A0A3Q0KSD0_SCHMA Loading...

AXH domain-containing protein

AlphaFold DB , UniProt , Accession A0A3Q0KSD0, Species SCHMA (Schistosoma mansoni, Blood fluke), Gene n/a, Length 723 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	36	Very low	30.5	Very low	226 Å²	226	166.2 Å²	166.2	100%	1.113	84%	0.835	S	S	*	*				0	84.4	0	-68.6	162.1	169.8	0	0	106.3
2	N	29.4	Very low	30.2	Very low	134 Å²	134	161.8 Å²	161.8	72%	0.717	83%	0.832	S	S	*	*			cis	65	126.6	40.5	-55.1	50.2	0	0	0	111
3	Q	30.1	Very low	30.1	Very low	169 Å²	169	159.5 Å²	159.5	79%	0.79	83%	0.829	S	S	*	*			cis	-154.4	168.5	-3.8	-132	152.8	-33.2	0	0	111.2
4	H	30.7	Very low	29.9	Very low	178 Å²	178	162.3 Å²	162.3	82%	0.824	83%	0.832	S	S	*	*			trans	-67.3	131.9	179.4	-79	-107.8	0	0	0	112.3
5	T	33.2	Very low	29.6	Very low	134 Å²	134	161.7 Å²	161.7	82%	0.822	83%	0.831	S	S	*	*			trans	-92.1	106.5	157.1	34.5	0	0	0	0	109.5
6	L	30.2	Very low	29.7	Very low	152 Å²	152	158.1 Å²	158.1	80%	0.796	83%	0.825	S	S	*	*			trans	-114.7	107.6	169.4	-105.5	167	0	0	0	107.9
7	Y	31	Very low	29.5	Very low	221 Å²	221	155.9 Å²	155.9	87%	0.867	83%	0.826	S	S	*	*			trans	-93	115.7	179.4	-115.2	-90.9	0	0	0	110.2
8	N	28.5	Very low	29.4	Very low	140 Å²	140	154 Å²	154	75%	0.749	82%	0.816	S	S	*	*			trans	-84.3	147.6	163.5	-77.5	-25	0	0	0	109.7
9	P	32.3	Very low	29.3	Very low	120 Å²	120	151.2 Å²	151.2	78%	0.779	81%	0.808	S	S	*	*			trans	-127.7	100.2	150.6	32.7	-18	0	0	0	110.8
10	I	27.1	Very low	29.3	Very low	158 Å²	158	151 Å²	151	81%	0.81	81%	0.807	S	S	*	*			trans	-126.9	76.7	161.2	-55.3	179	0	0	0	107.2
11	E	26.8	Very low	29.3	Very low	196 Å²	196	149 Å²	149	92%	0.916	80%	0.804	S	S	*	*			trans	-166.3	103.6	162.4	-117.5	166.9	-143.6	0	0	110.7
12	S	27.2	Very low	28.9	Very low	114 Å²	114	145.4 Å²	145.4	80%	0.797	79%	0.785	S	S	*	*			trans	-177.9	172.9	160.9	44.2	0	0	0	0	108.8
13	V	29.6	Very low	28.8	Very low	131 Å²	131	147.1 Å²	147.1	79%	0.794	79%	0.786	S	S	*	*			trans	67.9	56.6	-175.6	-158.9	0	0	0	0	114
14	F	26.2	Very low	29.2	Very low	199 Å²	199	145.9 Å²	145.9	87%	0.873	78%	0.78	S	S	*	*			trans	-93.5	156.9	133.7	-93.9	-89.8	0	0	0	108.9
15	N	26.1	Very low	29.2	Very low	153 Å²	153	144.8 Å²	144.8	82%	0.818	77%	0.774	S	S	*	*			trans	70.7	80.1	170.2	-56.2	-18.7	0	0	0	118.8
16	S	30.3	Very low	29.3	Very low	105 Å²	105	143 Å²	143	73%	0.734	76%	0.759	S	S	*	*			trans	-160.9	86.5	137.9	45.6	0	0	0	0	113.7
17	S	26.3	Very low	29.7	Very low	121 Å²	121	143.3 Å²	143.3	85%	0.846	75%	0.751	S	S	*	*			trans	17.5	105.3	147.6	56.8	0	0	0	0	120.2
18	N	29	Very low	30.5	Very low	121 Å²	121	134.3 Å²	134.3	65%	0.647	72%	0.717	S	S	*	*			trans	-149.9	113	141.7	-168.9	-9.1	0	0	0	109.2	N20	N18-N20 PolarHBondContact O-N 2.78Å
19	P	26	Very low	31.4	Very low	101 Å²	101	132.8 Å²	132.8	66%	0.656	71%	0.705	S	S	*	*			trans	-81.3	-7.7	-168.5	31.4	-35.3	0	0	0	115.3	S21	P19-S21 VanDerWaalsContact C-N 3.28Å; P19-S21 PolarHBondContact O-N 3.12Å; P19-S21 VanDerWaalsContact O-N 3.17Å
20	N	29.6	Very low	32.4	Very low	147 Å²	147	130.7 Å²	130.7	79%	0.786	69%	0.69	S	S	*	*	T	Hydrogen-bonded Turn	trans	-87.1	25.4	-168.5	-67	0.6	0	0	0	114.9	N18	N18-N20 PolarHBondContact O-N 2.78Å
21	S	30.7	Very low	33.6	Very low	108 Å²	108	125.7 Å²	125.7	76%	0.755	66%	0.664	S	S	*	*	T	Hydrogen-bonded Turn	trans	-121	8.3	-178.5	60.7	0	0	0	0	114.9	P19	P19-S21 VanDerWaalsContact C-N 3.28Å; P19-S21 PolarHBondContact O-N 3.12Å; P19-S21 VanDerWaalsContact O-N 3.17Å
22	Q	26.9	Very low	34.8	Very low	152 Å²	152	117.6 Å²	117.6	71%	0.71	63%	0.626	S	S	*	*			trans	-83	153.1	162.5	-67.6	-179.5	-68	0	0	110
23	F	27.2	Very low	36	Very low	170 Å²	170	115.2 Å²	115.2	75%	0.746	60%	0.604	S	S	*	*			trans	74.4	69.3	178.2	-51.4	-73.8	0	0	0	117.9	D26	F23-D26 WeakPolarHBondContact CD1-OD2 3.36Å
24	Q	37.5	Very low	37.3	Very low	142 Å²	142	111.9 Å²	111.9	66%	0.664	58%	0.584	S	S	*	*	S	Bend	trans	-129.2	-26.4	149.5	-160.2	159.6	6.5	0	0	113.2	D26 Y27	Q24-D26 VanDerWaalsContact C-N 3.31Å; Q24-D26 PolarHBondContact O-N 2.81Å; Q24-Y27 WeakPolarHBondContact O-CB 3.35Å; Q24-Y27 PolarHBondContact O-N 2.93Å; Q24-Y27 VanDerWaalsContact O-N 3.1Å
25	F	32.3	Very low	38.4	Very low	155 Å²	155	103.3 Å²	103.3	68%	0.68	55%	0.547	S	S	*	.	H	α-helix	trans	-53.4	-38	176.3	-73.5	-83.3	0	0	0	115	Y27 D28 F29 W518	F25-Y27 VanDerWaalsContact C-N 3.25Å; F25-Y27 PolarHBondContact O-N 3.05Å; F25-D28 PolarHBondContact O-N 2.88Å; F25-F29 PolarHBondContact O-N 3.35Å; F25-W518 HydrophobicContact CD1-CH2 4.12Å; F25-W518 AromaticContact CD1-CZ3 3.81Å; F25-W518 HydrophobicContact CD1-CZ3 3.81Å; F25-W518 HydrophobicContact CE1-CZ3 4.04Å
26	D	34	Very low	39.4	Very low	96 Å²	96	98.7 Å²	98.7	51%	0.513	52%	0.522	S	S	.	.	H	α-helix	trans	-67.2	-28.1	-178.9	-64.8	-40.8	0	0	0	112.5	F23 Q24 T30	F23-D26 WeakPolarHBondContact CD1-OD2 3.36Å; Q24-D26 VanDerWaalsContact C-N 3.31Å; Q24-D26 PolarHBondContact O-N 2.81Å; D26-T30 VanDerWaalsContact O-CB 3.3Å; D26-T30 WeakPolarHBondContact O-CB 3.24Å; D26-T30 PolarHBondContact O-N 3.08Å; D26-T30 PolarHBondContact O-OG1 2.8Å
27	Y	38.5	Very low	40.3	Very low	160 Å²	160	98.4 Å²	98.4	63%	0.627	51%	0.509	S	S	*	.	H	α-helix	trans	-72	-45.2	177.9	-144.4	-100.2	0	0	0	110.7	Q24 F25 F29 T30 N31	Q24-Y27 WeakPolarHBondContact O-CB 3.35Å; Q24-Y27 PolarHBondContact O-N 2.93Å; Q24-Y27 VanDerWaalsContact O-N 3.1Å; F25-Y27 VanDerWaalsContact C-N 3.25Å; F25-Y27 PolarHBondContact O-N 3.05Å; Y27-F29 PolarHBondContact O-N 3.32Å; Y27-T30 PolarHBondContact O-N 2.89Å; Y27-N31 VanDerWaalsContact CD1-ND2 3.25Å; Y27-N31 WeakPolarHBondContact CD1-ND2 3.38Å; Y27-N31 WeakPolarHBondContact O-CB 3.35Å; Y27-N31 PolarHBondContact O-N 3.41Å; Y27-N31 PolarHBondContact O-ND2 3.42Å; Y27-N31 VanDerWaalsContact O-ND2 3.15Å
28	D	48.8	Very low	41.4	Very low	31 Å²	31	96.6 Å²	96.6	17%	0.166	49%	0.49	C	S	.	.	H	α-helix	trans	-62	-41.8	173.9	-84.7	-33.1	0	0	0	112.3	F25 F32 S432 W518	F25-D28 PolarHBondContact O-N 2.88Å; D28-F32 WeakPolarHBondContact O-CB 3.31Å; D28-F32 PolarHBondContact O-N 2.76Å; D28-S432 WeakPolarHBondContact OD1-CB 3.14Å; D28-W518 HydrophobicContact CB-CH2 3.98Å; D28-W518 HydrophobicContact CB-CZ2 4.2Å
29	F	47.2	Very low	42	Very low	109 Å²	109	92.9 Å²	92.9	48%	0.478	47%	0.47	S	S	.	.	H	α-helix	trans	-63.7	-45.1	175.9	-175.6	-98	0	0	0	111.9	F25 Y27 F32 L33	F25-F29 PolarHBondContact O-N 3.35Å; Y27-F29 PolarHBondContact O-N 3.32Å; F29-F32 PolarHBondContact O-N 3.47Å; F29-L33 HydrophobicContact CE1-CD1 3.93Å; F29-L33 HydrophobicContact CE1-CD2 4.01Å; F29-L33 HydrophobicContact CE2-CD1 4.07Å; F29-L33 HydrophobicContact CZ-CD1 3.64Å; F29-L33 HydrophobicContact CZ-CD2 4.37Å; F29-L33 PolarHBondContact O-N 3.44Å
30	T	52.4	Low	42.5	Very low	76 Å²	76	94.9 Å²	94.9	47%	0.466	47%	0.47	S	S	.	.	H	α-helix	trans	-64.4	-42.8	179.1	-58.7	0	0	0	0	111.6	D26 Y27 L33 T34	D26-T30 VanDerWaalsContact O-CB 3.3Å; D26-T30 WeakPolarHBondContact O-CB 3.24Å; D26-T30 PolarHBondContact O-N 3.08Å; D26-T30 PolarHBondContact O-OG1 2.8Å; Y27-T30 PolarHBondContact O-N 2.89Å; T30-L33 PolarHBondContact O-N 3.35Å; T30-T34 WeakPolarHBondContact O-CB 3.32Å; T30-T34 PolarHBondContact O-N 3Å; T30-T34 PolarHBondContact O-OG1 3.3Å
31	N	52.1	Low	42.8	Very low	52 Å²	52	95.4 Å²	95.4	28%	0.278	47%	0.465	S	S	.	.	H	α-helix	trans	-64.4	-42.2	175.8	-70.6	-26.5	0	0	0	111.5	Y27 T34 F35	Y27-N31 VanDerWaalsContact CD1-ND2 3.25Å; Y27-N31 WeakPolarHBondContact CD1-ND2 3.38Å; Y27-N31 WeakPolarHBondContact O-CB 3.35Å; Y27-N31 PolarHBondContact O-N 3.41Å; Y27-N31 PolarHBondContact O-ND2 3.42Å; Y27-N31 VanDerWaalsContact O-ND2 3.15Å; N31-T34 PolarHBondContact O-N 3.07Å; N31-F35 WeakPolarHBondContact O-CB 3.24Å; N31-F35 PolarHBondContact O-N 3.05Å
32	F	53	Low	42.8	Very low	26 Å²	26	96.9 Å²	96.9	11%	0.114	46%	0.464	C	S	.	.	H	α-helix	trans	-66.2	-38.7	175.9	-178.3	-114.3	0	0	0	113	D28 F29 F35 L36 S514 L517	D28-F32 WeakPolarHBondContact O-CB 3.31Å; D28-F32 PolarHBondContact O-N 2.76Å; F29-F32 PolarHBondContact O-N 3.47Å; F32-F35 WeakPolarHBondContact O-CB 3.11Å; F32-F35 PolarHBondContact O-N 3.5Å; F32-L36 HydrophobicContact CD1-CD1 4.16Å; F32-L36 HydrophobicContact CE1-CD1 3.53Å; F32-L36 HydrophobicContact CE1-CG 4.2Å; F32-L36 HydrophobicContact CE2-CD1 4.31Å; F32-L36 HydrophobicContact CE2-CD2 4.25Å; F32-L36 HydrophobicContact CE2-CG 4.1Å; F32-L36 HydrophobicContact CZ-CD1 3.61Å; F32-L36 HydrophobicContact CZ-CD2 4.08Å; F32-L36 HydrophobicContact CZ-CG 3.89Å; F32-L36 WeakPolarHBondContact O-CG 3.28Å; F32-L36 PolarHBondContact O-N 3.29Å; F32-S514 VanDerWaalsContact CZ-OG 3.25Å; F32-S514 WeakPolarHBondContact CZ-OG 3.36Å; F32-L517 HydrophobicContact CB-CD1 4.36Å; F32-L517 HydrophobicContact CD2-CD1 3.34Å; F32-L517 HydrophobicContact CE2-CD1 3.69Å; F32-L517 HydrophobicContact CG-CD1 3.83Å; F32-L517 HydrophobicContact CZ-CD1 4.43Å
33	L	52.7	Low	42.9	Very low	65 Å²	65	94.5 Å²	94.5	34%	0.34	46%	0.457	S	S	.	.	H	α-helix	trans	-64.9	-43.9	174.1	-122.8	70.7	0	0	0	111.6	F29 T30 F35 L36 Q37	F29-L33 HydrophobicContact CE1-CD1 3.93Å; F29-L33 HydrophobicContact CE1-CD2 4.01Å; F29-L33 HydrophobicContact CE2-CD1 4.07Å; F29-L33 HydrophobicContact CZ-CD1 3.64Å; F29-L33 HydrophobicContact CZ-CD2 4.37Å; F29-L33 PolarHBondContact O-N 3.44Å; T30-L33 PolarHBondContact O-N 3.35Å; L33-F35 VanDerWaalsContact C-N 3.35Å; L33-L36 PolarHBondContact O-N 3.02Å; L33-Q37 WeakPolarHBondContact O-CB 3.48Å; L33-Q37 VanDerWaalsContact O-CG 3.26Å; L33-Q37 WeakPolarHBondContact O-CG 3.26Å; L33-Q37 PolarHBondContact O-N 2.94Å
34	T	56.1	Low	42.7	Very low	60 Å²	60	90.8 Å²	90.8	37%	0.368	45%	0.452	S	S	.	.	H	α-helix	trans	-64.4	-40.5	178	-55.2	0	0	0	0	111.2	T30 N31 Q37 N38	T30-T34 WeakPolarHBondContact O-CB 3.32Å; T30-T34 PolarHBondContact O-N 3Å; T30-T34 PolarHBondContact O-OG1 3.3Å; N31-T34 PolarHBondContact O-N 3.07Å; T34-Q37 PolarHBondContact O-N 3.03Å; T34-N38 WeakPolarHBondContact O-CB 3.43Å; T34-N38 VanDerWaalsContact O-CG 3.3Å; T34-N38 PolarHBondContact O-N 3.09Å; T34-N38 PolarHBondContact O-ND2 3.18Å
35	F	50.4	Low	42.1	Very low	19 Å²	19	94.2 Å²	94.2	8%	0.083	47%	0.465	C	S	.	.	H	α-helix	trans	-56.8	-49.5	171.2	175.1	-77.7	0	0	0	111.7	N31 F32 L33 N39 I439 K440 E506	N31-F35 WeakPolarHBondContact O-CB 3.24Å; N31-F35 PolarHBondContact O-N 3.05Å; F32-F35 WeakPolarHBondContact O-CB 3.11Å; F32-F35 PolarHBondContact O-N 3.5Å; L33-F35 VanDerWaalsContact C-N 3.35Å; F35-N39 WeakPolarHBondContact O-CB 3.41Å; F35-N39 PolarHBondContact O-N 3.13Å; F35-N39 PolarHBondContact O-ND2 3.29Å; F35-I439 HydrophobicContact CZ-CD1 4.35Å; F35-I439 HydrophobicContact CZ-CG2 4.17Å; F35-K440 HydrophobicContact CE2-CD 4.06Å; F35-K440 VanDerWaalsContact CE2-CE 3.44Å; F35-K440 HydrophobicContact CE2-CG 4.26Å; F35-E506 WeakPolarHBondContact CE1-OE2 3.15Å; F35-E506 VanDerWaalsContact CZ-CD 3.48Å; F35-E506 WeakPolarHBondContact CZ-OE1 3.4Å
36	L	45.8	Very low	41.8	Very low	56 Å²	56	92.1 Å²	92.1	29%	0.293	47%	0.469	S	S	.	.	H	α-helix	trans	-64.7	-43.6	178.1	-72.9	178.8	0	0	0	112.3	F32 L33 Q40	F32-L36 HydrophobicContact CD1-CD1 4.16Å; F32-L36 HydrophobicContact CE1-CD1 3.53Å; F32-L36 HydrophobicContact CE1-CG 4.2Å; F32-L36 HydrophobicContact CE2-CD1 4.31Å; F32-L36 HydrophobicContact CE2-CD2 4.25Å; F32-L36 HydrophobicContact CE2-CG 4.1Å; F32-L36 HydrophobicContact CZ-CD1 3.61Å; F32-L36 HydrophobicContact CZ-CD2 4.08Å; F32-L36 HydrophobicContact CZ-CG 3.89Å; F32-L36 WeakPolarHBondContact O-CG 3.28Å; F32-L36 PolarHBondContact O-N 3.29Å; L33-L36 PolarHBondContact O-N 3.02Å; L36-Q40 WeakPolarHBondContact O-CG 3.48Å; L36-Q40 PolarHBondContact O-N 2.9Å
37	Q	50.5	Low	41.3	Very low	99 Å²	99	92.7 Å²	92.7	46%	0.463	48%	0.481	S	S	.	.	H	α-helix	trans	-66.9	-42.6	-177.9	-73	175.2	15.1	0	0	112.4	L33 T34 Q40 K41	L33-Q37 WeakPolarHBondContact O-CB 3.48Å; L33-Q37 VanDerWaalsContact O-CG 3.26Å; L33-Q37 WeakPolarHBondContact O-CG 3.26Å; L33-Q37 PolarHBondContact O-N 2.94Å; T34-Q37 PolarHBondContact O-N 3.03Å; Q37-Q40 PolarHBondContact O-N 2.84Å; Q37-K41 PolarHBondContact O-N 2.95Å
38	N	47.8	Very low	40.8	Very low	84 Å²	84	91.8 Å²	91.8	45%	0.449	49%	0.485	S	S	.	.	H	α-helix	trans	-66.3	-39.4	178.9	-73	-15	0	0	0	111.6	T34 Q40 K41	T34-N38 WeakPolarHBondContact O-CB 3.43Å; T34-N38 VanDerWaalsContact O-CG 3.3Å; T34-N38 PolarHBondContact O-N 3.09Å; T34-N38 PolarHBondContact O-ND2 3.18Å; N38-Q40 VanDerWaalsContact C-N 3.34Å; N38-Q40 PolarHBondContact O-N 2.94Å; N38-K41 PolarHBondContact O-N 2.94Å
39	N	42	Very low	39.7	Very low	42 Å²	42	96.8 Å²	96.8	23%	0.225	51%	0.512	C	S	.	.	H	α-helix	trans	-74.6	-21.4	176.8	-73.1	-51.7	0	0	0	113.5	F35 N43 K440 E506	F35-N39 WeakPolarHBondContact O-CB 3.41Å; F35-N39 PolarHBondContact O-N 3.13Å; F35-N39 PolarHBondContact O-ND2 3.29Å; N39-N43 PolarHBondContact O-ND2 3.01Å; N39-K440 VanDerWaalsContact ND2-CE 3.28Å; N39-K440 WeakPolarHBondContact ND2-CE 3.47Å; N39-K440 PolarHBondContact ND2-NZ 3.05Å; N39-E506 VanDerWaalsContact CB-OE2 3.31Å; N39-E506 WeakPolarHBondContact CB-OE2 3.37Å; N39-E506 VanDerWaalsContact CG-CD 3.41Å; N39-E506 VanDerWaalsContact CG-OE1 3.31Å; N39-E506 PolarHBondContact ND2-OE1 3.45Å; N39-E506 PolarHBondContact ND2-OE2 2.95Å
40	Q	36.9	Very low	38.8	Very low	144 Å²	144	97.9 Å²	97.9	67%	0.673	52%	0.52	S	S	*	.	H	α-helix	trans	-72.7	-40	166.5	-76	177.7	4.9	0	0	112.6	L36 Q37 N38 L42 N43	L36-Q40 WeakPolarHBondContact O-CG 3.48Å; L36-Q40 PolarHBondContact O-N 2.9Å; Q37-Q40 PolarHBondContact O-N 2.84Å; N38-Q40 VanDerWaalsContact C-N 3.34Å; N38-Q40 PolarHBondContact O-N 2.94Å; Q40-L42 PolarHBondContact O-N 3.23Å; Q40-N43 PolarHBondContact O-N 3.13Å
41	K	35	Very low	37.6	Very low	157 Å²	157	101.6 Å²	101.6	68%	0.683	53%	0.532	S	S	*	.	H	α-helix	trans	-65.3	-15.9	-178.3	-81.4	-179.9	174.7	175.3	0	115.3	Q37 N38 N43	Q37-K41 PolarHBondContact O-N 2.95Å; N38-K41 PolarHBondContact O-N 2.94Å; K41-N43 VanDerWaalsContact C-N 3.28Å; K41-N43 PolarHBondContact O-N 3.07Å
42	L	31.1	Very low	36.3	Very low	140 Å²	140	104.1 Å²	104.1	73%	0.733	55%	0.553	S	S	*	*	T	Hydrogen-bonded Turn	trans	-83.2	12.4	178.9	-82.4	163.9	0	0	0	115.1	Q40	Q40-L42 PolarHBondContact O-N 3.23Å
43	N	28.6	Very low	35.1	Very low	102 Å²	102	108.8 Å²	108.8	55%	0.545	59%	0.59	S	S	.	*			trans	-131.4	59	178.9	-58.8	-107.5	0	0	0	111.9	N39 Q40 K41 K507	N39-N43 PolarHBondContact O-ND2 3.01Å; Q40-N43 PolarHBondContact O-N 3.13Å; K41-N43 VanDerWaalsContact C-N 3.28Å; K41-N43 PolarHBondContact O-N 3.07Å; N43-K507 PolarHBondContact OD1-NZ 2.94Å
44	S	24.2	Very low	33.8	Very low	92 Å²	92	110.5 Å²	110.5	64%	0.643	61%	0.607	S	S	*	*			trans	-144.9	67.8	178.7	66.2	0	0	0	0	114.8
45	F	23.9	Very low	32.4	Very low	214 Å²	214	114 Å²	114	94%	0.939	63%	0.633	S	S	*	*			trans	-144.2	47.7	169.7	-105.5	-69	0	0	0	113.7
46	S	26.7	Very low	31.3	Very low	110 Å²	110	124.1 Å²	124.1	77%	0.769	67%	0.67	S	S	*	*	S	Bend	trans	-162.8	78	163.8	57.5	0	0	0	0	112.8
47	S	24.2	Very low	30.3	Very low	108 Å²	108	129.2 Å²	129.2	76%	0.755	70%	0.698	S	S	*	*			trans	39.4	126.8	132.2	-51.5	0	0	0	0	122.1
48	I	27.6	Very low	29.3	Very low	142 Å²	142	133.9 Å²	133.9	73%	0.728	72%	0.716	S	S	*	*			trans	92.9	113.5	140.8	-64.1	158.5	0	0	0	119.2
49	N	26.4	Very low	28.4	Very low	135 Å²	135	137.8 Å²	137.8	72%	0.722	74%	0.736	S	S	*	*			trans	67.4	146.7	150.4	-66.4	-1.8	0	0	0	120
50	M	26.4	Very low	27.5	Very low	132 Å²	132	144.2 Å²	144.2	65%	0.65	77%	0.767	S	S	*	*			cis	-160.6	166.5	-8.3	-114.4	-64.3	178.9	0	0	110.3
51	H	28.4	Very low	27.1	Very low	155 Å²	155	143.3 Å²	143.3	72%	0.718	77%	0.774	S	S	*	*			trans	54.6	113.6	166.7	-57.3	-55.7	0	0	0	118.7
52	S	23.7	Very low	26.6	Very low	104 Å²	104	141.7 Å²	141.7	73%	0.727	77%	0.772	S	S	*	*			cis	84.3	86	45.5	81.7	0	0	0	0	115.8
53	S	27.9	Very low	26.4	Very low	125 Å²	125	144.6 Å²	144.6	87%	0.874	78%	0.775	S	S	*	*			trans	-147.7	135.3	150.2	59.6	0	0	0	0	111.3
54	S	26.1	Very low	26.2	Very low	101 Å²	101	149.2 Å²	149.2	71%	0.706	79%	0.791	S	S	*	*			trans	-77	143.4	-172	130.8	0	0	0	0	112.6
55	C	27.8	Very low	26.3	Very low	134 Å²	134	153.7 Å²	153.7	91%	0.905	80%	0.801	S	S	*	*			trans	-154.5	126.6	132.5	-120	0	0	0	0	114.7
56	R	27	Very low	26.4	Very low	231 Å²	231	151.2 Å²	151.2	87%	0.872	80%	0.797	S	S	*	*			trans	-61.9	158	-171.6	-66.6	165.1	164.8	166.2	-6.8	116.3
57	N	25.1	Very low	26.3	Very low	163 Å²	163	155.5 Å²	155.5	87%	0.872	80%	0.802	S	S	*	*			trans	-52.3	134.1	162.9	-61.7	-20.3	0	0	0	113.1
58	K	29.2	Very low	26.6	Very low	196 Å²	196	156.1 Å²	156.1	85%	0.852	80%	0.804	S	S	*	*			trans	-139.2	113.6	147.2	-72.1	-172.4	176.1	-176.9	0	106.4
59	L	28.3	Very low	26.4	Very low	166 Å²	166	158.9 Å²	158.9	87%	0.869	81%	0.806	S	S	*	*				59.9	120.4	87	-91.4	160.7	0	0	0	113.4
60	M	22.7	Very low	26.5	Very low	178 Å²	178	159.4 Å²	159.4	88%	0.877	81%	0.814	S	S	*	*			trans	-61.5	133.4	177.2	-67.7	147.7	57.4	0	0	111.5
61	P	29.9	Very low	26.6	Very low	125 Å²	125	160.2 Å²	160.2	81%	0.812	82%	0.82	S	S	*	*			trans	-78.1	123	151.8	31.6	-27.4	0	0	0	109.1
62	N	24.1	Very low	26.5	Very low	122 Å²	122	161.4 Å²	161.4	65%	0.652	83%	0.826	S	S	*	*			trans	-81.3	-171.2	157	-167.4	-4.1	0	0	0	108.1
63	Y	25.4	Very low	26.6	Very low	201 Å²	201	163.4 Å²	163.4	79%	0.788	83%	0.828	S	S	*	*			trans	88.7	127	164.7	-43.7	-65.6	0	0	0	117.5
64	K	24.4	Very low	26.5	Very low	200 Å²	200	164.6 Å²	164.6	87%	0.87	83%	0.825	S	S	*	*			trans	-36.9	141.9	161	-52.1	161.7	177.9	178.7	0	112.8
65	E	26.3	Very low	26.6	Very low	185 Å²	185	165.3 Å²	165.3	86%	0.864	83%	0.825	S	S	*	*				-174.9	179.2	126	-106.7	168.4	-153.4	0	0	111.6
66	L	27.1	Very low	26.7	Very low	162 Å²	162	165.1 Å²	165.1	85%	0.848	82%	0.82	S	S	*	*			trans	74.2	63.4	170.9	-51	-178	0	0	0	118.3
67	F	23.6	Very low	26.7	Very low	201 Å²	201	159.2 Å²	159.2	88%	0.882	81%	0.814	S	S	*	*			trans	-78.8	150.5	131.7	-80.7	-87.7	0	0	0	109.5
68	P	30.7	Very low	26.9	Very low	121 Å²	121	159.1 Å²	159.1	79%	0.786	81%	0.81	S	S	*	*			trans	-109.5	131.9	147	10.3	9.2	0	0	0	110.7
69	Y	25	Very low	26.8	Very low	199 Å²	199	155.8 Å²	155.8	78%	0.78	80%	0.802	S	S	*	*			trans	-70.7	153.9	171.2	-78.7	-109.1	0	0	0	111.9	I71	Y69-I71 HydrophobicContact CD1-CG1 4.16Å
70	T	27.2	Very low	26.9	Very low	146 Å²	146	154.4 Å²	154.4	90%	0.896	80%	0.795	S	S	*	*				-137.9	141.7	129.5	35.3	0	0	0	0	108.8
71	I	28.4	Very low	27.1	Very low	149 Å²	149	150.5 Å²	150.5	76%	0.764	79%	0.786	S	S	*	*	P	Polyproline II helix	trans	-93.1	160.4	-173.5	-67.3	167.6	0	0	0	109.9	Y69	Y69-I71 HydrophobicContact CD1-CG1 4.16Å
72	E	26.1	Very low	27	Very low	181 Å²	181	149.8 Å²	149.8	85%	0.846	78%	0.779	S	S	*	*	P	Polyproline II helix	trans	-66.2	168.4	-179	-61.1	-176.3	118.2	0	0	113.8
73	N	25.7	Very low	27.2	Very low	146 Å²	146	154 Å²	154	78%	0.781	79%	0.786	S	S	*	*	P	Polyproline II helix	trans	-68.5	153.3	-176.2	-35.7	-81	0	0	0	112.1
74	D	26.5	Very low	27.5	Very low	150 Å²	150	151 Å²	151	80%	0.802	78%	0.778	S	S	*	*				-170.5	178.5	98	-114.4	-23.5	0	0	0	114.7
75	T	28.9	Very low	27.7	Very low	116 Å²	116	149.1 Å²	149.1	71%	0.712	77%	0.77	S	S	*	*			trans	69.6	100	166.3	65	0	0	0	0	121.9
76	T	28.6	Very low	28	Very low	130 Å²	130	148.4 Å²	148.4	80%	0.798	77%	0.767	S	S	*	*				73.3	133.8	125.8	62.4	0	0	0	0	123.3
77	S	27.2	Very low	28.1	Very low	107 Å²	107	148.5 Å²	148.5	75%	0.748	76%	0.763	S	S	*	*				109.7	126.8	129.9	-148.9	0	0	0	0	120.3
78	M	30.1	Very low	28.5	Very low	160 Å²	160	146.6 Å²	146.6	79%	0.788	76%	0.76	S	S	*	*			trans	61.8	95.5	152.7	-69.2	-66.9	-172.5	0	0	122.1
79	D	26.6	Very low	28.4	Very low	127 Å²	127	145.4 Å²	145.4	68%	0.679	75%	0.751	S	S	*	*				65.9	136.2	107.6	-106	34.8	0	0	0	124.3
80	N	29.7	Very low	28.5	Very low	136 Å²	136	142.3 Å²	142.3	73%	0.727	74%	0.743	S	S	*	*			trans	70.6	146.4	152.1	-66.3	-51.3	0	0	0	120.1
81	S	27.1	Very low	28.5	Very low	97 Å²	97	144.7 Å²	144.7	68%	0.678	74%	0.736	S	S	*	*			cis	-170.8	-174.9	-21.4	-166.5	0	0	0	0	110.1
82	V	28.5	Very low	28.4	Very low	110 Å²	110	142.4 Å²	142.4	67%	0.667	73%	0.733	S	S	*	*			trans	73.4	99	155.7	-179.3	0	0	0	0	120
83	R	29.1	Very low	28.4	Very low	211 Å²	211	141 Å²	141	80%	0.796	73%	0.731	S	S	*	*				64.5	159.9	129	-62.3	-178.6	-171.3	-177.7	1.7	119.3
84	Q	29.8	Very low	28.4	Very low	136 Å²	136	139 Å²	139	64%	0.636	72%	0.724	S	S	*	*			cis	-154.7	158.1	-0.9	-128.9	167.7	12.5	0	0	112.6
85	K	29	Very low	28.5	Very low	161 Å²	161	139.1 Å²	139.1	70%	0.7	73%	0.725	S	S	*	*			trans	20.4	136.5	149.6	-64.6	170.5	178.2	-177.1	0	119.6
86	H	33	Very low	28.5	Very low	170 Å²	170	139 Å²	139	79%	0.787	73%	0.729	S	S	*	*				-154.4	154	62.2	-105.4	-88	0	0	0	115.4
87	Q	30.2	Very low	28.3	Very low	164 Å²	164	139 Å²	139	77%	0.766	73%	0.728	S	S	*	*			trans	-114.2	162.8	168.4	-68.4	176.9	-51.4	0	0	110.8
88	I	30.9	Very low	28.4	Very low	161 Å²	161	139.7 Å²	139.7	83%	0.826	73%	0.73	S	S	*	*			trans	-175.3	121.9	141.2	-92.8	147.8	0	0	0	105.7
89	T	28.5	Very low	28.1	Very low	96 Å²	96	139.1 Å²	139.1	59%	0.589	73%	0.73	S	S	*	*			cis	85	132.4	25	-51.3	0	0	0	0	112.6
90	E	27.6	Very low	28.1	Very low	134 Å²	134	137.7 Å²	137.7	63%	0.626	73%	0.73	S	S	*	*			cis	-172	177.9	-16	-110.6	-173.3	-177.5	0	0	107.4
91	R	27.8	Very low	28.1	Very low	197 Å²	197	137.6 Å²	137.6	74%	0.743	73%	0.73	S	S	*	*			trans	73	144.2	160.8	-60.9	131.4	-159.6	-128.7	1.2	117.9
92	S	25	Very low	27.9	Very low	101 Å²	101	139.5 Å²	139.5	71%	0.706	73%	0.732	S	S	*	*			cis	87.1	157.9	12.7	93.2	0	0	0	0	118
93	L	27.3	Very low	27.8	Very low	150 Å²	150	144.6 Å²	144.6	79%	0.785	74%	0.741	S	S	*	*			trans	90.9	145.6	-169.2	-59.1	169.3	0	0	0	114.8
94	T	25.5	Very low	27.7	Very low	105 Å²	105	140.1 Å²	140.1	64%	0.644	74%	0.737	S	S	*	*			cis	-176.4	170.1	-36.7	20.2	0	0	0	0	107.9
95	N	27.2	Very low	27.3	Very low	152 Å²	152	143.9 Å²	143.9	81%	0.813	75%	0.746	S	S	*	*			trans	74.6	151.9	168	-52.2	-24.9	0	0	0	115.4
96	S	30	Very low	27.2	Very low	115 Å²	115	143.9 Å²	143.9	80%	0.804	75%	0.754	S	S	*	*			cis	-155.9	159.8	-5.1	32.9	0	0	0	0	111.2
97	V	24	Very low	26.8	Very low	129 Å²	129	141.6 Å²	141.6	78%	0.782	75%	0.747	S	S	*	*			trans	-92.7	148.4	178.6	176.8	0	0	0	0	111.5
98	P	28.6	Very low	26.7	Very low	121 Å²	121	138.2 Å²	138.2	79%	0.786	75%	0.747	S	S	*	*			trans	-130.8	152.4	131.9	36.4	-27.1	0	0	0	113.5
99	N	23.7	Very low	26.5	Very low	148 Å²	148	140 Å²	140	79%	0.791	75%	0.749	S	S	*	*			trans	-73.8	153.9	174.1	-74.1	-29.3	0	0	0	112
100	S	27.7	Very low	26.3	Very low	97 Å²	97	144.4 Å²	144.4	68%	0.678	76%	0.76	S	S	*	*				169.3	157	102.3	53.4	0	0	0	0	114.9
101	N	28.7	Very low	26	Very low	135 Å²	135	143.2 Å²	143.2	72%	0.722	77%	0.766	S	S	*	*			trans	68.1	102.8	153.8	-56.7	-21.1	0	0	0	120.7
102	N	24	Very low	26	Very low	136 Å²	136	143.4 Å²	143.4	73%	0.727	77%	0.769	S	S	*	*				42.2	123.9	125.1	-51.4	-14.7	0	0	0	120.2
103	Y	26.7	Very low	25.9	Very low	217 Å²	217	148.8 Å²	148.8	85%	0.851	78%	0.78	S	S	*	*				-172.2	149.2	102.7	-97	-67.9	0	0	0	112.6
104	T	25.6	Very low	25.8	Very low	118 Å²	118	145.1 Å²	145.1	72%	0.724	76%	0.761	S	S	*	*			trans	26.1	108.5	159.6	49	0	0	0	0	122
105	R	22.3	Very low	25.8	Very low	215 Å²	215	146.1 Å²	146.1	81%	0.811	76%	0.762	S	S	*	*				-2.2	126.8	129.5	-176.6	-172.7	-166	150.1	9.5	117.1	D107	R105-D107 IonicContact CZ-OD2 2.59Å; R105-D107 IonicContact NE-OD2 2.64Å; R105-D107 PolarHBondContact NE-OD2 3.19Å; R105-D107 VanDerWaalsContact NE-OD2 3.13Å
106	D	27.6	Very low	25.9	Very low	161 Å²	161	147.3 Å²	147.3	86%	0.861	76%	0.763	S	S	*	*			trans	-135	118.4	168.4	-117.8	-29.4	0	0	0	110.6	A108	D106-A108 PolarHBondContact O-N 2.9Å
107	D	23.2	Very low	25.8	Very low	121 Å²	121	151.8 Å²	151.8	65%	0.647	76%	0.763	S	S	*	*			trans	-95	88.2	-173	-75.1	-56.7	0	0	0	111.7	R105 K109	R105-D107 IonicContact CZ-OD2 2.59Å; R105-D107 IonicContact NE-OD2 2.64Å; R105-D107 PolarHBondContact NE-OD2 3.19Å; R105-D107 VanDerWaalsContact NE-OD2 3.13Å; D107-K109 PolarHBondContact O-N 3.47Å; D107-K109 VanDerWaalsContact O-N 3.08Å
108	A	28.7	Very low	26.2	Very low	93 Å²	93	148.4 Å²	148.4	77%	0.769	74%	0.741	S	S	*	*			trans	-76.7	90.4	-174.4	0	0	0	0	0	114.1	D106 F110	D106-A108 PolarHBondContact O-N 2.9Å; A108-F110 PolarHBondContact O-N 3.24Å
109	K	26.1	Very low	26.2	Very low	198 Å²	198	148.3 Å²	148.3	86%	0.861	73%	0.73	S	S	*	*			trans	-49.5	126.8	175.5	-66.9	168.3	-178.6	163	0	113.8	D107	D107-K109 PolarHBondContact O-N 3.47Å; D107-K109 VanDerWaalsContact O-N 3.08Å
110	F	24.2	Very low	26.5	Very low	190 Å²	190	144.1 Å²	144.1	83%	0.833	72%	0.716	S	S	*	*			trans	-90.3	103.8	157.9	-95.9	-88.4	0	0	0	110.4	A108 Y112	A108-F110 PolarHBondContact O-N 3.24Å; F110-Y112 HydrophobicContact CD1-CE2 4.33Å
111	S	22.7	Very low	26.6	Very low	108 Å²	108	144.9 Å²	144.9	76%	0.755	71%	0.711	S	S	*	*			trans	-91.7	114.8	172	56	0	0	0	0	111.1
112	Y	26.5	Very low	26.6	Very low	201 Å²	201	145.3 Å²	145.3	79%	0.788	70%	0.704	S	S	*	*			trans	-104	150.9	160	-88.3	-87.9	0	0	0	110.1	F110 L114	F110-Y112 HydrophobicContact CD1-CE2 4.33Å; Y112-L114 PolarHBondContact O-N 2.86Å
113	F	23.8	Very low	26.9	Very low	215 Å²	215	141.7 Å²	141.7	94%	0.943	69%	0.689	S	S	*	*			trans	-67.2	114.5	-173.8	-86.3	-106.3	0	0	0	111.6
114	L	25.7	Very low	27.1	Very low	73 Å²	73	138.5 Å²	138.5	38%	0.382	68%	0.682	S	S	.	*			trans	-76.5	152.7	161	-106.3	59	0	0	0	109.9	Y112 D118 Y122	Y112-L114 PolarHBondContact O-N 2.86Å; L114-D118 HydrophobicContact CB-CB 3.97Å; L114-D118 HydrophobicContact CD2-CB 3.65Å; L114-D118 HydrophobicContact CG-CB 3.69Å; L114-Y122 HydrophobicContact CD2-CD2 3.82Å; L114-Y122 HydrophobicContact CD2-CE2 4.38Å; L114-Y122 HydrophobicContact CD2-CG 4.1Å
115	N	25.6	Very low	27.5	Very low	125 Å²	125	138.9 Å²	138.9	67%	0.668	68%	0.679	S	S	*	*			trans	-71	158.6	173.2	-91.5	-49	0	0	0	110.5	Y117 D118 H119	N115-Y117 PolarHBondContact O-N 3.38Å; N115-D118 WeakPolarHBondContact CB-OD2 3.5Å; N115-D118 PolarHBondContact N-OD2 2.79Å; N115-D118 PolarHBondContact O-N 2.94Å; N115-H119 PolarHBondContact O-N 3.41Å
116	Q	28.4	Very low	28	Very low	178 Å²	178	135.7 Å²	135.7	83%	0.832	67%	0.671	S	S	*	*	T	Hydrogen-bonded Turn	trans	-62.2	-21	-174.2	-143.6	168.7	16.3	0	0	113.5
117	Y	28.9	Very low	28.2	Very low	208 Å²	208	134.3 Å²	134.3	82%	0.816	66%	0.664	S	S	*	*	T	Hydrogen-bonded Turn	trans	-80.1	-36.2	173	-70.9	-84.3	0	0	0	113.6	N115 H119 A120	N115-Y117 PolarHBondContact O-N 3.38Å; Y117-H119 PolarHBondContact O-N 2.96Å; Y117-A120 PolarHBondContact O-N 2.78Å
118	D	30.9	Very low	28.5	Very low	58 Å²	58	134 Å²	134	31%	0.31	66%	0.661	S	S	.	*	H	α-helix	trans	-63.1	-33.8	178.5	-59.3	-56.8	0	0	0	111.2	L114 N115 A120 L121 Y122	L114-D118 HydrophobicContact CB-CB 3.97Å; L114-D118 HydrophobicContact CD2-CB 3.65Å; L114-D118 HydrophobicContact CG-CB 3.69Å; N115-D118 WeakPolarHBondContact CB-OD2 3.5Å; N115-D118 PolarHBondContact N-OD2 2.79Å; N115-D118 PolarHBondContact O-N 2.94Å; D118-A120 PolarHBondContact O-N 3.48Å; D118-L121 PolarHBondContact O-N 3.02Å; D118-Y122 WeakPolarHBondContact O-CB 3.39Å; D118-Y122 PolarHBondContact O-N 3.3Å
119	H	29.6	Very low	28.5	Very low	119 Å²	119	138 Å²	138	55%	0.551	67%	0.67	S	S	*	*	H	α-helix	trans	-57.9	-28.3	179.7	-100	-79.4	0	0	0	114	N115 Y117 S123	N115-H119 PolarHBondContact O-N 3.41Å; Y117-H119 PolarHBondContact O-N 2.96Å; H119-S123 VanDerWaalsContact O-CB 3.26Å; H119-S123 WeakPolarHBondContact O-CB 3.27Å; H119-S123 PolarHBondContact O-N 2.89Å; H119-S123 PolarHBondContact O-OG 3.04Å
120	A	29.4	Very low	28.7	Very low	60 Å²	60	134 Å²	134	50%	0.496	66%	0.662	S	S	.	*	H	α-helix	trans	-67	-55.8	175.6	0	0	0	0	0	110.9	Y117 D118 Y122 S123 H124	Y117-A120 PolarHBondContact O-N 2.78Å; D118-A120 PolarHBondContact O-N 3.48Å; A120-Y122 VanDerWaalsContact C-N 3.35Å; A120-Y122 PolarHBondContact O-N 2.99Å; A120-S123 PolarHBondContact O-N 3.25Å; A120-S123 PolarHBondContact O-OG 3.35Å; A120-H124 PolarHBondContact O-N 3.46Å; A120-H124 VanDerWaalsContact O-N 3.13Å
121	L	29.6	Very low	29.1	Very low	113 Å²	113	133.6 Å²	133.6	59%	0.592	66%	0.663	S	S	*	*	H	α-helix	trans	-58.6	-44.7	176.3	-78.3	162.9	0	0	0	111.8	D118 S123 H124 L125	D118-L121 PolarHBondContact O-N 3.02Å; L121-S123 VanDerWaalsContact C-N 3.27Å; L121-S123 PolarHBondContact O-N 2.88Å; L121-H124 PolarHBondContact O-N 2.82Å; L121-L125 PolarHBondContact O-N 3.22Å; L121-L125 VanDerWaalsContact O-N 3.14Å
122	Y	28.2	Very low	29.5	Very low	145 Å²	145	132.5 Å²	132.5	57%	0.569	65%	0.653	S	S	*	*	H	α-helix	trans	-69.7	-21.8	-178.9	-139.8	-84.8	0	0	0	113.4	L114 D118 A120 K126	L114-Y122 HydrophobicContact CD2-CD2 3.82Å; L114-Y122 HydrophobicContact CD2-CE2 4.38Å; L114-Y122 HydrophobicContact CD2-CG 4.1Å; D118-Y122 WeakPolarHBondContact O-CB 3.39Å; D118-Y122 PolarHBondContact O-N 3.3Å; A120-Y122 VanDerWaalsContact C-N 3.35Å; A120-Y122 PolarHBondContact O-N 2.99Å; Y122-K126 VanDerWaalsContact O-CB 3.25Å; Y122-K126 WeakPolarHBondContact O-CB 3.29Å
123	S	30.1	Very low	29.6	Very low	59 Å²	59	128.1 Å²	128.1	41%	0.413	64%	0.643	S	S	.	*	H	α-helix	trans	-80.2	-39.5	171.7	73	0	0	0	0	112.4	H119 A120 L121 K126 N127	H119-S123 VanDerWaalsContact O-CB 3.26Å; H119-S123 WeakPolarHBondContact O-CB 3.27Å; H119-S123 PolarHBondContact O-N 2.89Å; H119-S123 PolarHBondContact O-OG 3.04Å; A120-S123 PolarHBondContact O-N 3.25Å; A120-S123 PolarHBondContact O-OG 3.35Å; L121-S123 VanDerWaalsContact C-N 3.27Å; L121-S123 PolarHBondContact O-N 2.88Å; S123-K126 PolarHBondContact O-N 2.95Å; S123-N127 PolarHBondContact O-N 2.97Å
124	H	32.4	Very low	30.1	Very low	150 Å²	150	124 Å²	124	69%	0.694	63%	0.627	S	S	*	*	H	α-helix	trans	-67.9	-39	-179.3	-113.1	-57.1	0	0	0	112.8	A120 L121 K126	A120-H124 PolarHBondContact O-N 3.46Å; A120-H124 VanDerWaalsContact O-N 3.13Å; L121-H124 PolarHBondContact O-N 2.82Å; H124-K126 VanDerWaalsContact C-N 3.26Å; H124-K126 PolarHBondContact O-N 2.71Å
125	L	32.7	Very low	30.3	Very low	127 Å²	127	126.2 Å²	126.2	67%	0.665	63%	0.633	S	S	*	*	T	Hydrogen-bonded Turn	trans	-74.6	-11.5	177.7	-71.1	168.9	0	0	0	113.9	L121	L121-L125 PolarHBondContact O-N 3.22Å; L121-L125 VanDerWaalsContact O-N 3.14Å
126	K	32.9	Very low	30.6	Very low	147 Å²	147	124 Å²	124	64%	0.639	62%	0.622	S	S	*	*	T	Hydrogen-bonded Turn	trans	-106.3	-14.1	-171.1	-167.3	157.7	-169.8	149.5	0	115	Y122 S123 H124	Y122-K126 VanDerWaalsContact O-CB 3.25Å; Y122-K126 WeakPolarHBondContact O-CB 3.29Å; S123-K126 PolarHBondContact O-N 2.95Å; H124-K126 VanDerWaalsContact C-N 3.26Å; H124-K126 PolarHBondContact O-N 2.71Å
127	N	33	Very low	30.8	Very low	133 Å²	133	119.4 Å²	119.4	71%	0.711	60%	0.602	S	S	*	*	S	Bend	trans	-95.4	-7.3	-175.6	-75.5	-9.8	0	0	0	114.6	S123	S123-N127 PolarHBondContact O-N 2.97Å
128	N	29.5	Very low	30.9	Very low	113 Å²	113	114 Å²	114	60%	0.604	59%	0.587	S	S	*	*			trans	-108.8	111.6	178.8	-70.8	-26.3	0	0	0	110.7	V130	N128-V130 PolarHBondContact O-N 2.93Å
129	N	28.4	Very low	30.9	Very low	177 Å²	177	119.3 Å²	119.3	95%	0.947	60%	0.603	S	S	*	*			trans	-76.1	52.2	172.8	-81.2	-23.6	0	0	0	111.9
130	V	30.6	Very low	31	Very low	115 Å²	115	117.1 Å²	117.1	70%	0.697	60%	0.601	S	S	*	*	S	Bend	trans	-135.6	133.8	-179.1	-175.9	0	0	0	0	107.3	N128	N128-V130 PolarHBondContact O-N 2.93Å
131	Q	31.2	Very low	31	Very low	182 Å²	182	122 Å²	122	85%	0.85	61%	0.611	S	S	*	*	P	Polyproline II helix	trans	-57.4	125.2	174.8	-78.3	-174.6	-41	0	0	109.5	N133	Q131-N133 PolarHBondContact O-N 3.39Å
132	P	30.9	Very low	31.1	Very low	84 Å²	84	121.1 Å²	121.1	55%	0.545	61%	0.614	S	S	.	*	P	Polyproline II helix	trans	-66.3	120	176.9	27.5	-32.8	0	0	0	108.5	I137	P132-I137 HydrophobicContact CB-CD1 4.46Å
133	N	28.9	Very low	31	Very low	109 Å²	109	117 Å²	117	58%	0.583	61%	0.607	S	S	*	*	P	Polyproline II helix	trans	-70.2	144.5	-178.9	-157.9	-15.4	0	0	0	109.1	Q131 F135 D136	Q131-N133 PolarHBondContact O-N 3.39Å; N133-F135 PolarHBondContact O-N 2.89Å; N133-D136 WeakPolarHBondContact CB-OD2 3.4Å; N133-D136 PolarHBondContact O-N 3.09Å
134	H	34.1	Very low	30.8	Very low	129 Å²	129	120.2 Å²	120.2	60%	0.597	63%	0.626	S	S	*	*	T	Hydrogen-bonded Turn	trans	-62.6	-15.4	-163	-156.3	-49.3	0	0	0	113.9
135	F	31.5	Very low	30.7	Very low	119 Å²	119	120.6 Å²	120.6	52%	0.522	63%	0.632	S	S	.	*	T	Hydrogen-bonded Turn	trans	-86.6	-24.3	174	-76.6	-85.5	0	0	0	114.9	N133 L138 R139 L217	N133-F135 PolarHBondContact O-N 2.89Å; F135-L138 PolarHBondContact O-N 3.39Å; F135-R139 WeakPolarHBondContact O-CB 3.5Å; F135-R139 PolarHBondContact O-N 3.3Å; F135-L217 HydrophobicContact CE1-CD2 4.23Å; F135-L217 HydrophobicContact CZ-CD2 4.45Å
136	D	31.8	Very low	30.4	Very low	79 Å²	79	119.9 Å²	119.9	42%	0.422	64%	0.638	S	S	.	*	H	α-helix	trans	-73.1	-34.6	-173.2	-65.9	-45.4	0	0	0	112	N133 L138 R139 S140	N133-D136 WeakPolarHBondContact CB-OD2 3.4Å; N133-D136 PolarHBondContact O-N 3.09Å; D136-L138 VanDerWaalsContact C-N 3.33Å; D136-R139 PolarHBondContact O-N 3.03Å; D136-R139 IonicContact OD1-NH1 3.71Å; D136-S140 PolarHBondContact O-N 2.74Å; D136-S140 VanDerWaalsContact O-N 3.15Å; D136-S140 PolarHBondContact O-OG 3.09Å
137	I	32.1	Very low	30	Very low	82 Å²	82	118.8 Å²	118.8	42%	0.421	65%	0.649	S	S	.	*	H	α-helix	trans	-62.9	-40.2	171.6	-59.9	175	0	0	0	110.6	P132 S140 F141	P132-I137 HydrophobicContact CB-CD1 4.46Å; I137-S140 PolarHBondContact O-OG 3.09Å; I137-F141 HydrophobicContact CG2-CE2 4.2Å; I137-F141 WeakPolarHBondContact O-CD2 3.25Å
138	L	31.2	Very low	29.8	Very low	95 Å²	95	117.7 Å²	117.7	50%	0.497	65%	0.652	S	S	.	*	H	α-helix	trans	-72.1	-40.9	177.1	-65.8	172.7	0	0	0	111.2	F135 D136 S140 F141 S142	F135-L138 PolarHBondContact O-N 3.39Å; D136-L138 VanDerWaalsContact C-N 3.33Å; L138-S140 VanDerWaalsContact C-N 3.26Å; L138-S140 PolarHBondContact O-N 3.36Å; L138-F141 PolarHBondContact O-N 2.99Å; L138-S142 PolarHBondContact O-N 3.1Å; L138-S142 PolarHBondContact O-OG 2.86Å
139	R	30.2	Very low	29.7	Very low	169 Å²	169	117.5 Å²	117.5	64%	0.638	66%	0.659	S	S	*	*	H	α-helix	trans	-60.6	-32.2	179.3	-177.1	177.2	-81.9	152.1	-11.3	112.7	F135 D136 F141 S142	F135-R139 WeakPolarHBondContact O-CB 3.5Å; F135-R139 PolarHBondContact O-N 3.3Å; D136-R139 PolarHBondContact O-N 3.03Å; D136-R139 IonicContact OD1-NH1 3.71Å; R139-F141 VanDerWaalsContact C-N 3.29Å; R139-F141 PolarHBondContact O-N 2.73Å; R139-S142 PolarHBondContact O-N 3.35Å
140	S	31.7	Very low	29.7	Very low	73 Å²	73	116.2 Å²	116.2	51%	0.51	66%	0.658	S	S	.	*	T	Hydrogen-bonded Turn	trans	-74.3	-12.5	174.5	53.7	0	0	0	0	114.7	D136 I137 L138	D136-S140 PolarHBondContact O-N 2.74Å; D136-S140 VanDerWaalsContact O-N 3.15Å; D136-S140 PolarHBondContact O-OG 3.09Å; I137-S140 PolarHBondContact O-OG 3.09Å; L138-S140 VanDerWaalsContact C-N 3.26Å; L138-S140 PolarHBondContact O-N 3.36Å
141	F	31.2	Very low	29.4	Very low	162 Å²	162	116.1 Å²	116.1	71%	0.711	66%	0.662	S	S	*	*	T	Hydrogen-bonded Turn	trans	-99.7	-20.4	168.3	-64.2	-66.2	0	0	0	113.8	I137 L138 R139	I137-F141 HydrophobicContact CG2-CE2 4.2Å; I137-F141 WeakPolarHBondContact O-CD2 3.25Å; L138-F141 PolarHBondContact O-N 2.99Å; R139-F141 VanDerWaalsContact C-N 3.29Å; R139-F141 PolarHBondContact O-N 2.73Å
142	S	29.7	Very low	29.2	Very low	94 Å²	94	113.2 Å²	113.2	66%	0.657	66%	0.657	S	S	*	*	S	Bend	trans	-92	-0.8	-176.3	-58.9	0	0	0	0	115.1	L138 R139 P144	L138-S142 PolarHBondContact O-N 3.1Å; L138-S142 PolarHBondContact O-OG 2.86Å; R139-S142 PolarHBondContact O-N 3.35Å; S142-P144 WeakPolarHBondContact O-CD 3.44Å
143	S	26.2	Very low	28.8	Very low	59 Å²	59	116 Å²	116	41%	0.413	67%	0.672	S	S	.	*			trans	-94.7	110.3	-178.8	55.9	0	0	0	0	112.9	L145	S143-L145 PolarHBondContact O-N 2.85Å
144	P	26.8	Very low	28.7	Very low	127 Å²	127	116.3 Å²	116.3	83%	0.825	68%	0.678	S	S	*	*			trans	-73.1	100	169.1	30.2	-32.4	0	0	0	109.2	S142 S146	S142-P144 WeakPolarHBondContact O-CD 3.44Å; P144-S146 PolarHBondContact O-N 2.77Å
145	L	29.4	Very low	28.3	Very low	157 Å²	157	117.1 Å²	117.1	82%	0.822	69%	0.692	S	S	*	*	P	Polyproline II helix	trans	-61.7	123.1	179.1	-93.5	74.4	0	0	0	110.3	S143	S143-L145 PolarHBondContact O-N 2.85Å
146	S	26.8	Very low	28.3	Very low	112 Å²	112	119.5 Å²	119.5	78%	0.783	71%	0.705	S	S	*	*	P	Polyproline II helix	trans	-66.8	144.6	-174.2	49	0	0	0	0	112.8	P144 S148	P144-S146 PolarHBondContact O-N 2.77Å; S146-S148 PolarHBondContact O-N 3.26Å
147	S	24.7	Very low	28.1	Very low	125 Å²	125	121.1 Å²	121.1	87%	0.874	72%	0.72	S	S	*	*	P	Polyproline II helix	trans	-68.7	119.7	-179.5	42.9	0	0	0	0	112.4
148	S	29.7	Very low	28	Very low	110 Å²	110	122.8 Å²	122.8	77%	0.769	74%	0.736	S	S	*	*			trans	-105.9	90.6	165.5	39.5	0	0	0	0	110.4	S146 T150	S146-S148 PolarHBondContact O-N 3.26Å; S148-T150 PolarHBondContact O-N 3.42Å
149	S	26.9	Very low	28.2	Very low	108 Å²	108	124.1 Å²	124.1	76%	0.755	74%	0.742	S	S	*	*	S	Bend	trans	14.8	97.3	158.5	58.9	0	0	0	0	119.3
150	T	28.7	Very low	28.4	Very low	151 Å²	151	119.6 Å²	119.6	93%	0.926	73%	0.734	S	S	*	*				-164.1	152.6	123.9	12.1	0	0	0	0	110.3	S148	S148-T150 PolarHBondContact O-N 3.42Å
151	S	23.6	Very low	28.5	Very low	113 Å²	113	121 Å²	121	79%	0.79	74%	0.744	S	S	*	*			trans	-108.3	115.3	-159.2	54.9	0	0	0	0	114.8
152	V	26.7	Very low	28.7	Very low	121 Å²	121	116.5 Å²	116.5	73%	0.733	73%	0.732	S	S	*	*			trans	-139.3	128.5	150.9	-177.3	0	0	0	0	108
153	T	22.8	Very low	29.1	Very low	142 Å²	142	114.5 Å²	114.5	87%	0.871	72%	0.718	S	S	*	*			trans	-97.7	106.6	-178.8	48.4	0	0	0	0	111.7
154	T	27.1	Very low	29.8	Very low	115 Å²	115	116.6 Å²	116.6	71%	0.706	72%	0.724	S	S	*	*			trans	-128.6	117.8	165.3	50	0	0	0	0	109.6	Q156	T154-Q156 PolarHBondContact O-N 3.2Å
155	T	26.4	Very low	30.7	Very low	146 Å²	146	113.8 Å²	113.8	90%	0.896	70%	0.702	S	S	*	*			trans	-77.8	101.3	-175.6	51.6	0	0	0	0	111.9
156	Q	30.6	Very low	31.6	Very low	170 Å²	170	110.8 Å²	110.8	79%	0.794	69%	0.686	S	S	*	*	P	Polyproline II helix	trans	-84.8	142.9	158.6	-68.4	-175.5	-75.4	0	0	109.7	T154	T154-Q156 PolarHBondContact O-N 3.2Å
157	P	27.7	Very low	32.6	Very low	112 Å²	112	111.1 Å²	111.1	73%	0.727	68%	0.679	S	S	*	*	P	Polyproline II helix	trans	-68.5	148.9	169.6	30.5	-34.3	0	0	0	110.3
158	P	30.5	Very low	33.6	Very low	117 Å²	117	110 Å²	110	76%	0.76	66%	0.655	S	S	*	*	P	Polyproline II helix	trans	-65.2	142.4	174.1	28.4	-34.3	0	0	0	110.8	T160	P158-T160 PolarHBondContact O-N 3.13Å
159	I	34	Very low	34.7	Very low	123 Å²	123	108 Å²	108	63%	0.631	64%	0.636	S	S	*	*	P	Polyproline II helix	trans	-65.3	126.6	174	-58	174.7	0	0	0	108.3	L164	I159-L164 HydrophobicContact CG2-CD2 4.42Å; I159-L164 HydrophobicContact CG2-CG 4.06Å
160	T	34.7	Very low	35.6	Very low	75 Å²	75	106.2 Å²	106.2	46%	0.46	62%	0.623	S	S	.	*	P	Polyproline II helix	trans	-73.3	152.2	178.6	56.4	0	0	0	0	111.4	P158 S162 S163 L164	P158-T160 PolarHBondContact O-N 3.13Å; T160-S162 PolarHBondContact O-N 3.3Å; T160-S162 PolarHBondContact OG1-OG 3.28Å; T160-S163 PolarHBondContact O-N 3.39Å; T160-S163 PolarHBondContact OG1-OG 3.47Å; T160-L164 PolarHBondContact O-N 2.92Å
161	S	33.9	Very low	36.5	Very low	103 Å²	103	106 Å²	106	72%	0.72	61%	0.605	S	S	*	*	H	α-helix	trans	-54.3	-34.9	175.6	47.8	0	0	0	0	112.7	S163 L164 L165	S161-S163 PolarHBondContact O-N 2.99Å; S161-L164 PolarHBondContact O-N 3.25Å; S161-L165 PolarHBondContact O-N 3.3Å
162	S	35.1	Very low	37.6	Very low	67 Å²	67	101.3 Å²	101.3	47%	0.469	57%	0.571	S	S	.	*	H	α-helix	trans	-60.5	-40.4	174.3	51.1	0	0	0	0	113.7	T160 L165 L166	T160-S162 PolarHBondContact O-N 3.3Å; T160-S162 PolarHBondContact OG1-OG 3.28Å; S162-L165 PolarHBondContact O-N 3.45Å; S162-L166 WeakPolarHBondContact O-CG 3.25Å; S162-L166 PolarHBondContact O-N 3.31Å; S162-L166 VanDerWaalsContact O-N 3.09Å
163	S	38.6	Very low	38.6	Very low	52 Å²	52	101 Å²	101	36%	0.364	57%	0.566	S	S	.	*	H	α-helix	trans	-69.2	-37.7	177.8	-58.4	0	0	0	0	112.2	T160 S161 L167	T160-S163 PolarHBondContact O-N 3.39Å; T160-S163 PolarHBondContact OG1-OG 3.47Å; S161-S163 PolarHBondContact O-N 2.99Å; S163-L167 PolarHBondContact O-N 3.05Å; S163-L167 VanDerWaalsContact O-N 3.11Å
164	L	41.8	Very low	39.7	Very low	102 Å²	102	98.8 Å²	98.8	53%	0.534	55%	0.545	S	S	.	.	H	α-helix	trans	-65.5	-43	173.6	-71.9	171.6	0	0	0	111.4	I159 T160 S161 L166 L167 W168	I159-L164 HydrophobicContact CG2-CD2 4.42Å; I159-L164 HydrophobicContact CG2-CG 4.06Å; T160-L164 PolarHBondContact O-N 2.92Å; S161-L164 PolarHBondContact O-N 3.25Å; L164-L166 VanDerWaalsContact C-N 3.35Å; L164-L166 PolarHBondContact O-N 3.18Å; L164-L167 PolarHBondContact O-N 3.02Å; L164-W168 VanDerWaalsContact O-CB 3.25Å; L164-W168 WeakPolarHBondContact O-CB 3.4Å; L164-W168 PolarHBondContact O-N 3.15Å
165	L	45.3	Very low	40.5	Very low	69 Å²	69	98.4 Å²	98.4	36%	0.361	54%	0.539	S	S	.	.	H	α-helix	trans	-59	-44.5	177	-164.7	82.8	0	0	0	111.7	S161 S162 W168 L169 L197	S161-L165 PolarHBondContact O-N 3.3Å; S162-L165 PolarHBondContact O-N 3.45Å; L165-W168 PolarHBondContact O-N 2.88Å; L165-L169 HydrophobicContact CD2-CD1 4.26Å; L165-L169 HydrophobicContact CG-CD1 4.1Å; L165-L169 WeakPolarHBondContact O-CB 3.42Å; L165-L169 VanDerWaalsContact O-CG 3.27Å; L165-L169 WeakPolarHBondContact O-CG 3.26Å; L165-L169 PolarHBondContact O-N 3.34Å; L165-L197 HydrophobicContact CD1-CD2 4.25Å
166	L	47.8	Very low	41.4	Very low	93 Å²	93	94.5 Å²	94.5	49%	0.487	51%	0.512	S	S	.	.	H	α-helix	trans	-67	-42.3	179.2	-72.2	169.3	0	0	0	112.8	S162 L164 W168 S170	S162-L166 WeakPolarHBondContact O-CG 3.25Å; S162-L166 PolarHBondContact O-N 3.31Å; S162-L166 VanDerWaalsContact O-N 3.09Å; L164-L166 VanDerWaalsContact C-N 3.35Å; L164-L166 PolarHBondContact O-N 3.18Å; L166-W168 VanDerWaalsContact C-N 3.31Å; L166-W168 PolarHBondContact O-N 3.21Å; L166-S170 WeakPolarHBondContact O-CB 3.4Å; L166-S170 PolarHBondContact O-N 3.04Å
167	L	48.7	Very low	41.8	Very low	119 Å²	119	95.7 Å²	95.7	62%	0.623	51%	0.51	S	S	*	.	H	α-helix	trans	-60.2	-42.2	172.8	-88.1	161.2	0	0	0	111.7	S163 L164 S170 R171	S163-L167 PolarHBondContact O-N 3.05Å; S163-L167 VanDerWaalsContact O-N 3.11Å; L164-L167 PolarHBondContact O-N 3.02Å; L167-S170 PolarHBondContact O-N 3.06Å; L167-R171 PolarHBondContact O-N 3.17Å; L167-R171 VanDerWaalsContact O-N 3.15Å
168	W	45.8	Very low	42.4	Very low	101 Å²	101	97.7 Å²	97.7	38%	0.383	51%	0.51	S	S	.	.	H	α-helix	trans	-70.5	-42.1	-179.4	-167.4	90	0	0	0	112.2	L164 L165 L166 S170 R171 L172 I189 L193	L164-W168 VanDerWaalsContact O-CB 3.25Å; L164-W168 WeakPolarHBondContact O-CB 3.4Å; L164-W168 PolarHBondContact O-N 3.15Å; L165-W168 PolarHBondContact O-N 2.88Å; L166-W168 VanDerWaalsContact C-N 3.31Å; L166-W168 PolarHBondContact O-N 3.21Å; W168-S170 VanDerWaalsContact C-N 3.32Å; W168-S170 PolarHBondContact O-N 3.22Å; W168-R171 PolarHBondContact O-N 2.98Å; W168-L172 HydrophobicContact CE3-CD1 4.05Å; W168-L172 HydrophobicContact CE3-CG 4Å; W168-L172 HydrophobicContact CH2-CD1 3.51Å; W168-L172 HydrophobicContact CH2-CD2 4Å; W168-L172 HydrophobicContact CH2-CG 3.68Å; W168-L172 HydrophobicContact CZ2-CD2 4.31Å; W168-L172 HydrophobicContact CZ2-CG 4.25Å; W168-L172 HydrophobicContact CZ3-CD1 3.22Å; W168-L172 HydrophobicContact CZ3-CD2 4.37Å; W168-L172 HydrophobicContact CZ3-CG 3.55Å; W168-L172 PolarHBondContact O-N 2.93Å; W168-I189 HydrophobicContact CH2-CG2 3.73Å; W168-I189 HydrophobicContact CZ2-CG2 4.15Å; W168-L193 HydrophobicContact CE3-CD1 4.42Å; W168-L193 HydrophobicContact CE3-CD2 4.13Å; W168-L193 HydrophobicContact CH2-CD1 3.52Å; W168-L193 HydrophobicContact CH2-CD2 3.98Å; W168-L193 HydrophobicContact CH2-CG 4.3Å; W168-L193 HydrophobicContact CZ2-CD1 4.04Å; W168-L193 HydrophobicContact CZ3-CD1 3.73Å; W168-L193 HydrophobicContact CZ3-CD2 3.4Å; W168-L193 HydrophobicContact CZ3-CG 4.17Å
169	L	51.7	Low	42.6	Very low	70 Å²	70	96 Å²	96	37%	0.366	49%	0.494	S	S	.	.	H	α-helix	trans	-61	-38.7	171.9	-75.5	168.8	0	0	0	112.2	L165 R171 L172 N173	L165-L169 HydrophobicContact CD2-CD1 4.26Å; L165-L169 HydrophobicContact CG-CD1 4.1Å; L165-L169 WeakPolarHBondContact O-CB 3.42Å; L165-L169 VanDerWaalsContact O-CG 3.27Å; L165-L169 WeakPolarHBondContact O-CG 3.26Å; L165-L169 PolarHBondContact O-N 3.34Å; L169-R171 VanDerWaalsContact C-N 3.34Å; L169-R171 PolarHBondContact O-N 2.75Å; L169-L172 PolarHBondContact O-N 2.87Å; L169-N173 WeakPolarHBondContact O-CB 3.42Å; L169-N173 PolarHBondContact O-N 3.32Å
170	S	46.1	Very low	42.8	Very low	69 Å²	69	94.3 Å²	94.3	48%	0.483	49%	0.493	S	S	.	.	H	α-helix	trans	-63.4	-39.5	175	-167.9	0	0	0	0	112.1	L166 L167 W168 N173 E174	L166-S170 WeakPolarHBondContact O-CB 3.4Å; L166-S170 PolarHBondContact O-N 3.04Å; L167-S170 PolarHBondContact O-N 3.06Å; W168-S170 VanDerWaalsContact C-N 3.32Å; W168-S170 PolarHBondContact O-N 3.22Å; S170-N173 PolarHBondContact O-N 3.04Å; S170-E174 PolarHBondContact O-N 2.86Å
171	R	47.4	Very low	43	Very low	147 Å²	147	99.1 Å²	99.1	56%	0.555	51%	0.51	S	S	*	.	H	α-helix	trans	-73.9	-33.9	176	-70.7	-56.5	-161.6	178.6	2.8	113.1	L167 W168 L169 N173 E174 L175	L167-R171 PolarHBondContact O-N 3.17Å; L167-R171 VanDerWaalsContact O-N 3.15Å; W168-R171 PolarHBondContact O-N 2.98Å; L169-R171 VanDerWaalsContact C-N 3.34Å; L169-R171 PolarHBondContact O-N 2.75Å; R171-N173 VanDerWaalsContact C-N 3.3Å; R171-N173 PolarHBondContact O-N 3.05Å; R171-E174 WeakPolarHBondContact CD-OE2 3.32Å; R171-E174 IonicContact CZ-OE2 2.71Å; R171-E174 IonicContact NE-OE2 3.24Å; R171-E174 IonicContact NH1-OE1 2.78Å; R171-E174 IonicContact NH1-OE2 2.73Å; R171-E174 PolarHBondContact NH1-OE2 3.3Å; R171-E174 PolarHBondContact O-N 3.02Å; R171-L175 WeakPolarHBondContact O-CG 3.36Å; R171-L175 PolarHBondContact O-N 3.47Å
172	L	47.4	Very low	43.1	Very low	15 Å²	15	98.7 Å²	98.7	8%	0.079	50%	0.497	C	S	.	.	H	α-helix	trans	-58.2	-44.5	167.3	-91.6	-160	0	0	0	111.4	W168 L169 E174 L175 I176 I189	W168-L172 HydrophobicContact CE3-CD1 4.05Å; W168-L172 HydrophobicContact CE3-CG 4Å; W168-L172 HydrophobicContact CH2-CD1 3.51Å; W168-L172 HydrophobicContact CH2-CD2 4Å; W168-L172 HydrophobicContact CH2-CG 3.68Å; W168-L172 HydrophobicContact CZ2-CD2 4.31Å; W168-L172 HydrophobicContact CZ2-CG 4.25Å; W168-L172 HydrophobicContact CZ3-CD1 3.22Å; W168-L172 HydrophobicContact CZ3-CD2 4.37Å; W168-L172 HydrophobicContact CZ3-CG 3.55Å; W168-L172 PolarHBondContact O-N 2.93Å; L169-L172 PolarHBondContact O-N 2.87Å; L172-E174 VanDerWaalsContact C-N 3.3Å; L172-E174 PolarHBondContact O-N 3.43Å; L172-L175 PolarHBondContact O-N 3.32Å; L172-I176 HydrophobicContact CB-CD1 4.45Å; L172-I176 WeakPolarHBondContact O-CB 3.36Å; L172-I176 WeakPolarHBondContact O-CD1 3.44Å; L172-I176 VanDerWaalsContact O-CG1 3.23Å; L172-I176 WeakPolarHBondContact O-CG1 3.44Å; L172-I176 PolarHBondContact O-N 2.93Å; L172-I189 HydrophobicContact CD2-CG2 4.29Å
173	N	47.2	Very low	43.1	Very low	115 Å²	115	100.1 Å²	100.1	62%	0.615	50%	0.503	S	S	*	.	H	α-helix	trans	-64.8	-35.3	-177.5	-162.4	39.4	0	0	0	112.1	L169 S170 R171 Y177	L169-N173 WeakPolarHBondContact O-CB 3.42Å; L169-N173 PolarHBondContact O-N 3.32Å; S170-N173 PolarHBondContact O-N 3.04Å; R171-N173 VanDerWaalsContact C-N 3.3Å; R171-N173 PolarHBondContact O-N 3.05Å; N173-Y177 WeakPolarHBondContact O-CB 3.26Å; N173-Y177 PolarHBondContact O-N 3.49Å; N173-Y177 VanDerWaalsContact O-N 3.14Å
174	E	46.5	Very low	43	Very low	95 Å²	95	103 Å²	103	44%	0.444	52%	0.518	S	S	.	.	H	α-helix	trans	-67.1	-44.2	170	-70.7	179.7	148.8	0	0	112.4	S170 R171 L172 I176 Y177 E178	S170-E174 PolarHBondContact O-N 2.86Å; R171-E174 WeakPolarHBondContact CD-OE2 3.32Å; R171-E174 IonicContact CZ-OE2 2.71Å; R171-E174 IonicContact NE-OE2 3.24Å; R171-E174 IonicContact NH1-OE1 2.78Å; R171-E174 IonicContact NH1-OE2 2.73Å; R171-E174 PolarHBondContact NH1-OE2 3.3Å; R171-E174 PolarHBondContact O-N 3.02Å; L172-E174 VanDerWaalsContact C-N 3.3Å; L172-E174 PolarHBondContact O-N 3.43Å; E174-I176 PolarHBondContact O-N 2.75Å; E174-Y177 WeakPolarHBondContact O-CB 3.29Å; E174-Y177 PolarHBondContact O-N 3.05Å; E174-Y177 VanDerWaalsContact O-N 3.13Å; E174-E178 PolarHBondContact O-N 3.13Å
175	L	42.4	Very low	42.7	Very low	107 Å²	107	104 Å²	104	56%	0.56	52%	0.52	S	S	*	.	H	α-helix	trans	-62.4	-40.2	177.3	-74.8	164.8	0	0	0	112.5	R171 L172 Y177 E178 N179	R171-L175 WeakPolarHBondContact O-CG 3.36Å; R171-L175 PolarHBondContact O-N 3.47Å; L172-L175 PolarHBondContact O-N 3.32Å; L175-Y177 VanDerWaalsContact C-N 3.27Å; L175-Y177 PolarHBondContact O-N 3.45Å; L175-E178 PolarHBondContact O-N 2.86Å; L175-N179 PolarHBondContact O-N 3.41Å
176	I	45.9	Very low	42.3	Very low	64 Å²	64	102.4 Å²	102.4	33%	0.328	51%	0.514	S	S	.	.	H	α-helix	trans	-67.1	-30.1	175.5	-68.5	163.8	0	0	0	111.2	L172 E174 T186 Y190	L172-I176 HydrophobicContact CB-CD1 4.45Å; L172-I176 WeakPolarHBondContact O-CB 3.36Å; L172-I176 WeakPolarHBondContact O-CD1 3.44Å; L172-I176 VanDerWaalsContact O-CG1 3.23Å; L172-I176 WeakPolarHBondContact O-CG1 3.44Å; L172-I176 PolarHBondContact O-N 2.93Å; E174-I176 PolarHBondContact O-N 2.75Å; I176-T186 HydrophobicContact CG1-CG2 4.31Å; I176-Y190 HydrophobicContact CD1-CE2 4.25Å
177	Y	40.2	Very low	41.7	Very low	194 Å²	194	102.1 Å²	102.1	76%	0.761	51%	0.512	S	S	*	.	H	α-helix	trans	-74.7	-41.3	177.2	-168.1	-95.8	0	0	0	112.6	N173 E174 L175	N173-Y177 WeakPolarHBondContact O-CB 3.26Å; N173-Y177 PolarHBondContact O-N 3.49Å; N173-Y177 VanDerWaalsContact O-N 3.14Å; E174-Y177 WeakPolarHBondContact O-CB 3.29Å; E174-Y177 PolarHBondContact O-N 3.05Å; E174-Y177 VanDerWaalsContact O-N 3.13Å; L175-Y177 VanDerWaalsContact C-N 3.27Å; L175-Y177 PolarHBondContact O-N 3.45Å
178	E	39.1	Very low	41.2	Very low	154 Å²	154	100.3 Å²	100.3	72%	0.72	51%	0.509	S	S	*	.	H	α-helix	trans	-73.7	-49.7	177.4	-65	-87.2	115.5	0	0	111.6	E174 L175 S180	E174-E178 PolarHBondContact O-N 3.13Å; L175-E178 PolarHBondContact O-N 2.86Å; E178-S180 PolarHBondContact O-N 2.84Å
179	N	34.3	Very low	40.8	Very low	82 Å²	82	97.9 Å²	97.9	44%	0.439	50%	0.503	S	S	.	.			trans	-103.8	49	-169.6	-72.8	13.9	0	0	0	113.9	L175 Q181 E182	L175-N179 PolarHBondContact O-N 3.41Å; N179-Q181 PolarHBondContact O-N 3.3Å; N179-E182 PolarHBondContact ND2-OE2 2.84Å; N179-E182 PolarHBondContact O-N 2.78Å; N179-E182 VanDerWaalsContact O-N 3.14Å
180	S	38.1	Very low	40.2	Very low	87 Å²	87	97.3 Å²	97.3	61%	0.608	50%	0.496	S	S	*	.	T	Hydrogen-bonded Turn	trans	-58.3	-6.7	178.7	64.5	0	0	0	0	116.2	E178	E178-S180 PolarHBondContact O-N 2.84Å
181	Q	38.7	Very low	40.1	Very low	176 Å²	176	100.8 Å²	100.8	82%	0.822	50%	0.503	S	S	*	.	T	Hydrogen-bonded Turn	trans	-87.8	-19.8	179.2	-148.8	85.4	11.2	0	0	113.6	N179 V183	N179-Q181 PolarHBondContact O-N 3.3Å; Q181-V183 PolarHBondContact O-N 3.48Å
182	E	36	Very low	39.9	Very low	94 Å²	94	97.8 Å²	97.8	44%	0.439	50%	0.501	S	S	.	.			trans	-105	41.2	-166.2	-66.5	175.7	148.7	0	0	113.3	N179 T184 E185	N179-E182 PolarHBondContact ND2-OE2 2.84Å; N179-E182 PolarHBondContact O-N 2.78Å; N179-E182 VanDerWaalsContact O-N 3.14Å; E182-T184 PolarHBondContact O-N 3.2Å; E182-E185 PolarHBondContact O-N 2.88Å; E182-E185 VanDerWaalsContact O-N 3.09Å
183	V	36	Very low	39.2	Very low	97 Å²	97	98.8 Å²	98.8	59%	0.588	51%	0.506	S	S	*	.	H	α-helix	trans	-59.6	-15.4	-172.8	-176.3	0	0	0	0	114.3	Q181 T186	Q181-V183 PolarHBondContact O-N 3.48Å; V183-T186 PolarHBondContact O-OG1 3.02Å
184	T	36.4	Very low	38.9	Very low	112 Å²	112	96.1 Å²	96.1	69%	0.687	49%	0.494	S	S	*	.	H	α-helix	trans	-74	-37.1	174.7	40.6	0	0	0	0	113.6	E182	E182-T184 PolarHBondContact O-N 3.2Å
185	E	35.2	Very low	38.4	Very low	124 Å²	124	96 Å²	96	58%	0.579	50%	0.496	S	S	*	.	H	α-helix	trans	-80.1	-37.9	-174.8	-60.3	-161.3	166.3	0	0	111.9	E182 N187 C188 I189	E182-E185 PolarHBondContact O-N 2.88Å; E182-E185 VanDerWaalsContact O-N 3.09Å; E185-N187 PolarHBondContact O-N 2.9Å; E185-C188 WeakPolarHBondContact O-CB 3.5Å; E185-C188 PolarHBondContact O-N 3.19Å; E185-I189 WeakPolarHBondContact O-CG1 3.35Å; E185-I189 PolarHBondContact O-N 3.03Å
186	T	37.7	Very low	38.1	Very low	36 Å²	36	96.4 Å²	96.4	22%	0.221	50%	0.499	C	S	.	.	H	α-helix	trans	-56.7	-38.1	174.6	59.2	0	0	0	0	111.5	I176 V183 C188 I189 Y190	I176-T186 HydrophobicContact CG1-CG2 4.31Å; V183-T186 PolarHBondContact O-OG1 3.02Å; T186-C188 VanDerWaalsContact C-N 3.34Å; T186-C188 PolarHBondContact O-N 3.46Å; T186-I189 PolarHBondContact O-N 2.67Å; T186-Y190 VanDerWaalsContact O-CD2 3.31Å; T186-Y190 WeakPolarHBondContact O-CD2 3.35Å; T186-Y190 PolarHBondContact O-N 3.47Å
187	N	35.4	Very low	37.6	Very low	86 Å²	86	97.3 Å²	97.3	46%	0.46	50%	0.504	S	S	.	.	H	α-helix	trans	-64.5	-36.2	178.1	-150.7	-13.8	0	0	0	112.4	E185 K191	E185-N187 PolarHBondContact O-N 2.9Å; N187-K191 WeakPolarHBondContact O-CB 3.48Å; N187-K191 PolarHBondContact O-N 2.9Å
188	C	37.3	Very low	37.3	Very low	82 Å²	82	91.7 Å²	91.7	55%	0.554	49%	0.493	S	S	*	.	H	α-helix	trans	-69.2	-39.7	172.3	-68.6	0	0	0	0	112.4	E185 T186 K191 T192	E185-C188 WeakPolarHBondContact O-CB 3.5Å; E185-C188 PolarHBondContact O-N 3.19Å; T186-C188 VanDerWaalsContact C-N 3.34Å; T186-C188 PolarHBondContact O-N 3.46Å; C188-K191 PolarHBondContact O-N 3.34Å; C188-T192 WeakPolarHBondContact O-CB 3.47Å; C188-T192 PolarHBondContact O-N 2.61Å; C188-T192 PolarHBondContact O-OG1 3.1Å
189	I	38.6	Very low	36.8	Very low	50 Å²	50	91.9 Å²	91.9	26%	0.256	49%	0.494	S	S	.	.	H	α-helix	trans	-63.3	-49.2	175.9	-65.7	167.3	0	0	0	110.4	W168 L172 E185 T186 K191 T192 L193	W168-I189 HydrophobicContact CH2-CG2 3.73Å; W168-I189 HydrophobicContact CZ2-CG2 4.15Å; L172-I189 HydrophobicContact CD2-CG2 4.29Å; E185-I189 WeakPolarHBondContact O-CG1 3.35Å; E185-I189 PolarHBondContact O-N 3.03Å; T186-I189 PolarHBondContact O-N 2.67Å; I189-K191 PolarHBondContact O-N 3.22Å; I189-T192 PolarHBondContact O-N 2.85Å; I189-L193 PolarHBondContact O-N 2.76Å
190	Y	39.4	Very low	36.5	Very low	57 Å²	57	93.2 Å²	93.2	22%	0.224	51%	0.505	C	S	.	.	H	α-helix	trans	-58.1	-45.3	175.9	-90.8	-77.5	0	0	0	112.2	I176 T186 T192 L193 T194 F320	I176-Y190 HydrophobicContact CD1-CE2 4.25Å; T186-Y190 VanDerWaalsContact O-CD2 3.31Å; T186-Y190 WeakPolarHBondContact O-CD2 3.35Å; T186-Y190 PolarHBondContact O-N 3.47Å; Y190-T192 VanDerWaalsContact C-N 3.33Å; Y190-T192 PolarHBondContact O-N 2.75Å; Y190-L193 PolarHBondContact O-N 2.78Å; Y190-T194 PolarHBondContact O-N 3Å; Y190-T194 PolarHBondContact O-OG1 2.77Å; Y190-F320 HydrophobicContact CD1-CD1 4.41Å; Y190-F320 HydrophobicContact CD1-CE1 4.24Å; Y190-F320 AromaticContact CD2-CE1 3.62Å; Y190-F320 HydrophobicContact CD2-CE1 3.62Å; Y190-F320 HydrophobicContact CD2-CZ 4.39Å; Y190-F320 HydrophobicContact CE1-CD1 4.27Å; Y190-F320 HydrophobicContact CE1-CE1 4.26Å; Y190-F320 HydrophobicContact CE2-CD1 4.37Å; Y190-F320 AromaticContact CE2-CE1 3.64Å; Y190-F320 HydrophobicContact CE2-CE1 3.64Å; Y190-F320 HydrophobicContact CE2-CZ 4.33Å; Y190-F320 AromaticContact CG-CE1 3.94Å; Y190-F320 HydrophobicContact CG-CE1 3.94Å; Y190-F320 AromaticContact CZ-CE1 3.97Å
191	K	43.2	Very low	35.9	Very low	143 Å²	143	94.5 Å²	94.5	62%	0.622	51%	0.514	S	S	*	.	H	α-helix	trans	-63.8	-37.9	178.4	-170.1	172.7	-175.7	177.1	0	112.7	N187 C188 I189 L193 T194 N195	N187-K191 WeakPolarHBondContact O-CB 3.48Å; N187-K191 PolarHBondContact O-N 2.9Å; C188-K191 PolarHBondContact O-N 3.34Å; I189-K191 PolarHBondContact O-N 3.22Å; K191-L193 VanDerWaalsContact C-N 3.34Å; K191-T194 WeakPolarHBondContact CA-OG1 3.22Å; K191-T194 PolarHBondContact O-OG1 2.94Å; K191-N195 VanDerWaalsContact O-CG 3.3Å; K191-N195 PolarHBondContact O-N 3.17Å; K191-N195 PolarHBondContact O-OD1 3.12Å
192	T	42.8	Very low	35.3	Very low	84 Å²	84	91.5 Å²	91.5	52%	0.515	51%	0.508	S	S	.	.	H	α-helix	trans	-66.1	-39.5	174.7	-56.1	0	0	0	0	110.9	C188 I189 Y190 N195 L196	C188-T192 WeakPolarHBondContact O-CB 3.47Å; C188-T192 PolarHBondContact O-N 2.61Å; C188-T192 PolarHBondContact O-OG1 3.1Å; I189-T192 PolarHBondContact O-N 2.85Å; Y190-T192 VanDerWaalsContact C-N 3.33Å; Y190-T192 PolarHBondContact O-N 2.75Å; T192-N195 PolarHBondContact O-N 2.72Å; T192-L196 HydrophobicContact CG2-CD1 4.18Å; T192-L196 PolarHBondContact O-N 3.05Å; T192-L196 VanDerWaalsContact O-N 3.08Å
193	L	33.8	Very low	34.8	Very low	36 Å²	36	92.7 Å²	92.7	19%	0.188	53%	0.527	C	S	.	.	H	α-helix	trans	-70	-40.2	177.9	-140.6	81.8	0	0	0	113.2	W168 I189 Y190 K191 N195 L196 L197	W168-L193 HydrophobicContact CE3-CD1 4.42Å; W168-L193 HydrophobicContact CE3-CD2 4.13Å; W168-L193 HydrophobicContact CH2-CD1 3.52Å; W168-L193 HydrophobicContact CH2-CD2 3.98Å; W168-L193 HydrophobicContact CH2-CG 4.3Å; W168-L193 HydrophobicContact CZ2-CD1 4.04Å; W168-L193 HydrophobicContact CZ3-CD1 3.73Å; W168-L193 HydrophobicContact CZ3-CD2 3.4Å; W168-L193 HydrophobicContact CZ3-CG 4.17Å; I189-L193 PolarHBondContact O-N 2.76Å; Y190-L193 PolarHBondContact O-N 2.78Å; K191-L193 VanDerWaalsContact C-N 3.34Å; L193-N195 VanDerWaalsContact C-N 3.26Å; L193-N195 PolarHBondContact O-N 2.98Å; L193-L196 PolarHBondContact O-N 3.39Å; L193-L197 HydrophobicContact CD2-CD1 4.04Å; L193-L197 HydrophobicContact CG-CD1 4.18Å; L193-L197 WeakPolarHBondContact O-CB 3.3Å; L193-L197 VanDerWaalsContact O-CG 3.32Å; L193-L197 WeakPolarHBondContact O-CG 3.49Å; L193-L197 PolarHBondContact O-N 3.36Å
194	T	39.3	Very low	34.2	Very low	59 Å²	59	97 Å²	97	36%	0.362	54%	0.541	S	S	.	.	H	α-helix	trans	-62.9	-35.8	175.6	46.3	0	0	0	0	111.6	Y190 K191 S198 F322	Y190-T194 PolarHBondContact O-N 3Å; Y190-T194 PolarHBondContact O-OG1 2.77Å; K191-T194 WeakPolarHBondContact CA-OG1 3.22Å; K191-T194 PolarHBondContact O-OG1 2.94Å; T194-S198 VanDerWaalsContact O-CB 3.24Å; T194-S198 WeakPolarHBondContact O-CB 3.4Å; T194-S198 PolarHBondContact O-N 2.86Å; T194-S198 VanDerWaalsContact O-N 3.09Å; T194-S198 PolarHBondContact O-OG 2.86Å; T194-S198 VanDerWaalsContact O-OG 3.13Å; T194-F322 HydrophobicContact CG2-CE2 4.23Å; T194-F322 HydrophobicContact CG2-CZ 4.42Å
195	N	37.1	Very low	33.7	Very low	91 Å²	91	100.7 Å²	100.7	49%	0.487	55%	0.547	S	S	.	.	H	α-helix	trans	-63.6	-54.9	172.8	-67.9	7	0	0	0	110.5	K191 T192 L193 L197 S198 E199	K191-N195 VanDerWaalsContact O-CG 3.3Å; K191-N195 PolarHBondContact O-N 3.17Å; K191-N195 PolarHBondContact O-OD1 3.12Å; T192-N195 PolarHBondContact O-N 2.72Å; L193-N195 VanDerWaalsContact C-N 3.26Å; L193-N195 PolarHBondContact O-N 2.98Å; N195-L197 VanDerWaalsContact C-N 3.26Å; N195-L197 PolarHBondContact O-N 2.81Å; N195-S198 PolarHBondContact O-N 3.01Å; N195-S198 PolarHBondContact O-OG 2.95Å; N195-E199 PolarHBondContact O-N 3.44Å
196	L	35.5	Very low	33.3	Very low	117 Å²	117	99.9 Å²	99.9	61%	0.613	56%	0.555	S	S	*	*	H	α-helix	trans	-57.9	-31.2	179	-94.1	153.4	0	0	0	114.5	T192 L193	T192-L196 HydrophobicContact CG2-CD1 4.18Å; T192-L196 PolarHBondContact O-N 3.05Å; T192-L196 VanDerWaalsContact O-N 3.08Å; L193-L196 PolarHBondContact O-N 3.39Å
197	L	36	Very low	32.7	Very low	83 Å²	83	105 Å²	105	44%	0.435	58%	0.581	S	S	.	*	H	α-helix	trans	-85.6	-14.2	176.2	-68.7	170.7	0	0	0	113.4	L165 L193 N195	L165-L197 HydrophobicContact CD1-CD2 4.25Å; L193-L197 HydrophobicContact CD2-CD1 4.04Å; L193-L197 HydrophobicContact CG-CD1 4.18Å; L193-L197 WeakPolarHBondContact O-CB 3.3Å; L193-L197 VanDerWaalsContact O-CG 3.32Å; L193-L197 WeakPolarHBondContact O-CG 3.49Å; L193-L197 PolarHBondContact O-N 3.36Å; N195-L197 VanDerWaalsContact C-N 3.26Å; N195-L197 PolarHBondContact O-N 2.81Å
198	S	33.1	Very low	32.2	Very low	76 Å²	76	108 Å²	108	53%	0.531	60%	0.597	S	S	.	*	H	α-helix	trans	-92.6	-11.3	178	69.6	0	0	0	0	114.3	T194 N195 T200	T194-S198 VanDerWaalsContact O-CB 3.24Å; T194-S198 WeakPolarHBondContact O-CB 3.4Å; T194-S198 PolarHBondContact O-N 2.86Å; T194-S198 VanDerWaalsContact O-N 3.09Å; T194-S198 PolarHBondContact O-OG 2.86Å; T194-S198 VanDerWaalsContact O-OG 3.13Å; N195-S198 PolarHBondContact O-N 3.01Å; N195-S198 PolarHBondContact O-OG 2.95Å; S198-T200 PolarHBondContact O-N 2.89Å
199	E	29.3	Very low	31.8	Very low	157 Å²	157	108.9 Å²	108.9	73%	0.734	61%	0.605	S	S	*	*			trans	-76.5	40.1	-179.9	-72.3	-174.6	165.9	0	0	113.9	N195 S201	N195-E199 PolarHBondContact O-N 3.44Å; E199-S201 PolarHBondContact O-N 3.14Å
200	T	28.3	Very low	31.3	Very low	110 Å²	110	114.4 Å²	114.4	68%	0.675	63%	0.629	S	S	*	*	S	Bend	trans	-92.4	78.3	166.3	56.4	0	0	0	0	111.2	S198	S198-T200 PolarHBondContact O-N 2.89Å
201	S	24.6	Very low	30.7	Very low	115 Å²	115	120.9 Å²	120.9	80%	0.804	66%	0.658	S	S	*	*			trans	53.7	76.6	157.2	59.7	0	0	0	0	118.3	E199	E199-S201 PolarHBondContact O-N 3.14Å
202	T	27	Very low	29.9	Very low	112 Å²	112	118.7 Å²	118.7	69%	0.687	66%	0.661	S	S	*	*			trans	-124.3	90.6	158.9	42	0	0	0	0	111.5	Q204	T202-Q204 VanDerWaalsContact C-N 3.34Å; T202-Q204 PolarHBondContact O-N 3.2Å
203	S	24.1	Very low	29	Very low	120 Å²	120	121.5 Å²	121.5	84%	0.839	68%	0.677	S	S	*	*			trans	-78.6	74.4	178	58.5	0	0	0	0	112.3
204	Q	24.7	Very low	28.7	Very low	188 Å²	188	124.3 Å²	124.3	88%	0.879	70%	0.7	S	S	*	*			trans	-174.5	84.1	159.2	-106.5	163.4	32.5	0	0	111.2	T202	T202-Q204 VanDerWaalsContact C-N 3.34Å; T202-Q204 PolarHBondContact O-N 3.2Å
205	F	26.1	Very low	28.1	Very low	188 Å²	188	127.9 Å²	127.9	83%	0.825	72%	0.717	S	S	*	*			trans	-107.8	102.6	159.5	-89.6	-82.1	0	0	0	109
206	S	25.8	Very low	27.5	Very low	108 Å²	108	130.6 Å²	130.6	76%	0.755	73%	0.732	S	S	*	*			trans	-72.8	139	162.5	51.4	0	0	0	0	109.5
207	N	24.8	Very low	27.1	Very low	143 Å²	143	131.5 Å²	131.5	77%	0.765	74%	0.737	S	S	*	*			trans	-52.1	147.3	167.3	-52.7	-54.5	0	0	0	109.3
208	D	26.2	Very low	26.6	Very low	149 Å²	149	134.6 Å²	134.6	80%	0.797	75%	0.753	S	S	*	*				-157.8	160.7	57.5	-104.5	-48.1	0	0	0	115
209	S	27.2	Very low	26.4	Very low	101 Å²	101	137.6 Å²	137.6	71%	0.706	76%	0.763	S	S	*	*			trans	69.9	139.3	161.8	83.4	0	0	0	0	117.7
210	H	29.3	Very low	26.2	Very low	165 Å²	165	141.2 Å²	141.2	76%	0.764	77%	0.772	S	S	*	*			cis	-139.8	115.2	-1.3	-115.3	-64	0	0	0	112.6	S212	H210-S212 PolarHBondContact O-N 2.67Å
211	K	26.4	Very low	26	Very low	194 Å²	194	143.8 Å²	143.8	84%	0.843	78%	0.781	S	S	*	*			trans	10	97.1	148.4	-64.7	172.8	177	172.9	0	118.4
212	S	26	Very low	26	Very low	97 Å²	97	145.5 Å²	145.5	68%	0.678	78%	0.781	S	S	*	*	S	Bend	trans	-162.5	167.2	134	55.5	0	0	0	0	110.3	H210 S214	H210-S212 PolarHBondContact O-N 2.67Å; S212-S214 PolarHBondContact O-N 2.59Å
213	V	25.6	Very low	25.8	Very low	142 Å²	142	145.2 Å²	145.2	86%	0.861	78%	0.783	S	S	*	*	S	Bend	trans	68.6	-27.4	179	-169.7	0	0	0	0	116.7	N215	V213-N215 PolarHBondContact O-N 3.13Å
214	S	25.5	Very low	26	Very low	95 Å²	95	143.8 Å²	143.8	66%	0.664	78%	0.779	S	S	*	*	T	Hydrogen-bonded Turn	trans	-74.2	32.2	-172.7	63.7	0	0	0	0	117.3	S212	S212-S214 PolarHBondContact O-N 2.59Å
215	N	26.9	Very low	26.1	Very low	135 Å²	135	141.9 Å²	141.9	72%	0.722	78%	0.775	S	S	*	*	T	Hydrogen-bonded Turn	trans	-118.9	-5.6	-172.7	-97	20	0	0	0	116.5	V213	V213-N215 PolarHBondContact O-N 3.13Å
216	N	26.1	Very low	26.1	Very low	148 Å²	148	139 Å²	139	79%	0.791	77%	0.767	S	S	*	*	S	Bend	trans	-110.5	3.3	-168.7	-78.4	-6.3	0	0	0	116.5
217	L	26.5	Very low	26.1	Very low	136 Å²	136	141.2 Å²	141.2	71%	0.712	77%	0.765	S	S	*	*	S	Bend	trans	-113.5	-14.1	-176.7	-79.1	165.7	0	0	0	115.6	F135 N219	F135-L217 HydrophobicContact CE1-CD2 4.23Å; F135-L217 HydrophobicContact CZ-CD2 4.45Å; L217-N219 PolarHBondContact O-N 3.45Å
218	N	26.2	Very low	26.2	Very low	147 Å²	147	140.8 Å²	140.8	79%	0.786	76%	0.763	S	S	*	*	T	Hydrogen-bonded Turn	trans	-94.1	17.7	-174.4	-70.4	-8	0	0	0	114.9
219	N	27.3	Very low	26.3	Very low	139 Å²	139	143.2 Å²	143.2	74%	0.743	77%	0.77	S	S	*	*	T	Hydrogen-bonded Turn	trans	-126	17.3	-171.2	-84.4	-23.9	0	0	0	115.2	L217	L217-N219 PolarHBondContact O-N 3.45Å
220	Y	26.1	Very low	26.2	Very low	233 Å²	233	144.4 Å²	144.4	91%	0.914	77%	0.772	S	S	*	*	S	Bend	trans	-133.8	38.2	176.8	-91.6	-77.1	0	0	0	113.1
221	L	24	Very low	26	Very low	164 Å²	164	145.4 Å²	145.4	86%	0.859	78%	0.775	S	S	*	*	S	Bend	trans	-130.4	49.6	-177.5	-136.3	172.3	0	0	0	112.1
222	D	23.8	Very low	26	Very low	152 Å²	152	146.9 Å²	146.9	81%	0.813	78%	0.775	S	S	*	*			trans	-157.9	158.6	165.1	-142.3	-41	0	0	0	113.8
223	S	23.6	Very low	26	Very low	105 Å²	105	149.6 Å²	149.6	73%	0.734	78%	0.777	S	S	*	*			trans	68.8	66.8	149.1	-67.1	0	0	0	0	121.5
224	A	27.4	Very low	26	Very low	91 Å²	91	148 Å²	148	75%	0.752	77%	0.771	S	S	*	*			trans	-165.1	119.5	139	0	0	0	0	0	109.9
225	N	26.8	Very low	26	Very low	147 Å²	147	153.7 Å²	153.7	79%	0.786	78%	0.78	S	S	*	*				62.1	128.4	73.6	-70.2	-22.8	0	0	0	114.1
226	I	26.5	Very low	25.9	Very low	128 Å²	128	153.9 Å²	153.9	66%	0.656	78%	0.78	S	S	*	*			cis	-159.1	143.5	0.4	-126.6	162	0	0	0	111.6
227	Q	26.6	Very low	25.8	Very low	154 Å²	154	156.1 Å²	156.1	72%	0.72	78%	0.779	S	S	*	*			trans	46.7	142.4	153.6	-66.2	175.7	-35	0	0	124.5
228	N	26.2	Very low	25.8	Very low	134 Å²	134	155.6 Å²	155.6	72%	0.717	78%	0.777	S	S	*	*			trans	67.1	103.7	143.9	-62.1	-18.2	0	0	0	120.8
229	Q	28.5	Very low	25.8	Very low	201 Å²	201	155.9 Å²	155.9	94%	0.939	77%	0.771	S	S	*	*				-157.2	132.2	93	-103.7	177.9	47.5	0	0	112.2
230	T	25.4	Very low	25.7	Very low	125 Å²	125	155.8 Å²	155.8	77%	0.767	77%	0.769	S	S	*	*			trans	-110.8	131.3	-179.7	36.9	0	0	0	0	111.7
231	K	25.9	Very low	25.8	Very low	186 Å²	186	152.3 Å²	152.3	81%	0.809	76%	0.756	S	S	*	*			trans	162.9	130.4	133	-90.6	155.1	-174.3	171.4	0	113.1
232	R	25.5	Very low	25.9	Very low	225 Å²	225	149.1 Å²	149.1	85%	0.849	75%	0.747	S	S	*	*			trans	67.8	143.3	166.8	-51.3	164.8	177.1	156.3	-4.1	114.5
233	H	26.3	Very low	26.1	Very low	155 Å²	155	148.7 Å²	148.7	72%	0.718	75%	0.745	S	S	*	*			cis	-122	144	-0.7	-78.4	-98	0	0	0	111.3
234	S	24.6	Very low	26.3	Very low	107 Å²	107	151.2 Å²	151.2	75%	0.748	75%	0.745	S	S	*	*			trans	-107.8	121.5	168	54	0	0	0	0	110
235	Y	25.5	Very low	26.2	Very low	216 Å²	216	154.6 Å²	154.6	85%	0.847	75%	0.745	S	S	*	*			trans	-122.4	89.1	164.5	-83.2	-71.9	0	0	0	109.7
236	L	24.5	Very low	26.4	Very low	139 Å²	139	155.4 Å²	155.4	73%	0.728	74%	0.744	S	S	*	*			trans	-69.6	148.2	158.4	-79.4	161.7	0	0	0	109
237	Y	24.4	Very low	26.4	Very low	194 Å²	194	155.4 Å²	155.4	76%	0.761	75%	0.75	S	S	*	*			trans	-133.8	49.3	155.9	-132.5	-75.4	0	0	0	112.3	K239	Y237-K239 HydrophobicContact CD1-CB 4.4Å; Y237-K239 HydrophobicContact CE1-CB 4.45Å; Y237-K239 HydrophobicContact CE1-CD 4.45Å; Y237-K239 HydrophobicContact CE1-CG 4.42Å; Y237-K239 PolarHBondContact O-N 3.5Å; Y237-K239 VanDerWaalsContact O-N 3.1Å
238	N	26.6	Very low	26.4	Very low	125 Å²	125	158.7 Å²	158.7	67%	0.668	76%	0.756	S	S	*	*			trans	-64.6	104.7	157.6	-86.4	-8.6	0	0	0	108.1	I240	N238-I240 PolarHBondContact O-N 3.01Å
239	K	26	Very low	26.5	Very low	154 Å²	154	159.8 Å²	159.8	67%	0.67	76%	0.762	S	S	*	*			trans	-83.5	59	176.5	-159.3	175.6	-176.7	-178.7	0	111.7	Y237 Y241	Y237-K239 HydrophobicContact CD1-CB 4.4Å; Y237-K239 HydrophobicContact CE1-CB 4.45Å; Y237-K239 HydrophobicContact CE1-CD 4.45Å; Y237-K239 HydrophobicContact CE1-CG 4.42Å; Y237-K239 PolarHBondContact O-N 3.5Å; Y237-K239 VanDerWaalsContact O-N 3.1Å; K239-Y241 HydrophobicContact CD-CD2 4.45Å; K239-Y241 HydrophobicContact CG-CD2 3.84Å; K239-Y241 HydrophobicContact CG-CE2 4.24Å; K239-Y241 PolarHBondContact O-N 3.45Å
240	I	26	Very low	26.4	Very low	136 Å²	136	153.5 Å²	153.5	70%	0.697	75%	0.751	S	S	*	*			trans	-79.3	106.4	160.1	-61.1	176.7	0	0	0	106.1	N238	N238-I240 PolarHBondContact O-N 3.01Å
241	Y	27.4	Very low	26.5	Very low	161 Å²	161	153 Å²	153	63%	0.631	75%	0.753	S	S	*	*			trans	-90.3	105.1	169.4	-109.7	-100.3	0	0	0	108.6	K239 D243	K239-Y241 HydrophobicContact CD-CD2 4.45Å; K239-Y241 HydrophobicContact CG-CD2 3.84Å; K239-Y241 HydrophobicContact CG-CE2 4.24Å; K239-Y241 PolarHBondContact O-N 3.45Å; Y241-D243 VanDerWaalsContact CD1-OD2 3.32Å; Y241-D243 WeakPolarHBondContact CD1-OD2 3.34Å
242	S	25.9	Very low	26.6	Very low	97 Å²	97	150.9 Å²	150.9	68%	0.678	75%	0.75	S	S	*	*			trans	-115.9	75.6	169.2	-64.6	0	0	0	0	108.1	Q244	S242-Q244 PolarHBondContact O-N 3.48Å
243	D	28.7	Very low	26.7	Very low	143 Å²	143	147.1 Å²	147.1	77%	0.765	75%	0.745	S	S	*	*			trans	-73.7	107.4	170.3	-71.6	-29.9	0	0	0	108.4	Y241	Y241-D243 VanDerWaalsContact CD1-OD2 3.32Å; Y241-D243 WeakPolarHBondContact CD1-OD2 3.34Å
244	Q	27.8	Very low	27	Very low	157 Å²	157	145.7 Å²	145.7	73%	0.734	75%	0.749	S	S	*	*			trans	-122.4	122.1	176.9	-150.2	-171.5	-36.4	0	0	108.9	S242	S242-Q244 PolarHBondContact O-N 3.48Å
245	E	26	Very low	27.1	Very low	162 Å²	162	143.7 Å²	143.7	76%	0.757	75%	0.745	S	S	*	*			trans	68.2	137.2	173.5	-57.2	168.8	-159.8	0	0	114.3
246	Q	29.1	Very low	27.4	Very low	165 Å²	165	140.9 Å²	140.9	77%	0.771	74%	0.743	S	S	*	*			cis	-149.9	148.3	46.5	-79.7	-179.9	4.2	0	0	115.4
247	T	27.7	Very low	27.4	Very low	128 Å²	128	140.2 Å²	140.2	79%	0.785	75%	0.746	S	S	*	*			trans	65.5	119.3	145.5	57.7	0	0	0	0	121.8
248	R	26.8	Very low	27.8	Very low	223 Å²	223	136.9 Å²	136.9	84%	0.842	75%	0.747	S	S	*	*				107.7	106.1	126.8	-140.6	171.4	-160.6	175.8	4.6	118
249	N	27.3	Very low	27.8	Very low	156 Å²	156	136.5 Å²	136.5	83%	0.834	75%	0.75	S	S	*	*			trans	36.6	118.7	139.5	-45.7	5.8	0	0	0	117.7
250	G	27.1	Very low	27.8	Very low	70 Å²	70	135.1 Å²	135.1	72%	0.722	75%	0.75	S	S	*	*			cis	133.6	167.7	8.1	0	0	0	0	0	110.7
251	S	26.6	Very low	28	Very low	114 Å²	114	136.6 Å²	136.6	80%	0.797	75%	0.753	S	S	*	*			trans	69.6	136.6	174.7	179	0	0	0	0	116
252	L	29.2	Very low	28	Very low	141 Å²	141	132.7 Å²	132.7	74%	0.738	75%	0.75	S	S	*	*			cis	-156	138.9	-13.5	-140.2	76.4	0	0	0	110
253	I	28	Very low	28.1	Very low	147 Å²	147	137 Å²	137	75%	0.754	76%	0.756	S	S	*	*			trans	55	141.2	139.4	-75.1	173.3	0	0	0	122
254	P	31.7	Very low	28.1	Very low	124 Å²	124	136 Å²	136	81%	0.805	75%	0.75	S	S	*	*			trans	-105.3	-173.7	-176.2	43	-37.5	0	0	0	114.3
255	G	27.1	Very low	28.2	Very low	65 Å²	65	136.7 Å²	136.7	67%	0.67	75%	0.752	S	S	*	*			trans	-165.5	144.2	167	0	0	0	0	0	117.7
256	I	30.3	Very low	28.2	Very low	157 Å²	157	132.1 Å²	132.1	81%	0.805	75%	0.749	S	S	*	*			trans	65.6	84.5	140.9	-54.4	168.5	0	0	0	115.8
257	T	26.3	Very low	28.4	Very low	126 Å²	126	130.4 Å²	130.4	77%	0.773	75%	0.752	S	S	*	*				73.1	135.8	80.8	61.8	0	0	0	0	116.6
258	P	31.8	Very low	28.6	Very low	123 Å²	123	129.8 Å²	129.8	80%	0.799	75%	0.75	S	S	*	*			trans	-97.4	157	-173.2	38.7	-36.1	0	0	0	114.7
259	T	27	Very low	28.8	Very low	118 Å²	118	125.5 Å²	125.5	72%	0.724	74%	0.744	S	S	*	*			trans	-149.7	117.6	163.8	33.9	0	0	0	0	113.9
260	N	25.9	Very low	29	Very low	125 Å²	125	125.8 Å²	125.8	67%	0.668	74%	0.74	S	S	*	*				60.7	159.3	128.6	-57.4	-18.9	0	0	0	123.3
261	H	29.5	Very low	29.1	Very low	166 Å²	166	126.5 Å²	126.5	77%	0.769	73%	0.731	S	S	*	*			trans	81	141.2	159.5	-48	-66.4	0	0	0	117.9
262	S	28.2	Very low	29.1	Very low	79 Å²	79	130 Å²	130	55%	0.552	73%	0.732	S	S	*	*			cis	-174	161.3	-22.3	61.9	0	0	0	0	110.3
263	K	27.9	Very low	29.1	Very low	187 Å²	187	127.9 Å²	127.9	81%	0.813	73%	0.728	S	S	*	*			trans	68.4	160	155.2	-67.1	166	-177.7	176	0	114.4
264	I	29.3	Very low	29	Very low	123 Å²	123	129.8 Å²	129.8	63%	0.631	73%	0.731	S	S	*	*			cis	-156.4	152.4	-2.5	-130.7	164.7	0	0	0	110.7
265	H	28.8	Very low	28.7	Very low	171 Å²	171	131.7 Å²	131.7	79%	0.792	73%	0.733	S	S	*	*			trans	44.7	144.8	164.2	-54.3	-55.4	0	0	0	119.9
266	G	26.5	Very low	28.6	Very low	66 Å²	66	139.8 Å²	139.8	68%	0.68	74%	0.744	S	S	*	*			cis	98.5	142.9	15.6	0	0	0	0	0	111.7
267	P	32.4	Very low	28.4	Very low	129 Å²	129	135.8 Å²	135.8	84%	0.838	74%	0.741	S	S	*	*			cis	-125.9	-176.7	7.6	42.8	-27.4	0	0	0	114.9
268	P	32.8	Very low	28.3	Very low	115 Å²	115	136 Å²	136	75%	0.747	74%	0.737	S	S	*	*			trans	-110.7	171.2	178.3	41.1	-33	0	0	0	114.9
269	N	30.8	Very low	28	Very low	134 Å²	134	136.3 Å²	136.3	72%	0.717	73%	0.733	S	S	*	*			trans	-134	122.9	159.1	-105.7	36	0	0	0	108.2
270	E	31.4	Very low	28	Very low	161 Å²	161	139.3 Å²	139.3	75%	0.752	74%	0.735	S	S	*	*				80.3	139.8	90.8	-72.7	-164.2	136.4	0	0	114.7
271	T	28.8	Very low	27.9	Very low	86 Å²	86	138.5 Å²	138.5	53%	0.528	74%	0.74	S	S	.	*			cis	-160.7	135	-23.3	-62.6	0	0	0	0	104.8
272	F	27.9	Very low	27.9	Very low	188 Å²	188	135.9 Å²	135.9	83%	0.825	74%	0.74	S	S	*	*				-178.8	122.1	89.4	-90.7	-88.6	0	0	0	106.1
273	C	28.2	Very low	27.7	Very low	96 Å²	96	137 Å²	137	65%	0.649	75%	0.748	S	S	*	*				60.4	105.5	74.7	-68.4	0	0	0	0	113.4
274	K	26.2	Very low	27.7	Very low	187 Å²	187	134.6 Å²	134.6	81%	0.813	75%	0.753	S	S	*	*				65.7	127.4	77	-71.5	-179.6	176.4	178.9	0	111.6
275	L	25.9	Very low	27.4	Very low	164 Å²	164	135.7 Å²	135.7	86%	0.859	76%	0.76	S	S	*	*				-172.8	168.3	70.1	-119.4	131.5	0	0	0	114.2
276	W	24.1	Very low	27.4	Very low	235 Å²	235	135 Å²	135	89%	0.89	76%	0.761	S	S	*	*			trans	-67.2	144	165.8	-143.9	-81.7	0	0	0	110.9
277	G	27.4	Very low	27.5	Very low	72 Å²	72	139.7 Å²	139.7	74%	0.742	77%	0.765	S	S	*	*			trans	-157	130.9	179.7	0	0	0	0	0	113.7
278	N	24.2	Very low	27.1	Very low	131 Å²	131	139.2 Å²	139.2	70%	0.701	76%	0.76	S	S	*	*			trans	-101.9	163.7	-174	-64	-35.6	0	0	0	112.9
279	N	25.7	Very low	26.9	Very low	130 Å²	130	141.5 Å²	141.5	70%	0.695	77%	0.765	S	S	*	*			trans	110.4	115.5	146.9	-65.1	-63.9	0	0	0	120.4
280	K	25.5	Very low	26.7	Very low	180 Å²	180	141.5 Å²	141.5	78%	0.783	77%	0.766	S	S	*	*				78.5	115.8	121.7	-67.2	179.6	-177.9	-175.9	0	122.2
281	S	24.7	Very low	26.5	Very low	109 Å²	109	139.9 Å²	139.9	76%	0.762	77%	0.766	S	S	*	*				69.4	105.1	124.5	69.5	0	0	0	0	122.3
282	S	29.8	Very low	26.4	Very low	111 Å²	111	145.2 Å²	145.2	78%	0.776	78%	0.778	S	S	*	*				-161.4	112	117.4	47	0	0	0	0	108.3
283	S	23.6	Very low	26.2	Very low	102 Å²	102	140.7 Å²	140.7	71%	0.713	77%	0.77	S	S	*	*				67.5	97.3	62.3	77.5	0	0	0	0	114.3
284	C	28.2	Very low	26.3	Very low	137 Å²	137	144.5 Å²	144.5	93%	0.926	78%	0.776	S	S	*	*			trans	-159.4	89.1	156.3	-110.2	0	0	0	0	109
285	D	23.6	Very low	26.3	Very low	146 Å²	146	142.3 Å²	142.3	78%	0.781	77%	0.773	S	S	*	*			trans	-74.2	162.5	172.6	-54.6	-85.3	0	0	0	112.1
286	I	28.7	Very low	26.2	Very low	157 Å²	157	140.1 Å²	140.1	81%	0.805	77%	0.77	S	S	*	*			trans	-161.7	116.1	135.6	-98.5	146.8	0	0	0	109.8
287	Q	28.2	Very low	26.3	Very low	163 Å²	163	138.8 Å²	138.8	76%	0.762	77%	0.77	S	S	*	*			trans	18.2	120.6	146	-63.6	158.5	8.3	0	0	117.5
288	V	24.1	Very low	26.2	Very low	120 Å²	120	141 Å²	141	73%	0.727	77%	0.77	S	S	*	*			cis	59	114.6	46.8	-171.3	0	0	0	0	114.1
289	N	28.7	Very low	26.4	Very low	162 Å²	162	141.9 Å²	141.9	87%	0.866	77%	0.774	S	S	*	*			trans	-157.1	129.3	146.6	-105.6	-36.6	0	0	0	110
290	D	25.7	Very low	26.3	Very low	135 Å²	135	145 Å²	145	72%	0.722	78%	0.776	S	S	*	*			trans	-76.9	179	173.6	-60.5	-80.2	0	0	0	112.2
291	V	27.4	Very low	26.6	Very low	127 Å²	127	141.3 Å²	141.3	77%	0.77	77%	0.765	S	S	*	*				175.5	114.2	113.4	153	0	0	0	0	112.7
292	Y	26.8	Very low	26.7	Very low	197 Å²	197	145.2 Å²	145.2	77%	0.773	76%	0.763	S	S	*	*			trans	47.2	117.6	145.8	-70	-97	0	0	0	124
293	S	24.3	Very low	26.7	Very low	94 Å²	94	146.5 Å²	146.5	66%	0.657	76%	0.761	S	S	*	*			trans	-31	155.1	142.9	56.3	0	0	0	0	119.3
294	K	29.5	Very low	26.9	Very low	176 Å²	176	151 Å²	151	77%	0.765	77%	0.771	S	S	*	*				-176.3	127.2	118.4	-100	157.7	-174.4	170.5	0	116.4
295	N	25.8	Very low	27	Very low	140 Å²	140	147.8 Å²	147.8	75%	0.749	76%	0.761	S	S	*	*			trans	46.3	112.8	134.2	-57	0.7	0	0	0	122.5
296	C	23.7	Very low	27.2	Very low	119 Å²	119	149.5 Å²	149.5	80%	0.804	76%	0.764	S	S	*	*				27.7	123.8	125.3	-47.3	0	0	0	0	120.8
297	K	27.1	Very low	27.3	Very low	207 Å²	207	149.1 Å²	149.1	90%	0.9	76%	0.763	S	S	*	*				-170.8	157.2	109.5	-105.3	166.1	-175.9	177.2	0	115.6
298	T	24.8	Very low	27.1	Very low	118 Å²	118	148 Å²	148	72%	0.724	76%	0.762	S	S	*	*			trans	-71	141.2	-179.4	48.5	0	0	0	0	115.2
299	N	28.5	Very low	27.4	Very low	149 Å²	149	153.8 Å²	153.8	80%	0.797	77%	0.773	S	S	*	*				170.1	167.9	129.5	-88.7	-24.7	0	0	0	110.2
300	R	24.7	Very low	27.2	Very low	197 Å²	197	153 Å²	153	74%	0.743	77%	0.767	S	S	*	*			cis	-179.3	152.2	-45.1	-155.5	-178.9	-171.1	168	4.1	106
301	D	30	Very low	27.3	Very low	102 Å²	102	152.3 Å²	152.3	55%	0.545	77%	0.77	S	S	.	*			trans	68.7	149	164.5	-58.7	-51.7	0	0	0	116.1
302	R	26.8	Very low	27.1	Very low	190 Å²	190	151 Å²	151	72%	0.717	77%	0.767	S	S	*	*			cis	-163.7	178.2	-8.5	-125.4	171.2	-128.8	-169.3	9.1	114.1
303	N	31	Very low	27.1	Very low	139 Å²	139	147 Å²	147	74%	0.743	77%	0.768	S	S	*	*			trans	77.2	118.6	168	-51.5	-20.7	0	0	0	115.3
304	Q	27.7	Very low	27	Very low	196 Å²	196	150.7 Å²	150.7	92%	0.916	78%	0.78	S	S	*	*			cis	100.4	141.8	23.9	-68.3	-163.3	-33.2	0	0	116.2
305	G	30.6	Very low	26.8	Very low	69 Å²	69	150 Å²	150	71%	0.711	78%	0.783	S	S	*	*			trans	119.6	84.6	-171.5	0	0	0	0	0	110.4
306	E	26.4	Very low	26.7	Very low	183 Å²	183	148 Å²	148	86%	0.855	78%	0.777	S	S	*	*				64.7	132	86.7	-73.6	-166.2	166.7	0	0	113.7
307	L	31.5	Very low	26.8	Very low	149 Å²	149	147.9 Å²	147.9	78%	0.78	78%	0.778	S	S	*	*			cis	-144.5	173.4	24.2	-115.3	152.4	0	0	0	113.1
308	N	24.4	Very low	26.7	Very low	138 Å²	138	142.8 Å²	142.8	74%	0.738	76%	0.764	S	S	*	*			trans	-86	151	-169.7	-52.2	-71	0	0	0	115.2
309	Y	29.9	Very low	26.8	Very low	243 Å²	243	143.2 Å²	143.2	95%	0.953	77%	0.766	S	S	*	*			trans	-160.2	143.9	135.1	-97.4	-67.8	0	0	0	110.8
310	L	25.8	Very low	26.6	Very low	144 Å²	144	142.1 Å²	142.1	75%	0.754	76%	0.755	S	S	*	*			trans	-147.2	137.9	-175.1	-130.6	171.6	0	0	0	110.1
311	P	26.8	Very low	26.6	Very low	121 Å²	121	138.3 Å²	138.3	79%	0.786	76%	0.756	S	S	*	*				-137.3	138.4	121.2	33.9	-21.2	0	0	0	112
312	S	23.3	Very low	26.3	Very low	100 Å²	100	139.7 Å²	139.7	70%	0.699	76%	0.757	S	S	*	*			cis	90.8	65.1	49.7	-61.6	0	0	0	0	115
313	S	26.7	Very low	26.3	Very low	114 Å²	114	139.5 Å²	139.5	80%	0.797	76%	0.762	S	S	*	*			trans	-172.6	127	145.8	42.7	0	0	0	0	108
314	L	23	Very low	26.2	Very low	171 Å²	171	140.5 Å²	140.5	90%	0.895	77%	0.767	S	S	*	*			cis	68.1	77.9	40.3	-81	161.7	0	0	0	115.4
315	I	24.7	Very low	26.1	Very low	162 Å²	162	136.5 Å²	136.5	83%	0.831	76%	0.761	S	S	*	*			trans	-141	124.9	145.7	-54.5	-179.2	0	0	0	107.7
316	P	23.8	Very low	25.9	Very low	96 Å²	96	139.2 Å²	139.2	62%	0.623	76%	0.758	S	S	*	*			trans	-79.2	141.5	171.8	32.4	-33.2	0	0	0	111.3	T318	P316-T318 VanDerWaalsContact C-N 3.33Å; P316-T318 PolarHBondContact O-N 3.39Å
317	S	26.2	Very low	26.1	Very low	118 Å²	118	136.1 Å²	136.1	83%	0.825	75%	0.745	S	S	*	*			trans	-79.6	72.5	-178.5	56.1	0	0	0	0	112.8	V319	S317-V319 PolarHBondContact O-N 2.8Å
318	T	23.8	Very low	25.9	Very low	99 Å²	99	135.7 Å²	135.7	61%	0.607	74%	0.744	S	S	*	*			trans	-77.5	96.5	171.7	50.7	0	0	0	0	110.8	P316	P316-T318 VanDerWaalsContact C-N 3.33Å; P316-T318 PolarHBondContact O-N 3.39Å
319	V	27	Very low	26	Very low	128 Å²	128	133.9 Å²	133.9	78%	0.776	74%	0.742	S	S	*	*			trans	-115	98.6	175.5	-176.6	0	0	0	0	110.2	S317	S317-V319 PolarHBondContact O-N 2.8Å
320	F	24.7	Very low	26	Very low	125 Å²	125	132.7 Å²	132.7	55%	0.548	74%	0.736	S	S	.	*			trans	0.6	115.1	163.7	-63.4	-84.5	0	0	0	119.4	Y190	Y190-F320 HydrophobicContact CD1-CD1 4.41Å; Y190-F320 HydrophobicContact CD1-CE1 4.24Å; Y190-F320 AromaticContact CD2-CE1 3.62Å; Y190-F320 HydrophobicContact CD2-CE1 3.62Å; Y190-F320 HydrophobicContact CD2-CZ 4.39Å; Y190-F320 HydrophobicContact CE1-CD1 4.27Å; Y190-F320 HydrophobicContact CE1-CE1 4.26Å; Y190-F320 HydrophobicContact CE2-CD1 4.37Å; Y190-F320 AromaticContact CE2-CE1 3.64Å; Y190-F320 HydrophobicContact CE2-CE1 3.64Å; Y190-F320 HydrophobicContact CE2-CZ 4.33Å; Y190-F320 AromaticContact CG-CE1 3.94Å; Y190-F320 HydrophobicContact CG-CE1 3.94Å; Y190-F320 AromaticContact CZ-CE1 3.97Å
321	P	24.8	Very low	26.1	Very low	118 Å²	118	132.8 Å²	132.8	77%	0.766	73%	0.734	S	S	*	*			trans	-95	112.7	166.5	34.2	-28	0	0	0	111.8
322	F	24.3	Very low	26	Very low	130 Å²	130	135.2 Å²	135.2	57%	0.57	74%	0.737	S	S	*	*			trans	-149.6	155.4	161.4	-101.6	-81.2	0	0	0	109.9	T194	T194-F322 HydrophobicContact CG2-CE2 4.23Å; T194-F322 HydrophobicContact CG2-CZ 4.42Å
323	F	27	Very low	26.2	Very low	187 Å²	187	141.5 Å²	141.5	82%	0.82	75%	0.746	S	S	*	*	S	Bend	trans	72.2	27.4	-175.1	-61.7	-74	0	0	0	118.6
324	N	28.4	Very low	26.3	Very low	159 Å²	159	145 Å²	145	85%	0.85	75%	0.749	S	S	*	*			trans	-125.9	10.3	162.3	-98.5	-8.8	0	0	0	113.9	L326	N324-L326 PolarHBondContact O-N 3.12Å
325	S	25.6	Very low	26.4	Very low	113 Å²	113	143.9 Å²	143.9	79%	0.79	74%	0.744	S	S	*	*	T	Hydrogen-bonded Turn	trans	-90.8	18.7	-165.4	-164.9	0	0	0	0	116
326	L	26.5	Very low	26.4	Very low	125 Å²	125	141 Å²	141	65%	0.654	74%	0.738	S	S	*	*	T	Hydrogen-bonded Turn	trans	-131.6	15.4	-172.2	-144.6	92.7	0	0	0	116	N324	N324-L326 PolarHBondContact O-N 3.12Å
327	M	29.5	Very low	26.5	Very low	119 Å²	119	145.7 Å²	145.7	59%	0.586	75%	0.749	S	S	*	*			trans	-116.1	-7.2	179.5	-76.1	-68.9	167.5	0	0	115.4	S329	M327-S329 PolarHBondContact O-N 3.41Å
328	D	27.1	Very low	26.6	Very low	139 Å²	139	148.7 Å²	148.7	74%	0.743	75%	0.75	S	S	*	*	T	Hydrogen-bonded Turn	trans	-73.3	9.1	-179.1	-82.6	-39	0	0	0	115.3
329	S	27.2	Very low	26.7	Very low	101 Å²	101	151.9 Å²	151.9	71%	0.706	76%	0.762	S	S	*	*	T	Hydrogen-bonded Turn	trans	-86.7	-5.5	179.1	61.9	0	0	0	0	114.7	M327	M327-S329 PolarHBondContact O-N 3.41Å
330	R	29.2	Very low	26.7	Very low	217 Å²	217	153 Å²	153	82%	0.819	76%	0.764	S	S	*	*	S	Bend	trans	-112.5	-10.7	-178.9	-63.4	-167.1	-174.9	-155.1	3.5	115.7	M332	R330-M332 VanDerWaalsContact C-N 3.28Å; R330-M332 PolarHBondContact O-N 2.83Å
331	M	27.6	Very low	26.8	Very low	146 Å²	146	152 Å²	152	72%	0.719	77%	0.771	S	S	*	*			trans	-91	43	179.6	-151.9	179.2	73.8	0	0	113.8
332	M	26	Very low	27.1	Very low	173 Å²	173	153.7 Å²	153.7	85%	0.852	77%	0.774	S	S	*	*			trans	-126.6	49.5	-178.4	-88	-71.1	-161.8	0	0	112.3	R330	R330-M332 VanDerWaalsContact C-N 3.28Å; R330-M332 PolarHBondContact O-N 2.83Å
333	R	27.2	Very low	27.3	Very low	232 Å²	232	157 Å²	157	88%	0.875	79%	0.791	S	S	*	*	S	Bend	trans	-151.6	10.8	169.7	-150.1	170.7	-70.7	-146.7	-0.6	116.9
334	E	28.2	Very low	27.5	Very low	187 Å²	187	153.6 Å²	153.6	87%	0.874	78%	0.781	S	S	*	*	S	Bend	trans	-147.4	61.7	-176.3	-122.3	153.8	-132.9	0	0	112.7
335	N	25.5	Very low	27.7	Very low	148 Å²	148	153.1 Å²	153.1	79%	0.791	77%	0.771	S	S	*	*			trans	-150.9	64	171.8	-98.4	-47.8	0	0	0	110.9
336	S	24.3	Very low	27.9	Very low	100 Å²	100	154.8 Å²	154.8	70%	0.699	77%	0.771	S	S	*	*			trans	-153.5	108.5	174.3	59.6	0	0	0	0	109.1
337	K	27.2	Very low	27.9	Very low	196 Å²	196	154.5 Å²	154.5	85%	0.852	78%	0.778	S	S	*	*	S	Bend	trans	100	118.3	-147.3	-65.7	154.5	-170.4	173.8	0	108.6
338	E	27.4	Very low	27.6	Very low	180 Å²	180	154.1 Å²	154.1	84%	0.841	79%	0.787	S	S	*	*			cis	-134.8	115.1	8.1	-58.9	-178.8	144.5	0	0	111.2
339	L	26.3	Very low	27.7	Very low	167 Å²	167	154.7 Å²	154.7	87%	0.874	80%	0.796	S	S	*	*			trans	-111.7	76	166	-91.1	171.8	0	0	0	109	C341	L339-C341 VanDerWaalsContact C-N 3.32Å; L339-C341 PolarHBondContact O-N 3.44Å; L339-C341 VanDerWaalsContact O-N 3.07Å
340	N	26.6	Very low	27.6	Very low	151 Å²	151	157.7 Å²	157.7	81%	0.807	80%	0.799	S	S	*	*			trans	-85.9	71.9	-176.2	-159.7	3.7	0	0	0	111.2
341	C	27.7	Very low	27.4	Very low	104 Å²	104	153.3 Å²	153.3	70%	0.703	79%	0.791	S	S	*	*			trans	-103.9	92.6	178.2	-68.1	0	0	0	0	111.2	L339 H343	L339-C341 VanDerWaalsContact C-N 3.32Å; L339-C341 PolarHBondContact O-N 3.44Å; L339-C341 VanDerWaalsContact O-N 3.07Å; C341-H343 PolarHBondContact O-N 3.33Å
342	N	29.6	Very low	27.2	Very low	154 Å²	154	151.9 Å²	151.9	82%	0.824	79%	0.786	S	S	*	*			trans	6.3	92.4	163.3	-60.8	-17.7	0	0	0	117
343	H	29.5	Very low	27.3	Very low	200 Å²	200	152.6 Å²	152.6	93%	0.926	78%	0.784	S	S	*	*			trans	-78.9	131.4	157.6	-109.3	-61.2	0	0	0	109.9	C341	C341-H343 PolarHBondContact O-N 3.33Å
344	D	31.2	Very low	27.2	Very low	114 Å²	114	150 Å²	150	61%	0.61	78%	0.784	S	S	*	*			trans	-134.4	126.6	170.8	-168.7	14.3	0	0	0	109.6
345	K	33.2	Very low	27	Very low	150 Å²	150	147.1 Å²	147.1	65%	0.652	78%	0.783	S	S	*	*			trans	64.9	101.7	173.8	-66.6	129	-168.8	157.4	0	121.1
346	N	28.6	Very low	27.1	Very low	147 Å²	147	145.8 Å²	145.8	79%	0.786	78%	0.781	S	S	*	*				78.6	157.1	119	-60.8	-2	0	0	0	121.6
347	C	26.8	Very low	27.3	Very low	119 Å²	119	148.1 Å²	148.1	80%	0.804	79%	0.791	S	S	*	*			trans	65.2	94.9	179	-57.3	0	0	0	0	114
348	S	23.3	Very low	27.3	Very low	111 Å²	111	145.1 Å²	145.1	78%	0.776	78%	0.784	S	S	*	*			cis	60.3	104.4	45.4	91.7	0	0	0	0	115
349	V	29.2	Very low	27.4	Very low	152 Å²	152	147.6 Å²	147.6	92%	0.921	79%	0.786	S	S	*	*			trans	-163.1	159.7	130.8	141.3	0	0	0	0	107.8
350	E	24.8	Very low	27.5	Very low	163 Å²	163	147.5 Å²	147.5	76%	0.762	78%	0.784	S	S	*	*			trans	-107.4	170.2	-157.7	-126.9	-178.6	127.6	0	0	115
351	L	24.9	Very low	27.5	Very low	125 Å²	125	147.8 Å²	147.8	65%	0.654	79%	0.785	S	S	*	*			trans	71.9	124.8	147.3	-73.6	161.4	0	0	0	122.5
352	D	23.5	Very low	27.5	Very low	117 Å²	117	150.4 Å²	150.4	63%	0.626	79%	0.786	S	S	*	*			trans	53.2	111.8	134.6	-72	5.6	0	0	0	121.8
353	K	29.4	Very low	27.3	Very low	187 Å²	187	150.1 Å²	150.1	81%	0.813	79%	0.785	S	S	*	*				-173.8	162.2	97.3	-101.5	138	-152.2	134.8	0	116.3
354	M	24.3	Very low	27.3	Very low	178 Å²	178	145.2 Å²	145.2	88%	0.877	78%	0.779	S	S	*	*			trans	70	85.9	155.9	-70.3	159.3	68.9	0	0	118.9
355	C	23.9	Very low	27.2	Very low	126 Å²	126	143.4 Å²	143.4	85%	0.851	78%	0.78	S	S	*	*			trans	-81.6	135.4	142.4	-67.3	0	0	0	0	110
356	T	27.3	Very low	26.9	Very low	120 Å²	120	142.5 Å²	142.5	74%	0.736	79%	0.793	S	S	*	*			trans	-175.7	111	136.9	24.2	0	0	0	0	111.6
357	V	29.4	Very low	26.9	Very low	150 Å²	150	143.8 Å²	143.8	91%	0.909	79%	0.791	S	S	*	*			trans	-139.5	100	149.1	-179.8	0	0	0	0	107.4
358	D	27.1	Very low	26.9	Very low	132 Å²	132	147.4 Å²	147.4	71%	0.706	79%	0.788	S	S	*	*			trans	-70.8	141.2	170.2	-60.2	-79.4	0	0	0	111
359	R	28.4	Very low	27.1	Very low	233 Å²	233	149.2 Å²	149.2	88%	0.879	79%	0.789	S	S	*	*				176.7	146.6	118.5	-96.3	158.2	-177.2	-163.3	-0.9	114.5
360	I	29.2	Very low	27.1	Very low	164 Å²	164	147.1 Å²	147.1	84%	0.841	78%	0.781	S	S	*	*			trans	68.9	74.5	164.2	-54.3	158.5	0	0	0	115.1
361	L	26.3	Very low	27.1	Very low	158 Å²	158	145.7 Å²	145.7	83%	0.827	78%	0.778	S	S	*	*			trans	-83.6	119.4	142.5	174.4	87.6	0	0	0	108
362	H	27.9	Very low	27.3	Very low	158 Å²	158	147.4 Å²	147.4	73%	0.731	79%	0.787	S	S	*	*			trans	-173.4	156.2	135.8	-122.8	-97.7	0	0	0	115.7
363	N	25	Very low	27.5	Very low	148 Å²	148	149.4 Å²	149.4	79%	0.791	80%	0.798	S	S	*	*			trans	-70.7	140.7	-179.6	-58.8	-39.5	0	0	0	114.3
364	A	28.9	Very low	27.3	Very low	98 Å²	98	148.5 Å²	148.5	81%	0.81	80%	0.802	S	S	*	*			trans	-137.4	88	149.1	0	0	0	0	0	107.7
365	A	28.9	Very low	27.5	Very low	75 Å²	75	149.3 Å²	149.3	62%	0.62	80%	0.8	S	S	*	*				69.8	104.2	97.5	0	0	0	0	0	112.4
366	S	27.4	Very low	27.8	Very low	132 Å²	132	147.8 Å²	147.8	92%	0.923	79%	0.791	S	S	*	*				58.9	54.8	56.7	-41.1	0	0	0	0	112.8
367	K	28.2	Very low	27.9	Very low	173 Å²	173	148.8 Å²	148.8	75%	0.752	79%	0.791	S	S	*	*			trans	-156.1	70	178.5	-159	178.1	-177.4	177.9	0	116
368	W	27.6	Very low	27.8	Very low	196 Å²	196	146.4 Å²	146.4	74%	0.742	78%	0.776	S	S	*	*	S	Bend	trans	-143.1	-15.4	158	-91.4	119.6	0	0	0	116.3	S370 K405	W368-S370 PolarHBondContact O-N 3.4Å; W368-K405 PolarHBondContact O-NZ 3.17Å
369	D	26.8	Very low	28	Very low	149 Å²	149	147.5 Å²	147.5	80%	0.797	78%	0.777	S	S	*	*	T	Hydrogen-bonded Turn	trans	-95.3	79.1	175.2	-58.9	-51.7	0	0	0	112.2
370	S	29.4	Very low	28	Very low	108 Å²	108	143.9 Å²	143.9	76%	0.755	77%	0.774	S	S	*	*	T	Hydrogen-bonded Turn	trans	-175.1	19.1	163.1	28.1	0	0	0	0	114.3	W368	W368-S370 PolarHBondContact O-N 3.4Å
371	L	26.4	Very low	28	Very low	133 Å²	133	140.6 Å²	140.6	70%	0.696	77%	0.766	S	S	*	*	S	Bend	trans	-129.9	140.6	167.9	-72.1	176	0	0	0	110.3
372	L	27.4	Very low	28.3	Very low	161 Å²	161	139.3 Å²	139.3	84%	0.843	76%	0.76	S	S	*	*	S	Bend	trans	74.2	69.9	-173	-60.2	163.9	0	0	0	115.9
373	N	28	Very low	28.5	Very low	159 Å²	159	136.3 Å²	136.3	85%	0.85	76%	0.757	S	S	*	*			trans	-152.3	64.2	136.1	-128.7	-4.2	0	0	0	113.4
374	N	25.3	Very low	28.9	Very low	168 Å²	168	134 Å²	134	90%	0.898	75%	0.75	S	S	*	*			trans	-93.8	95.9	170.4	-90.7	1.1	0	0	0	110.7
375	K	29.6	Very low	28.9	Very low	195 Å²	195	136.8 Å²	136.8	85%	0.848	75%	0.749	S	S	*	*			trans	-168	137	160.1	-100.5	159.4	-177.4	178.3	0	106.3
376	S	28.6	Very low	29.1	Very low	94 Å²	94	137.8 Å²	137.8	66%	0.657	75%	0.75	S	S	*	*			cis	-170.9	179.5	0.9	40	0	0	0	0	110.7
377	I	29.5	Very low	29.1	Very low	141 Å²	141	140 Å²	140	72%	0.723	74%	0.743	S	S	*	*			trans	110.2	92	154.9	-63.1	163.1	0	0	0	116.2
378	T	27.7	Very low	29.3	Very low	100 Å²	100	138.6 Å²	138.6	61%	0.613	74%	0.744	S	S	*	*			trans	54.5	134.7	135.4	64.8	0	0	0	0	120.4
379	H	31.3	Very low	29.4	Very low	154 Å²	154	133.1 Å²	133.1	71%	0.713	74%	0.74	S	S	*	*				-169.5	151.4	62.1	-98.8	-79.3	0	0	0	111.5
380	L	29.2	Very low	29.8	Very low	158 Å²	158	134.1 Å²	134.1	83%	0.827	75%	0.746	S	S	*	*			trans	47.9	128.4	148.9	-53	165.6	0	0	0	118.1
381	S	28.9	Very low	29.7	Very low	95 Å²	95	137.9 Å²	137.9	66%	0.664	75%	0.748	S	S	*	*			cis	-161.2	-169	-5.1	60.8	0	0	0	0	107.1
382	D	32	Very low	29.8	Very low	131 Å²	131	137.1 Å²	137.1	70%	0.701	75%	0.751	S	S	*	*			cis	-157.8	174.4	14.5	-133.8	-49	0	0	0	114.1
383	S	32.1	Very low	29.7	Very low	95 Å²	95	136.4 Å²	136.4	66%	0.664	75%	0.747	S	S	*	*			trans	-7.1	162	155.1	-62	0	0	0	0	122.9
384	P	32.7	Very low	29.9	Very low	100 Å²	100	136 Å²	136	65%	0.649	75%	0.745	S	S	*	*			cis	-148.2	170	-47.2	42.2	-25.1	0	0	0	115.5
385	I	30.1	Very low	29.9	Very low	156 Å²	156	135.3 Å²	135.3	80%	0.8	74%	0.74	S	S	*	*			trans	68.7	144.1	139.5	-80.8	165.6	0	0	0	120
386	P	32	Very low	30	Very low	96 Å²	96	133.7 Å²	133.7	62%	0.623	74%	0.739	S	S	*	*			cis	-149.3	-174.1	-26	46.1	-27	0	0	0	117.3
387	F	29	Very low	29.9	Very low	178 Å²	178	136.9 Å²	136.9	78%	0.781	75%	0.749	S	S	*	*			trans	50.9	128.6	143.2	-75.9	-56.8	0	0	0	125.1
388	N	30.8	Very low	30	Very low	144 Å²	144	135.1 Å²	135.1	77%	0.77	75%	0.749	S	S	*	*			trans	68.1	154.4	137.3	-67.3	-13.3	0	0	0	121
389	A	30	Very low	30	Very low	81 Å²	81	133.7 Å²	133.7	67%	0.669	75%	0.754	S	S	*	*			cis	-173.9	115.8	-32.6	0	0	0	0	0	107.9
390	D	34.9	Very low	29.8	Very low	170 Å²	170	132.6 Å²	132.6	91%	0.909	75%	0.753	S	S	*	*			trans	-156.8	161.3	164.8	-120.6	-38.1	0	0	0	114.6
391	K	27.7	Very low	29.8	Very low	186 Å²	186	131.2 Å²	131.2	81%	0.809	75%	0.752	S	S	*	*			trans	-90.2	158.2	-178.2	-88.9	172.6	-177.4	172.4	0	110.7
392	P	28.3	Very low	30	Very low	117 Å²	117	132 Å²	132	76%	0.76	75%	0.749	S	S	*	*			cis	-145.4	-179.8	48.2	40.8	-20.2	0	0	0	118
393	I	26	Very low	30	Very low	146 Å²	146	134.3 Å²	134.3	75%	0.749	76%	0.755	S	S	*	*			trans	-73.9	137.4	175.6	-61.6	159.5	0	0	0	110.2	L395	I393-L395 HydrophobicContact CG2-CD1 4.39Å
394	N	31.8	Very low	30.1	Very low	151 Å²	151	140.7 Å²	140.7	81%	0.807	77%	0.765	S	S	*	*			trans	-147.3	139.6	157.7	-95.8	-44.5	0	0	0	110
395	L	25.8	Very low	30	Very low	154 Å²	154	140.6 Å²	140.6	81%	0.806	75%	0.754	S	S	*	*			trans	-85.7	126	178.4	-76.2	72.9	0	0	0	110.2	I393	I393-L395 HydrophobicContact CG2-CD1 4.39Å
396	I	32.4	Very low	30.3	Very low	161 Å²	161	138.6 Å²	138.6	83%	0.826	74%	0.744	S	S	*	*			trans	-134.8	134.5	157.6	-60.1	-176.9	0	0	0	107.8
397	N	26.2	Very low	30.3	Very low	160 Å²	160	140.2 Å²	140.2	86%	0.856	75%	0.748	S	S	*	*			trans	-75.6	129.7	-175.9	-64.1	-42.2	0	0	0	111.9
398	S	29.9	Very low	30.9	Very low	105 Å²	105	138.3 Å²	138.3	73%	0.734	75%	0.746	S	S	*	*			trans	-130.4	87.1	162	62.2	0	0	0	0	109.5	N400	S398-N400 PolarHBondContact O-N 2.82Å
399	G	28.2	Very low	31.6	Very low	70 Å²	70	140.8 Å²	140.8	72%	0.722	75%	0.753	S	S	*	*			trans	-73.8	121.7	170.6	0	0	0	0	0	109.6	T401	G399-T401 PolarHBondContact O-N 3.43Å
400	N	28.1	Very low	32.3	Very low	130 Å²	130	139.1 Å²	139.1	70%	0.695	74%	0.736	S	S	*	*			trans	-63.9	102.3	-179.4	-77.8	11.9	0	0	0	111.1	S398 D402	S398-N400 PolarHBondContact O-N 2.82Å; N400-D402 PolarHBondContact O-N 2.69Å
401	T	29.1	Very low	33.4	Very low	129 Å²	129	136.1 Å²	136.1	79%	0.791	72%	0.72	S	S	*	*			trans	-76.6	76.5	159	52.6	0	0	0	0	108.7	G399 Q403	G399-T401 PolarHBondContact O-N 3.43Å; T401-Q403 VanDerWaalsContact C-N 3.29Å; T401-Q403 PolarHBondContact O-N 2.86Å
402	D	32.7	Very low	34.8	Very low	113 Å²	113	131.9 Å²	131.9	60%	0.604	71%	0.706	S	S	*	*			trans	-65.9	93.7	169	-70.3	-32.3	0	0	0	108.1	N400 W404	N400-D402 PolarHBondContact O-N 2.69Å; D402-W404 PolarHBondContact O-N 3.44Å
403	Q	32.4	Very low	36.6	Very low	179 Å²	179	130.3 Å²	130.3	84%	0.836	69%	0.69	S	S	*	*			trans	-74.4	99.7	165.4	-77.6	-172.7	-28	0	0	107.9	T401 K405	T401-Q403 VanDerWaalsContact C-N 3.29Å; T401-Q403 PolarHBondContact O-N 2.86Å; Q403-K405 VanDerWaalsContact C-N 3.33Å; Q403-K405 PolarHBondContact O-N 2.87Å
404	W	34.5	Very low	39	Very low	229 Å²	229	125.6 Å²	125.6	87%	0.867	67%	0.665	S	S	*	*			trans	-68.4	93	172.7	-71.7	55.1	0	0	0	108.4	D402 L406	D402-W404 PolarHBondContact O-N 3.44Å; W404-L406 PolarHBondContact O-N 3.12Å
405	K	29.9	Very low	41.1	Very low	98 Å²	98	119 Å²	119	43%	0.426	63%	0.631	S	S	.	*			trans	-56.3	102.8	164.1	-89.6	-165.4	168	-164.2	0	107.5	W368 Q403 N407	W368-K405 PolarHBondContact O-NZ 3.17Å; Q403-K405 VanDerWaalsContact C-N 3.33Å; Q403-K405 PolarHBondContact O-N 2.87Å; K405-N407 PolarHBondContact O-N 2.94Å
406	L	36.1	Very low	43.6	Very low	113 Å²	113	111.8 Å²	111.8	59%	0.592	59%	0.593	S	S	*	*			trans	-80	75.6	-174.5	-150.2	162.1	0	0	0	108.3	W404 N408 I423	W404-L406 PolarHBondContact O-N 3.12Å; L406-N408 PolarHBondContact O-N 2.83Å; L406-I423 HydrophobicContact CD1-CD1 4.23Å
407	N	32.3	Very low	45.6	Very low	131 Å²	131	109.3 Å²	109.3	70%	0.701	57%	0.573	S	S	*	*			trans	-72.7	66.9	-178.3	-74.9	9.3	0	0	0	111.4	K405	K405-N407 PolarHBondContact O-N 2.94Å
408	N	42.5	Very low	48	Very low	138 Å²	138	102.1 Å²	102.1	74%	0.738	53%	0.534	S	S	*	.	S	Bend	trans	-169.9	137.2	159.5	-94.1	-26.7	0	0	0	107.3	L406 C410	L406-N408 PolarHBondContact O-N 2.83Å; N408-C410 PolarHBondContact O-N 3.2Å
409	E	43.8	Very low	49.8	Very low	196 Å²	196	98.1 Å²	98.1	92%	0.916	51%	0.505	S	S	*	.			trans	-73.3	68	173.4	-68.4	178.9	114.3	0	0	111.1	N411	E409-N411 PolarHBondContact O-N 2.91Å
410	C	46.3	Very low	51.6	Low	45 Å²	45	98.2 Å²	98.2	30%	0.304	49%	0.489	S	S	.	.			trans	-62.3	103.3	157.4	-150.8	0	0	0	0	105.6	N408 L412 C415	N408-C410 PolarHBondContact O-N 3.2Å; C410-L412 WeakPolarHBondContact O-CD1 3.49Å; C410-L412 PolarHBondContact O-N 2.89Å; C410-C415 HydrophobicContact CB-CB 4.27Å; C410-C415 WeakPolarHBondContact CB-SG 3.21Å; C410-C415 WeakPolarHBondContact SG-CB 3.42Å; C410-C415 CovalentContact SG-SG 2.05Å; C410-C415 PolarHBondContact SG-SG 2.76Å
411	N	56.9	Low	53.5	Low	108 Å²	108	93.4 Å²	93.4	58%	0.578	47%	0.47	S	S	*	.			trans	-51.1	105.8	173	-89.8	-61.1	0	0	0	108.1	E409 N413 K414 C415	E409-N411 PolarHBondContact O-N 2.91Å; N411-N413 PolarHBondContact O-N 3.46Å; N411-K414 PolarHBondContact O-N 3.43Å; N411-C415 PolarHBondContact O-N 2.85Å; N411-C415 PolarHBondContact O-SG 3.44Å
412	L	57.7	Low	55.8	Low	97 Å²	97	92 Å²	92	51%	0.508	45%	0.454	S	S	.	.	T	Hydrogen-bonded Turn	trans	-60.5	-22.1	-168.2	-74.3	92.1	0	0	0	112.5	C410 K414 C415 E721	C410-L412 WeakPolarHBondContact O-CD1 3.49Å; C410-L412 PolarHBondContact O-N 2.89Å; L412-K414 VanDerWaalsContact C-N 3.25Å; L412-K414 PolarHBondContact O-N 2.86Å; L412-C415 PolarHBondContact O-N 2.79Å; L412-E721 WeakPolarHBondContact CB-OE2 3.37Å
413	N	65.7	Low	58.1	Low	83 Å²	83	91 Å²	91	44%	0.444	45%	0.448	S	S	.	.	T	Hydrogen-bonded Turn	trans	-61.9	-24.6	171.2	-63.2	-13.3	0	0	0	114.5	N411 R426	N411-N413 PolarHBondContact O-N 3.46Å; N413-R426 PolarHBondContact O-NH1 2.81Å; N413-R426 PolarHBondContact O-NH2 2.91Å
414	K	76.1	Confident	60.5	Low	47 Å²	47	84.4 Å²	84.4	20%	0.204	42%	0.417	C	S	.	.	T	Hydrogen-bonded Turn	trans	-97.2	-23.1	174.7	-68.7	-175.5	176.6	-80.7	0	113.3	N411 L412 V425 R426 D562	N411-K414 PolarHBondContact O-N 3.43Å; L412-K414 VanDerWaalsContact C-N 3.25Å; L412-K414 PolarHBondContact O-N 2.86Å; K414-V425 HydrophobicContact CB-CG1 3.94Å; K414-R426 WeakPolarHBondContact O-CB 3.29Å; K414-R426 PolarHBondContact O-N 3.35Å; K414-D562 VanDerWaalsContact CE-CG 3.4Å; K414-D562 WeakPolarHBondContact CE-OD2 3.19Å; K414-D562 PolarHBondContact NZ-O 2.97Å; K414-D562 IonicContact NZ-OD1 3.8Å; K414-D562 PolarHBondContact NZ-OD1 2.79Å; K414-D562 IonicContact NZ-OD2 3.08Å; K414-D562 PolarHBondContact NZ-OD2 3.28Å; K414-D562 VanDerWaalsContact NZ-OD2 3.08Å
415	C	77.2	Confident	63	Low	14 Å²	14	75.8 Å²	75.8	10%	0.095	39%	0.389	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-97.5	131.1	-167.7	-47.6	0	0	0	0	111.1	C410 N411 L412 I423	C410-C415 HydrophobicContact CB-CB 4.27Å; C410-C415 WeakPolarHBondContact CB-SG 3.21Å; C410-C415 WeakPolarHBondContact SG-CB 3.42Å; C410-C415 CovalentContact SG-SG 2.05Å; C410-C415 PolarHBondContact SG-SG 2.76Å; N411-C415 PolarHBondContact O-N 2.85Å; N411-C415 PolarHBondContact O-SG 3.44Å; L412-C415 PolarHBondContact O-N 2.79Å; C415-I423 HydrophobicContact CB-CG2 3.98Å
416	V	77.1	Confident	65.5	Low	2 Å²	2	71.6 Å²	71.6	1%	0.012	37%	0.37	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-121.3	126.6	-168.3	178.5	0	0	0	0	110.2	I423 K424 R426 L429 A717	V416-I423 VanDerWaalsContact O-CA 3.32Å; V416-I423 WeakPolarHBondContact O-CA 3.09Å; V416-K424 PolarHBondContact N-O 2.85Å; V416-K424 PolarHBondContact O-N 3.08Å; V416-R426 HydrophobicContact CG2-CB 4.14Å; V416-L429 HydrophobicContact CB-CD1 4.35Å; V416-L429 HydrophobicContact CG1-CD1 4.27Å; V416-L429 HydrophobicContact CG2-CD1 4.15Å; V416-A717 HydrophobicContact CG1-CB 4.14Å; V416-A717 HydrophobicContact CG2-CB 4.26Å; V416-A717 VanDerWaalsContact CG2-O 3.28Å; V416-A717 WeakPolarHBondContact CG2-O 3.3Å
417	R	75.7	Confident	68	Low	108 Å²	108	69.4 Å²	69.4	41%	0.408	36%	0.357	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-96.2	114.2	178.1	-168.5	175.4	-178.7	-136.4	-3.6	111.6	E422 I423	R417-E422 CarbonylContact C-O 3.46Å; R417-E422 WeakPolarHBondContact CA-O 2.86Å; R417-I423 HydrophobicContact CB-CG1 4.18Å; R417-I423 HydrophobicContact CG-CG1 4.06Å
418	L	76.8	Confident	70.6	Confident	9 Å²	9	67.7 Å²	67.7	5%	0.047	35%	0.348	C	S	.	.			trans	-79.8	166.4	-178.7	-63.2	176.8	0	0	0	112.3	N420 G421 E422 K424 L429 D433	L418-N420 WeakPolarHBondContact CB-OD1 3.29Å; L418-N420 PolarHBondContact O-N 3.43Å; L418-G421 WeakPolarHBondContact O-CA 3.18Å; L418-G421 PolarHBondContact O-N 3.09Å; L418-E422 PolarHBondContact N-O 3.38Å; L418-K424 HydrophobicContact CD1-CD 4.02Å; L418-K424 HydrophobicContact CD1-CG 4.21Å; L418-L429 HydrophobicContact CD2-CD2 3.9Å; L418-D433 HydrophobicContact CD1-CB 3.8Å; L418-D433 WeakPolarHBondContact CD1-OD1 3.47Å; L418-D433 HydrophobicContact CD2-CB 4.05Å
419	I	65.9	Low	72.7	Confident	21 Å²	21	61.5 Å²	61.5	11%	0.108	32%	0.315	C	S	.	.	T	Hydrogen-bonded Turn	trans	-68	-21	-175.4	-140.2	166.7	0	0	0	114.1	G421 K440 Y441 F444	I419-G421 PolarHBondContact O-N 3.1Å; I419-K440 HydrophobicContact CG2-CB 3.75Å; I419-Y441 HydrophobicContact CD1-CD2 3.57Å; I419-Y441 HydrophobicContact CD1-CE2 4.17Å; I419-Y441 HydrophobicContact CD1-CG 4.38Å; I419-F444 HydrophobicContact CG1-CD2 3.67Å; I419-F444 HydrophobicContact CG1-CE2 4.01Å; I419-F444 HydrophobicContact CG1-CG 4.48Å; I419-F444 WeakPolarHBondContact O-CD2 3.41Å; I419-F444 WeakPolarHBondContact O-CE2 3.06Å
420	N	66.7	Low	74.9	Confident	72 Å²	72	52.8 Å²	52.8	39%	0.385	28%	0.276	S	S	.	.	T	Hydrogen-bonded Turn	trans	-76.8	-3.7	171.6	60.3	-2.6	0	0	0	112.7	L418 E422	L418-N420 WeakPolarHBondContact CB-OD1 3.29Å; L418-N420 PolarHBondContact O-N 3.43Å; N420-E422 PolarHBondContact ND2-OE1 3.13Å; N420-E422 PolarHBondContact ND2-OE2 3.12Å; N420-E422 WeakPolarHBondContact OD1-CB 3.49Å; N420-E422 PolarHBondContact OD1-N 2.97Å; N420-E422 VanDerWaalsContact OD1-N 3.12Å
421	G	69.2	Low	76.9	Confident	29 Å²	29	51.8 Å²	51.8	30%	0.299	27%	0.268	S	S	.	.	S	Bend	trans	90.3	-9.4	-178.4	0	0	0	0	0	114.7	L418 I419	L418-G421 WeakPolarHBondContact O-CA 3.18Å; L418-G421 PolarHBondContact O-N 3.09Å; I419-G421 PolarHBondContact O-N 3.1Å
422	E	76.4	Confident	78.4	Confident	100 Å²	100	47 Å²	47	47%	0.467	24%	0.243	S	C	.	.			trans	-64.9	149.3	176.8	-68.2	169.8	-173.4	0	0	111.2	R417 L418 N420	R417-E422 CarbonylContact C-O 3.46Å; R417-E422 WeakPolarHBondContact CA-O 2.86Å; L418-E422 PolarHBondContact N-O 3.38Å; N420-E422 PolarHBondContact ND2-OE1 3.13Å; N420-E422 PolarHBondContact ND2-OE2 3.12Å; N420-E422 WeakPolarHBondContact OD1-CB 3.49Å; N420-E422 PolarHBondContact OD1-N 2.97Å; N420-E422 VanDerWaalsContact OD1-N 3.12Å
423	I	80.5	Confident	79.8	Confident	92 Å²	92	42.7 Å²	42.7	47%	0.472	22%	0.221	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-112.7	124.7	172.5	-59	173.4	0	0	0	107.7	L406 C415 V416 R417	L406-I423 HydrophobicContact CD1-CD1 4.23Å; C415-I423 HydrophobicContact CB-CG2 3.98Å; V416-I423 VanDerWaalsContact O-CA 3.32Å; V416-I423 WeakPolarHBondContact O-CA 3.09Å; R417-I423 HydrophobicContact CB-CG1 4.18Å; R417-I423 HydrophobicContact CG-CG1 4.06Å
424	K	84	Confident	80.7	Confident	41 Å²	41	38.9 Å²	38.9	18%	0.178	20%	0.2	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-121.5	155	173.7	-69.7	-167.5	176.8	-178.6	0	110.4	V416 L418 L429 D433	V416-K424 PolarHBondContact N-O 2.85Å; V416-K424 PolarHBondContact O-N 3.08Å; L418-K424 HydrophobicContact CD1-CD 4.02Å; L418-K424 HydrophobicContact CD1-CG 4.21Å; K424-L429 HydrophobicContact CB-CD2 4.19Å; K424-L429 HydrophobicContact CD-CD2 4.47Å; K424-D433 WeakPolarHBondContact CE-OD1 3.34Å; K424-D433 IonicContact NZ-OD1 3.64Å; K424-D433 PolarHBondContact NZ-OD1 3.11Å; K424-D433 IonicContact NZ-OD2 3.63Å; K424-D433 PolarHBondContact NZ-OD2 2.92Å
425	V	85.5	Confident	81.1	Confident	47 Å²	47	36.9 Å²	36.9	29%	0.285	19%	0.191	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-72.9	147.9	168	-148.9	0	0	0	0	108.5	K414 E427 D428	K414-V425 HydrophobicContact CB-CG1 3.94Å; V425-E427 VanDerWaalsContact CG1-OE2 3.24Å; V425-E427 WeakPolarHBondContact CG1-OE2 3.42Å; V425-E427 PolarHBondContact O-N 2.73Å; V425-D428 WeakPolarHBondContact CG2-OD2 3.25Å; V425-D428 PolarHBondContact O-N 3.15Å
426	R	83.9	Confident	81.2	Confident	10 Å²	10	37 Å²	37	4%	0.038	19%	0.193	C	C	.	.	G	3₁₀ helix	trans	-58.9	-34.6	-174.5	-172.3	-179.5	-66	131.7	4	112.2	N413 K414 V416 D428 L429 W549 Q561 L563	N413-R426 PolarHBondContact O-NH1 2.81Å; N413-R426 PolarHBondContact O-NH2 2.91Å; K414-R426 WeakPolarHBondContact O-CB 3.29Å; K414-R426 PolarHBondContact O-N 3.35Å; V416-R426 HydrophobicContact CG2-CB 4.14Å; R426-D428 VanDerWaalsContact C-N 3.29Å; R426-D428 PolarHBondContact O-N 2.95Å; R426-L429 HydrophobicContact CG-CD1 4.22Å; R426-L429 WeakPolarHBondContact O-CB 3.29Å; R426-L429 PolarHBondContact O-N 3.24Å; R426-W549 HydrophobicContact CG-CZ2 4.11Å; R426-W549 PolarHBondContact O-NE1 3.49Å; R426-Q561 PolarHBondContact NH1-O 3.27Å; R426-L563 HydrophobicContact CB-CD1 4.44Å; R426-L563 HydrophobicContact CG-CD1 3.95Å
427	E	86.8	Confident	81.3	Confident	68 Å²	68	37.8 Å²	37.8	32%	0.318	20%	0.198	S	C	.	.	G	3₁₀ helix	trans	-64.6	-31.4	177.4	-66.3	64.3	-139.8	0	0	112.4	V425 L429 L563	V425-E427 VanDerWaalsContact CG1-OE2 3.24Å; V425-E427 WeakPolarHBondContact CG1-OE2 3.42Å; V425-E427 PolarHBondContact O-N 2.73Å; E427-L429 VanDerWaalsContact C-N 3.33Å; E427-L429 PolarHBondContact O-N 2.64Å; E427-L563 HydrophobicContact CG-CD1 4.24Å; E427-L563 WeakPolarHBondContact OE1-CD1 3.36Å
428	D	87.4	Confident	81.3	Confident	95 Å²	95	32.8 Å²	32.8	51%	0.508	18%	0.18	S	C	.	.	G	3₁₀ helix	trans	-86.6	3	-176.9	-61.1	-40	0	0	0	113.9	V425 R426 S430	V425-D428 WeakPolarHBondContact CG2-OD2 3.25Å; V425-D428 PolarHBondContact O-N 3.15Å; R426-D428 VanDerWaalsContact C-N 3.29Å; R426-D428 PolarHBondContact O-N 2.95Å; D428-S430 PolarHBondContact O-N 3.1Å
429	L	87.8	Confident	81.2	Confident	7 Å²	7	32.5 Å²	32.5	4%	0.037	18%	0.179	C	C	.	.			trans	-71.4	127	-176.2	-72.2	172.9	0	0	0	112.2	V416 L418 K424 R426 E427 D433 F434 F543 W549 A717	V416-L429 HydrophobicContact CB-CD1 4.35Å; V416-L429 HydrophobicContact CG1-CD1 4.27Å; V416-L429 HydrophobicContact CG2-CD1 4.15Å; L418-L429 HydrophobicContact CD2-CD2 3.9Å; K424-L429 HydrophobicContact CB-CD2 4.19Å; K424-L429 HydrophobicContact CD-CD2 4.47Å; R426-L429 HydrophobicContact CG-CD1 4.22Å; R426-L429 WeakPolarHBondContact O-CB 3.29Å; R426-L429 PolarHBondContact O-N 3.24Å; E427-L429 VanDerWaalsContact C-N 3.33Å; E427-L429 PolarHBondContact O-N 2.64Å; L429-D433 HydrophobicContact CD2-CB 4.27Å; L429-F434 HydrophobicContact CB-CE2 4.25Å; L429-F434 HydrophobicContact CB-CZ 4.01Å; L429-F434 HydrophobicContact CD1-CZ 4.18Å; L429-F543 WeakPolarHBondContact O-CE2 3.12Å; L429-F543 WeakPolarHBondContact O-CZ 3.28Å; L429-W549 HydrophobicContact CB-CZ2 4.43Å; L429-W549 HydrophobicContact CD1-CZ2 3.99Å; L429-A717 HydrophobicContact CD1-CB 3.64Å
430	S	89.4	Confident	81.2	Confident	14 Å²	14	33.7 Å²	33.7	10%	0.098	18%	0.183	C	C	.	.			trans	-103.9	164	-179	70.7	0	0	0	0	112.8	D428 S432 D433 F434	D428-S430 PolarHBondContact O-N 3.1Å; S430-S432 PolarHBondContact O-N 3.34Å; S430-S432 WeakPolarHBondContact OG-CB 3.17Å; S430-S432 PolarHBondContact OG-N 3.21Å; S430-D433 WeakPolarHBondContact CB-OD2 3.45Å; S430-D433 PolarHBondContact N-OD2 3.35Å; S430-D433 WeakPolarHBondContact O-CB 3.5Å; S430-D433 PolarHBondContact O-N 3.21Å; S430-D433 VanDerWaalsContact O-N 3.1Å; S430-D433 PolarHBondContact OG-N 2.95Å; S430-D433 VanDerWaalsContact OG-N 3.13Å; S430-D433 PolarHBondContact OG-OD2 3.47Å; S430-F434 WeakPolarHBondContact O-CD2 3.41Å; S430-F434 PolarHBondContact O-N 3.15Å
431	V	89.2	Confident	80.8	Confident	23 Å²	23	31.8 Å²	31.8	14%	0.139	17%	0.171	C	C	.	.	H	α-helix	trans	-56.5	-32.5	168	-179.4	0	0	0	0	111.2	D433 I435 W468 F543	V431-D433 VanDerWaalsContact C-N 3.35Å; V431-I435 HydrophobicContact CG1-CD1 3.65Å; V431-I435 HydrophobicContact CG1-CG1 4.38Å; V431-I435 WeakPolarHBondContact O-CB 3.24Å; V431-I435 VanDerWaalsContact O-CG1 3.3Å; V431-I435 WeakPolarHBondContact O-CG1 3.49Å; V431-I435 PolarHBondContact O-N 3.42Å; V431-I435 VanDerWaalsContact O-N 3.08Å; V431-W468 HydrophobicContact CG1-CZ2 3.94Å; V431-W468 HydrophobicContact CG2-CH2 4.09Å; V431-W468 HydrophobicContact CG2-CZ2 4.25Å; V431-F543 HydrophobicContact CG2-CD1 4.27Å; V431-F543 HydrophobicContact CG2-CE1 3.61Å; V431-F543 HydrophobicContact CG2-CZ 4.47Å
432	S	87.4	Confident	79.9	Confident	7 Å²	7	35.6 Å²	35.6	5%	0.049	18%	0.184	C	C	.	.	H	α-helix	trans	-66.7	-33.5	177.9	-160.9	0	0	0	0	113	D28 S430 S436	D28-S432 WeakPolarHBondContact OD1-CB 3.14Å; S430-S432 PolarHBondContact O-N 3.34Å; S430-S432 WeakPolarHBondContact OG-CB 3.17Å; S430-S432 PolarHBondContact OG-N 3.21Å; S432-S436 WeakPolarHBondContact O-CB 3.24Å; S432-S436 PolarHBondContact O-N 3.44Å; S432-S436 PolarHBondContact O-OG 3.01Å
433	D	86.5	Confident	78.6	Confident	8 Å²	8	34.8 Å²	34.8	4%	0.043	19%	0.189	C	C	.	.	H	α-helix	trans	-69.8	-44.1	178.3	-62.1	-50.6	0	0	0	111.7	L418 K424 L429 S430 V431 S437	L418-D433 HydrophobicContact CD1-CB 3.8Å; L418-D433 WeakPolarHBondContact CD1-OD1 3.47Å; L418-D433 HydrophobicContact CD2-CB 4.05Å; K424-D433 WeakPolarHBondContact CE-OD1 3.34Å; K424-D433 IonicContact NZ-OD1 3.64Å; K424-D433 PolarHBondContact NZ-OD1 3.11Å; K424-D433 IonicContact NZ-OD2 3.63Å; K424-D433 PolarHBondContact NZ-OD2 2.92Å; L429-D433 HydrophobicContact CD2-CB 4.27Å; S430-D433 WeakPolarHBondContact CB-OD2 3.45Å; S430-D433 PolarHBondContact N-OD2 3.35Å; S430-D433 WeakPolarHBondContact O-CB 3.5Å; S430-D433 PolarHBondContact O-N 3.21Å; S430-D433 VanDerWaalsContact O-N 3.1Å; S430-D433 PolarHBondContact OG-N 2.95Å; S430-D433 VanDerWaalsContact OG-N 3.13Å; S430-D433 PolarHBondContact OG-OD2 3.47Å; V431-D433 VanDerWaalsContact C-N 3.35Å; D433-S437 WeakPolarHBondContact O-CB 3.18Å; D433-S437 PolarHBondContact O-N 3.41Å; D433-S437 PolarHBondContact O-OG 2.98Å
434	F	85.9	Confident	77.2	Confident	3 Å²	3	32.9 Å²	32.9	1%	0.013	18%	0.178	C	C	.	.	H	α-helix	trans	-65.5	-40.6	175.1	-59.5	-64.7	0	0	0	111.9	L429 S430 S437 A438 M466 F543 W549 L575 A713 L716	L429-F434 HydrophobicContact CB-CE2 4.25Å; L429-F434 HydrophobicContact CB-CZ 4.01Å; L429-F434 HydrophobicContact CD1-CZ 4.18Å; S430-F434 WeakPolarHBondContact O-CD2 3.41Å; S430-F434 PolarHBondContact O-N 3.15Å; F434-S437 PolarHBondContact O-N 3.49Å; F434-A438 WeakPolarHBondContact O-CB 3.38Å; F434-A438 PolarHBondContact O-N 3.4Å; F434-M466 HydrophobicContact CB-CE 4.26Å; F434-M466 HydrophobicContact CB-SD 4.03Å; F434-F543 HydrophobicContact CE2-CD1 4.47Å; F434-F543 AromaticContact CE2-CD2 3.66Å; F434-F543 HydrophobicContact CE2-CD2 3.66Å; F434-F543 AromaticContact CE2-CE2 3.94Å; F434-F543 HydrophobicContact CE2-CE2 3.94Å; F434-F543 AromaticContact CE2-CG 3.95Å; F434-F543 HydrophobicContact CE2-CG 3.95Å; F434-F543 HydrophobicContact CE2-CZ 4.45Å; F434-F543 HydrophobicContact CZ-CD2 4.2Å; F434-W549 AromaticContact CZ-CH2 3.97Å; F434-W549 HydrophobicContact CZ-CH2 3.97Å; F434-W549 AromaticContact CZ-CZ2 3.94Å; F434-W549 HydrophobicContact CZ-CZ2 3.94Å; F434-L575 HydrophobicContact CB-CD2 3.93Å; F434-L575 HydrophobicContact CD2-CD2 3.93Å; F434-L575 HydrophobicContact CG-CD2 4.1Å; F434-A713 HydrophobicContact CD1-CB 3.92Å; F434-A713 HydrophobicContact CD2-CB 4.37Å; F434-A713 HydrophobicContact CE1-CB 3.71Å; F434-A713 WeakPolarHBondContact CE1-O 3.38Å; F434-A713 HydrophobicContact CE2-CB 4.19Å; F434-A713 HydrophobicContact CG-CB 4.26Å; F434-A713 HydrophobicContact CZ-CB 3.85Å; F434-L716 HydrophobicContact CD1-CB 4.29Å; F434-L716 HydrophobicContact CD1-CD1 4.12Å; F434-L716 HydrophobicContact CE1-CB 4.48Å
435	I	84.6	Confident	75.3	Confident	4 Å²	4	37 Å²	37	2%	0.021	20%	0.201	C	C	.	.	H	α-helix	trans	-69.5	-43.5	178.4	-70.9	171.2	0	0	0	111.4	V431 S437 A438 I439 M466 L500 A513 M516 L517	V431-I435 HydrophobicContact CG1-CD1 3.65Å; V431-I435 HydrophobicContact CG1-CG1 4.38Å; V431-I435 WeakPolarHBondContact O-CB 3.24Å; V431-I435 VanDerWaalsContact O-CG1 3.3Å; V431-I435 WeakPolarHBondContact O-CG1 3.49Å; V431-I435 PolarHBondContact O-N 3.42Å; V431-I435 VanDerWaalsContact O-N 3.08Å; I435-S437 VanDerWaalsContact C-N 3.3Å; I435-S437 PolarHBondContact O-N 2.87Å; I435-A438 PolarHBondContact O-N 3.2Å; I435-I439 HydrophobicContact CG2-CD1 3.67Å; I435-I439 WeakPolarHBondContact O-CD1 3.2Å; I435-I439 VanDerWaalsContact O-CG1 3.26Å; I435-I439 WeakPolarHBondContact O-CG1 3.21Å; I435-I439 PolarHBondContact O-N 3.49Å; I435-I439 VanDerWaalsContact O-N 3.13Å; I435-M466 HydrophobicContact CB-CE 4.3Å; I435-M466 HydrophobicContact CG1-CE 3.47Å; I435-M466 VanDerWaalsContact CG1-CE 3.47Å; I435-L500 HydrophobicContact CB-CD2 4.49Å; I435-L500 HydrophobicContact CG1-CD2 4.38Å; I435-L500 HydrophobicContact CG2-CD2 4.07Å; I435-A513 HydrophobicContact CG2-CB 3.95Å; I435-M516 VanDerWaalsContact CD1-C 3.46Å; I435-M516 HydrophobicContact CD1-CB 3.47Å; I435-M516 VanDerWaalsContact CD1-CB 3.47Å; I435-M516 HydrophobicContact CG1-CB 4.19Å; I435-L517 HydrophobicContact CD1-CB 4.31Å; I435-L517 HydrophobicContact CD1-CD2 3.9Å; I435-L517 HydrophobicContact CD1-CG 3.69Å; I435-L517 VanDerWaalsContact CD1-N 3.29Å
436	S	79.3	Confident	73.5	Confident	18 Å²	18	42.8 Å²	42.8	13%	0.126	22%	0.223	C	C	.	.	H	α-helix	trans	-61.3	-41.7	174.7	-63	0	0	0	0	111.1	S432 I439 K440	S432-S436 WeakPolarHBondContact O-CB 3.24Å; S432-S436 PolarHBondContact O-N 3.44Å; S432-S436 PolarHBondContact O-OG 3.01Å; S436-I439 PolarHBondContact O-N 3.23Å; S436-K440 PolarHBondContact O-N 3.4Å
437	S	77.9	Confident	71.6	Confident	18 Å²	18	46.7 Å²	46.7	13%	0.126	25%	0.252	C	S	.	.	H	α-helix	trans	-66.5	-38	177.2	-60.4	0	0	0	0	113.1	D433 F434 I435 I439	D433-S437 WeakPolarHBondContact O-CB 3.18Å; D433-S437 PolarHBondContact O-N 3.41Å; D433-S437 PolarHBondContact O-OG 2.98Å; F434-S437 PolarHBondContact O-N 3.49Å; I435-S437 VanDerWaalsContact C-N 3.3Å; I435-S437 PolarHBondContact O-N 2.87Å; S437-I439 VanDerWaalsContact C-N 3.31Å; S437-I439 PolarHBondContact O-N 2.81Å
438	A	77.2	Confident	69.5	Low	3 Å²	3	46.6 Å²	46.6	3%	0.025	26%	0.256	C	S	.	.	H	α-helix	trans	-68.7	-25.8	175.4	0	0	0	0	0	113.7	F434 I435 M466 L500 V502 G503	F434-A438 WeakPolarHBondContact O-CB 3.38Å; F434-A438 PolarHBondContact O-N 3.4Å; I435-A438 PolarHBondContact O-N 3.2Å; A438-M466 HydrophobicContact CB-CE 4.16Å; A438-L500 HydrophobicContact CB-CD2 3.87Å; A438-V502 HydrophobicContact CB-CG2 4.27Å; A438-V502 WeakPolarHBondContact O-CA 3.43Å; A438-G503 PolarHBondContact O-N 2.85Å
439	I	74.3	Confident	67.2	Low	3 Å²	3	51.7 Å²	51.7	2%	0.015	27%	0.269	C	S	.	.	H	α-helix	trans	-94.1	-45.2	-174.6	-68.4	167.5	0	0	0	112.7	F35 I435 S436 S437 Y441 L500 E506 A513	F35-I439 HydrophobicContact CZ-CD1 4.35Å; F35-I439 HydrophobicContact CZ-CG2 4.17Å; I435-I439 HydrophobicContact CG2-CD1 3.67Å; I435-I439 WeakPolarHBondContact O-CD1 3.2Å; I435-I439 VanDerWaalsContact O-CG1 3.26Å; I435-I439 WeakPolarHBondContact O-CG1 3.21Å; I435-I439 PolarHBondContact O-N 3.49Å; I435-I439 VanDerWaalsContact O-N 3.13Å; S436-I439 PolarHBondContact O-N 3.23Å; S437-I439 VanDerWaalsContact C-N 3.31Å; S437-I439 PolarHBondContact O-N 2.81Å; I439-Y441 PolarHBondContact O-N 2.98Å; I439-L500 HydrophobicContact CD1-CD1 4.09Å; I439-L500 HydrophobicContact CD1-CD2 4.17Å; I439-L500 HydrophobicContact CG1-CD1 4.12Å; I439-L500 HydrophobicContact CG1-CD2 3.97Å; I439-L500 HydrophobicContact CG1-CG 4.41Å; I439-E506 HydrophobicContact CG2-CB 4.1Å; I439-E506 HydrophobicContact CG2-CG 3.55Å; I439-A513 HydrophobicContact CD1-CB 3.54Å
440	K	65.3	Low	65.2	Low	46 Å²	46	57.1 Å²	57.1	20%	0.2	30%	0.298	C	S	.	.	G	3₁₀ helix	trans	-79	13.3	-167.1	-76.5	-174.6	165.1	177.1	0	115.9	F35 N39 I419 S436 D442 S443 E506	F35-K440 HydrophobicContact CE2-CD 4.06Å; F35-K440 VanDerWaalsContact CE2-CE 3.44Å; F35-K440 HydrophobicContact CE2-CG 4.26Å; N39-K440 VanDerWaalsContact ND2-CE 3.28Å; N39-K440 WeakPolarHBondContact ND2-CE 3.47Å; N39-K440 PolarHBondContact ND2-NZ 3.05Å; I419-K440 HydrophobicContact CG2-CB 3.75Å; S436-K440 PolarHBondContact O-N 3.4Å; K440-D442 VanDerWaalsContact C-N 3.3Å; K440-D442 PolarHBondContact O-N 3.4Å; K440-S443 PolarHBondContact O-N 3.14Å; K440-S443 VanDerWaalsContact O-N 3.15Å; K440-S443 PolarHBondContact O-OG 3.46Å; K440-E506 VanDerWaalsContact CE-OE1 3.24Å; K440-E506 WeakPolarHBondContact CE-OE1 3.36Å
441	Y	57.4	Low	63	Low	32 Å²	32	58.7 Å²	58.7	13%	0.125	31%	0.306	C	S	.	.	G	3₁₀ helix	trans	-52.3	-42.8	-175.7	-166.4	-87.3	0	0	0	113.8	I419 I439 S443 F444 I455 E456 A459	I419-Y441 HydrophobicContact CD1-CD2 3.57Å; I419-Y441 HydrophobicContact CD1-CE2 4.17Å; I419-Y441 HydrophobicContact CD1-CG 4.38Å; I439-Y441 PolarHBondContact O-N 2.98Å; Y441-S443 PolarHBondContact O-N 2.85Å; Y441-F444 PolarHBondContact O-N 3.17Å; Y441-I455 HydrophobicContact CD2-CG2 4.01Å; Y441-I455 HydrophobicContact CE2-CB 4.48Å; Y441-I455 HydrophobicContact CE2-CG2 3.86Å; Y441-E456 WeakPolarHBondContact OH-CA 3.33Å; Y441-E456 WeakPolarHBondContact OH-CB 3.42Å; Y441-E456 VanDerWaalsContact OH-CG 3.29Å; Y441-E456 WeakPolarHBondContact OH-CG 2.88Å; Y441-A459 HydrophobicContact CD1-CB 3.67Å; Y441-A459 HydrophobicContact CD2-CB 3.61Å; Y441-A459 HydrophobicContact CE1-CB 3.89Å; Y441-A459 HydrophobicContact CE2-CB 3.85Å; Y441-A459 HydrophobicContact CG-CB 3.6Å
442	D	51.9	Low	60.7	Low	109 Å²	109	58.1 Å²	58.1	58%	0.583	31%	0.305	S	S	*	.	G	3₁₀ helix	trans	-55.3	-14.8	-178.5	-66.6	-19.2	0	0	0	114.9	K440	K440-D442 VanDerWaalsContact C-N 3.3Å; K440-D442 PolarHBondContact O-N 3.4Å
443	S	48.8	Very low	58.7	Low	82 Å²	82	61.1 Å²	61.1	57%	0.573	33%	0.326	S	S	*	.	G	3₁₀ helix	trans	-103.9	0.4	-173.8	65.1	0	0	0	0	115.4	K440 Y441 N445	K440-S443 PolarHBondContact O-N 3.14Å; K440-S443 VanDerWaalsContact O-N 3.15Å; K440-S443 PolarHBondContact O-OG 3.46Å; Y441-S443 PolarHBondContact O-N 2.85Å; S443-N445 PolarHBondContact O-N 2.94Å; S443-N445 VanDerWaalsContact O-N 3.17Å
444	F	50.1	Low	56.7	Low	52 Å²	52	64.8 Å²	64.8	23%	0.228	35%	0.345	C	S	.	.			trans	-77.2	105.2	-177	-143.3	-100.2	0	0	0	111.5	I419 Y441 K446	I419-F444 HydrophobicContact CG1-CD2 3.67Å; I419-F444 HydrophobicContact CG1-CE2 4.01Å; I419-F444 HydrophobicContact CG1-CG 4.48Å; I419-F444 WeakPolarHBondContact O-CD2 3.41Å; I419-F444 WeakPolarHBondContact O-CE2 3.06Å; Y441-F444 PolarHBondContact O-N 3.17Å; F444-K446 PolarHBondContact O-N 2.86Å
445	N	44.8	Very low	54.9	Low	127 Å²	127	67.5 Å²	67.5	68%	0.679	36%	0.359	S	S	*	.			trans	-61.5	129.3	176.1	-80.3	-34.1	0	0	0	110.8	S443 S447	S443-N445 PolarHBondContact O-N 2.94Å; S443-N445 VanDerWaalsContact O-N 3.17Å; N445-S447 PolarHBondContact O-N 3.14Å
446	K	48.5	Very low	53.1	Low	170 Å²	170	69.7 Å²	69.7	74%	0.739	37%	0.369	S	S	*	.	T	Hydrogen-bonded Turn	trans	-69.1	23.5	-177.8	-59.4	-161.1	177.1	-148.3	0	115.5	F444 E456	F444-K446 PolarHBondContact O-N 2.86Å; K446-E456 VanDerWaalsContact CE-OE1 3.25Å; K446-E456 WeakPolarHBondContact CE-OE1 3.35Å; K446-E456 IonicContact NZ-OE1 3.2Å; K446-E456 PolarHBondContact NZ-OE1 2.95Å
447	S	42.9	Very low	51.5	Low	91 Å²	91	71.1 Å²	71.1	64%	0.636	38%	0.382	S	S	*	.	T	Hydrogen-bonded Turn	trans	-113.5	-2.9	-170.2	60	0	0	0	0	114.6	N445	N445-S447 PolarHBondContact O-N 3.14Å
448	T	42.7	Very low	50.2	Low	67 Å²	67	71.9 Å²	71.9	41%	0.411	39%	0.385	S	S	.	.	S	Bend	trans	-112.8	126.1	172.1	52.4	0	0	0	0	110.8
449	Y	39.7	Very low	49	Very low	201 Å²	201	72.2 Å²	72.2	79%	0.788	39%	0.387	S	S	*	.			trans	-66	160.3	-166	-85	-111.2	0	0	0	115.3	N451	Y449-N451 VanDerWaalsContact C-N 3.34Å; Y449-N451 PolarHBondContact O-N 3.05Å
450	D	45.3	Very low	47.8	Very low	121 Å²	121	75.7 Å²	75.7	65%	0.647	41%	0.411	S	S	*	.	S	Bend	trans	60.2	-54.1	163.7	-52.4	-25.2	0	0	0	118.6	G452 S453	D450-G452 PolarHBondContact O-N 3.34Å; D450-G452 VanDerWaalsContact O-N 3.15Å; D450-S453 PolarHBondContact O-N 3.22Å
451	N	44.2	Very low	47.3	Very low	47 Å²	47	76 Å²	76	25%	0.251	42%	0.417	S	S	.	.	H	α-helix	trans	-60.5	-28.9	-179.8	-86	15.2	0	0	0	113.7	Y449 P720	Y449-N451 VanDerWaalsContact C-N 3.34Å; Y449-N451 PolarHBondContact O-N 3.05Å; N451-P720 WeakPolarHBondContact OD1-CB 3.48Å; N451-P720 WeakPolarHBondContact OD1-CD 3.25Å; N451-P720 WeakPolarHBondContact OD1-CG 3.28Å
452	G	40.9	Very low	47.1	Very low	12 Å²	12	79 Å²	79	12%	0.124	44%	0.435	C	S	.	.	H	α-helix	trans	-60.3	-49	-179	0	0	0	0	0	111.9	D450 L454 I455 E456	D450-G452 PolarHBondContact O-N 3.34Å; D450-G452 VanDerWaalsContact O-N 3.15Å; G452-L454 PolarHBondContact O-N 2.96Å; G452-I455 PolarHBondContact O-N 3.37Å; G452-E456 WeakPolarHBondContact O-CA 3.4Å; G452-E456 WeakPolarHBondContact O-CB 3.43Å; G452-E456 PolarHBondContact O-N 2.73Å
453	S	44	Very low	47.9	Very low	69 Å²	69	76.5 Å²	76.5	48%	0.483	42%	0.422	S	S	.	.	H	α-helix	trans	-55.6	-42.7	-159.8	-55.8	0	0	0	0	115.4	D450 A457	D450-S453 PolarHBondContact O-N 3.22Å; S453-A457 WeakPolarHBondContact O-CB 3.37Å; S453-A457 PolarHBondContact O-N 2.91Å
454	L	45.3	Very low	49.1	Very low	85 Å²	85	72.9 Å²	72.9	45%	0.445	40%	0.396	S	S	.	.	H	α-helix	trans	-76.1	-45.3	-178.3	-165.9	79.2	0	0	0	111.8	G452 E456 A457 L458 L723	G452-L454 PolarHBondContact O-N 2.96Å; L454-E456 VanDerWaalsContact C-N 3.29Å; L454-E456 PolarHBondContact O-N 3.17Å; L454-A457 PolarHBondContact O-N 3.24Å; L454-L458 HydrophobicContact CD2-CD1 4.47Å; L454-L458 HydrophobicContact CG-CD1 4.17Å; L454-L458 WeakPolarHBondContact O-CB 3.36Å; L454-L458 VanDerWaalsContact O-CG 3.24Å; L454-L458 WeakPolarHBondContact O-CG 3.43Å; L454-L458 PolarHBondContact O-N 3.11Å; L454-L723 HydrophobicContact CD2-CD1 4.12Å; L454-L723 HydrophobicContact CD2-CD2 4.47Å
455	I	47.9	Very low	50.6	Low	60 Å²	60	71.4 Å²	71.4	31%	0.308	39%	0.389	S	S	.	.	H	α-helix	trans	-71.5	-30	179.2	-54.1	-180	0	0	0	110	Y441 G452 A459	Y441-I455 HydrophobicContact CD2-CG2 4.01Å; Y441-I455 HydrophobicContact CE2-CB 4.48Å; Y441-I455 HydrophobicContact CE2-CG2 3.86Å; G452-I455 PolarHBondContact O-N 3.37Å; I455-A459 WeakPolarHBondContact O-CB 3.39Å; I455-A459 PolarHBondContact O-N 2.81Å
456	E	46.2	Very low	52.6	Low	50 Å²	50	65.4 Å²	65.4	23%	0.234	36%	0.357	C	S	.	.	H	α-helix	trans	-65	-50.2	169.8	-173.1	165.2	-178.5	0	0	111.6	Y441 K446 G452 L454 L458 A459 C460	Y441-E456 WeakPolarHBondContact OH-CA 3.33Å; Y441-E456 WeakPolarHBondContact OH-CB 3.42Å; Y441-E456 VanDerWaalsContact OH-CG 3.29Å; Y441-E456 WeakPolarHBondContact OH-CG 2.88Å; K446-E456 VanDerWaalsContact CE-OE1 3.25Å; K446-E456 WeakPolarHBondContact CE-OE1 3.35Å; K446-E456 IonicContact NZ-OE1 3.2Å; K446-E456 PolarHBondContact NZ-OE1 2.95Å; G452-E456 WeakPolarHBondContact O-CA 3.4Å; G452-E456 WeakPolarHBondContact O-CB 3.43Å; G452-E456 PolarHBondContact O-N 2.73Å; L454-E456 VanDerWaalsContact C-N 3.29Å; L454-E456 PolarHBondContact O-N 3.17Å; E456-L458 VanDerWaalsContact C-N 3.32Å; E456-L458 PolarHBondContact O-N 3.15Å; E456-A459 PolarHBondContact O-N 2.94Å; E456-C460 WeakPolarHBondContact O-CB 3.47Å; E456-C460 PolarHBondContact O-N 3.49Å; E456-C460 PolarHBondContact O-SG 2.83Å
457	A	45.7	Very low	54.6	Low	48 Å²	48	57.3 Å²	57.3	40%	0.397	32%	0.322	S	S	.	.	H	α-helix	trans	-56.7	-47.9	174.5	0	0	0	0	0	111.2	S453 L454 T461	S453-A457 WeakPolarHBondContact O-CB 3.37Å; S453-A457 PolarHBondContact O-N 2.91Å; L454-A457 PolarHBondContact O-N 3.24Å; A457-T461 VanDerWaalsContact O-CG2 3.28Å; A457-T461 WeakPolarHBondContact O-CG2 3.48Å; A457-T461 PolarHBondContact O-N 3.14Å
458	L	50.8	Low	56.9	Low	35 Å²	35	53 Å²	53	18%	0.183	29%	0.292	C	S	.	.	H	α-helix	trans	-62.4	-48.7	179.3	-74.9	170	0	0	0	112.6	L454 E456 T461 L464 F711	L454-L458 HydrophobicContact CD2-CD1 4.47Å; L454-L458 HydrophobicContact CG-CD1 4.17Å; L454-L458 WeakPolarHBondContact O-CB 3.36Å; L454-L458 VanDerWaalsContact O-CG 3.24Å; L454-L458 WeakPolarHBondContact O-CG 3.43Å; L454-L458 PolarHBondContact O-N 3.11Å; E456-L458 VanDerWaalsContact C-N 3.32Å; E456-L458 PolarHBondContact O-N 3.15Å; L458-T461 WeakPolarHBondContact O-CB 3.23Å; L458-T461 PolarHBondContact O-N 2.85Å; L458-T461 PolarHBondContact O-OG1 2.71Å; L458-L464 HydrophobicContact CB-CD1 3.66Å; L458-L464 HydrophobicContact CD2-CD1 4Å; L458-L464 HydrophobicContact CG-CD1 4.37Å; L458-L464 WeakPolarHBondContact O-CD1 3.47Å; L458-F711 HydrophobicContact CD2-CE2 4.34Å
459	A	51.9	Low	59.3	Low	9 Å²	9	49.8 Å²	49.8	7%	0.074	27%	0.272	C	S	.	.	H	α-helix	trans	-70.2	-38.6	179.6	0	0	0	0	0	112.5	Y441 I455 E456 T461 N462	Y441-A459 HydrophobicContact CD1-CB 3.67Å; Y441-A459 HydrophobicContact CD2-CB 3.61Å; Y441-A459 HydrophobicContact CE1-CB 3.89Å; Y441-A459 HydrophobicContact CE2-CB 3.85Å; Y441-A459 HydrophobicContact CG-CB 3.6Å; I455-A459 WeakPolarHBondContact O-CB 3.39Å; I455-A459 PolarHBondContact O-N 2.81Å; E456-A459 PolarHBondContact O-N 2.94Å; A459-T461 PolarHBondContact O-N 2.86Å; A459-N462 PolarHBondContact O-N 3.05Å
460	C	49.5	Very low	61.9	Low	76 Å²	76	42.7 Å²	42.7	51%	0.514	25%	0.246	S	C	.	.	H	α-helix	trans	-61.7	-22.9	176.5	-72.8	0	0	0	0	113	E456 N462	E456-C460 WeakPolarHBondContact O-CB 3.47Å; E456-C460 PolarHBondContact O-N 3.49Å; E456-C460 PolarHBondContact O-SG 2.83Å; C460-N462 PolarHBondContact O-N 2.84Å; C460-N462 PolarHBondContact O-ND2 3.22Å
461	T	54	Low	64.2	Low	54 Å²	54	37 Å²	37	33%	0.331	22%	0.215	S	C	.	.	T	Hydrogen-bonded Turn	trans	-58.9	-17.5	171.4	72.6	0	0	0	0	113.6	A457 L458 A459 N463	A457-T461 VanDerWaalsContact O-CG2 3.28Å; A457-T461 WeakPolarHBondContact O-CG2 3.48Å; A457-T461 PolarHBondContact O-N 3.14Å; L458-T461 WeakPolarHBondContact O-CB 3.23Å; L458-T461 PolarHBondContact O-N 2.85Å; L458-T461 PolarHBondContact O-OG1 2.71Å; A459-T461 PolarHBondContact O-N 2.86Å; T461-N463 WeakPolarHBondContact O-CB 3.42Å; T461-N463 PolarHBondContact O-N 2.82Å; T461-N463 PolarHBondContact O-ND2 2.61Å; T461-N463 PolarHBondContact OG1-N 2.88Å
462	N	54.4	Low	66.6	Low	93 Å²	93	37 Å²	37	50%	0.497	22%	0.215	S	C	.	.	S	Bend	trans	58	3.6	-174.4	-80.9	-90.8	0	0	0	115.4	A459 C460	A459-N462 PolarHBondContact O-N 3.05Å; C460-N462 PolarHBondContact O-N 2.84Å; C460-N462 PolarHBondContact O-ND2 3.22Å
463	N	68.5	Low	69.1	Low	58 Å²	58	40.9 Å²	40.9	31%	0.31	23%	0.23	S	C	.	.			trans	-123.4	33.4	-162.6	-72.7	-34.7	0	0	0	112.2	T461 Y579 C580 L582	T461-N463 WeakPolarHBondContact O-CB 3.42Å; T461-N463 PolarHBondContact O-N 2.82Å; T461-N463 PolarHBondContact O-ND2 2.61Å; T461-N463 PolarHBondContact OG1-N 2.88Å; N463-Y579 CarbonylContact O-C 3.46Å; N463-Y579 VanDerWaalsContact O-CA 3.24Å; N463-Y579 WeakPolarHBondContact O-CA 3.34Å; N463-Y579 WeakPolarHBondContact O-CD1 3.4Å; N463-C580 HydrophobicContact CB-CB 4.5Å; N463-C580 PolarHBondContact O-N 2.67Å; N463-L582 VanDerWaalsContact OD1-CD1 3.24Å; N463-L582 WeakPolarHBondContact OD1-CD1 3.37Å
464	L	75	Confident	71.4	Confident	6 Å²	6	39.8 Å²	39.8	3%	0.031	22%	0.218	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-114.9	131.1	172.6	-71.4	173.3	0	0	0	111.5	L458 V502 Y579 C580	L458-L464 HydrophobicContact CB-CD1 3.66Å; L458-L464 HydrophobicContact CD2-CD1 4Å; L458-L464 HydrophobicContact CG-CD1 4.37Å; L458-L464 WeakPolarHBondContact O-CD1 3.47Å; L464-V502 HydrophobicContact CB-CB 4.02Å; L464-V502 HydrophobicContact CB-CG2 3.96Å; L464-V502 PolarHBondContact O-N 2.87Å; L464-Y579 HydrophobicContact CD2-CD1 3.6Å; L464-Y579 HydrophobicContact CD2-CD2 4.36Å; L464-Y579 HydrophobicContact CD2-CE1 3.61Å; L464-Y579 HydrophobicContact CD2-CE2 4.39Å; L464-Y579 HydrophobicContact CD2-CG 4Å; L464-Y579 HydrophobicContact CG-CD1 4.33Å; L464-Y579 HydrophobicContact CG-CE1 4.24Å; L464-C580 VanDerWaalsContact C-SG 3.57Å
465	E	81.1	Confident	73.6	Confident	20 Å²	20	39.5 Å²	39.5	9%	0.093	21%	0.213	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-113.9	127.4	165.8	54.5	-171.8	-169.1	0	0	110.2	Q493 H499 L500 L501 L577 T578 C580	E465-Q493 PolarHBondContact OE1-NE2 2.8Å; E465-H499 IonicContact OE1-CE1 3.13Å; E465-H499 PolarHBondContact OE1-CE1 2.97Å; E465-H499 IonicContact OE1-ND1 3.41Å; E465-H499 PolarHBondContact OE1-ND1 3.38Å; E465-H499 IonicContact OE2-CE1 3.99Å; E465-H499 IonicContact OE2-CG 3.91Å; E465-H499 IonicContact OE2-ND1 3.73Å; E465-H499 PolarHBondContact OE2-ND1 3.09Å; E465-L500 CarbonylContact C-O 3.58Å; E465-L500 VanDerWaalsContact CA-O 3.29Å; E465-L500 WeakPolarHBondContact CA-O 3.36Å; E465-L501 HydrophobicContact CB-CD2 4.25Å; E465-L577 CarbonylContact O-C 3.36Å; E465-T578 WeakPolarHBondContact CG-OG1 3.13Å; E465-T578 PolarHBondContact N-O 3.45Å; E465-T578 PolarHBondContact O-N 2.86Å; E465-T578 PolarHBondContact O-OG1 2.83Å; E465-C580 WeakPolarHBondContact CB-SG 3.5Å; E465-C580 VanDerWaalsContact CG-SG 3.55Å; E465-C580 PolarHBondContact N-SG 2.93Å; E465-C580 VanDerWaalsContact N-SG 3.43Å
466	M	86.8	Confident	75.3	Confident	1 Å²	1	40.6 Å²	40.6	1%	0.005	22%	0.219	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-78.2	130.1	159.2	-162.8	168.3	62.8	0	0	107.8	F434 I435 A438 H499 L500 M516 L575 V576 L577	F434-M466 HydrophobicContact CB-CE 4.26Å; F434-M466 HydrophobicContact CB-SD 4.03Å; I435-M466 HydrophobicContact CB-CE 4.3Å; I435-M466 HydrophobicContact CG1-CE 3.47Å; I435-M466 VanDerWaalsContact CG1-CE 3.47Å; A438-M466 HydrophobicContact CB-CE 4.16Å; M466-H499 CarbonylContact O-C 3.53Å; M466-H499 WeakPolarHBondContact O-CA 3.09Å; M466-L500 HydrophobicContact CE-CD2 4.03Å; M466-L500 PolarHBondContact N-O 3.49Å; M466-L500 PolarHBondContact O-N 3.2Å; M466-M516 HydrophobicContact CE-CE 4.34Å; M466-M516 HydrophobicContact CE-SD 4.43Å; M466-M516 HydrophobicContact CG-CE 4.24Å; M466-M516 VanDerWaalsContact O-SD 3.35Å; M466-L575 HydrophobicContact CE-CD1 4.31Å; M466-L575 HydrophobicContact CE-CD2 4.45Å; M466-L575 HydrophobicContact CG-CD1 3.78Å; M466-L575 HydrophobicContact CG-CG 4.16Å; M466-L575 HydrophobicContact SD-CD1 4Å; M466-L575 HydrophobicContact SD-CD2 3.95Å; M466-L575 HydrophobicContact SD-CG 4.01Å; M466-V576 CarbonylContact C-O 3.55Å; M466-V576 WeakPolarHBondContact CA-O 3.25Å; M466-L577 HydrophobicContact CB-CD2 3.77Å; M466-L577 HydrophobicContact CG-CD2 3.94Å; M466-L577 HydrophobicContact SD-CD2 4.39Å
467	C	89.2	Confident	76.4	Confident	0 Å²	0	41.5 Å²	41.5	0%	0	23%	0.226	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-146.2	152.9	-178.6	68.3	0	0	0	0	111.8	H499 V576	C467-H499 HydrophobicContact CB-CB 4.31Å; C467-V576 PolarHBondContact N-O 3.11Å; C467-V576 PolarHBondContact O-N 2.79Å; C467-V576 VanDerWaalsContact O-N 3.12Å
468	W	92.6	Very high	77.1	Confident	0 Å²	0	43.7 Å²	43.7	0%	0	24%	0.238	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-77.7	138.1	167.2	-68.6	109.1	0	0	0	110.3	V431 S494 H498 M516 P519 F521 Y545 I573 C574 L575	V431-W468 HydrophobicContact CG1-CZ2 3.94Å; V431-W468 HydrophobicContact CG2-CH2 4.09Å; V431-W468 HydrophobicContact CG2-CZ2 4.25Å; W468-S494 WeakPolarHBondContact O-CB 3.37Å; W468-S494 PolarHBondContact O-N 3.24Å; W468-S494 PolarHBondContact O-OG 2.87Å; W468-H498 PolarHBondContact N-O 3.02Å; W468-M516 HydrophobicContact CG-CE 4.25Å; W468-M516 PolarHBondContact NE1-O 3.24Å; W468-M516 VanDerWaalsContact NE1-O 3.12Å; W468-P519 HydrophobicContact CZ2-CG 4.36Å; W468-F521 HydrophobicContact CB-CE1 3.91Å; W468-F521 HydrophobicContact CB-CZ 3.85Å; W468-F521 HydrophobicContact CD2-CZ 4.1Å; W468-F521 HydrophobicContact CG-CE1 4.17Å; W468-F521 AromaticContact CG-CZ 3.72Å; W468-F521 HydrophobicContact CG-CZ 3.72Å; W468-Y545 AromaticContact CH2-CD2 3.93Å; W468-Y545 HydrophobicContact CH2-CD2 3.93Å; W468-Y545 HydrophobicContact CH2-CG 4.45Å; W468-Y545 HydrophobicContact CZ2-CD2 4.03Å; W468-Y545 HydrophobicContact CZ3-CD2 4.46Å; W468-I573 HydrophobicContact CB-CG2 4.11Å; W468-I573 HydrophobicContact CD2-CG2 4.43Å; W468-I573 HydrophobicContact CE3-CG2 3.92Å; W468-C574 WeakPolarHBondContact CA-O 3.33Å; W468-L575 HydrophobicContact CD2-CD1 4.07Å; W468-L575 HydrophobicContact CE3-CB 4.03Å; W468-L575 HydrophobicContact CE3-CD1 4.22Å; W468-L575 HydrophobicContact CH2-CB 4.07Å; W468-L575 HydrophobicContact CH2-CD1 4.34Å; W468-L575 HydrophobicContact CZ2-CD1 4.18Å; W468-L575 HydrophobicContact CZ3-CB 3.68Å; W468-L575 HydrophobicContact CZ3-CD1 4.35Å
469	V	92.1	Very high	77.4	Confident	1 Å²	1	46.9 Å²	46.9	1%	0.006	26%	0.256	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-134.2	144.4	177	-58.4	0	0	0	0	110.2	F491 I492 Q493 L532 I573 C574 V576	V469-F491 HydrophobicContact CB-CB 4.11Å; V469-F491 HydrophobicContact CB-CD1 4.39Å; V469-F491 HydrophobicContact CG2-CB 4.1Å; V469-F491 HydrophobicContact CG2-CD1 3.61Å; V469-F491 HydrophobicContact CG2-CE1 4.22Å; V469-F491 HydrophobicContact CG2-CG 3.99Å; V469-I492 WeakPolarHBondContact CA-O 3.24Å; V469-Q493 HydrophobicContact CG1-CG 4.33Å; V469-L532 HydrophobicContact CG1-CD1 3.99Å; V469-I573 CarbonylContact O-C 3.59Å; V469-I573 WeakPolarHBondContact O-CA 3.32Å; V469-C574 HydrophobicContact CG2-CB 4.12Å; V469-C574 PolarHBondContact N-O 2.81Å; V469-C574 PolarHBondContact O-N 3.44Å; V469-V576 HydrophobicContact CB-CG2 4.24Å; V469-V576 HydrophobicContact CG1-CG2 3.48Å; V469-V576 VanDerWaalsContact CG1-CG2 3.48Å; V469-V576 HydrophobicContact CG2-CB 4.48Å; V469-V576 HydrophobicContact CG2-CG1 3.95Å; V469-V576 HydrophobicContact CG2-CG2 3.65Å
470	K	94	Very high	77.2	Confident	52 Å²	52	53 Å²	53	23%	0.226	29%	0.287	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-101.7	124.5	-179.7	-174	-179.1	177.5	-162.7	0	110.5	F491 I492 F526 D571 I573	K470-F491 CarbonylContact O-C 3.58Å; K470-F491 WeakPolarHBondContact O-CA 3.41Å; K470-I492 PolarHBondContact N-O 3.15Å; K470-I492 PolarHBondContact O-N 2.98Å; K470-F526 HydrophobicContact CB-CD1 3.59Å; K470-F526 HydrophobicContact CB-CD2 4.29Å; K470-F526 HydrophobicContact CB-CE1 3.64Å; K470-F526 HydrophobicContact CB-CE2 4.34Å; K470-F526 HydrophobicContact CB-CG 3.93Å; K470-F526 HydrophobicContact CB-CZ 4.03Å; K470-F526 HydrophobicContact CD-CD2 4.19Å; K470-F526 HydrophobicContact CD-CG 4.34Å; K470-D571 VanDerWaalsContact CE-CA 3.49Å; K470-D571 WeakPolarHBondContact CE-OD1 3.33Å; K470-D571 VanDerWaalsContact NZ-CG 3.3Å; K470-D571 IonicContact NZ-OD1 3.73Å; K470-D571 PolarHBondContact NZ-OD1 2.87Å; K470-D571 IonicContact NZ-OD2 2.95Å; K470-I573 HydrophobicContact CB-CG1 4.37Å; K470-I573 HydrophobicContact CG-CG1 4.21Å
471	L	94.5	Very high	77.5	Confident	0 Å²	0	57.8 Å²	57.8	0%	0	31%	0.307	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-71.3	125.9	175.4	-179	53.7	0	0	0	109.8	Q473 I474 L489 F491 L568 K569 D571 D572	L471-Q473 WeakPolarHBondContact CD1-O 3.46Å; L471-I474 HydrophobicContact CD1-CG1 4.41Å; L471-I474 HydrophobicContact CD2-CD1 4.15Å; L471-I474 HydrophobicContact CD2-CG1 4.04Å; L471-I474 HydrophobicContact CG-CG1 4.46Å; L471-L489 HydrophobicContact CD1-CB 4.19Å; L471-L489 HydrophobicContact CD1-CD2 4.2Å; L471-F491 HydrophobicContact CB-CD1 3.84Å; L471-F491 HydrophobicContact CB-CE1 3.82Å; L471-F491 HydrophobicContact CD1-CD1 4.06Å; L471-F491 HydrophobicContact CD1-CE1 3.84Å; L471-F491 HydrophobicContact CD1-CE2 4.46Å; L471-F491 HydrophobicContact CD1-CG 4.47Å; L471-F491 HydrophobicContact CD1-CZ 4.07Å; L471-F491 HydrophobicContact CG-CE1 4.26Å; L471-L568 HydrophobicContact CD2-CD1 4Å; L471-L568 HydrophobicContact CD2-CD2 3.75Å; L471-L568 HydrophobicContact CD2-CG 3.59Å; L471-K569 WeakPolarHBondContact CD2-O 3.17Å; L471-D571 WeakPolarHBondContact O-CA 3.34Å; L471-D571 PolarHBondContact O-N 3.24Å; L471-D572 PolarHBondContact N-O 2.86Å
472	I	93.6	Very high	77.5	Confident	48 Å²	48	60.2 Å²	60.2	25%	0.246	32%	0.323	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-117.6	-17.2	-179.3	61.7	156.5	0	0	0	114.2	T490 I492 K531 T570	I472-T490 HydrophobicContact CD1-CG2 3.87Å; I472-T490 HydrophobicContact CG1-CG2 3.89Å; I472-T490 WeakPolarHBondContact CG1-O 3.38Å; I472-T490 PolarHBondContact N-O 3.27Å; I472-I492 HydrophobicContact CD1-CD1 4.11Å; I472-I492 HydrophobicContact CD1-CG1 3.92Å; I472-I492 HydrophobicContact CG1-CG1 4.27Å; I472-I492 HydrophobicContact CG2-CD1 3.74Å; I472-I492 HydrophobicContact CG2-CG1 3.84Å; I472-K531 HydrophobicContact CD1-CD 4.48Å; I472-T570 WeakPolarHBondContact O-CG2 3.49Å
473	Q	93.6	Very high	77.9	Confident	94 Å²	94	61.4 Å²	61.4	44%	0.439	33%	0.333	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-156.2	135.9	177.9	-172.1	172.5	-8.9	0	0	110.8	L471 L489 T490	L471-Q473 WeakPolarHBondContact CD1-O 3.46Å; Q473-L489 WeakPolarHBondContact O-CA 3.11Å; Q473-T490 PolarHBondContact N-O 2.88Å; Q473-T490 PolarHBondContact O-N 3.26Å
474	I	93.7	Very high	77.6	Confident	45 Å²	45	61.5 Å²	61.5	23%	0.231	33%	0.333	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-108.8	130.8	162.5	-52.1	-178.3	0	0	0	106.2	L471 L489	L471-I474 HydrophobicContact CD1-CG1 4.41Å; L471-I474 HydrophobicContact CD2-CD1 4.15Å; L471-I474 HydrophobicContact CD2-CG1 4.04Å; L471-I474 HydrophobicContact CG-CG1 4.46Å; I474-L489 HydrophobicContact CB-CD2 4.08Å; I474-L489 HydrophobicContact CD1-CD2 4.47Å; I474-L489 HydrophobicContact CG1-CD2 3.75Å; I474-L489 HydrophobicContact CG2-CD2 3.84Å
475	K	91	Very high	77.7	Confident	80 Å²	80	65.9 Å²	65.9	35%	0.348	36%	0.356	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-135.2	101.8	176.5	168.8	175	148	-93.6	0	108.9	E488	K475-E488 HydrophobicContact CB-CB 4.28Å; K475-E488 WeakPolarHBondContact CD-OE1 3.44Å; K475-E488 PolarHBondContact N-O 2.84Å; K475-E488 IonicContact NZ-OE1 2.73Å; K475-E488 PolarHBondContact NZ-OE1 3.28Å; K475-E488 IonicContact NZ-OE2 2.73Å; K475-E488 PolarHBondContact NZ-OE2 2.87Å; K475-E488 PolarHBondContact O-N 3.4Å
476	N	83.9	Confident	77.8	Confident	82 Å²	82	67.3 Å²	67.3	44%	0.439	37%	0.369	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-62.1	138.2	173.1	-50.4	38.1	0	0	0	108.8	S478	N476-S478 PolarHBondContact O-N 3.26Å
477	D	68.3	Low	77.9	Confident	69 Å²	69	67.4 Å²	67.4	37%	0.369	37%	0.369	S	S	.	.			trans	-76.6	115.8	177.4	-167.2	34.4	0	0	0	110.3	N479 N484 S486	D477-N479 VanDerWaalsContact C-N 3.31Å; D477-N479 PolarHBondContact O-N 3.07Å; D477-N479 PolarHBondContact OD1-ND2 2.99Å; D477-N479 PolarHBondContact OD2-ND2 3.33Å; D477-N484 PolarHBondContact O-ND2 2.95Å; D477-N484 PolarHBondContact O-OD1 3.07Å; D477-S486 PolarHBondContact N-O 3.46Å
478	S	60.4	Low	77.9	Confident	95 Å²	95	70 Å²	70	66%	0.664	38%	0.381	S	S	*	.			trans	-95.1	36.6	-169.4	68.9	0	0	0	0	113.2	N476 N480	N476-S478 PolarHBondContact O-N 3.26Å; S478-N480 PolarHBondContact O-N 3.4Å
479	N	58.2	Low	77.9	Confident	102 Å²	102	70 Å²	70	55%	0.545	38%	0.381	S	S	.	.			trans	-89.9	79.4	-171.8	-79.2	-38.4	0	0	0	112.9	D477	D477-N479 VanDerWaalsContact C-N 3.31Å; D477-N479 PolarHBondContact O-N 3.07Å; D477-N479 PolarHBondContact OD1-ND2 2.99Å; D477-N479 PolarHBondContact OD2-ND2 3.33Å
480	N	47.5	Very low	77.8	Confident	136 Å²	136	70.5 Å²	70.5	73%	0.727	38%	0.384	S	S	*	.	S	Bend	trans	52.9	101.4	157.7	-61.3	-29.2	0	0	0	118.3	S478 T482	S478-N480 PolarHBondContact O-N 3.4Å; N480-T482 PolarHBondContact O-N 3.15Å
481	N	54.5	Low	77.8	Confident	177 Å²	177	68.1 Å²	68.1	95%	0.947	37%	0.374	S	S	*	.	S	Bend	trans	64.4	-6.8	156.4	-61.9	-4.5	0	0	0	119.1
482	T	55.8	Low	77.6	Confident	106 Å²	106	69.7 Å²	69.7	65%	0.65	38%	0.382	S	S	*	.	S	Bend	trans	-88.3	156.6	162.5	44.5	0	0	0	0	110.7	N480 N484	N480-T482 PolarHBondContact O-N 3.15Å; T482-N484 PolarHBondContact O-N 2.85Å; T482-N484 PolarHBondContact O-OD1 3.15Å
483	V	61.2	Low	77.4	Confident	117 Å²	117	67.8 Å²	67.8	71%	0.709	37%	0.372	S	S	*	.			trans	-64.6	128.7	173.6	178.8	0	0	0	0	108.5	L485	V483-L485 HydrophobicContact CB-CG 4.38Å; V483-L485 HydrophobicContact CG1-CD2 4.15Å; V483-L485 HydrophobicContact CG1-CG 4.18Å; V483-L485 PolarHBondContact O-N 3.28Å
484	N	62.4	Low	77.2	Confident	61 Å²	61	63.4 Å²	63.4	33%	0.326	35%	0.352	S	S	.	.			trans	-72.1	63.6	-175.1	-63	7.3	0	0	0	112.3	D477 T482 S486 N538	D477-N484 PolarHBondContact O-ND2 2.95Å; D477-N484 PolarHBondContact O-OD1 3.07Å; T482-N484 PolarHBondContact O-N 2.85Å; T482-N484 PolarHBondContact O-OD1 3.15Å; N484-S486 PolarHBondContact O-N 3.42Å; N484-N538 PolarHBondContact O-ND2 3.4Å
485	L	76.6	Confident	76.8	Confident	98 Å²	98	62.3 Å²	62.3	51%	0.513	35%	0.348	S	S	.	.			trans	-65.7	-3.4	-175.9	-69.5	169.5	0	0	0	114.5	V483 T537 N538 L556	V483-L485 HydrophobicContact CB-CG 4.38Å; V483-L485 HydrophobicContact CG1-CD2 4.15Å; V483-L485 HydrophobicContact CG1-CG 4.18Å; V483-L485 PolarHBondContact O-N 3.28Å; L485-T537 CarbonylContact O-C 3.56Å; L485-T537 VanDerWaalsContact O-CA 3.22Å; L485-T537 WeakPolarHBondContact O-CA 3.48Å; L485-N538 PolarHBondContact O-N 3.09Å; L485-L556 HydrophobicContact CD2-CD2 4.46Å
486	S	83.7	Confident	76.5	Confident	50 Å²	50	66 Å²	66	35%	0.35	36%	0.364	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-138.9	151.4	179.8	70.4	0	0	0	0	113.4	D477 N484 V536 N538	D477-S486 PolarHBondContact N-O 3.46Å; N484-S486 PolarHBondContact O-N 3.42Å; S486-V536 CarbonylContact C-O 3.59Å; S486-V536 WeakPolarHBondContact CA-O 3.48Å; S486-V536 VanDerWaalsContact CB-O 3.32Å; S486-V536 WeakPolarHBondContact CB-O 3.36Å; S486-N538 VanDerWaalsContact C-OD1 3.29Å; S486-N538 WeakPolarHBondContact CA-OD1 3.21Å
487	S	88.4	Confident	76.5	Confident	2 Å²	2	65.9 Å²	65.9	1%	0.014	36%	0.358	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-136.6	145.1	-179.6	-60.3	0	0	0	0	112	V536 N538	S487-V536 PolarHBondContact N-O 2.88Å; S487-V536 PolarHBondContact O-N 3.48Å; S487-V536 VanDerWaalsContact O-N 3.08Å; S487-N538 PolarHBondContact N-OD1 3.3Å; S487-N538 PolarHBondContact OG-OD1 3.41Å
488	E	90.2	Very high	77.3	Confident	55 Å²	55	62.7 Å²	62.7	26%	0.257	34%	0.341	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-84.6	113.1	168.7	-178.8	-176.8	91	0	0	109.2	K475 V533 L534 N535	K475-E488 HydrophobicContact CB-CB 4.28Å; K475-E488 WeakPolarHBondContact CD-OE1 3.44Å; K475-E488 PolarHBondContact N-O 2.84Å; K475-E488 IonicContact NZ-OE1 2.73Å; K475-E488 PolarHBondContact NZ-OE1 3.28Å; K475-E488 IonicContact NZ-OE2 2.73Å; K475-E488 PolarHBondContact NZ-OE2 2.87Å; K475-E488 PolarHBondContact O-N 3.4Å; E488-V533 HydrophobicContact CG-CG1 3.61Å; E488-L534 CarbonylContact C-O 3.6Å; E488-L534 WeakPolarHBondContact CA-O 3.47Å; E488-N535 WeakPolarHBondContact CG-OD1 3.49Å
489	L	91.8	Very high	78.6	Confident	0 Å²	0	58.4 Å²	58.4	0%	0	31%	0.31	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-99.7	128.4	174.6	-60	-179.1	0	0	0	109.8	L471 Q473 I474 F491 V533 L534 V536 F542 I552 L568	L471-L489 HydrophobicContact CD1-CB 4.19Å; L471-L489 HydrophobicContact CD1-CD2 4.2Å; Q473-L489 WeakPolarHBondContact O-CA 3.11Å; I474-L489 HydrophobicContact CB-CD2 4.08Å; I474-L489 HydrophobicContact CD1-CD2 4.47Å; I474-L489 HydrophobicContact CG1-CD2 3.75Å; I474-L489 HydrophobicContact CG2-CD2 3.84Å; L489-F491 HydrophobicContact CB-CD2 4.27Å; L489-F491 HydrophobicContact CB-CE2 3.5Å; L489-F491 VanDerWaalsContact CB-CE2 3.5Å; L489-F491 HydrophobicContact CB-CZ 3.98Å; L489-F491 HydrophobicContact CD1-CE2 4.06Å; L489-F491 HydrophobicContact CD1-CZ 3.85Å; L489-F491 HydrophobicContact CG-CE2 4.45Å; L489-V533 CarbonylContact O-C 3.58Å; L489-V533 WeakPolarHBondContact O-CA 3.49Å; L489-L534 HydrophobicContact CB-CB 4.28Å; L489-L534 PolarHBondContact N-O 3.02Å; L489-L534 PolarHBondContact O-N 2.89Å; L489-V536 HydrophobicContact CD1-CG2 3.57Å; L489-V536 HydrophobicContact CG-CG2 4.02Å; L489-F542 HydrophobicContact CD1-CE1 4.43Å; L489-F542 HydrophobicContact CD1-CE2 3.52Å; L489-F542 HydrophobicContact CD1-CZ 3.44Å; L489-F542 VanDerWaalsContact CD1-CZ 3.44Å; L489-I552 HydrophobicContact CD1-CD1 4.17Å; L489-I552 HydrophobicContact CD2-CD1 4.1Å; L489-I552 HydrophobicContact CD2-CG1 4.23Å; L489-I552 HydrophobicContact CG-CD1 4.32Å; L489-L568 HydrophobicContact CD1-CD2 4.26Å
490	T	91.6	Very high	79.9	Confident	12 Å²	12	53.6 Å²	53.6	7%	0.074	28%	0.284	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-109.8	123.9	171.4	-56.6	0	0	0	0	110.7	I472 Q473 K531 L532 V533	I472-T490 HydrophobicContact CD1-CG2 3.87Å; I472-T490 HydrophobicContact CG1-CG2 3.89Å; I472-T490 WeakPolarHBondContact CG1-O 3.38Å; I472-T490 PolarHBondContact N-O 3.27Å; Q473-T490 PolarHBondContact N-O 2.88Å; Q473-T490 PolarHBondContact O-N 3.26Å; T490-K531 HydrophobicContact CG2-CB 4.3Å; T490-K531 HydrophobicContact CG2-CD 4.18Å; T490-L532 WeakPolarHBondContact CA-O 3.42Å; T490-V533 HydrophobicContact CG2-CG2 4.28Å
491	F	92.3	Very high	81.6	Confident	2 Å²	2	49.2 Å²	49.2	1%	0.009	26%	0.261	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-113.5	157.3	176.8	-56.1	-96.5	0	0	0	111.6	V469 K470 L471 L489 K531 L532 L534 F542 C574	V469-F491 HydrophobicContact CB-CB 4.11Å; V469-F491 HydrophobicContact CB-CD1 4.39Å; V469-F491 HydrophobicContact CG2-CB 4.1Å; V469-F491 HydrophobicContact CG2-CD1 3.61Å; V469-F491 HydrophobicContact CG2-CE1 4.22Å; V469-F491 HydrophobicContact CG2-CG 3.99Å; K470-F491 CarbonylContact O-C 3.58Å; K470-F491 WeakPolarHBondContact O-CA 3.41Å; L471-F491 HydrophobicContact CB-CD1 3.84Å; L471-F491 HydrophobicContact CB-CE1 3.82Å; L471-F491 HydrophobicContact CD1-CD1 4.06Å; L471-F491 HydrophobicContact CD1-CE1 3.84Å; L471-F491 HydrophobicContact CD1-CE2 4.46Å; L471-F491 HydrophobicContact CD1-CG 4.47Å; L471-F491 HydrophobicContact CD1-CZ 4.07Å; L471-F491 HydrophobicContact CG-CE1 4.26Å; L489-F491 HydrophobicContact CB-CD2 4.27Å; L489-F491 HydrophobicContact CB-CE2 3.5Å; L489-F491 VanDerWaalsContact CB-CE2 3.5Å; L489-F491 HydrophobicContact CB-CZ 3.98Å; L489-F491 HydrophobicContact CD1-CE2 4.06Å; L489-F491 HydrophobicContact CD1-CZ 3.85Å; L489-F491 HydrophobicContact CG-CE2 4.45Å; F491-K531 CarbonylContact O-C 3.49Å; F491-K531 VanDerWaalsContact O-CA 3.28Å; F491-K531 WeakPolarHBondContact O-CA 3.12Å; F491-L532 HydrophobicContact CB-CB 4.41Å; F491-L532 PolarHBondContact N-O 3.02Å; F491-L532 PolarHBondContact O-N 3.24Å; F491-L534 HydrophobicContact CD2-CD1 4.35Å; F491-L534 HydrophobicContact CE2-CB 4.15Å; F491-L534 HydrophobicContact CE2-CD1 3.74Å; F491-L534 HydrophobicContact CE2-CG 4.5Å; F491-F542 HydrophobicContact CE2-CE1 4.45Å; F491-F542 HydrophobicContact CZ-CD1 4.31Å; F491-F542 AromaticContact CZ-CE1 3.82Å; F491-F542 HydrophobicContact CZ-CE1 3.82Å; F491-F542 HydrophobicContact CZ-CZ 4.15Å; F491-C574 HydrophobicContact CE1-CB 4.17Å
492	I	91.3	Very high	82.6	Confident	33 Å²	33	41.7 Å²	41.7	17%	0.169	22%	0.221	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-104.5	128	164.4	-65.6	-179.3	0	0	0	109	V469 K470 I472 F526 V528	V469-I492 WeakPolarHBondContact CA-O 3.24Å; K470-I492 PolarHBondContact N-O 3.15Å; K470-I492 PolarHBondContact O-N 2.98Å; I472-I492 HydrophobicContact CD1-CD1 4.11Å; I472-I492 HydrophobicContact CD1-CG1 3.92Å; I472-I492 HydrophobicContact CG1-CG1 4.27Å; I472-I492 HydrophobicContact CG2-CD1 3.74Å; I472-I492 HydrophobicContact CG2-CG1 3.84Å; I492-F526 HydrophobicContact CG2-CB 4.07Å; I492-F526 WeakPolarHBondContact CG2-O 3.4Å; I492-V528 WeakPolarHBondContact CG2-O 3.43Å
493	Q	88.9	Confident	83.2	Confident	7 Å²	7	37.2 Å²	37.2	3%	0.033	20%	0.196	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-68.1	139.6	175.5	-157.7	-176.9	32.4	0	0	110.4	E465 V469 H499 K530 L532 T578	E465-Q493 PolarHBondContact OE1-NE2 2.8Å; V469-Q493 HydrophobicContact CG1-CG 4.33Å; Q493-H499 VanDerWaalsContact CD-CE1 3.47Å; Q493-H499 PolarHBondContact NE2-CE1 3.09Å; Q493-H499 VanDerWaalsContact NE2-CE1 3.3Å; Q493-K530 HydrophobicContact CB-CB 4.01Å; Q493-K530 HydrophobicContact CB-CD 4.38Å; Q493-K530 PolarHBondContact N-O 3.38Å; Q493-L532 HydrophobicContact CB-CD1 4.18Å; Q493-L532 HydrophobicContact CG-CD1 4.28Å; Q493-T578 PolarHBondContact NE2-OG1 3.49Å
494	S	89.3	Confident	83.5	Confident	2 Å²	2	34.9 Å²	34.9	1%	0.014	18%	0.177	C	C	.	.	P	Polyproline II helix	trans	-69.8	171.3	174.4	64	0	0	0	0	113.1	W468 H498 H499 S525	W468-S494 WeakPolarHBondContact O-CB 3.37Å; W468-S494 PolarHBondContact O-N 3.24Å; W468-S494 PolarHBondContact O-OG 2.87Å; S494-H498 WeakPolarHBondContact OG-CB 3.44Å; S494-H499 PolarHBondContact O-NE2 2.84Å; S494-S525 CarbonylContact C-O 3.5Å; S494-S525 WeakPolarHBondContact CA-O 3.31Å
495	S	86	Confident	83.3	Confident	22 Å²	22	35.8 Å²	35.8	15%	0.154	18%	0.181	C	C	.	.	P	Polyproline II helix	trans	-67.9	140.3	169.5	64.3	0	0	0	0	110.7	R497 H498 S525	S495-R497 PolarHBondContact O-N 3.36Å; S495-R497 WeakPolarHBondContact OG-CD 3.2Å; S495-R497 WeakPolarHBondContact OG-CG 3.11Å; S495-R497 PolarHBondContact OG-NE 3.35Å; S495-H498 PolarHBondContact O-N 3.19Å; S495-S525 PolarHBondContact N-O 3.25Å
496	K	83.9	Confident	82.4	Confident	157 Å²	157	32.8 Å²	32.8	68%	0.683	17%	0.165	S	C	*	.	G	3₁₀ helix	trans	-47.9	-11	-177.7	-62.6	-170.3	176.6	-169.1	0	117.5	H498	K496-H498 VanDerWaalsContact C-N 3.27Å
497	R	83.3	Confident	81.2	Confident	80 Å²	80	37.9 Å²	37.9	30%	0.302	18%	0.181	S	C	.	.	G	3₁₀ helix	trans	-73.3	-15.9	172.6	78.7	-160.3	-176.4	101.4	4.4	113.9	S495 R515 H520 N522 S525	S495-R497 PolarHBondContact O-N 3.36Å; S495-R497 WeakPolarHBondContact OG-CD 3.2Å; S495-R497 WeakPolarHBondContact OG-CG 3.11Å; S495-R497 PolarHBondContact OG-NE 3.35Å; R497-R515 WeakPolarHBondContact O-CD 3.48Å; R497-H520 PolarHBondContact NH1-O 3.06Å; R497-H520 PolarHBondContact NH2-O 3.1Å; R497-N522 PolarHBondContact NH2-OD1 3.5Å; R497-S525 PolarHBondContact NH2-OG 2.96Å
498	H	85.9	Confident	79.8	Confident	3 Å²	3	43.8 Å²	43.8	1%	0.014	21%	0.212	C	C	.	.	G	3₁₀ helix	trans	-111.1	23.1	-179.9	-63.4	-50.2	0	0	0	112.2	W468 S494 S495 K496 R515 H520 F521	W468-H498 PolarHBondContact N-O 3.02Å; S494-H498 WeakPolarHBondContact OG-CB 3.44Å; S495-H498 PolarHBondContact O-N 3.19Å; K496-H498 VanDerWaalsContact C-N 3.27Å; H498-R515 PolarHBondContact CE1-O 2.73Å; H498-H520 PolarHBondContact NE2-N 3.42Å; H498-H520 PolarHBondContact NE2-O 3.43Å; H498-F521 AromaticContact CD2-CD1 3.85Å; H498-F521 AromaticContact CD2-CE1 3.87Å
499	H	87.7	Confident	78.7	Confident	5 Å²	5	41.3 Å²	41.3	2%	0.023	20%	0.2	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-113.7	147.6	177.7	-63.7	-153.2	0	0	0	108.9	E465 M466 C467 Q493 S494 Q512	E465-H499 IonicContact OE1-CE1 3.13Å; E465-H499 PolarHBondContact OE1-CE1 2.97Å; E465-H499 IonicContact OE1-ND1 3.41Å; E465-H499 PolarHBondContact OE1-ND1 3.38Å; E465-H499 IonicContact OE2-CE1 3.99Å; E465-H499 IonicContact OE2-CG 3.91Å; E465-H499 IonicContact OE2-ND1 3.73Å; E465-H499 PolarHBondContact OE2-ND1 3.09Å; M466-H499 CarbonylContact O-C 3.53Å; M466-H499 WeakPolarHBondContact O-CA 3.09Å; C467-H499 HydrophobicContact CB-CB 4.31Å; Q493-H499 VanDerWaalsContact CD-CE1 3.47Å; Q493-H499 PolarHBondContact NE2-CE1 3.09Å; Q493-H499 VanDerWaalsContact NE2-CE1 3.3Å; S494-H499 PolarHBondContact O-NE2 2.84Å; H499-Q512 PolarHBondContact O-NE2 2.81Å
500	L	85.8	Confident	77.7	Confident	0 Å²	0	43.7 Å²	43.7	0%	0	22%	0.217	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-131.4	127.3	176.3	178.7	77.9	0	0	0	108	I435 A438 I439 E465 M466 V502 C509 Q512 A513 M516	I435-L500 HydrophobicContact CB-CD2 4.49Å; I435-L500 HydrophobicContact CG1-CD2 4.38Å; I435-L500 HydrophobicContact CG2-CD2 4.07Å; A438-L500 HydrophobicContact CB-CD2 3.87Å; I439-L500 HydrophobicContact CD1-CD1 4.09Å; I439-L500 HydrophobicContact CD1-CD2 4.17Å; I439-L500 HydrophobicContact CG1-CD1 4.12Å; I439-L500 HydrophobicContact CG1-CD2 3.97Å; I439-L500 HydrophobicContact CG1-CG 4.41Å; E465-L500 CarbonylContact C-O 3.58Å; E465-L500 VanDerWaalsContact CA-O 3.29Å; E465-L500 WeakPolarHBondContact CA-O 3.36Å; M466-L500 HydrophobicContact CE-CD2 4.03Å; M466-L500 PolarHBondContact N-O 3.49Å; M466-L500 PolarHBondContact O-N 3.2Å; L500-V502 PolarHBondContact O-N 3.19Å; L500-C509 HydrophobicContact CD1-CB 4.05Å; L500-C509 VanDerWaalsContact CD1-SG 3.52Å; L500-Q512 HydrophobicContact CD1-CB 3.94Å; L500-A513 HydrophobicContact CD1-CB 4.33Å; L500-M516 HydrophobicContact CB-CG 4.23Å; L500-M516 HydrophobicContact CB-SD 3.32Å; L500-M516 WeakPolarHBondContact CB-SD 3.47Å; L500-M516 HydrophobicContact CD2-SD 4.44Å
501	L	82	Confident	77.1	Confident	45 Å²	45	51 Å²	51	24%	0.236	25%	0.248	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-78.9	123.3	177.3	-64.3	172.1	0	0	0	108.9	E465 K504 C580	E465-L501 HydrophobicContact CB-CD2 4.25Å; L501-K504 HydrophobicContact CB-CB 4.46Å; L501-K504 HydrophobicContact CB-CD 3.75Å; L501-K504 HydrophobicContact CB-CG 3.96Å; L501-K504 HydrophobicContact CD1-CD 3.82Å; L501-K504 HydrophobicContact CG-CD 4.42Å; L501-C580 WeakPolarHBondContact CD2-SG 3.15Å
502	V	77.4	Confident	76.6	Confident	18 Å²	18	53.4 Å²	53.4	11%	0.109	26%	0.259	C	S	.	.	T	Hydrogen-bonded Turn	trans	-68.7	141	178.6	-177.3	0	0	0	0	109.1	A438 L464 L500 K504 L577	A438-V502 HydrophobicContact CB-CG2 4.27Å; A438-V502 WeakPolarHBondContact O-CA 3.43Å; L464-V502 HydrophobicContact CB-CB 4.02Å; L464-V502 HydrophobicContact CB-CG2 3.96Å; L464-V502 PolarHBondContact O-N 2.87Å; L500-V502 PolarHBondContact O-N 3.19Å; V502-K504 PolarHBondContact O-N 2.94Å; V502-L577 HydrophobicContact CG2-CD2 3.87Å
503	G	68.2	Low	76.2	Confident	13 Å²	13	52 Å²	52	13%	0.134	25%	0.252	C	S	.	.	T	Hydrogen-bonded Turn	trans	65.3	36.2	176.6	0	0	0	0	0	114.4	A438	A438-G503 PolarHBondContact O-N 2.85Å
504	K	66.3	Low	76.1	Confident	68 Å²	68	53.6 Å²	53.6	30%	0.296	26%	0.264	S	S	.	.			trans	-121.5	126.6	172.7	-58.3	-155.7	-177.6	-167.7	0	111.8	L501 V502	L501-K504 HydrophobicContact CB-CB 4.46Å; L501-K504 HydrophobicContact CB-CD 3.75Å; L501-K504 HydrophobicContact CB-CG 3.96Å; L501-K504 HydrophobicContact CD1-CD 3.82Å; L501-K504 HydrophobicContact CG-CD 4.42Å; V502-K504 PolarHBondContact O-N 2.94Å
505	N	57.6	Low	75.9	Confident	79 Å²	79	60 Å²	60	42%	0.422	29%	0.288	S	S	.	.			trans	-43.9	138.5	-178.3	57.8	50.2	0	0	0	114.8	K507 N508 C509	N505-K507 PolarHBondContact O-N 2.76Å; N505-N508 PolarHBondContact O-N 3.3Å; N505-N508 PolarHBondContact OD1-ND2 3.35Å; N505-C509 PolarHBondContact O-N 2.85Å
506	E	58.7	Low	76	Confident	36 Å²	36	58.9 Å²	58.9	17%	0.168	28%	0.281	C	S	.	.	H	α-helix	trans	-60.7	-26	-168.4	-29.1	-162.4	153.8	0	0	113.7	F35 N39 I439 K440 N508 C509 S510	F35-E506 WeakPolarHBondContact CE1-OE2 3.15Å; F35-E506 VanDerWaalsContact CZ-CD 3.48Å; F35-E506 WeakPolarHBondContact CZ-OE1 3.4Å; N39-E506 VanDerWaalsContact CB-OE2 3.31Å; N39-E506 WeakPolarHBondContact CB-OE2 3.37Å; N39-E506 VanDerWaalsContact CG-CD 3.41Å; N39-E506 VanDerWaalsContact CG-OE1 3.31Å; N39-E506 PolarHBondContact ND2-OE1 3.45Å; N39-E506 PolarHBondContact ND2-OE2 2.95Å; I439-E506 HydrophobicContact CG2-CB 4.1Å; I439-E506 HydrophobicContact CG2-CG 3.55Å; K440-E506 VanDerWaalsContact CE-OE1 3.24Å; K440-E506 WeakPolarHBondContact CE-OE1 3.36Å; E506-N508 PolarHBondContact O-N 3.07Å; E506-N508 VanDerWaalsContact O-N 3.09Å; E506-C509 PolarHBondContact O-N 3.27Å; E506-S510 PolarHBondContact O-N 3.05Å
507	K	58.7	Low	76.1	Confident	157 Å²	157	52 Å²	52	68%	0.683	25%	0.251	S	S	*	.	H	α-helix	trans	-55.4	-28.6	-178.5	-64.6	-174	176.9	-177.2	0	112.1	N43 N505	N43-K507 PolarHBondContact OD1-NZ 2.94Å; N505-K507 PolarHBondContact O-N 2.76Å
508	N	58.9	Low	76.2	Confident	125 Å²	125	53 Å²	53	67%	0.668	26%	0.255	S	S	*	.	H	α-helix	trans	-101.8	-30.1	171.5	-64.6	-70.9	0	0	0	113.4	N505 E506	N505-N508 PolarHBondContact O-N 3.3Å; N505-N508 PolarHBondContact OD1-ND2 3.35Å; E506-N508 PolarHBondContact O-N 3.07Å; E506-N508 VanDerWaalsContact O-N 3.09Å
509	C	66.5	Low	76.3	Confident	3 Å²	3	53 Å²	53	2%	0.02	26%	0.255	C	S	.	.	H	α-helix	trans	-84.8	-19	-171.9	-106.8	0	0	0	0	115.9	L500 N505 E506 K511 Q512 A513	L500-C509 HydrophobicContact CD1-CB 4.05Å; L500-C509 VanDerWaalsContact CD1-SG 3.52Å; N505-C509 PolarHBondContact O-N 2.85Å; E506-C509 PolarHBondContact O-N 3.27Å; C509-K511 VanDerWaalsContact C-N 3.32Å; C509-K511 PolarHBondContact O-N 3.37Å; C509-K511 VanDerWaalsContact O-N 3.13Å; C509-Q512 CarbonylContact O-C 3.56Å; C509-Q512 WeakPolarHBondContact O-CA 3.1Å; C509-Q512 WeakPolarHBondContact O-CB 3.36Å; C509-Q512 PolarHBondContact O-N 2.79Å; C509-A513 PolarHBondContact O-N 2.81Å
510	S	71.3	Confident	76.3	Confident	50 Å²	50	59.7 Å²	59.7	35%	0.35	29%	0.286	S	S	.	.	H	α-helix	trans	-48.7	-45.1	-173.5	55.6	0	0	0	0	114.7	E506 Q512 A513 S514	E506-S510 PolarHBondContact O-N 3.05Å; S510-Q512 VanDerWaalsContact C-N 3.28Å; S510-Q512 PolarHBondContact O-N 2.85Å; S510-A513 WeakPolarHBondContact O-CB 3.27Å; S510-A513 PolarHBondContact O-N 2.76Å; S510-S514 PolarHBondContact O-N 3.45Å; S510-S514 PolarHBondContact O-OG 3.25Å
511	K	79.1	Confident	76.5	Confident	165 Å²	165	61.5 Å²	61.5	72%	0.717	29%	0.294	S	S	*	.	H	α-helix	trans	-68.8	-21	177.3	-69	178.4	-179.5	173	0	114.2	C509 R515	C509-K511 VanDerWaalsContact C-N 3.32Å; C509-K511 PolarHBondContact O-N 3.37Å; C509-K511 VanDerWaalsContact O-N 3.13Å; K511-R515 VanDerWaalsContact O-CD 3.29Å; K511-R515 WeakPolarHBondContact O-CD 3.46Å; K511-R515 VanDerWaalsContact O-CG 3.27Å; K511-R515 WeakPolarHBondContact O-CG 3.33Å
512	Q	81.7	Confident	76.7	Confident	54 Å²	54	63 Å²	63	25%	0.252	30%	0.302	S	S	.	.	H	α-helix	trans	-85	-42.2	171.7	-67.9	178.1	-100	0	0	110.4	H499 L500 C509 S510 S514 R515 M516	H499-Q512 PolarHBondContact O-NE2 2.81Å; L500-Q512 HydrophobicContact CD1-CB 3.94Å; C509-Q512 CarbonylContact O-C 3.56Å; C509-Q512 WeakPolarHBondContact O-CA 3.1Å; C509-Q512 WeakPolarHBondContact O-CB 3.36Å; C509-Q512 PolarHBondContact O-N 2.79Å; S510-Q512 VanDerWaalsContact C-N 3.28Å; S510-Q512 PolarHBondContact O-N 2.85Å; Q512-S514 PolarHBondContact O-N 2.83Å; Q512-R515 CarbonylContact O-C 3.52Å; Q512-R515 WeakPolarHBondContact O-CA 3.25Å; Q512-R515 WeakPolarHBondContact O-CB 3.42Å; Q512-R515 PolarHBondContact O-N 3.02Å; Q512-M516 PolarHBondContact O-N 3.22Å
513	A	83.8	Confident	77	Confident	2 Å²	2	66.9 Å²	66.9	2%	0.017	34%	0.336	C	S	.	.	H	α-helix	trans	-53.8	-52.9	174.6	0	0	0	0	0	111.7	I435 I439 L500 C509 S510 R515 M516 L517	I435-A513 HydrophobicContact CG2-CB 3.95Å; I439-A513 HydrophobicContact CD1-CB 3.54Å; L500-A513 HydrophobicContact CD1-CB 4.33Å; C509-A513 PolarHBondContact O-N 2.81Å; S510-A513 WeakPolarHBondContact O-CB 3.27Å; S510-A513 PolarHBondContact O-N 2.76Å; A513-R515 PolarHBondContact O-N 2.9Å; A513-M516 PolarHBondContact O-N 3.45Å; A513-L517 PolarHBondContact O-N 3.47Å
514	S	84.8	Confident	77.8	Confident	41 Å²	41	74 Å²	74	29%	0.287	36%	0.363	S	S	.	.	H	α-helix	trans	-61.2	-27.7	177	-53.2	0	0	0	0	113.7	F32 S510 Q512 W518	F32-S514 VanDerWaalsContact CZ-OG 3.25Å; F32-S514 WeakPolarHBondContact CZ-OG 3.36Å; S510-S514 PolarHBondContact O-N 3.45Å; S510-S514 PolarHBondContact O-OG 3.25Å; Q512-S514 PolarHBondContact O-N 2.83Å; S514-W518 PolarHBondContact O-N 2.86Å; S514-W518 VanDerWaalsContact O-N 3.09Å
515	R	85.6	Confident	78.9	Confident	136 Å²	136	70.7 Å²	70.7	51%	0.513	35%	0.349	S	S	.	.	H	α-helix	trans	-84.1	-13.8	176.2	-73.8	176.1	177.4	177.8	-1.1	114	R497 H498 K511 Q512 A513 P519	R497-R515 WeakPolarHBondContact O-CD 3.48Å; H498-R515 PolarHBondContact CE1-O 2.73Å; K511-R515 VanDerWaalsContact O-CD 3.29Å; K511-R515 WeakPolarHBondContact O-CD 3.46Å; K511-R515 VanDerWaalsContact O-CG 3.27Å; K511-R515 WeakPolarHBondContact O-CG 3.33Å; Q512-R515 CarbonylContact O-C 3.52Å; Q512-R515 WeakPolarHBondContact O-CA 3.25Å; Q512-R515 WeakPolarHBondContact O-CB 3.42Å; Q512-R515 PolarHBondContact O-N 3.02Å; A513-R515 PolarHBondContact O-N 2.9Å; R515-P519 VanDerWaalsContact O-CA 3.29Å; R515-P519 WeakPolarHBondContact O-CA 3.12Å; R515-P519 WeakPolarHBondContact O-CB 3.11Å
516	M	87.9	Confident	80.4	Confident	0 Å²	0	68.6 Å²	68.6	0%	0	34%	0.336	C	S	.	.	H	α-helix	trans	-93.8	-34.6	171.2	-74.7	-150.5	72	0	0	111.9	I435 M466 W468 L500 Q512 A513 L575	I435-M516 VanDerWaalsContact CD1-C 3.46Å; I435-M516 HydrophobicContact CD1-CB 3.47Å; I435-M516 VanDerWaalsContact CD1-CB 3.47Å; I435-M516 HydrophobicContact CG1-CB 4.19Å; M466-M516 HydrophobicContact CE-CE 4.34Å; M466-M516 HydrophobicContact CE-SD 4.43Å; M466-M516 HydrophobicContact CG-CE 4.24Å; M466-M516 VanDerWaalsContact O-SD 3.35Å; W468-M516 HydrophobicContact CG-CE 4.25Å; W468-M516 PolarHBondContact NE1-O 3.24Å; W468-M516 VanDerWaalsContact NE1-O 3.12Å; L500-M516 HydrophobicContact CB-CG 4.23Å; L500-M516 HydrophobicContact CB-SD 3.32Å; L500-M516 WeakPolarHBondContact CB-SD 3.47Å; L500-M516 HydrophobicContact CD2-SD 4.44Å; Q512-M516 PolarHBondContact O-N 3.22Å; A513-M516 PolarHBondContact O-N 3.45Å; M516-L575 HydrophobicContact CE-CD1 3.43Å; M516-L575 VanDerWaalsContact CE-CD1 3.43Å
517	L	86.9	Confident	81.3	Confident	13 Å²	13	72.6 Å²	72.6	7%	0.068	36%	0.359	C	S	.	.	H	α-helix	trans	-60.9	-49.8	168.1	-74.9	166.4	0	0	0	110.9	F32 I435 A513 P519	F32-L517 HydrophobicContact CB-CD1 4.36Å; F32-L517 HydrophobicContact CD2-CD1 3.34Å; F32-L517 HydrophobicContact CE2-CD1 3.69Å; F32-L517 HydrophobicContact CG-CD1 3.83Å; F32-L517 HydrophobicContact CZ-CD1 4.43Å; I435-L517 HydrophobicContact CD1-CB 4.31Å; I435-L517 HydrophobicContact CD1-CD2 3.9Å; I435-L517 HydrophobicContact CD1-CG 3.69Å; I435-L517 VanDerWaalsContact CD1-N 3.29Å; A513-L517 PolarHBondContact O-N 3.47Å; L517-P519 VanDerWaalsContact C-CD 3.41Å; L517-P519 WeakPolarHBondContact O-CD 3.2Å
518	W	85.2	Confident	81.8	Confident	101 Å²	101	67.3 Å²	67.3	38%	0.383	34%	0.34	S	S	.	.	S	Bend	trans	-120.2	70.3	-175.2	-48.4	111.5	0	0	0	110.6	F25 D28 S514 H520	F25-W518 HydrophobicContact CD1-CH2 4.12Å; F25-W518 AromaticContact CD1-CZ3 3.81Å; F25-W518 HydrophobicContact CD1-CZ3 3.81Å; F25-W518 HydrophobicContact CE1-CZ3 4.04Å; D28-W518 HydrophobicContact CB-CH2 3.98Å; D28-W518 HydrophobicContact CB-CZ2 4.2Å; S514-W518 PolarHBondContact O-N 2.86Å; S514-W518 VanDerWaalsContact O-N 3.09Å; W518-H520 PolarHBondContact O-N 2.81Å
519	P	87.8	Confident	82.2	Confident	3 Å²	3	69.2 Å²	69.2	2%	0.019	35%	0.35	C	S	.	.			trans	-78.6	93.4	-171.2	33.7	-36.4	0	0	0	111.6	W468 R515 L517 F521 Y545	W468-P519 HydrophobicContact CZ2-CG 4.36Å; R515-P519 VanDerWaalsContact O-CA 3.29Å; R515-P519 WeakPolarHBondContact O-CA 3.12Å; R515-P519 WeakPolarHBondContact O-CB 3.11Å; L517-P519 VanDerWaalsContact C-CD 3.41Å; L517-P519 WeakPolarHBondContact O-CD 3.2Å; P519-F521 VanDerWaalsContact C-N 3.29Å; P519-F521 HydrophobicContact CB-CD2 4.39Å; P519-F521 HydrophobicContact CB-CE1 4.04Å; P519-F521 HydrophobicContact CB-CE2 3.76Å; P519-F521 HydrophobicContact CB-CZ 3.55Å; P519-F521 HydrophobicContact CG-CD2 4.46Å; P519-F521 HydrophobicContact CG-CE2 3.64Å; P519-F521 HydrophobicContact CG-CZ 3.79Å; P519-F521 VanDerWaalsContact O-CD2 3.29Å; P519-F521 WeakPolarHBondContact O-CD2 3.32Å; P519-F521 PolarHBondContact O-N 2.75Å; P519-Y545 HydrophobicContact CG-CD2 3.74Å; P519-Y545 HydrophobicContact CG-CE2 3.33Å
520	H	88.2	Confident	83.1	Confident	145 Å²	145	73.8 Å²	73.8	67%	0.671	37%	0.369	S	S	*	.			trans	-69	86.3	170	-171.6	-35.1	0	0	0	110.8	R497 H498 W518	R497-H520 PolarHBondContact NH1-O 3.06Å; R497-H520 PolarHBondContact NH2-O 3.1Å; H498-H520 PolarHBondContact NE2-N 3.42Å; H498-H520 PolarHBondContact NE2-O 3.43Å; W518-H520 PolarHBondContact O-N 2.81Å
521	F	89.7	Confident	83.8	Confident	38 Å²	38	78 Å²	78	17%	0.167	38%	0.382	C	S	.	.			trans	-64.2	157.2	169.8	-58.4	-64.4	0	0	0	111.3	W468 H498 P519 S525 F526 Y545 I573	W468-F521 HydrophobicContact CB-CE1 3.91Å; W468-F521 HydrophobicContact CB-CZ 3.85Å; W468-F521 HydrophobicContact CD2-CZ 4.1Å; W468-F521 HydrophobicContact CG-CE1 4.17Å; W468-F521 AromaticContact CG-CZ 3.72Å; W468-F521 HydrophobicContact CG-CZ 3.72Å; H498-F521 AromaticContact CD2-CD1 3.85Å; H498-F521 AromaticContact CD2-CE1 3.87Å; P519-F521 VanDerWaalsContact C-N 3.29Å; P519-F521 HydrophobicContact CB-CD2 4.39Å; P519-F521 HydrophobicContact CB-CE1 4.04Å; P519-F521 HydrophobicContact CB-CE2 3.76Å; P519-F521 HydrophobicContact CB-CZ 3.55Å; P519-F521 HydrophobicContact CG-CD2 4.46Å; P519-F521 HydrophobicContact CG-CE2 3.64Å; P519-F521 HydrophobicContact CG-CZ 3.79Å; P519-F521 VanDerWaalsContact O-CD2 3.29Å; P519-F521 WeakPolarHBondContact O-CD2 3.32Å; P519-F521 PolarHBondContact O-N 2.75Å; F521-S525 WeakPolarHBondContact CA-OG 3.28Å; F521-F526 HydrophobicContact CB-CE2 4.42Å; F521-F526 AromaticContact CD1-CE2 3.61Å; F521-F526 HydrophobicContact CD1-CE2 3.61Å; F521-F526 AromaticContact CD1-CZ 3.62Å; F521-F526 HydrophobicContact CD1-CZ 3.62Å; F521-F526 HydrophobicContact CE1-CE2 4.1Å; F521-F526 AromaticContact CE1-CZ 3.59Å; F521-F526 HydrophobicContact CE1-CZ 3.59Å; F521-F526 HydrophobicContact CG-CE2 4.09Å; F521-F526 HydrophobicContact CG-CZ 4.39Å; F521-F526 HydrophobicContact CZ-CZ 4.35Å; F521-Y545 HydrophobicContact CD2-CD1 4.44Å; F521-Y545 HydrophobicContact CD2-CE1 4.41Å; F521-Y545 AromaticContact CE2-CD1 3.93Å; F521-Y545 HydrophobicContact CE2-CD1 3.93Å; F521-Y545 HydrophobicContact CE2-CD2 4.41Å; F521-Y545 HydrophobicContact CE2-CE1 4.17Å; F521-Y545 HydrophobicContact CE2-CG 4.05Å; F521-I573 HydrophobicContact CD2-CD1 3.78Å; F521-I573 HydrophobicContact CE1-CG2 4.23Å; F521-I573 HydrophobicContact CE2-CD1 3.86Å; F521-I573 HydrophobicContact CE2-CG2 4.04Å; F521-I573 HydrophobicContact CG-CD1 4.16Å; F521-I573 HydrophobicContact CZ-CD1 4.3Å; F521-I573 HydrophobicContact CZ-CG2 3.65Å
522	N	86.9	Confident	84.1	Confident	76 Å²	76	71.4 Å²	71.4	41%	0.406	35%	0.354	S	S	.	.			trans	-159.7	172.9	176.8	65.5	17.5	0	0	0	108.6	R497 K524 S525	R497-N522 PolarHBondContact NH2-OD1 3.5Å; N522-K524 PolarHBondContact O-N 3.45Å; N522-K524 PolarHBondContact OD1-N 2.86Å; N522-K524 VanDerWaalsContact OD1-N 3.09Å; N522-S525 PolarHBondContact N-OG 3.43Å; N522-S525 WeakPolarHBondContact O-CB 3.46Å; N522-S525 PolarHBondContact O-N 2.94Å; N522-S525 PolarHBondContact O-OG 3.2Å; N522-S525 PolarHBondContact OD1-N 3.44Å; N522-S525 VanDerWaalsContact OD1-N 3.1Å; N522-S525 PolarHBondContact OD1-OG 3.17Å
523	A	82.7	Confident	84.4	Confident	99 Å²	99	72.7 Å²	72.7	82%	0.818	37%	0.365	S	S	*	.	T	Hydrogen-bonded Turn	trans	-55.4	-24.3	-179	0	0	0	0	0	114.8
524	K	86	Confident	84.5	Confident	162 Å²	162	72.9 Å²	72.9	70%	0.704	37%	0.366	S	S	*	.	T	Hydrogen-bonded Turn	trans	-89	-0.9	177.3	-61.3	-177.1	-178.7	179.1	0	113.6	N522	N522-K524 PolarHBondContact O-N 3.45Å; N522-K524 PolarHBondContact OD1-N 2.86Å; N522-K524 VanDerWaalsContact OD1-N 3.09Å
525	S	88.3	Confident	84.6	Confident	0 Å²	0	76.1 Å²	76.1	0%	0	38%	0.38	C	S	.	.	S	Bend	trans	-76.4	-29.9	-175.9	-59.2	0	0	0	0	113.7	S494 S495 R497 F521 N522	S494-S525 CarbonylContact C-O 3.5Å; S494-S525 WeakPolarHBondContact CA-O 3.31Å; S495-S525 PolarHBondContact N-O 3.25Å; R497-S525 PolarHBondContact NH2-OG 2.96Å; F521-S525 WeakPolarHBondContact CA-OG 3.28Å; N522-S525 PolarHBondContact N-OG 3.43Å; N522-S525 WeakPolarHBondContact O-CB 3.46Å; N522-S525 PolarHBondContact O-N 2.94Å; N522-S525 PolarHBondContact O-OG 3.2Å; N522-S525 PolarHBondContact OD1-N 3.44Å; N522-S525 VanDerWaalsContact OD1-N 3.1Å; N522-S525 PolarHBondContact OD1-OG 3.17Å
526	F	89	Confident	84.5	Confident	34 Å²	34	70.4 Å²	70.4	15%	0.149	36%	0.36	C	S	.	.	S	Bend	trans	-122.9	20.7	178.7	-55.8	-78	0	0	0	111.1	K470 I492 F521 V528 I573	K470-F526 HydrophobicContact CB-CD1 3.59Å; K470-F526 HydrophobicContact CB-CD2 4.29Å; K470-F526 HydrophobicContact CB-CE1 3.64Å; K470-F526 HydrophobicContact CB-CE2 4.34Å; K470-F526 HydrophobicContact CB-CG 3.93Å; K470-F526 HydrophobicContact CB-CZ 4.03Å; K470-F526 HydrophobicContact CD-CD2 4.19Å; K470-F526 HydrophobicContact CD-CG 4.34Å; I492-F526 HydrophobicContact CG2-CB 4.07Å; I492-F526 WeakPolarHBondContact CG2-O 3.4Å; F521-F526 HydrophobicContact CB-CE2 4.42Å; F521-F526 AromaticContact CD1-CE2 3.61Å; F521-F526 HydrophobicContact CD1-CE2 3.61Å; F521-F526 AromaticContact CD1-CZ 3.62Å; F521-F526 HydrophobicContact CD1-CZ 3.62Å; F521-F526 HydrophobicContact CE1-CE2 4.1Å; F521-F526 AromaticContact CE1-CZ 3.59Å; F521-F526 HydrophobicContact CE1-CZ 3.59Å; F521-F526 HydrophobicContact CG-CE2 4.09Å; F521-F526 HydrophobicContact CG-CZ 4.39Å; F521-F526 HydrophobicContact CZ-CZ 4.35Å; F526-V528 PolarHBondContact O-N 3.04Å; F526-V528 VanDerWaalsContact O-N 3.1Å; F526-I573 HydrophobicContact CE2-CD1 3.8Å; F526-I573 HydrophobicContact CE2-CG1 4.32Å; F526-I573 HydrophobicContact CZ-CD1 3.88Å; F526-I573 HydrophobicContact CZ-CG1 4.07Å; F526-I573 HydrophobicContact CZ-CG2 3.88Å
527	N	77.5	Confident	84.5	Confident	121 Å²	121	73.6 Å²	73.6	65%	0.647	38%	0.38	S	S	*	.			trans	-87	59.4	172.6	-166.9	8.3	0	0	0	109.5
528	V	70.2	Confident	84.5	Confident	46 Å²	46	73 Å²	73	28%	0.279	38%	0.376	S	S	.	.			trans	-137.9	118	-177.4	-173.7	0	0	0	0	106.9	I492 F526 K530	I492-V528 WeakPolarHBondContact CG2-O 3.43Å; F526-V528 PolarHBondContact O-N 3.04Å; F526-V528 VanDerWaalsContact O-N 3.1Å; V528-K530 HydrophobicContact CG1-CB 3.99Å; V528-K530 HydrophobicContact CG1-CD 4.34Å; V528-K530 HydrophobicContact CG1-CG 4.02Å; V528-K530 PolarHBondContact O-N 3.44Å
529	D	68.1	Low	84.7	Confident	165 Å²	165	69.2 Å²	69.2	88%	0.882	36%	0.364	S	S	*	.			trans	-68.4	8.2	-175.3	-57.1	-63.9	0	0	0	114.9	K531	D529-K531 PolarHBondContact O-N 3.05Å; D529-K531 VanDerWaalsContact O-N 3.09Å
530	K	83.7	Confident	84.6	Confident	98 Å²	98	70.7 Å²	70.7	43%	0.426	37%	0.369	S	S	.	.			trans	-73.7	96.7	173.4	-78.5	-169.5	167.7	-157.9	0	110.6	Q493 V528	Q493-K530 HydrophobicContact CB-CB 4.01Å; Q493-K530 HydrophobicContact CB-CD 4.38Å; Q493-K530 PolarHBondContact N-O 3.38Å; V528-K530 HydrophobicContact CG1-CB 3.99Å; V528-K530 HydrophobicContact CG1-CD 4.34Å; V528-K530 HydrophobicContact CG1-CG 4.02Å; V528-K530 PolarHBondContact O-N 3.44Å
531	K	86.8	Confident	84.8	Confident	140 Å²	140	63.8 Å²	63.8	61%	0.609	34%	0.337	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-82.1	140	164.1	-62.2	-172.8	178.6	-170.2	0	110.5	I472 T490 F491 D529	I472-K531 HydrophobicContact CD1-CD 4.48Å; T490-K531 HydrophobicContact CG2-CB 4.3Å; T490-K531 HydrophobicContact CG2-CD 4.18Å; F491-K531 CarbonylContact O-C 3.49Å; F491-K531 VanDerWaalsContact O-CA 3.28Å; F491-K531 WeakPolarHBondContact O-CA 3.12Å; D529-K531 PolarHBondContact O-N 3.05Å; D529-K531 VanDerWaalsContact O-N 3.09Å
532	L	85.8	Confident	84.9	Confident	26 Å²	26	62 Å²	62	14%	0.136	33%	0.329	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-114.9	129	168.5	-65.6	165.4	0	0	0	106.7	V469 T490 F491 Q493 T578 P710	V469-L532 HydrophobicContact CG1-CD1 3.99Å; T490-L532 WeakPolarHBondContact CA-O 3.42Å; F491-L532 HydrophobicContact CB-CB 4.41Å; F491-L532 PolarHBondContact N-O 3.02Å; F491-L532 PolarHBondContact O-N 3.24Å; Q493-L532 HydrophobicContact CB-CD1 4.18Å; Q493-L532 HydrophobicContact CG-CD1 4.28Å; L532-T578 HydrophobicContact CD1-CG2 3.95Å; L532-P710 HydrophobicContact CB-CG 4.37Å; L532-P710 HydrophobicContact CD1-CG 4.34Å
533	V	87.5	Confident	85.2	Confident	80 Å²	80	59.1 Å²	59.1	49%	0.485	31%	0.313	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-112.7	135.4	177.5	-177.1	0	0	0	0	108.2	E488 L489 T490	E488-V533 HydrophobicContact CG-CG1 3.61Å; L489-V533 CarbonylContact O-C 3.58Å; L489-V533 WeakPolarHBondContact O-CA 3.49Å; T490-V533 HydrophobicContact CG2-CG2 4.28Å
534	L	85.2	Confident	85.8	Confident	6 Å²	6	54.4 Å²	54.4	3%	0.031	27%	0.274	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-135.3	120.5	-174.2	-103.5	176.8	0	0	0	109.8	E488 L489 F491 V536 F542 P710	E488-L534 CarbonylContact C-O 3.6Å; E488-L534 WeakPolarHBondContact CA-O 3.47Å; L489-L534 HydrophobicContact CB-CB 4.28Å; L489-L534 PolarHBondContact N-O 3.02Å; L489-L534 PolarHBondContact O-N 2.89Å; F491-L534 HydrophobicContact CD2-CD1 4.35Å; F491-L534 HydrophobicContact CE2-CB 4.15Å; F491-L534 HydrophobicContact CE2-CD1 3.74Å; F491-L534 HydrophobicContact CE2-CG 4.5Å; L534-V536 HydrophobicContact CB-CG1 4.4Å; L534-V536 HydrophobicContact CD2-CG1 4.16Å; L534-F542 HydrophobicContact CD1-CE1 4.25Å; L534-P710 HydrophobicContact CD1-CB 3.93Å; L534-P710 HydrophobicContact CD1-CG 3.84Å; L534-P710 HydrophobicContact CD2-CG 4.49Å; L534-P710 HydrophobicContact CG-CG 3.97Å
535	N	87.2	Confident	86.1	Confident	109 Å²	109	51.1 Å²	51.1	58%	0.583	26%	0.258	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-92.5	122.1	164.5	-65.8	4.9	0	0	0	107.5	E488	E488-N535 WeakPolarHBondContact CG-OD1 3.49Å
536	V	84.9	Confident	86.2	Confident	16 Å²	16	54.7 Å²	54.7	10%	0.097	30%	0.295	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-136.3	158.2	-179.5	-64.3	0	0	0	0	110.2	S486 S487 L489 L534 Y540 F542 I552	S486-V536 CarbonylContact C-O 3.59Å; S486-V536 WeakPolarHBondContact CA-O 3.48Å; S486-V536 VanDerWaalsContact CB-O 3.32Å; S486-V536 WeakPolarHBondContact CB-O 3.36Å; S487-V536 PolarHBondContact N-O 2.88Å; S487-V536 PolarHBondContact O-N 3.48Å; S487-V536 VanDerWaalsContact O-N 3.08Å; L489-V536 HydrophobicContact CD1-CG2 3.57Å; L489-V536 HydrophobicContact CG-CG2 4.02Å; L534-V536 HydrophobicContact CB-CG1 4.4Å; L534-V536 HydrophobicContact CD2-CG1 4.16Å; V536-Y540 HydrophobicContact CB-CD1 4.18Å; V536-Y540 HydrophobicContact CB-CG 4.13Å; V536-Y540 HydrophobicContact CG1-CD1 4Å; V536-Y540 HydrophobicContact CG1-CE1 4.37Å; V536-Y540 HydrophobicContact CG1-CG 4.29Å; V536-F542 HydrophobicContact CG1-CZ 4.27Å; V536-F542 HydrophobicContact CG2-CE2 4.31Å; V536-F542 HydrophobicContact CG2-CZ 4.28Å; V536-I552 HydrophobicContact CG2-CD1 3.74Å
537	T	87	Confident	86.4	Confident	67 Å²	67	57.7 Å²	57.7	41%	0.411	31%	0.309	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-71.2	153.6	168.8	51.1	0	0	0	0	110.5	L485 D539 Y540	L485-T537 CarbonylContact O-C 3.56Å; L485-T537 VanDerWaalsContact O-CA 3.22Å; L485-T537 WeakPolarHBondContact O-CA 3.48Å; T537-D539 VanDerWaalsContact C-N 3.26Å; T537-D539 WeakPolarHBondContact CB-OD1 3.39Å; T537-D539 PolarHBondContact O-N 3.32Å; T537-D539 PolarHBondContact OG1-OD1 2.92Å; T537-Y540 WeakPolarHBondContact O-CB 3.44Å; T537-Y540 PolarHBondContact O-N 3.08Å; T537-Y540 VanDerWaalsContact O-N 3.11Å
538	N	88	Confident	87.1	Confident	0 Å²	0	53 Å²	53	0%	0	29%	0.289	C	S	.	.	T	Hydrogen-bonded Turn	trans	-71.9	-21.5	-172.1	-64.2	-5.7	0	0	0	113.4	N484 L485 S486 S487 Y540 I552 E553 L556	N484-N538 PolarHBondContact O-ND2 3.4Å; L485-N538 PolarHBondContact O-N 3.09Å; S486-N538 VanDerWaalsContact C-OD1 3.29Å; S486-N538 WeakPolarHBondContact CA-OD1 3.21Å; S487-N538 PolarHBondContact N-OD1 3.3Å; S487-N538 PolarHBondContact OG-OD1 3.41Å; N538-Y540 VanDerWaalsContact C-N 3.25Å; N538-Y540 PolarHBondContact O-N 2.9Å; N538-I552 HydrophobicContact CB-CB 4.02Å; N538-I552 HydrophobicContact CB-CG2 4.06Å; N538-I552 WeakPolarHBondContact O-CB 3.4Å; N538-I552 PolarHBondContact O-N 2.87Å; N538-E553 HydrophobicContact CB-CB 4.11Å; N538-E553 HydrophobicContact CB-CG 3.91Å; N538-E553 WeakPolarHBondContact CB-OE1 3.49Å; N538-E553 PolarHBondContact ND2-OE1 3.17Å; N538-E553 PolarHBondContact O-N 3.4Å; N538-L556 HydrophobicContact CB-CD2 4.47Å
539	D	87.7	Confident	88.2	Confident	22 Å²	22	51.5 Å²	51.5	12%	0.118	28%	0.278	C	S	.	.	T	Hydrogen-bonded Turn	trans	-73.5	-14.5	172.7	74.1	-52	0	0	0	113.3	T537 P541 L556 T557 Q560 Q561	T537-D539 VanDerWaalsContact C-N 3.26Å; T537-D539 WeakPolarHBondContact CB-OD1 3.39Å; T537-D539 PolarHBondContact O-N 3.32Å; T537-D539 PolarHBondContact OG1-OD1 2.92Å; D539-P541 WeakPolarHBondContact O-CD 3.18Å; D539-L556 HydrophobicContact CB-CB 4.37Å; D539-L556 HydrophobicContact CB-CD2 3.96Å; D539-L556 HydrophobicContact CB-CG 3.93Å; D539-T557 WeakPolarHBondContact CA-OG1 3.25Å; D539-T557 WeakPolarHBondContact O-CB 3.5Å; D539-T557 WeakPolarHBondContact O-CG2 3.5Å; D539-T557 PolarHBondContact O-OG1 2.73Å; D539-Q560 VanDerWaalsContact CB-OE1 3.24Å; D539-Q560 PolarHBondContact OD2-OE1 3.1Å; D539-Q561 PolarHBondContact O-NE2 2.85Å; D539-Q561 PolarHBondContact OD2-NE2 2.79Å
540	Y	87.3	Confident	89.5	Confident	35 Å²	35	43.6 Å²	43.6	14%	0.137	24%	0.236	C	C	.	.			trans	-68.4	119.6	-167.6	-172.7	-89	0	0	0	112.5	V536 T537 N538 F542 S712 Y714 N715	V536-Y540 HydrophobicContact CB-CD1 4.18Å; V536-Y540 HydrophobicContact CB-CG 4.13Å; V536-Y540 HydrophobicContact CG1-CD1 4Å; V536-Y540 HydrophobicContact CG1-CE1 4.37Å; V536-Y540 HydrophobicContact CG1-CG 4.29Å; T537-Y540 WeakPolarHBondContact O-CB 3.44Å; T537-Y540 PolarHBondContact O-N 3.08Å; T537-Y540 VanDerWaalsContact O-N 3.11Å; N538-Y540 VanDerWaalsContact C-N 3.25Å; N538-Y540 PolarHBondContact O-N 2.9Å; Y540-F542 HydrophobicContact CD1-CD2 4.27Å; Y540-F542 HydrophobicContact CD1-CE1 4.35Å; Y540-F542 AromaticContact CD1-CE2 3.63Å; Y540-F542 HydrophobicContact CD1-CE2 3.63Å; Y540-F542 AromaticContact CD1-CZ 3.66Å; Y540-F542 HydrophobicContact CD1-CZ 3.66Å; Y540-F542 HydrophobicContact CE1-CE1 4.13Å; Y540-F542 HydrophobicContact CE1-CE2 4.22Å; Y540-F542 AromaticContact CE1-CZ 3.87Å; Y540-F542 HydrophobicContact CE1-CZ 3.87Å; Y540-S712 WeakPolarHBondContact CE1-OG 3.31Å; Y540-S712 VanDerWaalsContact CZ-OG 3.25Å; Y540-S712 PolarHBondContact OH-N 3.43Å; Y540-S712 PolarHBondContact OH-OG 2.05Å; Y540-Y714 HydrophobicContact CE2-CD1 4.42Å; Y540-N715 PolarHBondContact OH-ND2 2.86Å
541	P	91.3	Very high	90	Very high	0 Å²	0	39 Å²	39	0%	0	22%	0.216	C	C	.	.			trans	-88.6	144	-172.1	34.1	-35.4	0	0	0	114	D539 W549 T557 L563 S712 Y714	D539-P541 WeakPolarHBondContact O-CD 3.18Å; P541-W549 HydrophobicContact CB-CE3 3.96Å; P541-W549 HydrophobicContact CB-CZ3 4.33Å; P541-T557 HydrophobicContact CB-CG2 4.41Å; P541-L563 HydrophobicContact CB-CD2 3.95Å; P541-L563 HydrophobicContact CG-CD2 4.05Å; P541-S712 PolarHBondContact O-OG 3.19Å; P541-Y714 HydrophobicContact CG-CD1 3.76Å; P541-Y714 HydrophobicContact CG-CD2 3.64Å; P541-Y714 HydrophobicContact CG-CE1 4.13Å; P541-Y714 HydrophobicContact CG-CE2 4.05Å; P541-Y714 HydrophobicContact CG-CG 3.5Å; P541-Y714 VanDerWaalsContact CG-CG 3.5Å
542	F	92.9	Very high	90.2	Very high	0 Å²	0	32.8 Å²	32.8	0%	0	19%	0.19	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-118.9	148.1	173.5	-64.7	-92.3	0	0	0	109.9	L489 F491 L534 V536 Y540 W549 S550 L568 C574	L489-F542 HydrophobicContact CD1-CE1 4.43Å; L489-F542 HydrophobicContact CD1-CE2 3.52Å; L489-F542 HydrophobicContact CD1-CZ 3.44Å; L489-F542 VanDerWaalsContact CD1-CZ 3.44Å; F491-F542 HydrophobicContact CE2-CE1 4.45Å; F491-F542 HydrophobicContact CZ-CD1 4.31Å; F491-F542 AromaticContact CZ-CE1 3.82Å; F491-F542 HydrophobicContact CZ-CE1 3.82Å; F491-F542 HydrophobicContact CZ-CZ 4.15Å; L534-F542 HydrophobicContact CD1-CE1 4.25Å; V536-F542 HydrophobicContact CG1-CZ 4.27Å; V536-F542 HydrophobicContact CG2-CE2 4.31Å; V536-F542 HydrophobicContact CG2-CZ 4.28Å; Y540-F542 HydrophobicContact CD1-CD2 4.27Å; Y540-F542 HydrophobicContact CD1-CE1 4.35Å; Y540-F542 AromaticContact CD1-CE2 3.63Å; Y540-F542 HydrophobicContact CD1-CE2 3.63Å; Y540-F542 AromaticContact CD1-CZ 3.66Å; Y540-F542 HydrophobicContact CD1-CZ 3.66Å; Y540-F542 HydrophobicContact CE1-CE1 4.13Å; Y540-F542 HydrophobicContact CE1-CE2 4.22Å; Y540-F542 AromaticContact CE1-CZ 3.87Å; Y540-F542 HydrophobicContact CE1-CZ 3.87Å; F542-W549 WeakPolarHBondContact O-CA 3.5Å; F542-S550 PolarHBondContact N-O 2.84Å; F542-S550 PolarHBondContact O-N 3.1Å; F542-L568 HydrophobicContact CD2-CD2 3.8Å; F542-L568 HydrophobicContact CE2-CD2 4.13Å; F542-C574 HydrophobicContact CB-CB 4.45Å; F542-C574 HydrophobicContact CD1-CB 4.4Å
543	F	92.8	Very high	90.5	Very high	15 Å²	15	35.2 Å²	35.2	7%	0.066	20%	0.2	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-94.6	112.9	172.3	-159.2	-82.6	0	0	0	109.6	L429 V431 F434 W549 C574 L575 A713	L429-F543 WeakPolarHBondContact O-CE2 3.12Å; L429-F543 WeakPolarHBondContact O-CZ 3.28Å; V431-F543 HydrophobicContact CG2-CD1 4.27Å; V431-F543 HydrophobicContact CG2-CE1 3.61Å; V431-F543 HydrophobicContact CG2-CZ 4.47Å; F434-F543 HydrophobicContact CE2-CD1 4.47Å; F434-F543 AromaticContact CE2-CD2 3.66Å; F434-F543 HydrophobicContact CE2-CD2 3.66Å; F434-F543 AromaticContact CE2-CE2 3.94Å; F434-F543 HydrophobicContact CE2-CE2 3.94Å; F434-F543 AromaticContact CE2-CG 3.95Å; F434-F543 HydrophobicContact CE2-CG 3.95Å; F434-F543 HydrophobicContact CE2-CZ 4.45Å; F434-F543 HydrophobicContact CZ-CD2 4.2Å; F543-W549 HydrophobicContact CB-CE3 4.41Å; F543-W549 HydrophobicContact CB-CZ3 4.28Å; F543-W549 AromaticContact CD2-CD2 3.95Å; F543-W549 HydrophobicContact CD2-CD2 3.95Å; F543-W549 AromaticContact CD2-CE2 3.88Å; F543-W549 HydrophobicContact CD2-CE3 4.17Å; F543-W549 HydrophobicContact CD2-CG 4.48Å; F543-W549 HydrophobicContact CD2-CH2 4.3Å; F543-W549 HydrophobicContact CD2-CZ2 4.08Å; F543-W549 HydrophobicContact CD2-CZ3 4.35Å; F543-C574 CarbonylContact O-C 3.34Å; F543-C574 WeakPolarHBondContact O-CA 3.16Å; F543-L575 HydrophobicContact CB-CB 4.38Å; F543-L575 PolarHBondContact O-N 3.46Å; F543-A713 HydrophobicContact CB-CB 4Å
544	V	94.6	Very high	90.8	Very high	0 Å²	0	32.3 Å²	32.3	0%	0	18%	0.183	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-102.7	132.7	-172.5	178.2	0	0	0	0	111.1	G546 H547 G548 L568 D572 I573	V544-G546 PolarHBondContact O-N 2.78Å; V544-H547 HydrophobicContact CB-CB 4.07Å; V544-H547 HydrophobicContact CG1-CB 3.91Å; V544-H547 PolarHBondContact O-N 2.73Å; V544-H547 VanDerWaalsContact O-N 3.07Å; V544-G548 PolarHBondContact N-O 3.19Å; V544-G548 PolarHBondContact O-N 2.85Å; V544-L568 HydrophobicContact CG2-CD1 3.82Å; V544-D572 HydrophobicContact CG1-CB 3.82Å; V544-D572 HydrophobicContact CG2-CB 4.35Å; V544-I573 WeakPolarHBondContact CA-O 2.96Å
545	Y	92.5	Very high	91.1	Very high	94 Å²	94	38.1 Å²	38.1	37%	0.369	21%	0.214	S	C	.	.	T	Hydrogen-bonded Turn	trans	-56.7	127.5	177.4	-176.4	-106.2	0	0	0	111.6	W468 P519 F521 H547 I573	W468-Y545 AromaticContact CH2-CD2 3.93Å; W468-Y545 HydrophobicContact CH2-CD2 3.93Å; W468-Y545 HydrophobicContact CH2-CG 4.45Å; W468-Y545 HydrophobicContact CZ2-CD2 4.03Å; W468-Y545 HydrophobicContact CZ3-CD2 4.46Å; P519-Y545 HydrophobicContact CG-CD2 3.74Å; P519-Y545 HydrophobicContact CG-CE2 3.33Å; F521-Y545 HydrophobicContact CD2-CD1 4.44Å; F521-Y545 HydrophobicContact CD2-CE1 4.41Å; F521-Y545 AromaticContact CE2-CD1 3.93Å; F521-Y545 HydrophobicContact CE2-CD1 3.93Å; F521-Y545 HydrophobicContact CE2-CD2 4.41Å; F521-Y545 HydrophobicContact CE2-CE1 4.17Å; F521-Y545 HydrophobicContact CE2-CG 4.05Å; Y545-H547 PolarHBondContact O-N 2.68Å; Y545-H547 PolarHBondContact O-ND1 3.2Å; Y545-I573 PolarHBondContact N-O 2.7Å
546	G	91.1	Very high	91.2	Very high	74 Å²	74	34.6 Å²	34.6	76%	0.763	20%	0.195	S	C	*	.	T	Hydrogen-bonded Turn	trans	70.8	3.7	-178.5	0	0	0	0	0	115.7	V544	V544-G546 PolarHBondContact O-N 2.78Å
547	H	92.7	Very high	91.4	Very high	98 Å²	98	33.8 Å²	33.8	45%	0.454	19%	0.19	S	C	.	.	T	Hydrogen-bonded Turn	trans	-136	-13.7	-172.7	-64.4	98.2	0	0	0	115.1	V544 Y545 R566	V544-H547 HydrophobicContact CB-CB 4.07Å; V544-H547 HydrophobicContact CG1-CB 3.91Å; V544-H547 PolarHBondContact O-N 2.73Å; V544-H547 VanDerWaalsContact O-N 3.07Å; Y545-H547 PolarHBondContact O-N 2.68Å; Y545-H547 PolarHBondContact O-ND1 3.2Å; H547-R566 VanDerWaalsContact CD2-CZ 3.43Å; H547-R566 PolarHBondContact CD2-NE 2.77Å; H547-R566 PolarHBondContact CD2-NH2 3.12Å; H547-R566 PolarHBondContact CE1-NH2 2.84Å; H547-R566 PolarHBondContact NE2-NH2 2.96Å
548	G	92.2	Very high	91.5	Very high	22 Å²	22	34.4 Å²	34.4	23%	0.227	19%	0.191	C	C	.	.	E	Extended strand (participates in β ladder)	trans	72.8	-143.8	-178.2	0	0	0	0	0	112.3	V544	V544-G548 PolarHBondContact N-O 3.19Å; V544-G548 PolarHBondContact O-N 2.85Å
549	W	93.7	Very high	91.5	Very high	14 Å²	14	40.9 Å²	40.9	5%	0.053	23%	0.225	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-67.4	134.7	-177.5	-66.2	111.8	0	0	0	112.8	R426 L429 F434 P541 F542 F543 L563 R566 Y714 A717	R426-W549 HydrophobicContact CG-CZ2 4.11Å; R426-W549 PolarHBondContact O-NE1 3.49Å; L429-W549 HydrophobicContact CB-CZ2 4.43Å; L429-W549 HydrophobicContact CD1-CZ2 3.99Å; F434-W549 AromaticContact CZ-CH2 3.97Å; F434-W549 HydrophobicContact CZ-CH2 3.97Å; F434-W549 AromaticContact CZ-CZ2 3.94Å; F434-W549 HydrophobicContact CZ-CZ2 3.94Å; P541-W549 HydrophobicContact CB-CE3 3.96Å; P541-W549 HydrophobicContact CB-CZ3 4.33Å; F542-W549 WeakPolarHBondContact O-CA 3.5Å; F543-W549 HydrophobicContact CB-CE3 4.41Å; F543-W549 HydrophobicContact CB-CZ3 4.28Å; F543-W549 AromaticContact CD2-CD2 3.95Å; F543-W549 HydrophobicContact CD2-CD2 3.95Å; F543-W549 AromaticContact CD2-CE2 3.88Å; F543-W549 HydrophobicContact CD2-CE3 4.17Å; F543-W549 HydrophobicContact CD2-CG 4.48Å; F543-W549 HydrophobicContact CD2-CH2 4.3Å; F543-W549 HydrophobicContact CD2-CZ2 4.08Å; F543-W549 HydrophobicContact CD2-CZ3 4.35Å; W549-L563 HydrophobicContact CB-CD1 4.47Å; W549-L563 HydrophobicContact CB-CD2 4.47Å; W549-L563 HydrophobicContact CD2-CD2 4.19Å; W549-L563 HydrophobicContact CE3-CD2 4.47Å; W549-L563 HydrophobicContact CG-CD1 4.02Å; W549-L563 HydrophobicContact CG-CD2 4.21Å; W549-L563 HydrophobicContact CG-CG 4.47Å; W549-R566 PolarHBondContact O-N 3.19Å; W549-Y714 HydrophobicContact CH2-CD2 4.44Å; W549-A717 HydrophobicContact CH2-CB 4.41Å
550	S	94.8	Very high	91.3	Very high	0 Å²	0	45.4 Å²	45.4	0%	0	25%	0.246	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-147.7	145.8	175.4	-61	0	0	0	0	112	F542 R566	F542-S550 PolarHBondContact N-O 2.84Å; F542-S550 PolarHBondContact O-N 3.1Å; S550-R566 CarbonylContact C-O 3.53Å; S550-R566 WeakPolarHBondContact CA-O 3.35Å; S550-R566 WeakPolarHBondContact CB-O 3.24Å; S550-R566 WeakPolarHBondContact OG-CB 3.44Å
551	S	93.2	Very high	91	Very high	0 Å²	0	45 Å²	45	0%	0	25%	0.245	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-142.2	169.8	-179.6	61.9	0	0	0	0	111.5	E553 P554 T557 R566 L568	S551-E553 VanDerWaalsContact C-N 3.35Å; S551-P554 WeakPolarHBondContact OG-CA 3.13Å; S551-T557 WeakPolarHBondContact CB-OG1 3.36Å; S551-T557 PolarHBondContact OG-OG1 3.22Å; S551-R566 PolarHBondContact N-O 2.99Å; S551-R566 VanDerWaalsContact N-O 3.12Å; S551-L568 WeakPolarHBondContact O-CB 3.35Å; S551-L568 PolarHBondContact O-N 2.79Å
552	I	92.9	Very high	90.8	Very high	11 Å²	11	49.2 Å²	49.2	6%	0.056	27%	0.267	C	S	.	.	S	Bend	trans	-71.2	-34.5	-179	-59	148.9	0	0	0	110.3	L489 V536 N538 Q567 L568	L489-I552 HydrophobicContact CD1-CD1 4.17Å; L489-I552 HydrophobicContact CD2-CD1 4.1Å; L489-I552 HydrophobicContact CD2-CG1 4.23Å; L489-I552 HydrophobicContact CG-CD1 4.32Å; V536-I552 HydrophobicContact CG2-CD1 3.74Å; N538-I552 HydrophobicContact CB-CB 4.02Å; N538-I552 HydrophobicContact CB-CG2 4.06Å; N538-I552 WeakPolarHBondContact O-CB 3.4Å; N538-I552 PolarHBondContact O-N 2.87Å; I552-Q567 PolarHBondContact O-NE2 3.3Å; I552-Q567 PolarHBondContact O-OE1 3.08Å; I552-L568 HydrophobicContact CG1-CD2 4.21Å
553	E	91.2	Very high	90.5	Very high	76 Å²	76	49.2 Å²	49.2	36%	0.355	27%	0.267	S	S	.	.			trans	-129.6	90.4	172.3	-75.5	177.8	-139.9	0	0	111	N538 S551 N555 L556 T557	N538-E553 HydrophobicContact CB-CB 4.11Å; N538-E553 HydrophobicContact CB-CG 3.91Å; N538-E553 WeakPolarHBondContact CB-OE1 3.49Å; N538-E553 PolarHBondContact ND2-OE1 3.17Å; N538-E553 PolarHBondContact O-N 3.4Å; S551-E553 VanDerWaalsContact C-N 3.35Å; E553-N555 VanDerWaalsContact C-N 3.28Å; E553-N555 PolarHBondContact O-N 3.45Å; E553-L556 HydrophobicContact CB-CB 3.71Å; E553-L556 HydrophobicContact CB-CD2 4.44Å; E553-L556 WeakPolarHBondContact O-CB 3.18Å; E553-L556 PolarHBondContact O-N 3.24Å; E553-T557 PolarHBondContact O-N 3.19Å; E553-T557 PolarHBondContact O-OG1 3.05Å
554	P	93	Very high	90.4	Very high	19 Å²	19	52.6 Å²	52.6	12%	0.123	29%	0.293	C	S	.	.	H	α-helix	trans	-57.9	-35.6	-178.2	-28.7	36.6	0	0	0	114.7	S551 L556 T557 L558 C565 Q567	S551-P554 WeakPolarHBondContact OG-CA 3.13Å; P554-L556 VanDerWaalsContact C-N 3.29Å; P554-L556 PolarHBondContact O-N 2.89Å; P554-T557 PolarHBondContact O-N 2.95Å; P554-L558 WeakPolarHBondContact O-CB 3.38Å; P554-L558 PolarHBondContact O-N 3.22Å; P554-C565 HydrophobicContact CB-CB 4.02Å; P554-C565 WeakPolarHBondContact CB-O 3.41Å; P554-Q567 VanDerWaalsContact CD-OE1 3.24Å; P554-Q567 VanDerWaalsContact CG-CA 3.49Å; P554-Q567 HydrophobicContact CG-CB 4.15Å
555	N	92	Very high	90.3	Very high	129 Å²	129	53.7 Å²	53.7	69%	0.69	30%	0.3	S	S	*	.	H	α-helix	trans	-65.3	-35.6	176.4	-62.2	-16.2	0	0	0	111.3	E553 N559	E553-N555 VanDerWaalsContact C-N 3.28Å; E553-N555 PolarHBondContact O-N 3.45Å; N555-N559 WeakPolarHBondContact O-CB 3.16Å; N555-N559 PolarHBondContact O-N 2.95Å; N555-N559 PolarHBondContact O-ND2 3.18Å
556	L	89.5	Confident	90.4	Very high	34 Å²	34	52.2 Å²	52.2	18%	0.178	29%	0.294	C	S	.	.	H	α-helix	trans	-71.5	-43.6	177.5	-168.2	66.1	0	0	0	110.3	L485 N538 D539 E553 P554 L558 N559 Q560	L485-L556 HydrophobicContact CD2-CD2 4.46Å; N538-L556 HydrophobicContact CB-CD2 4.47Å; D539-L556 HydrophobicContact CB-CB 4.37Å; D539-L556 HydrophobicContact CB-CD2 3.96Å; D539-L556 HydrophobicContact CB-CG 3.93Å; E553-L556 HydrophobicContact CB-CB 3.71Å; E553-L556 HydrophobicContact CB-CD2 4.44Å; E553-L556 WeakPolarHBondContact O-CB 3.18Å; E553-L556 PolarHBondContact O-N 3.24Å; P554-L556 VanDerWaalsContact C-N 3.29Å; P554-L556 PolarHBondContact O-N 2.89Å; L556-L558 PolarHBondContact O-N 3.45Å; L556-N559 PolarHBondContact O-N 2.97Å; L556-Q560 HydrophobicContact CD1-CG 4.24Å; L556-Q560 HydrophobicContact CG-CG 4.45Å; L556-Q560 VanDerWaalsContact O-CB 3.31Å; L556-Q560 WeakPolarHBondContact O-CB 3.08Å; L556-Q560 WeakPolarHBondContact O-CG 3.19Å; L556-Q560 PolarHBondContact O-N 3.21Å
557	T	88.1	Confident	90.6	Very high	0 Å²	0	52.8 Å²	52.8	0%	0	28%	0.277	C	S	.	.	H	α-helix	trans	-60.2	-43.2	173.6	-48.6	0	0	0	0	112.4	D539 P541 S551 E553 P554 Q560 Q561 D562 L563	D539-T557 WeakPolarHBondContact CA-OG1 3.25Å; D539-T557 WeakPolarHBondContact O-CB 3.5Å; D539-T557 WeakPolarHBondContact O-CG2 3.5Å; D539-T557 PolarHBondContact O-OG1 2.73Å; P541-T557 HydrophobicContact CB-CG2 4.41Å; S551-T557 WeakPolarHBondContact CB-OG1 3.36Å; S551-T557 PolarHBondContact OG-OG1 3.22Å; E553-T557 PolarHBondContact O-N 3.19Å; E553-T557 PolarHBondContact O-OG1 3.05Å; P554-T557 PolarHBondContact O-N 2.95Å; T557-Q560 PolarHBondContact O-N 3.45Å; T557-Q561 HydrophobicContact CG2-CB 4.29Å; T557-Q561 HydrophobicContact CG2-CG 4.4Å; T557-Q561 WeakPolarHBondContact O-CA 3.48Å; T557-Q561 WeakPolarHBondContact O-CB 3.44Å; T557-Q561 PolarHBondContact O-N 2.79Å; T557-D562 PolarHBondContact O-N 2.96Å; T557-L563 HydrophobicContact CG2-CB 4.31Å; T557-L563 HydrophobicContact CG2-CD2 4.22Å
558	L	89.7	Confident	90.8	Very high	80 Å²	80	48.3 Å²	48.3	42%	0.419	26%	0.256	S	S	.	.	H	α-helix	trans	-62.9	-44.5	177.1	-177.1	63	0	0	0	111.3	P554 L556 D562 L563	P554-L558 WeakPolarHBondContact O-CB 3.38Å; P554-L558 PolarHBondContact O-N 3.22Å; L556-L558 PolarHBondContact O-N 3.45Å; L558-D562 VanDerWaalsContact O-CA 3.25Å; L558-D562 WeakPolarHBondContact O-CA 3.42Å; L558-D562 PolarHBondContact O-N 3.29Å; L558-D562 VanDerWaalsContact O-N 3.12Å; L558-L563 WeakPolarHBondContact CA-O 3.32Å
559	N	88	Confident	90.9	Very high	135 Å²	135	52.8 Å²	52.8	72%	0.722	27%	0.27	S	S	*	.	H	α-helix	trans	-71.1	-32.8	-179.8	-69.2	-13.2	0	0	0	113.7	N555 L556	N555-N559 WeakPolarHBondContact O-CB 3.16Å; N555-N559 PolarHBondContact O-N 2.95Å; N555-N559 PolarHBondContact O-ND2 3.18Å; L556-N559 PolarHBondContact O-N 2.97Å
560	Q	84.3	Confident	90.9	Very high	118 Å²	118	55.8 Å²	55.8	55%	0.551	29%	0.29	S	S	*	.	H	α-helix	trans	-97.7	-29.7	-174.2	-68.2	-176.9	-27.7	0	0	114.2	D539 L556 T557	D539-Q560 VanDerWaalsContact CB-OE1 3.24Å; D539-Q560 PolarHBondContact OD2-OE1 3.1Å; L556-Q560 HydrophobicContact CD1-CG 4.24Å; L556-Q560 HydrophobicContact CG-CG 4.45Å; L556-Q560 VanDerWaalsContact O-CB 3.31Å; L556-Q560 WeakPolarHBondContact O-CB 3.08Å; L556-Q560 WeakPolarHBondContact O-CG 3.19Å; L556-Q560 PolarHBondContact O-N 3.21Å; T557-Q560 PolarHBondContact O-N 3.45Å
561	Q	81.6	Confident	90.9	Very high	27 Å²	27	60.4 Å²	60.4	13%	0.126	31%	0.314	C	S	.	.	H	α-helix	trans	-121.7	-2.1	-173.1	-51	-173.7	11.6	0	0	113.5	R426 D539 T557 L563 Y714	R426-Q561 PolarHBondContact NH1-O 3.27Å; D539-Q561 PolarHBondContact O-NE2 2.85Å; D539-Q561 PolarHBondContact OD2-NE2 2.79Å; T557-Q561 HydrophobicContact CG2-CB 4.29Å; T557-Q561 HydrophobicContact CG2-CG 4.4Å; T557-Q561 WeakPolarHBondContact O-CA 3.48Å; T557-Q561 WeakPolarHBondContact O-CB 3.44Å; T557-Q561 PolarHBondContact O-N 2.79Å; Q561-L563 HydrophobicContact CB-CB 4.35Å; Q561-L563 PolarHBondContact O-N 2.81Å; Q561-Y714 PolarHBondContact OE1-OH 3.06Å; Q561-Y714 VanDerWaalsContact OE1-OH 3.1Å
562	D	86.7	Confident	91	Very high	87 Å²	87	61 Å²	61	47%	0.465	32%	0.317	S	S	.	.			trans	51.9	40.5	-179.6	-162.5	-3.3	0	0	0	112.2	K414 T557 L558	K414-D562 VanDerWaalsContact CE-CG 3.4Å; K414-D562 WeakPolarHBondContact CE-OD2 3.19Å; K414-D562 PolarHBondContact NZ-O 2.97Å; K414-D562 IonicContact NZ-OD1 3.8Å; K414-D562 PolarHBondContact NZ-OD1 2.79Å; K414-D562 IonicContact NZ-OD2 3.08Å; K414-D562 PolarHBondContact NZ-OD2 3.28Å; K414-D562 VanDerWaalsContact NZ-OD2 3.08Å; T557-D562 PolarHBondContact O-N 2.96Å; L558-D562 VanDerWaalsContact O-CA 3.25Å; L558-D562 WeakPolarHBondContact O-CA 3.42Å; L558-D562 PolarHBondContact O-N 3.29Å; L558-D562 VanDerWaalsContact O-N 3.12Å
563	L	87	Confident	91	Very high	0 Å²	0	61.9 Å²	61.9	0%	0	32%	0.322	C	S	.	.			trans	-124.6	125.3	-175.2	172.5	65.2	0	0	0	110	R426 E427 P541 W549 T557 L558 Q561	R426-L563 HydrophobicContact CB-CD1 4.44Å; R426-L563 HydrophobicContact CG-CD1 3.95Å; E427-L563 HydrophobicContact CG-CD1 4.24Å; E427-L563 WeakPolarHBondContact OE1-CD1 3.36Å; P541-L563 HydrophobicContact CB-CD2 3.95Å; P541-L563 HydrophobicContact CG-CD2 4.05Å; W549-L563 HydrophobicContact CB-CD1 4.47Å; W549-L563 HydrophobicContact CB-CD2 4.47Å; W549-L563 HydrophobicContact CD2-CD2 4.19Å; W549-L563 HydrophobicContact CE3-CD2 4.47Å; W549-L563 HydrophobicContact CG-CD1 4.02Å; W549-L563 HydrophobicContact CG-CD2 4.21Å; W549-L563 HydrophobicContact CG-CG 4.47Å; T557-L563 HydrophobicContact CG2-CB 4.31Å; T557-L563 HydrophobicContact CG2-CD2 4.22Å; L558-L563 WeakPolarHBondContact CA-O 3.32Å; Q561-L563 HydrophobicContact CB-CB 4.35Å; Q561-L563 PolarHBondContact O-N 2.81Å
564	S	90.5	Very high	91.2	Very high	87 Å²	87	58.2 Å²	58.2	61%	0.608	31%	0.305	S	S	*	.			trans	-74.5	127.7	175.1	-169.1	0	0	0	0	111.2
565	C	92.4	Very high	91.1	Very high	22 Å²	22	57.4 Å²	57.4	15%	0.149	30%	0.299	C	S	.	.			trans	-130.7	150.6	-177.7	-81.7	0	0	0	0	112.2	P554	P554-C565 HydrophobicContact CB-CB 4.02Å; P554-C565 WeakPolarHBondContact CB-O 3.41Å
566	R	94.6	Very high	90.9	Very high	64 Å²	64	51.3 Å²	51.3	24%	0.242	27%	0.267	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-87	152	162.6	166	-173.9	167.9	-82.9	20.3	110.2	H547 W549 S550 S551 L568 D572	H547-R566 VanDerWaalsContact CD2-CZ 3.43Å; H547-R566 PolarHBondContact CD2-NE 2.77Å; H547-R566 PolarHBondContact CD2-NH2 3.12Å; H547-R566 PolarHBondContact CE1-NH2 2.84Å; H547-R566 PolarHBondContact NE2-NH2 2.96Å; W549-R566 PolarHBondContact O-N 3.19Å; S550-R566 CarbonylContact C-O 3.53Å; S550-R566 WeakPolarHBondContact CA-O 3.35Å; S550-R566 WeakPolarHBondContact CB-O 3.24Å; S550-R566 WeakPolarHBondContact OG-CB 3.44Å; S551-R566 PolarHBondContact N-O 2.99Å; S551-R566 VanDerWaalsContact N-O 3.12Å; R566-L568 PolarHBondContact O-N 2.58Å; R566-D572 IonicContact CZ-OD1 2.9Å; R566-D572 IonicContact CZ-OD2 3.44Å; R566-D572 VanDerWaalsContact NH1-CG 3.34Å; R566-D572 IonicContact NH1-OD1 2.67Å; R566-D572 PolarHBondContact NH1-OD1 2.95Å; R566-D572 IonicContact NH1-OD2 3.56Å; R566-D572 PolarHBondContact NH1-OD2 3.01Å; R566-D572 IonicContact NH2-OD1 3.53Å; R566-D572 PolarHBondContact NH2-OD1 2.83Å; R566-D572 IonicContact NH2-OD2 2.75Å
567	Q	95.7	Very high	90.6	Very high	86 Å²	86	50.2 Å²	50.2	40%	0.402	26%	0.261	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-59.5	118.7	169.5	-179.2	61.7	54.4	0	0	110.5	I552 P554	I552-Q567 PolarHBondContact O-NE2 3.3Å; I552-Q567 PolarHBondContact O-OE1 3.08Å; P554-Q567 VanDerWaalsContact CD-OE1 3.24Å; P554-Q567 VanDerWaalsContact CG-CA 3.49Å; P554-Q567 HydrophobicContact CG-CB 4.15Å
568	L	95.1	Very high	90	Very high	3 Å²	3	50.3 Å²	50.3	2%	0.016	26%	0.262	C	S	.	.	P	Polyproline II helix	trans	-66.9	136.2	173	-173	69	0	0	0	109.9	L471 L489 F542 V544 S551 I552 R566 D572	L471-L568 HydrophobicContact CD2-CD1 4Å; L471-L568 HydrophobicContact CD2-CD2 3.75Å; L471-L568 HydrophobicContact CD2-CG 3.59Å; L489-L568 HydrophobicContact CD1-CD2 4.26Å; F542-L568 HydrophobicContact CD2-CD2 3.8Å; F542-L568 HydrophobicContact CE2-CD2 4.13Å; V544-L568 HydrophobicContact CG2-CD1 3.82Å; S551-L568 WeakPolarHBondContact O-CB 3.35Å; S551-L568 PolarHBondContact O-N 2.79Å; I552-L568 HydrophobicContact CG1-CD2 4.21Å; R566-L568 PolarHBondContact O-N 2.58Å; L568-D572 HydrophobicContact CD1-CB 4.21Å
569	K	94.9	Very high	89.2	Confident	117 Å²	117	50.4 Å²	50.4	51%	0.509	26%	0.257	S	S	.	.			trans	-132.9	153.1	-174	-64.3	179.3	-174.9	-176.4	0	111.7	L471 D572	L471-K569 WeakPolarHBondContact CD2-O 3.17Å; K569-D572 PolarHBondContact N-OD2 3.49Å; K569-D572 VanDerWaalsContact O-CB 3.25Å; K569-D572 WeakPolarHBondContact O-CB 3.04Å; K569-D572 PolarHBondContact O-N 3.49Å; K569-D572 VanDerWaalsContact O-N 3.15Å
570	T	94.1	Very high	88.2	Confident	77 Å²	77	44.6 Å²	44.6	47%	0.472	23%	0.227	S	C	.	.	T	Hydrogen-bonded Turn	trans	-51	144.4	163.1	-52.2	0	0	0	0	110.3	I472 D572	I472-T570 WeakPolarHBondContact O-CG2 3.49Å; T570-D572 VanDerWaalsContact C-N 3.28Å; T570-D572 PolarHBondContact O-N 3.12Å
571	D	93.8	Very high	86.7	Confident	96 Å²	96	43.4 Å²	43.4	51%	0.513	23%	0.228	S	C	.	.	T	Hydrogen-bonded Turn	trans	72.5	-6.3	-172.1	-64.8	-31.9	0	0	0	117.5	K470 L471	K470-D571 VanDerWaalsContact CE-CA 3.49Å; K470-D571 WeakPolarHBondContact CE-OD1 3.33Å; K470-D571 VanDerWaalsContact NZ-CG 3.3Å; K470-D571 IonicContact NZ-OD1 3.73Å; K470-D571 PolarHBondContact NZ-OD1 2.87Å; K470-D571 IonicContact NZ-OD2 2.95Å; L471-D571 WeakPolarHBondContact O-CA 3.34Å; L471-D571 PolarHBondContact O-N 3.24Å
572	D	95.3	Very high	85.1	Confident	12 Å²	12	48 Å²	48	6%	0.064	25%	0.252	C	S	.	.			trans	-59.6	143	169.2	-77.5	-28.3	0	0	0	111.8	L471 V544 R566 L568 K569 T570	L471-D572 PolarHBondContact N-O 2.86Å; V544-D572 HydrophobicContact CG1-CB 3.82Å; V544-D572 HydrophobicContact CG2-CB 4.35Å; R566-D572 IonicContact CZ-OD1 2.9Å; R566-D572 IonicContact CZ-OD2 3.44Å; R566-D572 VanDerWaalsContact NH1-CG 3.34Å; R566-D572 IonicContact NH1-OD1 2.67Å; R566-D572 PolarHBondContact NH1-OD1 2.95Å; R566-D572 IonicContact NH1-OD2 3.56Å; R566-D572 PolarHBondContact NH1-OD2 3.01Å; R566-D572 IonicContact NH2-OD1 3.53Å; R566-D572 PolarHBondContact NH2-OD1 2.83Å; R566-D572 IonicContact NH2-OD2 2.75Å; L568-D572 HydrophobicContact CD1-CB 4.21Å; K569-D572 PolarHBondContact N-OD2 3.49Å; K569-D572 VanDerWaalsContact O-CB 3.25Å; K569-D572 WeakPolarHBondContact O-CB 3.04Å; K569-D572 PolarHBondContact O-N 3.49Å; K569-D572 VanDerWaalsContact O-N 3.15Å; T570-D572 VanDerWaalsContact C-N 3.28Å; T570-D572 PolarHBondContact O-N 3.12Å
573	I	94.4	Very high	82.7	Confident	30 Å²	30	48.4 Å²	48.4	15%	0.154	26%	0.262	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-107.3	111	179.5	-58.7	171.2	0	0	0	109	W468 V469 K470 F521 F526 V544 Y545	W468-I573 HydrophobicContact CB-CG2 4.11Å; W468-I573 HydrophobicContact CD2-CG2 4.43Å; W468-I573 HydrophobicContact CE3-CG2 3.92Å; V469-I573 CarbonylContact O-C 3.59Å; V469-I573 WeakPolarHBondContact O-CA 3.32Å; K470-I573 HydrophobicContact CB-CG1 4.37Å; K470-I573 HydrophobicContact CG-CG1 4.21Å; F521-I573 HydrophobicContact CD2-CD1 3.78Å; F521-I573 HydrophobicContact CE1-CG2 4.23Å; F521-I573 HydrophobicContact CE2-CD1 3.86Å; F521-I573 HydrophobicContact CE2-CG2 4.04Å; F521-I573 HydrophobicContact CG-CD1 4.16Å; F521-I573 HydrophobicContact CZ-CD1 4.3Å; F521-I573 HydrophobicContact CZ-CG2 3.65Å; F526-I573 HydrophobicContact CE2-CD1 3.8Å; F526-I573 HydrophobicContact CE2-CG1 4.32Å; F526-I573 HydrophobicContact CZ-CD1 3.88Å; F526-I573 HydrophobicContact CZ-CG1 4.07Å; F526-I573 HydrophobicContact CZ-CG2 3.88Å; V544-I573 WeakPolarHBondContact CA-O 2.96Å; Y545-I573 PolarHBondContact N-O 2.7Å
574	C	93.6	Very high	80.1	Confident	0 Å²	0	53.7 Å²	53.7	0%	0	31%	0.306	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-99.9	148	-173.4	-59.6	0	0	0	0	112.3	W468 V469 F491 F542 F543	W468-C574 WeakPolarHBondContact CA-O 3.33Å; V469-C574 HydrophobicContact CG2-CB 4.12Å; V469-C574 PolarHBondContact N-O 2.81Å; V469-C574 PolarHBondContact O-N 3.44Å; F491-C574 HydrophobicContact CE1-CB 4.17Å; F542-C574 HydrophobicContact CB-CB 4.45Å; F542-C574 HydrophobicContact CD1-CB 4.4Å; F543-C574 CarbonylContact O-C 3.34Å; F543-C574 WeakPolarHBondContact O-CA 3.16Å
575	L	91.9	Very high	77.2	Confident	1 Å²	1	52.9 Å²	52.9	1%	0.005	31%	0.312	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-90.1	123	169.4	-170.5	64.8	0	0	0	110.2	F434 M466 W468 M516 F543 A713	F434-L575 HydrophobicContact CB-CD2 3.93Å; F434-L575 HydrophobicContact CD2-CD2 3.93Å; F434-L575 HydrophobicContact CG-CD2 4.1Å; M466-L575 HydrophobicContact CE-CD1 4.31Å; M466-L575 HydrophobicContact CE-CD2 4.45Å; M466-L575 HydrophobicContact CG-CD1 3.78Å; M466-L575 HydrophobicContact CG-CG 4.16Å; M466-L575 HydrophobicContact SD-CD1 4Å; M466-L575 HydrophobicContact SD-CD2 3.95Å; M466-L575 HydrophobicContact SD-CG 4.01Å; W468-L575 HydrophobicContact CD2-CD1 4.07Å; W468-L575 HydrophobicContact CE3-CB 4.03Å; W468-L575 HydrophobicContact CE3-CD1 4.22Å; W468-L575 HydrophobicContact CH2-CB 4.07Å; W468-L575 HydrophobicContact CH2-CD1 4.34Å; W468-L575 HydrophobicContact CZ2-CD1 4.18Å; W468-L575 HydrophobicContact CZ3-CB 3.68Å; W468-L575 HydrophobicContact CZ3-CD1 4.35Å; M516-L575 HydrophobicContact CE-CD1 3.43Å; M516-L575 VanDerWaalsContact CE-CD1 3.43Å; F543-L575 HydrophobicContact CB-CB 4.38Å; F543-L575 PolarHBondContact O-N 3.46Å; L575-A713 HydrophobicContact CD2-CB 4.41Å
576	V	88.5	Confident	74.5	Confident	2 Å²	2	63.1 Å²	63.1	1%	0.012	35%	0.347	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-138.7	154.3	179.8	-61	0	0	0	0	112	M466 C467 V469 T578 P710	M466-V576 CarbonylContact C-O 3.55Å; M466-V576 WeakPolarHBondContact CA-O 3.25Å; C467-V576 PolarHBondContact N-O 3.11Å; C467-V576 PolarHBondContact O-N 2.79Å; C467-V576 VanDerWaalsContact O-N 3.12Å; V469-V576 HydrophobicContact CB-CG2 4.24Å; V469-V576 HydrophobicContact CG1-CG2 3.48Å; V469-V576 VanDerWaalsContact CG1-CG2 3.48Å; V469-V576 HydrophobicContact CG2-CB 4.48Å; V469-V576 HydrophobicContact CG2-CG1 3.95Å; V469-V576 HydrophobicContact CG2-CG2 3.65Å; V576-T578 HydrophobicContact CG2-CG2 4.03Å; V576-P710 HydrophobicContact CB-CB 4.02Å; V576-P710 HydrophobicContact CG1-CB 4.35Å; V576-P710 HydrophobicContact CG2-CB 4.2Å
577	L	83.1	Confident	71.4	Confident	10 Å²	10	70.2 Å²	70.2	5%	0.052	38%	0.379	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-90.5	135.4	163.6	-62	170.2	0	0	0	109	E465 M466 V502 P710 F711 L716	E465-L577 CarbonylContact O-C 3.36Å; M466-L577 HydrophobicContact CB-CD2 3.77Å; M466-L577 HydrophobicContact CG-CD2 3.94Å; M466-L577 HydrophobicContact SD-CD2 4.39Å; V502-L577 HydrophobicContact CG2-CD2 3.87Å; L577-P710 CarbonylContact O-C 3.56Å; L577-P710 WeakPolarHBondContact O-CA 3.37Å; L577-F711 HydrophobicContact CB-CB 4.27Å; L577-F711 HydrophobicContact CD1-CB 4.37Å; L577-F711 PolarHBondContact N-O 3.39Å; L577-F711 PolarHBondContact O-N 2.8Å; L577-F711 VanDerWaalsContact O-N 3.14Å; L577-L716 HydrophobicContact CD1-CD1 4.08Å; L577-L716 HydrophobicContact CD1-CD2 4.03Å; L577-L716 HydrophobicContact CD1-CG 3.93Å; L577-L716 HydrophobicContact CD2-CD1 4.49Å
578	T	75.5	Confident	68.3	Low	3 Å²	3	70.8 Å²	70.8	2%	0.018	39%	0.393	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-136.4	156.3	175	53.3	0	0	0	0	110.8	E465 Q493 L532 V576 P710	E465-T578 WeakPolarHBondContact CG-OG1 3.13Å; E465-T578 PolarHBondContact N-O 3.45Å; E465-T578 PolarHBondContact O-N 2.86Å; E465-T578 PolarHBondContact O-OG1 2.83Å; Q493-T578 PolarHBondContact NE2-OG1 3.49Å; L532-T578 HydrophobicContact CD1-CG2 3.95Å; V576-T578 HydrophobicContact CG2-CG2 4.03Å; T578-P710 HydrophobicContact CG2-CB 3.76Å; T578-P710 HydrophobicContact CG2-CG 4.01Å
579	Y	72.1	Confident	65.2	Low	81 Å²	81	81.7 Å²	81.7	32%	0.318	43%	0.434	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-77.6	125.3	177.4	-75.2	-80.3	0	0	0	111.8	N463 L464 V581 F711	N463-Y579 CarbonylContact O-C 3.46Å; N463-Y579 VanDerWaalsContact O-CA 3.24Å; N463-Y579 WeakPolarHBondContact O-CA 3.34Å; N463-Y579 WeakPolarHBondContact O-CD1 3.4Å; L464-Y579 HydrophobicContact CD2-CD1 3.6Å; L464-Y579 HydrophobicContact CD2-CD2 4.36Å; L464-Y579 HydrophobicContact CD2-CE1 3.61Å; L464-Y579 HydrophobicContact CD2-CE2 4.39Å; L464-Y579 HydrophobicContact CD2-CG 4Å; L464-Y579 HydrophobicContact CG-CD1 4.33Å; L464-Y579 HydrophobicContact CG-CE1 4.24Å; Y579-V581 PolarHBondContact O-N 2.85Å; Y579-F711 AromaticContact CE2-CE2 3.86Å; Y579-F711 HydrophobicContact CE2-CE2 3.86Å
580	C	66.5	Low	62.2	Low	13 Å²	13	82.7 Å²	82.7	9%	0.088	44%	0.443	C	S	.	.			trans	-67.1	98.8	170.6	-67.1	0	0	0	0	110.7	N463 L464 E465 L501 L582	N463-C580 HydrophobicContact CB-CB 4.5Å; N463-C580 PolarHBondContact O-N 2.67Å; L464-C580 VanDerWaalsContact C-SG 3.57Å; E465-C580 WeakPolarHBondContact CB-SG 3.5Å; E465-C580 VanDerWaalsContact CG-SG 3.55Å; E465-C580 PolarHBondContact N-SG 2.93Å; E465-C580 VanDerWaalsContact N-SG 3.43Å; L501-C580 WeakPolarHBondContact CD2-SG 3.15Å; C580-L582 VanDerWaalsContact C-N 3.26Å; C580-L582 PolarHBondContact O-N 3.32Å
581	V	54.2	Low	59.1	Low	94 Å²	94	83.4 Å²	83.4	57%	0.57	45%	0.452	S	S	*	.			trans	-68.5	90.6	159.6	-175.7	0	0	0	0	108.4	Y579 S583 I706	Y579-V581 PolarHBondContact O-N 2.85Å; V581-S583 PolarHBondContact O-N 2.9Å; V581-I706 HydrophobicContact CG2-CD1 4.41Å
582	L	47.4	Very low	56	Low	122 Å²	122	84.7 Å²	84.7	64%	0.639	46%	0.463	S	S	*	.			trans	-62.5	94	171.8	-73.6	178.7	0	0	0	109.3	N463 C580 A584	N463-L582 VanDerWaalsContact OD1-CD1 3.24Å; N463-L582 WeakPolarHBondContact OD1-CD1 3.37Å; C580-L582 VanDerWaalsContact C-N 3.26Å; C580-L582 PolarHBondContact O-N 3.32Å; L582-A584 PolarHBondContact O-N 3.34Å
583	S	36.3	Very low	52.9	Low	96 Å²	96	89.8 Å²	89.8	67%	0.671	50%	0.495	S	S	*	.			trans	-59.5	114.8	177	-42.7	0	0	0	0	109.5	V581 G585	V581-S583 PolarHBondContact O-N 2.9Å; S583-G585 PolarHBondContact O-N 3.31Å
584	A	32.5	Very low	49.8	Very low	111 Å²	111	95 Å²	95	92%	0.917	52%	0.523	S	S	*	.	S	Bend	trans	-67.1	19.5	-168.7	0	0	0	0	0	116.1	L582	L582-A584 PolarHBondContact O-N 3.34Å
585	G	30	Very low	46.7	Very low	71 Å²	71	100.5 Å²	100.5	73%	0.732	56%	0.562	S	S	*	*			trans	-93.5	6.9	-170.1	0	0	0	0	0	116.5	S583	S583-G585 PolarHBondContact O-N 3.31Å
586	R	33.9	Very low	43.5	Very low	237 Å²	237	104.6 Å²	104.6	89%	0.894	59%	0.589	S	S	*	*			trans	-137	111.7	174.9	-71.8	-170.2	176.9	176.1	-0.7	112.4	S588	R586-S588 VanDerWaalsContact C-N 3.3Å; R586-S588 PolarHBondContact O-N 3.01Å
587	K	29.5	Very low	40.5	Very low	212 Å²	212	108.9 Å²	108.9	92%	0.922	62%	0.616	S	S	*	*			trans	-61.9	90.8	162.5	-66	-179.9	179.2	-179.1	0	108.8	R589	K587-R589 PolarHBondContact O-N 3.31Å
588	S	32.2	Very low	37.9	Very low	98 Å²	98	117.9 Å²	117.9	69%	0.685	65%	0.65	S	S	*	*			trans	-58.6	127	160.9	-172.4	0	0	0	0	107.2	R586 I590	R586-S588 VanDerWaalsContact C-N 3.3Å; R586-S588 PolarHBondContact O-N 3.01Å; S588-I590 PolarHBondContact O-N 2.73Å
589	R	29.1	Very low	35.7	Very low	232 Å²	232	126.2 Å²	126.2	88%	0.875	69%	0.686	S	S	*	*			trans	-70.8	93.6	164.2	-69.2	-176.1	-171.4	163.7	2.4	105.9	K587 S591	K587-R589 PolarHBondContact O-N 3.31Å; R589-S591 PolarHBondContact O-N 2.77Å
590	I	33.1	Very low	33.5	Very low	138 Å²	138	129.7 Å²	129.7	71%	0.708	71%	0.707	S	S	*	*			trans	-65.1	95	165.8	-62.1	175.8	0	0	0	105.6	S588 T592	S588-I590 PolarHBondContact O-N 2.73Å; I590-T592 HydrophobicContact CG2-CG2 4.28Å; I590-T592 PolarHBondContact O-N 2.88Å
591	S	28.4	Very low	31.6	Very low	93 Å²	93	133.5 Å²	133.5	65%	0.65	74%	0.74	S	S	*	*			trans	-60.1	105.9	161.9	-52.1	0	0	0	0	106.4	R589 T593	R589-S591 PolarHBondContact O-N 2.77Å; S591-T593 PolarHBondContact O-N 3.29Å
592	T	27.9	Very low	30.4	Very low	123 Å²	123	136.4 Å²	136.4	76%	0.755	75%	0.751	S	S	*	*			trans	-72.5	72.2	176.5	36.2	0	0	0	0	110.2	I590	I590-T592 HydrophobicContact CG2-CG2 4.28Å; I590-T592 PolarHBondContact O-N 2.88Å
593	T	30.4	Very low	29.4	Very low	118 Å²	118	135.6 Å²	135.6	72%	0.724	76%	0.756	S	S	*	*			trans	-95.1	125.1	169.6	51.3	0	0	0	0	108.9	S591 S595	S591-T593 PolarHBondContact O-N 3.29Å; T593-S595 PolarHBondContact O-N 3.4Å; T593-S595 VanDerWaalsContact O-N 3.12Å
594	N	30.3	Very low	29.1	Very low	141 Å²	141	137.8 Å²	137.8	75%	0.754	76%	0.76	S	S	*	*			trans	-76.5	97.7	-153.7	-62.2	-48.2	0	0	0	115.8
595	S	27.9	Very low	29	Very low	115 Å²	115	140.3 Å²	140.3	80%	0.804	75%	0.753	S	S	*	*			trans	-170.5	123.6	150	55.2	0	0	0	0	108.8	T593	T593-S595 PolarHBondContact O-N 3.4Å; T593-S595 VanDerWaalsContact O-N 3.12Å
596	C	25.1	Very low	29	Very low	87 Å²	87	142.7 Å²	142.7	59%	0.588	75%	0.749	S	S	*	*			cis	-110.3	118.4	16.2	-171.2	0	0	0	0	112.8
597	T	26.1	Very low	28.8	Very low	92 Å²	92	143 Å²	143	56%	0.564	75%	0.752	S	S	*	*			trans	-95.9	113.3	152.3	43	0	0	0	0	107.2	K599	T597-K599 PolarHBondContact O-N 3.05Å
598	Y	27.6	Very low	28.6	Very low	199 Å²	199	138.3 Å²	138.3	78%	0.78	75%	0.745	S	S	*	*			trans	-70.5	73.2	164.5	-64.5	-75	0	0	0	108.7	M600	Y598-M600 VanDerWaalsContact C-N 3.33Å; Y598-M600 PolarHBondContact O-N 3.47Å
599	K	28.5	Very low	28.6	Very low	178 Å²	178	140 Å²	140	77%	0.774	75%	0.751	S	S	*	*			trans	-64.9	100.2	164.9	-78.4	-167.3	175.1	-172.9	0	107	T597 A601	T597-K599 PolarHBondContact O-N 3.05Å; K599-A601 PolarHBondContact O-N 2.98Å
600	M	26.7	Very low	28.4	Very low	154 Å²	154	135.9 Å²	135.9	76%	0.759	75%	0.746	S	S	*	*			trans	-53.2	106.5	166.2	-69.5	-66.2	-74	0	0	107.7	Y598 L602	Y598-M600 VanDerWaalsContact C-N 3.33Å; Y598-M600 PolarHBondContact O-N 3.47Å; M600-L602 PolarHBondContact O-N 3.24Å
601	A	25.9	Very low	28.4	Very low	93 Å²	93	140 Å²	140	77%	0.769	76%	0.755	S	S	*	*			trans	-77.2	69.4	-178.1	0	0	0	0	0	109.9	K599 S603	K599-A601 PolarHBondContact O-N 2.98Å; A601-S603 PolarHBondContact O-N 2.9Å
602	L	30	Very low	28.6	Very low	154 Å²	154	144.6 Å²	144.6	81%	0.806	76%	0.763	S	S	*	*			trans	-72.5	74.7	167.3	-80.5	165.8	0	0	0	109.1	M600 N604	M600-L602 PolarHBondContact O-N 3.24Å; L602-N604 VanDerWaalsContact C-N 3.31Å; L602-N604 PolarHBondContact O-N 3.34Å
603	S	26.3	Very low	28.8	Very low	105 Å²	105	143.3 Å²	143.3	73%	0.734	76%	0.759	S	S	*	*			trans	-75.7	82	170	56.9	0	0	0	0	110	A601	A601-S603 PolarHBondContact O-N 2.9Å
604	N	30.4	Very low	29.1	Very low	143 Å²	143	146.5 Å²	146.5	77%	0.765	77%	0.766	S	S	*	*			trans	-109.7	114.1	156.5	-88.6	-11.3	0	0	0	107.7	L602	L602-N604 VanDerWaalsContact C-N 3.31Å; L602-N604 PolarHBondContact O-N 3.34Å
605	E	29.6	Very low	29.4	Very low	163 Å²	163	145 Å²	145	76%	0.762	77%	0.766	S	S	*	*			trans	-77.9	172.2	177.5	-58.4	-169.8	150.9	0	0	112.5
606	N	30	Very low	29.6	Very low	122 Å²	122	145.6 Å²	145.6	65%	0.652	77%	0.765	S	S	*	*			trans	64.4	92.7	152.8	-55.1	-42.6	0	0	0	117.6
607	Y	29.8	Very low	30.2	Very low	244 Å²	244	146.2 Å²	146.2	96%	0.957	77%	0.768	S	S	*	*				-149.8	148.1	122.4	-91.6	-66.2	0	0	0	110.2
608	S	25	Very low	30.8	Very low	112 Å²	112	151.1 Å²	151.1	78%	0.783	78%	0.782	S	S	*	*			trans	-129.6	136.3	-170.3	-47.8	0	0	0	0	112.1
609	V	32.5	Very low	31.2	Very low	133 Å²	133	146.4 Å²	146.4	81%	0.806	78%	0.778	S	S	*	*			trans	-139.4	135.2	168.3	-174.4	0	0	0	0	110
610	N	24.7	Very low	31.6	Very low	146 Å²	146	143.5 Å²	143.5	78%	0.781	78%	0.775	S	S	*	*			trans	-83.9	148.1	-177.9	-85.3	-67.7	0	0	0	113.3
611	Y	33.7	Very low	32.1	Very low	226 Å²	226	141.5 Å²	141.5	89%	0.886	77%	0.773	S	S	*	*			trans	-131.6	103.3	150.7	-80.3	-72.4	0	0	0	112.9
612	K	32.6	Very low	32.5	Very low	188 Å²	188	145.7 Å²	145.7	82%	0.817	78%	0.775	S	S	*	*			trans	-40	150.8	172.5	-83.7	171.3	164.5	175	0	117.8
613	S	32.3	Very low	32.7	Very low	97 Å²	97	145.5 Å²	145.5	68%	0.678	77%	0.774	S	S	*	*			trans	56.7	146.5	141.5	59.3	0	0	0	0	119.2
614	Q	35.6	Very low	32.9	Very low	184 Å²	184	146.5 Å²	146.5	86%	0.86	77%	0.771	S	S	*	*			cis	-152	172.5	16.9	-116.1	143.4	-3.4	0	0	106.6
615	S	36.5	Very low	33.1	Very low	110 Å²	110	151.2 Å²	151.2	77%	0.769	78%	0.779	S	S	*	*			cis	-154.2	166.6	21	48.1	0	0	0	0	112.8
616	T	33.6	Very low	33.2	Very low	127 Å²	127	150.4 Å²	150.4	78%	0.779	78%	0.78	S	S	*	*			trans	-76.5	168	175.2	51.2	0	0	0	0	112.7
617	P	37.2	Very low	33.5	Very low	100 Å²	100	149.4 Å²	149.4	65%	0.649	79%	0.789	S	S	*	*			cis	-161.3	160.5	43.8	43.2	-20.1	0	0	0	123.2
618	K	37.4	Very low	33.8	Very low	196 Å²	196	147 Å²	147	85%	0.852	78%	0.784	S	S	*	*			trans	64.9	147.2	143.3	-68.1	162.3	-166.7	176.2	0	119.4
619	S	36.3	Very low	34.2	Very low	99 Å²	99	148.8 Å²	148.8	69%	0.692	78%	0.784	S	S	*	*			cis	-164.7	126.9	-11.6	44.8	0	0	0	0	114.4
620	V	36.6	Very low	34.2	Very low	118 Å²	118	150 Å²	150	72%	0.715	79%	0.786	S	S	*	*			trans	59	126.3	136	-170.4	0	0	0	0	120.9	F622	V620-F622 HydrophobicContact CG1-CE2 4.13Å; V620-F622 HydrophobicContact CG1-CZ 4.44Å
621	P	38.5	Very low	34.3	Very low	112 Å²	112	148.7 Å²	148.7	73%	0.727	79%	0.787	S	S	*	*			trans	-104.9	176.1	173.2	42	-35.4	0	0	0	113.8
622	F	33.8	Very low	34.1	Very low	181 Å²	181	144 Å²	144	79%	0.794	79%	0.787	S	S	*	*			trans	-145.5	128.7	163.5	-79.3	-73.7	0	0	0	115.2	V620	V620-F622 HydrophobicContact CG1-CE2 4.13Å; V620-F622 HydrophobicContact CG1-CZ 4.44Å
623	L	34.9	Very low	34.1	Very low	150 Å²	150	141 Å²	141	79%	0.785	79%	0.787	S	S	*	*			trans	53.5	118.3	146.7	-52.9	171.5	0	0	0	119.9
624	N	30.7	Very low	33.8	Very low	126 Å²	126	143.9 Å²	143.9	67%	0.674	79%	0.794	S	S	*	*				70	115.5	64.5	-88.9	30.6	0	0	0	116.2
625	Y	33.6	Very low	33.5	Very low	241 Å²	241	141.8 Å²	141.8	95%	0.945	79%	0.794	S	S	*	*				-155.1	120.6	128.3	-107.2	-72.7	0	0	0	110.1
626	D	32.7	Very low	33.2	Very low	147 Å²	147	140.5 Å²	140.5	79%	0.786	80%	0.798	S	S	*	*			trans	-89.5	135.5	177.6	-70.2	-70.4	0	0	0	112.2
627	A	35.7	Very low	33	Very low	100 Å²	100	139 Å²	139	83%	0.826	79%	0.792	S	S	*	*			trans	-160.2	102.8	152.2	0	0	0	0	0	112.9
628	K	36.8	Very low	32.7	Very low	195 Å²	195	141.3 Å²	141.3	85%	0.848	80%	0.795	S	S	*	*			trans	-30.2	129.4	168.1	-56.7	160.1	-177.4	173.1	0	115.3
629	N	33	Very low	32.5	Very low	148 Å²	148	143.1 Å²	143.1	79%	0.791	80%	0.796	S	S	*	*				-172.4	152.9	106.8	-93.7	-24.2	0	0	0	114.1
630	N	32.6	Very low	32.1	Very low	159 Å²	159	144.7 Å²	144.7	85%	0.85	80%	0.797	S	S	*	*			trans	-45.5	126.6	-173.1	-52.6	-28.7	0	0	0	116
631	C	26.9	Very low	31.9	Very low	119 Å²	119	147.3 Å²	147.3	80%	0.804	80%	0.799	S	S	*	*			trans	-134.2	136.6	159.5	-86	0	0	0	0	111.6
632	S	28.3	Very low	31.5	Very low	127 Å²	127	148 Å²	148	89%	0.888	80%	0.796	S	S	*	*			trans	-148.5	109.9	163.3	-64	0	0	0	0	108.7
633	P	33.1	Very low	31.3	Very low	126 Å²	126	145.6 Å²	145.6	82%	0.818	79%	0.792	S	S	*	*			trans	-130.1	165.2	156.5	34.9	-21.1	0	0	0	113.1
634	L	26.5	Very low	31.2	Very low	157 Å²	157	145.9 Å²	145.9	82%	0.822	79%	0.789	S	S	*	*			trans	-94.2	162.7	-179.9	-78.2	154.6	0	0	0	111.9
635	T	28.8	Very low	31.3	Very low	140 Å²	140	146.8 Å²	146.8	86%	0.859	79%	0.793	S	S	*	*			trans	59.8	133.8	149.5	49.5	0	0	0	0	120.3
636	G	29.3	Very low	31.3	Very low	82 Å²	82	142 Å²	142	85%	0.845	78%	0.784	S	S	*	*			trans	170.8	108.8	165.1	0	0	0	0	0	115.7
637	S	30.8	Very low	31.6	Very low	95 Å²	95	140.2 Å²	140.2	66%	0.664	78%	0.781	S	S	*	*			trans	-51.2	155.7	180	-103.2	0	0	0	0	120.4
638	E	30.6	Very low	31.6	Very low	150 Å²	150	143.3 Å²	143.3	70%	0.701	78%	0.778	S	S	*	*			trans	68	109.3	133.9	-67.3	158.3	-125.7	0	0	123.2
639	R	32.2	Very low	31.5	Very low	233 Å²	233	141.8 Å²	141.8	88%	0.879	77%	0.771	S	S	*	*				-178	170	98	-102	156	-65.4	173.5	2.7	114.7
640	N	29.1	Very low	31.8	Very low	132 Å²	132	141.7 Å²	141.7	71%	0.706	77%	0.77	S	S	*	*			trans	-92.3	161.9	-176.2	-52.3	-36.9	0	0	0	113.2
641	F	31.1	Very low	32	Very low	174 Å²	174	138.3 Å²	138.3	76%	0.763	75%	0.751	S	S	*	*				165.3	127.6	106.3	-86.6	-62.9	0	0	0	115.4
642	N	31.2	Very low	32.3	Very low	126 Å²	126	142.6 Å²	142.6	67%	0.674	75%	0.752	S	S	*	*			trans	56.7	131.6	139.7	-61.4	1.9	0	0	0	125.8
643	N	29.4	Very low	32.5	Very low	131 Å²	131	142.1 Å²	142.1	70%	0.701	74%	0.736	S	S	*	*			trans	68.7	157.8	142.1	-61.2	19.2	0	0	0	119
644	E	32.3	Very low	32.5	Very low	155 Å²	155	143.4 Å²	143.4	72%	0.724	73%	0.729	S	S	*	*			cis	-154.4	146	12.9	-149.6	147.6	-110.5	0	0	115.3
645	L	33.2	Very low	32.7	Very low	146 Å²	146	142.9 Å²	142.9	76%	0.764	73%	0.725	S	S	*	*			trans	44.8	150.5	151.3	-75.7	173.5	0	0	0	127.5
646	N	34.4	Very low	32.8	Very low	141 Å²	141	141.4 Å²	141.4	75%	0.754	72%	0.718	S	S	*	*			trans	100	145.8	148.1	-75.5	-7.5	0	0	0	122.3
647	P	37.9	Very low	33	Very low	109 Å²	109	145.4 Å²	145.4	71%	0.708	72%	0.718	S	S	*	*			trans	-141.1	-155.9	-134.7	41.5	-18.6	0	0	0	116.8
648	E	36	Very low	32.7	Very low	164 Å²	164	147.9 Å²	147.9	77%	0.766	72%	0.724	S	S	*	*			trans	84	141.1	172	-50.2	-155.4	135.7	0	0	117
649	F	35.2	Very low	32.7	Very low	163 Å²	163	149.2 Å²	149.2	72%	0.715	74%	0.735	S	S	*	*			cis	-156	165.4	-4.8	-137.7	-130.2	0	0	0	110.8
650	I	38.3	Very low	32.5	Very low	147 Å²	147	146.7 Å²	146.7	75%	0.754	73%	0.73	S	S	*	*			trans	70.9	143.4	162.9	-65.3	152.2	0	0	0	118.3
651	D	36.5	Very low	32.4	Very low	88 Å²	88	147.5 Å²	147.5	47%	0.471	73%	0.732	S	S	.	*				-174	168.9	-64.6	-111	-79.8	0	0	0	106.7	Q653	D651-Q653 WeakPolarHBondContact OD1-CG 3.41Å; D651-Q653 PolarHBondContact OD1-NE2 2.81Å
652	Y	34.1	Very low	32.3	Very low	208 Å²	208	145.5 Å²	145.5	82%	0.816	73%	0.729	S	S	*	*			cis	-123.1	159.4	5.3	-71	-74.2	0	0	0	108.8
653	Q	32.1	Very low	32.6	Very low	118 Å²	118	143.9 Å²	143.9	55%	0.551	73%	0.726	S	S	*	*			cis	68.6	135.1	48.2	-55.8	-162.9	60.9	0	0	116.3	D651	D651-Q653 WeakPolarHBondContact OD1-CG 3.41Å; D651-Q653 PolarHBondContact OD1-NE2 2.81Å
654	K	32.7	Very low	32.6	Very low	153 Å²	153	147.5 Å²	147.5	67%	0.665	73%	0.731	S	S	*	*			cis	-156.1	133.8	-15.4	-111.2	-179.8	-170.9	146.6	0	108.7
655	I	30.6	Very low	32.4	Very low	145 Å²	145	145.8 Å²	145.8	74%	0.744	73%	0.727	S	S	*	*				63	123.4	94.9	-61.3	-175.6	0	0	0	115.9
656	P	32.2	Very low	32.3	Very low	110 Å²	110	145.2 Å²	145.2	71%	0.714	72%	0.724	S	S	*	*			trans	-96	163.8	164.6	39.1	-33.9	0	0	0	112.8
657	I	32.2	Very low	32	Very low	165 Å²	165	145.1 Å²	145.1	85%	0.846	72%	0.723	S	S	*	*			trans	179.1	153.3	141.7	-96.3	154.2	0	0	0	110.2
658	N	25.9	Very low	31.5	Very low	147 Å²	147	145 Å²	145	79%	0.786	73%	0.725	S	S	*	*			trans	-71.7	158.7	-179.2	-48.2	-82.7	0	0	0	113.8
659	L	29.8	Very low	31.1	Very low	179 Å²	179	141.6 Å²	141.6	94%	0.937	72%	0.719	S	S	*	*			trans	-161.3	178.7	132.4	-107.2	166.2	0	0	0	112
660	K	27.9	Very low	30.9	Very low	179 Å²	179	144.2 Å²	144.2	78%	0.778	73%	0.726	S	S	*	*			trans	-100.1	154.2	-160.1	-85	179.7	168.6	-178.2	0	115.6
661	M	26.8	Very low	30.2	Very low	150 Å²	150	142.8 Å²	142.8	74%	0.739	73%	0.728	S	S	*	*			trans	61	155.3	142.9	-76.1	9.6	-151.5	0	0	118.2
662	D	30	Very low	29.9	Very low	132 Å²	132	146.9 Å²	146.9	71%	0.706	75%	0.748	S	S	*	*			cis	-146.5	174.6	-2.8	-115.3	-26.4	0	0	0	109.4
663	P	36.8	Very low	29.5	Very low	92 Å²	92	145 Å²	145	60%	0.597	75%	0.746	S	S	*	*			trans	-93	171.4	-164.5	38	-39.2	0	0	0	115.1
664	Y	29	Very low	29.5	Very low	206 Å²	206	148 Å²	148	81%	0.808	76%	0.758	S	S	*	*				173	158.4	121.8	-101.2	-71.8	0	0	0	112.5
665	N	29.5	Very low	29.5	Very low	120 Å²	120	147.4 Å²	147.4	64%	0.642	76%	0.762	S	S	*	*			trans	64.6	112.4	157.6	-64.3	-14.9	0	0	0	117.7
666	N	29.4	Very low	29.4	Very low	133 Å²	133	145.8 Å²	145.8	71%	0.711	76%	0.759	S	S	*	*				104.1	145	87.3	-80	-9.8	0	0	0	110.6
667	L	29.4	Very low	29.5	Very low	139 Å²	139	150.2 Å²	150.2	73%	0.728	77%	0.767	S	S	*	*			cis	-158	159.4	-3.4	-162.6	70.4	0	0	0	108.8
668	S	27.7	Very low	29.3	Very low	106 Å²	106	149.7 Å²	149.7	74%	0.741	77%	0.765	S	S	*	*			trans	60.9	159.2	156.4	59	0	0	0	0	118.5
669	S	27.4	Very low	29.7	Very low	94 Å²	94	151.9 Å²	151.9	66%	0.657	77%	0.767	S	S	*	*			cis	-158.4	147	-24.1	46.6	0	0	0	0	106.1
670	Y	29.9	Very low	29.8	Very low	218 Å²	218	151.3 Å²	151.3	86%	0.855	76%	0.76	S	S	*	*				-160.6	138.6	79.9	-112.3	-94.9	0	0	0	111
671	C	24.4	Very low	29.7	Very low	117 Å²	117	153.2 Å²	153.2	79%	0.791	76%	0.764	S	S	*	*			trans	-111	148.4	170.7	-56.2	0	0	0	0	109.9
672	I	30.1	Very low	30	Very low	173 Å²	173	153.5 Å²	153.5	89%	0.887	77%	0.768	S	S	*	*			trans	-128.6	129.8	147.3	-62.3	-175	0	0	0	107.6
673	E	25.8	Very low	30.1	Very low	169 Å²	169	151.1 Å²	151.1	79%	0.79	76%	0.762	S	S	*	*			trans	-121.1	-174.7	-172.3	-163.8	-177.9	-156.7	0	0	109.2
674	K	32.4	Very low	29.9	Very low	181 Å²	181	154 Å²	154	79%	0.787	77%	0.772	S	S	*	*			trans	101	140.4	174.7	-57.8	160.5	-175.3	172.6	0	114
675	N	32.8	Very low	30.2	Very low	140 Å²	140	151.3 Å²	151.3	75%	0.749	77%	0.77	S	S	*	*			cis	-153	157.5	-10.5	-118.6	-15.8	0	0	0	114.2
676	T	27.9	Very low	30.3	Very low	111 Å²	111	151.8 Å²	151.8	68%	0.681	78%	0.78	S	S	*	*			trans	-47.7	153.6	172.2	50.4	0	0	0	0	116.7
677	K	34.7	Very low	30.5	Very low	204 Å²	204	151.6 Å²	151.6	89%	0.887	78%	0.783	S	S	*	*				-163.4	141.5	129.1	-108	157.5	-171.4	174.9	0	113.1
678	L	28.1	Very low	30.5	Very low	153 Å²	153	153.2 Å²	153.2	80%	0.801	79%	0.789	S	S	*	*			trans	-89.3	153.7	175.5	-61.7	81.9	0	0	0	111
679	K	33.4	Very low	30.8	Very low	193 Å²	193	158 Å²	158	84%	0.839	80%	0.797	S	S	*	*			trans	163.1	153.7	130.6	-90.5	165.4	179.5	-171.5	0	108.5
680	Q	31.5	Very low	31.2	Very low	167 Å²	167	163.1 Å²	163.1	78%	0.78	81%	0.807	S	S	*	*			cis	169.7	140	-16.4	173.4	168.9	-9.9	0	0	102.6
681	Y	27.1	Very low	31	Very low	220 Å²	220	158.1 Å²	158.1	86%	0.863	80%	0.804	S	S	*	*			trans	-80.5	143.8	-174.5	-95.7	-96.8	0	0	0	113.3
682	D	32.7	Very low	31.1	Very low	155 Å²	155	160.4 Å²	160.4	83%	0.829	80%	0.801	S	S	*	*			trans	-177.3	154.7	144.2	-93	-31	0	0	0	109.1
683	S	31.2	Very low	31.1	Very low	83 Å²	83	159.6 Å²	159.6	58%	0.58	80%	0.797	S	S	*	*			cis	-160.6	162.3	-30.6	61.9	0	0	0	0	110.9
684	N	32.6	Very low	31.1	Very low	151 Å²	151	158.4 Å²	158.4	81%	0.807	79%	0.792	S	S	*	*			trans	48.7	79.9	148.5	-56.4	-25.8	0	0	0	122.1
685	I	37	Very low	30.9	Very low	151 Å²	151	155.3 Å²	155.3	77%	0.774	78%	0.783	S	S	*	*			trans	-140.6	120.9	142.7	-55.8	-178.3	0	0	0	110.5	V687	I685-V687 HydrophobicContact CG2-CG2 4.42Å
686	P	30.2	Very low	30.6	Very low	129 Å²	129	154 Å²	154	84%	0.838	79%	0.785	S	S	*	*			trans	-91.4	106.2	175.4	33.5	-30.6	0	0	0	112.3
687	V	34.1	Very low	30.5	Very low	130 Å²	130	156.1 Å²	156.1	79%	0.788	79%	0.787	S	S	*	*			trans	-85.3	132	176.3	-179	0	0	0	0	111.3	I685 K689	I685-V687 HydrophobicContact CG2-CG2 4.42Å; V687-K689 PolarHBondContact O-N 2.73Å
688	M	29.1	Very low	30	Very low	172 Å²	172	155.3 Å²	155.3	85%	0.847	78%	0.783	S	S	*	*			trans	-57.7	122.5	-177.8	-66.2	159.9	58.8	0	0	113.2	K690	M688-K690 PolarHBondContact O-N 3.47Å
689	K	35	Very low	29.8	Very low	208 Å²	208	156.1 Å²	156.1	90%	0.904	78%	0.78	S	S	*	*			trans	-74.9	108.9	161.8	-78.9	-173	175.2	-179.3	0	109.6	V687	V687-K689 PolarHBondContact O-N 2.73Å
690	K	35.4	Very low	29.4	Very low	200 Å²	200	152.1 Å²	152.1	87%	0.87	77%	0.772	S	S	*	*			trans	-59.3	146.4	168	-78.9	-175.3	173.9	-179.3	0	110.9	M688	M688-K690 PolarHBondContact O-N 3.47Å
691	S	25	Very low	29	Very low	114 Å²	114	149.3 Å²	149.3	80%	0.797	76%	0.761	S	S	*	*			trans	-88	150.9	179.1	45.2	0	0	0	0	113.1
692	K	27.4	Very low	28.9	Very low	164 Å²	164	148.6 Å²	148.6	71%	0.713	76%	0.763	S	S	*	*			trans	40.4	105.6	151.9	-162.1	173.2	-173.4	178	0	118.7	E694	K692-E694 WeakPolarHBondContact CE-OE2 3.49Å; K692-E694 IonicContact NZ-OE2 2.85Å; K692-E694 PolarHBondContact NZ-OE2 3.41Å
693	L	30.1	Very low	28.5	Very low	156 Å²	156	144.7 Å²	144.7	82%	0.817	75%	0.748	S	S	*	*			trans	-136.6	105.2	146.1	-111.5	168.8	0	0	0	108.7	L695	L693-L695 HydrophobicContact CB-CD1 4.49Å; L693-L695 HydrophobicContact CD2-CD1 4.42Å; L693-L695 PolarHBondContact O-N 2.88Å; L693-L695 VanDerWaalsContact O-N 3.17Å
694	E	25.5	Very low	28.3	Very low	144 Å²	144	147.3 Å²	147.3	67%	0.673	76%	0.755	S	S	*	*			trans	-76.6	96.3	171.6	-70.7	176.1	108.7	0	0	108.3	K692 S696	K692-E694 WeakPolarHBondContact CE-OE2 3.49Å; K692-E694 IonicContact NZ-OE2 2.85Å; K692-E694 PolarHBondContact NZ-OE2 3.41Å; E694-S696 VanDerWaalsContact C-N 3.34Å; E694-S696 PolarHBondContact O-N 3.37Å
695	L	28.2	Very low	28	Very low	116 Å²	116	146.5 Å²	146.5	61%	0.607	76%	0.756	S	S	*	*			trans	-73.9	93.8	168.3	-106	75	0	0	0	109.2	L693 H697	L693-L695 HydrophobicContact CB-CD1 4.49Å; L693-L695 HydrophobicContact CD2-CD1 4.42Å; L693-L695 PolarHBondContact O-N 2.88Å; L693-L695 VanDerWaalsContact O-N 3.17Å; L695-H697 PolarHBondContact O-CD2 3.09Å; L695-H697 PolarHBondContact O-N 3.33Å
696	S	25.4	Very low	27.6	Very low	112 Å²	112	144 Å²	144	78%	0.783	74%	0.743	S	S	*	*			trans	-59.4	83.9	165.6	-63.3	0	0	0	0	109.9	E694 K698	E694-S696 VanDerWaalsContact C-N 3.34Å; E694-S696 PolarHBondContact O-N 3.37Å; S696-K698 PolarHBondContact O-N 2.76Å
697	H	26.1	Very low	27.4	Very low	156 Å²	156	144.9 Å²	144.9	72%	0.722	74%	0.739	S	S	*	*			trans	-69.7	72.8	174.7	-81.9	-70.4	0	0	0	110.6	L695 K699	L695-H697 PolarHBondContact O-CD2 3.09Å; L695-H697 PolarHBondContact O-N 3.33Å; H697-K699 PolarHBondContact O-N 2.96Å
698	K	25.6	Very low	27.2	Very low	187 Å²	187	139.4 Å²	139.4	81%	0.813	71%	0.706	S	S	*	*			trans	-66.2	71.2	165	-168.7	176	-175	177.8	0	107.9	S696 T700	S696-K698 PolarHBondContact O-N 2.76Å; K698-T700 VanDerWaalsContact C-N 3.26Å; K698-T700 PolarHBondContact O-N 3.4Å; K698-T700 PolarHBondContact O-OG1 3.13Å
699	K	24.1	Very low	27.7	Very low	170 Å²	170	136.5 Å²	136.5	74%	0.739	69%	0.691	S	S	*	*			trans	-71.4	86.1	-178.3	-167.5	-178	-179.7	179.6	0	107.7	H697 I701	H697-K699 PolarHBondContact O-N 2.96Å; K699-I701 HydrophobicContact CD-CD1 4.14Å; K699-I701 HydrophobicContact CD-CG1 4.06Å; K699-I701 HydrophobicContact CG-CD1 4.45Å; K699-I701 HydrophobicContact CG-CG1 3.85Å; K699-I701 WeakPolarHBondContact O-CG1 3.22Å; K699-I701 PolarHBondContact O-N 3Å
700	T	23	Very low	28.2	Very low	109 Å²	109	126.8 Å²	126.8	67%	0.669	65%	0.649	S	S	*	*			trans	-67.5	77.8	175.2	-51.9	0	0	0	0	109.2	K698 K702	K698-T700 VanDerWaalsContact C-N 3.26Å; K698-T700 PolarHBondContact O-N 3.4Å; K698-T700 PolarHBondContact O-OG1 3.13Å; T700-K702 PolarHBondContact O-N 3.35Å
701	I	25	Very low	29.3	Very low	108 Å²	108	120.3 Å²	120.3	55%	0.554	62%	0.621	S	S	*	*			trans	-71.4	96.7	174.6	-47.5	-178.8	0	0	0	107.3	K699 S703	K699-I701 HydrophobicContact CD-CD1 4.14Å; K699-I701 HydrophobicContact CD-CG1 4.06Å; K699-I701 HydrophobicContact CG-CD1 4.45Å; K699-I701 HydrophobicContact CG-CG1 3.85Å; K699-I701 WeakPolarHBondContact O-CG1 3.22Å; K699-I701 PolarHBondContact O-N 3Å; I701-S703 VanDerWaalsContact CG2-OG 3.24Å; I701-S703 WeakPolarHBondContact CG2-OG 3.4Å; I701-S703 PolarHBondContact O-N 3.08Å
702	K	24.3	Very low	30.9	Very low	205 Å²	205	114.9 Å²	114.9	89%	0.891	58%	0.583	S	S	*	*			trans	-68.4	84.2	162.1	-68.9	-174.7	177.1	-174.6	0	107.9	T700	T700-K702 PolarHBondContact O-N 3.35Å
703	S	24.5	Very low	32.4	Very low	73 Å²	73	107.1 Å²	107.1	51%	0.51	55%	0.55	S	S	.	.			trans	-137.3	121.9	174.9	59.7	0	0	0	0	111.1	I701	I701-S703 VanDerWaalsContact CG2-OG 3.24Å; I701-S703 WeakPolarHBondContact CG2-OG 3.4Å; I701-S703 PolarHBondContact O-N 3.08Å
704	N	26.5	Very low	33.8	Very low	138 Å²	138	100.8 Å²	100.8	74%	0.738	52%	0.515	S	S	*	.			trans	59.2	82.2	157.8	-53.4	19.7	0	0	0	114.5	I706	N704-I706 HydrophobicContact CB-CG1 4.19Å; N704-I706 PolarHBondContact O-N 2.89Å
705	T	25.7	Very low	35.4	Very low	134 Å²	134	96.6 Å²	96.6	82%	0.822	50%	0.497	S	S	*	.			trans	-55.2	89.3	142.6	26.4	0	0	0	0	108.6	I707	T705-I707 PolarHBondContact O-N 3.3Å
706	I	29.7	Very low	36.6	Very low	98 Å²	98	92.9 Å²	92.9	50%	0.503	48%	0.478	S	S	.	.			trans	-71.3	100.8	169.4	-58	176.3	0	0	0	105.9	V581 N704 S708	V581-I706 HydrophobicContact CG2-CD1 4.41Å; N704-I706 HydrophobicContact CB-CG1 4.19Å; N704-I706 PolarHBondContact O-N 2.89Å; I706-S708 WeakPolarHBondContact CG2-OG 3.21Å; I706-S708 PolarHBondContact O-N 3.47Å
707	I	26	Very low	37.8	Very low	149 Å²	149	87.6 Å²	87.6	76%	0.764	44%	0.441	S	S	*	.			trans	-75.5	65.4	172.7	-50.5	179.2	0	0	0	108.5	T705	T705-I707 PolarHBondContact O-N 3.3Å
708	S	30.6	Very low	39	Very low	14 Å²	14	83.9 Å²	83.9	10%	0.098	42%	0.422	C	S	.	.			trans	-104.2	109.7	155.8	55.4	0	0	0	0	105.6	I706 P710	I706-S708 WeakPolarHBondContact CG2-OG 3.21Å; I706-S708 PolarHBondContact O-N 3.47Å; S708-P710 WeakPolarHBondContact O-CD 3.49Å
709	H	39.4	Very low	39.3	Very low	111 Å²	111	75.3 Å²	75.3	51%	0.514	39%	0.386	S	S	.	.			trans	-68.2	120.1	161.8	-70.4	-92.8	0	0	0	107.3	F711	H709-F711 PolarHBondContact O-N 2.75Å; H709-F711 VanDerWaalsContact O-N 3.11Å
710	P	45.1	Very low	39.7	Very low	5 Å²	5	69.9 Å²	69.9	3%	0.032	37%	0.368	C	S	.	.			trans	-62.3	111.3	163	-14.9	26.4	0	0	0	109.4	L532 L534 V576 L577 T578 S708 S712	L532-P710 HydrophobicContact CB-CG 4.37Å; L532-P710 HydrophobicContact CD1-CG 4.34Å; L534-P710 HydrophobicContact CD1-CB 3.93Å; L534-P710 HydrophobicContact CD1-CG 3.84Å; L534-P710 HydrophobicContact CD2-CG 4.49Å; L534-P710 HydrophobicContact CG-CG 3.97Å; V576-P710 HydrophobicContact CB-CB 4.02Å; V576-P710 HydrophobicContact CG1-CB 4.35Å; V576-P710 HydrophobicContact CG2-CB 4.2Å; L577-P710 CarbonylContact O-C 3.56Å; L577-P710 WeakPolarHBondContact O-CA 3.37Å; T578-P710 HydrophobicContact CG2-CB 3.76Å; T578-P710 HydrophobicContact CG2-CG 4.01Å; S708-P710 WeakPolarHBondContact O-CD 3.49Å; P710-S712 PolarHBondContact O-N 3.3Å
711	F	58.5	Low	40.2	Very low	63 Å²	63	70.4 Å²	70.4	28%	0.276	36%	0.363	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-71	121.8	169.1	-54.6	-84.8	0	0	0	107.1	L458 L577 Y579 H709 N715	L458-F711 HydrophobicContact CD2-CE2 4.34Å; L577-F711 HydrophobicContact CB-CB 4.27Å; L577-F711 HydrophobicContact CD1-CB 4.37Å; L577-F711 PolarHBondContact N-O 3.39Å; L577-F711 PolarHBondContact O-N 2.8Å; L577-F711 VanDerWaalsContact O-N 3.14Å; Y579-F711 AromaticContact CE2-CE2 3.86Å; Y579-F711 HydrophobicContact CE2-CE2 3.86Å; H709-F711 PolarHBondContact O-N 2.75Å; H709-F711 VanDerWaalsContact O-N 3.11Å; F711-N715 HydrophobicContact CB-CB 4.27Å
712	S	58.7	Low	40.8	Very low	0 Å²	0	67.6 Å²	67.6	0%	0	35%	0.349	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-66.3	163.2	170.6	75.1	0	0	0	0	110.3	Y540 P541 P710 Y714 N715	Y540-S712 WeakPolarHBondContact CE1-OG 3.31Å; Y540-S712 VanDerWaalsContact CZ-OG 3.25Å; Y540-S712 PolarHBondContact OH-N 3.43Å; Y540-S712 PolarHBondContact OH-OG 2.05Å; P541-S712 PolarHBondContact O-OG 3.19Å; P710-S712 PolarHBondContact O-N 3.3Å; S712-Y714 PolarHBondContact O-N 3.31Å; S712-Y714 WeakPolarHBondContact OG-CB 3.32Å; S712-Y714 PolarHBondContact OG-N 3.22Å; S712-N715 PolarHBondContact O-N 3.28Å
713	A	58.5	Low	41.2	Very low	2 Å²	2	64.3 Å²	64.3	2%	0.017	34%	0.341	C	S	.	.	G	3₁₀ helix	trans	-52	-21.6	175.7	0	0	0	0	0	113.8	F434 F543 L575 N715 L716	F434-A713 HydrophobicContact CD1-CB 3.92Å; F434-A713 HydrophobicContact CD2-CB 4.37Å; F434-A713 HydrophobicContact CE1-CB 3.71Å; F434-A713 WeakPolarHBondContact CE1-O 3.38Å; F434-A713 HydrophobicContact CE2-CB 4.19Å; F434-A713 HydrophobicContact CG-CB 4.26Å; F434-A713 HydrophobicContact CZ-CB 3.85Å; F543-A713 HydrophobicContact CB-CB 4Å; L575-A713 HydrophobicContact CD2-CB 4.41Å; A713-N715 VanDerWaalsContact C-N 3.26Å; A713-N715 PolarHBondContact O-N 3.23Å; A713-L716 WeakPolarHBondContact O-CB 3.24Å; A713-L716 PolarHBondContact O-N 2.93Å
714	Y	60.8	Low	42	Very low	22 Å²	22	63.9 Å²	63.9	9%	0.086	33%	0.332	C	S	.	.	G	3₁₀ helix	trans	-57.1	-32.5	174.3	-175.6	-126.6	0	0	0	114.3	Y540 P541 W549 Q561 S712 L716 A717 K718	Y540-Y714 HydrophobicContact CE2-CD1 4.42Å; P541-Y714 HydrophobicContact CG-CD1 3.76Å; P541-Y714 HydrophobicContact CG-CD2 3.64Å; P541-Y714 HydrophobicContact CG-CE1 4.13Å; P541-Y714 HydrophobicContact CG-CE2 4.05Å; P541-Y714 HydrophobicContact CG-CG 3.5Å; P541-Y714 VanDerWaalsContact CG-CG 3.5Å; W549-Y714 HydrophobicContact CH2-CD2 4.44Å; Q561-Y714 PolarHBondContact OE1-OH 3.06Å; Q561-Y714 VanDerWaalsContact OE1-OH 3.1Å; S712-Y714 PolarHBondContact O-N 3.31Å; S712-Y714 WeakPolarHBondContact OG-CB 3.32Å; S712-Y714 PolarHBondContact OG-N 3.22Å; Y714-L716 PolarHBondContact O-N 3.4Å; Y714-A717 CarbonylContact O-C 3.58Å; Y714-A717 VanDerWaalsContact O-CA 3.31Å; Y714-A717 WeakPolarHBondContact O-CA 3.38Å; Y714-A717 WeakPolarHBondContact O-CB 3.31Å; Y714-A717 PolarHBondContact O-N 3.02Å; Y714-K718 HydrophobicContact CE1-CG 4.48Å; Y714-K718 PolarHBondContact O-N 2.95Å
715	N	58.4	Low	42.8	Very low	56 Å²	56	60 Å²	60	30%	0.299	31%	0.311	S	S	.	.	G	3₁₀ helix	trans	-77.3	-10.1	179	-63.7	-38.7	0	0	0	113.2	Y540 F711 S712 A713 A717	Y540-N715 PolarHBondContact OH-ND2 2.86Å; F711-N715 HydrophobicContact CB-CB 4.27Å; S712-N715 PolarHBondContact O-N 3.28Å; A713-N715 VanDerWaalsContact C-N 3.26Å; A713-N715 PolarHBondContact O-N 3.23Å; N715-A717 VanDerWaalsContact C-N 3.32Å
716	L	53.9	Low	43.8	Very low	39 Å²	39	55.9 Å²	55.9	20%	0.204	28%	0.283	C	S	.	.	G	3₁₀ helix	trans	-85.9	-5.8	162.2	-62.7	174.2	0	0	0	112.3	F434 L577 A713 Y714	F434-L716 HydrophobicContact CD1-CB 4.29Å; F434-L716 HydrophobicContact CD1-CD1 4.12Å; F434-L716 HydrophobicContact CE1-CB 4.48Å; L577-L716 HydrophobicContact CD1-CD1 4.08Å; L577-L716 HydrophobicContact CD1-CD2 4.03Å; L577-L716 HydrophobicContact CD1-CG 3.93Å; L577-L716 HydrophobicContact CD2-CD1 4.49Å; A713-L716 WeakPolarHBondContact O-CB 3.24Å; A713-L716 PolarHBondContact O-N 2.93Å; Y714-L716 PolarHBondContact O-N 3.4Å
717	A	50.5	Low	44.6	Very low	0 Å²	0	53.4 Å²	53.4	0%	0	27%	0.27	C	S	.	.	S	Bend	trans	-121.5	18	-171.1	0	0	0	0	0	114	V416 L429 W549 Y714 N715	V416-A717 HydrophobicContact CG1-CB 4.14Å; V416-A717 HydrophobicContact CG2-CB 4.26Å; V416-A717 VanDerWaalsContact CG2-O 3.28Å; V416-A717 WeakPolarHBondContact CG2-O 3.3Å; L429-A717 HydrophobicContact CD1-CB 3.64Å; W549-A717 HydrophobicContact CH2-CB 4.41Å; Y714-A717 CarbonylContact O-C 3.58Å; Y714-A717 VanDerWaalsContact O-CA 3.31Å; Y714-A717 WeakPolarHBondContact O-CA 3.38Å; Y714-A717 WeakPolarHBondContact O-CB 3.31Å; Y714-A717 PolarHBondContact O-N 3.02Å; N715-A717 VanDerWaalsContact C-N 3.32Å
718	K	50.6	Low	45.7	Very low	78 Å²	78	47.4 Å²	47.4	34%	0.339	24%	0.239	S	C	.	.			trans	-86.7	137.9	167.6	-76.3	-167.2	169.1	-164.8	0	110.7	Y714 L723	Y714-K718 HydrophobicContact CE1-CG 4.48Å; Y714-K718 PolarHBondContact O-N 2.95Å; K718-L723 HydrophobicContact CD-CD2 4.47Å
719	S	32.4	Very low	46.8	Very low	7 Å²	7	49.7 Å²	49.7	5%	0.049	25%	0.248	C	C	.	.			trans	-70.1	149	167.7	171.1	0	0	0	0	110.1	E721 N722	S719-E721 PolarHBondContact O-N 3.23Å; S719-E721 VanDerWaalsContact O-N 3.09Å; S719-N722 PolarHBondContact O-N 2.98Å
720	P	32	Very low	47.3	Very low	57 Å²	57	45.3 Å²	45.3	37%	0.37	23%	0.229	S	C	.	.	G	3₁₀ helix	trans	-47.5	-35.8	174.2	10.1	-25.4	0	0	0	114	N451 N722 L723	N451-P720 WeakPolarHBondContact OD1-CB 3.48Å; N451-P720 WeakPolarHBondContact OD1-CD 3.25Å; N451-P720 WeakPolarHBondContact OD1-CG 3.28Å; P720-N722 PolarHBondContact O-N 3.2Å; P720-L723 PolarHBondContact O-N 3.07Å
721	E	33.1	Very low	47.5	Very low	119 Å²	119	48.4 Å²	48.4	56%	0.556	24%	0.244	S	C	*	.	G	3₁₀ helix	trans	-73.2	5.6	-173.1	-56.7	176.1	155.1	0	0	113.7	L412 S719	L412-E721 WeakPolarHBondContact CB-OE2 3.37Å; S719-E721 PolarHBondContact O-N 3.23Å; S719-E721 VanDerWaalsContact O-N 3.09Å
722	N	37.2	Very low	46.5	Very low	49 Å²	49	47.2 Å²	47.2	26%	0.262	24%	0.242	S	C	.	.	G	3₁₀ helix	trans	-132.7	32.4	-177.3	-69.1	-92	0	0	0	112.7	S719 P720	S719-N722 PolarHBondContact O-N 2.98Å; P720-N722 PolarHBondContact O-N 3.2Å
723	L	32.5	Very low	45.4	Very low	137 Å²	137	51.5 Å²	51.5	72%	0.717	26%	0.264	S	S	*	.			trans	-130.2	0	173.3	-78.8	171.6	0	0	0	110.9	L454 K718 P720	L454-L723 HydrophobicContact CD2-CD1 4.12Å; L454-L723 HydrophobicContact CD2-CD2 4.47Å; K718-L723 HydrophobicContact CD-CD2 4.47Å; P720-L723 PolarHBondContact O-N 3.07Å

Retrieved 723 of 723 residues in 941.3 ms (Link to these results)

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