.2	Very low	36.4	Very low	126 Å²	126	155.9 Å²	155.9	82%	0.818	79%	0.794	S	S	*	*			trans	-94.4	126.5	160.8	33.3	-26.9	0	0	0	111.2
279	S	33.4	Very low	36.2	Very low	104 Å²	104	158.1 Å²	158.1	73%	0.727	80%	0.801	S	S	*	*			trans	-71.5	175.5	148.8	41.4	0	0	0	0	108.9
280	V	42.6	Very low	36.7	Very low	123 Å²	123	151.6 Å²	151.6	75%	0.745	80%	0.798	S	S	*	*			cis	-157.9	157.4	38.8	-147.7	0	0	0	0	111.3
281	S	34.9	Very low	37	Very low	94 Å²	94	146 Å²	146	66%	0.657	79%	0.792	S	S	*	*			trans	38.7	129.7	149.9	59.5	0	0	0	0	119.6
282	E	40.1	Very low	37.3	Very low	146 Å²	146	143 Å²	143	68%	0.682	79%	0.79	S	S	*	*				-171.5	162.9	69.7	-81.5	-169.9	175.7	0	0	110
283	R	41.5	Very low	37.7	Very low	167 Å²	167	140.1 Å²	140.1	63%	0.63	79%	0.787	S	S	*	*			cis	-167	130.7	-26.2	-169.8	-168.2	-80.3	100.7	2.3	107.3
284	N	36.1	Very low	37.8	Very low	141 Å²	141	134.6 Å²	134.6	75%	0.754	78%	0.776	S	S	*	*			trans	66.4	159.5	173.4	-49.3	-27.2	0	0	0	116.3
285	L	42.3	Very low	38.8	Very low	174 Å²	174	134.3 Å²	134.3	91%	0.911	78%	0.777	S	S	*	*			cis	-105.3	170.8	-2.5	-80.8	75.6	0	0	0	111.9
286	A	34.4	Very low	38.9	Very low	81 Å²	81	137.2 Å²	137.2	67%	0.669	78%	0.779	S	S	*	*			trans	-124.3	-170.6	-175.3	0	0	0	0	0	112.5
287	Y	36.3	Very low	39.1	Very low	223 Å²	223	133.8 Å²	133.8	88%	0.875	78%	0.78	S	S	*	*			trans	75.9	138	-179.8	-60.5	-87.3	0	0	0	116
288	S	34.5	Very low	39.6	Very low	103 Å²	103	131.6 Å²	131.6	72%	0.72	78%	0.776	S	S	*	*			cis	-159.8	167.9	-22.7	-135.7	0	0	0	0	111.1
289	N	33.5	Very low	39.1	Very low	165 Å²	165	131.4 Å²	131.4	88%	0.882	78%	0.777	S	S	*	*			trans	-70.7	139.5	168.4	-60.1	-68.2	0	0	0	110.6
290	A	42.8	Very low	39.4	Very low	99 Å²	99	131.2 Å²	131.2	82%	0.818	78%	0.776	S	S	*	*			trans	-138.9	125.5	173.9	0	0	0	0	0	110.6
291	P	39.1	Very low	39.2	Very low	119 Å²	119	133.7 Å²	133.7	77%	0.773	78%	0.784	S	S	*	*			trans	-108.4	145.6	179.5	37.3	-30.3	0	0	0	114.2
292	A	39.9	Very low	39.2	Very low	96 Å²	96	132.8 Å²	132.8	79%	0.793	79%	0.789	S	S	*	*			trans	62.3	167.4	170.4	0	0	0	0	0	115.7
293	P	47.4	Very low	39	Very low	123 Å²	123	134.7 Å²	134.7	80%	0.799	80%	0.796	S	S	*	*				-132.5	159.5	73.5	39	-27.1	0	0	0	115.5
294	N	36.2	Very low	38.8	Very low	135 Å²	135	132.7 Å²	132.7	72%	0.722	79%	0.794	S	S	*	*			trans	-86.1	154	158.1	-81.9	-3.3	0	0	0	109.9
295	P	58.3	Low	38.8	Very low	131 Å²	131	134 Å²	134	85%	0.851	80%	0.795	S	S	*	*			trans	-92.5	100.2	156.6	33.7	-26	0	0	0	110.4
296	E	34.5	Very low	38.5	Very low	166 Å²	166	129.6 Å²	129.6	78%	0.776	78%	0.784	S	S	*	*			trans	-114.5	126.8	157.2	-69.3	-168.4	143.1	0	0	108
297	D	40.8	Very low	38.5	Very low	176 Å²	176	130.7 Å²	130.7	94%	0.941	79%	0.786	S	S	*	*			trans	162.7	138.5	150.8	-92.2	-29	0	0	0	109.3
298	G	38.2	Very low	38.5	Very low	72 Å²	72	126.1 Å²	126.1	74%	0.742	78%	0.782	S	S	*	*			trans	141	53.4	175.6	0	0	0	0	0	117.9
299	S	33.7	Very low	38.4	Very low	121 Å²	121	132.2 Å²	132.2	85%	0.846	79%	0.789	S	S	*	*			trans	5.8	131.5	154.5	-52.1	0	0	0	0	118.5
300	S	41.6	Very low	38.4	Very low	100 Å²	100	132.1 Å²	132.1	70%	0.699	79%	0.788	S	S	*	*				-176	151.3	59.2	72.9	0	0	0	0	113.1
301	L	37.8	Very low	38.1	Very low	176 Å²	176	130.7 Å²	130.7	92%	0.921	78%	0.784	S	S	*	*			trans	50.5	147	148.8	-55.5	170.9	0	0	0	120.6
302	G	35.1	Very low	37.8	Very low	75 Å²	75	130.6 Å²	130.6	77%	0.773	79%	0.786	S	S	*	*			trans	162.8	-22.1	157.8	0	0	0	0	0	122.6
303	F	35.2	Very low	37.8	Very low	185 Å²	185	135.8 Å²	135.8	81%	0.811	79%	0.791	S	S	*	*			trans	55.8	130.6	164.8	-148.2	-119.6	0	0	0	121.5
304	E	37.9	Very low	37.3	Very low	126 Å²	126	135.5 Å²	135.5	59%	0.589	79%	0.792	S	S	*	*			trans	69.2	108.6	151.6	-80.2	-159.3	144.3	0	0	126.8
305	Q	35.1	Very low	36.9	Very low	168 Å²	168	140.9 Å²	140.9	79%	0.785	80%	0.802	S	S	*	*				77.7	157.4	116.7	-81.2	-157.5	72.8	0	0	124.6
306	A	36.2	Very low	35.8	Very low	81 Å²	81	145.6 Å²	145.6	67%	0.669	80%	0.803	S	S	*	*			trans	79.6	61.2	155.4	0	0	0	0	0	121.4
307	S	33.7	Very low	35.6	Very low	104 Å²	104	143.2 Å²	143.2	73%	0.727	80%	0.8	S	S	*	*				58.4	126.2	120.4	67.6	0	0	0	0	123.5
308	V	36.3	Very low	35.5	Very low	128 Å²	128	145.9 Å²	145.9	78%	0.776	80%	0.796	S	S	*	*				66.2	119.6	129.8	176.9	0	0	0	0	117
309	R	34.3	Very low	35.2	Very low	230 Å²	230	150.9 Å²	150.9	87%	0.868	80%	0.8	S	S	*	*				-176.5	164	68.4	-153.4	157.8	166.4	-168.8	-6.1	113.6
310	D	32.9	Very low	35.4	Very low	163 Å²	163	151.3 Å²	151.3	87%	0.872	80%	0.803	S	S	*	*			trans	-65.4	151.6	176.2	-57.7	-91.5	0	0	0	116.5
311	G	36	Very low	35.1	Very low	70 Å²	70	151.5 Å²	151.5	72%	0.722	80%	0.804	S	S	*	*			trans	-148.7	104.1	166.8	0	0	0	0	0	112.4
312	S	34	Very low	35.2	Very low	117 Å²	117	152.5 Å²	152.5	82%	0.818	80%	0.804	S	S	*	*			trans	-92.1	135	-178.3	-180	0	0	0	0	112.4
313	F	38.7	Very low	35.2	Very low	205 Å²	205	156.2 Å²	156.2	90%	0.899	81%	0.807	S	S	*	*			trans	-131.5	144.8	173.2	-85	-76.7	0	0	0	113.8
314	S	36.3	Very low	35.3	Very low	117 Å²	117	152.7 Å²	152.7	82%	0.818	81%	0.805	S	S	*	*			trans	-96.7	162.3	-171.9	-83.1	0	0	0	0	114.2
315	R	29.7	Very low	35.6	Very low	248 Å²	248	151.8 Å²	151.8	94%	0.936	81%	0.813	S	S	*	*			trans	-50.7	145.2	175.4	-52.5	175.2	-174.1	-149.9	-1.7	112.5
316	R	33.5	Very low	35.9	Very low	229 Å²	229	149.5 Å²	149.5	86%	0.864	82%	0.815	S	S	*	*			trans	-139.7	123.1	154.1	-175.5	168.6	-73.5	-162.5	-2.7	110.1
317	T	31.1	Very low	35.9	Very low	117 Å²	117	149.5 Å²	149.5	72%	0.718	82%	0.823	S	S	*	*			trans	-77.4	152.9	169.4	39.1	0	0	0	0	110.7
318	R	38	Very low	36	Very low	231 Å²	231	149.5 Å²	149.5	87%	0.872	83%	0.83	S	S	*	*			trans	-134.4	147.8	159.4	-82.9	-173.3	165.2	169.5	-5.1	109
319	H	32.5	Very low	36.1	Very low	177 Å²	177	148.6 Å²	148.6	82%	0.819	83%	0.829	S	S	*	*			trans	-112.9	142.6	174.4	-58.3	-100.4	0	0	0	107.8
320	S	37.3	Very low	36.5	Very low	130 Å²	130	144.6 Å²	144.6	91%	0.909	83%	0.83	S	S	*	*			trans	-136.7	141.2	163	-60.4	0	0	0	0	107.7
321	S	35.1	Very low	36.7	Very low	104 Å²	104	141.8 Å²	141.8	73%	0.727	83%	0.829	S	S	*	*			trans	-132.1	143.4	-175.6	54.3	0	0	0	0	109.3
322	E	41	Very low	36.8	Very low	197 Å²	197	144 Å²	144	92%	0.921	83%	0.834	S	S	*	*			trans	-148	149.1	165.8	-114.3	135.3	-145.9	0	0	111.2
323	N	34	Very low	37.3	Very low	153 Å²	153	143.5 Å²	143.5	82%	0.818	83%	0.83	S	S	*	*			trans	-121.2	151.9	-169.5	-64.3	-26	0	0	0	110.8
324	S	38.8	Very low	37.2	Very low	111 Å²	111	141.6 Å²	141.6	78%	0.776	83%	0.829	S	S	*	*			trans	-177	119.9	147.9	-84.1	0	0	0	0	107.3
325	S	44	Very low	37.3	Very low	107 Å²	107	139.5 Å²	139.5	75%	0.748	83%	0.827	S	S	*	*				64.1	141.7	78.4	79.2	0	0	0	0	113
326	S	39.9	Very low	37.7	Very low	120 Å²	120	132.6 Å²	132.6	84%	0.839	82%	0.823	S	S	*	*			cis	-170.8	152.3	-14.3	42.7	0	0	0	0	109.1
327	G	37.7	Very low	37.8	Very low	82 Å²	82	130.8 Å²	130.8	85%	0.845	82%	0.821	S	S	*	*			trans	173.2	123.6	170	0	0	0	0	0	113.4
328	A	34.7	Very low	38.2	Very low	104 Å²	104	131 Å²	131	86%	0.86	82%	0.818	S	S	*	*			trans	-153	135.6	-179.8	0	0	0	0	0	112.4
329	S	39	Very low	38.1	Very low	109 Å²	109	125 Å²	125	76%	0.762	81%	0.811	S	S	*	*			trans	-160.2	104.1	167	35.9	0	0	0	0	108.6
330	V	42.1	Very low	38.7	Very low	145 Å²	145	122.5 Å²	122.5	88%	0.879	81%	0.811	S	S	*	*				63.2	109.6	90.6	-59.6	0	0	0	0	116.5
331	A	38	Very low	38.6	Very low	104 Å²	104	126.5 Å²	126.5	86%	0.86	81%	0.806	S	S	*	*			trans	-164.9	134.7	144.8	0	0	0	0	0	109.2
332	S	37.3	Very low	38.9	Very low	118 Å²	118	129.3 Å²	129.3	83%	0.825	81%	0.813	S	S	*	*			trans	-123.9	151.1	-177.6	-60.5	0	0	0	0	111.3
333	S	45.4	Very low	38.7	Very low	106 Å²	106	129.8 Å²	129.8	74%	0.741	81%	0.806	S	S	*	*			trans	-178.5	119.3	132.9	31.5	0	0	0	0	115.7
334	N	36.9	Very low	39	Very low	164 Å²	164	128.6 Å²	128.6	88%	0.877	81%	0.81	S	S	*	*				59.5	140.4	121.7	-50.2	-11.4	0	0	0	123.5
335	G	37.2	Very low	39.1	Very low	74 Å²	74	126.8 Å²	126.8	76%	0.763	81%	0.809	S	S	*	*			trans	90.2	108.5	162.6	0	0	0	0	0	115.3
336	A	37.6	Very low	38.9	Very low	103 Å²	103	133.8 Å²	133.8	85%	0.851	82%	0.819	S	S	*	*			cis	77.5	85	7.5	0	0	0	0	0	118.2
337	F	36.4	Very low	38.9	Very low	191 Å²	191	137.5 Å²	137.5	84%	0.838	82%	0.82	S	S	*	*			trans	-156	114.3	143.3	-158	-111.2	0	0	0	115.2
338	D	39	Very low	38.9	Very low	121 Å²	121	144.8 Å²	144.8	65%	0.647	82%	0.822	S	S	*	*			trans	54.5	167.7	140.1	-142.3	4	0	0	0	124.5
339	S	36.5	Very low	39.3	Very low	104 Å²	104	145 Å²	145	73%	0.727	81%	0.813	S	S	*	*			trans	-163.5	133	176.2	-72.2	0	0	0	0	111.8
340	P	45.7	Very low	39.2	Very low	126 Å²	126	148.5 Å²	148.5	82%	0.818	82%	0.816	S	S	*	*			trans	-114.4	127.9	162.8	24	-7.7	0	0	0	114.3
341	R	33.9	Very low	38.9	Very low	213 Å²	213	146.7 Å²	146.7	80%	0.804	81%	0.81	S	S	*	*			trans	-81.4	137.7	166.8	169.3	-160	-165.2	-175.3	10.1	109.4
342	N	41.6	Very low	39.1	Very low	163 Å²	163	149.8 Å²	149.8	87%	0.872	81%	0.811	S	S	*	*			trans	-138.1	154.9	169.1	-135.1	-31.3	0	0	0	114.7
343	R	36.6	Very low	39.3	Very low	207 Å²	207	149.1 Å²	149.1	78%	0.781	81%	0.806	S	S	*	*			trans	-130.8	112.7	-171.9	-94.1	179.9	163.5	175.9	-5.1	111.2
344	S	41.5	Very low	39.2	Very low	129 Å²	129	149.9 Å²	149.9	90%	0.902	81%	0.808	S	S	*	*			trans	-164.5	159.3	148.4	60.6	0	0	0	0	110.1
345	G	39.8	Very low	39.7	Very low	73 Å²	73	147.7 Å²	147.7	75%	0.753	80%	0.803	S	S	*	*			cis	147.2	43.5	-10	0	0	0	0	0	116.6
346	R	39.6	Very low	39.8	Very low	254 Å²	254	155.2 Å²	155.2	96%	0.958	81%	0.81	S	S	*	*			trans	-141.8	163.6	169.1	-109.3	172.9	-173.5	-154.5	0.4	114
347	K	40.7	Very low	39.9	Very low	197 Å²	197	157.6 Å²	157.6	86%	0.857	81%	0.808	S	S	*	*			trans	-112.5	178.1	-169	-58.4	174.1	179.1	176.3	0	110.7
348	R	37.9	Very low	40.1	Very low	235 Å²	235	156 Å²	156	89%	0.887	81%	0.809	S	S	*	*			trans	86.2	144.5	164.4	-59.6	-168.8	-162.5	-178	6.9	116.1
349	V	42	Very low	40	Very low	110 Å²	110	156 Å²	156	67%	0.667	81%	0.813	S	S	*	*			cis	-163.2	170.5	-41.9	-111.2	0	0	0	0	107.2
350	H	37.1	Very low	40.1	Very low	181 Å²	181	162.7 Å²	162.7	84%	0.838	82%	0.822	S	S	*	*			trans	92.8	151.7	165.4	-52.7	113.6	0	0	0	117.7
351	S	36.6	Very low	39.6	Very low	108 Å²	108	163.8 Å²	163.8	76%	0.755	82%	0.821	S	S	*	*			trans	-135.7	137.4	-163.4	52.2	0	0	0	0	110.4
352	I	41.5	Very low	39.8	Very low	169 Å²	169	165.7 Å²	165.7	87%	0.867	83%	0.828	S	S	*	*			trans	-132.4	143.5	161.2	-76.8	96.6	0	0	0	108.3
353	S	41.1	Very low	39.6	Very low	104 Å²	104	164.5 Å²	164.5	73%	0.727	83%	0.827	S	S	*	*	P	Polyproline II helix	trans	-83.6	159.8	-178.4	-64.2	0	0	0	0	112.6
354	P	43	Very low	40	Very low	121 Å²	121	160.7 Å²	160.7	79%	0.786	83%	0.833	S	S	*	*	P	Polyproline II helix	trans	-72.1	152.6	178.1	30.4	-36	0	0	0	112.8
355	P	49.3	Very low	39.9	Very low	119 Å²	119	164.7 Å²	164.7	77%	0.773	83%	0.833	S	S	*	*	P	Polyproline II helix	trans	-83.6	156	-173.2	33.7	-36.6	0	0	0	114.2
356	Y	37.9	Very low	40.1	Very low	232 Å²	232	165.9 Å²	165.9	91%	0.91	84%	0.837	S	S	*	*			trans	-104.7	144.5	157.4	-111.2	-104.1	0	0	0	108.4
357	N	39.8	Very low	40	Very low	152 Å²	152	161.8 Å²	161.8	81%	0.813	83%	0.826	S	S	*	*			trans	-89.9	133.5	167.9	-87.2	-6.4	0	0	0	109.7
358	D	41.4	Very low	40.2	Very low	159 Å²	159	156.9 Å²	156.9	85%	0.85	82%	0.822	S	S	*	*			trans	-141.9	134	164.3	-142.4	-26.2	0	0	0	107.7
359	V	37.4	Very low	40.1	Very low	121 Å²	121	153.1 Å²	153.1	73%	0.733	81%	0.814	S	S	*	*			trans	-123.4	114.4	-170.3	177.6	0	0	0	0	109.4
360	R	38.6	Very low	40.2	Very low	244 Å²	244	153 Å²	153	92%	0.921	83%	0.825	S	S	*	*			trans	-151.2	134.7	168.9	-113.9	164.3	-175.5	174	1	113.5
361	N	33.4	Very low	40.3	Very low	148 Å²	148	149.4 Å²	149.4	79%	0.791	83%	0.827	S	S	*	*			trans	-63.2	153	-173.3	-51.4	-17.1	0	0	0	113.4
362	R	39.1	Very low	40.8	Very low	253 Å²	253	149 Å²	149	96%	0.955	82%	0.824	S	S	*	*			trans	-154.6	155.5	138.4	-109.3	161.6	-160.5	-147.8	0.9	111.2
363	T	37.6	Very low	40.9	Very low	138 Å²	138	147.6 Å²	147.6	85%	0.847	82%	0.818	S	S	*	*			trans	-114.3	149.1	-166	42.6	0	0	0	0	112.5
364	S	44.4	Very low	40.9	Very low	128 Å²	128	147.2 Å²	147.2	90%	0.895	82%	0.815	S	S	*	*			trans	-159.4	160.2	162.6	46.8	0	0	0	0	109.8
365	K	39	Very low	40.9	Very low	212 Å²	212	148.7 Å²	148.7	92%	0.922	82%	0.817	S	S	*	*			trans	-152.7	115.3	-152.6	176.7	-171.4	177.8	-176.1	0	114.1
366	A	44.1	Very low	40.9	Very low	99 Å²	99	150.8 Å²	150.8	82%	0.818	82%	0.816	S	S	*	*			trans	-171.5	143.1	158.9	0	0	0	0	0	107.7
367	K	38.2	Very low	41.1	Very low	168 Å²	168	146.9 Å²	146.9	73%	0.73	80%	0.804	S	S	*	*			cis	116.9	89.8	3.6	-159.2	-141.5	179.3	-143.6	0	114.6	E369	K367-E369 WeakPolarHBondContact CE-OE1 3.2Å; K367-E369 IonicContact NZ-OE1 2.62Å; K367-E369 PolarHBondContact NZ-OE1 2.99Å; K367-E369 IonicContact NZ-OE2 3.75Å
368	A	44	Very low	41.4	Very low	93 Å²	93	145.5 Å²	145.5	77%	0.769	80%	0.797	S	S	*	*			trans	-170.4	124.5	146.6	0	0	0	0	0	105.8
369	E	36.8	Very low	41.4	Very low	156 Å²	156	146.6 Å²	146.6	73%	0.729	80%	0.796	S	S	*	*				80.7	97.4	51.3	-71.9	179.6	-162.3	0	0	114.8	K367	K367-E369 WeakPolarHBondContact CE-OE1 3.2Å; K367-E369 IonicContact NZ-OE1 2.62Å; K367-E369 PolarHBondContact NZ-OE1 2.99Å; K367-E369 IonicContact NZ-OE2 3.75Å
370	A	43.9	Very low	41.9	Very low	108 Å²	108	146.4 Å²	146.4	89%	0.893	80%	0.798	S	S	*	*			trans	-160.3	150	156.6	0	0	0	0	0	107.9
371	A	39.2	Very low	42.1	Very low	106 Å²	106	139.1 Å²	139.1	88%	0.876	79%	0.79	S	S	*	*			trans	-142.3	160.8	-168.3	0	0	0	0	0	113.9
372	S	47.6	Very low	42.7	Very low	99 Å²	99	138.2 Å²	138.2	69%	0.692	79%	0.789	S	S	*	*			trans	-172.4	118.7	162.5	173.7	0	0	0	0	112.4
373	N	43	Very low	42.7	Very low	140 Å²	140	133.4 Å²	133.4	75%	0.749	78%	0.778	S	S	*	*			trans	49.3	125.6	139.4	-51	-2.1	0	0	0	119.8
374	S	40.9	Very low	43.1	Very low	96 Å²	96	131.6 Å²	131.6	67%	0.671	77%	0.771	S	S	*	*				70.8	136	52.1	82.3	0	0	0	0	113.7
375	D	44.3	Very low	43.1	Very low	152 Å²	152	132.8 Å²	132.8	81%	0.813	76%	0.762	S	S	*	*			cis	-162.3	-167.9	-0.7	-136.2	-63.1	0	0	0	111.4
376	E	48.4	Very low	43.5	Very low	163 Å²	163	130.9 Å²	130.9	76%	0.762	75%	0.754	S	S	*	*			trans	72.5	154.5	163.7	-70.6	-152.4	98.5	0	0	121
377	K	43	Very low	43.4	Very low	149 Å²	149	136 Å²	136	65%	0.648	75%	0.752	S	S	*	*			cis	-168.7	159.1	-36	-137.8	170.4	158.5	-91.8	0	113.6
378	D	45.3	Very low	43.7	Very low	124 Å²	124	137.7 Å²	137.7	66%	0.663	75%	0.754	S	S	*	*			trans	64.9	177.2	156.5	-62	-25.5	0	0	0	123
379	Q	41	Very low	44.1	Very low	181 Å²	181	142.3 Å²	142.3	85%	0.846	76%	0.757	S	S	*	*			trans	-131.5	-146.2	-140.6	-47.5	-173.8	3.2	0	0	118
380	P	48.9	Very low	44.5	Very low	117 Å²	117	140.2 Å²	140.2	76%	0.76	75%	0.754	S	S	*	*				-136	178.5	-129.9	41.2	-16.7	0	0	0	119.5
381	A	42.9	Very low	44.5	Very low	92 Å²	92	145.4 Å²	145.4	76%	0.76	75%	0.751	S	S	*	*			trans	-161.6	138.5	159.1	0	0	0	0	0	108.7
382	V	44.2	Very low	44.7	Very low	129 Å²	129	146.6 Å²	146.6	78%	0.782	74%	0.742	S	S	*	*			cis	100.3	140	42	177	0	0	0	0	112.9
383	E	39.4	Very low	44.5	Very low	151 Å²	151	144.8 Å²	144.8	71%	0.706	73%	0.734	S	S	*	*			trans	68.3	153.1	179.3	-115.6	62.7	-118.8	0	0	116.9
384	S	45.8	Very low	44.5	Very low	101 Å²	101	146.7 Å²	146.7	71%	0.706	74%	0.738	S	S	*	*			cis	-146.2	133.7	7.5	-69.8	0	0	0	0	115.6
385	Q	45.4	Very low	44.2	Very low	152 Å²	152	147.4 Å²	147.4	71%	0.71	74%	0.743	S	S	*	*			trans	12	135.1	143.8	-40.5	175.5	4.4	0	0	124.2
386	K	47.8	Very low	44.3	Very low	173 Å²	173	145.9 Å²	145.9	75%	0.752	74%	0.741	S	S	*	*				166.1	128	103.7	-93.5	169.2	-175.8	163.2	0	116.9
387	R	42	Very low	43.9	Very low	207 Å²	207	142.4 Å²	142.4	78%	0.781	74%	0.74	S	S	*	*			trans	56.2	146.4	145	-66.8	171.2	149	-160.6	-3.9	119.7
388	R	45.1	Very low	44	Very low	202 Å²	202	143 Å²	143	76%	0.762	75%	0.75	S	S	*	*			cis	-153.4	130	-1.1	-109.3	169.5	163.9	172.5	-8.8	105.8
389	K	50.4	Low	43.6	Very low	191 Å²	191	144.4 Å²	144.4	83%	0.83	76%	0.758	S	S	*	*				60.5	118.4	88.4	-167.7	155.8	-178.2	172.7	0	112.6
390	T	46.4	Very low	43.7	Very low	111 Å²	111	141.6 Å²	141.6	68%	0.681	76%	0.758	S	S	*	*			cis	-151.2	155.6	49.8	47.9	0	0	0	0	116.9
391	R	44.6	Very low	43.3	Very low	218 Å²	218	142 Å²	142	82%	0.823	76%	0.759	S	S	*	*			trans	40	136.9	137.9	-60.8	174.1	68.8	166	-3.1	118.9
392	N	41.9	Very low	43.2	Very low	130 Å²	130	146.1 Å²	146.1	70%	0.695	76%	0.763	S	S	*	*			cis	-167.3	-174.2	10.1	-111.2	33.3	0	0	0	107
393	A	44	Very low	42.9	Very low	62 Å²	62	144.5 Å²	144.5	51%	0.512	76%	0.757	S	S	.	*			cis	164.9	143.5	-34.8	0	0	0	0	0	107.2
394	H	42.6	Very low	43.2	Very low	179 Å²	179	144.8 Å²	144.8	83%	0.829	76%	0.762	S	S	*	*			cis	-141.5	-177.8	4.1	-67.9	-85.1	0	0	0	110.7
395	S	34.1	Very low	42.8	Very low	112 Å²	112	145.1 Å²	145.1	78%	0.783	77%	0.765	S	S	*	*			trans	-107.6	-162.7	156.5	-40.5	0	0	0	0	108.6
396	P	48.2	Very low	42.6	Very low	120 Å²	120	146.8 Å²	146.8	78%	0.779	77%	0.772	S	S	*	*			cis	-117.8	166.3	16.7	23.1	1.7	0	0	0	113.3
397	A	39	Very low	42.8	Very low	89 Å²	89	144 Å²	144	74%	0.736	77%	0.772	S	S	*	*			cis	83.5	113.9	39.8	0	0	0	0	0	115.7
398	N	45.2	Very low	43.1	Very low	161 Å²	161	140 Å²	140	86%	0.861	77%	0.773	S	S	*	*			trans	-154.5	135.2	152.4	48.2	-7.5	0	0	0	110.4
399	N	37	Very low	42.7	Very low	155 Å²	155	139 Å²	139	83%	0.829	78%	0.777	S	S	*	*			trans	-105.6	158	-174.2	-55.6	-38.7	0	0	0	111.3
400	S	42.1	Very low	42.4	Very low	121 Å²	121	136.7 Å²	136.7	85%	0.846	78%	0.778	S	S	*	*				-172.8	152.3	123.1	-79.9	0	0	0	0	112.8
401	T	41.8	Very low	41.9	Very low	126 Å²	126	142.3 Å²	142.3	77%	0.773	79%	0.787	S	S	*	*			trans	-65.7	165.6	167.4	39.4	0	0	0	0	111
402	E	39.3	Very low	41.7	Very low	179 Å²	179	136.6 Å²	136.6	84%	0.836	78%	0.78	S	S	*	*				-163.9	-178.2	57.4	-155.2	154.2	120.5	0	0	115.3
403	S	39.7	Very low	41.8	Very low	95 Å²	95	139.4 Å²	139.4	66%	0.664	79%	0.786	S	S	*	*			trans	-83.9	174.2	-174.2	55.6	0	0	0	0	114.6
404	L	44.1	Very low	41.9	Very low	156 Å²	156	142.1 Å²	142.1	82%	0.817	80%	0.797	S	S	*	*			cis	-165	170.3	-6.7	-120.6	166.4	0	0	0	109.8
405	S	38.4	Very low	42	Very low	108 Å²	108	142.3 Å²	142.3	76%	0.755	80%	0.798	S	S	*	*			trans	76.5	129.8	151	-63	0	0	0	0	123.5
406	E	40.5	Very low	42.1	Very low	187 Å²	187	148.2 Å²	148.2	87%	0.874	80%	0.803	S	S	*	*			trans	-39.9	165.3	176.1	-66.6	-179.1	116.1	0	0	122.7
407	P	53.1	Low	42.1	Very low	114 Å²	114	149 Å²	149	74%	0.74	81%	0.806	S	S	*	*			trans	-95.6	-177.9	178.2	41.5	-38.5	0	0	0	114.3
408	P	47.2	Very low	42.2	Very low	124 Å²	124	149 Å²	149	81%	0.805	80%	0.801	S	S	*	*				-145.3	179.9	115.2	38.2	-23.1	0	0	0	116.5
409	H	37.2	Very low	42.3	Very low	182 Å²	182	148.6 Å²	148.6	84%	0.843	80%	0.798	S	S	*	*			trans	-65.4	150.4	-173.9	-42.9	-92.3	0	0	0	116.7
410	T	43.3	Very low	42.6	Very low	141 Å²	141	149.7 Å²	149.7	87%	0.865	80%	0.798	S	S	*	*				-163	115.4	121	30.8	0	0	0	0	115.6
411	R	37.5	Very low	42.5	Very low	230 Å²	230	153.6 Å²	153.6	87%	0.868	80%	0.8	S	S	*	*			trans	26	101.3	131	-167	175.7	175.7	-179.7	-0.9	121.3
412	S	39	Very low	42.6	Very low	97 Å²	97	154.5 Å²	154.5	68%	0.678	81%	0.805	S	S	*	*				85.8	146.2	129.2	80.8	0	0	0	0	123.9
413	K	45.1	Very low	42.4	Very low	189 Å²	189	151.4 Å²	151.4	82%	0.822	80%	0.803	S	S	*	*			trans	100.1	106	136.9	-99.3	-175.4	177.6	-173.1	0	122.2
414	T	45.9	Very low	42.4	Very low	120 Å²	120	156.5 Å²	156.5	74%	0.736	81%	0.808	S	S	*	*			trans	95.2	149.2	134.8	-19.7	0	0	0	0	119.7
415	Q	43.6	Very low	42.1	Very low	183 Å²	183	153.9 Å²	153.9	86%	0.855	80%	0.799	S	S	*	*			trans	75	121	170	-49.6	-170.5	10.6	0	0	115.6
416	R	37.7	Very low	42.3	Very low	235 Å²	235	155.6 Å²	155.6	89%	0.887	80%	0.795	S	S	*	*			cis	102.1	74.3	11.8	-164.8	-156.9	133.3	170.5	-2.6	116.4
417	T	46.6	Very low	42.5	Very low	137 Å²	137	154.6 Å²	154.6	84%	0.84	80%	0.796	S	S	*	*			trans	-167.8	157.6	149.6	32.2	0	0	0	0	107.8
418	S	42.9	Very low	41.7	Very low	89 Å²	89	154.3 Å²	154.3	62%	0.622	80%	0.796	S	S	*	*			cis	173	147.6	-39.6	48	0	0	0	0	106.8
419	L	45.7	Very low	41.9	Very low	153 Å²	153	155.6 Å²	155.6	80%	0.801	80%	0.802	S	S	*	*			trans	70.1	154.7	179.7	-45.1	174.7	0	0	0	113.1
420	Q	44.9	Very low	42.2	Very low	178 Å²	178	151.9 Å²	151.9	83%	0.832	79%	0.792	S	S	*	*			cis	-143.2	-176	-5.1	-134.2	161.3	29.5	0	0	110.6
421	K	39.9	Very low	42.5	Very low	203 Å²	203	153.5 Å²	153.5	88%	0.883	79%	0.794	S	S	*	*			trans	-129.3	114.8	-163.8	-176.4	-176.8	-176.7	-177.5	0	111.5
422	T	42.7	Very low	42.7	Very low	145 Å²	145	152.8 Å²	152.8	89%	0.89	79%	0.791	S	S	*	*			trans	-129.9	164	172.1	47.4	0	0	0	0	110.5
423	S	35.6	Very low	43.1	Very low	113 Å²	113	157 Å²	157	79%	0.79	80%	0.8	S	S	*	*			trans	-151.9	170.2	-167.8	61.3	0	0	0	0	113.4
424	R	38.8	Very low	43.1	Very low	202 Å²	202	152 Å²	152	76%	0.762	79%	0.793	S	S	*	*			trans	85.4	156.1	156.4	-150.4	-162.2	167.7	159	-3	116.9
425	T	39.6	Very low	42.9	Very low	102 Å²	102	154.2 Å²	154.2	63%	0.626	80%	0.801	S	S	*	*			trans	64.6	138.8	160.6	37.5	0	0	0	0	117.4
426	E	42.5	Very low	42.8	Very low	143 Å²	143	149.9 Å²	149.9	67%	0.668	80%	0.796	S	S	*	*			cis	-170.4	171.4	-29.3	-121.2	154.4	-120.4	0	0	106.6
427	N	44.8	Very low	43	Very low	167 Å²	167	145.5 Å²	145.5	89%	0.893	79%	0.79	S	S	*	*			trans	160.8	112.7	146.6	-83.7	-21.3	0	0	0	110
428	S	35.8	Very low	42.6	Very low	107 Å²	107	148.7 Å²	148.7	75%	0.748	79%	0.787	S	S	*	*			trans	-107.2	147.7	-177.4	-57.5	0	0	0	0	111.3
429	T	51.3	Low	42.5	Very low	152 Å²	152	151.9 Å²	151.9	93%	0.933	79%	0.79	S	S	*	*			trans	-125.9	123.4	161.4	-47.2	0	0	0	0	108.6
430	T	43.9	Very low	42.3	Very low	104 Å²	104	153 Å²	153	64%	0.638	79%	0.791	S	S	*	*			trans	-127.5	134.3	-165.2	-54.5	0	0	0	0	111.3	R432	T430-R432 HydrophobicContact CG2-CG 4.26Å
431	I	49.4	Very low	41.9	Very low	174 Å²	174	155.4 Å²	155.4	89%	0.892	79%	0.792	S	S	*	*			trans	-114.1	142.8	161.7	-64	180	0	0	0	108.1
432	R	41.1	Very low	41.9	Very low	215 Å²	215	151.7 Å²	151.7	81%	0.811	79%	0.789	S	S	*	*			trans	-121.3	149.3	-167.2	-69.7	173.4	163.6	175.1	-5.5	112	T430	T430-R432 HydrophobicContact CG2-CG 4.26Å
433	Q	47.3	Very low	41.5	Very low	187 Å²	187	149.6 Å²	149.6	87%	0.874	78%	0.78	S	S	*	*			trans	158.5	120.9	130.7	-83.9	161.2	20.2	0	0	107.3
434	A	44.7	Very low	41.6	Very low	82 Å²	82	148.9 Å²	148.9	68%	0.678	78%	0.781	S	S	*	*				75.2	134	57	0	0	0	0	0	111.6
435	N	41.9	Very low	41.6	Very low	167 Å²	167	143.2 Å²	143.2	89%	0.893	78%	0.778	S	S	*	*			cis	-133.1	-178.3	21.8	-75.6	-66.7	0	0	0	114.1
436	A	40.9	Very low	41.7	Very low	92 Å²	92	148.1 Å²	148.1	76%	0.76	79%	0.791	S	S	*	*			trans	-152.4	157.3	177.1	0	0	0	0	0	112.3
437	D	43.9	Very low	41.6	Very low	143 Å²	143	145 Å²	145	77%	0.765	79%	0.789	S	S	*	*			trans	-143.5	137.3	151.5	-102.7	-45.9	0	0	0	108.3
438	R	36.6	Very low	41.5	Very low	205 Å²	205	143.9 Å²	143.9	77%	0.774	78%	0.783	S	S	*	*			cis	74.9	137.1	39.1	-122.9	-171.5	176.7	-171.6	0.2	111.6
439	K	42	Very low	42	Very low	156 Å²	156	147 Å²	147	68%	0.678	78%	0.783	S	S	*	*			cis	-143.6	145.9	20	-66.4	164.4	-177.5	167.9	0	113.9
440	Q	40.5	Very low	41.5	Very low	177 Å²	177	148.8 Å²	148.8	83%	0.827	78%	0.778	S	S	*	*			trans	43.7	145.4	131.6	-61.6	177.5	-50.7	0	0	124.2
441	R	36	Very low	41.6	Very low	227 Å²	227	147.9 Å²	147.9	86%	0.857	78%	0.776	S	S	*	*			trans	-103.6	149.8	169.6	166.6	-168.9	179	-153.1	4.2	110.2
442	P	41.4	Very low	41.3	Very low	125 Å²	125	145 Å²	145	81%	0.812	77%	0.767	S	S	*	*			trans	-129.8	-167.3	143.5	38.1	-26.7	0	0	0	112.3
443	S	34.5	Very low	41.3	Very low	101 Å²	101	140 Å²	140	71%	0.706	76%	0.76	S	S	*	*			trans	-143.6	157.4	-166.8	56	0	0	0	0	114.6
444	A	36.8	Very low	41	Very low	98 Å²	98	139.2 Å²	139.2	81%	0.81	75%	0.754	S	S	*	*			trans	97.4	147.5	147.4	0	0	0	0	0	121.1
445	A	39.5	Very low	40.8	Very low	84 Å²	84	141.4 Å²	141.4	69%	0.694	75%	0.754	S	S	*	*			trans	92.7	119.2	146.4	0	0	0	0	0	121.9
446	K	40.3	Very low	40.5	Very low	205 Å²	205	138.8 Å²	138.8	89%	0.891	75%	0.749	S	S	*	*			trans	74.4	146.7	142.5	-67.8	170.3	-177.7	176.6	0	118.1
447	A	41.3	Very low	40.8	Very low	78 Å²	78	140 Å²	140	65%	0.645	75%	0.749	S	S	*	*			cis	-166.6	173.3	-11.9	0	0	0	0	0	112.3
448	N	42.5	Very low	41.2	Very low	143 Å²	143	138.3 Å²	138.3	77%	0.765	75%	0.746	S	S	*	*			trans	71.5	149.7	163.5	-73	-40.3	0	0	0	117.5
449	K	46	Very low	41.2	Very low	172 Å²	172	134.3 Å²	134.3	75%	0.748	74%	0.744	S	S	*	*			cis	-144.6	132.6	0.7	-113.3	151.2	-172.5	177.9	0	107.6
450	K	40.8	Very low	41.1	Very low	189 Å²	189	133.4 Å²	133.4	82%	0.822	75%	0.746	S	S	*	*				69	122.6	94.6	-172.1	178.6	-177.9	179.5	0	113.6
451	S	45.9	Very low	41.1	Very low	86 Å²	86	131.6 Å²	131.6	60%	0.601	74%	0.737	S	S	*	*			cis	-149.5	-128.5	-8.3	33.8	0	0	0	0	109.2
452	T	42.9	Very low	41.2	Very low	113 Å²	113	128.5 Å²	128.5	69%	0.693	73%	0.73	S	S	*	*			cis	-173.7	142	-3.4	-6.1	0	0	0	0	104.7
453	T	42.7	Very low	41.1	Very low	110 Å²	110	127.2 Å²	127.2	68%	0.675	72%	0.724	S	S	*	*			cis	-174.4	151.4	-12	18.7	0	0	0	0	110.1
454	K	40.2	Very low	41.2	Very low	171 Å²	171	128.3 Å²	128.3	74%	0.743	73%	0.727	S	S	*	*			trans	69.5	149.9	145.7	-68.5	175.4	156.6	-86.1	0	119.7
455	D	41.1	Very low	41.4	Very low	128 Å²	128	127.8 Å²	127.8	68%	0.684	72%	0.717	S	S	*	*			cis	-148.7	178.5	-9.3	-109.2	-27.3	0	0	0	111.8
456	S	35.4	Very low	41.5	Very low	111 Å²	111	132.3 Å²	132.3	78%	0.776	72%	0.721	S	S	*	*			trans	-112.6	166.4	-163.3	-73.3	0	0	0	0	116.6
457	P	47.2	Very low	41.3	Very low	117 Å²	117	129.2 Å²	129.2	76%	0.76	71%	0.714	S	S	*	*			trans	-93.7	-147.1	175.8	43.7	-39.5	0	0	0	110.2
458	P	51.5	Low	40.9	Very low	108 Å²	108	129.3 Å²	129.3	70%	0.701	71%	0.71	S	S	*	*			cis	-130.1	-166.7	-20.8	42.6	-25.9	0	0	0	113
459	T	37.5	Very low	40.9	Very low	121 Å²	121	131 Å²	131	74%	0.742	71%	0.713	S	S	*	*			trans	176.8	136	131.5	36.1	0	0	0	0	115.5
460	I	38.9	Very low	40.4	Very low	137 Å²	137	129.7 Å²	129.7	70%	0.703	71%	0.714	S	S	*	*				39.3	126.2	126.1	-42.6	167.8	0	0	0	119.4
461	E	40.8	Very low	40.2	Very low	139 Å²	139	125.1 Å²	125.1	65%	0.65	71%	0.706	S	S	*	*				-169	176.4	96.6	-102.8	-59.3	126.8	0	0	115.2
462	K	38.3	Very low	39.6	Very low	162 Å²	162	131.4 Å²	131.4	70%	0.704	72%	0.716	S	S	*	*			trans	-75.7	177.5	-170.1	-52.6	162.2	-162.6	88.6	0	112.2
463	S	39.7	Very low	39.4	Very low	98 Å²	98	136.5 Å²	136.5	69%	0.685	72%	0.723	S	S	*	*			cis	-176	163.9	37	64.5	0	0	0	0	115
464	T	36.8	Very low	39.3	Very low	125 Å²	125	135.9 Å²	135.9	77%	0.767	72%	0.723	S	S	*	*			trans	23.9	146.7	142.9	50.6	0	0	0	0	123.2
465	S	40.4	Very low	39.4	Very low	86 Å²	86	133.9 Å²	133.9	60%	0.601	72%	0.72	S	S	*	*			cis	-179.8	170.4	0.4	53.8	0	0	0	0	115
466	K	41.8	Very low	39.3	Very low	180 Å²	180	134.7 Å²	134.7	78%	0.783	73%	0.73	S	S	*	*			trans	83.3	144.8	143.4	-82.1	162.8	-173.7	169.1	0	122.4
467	N	36.4	Very low	39.5	Very low	139 Å²	139	133.4 Å²	133.4	74%	0.743	73%	0.726	S	S	*	*			trans	61	128.6	157.3	-61	10.7	0	0	0	118.3
468	S	32.7	Very low	39	Very low	80 Å²	80	139.6 Å²	139.6	56%	0.559	74%	0.735	S	S	*	*			cis	102.8	141.1	22	77.1	0	0	0	0	114.8
469	H	41.9	Very low	38.3	Very low	178 Å²	178	139.8 Å²	139.8	82%	0.824	74%	0.738	S	S	*	*			trans	77	158	-174.7	-50.8	-68.7	0	0	0	115.8
470	N	35.1	Very low	38.5	Very low	146 Å²	146	139.6 Å²	139.6	78%	0.781	74%	0.739	S	S	*	*			cis	-169.7	168.4	-38.9	-163.9	7.9	0	0	0	108.2
471	S	37.8	Very low	38.3	Very low	92 Å²	92	141 Å²	141	64%	0.643	75%	0.747	S	S	*	*			trans	64.5	120.2	175.2	-92.3	0	0	0	0	116
472	R	32.9	Very low	38.3	Very low	218 Å²	218	140.3 Å²	140.3	82%	0.823	76%	0.758	S	S	*	*				78.3	119.8	66.4	-79	179.5	164	-174	-2.1	114.5
473	R	37.7	Very low	38.1	Very low	221 Å²	221	140.5 Å²	140.5	83%	0.834	77%	0.766	S	S	*	*			trans	67.4	160.7	149.8	-72.7	-178.8	176.1	-163.5	-4.5	115.5
474	S	41.2	Very low	38.1	Very low	97 Å²	97	142.9 Å²	142.9	68%	0.678	78%	0.776	S	S	*	*			cis	-167.7	156.7	-10	37.2	0	0	0	0	108.5
475	D	41.5	Very low	37.9	Very low	128 Å²	128	142.7 Å²	142.7	68%	0.684	78%	0.78	S	S	*	*			cis	-168.2	-160.1	-18	-86.4	-35.3	0	0	0	105.3
476	T	39.6	Very low	37.7	Very low	145 Å²	145	150.2 Å²	150.2	89%	0.89	80%	0.795	S	S	*	*			trans	68.4	150.8	170.3	27.2	0	0	0	0	118
477	A	39.4	Very low	37.2	Very low	84 Å²	84	148.1 Å²	148.1	69%	0.694	79%	0.788	S	S	*	*			cis	-155.7	170.1	-3.2	0	0	0	0	0	113.4
478	R	38	Very low	37	Very low	248 Å²	248	148.5 Å²	148.5	94%	0.936	80%	0.796	S	S	*	*			trans	69.5	120.3	157.1	-75.6	178.9	172	-177.6	-3.1	120.8
479	S	36	Very low	37	Very low	112 Å²	112	150.3 Å²	150.3	78%	0.783	79%	0.794	S	S	*	*			trans	-85.1	175.1	158.5	-40.9	0	0	0	0	111.3
480	P	42.3	Very low	36.4	Very low	116 Å²	116	153.4 Å²	153.4	75%	0.753	80%	0.798	S	S	*	*				-146.8	150.5	89.5	38.5	-22.2	0	0	0	117.6
481	L	35.1	Very low	36.1	Very low	166 Å²	166	155.9 Å²	155.9	87%	0.869	80%	0.797	S	S	*	*			trans	31.6	118.5	139.5	-55	173.2	0	0	0	121.4
482	S	39.5	Very low	35.8	Very low	125 Å²	125	162.5 Å²	162.5	87%	0.874	81%	0.807	S	S	*	*				-155.6	160.8	122.9	54.5	0	0	0	0	110.7
483	L	34.9	Very low	35.7	Very low	167 Å²	167	157.2 Å²	157.2	87%	0.874	80%	0.799	S	S	*	*			trans	-115.9	128	-170.1	-72.8	143.8	0	0	0	111.6
484	T	39.9	Very low	35.7	Very low	148 Å²	148	152.4 Å²	152.4	91%	0.908	80%	0.797	S	S	*	*			trans	-145	152.1	146.7	48.9	0	0	0	0	110.5
485	S	32.3	Very low	35.3	Very low	121 Å²	121	155.3 Å²	155.3	85%	0.846	80%	0.799	S	S	*	*			trans	-96.2	128.6	-165.9	-56.7	0	0	0	0	114.3
486	R	35.1	Very low	34.9	Very low	244 Å²	244	156.5 Å²	156.5	92%	0.921	81%	0.806	S	S	*	*				-162	123.1	129.3	-111.4	167.1	179.3	-177.7	-0.8	111.2
487	E	31.9	Very low	34.7	Very low	136 Å²	136	158.8 Å²	158.8	64%	0.636	81%	0.806	S	S	*	*			trans	-104.9	90.6	-158.6	-170	164.4	-156.3	0	0	113.4	K489	E487-K489 HydrophobicContact CG-CB 3.99Å; E487-K489 HydrophobicContact CG-CD 3.92Å; E487-K489 HydrophobicContact CG-CG 3.71Å; E487-K489 PolarHBondContact O-N 3.12Å; E487-K489 WeakPolarHBondContact OE1-CD 3.37Å; E487-K489 WeakPolarHBondContact OE1-CE 3.36Å; E487-K489 IonicContact OE1-NZ 2.61Å; E487-K489 PolarHBondContact OE1-NZ 3.09Å
488	T	32	Very low	34.8	Very low	146 Å²	146	161 Å²	161	90%	0.896	81%	0.811	S	S	*	*			trans	-81.8	58.9	171.2	44.1	0	0	0	0	112
489	K	32.3	Very low	34.5	Very low	119 Å²	119	156.4 Å²	156.4	52%	0.517	81%	0.805	S	S	.	*			trans	-100.5	101.8	-179.4	-70.9	-170.8	-159.2	151.6	0	114.7	E487 W491	E487-K489 HydrophobicContact CG-CB 3.99Å; E487-K489 HydrophobicContact CG-CD 3.92Å; E487-K489 HydrophobicContact CG-CG 3.71Å; E487-K489 PolarHBondContact O-N 3.12Å; E487-K489 WeakPolarHBondContact OE1-CD 3.37Å; E487-K489 WeakPolarHBondContact OE1-CE 3.36Å; E487-K489 IonicContact OE1-NZ 2.61Å; E487-K489 PolarHBondContact OE1-NZ 3.09Å; K489-W491 HydrophobicContact CD-CH2 4.44Å; K489-W491 HydrophobicContact CD-CZ2 3.53Å; K489-W491 PolarHBondContact O-N 2.93Å
490	R	29.1	Very low	34.4	Very low	242 Å²	242	159.4 Å²	159.4	91%	0.913	81%	0.813	S	S	*	*			trans	-37.9	120.9	138.3	174.4	-167.4	-168.1	-137.2	7.3	111.1
491	W	30.2	Very low	34.1	Very low	199 Å²	199	160.8 Å²	160.8	75%	0.754	81%	0.813	S	S	*	*			trans	-121.9	162.5	171.5	-78.6	114.1	0	0	0	112.4	K489	K489-W491 HydrophobicContact CD-CH2 4.44Å; K489-W491 HydrophobicContact CD-CZ2 3.53Å; K489-W491 PolarHBondContact O-N 2.93Å
492	R	31.1	Very low	34	Very low	231 Å²	231	161.5 Å²	161.5	87%	0.872	81%	0.812	S	S	*	*	P	Polyproline II helix	trans	-87	170.2	-178.8	-69.6	-178.1	177.9	169.8	-1.5	111.5
493	T	31	Very low	33.9	Very low	106 Å²	106	163.6 Å²	163.6	65%	0.65	81%	0.812	S	S	*	*	P	Polyproline II helix	trans	-56.9	133.9	157.7	39.2	0	0	0	0	111.1
494	P	38.3	Very low	33.9	Very low	120 Å²	120	165 Å²	165	78%	0.779	81%	0.814	S	S	*	*	P	Polyproline II helix	trans	-74.8	144.9	136.4	-0.6	20.5	0	0	0	108.6
495	E	31.3	Very low	33.7	Very low	158 Å²	158	166.9 Å²	166.9	74%	0.738	81%	0.81	S	S	*	*			trans	-118.3	148.8	166.8	-72.2	167.9	-133.3	0	0	106.7
496	D	34.5	Very low	33.7	Very low	154 Å²	154	170.2 Å²	170.2	82%	0.824	81%	0.812	S	S	*	*	S	Bend	trans	67.5	153	-174.7	-54.7	-44.6	0	0	0	117.7
497	E	34	Very low	33.7	Very low	192 Å²	192	165.9 Å²	165.9	90%	0.897	80%	0.802	S	S	*	*			trans	61	124.4	-170.5	-53.3	-175.4	-176	0	0	114
498	V	42.6	Very low	33.7	Very low	130 Å²	130	168.9 Å²	168.9	79%	0.788	81%	0.813	S	S	*	*			cis	-147.1	150	45.2	174.1	0	0	0	0	111.5
499	N	31.5	Very low	33.8	Very low	153 Å²	153	171.3 Å²	171.3	82%	0.818	81%	0.806	S	S	*	*			trans	-34	126.9	-178.5	-55.1	-59.3	0	0	0	118.8	D501	N499-D501 PolarHBondContact O-N 3.46Å; N499-D501 VanDerWaalsContact O-N 3.12Å
500	D	33.7	Very low	33.8	Very low	175 Å²	175	170.8 Å²	170.8	94%	0.936	82%	0.815	S	S	*	*			trans	-75.2	77.3	164	-88.2	-65	0	0	0	111.7
501	D	35.9	Very low	33.7	Very low	144 Å²	144	165 Å²	165	77%	0.77	81%	0.812	S	S	*	*			trans	-152.7	71.3	170.2	-136.8	-17.6	0	0	0	115.4	N499	N499-D501 PolarHBondContact O-N 3.46Å; N499-D501 VanDerWaalsContact O-N 3.12Å
502	H	33.6	Very low	33.9	Very low	182 Å²	182	161.7 Å²	161.7	84%	0.843	81%	0.813	S	S	*	*			trans	179.9	98.1	150.2	-100.7	-47.8	0	0	0	112.1
503	L	37.3	Very low	34.1	Very low	168 Å²	168	158.8 Å²	158.8	88%	0.88	81%	0.813	S	S	*	*			trans	-155.5	25.9	153.8	-117.3	172.6	0	0	0	115.6	K505	L503-K505 PolarHBondContact O-N 3.43Å
504	H	34.3	Very low	34.3	Very low	197 Å²	197	161.3 Å²	161.3	91%	0.912	82%	0.823	S	S	*	*			trans	-83.3	84.1	162.3	-92.2	-79.6	0	0	0	110.5
505	K	35.3	Very low	34.2	Very low	188 Å²	188	165 Å²	165	82%	0.817	83%	0.826	S	S	*	*			trans	-135	127.3	161.5	-79	-173.4	175.5	174.3	0	109.8	L503 E507	L503-K505 PolarHBondContact O-N 3.43Å; K505-E507 PolarHBondContact O-N 2.82Å
506	E	32.6	Very low	34.3	Very low	191 Å²	191	166 Å²	166	89%	0.893	84%	0.836	S	S	*	*			trans	-79.8	110.1	-178	-60.6	-169.6	139.5	0	0	111.1	K508	E506-K508 PolarHBondContact O-N 3.12Å
507	E	34.8	Very low	34.2	Very low	153 Å²	153	163.4 Å²	163.4	72%	0.715	84%	0.836	S	S	*	*			trans	-73.7	91.4	166.3	-76.1	-160.7	156.8	0	0	110.8	K505 W509	K505-E507 PolarHBondContact O-N 2.82Å; E507-W509 VanDerWaalsContact C-N 3.34Å; E507-W509 PolarHBondContact O-N 3.41Å; E507-W509 PolarHBondContact OE2-NE1 2.88Å
508	K	31.8	Very low	34.4	Very low	198 Å²	198	164.2 Å²	164.2	86%	0.861	84%	0.837	S	S	*	*			trans	-79.9	76.3	178	-170.4	174.4	-179.4	175	0	111.3	E506	E506-K508 PolarHBondContact O-N 3.12Å
509	W	34.4	Very low	34.2	Very low	198 Å²	198	166.8 Å²	166.8	75%	0.75	85%	0.845	S	S	*	*			trans	-63	139.6	178.6	-74.1	89.6	0	0	0	112.6	E507	E507-W509 VanDerWaalsContact C-N 3.34Å; E507-W509 PolarHBondContact O-N 3.41Å; E507-W509 PolarHBondContact OE2-NE1 2.88Å
510	P	31.5	Very low	34.7	Very low	108 Å²	108	168.4 Å²	168.4	70%	0.701	85%	0.845	S	S	*	*			trans	-76.8	132.2	-171.4	29.9	-35.1	0	0	0	113.2	T512	P510-T512 PolarHBondContact O-N 3.24Å
511	S	28.6	Very low	35	Very low	121 Å²	121	169.1 Å²	169.1	85%	0.846	84%	0.839	S	S	*	*			trans	-100.5	74.4	-174	59.5	0	0	0	0	113
512	T	34.5	Very low	35	Very low	129 Å²	129	172.4 Å²	172.4	79%	0.791	85%	0.847	S	S	*	*			trans	-139.6	72.8	177.5	50.6	0	0	0	0	113.3	P510	P510-T512 PolarHBondContact O-N 3.24Å
513	I	35.6	Very low	35	Very low	169 Å²	169	169.5 Å²	169.5	87%	0.867	85%	0.847	S	S	*	*			trans	-131.9	104.2	154.1	-57.7	-179.1	0	0	0	107.3
514	N	34.2	Very low	35	Very low	159 Å²	159	165.7 Å²	165.7	85%	0.85	84%	0.84	S	S	*	*			trans	-155.3	146.1	174.5	-106.9	-33.4	0	0	0	107.9
515	K	37.1	Very low	35.4	Very low	197 Å²	197	164 Å²	164	86%	0.857	84%	0.836	S	S	*	*			trans	70.6	91.3	-175.3	-47.3	177.3	-175.1	-180	0	116.1
516	L	32.5	Very low	35.2	Very low	180 Å²	180	160.6 Å²	160.6	94%	0.942	84%	0.836	S	S	*	*				-160.5	96.4	126	-138.3	77.6	0	0	0	110.4
517	A	32.8	Very low	35.5	Very low	99 Å²	99	156.5 Å²	156.5	82%	0.818	83%	0.828	S	S	*	*			trans	-157.3	41.7	-179.2	0	0	0	0	0	112.9
518	K	38.2	Very low	35.9	Very low	210 Å²	210	153.2 Å²	153.2	91%	0.913	83%	0.827	S	S	*	*			trans	-147.3	88.6	170.8	-77.3	-161.6	177.6	-173	0	111.4
519	L	39	Very low	36.4	Very low	184 Å²	184	150.4 Å²	150.4	96%	0.963	82%	0.821	S	S	*	*			trans	-142.9	116.6	157.5	-98.2	167.7	0	0	0	106.7
520	K	42.1	Very low	36.7	Very low	187 Å²	187	147.6 Å²	147.6	81%	0.813	82%	0.821	S	S	*	*			trans	-140.7	123.6	-172.3	-178	176.9	-178.2	179.8	0	109.1
521	K	38.3	Very low	37.3	Very low	189 Å²	189	148 Å²	148	82%	0.822	83%	0.827	S	S	*	*			trans	52.3	111.1	170	-65.9	-172.6	173.1	-167.4	0	117.7
522	K	37.3	Very low	38.2	Very low	213 Å²	213	146 Å²	146	93%	0.926	81%	0.813	S	S	*	*			trans	-170.7	92.3	143.5	-112.3	-177.7	-179.3	-171.8	0	111.5
523	S	33.2	Very low	38.8	Very low	122 Å²	122	146.3 Å²	146.3	85%	0.853	81%	0.809	S	S	*	*			trans	179.6	86.4	163.5	53.8	0	0	0	0	111.2
524	A	38.1	Very low	39.4	Very low	88 Å²	88	145.3 Å²	145.3	73%	0.727	81%	0.806	S	S	*	*			trans	-160	139.7	166.3	0	0	0	0	0	109.9
525	I	41.5	Very low	39.9	Very low	161 Å²	161	144.4 Å²	144.4	83%	0.826	80%	0.801	S	S	*	*			trans	63.2	109.2	165.2	-51.2	149.6	0	0	0	115.8
526	S	30.7	Very low	40.3	Very low	116 Å²	116	142.3 Å²	142.3	81%	0.811	79%	0.794	S	S	*	*			trans	-139.7	98.2	160.4	57.4	0	0	0	0	107.7
527	S	40.3	Very low	40.6	Very low	105 Å²	105	139.1 Å²	139.1	73%	0.734	79%	0.787	S	S	*	*			trans	-151.8	98.1	-171.1	-58.7	0	0	0	0	113.4
528	A	41.4	Very low	41.1	Very low	84 Å²	84	141.3 Å²	141.3	69%	0.694	79%	0.785	S	S	*	*			trans	67.5	153.6	143.6	0	0	0	0	0	121.7
529	N	43.5	Very low	41.1	Very low	139 Å²	139	136.7 Å²	136.7	74%	0.743	77%	0.774	S	S	*	*			trans	77.7	143.3	160.6	-49	-31.7	0	0	0	118.8
530	N	41.5	Very low	41.2	Very low	140 Å²	140	133.1 Å²	133.1	75%	0.749	76%	0.764	S	S	*	*			cis	-173.3	146.3	-32.8	-103.2	-11.7	0	0	0	108.4
531	S	42.7	Very low	41.1	Very low	116 Å²	116	133.9 Å²	133.9	81%	0.811	77%	0.768	S	S	*	*			trans	62.5	155.2	167.9	-110.6	0	0	0	0	118
532	S	47.3	Very low	41.4	Very low	80 Å²	80	131.5 Å²	131.5	56%	0.559	77%	0.769	S	S	*	*			cis	-165.2	171.4	-34.4	45.2	0	0	0	0	110
533	D	47.5	Very low	41.4	Very low	134 Å²	134	128.7 Å²	128.7	72%	0.717	76%	0.764	S	S	*	*			trans	80.2	130	153.7	-47.8	-47.4	0	0	0	122
534	N	48	Very low	41.6	Very low	149 Å²	149	126.7 Å²	126.7	80%	0.797	76%	0.762	S	S	*	*			trans	67.2	70	147.4	-60.7	-10.4	0	0	0	121
535	D	45.1	Very low	41.4	Very low	139 Å²	139	130.2 Å²	130.2	74%	0.743	77%	0.769	S	S	*	*				42.2	145.9	111	-104.9	-35.4	0	0	0	124.8
536	H	45.7	Very low	41.3	Very low	153 Å²	153	131.1 Å²	131.1	71%	0.708	77%	0.77	S	S	*	*			trans	77.2	64.6	151.4	-65	10.7	0	0	0	119.8
537	S	39.1	Very low	41.4	Very low	113 Å²	113	130.3 Å²	130.3	79%	0.79	76%	0.76	S	S	*	*				54.5	100.7	122.4	63.4	0	0	0	0	120.2
538	D	42.1	Very low	41.1	Very low	146 Å²	146	132 Å²	132	78%	0.781	77%	0.766	S	S	*	*			trans	-155	141	163.6	-143.4	-5.8	0	0	0	116.4
539	T	39.5	Very low	40.7	Very low	113 Å²	113	134.4 Å²	134.4	69%	0.693	77%	0.766	S	S	*	*			trans	53.8	172.5	161.5	76.8	0	0	0	0	123.8
540	S	41.1	Very low	40.2	Very low	108 Å²	108	133 Å²	133	76%	0.755	77%	0.767	S	S	*	*			trans	68.8	134.1	171.6	78.8	0	0	0	0	117.4
541	K	40.4	Very low	39.9	Very low	203 Å²	203	137.4 Å²	137.4	88%	0.883	77%	0.773	S	S	*	*			cis	69.6	90.5	-8.6	-137.9	-172.2	-168.1	-174.3	0	117.5
542	V	43.8	Very low	39.5	Very low	140 Å²	140	138 Å²	138	85%	0.848	77%	0.767	S	S	*	*			trans	-174.8	159.9	135.9	140.5	0	0	0	0	110.1
543	D	37.5	Very low	38.9	Very low	154 Å²	154	141.4 Å²	141.4	82%	0.824	78%	0.779	S	S	*	*			trans	-69.7	158.2	-170.3	-52.7	-98.3	0	0	0	116.1
544	G	37.5	Very low	38.4	Very low	79 Å²	79	142.5 Å²	142.5	81%	0.814	79%	0.785	S	S	*	*			trans	-162.6	48.8	-175.3	0	0	0	0	0	115.5	Q546	G544-Q546 PolarHBondContact O-N 3.33Å
545	N	34.2	Very low	37.8	Very low	163 Å²	163	142.1 Å²	142.1	87%	0.872	79%	0.787	S	S	*	*			trans	-65.1	118	173.1	-87	-44.3	0	0	0	111.6
546	Q	38.1	Very low	37.4	Very low	179 Å²	179	141.1 Å²	141.1	84%	0.836	79%	0.787	S	S	*	*			trans	-163.6	138.6	140.5	-106.9	-161.2	85.5	0	0	115.1	G544	G544-Q546 PolarHBondContact O-N 3.33Å
547	V	33.4	Very low	36.8	Very low	99 Å²	99	138.6 Å²	138.6	60%	0.6	79%	0.792	S	S	*	*			trans	37.4	107.8	143	-174.6	0	0	0	0	119.3	I549	V547-I549 HydrophobicContact CG1-CD1 4.46Å; V547-I549 HydrophobicContact CG1-CG1 4.01Å
548	T	34.2	Very low	36.8	Very low	142 Å²	142	143 Å²	143	87%	0.871	80%	0.798	S	S	*	*			trans	-131.2	139.4	133.9	40.9	0	0	0	0	110.5
549	I	32.3	Very low	36.7	Very low	134 Å²	134	144.9 Å²	144.9	69%	0.687	80%	0.801	S	S	*	*			trans	-93.2	112.9	-164.6	-61.1	165.4	0	0	0	111	V547 R551	V547-I549 HydrophobicContact CG1-CD1 4.46Å; V547-I549 HydrophobicContact CG1-CG1 4.01Å; I549-R551 HydrophobicContact CG2-CB 4.5Å; I549-R551 HydrophobicContact CG2-CG 4.06Å
550	S	33.8	Very low	36.6	Very low	110 Å²	110	144.6 Å²	144.6	77%	0.769	80%	0.804	S	S	*	*			trans	-112.5	83.1	166.7	-71.2	0	0	0	0	110.9	N552	S550-N552 PolarHBondContact O-N 2.99Å
551	R	34.6	Very low	36.5	Very low	232 Å²	232	147.1 Å²	147.1	88%	0.875	81%	0.808	S	S	*	*			trans	-80.9	105.5	174.1	-88.1	-176	173.6	145.3	0.6	111	I549	I549-R551 HydrophobicContact CG2-CB 4.5Å; I549-R551 HydrophobicContact CG2-CG 4.06Å
552	N	34.4	Very low	36.4	Very low	128 Å²	128	146.6 Å²	146.6	68%	0.684	81%	0.806	S	S	*	*			trans	-74.5	168.6	167.3	-60.4	-26.8	0	0	0	110.9	S550	S550-N552 PolarHBondContact O-N 2.99Å
553	N	34.5	Very low	36.1	Very low	151 Å²	151	145.1 Å²	145.1	81%	0.807	80%	0.799	S	S	*	*			trans	73.5	123.1	167	-46.2	-31.7	0	0	0	116.9
554	N	36.3	Very low	36	Very low	157 Å²	157	145.2 Å²	145.2	84%	0.84	80%	0.799	S	S	*	*				-160.5	97.3	117.1	-103.5	-29.6	0	0	0	111.5
555	V	36	Very low	36	Very low	141 Å²	141	151.1 Å²	151.1	86%	0.855	80%	0.803	S	S	*	*			trans	-114.6	105.9	158.9	174.8	0	0	0	0	107.1
556	T	37.1	Very low	36.2	Very low	119 Å²	119	152.6 Å²	152.6	73%	0.73	80%	0.801	S	S	*	*			trans	-168.4	134.7	152.4	5.8	0	0	0	0	109.3
557	A	33.4	Very low	35.9	Very low	100 Å²	100	154.3 Å²	154.3	83%	0.826	81%	0.806	S	S	*	*			trans	-81.5	133.9	164.8	0	0	0	0	0	108.9
558	K	39.5	Very low	36.2	Very low	206 Å²	206	154.3 Å²	154.3	90%	0.896	81%	0.81	S	S	*	*			trans	-133.6	144.4	157.9	-76.7	-166.3	175.7	-180	0	110
559	E	39.1	Very low	36.2	Very low	184 Å²	184	152.5 Å²	152.5	86%	0.86	80%	0.803	S	S	*	*			trans	-117.3	149.3	-170.9	176.9	178.4	-162	0	0	108.8
560	S	36.4	Very low	36.3	Very low	107 Å²	107	151.6 Å²	151.6	75%	0.748	81%	0.809	S	S	*	*			trans	70.5	143.2	177.4	-131.8	0	0	0	0	113.8
561	L	39.4	Very low	36.4	Very low	161 Å²	161	151.7 Å²	151.7	84%	0.843	81%	0.81	S	S	*	*			cis	-145.3	-174.8	32.7	-84.5	163.2	0	0	0	112.7
562	K	39.7	Very low	36.7	Very low	193 Å²	193	146.1 Å²	146.1	84%	0.839	81%	0.806	S	S	*	*			trans	-113.4	152.5	171.1	-57.4	173.3	-176.3	174.5	0	110.7
563	P	35.9	Very low	37	Very low	108 Å²	108	147 Å²	147	70%	0.701	81%	0.811	S	S	*	*				-128.5	146.9	110.9	35.9	-29.1	0	0	0	110.8
564	L	36.9	Very low	37.3	Very low	157 Å²	157	147.5 Å²	147.5	82%	0.822	81%	0.814	S	S	*	*			cis	74.8	85.9	44.1	-158.1	92.4	0	0	0	113.8
565	F	36.5	Very low	37.6	Very low	203 Å²	203	146.9 Å²	146.9	89%	0.89	81%	0.81	S	S	*	*			trans	-119.5	140.5	163.9	-81.2	-79.4	0	0	0	111
566	K	39.5	Very low	38.2	Very low	193 Å²	193	147 Å²	147	84%	0.839	81%	0.806	S	S	*	*			trans	-133.3	100.2	176.1	-91.1	-171	173	-175.8	0	111.4
567	K	31.6	Very low	38.6	Very low	216 Å²	216	150 Å²	150	94%	0.939	81%	0.812	S	S	*	*			trans	22.5	102.6	138.1	-166.8	178.8	-173.6	177.8	0	119.5
568	S	38.6	Very low	38.9	Very low	99 Å²	99	150.9 Å²	150.9	69%	0.692	81%	0.812	S	S	*	*			trans	-170.1	113.2	150.7	44.6	0	0	0	0	106.8
569	S	34	Very low	39.1	Very low	103 Å²	103	147.5 Å²	147.5	72%	0.72	81%	0.808	S	S	*	*				87.9	139.1	62.7	68.4	0	0	0	0	113.5
570	S	35.9	Very low	39.3	Very low	116 Å²	116	145.2 Å²	145.2	81%	0.811	81%	0.807	S	S	*	*			trans	58.4	120.7	-175.5	39.1	0	0	0	0	115.3
571	S	35.6	Very low	39.6	Very low	112 Å²	112	147.6 Å²	147.6	78%	0.783	82%	0.816	S	S	*	*			cis	79.2	101.7	46.6	-174	0	0	0	0	113.9
572	S	39.8	Very low	39.7	Very low	115 Å²	115	143 Å²	143	80%	0.804	81%	0.809	S	S	*	*				-174.8	151.2	124.5	-77.2	0	0	0	0	110.8
573	N	40.2	Very low	39.6	Very low	147 Å²	147	140.1 Å²	140.1	79%	0.786	81%	0.812	S	S	*	*			trans	-75.9	160.7	170.9	-61.1	-30.1	0	0	0	110.5
574	N	42.2	Very low	39.5	Very low	161 Å²	161	140 Å²	140	86%	0.861	82%	0.821	S	S	*	*				-168.6	144.4	111.6	-92	-21	0	0	0	111.8
575	N	43.2	Very low	39.5	Very low	144 Å²	144	137.9 Å²	137.9	77%	0.77	82%	0.819	S	S	*	*			trans	-78.3	153	170.9	-59.8	-34.2	0	0	0	109.7
576	N	47.1	Very low	39.4	Very low	143 Å²	143	133.2 Å²	133.2	77%	0.765	81%	0.811	S	S	*	*				179.2	128.9	107.3	-87	-20.4	0	0	0	113.3
577	Q	45.9	Very low	39.6	Very low	183 Å²	183	129.9 Å²	129.9	86%	0.855	81%	0.807	S	S	*	*			trans	21.4	118.5	140.2	-56.6	175.9	3.8	0	0	119
578	S	39.5	Very low	39.7	Very low	118 Å²	118	126.4 Å²	126.4	83%	0.825	80%	0.799	S	S	*	*			trans	-139.6	138	133.1	-172.9	0	0	0	0	108.4
579	V	43.3	Very low	39.8	Very low	135 Å²	135	128.7 Å²	128.7	82%	0.818	80%	0.803	S	S	*	*			trans	-109.1	128.1	-174.6	-74.5	0	0	0	0	111
580	T	44.3	Very low	40.1	Very low	135 Å²	135	133.4 Å²	133.4	83%	0.828	81%	0.814	S	S	*	*			trans	-132	100.5	167.8	53.2	0	0	0	0	108.8
581	V	41.7	Very low	40.7	Very low	157 Å²	157	134.8 Å²	134.8	95%	0.952	81%	0.808	S	S	*	*			trans	-71.3	133.4	172.3	-81.9	0	0	0	0	110.2
582	G	41.7	Very low	40.9	Very low	66 Å²	66	135.4 Å²	135.4	68%	0.68	80%	0.802	S	S	*	*			trans	-170.5	99.4	179.7	0	0	0	0	0	112.8
583	S	39	Very low	41.4	Very low	131 Å²	131	139.9 Å²	139.9	92%	0.916	81%	0.81	S	S	*	*			trans	53.9	114.8	163	-57.5	0	0	0	0	118.8
584	A	32.4	Very low	41.7	Very low	106 Å²	106	137.9 Å²	137.9	88%	0.876	81%	0.808	S	S	*	*			trans	-87.8	141.9	170.1	0	0	0	0	0	112.4
585	S	37.2	Very low	42.1	Very low	112 Å²	112	133.5 Å²	133.5	78%	0.783	80%	0.801	S	S	*	*			trans	-162.8	153.1	153.2	54.7	0	0	0	0	111.5
586	S	35.3	Very low	42.6	Very low	105 Å²	105	131.9 Å²	131.9	73%	0.734	79%	0.792	S	S	*	*			trans	40.7	98.1	166.9	-59.7	0	0	0	0	118.8
587	V	43.7	Very low	42.6	Very low	123 Å²	123	129.5 Å²	129.5	75%	0.745	79%	0.786	S	S	*	*				62.1	125.3	76.3	-46.9	0	0	0	0	116.3
588	N	34	Very low	43.8	Very low	143 Å²	143	124 Å²	124	77%	0.765	77%	0.767	S	S	*	*			trans	61.4	112.3	150.2	-55	1.1	0	0	0	119.6
589	N	39.6	Very low	45.6	Very low	147 Å²	147	123.2 Å²	123.2	79%	0.786	75%	0.754	S	S	*	*			trans	-150.8	48.3	148.7	-98.6	-61.3	0	0	0	109.9	E591	N589-E591 VanDerWaalsContact C-N 3.32Å; N589-E591 PolarHBondContact O-N 3.12Å
590	E	40.9	Very low	47.6	Very low	202 Å²	202	121.2 Å²	121.2	94%	0.944	74%	0.738	S	S	*	*			trans	-81.8	81.9	163.9	-71.3	-169.1	154.9	0	0	108.5
591	E	49.4	Very low	49.5	Very low	146 Å²	146	115.8 Å²	115.8	68%	0.682	71%	0.705	S	S	*	*			trans	-120.9	108.3	-175.3	-82.6	-152.8	-173.5	0	0	113.3	N589	N589-E591 VanDerWaalsContact C-N 3.32Å; N589-E591 PolarHBondContact O-N 3.12Å
592	N	39.5	Very low	51.5	Low	125 Å²	125	112.2 Å²	112.2	67%	0.668	68%	0.679	S	S	*	*			trans	79.2	40.7	150.7	-53.8	-61.5	0	0	0	119.8	S594	N592-S594 PolarHBondContact O-N 2.98Å
593	E	49.3	Very low	53.7	Low	208 Å²	208	111.9 Å²	111.9	97%	0.972	66%	0.662	S	S	*	*	T	Hydrogen-bonded Turn	trans	-78	58.3	164.2	-163.2	175.5	-128.7	0	0	112.2
594	S	46.3	Very low	56.2	Low	105 Å²	105	109.2 Å²	109.2	73%	0.734	64%	0.637	S	S	*	*	T	Hydrogen-bonded Turn	trans	-140	7.4	-172.1	62.5	0	0	0	0	115.9	N592	N592-S594 PolarHBondContact O-N 2.98Å
595	G	51.6	Low	59	Low	69 Å²	69	105.4 Å²	105.4	71%	0.711	60%	0.601	S	S	*	*	S	Bend	trans	-106.3	-16.9	-176.6	0	0	0	0	0	117.1
596	D	53.1	Low	61.5	Low	110 Å²	110	104.1 Å²	104.1	59%	0.588	58%	0.579	S	S	*	*			trans	-86.3	-26.2	-154.9	-136.1	-8.1	0	0	0	115.3	S598 D599 D600	D596-S598 PolarHBondContact O-N 3.16Å; D596-D599 PolarHBondContact O-N 3.17Å; D596-D600 PolarHBondContact O-N 3.17Å; D596-D600 VanDerWaalsContact O-N 3.09Å
597	C	47.4	Very low	64.2	Low	94 Å²	94	104.1 Å²	104.1	64%	0.635	57%	0.571	S	S	*	*	H	α-helix	trans	-53.3	-32.7	-167.3	-54.4	0	0	0	0	115	V601	C597-V601 WeakPolarHBondContact O-CG2 3.46Å; C597-V601 PolarHBondContact O-N 3.47Å; C597-V601 VanDerWaalsContact O-N 3.09Å
598	S	69.9	Low	66.5	Low	67 Å²	67	102.7 Å²	102.7	47%	0.469	55%	0.552	S	S	.	*	H	α-helix	trans	-82.1	-31.7	-178.8	-158.8	0	0	0	0	112.8	D596 D600 V601 M602 E671	D596-S598 PolarHBondContact O-N 3.16Å; S598-D600 VanDerWaalsContact C-N 3.33Å; S598-V601 PolarHBondContact O-N 3.43Å; S598-M602 WeakPolarHBondContact O-CB 3.35Å; S598-M602 VanDerWaalsContact O-CG 3.24Å; S598-M602 WeakPolarHBondContact O-CG 3.46Å; S598-M602 PolarHBondContact O-N 2.92Å; S598-E671 PolarHBondContact OG-OE1 3.3Å
599	D	78.2	Confident	69.3	Low	101 Å²	101	99 Å²	99	54%	0.54	53%	0.529	S	S	.	.	H	α-helix	trans	-71.6	-31.8	172.2	-100.2	-36.8	0	0	0	110.8	D596 M602 N603	D596-D599 PolarHBondContact O-N 3.17Å; D599-M602 CarbonylContact O-C 3.51Å; D599-M602 PolarHBondContact O-N 2.93Å; D599-N603 WeakPolarHBondContact O-CB 3.43Å; D599-N603 PolarHBondContact O-N 3.27Å; D599-N603 PolarHBondContact O-ND2 2.87Å; D599-N603 VanDerWaalsContact O-ND2 3.13Å
600	D	85.1	Confident	71.9	Confident	93 Å²	93	96 Å²	96	50%	0.497	51%	0.514	S	S	.	.	H	α-helix	trans	-63.3	-48.8	168.6	-98.9	-14.4	0	0	0	113.3	D596 S598 M602 N603 L604	D596-D600 PolarHBondContact O-N 3.17Å; D596-D600 VanDerWaalsContact O-N 3.09Å; S598-D600 VanDerWaalsContact C-N 3.33Å; D600-M602 PolarHBondContact O-N 3.14Å; D600-N603 WeakPolarHBondContact O-CB 3.4Å; D600-N603 PolarHBondContact O-N 3.49Å; D600-N603 VanDerWaalsContact O-N 3.15Å; D600-L604 VanDerWaalsContact O-CB 3.29Å; D600-L604 WeakPolarHBondContact O-CB 3.21Å; D600-L604 PolarHBondContact O-N 3.12Å
601	V	83.4	Confident	74.4	Confident	22 Å²	22	88.9 Å²	88.9	13%	0.133	49%	0.489	C	S	.	.	H	α-helix	trans	-59.2	-38.5	173.2	168.1	0	0	0	0	110.7	C597 S598 L604 I605 H667 E671	C597-V601 WeakPolarHBondContact O-CG2 3.46Å; C597-V601 PolarHBondContact O-N 3.47Å; C597-V601 VanDerWaalsContact O-N 3.09Å; S598-V601 PolarHBondContact O-N 3.43Å; V601-L604 PolarHBondContact O-N 2.92Å; V601-I605 HydrophobicContact CG1-CD1 3.67Å; V601-I605 HydrophobicContact CG1-CG1 4.4Å; V601-I605 WeakPolarHBondContact O-CB 3.43Å; V601-I605 VanDerWaalsContact O-CG1 3.24Å; V601-I605 WeakPolarHBondContact O-CG1 3.36Å; V601-I605 PolarHBondContact O-N 2.96Å; V601-H667 HydrophobicContact CG1-CB 4.13Å; V601-E671 HydrophobicContact CG2-CG 4.36Å
602	M	85.2	Confident	76.5	Confident	82 Å²	82	82.7 Å²	82.7	40%	0.404	46%	0.461	S	S	.	.	H	α-helix	trans	-73.3	-28.6	176.2	-73	-68.6	-73	0	0	113.9	S598 D599 D600 R606	S598-M602 WeakPolarHBondContact O-CB 3.35Å; S598-M602 VanDerWaalsContact O-CG 3.24Å; S598-M602 WeakPolarHBondContact O-CG 3.46Å; S598-M602 PolarHBondContact O-N 2.92Å; D599-M602 CarbonylContact O-C 3.51Å; D599-M602 PolarHBondContact O-N 2.93Å; D600-M602 PolarHBondContact O-N 3.14Å; M602-R606 WeakPolarHBondContact O-CB 3.48Å; M602-R606 VanDerWaalsContact O-CG 3.29Å; M602-R606 WeakPolarHBondContact O-CG 3.11Å; M602-R606 PolarHBondContact O-N 2.71Å; M602-R606 PolarHBondContact O-NE 2.84Å
603	N	88.3	Confident	79	Confident	59 Å²	59	79 Å²	79	32%	0.316	45%	0.448	S	S	.	.	H	α-helix	trans	-63.4	-52.8	167.4	-73.6	-39.8	0	0	0	109.3	D599 D600 I605 R606 D607	D599-N603 WeakPolarHBondContact O-CB 3.43Å; D599-N603 PolarHBondContact O-N 3.27Å; D599-N603 PolarHBondContact O-ND2 2.87Å; D599-N603 VanDerWaalsContact O-ND2 3.13Å; D600-N603 WeakPolarHBondContact O-CB 3.4Å; D600-N603 PolarHBondContact O-N 3.49Å; D600-N603 VanDerWaalsContact O-N 3.15Å; N603-I605 PolarHBondContact O-N 3.49Å; N603-R606 WeakPolarHBondContact O-CA 3.46Å; N603-R606 VanDerWaalsContact O-CB 3.32Å; N603-R606 WeakPolarHBondContact O-CB 3.29Å; N603-R606 PolarHBondContact O-N 3.37Å; N603-R606 PolarHBondContact OD1-NH1 3.44Å; N603-R606 PolarHBondContact OD1-NH2 3.27Å; N603-D607 PolarHBondContact O-N 2.98Å
604	L	90.2	Very high	81.1	Confident	75 Å²	75	73.5 Å²	73.5	39%	0.393	42%	0.422	S	S	.	.	H	α-helix	trans	-64.6	-38.9	-175.3	-176.8	51.9	0	0	0	112.9	D600 V601 D607 R608 F663 H667	D600-L604 VanDerWaalsContact O-CB 3.29Å; D600-L604 WeakPolarHBondContact O-CB 3.21Å; D600-L604 PolarHBondContact O-N 3.12Å; V601-L604 PolarHBondContact O-N 2.92Å; L604-D607 PolarHBondContact O-N 3.36Å; L604-R608 WeakPolarHBondContact O-CB 3.28Å; L604-R608 PolarHBondContact O-N 3.31Å; L604-F663 HydrophobicContact CD1-CE1 4.47Å; L604-F663 HydrophobicContact CD1-CZ 3.85Å; L604-F663 HydrophobicContact CD2-CZ 4.35Å; L604-F663 HydrophobicContact CG-CE1 3.97Å; L604-F663 HydrophobicContact CG-CZ 3.69Å; L604-H667 WeakPolarHBondContact CD2-CE1 3.17Å
605	I	90.8	Very high	83.3	Confident	25 Å²	25	71 Å²	71	13%	0.128	40%	0.4	C	S	.	.	H	α-helix	trans	-65.3	-38.8	170.9	-70.1	165.4	0	0	0	111.3	V601 N603 K609 F663 I664	V601-I605 HydrophobicContact CG1-CD1 3.67Å; V601-I605 HydrophobicContact CG1-CG1 4.4Å; V601-I605 WeakPolarHBondContact O-CB 3.43Å; V601-I605 VanDerWaalsContact O-CG1 3.24Å; V601-I605 WeakPolarHBondContact O-CG1 3.36Å; V601-I605 PolarHBondContact O-N 2.96Å; N603-I605 PolarHBondContact O-N 3.49Å; I605-K609 WeakPolarHBondContact O-CB 3.27Å; I605-K609 PolarHBondContact O-N 2.9Å; I605-F663 HydrophobicContact CG1-CD1 4.29Å; I605-F663 HydrophobicContact CG1-CE1 4.29Å; I605-I664 HydrophobicContact CD1-CG1 4.16Å; I605-I664 HydrophobicContact CG1-CG1 4.17Å; I605-I664 HydrophobicContact CG2-CD1 4.14Å; I605-I664 HydrophobicContact CG2-CG1 3.94Å
606	R	90.4	Very high	85.4	Confident	85 Å²	85	69.6 Å²	69.6	32%	0.321	37%	0.374	S	S	.	.	H	α-helix	trans	-62.7	-44.3	175.8	-83.7	177.5	-87.3	122.3	-9.7	111.2	M602 N603 K609 D610	M602-R606 WeakPolarHBondContact O-CB 3.48Å; M602-R606 VanDerWaalsContact O-CG 3.29Å; M602-R606 WeakPolarHBondContact O-CG 3.11Å; M602-R606 PolarHBondContact O-N 2.71Å; M602-R606 PolarHBondContact O-NE 2.84Å; N603-R606 WeakPolarHBondContact O-CA 3.46Å; N603-R606 VanDerWaalsContact O-CB 3.32Å; N603-R606 WeakPolarHBondContact O-CB 3.29Å; N603-R606 PolarHBondContact O-N 3.37Å; N603-R606 PolarHBondContact OD1-NH1 3.44Å; N603-R606 PolarHBondContact OD1-NH2 3.27Å; R606-K609 WeakPolarHBondContact O-CB 3.47Å; R606-K609 PolarHBondContact O-N 2.93Å; R606-K609 PolarHBondContact O-NZ 2.89Å; R606-D610 PolarHBondContact O-N 3.47Å
607	D	92.2	Very high	87.4	Confident	105 Å²	105	66.7 Å²	66.7	56%	0.561	36%	0.356	S	S	*	.	H	α-helix	trans	-69.8	-42.9	-178.9	-71.1	-10.8	0	0	0	112.1	N603 L604 K609 D610 A611	N603-D607 PolarHBondContact O-N 2.98Å; L604-D607 PolarHBondContact O-N 3.36Å; D607-K609 VanDerWaalsContact C-N 3.32Å; D607-K609 PolarHBondContact O-N 3.41Å; D607-D610 PolarHBondContact O-N 2.93Å; D607-A611 WeakPolarHBondContact O-CB 3.35Å; D607-A611 PolarHBondContact O-N 3.11Å
608	R	92.5	Very high	89.5	Confident	93 Å²	93	69.4 Å²	69.4	35%	0.351	35%	0.353	S	S	.	.	H	α-helix	trans	-57.5	-46.2	172.2	-174.8	74.5	-176.3	174.4	1.7	111.3	L604 D610 A611 L612 D659 L660 F663	L604-R608 WeakPolarHBondContact O-CB 3.28Å; L604-R608 PolarHBondContact O-N 3.31Å; R608-D610 PolarHBondContact O-N 2.94Å; R608-A611 PolarHBondContact O-N 3.43Å; R608-L612 HydrophobicContact CG-CD1 3.95Å; R608-L612 WeakPolarHBondContact O-CB 3.49Å; R608-L612 VanDerWaalsContact O-CG 3.31Å; R608-L612 WeakPolarHBondContact O-CG 3.49Å; R608-L612 PolarHBondContact O-N 3.17Å; R608-D659 IonicContact CZ-OD1 2.93Å; R608-D659 VanDerWaalsContact CZ-OD1 3.22Å; R608-D659 IonicContact CZ-OD2 3.22Å; R608-D659 IonicContact NE-OD1 2.97Å; R608-D659 PolarHBondContact NE-OD1 3.44Å; R608-D659 IonicContact NH2-OD1 2.72Å; R608-D659 PolarHBondContact NH2-OD1 3.13Å; R608-D659 IonicContact NH2-OD2 2.71Å; R608-D659 PolarHBondContact NH2-OD2 3.43Å; R608-L660 HydrophobicContact CG-CD1 4.48Å; R608-F663 HydrophobicContact CB-CD1 3.67Å; R608-F663 HydrophobicContact CB-CD2 4.46Å; R608-F663 HydrophobicContact CB-CE1 3.52Å; R608-F663 HydrophobicContact CB-CE2 4.34Å; R608-F663 HydrophobicContact CB-CG 4.13Å; R608-F663 HydrophobicContact CB-CZ 3.87Å; R608-F663 HydrophobicContact CG-CB 4.09Å; R608-F663 HydrophobicContact CG-CD1 3.65Å; R608-F663 HydrophobicContact CG-CD2 3.85Å; R608-F663 HydrophobicContact CG-CE1 3.94Å; R608-F663 HydrophobicContact CG-CE2 4.12Å; R608-F663 HydrophobicContact CG-CG 3.59Å; R608-F663 HydrophobicContact CG-CZ 4.15Å
609	K	92.5	Very high	90.7	Very high	65 Å²	65	68.1 Å²	68.1	28%	0.283	34%	0.341	S	S	.	.	H	α-helix	trans	-61.5	-39.4	178.4	177.5	-128.8	72.2	-126.1	0	112.2	I605 R606 D607 A613 L660	I605-K609 WeakPolarHBondContact O-CB 3.27Å; I605-K609 PolarHBondContact O-N 2.9Å; R606-K609 WeakPolarHBondContact O-CB 3.47Å; R606-K609 PolarHBondContact O-N 2.93Å; R606-K609 PolarHBondContact O-NZ 2.89Å; D607-K609 VanDerWaalsContact C-N 3.32Å; D607-K609 PolarHBondContact O-N 3.41Å; K609-A613 WeakPolarHBondContact O-CB 3.44Å; K609-A613 PolarHBondContact O-N 3.4Å; K609-A613 VanDerWaalsContact O-N 3.12Å; K609-L660 HydrophobicContact CB-CD1 3.86Å; K609-L660 HydrophobicContact CB-CD2 4.05Å; K609-L660 HydrophobicContact CG-CD2 3.87Å
610	D	93.2	Very high	91.4	Very high	86 Å²	86	63.5 Å²	63.5	46%	0.46	32%	0.317	S	S	.	.	H	α-helix	trans	-76.7	-34.7	178.3	-76.2	-34.7	0	0	0	112.7	R606 D607 R608 A613 E614	R606-D610 PolarHBondContact O-N 3.47Å; D607-D610 PolarHBondContact O-N 2.93Å; R608-D610 PolarHBondContact O-N 2.94Å; D610-A613 PolarHBondContact O-N 2.82Å; D610-E614 PolarHBondContact O-N 2.8Å
611	A	93.7	Very high	91.8	Very high	52 Å²	52	64.3 Å²	64.3	43%	0.43	32%	0.317	S	S	.	.	H	α-helix	trans	-60.3	-50.5	170.2	0	0	0	0	0	111.5	D607 R608 A613 E614 D615	D607-A611 WeakPolarHBondContact O-CB 3.35Å; D607-A611 PolarHBondContact O-N 3.11Å; R608-A611 PolarHBondContact O-N 3.43Å; A611-A613 VanDerWaalsContact C-N 3.25Å; A611-A613 PolarHBondContact O-N 3.32Å; A611-E614 PolarHBondContact O-N 3.37Å; A611-E614 VanDerWaalsContact O-N 3.15Å; A611-D615 PolarHBondContact O-N 3.34Å
612	L	93.9	Very high	92.3	Very high	16 Å²	16	65.7 Å²	65.7	8%	0.084	33%	0.331	C	S	.	.	H	α-helix	trans	-61.5	-31.8	177.2	-70.4	169.1	0	0	0	112.9	R608 Y616 D659 L660	R608-L612 HydrophobicContact CG-CD1 3.95Å; R608-L612 WeakPolarHBondContact O-CB 3.49Å; R608-L612 VanDerWaalsContact O-CG 3.31Å; R608-L612 WeakPolarHBondContact O-CG 3.49Å; R608-L612 PolarHBondContact O-N 3.17Å; L612-Y616 WeakPolarHBondContact O-CB 3.29Å; L612-Y616 PolarHBondContact O-N 3.4Å; L612-D659 HydrophobicContact CD1-CB 4.1Å; L612-D659 HydrophobicContact CD2-CB 4.09Å; L612-L660 HydrophobicContact CD1-CB 3.82Å
613	A	92.6	Very high	92.7	Very high	48 Å²	48	65.3 Å²	65.3	40%	0.397	33%	0.327	S	S	.	.	H	α-helix	trans	-69.9	-38.8	175.2	0	0	0	0	0	112.7	K609 D610 A611 K617	K609-A613 WeakPolarHBondContact O-CB 3.44Å; K609-A613 PolarHBondContact O-N 3.4Å; K609-A613 VanDerWaalsContact O-N 3.12Å; D610-A613 PolarHBondContact O-N 2.82Å; A611-A613 VanDerWaalsContact C-N 3.25Å; A611-A613 PolarHBondContact O-N 3.32Å; A613-K617 VanDerWaalsContact O-CB 3.25Å; A613-K617 WeakPolarHBondContact O-CB 3.4Å; A613-K617 PolarHBondContact O-N 3.43Å; A613-K617 VanDerWaalsContact O-N 3.09Å
614	E	93	Very high	92.9	Very high	92 Å²	92	64.9 Å²	64.9	43%	0.43	33%	0.327	S	S	.	.	H	α-helix	trans	-71.7	-36.8	173.9	-81.9	-65.2	142.7	0	0	112.4	D610 A611 K617 R618	D610-E614 PolarHBondContact O-N 2.8Å; A611-E614 PolarHBondContact O-N 3.37Å; A611-E614 VanDerWaalsContact O-N 3.15Å; E614-K617 PolarHBondContact O-N 2.9Å; E614-K617 IonicContact OE1-NZ 2.7Å; E614-K617 PolarHBondContact OE1-NZ 2.93Å; E614-K617 IonicContact OE2-NZ 3.88Å; E614-K617 PolarHBondContact OE2-NZ 3.03Å; E614-R618 WeakPolarHBondContact O-CG 3.36Å; E614-R618 PolarHBondContact O-N 2.93Å
615	D	93.2	Very high	93	Very high	52 Å²	52	64 Å²	64	28%	0.278	32%	0.324	S	S	.	.	H	α-helix	trans	-59.9	-54.2	172	-84.2	40.1	0	0	0	111.9	A611 K617 R618 D619	A611-D615 PolarHBondContact O-N 3.34Å; D615-K617 PolarHBondContact O-N 3.44Å; D615-R618 VanDerWaalsContact CG-NH2 3.26Å; D615-R618 PolarHBondContact O-N 3.42Å; D615-R618 VanDerWaalsContact O-N 3.1Å; D615-R618 IonicContact OD1-CZ 3.9Å; D615-R618 IonicContact OD1-NE 3.96Å; D615-R618 IonicContact OD1-NH2 2.91Å; D615-R618 PolarHBondContact OD1-NH2 3.21Å; D615-R618 IonicContact OD2-NH2 3.82Å; D615-R618 PolarHBondContact OD2-NH2 3.06Å; D615-D619 PolarHBondContact O-N 3.13Å
616	Y	95.2	Very high	93.1	Very high	39 Å²	39	66.8 Å²	66.8	15%	0.153	34%	0.343	C	S	.	.	H	α-helix	trans	-57.2	-36	176.5	179.8	-104.1	0	0	0	112.3	L612 C620 L649 R652 G653	L612-Y616 WeakPolarHBondContact O-CB 3.29Å; L612-Y616 PolarHBondContact O-N 3.4Å; Y616-C620 VanDerWaalsContact CE1-SG 3.52Å; Y616-C620 VanDerWaalsContact CZ-SG 3.54Å; Y616-C620 WeakPolarHBondContact O-CB 3.31Å; Y616-C620 PolarHBondContact O-N 2.89Å; Y616-C620 PolarHBondContact O-SG 2.87Å; Y616-L649 WeakPolarHBondContact CE2-O 3.47Å; Y616-L649 PolarHBondContact OH-O 3.36Å; Y616-R652 HydrophobicContact CD2-CG 4.27Å; Y616-G653 VanDerWaalsContact CE2-CA 3.45Å
617	K	93.8	Very high	93.2	Very high	49 Å²	49	63.5 Å²	63.5	21%	0.213	33%	0.332	C	S	.	.	H	α-helix	trans	-68.5	-43.8	174.9	166.3	165.9	153.8	-90.4	0	112.8	A613 E614 D615 D619 C620 E621	A613-K617 VanDerWaalsContact O-CB 3.25Å; A613-K617 WeakPolarHBondContact O-CB 3.4Å; A613-K617 PolarHBondContact O-N 3.43Å; A613-K617 VanDerWaalsContact O-N 3.09Å; E614-K617 PolarHBondContact O-N 2.9Å; E614-K617 IonicContact OE1-NZ 2.7Å; E614-K617 PolarHBondContact OE1-NZ 2.93Å; E614-K617 IonicContact OE2-NZ 3.88Å; E614-K617 PolarHBondContact OE2-NZ 3.03Å; D615-K617 PolarHBondContact O-N 3.44Å; K617-D619 VanDerWaalsContact C-N 3.31Å; K617-D619 PolarHBondContact O-N 2.75Å; K617-C620 WeakPolarHBondContact O-CB 3.46Å; K617-C620 PolarHBondContact O-N 3.12Å; K617-E621 PolarHBondContact O-N 3.21Å
618	R	93.3	Very high	93.1	Very high	151 Å²	151	65.3 Å²	65.3	57%	0.57	33%	0.331	S	S	*	.	H	α-helix	trans	-58.2	-44.8	174.2	-73.9	-173.3	-69.8	148.6	-11.9	110.9	E614 D615 E621 A622	E614-R618 WeakPolarHBondContact O-CG 3.36Å; E614-R618 PolarHBondContact O-N 2.93Å; D615-R618 VanDerWaalsContact CG-NH2 3.26Å; D615-R618 PolarHBondContact O-N 3.42Å; D615-R618 VanDerWaalsContact O-N 3.1Å; D615-R618 IonicContact OD1-CZ 3.9Å; D615-R618 IonicContact OD1-NE 3.96Å; D615-R618 IonicContact OD1-NH2 2.91Å; D615-R618 PolarHBondContact OD1-NH2 3.21Å; D615-R618 IonicContact OD2-NH2 3.82Å; D615-R618 PolarHBondContact OD2-NH2 3.06Å; R618-E621 PolarHBondContact O-N 2.96Å; R618-A622 WeakPolarHBondContact O-CB 3.4Å; R618-A622 PolarHBondContact O-N 3.39Å
619	D	93.2	Very high	93.1	Very high	40 Å²	40	66.5 Å²	66.5	21%	0.214	34%	0.342	C	S	.	.	H	α-helix	trans	-64.6	-43.4	176.8	-69	-31	0	0	0	112.1	D615 K617 E621 A622 F623 R652	D615-D619 PolarHBondContact O-N 3.13Å; K617-D619 VanDerWaalsContact C-N 3.31Å; K617-D619 PolarHBondContact O-N 2.75Å; D619-E621 VanDerWaalsContact C-N 3.34Å; D619-E621 PolarHBondContact O-N 3.15Å; D619-A622 PolarHBondContact O-N 3.02Å; D619-F623 HydrophobicContact CB-CD2 4.16Å; D619-F623 HydrophobicContact CB-CE2 3.95Å; D619-F623 WeakPolarHBondContact O-CD2 3.32Å; D619-F623 PolarHBondContact O-N 3.08Å; D619-R652 HydrophobicContact CB-CG 4.46Å; D619-R652 IonicContact OD2-CZ 3.43Å; D619-R652 IonicContact OD2-NE 2.67Å; D619-R652 PolarHBondContact OD2-NE 2.76Å; D619-R652 IonicContact OD2-NH2 3.36Å; D619-R652 PolarHBondContact OD2-NH2 2.95Å
620	C	94.2	Very high	93.1	Very high	5 Å²	5	66.4 Å²	66.4	3%	0.034	34%	0.344	C	S	.	.	H	α-helix	trans	-57.7	-44.3	173.9	-74.9	0	0	0	0	112.3	L8 Y616 K617 T624 L649	L8-C620 HydrophobicContact CD1-CB 3.99Å; Y616-C620 VanDerWaalsContact CE1-SG 3.52Å; Y616-C620 VanDerWaalsContact CZ-SG 3.54Å; Y616-C620 WeakPolarHBondContact O-CB 3.31Å; Y616-C620 PolarHBondContact O-N 2.89Å; Y616-C620 PolarHBondContact O-SG 2.87Å; K617-C620 WeakPolarHBondContact O-CB 3.46Å; K617-C620 PolarHBondContact O-N 3.12Å; C620-T624 WeakPolarHBondContact O-CB 3.35Å; C620-T624 PolarHBondContact O-N 3.1Å; C620-T624 VanDerWaalsContact O-N 3.09Å; C620-T624 PolarHBondContact O-OG1 3.35Å; C620-L649 HydrophobicContact CB-CD2 4.43Å
621	E	94	Very high	93	Very high	109 Å²	109	63.7 Å²	63.7	51%	0.509	33%	0.33	S	S	.	.	H	α-helix	trans	-67.2	-40.1	177.2	-71.8	-175.9	-164	0	0	111.6	K617 R618 D619 T625	K617-E621 PolarHBondContact O-N 3.21Å; R618-E621 PolarHBondContact O-N 2.96Å; D619-E621 VanDerWaalsContact C-N 3.34Å; D619-E621 PolarHBondContact O-N 3.15Å; E621-T625 VanDerWaalsContact O-CB 3.28Å; E621-T625 WeakPolarHBondContact O-CB 3.45Å; E621-T625 PolarHBondContact O-N 3.28Å; E621-T625 VanDerWaalsContact O-N 3.08Å; E621-T625 PolarHBondContact O-OG1 3.25Å
622	A	93.8	Very high	92.9	Very high	52 Å²	52	66.1 Å²	66.1	43%	0.43	34%	0.343	S	S	.	.	H	α-helix	trans	-64.2	-59.5	176.6	0	0	0	0	0	112.4	R618 D619 T624 T625 V626	R618-A622 WeakPolarHBondContact O-CB 3.4Å; R618-A622 PolarHBondContact O-N 3.39Å; D619-A622 PolarHBondContact O-N 3.02Å; A622-T624 VanDerWaalsContact C-N 3.33Å; A622-T624 PolarHBondContact O-N 3.15Å; A622-T625 PolarHBondContact O-N 3.44Å; A622-V626 PolarHBondContact O-N 2.97Å
623	F	93.8	Very high	92.9	Very high	74 Å²	74	73.2 Å²	73.2	33%	0.325	37%	0.373	S	S	.	.	H	α-helix	trans	-59.7	-42.1	-178.7	-67.8	-57.6	0	0	0	112	D619 T625 V626 V627 L645 I648 L649	D619-F623 HydrophobicContact CB-CD2 4.16Å; D619-F623 HydrophobicContact CB-CE2 3.95Å; D619-F623 WeakPolarHBondContact O-CD2 3.32Å; D619-F623 PolarHBondContact O-N 3.08Å; F623-T625 VanDerWaalsContact C-N 3.26Å; F623-T625 PolarHBondContact O-N 2.95Å; F623-V626 PolarHBondContact O-N 3.45Å; F623-V627 WeakPolarHBondContact O-CB 3.25Å; F623-V627 WeakPolarHBondContact O-CG2 3.4Å; F623-V627 PolarHBondContact O-N 3.47Å; F623-L645 HydrophobicContact CB-CD1 3.62Å; F623-I648 HydrophobicContact CD1-CG2 4.17Å; F623-I648 HydrophobicContact CD2-CG2 3.95Å; F623-I648 HydrophobicContact CE1-CG2 3.84Å; F623-I648 HydrophobicContact CE2-CG2 3.6Å; F623-I648 HydrophobicContact CG-CG2 4.23Å; F623-I648 HydrophobicContact CZ-CG2 3.55Å; F623-L649 HydrophobicContact CB-CD2 4.37Å; F623-L649 HydrophobicContact CD2-CD2 3.74Å; F623-L649 HydrophobicContact CG-CD2 4.47Å
624	T	90.9	Very high	92.8	Very high	50 Å²	50	75.3 Å²	75.3	31%	0.307	38%	0.378	S	S	.	.	H	α-helix	trans	-67.8	-26.6	177.9	-53	0	0	0	0	111.9	C620 A622 R628	C620-T624 WeakPolarHBondContact O-CB 3.35Å; C620-T624 PolarHBondContact O-N 3.1Å; C620-T624 VanDerWaalsContact O-N 3.09Å; C620-T624 PolarHBondContact O-OG1 3.35Å; A622-T624 VanDerWaalsContact C-N 3.33Å; A622-T624 PolarHBondContact O-N 3.15Å; T624-R628 WeakPolarHBondContact O-CB 3.45Å; T624-R628 WeakPolarHBondContact O-CG 3.39Å; T624-R628 PolarHBondContact O-N 2.86Å; T624-R628 VanDerWaalsContact O-N 3.16Å; T624-R628 PolarHBondContact O-NE 3.21Å
625	T	93.3	Very high	92.7	Very high	55 Å²	55	77.9 Å²	77.9	34%	0.337	39%	0.39	S	S	.	.	H	α-helix	trans	-76.2	-47	174.7	-58.3	0	0	0	0	111.5	E621 A622 F623 V627 R628 M629	E621-T625 VanDerWaalsContact O-CB 3.28Å; E621-T625 WeakPolarHBondContact O-CB 3.45Å; E621-T625 PolarHBondContact O-N 3.28Å; E621-T625 VanDerWaalsContact O-N 3.08Å; E621-T625 PolarHBondContact O-OG1 3.25Å; A622-T625 PolarHBondContact O-N 3.44Å; F623-T625 VanDerWaalsContact C-N 3.26Å; F623-T625 PolarHBondContact O-N 2.95Å; T625-V627 PolarHBondContact O-N 2.8Å; T625-R628 PolarHBondContact O-N 2.8Å; T625-R628 PolarHBondContact OG1-NH2 3.24Å; T625-M629 HydrophobicContact CG2-SD 4.2Å; T625-M629 WeakPolarHBondContact O-CG 3.18Å; T625-M629 PolarHBondContact O-N 3.39Å
626	V	93.2	Very high	92.5	Very high	84 Å²	84	82.4 Å²	82.4	51%	0.509	41%	0.414	S	S	.	.	H	α-helix	trans	-58.6	-47.4	175.3	175.2	0	0	0	0	111	A622 F623 R628 M629 L630	A622-V626 PolarHBondContact O-N 2.97Å; F623-V626 PolarHBondContact O-N 3.45Å; V626-R628 PolarHBondContact O-N 2.93Å; V626-M629 PolarHBondContact O-N 3.3Å; V626-M629 VanDerWaalsContact O-N 3.16Å; V626-L630 HydrophobicContact CG1-CD1 4.04Å; V626-L630 HydrophobicContact CG1-CG 4.47Å; V626-L630 WeakPolarHBondContact O-CG 3.38Å; V626-L630 PolarHBondContact O-N 3.31Å
627	V	92	Very high	92.2	Very high	17 Å²	17	83.2 Å²	83.2	10%	0.103	42%	0.421	C	S	.	.	H	α-helix	trans	-64.4	-40	178.9	169.9	0	0	0	0	112.1	F623 T625 M629 L630 I631 L641 L645	F623-V627 WeakPolarHBondContact O-CB 3.25Å; F623-V627 WeakPolarHBondContact O-CG2 3.4Å; F623-V627 PolarHBondContact O-N 3.47Å; T625-V627 PolarHBondContact O-N 2.8Å; V627-M629 VanDerWaalsContact C-N 3.34Å; V627-M629 PolarHBondContact O-N 3.35Å; V627-L630 PolarHBondContact O-N 3.09Å; V627-I631 HydrophobicContact CG1-CD1 3.62Å; V627-I631 HydrophobicContact CG1-CG1 4.34Å; V627-I631 VanDerWaalsContact O-CG1 3.28Å; V627-I631 WeakPolarHBondContact O-CG1 3.49Å; V627-I631 PolarHBondContact O-N 3.42Å; V627-L641 HydrophobicContact CG1-CB 3.94Å; V627-L641 HydrophobicContact CG1-CD1 4.4Å; V627-L645 HydrophobicContact CB-CD2 4.21Å; V627-L645 HydrophobicContact CG1-CD2 4.07Å; V627-L645 HydrophobicContact CG2-CB 4.32Å; V627-L645 HydrophobicContact CG2-CD1 4.16Å; V627-L645 HydrophobicContact CG2-CD2 4.29Å; V627-L645 HydrophobicContact CG2-CG 4.49Å
628	R	90.6	Very high	92	Very high	142 Å²	142	84.8 Å²	84.8	54%	0.536	43%	0.429	S	S	.	.	H	α-helix	trans	-61.9	-40.8	172.5	-78.4	177.4	-63.9	167.5	1.2	112	T624 T625 V626 S632	T624-R628 WeakPolarHBondContact O-CB 3.45Å; T624-R628 WeakPolarHBondContact O-CG 3.39Å; T624-R628 PolarHBondContact O-N 2.86Å; T624-R628 VanDerWaalsContact O-N 3.16Å; T624-R628 PolarHBondContact O-NE 3.21Å; T625-R628 PolarHBondContact O-N 2.8Å; T625-R628 PolarHBondContact OG1-NH2 3.24Å; V626-R628 PolarHBondContact O-N 2.93Å; R628-S632 VanDerWaalsContact O-CB 3.31Å; R628-S632 WeakPolarHBondContact O-CB 3.23Å; R628-S632 PolarHBondContact O-N 3.09Å; R628-S632 PolarHBondContact O-OG 2.96Å
629	M	91.9	Very high	91.8	Very high	118 Å²	118	82.1 Å²	82.1	58%	0.581	43%	0.434	S	S	*	.	H	α-helix	trans	-66.5	-37.6	177.7	-72.9	174.9	65.5	0	0	112.5	T625 V626 V627 S632 K633	T625-M629 HydrophobicContact CG2-SD 4.2Å; T625-M629 WeakPolarHBondContact O-CG 3.18Å; T625-M629 PolarHBondContact O-N 3.39Å; V626-M629 PolarHBondContact O-N 3.3Å; V626-M629 VanDerWaalsContact O-N 3.16Å; V627-M629 VanDerWaalsContact C-N 3.34Å; V627-M629 PolarHBondContact O-N 3.35Å; M629-S632 PolarHBondContact O-N 3.03Å; M629-K633 PolarHBondContact O-N 3.44Å
630	L	91.6	Very high	91.6	Very high	64 Å²	64	88.6 Å²	88.6	34%	0.335	46%	0.455	S	S	.	.	H	α-helix	trans	-67.4	-47.6	175.6	-69.2	170.3	0	0	0	111.8	V626 V627 S632 K633 D634 L641	V626-L630 HydrophobicContact CG1-CD1 4.04Å; V626-L630 HydrophobicContact CG1-CG 4.47Å; V626-L630 WeakPolarHBondContact O-CG 3.38Å; V626-L630 PolarHBondContact O-N 3.31Å; V627-L630 PolarHBondContact O-N 3.09Å; L630-S632 PolarHBondContact O-N 3.25Å; L630-K633 PolarHBondContact O-N 3.03Å; L630-D634 PolarHBondContact O-N 3.15Å; L630-L641 HydrophobicContact CB-CD1 3.6Å; L630-L641 HydrophobicContact CD1-CD1 4.11Å; L630-L641 HydrophobicContact CD1-CD2 4.04Å
631	I	92	Very high	91.4	Very high	29 Å²	29	89.4 Å²	89.4	15%	0.149	46%	0.459	C	S	.	.	H	α-helix	trans	-62.3	-30.9	176.1	-65.5	167.5	0	0	0	111.6	V627 K633 D634 E638 L641 M642	V627-I631 HydrophobicContact CG1-CD1 3.62Å; V627-I631 HydrophobicContact CG1-CG1 4.34Å; V627-I631 VanDerWaalsContact O-CG1 3.28Å; V627-I631 WeakPolarHBondContact O-CG1 3.49Å; V627-I631 PolarHBondContact O-N 3.42Å; I631-K633 PolarHBondContact O-N 2.94Å; I631-D634 CarbonylContact O-C 3.42Å; I631-E638 HydrophobicContact CD1-CB 3.94Å; I631-E638 HydrophobicContact CD1-CG 3.95Å; I631-E638 HydrophobicContact CG1-CB 3.99Å; I631-E638 HydrophobicContact CG2-CB 4.05Å; I631-L641 HydrophobicContact CG1-CD1 3.89Å; I631-M642 HydrophobicContact CD1-CE 4.04Å
632	S	91.6	Very high	91.2	Very high	102 Å²	102	87.4 Å²	87.4	71%	0.713	45%	0.45	S	S	*	.	T	Hydrogen-bonded Turn	trans	-75.2	-10.2	176.6	-53.9	0	0	0	0	113.7	R628 M629 L630	R628-S632 VanDerWaalsContact O-CB 3.31Å; R628-S632 WeakPolarHBondContact O-CB 3.23Å; R628-S632 PolarHBondContact O-N 3.09Å; R628-S632 PolarHBondContact O-OG 2.96Å; M629-S632 PolarHBondContact O-N 3.03Å; L630-S632 PolarHBondContact O-N 3.25Å
633	K	93.6	Very high	91.1	Very high	165 Å²	165	88.1 Å²	88.1	72%	0.717	45%	0.451	S	S	*	.	T	Hydrogen-bonded Turn	trans	-96.2	-56.3	169.7	-70	-179	176.4	-171.6	0	110.2	M629 L630 I631	M629-K633 PolarHBondContact O-N 3.44Å; L630-K633 PolarHBondContact O-N 3.03Å; I631-K633 PolarHBondContact O-N 2.94Å
634	D	90.7	Very high	91	Very high	93 Å²	93	88.4 Å²	88.4	50%	0.497	45%	0.454	S	S	.	.			trans	-124.2	99	-174.8	-54.4	-54.9	0	0	0	109.7	L630 I631 D636 L637	L630-D634 PolarHBondContact O-N 3.15Å; I631-D634 CarbonylContact O-C 3.42Å; D634-D636 VanDerWaalsContact C-N 3.27Å; D634-D636 PolarHBondContact O-N 3.33Å; D634-L637 HydrophobicContact CB-CD1 3.75Å; D634-L637 HydrophobicContact CB-CG 3.76Å; D634-L637 WeakPolarHBondContact O-CB 3.49Å; D634-L637 PolarHBondContact O-N 3.33Å; D634-L637 VanDerWaalsContact O-N 3.13Å
635	Q	90.7	Very high	91.1	Very high	146 Å²	146	87 Å²	87	68%	0.682	44%	0.444	S	S	*	.	G	3₁₀ helix	trans	-62.7	-33.2	-173.4	-173.2	172.4	2	0	0	112.9	L637 E638	Q635-L637 PolarHBondContact O-N 2.94Å; Q635-L637 VanDerWaalsContact O-N 3.11Å; Q635-E638 WeakPolarHBondContact O-CB 3.36Å; Q635-E638 PolarHBondContact O-N 2.74Å
636	D	88.7	Confident	91	Very high	147 Å²	147	89.2 Å²	89.2	79%	0.786	45%	0.449	S	S	*	.	G	3₁₀ helix	trans	-58.8	-26	178.6	-63.9	-37.8	0	0	0	112.8	D634 E638 S639	D634-D636 VanDerWaalsContact C-N 3.27Å; D634-D636 PolarHBondContact O-N 3.33Å; D636-E638 PolarHBondContact O-N 3.5Å; D636-S639 PolarHBondContact O-N 3.29Å; D636-S639 PolarHBondContact O-OG 2.97Å
637	L	89.5	Confident	91	Very high	55 Å²	55	91.6 Å²	91.6	29%	0.288	46%	0.455	S	S	.	.	G	3₁₀ helix	trans	-67.3	-18.8	175.8	-60.9	-177.3	0	0	0	113.3	D634 Q635 S639 R640 L641	D634-L637 HydrophobicContact CB-CD1 3.75Å; D634-L637 HydrophobicContact CB-CG 3.76Å; D634-L637 WeakPolarHBondContact O-CB 3.49Å; D634-L637 PolarHBondContact O-N 3.33Å; D634-L637 VanDerWaalsContact O-N 3.13Å; Q635-L637 PolarHBondContact O-N 2.94Å; Q635-L637 VanDerWaalsContact O-N 3.11Å; L637-S639 PolarHBondContact O-N 3.16Å; L637-R640 PolarHBondContact O-N 2.89Å; L637-L641 HydrophobicContact CB-CD1 3.6Å; L637-L641 HydrophobicContact CB-CG 4.06Å; L637-L641 HydrophobicContact CD1-CD1 4.39Å; L637-L641 WeakPolarHBondContact O-CB 3.32Å; L637-L641 WeakPolarHBondContact O-CG 3.4Å; L637-L641 PolarHBondContact O-N 2.89Å
638	E	89.2	Confident	91.1	Very high	83 Å²	83	94 Å²	94	39%	0.388	47%	0.467	S	S	.	.	H	α-helix	trans	-53.9	-42.3	177.3	-179.5	174.7	-171.6	0	0	111.1	I631 Q635 D636 R640 M642	I631-E638 HydrophobicContact CD1-CB 3.94Å; I631-E638 HydrophobicContact CD1-CG 3.95Å; I631-E638 HydrophobicContact CG1-CB 3.99Å; I631-E638 HydrophobicContact CG2-CB 4.05Å; Q635-E638 WeakPolarHBondContact O-CB 3.36Å; Q635-E638 PolarHBondContact O-N 2.74Å; D636-E638 PolarHBondContact O-N 3.5Å; E638-R640 PolarHBondContact O-N 3.09Å; E638-M642 HydrophobicContact CG-CE 4.04Å; E638-M642 HydrophobicContact CG-CG 3.69Å; E638-M642 WeakPolarHBondContact O-CB 3.49Å; E638-M642 WeakPolarHBondContact O-CG 3.31Å; E638-M642 PolarHBondContact O-N 2.92Å; E638-M642 WeakPolarHBondContact OE1-CE 3.49Å
639	S	89.5	Confident	91.2	Very high	95 Å²	95	88.2 Å²	88.2	66%	0.664	45%	0.446	S	S	*	.	H	α-helix	trans	-55.7	-34.3	179.2	67.5	0	0	0	0	113.7	D636 L637 P643	D636-S639 PolarHBondContact O-N 3.29Å; D636-S639 PolarHBondContact O-OG 2.97Å; L637-S639 PolarHBondContact O-N 3.16Å; S639-P643 WeakPolarHBondContact O-CD 3.23Å; S639-P643 WeakPolarHBondContact O-CG 3.38Å
640	R	89.7	Confident	91.2	Very high	175 Å²	175	86.2 Å²	86.2	66%	0.66	44%	0.435	S	S	*	.	H	α-helix	trans	-103.4	-33.4	-172.2	-175	176.3	171	-165.6	-3	112.7	L637 E638 P643 M644	L637-R640 PolarHBondContact O-N 2.89Å; E638-R640 PolarHBondContact O-N 3.09Å; R640-P643 WeakPolarHBondContact O-CD 3.48Å; R640-M644 HydrophobicContact CG-CE 4.33Å; R640-M644 WeakPolarHBondContact O-CG 3.49Å
641	L	89.9	Confident	91.3	Very high	22 Å²	22	87.8 Å²	87.8	12%	0.115	44%	0.441	C	S	.	.	H	α-helix	trans	-74.7	-37.3	176.1	-68	170	0	0	0	112.3	V627 L630 I631 L637 M644 L645	V627-L641 HydrophobicContact CG1-CB 3.94Å; V627-L641 HydrophobicContact CG1-CD1 4.4Å; L630-L641 HydrophobicContact CB-CD1 3.6Å; L630-L641 HydrophobicContact CD1-CD1 4.11Å; L630-L641 HydrophobicContact CD1-CD2 4.04Å; I631-L641 HydrophobicContact CG1-CD1 3.89Å; L637-L641 HydrophobicContact CB-CD1 3.6Å; L637-L641 HydrophobicContact CB-CG 4.06Å; L637-L641 HydrophobicContact CD1-CD1 4.39Å; L637-L641 WeakPolarHBondContact O-CB 3.32Å; L637-L641 WeakPolarHBondContact O-CG 3.4Å; L637-L641 PolarHBondContact O-N 2.89Å; L641-M644 HydrophobicContact CD2-CE 3.85Å; L641-M644 PolarHBondContact O-N 3.21Å; L641-L645 WeakPolarHBondContact O-CB 3.24Å; L641-L645 PolarHBondContact O-N 3.28Å
642	M	89.2	Confident	91.3	Very high	68 Å²	68	89.7 Å²	89.7	34%	0.335	45%	0.446	S	S	.	.	H	α-helix	trans	-64.9	-31.7	-178.2	-75	-74.4	-171.3	0	0	114.8	I631 E638 K646	I631-M642 HydrophobicContact CD1-CE 4.04Å; E638-M642 HydrophobicContact CG-CE 4.04Å; E638-M642 HydrophobicContact CG-CG 3.69Å; E638-M642 WeakPolarHBondContact O-CB 3.49Å; E638-M642 WeakPolarHBondContact O-CG 3.31Å; E638-M642 PolarHBondContact O-N 2.92Å; E638-M642 WeakPolarHBondContact OE1-CE 3.49Å; M642-K646 VanDerWaalsContact O-CD 3.26Å; M642-K646 WeakPolarHBondContact O-CD 3.5Å; M642-K646 VanDerWaalsContact O-CE 3.25Å; M642-K646 WeakPolarHBondContact O-CE 3.2Å; M642-K646 VanDerWaalsContact O-CG 3.31Å; M642-K646 WeakPolarHBondContact O-CG 3.48Å
643	P	91.5	Very high	91.4	Very high	67 Å²	67	85.1 Å²	85.1	44%	0.435	42%	0.416	S	S	.	.	H	α-helix	trans	-65.8	-55.2	165	-25.7	35.6	0	0	0	112.8	S639 R640 L645 K646 E647	S639-P643 WeakPolarHBondContact O-CD 3.23Å; S639-P643 WeakPolarHBondContact O-CG 3.38Å; R640-P643 WeakPolarHBondContact O-CD 3.48Å; P643-L645 VanDerWaalsContact C-N 3.3Å; P643-L645 PolarHBondContact O-N 3.37Å; P643-K646 WeakPolarHBondContact O-CB 3.29Å; P643-K646 PolarHBondContact O-N 2.92Å; P643-E647 PolarHBondContact O-N 2.83Å; P643-E647 VanDerWaalsContact O-N 3.12Å
644	M	91.2	Very high	91.4	Very high	79 Å²	79	79.9 Å²	79.9	39%	0.389	39%	0.394	S	S	.	.	H	α-helix	trans	-60.6	-37	-175.9	-62.1	-173.8	-54.8	0	0	112.4	R640 L641 K646 E647 I648	R640-M644 HydrophobicContact CG-CE 4.33Å; R640-M644 WeakPolarHBondContact O-CG 3.49Å; L641-M644 HydrophobicContact CD2-CE 3.85Å; L641-M644 PolarHBondContact O-N 3.21Å; M644-K646 VanDerWaalsContact C-N 3.32Å; M644-K646 PolarHBondContact O-N 3.41Å; M644-E647 PolarHBondContact O-N 2.91Å; M644-I648 VanDerWaalsContact O-CG1 3.32Å; M644-I648 WeakPolarHBondContact O-CG1 3.31Å; M644-I648 PolarHBondContact O-N 2.72Å
645	L	92.7	Very high	91.6	Very high	21 Å²	21	81.5 Å²	81.5	11%	0.11	39%	0.393	C	S	.	.	H	α-helix	trans	-60.8	-39.1	173.7	-179.9	61.7	0	0	0	112.3	F623 V627 L641 P643 E647 L649	F623-L645 HydrophobicContact CB-CD1 3.62Å; V627-L645 HydrophobicContact CB-CD2 4.21Å; V627-L645 HydrophobicContact CG1-CD2 4.07Å; V627-L645 HydrophobicContact CG2-CB 4.32Å; V627-L645 HydrophobicContact CG2-CD1 4.16Å; V627-L645 HydrophobicContact CG2-CD2 4.29Å; V627-L645 HydrophobicContact CG2-CG 4.49Å; L641-L645 WeakPolarHBondContact O-CB 3.24Å; L641-L645 PolarHBondContact O-N 3.28Å; P643-L645 VanDerWaalsContact C-N 3.3Å; P643-L645 PolarHBondContact O-N 3.37Å; L645-E647 VanDerWaalsContact C-N 3.33Å; L645-L649 HydrophobicContact CD1-CD1 3.87Å; L645-L649 HydrophobicContact CD1-CG 4Å; L645-L649 HydrophobicContact CG-CD1 4.07Å; L645-L649 HydrophobicContact CG-CG 4.48Å; L645-L649 WeakPolarHBondContact O-CB 3.42Å; L645-L649 WeakPolarHBondContact O-CG 3.46Å; L645-L649 PolarHBondContact O-N 3.3Å
646	K	92.5	Very high	91.7	Very high	101 Å²	101	75.1 Å²	75.1	44%	0.439	36%	0.364	S	S	.	.	H	α-helix	trans	-70.4	-34.1	177.6	-67.6	162.6	-167.5	155.1	0	111.6	M642 P643 M644 H650	M642-K646 VanDerWaalsContact O-CD 3.26Å; M642-K646 WeakPolarHBondContact O-CD 3.5Å; M642-K646 VanDerWaalsContact O-CE 3.25Å; M642-K646 WeakPolarHBondContact O-CE 3.2Å; M642-K646 VanDerWaalsContact O-CG 3.31Å; M642-K646 WeakPolarHBondContact O-CG 3.48Å; P643-K646 WeakPolarHBondContact O-CB 3.29Å; P643-K646 PolarHBondContact O-N 2.92Å; M644-K646 VanDerWaalsContact C-N 3.32Å; M644-K646 PolarHBondContact O-N 3.41Å; K646-H650 WeakPolarHBondContact O-CB 3.42Å; K646-H650 PolarHBondContact O-N 2.85Å
647	E	93.3	Very high	91.9	Very high	134 Å²	134	70.6 Å²	70.6	63%	0.626	34%	0.339	S	S	*	.	H	α-helix	trans	-68.3	-52	177.4	-173.7	162.8	-147.1	0	0	111	P643 M644 L645 L649 H650 E651	P643-E647 PolarHBondContact O-N 2.83Å; P643-E647 VanDerWaalsContact O-N 3.12Å; M644-E647 PolarHBondContact O-N 2.91Å; L645-E647 VanDerWaalsContact C-N 3.33Å; E647-L649 PolarHBondContact O-N 2.95Å; E647-H650 WeakPolarHBondContact O-CB 3.34Å; E647-H650 PolarHBondContact O-N 2.95Å; E647-H650 VanDerWaalsContact O-N 3.12Å; E647-E651 WeakPolarHBondContact O-CB 3.48Å; E647-E651 PolarHBondContact O-N 2.98Å
648	I	93.1	Very high	92.1	Very high	69 Å²	69	72.3 Å²	72.3	35%	0.354	35%	0.346	S	S	.	.	H	α-helix	trans	-59	-46.6	176.6	-66.7	164.3	0	0	0	111.5	F623 M644 H650 E651 R652	F623-I648 HydrophobicContact CD1-CG2 4.17Å; F623-I648 HydrophobicContact CD2-CG2 3.95Å; F623-I648 HydrophobicContact CE1-CG2 3.84Å; F623-I648 HydrophobicContact CE2-CG2 3.6Å; F623-I648 HydrophobicContact CG-CG2 4.23Å; F623-I648 HydrophobicContact CZ-CG2 3.55Å; M644-I648 VanDerWaalsContact O-CG1 3.32Å; M644-I648 WeakPolarHBondContact O-CG1 3.31Å; M644-I648 PolarHBondContact O-N 2.72Å; I648-H650 VanDerWaalsContact C-N 3.33Å; I648-H650 PolarHBondContact O-N 2.94Å; I648-E651 PolarHBondContact O-N 3.31Å; I648-R652 WeakPolarHBondContact O-CB 3.49Å; I648-R652 PolarHBondContact O-N 2.84Å
649	L	93.1	Very high	92.3	Very high	20 Å²	20	70.6 Å²	70.6	11%	0.105	34%	0.339	C	S	.	.	H	α-helix	trans	-68.8	-31.1	177.3	-66	-178.1	0	0	0	112.5	Y616 C620 F623 L645 E647 G653	Y616-L649 WeakPolarHBondContact CE2-O 3.47Å; Y616-L649 PolarHBondContact OH-O 3.36Å; C620-L649 HydrophobicContact CB-CD2 4.43Å; F623-L649 HydrophobicContact CB-CD2 4.37Å; F623-L649 HydrophobicContact CD2-CD2 3.74Å; F623-L649 HydrophobicContact CG-CD2 4.47Å; L645-L649 HydrophobicContact CD1-CD1 3.87Å; L645-L649 HydrophobicContact CD1-CG 4Å; L645-L649 HydrophobicContact CG-CD1 4.07Å; L645-L649 HydrophobicContact CG-CG 4.48Å; L645-L649 WeakPolarHBondContact O-CB 3.42Å; L645-L649 WeakPolarHBondContact O-CG 3.46Å; L645-L649 PolarHBondContact O-N 3.3Å; E647-L649 PolarHBondContact O-N 2.95Å; L649-G653 PolarHBondContact O-N 2.99Å
650	H	91.9	Very high	92.4	Very high	76 Å²	76	67.9 Å²	67.9	35%	0.352	32%	0.317	S	S	.	.	H	α-helix	trans	-67.8	-49.7	172.6	175.3	-73.7	0	0	0	111.3	F12 K646 E647 I648 G653 Q654	F12-H650 HydrophobicContact CE2-CB 3.82Å; F12-H650 AromaticContact CE2-CD2 3.4Å; F12-H650 WeakPolarHBondContact CE2-CD2 3.47Å; F12-H650 AromaticContact CE2-CG 3.81Å; F12-H650 HydrophobicContact CZ-CB 4.2Å; F12-H650 AromaticContact CZ-CD2 3.25Å; F12-H650 WeakPolarHBondContact CZ-CD2 3.29Å; F12-H650 AromaticContact CZ-CG 3.76Å; F12-H650 AromaticContact CZ-NE2 3.82Å; K646-H650 WeakPolarHBondContact O-CB 3.42Å; K646-H650 PolarHBondContact O-N 2.85Å; E647-H650 WeakPolarHBondContact O-CB 3.34Å; E647-H650 PolarHBondContact O-N 2.95Å; E647-H650 VanDerWaalsContact O-N 3.12Å; I648-H650 VanDerWaalsContact C-N 3.33Å; I648-H650 PolarHBondContact O-N 2.94Å; H650-G653 PolarHBondContact O-N 3.04Å; H650-Q654 PolarHBondContact CE1-NE2 3.24Å; H650-Q654 PolarHBondContact NE2-NE2 3.07Å; H650-Q654 WeakPolarHBondContact O-CG 3.36Å; H650-Q654 PolarHBondContact O-N 3.43Å
651	E	93.7	Very high	92.5	Very high	97 Å²	97	65.8 Å²	65.8	45%	0.453	31%	0.309	S	S	.	.	H	α-helix	trans	-59.3	-50.8	179.1	-164.1	-162.4	169.8	0	0	111.1	E647 I648 G653 Q654 R655	E647-E651 WeakPolarHBondContact O-CB 3.48Å; E647-E651 PolarHBondContact O-N 2.98Å; I648-E651 PolarHBondContact O-N 3.31Å; E651-G653 VanDerWaalsContact C-N 3.26Å; E651-G653 PolarHBondContact O-N 3.29Å; E651-Q654 PolarHBondContact O-N 3.32Å; E651-Q654 VanDerWaalsContact O-N 3.11Å; E651-R655 WeakPolarHBondContact O-CG 3.48Å; E651-R655 PolarHBondContact O-N 3.04Å; E651-R655 IonicContact OE1-CZ 2.61Å; E651-R655 IonicContact OE1-NE 2.9Å; E651-R655 PolarHBondContact OE1-NE 3.4Å; E651-R655 IonicContact OE1-NH2 2.72Å; E651-R655 PolarHBondContact OE1-NH2 3.32Å; E651-R655 IonicContact OE2-NH2 3.47Å; E651-R655 PolarHBondContact OE2-NH2 3.01Å
652	R	92.5	Very high	92.6	Very high	68 Å²	68	68.4 Å²	68.4	26%	0.257	33%	0.327	S	S	.	.	H	α-helix	trans	-61.8	-35.1	177	-173.2	54.4	163.2	148.6	4.2	112.2	Y616 D619 I648 R655 C656	Y616-R652 HydrophobicContact CD2-CG 4.27Å; D619-R652 HydrophobicContact CB-CG 4.46Å; D619-R652 IonicContact OD2-CZ 3.43Å; D619-R652 IonicContact OD2-NE 2.67Å; D619-R652 PolarHBondContact OD2-NE 2.76Å; D619-R652 IonicContact OD2-NH2 3.36Å; D619-R652 PolarHBondContact OD2-NH2 2.95Å; I648-R652 WeakPolarHBondContact O-CB 3.49Å; I648-R652 PolarHBondContact O-N 2.84Å; R652-R655 PolarHBondContact O-N 2.79Å; R652-C656 PolarHBondContact O-N 3.04Å; R652-C656 VanDerWaalsContact O-N 3.09Å; R652-C656 PolarHBondContact O-SG 2.88Å; R652-C656 VanDerWaalsContact O-SG 3.34Å
653	G	94	Very high	92.7	Very high	7 Å²	7	66.9 Å²	66.9	7%	0.072	32%	0.318	C	S	.	.	H	α-helix	trans	-65.8	-37.8	174	0	0	0	0	0	113.6	Y616 L649 H650 E651 I657	Y616-G653 VanDerWaalsContact CE2-CA 3.45Å; L649-G653 PolarHBondContact O-N 2.99Å; H650-G653 PolarHBondContact O-N 3.04Å; E651-G653 VanDerWaalsContact C-N 3.26Å; E651-G653 PolarHBondContact O-N 3.29Å; G653-I657 WeakPolarHBondContact O-CD1 3.42Å; G653-I657 WeakPolarHBondContact O-CG1 3.26Å; G653-I657 PolarHBondContact O-N 2.98Å
654	Q	92.9	Very high	92.6	Very high	55 Å²	55	66 Å²	66	26%	0.257	31%	0.309	S	S	.	.	H	α-helix	trans	-67.4	-46.5	171.6	-62.1	-57.9	-10.9	0	0	110.8	H650 E651 C656 I657 E658	H650-Q654 PolarHBondContact CE1-NE2 3.24Å; H650-Q654 PolarHBondContact NE2-NE2 3.07Å; H650-Q654 WeakPolarHBondContact O-CG 3.36Å; H650-Q654 PolarHBondContact O-N 3.43Å; E651-Q654 PolarHBondContact O-N 3.32Å; E651-Q654 VanDerWaalsContact O-N 3.11Å; Q654-C656 PolarHBondContact O-N 2.94Å; Q654-C656 VanDerWaalsContact O-N 3.17Å; Q654-I657 CarbonylContact O-C 3.6Å; Q654-I657 WeakPolarHBondContact O-CA 3.25Å; Q654-I657 WeakPolarHBondContact O-CB 3.35Å; Q654-I657 PolarHBondContact O-N 3.49Å; Q654-E658 VanDerWaalsContact O-CD 3.24Å; Q654-E658 PolarHBondContact O-N 3.11Å
655	R	93.8	Very high	92.5	Very high	126 Å²	126	65.4 Å²	65.4	48%	0.475	31%	0.313	S	S	.	.	H	α-helix	trans	-54.4	-39.3	177.2	-65.3	-176	-160.9	173.2	4.2	112.6	E651 R652 I657 E658 D659	E651-R655 WeakPolarHBondContact O-CG 3.48Å; E651-R655 PolarHBondContact O-N 3.04Å; E651-R655 IonicContact OE1-CZ 2.61Å; E651-R655 IonicContact OE1-NE 2.9Å; E651-R655 PolarHBondContact OE1-NE 3.4Å; E651-R655 IonicContact OE1-NH2 2.72Å; E651-R655 PolarHBondContact OE1-NH2 3.32Å; E651-R655 IonicContact OE2-NH2 3.47Å; E651-R655 PolarHBondContact OE2-NH2 3.01Å; R652-R655 PolarHBondContact O-N 2.79Å; R655-I657 VanDerWaalsContact C-N 3.34Å; R655-E658 WeakPolarHBondContact CA-OE2 3.4Å; R655-E658 PolarHBondContact N-OE2 2.88Å; R655-E658 PolarHBondContact O-N 3.3Å; R655-D659 VanDerWaalsContact O-CB 3.28Å; R655-D659 WeakPolarHBondContact O-CB 3.4Å; R655-D659 PolarHBondContact O-N 3.07Å
656	C	93.5	Very high	92.2	Very high	13 Å²	13	68.8 Å²	68.8	9%	0.088	33%	0.331	C	S	.	.	H	α-helix	trans	-70.8	-25	175	-67.1	0	0	0	0	114	R652 Q654 L660	R652-C656 PolarHBondContact O-N 3.04Å; R652-C656 VanDerWaalsContact O-N 3.09Å; R652-C656 PolarHBondContact O-SG 2.88Å; R652-C656 VanDerWaalsContact O-SG 3.34Å; Q654-C656 PolarHBondContact O-N 2.94Å; Q654-C656 VanDerWaalsContact O-N 3.17Å; C656-L660 WeakPolarHBondContact O-CB 3.47Å; C656-L660 PolarHBondContact O-N 3.34Å
657	I	92.9	Very high	91.6	Very high	51 Å²	51	65.9 Å²	65.9	26%	0.262	32%	0.319	S	S	.	.	H	α-helix	trans	-80.4	-37.1	172.5	-66.8	164.3	0	0	0	110.5	G653 Q654 R655 R661	G653-I657 WeakPolarHBondContact O-CD1 3.42Å; G653-I657 WeakPolarHBondContact O-CG1 3.26Å; G653-I657 PolarHBondContact O-N 2.98Å; Q654-I657 CarbonylContact O-C 3.6Å; Q654-I657 WeakPolarHBondContact O-CA 3.25Å; Q654-I657 WeakPolarHBondContact O-CB 3.35Å; Q654-I657 PolarHBondContact O-N 3.49Å; R655-I657 VanDerWaalsContact C-N 3.34Å; I657-R661 WeakPolarHBondContact O-CB 3.3Å; I657-R661 VanDerWaalsContact O-CG 3.23Å; I657-R661 WeakPolarHBondContact O-CG 3.41Å; I657-R661 PolarHBondContact O-N 2.96Å
658	E	93.7	Very high	90.6	Very high	91 Å²	91	64.9 Å²	64.9	43%	0.425	31%	0.314	S	S	.	.	H	α-helix	trans	-65.2	-47.6	174.1	-79.1	125.1	-153.6	0	0	111.6	Q654 R655 L660 R661 T662	Q654-E658 VanDerWaalsContact O-CD 3.24Å; Q654-E658 PolarHBondContact O-N 3.11Å; R655-E658 WeakPolarHBondContact CA-OE2 3.4Å; R655-E658 PolarHBondContact N-OE2 2.88Å; R655-E658 PolarHBondContact O-N 3.3Å; E658-L660 PolarHBondContact O-N 2.72Å; E658-R661 WeakPolarHBondContact O-CA 3.48Å; E658-R661 WeakPolarHBondContact O-CB 3.49Å; E658-R661 PolarHBondContact O-N 2.97Å; E658-T662 PolarHBondContact O-N 3.2Å; E658-T662 PolarHBondContact O-OG1 3.43Å
659	D	93.1	Very high	89	Confident	47 Å²	47	65.1 Å²	65.1	25%	0.251	32%	0.319	S	S	.	.	H	α-helix	trans	-57.4	-45.9	174.6	-174.1	-44.1	0	0	0	111.9	R608 L612 R655 R661 T662 F663	R608-D659 IonicContact CZ-OD1 2.93Å; R608-D659 VanDerWaalsContact CZ-OD1 3.22Å; R608-D659 IonicContact CZ-OD2 3.22Å; R608-D659 IonicContact NE-OD1 2.97Å; R608-D659 PolarHBondContact NE-OD1 3.44Å; R608-D659 IonicContact NH2-OD1 2.72Å; R608-D659 PolarHBondContact NH2-OD1 3.13Å; R608-D659 IonicContact NH2-OD2 2.71Å; R608-D659 PolarHBondContact NH2-OD2 3.43Å; L612-D659 HydrophobicContact CD1-CB 4.1Å; L612-D659 HydrophobicContact CD2-CB 4.09Å; R655-D659 VanDerWaalsContact O-CB 3.28Å; R655-D659 WeakPolarHBondContact O-CB 3.4Å; R655-D659 PolarHBondContact O-N 3.07Å; D659-R661 VanDerWaalsContact C-N 3.27Å; D659-R661 PolarHBondContact O-N 3.21Å; D659-T662 WeakPolarHBondContact CA-OG1 3.34Å; D659-T662 PolarHBondContact O-N 2.88Å; D659-T662 PolarHBondContact O-OG1 3.21Å; D659-F663 WeakPolarHBondContact O-CB 3.28Å; D659-F663 PolarHBondContact O-N 2.86Å
660	L	93	Very high	87.3	Confident	39 Å²	39	68.1 Å²	68.1	20%	0.204	34%	0.335	C	S	.	.	H	α-helix	trans	-64.3	-31.9	175.2	-177.5	58.5	0	0	0	112.4	R608 K609 L612 C656 E658 I664	R608-L660 HydrophobicContact CG-CD1 4.48Å; K609-L660 HydrophobicContact CB-CD1 3.86Å; K609-L660 HydrophobicContact CB-CD2 4.05Å; K609-L660 HydrophobicContact CG-CD2 3.87Å; L612-L660 HydrophobicContact CD1-CB 3.82Å; C656-L660 WeakPolarHBondContact O-CB 3.47Å; C656-L660 PolarHBondContact O-N 3.34Å; E658-L660 PolarHBondContact O-N 2.72Å; L660-I664 HydrophobicContact CD1-CD1 4.08Å; L660-I664 HydrophobicContact CD1-CG1 4.39Å; L660-I664 HydrophobicContact CG-CD1 4Å; L660-I664 WeakPolarHBondContact O-CB 3.35Å; L660-I664 WeakPolarHBondContact O-CD1 3.24Å; L660-I664 WeakPolarHBondContact O-CG1 3.4Å; L660-I664 PolarHBondContact O-N 3.1Å; L660-I664 VanDerWaalsContact O-N 3.09Å
661	R	91.3	Very high	85.6	Confident	130 Å²	130	67.6 Å²	67.6	49%	0.491	33%	0.332	S	S	.	.	H	α-helix	trans	-73	-45.9	176.1	-77.2	168.9	-179	-176.2	3.5	112.2	I657 E658 D659 F663 I664 S665	I657-R661 WeakPolarHBondContact O-CB 3.3Å; I657-R661 VanDerWaalsContact O-CG 3.23Å; I657-R661 WeakPolarHBondContact O-CG 3.41Å; I657-R661 PolarHBondContact O-N 2.96Å; E658-R661 WeakPolarHBondContact O-CA 3.48Å; E658-R661 WeakPolarHBondContact O-CB 3.49Å; E658-R661 PolarHBondContact O-N 2.97Å; D659-R661 VanDerWaalsContact C-N 3.27Å; D659-R661 PolarHBondContact O-N 3.21Å; R661-F663 VanDerWaalsContact C-N 3.28Å; R661-F663 PolarHBondContact O-N 3.42Å; R661-I664 PolarHBondContact O-N 2.93Å; R661-S665 WeakPolarHBondContact O-CB 3.27Å; R661-S665 PolarHBondContact O-N 3.45Å; R661-S665 PolarHBondContact O-OG 3.06Å
662	T	91.7	Very high	83.7	Confident	78 Å²	78	66 Å²	66	48%	0.479	33%	0.332	S	S	.	.	H	α-helix	trans	-58.6	-46.3	175.4	48.1	0	0	0	0	109.5	E658 D659 I664 S665 D666	E658-T662 PolarHBondContact O-N 3.2Å; E658-T662 PolarHBondContact O-OG1 3.43Å; D659-T662 WeakPolarHBondContact CA-OG1 3.34Å; D659-T662 PolarHBondContact O-N 2.88Å; D659-T662 PolarHBondContact O-OG1 3.21Å; T662-I664 PolarHBondContact O-N 3.13Å; T662-S665 CarbonylContact O-C 3.59Å; T662-S665 WeakPolarHBondContact O-CB 3.4Å; T662-S665 PolarHBondContact O-N 3.08Å; T662-D666 WeakPolarHBondContact O-CB 3.11Å; T662-D666 PolarHBondContact O-N 3.47Å; T662-D666 VanDerWaalsContact O-OD2 3.13Å
663	F	91.3	Very high	81.9	Confident	35 Å²	35	66.3 Å²	66.3	15%	0.154	34%	0.339	C	S	.	.	H	α-helix	trans	-57.7	-43.2	176.7	-164.9	-97.1	0	0	0	113.7	L604 I605 R608 D659 R661 H667	L604-F663 HydrophobicContact CD1-CE1 4.47Å; L604-F663 HydrophobicContact CD1-CZ 3.85Å; L604-F663 HydrophobicContact CD2-CZ 4.35Å; L604-F663 HydrophobicContact CG-CE1 3.97Å; L604-F663 HydrophobicContact CG-CZ 3.69Å; I605-F663 HydrophobicContact CG1-CD1 4.29Å; I605-F663 HydrophobicContact CG1-CE1 4.29Å; R608-F663 HydrophobicContact CB-CD1 3.67Å; R608-F663 HydrophobicContact CB-CD2 4.46Å; R608-F663 HydrophobicContact CB-CE1 3.52Å; R608-F663 HydrophobicContact CB-CE2 4.34Å; R608-F663 HydrophobicContact CB-CG 4.13Å; R608-F663 HydrophobicContact CB-CZ 3.87Å; R608-F663 HydrophobicContact CG-CB 4.09Å; R608-F663 HydrophobicContact CG-CD1 3.65Å; R608-F663 HydrophobicContact CG-CD2 3.85Å; R608-F663 HydrophobicContact CG-CE1 3.94Å; R608-F663 HydrophobicContact CG-CE2 4.12Å; R608-F663 HydrophobicContact CG-CG 3.59Å; R608-F663 HydrophobicContact CG-CZ 4.15Å; D659-F663 WeakPolarHBondContact O-CB 3.28Å; D659-F663 PolarHBondContact O-N 2.86Å; R661-F663 VanDerWaalsContact C-N 3.28Å; R661-F663 PolarHBondContact O-N 3.42Å; F663-H667 AromaticContact CD1-CD2 3.92Å; F663-H667 AromaticContact CE1-CD2 3.65Å; F663-H667 AromaticContact CE1-NE2 3.93Å; F663-H667 AromaticContact CE2-CD2 3.98Å; F663-H667 AromaticContact CE2-NE2 3.76Å; F663-H667 AromaticContact CZ-CD2 3.69Å; F663-H667 AromaticContact CZ-NE2 3.49Å; F663-H667 WeakPolarHBondContact CZ-NE2 3.21Å; F663-H667 WeakPolarHBondContact O-CB 3.04Å; F663-H667 PolarHBondContact O-CD2 3.03Å; F663-H667 VanDerWaalsContact O-CD2 3.31Å; F663-H667 PolarHBondContact O-N 3.43Å; F663-H667 VanDerWaalsContact O-N 3.11Å
664	I	90.3	Very high	80.1	Confident	49 Å²	49	72.3 Å²	72.3	25%	0.251	37%	0.367	S	S	.	.	H	α-helix	trans	-66.8	-40.4	175.7	-70.9	166.3	0	0	0	111.2	I605 L660 R661 T662 Q668	I605-I664 HydrophobicContact CD1-CG1 4.16Å; I605-I664 HydrophobicContact CG1-CG1 4.17Å; I605-I664 HydrophobicContact CG2-CD1 4.14Å; I605-I664 HydrophobicContact CG2-CG1 3.94Å; L660-I664 HydrophobicContact CD1-CD1 4.08Å; L660-I664 HydrophobicContact CD1-CG1 4.39Å; L660-I664 HydrophobicContact CG-CD1 4Å; L660-I664 WeakPolarHBondContact O-CB 3.35Å; L660-I664 WeakPolarHBondContact O-CD1 3.24Å; L660-I664 WeakPolarHBondContact O-CG1 3.4Å; L660-I664 PolarHBondContact O-N 3.1Å; L660-I664 VanDerWaalsContact O-N 3.09Å; R661-I664 PolarHBondContact O-N 2.93Å; T662-I664 PolarHBondContact O-N 3.13Å; I664-Q668 HydrophobicContact CG2-CG 4.38Å; I664-Q668 WeakPolarHBondContact O-CB 3.44Å; I664-Q668 VanDerWaalsContact O-CG 3.28Å; I664-Q668 WeakPolarHBondContact O-CG 3.48Å; I664-Q668 PolarHBondContact O-N 2.9Å
665	S	88.3	Confident	78.2	Confident	66 Å²	66	74.6 Å²	74.6	46%	0.462	38%	0.381	S	S	.	.	H	α-helix	trans	-64.6	-46.5	176.2	-74.1	0	0	0	0	112.3	R661 T662 H667 Q668 V669	R661-S665 WeakPolarHBondContact O-CB 3.27Å; R661-S665 PolarHBondContact O-N 3.45Å; R661-S665 PolarHBondContact O-OG 3.06Å; T662-S665 CarbonylContact O-C 3.59Å; T662-S665 WeakPolarHBondContact O-CB 3.4Å; T662-S665 PolarHBondContact O-N 3.08Å; S665-H667 VanDerWaalsContact C-N 3.33Å; S665-H667 PolarHBondContact O-N 3.15Å; S665-Q668 PolarHBondContact O-N 3.11Å; S665-V669 WeakPolarHBondContact O-CB 3.35Å; S665-V669 VanDerWaalsContact O-CG2 3.3Å; S665-V669 WeakPolarHBondContact O-CG2 3.41Å; S665-V669 PolarHBondContact O-N 2.95Å
666	D	86.8	Confident	76.1	Confident	93 Å²	93	73.3 Å²	73.3	50%	0.497	38%	0.38	S	S	.	.	H	α-helix	trans	-60.3	-44	179.3	-59.7	-27	0	0	0	110.5	T662 N670	T662-D666 WeakPolarHBondContact O-CB 3.11Å; T662-D666 PolarHBondContact O-N 3.47Å; T662-D666 VanDerWaalsContact O-OD2 3.13Å; D666-N670 WeakPolarHBondContact O-CB 3.33Å; D666-N670 PolarHBondContact O-N 2.65Å; D666-N670 PolarHBondContact O-ND2 3.49Å
667	H	80.6	Confident	74.1	Confident	40 Å²	40	79.7 Å²	79.7	19%	0.185	41%	0.407	C	S	.	.	H	α-helix	trans	-71.8	-36.1	177.3	-82.4	-78	0	0	0	113.9	V601 L604 F663 S665 N670 E671	V601-H667 HydrophobicContact CG1-CB 4.13Å; L604-H667 WeakPolarHBondContact CD2-CE1 3.17Å; F663-H667 AromaticContact CD1-CD2 3.92Å; F663-H667 AromaticContact CE1-CD2 3.65Å; F663-H667 AromaticContact CE1-NE2 3.93Å; F663-H667 AromaticContact CE2-CD2 3.98Å; F663-H667 AromaticContact CE2-NE2 3.76Å; F663-H667 AromaticContact CZ-CD2 3.69Å; F663-H667 AromaticContact CZ-NE2 3.49Å; F663-H667 WeakPolarHBondContact CZ-NE2 3.21Å; F663-H667 WeakPolarHBondContact O-CB 3.04Å; F663-H667 PolarHBondContact O-CD2 3.03Å; F663-H667 VanDerWaalsContact O-CD2 3.31Å; F663-H667 PolarHBondContact O-N 3.43Å; F663-H667 VanDerWaalsContact O-N 3.11Å; S665-H667 VanDerWaalsContact C-N 3.33Å; S665-H667 PolarHBondContact O-N 3.15Å; H667-N670 PolarHBondContact O-N 2.91Å; H667-E671 PolarHBondContact O-N 3.44Å
668	Q	70.9	Confident	72.3	Confident	113 Å²	113	84.4 Å²	84.4	53%	0.528	43%	0.425	S	S	.	.	H	α-helix	trans	-68.5	-37.5	174.1	-75.9	178.1	0.6	0	0	112.6	I664 S665 N670 E671 S672	I664-Q668 HydrophobicContact CG2-CG 4.38Å; I664-Q668 WeakPolarHBondContact O-CB 3.44Å; I664-Q668 VanDerWaalsContact O-CG 3.28Å; I664-Q668 WeakPolarHBondContact O-CG 3.48Å; I664-Q668 PolarHBondContact O-N 2.9Å; S665-Q668 PolarHBondContact O-N 3.11Å; Q668-N670 VanDerWaalsContact C-N 3.31Å; Q668-E671 PolarHBondContact O-N 3.06Å; Q668-S672 PolarHBondContact O-N 3.49Å; Q668-S672 PolarHBondContact O-OG 3.09Å
669	V	60.1	Low	70.3	Confident	74 Å²	74	87 Å²	87	45%	0.448	44%	0.437	S	S	.	.	H	α-helix	trans	-66.4	-35.3	173.8	169.5	0	0	0	0	110.9	S665 S672 N673	S665-V669 WeakPolarHBondContact O-CB 3.35Å; S665-V669 VanDerWaalsContact O-CG2 3.3Å; S665-V669 WeakPolarHBondContact O-CG2 3.41Å; S665-V669 PolarHBondContact O-N 2.95Å; V669-S672 WeakPolarHBondContact CA-OG 3.33Å; V669-S672 PolarHBondContact O-N 3.34Å; V669-S672 PolarHBondContact O-OG 3.23Å; V669-N673 WeakPolarHBondContact O-CB 3.44Å; V669-N673 PolarHBondContact O-N 3.21Å; V669-N673 PolarHBondContact O-ND2 2.93Å; V669-N673 PolarHBondContact O-OD1 3.37Å
670	N	57.3	Low	68.6	Low	83 Å²	83	91.3 Å²	91.3	44%	0.444	45%	0.454	S	S	.	.	H	α-helix	trans	-68.1	-37	173.2	-71.6	-31.4	0	0	0	112.7	D666 H667 Q668 M674	D666-N670 WeakPolarHBondContact O-CB 3.33Å; D666-N670 PolarHBondContact O-N 2.65Å; D666-N670 PolarHBondContact O-ND2 3.49Å; H667-N670 PolarHBondContact O-N 2.91Å; Q668-N670 VanDerWaalsContact C-N 3.31Å; N670-M674 WeakPolarHBondContact O-CB 3.16Å; N670-M674 WeakPolarHBondContact O-CG 3.26Å; N670-M674 PolarHBondContact O-N 3.31Å
671	E	56	Low	66.8	Low	64 Å²	64	95.3 Å²	95.3	30%	0.299	48%	0.476	S	S	.	.	H	α-helix	trans	-60.9	-44.4	170.5	-74.3	-173.3	154.5	0	0	111.5	S598 V601 H667 Q668 N675	S598-E671 PolarHBondContact OG-OE1 3.3Å; V601-E671 HydrophobicContact CG2-CG 4.36Å; H667-E671 PolarHBondContact O-N 3.44Å; Q668-E671 PolarHBondContact O-N 3.06Å; E671-N675 VanDerWaalsContact O-CG 3.22Å; E671-N675 PolarHBondContact O-N 3.05Å; E671-N675 PolarHBondContact O-ND2 3.19Å
672	S	54	Low	65	Low	63 Å²	63	97 Å²	97	44%	0.441	49%	0.488	S	S	.	.	H	α-helix	trans	-66.6	-43.6	177.2	56.3	0	0	0	0	113	Q668 V669 M674 N675 E676	Q668-S672 PolarHBondContact O-N 3.49Å; Q668-S672 PolarHBondContact O-OG 3.09Å; V669-S672 WeakPolarHBondContact CA-OG 3.33Å; V669-S672 PolarHBondContact O-N 3.34Å; V669-S672 PolarHBondContact O-OG 3.23Å; S672-M674 VanDerWaalsContact C-N 3.35Å; S672-M674 PolarHBondContact O-N 3.32Å; S672-N675 PolarHBondContact O-N 3.34Å; S672-E676 PolarHBondContact O-N 2.97Å
673	N	54.4	Low	63.1	Low	75 Å²	75	100 Å²	100	40%	0.401	50%	0.5	S	S	.	.	H	α-helix	trans	-67.5	-35.4	-177.5	-66.6	-3.9	0	0	0	112.1	V669 F677	V669-N673 WeakPolarHBondContact O-CB 3.44Å; V669-N673 PolarHBondContact O-N 3.21Å; V669-N673 PolarHBondContact O-ND2 2.93Å; V669-N673 PolarHBondContact O-OD1 3.37Å; N673-F677 PolarHBondContact O-N 3.37Å; N673-F677 VanDerWaalsContact O-N 3.09Å
674	M	55.4	Low	60.7	Low	133 Å²	133	109.1 Å²	109.1	66%	0.655	55%	0.55	S	S	*	*	H	α-helix	trans	-70	-32.8	174.3	-72.5	-70.1	175.1	0	0	112.4	N670 S672 K678	N670-M674 WeakPolarHBondContact O-CB 3.16Å; N670-M674 WeakPolarHBondContact O-CG 3.26Å; N670-M674 PolarHBondContact O-N 3.31Å; S672-M674 VanDerWaalsContact C-N 3.35Å; S672-M674 PolarHBondContact O-N 3.32Å; M674-K678 WeakPolarHBondContact O-CG 3.18Å; M674-K678 PolarHBondContact O-N 2.76Å; M674-K678 VanDerWaalsContact O-N 3.15Å
675	N	53.1	Low	59.2	Low	104 Å²	104	112.1 Å²	112.1	56%	0.556	57%	0.565	S	S	*	*	H	α-helix	trans	-71.3	-42.9	174.3	-70.6	-28.8	0	0	0	111.7	E671 S672 F677 K678 E679	E671-N675 VanDerWaalsContact O-CG 3.22Å; E671-N675 PolarHBondContact O-N 3.05Å; E671-N675 PolarHBondContact O-ND2 3.19Å; S672-N675 PolarHBondContact O-N 3.34Å; N675-F677 VanDerWaalsContact C-N 3.29Å; N675-F677 PolarHBondContact O-N 3.06Å; N675-K678 PolarHBondContact O-N 3.09Å; N675-E679 PolarHBondContact O-N 2.95Å
676	E	50.2	Low	57.7	Low	99 Å²	99	114.5 Å²	114.5	46%	0.463	57%	0.571	S	S	.	*	H	α-helix	trans	-62.2	-36.6	175.6	-163.9	-171.7	141.3	0	0	111.9	S672 K680	S672-E676 PolarHBondContact O-N 2.97Å; E676-K680 HydrophobicContact CG-CD 4.41Å; E676-K680 WeakPolarHBondContact O-CG 3.44Å; E676-K680 PolarHBondContact O-N 3.17Å; E676-K680 IonicContact OE1-NZ 2.69Å; E676-K680 PolarHBondContact OE1-NZ 3.2Å
677	F	51.8	Low	56	Low	147 Å²	147	115.7 Å²	115.7	65%	0.645	58%	0.575	S	S	*	*	H	α-helix	trans	-68.3	-30.7	172.5	-105.5	-88.1	0	0	0	113.5	N673 N675 N681	N673-F677 PolarHBondContact O-N 3.37Å; N673-F677 VanDerWaalsContact O-N 3.09Å; N675-F677 VanDerWaalsContact C-N 3.29Å; N675-F677 PolarHBondContact O-N 3.06Å; F677-N681 PolarHBondContact O-ND2 3.48Å
678	K	54.3	Low	54.6	Low	150 Å²	150	120.2 Å²	120.2	65%	0.652	60%	0.598	S	S	*	*	H	α-helix	trans	-74.2	-40.5	174.5	-76.9	-176.1	176.5	-173.3	0	112.3	M674 N675 K680 N681	M674-K678 WeakPolarHBondContact O-CG 3.18Å; M674-K678 PolarHBondContact O-N 2.76Å; M674-K678 VanDerWaalsContact O-N 3.15Å; N675-K678 PolarHBondContact O-N 3.09Å; K678-K680 VanDerWaalsContact C-N 3.27Å; K678-K680 PolarHBondContact O-N 3.38Å; K678-N681 PolarHBondContact O-N 3.2Å
679	E	53.3	Low	53.6	Low	145 Å²	145	120.6 Å²	120.6	68%	0.678	60%	0.602	S	S	*	*	H	α-helix	trans	-63.6	-33.2	177.8	-166.9	165.5	-162.5	0	0	112	N675 N681	N675-E679 PolarHBondContact O-N 2.95Å; E679-N681 VanDerWaalsContact C-N 3.35Å; E679-N681 PolarHBondContact O-N 2.61Å
680	K	57	Low	53.1	Low	137 Å²	137	123.7 Å²	123.7	60%	0.596	61%	0.613	S	S	*	*	T	Hydrogen-bonded Turn	trans	-79.5	-4.9	175.8	-73.2	172.5	175.3	173.2	0	115.7	E676 K678	E676-K680 HydrophobicContact CG-CD 4.41Å; E676-K680 WeakPolarHBondContact O-CG 3.44Å; E676-K680 PolarHBondContact O-N 3.17Å; E676-K680 IonicContact OE1-NZ 2.69Å; E676-K680 PolarHBondContact OE1-NZ 3.2Å; K678-K680 VanDerWaalsContact C-N 3.27Å; K678-K680 PolarHBondContact O-N 3.38Å
681	N	55.4	Low	52.8	Low	124 Å²	124	126.6 Å²	126.6	66%	0.663	63%	0.625	S	S	*	*	T	Hydrogen-bonded Turn	trans	-116.7	26.9	178.3	-75	-82.8	0	0	0	112.3	F677 K678 E679	F677-N681 PolarHBondContact O-ND2 3.48Å; K678-N681 PolarHBondContact O-N 3.2Å; E679-N681 VanDerWaalsContact C-N 3.35Å; E679-N681 PolarHBondContact O-N 2.61Å
682	H	52.9	Low	52.6	Low	164 Å²	164	131.5 Å²	131.5	76%	0.759	65%	0.65	S	S	*	*	S	Bend	trans	-138.5	32.8	177.9	-166.2	34	0	0	0	112.3
683	I	51.3	Low	52.5	Low	143 Å²	143	137.2 Å²	137.2	73%	0.733	67%	0.667	S	S	*	*			trans	-129	-11	-177.3	-62.7	-179.9	0	0	0	112
684	D	40.7	Very low	52.3	Low	225 Å²	225	142.8 Å²	142.8	100%	1.203	69%	0.691	S	S	*	*			trans	-101.6	0	162	-67.8	-45.5	0	0	0	109.7

Retrieved 684 of 684 residues in 275.1 ms (Link to these results)

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