G4VM66_SCHMA Loading...

Kruppel-like factor 13,14,16

AlphaFold DB , UniProt , Accession G4VM66, Species SCHMA (Schistosoma mansoni, Blood fluke), Gene n/a, Length 312 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	29.8	Very low	25.6	Very low	242 Å²	242	146.7 Å²	146.7	100%	1.192	89%	0.89	S	S	*	*				0	123.6	0	-70.8	179.4	-161.7	0	0	107.3
2	L	27.8	Very low	25.5	Very low	178 Å²	178	147.7 Å²	147.7	93%	0.932	89%	0.887	S	S	*	*			trans	63.5	93.4	173.4	-54.5	177	0	0	0	117.3
3	C	22.6	Very low	25.7	Very low	136 Å²	136	145.6 Å²	145.6	92%	0.919	88%	0.879	S	S	*	*			trans	-94.3	137.7	154.3	-107.1	0	0	0	0	109.4
4	S	23	Very low	25.8	Very low	110 Å²	110	145.1 Å²	145.1	77%	0.769	88%	0.877	S	S	*	*			trans	-59.7	160.5	178.3	-36.6	0	0	0	0	114.7
5	M	27.3	Very low	25.8	Very low	182 Å²	182	146.1 Å²	146.1	90%	0.897	87%	0.873	S	S	*	*				179.5	127.4	122.3	-94.1	174.8	-165.5	0	0	113.4
6	N	23.5	Very low	25.9	Very low	146 Å²	146	140.9 Å²	140.9	78%	0.781	84%	0.844	S	S	*	*			trans	2.6	148.5	155.2	-58.4	-19.7	0	0	0	121.5
7	T	24.8	Very low	26.1	Very low	141 Å²	141	138.5 Å²	138.5	87%	0.865	83%	0.826	S	S	*	*				176.7	152.9	114	34.2	0	0	0	0	114.4
8	A	28.6	Very low	26.2	Very low	102 Å²	102	139.8 Å²	139.8	84%	0.843	82%	0.822	S	S	*	*			trans	86.5	114	147.3	0	0	0	0	0	120.6
9	G	24.2	Very low	26.2	Very low	80 Å²	80	138.1 Å²	138.1	83%	0.825	81%	0.809	S	S	*	*			trans	-81.4	170.2	179.3	0	0	0	0	0	115.3
10	S	23.4	Very low	26.3	Very low	124 Å²	124	135.5 Å²	135.5	87%	0.867	79%	0.791	S	S	*	*			trans	-79.4	138	-174.3	67.1	0	0	0	0	113.6
11	L	26.6	Very low	26.4	Very low	173 Å²	173	133 Å²	133	91%	0.906	77%	0.774	S	S	*	*			trans	-131.9	125.7	162.8	-82.8	163.4	0	0	0	108.1
12	N	24.5	Very low	26.3	Very low	158 Å²	158	126.8 Å²	126.8	85%	0.845	74%	0.742	S	S	*	*	P	Polyproline II helix	trans	-62.1	141.4	179.1	-91.5	-35.5	0	0	0	112.2	T14	N12-T14 PolarHBondContact O-N 3.18Å
13	P	28.5	Very low	26.2	Very low	121 Å²	121	122.4 Å²	122.4	79%	0.786	72%	0.718	S	S	*	*	P	Polyproline II helix	trans	-73	122.6	174.5	28.6	-30.5	0	0	0	111.2
14	T	26.9	Very low	26.6	Very low	138 Å²	138	120 Å²	120	85%	0.847	70%	0.696	S	S	*	*	P	Polyproline II helix	trans	-66.9	129.8	172.6	35.3	0	0	0	0	111.9	N12	N12-T14 PolarHBondContact O-N 3.18Å
15	I	25.9	Very low	26.9	Very low	161 Å²	161	119.2 Å²	119.2	83%	0.826	68%	0.682	S	S	*	*	P	Polyproline II helix	trans	-64.8	128.8	175.3	-60.4	166.5	0	0	0	109.5
16	P	27.5	Very low	27	Very low	62 Å²	62	115.3 Å²	115.3	40%	0.403	66%	0.663	S	S	.	*	P	Polyproline II helix	trans	-64.3	141.2	177.5	23.5	-30.5	0	0	0	111.6
17	N	28.5	Very low	27.5	Very low	100 Å²	100	111.4 Å²	111.4	54%	0.535	64%	0.638	S	S	.	*	P	Polyproline II helix	trans	-62.3	137.6	-176.7	-167.5	-7.6	0	0	0	110.6	N19 D20	N17-N19 PolarHBondContact O-N 3.42Å; N17-D20 PolarHBondContact O-N 3.47Å
18	Q	27.4	Very low	28.4	Very low	163 Å²	163	109.5 Å²	109.5	76%	0.762	62%	0.615	S	S	*	*	H	α-helix	trans	-57.9	-22.3	-174.8	-149	152.2	-8	0	0	113	H22	Q18-H22 PolarHBondContact O-N 3.28Å
19	N	26.5	Very low	29	Very low	107 Å²	107	113.4 Å²	113.4	57%	0.572	61%	0.608	S	S	*	*	H	α-helix	trans	-70.1	-35.5	174.7	-68.4	-19.1	0	0	0	113.8	N17 I21 H22 M23	N17-N19 PolarHBondContact O-N 3.42Å; N19-I21 VanDerWaalsContact C-N 3.33Å; N19-I21 PolarHBondContact O-N 2.97Å; N19-H22 PolarHBondContact O-N 3.21Å; N19-M23 WeakPolarHBondContact O-CG 3.07Å; N19-M23 PolarHBondContact O-N 3.08Å
20	D	28.1	Very low	29.9	Very low	86 Å²	86	114 Å²	114	46%	0.46	59%	0.592	S	S	.	*	H	α-helix	trans	-71.5	-32	-179	-67.4	-36.4	0	0	0	111.8	N17 N24	N17-D20 PolarHBondContact O-N 3.47Å; D20-N24 WeakPolarHBondContact O-CB 3.38Å; D20-N24 PolarHBondContact O-N 3.44Å; D20-N24 PolarHBondContact O-ND2 2.88Å
21	I	29.8	Very low	31	Very low	83 Å²	83	110.9 Å²	110.9	43%	0.426	57%	0.565	S	S	.	*	H	α-helix	trans	-69.4	-43.1	174	-59	174.3	0	0	0	109.9	N19 L25	N19-I21 VanDerWaalsContact C-N 3.33Å; N19-I21 PolarHBondContact O-N 2.97Å; I21-L25 HydrophobicContact CG2-CD1 4.05Å; I21-L25 WeakPolarHBondContact O-CG 3.11Å; I21-L25 PolarHBondContact O-N 3.36Å; I21-L25 VanDerWaalsContact O-N 3.13Å
22	H	27.1	Very low	31.9	Very low	112 Å²	112	105 Å²	105	52%	0.519	54%	0.535	S	S	.	.	H	α-helix	trans	-65.8	-43.7	-179.9	-164.5	73.1	0	0	0	112.3	Q18 N19 L25 M26	Q18-H22 PolarHBondContact O-N 3.28Å; N19-H22 PolarHBondContact O-N 3.21Å; H22-L25 PolarHBondContact O-N 3.46Å; H22-M26 PolarHBondContact O-N 3.41Å
23	M	24.7	Very low	32.9	Very low	86 Å²	86	101 Å²	101	42%	0.424	51%	0.513	S	S	.	.	H	α-helix	trans	-61.1	-47.3	176.8	-71.9	-67.5	-78.4	0	0	111.5	N19 L25 M26 Y27	N19-M23 WeakPolarHBondContact O-CG 3.07Å; N19-M23 PolarHBondContact O-N 3.08Å; M23-L25 PolarHBondContact O-N 2.76Å; M23-M26 PolarHBondContact O-N 3.07Å; M23-Y27 HydrophobicContact CB-CD2 4.45Å; M23-Y27 HydrophobicContact CB-CE2 4.17Å; M23-Y27 HydrophobicContact CE-CE2 3.82Å; M23-Y27 WeakPolarHBondContact CE-OH 3.38Å; M23-Y27 WeakPolarHBondContact O-CD2 3.49Å; M23-Y27 PolarHBondContact O-N 3.04Å
24	N	31	Very low	33.8	Very low	86 Å²	86	98 Å²	98	46%	0.46	49%	0.487	S	S	.	.	H	α-helix	trans	-61.7	-29.4	176.6	-97.3	-58.2	0	0	0	113.6	D20 R28	D20-N24 WeakPolarHBondContact O-CB 3.38Å; D20-N24 PolarHBondContact O-N 3.44Å; D20-N24 PolarHBondContact O-ND2 2.88Å; N24-R28 VanDerWaalsContact O-CG 3.24Å; N24-R28 WeakPolarHBondContact O-CG 3.44Å; N24-R28 PolarHBondContact O-N 3.35Å; N24-R28 PolarHBondContact O-NE 3.39Å
25	L	30.9	Very low	34.7	Very low	92 Å²	92	94 Å²	94	48%	0.482	46%	0.459	S	S	.	.	H	α-helix	trans	-77.8	-37.4	175.9	-73	167.7	0	0	0	112.1	I21 H22 M23 R28 R29	I21-L25 HydrophobicContact CG2-CD1 4.05Å; I21-L25 WeakPolarHBondContact O-CG 3.11Å; I21-L25 PolarHBondContact O-N 3.36Å; I21-L25 VanDerWaalsContact O-N 3.13Å; H22-L25 PolarHBondContact O-N 3.46Å; M23-L25 PolarHBondContact O-N 2.76Å; L25-R28 PolarHBondContact O-N 3.3Å; L25-R29 PolarHBondContact O-N 3.35Å
26	M	28.2	Very low	35.6	Very low	100 Å²	100	89.3 Å²	89.3	49%	0.493	44%	0.436	S	S	.	.	H	α-helix	trans	-64.1	-47.8	174.2	-72	-173.1	91.8	0	0	111.6	H22 M23 R28 R29 D30	H22-M26 PolarHBondContact O-N 3.41Å; M23-M26 PolarHBondContact O-N 3.07Å; M26-R28 VanDerWaalsContact C-N 3.26Å; M26-R28 PolarHBondContact O-N 3.22Å; M26-R29 WeakPolarHBondContact O-CB 3.44Å; M26-R29 PolarHBondContact O-N 3.19Å; M26-D30 PolarHBondContact O-N 2.71Å; M26-D30 VanDerWaalsContact O-N 3.07Å
27	Y	34.4	Very low	36.5	Very low	65 Å²	65	91.2 Å²	91.2	26%	0.255	44%	0.442	S	S	.	.	H	α-helix	trans	-59.9	-35.4	177.9	-73	-61.7	0	0	0	113.2	M23 R29 L31 T165	M23-Y27 HydrophobicContact CB-CD2 4.45Å; M23-Y27 HydrophobicContact CB-CE2 4.17Å; M23-Y27 HydrophobicContact CE-CE2 3.82Å; M23-Y27 WeakPolarHBondContact CE-OH 3.38Å; M23-Y27 WeakPolarHBondContact O-CD2 3.49Å; M23-Y27 PolarHBondContact O-N 3.04Å; Y27-R29 VanDerWaalsContact C-N 3.32Å; Y27-L31 PolarHBondContact O-N 3.34Å; Y27-T165 HydrophobicContact CD2-CG2 4.38Å; Y27-T165 HydrophobicContact CE2-CG2 3.71Å
28	R	43.5	Very low	37.2	Very low	100 Å²	100	87.7 Å²	87.7	38%	0.377	42%	0.422	S	S	.	.	H	α-helix	trans	-64.1	-37.6	175.4	-83.6	-177.6	-97.3	-168.5	-5.3	112.1	N24 L25 M26 L32	N24-R28 VanDerWaalsContact O-CG 3.24Å; N24-R28 WeakPolarHBondContact O-CG 3.44Å; N24-R28 PolarHBondContact O-N 3.35Å; N24-R28 PolarHBondContact O-NE 3.39Å; L25-R28 PolarHBondContact O-N 3.3Å; M26-R28 VanDerWaalsContact C-N 3.26Å; M26-R28 PolarHBondContact O-N 3.22Å; R28-L32 VanDerWaalsContact O-CB 3.28Å; R28-L32 WeakPolarHBondContact O-CB 3.47Å; R28-L32 PolarHBondContact O-N 3.01Å
29	R	42.3	Very low	37.8	Very low	184 Å²	184	82.4 Å²	82.4	69%	0.694	40%	0.398	S	S	*	.	H	α-helix	trans	-74.4	-42.8	-178.9	-157.7	171.8	-173.8	163.2	1.9	111.9	L25 M26 Y27 L32 D33	L25-R29 PolarHBondContact O-N 3.35Å; M26-R29 WeakPolarHBondContact O-CB 3.44Å; M26-R29 PolarHBondContact O-N 3.19Å; Y27-R29 VanDerWaalsContact C-N 3.32Å; R29-L32 PolarHBondContact O-N 3.39Å; R29-D33 WeakPolarHBondContact O-CB 3.38Å; R29-D33 PolarHBondContact O-N 3.35Å
30	D	42.5	Very low	38.5	Very low	93 Å²	93	83.1 Å²	83.1	50%	0.497	40%	0.402	S	S	.	.	H	α-helix	trans	-65.9	-41.1	-179.9	-67.9	-24.8	0	0	0	112.7	M26 Y34	M26-D30 PolarHBondContact O-N 2.71Å; M26-D30 VanDerWaalsContact O-N 3.07Å; D30-Y34 WeakPolarHBondContact O-CB 3.26Å; D30-Y34 PolarHBondContact O-N 2.91Å
31	L	45.5	Very low	39.1	Very low	59 Å²	59	83.8 Å²	83.8	31%	0.309	41%	0.413	S	S	.	.	H	α-helix	trans	-65.7	-41.3	175.8	-175.6	67.9	0	0	0	111.1	Y27 Y34 I35 F157	Y27-L31 PolarHBondContact O-N 3.34Å; L31-Y34 PolarHBondContact O-N 3.16Å; L31-I35 HydrophobicContact CD1-CD1 4.36Å; L31-I35 HydrophobicContact CG-CD1 3.99Å; L31-I35 WeakPolarHBondContact O-CD1 3.43Å; L31-I35 VanDerWaalsContact O-CG1 3.23Å; L31-I35 WeakPolarHBondContact O-CG1 3.07Å; L31-I35 PolarHBondContact O-N 3.46Å; L31-F157 HydrophobicContact CD1-CE1 4.17Å
32	L	46	Very low	39.5	Very low	49 Å²	49	83.1 Å²	83.1	26%	0.257	41%	0.41	S	S	.	.	H	α-helix	trans	-66.7	-44.3	178.8	-171.4	66.3	0	0	0	111.4	R28 R29 Y34 I35 L36 L57	R28-L32 VanDerWaalsContact O-CB 3.28Å; R28-L32 WeakPolarHBondContact O-CB 3.47Å; R28-L32 PolarHBondContact O-N 3.01Å; R29-L32 PolarHBondContact O-N 3.39Å; L32-Y34 VanDerWaalsContact C-N 3.32Å; L32-Y34 PolarHBondContact O-N 3.44Å; L32-I35 PolarHBondContact O-N 3.47Å; L32-L36 HydrophobicContact CD1-CD1 4.48Å; L32-L36 HydrophobicContact CG-CD1 3.95Å; L32-L36 HydrophobicContact CG-CG 4.42Å; L32-L36 WeakPolarHBondContact O-CB 3.17Å; L32-L36 VanDerWaalsContact O-CG 3.25Å; L32-L36 WeakPolarHBondContact O-CG 3.39Å; L32-L36 PolarHBondContact O-N 2.84Å; L32-L57 HydrophobicContact CD1-CD1 4.14Å
33	D	46.6	Very low	39.9	Very low	74 Å²	74	88.4 Å²	88.4	40%	0.396	43%	0.426	S	S	.	.	H	α-helix	trans	-63.4	-38.1	176	-79.5	-19.8	0	0	0	111.6	R29 N37	R29-D33 WeakPolarHBondContact O-CB 3.38Å; R29-D33 PolarHBondContact O-N 3.35Å; D33-N37 WeakPolarHBondContact O-CB 3.35Å; D33-N37 VanDerWaalsContact O-CG 3.22Å; D33-N37 PolarHBondContact O-N 3.22Å; D33-N37 PolarHBondContact O-ND2 3.22Å
34	Y	46.5	Very low	40.3	Very low	58 Å²	58	87.3 Å²	87.3	23%	0.227	42%	0.42	C	S	.	.	H	α-helix	trans	-62.9	-46.9	173.6	178.1	-97.1	0	0	0	111.9	D30 L31 L32 Y38 Y153 L154	D30-Y34 WeakPolarHBondContact O-CB 3.26Å; D30-Y34 PolarHBondContact O-N 2.91Å; L31-Y34 PolarHBondContact O-N 3.16Å; L32-Y34 VanDerWaalsContact C-N 3.32Å; L32-Y34 PolarHBondContact O-N 3.44Å; Y34-Y38 VanDerWaalsContact O-CB 3.28Å; Y34-Y38 WeakPolarHBondContact O-CB 3.26Å; Y34-Y38 PolarHBondContact O-N 3.18Å; Y34-Y153 AromaticContact CE2-CE1 3.97Å; Y34-Y153 HydrophobicContact CE2-CE1 3.97Å; Y34-L154 HydrophobicContact CE1-CD1 4.17Å
35	I	44.8	Very low	40.2	Very low	54 Å²	54	90.5 Å²	90.5	28%	0.277	44%	0.437	S	S	.	.	H	α-helix	trans	-63.6	-47.3	178.6	-68.1	166.1	0	0	0	110.2	L31 L32 Y38 M39	L31-I35 HydrophobicContact CD1-CD1 4.36Å; L31-I35 HydrophobicContact CG-CD1 3.99Å; L31-I35 WeakPolarHBondContact O-CD1 3.43Å; L31-I35 VanDerWaalsContact O-CG1 3.23Å; L31-I35 WeakPolarHBondContact O-CG1 3.07Å; L31-I35 PolarHBondContact O-N 3.46Å; L32-I35 PolarHBondContact O-N 3.47Å; I35-Y38 PolarHBondContact O-N 2.94Å; I35-M39 HydrophobicContact CG2-CG 4.19Å; I35-M39 WeakPolarHBondContact O-CB 2.82Å; I35-M39 WeakPolarHBondContact O-CG 3.49Å; I35-M39 PolarHBondContact O-N 3.4Å
36	L	46	Very low	40.3	Very low	63 Å²	63	89.5 Å²	89.5	33%	0.33	44%	0.435	S	S	.	.	H	α-helix	trans	-63.2	-44.4	179.6	-71.9	172.1	0	0	0	112.1	L32 Y38 M39 N40 M54	L32-L36 HydrophobicContact CD1-CD1 4.48Å; L32-L36 HydrophobicContact CG-CD1 3.95Å; L32-L36 HydrophobicContact CG-CG 4.42Å; L32-L36 WeakPolarHBondContact O-CB 3.17Å; L32-L36 VanDerWaalsContact O-CG 3.25Å; L32-L36 WeakPolarHBondContact O-CG 3.39Å; L32-L36 PolarHBondContact O-N 2.84Å; L36-Y38 VanDerWaalsContact C-N 3.3Å; L36-Y38 PolarHBondContact O-N 3.34Å; L36-M39 PolarHBondContact O-N 3.46Å; L36-N40 WeakPolarHBondContact O-CB 3.47Å; L36-N40 VanDerWaalsContact O-CG 3.26Å; L36-N40 PolarHBondContact O-N 3.44Å; L36-N40 PolarHBondContact O-ND2 3.22Å; L36-M54 HydrophobicContact CD1-CE 4.37Å
37	N	46.9	Very low	40.1	Very low	101 Å²	101	92.3 Å²	92.3	54%	0.54	45%	0.45	S	S	.	.	H	α-helix	trans	-62.6	-38.8	175.6	-78.5	-37.2	0	0	0	111.8	D33 S41	D33-N37 WeakPolarHBondContact O-CB 3.35Å; D33-N37 VanDerWaalsContact O-CG 3.22Å; D33-N37 PolarHBondContact O-N 3.22Å; D33-N37 PolarHBondContact O-ND2 3.22Å; N37-S41 VanDerWaalsContact O-CB 3.24Å; N37-S41 WeakPolarHBondContact O-CB 3.33Å; N37-S41 PolarHBondContact O-N 3.35Å; N37-S41 PolarHBondContact O-OG 3.39Å
38	Y	42.2	Very low	39.6	Very low	26 Å²	26	92.2 Å²	92.2	10%	0.102	46%	0.458	C	S	.	.	H	α-helix	trans	-66.8	-43.6	176	-176	-88.9	0	0	0	112.1	Y34 I35 L36 S41 N42 F142 H146	Y34-Y38 VanDerWaalsContact O-CB 3.28Å; Y34-Y38 WeakPolarHBondContact O-CB 3.26Å; Y34-Y38 PolarHBondContact O-N 3.18Å; I35-Y38 PolarHBondContact O-N 2.94Å; L36-Y38 VanDerWaalsContact C-N 3.3Å; L36-Y38 PolarHBondContact O-N 3.34Å; Y38-S41 PolarHBondContact O-N 2.9Å; Y38-N42 WeakPolarHBondContact CD1-ND2 3.25Å; Y38-N42 WeakPolarHBondContact CE1-ND2 3.47Å; Y38-N42 WeakPolarHBondContact CE2-ND2 3.34Å; Y38-N42 PolarHBondContact O-N 3.46Å; Y38-N42 PolarHBondContact O-ND2 3.37Å; Y38-F142 AromaticContact CD1-CE1 3.71Å; Y38-F142 HydrophobicContact CD1-CE1 3.71Å; Y38-F142 AromaticContact CD1-CZ 3.79Å; Y38-F142 HydrophobicContact CD1-CZ 3.79Å; Y38-F142 HydrophobicContact CE1-CD1 4.23Å; Y38-F142 AromaticContact CE1-CE1 3.2Å; Y38-F142 HydrophobicContact CE1-CE1 3.2Å; Y38-F142 AromaticContact CE1-CZ 3.66Å; Y38-F142 HydrophobicContact CE1-CZ 3.66Å; Y38-F142 HydrophobicContact CE2-CE1 4.31Å; Y38-F142 HydrophobicContact CG-CE1 4.44Å; Y38-F142 AromaticContact CZ-CE1 3.55Å; Y38-H146 AromaticContact CE1-NE2 3.93Å; Y38-H146 PolarHBondContact OH-CD2 2.81Å; Y38-H146 VanDerWaalsContact OH-CD2 3.29Å; Y38-H146 PolarHBondContact OH-CE1 2.95Å; Y38-H146 PolarHBondContact OH-NE2 3.4Å
39	M	39.6	Very low	38.7	Very low	52 Å²	52	92.9 Å²	92.9	26%	0.256	48%	0.478	S	S	.	.	H	α-helix	trans	-63	-44	177.8	-68.1	-72	-81.6	0	0	111.2	I35 L36 N42 M44 V46	I35-M39 HydrophobicContact CG2-CG 4.19Å; I35-M39 WeakPolarHBondContact O-CB 2.82Å; I35-M39 WeakPolarHBondContact O-CG 3.49Å; I35-M39 PolarHBondContact O-N 3.4Å; L36-M39 PolarHBondContact O-N 3.46Å; M39-N42 PolarHBondContact O-N 3Å; M39-M44 HydrophobicContact CE-CB 4.16Å; M39-M44 PolarHBondContact O-N 3.29Å; M39-M44 HydrophobicContact SD-CB 4.3Å; M39-M44 HydrophobicContact SD-CG 4.12Å; M39-V46 HydrophobicContact CE-CG2 3.9Å
40	N	41.1	Very low	38.1	Very low	123 Å²	123	91.4 Å²	91.4	66%	0.658	48%	0.484	S	S	*	.	H	α-helix	trans	-65	-41.6	175.8	-74.1	-24.7	0	0	0	112.3	L36 N42 R43	L36-N40 WeakPolarHBondContact O-CB 3.47Å; L36-N40 VanDerWaalsContact O-CG 3.26Å; L36-N40 PolarHBondContact O-N 3.44Å; L36-N40 PolarHBondContact O-ND2 3.22Å; N40-N42 VanDerWaalsContact C-N 3.26Å; N40-N42 PolarHBondContact O-N 3.2Å; N40-R43 PolarHBondContact O-N 3.29Å
41	S	42.5	Very low	37.3	Very low	99 Å²	99	90.3 Å²	90.3	69%	0.692	48%	0.484	S	S	*	.	H	α-helix	trans	-67	-25.8	-179	-62.6	0	0	0	0	113.3	N37 Y38	N37-S41 VanDerWaalsContact O-CB 3.24Å; N37-S41 WeakPolarHBondContact O-CB 3.33Å; N37-S41 PolarHBondContact O-N 3.35Å; N37-S41 PolarHBondContact O-OG 3.39Å; Y38-S41 PolarHBondContact O-N 2.9Å
42	N	36.2	Very low	36.4	Very low	69 Å²	69	94.8 Å²	94.8	37%	0.369	50%	0.501	S	S	.	.	T	Hydrogen-bonded Turn	trans	-99.7	8.2	-177.6	-70.1	-55.1	0	0	0	114.3	Y38 M39 N40 M44	Y38-N42 WeakPolarHBondContact CD1-ND2 3.25Å; Y38-N42 WeakPolarHBondContact CE1-ND2 3.47Å; Y38-N42 WeakPolarHBondContact CE2-ND2 3.34Å; Y38-N42 PolarHBondContact O-N 3.46Å; Y38-N42 PolarHBondContact O-ND2 3.37Å; M39-N42 PolarHBondContact O-N 3Å; N40-N42 VanDerWaalsContact C-N 3.26Å; N40-N42 PolarHBondContact O-N 3.2Å; N42-M44 HydrophobicContact CB-CG 4.21Å; N42-M44 PolarHBondContact O-N 3.46Å
43	R	36.8	Very low	35.8	Very low	223 Å²	223	95.7 Å²	95.7	84%	0.842	51%	0.506	S	S	*	.	T	Hydrogen-bonded Turn	trans	46.1	48.6	-175.6	-62.6	-165.7	-171.4	-143.4	3	112.4	N40 D45	N40-R43 PolarHBondContact O-N 3.29Å; R43-D45 PolarHBondContact O-N 3.18Å; R43-D45 VanDerWaalsContact O-N 3.16Å
44	M	32.1	Very low	35	Very low	64 Å²	64	95.5 Å²	95.5	32%	0.315	50%	0.503	S	S	.	.			trans	-74	104.1	171.6	-63.7	-66.3	-83	0	0	107.8	M39 N42 V46	M39-M44 HydrophobicContact CE-CB 4.16Å; M39-M44 PolarHBondContact O-N 3.29Å; M39-M44 HydrophobicContact SD-CB 4.3Å; M39-M44 HydrophobicContact SD-CG 4.12Å; N42-M44 HydrophobicContact CB-CG 4.21Å; N42-M44 PolarHBondContact O-N 3.46Å; M44-V46 VanDerWaalsContact C-N 3.29Å; M44-V46 PolarHBondContact O-N 3.25Å
45	D	30.2	Very low	34.4	Very low	153 Å²	153	96.8 Å²	96.8	82%	0.818	51%	0.514	S	S	*	.			trans	-70.5	82.8	176.7	-71.3	-30.6	0	0	0	109.9	R43 I47	R43-D45 PolarHBondContact O-N 3.18Å; R43-D45 VanDerWaalsContact O-N 3.16Å; D45-I47 PolarHBondContact O-N 2.95Å
46	V	31.6	Very low	34	Very low	71 Å²	71	95.2 Å²	95.2	43%	0.43	51%	0.508	S	S	.	.			trans	-92.6	98.5	169.9	-177	0	0	0	0	108.7	M39 M44 C48 P85	M39-V46 HydrophobicContact CE-CG2 3.9Å; M44-V46 VanDerWaalsContact C-N 3.29Å; M44-V46 PolarHBondContact O-N 3.25Å; V46-C48 VanDerWaalsContact C-N 3.26Å; V46-C48 HydrophobicContact CG1-CB 4.5Å; V46-C48 PolarHBondContact O-N 2.99Å; V46-P85 HydrophobicContact CG2-CB 4.36Å; V46-P85 HydrophobicContact CG2-CG 4.37Å
47	I	23.9	Very low	33.5	Very low	159 Å²	159	96 Å²	96	82%	0.815	51%	0.512	S	S	*	.			trans	-64	84.9	163	-56.2	166.3	0	0	0	107.2	D45	D45-I47 PolarHBondContact O-N 2.95Å
48	C	25.4	Very low	33	Very low	62 Å²	62	97.3 Å²	97.3	42%	0.419	52%	0.518	S	S	.	.			trans	-172.8	90.5	158.8	-102.7	0	0	0	0	111.5	V46 N50	V46-C48 VanDerWaalsContact C-N 3.26Å; V46-C48 HydrophobicContact CG1-CB 4.5Å; V46-C48 PolarHBondContact O-N 2.99Å; C48-N50 PolarHBondContact O-N 2.87Å
49	S	25	Very low	32.7	Very low	115 Å²	115	101.8 Å²	101.8	80%	0.804	54%	0.544	S	S	*	.			trans	1.3	77.8	144.3	-35.3	0	0	0	0	118.1	S51	S49-S51 VanDerWaalsContact C-N 3.33Å; S49-S51 PolarHBondContact O-N 3.13Å
50	N	27.7	Very low	32.4	Very low	153 Å²	153	101.9 Å²	101.9	82%	0.818	54%	0.543	S	S	*	.	T	Hydrogen-bonded Turn		38.8	26.2	114	-94.4	-21.7	0	0	0	123	C48	C48-N50 PolarHBondContact O-N 2.87Å
51	S	26.9	Very low	32	Very low	70 Å²	70	100.4 Å²	100.4	49%	0.49	54%	0.535	S	S	.	.	T	Hydrogen-bonded Turn	trans	-143.4	-38.2	159	94.4	0	0	0	0	114.9	S49 M54 D55	S49-S51 VanDerWaalsContact C-N 3.33Å; S49-S51 PolarHBondContact O-N 3.13Å; S51-M54 PolarHBondContact O-N 3.49Å; S51-D55 PolarHBondContact O-N 2.97Å
52	F	27.4	Very low	31.7	Very low	153 Å²	153	98.3 Å²	98.3	67%	0.671	52%	0.519	S	S	*	.	H	α-helix	trans	-72.2	-38.5	-169.9	-152.2	-95.8	0	0	0	113.9	S56	F52-S56 WeakPolarHBondContact O-CB 3.47Å; F52-S56 PolarHBondContact O-N 3.35Å; F52-S56 PolarHBondContact O-OG 3.29Å
53	I	32.5	Very low	31.4	Very low	68 Å²	68	101.5 Å²	101.5	35%	0.349	53%	0.532	S	S	.	.	H	α-helix	trans	-70.3	-36	176.4	-61.5	174	0	0	0	110.4	S56 L57 Y82	I53-S56 PolarHBondContact O-N 2.89Å; I53-L57 HydrophobicContact CG2-CD1 3.79Å; I53-L57 HydrophobicContact CG2-CG 4.46Å; I53-L57 WeakPolarHBondContact O-CB 3.45Å; I53-L57 WeakPolarHBondContact O-CG 3.36Å; I53-L57 PolarHBondContact O-N 3.41Å; I53-Y82 HydrophobicContact CD1-CD1 4.47Å; I53-Y82 HydrophobicContact CD1-CG 4.33Å
54	M	30.6	Very low	31.2	Very low	70 Å²	70	96 Å²	96	35%	0.345	52%	0.518	S	S	.	.	H	α-helix	trans	-66.7	-49.4	176.3	-68.9	-61.7	-140.7	0	0	111.1	L36 S51 S56 L57 L58	L36-M54 HydrophobicContact CD1-CE 4.37Å; S51-M54 PolarHBondContact O-N 3.49Å; M54-S56 VanDerWaalsContact C-N 3.3Å; M54-S56 PolarHBondContact O-N 3.48Å; M54-L57 PolarHBondContact O-N 3.49Å; M54-L58 HydrophobicContact CB-CD1 4.45Å; M54-L58 WeakPolarHBondContact O-CB 3.39Å; M54-L58 WeakPolarHBondContact O-CD1 3.03Å; M54-L58 WeakPolarHBondContact O-CG 3.39Å; M54-L58 PolarHBondContact O-N 3.23Å
55	D	32.2	Very low	31.1	Very low	84 Å²	84	97.6 Å²	97.6	45%	0.449	54%	0.536	S	S	.	.	H	α-helix	trans	-62	-39.1	175.6	-81.3	-24.7	0	0	0	111.8	S51 N59	S51-D55 PolarHBondContact O-N 2.97Å; D55-N59 WeakPolarHBondContact O-CA 3.32Å; D55-N59 WeakPolarHBondContact O-CB 3.5Å; D55-N59 PolarHBondContact O-N 2.85Å; D55-N59 PolarHBondContact O-ND2 2.98Å
56	S	36.5	Very low	31.1	Very low	21 Å²	21	98.7 Å²	98.7	15%	0.147	54%	0.536	C	S	.	.	H	α-helix	trans	-68	-38.6	-178.9	-72.1	0	0	0	0	113.3	F52 I53 M54 F75	F52-S56 WeakPolarHBondContact O-CB 3.47Å; F52-S56 PolarHBondContact O-N 3.35Å; F52-S56 PolarHBondContact O-OG 3.29Å; I53-S56 PolarHBondContact O-N 2.89Å; M54-S56 VanDerWaalsContact C-N 3.3Å; M54-S56 PolarHBondContact O-N 3.48Å; S56-F75 WeakPolarHBondContact O-CZ 3.3Å
57	L	36.1	Very low	30.9	Very low	79 Å²	79	102.6 Å²	102.6	41%	0.414	55%	0.554	S	S	.	*	H	α-helix	trans	-80.5	-31.5	176.9	-70.2	169.5	0	0	0	112.6	L32 I53 M54	L32-L57 HydrophobicContact CD1-CD1 4.14Å; I53-L57 HydrophobicContact CG2-CD1 3.79Å; I53-L57 HydrophobicContact CG2-CG 4.46Å; I53-L57 WeakPolarHBondContact O-CB 3.45Å; I53-L57 WeakPolarHBondContact O-CG 3.36Å; I53-L57 PolarHBondContact O-N 3.41Å; M54-L57 PolarHBondContact O-N 3.49Å
58	L	37.4	Very low	31.2	Very low	130 Å²	130	97 Å²	97	68%	0.681	53%	0.528	S	S	*	.	H	α-helix	trans	-80.1	-32.7	177.9	-70.1	167.3	0	0	0	113	M54 F60	M54-L58 HydrophobicContact CB-CD1 4.45Å; M54-L58 WeakPolarHBondContact O-CB 3.39Å; M54-L58 WeakPolarHBondContact O-CD1 3.03Å; M54-L58 WeakPolarHBondContact O-CG 3.39Å; M54-L58 PolarHBondContact O-N 3.23Å; L58-F60 VanDerWaalsContact C-N 3.33Å
59	N	34.9	Very low	31.4	Very low	119 Å²	119	98.2 Å²	98.2	64%	0.636	53%	0.533	S	S	*	.	S	Bend	trans	-88.8	6.6	179.8	-65.6	-38.4	0	0	0	113.8	D55 N61	D55-N59 WeakPolarHBondContact O-CA 3.32Å; D55-N59 WeakPolarHBondContact O-CB 3.5Å; D55-N59 PolarHBondContact O-N 2.85Å; D55-N59 PolarHBondContact O-ND2 2.98Å; N59-N61 PolarHBondContact O-N 3.35Å
60	F	34.3	Very low	31.6	Very low	55 Å²	55	99.5 Å²	99.5	24%	0.241	53%	0.53	C	S	.	.			trans	-67.4	102.9	174.9	-171.3	-96.5	0	0	0	110.4	L58 P62 Y76	L58-F60 VanDerWaalsContact C-N 3.33Å; F60-P62 HydrophobicContact CE1-CB 4.17Å; F60-P62 VanDerWaalsContact O-CD 3.3Å; F60-P62 WeakPolarHBondContact O-CD 3.45Å; F60-Y76 WeakPolarHBondContact CE2-OH 3.35Å
61	N	32.4	Very low	31.8	Very low	91 Å²	91	98.1 Å²	98.1	49%	0.487	52%	0.518	S	S	.	.			trans	-104.8	99.4	178.5	-163.9	-8.5	0	0	0	110.4	N59 Q63 L64	N59-N61 PolarHBondContact O-N 3.35Å; N61-Q63 PolarHBondContact O-N 3.39Å; N61-Q63 WeakPolarHBondContact OD1-CB 3.38Å; N61-Q63 PolarHBondContact OD1-N 3.1Å; N61-L64 HydrophobicContact CB-CD1 3.87Å; N61-L64 PolarHBondContact O-N 2.88Å
62	P	36.2	Very low	32.2	Very low	55 Å²	55	97 Å²	97	36%	0.357	51%	0.506	S	S	.	.	G	3₁₀ helix	trans	-65.3	-8.5	-178.2	24.3	-31.7	0	0	0	113.9	F60 L64	F60-P62 HydrophobicContact CE1-CB 4.17Å; F60-P62 VanDerWaalsContact O-CD 3.3Å; F60-P62 WeakPolarHBondContact O-CD 3.45Å; P62-L64 VanDerWaalsContact C-N 3.33Å; P62-L64 PolarHBondContact O-N 3.44Å
63	Q	29.9	Very low	32.5	Very low	137 Å²	137	92.6 Å²	92.6	64%	0.64	49%	0.49	S	S	*	.	G	3₁₀ helix	trans	-79.3	-6.8	178.6	-64.9	-83.3	-25.5	0	0	114	N61 S65	N61-Q63 PolarHBondContact O-N 3.39Å; N61-Q63 WeakPolarHBondContact OD1-CB 3.38Å; N61-Q63 PolarHBondContact OD1-N 3.1Å; Q63-S65 VanDerWaalsContact C-N 3.26Å; Q63-S65 PolarHBondContact O-N 3.25Å
64	L	31.2	Very low	32.6	Very low	107 Å²	107	94.9 Å²	94.9	56%	0.56	50%	0.499	S	S	*	.	G	3₁₀ helix	trans	-88.7	19.8	175.7	-85.9	109.8	0	0	0	114	N61 P62 H66 N67	N61-L64 HydrophobicContact CB-CD1 3.87Å; N61-L64 PolarHBondContact O-N 2.88Å; P62-L64 VanDerWaalsContact C-N 3.33Å; P62-L64 PolarHBondContact O-N 3.44Å; L64-H66 PolarHBondContact O-N 3.22Å; L64-N67 PolarHBondContact O-N 3.43Å
65	S	29.9	Very low	32.9	Very low	97 Å²	97	93.9 Å²	93.9	68%	0.678	49%	0.493	S	S	*	.	T	Hydrogen-bonded Turn	trans	-64.4	-1.4	-166.3	58.2	0	0	0	0	117.4	Q63	Q63-S65 VanDerWaalsContact C-N 3.26Å; Q63-S65 PolarHBondContact O-N 3.25Å
66	H	30.3	Very low	33.3	Very low	176 Å²	176	91.9 Å²	91.9	82%	0.815	48%	0.48	S	S	*	.	T	Hydrogen-bonded Turn	trans	-100.4	-12	-178.7	-114.2	-67.8	0	0	0	115.9	L64	L64-H66 PolarHBondContact O-N 3.22Å
67	N	28.2	Very low	33.4	Very low	154 Å²	154	94.4 Å²	94.4	82%	0.824	50%	0.497	S	S	*	.	S	Bend	trans	-136.7	10.7	-167.9	-88.6	-26.2	0	0	0	118	L64	L64-N67 PolarHBondContact O-N 3.43Å
68	T	29.8	Very low	33.6	Very low	42 Å²	42	94 Å²	94	26%	0.258	50%	0.498	S	S	.	.			trans	-143.1	44.6	-172	33.9	0	0	0	0	115.4	L70 H71 N72	T68-L70 PolarHBondContact O-N 3.34Å; T68-H71 HydrophobicContact CG2-CB 3.66Å; T68-H71 PolarHBondContact O-N 3.32Å; T68-N72 PolarHBondContact O-N 2.76Å
69	V	31.2	Very low	33.8	Very low	87 Å²	87	88.9 Å²	88.9	53%	0.527	47%	0.471	S	S	.	.	H	α-helix	trans	-59.6	-35.2	167.3	178	0	0	0	0	111.5	N73	V69-N73 PolarHBondContact O-N 3.1Å; V69-N73 VanDerWaalsContact O-N 3.16Å
70	L	28.9	Very low	34.2	Very low	141 Å²	141	84.7 Å²	84.7	74%	0.738	45%	0.449	S	S	*	.	H	α-helix	trans	-68.5	-37.9	174.5	-95.7	123	0	0	0	113.6	T68 Q74	T68-L70 PolarHBondContact O-N 3.34Å; L70-Q74 WeakPolarHBondContact O-CG 3.31Å; L70-Q74 PolarHBondContact O-N 3.3Å; L70-Q74 VanDerWaalsContact O-N 3.16Å
71	H	30.5	Very low	34.6	Very low	125 Å²	125	86.1 Å²	86.1	58%	0.579	46%	0.463	S	S	*	.	H	α-helix	trans	-73	-35.7	-179.5	-116.9	-70	0	0	0	111.4	T68 F75	T68-H71 HydrophobicContact CG2-CB 3.66Å; T68-H71 PolarHBondContact O-N 3.32Å; H71-F75 WeakPolarHBondContact O-CB 3.35Å; H71-F75 PolarHBondContact O-N 3.36Å
72	N	35	Very low	34.9	Very low	45 Å²	45	87.6 Å²	87.6	24%	0.241	46%	0.463	C	S	.	.	H	α-helix	trans	-65.9	-43.6	173.8	-72.8	-11.3	0	0	0	111.3	T68 Q74 F75 Y76	T68-N72 PolarHBondContact O-N 2.76Å; N72-Q74 PolarHBondContact O-N 3.43Å; N72-F75 WeakPolarHBondContact O-CB 3.38Å; N72-F75 PolarHBondContact O-N 2.93Å; N72-Y76 HydrophobicContact CB-CD2 4.36Å; N72-Y76 HydrophobicContact CB-CE2 4.12Å; N72-Y76 WeakPolarHBondContact O-CD2 3.34Å; N72-Y76 PolarHBondContact O-N 3.19Å
73	N	34.1	Very low	35	Very low	61 Å²	61	88.9 Å²	88.9	33%	0.326	47%	0.466	S	S	.	.	H	α-helix	trans	-64.2	-39.5	178.1	-73.1	-10	0	0	0	112.9	V69 S77 W109	V69-N73 PolarHBondContact O-N 3.1Å; V69-N73 VanDerWaalsContact O-N 3.16Å; N73-S77 WeakPolarHBondContact O-CB 3.31Å; N73-S77 PolarHBondContact O-N 3.34Å; N73-S77 PolarHBondContact O-OG 3.3Å; N73-W109 HydrophobicContact CB-CH2 4.24Å; N73-W109 WeakPolarHBondContact OD1-CH2 3.49Å
74	Q	35.3	Very low	35.6	Very low	116 Å²	116	83 Å²	83	54%	0.542	44%	0.439	S	S	.	.	H	α-helix	trans	-64.3	-46.9	173.4	-75.5	178.5	-21.8	0	0	111.5	L70 N72 Y76 S77 T78	L70-Q74 WeakPolarHBondContact O-CG 3.31Å; L70-Q74 PolarHBondContact O-N 3.3Å; L70-Q74 VanDerWaalsContact O-N 3.16Å; N72-Q74 PolarHBondContact O-N 3.43Å; Q74-Y76 PolarHBondContact O-N 3.15Å; Q74-S77 PolarHBondContact O-N 3.37Å; Q74-S77 PolarHBondContact O-OG 2.83Å; Q74-T78 PolarHBondContact O-N 2.64Å; Q74-T78 VanDerWaalsContact O-N 3.08Å; Q74-T78 PolarHBondContact O-OG1 3.39Å
75	F	37	Very low	36	Very low	49 Å²	49	79.4 Å²	79.4	22%	0.215	42%	0.421	C	S	.	.	H	α-helix	trans	-58	-44.5	179.5	-178.9	-97.7	0	0	0	113.2	S56 H71 N72 T78 L79	S56-F75 WeakPolarHBondContact O-CZ 3.3Å; H71-F75 WeakPolarHBondContact O-CB 3.35Å; H71-F75 PolarHBondContact O-N 3.36Å; N72-F75 WeakPolarHBondContact O-CB 3.38Å; N72-F75 PolarHBondContact O-N 2.93Å; F75-T78 WeakPolarHBondContact CA-OG1 3.42Å; F75-T78 PolarHBondContact O-N 3.49Å; F75-T78 PolarHBondContact O-OG1 3.46Å; F75-L79 HydrophobicContact CD1-CD1 3.62Å; F75-L79 HydrophobicContact CD2-CD1 4.49Å; F75-L79 HydrophobicContact CE1-CD1 3.17Å; F75-L79 HydrophobicContact CE2-CD1 4.15Å; F75-L79 HydrophobicContact CG-CD1 4.26Å; F75-L79 HydrophobicContact CZ-CD1 3.48Å; F75-L79 VanDerWaalsContact CZ-CD1 3.48Å; F75-L79 PolarHBondContact O-N 3.06Å; F75-L79 VanDerWaalsContact O-N 3.08Å
76	Y	40.6	Very low	36.5	Very low	43 Å²	43	79.3 Å²	79.3	17%	0.169	41%	0.412	C	S	.	.	H	α-helix	trans	-77.3	-33.2	179.9	-65.8	-62.9	0	0	0	113	F60 N72 Q74 T78 L79 I80 W109 Y130	F60-Y76 WeakPolarHBondContact CE2-OH 3.35Å; N72-Y76 HydrophobicContact CB-CD2 4.36Å; N72-Y76 HydrophobicContact CB-CE2 4.12Å; N72-Y76 WeakPolarHBondContact O-CD2 3.34Å; N72-Y76 PolarHBondContact O-N 3.19Å; Q74-Y76 PolarHBondContact O-N 3.15Å; Y76-T78 PolarHBondContact O-N 2.85Å; Y76-L79 HydrophobicContact CD1-CD1 4.48Å; Y76-L79 PolarHBondContact O-N 3.4Å; Y76-I80 WeakPolarHBondContact O-CG1 3Å; Y76-I80 PolarHBondContact O-N 3Å; Y76-W109 HydrophobicContact CD2-CZ2 4.04Å; Y76-W109 HydrophobicContact CG-CZ2 4.26Å; Y76-Y130 HydrophobicContact CE2-CD1 4.46Å; Y76-Y130 HydrophobicContact CE2-CE1 4.41Å
77	S	39.1	Very low	37	Very low	73 Å²	73	74.4 Å²	74.4	51%	0.51	39%	0.391	S	S	.	.	H	α-helix	trans	-59.4	-33.7	170.5	77.7	0	0	0	0	112.1	N73 Q74 P81	N73-S77 WeakPolarHBondContact O-CB 3.31Å; N73-S77 PolarHBondContact O-N 3.34Å; N73-S77 PolarHBondContact O-OG 3.3Å; Q74-S77 PolarHBondContact O-N 3.37Å; Q74-S77 PolarHBondContact O-OG 2.83Å; S77-P81 WeakPolarHBondContact O-CD 3.35Å
78	T	39	Very low	37.8	Very low	72 Å²	72	73.7 Å²	73.7	44%	0.442	39%	0.387	S	S	.	.	H	α-helix	trans	-77.2	-29.5	173.8	50.4	0	0	0	0	113.1	Q74 F75 Y76 P81 Y82	Q74-T78 PolarHBondContact O-N 2.64Å; Q74-T78 VanDerWaalsContact O-N 3.08Å; Q74-T78 PolarHBondContact O-OG1 3.39Å; F75-T78 WeakPolarHBondContact CA-OG1 3.42Å; F75-T78 PolarHBondContact O-N 3.49Å; F75-T78 PolarHBondContact O-OG1 3.46Å; Y76-T78 PolarHBondContact O-N 2.85Å; T78-P81 WeakPolarHBondContact O-CD 2.74Å; T78-Y82 WeakPolarHBondContact O-CD2 3.29Å; T78-Y82 WeakPolarHBondContact O-CE2 3.49Å
79	L	42.1	Very low	38.3	Very low	22 Å²	22	78.9 Å²	78.9	12%	0.115	41%	0.413	C	S	.	.	H	α-helix	trans	-80.4	-31.7	-176.5	-113.7	137.9	0	0	0	114	F75 Y76 Y82 L83	F75-L79 HydrophobicContact CD1-CD1 3.62Å; F75-L79 HydrophobicContact CD2-CD1 4.49Å; F75-L79 HydrophobicContact CE1-CD1 3.17Å; F75-L79 HydrophobicContact CE2-CD1 4.15Å; F75-L79 HydrophobicContact CG-CD1 4.26Å; F75-L79 HydrophobicContact CZ-CD1 3.48Å; F75-L79 VanDerWaalsContact CZ-CD1 3.48Å; F75-L79 PolarHBondContact O-N 3.06Å; F75-L79 VanDerWaalsContact O-N 3.08Å; Y76-L79 HydrophobicContact CD1-CD1 4.48Å; Y76-L79 PolarHBondContact O-N 3.4Å; L79-Y82 PolarHBondContact O-N 2.78Å; L79-L83 HydrophobicContact CD2-CD1 4.05Å; L79-L83 HydrophobicContact CD2-CD2 4.33Å; L79-L83 HydrophobicContact CD2-CG 4.03Å; L79-L83 WeakPolarHBondContact O-CG 3.36Å; L79-L83 PolarHBondContact O-N 2.71Å
80	I	44.2	Very low	38.9	Very low	31 Å²	31	76.6 Å²	76.6	16%	0.159	40%	0.398	C	S	.	.	H	α-helix	trans	-54.6	-49.4	-177.6	-71.7	164.1	0	0	0	112	Y76 Y82 L83 F84 I102 T106	Y76-I80 WeakPolarHBondContact O-CG1 3Å; Y76-I80 PolarHBondContact O-N 3Å; I80-Y82 PolarHBondContact O-N 3.21Å; I80-L83 PolarHBondContact O-N 3.31Å; I80-F84 HydrophobicContact CG2-CD2 4.04Å; I80-F84 HydrophobicContact CG2-CE2 4.27Å; I80-F84 VanDerWaalsContact O-CD2 3.27Å; I80-F84 WeakPolarHBondContact O-CD2 3.31Å; I80-F84 PolarHBondContact O-N 3.32Å; I80-I102 HydrophobicContact CG2-CG2 3.98Å; I80-T106 HydrophobicContact CD1-CG2 4.31Å
81	P	41.2	Very low	39.6	Very low	84 Å²	84	73.1 Å²	73.1	55%	0.545	38%	0.38	S	S	.	.	H	α-helix	trans	-59.2	-29.5	177	-24	33.7	0	0	0	114.5	S77 T78 F84	S77-P81 WeakPolarHBondContact O-CD 3.35Å; T78-P81 WeakPolarHBondContact O-CD 2.74Å; P81-F84 CarbonylContact O-C 3.52Å
82	Y	39.2	Very low	40.4	Very low	123 Å²	123	71.5 Å²	71.5	48%	0.482	38%	0.382	S	S	.	.	H	α-helix	trans	-83.6	-28	179.9	-61.8	-71.9	0	0	0	113.2	I53 T78 L79 I80 F84	I53-Y82 HydrophobicContact CD1-CD1 4.47Å; I53-Y82 HydrophobicContact CD1-CG 4.33Å; T78-Y82 WeakPolarHBondContact O-CD2 3.29Å; T78-Y82 WeakPolarHBondContact O-CE2 3.49Å; L79-Y82 PolarHBondContact O-N 2.78Å; I80-Y82 PolarHBondContact O-N 3.21Å; Y82-F84 VanDerWaalsContact C-N 3.31Å
83	L	39.1	Very low	40.9	Very low	81 Å²	81	75 Å²	75	42%	0.424	40%	0.401	S	S	.	.	H	α-helix	trans	-74.6	-24.1	174.2	-70.4	170.4	0	0	0	112.4	L79 I80 P85	L79-L83 HydrophobicContact CD2-CD1 4.05Å; L79-L83 HydrophobicContact CD2-CD2 4.33Å; L79-L83 HydrophobicContact CD2-CG 4.03Å; L79-L83 WeakPolarHBondContact O-CG 3.36Å; L79-L83 PolarHBondContact O-N 2.71Å; I80-L83 PolarHBondContact O-N 3.31Å; L83-P85 VanDerWaalsContact C-CD 3.44Å; L83-P85 VanDerWaalsContact O-CD 3.32Å; L83-P85 WeakPolarHBondContact O-CD 3.32Å
84	F	42.1	Very low	41.5	Very low	15 Å²	15	75.6 Å²	75.6	7%	0.066	40%	0.401	C	S	.	.	S	Bend	trans	-118.2	71.4	178.6	-61.9	-84.3	0	0	0	110.6	I80 P81 Y82 M86 I102 C105 C137 Y141	I80-F84 HydrophobicContact CG2-CD2 4.04Å; I80-F84 HydrophobicContact CG2-CE2 4.27Å; I80-F84 VanDerWaalsContact O-CD2 3.27Å; I80-F84 WeakPolarHBondContact O-CD2 3.31Å; I80-F84 PolarHBondContact O-N 3.32Å; P81-F84 CarbonylContact O-C 3.52Å; Y82-F84 VanDerWaalsContact C-N 3.31Å; F84-M86 PolarHBondContact O-N 3.44Å; F84-M86 VanDerWaalsContact O-N 3.13Å; F84-I102 HydrophobicContact CB-CD1 3.86Å; F84-I102 HydrophobicContact CB-CG1 3.9Å; F84-I102 HydrophobicContact CD1-CG1 4.12Å; F84-I102 HydrophobicContact CD2-CG1 4.29Å; F84-I102 HydrophobicContact CG-CD1 4.4Å; F84-I102 HydrophobicContact CG-CG1 3.87Å; F84-C105 HydrophobicContact CZ-CB 4.16Å; F84-C137 HydrophobicContact CZ-CB 3.96Å; F84-Y141 AromaticContact CD1-CD2 3.65Å; F84-Y141 HydrophobicContact CD1-CD2 3.65Å; F84-Y141 HydrophobicContact CD1-CE2 4.39Å; F84-Y141 HydrophobicContact CD1-CG 4.11Å; F84-Y141 HydrophobicContact CE1-CD2 4.21Å; F84-Y141 HydrophobicContact CE1-CG 4.34Å
85	P	39.9	Very low	42	Very low	30 Å²	30	73 Å²	73	20%	0.195	39%	0.389	C	S	.	.			trans	-56.6	124.4	176.6	22.1	-30	0	0	0	109.6	V46 L83 D87 Q98	V46-P85 HydrophobicContact CG2-CB 4.36Å; V46-P85 HydrophobicContact CG2-CG 4.37Å; L83-P85 VanDerWaalsContact C-CD 3.44Å; L83-P85 VanDerWaalsContact O-CD 3.32Å; L83-P85 WeakPolarHBondContact O-CD 3.32Å; P85-D87 PolarHBondContact O-N 3.04Å; P85-Q98 PolarHBondContact O-NE2 3.34Å; P85-Q98 VanDerWaalsContact O-NE2 3.13Å
86	M	40.8	Very low	42.8	Very low	96 Å²	96	76.7 Å²	76.7	47%	0.473	41%	0.407	S	S	.	.			trans	-61.6	119.5	175.1	-82	-92	-80.8	0	0	108.8	F84 L88	F84-M86 PolarHBondContact O-N 3.44Å; F84-M86 VanDerWaalsContact O-N 3.13Å; M86-L88 PolarHBondContact O-N 3.17Å
87	D	40.3	Very low	43.3	Very low	73 Å²	73	79.9 Å²	79.9	39%	0.39	42%	0.423	S	S	.	.			trans	-82.8	99.1	172.2	-174	-0.8	0	0	0	107.8	P85 N89 L90	P85-D87 PolarHBondContact O-N 3.04Å; D87-N89 PolarHBondContact O-N 2.93Å; D87-N89 VanDerWaalsContact O-N 3.08Å; D87-N89 WeakPolarHBondContact OD1-CB 3.43Å; D87-N89 PolarHBondContact OD1-N 3.35Å; D87-N89 VanDerWaalsContact OD1-N 3.16Å; D87-N89 PolarHBondContact OD1-ND2 3.29Å; D87-L90 HydrophobicContact CB-CD1 3.79Å; D87-L90 HydrophobicContact CB-CG 3.79Å; D87-L90 VanDerWaalsContact O-CB 3.32Å; D87-L90 WeakPolarHBondContact O-CB 3.45Å; D87-L90 VanDerWaalsContact O-CG 3.29Å; D87-L90 WeakPolarHBondContact O-CG 3.45Å; D87-L90 PolarHBondContact O-N 3.16Å; D87-L90 VanDerWaalsContact O-N 3.09Å
88	L	45.8	Very low	43.7	Very low	139 Å²	139	77.1 Å²	77.1	73%	0.728	40%	0.402	S	S	*	.	T	Hydrogen-bonded Turn	trans	-63.8	-11.4	-178.7	-67.6	168.4	0	0	0	112.7	M86 L90	M86-L88 PolarHBondContact O-N 3.17Å; L88-L90 VanDerWaalsContact C-N 3.31Å
89	N	38.3	Very low	44.4	Very low	151 Å²	151	77 Å²	77	81%	0.807	40%	0.399	S	S	*	.	T	Hydrogen-bonded Turn	trans	-85.5	-0.5	175.9	-60	-59.9	0	0	0	113.7	D87	D87-N89 PolarHBondContact O-N 2.93Å; D87-N89 VanDerWaalsContact O-N 3.08Å; D87-N89 WeakPolarHBondContact OD1-CB 3.43Å; D87-N89 PolarHBondContact OD1-N 3.35Å; D87-N89 VanDerWaalsContact OD1-N 3.16Å; D87-N89 PolarHBondContact OD1-ND2 3.29Å
90	L	45	Very low	45.1	Very low	39 Å²	39	81 Å²	81	20%	0.204	42%	0.417	C	S	.	.	S	Bend	trans	-76.9	142.6	177.4	-66.7	175	0	0	0	111.6	D87 L88 Q94 Q95 Q98	D87-L90 HydrophobicContact CB-CD1 3.79Å; D87-L90 HydrophobicContact CB-CG 3.79Å; D87-L90 VanDerWaalsContact O-CB 3.32Å; D87-L90 WeakPolarHBondContact O-CB 3.45Å; D87-L90 VanDerWaalsContact O-CG 3.29Å; D87-L90 WeakPolarHBondContact O-CG 3.45Å; D87-L90 PolarHBondContact O-N 3.16Å; D87-L90 VanDerWaalsContact O-N 3.09Å; L88-L90 VanDerWaalsContact C-N 3.31Å; L90-Q94 HydrophobicContact CB-CB 3.71Å; L90-Q94 HydrophobicContact CD1-CB 4.36Å; L90-Q94 HydrophobicContact CD2-CB 3.87Å; L90-Q94 HydrophobicContact CD2-CG 4.31Å; L90-Q94 HydrophobicContact CG-CB 4.17Å; L90-Q95 HydrophobicContact CB-CG 3.78Å; L90-Q95 PolarHBondContact O-NE2 3.03Å; L90-Q95 VanDerWaalsContact O-NE2 3.13Å; L90-Q98 HydrophobicContact CD1-CB 4.46Å
91	N	44.3	Very low	45.4	Very low	67 Å²	67	81.3 Å²	81.3	36%	0.358	42%	0.418	S	S	.	.			trans	-69.2	164.7	170.4	69.1	37.2	0	0	0	111.2	L93 Q94 Q95	N91-L93 PolarHBondContact O-N 2.86Å; N91-L93 VanDerWaalsContact O-N 3.13Å; N91-L93 PolarHBondContact OD1-N 2.96Å; N91-Q94 PolarHBondContact ND2-OE1 2.98Å; N91-Q94 VanDerWaalsContact ND2-OE1 3.15Å; N91-Q94 WeakPolarHBondContact O-CA 3.48Å; N91-Q94 WeakPolarHBondContact O-CB 3.24Å; N91-Q94 PolarHBondContact O-N 3.27Å; N91-Q94 WeakPolarHBondContact OD1-CB 3.26Å; N91-Q94 VanDerWaalsContact OD1-CG 3.23Å; N91-Q94 WeakPolarHBondContact OD1-CG 3.41Å; N91-Q94 PolarHBondContact OD1-N 2.91Å; N91-Q94 PolarHBondContact OD1-OE1 3.36Å; N91-Q95 PolarHBondContact O-N 3Å
92	S	45.9	Very low	45.9	Very low	91 Å²	91	78.8 Å²	78.8	64%	0.636	40%	0.399	S	S	*	.	H	α-helix	trans	-53.6	-37.9	-176.1	55	0	0	0	0	113.9	Q95 Q96	S92-Q95 PolarHBondContact O-N 3.18Å; S92-Q96 WeakPolarHBondContact O-CB 3.28Å; S92-Q96 VanDerWaalsContact O-CG 3.31Å; S92-Q96 WeakPolarHBondContact O-CG 3.48Å; S92-Q96 PolarHBondContact O-N 3.03Å
93	L	46.9	Very low	46.5	Very low	119 Å²	119	78.7 Å²	78.7	62%	0.623	40%	0.403	S	S	*	.	H	α-helix	trans	-69.6	-38.4	177.6	-164.4	81	0	0	0	112	N91 Q96 H97	N91-L93 PolarHBondContact O-N 2.86Å; N91-L93 VanDerWaalsContact O-N 3.13Å; N91-L93 PolarHBondContact OD1-N 2.96Å; L93-Q96 PolarHBondContact O-N 3.11Å; L93-H97 WeakPolarHBondContact O-CB 3.49Å; L93-H97 PolarHBondContact O-N 3.49Å
94	Q	45.4	Very low	47.1	Very low	74 Å²	74	77.7 Å²	77.7	35%	0.346	40%	0.398	S	S	.	.	H	α-helix	trans	-69.8	-38.3	176	-74.2	171.4	-50.6	0	0	111.6	L90 N91 H97 Q98	L90-Q94 HydrophobicContact CB-CB 3.71Å; L90-Q94 HydrophobicContact CD1-CB 4.36Å; L90-Q94 HydrophobicContact CD2-CB 3.87Å; L90-Q94 HydrophobicContact CD2-CG 4.31Å; L90-Q94 HydrophobicContact CG-CB 4.17Å; N91-Q94 PolarHBondContact ND2-OE1 2.98Å; N91-Q94 VanDerWaalsContact ND2-OE1 3.15Å; N91-Q94 WeakPolarHBondContact O-CA 3.48Å; N91-Q94 WeakPolarHBondContact O-CB 3.24Å; N91-Q94 PolarHBondContact O-N 3.27Å; N91-Q94 WeakPolarHBondContact OD1-CB 3.26Å; N91-Q94 VanDerWaalsContact OD1-CG 3.23Å; N91-Q94 WeakPolarHBondContact OD1-CG 3.41Å; N91-Q94 PolarHBondContact OD1-N 2.91Å; N91-Q94 PolarHBondContact OD1-OE1 3.36Å; Q94-H97 PolarHBondContact O-N 3.46Å; Q94-Q98 WeakPolarHBondContact O-CB 3.46Å; Q94-Q98 PolarHBondContact O-N 3.28Å
95	Q	46.7	Very low	47.4	Very low	60 Å²	60	77.3 Å²	77.3	28%	0.28	40%	0.397	S	S	.	.	H	α-helix	trans	-64.4	-42.8	172.2	-69.6	178.4	-5	0	0	111.3	L90 N91 S92 H97 Q98 N99	L90-Q95 HydrophobicContact CB-CG 3.78Å; L90-Q95 PolarHBondContact O-NE2 3.03Å; L90-Q95 VanDerWaalsContact O-NE2 3.13Å; N91-Q95 PolarHBondContact O-N 3Å; S92-Q95 PolarHBondContact O-N 3.18Å; Q95-H97 VanDerWaalsContact C-N 3.31Å; Q95-H97 PolarHBondContact O-N 3.32Å; Q95-Q98 PolarHBondContact O-N 2.85Å; Q95-N99 WeakPolarHBondContact O-CB 3.31Å; Q95-N99 PolarHBondContact O-N 2.6Å; Q95-N99 PolarHBondContact O-ND2 3.04Å
96	Q	52.2	Low	47.7	Very low	128 Å²	128	77.8 Å²	77.8	60%	0.598	40%	0.4	S	S	*	.	H	α-helix	trans	-59.6	-41.8	173	-78.3	177.1	-21.8	0	0	112.1	S92 L93 N99 H100	S92-Q96 WeakPolarHBondContact O-CB 3.28Å; S92-Q96 VanDerWaalsContact O-CG 3.31Å; S92-Q96 WeakPolarHBondContact O-CG 3.48Å; S92-Q96 PolarHBondContact O-N 3.03Å; L93-Q96 PolarHBondContact O-N 3.11Å; Q96-N99 PolarHBondContact O-N 3.43Å; Q96-H100 WeakPolarHBondContact O-CB 3.28Å; Q96-H100 PolarHBondContact O-N 3.5Å
97	H	51.9	Low	48.1	Very low	110 Å²	110	77.2 Å²	77.2	51%	0.509	40%	0.399	S	S	.	.	H	α-helix	trans	-65.9	-43.5	176.2	-168.9	63.8	0	0	0	112.1	L93 Q94 Q95 N99 H100 Q101	L93-H97 WeakPolarHBondContact O-CB 3.49Å; L93-H97 PolarHBondContact O-N 3.49Å; Q94-H97 PolarHBondContact O-N 3.46Å; Q95-H97 VanDerWaalsContact C-N 3.31Å; Q95-H97 PolarHBondContact O-N 3.32Å; H97-N99 VanDerWaalsContact C-N 3.33Å; H97-N99 PolarHBondContact O-N 2.93Å; H97-H100 PolarHBondContact O-N 3.34Å; H97-Q101 PolarHBondContact CD2-NE2 3.45Å; H97-Q101 PolarHBondContact NE2-NE2 3.1Å; H97-Q101 VanDerWaalsContact O-CG 3.31Å; H97-Q101 WeakPolarHBondContact O-CG 3.22Å; H97-Q101 PolarHBondContact O-N 3.3Å
98	Q	48.1	Very low	48.4	Very low	15 Å²	15	77.3 Å²	77.3	7%	0.07	40%	0.399	C	S	.	.	H	α-helix	trans	-59.4	-44.9	175.2	-172.6	176.2	15.9	0	0	110.9	P85 L90 Q94 Q95 H100 Q101 I102	P85-Q98 PolarHBondContact O-NE2 3.34Å; P85-Q98 VanDerWaalsContact O-NE2 3.13Å; L90-Q98 HydrophobicContact CD1-CB 4.46Å; Q94-Q98 WeakPolarHBondContact O-CB 3.46Å; Q94-Q98 PolarHBondContact O-N 3.28Å; Q95-Q98 PolarHBondContact O-N 2.85Å; Q98-H100 PolarHBondContact O-N 2.8Å; Q98-Q101 WeakPolarHBondContact O-CB 3.5Å; Q98-Q101 PolarHBondContact O-N 3.19Å; Q98-I102 HydrophobicContact CG-CD1 4.15Å; Q98-I102 VanDerWaalsContact O-CG1 3.31Å; Q98-I102 WeakPolarHBondContact O-CG1 3.45Å; Q98-I102 PolarHBondContact O-N 3.07Å
99	N	52.7	Low	48.4	Very low	70 Å²	70	72.3 Å²	72.3	37%	0.374	37%	0.371	S	S	.	.	H	α-helix	trans	-63.1	-43.4	177.4	-71	-21.3	0	0	0	112.5	Q95 Q96 H97 Q101 I102 Q103	Q95-N99 WeakPolarHBondContact O-CB 3.31Å; Q95-N99 PolarHBondContact O-N 2.6Å; Q95-N99 PolarHBondContact O-ND2 3.04Å; Q96-N99 PolarHBondContact O-N 3.43Å; H97-N99 VanDerWaalsContact C-N 3.33Å; H97-N99 PolarHBondContact O-N 2.93Å; N99-Q101 VanDerWaalsContact C-N 3.28Å; N99-Q101 PolarHBondContact O-N 3.06Å; N99-I102 PolarHBondContact O-N 3.32Å; N99-Q103 WeakPolarHBondContact O-CG 3.38Å; N99-Q103 PolarHBondContact O-N 2.96Å
100	H	57.8	Low	48.7	Very low	104 Å²	104	69 Å²	69	48%	0.481	35%	0.352	S	S	.	.	H	α-helix	trans	-62.8	-36.6	175.9	-170.6	-48.9	0	0	0	111.7	Q96 H97 Q98 Q103 N104	Q96-H100 WeakPolarHBondContact O-CB 3.28Å; Q96-H100 PolarHBondContact O-N 3.5Å; H97-H100 PolarHBondContact O-N 3.34Å; Q98-H100 PolarHBondContact O-N 2.8Å; H100-Q103 PolarHBondContact O-N 3.46Å; H100-N104 PolarHBondContact CE1-ND2 3.4Å; H100-N104 VanDerWaalsContact CE1-ND2 3.35Å; H100-N104 PolarHBondContact CE1-OD1 3.49Å; H100-N104 VanDerWaalsContact CE1-OD1 3.24Å; H100-N104 PolarHBondContact ND1-ND2 3.08Å; H100-N104 PolarHBondContact ND1-OD1 3.16Å; H100-N104 VanDerWaalsContact O-CG 3.3Å; H100-N104 PolarHBondContact O-N 3.05Å; H100-N104 PolarHBondContact O-OD1 2.64Å
101	Q	50.4	Low	48.6	Very low	39 Å²	39	70.9 Å²	70.9	18%	0.182	37%	0.366	C	S	.	.	H	α-helix	trans	-67.8	-43.3	176.6	-73.2	178.4	-0.9	0	0	112.1	H97 Q98 N99 Q103 N104 C105 T144	H97-Q101 PolarHBondContact CD2-NE2 3.45Å; H97-Q101 PolarHBondContact NE2-NE2 3.1Å; H97-Q101 VanDerWaalsContact O-CG 3.31Å; H97-Q101 WeakPolarHBondContact O-CG 3.22Å; H97-Q101 PolarHBondContact O-N 3.3Å; Q98-Q101 WeakPolarHBondContact O-CB 3.5Å; Q98-Q101 PolarHBondContact O-N 3.19Å; N99-Q101 VanDerWaalsContact C-N 3.28Å; N99-Q101 PolarHBondContact O-N 3.06Å; Q101-Q103 VanDerWaalsContact C-N 3.32Å; Q101-Q103 PolarHBondContact O-N 3.35Å; Q101-N104 PolarHBondContact O-N 3.3Å; Q101-C105 PolarHBondContact O-N 2.91Å; Q101-C105 PolarHBondContact O-SG 3.24Å; Q101-T144 PolarHBondContact OE1-OG1 3.09Å
102	I	50.5	Low	48.4	Very low	31 Å²	31	68.5 Å²	68.5	16%	0.159	36%	0.356	C	S	.	.	H	α-helix	trans	-58.2	-48.6	174.3	-67.3	165.5	0	0	0	109.2	I80 F84 Q98 N99 N104 C105 T106	I80-I102 HydrophobicContact CG2-CG2 3.98Å; F84-I102 HydrophobicContact CB-CD1 3.86Å; F84-I102 HydrophobicContact CB-CG1 3.9Å; F84-I102 HydrophobicContact CD1-CG1 4.12Å; F84-I102 HydrophobicContact CD2-CG1 4.29Å; F84-I102 HydrophobicContact CG-CD1 4.4Å; F84-I102 HydrophobicContact CG-CG1 3.87Å; Q98-I102 HydrophobicContact CG-CD1 4.15Å; Q98-I102 VanDerWaalsContact O-CG1 3.31Å; Q98-I102 WeakPolarHBondContact O-CG1 3.45Å; Q98-I102 PolarHBondContact O-N 3.07Å; N99-I102 PolarHBondContact O-N 3.32Å; I102-N104 PolarHBondContact O-N 3.4Å; I102-C105 PolarHBondContact O-N 3.47Å; I102-C105 VanDerWaalsContact O-N 3.17Å; I102-T106 PolarHBondContact O-N 3.32Å; I102-T106 PolarHBondContact O-OG1 3.25Å
103	Q	52.7	Low	48	Very low	121 Å²	121	65 Å²	65	57%	0.565	33%	0.331	S	S	*	.	H	α-helix	trans	-58.7	-43.4	177.3	-74.6	179.9	-25.6	0	0	113.1	N99 H100 Q101 C105 T106 N107	N99-Q103 WeakPolarHBondContact O-CG 3.38Å; N99-Q103 PolarHBondContact O-N 2.96Å; H100-Q103 PolarHBondContact O-N 3.46Å; Q101-Q103 VanDerWaalsContact C-N 3.32Å; Q101-Q103 PolarHBondContact O-N 3.35Å; Q103-C105 VanDerWaalsContact C-N 3.35Å; Q103-C105 PolarHBondContact O-N 2.89Å; Q103-T106 PolarHBondContact O-N 3.33Å; Q103-N107 WeakPolarHBondContact O-CB 3.2Å; Q103-N107 PolarHBondContact O-N 3.5Å; Q103-N107 PolarHBondContact O-ND2 3.43Å
104	N	52.2	Low	47.5	Very low	60 Å²	60	63.7 Å²	63.7	32%	0.321	32%	0.324	S	S	.	.	H	α-helix	trans	-62.6	-42.1	176.2	-74.6	-5.1	0	0	0	112	H100 Q101 I102 T106 N107 D108	H100-N104 PolarHBondContact CE1-ND2 3.4Å; H100-N104 VanDerWaalsContact CE1-ND2 3.35Å; H100-N104 PolarHBondContact CE1-OD1 3.49Å; H100-N104 VanDerWaalsContact CE1-OD1 3.24Å; H100-N104 PolarHBondContact ND1-ND2 3.08Å; H100-N104 PolarHBondContact ND1-OD1 3.16Å; H100-N104 VanDerWaalsContact O-CG 3.3Å; H100-N104 PolarHBondContact O-N 3.05Å; H100-N104 PolarHBondContact O-OD1 2.64Å; Q101-N104 PolarHBondContact O-N 3.3Å; I102-N104 PolarHBondContact O-N 3.4Å; N104-T106 VanDerWaalsContact C-N 3.31Å; N104-T106 PolarHBondContact O-N 2.98Å; N104-N107 PolarHBondContact O-N 3.12Å; N104-D108 WeakPolarHBondContact O-CB 3.4Å; N104-D108 PolarHBondContact O-N 2.91Å
105	C	47.2	Very low	46.9	Very low	6 Å²	6	65.8 Å²	65.8	4%	0.041	33%	0.334	C	S	.	.	H	α-helix	trans	-63.8	-39.2	176.7	-65	0	0	0	0	111.4	F84 Q101 I102 Q103 W109	F84-C105 HydrophobicContact CZ-CB 4.16Å; Q101-C105 PolarHBondContact O-N 2.91Å; Q101-C105 PolarHBondContact O-SG 3.24Å; I102-C105 PolarHBondContact O-N 3.47Å; I102-C105 VanDerWaalsContact O-N 3.17Å; Q103-C105 VanDerWaalsContact C-N 3.35Å; Q103-C105 PolarHBondContact O-N 2.89Å; C105-W109 WeakPolarHBondContact O-CB 3.36Å; C105-W109 PolarHBondContact O-N 3.32Å
106	T	47.5	Very low	46.4	Very low	40 Å²	40	65.6 Å²	65.6	25%	0.245	33%	0.334	C	S	.	.	H	α-helix	trans	-64.4	-40.9	174.2	-48.5	0	0	0	0	111.8	I80 I102 Q103 N104 W109 L110	I80-T106 HydrophobicContact CD1-CG2 4.31Å; I102-T106 PolarHBondContact O-N 3.32Å; I102-T106 PolarHBondContact O-OG1 3.25Å; Q103-T106 PolarHBondContact O-N 3.33Å; N104-T106 VanDerWaalsContact C-N 3.31Å; N104-T106 PolarHBondContact O-N 2.98Å; T106-W109 WeakPolarHBondContact O-CB 3.37Å; T106-W109 PolarHBondContact O-N 2.96Å; T106-L110 WeakPolarHBondContact O-CG 3.35Å; T106-L110 PolarHBondContact O-N 3.33Å
107	N	48.9	Very low	45.7	Very low	85 Å²	85	64.1 Å²	64.1	46%	0.455	33%	0.331	S	S	.	.	H	α-helix	trans	-68.2	-44.1	177.8	-69.3	-22.6	0	0	0	112	Q103 N104 W109 L110 V111	Q103-N107 WeakPolarHBondContact O-CB 3.2Å; Q103-N107 PolarHBondContact O-N 3.5Å; Q103-N107 PolarHBondContact O-ND2 3.43Å; N104-N107 PolarHBondContact O-N 3.12Å; N107-W109 PolarHBondContact O-N 3.01Å; N107-L110 PolarHBondContact O-N 3.12Å; N107-L110 VanDerWaalsContact O-N 3.14Å; N107-V111 WeakPolarHBondContact O-CG2 3.49Å; N107-V111 PolarHBondContact O-N 2.9Å
108	D	45.7	Very low	45	Very low	74 Å²	74	65.1 Å²	65.1	40%	0.396	34%	0.339	S	S	.	.	H	α-helix	trans	-59.6	-36.8	175.2	-69	-21.3	0	0	0	110.5	N104 G112 R140	N104-D108 WeakPolarHBondContact O-CB 3.4Å; N104-D108 PolarHBondContact O-N 2.91Å; D108-G112 PolarHBondContact O-N 2.73Å; D108-R140 IonicContact OD2-CZ 3.2Å; D108-R140 IonicContact OD2-NH1 2.74Å; D108-R140 PolarHBondContact OD2-NH1 3.13Å; D108-R140 IonicContact OD2-NH2 3.05Å; D108-R140 PolarHBondContact OD2-NH2 3.32Å
109	W	46.4	Very low	44.2	Very low	34 Å²	34	69.4 Å²	69.4	13%	0.129	36%	0.363	C	S	.	.	H	α-helix	trans	-66.7	-42.4	173.3	-179	86.1	0	0	0	113.1	N73 Y76 C105 T106 N107 G112 N113 V133	N73-W109 HydrophobicContact CB-CH2 4.24Å; N73-W109 WeakPolarHBondContact OD1-CH2 3.49Å; Y76-W109 HydrophobicContact CD2-CZ2 4.04Å; Y76-W109 HydrophobicContact CG-CZ2 4.26Å; C105-W109 WeakPolarHBondContact O-CB 3.36Å; C105-W109 PolarHBondContact O-N 3.32Å; T106-W109 WeakPolarHBondContact O-CB 3.37Å; T106-W109 PolarHBondContact O-N 2.96Å; N107-W109 PolarHBondContact O-N 3.01Å; W109-G112 PolarHBondContact O-N 3.09Å; W109-N113 VanDerWaalsContact CD2-ND2 3.33Å; W109-N113 WeakPolarHBondContact CZ2-ND2 3.34Å; W109-N113 PolarHBondContact O-N 3.02Å; W109-N113 VanDerWaalsContact O-N 3.15Å; W109-N113 PolarHBondContact O-ND2 3.19Å; W109-V133 HydrophobicContact CB-CG1 4.15Å; W109-V133 HydrophobicContact CG-CG1 4.4Å
110	L	44.6	Very low	43.3	Very low	81 Å²	81	69.6 Å²	69.6	42%	0.424	38%	0.381	S	S	.	.	H	α-helix	trans	-63.2	-45.5	176.4	-72.9	168.8	0	0	0	111.6	T106 N107 G112 N113 D114	T106-L110 WeakPolarHBondContact O-CG 3.35Å; T106-L110 PolarHBondContact O-N 3.33Å; N107-L110 PolarHBondContact O-N 3.12Å; N107-L110 VanDerWaalsContact O-N 3.14Å; L110-G112 PolarHBondContact O-N 3.44Å; L110-N113 PolarHBondContact O-N 3.35Å; L110-D114 PolarHBondContact O-N 3.29Å
111	V	42.4	Very low	42.2	Very low	80 Å²	80	70.9 Å²	70.9	49%	0.485	39%	0.391	S	S	.	.	H	α-helix	trans	-63.7	-40.5	178.2	174.1	0	0	0	0	111.5	N107 N113 D114 H115	N107-V111 WeakPolarHBondContact O-CG2 3.49Å; N107-V111 PolarHBondContact O-N 2.9Å; V111-N113 VanDerWaalsContact C-N 3.3Å; V111-N113 PolarHBondContact O-N 3.04Å; V111-D114 PolarHBondContact O-N 3.45Å; V111-H115 PolarHBondContact O-CD2 3.5Å; V111-H115 PolarHBondContact O-N 3.2Å
112	G	40.1	Very low	41.2	Very low	16 Å²	16	77 Å²	77	17%	0.165	43%	0.426	C	S	.	.	H	α-helix	trans	-60.2	-38	174.8	0	0	0	0	0	113.1	D108 W109 L110 I116	D108-G112 PolarHBondContact O-N 2.73Å; W109-G112 PolarHBondContact O-N 3.09Å; L110-G112 PolarHBondContact O-N 3.44Å; G112-I116 WeakPolarHBondContact O-CG1 3.36Å
113	N	38.1	Very low	40.4	Very low	18 Å²	18	81.8 Å²	81.8	10%	0.096	46%	0.457	C	S	.	.	H	α-helix	trans	-74.4	-35	176.3	-74.7	-56.8	0	0	0	113	W109 L110 V111 H115 I116 N117	W109-N113 VanDerWaalsContact CD2-ND2 3.33Å; W109-N113 WeakPolarHBondContact CZ2-ND2 3.34Å; W109-N113 PolarHBondContact O-N 3.02Å; W109-N113 VanDerWaalsContact O-N 3.15Å; W109-N113 PolarHBondContact O-ND2 3.19Å; L110-N113 PolarHBondContact O-N 3.35Å; V111-N113 VanDerWaalsContact C-N 3.3Å; V111-N113 PolarHBondContact O-N 3.04Å; N113-H115 VanDerWaalsContact C-N 3.3Å; N113-H115 PolarHBondContact O-N 3.2Å; N113-I116 WeakPolarHBondContact O-CB 3.24Å; N113-I116 PolarHBondContact O-N 3.12Å; N113-I116 VanDerWaalsContact O-N 3.13Å; N113-N117 VanDerWaalsContact O-CG 3.31Å; N113-N117 PolarHBondContact O-N 2.9Å; N113-N117 PolarHBondContact O-ND2 3.36Å
114	D	36.5	Very low	39.8	Very low	91 Å²	91	79.5 Å²	79.5	49%	0.487	45%	0.454	S	S	.	.	H	α-helix	trans	-66.8	-31.7	177	-78.6	-18	0	0	0	112.7	L110 V111 I116 N117 N118	L110-D114 PolarHBondContact O-N 3.29Å; V111-D114 PolarHBondContact O-N 3.45Å; D114-I116 VanDerWaalsContact C-N 3.32Å; D114-N117 PolarHBondContact O-N 3.28Å; D114-N118 WeakPolarHBondContact O-CB 3.35Å; D114-N118 PolarHBondContact O-N 2.85Å; D114-N118 VanDerWaalsContact O-N 3.15Å; D114-N118 PolarHBondContact O-ND2 3.18Å
115	H	33.1	Very low	39.3	Very low	119 Å²	119	80.6 Å²	80.6	55%	0.551	46%	0.46	S	S	*	.	H	α-helix	trans	-70.3	-26.7	172	-77.5	-61.5	0	0	0	113.4	V111 N113 N119	V111-H115 PolarHBondContact O-CD2 3.5Å; V111-H115 PolarHBondContact O-N 3.2Å; N113-H115 VanDerWaalsContact C-N 3.3Å; N113-H115 PolarHBondContact O-N 3.2Å; H115-N119 WeakPolarHBondContact O-CB 3.45Å; H115-N119 PolarHBondContact O-ND2 3.35Å
116	I	36.2	Very low	39.1	Very low	56 Å²	56	83.3 Å²	83.3	29%	0.287	48%	0.477	S	S	.	.	H	α-helix	trans	-76.8	-39.1	173.4	-63.4	166.4	0	0	0	110.4	G112 N113 D114 M129	G112-I116 WeakPolarHBondContact O-CG1 3.36Å; N113-I116 WeakPolarHBondContact O-CB 3.24Å; N113-I116 PolarHBondContact O-N 3.12Å; N113-I116 VanDerWaalsContact O-N 3.13Å; D114-I116 VanDerWaalsContact C-N 3.32Å; I116-M129 HydrophobicContact CD1-CE 3.65Å; I116-M129 HydrophobicContact CD1-SD 3.68Å; I116-M129 HydrophobicContact CG1-CE 3.94Å; I116-M129 HydrophobicContact CG1-SD 3.75Å
117	N	35.8	Very low	38.8	Very low	97 Å²	97	83.3 Å²	83.3	52%	0.519	48%	0.477	S	S	.	.	H	α-helix	trans	-74.2	-27.1	-176.9	-70	-28.1	0	0	0	113.7	N113 D114	N113-N117 VanDerWaalsContact O-CG 3.31Å; N113-N117 PolarHBondContact O-N 2.9Å; N113-N117 PolarHBondContact O-ND2 3.36Å; D114-N117 PolarHBondContact O-N 3.28Å
118	N	37.1	Very low	38.6	Very low	130 Å²	130	84.1 Å²	84.1	70%	0.695	48%	0.481	S	S	*	.	H	α-helix	trans	-97	-16.4	-176.5	-70.7	-49.4	0	0	0	114.3	D114	D114-N118 WeakPolarHBondContact O-CB 3.35Å; D114-N118 PolarHBondContact O-N 2.85Å; D114-N118 VanDerWaalsContact O-N 3.15Å; D114-N118 PolarHBondContact O-ND2 3.18Å
119	N	32.7	Very low	38.4	Very low	106 Å²	106	83.5 Å²	83.5	57%	0.567	48%	0.476	S	S	*	.			trans	-106.8	91	176.9	-69.5	-24.6	0	0	0	109	H115 N121	H115-N119 WeakPolarHBondContact O-CB 3.45Å; H115-N119 PolarHBondContact O-ND2 3.35Å; N119-N121 PolarHBondContact O-N 3.31Å
120	G	33.6	Very low	38.3	Very low	73 Å²	73	84.2 Å²	84.2	75%	0.753	48%	0.479	S	S	*	.			trans	-63.6	27.4	176.4	0	0	0	0	0	115.8
121	N	33.8	Very low	38.5	Very low	131 Å²	131	83.3 Å²	83.3	70%	0.701	48%	0.475	S	S	*	.			trans	-105.8	105.8	177.1	-76.9	-10.7	0	0	0	109.9	N119 T123	N119-N121 PolarHBondContact O-N 3.31Å; N121-T123 PolarHBondContact O-N 2.9Å
122	N	31.1	Very low	38.6	Very low	168 Å²	168	81.6 Å²	81.6	90%	0.898	47%	0.469	S	S	*	.			trans	-66.4	61.1	179	-69.4	-27.9	0	0	0	113.8
123	T	33.4	Very low	38.9	Very low	132 Å²	132	82 Å²	82	81%	0.81	47%	0.468	S	S	*	.			trans	-128.2	15.6	-176.8	57.8	0	0	0	0	115.7	N121	N121-T123 PolarHBondContact O-N 2.9Å
124	S	40.5	Very low	39.5	Very low	72 Å²	72	83.1 Å²	83.1	50%	0.503	48%	0.48	S	S	.	.	S	Bend	trans	-137.6	113.1	170.9	49.7	0	0	0	0	109.8	P126	S124-P126 WeakPolarHBondContact O-CD 3.4Å; S124-P126 VanDerWaalsContact O-N 3.08Å
125	D	41.3	Very low	40	Very low	84 Å²	84	80.2 Å²	80.2	45%	0.449	47%	0.466	S	S	.	.			trans	-49.2	114.6	175.7	-179.4	-5	0	0	0	109.2	T127 L128 M129	D125-T127 PolarHBondContact O-N 3.34Å; D125-T127 WeakPolarHBondContact OD1-CB 3.35Å; D125-T127 PolarHBondContact OD1-N 3.24Å; D125-T127 PolarHBondContact OD1-OG1 2.88Å; D125-L128 HydrophobicContact CB-CB 4.26Å; D125-L128 HydrophobicContact CB-CD1 4.01Å; D125-L128 WeakPolarHBondContact O-CB 3.39Å; D125-L128 PolarHBondContact O-N 3.41Å; D125-M129 PolarHBondContact O-N 2.81Å
126	P	41.5	Very low	40.7	Very low	62 Å²	62	79 Å²	79	40%	0.403	46%	0.46	S	S	.	.	H	α-helix	trans	-51.5	-35.9	-178.6	-24.2	31.4	0	0	0	110.9	S124 L128 M129 Y130	S124-P126 WeakPolarHBondContact O-CD 3.4Å; S124-P126 VanDerWaalsContact O-N 3.08Å; P126-L128 VanDerWaalsContact C-N 3.3Å; P126-L128 PolarHBondContact O-N 3.45Å; P126-M129 PolarHBondContact O-N 3.49Å; P126-Y130 HydrophobicContact CB-CD2 4.08Å; P126-Y130 HydrophobicContact CB-CE2 3.67Å; P126-Y130 WeakPolarHBondContact O-CD2 3.49Å; P126-Y130 PolarHBondContact O-N 3.42Å
127	T	42.6	Very low	41.3	Very low	41 Å²	41	77.3 Å²	77.3	25%	0.252	45%	0.453	S	S	.	.	H	α-helix	trans	-58.2	-39.2	178.5	-34.6	0	0	0	0	112.6	D125 Y130 L131	D125-T127 PolarHBondContact O-N 3.34Å; D125-T127 WeakPolarHBondContact OD1-CB 3.35Å; D125-T127 PolarHBondContact OD1-N 3.24Å; D125-T127 PolarHBondContact OD1-OG1 2.88Å; T127-Y130 PolarHBondContact O-N 2.88Å; T127-L131 HydrophobicContact CG2-CD1 4.5Å; T127-L131 WeakPolarHBondContact O-CB 3.42Å; T127-L131 VanDerWaalsContact O-CG 3.31Å; T127-L131 WeakPolarHBondContact O-CG 3.21Å; T127-L131 PolarHBondContact O-N 2.93Å
128	L	43.7	Very low	42	Very low	101 Å²	101	75 Å²	75	53%	0.529	44%	0.44	S	S	.	.	H	α-helix	trans	-71.5	-39.2	179.1	-105.8	141.1	0	0	0	112	D125 P126 A132	D125-L128 HydrophobicContact CB-CB 4.26Å; D125-L128 HydrophobicContact CB-CD1 4.01Å; D125-L128 WeakPolarHBondContact O-CB 3.39Å; D125-L128 PolarHBondContact O-N 3.41Å; P126-L128 VanDerWaalsContact C-N 3.3Å; P126-L128 PolarHBondContact O-N 3.45Å; L128-A132 WeakPolarHBondContact O-CB 3.4Å; L128-A132 PolarHBondContact O-N 2.96Å
129	M	40.9	Very low	42.5	Very low	61 Å²	61	70.2 Å²	70.2	30%	0.3	42%	0.415	S	S	.	.	H	α-helix	trans	-67.6	-41.3	172.7	-89.5	-165.2	66.4	0	0	111.9	I116 D125 P126 L131 A132 V133	I116-M129 HydrophobicContact CD1-CE 3.65Å; I116-M129 HydrophobicContact CD1-SD 3.68Å; I116-M129 HydrophobicContact CG1-CE 3.94Å; I116-M129 HydrophobicContact CG1-SD 3.75Å; D125-M129 PolarHBondContact O-N 2.81Å; P126-M129 PolarHBondContact O-N 3.49Å; M129-L131 PolarHBondContact O-N 2.93Å; M129-A132 WeakPolarHBondContact O-CB 3.26Å; M129-A132 PolarHBondContact O-N 3.25Å; M129-V133 WeakPolarHBondContact O-CG2 3.36Å; M129-V133 PolarHBondContact O-N 2.94Å
130	Y	45.8	Very low	43.3	Very low	49 Å²	49	69.1 Å²	69.1	19%	0.192	40%	0.402	C	S	.	.	H	α-helix	trans	-62.7	-41.8	176.5	-71.4	-58.2	0	0	0	112.2	Y76 P126 T127 A134	Y76-Y130 HydrophobicContact CE2-CD1 4.46Å; Y76-Y130 HydrophobicContact CE2-CE1 4.41Å; P126-Y130 HydrophobicContact CB-CD2 4.08Å; P126-Y130 HydrophobicContact CB-CE2 3.67Å; P126-Y130 WeakPolarHBondContact O-CD2 3.49Å; P126-Y130 PolarHBondContact O-N 3.42Å; T127-Y130 PolarHBondContact O-N 2.88Å; Y130-A134 VanDerWaalsContact O-CB 3.28Å; Y130-A134 WeakPolarHBondContact O-CB 3.18Å; Y130-A134 PolarHBondContact O-N 3.49Å
131	L	48.1	Very low	44	Very low	63 Å²	63	66.8 Å²	66.8	33%	0.33	37%	0.371	S	S	.	.	H	α-helix	trans	-64.8	-39.4	172.7	-75.7	167	0	0	0	111.9	T127 M129 T135	T127-L131 HydrophobicContact CG2-CD1 4.5Å; T127-L131 WeakPolarHBondContact O-CB 3.42Å; T127-L131 VanDerWaalsContact O-CG 3.31Å; T127-L131 WeakPolarHBondContact O-CG 3.21Å; T127-L131 PolarHBondContact O-N 2.93Å; M129-L131 PolarHBondContact O-N 2.93Å; L131-T135 VanDerWaalsContact O-CB 3.29Å; L131-T135 WeakPolarHBondContact O-CB 3.42Å; L131-T135 WeakPolarHBondContact O-CG2 3.4Å; L131-T135 PolarHBondContact O-N 3.11Å; L131-T135 PolarHBondContact O-OG1 3.4Å
132	A	44.8	Very low	44.6	Very low	44 Å²	44	61.6 Å²	61.6	36%	0.364	34%	0.343	S	S	.	.	H	α-helix	trans	-63.8	-42.7	177	0	0	0	0	0	112.5	L128 M129 T135 Q136	L128-A132 WeakPolarHBondContact O-CB 3.4Å; L128-A132 PolarHBondContact O-N 2.96Å; M129-A132 WeakPolarHBondContact O-CB 3.26Å; M129-A132 PolarHBondContact O-N 3.25Å; A132-T135 WeakPolarHBondContact CA-OG1 3.49Å; A132-T135 PolarHBondContact O-OG1 3.35Å; A132-Q136 WeakPolarHBondContact O-CB 3.46Å; A132-Q136 WeakPolarHBondContact O-CG 3.32Å; A132-Q136 PolarHBondContact O-N 3.13Å
133	V	46.7	Very low	45.2	Very low	23 Å²	23	56.7 Å²	56.7	14%	0.139	32%	0.316	C	S	.	.	H	α-helix	trans	-71.7	-42.9	177.8	179.7	0	0	0	0	111.1	W109 M129 T135 Q136 C137	W109-V133 HydrophobicContact CB-CG1 4.15Å; W109-V133 HydrophobicContact CG-CG1 4.4Å; M129-V133 WeakPolarHBondContact O-CG2 3.36Å; M129-V133 PolarHBondContact O-N 2.94Å; V133-T135 VanDerWaalsContact C-N 3.34Å; V133-T135 PolarHBondContact O-N 3.11Å; V133-Q136 PolarHBondContact O-N 3.46Å; V133-C137 WeakPolarHBondContact O-CB 3.48Å; V133-C137 PolarHBondContact O-N 2.92Å; V133-C137 PolarHBondContact O-SG 2.89Å
134	A	49.4	Very low	45.8	Very low	43 Å²	43	53.9 Å²	53.9	36%	0.355	30%	0.299	S	S	.	.	H	α-helix	trans	-61.1	-43	175.7	0	0	0	0	0	111.8	Y130 C137 I138	Y130-A134 VanDerWaalsContact O-CB 3.28Å; Y130-A134 WeakPolarHBondContact O-CB 3.18Å; Y130-A134 PolarHBondContact O-N 3.49Å; A134-C137 PolarHBondContact O-N 3.29Å; A134-I138 WeakPolarHBondContact O-CB 3.26Å; A134-I138 WeakPolarHBondContact O-CD1 2.95Å; A134-I138 WeakPolarHBondContact O-CG1 3.33Å; A134-I138 PolarHBondContact O-N 2.87Å
135	T	48.8	Very low	46	Very low	30 Å²	30	53.7 Å²	53.7	18%	0.184	30%	0.295	C	S	.	.	H	α-helix	trans	-66.6	-39.3	175.5	52.6	0	0	0	0	112	L131 A132 V133 I138 L139 L158	L131-T135 VanDerWaalsContact O-CB 3.29Å; L131-T135 WeakPolarHBondContact O-CB 3.42Å; L131-T135 WeakPolarHBondContact O-CG2 3.4Å; L131-T135 PolarHBondContact O-N 3.11Å; L131-T135 PolarHBondContact O-OG1 3.4Å; A132-T135 WeakPolarHBondContact CA-OG1 3.49Å; A132-T135 PolarHBondContact O-OG1 3.35Å; V133-T135 VanDerWaalsContact C-N 3.34Å; V133-T135 PolarHBondContact O-N 3.11Å; T135-I138 PolarHBondContact O-N 2.89Å; T135-L139 WeakPolarHBondContact O-CB 3.26Å; T135-L139 WeakPolarHBondContact O-CD1 3.39Å; T135-L139 WeakPolarHBondContact O-CG 3.37Å; T135-L139 PolarHBondContact O-N 3.41Å; T135-L158 HydrophobicContact CG2-CD2 4.34Å
136	Q	47.7	Very low	46.2	Very low	93 Å²	93	52.5 Å²	52.5	44%	0.435	29%	0.286	S	S	.	.	H	α-helix	trans	-63.5	-40.3	173.6	-82.1	173.9	-16.7	0	0	112.8	A132 V133 R140	A132-Q136 WeakPolarHBondContact O-CB 3.46Å; A132-Q136 WeakPolarHBondContact O-CG 3.32Å; A132-Q136 PolarHBondContact O-N 3.13Å; V133-Q136 PolarHBondContact O-N 3.46Å; Q136-R140 WeakPolarHBondContact O-CB 3.09Å; Q136-R140 WeakPolarHBondContact O-CG 3.39Å; Q136-R140 PolarHBondContact O-N 2.83Å
137	C	48.2	Very low	46.4	Very low	21 Å²	21	50.7 Å²	50.7	14%	0.142	27%	0.273	C	S	.	.	H	α-helix	trans	-66	-46.3	176.2	-73	0	0	0	0	111.9	F84 V133 A134 R140 Y141	F84-C137 HydrophobicContact CZ-CB 3.96Å; V133-C137 WeakPolarHBondContact O-CB 3.48Å; V133-C137 PolarHBondContact O-N 2.92Å; V133-C137 PolarHBondContact O-SG 2.89Å; A134-C137 PolarHBondContact O-N 3.29Å; C137-R140 PolarHBondContact O-N 2.68Å; C137-Y141 PolarHBondContact O-N 2.81Å
138	I	50.2	Low	46.2	Very low	48 Å²	48	55.9 Å²	55.9	25%	0.246	29%	0.289	C	S	.	.	H	α-helix	trans	-62.9	-46.4	174.9	-67.8	166	0	0	0	109.7	A134 T135 R140 Y141 F142	A134-I138 WeakPolarHBondContact O-CB 3.26Å; A134-I138 WeakPolarHBondContact O-CD1 2.95Å; A134-I138 WeakPolarHBondContact O-CG1 3.33Å; A134-I138 PolarHBondContact O-N 2.87Å; T135-I138 PolarHBondContact O-N 2.89Å; I138-R140 PolarHBondContact O-N 3.29Å; I138-Y141 PolarHBondContact O-N 3.24Å; I138-F142 HydrophobicContact CG2-CD2 3.61Å; I138-F142 HydrophobicContact CG2-CE2 3.69Å; I138-F142 WeakPolarHBondContact O-CB 3.5Å; I138-F142 WeakPolarHBondContact O-CD2 3.25Å; I138-F142 PolarHBondContact O-N 2.94Å
139	L	48.8	Very low	45.8	Very low	30 Å²	30	57.6 Å²	57.6	16%	0.157	30%	0.295	C	S	.	.	H	α-helix	trans	-59.4	-46.9	176.3	-77.6	164.7	0	0	0	110.7	T135 Y141 F142 L143 L154 L158	T135-L139 WeakPolarHBondContact O-CB 3.26Å; T135-L139 WeakPolarHBondContact O-CD1 3.39Å; T135-L139 WeakPolarHBondContact O-CG 3.37Å; T135-L139 PolarHBondContact O-N 3.41Å; L139-Y141 PolarHBondContact O-N 3.5Å; L139-F142 PolarHBondContact O-N 3.44Å; L139-L143 HydrophobicContact CB-CD1 4.17Å; L139-L143 WeakPolarHBondContact O-CA 3.25Å; L139-L143 WeakPolarHBondContact O-CB 3.45Å; L139-L143 WeakPolarHBondContact O-CD1 3.43Å; L139-L143 WeakPolarHBondContact O-CG 3.48Å; L139-L143 PolarHBondContact O-N 3.3Å; L139-L154 HydrophobicContact CD2-CD2 4.19Å; L139-L158 HydrophobicContact CD1-CD1 4.29Å
140	R	49	Very low	45.9	Very low	82 Å²	82	57.7 Å²	57.7	31%	0.309	29%	0.294	S	S	.	.	H	α-helix	trans	-59.4	-43.1	176.9	-84.1	-176	174.4	-172.2	8.5	112.6	D108 Q136 C137 I138 L143 T144	D108-R140 IonicContact OD2-CZ 3.2Å; D108-R140 IonicContact OD2-NH1 2.74Å; D108-R140 PolarHBondContact OD2-NH1 3.13Å; D108-R140 IonicContact OD2-NH2 3.05Å; D108-R140 PolarHBondContact OD2-NH2 3.32Å; Q136-R140 WeakPolarHBondContact O-CB 3.09Å; Q136-R140 WeakPolarHBondContact O-CG 3.39Å; Q136-R140 PolarHBondContact O-N 2.83Å; C137-R140 PolarHBondContact O-N 2.68Å; I138-R140 PolarHBondContact O-N 3.29Å; R140-L143 PolarHBondContact O-N 3.01Å; R140-T144 WeakPolarHBondContact O-CG2 3.41Å; R140-T144 PolarHBondContact O-N 2.88Å; R140-T144 PolarHBondContact O-OG1 2.87Å
141	Y	48.4	Very low	45.6	Very low	24 Å²	24	56.5 Å²	56.5	9%	0.094	29%	0.291	C	S	.	.	H	α-helix	trans	-64.2	-45.2	175.6	-178.8	-106.3	0	0	0	112.4	F84 C137 I138 L139 T144 T145	F84-Y141 AromaticContact CD1-CD2 3.65Å; F84-Y141 HydrophobicContact CD1-CD2 3.65Å; F84-Y141 HydrophobicContact CD1-CE2 4.39Å; F84-Y141 HydrophobicContact CD1-CG 4.11Å; F84-Y141 HydrophobicContact CE1-CD2 4.21Å; F84-Y141 HydrophobicContact CE1-CG 4.34Å; C137-Y141 PolarHBondContact O-N 2.81Å; I138-Y141 PolarHBondContact O-N 3.24Å; L139-Y141 PolarHBondContact O-N 3.5Å; Y141-T144 PolarHBondContact O-N 2.94Å; Y141-T144 PolarHBondContact O-OG1 2.8Å; Y141-T145 HydrophobicContact CE2-CG2 4.33Å; Y141-T145 WeakPolarHBondContact O-CG2 3.26Å; Y141-T145 PolarHBondContact O-N 3.03Å; Y141-T145 PolarHBondContact O-OG1 2.89Å
142	F	46.3	Very low	45.1	Very low	23 Å²	23	57.7 Å²	57.7	10%	0.101	30%	0.297	C	S	.	.	H	α-helix	trans	-68.3	-35	177	-88.3	-105.5	0	0	0	112	Y38 I138 L139 T144 T145 H146 L154	Y38-F142 AromaticContact CD1-CE1 3.71Å; Y38-F142 HydrophobicContact CD1-CE1 3.71Å; Y38-F142 AromaticContact CD1-CZ 3.79Å; Y38-F142 HydrophobicContact CD1-CZ 3.79Å; Y38-F142 HydrophobicContact CE1-CD1 4.23Å; Y38-F142 AromaticContact CE1-CE1 3.2Å; Y38-F142 HydrophobicContact CE1-CE1 3.2Å; Y38-F142 AromaticContact CE1-CZ 3.66Å; Y38-F142 HydrophobicContact CE1-CZ 3.66Å; Y38-F142 HydrophobicContact CE2-CE1 4.31Å; Y38-F142 HydrophobicContact CG-CE1 4.44Å; Y38-F142 AromaticContact CZ-CE1 3.55Å; I138-F142 HydrophobicContact CG2-CD2 3.61Å; I138-F142 HydrophobicContact CG2-CE2 3.69Å; I138-F142 WeakPolarHBondContact O-CB 3.5Å; I138-F142 WeakPolarHBondContact O-CD2 3.25Å; I138-F142 PolarHBondContact O-N 2.94Å; L139-F142 PolarHBondContact O-N 3.44Å; F142-T144 VanDerWaalsContact C-N 3.27Å; F142-T144 PolarHBondContact O-N 2.91Å; F142-T145 PolarHBondContact O-N 3.39Å; F142-H146 AromaticContact CD1-CD2 3.66Å; F142-H146 WeakPolarHBondContact O-CA 3.34Å; F142-H146 VanDerWaalsContact O-CB 3.26Å; F142-H146 WeakPolarHBondContact O-CB 3.46Å; F142-H146 PolarHBondContact O-N 3.21Å; F142-L154 HydrophobicContact CD1-CD1 4.4Å; F142-L154 HydrophobicContact CE1-CD1 4.47Å
143	L	43.3	Very low	44.9	Very low	64 Å²	64	62 Å²	62	34%	0.335	31%	0.305	S	S	.	.	H	α-helix	trans	-66.6	-28.4	178.7	-76.8	161.3	0	0	0	112.2	L139 R140 I151	L139-L143 HydrophobicContact CB-CD1 4.17Å; L139-L143 WeakPolarHBondContact O-CA 3.25Å; L139-L143 WeakPolarHBondContact O-CB 3.45Å; L139-L143 WeakPolarHBondContact O-CD1 3.43Å; L139-L143 WeakPolarHBondContact O-CG 3.48Å; L139-L143 PolarHBondContact O-N 3.3Å; R140-L143 PolarHBondContact O-N 3.01Å; L143-I151 HydrophobicContact CD2-CB 4.29Å; L143-I151 HydrophobicContact CD2-CD1 3.47Å; L143-I151 VanDerWaalsContact CD2-CD1 3.47Å; L143-I151 HydrophobicContact CD2-CG1 3.62Å; L143-I151 HydrophobicContact CD2-CG2 3.68Å; L143-I151 HydrophobicContact CG-CD1 4.35Å; L143-I151 HydrophobicContact CG-CG1 4.27Å
144	T	45.1	Very low	44.8	Very low	74 Å²	74	61.8 Å²	61.8	45%	0.454	30%	0.303	S	S	.	.	H	α-helix	trans	-91.3	-19.1	-178.7	59.7	0	0	0	0	112.9	Q101 R140 Y141 F142	Q101-T144 PolarHBondContact OE1-OG1 3.09Å; R140-T144 WeakPolarHBondContact O-CG2 3.41Å; R140-T144 PolarHBondContact O-N 2.88Å; R140-T144 PolarHBondContact O-OG1 2.87Å; Y141-T144 PolarHBondContact O-N 2.94Å; Y141-T144 PolarHBondContact O-OG1 2.8Å; F142-T144 VanDerWaalsContact C-N 3.27Å; F142-T144 PolarHBondContact O-N 2.91Å
145	T	46.2	Very low	44.4	Very low	68 Å²	68	62.7 Å²	62.7	42%	0.417	30%	0.302	S	S	.	.	H	α-helix	trans	-110.3	-20.5	-175.4	55.1	0	0	0	0	114	Y141 F142	Y141-T145 HydrophobicContact CE2-CG2 4.33Å; Y141-T145 WeakPolarHBondContact O-CG2 3.26Å; Y141-T145 PolarHBondContact O-N 3.03Å; Y141-T145 PolarHBondContact O-OG1 2.89Å; F142-T145 PolarHBondContact O-N 3.39Å
146	H	43.8	Very low	44	Very low	58 Å²	58	64.3 Å²	64.3	27%	0.269	31%	0.314	S	S	.	.	S	Bend	trans	-134.4	174.1	-165	-66	-52.4	0	0	0	116.6	Y38 F142	Y38-H146 AromaticContact CE1-NE2 3.93Å; Y38-H146 PolarHBondContact OH-CD2 2.81Å; Y38-H146 VanDerWaalsContact OH-CD2 3.29Å; Y38-H146 PolarHBondContact OH-CE1 2.95Å; Y38-H146 PolarHBondContact OH-NE2 3.4Å; F142-H146 AromaticContact CD1-CD2 3.66Å; F142-H146 WeakPolarHBondContact O-CA 3.34Å; F142-H146 VanDerWaalsContact O-CB 3.26Å; F142-H146 WeakPolarHBondContact O-CB 3.46Å; F142-H146 PolarHBondContact O-N 3.21Å
147	N	46.5	Very low	43.7	Very low	24 Å²	24	62.1 Å²	62.1	13%	0.128	30%	0.303	C	S	.	.			trans	-79.7	138.7	-164.9	-176.3	-0.6	0	0	0	113.1	Q149 Q150 I151 R237	N147-Q149 PolarHBondContact O-N 3.48Å; N147-Q150 HydrophobicContact CB-CG 4.43Å; N147-Q150 WeakPolarHBondContact O-CA 3.35Å; N147-Q150 WeakPolarHBondContact O-CB 3.47Å; N147-Q150 PolarHBondContact O-N 2.91Å; N147-I151 PolarHBondContact O-N 2.77Å; N147-R237 PolarHBondContact OD1-NH2 3.41Å
148	Y	39.5	Very low	43.4	Very low	151 Å²	151	62.4 Å²	62.4	59%	0.592	30%	0.303	S	S	*	.	H	α-helix	trans	-45.3	-34.7	175.6	-175.2	-100.2	0	0	0	115	I151 L152	Y148-I151 WeakPolarHBondContact O-CB 3.43Å; Y148-I151 PolarHBondContact O-N 2.73Å; Y148-L152 HydrophobicContact CD1-CD1 3.9Å; Y148-L152 HydrophobicContact CD1-CG 4.48Å; Y148-L152 HydrophobicContact CE1-CD1 3.43Å; Y148-L152 VanDerWaalsContact CE1-CD1 3.43Å; Y148-L152 HydrophobicContact CE1-CG 4.1Å; Y148-L152 PolarHBondContact O-N 2.82Å; Y148-L152 VanDerWaalsContact O-N 3.12Å
149	Q	34.4	Very low	42.9	Very low	137 Å²	137	65.5 Å²	65.5	64%	0.64	32%	0.317	S	S	*	.	H	α-helix	trans	-71.1	-33.2	176.3	-75.9	-175.9	-43.2	0	0	113.8	N147 I151 L152 Y153	N147-Q149 PolarHBondContact O-N 3.48Å; Q149-I151 VanDerWaalsContact C-N 3.3Å; Q149-L152 PolarHBondContact O-N 3.42Å; Q149-Y153 PolarHBondContact O-N 2.72Å; Q149-Y153 VanDerWaalsContact O-N 3.09Å
150	Q	42	Very low	42.2	Very low	63 Å²	63	67.3 Å²	67.3	29%	0.294	33%	0.331	S	S	.	.	H	α-helix	trans	-70.3	-32.8	175.4	-69.5	168.4	-41.5	0	0	110.7	N147 Y153 L154	N147-Q150 HydrophobicContact CB-CG 4.43Å; N147-Q150 WeakPolarHBondContact O-CA 3.35Å; N147-Q150 WeakPolarHBondContact O-CB 3.47Å; N147-Q150 PolarHBondContact O-N 2.91Å; Q150-Y153 PolarHBondContact O-N 3.22Å; Q150-L154 WeakPolarHBondContact O-CB 3.26Å; Q150-L154 PolarHBondContact O-N 3.43Å
151	I	40.3	Very low	41.3	Very low	23 Å²	23	65.8 Å²	65.8	12%	0.118	33%	0.329	C	S	.	.	H	α-helix	trans	-66.6	-44.5	174.6	-67.8	146.2	0	0	0	111.5	L143 N147 Y148 Q149 Y153 L154 N155	L143-I151 HydrophobicContact CD2-CB 4.29Å; L143-I151 HydrophobicContact CD2-CD1 3.47Å; L143-I151 VanDerWaalsContact CD2-CD1 3.47Å; L143-I151 HydrophobicContact CD2-CG1 3.62Å; L143-I151 HydrophobicContact CD2-CG2 3.68Å; L143-I151 HydrophobicContact CG-CD1 4.35Å; L143-I151 HydrophobicContact CG-CG1 4.27Å; N147-I151 PolarHBondContact O-N 2.77Å; Y148-I151 WeakPolarHBondContact O-CB 3.43Å; Y148-I151 PolarHBondContact O-N 2.73Å; Q149-I151 VanDerWaalsContact C-N 3.3Å; I151-Y153 VanDerWaalsContact C-N 3.33Å; I151-Y153 PolarHBondContact O-N 3.37Å; I151-L154 PolarHBondContact O-N 3.46Å; I151-N155 WeakPolarHBondContact O-CB 3.41Å; I151-N155 PolarHBondContact O-N 2.87Å
152	L	37.3	Very low	40.6	Very low	88 Å²	88	69 Å²	69	46%	0.461	34%	0.342	S	S	.	.	H	α-helix	trans	-63.9	-39.3	175.1	-75.9	172	0	0	0	112.1	Y148 Q149 S156	Y148-L152 HydrophobicContact CD1-CD1 3.9Å; Y148-L152 HydrophobicContact CD1-CG 4.48Å; Y148-L152 HydrophobicContact CE1-CD1 3.43Å; Y148-L152 VanDerWaalsContact CE1-CD1 3.43Å; Y148-L152 HydrophobicContact CE1-CG 4.1Å; Y148-L152 PolarHBondContact O-N 2.82Å; Y148-L152 VanDerWaalsContact O-N 3.12Å; Q149-L152 PolarHBondContact O-N 3.42Å; L152-S156 WeakPolarHBondContact O-CB 3.28Å; L152-S156 PolarHBondContact O-N 3.31Å; L152-S156 PolarHBondContact O-OG 3.28Å
153	Y	41.9	Very low	39.8	Very low	135 Å²	135	71.5 Å²	71.5	53%	0.529	36%	0.362	S	S	.	.	H	α-helix	trans	-64.4	-47.8	176.2	-173	-96.5	0	0	0	111.5	Y34 Q149 Q150 I151 N155 S156 F157	Y34-Y153 AromaticContact CE2-CE1 3.97Å; Y34-Y153 HydrophobicContact CE2-CE1 3.97Å; Q149-Y153 PolarHBondContact O-N 2.72Å; Q149-Y153 VanDerWaalsContact O-N 3.09Å; Q150-Y153 PolarHBondContact O-N 3.22Å; I151-Y153 VanDerWaalsContact C-N 3.33Å; I151-Y153 PolarHBondContact O-N 3.37Å; Y153-N155 PolarHBondContact O-N 3.42Å; Y153-S156 PolarHBondContact O-N 3.06Å; Y153-S156 PolarHBondContact O-OG 2.95Å; Y153-F157 WeakPolarHBondContact O-CB 3.47Å; Y153-F157 PolarHBondContact O-N 3.29Å
154	L	42.9	Very low	39.1	Very low	19 Å²	19	70.9 Å²	70.9	10%	0.099	36%	0.363	C	S	.	.	H	α-helix	trans	-60.6	-44.7	176.3	-119.7	117.3	0	0	0	112	Y34 L139 F142 Q150 I151 S156 F157 L158	Y34-L154 HydrophobicContact CE1-CD1 4.17Å; L139-L154 HydrophobicContact CD2-CD2 4.19Å; F142-L154 HydrophobicContact CD1-CD1 4.4Å; F142-L154 HydrophobicContact CE1-CD1 4.47Å; Q150-L154 WeakPolarHBondContact O-CB 3.26Å; Q150-L154 PolarHBondContact O-N 3.43Å; I151-L154 PolarHBondContact O-N 3.46Å; L154-S156 VanDerWaalsContact C-N 3.34Å; L154-S156 PolarHBondContact O-N 3.17Å; L154-F157 PolarHBondContact O-N 3.39Å; L154-L158 HydrophobicContact CD2-CD1 4.33Å; L154-L158 WeakPolarHBondContact O-CB 3.32Å; L154-L158 VanDerWaalsContact O-CG 3.25Å; L154-L158 WeakPolarHBondContact O-CG 3.33Å; L154-L158 PolarHBondContact O-N 3.44Å
155	N	41.2	Very low	38.3	Very low	61 Å²	61	69.9 Å²	69.9	33%	0.326	36%	0.357	S	S	.	.	H	α-helix	trans	-64.6	-38.7	177	-83.7	-24.8	0	0	0	112.1	I151 Y153 H159	I151-N155 WeakPolarHBondContact O-CB 3.41Å; I151-N155 PolarHBondContact O-N 2.87Å; Y153-N155 PolarHBondContact O-N 3.42Å; N155-H159 WeakPolarHBondContact O-CB 3.37Å; N155-H159 PolarHBondContact O-N 3.03Å
156	S	41.8	Very low	37.5	Very low	64 Å²	64	69.9 Å²	69.9	45%	0.448	36%	0.36	S	S	.	.	H	α-helix	trans	-66.3	-38.9	175.2	72.1	0	0	0	0	112.5	L152 Y153 L154 H159 S160	L152-S156 WeakPolarHBondContact O-CB 3.28Å; L152-S156 PolarHBondContact O-N 3.31Å; L152-S156 PolarHBondContact O-OG 3.28Å; Y153-S156 PolarHBondContact O-N 3.06Å; Y153-S156 PolarHBondContact O-OG 2.95Å; L154-S156 VanDerWaalsContact C-N 3.34Å; L154-S156 PolarHBondContact O-N 3.17Å; S156-H159 PolarHBondContact O-N 3.32Å; S156-S160 PolarHBondContact O-N 3.27Å
157	F	40.8	Very low	36.7	Very low	48 Å²	48	70.2 Å²	70.2	21%	0.211	37%	0.372	C	S	.	.	H	α-helix	trans	-67	-42.3	176.9	-179.8	-98.8	0	0	0	111.6	L31 Y153 L154 S160 N161	L31-F157 HydrophobicContact CD1-CE1 4.17Å; Y153-F157 WeakPolarHBondContact O-CB 3.47Å; Y153-F157 PolarHBondContact O-N 3.29Å; L154-F157 PolarHBondContact O-N 3.39Å; F157-S160 PolarHBondContact O-OG 2.98Å; F157-S160 VanDerWaalsContact O-OG 3.12Å; F157-N161 WeakPolarHBondContact CE1-ND2 3.34Å; F157-N161 VanDerWaalsContact CE2-ND2 3.34Å; F157-N161 WeakPolarHBondContact CE2-ND2 3.4Å; F157-N161 VanDerWaalsContact CZ-ND2 3.26Å; F157-N161 WeakPolarHBondContact CZ-ND2 3.16Å; F157-N161 WeakPolarHBondContact O-CB 3.5Å; F157-N161 VanDerWaalsContact O-CG 3.27Å; F157-N161 PolarHBondContact O-N 2.93Å; F157-N161 PolarHBondContact O-ND2 2.69Å
158	L	41	Very low	35.9	Very low	26 Å²	26	73.6 Å²	73.6	14%	0.136	39%	0.394	C	S	.	.	H	α-helix	trans	-64.6	-46.8	173.5	-68.1	168.7	0	0	0	110.3	T135 L139 L154 S160 N161 Y162	T135-L158 HydrophobicContact CG2-CD2 4.34Å; L139-L158 HydrophobicContact CD1-CD1 4.29Å; L154-L158 HydrophobicContact CD2-CD1 4.33Å; L154-L158 WeakPolarHBondContact O-CB 3.32Å; L154-L158 VanDerWaalsContact O-CG 3.25Å; L154-L158 WeakPolarHBondContact O-CG 3.33Å; L154-L158 PolarHBondContact O-N 3.44Å; L158-S160 PolarHBondContact O-N 3.3Å; L158-N161 PolarHBondContact O-N 3.49Å; L158-Y162 HydrophobicContact CD2-CE2 4.21Å; L158-Y162 VanDerWaalsContact O-CD2 3.26Å; L158-Y162 WeakPolarHBondContact O-CD2 3.14Å; L158-Y162 PolarHBondContact O-N 3.45Å; L158-Y162 VanDerWaalsContact O-N 3.11Å
159	H	39.6	Very low	35.4	Very low	114 Å²	114	75.6 Å²	75.6	53%	0.528	40%	0.402	S	S	.	.	H	α-helix	trans	-60.5	-41.8	177.8	-107	-79.7	0	0	0	113.4	N155 S156 N161 S163	N155-H159 WeakPolarHBondContact O-CB 3.37Å; N155-H159 PolarHBondContact O-N 3.03Å; S156-H159 PolarHBondContact O-N 3.32Å; H159-N161 VanDerWaalsContact C-N 3.35Å; H159-N161 PolarHBondContact O-N 3.21Å; H159-S163 WeakPolarHBondContact O-CB 3.2Å; H159-S163 PolarHBondContact O-N 3.21Å; H159-S163 VanDerWaalsContact O-N 3.16Å; H159-S163 PolarHBondContact O-OG 2.86Å
160	S	34.3	Very low	35.2	Very low	67 Å²	67	74.1 Å²	74.1	47%	0.469	40%	0.399	S	S	.	.	H	α-helix	trans	-66	-39.2	-179.2	70.2	0	0	0	0	112	S156 F157 L158 S164	S156-S160 PolarHBondContact O-N 3.27Å; F157-S160 PolarHBondContact O-OG 2.98Å; F157-S160 VanDerWaalsContact O-OG 3.12Å; L158-S160 PolarHBondContact O-N 3.3Å; S160-S164 PolarHBondContact O-OG 3.02Å
161	N	31.2	Very low	34.5	Very low	50 Å²	50	78 Å²	78	27%	0.267	42%	0.421	S	S	.	.	H	α-helix	trans	-81.3	-27.3	-173.7	-66.8	-31.4	0	0	0	113.4	F157 L158 H159 S164	F157-N161 WeakPolarHBondContact CE1-ND2 3.34Å; F157-N161 VanDerWaalsContact CE2-ND2 3.34Å; F157-N161 WeakPolarHBondContact CE2-ND2 3.4Å; F157-N161 VanDerWaalsContact CZ-ND2 3.26Å; F157-N161 WeakPolarHBondContact CZ-ND2 3.16Å; F157-N161 WeakPolarHBondContact O-CB 3.5Å; F157-N161 VanDerWaalsContact O-CG 3.27Å; F157-N161 PolarHBondContact O-N 2.93Å; F157-N161 PolarHBondContact O-ND2 2.69Å; L158-N161 PolarHBondContact O-N 3.49Å; H159-N161 VanDerWaalsContact C-N 3.35Å; H159-N161 PolarHBondContact O-N 3.21Å; N161-S164 PolarHBondContact O-OG 3.05Å
162	Y	33	Very low	33.9	Very low	93 Å²	93	82 Å²	82	37%	0.365	45%	0.447	S	S	.	.	H	α-helix	trans	-86.1	-20.4	173.8	-78	-81.1	0	0	0	113.7	L158 S164 T165 S166	L158-Y162 HydrophobicContact CD2-CE2 4.21Å; L158-Y162 VanDerWaalsContact O-CD2 3.26Å; L158-Y162 WeakPolarHBondContact O-CD2 3.14Å; L158-Y162 PolarHBondContact O-N 3.45Å; L158-Y162 VanDerWaalsContact O-N 3.11Å; Y162-S164 VanDerWaalsContact C-N 3.31Å; Y162-T165 WeakPolarHBondContact CA-OG1 2.97Å; Y162-T165 PolarHBondContact O-OG1 2.74Å; Y162-T165 VanDerWaalsContact O-OG1 3.11Å; Y162-S166 PolarHBondContact O-N 3.35Å; Y162-S166 PolarHBondContact O-OG 3.24Å
163	S	29.4	Very low	33.5	Very low	75 Å²	75	83.3 Å²	83.3	52%	0.524	46%	0.464	S	S	.	.	H	α-helix	trans	-69.1	-30.8	171.9	-58.7	0	0	0	0	111.9	H159	H159-S163 WeakPolarHBondContact O-CB 3.2Å; H159-S163 PolarHBondContact O-N 3.21Å; H159-S163 VanDerWaalsContact O-N 3.16Å; H159-S163 PolarHBondContact O-OG 2.86Å
164	S	28.6	Very low	32.8	Very low	50 Å²	50	81.7 Å²	81.7	35%	0.35	47%	0.472	S	S	.	.	H	α-helix	trans	-75	-29.9	177.3	35.5	0	0	0	0	114.6	S160 N161 Y162	S160-S164 PolarHBondContact O-OG 3.02Å; N161-S164 PolarHBondContact O-OG 3.05Å; Y162-S164 VanDerWaalsContact C-N 3.31Å
165	T	28.8	Very low	32.1	Very low	53 Å²	53	89.4 Å²	89.4	33%	0.325	51%	0.508	S	S	.	.	H	α-helix	trans	-83.3	-17.8	179.9	45.9	0	0	0	0	113.3	Y27 Y162 T168	Y27-T165 HydrophobicContact CD2-CG2 4.38Å; Y27-T165 HydrophobicContact CE2-CG2 3.71Å; Y162-T165 WeakPolarHBondContact CA-OG1 2.97Å; Y162-T165 PolarHBondContact O-OG1 2.74Å; Y162-T165 VanDerWaalsContact O-OG1 3.11Å; T165-T168 PolarHBondContact O-OG1 2.82Å; T165-T168 VanDerWaalsContact O-OG1 3.13Å
166	S	28.6	Very low	31.5	Very low	69 Å²	69	94.2 Å²	94.2	48%	0.483	53%	0.534	S	S	.	.	S	Bend	trans	-83.2	-19.7	176.9	-52	0	0	0	0	113.1	Y162 N170	Y162-S166 PolarHBondContact O-N 3.35Å; Y162-S166 PolarHBondContact O-OG 3.24Å; S166-N170 PolarHBondContact O-ND2 3.18Å; S166-N170 VanDerWaalsContact O-ND2 3.08Å
167	A	27.6	Very low	30.7	Very low	64 Å²	64	98.2 Å²	98.2	53%	0.529	55%	0.55	S	S	.	.	S	Bend	trans	-79.2	-23.9	-179.7	0	0	0	0	0	112.9
168	T	30	Very low	29.8	Very low	96 Å²	96	103.3 Å²	103.3	59%	0.589	58%	0.579	S	S	*	*	S	Bend	trans	-85	-16.2	178.8	43.4	0	0	0	0	113.4	T165	T165-T168 PolarHBondContact O-OG1 2.82Å; T165-T168 VanDerWaalsContact O-OG1 3.13Å
169	Y	29.6	Very low	29.1	Very low	192 Å²	192	110.1 Å²	110.1	75%	0.753	61%	0.613	S	S	*	*	T	Hydrogen-bonded Turn	trans	-90.7	-9.8	-177.3	-135.3	-93.3	0	0	0	114.7
170	N	30.4	Very low	28.2	Very low	107 Å²	107	114.8 Å²	114.8	57%	0.572	63%	0.631	S	S	*	*	T	Hydrogen-bonded Turn	trans	-91.9	7.9	-176.5	-68.2	-42.5	0	0	0	114.5	S166	S166-N170 PolarHBondContact O-ND2 3.18Å; S166-N170 VanDerWaalsContact O-ND2 3.08Å
171	N	27.2	Very low	27.7	Very low	143 Å²	143	120.3 Å²	120.3	77%	0.765	65%	0.648	S	S	*	*	S	Bend	trans	-113.9	14.3	-172.4	-80.4	-19.4	0	0	0	115.2
172	T	27.4	Very low	27.3	Very low	107 Å²	107	126.7 Å²	126.7	66%	0.656	68%	0.676	S	S	*	*	S	Bend	trans	-139.4	123.5	177.6	48.5	0	0	0	0	111.5
173	S	28.8	Very low	26.9	Very low	117 Å²	117	126.4 Å²	126.4	82%	0.818	69%	0.687	S	S	*	*			trans	71.3	134	172.1	75.2	0	0	0	0	116.5
174	S	27.7	Very low	26.8	Very low	101 Å²	101	127.6 Å²	127.6	71%	0.706	69%	0.693	S	S	*	*			cis	174.8	136.3	-25.7	42.8	0	0	0	0	102.9	N176	S174-N176 PolarHBondContact O-N 3.42Å
175	Q	27.4	Very low	26.8	Very low	181 Å²	181	132.4 Å²	132.4	85%	0.846	71%	0.708	S	S	*	*			trans	3.7	107.7	152.6	-65.6	173.4	-44.1	0	0	115.1
176	N	28.3	Very low	26.6	Very low	162 Å²	162	135.6 Å²	135.6	87%	0.866	72%	0.723	S	S	*	*			trans	-168.1	119.9	139.1	-86.3	-29.5	0	0	0	108.2	S174	S174-N176 PolarHBondContact O-N 3.42Å
177	D	24.7	Very low	26.5	Very low	147 Å²	147	136 Å²	136	79%	0.786	72%	0.722	S	S	*	*			trans	-66.6	155.2	-177.7	-61.1	-56.4	0	0	0	112.4
178	D	22.2	Very low	26.6	Very low	156 Å²	156	138.9 Å²	138.9	83%	0.834	73%	0.729	S	S	*	*			trans	67.9	73.4	154.9	-55.8	-24.7	0	0	0	119.3
179	M	25.8	Very low	26.4	Very low	169 Å²	169	140 Å²	140	83%	0.833	73%	0.727	S	S	*	*			trans	-155.8	115.3	138	-137	-176.5	-44.3	0	0	110.4	F181	M179-F181 PolarHBondContact O-N 2.91Å
180	F	21.7	Very low	26.3	Very low	211 Å²	211	133.1 Å²	133.1	93%	0.925	71%	0.707	S	S	*	*			trans	-56.2	106	173.8	-96.1	-104.8	0	0	0	110.6
181	F	24	Very low	26.3	Very low	184 Å²	184	131.9 Å²	131.9	81%	0.807	70%	0.7	S	S	*	*			trans	-133.9	109.6	158.8	-106.5	-89.3	0	0	0	107.7	M179 S183	M179-F181 PolarHBondContact O-N 2.91Å; F181-S183 PolarHBondContact O-N 3.33Å
182	E	22.2	Very low	26.5	Very low	184 Å²	184	126.9 Å²	126.9	86%	0.86	68%	0.677	S	S	*	*			trans	-59.1	123.2	175.7	-77.4	-177.8	143.1	0	0	110.4
183	S	24.4	Very low	26.7	Very low	87 Å²	87	130.3 Å²	130.3	61%	0.608	68%	0.677	S	S	*	*			trans	-71.1	156.1	-175.7	-76.5	0	0	0	0	114	F181 K185	F181-S183 PolarHBondContact O-N 3.33Å; S183-K185 PolarHBondContact O-N 2.66Å
184	P	26.8	Very low	26.8	Very low	100 Å²	100	129.4 Å²	129.4	65%	0.649	66%	0.663	S	S	*	*	T	Hydrogen-bonded Turn	trans	-70.7	10.9	-166.1	-14.5	29.8	0	0	0	116.8	T187	P184-T187 WeakPolarHBondContact CA-OG1 3.44Å; P184-T187 PolarHBondContact O-OG1 2.97Å
185	K	29.1	Very low	27.1	Very low	151 Å²	151	127.7 Å²	127.7	66%	0.657	65%	0.645	S	S	*	*	H	α-helix	trans	-72.2	-32.4	-176.4	-71.5	-179.4	178.9	174.3	0	112.3	S183	S183-K185 PolarHBondContact O-N 2.66Å
186	N	25.1	Very low	27.3	Very low	119 Å²	119	123.9 Å²	123.9	64%	0.636	63%	0.63	S	S	*	*	H	α-helix	trans	-82.5	-21	-179.1	-70.3	-12.9	0	0	0	113.3	S190	N186-S190 WeakPolarHBondContact O-CB 3.11Å; N186-S190 PolarHBondContact O-N 3.04Å; N186-S190 PolarHBondContact O-OG 3.05Å
187	T	26.4	Very low	27.5	Very low	77 Å²	77	121.7 Å²	121.7	47%	0.472	61%	0.614	S	S	.	*	H	α-helix	trans	-79.2	-33.3	-177.6	10.5	0	0	0	0	112.9	P184 S190 N191	P184-T187 WeakPolarHBondContact CA-OG1 3.44Å; P184-T187 PolarHBondContact O-OG1 2.97Å; T187-S190 VanDerWaalsContact CA-OG 3.26Å; T187-S190 WeakPolarHBondContact CA-OG 3.49Å; T187-S190 PolarHBondContact O-OG 2.95Å; T187-N191 WeakPolarHBondContact O-CB 3.38Å; T187-N191 PolarHBondContact O-N 2.86Å; T187-N191 PolarHBondContact O-ND2 3.39Å; T187-N191 VanDerWaalsContact O-ND2 3.12Å; T187-N191 PolarHBondContact O-OD1 3.48Å
188	L	29.1	Very low	27.8	Very low	126 Å²	126	119.6 Å²	119.6	66%	0.66	60%	0.6	S	S	*	*	H	α-helix	trans	-75.9	-37.6	-179.8	-163.1	72.5	0	0	0	112.7	N191 S192	L188-N191 PolarHBondContact O-N 3.44Å; L188-S192 PolarHBondContact O-N 3.5Å; L188-S192 PolarHBondContact O-OG 2.93Å
189	E	26.3	Very low	28.3	Very low	120 Å²	120	116 Å²	116	56%	0.561	58%	0.575	S	S	*	*	H	α-helix	trans	-72.9	-32.1	177.5	-159.3	175.8	-167	0	0	112.1	S192 R193	E189-S192 PolarHBondContact O-OG 2.92Å; E189-S192 VanDerWaalsContact O-OG 3.07Å; E189-R193 WeakPolarHBondContact O-CB 3.26Å; E189-R193 WeakPolarHBondContact O-CG 3.36Å; E189-R193 PolarHBondContact O-N 2.89Å
190	S	27	Very low	28.5	Very low	46 Å²	46	113.5 Å²	113.5	32%	0.322	57%	0.565	S	S	.	*	H	α-helix	trans	-73	-40.6	170.3	46.3	0	0	0	0	111.6	N186 T187 S192 R193 L194	N186-S190 WeakPolarHBondContact O-CB 3.11Å; N186-S190 PolarHBondContact O-N 3.04Å; N186-S190 PolarHBondContact O-OG 3.05Å; T187-S190 VanDerWaalsContact CA-OG 3.26Å; T187-S190 WeakPolarHBondContact CA-OG 3.49Å; T187-S190 PolarHBondContact O-OG 2.95Å; S190-S192 PolarHBondContact O-N 2.93Å; S190-R193 PolarHBondContact O-N 3.19Å; S190-L194 VanDerWaalsContact O-CB 3.28Å; S190-L194 WeakPolarHBondContact O-CB 3.49Å; S190-L194 WeakPolarHBondContact O-CD1 3.14Å; S190-L194 PolarHBondContact O-N 3.23Å
191	N	30.1	Very low	28.7	Very low	82 Å²	82	108.5 Å²	108.5	44%	0.439	54%	0.544	S	S	.	.	H	α-helix	trans	-63.9	-40.4	175.9	-74.6	-18.4	0	0	0	112.7	T187 L188 L194 L195	T187-N191 WeakPolarHBondContact O-CB 3.38Å; T187-N191 PolarHBondContact O-N 2.86Å; T187-N191 PolarHBondContact O-ND2 3.39Å; T187-N191 VanDerWaalsContact O-ND2 3.12Å; T187-N191 PolarHBondContact O-OD1 3.48Å; L188-N191 PolarHBondContact O-N 3.44Å; N191-L194 PolarHBondContact O-N 3.26Å; N191-L195 WeakPolarHBondContact O-CB 3.37Å; N191-L195 WeakPolarHBondContact O-CD1 3.28Å; N191-L195 VanDerWaalsContact O-CG 3.26Å; N191-L195 WeakPolarHBondContact O-CG 3.37Å; N191-L195 PolarHBondContact O-N 2.98Å
192	S	32	Very low	29	Very low	38 Å²	38	103.6 Å²	103.6	27%	0.266	53%	0.525	S	S	.	.	H	α-helix	trans	-66.6	-39.8	176.3	65.2	0	0	0	0	112.1	L188 E189 S190 I196	L188-S192 PolarHBondContact O-N 3.5Å; L188-S192 PolarHBondContact O-OG 2.93Å; E189-S192 PolarHBondContact O-OG 2.92Å; E189-S192 VanDerWaalsContact O-OG 3.07Å; S190-S192 PolarHBondContact O-N 2.93Å; S192-I196 WeakPolarHBondContact O-CD1 3.12Å; S192-I196 WeakPolarHBondContact O-CG1 2.98Å; S192-I196 PolarHBondContact O-N 2.95Å
193	R	30.9	Very low	29.4	Very low	178 Å²	178	100.3 Å²	100.3	67%	0.672	51%	0.514	S	S	*	.	H	α-helix	trans	-68	-41.1	173.5	-80.3	179.3	160	175.9	-1.5	113.2	E189 S190 I196 H197	E189-R193 WeakPolarHBondContact O-CB 3.26Å; E189-R193 WeakPolarHBondContact O-CG 3.36Å; E189-R193 PolarHBondContact O-N 2.89Å; S190-R193 PolarHBondContact O-N 3.19Å; R193-I196 PolarHBondContact O-N 3.39Å; R193-H197 WeakPolarHBondContact O-CB 3.24Å; R193-H197 PolarHBondContact O-N 2.89Å
194	L	31.7	Very low	29.6	Very low	99 Å²	99	101.6 Å²	101.6	52%	0.518	51%	0.51	S	S	.	.	H	α-helix	trans	-63.6	-43.2	175.9	-101	138.3	0	0	0	111.4	S190 N191 H197 Q198	S190-L194 VanDerWaalsContact O-CB 3.28Å; S190-L194 WeakPolarHBondContact O-CB 3.49Å; S190-L194 WeakPolarHBondContact O-CD1 3.14Å; S190-L194 PolarHBondContact O-N 3.23Å; N191-L194 PolarHBondContact O-N 3.26Å; L194-H197 PolarHBondContact O-N 3.26Å; L194-Q198 WeakPolarHBondContact O-CB 3.42Å; L194-Q198 PolarHBondContact O-N 2.84Å
195	L	33.2	Very low	29.7	Very low	64 Å²	64	100 Å²	100	34%	0.335	50%	0.5	S	S	.	.	H	α-helix	trans	-58.2	-52.2	172.6	-78.2	160	0	0	0	109.7	N191 H197 Q198 Y199	N191-L195 WeakPolarHBondContact O-CB 3.37Å; N191-L195 WeakPolarHBondContact O-CD1 3.28Å; N191-L195 VanDerWaalsContact O-CG 3.26Å; N191-L195 WeakPolarHBondContact O-CG 3.37Å; N191-L195 PolarHBondContact O-N 2.98Å; L195-H197 VanDerWaalsContact C-N 3.31Å; L195-H197 PolarHBondContact O-N 3.44Å; L195-Q198 PolarHBondContact O-N 2.68Å; L195-Y199 HydrophobicContact CB-CD2 4.36Å; L195-Y199 HydrophobicContact CB-CE2 4.39Å; L195-Y199 HydrophobicContact CD2-CE2 3.94Å; L195-Y199 WeakPolarHBondContact O-CB 3.42Å; L195-Y199 WeakPolarHBondContact O-CD2 3.31Å; L195-Y199 PolarHBondContact O-N 2.99Å
196	I	33.2	Very low	29.7	Very low	102 Å²	102	97.7 Å²	97.7	52%	0.523	50%	0.495	S	S	.	.	H	α-helix	trans	-57.9	-40.8	178.6	-67.1	163.3	0	0	0	112	S192 R193 Y199 L200	S192-I196 WeakPolarHBondContact O-CD1 3.12Å; S192-I196 WeakPolarHBondContact O-CG1 2.98Å; S192-I196 PolarHBondContact O-N 2.95Å; R193-I196 PolarHBondContact O-N 3.39Å; I196-Y199 PolarHBondContact O-N 3.28Å; I196-L200 HydrophobicContact CG2-CD1 4.41Å; I196-L200 WeakPolarHBondContact O-CG 3.43Å; I196-L200 PolarHBondContact O-N 3.23Å
197	H	31.1	Very low	30.1	Very low	115 Å²	115	96.2 Å²	96.2	53%	0.532	49%	0.494	S	S	.	.	H	α-helix	trans	-70.7	-45.6	179.5	-161.2	-84.3	0	0	0	112.7	R193 L194 L195 Y199 L200 E201	R193-H197 WeakPolarHBondContact O-CB 3.24Å; R193-H197 PolarHBondContact O-N 2.89Å; L194-H197 PolarHBondContact O-N 3.26Å; L195-H197 VanDerWaalsContact C-N 3.31Å; L195-H197 PolarHBondContact O-N 3.44Å; H197-Y199 PolarHBondContact O-N 3Å; H197-L200 PolarHBondContact O-N 3.45Å; H197-E201 IonicContact CE1-OE1 3.03Å; H197-E201 PolarHBondContact CE1-OE1 3.3Å; H197-E201 IonicContact ND1-OE1 3.03Å; H197-E201 PolarHBondContact ND1-OE1 3.4Å; H197-E201 WeakPolarHBondContact O-CG 3.46Å; H197-E201 PolarHBondContact O-N 2.66Å
198	Q	30.8	Very low	30.2	Very low	104 Å²	104	98.5 Å²	98.5	49%	0.486	50%	0.501	S	S	.	.	H	α-helix	trans	-58.5	-35.9	171.9	-85.9	-178.6	-36.8	0	0	111.3	L194 L195 E201 I202	L194-Q198 WeakPolarHBondContact O-CB 3.42Å; L194-Q198 PolarHBondContact O-N 2.84Å; L195-Q198 PolarHBondContact O-N 2.68Å; Q198-E201 PolarHBondContact O-N 3.24Å; Q198-I202 WeakPolarHBondContact O-CB 3.14Å; Q198-I202 WeakPolarHBondContact O-CD1 3.34Å; Q198-I202 WeakPolarHBondContact O-CG1 3.43Å; Q198-I202 PolarHBondContact O-N 3.13Å
199	Y	33	Very low	30.3	Very low	80 Å²	80	99.7 Å²	99.7	31%	0.314	50%	0.501	S	S	.	.	H	α-helix	trans	-72.2	-36	177.4	-82.3	-65.7	0	0	0	113.2	L195 I196 H197 E201 I202 D203	L195-Y199 HydrophobicContact CB-CD2 4.36Å; L195-Y199 HydrophobicContact CB-CE2 4.39Å; L195-Y199 HydrophobicContact CD2-CE2 3.94Å; L195-Y199 WeakPolarHBondContact O-CB 3.42Å; L195-Y199 WeakPolarHBondContact O-CD2 3.31Å; L195-Y199 PolarHBondContact O-N 2.99Å; I196-Y199 PolarHBondContact O-N 3.28Å; H197-Y199 PolarHBondContact O-N 3Å; Y199-E201 VanDerWaalsContact C-N 3.27Å; Y199-E201 PolarHBondContact O-N 2.92Å; Y199-I202 HydrophobicContact CD1-CD1 4.48Å; Y199-I202 PolarHBondContact O-N 3Å; Y199-D203 WeakPolarHBondContact O-CB 3.41Å; Y199-D203 PolarHBondContact O-N 3.32Å
200	L	30.9	Very low	30.7	Very low	117 Å²	117	100.7 Å²	100.7	61%	0.613	51%	0.508	S	S	*	.	H	α-helix	trans	-62.4	-36.7	170.6	-73.2	169.4	0	0	0	111.5	I196 H197 H204	I196-L200 HydrophobicContact CG2-CD1 4.41Å; I196-L200 WeakPolarHBondContact O-CG 3.43Å; I196-L200 PolarHBondContact O-N 3.23Å; H197-L200 PolarHBondContact O-N 3.45Å; L200-H204 VanDerWaalsContact O-CB 3.31Å; L200-H204 WeakPolarHBondContact O-CB 3.42Å; L200-H204 PolarHBondContact O-N 3.49Å; L200-H204 VanDerWaalsContact O-N 3.1Å
201	E	25.7	Very low	30.8	Very low	106 Å²	106	104 Å²	104	50%	0.495	52%	0.523	S	S	.	.	H	α-helix	trans	-71.1	-38.9	175.2	-70.6	173.2	-177.1	0	0	112.7	H197 Q198 Y199 H204 C205	H197-E201 IonicContact CE1-OE1 3.03Å; H197-E201 PolarHBondContact CE1-OE1 3.3Å; H197-E201 IonicContact ND1-OE1 3.03Å; H197-E201 PolarHBondContact ND1-OE1 3.4Å; H197-E201 WeakPolarHBondContact O-CG 3.46Å; H197-E201 PolarHBondContact O-N 2.66Å; Q198-E201 PolarHBondContact O-N 3.24Å; Y199-E201 VanDerWaalsContact C-N 3.27Å; Y199-E201 PolarHBondContact O-N 2.92Å; E201-H204 WeakPolarHBondContact O-CB 3.17Å; E201-H204 PolarHBondContact O-N 3.2Å; E201-C205 WeakPolarHBondContact O-CB 3.28Å; E201-C205 PolarHBondContact O-N 3.03Å
202	I	30.7	Very low	30.8	Very low	80 Å²	80	109.2 Å²	109.2	41%	0.41	54%	0.544	S	S	.	.	H	α-helix	trans	-70.3	-40.5	178	-68.8	162.5	0	0	0	111.6	Q198 Y199 H204 C205 N206	Q198-I202 WeakPolarHBondContact O-CB 3.14Å; Q198-I202 WeakPolarHBondContact O-CD1 3.34Å; Q198-I202 WeakPolarHBondContact O-CG1 3.43Å; Q198-I202 PolarHBondContact O-N 3.13Å; Y199-I202 HydrophobicContact CD1-CD1 4.48Å; Y199-I202 PolarHBondContact O-N 3Å; I202-H204 VanDerWaalsContact C-N 3.32Å; I202-C205 PolarHBondContact O-N 3.26Å; I202-N206 WeakPolarHBondContact O-CB 3.31Å; I202-N206 PolarHBondContact O-N 3.27Å; I202-N206 PolarHBondContact O-ND2 3.27Å
203	D	29.5	Very low	30.7	Very low	116 Å²	116	115 Å²	115	62%	0.62	57%	0.572	S	S	*	*	H	α-helix	trans	-67	-35.2	173.6	-94.6	-9.3	0	0	0	111.6	Y199 S207	Y199-D203 WeakPolarHBondContact O-CB 3.41Å; Y199-D203 PolarHBondContact O-N 3.32Å; D203-S207 WeakPolarHBondContact O-CB 3.37Å; D203-S207 PolarHBondContact O-N 3.47Å
204	H	28.2	Very low	30.6	Very low	114 Å²	114	110.9 Å²	110.9	53%	0.528	57%	0.571	S	S	.	*	H	α-helix	trans	-63.7	-43.1	171	-153.5	72.7	0	0	0	111	L200 E201 I202 S207 M208	L200-H204 VanDerWaalsContact O-CB 3.31Å; L200-H204 WeakPolarHBondContact O-CB 3.42Å; L200-H204 PolarHBondContact O-N 3.49Å; L200-H204 VanDerWaalsContact O-N 3.1Å; E201-H204 WeakPolarHBondContact O-CB 3.17Å; E201-H204 PolarHBondContact O-N 3.2Å; I202-H204 VanDerWaalsContact C-N 3.32Å; H204-S207 PolarHBondContact O-N 3.07Å; H204-M208 PolarHBondContact CD2-SD 2.99Å; H204-M208 VanDerWaalsContact NE2-CE 3.28Å; H204-M208 WeakPolarHBondContact NE2-CE 3.29Å; H204-M208 PolarHBondContact NE2-SD 3.43Å; H204-M208 VanDerWaalsContact O-CB 3.26Å; H204-M208 WeakPolarHBondContact O-CB 3.36Å; H204-M208 WeakPolarHBondContact O-CG 3.46Å; H204-M208 PolarHBondContact O-N 3.22Å
205	C	28.6	Very low	30.6	Very low	65 Å²	65	111.5 Å²	111.5	44%	0.439	58%	0.583	S	S	.	*	H	α-helix	trans	-67.7	-40.5	177.6	-116.8	0	0	0	0	113.3	E201 I202 S207 M208 K209	E201-C205 WeakPolarHBondContact O-CB 3.28Å; E201-C205 PolarHBondContact O-N 3.03Å; I202-C205 PolarHBondContact O-N 3.26Å; C205-S207 VanDerWaalsContact C-N 3.34Å; C205-M208 PolarHBondContact O-N 2.85Å; C205-K209 WeakPolarHBondContact O-CB 3.41Å; C205-K209 WeakPolarHBondContact O-CG 3.2Å; C205-K209 PolarHBondContact O-N 2.83Å
206	N	29.9	Very low	30.6	Very low	104 Å²	104	116.5 Å²	116.5	56%	0.556	61%	0.609	S	S	*	*	H	α-helix	trans	-73.2	-27.1	176.9	-75.6	-27.7	0	0	0	112.4	I202	I202-N206 WeakPolarHBondContact O-CB 3.31Å; I202-N206 PolarHBondContact O-N 3.27Å; I202-N206 PolarHBondContact O-ND2 3.27Å
207	S	32.9	Very low	30.5	Very low	87 Å²	87	116.8 Å²	116.8	61%	0.608	62%	0.615	S	S	*	*	H	α-helix	trans	-72.7	-31.4	168.6	172.4	0	0	0	0	112.7	D203 H204 C205	D203-S207 WeakPolarHBondContact O-CB 3.37Å; D203-S207 PolarHBondContact O-N 3.47Å; H204-S207 PolarHBondContact O-N 3.07Å; C205-S207 VanDerWaalsContact C-N 3.34Å
208	M	29.2	Very low	30.8	Very low	125 Å²	125	115.9 Å²	115.9	62%	0.616	62%	0.619	S	S	*	*	H	α-helix	trans	-94.2	-17.1	-174.9	-75.7	-174.2	151.4	0	0	114.8	H204 C205 I210	H204-M208 PolarHBondContact CD2-SD 2.99Å; H204-M208 VanDerWaalsContact NE2-CE 3.28Å; H204-M208 WeakPolarHBondContact NE2-CE 3.29Å; H204-M208 PolarHBondContact NE2-SD 3.43Å; H204-M208 VanDerWaalsContact O-CB 3.26Å; H204-M208 WeakPolarHBondContact O-CB 3.36Å; H204-M208 WeakPolarHBondContact O-CG 3.46Å; H204-M208 PolarHBondContact O-N 3.22Å; C205-M208 PolarHBondContact O-N 2.85Å; M208-I210 VanDerWaalsContact C-N 3.33Å; M208-I210 PolarHBondContact O-N 3.28Å
209	K	31.4	Very low	31.9	Very low	152 Å²	152	121.2 Å²	121.2	66%	0.661	64%	0.635	S	S	*	*			trans	-89.6	17	175.7	-74.2	-177.5	179.2	178.2	0	115	C205 N211	C205-K209 WeakPolarHBondContact O-CB 3.41Å; C205-K209 WeakPolarHBondContact O-CG 3.2Å; C205-K209 PolarHBondContact O-N 2.83Å; K209-N211 VanDerWaalsContact CA-OD1 3.32Å; K209-N211 WeakPolarHBondContact CA-OD1 3.42Å; K209-N211 PolarHBondContact O-N 3.26Å; K209-N211 PolarHBondContact O-OD1 2.95Å
210	I	34.3	Very low	33.7	Very low	141 Å²	141	121.6 Å²	121.6	72%	0.723	64%	0.642	S	S	*	*	S	Bend	trans	-89.1	77	163.9	-52.6	177.5	0	0	0	106.8	M208	M208-I210 VanDerWaalsContact C-N 3.33Å; M208-I210 PolarHBondContact O-N 3.28Å
211	N	29.4	Very low	35.8	Very low	116 Å²	116	120.9 Å²	120.9	62%	0.62	63%	0.634	S	S	*	*			trans	-62.3	134.4	-175.8	-42.2	-11.1	0	0	0	109.2	K209 N213	K209-N211 VanDerWaalsContact CA-OD1 3.32Å; K209-N211 WeakPolarHBondContact CA-OD1 3.42Å; K209-N211 PolarHBondContact O-N 3.26Å; K209-N211 PolarHBondContact O-OD1 2.95Å; N211-N213 PolarHBondContact O-N 3.45Å
212	E	31.1	Very low	38	Very low	191 Å²	191	123.4 Å²	123.4	89%	0.893	64%	0.639	S	S	*	*	T	Hydrogen-bonded Turn	trans	-65.5	19.4	-170.9	-65.9	-177.5	136.8	0	0	116.4
213	N	28.8	Very low	40.2	Very low	159 Å²	159	123.6 Å²	123.6	85%	0.85	64%	0.635	S	S	*	*	T	Hydrogen-bonded Turn	trans	-135.9	21.1	-168.9	-78.9	-24.6	0	0	0	117.4	N211	N211-N213 PolarHBondContact O-N 3.45Å
214	S	28.7	Very low	42.5	Very low	92 Å²	92	125.4 Å²	125.4	64%	0.643	64%	0.637	S	S	*	*			trans	-118.9	90.4	170.9	65	0	0	0	0	112.4
215	S	31.4	Very low	44.9	Very low	112 Å²	112	120.6 Å²	120.6	78%	0.783	62%	0.616	S	S	*	*			trans	-46.8	139.7	157.3	-58.8	0	0	0	0	110.5
216	I	32.9	Very low	47.4	Very low	169 Å²	169	122.5 Å²	122.5	87%	0.867	63%	0.626	S	S	*	*			trans	86.8	58.7	174.3	-37.6	156.3	0	0	0	115.5
217	T	32.6	Very low	49.7	Very low	107 Å²	107	123 Å²	123	66%	0.656	62%	0.62	S	S	*	*			trans	-115	135	143.6	56.9	0	0	0	0	107.8	R219	T217-R219 PolarHBondContact O-N 3.32Å
218	P	37.2	Very low	52.1	Low	96 Å²	96	123.3 Å²	123.3	62%	0.623	62%	0.621	S	S	*	*			trans	-60.8	143.2	-179.6	-7.8	20	0	0	0	108.1	I220	P218-I220 HydrophobicContact CB-CD1 4.31Å; P218-I220 HydrophobicContact CB-CG1 3.9Å; P218-I220 HydrophobicContact CG-CD1 4.15Å; P218-I220 HydrophobicContact CG-CG1 4.3Å; P218-I220 WeakPolarHBondContact O-CG1 3.19Å; P218-I220 PolarHBondContact O-N 2.86Å
219	R	54.4	Low	54.6	Low	216 Å²	216	125.7 Å²	125.7	82%	0.815	64%	0.636	S	S	*	*			trans	-62.9	77.8	169.3	-85	-173.9	176.5	180	0.9	108.8	T217 Y235	T217-R219 PolarHBondContact O-N 3.32Å; R219-Y235 HydrophobicContact CB-CE1 3.69Å; R219-Y235 HydrophobicContact CG-CE1 4.41Å; R219-Y235 WeakPolarHBondContact O-CE1 3.34Å; R219-Y235 PolarHBondContact O-OH 2.93Å
220	I	70.2	Confident	56.9	Low	88 Å²	88	119.6 Å²	119.6	45%	0.451	61%	0.612	S	S	.	*			trans	-89.3	120.6	176.9	-59	172.6	0	0	0	108.7	P218 R222 Y235	P218-I220 HydrophobicContact CB-CD1 4.31Å; P218-I220 HydrophobicContact CB-CG1 3.9Å; P218-I220 HydrophobicContact CG-CD1 4.15Å; P218-I220 HydrophobicContact CG-CG1 4.3Å; P218-I220 WeakPolarHBondContact O-CG1 3.19Å; P218-I220 PolarHBondContact O-N 2.86Å; I220-R222 HydrophobicContact CG2-CG 4.15Å; I220-R222 PolarHBondContact O-N 3.37Å; I220-Y235 VanDerWaalsContact C-CE1 3.43Å; I220-Y235 VanDerWaalsContact O-CD1 3.25Å; I220-Y235 WeakPolarHBondContact O-CD1 3.23Å
221	K	74.8	Confident	59.5	Low	103 Å²	103	119.6 Å²	119.6	45%	0.448	62%	0.619	S	S	.	*			trans	-78.7	89.2	175.3	-68	171.5	168.3	-177.2	0	109	Y223 A233 Y234 Y235	K221-Y223 VanDerWaalsContact C-N 3.35Å; K221-A233 HydrophobicContact CB-CB 3.61Å; K221-A233 HydrophobicContact CD-CB 4.09Å; K221-A233 VanDerWaalsContact CD-O 3.28Å; K221-A233 WeakPolarHBondContact CD-O 3.24Å; K221-A233 HydrophobicContact CG-CB 4.42Å; K221-Y234 CarbonylContact C-O 3.58Å; K221-Y234 WeakPolarHBondContact CA-O 3.49Å; K221-Y235 HydrophobicContact CB-CE1 4.18Å; K221-Y235 WeakPolarHBondContact CE-OH 3.5Å; K221-Y235 HydrophobicContact CG-CD1 3.96Å; K221-Y235 HydrophobicContact CG-CD2 4.45Å; K221-Y235 HydrophobicContact CG-CE1 3.34Å; K221-Y235 HydrophobicContact CG-CE2 3.98Å; K221-Y235 HydrophobicContact CG-CG 4.44Å
222	R	72.5	Confident	62.3	Low	159 Å²	159	120 Å²	120	60%	0.6	62%	0.615	S	S	*	*			trans	-71.4	-28.2	-176.5	-63.2	-177.8	-179.7	-178.1	-0.3	113.2	I220 Y234	I220-R222 HydrophobicContact CG2-CG 4.15Å; I220-R222 PolarHBondContact O-N 3.37Å; R222-Y234 PolarHBondContact N-O 3.01Å
223	Y	76.4	Confident	64.6	Low	84 Å²	84	111.8 Å²	111.8	33%	0.329	58%	0.58	S	S	.	*	E	Extended strand (participates in β ladder)	trans	-101	95	-172.3	-57.4	-73.9	0	0	0	110.8	K221 A233 Y234 Y235 K236 R237	K221-Y223 VanDerWaalsContact C-N 3.35Å; Y223-A233 CarbonylContact O-C 3.57Å; Y223-A233 VanDerWaalsContact O-CA 3.26Å; Y223-A233 WeakPolarHBondContact O-CA 3.48Å; Y223-Y234 PolarHBondContact N-O 2.89Å; Y223-Y234 PolarHBondContact O-N 3.28Å; Y223-Y235 WeakPolarHBondContact CE2-O 3.49Å; Y223-K236 VanDerWaalsContact CD2-C 3.42Å; Y223-R237 HydrophobicContact CD1-CB 4.17Å; Y223-R237 HydrophobicContact CD1-CG 4.5Å; Y223-R237 HydrophobicContact CE1-CB 3.86Å; Y223-R237 HydrophobicContact CE1-CG 4.32Å; Y223-R237 HydrophobicContact CE2-CB 4.29Å; Y223-R237 HydrophobicContact CG-CB 4.49Å
224	K	77.1	Confident	67	Low	154 Å²	154	106.8 Å²	106.8	67%	0.67	55%	0.55	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-87	144.2	178.6	-61	178.5	-178	174.5	0	111	A233 L240	K224-A233 HydrophobicContact CB-CB 4.44Å; K224-A233 HydrophobicContact CG-CB 3.94Å; K224-L240 WeakPolarHBondContact O-CD2 3.36Å
225	C	78.9	Confident	69.3	Low	12 Å²	12	107.4 Å²	107.4	8%	0.081	54%	0.539	C	S	.	.			trans	-72.6	133.9	168.5	-171.2	0	0	0	0	109.7	Y227 C230 K232 L240 H243 H247	C225-Y227 VanDerWaalsContact SG-CB 3.57Å; C225-Y227 PolarHBondContact SG-N 3.24Å; C225-Y227 VanDerWaalsContact SG-N 3.45Å; C225-C230 HydrophobicContact CB-CB 4.12Å; C225-K232 WeakPolarHBondContact CB-O 3.22Å; C225-K232 PolarHBondContact N-O 3.19Å; C225-L240 HydrophobicContact CB-CD1 4.07Å; C225-H243 WeakPolarHBondContact CB-NE2 3.19Å; C225-H243 PolarHBondContact SG-NE2 3.43Å; C225-H247 VanDerWaalsContact SG-CD2 3.59Å; C225-H247 PolarHBondContact SG-NE2 2.94Å; C225-H247 VanDerWaalsContact SG-NE2 3.35Å
226	T	81.7	Confident	71.4	Confident	105 Å²	105	108.1 Å²	108.1	64%	0.644	53%	0.528	S	S	*	.			trans	-99.4	3.6	178.1	65.5	0	0	0	0	112.4	Y244	T226-Y244 PolarHBondContact N-OH 3.15Å; T226-Y244 VanDerWaalsContact N-OH 3.09Å; T226-Y244 PolarHBondContact OG1-OH 3.46Å
227	Y	78.5	Confident	73.4	Confident	114 Å²	114	104.4 Å²	104.4	45%	0.447	50%	0.503	S	S	.	.	S	Bend	trans	-69.1	137.1	178.5	-156.2	-89.8	0	0	0	110.2	C225 N229 C230 H247	C225-Y227 VanDerWaalsContact SG-CB 3.57Å; C225-Y227 PolarHBondContact SG-N 3.24Å; C225-Y227 VanDerWaalsContact SG-N 3.45Å; Y227-N229 PolarHBondContact O-N 3.33Å; Y227-C230 WeakPolarHBondContact O-CB 3.42Å; Y227-C230 PolarHBondContact O-N 3.36Å; Y227-H247 HydrophobicContact CD1-CB 4.38Å; Y227-H247 AromaticContact CD1-CE1 3.82Å; Y227-H247 AromaticContact CD1-CG 3.9Å; Y227-H247 AromaticContact CD1-ND1 3.4Å; Y227-H247 WeakPolarHBondContact CD1-ND1 3.47Å; Y227-H247 HydrophobicContact CD2-CB 3.61Å; Y227-H247 AromaticContact CD2-CG 3.76Å; Y227-H247 AromaticContact CE1-ND1 3.89Å; Y227-H247 HydrophobicContact CE2-CB 3.76Å; Y227-H247 HydrophobicContact CG-CB 3.94Å; Y227-H247 AromaticContact CG-CD2 3.93Å; Y227-H247 AromaticContact CG-CE1 3.92Å; Y227-H247 AromaticContact CG-CG 3.54Å; Y227-H247 AromaticContact CG-ND1 3.54Å
228	P	82.7	Confident	75.6	Confident	95 Å²	95	102.8 Å²	102.8	62%	0.617	50%	0.496	S	S	*	.	T	Hydrogen-bonded Turn	trans	-51.6	136.1	178.4	-27.5	34.6	0	0	0	112	C230	P228-C230 PolarHBondContact O-N 3.44Å
229	N	82.1	Confident	77.8	Confident	175 Å²	175	102.1 Å²	102.1	94%	0.936	48%	0.484	S	S	*	.	T	Hydrogen-bonded Turn	trans	63	12.9	-177.8	-53.5	-34.5	0	0	0	115.9	Y227	Y227-N229 PolarHBondContact O-N 3.33Å
230	C	80.1	Confident	79.1	Confident	24 Å²	24	92 Å²	92	16%	0.162	45%	0.446	C	S	.	.			trans	-102.8	117.9	173.7	-167.8	0	0	0	0	112.1	C225 Y227 P228 H243 H247	C225-C230 HydrophobicContact CB-CB 4.12Å; Y227-C230 WeakPolarHBondContact O-CB 3.42Å; Y227-C230 PolarHBondContact O-N 3.36Å; P228-C230 PolarHBondContact O-N 3.44Å; C230-H243 VanDerWaalsContact SG-CE1 3.52Å; C230-H243 PolarHBondContact SG-NE2 3.28Å; C230-H247 PolarHBondContact SG-NE2 2.86Å
231	T	87.4	Confident	79.6	Confident	140 Å²	140	92.1 Å²	92.1	86%	0.859	45%	0.448	S	S	*	.			trans	-100.1	10.7	178.8	58.5	0	0	0	0	113.2
232	K	87.9	Confident	79.8	Confident	124 Å²	124	90.4 Å²	90.4	54%	0.539	44%	0.441	S	S	.	.			trans	-74.9	138.7	-176.4	-63.2	-63.8	-175.7	-174.7	0	111.1	C225 Y234	C225-K232 WeakPolarHBondContact CB-O 3.22Å; C225-K232 PolarHBondContact N-O 3.19Å; K232-Y234 HydrophobicContact CB-CE2 3.88Å
233	A	80.4	Confident	80.5	Confident	19 Å²	19	83.4 Å²	83.4	16%	0.157	42%	0.415	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-139.2	151.4	175.6	0	0	0	0	0	111	K221 Y223 K224	K221-A233 HydrophobicContact CB-CB 3.61Å; K221-A233 HydrophobicContact CD-CB 4.09Å; K221-A233 VanDerWaalsContact CD-O 3.28Å; K221-A233 WeakPolarHBondContact CD-O 3.24Å; K221-A233 HydrophobicContact CG-CB 4.42Å; Y223-A233 CarbonylContact O-C 3.57Å; Y223-A233 VanDerWaalsContact O-CA 3.26Å; Y223-A233 WeakPolarHBondContact O-CA 3.48Å; K224-A233 HydrophobicContact CB-CB 4.44Å; K224-A233 HydrophobicContact CG-CB 3.94Å
234	Y	80	Confident	80.8	Confident	54 Å²	54	80.8 Å²	80.8	21%	0.212	41%	0.405	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-133.4	154.9	-168.8	-61.1	-87.2	0	0	0	112.1	K221 R222 Y223 K232 H239 L240 H243	K221-Y234 CarbonylContact C-O 3.58Å; K221-Y234 WeakPolarHBondContact CA-O 3.49Å; R222-Y234 PolarHBondContact N-O 3.01Å; Y223-Y234 PolarHBondContact N-O 2.89Å; Y223-Y234 PolarHBondContact O-N 3.28Å; K232-Y234 HydrophobicContact CB-CE2 3.88Å; Y234-H239 HydrophobicContact CD1-CB 3.59Å; Y234-H239 HydrophobicContact CE1-CB 4.37Å; Y234-H239 HydrophobicContact CG-CB 3.98Å; Y234-L240 HydrophobicContact CD2-CB 3.96Å; Y234-L240 HydrophobicContact CD2-CD1 3.93Å; Y234-L240 HydrophobicContact CE2-CD1 4.24Å; Y234-L240 HydrophobicContact CG-CB 4.4Å; Y234-H243 HydrophobicContact CD2-CB 4.43Å; Y234-H243 HydrophobicContact CE1-CB 4.39Å; Y234-H243 HydrophobicContact CE2-CB 3.51Å; Y234-H243 AromaticContact CE2-CD2 3.67Å; Y234-H243 AromaticContact CE2-CG 3.48Å; Y234-H243 VanDerWaalsContact CE2-CG 3.48Å; Y234-H243 VanDerWaalsContact CZ-CB 3.49Å; Y234-H243 AromaticContact CZ-CG 3.61Å; Y234-H243 AromaticContact CZ-ND1 3.93Å; Y234-H243 WeakPolarHBondContact OH-CB 3.13Å; Y234-H243 PolarHBondContact OH-ND1 2.91Å
235	Y	76.6	Confident	81.2	Confident	105 Å²	105	75.1 Å²	75.1	41%	0.412	38%	0.381	S	S	.	.	S	Bend	trans	-82.9	-26.4	176.7	-62	-63.8	0	0	0	113.5	R219 I220 K221 Y223	R219-Y235 HydrophobicContact CB-CE1 3.69Å; R219-Y235 HydrophobicContact CG-CE1 4.41Å; R219-Y235 WeakPolarHBondContact O-CE1 3.34Å; R219-Y235 PolarHBondContact O-OH 2.93Å; I220-Y235 VanDerWaalsContact C-CE1 3.43Å; I220-Y235 VanDerWaalsContact O-CD1 3.25Å; I220-Y235 WeakPolarHBondContact O-CD1 3.23Å; K221-Y235 HydrophobicContact CB-CE1 4.18Å; K221-Y235 WeakPolarHBondContact CE-OH 3.5Å; K221-Y235 HydrophobicContact CG-CD1 3.96Å; K221-Y235 HydrophobicContact CG-CD2 4.45Å; K221-Y235 HydrophobicContact CG-CE1 3.34Å; K221-Y235 HydrophobicContact CG-CE2 3.98Å; K221-Y235 HydrophobicContact CG-CG 4.44Å; Y223-Y235 WeakPolarHBondContact CE2-O 3.49Å
236	K	74.8	Confident	81.5	Confident	128 Å²	128	80.3 Å²	80.3	56%	0.557	41%	0.407	S	S	*	.	S	Bend	trans	-120.6	140.5	-178.7	-64.8	-171.8	176.6	-171.7	0	109.5	Y223 S238 H239 L240	Y223-K236 VanDerWaalsContact CD2-C 3.42Å; K236-S238 VanDerWaalsContact C-N 3.28Å; K236-S238 PolarHBondContact O-N 2.74Å; K236-H239 PolarHBondContact O-N 3.43Å; K236-L240 PolarHBondContact O-N 2.93Å
237	R	75.5	Confident	81.6	Confident	91 Å²	91	77.8 Å²	77.8	34%	0.343	39%	0.388	S	S	.	.	H	α-helix	trans	-59.8	-39.4	176.2	-174.2	65.1	177.3	172.7	5.5	112	N147 Y223 H239 L240 N241	N147-R237 PolarHBondContact OD1-NH2 3.41Å; Y223-R237 HydrophobicContact CD1-CB 4.17Å; Y223-R237 HydrophobicContact CD1-CG 4.5Å; Y223-R237 HydrophobicContact CE1-CB 3.86Å; Y223-R237 HydrophobicContact CE1-CG 4.32Å; Y223-R237 HydrophobicContact CE2-CB 4.29Å; Y223-R237 HydrophobicContact CG-CB 4.49Å; R237-H239 VanDerWaalsContact C-N 3.28Å; R237-H239 PolarHBondContact O-N 3.28Å; R237-L240 PolarHBondContact O-N 3.45Å; R237-L240 VanDerWaalsContact O-N 3.13Å; R237-N241 PolarHBondContact O-N 2.97Å
238	S	78.5	Confident	81.8	Confident	73 Å²	73	76.7 Å²	76.7	51%	0.51	39%	0.393	S	S	.	.	H	α-helix	trans	-56.7	-39.6	176.2	54.4	0	0	0	0	112.9	K236 N241 E242	K236-S238 VanDerWaalsContact C-N 3.28Å; K236-S238 PolarHBondContact O-N 2.74Å; S238-N241 PolarHBondContact O-N 3.15Å; S238-E242 WeakPolarHBondContact O-CB 3.28Å; S238-E242 PolarHBondContact O-N 3.13Å
239	H	83.5	Confident	81.8	Confident	82 Å²	82	74.7 Å²	74.7	38%	0.38	39%	0.39	S	S	.	.	H	α-helix	trans	-71.4	-35.2	177.6	-61.7	178.8	0	0	0	112.4	Y234 K236 R237 H243	Y234-H239 HydrophobicContact CD1-CB 3.59Å; Y234-H239 HydrophobicContact CE1-CB 4.37Å; Y234-H239 HydrophobicContact CG-CB 3.98Å; K236-H239 PolarHBondContact O-N 3.43Å; R237-H239 VanDerWaalsContact C-N 3.28Å; R237-H239 PolarHBondContact O-N 3.28Å; H239-H243 WeakPolarHBondContact O-CB 3.43Å; H239-H243 PolarHBondContact O-N 3.18Å
240	L	81.5	Confident	81.8	Confident	2 Å²	2	68.1 Å²	68.1	1%	0.01	36%	0.36	C	S	.	.	H	α-helix	trans	-65.7	-41.5	172.1	174.6	63.4	0	0	0	110.7	K224 C225 Y234 K236 R237 H243 Y244	K224-L240 WeakPolarHBondContact O-CD2 3.36Å; C225-L240 HydrophobicContact CB-CD1 4.07Å; Y234-L240 HydrophobicContact CD2-CB 3.96Å; Y234-L240 HydrophobicContact CD2-CD1 3.93Å; Y234-L240 HydrophobicContact CE2-CD1 4.24Å; Y234-L240 HydrophobicContact CG-CB 4.4Å; K236-L240 PolarHBondContact O-N 2.93Å; R237-L240 PolarHBondContact O-N 3.45Å; R237-L240 VanDerWaalsContact O-N 3.13Å; L240-H243 WeakPolarHBondContact O-CB 3.25Å; L240-H243 PolarHBondContact O-N 3.31Å; L240-Y244 HydrophobicContact CD1-CD2 4.11Å; L240-Y244 HydrophobicContact CD1-CE2 3.68Å; L240-Y244 HydrophobicContact CD2-CE2 3.97Å; L240-Y244 HydrophobicContact CG-CD2 3.98Å; L240-Y244 HydrophobicContact CG-CE2 3.61Å; L240-Y244 VanDerWaalsContact O-CD2 3.24Å; L240-Y244 WeakPolarHBondContact O-CD2 3.43Å; L240-Y244 PolarHBondContact O-N 3.41Å
241	N	79.7	Confident	82.1	Confident	91 Å²	91	72.1 Å²	72.1	49%	0.487	38%	0.375	S	S	.	.	H	α-helix	trans	-62.6	-45.2	176.8	-164.9	55.5	0	0	0	111.8	R237 S238 H243 Y244	R237-N241 PolarHBondContact O-N 2.97Å; S238-N241 PolarHBondContact O-N 3.15Å; N241-H243 VanDerWaalsContact C-N 3.26Å; N241-H243 PolarHBondContact O-N 2.99Å; N241-Y244 WeakPolarHBondContact O-CB 3.34Å; N241-Y244 PolarHBondContact O-N 3.19Å; N241-Y244 VanDerWaalsContact O-N 3.16Å
242	E	80.6	Confident	81.9	Confident	68 Å²	68	68.5 Å²	68.5	32%	0.318	35%	0.354	S	S	.	.	H	α-helix	trans	-57.6	-40.2	172.3	-177.9	-170.5	140.9	0	0	111.8	S238 H245 R266	S238-E242 WeakPolarHBondContact O-CB 3.28Å; S238-E242 PolarHBondContact O-N 3.13Å; E242-H245 VanDerWaalsContact O-CB 3.31Å; E242-H245 WeakPolarHBondContact O-CB 3.39Å; E242-H245 PolarHBondContact O-N 3.45Å; E242-R266 HydrophobicContact CG-CG 3.9Å; E242-R266 WeakPolarHBondContact OE1-CD 3.41Å; E242-R266 IonicContact OE1-CZ 2.64Å; E242-R266 IonicContact OE1-NE 3.42Å; E242-R266 IonicContact OE1-NH1 3.39Å; E242-R266 PolarHBondContact OE1-NH1 2.97Å
243	H	86.2	Confident	82	Confident	11 Å²	11	65.5 Å²	65.5	5%	0.051	34%	0.341	C	S	.	.	H	α-helix	trans	-65.1	-37.2	176.5	168.3	69.6	0	0	0	113.1	C225 C230 Y234 H239 L240 N241 H245 L246 H247	C225-H243 WeakPolarHBondContact CB-NE2 3.19Å; C225-H243 PolarHBondContact SG-NE2 3.43Å; C230-H243 VanDerWaalsContact SG-CE1 3.52Å; C230-H243 PolarHBondContact SG-NE2 3.28Å; Y234-H243 HydrophobicContact CD2-CB 4.43Å; Y234-H243 HydrophobicContact CE1-CB 4.39Å; Y234-H243 HydrophobicContact CE2-CB 3.51Å; Y234-H243 AromaticContact CE2-CD2 3.67Å; Y234-H243 AromaticContact CE2-CG 3.48Å; Y234-H243 VanDerWaalsContact CE2-CG 3.48Å; Y234-H243 VanDerWaalsContact CZ-CB 3.49Å; Y234-H243 AromaticContact CZ-CG 3.61Å; Y234-H243 AromaticContact CZ-ND1 3.93Å; Y234-H243 WeakPolarHBondContact OH-CB 3.13Å; Y234-H243 PolarHBondContact OH-ND1 2.91Å; H239-H243 WeakPolarHBondContact O-CB 3.43Å; H239-H243 PolarHBondContact O-N 3.18Å; L240-H243 WeakPolarHBondContact O-CB 3.25Å; L240-H243 PolarHBondContact O-N 3.31Å; N241-H243 VanDerWaalsContact C-N 3.26Å; N241-H243 PolarHBondContact O-N 2.99Å; H243-H245 PolarHBondContact O-N 3.03Å; H243-H245 VanDerWaalsContact O-N 3.17Å; H243-L246 VanDerWaalsContact O-CB 3.24Å; H243-L246 WeakPolarHBondContact O-CB 3.45Å; H243-L246 PolarHBondContact O-N 2.95Å; H243-H247 AromaticContact CD2-NE2 3.97Å; H243-H247 AromaticContact CE1-NE2 3.36Å; H243-H247 PolarHBondContact CE1-NE2 3.34Å; H243-H247 AromaticContact NE2-CD2 3.6Å; H243-H247 AromaticContact NE2-NE2 3.04Å; H243-H247 PolarHBondContact NE2-NE2 3.27Å
244	Y	82.4	Confident	82.6	Confident	30 Å²	30	68.4 Å²	68.4	12%	0.118	35%	0.354	C	S	.	.	H	α-helix	trans	-59.8	-25.8	175.9	-86	-67.6	0	0	0	113.3	T226 L240 N241 L246 H247 T248	T226-Y244 PolarHBondContact N-OH 3.15Å; T226-Y244 VanDerWaalsContact N-OH 3.09Å; T226-Y244 PolarHBondContact OG1-OH 3.46Å; L240-Y244 HydrophobicContact CD1-CD2 4.11Å; L240-Y244 HydrophobicContact CD1-CE2 3.68Å; L240-Y244 HydrophobicContact CD2-CE2 3.97Å; L240-Y244 HydrophobicContact CG-CD2 3.98Å; L240-Y244 HydrophobicContact CG-CE2 3.61Å; L240-Y244 VanDerWaalsContact O-CD2 3.24Å; L240-Y244 WeakPolarHBondContact O-CD2 3.43Å; L240-Y244 PolarHBondContact O-N 3.41Å; N241-Y244 WeakPolarHBondContact O-CB 3.34Å; N241-Y244 PolarHBondContact O-N 3.19Å; N241-Y244 VanDerWaalsContact O-N 3.16Å; Y244-L246 PolarHBondContact O-N 2.98Å; Y244-H247 PolarHBondContact O-N 3.14Å; Y244-H247 VanDerWaalsContact O-N 3.11Å; Y244-T248 PolarHBondContact O-N 2.88Å; Y244-T248 PolarHBondContact O-OG1 3.31Å
245	H	86.9	Confident	83.2	Confident	35 Å²	35	66.4 Å²	66.4	16%	0.162	35%	0.347	C	S	.	.	H	α-helix	trans	-62.5	-24.7	172.5	-62.5	-32.1	0	0	0	113.1	E242 H243 T248 G249 A250 T265	E242-H245 VanDerWaalsContact O-CB 3.31Å; E242-H245 WeakPolarHBondContact O-CB 3.39Å; E242-H245 PolarHBondContact O-N 3.45Å; H243-H245 PolarHBondContact O-N 3.03Å; H243-H245 VanDerWaalsContact O-N 3.17Å; H245-T248 WeakPolarHBondContact CA-OG1 3.38Å; H245-G249 CarbonylContact O-C 3.5Å; H245-G249 VanDerWaalsContact O-CA 3.32Å; H245-G249 WeakPolarHBondContact O-CA 3.48Å; H245-G249 PolarHBondContact O-N 3.48Å; H245-A250 WeakPolarHBondContact CB-O 3.46Å; H245-A250 PolarHBondContact O-N 3.48Å; H245-T265 HydrophobicContact CB-CG2 4.09Å; H245-T265 PolarHBondContact CD2-O 3.32Å
246	L	84.7	Confident	83.9	Confident	121 Å²	121	68.1 Å²	68.1	63%	0.634	36%	0.364	S	S	*	.	H	α-helix	trans	-72.7	-33.3	174.1	-58	176.7	0	0	0	112.2	H243 Y244	H243-L246 VanDerWaalsContact O-CB 3.24Å; H243-L246 WeakPolarHBondContact O-CB 3.45Å; H243-L246 PolarHBondContact O-N 2.95Å; Y244-L246 PolarHBondContact O-N 2.98Å
247	H	83.4	Confident	84.7	Confident	51 Å²	51	66.4 Å²	66.4	24%	0.236	36%	0.358	C	S	.	.	H	α-helix	trans	-79.5	-46.7	178.2	-70.1	-57.4	0	0	0	112.1	C225 Y227 C230 H243 Y244 G249	C225-H247 VanDerWaalsContact SG-CD2 3.59Å; C225-H247 PolarHBondContact SG-NE2 2.94Å; C225-H247 VanDerWaalsContact SG-NE2 3.35Å; Y227-H247 HydrophobicContact CD1-CB 4.38Å; Y227-H247 AromaticContact CD1-CE1 3.82Å; Y227-H247 AromaticContact CD1-CG 3.9Å; Y227-H247 AromaticContact CD1-ND1 3.4Å; Y227-H247 WeakPolarHBondContact CD1-ND1 3.47Å; Y227-H247 HydrophobicContact CD2-CB 3.61Å; Y227-H247 AromaticContact CD2-CG 3.76Å; Y227-H247 AromaticContact CE1-ND1 3.89Å; Y227-H247 HydrophobicContact CE2-CB 3.76Å; Y227-H247 HydrophobicContact CG-CB 3.94Å; Y227-H247 AromaticContact CG-CD2 3.93Å; Y227-H247 AromaticContact CG-CE1 3.92Å; Y227-H247 AromaticContact CG-CG 3.54Å; Y227-H247 AromaticContact CG-ND1 3.54Å; C230-H247 PolarHBondContact SG-NE2 2.86Å; H243-H247 AromaticContact CD2-NE2 3.97Å; H243-H247 AromaticContact CE1-NE2 3.36Å; H243-H247 PolarHBondContact CE1-NE2 3.34Å; H243-H247 AromaticContact NE2-CD2 3.6Å; H243-H247 AromaticContact NE2-NE2 3.04Å; H243-H247 PolarHBondContact NE2-NE2 3.27Å; Y244-H247 PolarHBondContact O-N 3.14Å; Y244-H247 VanDerWaalsContact O-N 3.11Å; H247-G249 VanDerWaalsContact C-N 3.27Å; H247-G249 PolarHBondContact O-N 3.27Å
248	T	82.3	Confident	85.4	Confident	92 Å²	92	67.5 Å²	67.5	56%	0.564	38%	0.376	S	S	*	.	H	α-helix	trans	-76.8	-15.1	-178.5	54.9	0	0	0	0	113.1	Y244 H245 A250	Y244-T248 PolarHBondContact O-N 2.88Å; Y244-T248 PolarHBondContact O-OG1 3.31Å; H245-T248 WeakPolarHBondContact CA-OG1 3.38Å; T248-A250 PolarHBondContact O-N 3.24Å; T248-A250 VanDerWaalsContact OG1-CB 3.29Å; T248-A250 WeakPolarHBondContact OG1-CB 3.4Å; T248-A250 PolarHBondContact OG1-N 3.35Å
249	G	82.6	Confident	86	Confident	52 Å²	52	68.1 Å²	68.1	54%	0.536	40%	0.395	S	S	.	.			trans	68.1	6.5	-168.9	0	0	0	0	0	113.7	H245 H247 K251	H245-G249 CarbonylContact O-C 3.5Å; H245-G249 VanDerWaalsContact O-CA 3.32Å; H245-G249 WeakPolarHBondContact O-CA 3.48Å; H245-G249 PolarHBondContact O-N 3.48Å; H247-G249 VanDerWaalsContact C-N 3.27Å; H247-G249 PolarHBondContact O-N 3.27Å; G249-K251 PolarHBondContact O-N 3.46Å
250	A	82.2	Confident	86.4	Confident	38 Å²	38	65.1 Å²	65.1	31%	0.314	38%	0.383	S	S	.	.			trans	-62.5	129.6	-177.4	0	0	0	0	0	111	H245 T248 P252	H245-A250 WeakPolarHBondContact CB-O 3.46Å; H245-A250 PolarHBondContact O-N 3.48Å; T248-A250 PolarHBondContact O-N 3.24Å; T248-A250 VanDerWaalsContact OG1-CB 3.29Å; T248-A250 WeakPolarHBondContact OG1-CB 3.4Å; T248-A250 PolarHBondContact OG1-N 3.35Å; A250-P252 WeakPolarHBondContact O-CD 3.48Å
251	K	86.7	Confident	86.8	Confident	108 Å²	108	72.6 Å²	72.6	47%	0.47	42%	0.423	S	S	.	.			trans	-124.9	80.6	175.9	-69.1	175	176.4	-176.3	0	109.2	G249 H253 R263 F264 T265	G249-K251 PolarHBondContact O-N 3.46Å; K251-H253 PolarHBondContact O-N 3.03Å; K251-R263 HydrophobicContact CB-CB 3.62Å; K251-R263 HydrophobicContact CD-CB 4.06Å; K251-R263 HydrophobicContact CG-CB 4.48Å; K251-R263 PolarHBondContact O-NE 3.5Å; K251-F264 CarbonylContact C-O 3.43Å; K251-F264 WeakPolarHBondContact CA-O 3.23Å; K251-T265 HydrophobicContact CG-CG2 4Å
252	P	84	Confident	87.4	Confident	64 Å²	64	69.5 Å²	69.5	42%	0.416	41%	0.41	S	S	.	.			trans	-69	-22.3	-172.4	25.1	-32.2	0	0	0	113	A250	A250-P252 WeakPolarHBondContact O-CD 3.48Å
253	H	89.6	Confident	88	Confident	61 Å²	61	73.2 Å²	73.2	28%	0.282	42%	0.421	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-96.2	105.3	-174.8	-58	-73.7	0	0	0	111.3	K251 R263 F264 R266 A267 L270	K251-H253 PolarHBondContact O-N 3.03Å; H253-R263 CarbonylContact O-C 3.45Å; H253-R263 WeakPolarHBondContact O-CA 3.47Å; H253-F264 HydrophobicContact CB-CB 4.2Å; H253-F264 PolarHBondContact N-O 3.37Å; H253-F264 VanDerWaalsContact N-O 3.1Å; H253-F264 PolarHBondContact O-N 2.93Å; H253-R266 WeakPolarHBondContact CD2-CA 3.45Å; H253-R266 PolarHBondContact CD2-N 3.18Å; H253-A267 PolarHBondContact CD2-N 3.17Å; H253-A267 VanDerWaalsContact CD2-N 3.32Å; H253-A267 PolarHBondContact NE2-N 3.4Å; H253-L270 HydrophobicContact CB-CB 4.04Å; H253-L270 HydrophobicContact CB-CD2 3.91Å
254	L	92.3	Very high	88.2	Confident	79 Å²	79	74.4 Å²	74.4	41%	0.414	43%	0.426	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-100.4	146.1	-177.4	50.5	84.1	0	0	0	112.3	N256 R263 L270	L254-N256 WeakPolarHBondContact CD1-OD1 3.31Å; L254-R263 HydrophobicContact CB-CG 4.42Å; L254-L270 WeakPolarHBondContact O-CD1 2.83Å; L254-L270 VanDerWaalsContact O-CD2 3.25Å; L254-L270 WeakPolarHBondContact O-CD2 3.47Å
255	C	94.1	Very high	88.2	Confident	12 Å²	12	74 Å²	74	8%	0.081	43%	0.427	C	S	.	.			trans	-84.6	124.4	172.2	-168.5	0	0	0	0	110.1	Q257 C260 A262 L270 H273 H277	C255-Q257 VanDerWaalsContact C-N 3.33Å; C255-C260 HydrophobicContact CB-CB 4.39Å; C255-A262 HydrophobicContact CB-CB 4.34Å; C255-A262 WeakPolarHBondContact CB-O 3.27Å; C255-A262 PolarHBondContact N-O 2.98Å; C255-L270 HydrophobicContact CB-CD1 3.98Å; C255-H273 PolarHBondContact SG-NE2 3.4Å; C255-H277 PolarHBondContact SG-NE2 3.09Å; C255-H277 VanDerWaalsContact SG-NE2 3.44Å
256	N	91.3	Very high	88.2	Confident	141 Å²	141	75.9 Å²	75.9	75%	0.754	43%	0.433	S	S	*	.			trans	-91.7	12.2	179.7	-71.3	-20.7	0	0	0	113.6	L254	L254-N256 WeakPolarHBondContact CD1-OD1 3.31Å
257	Q	90.5	Very high	88.4	Confident	92 Å²	92	73 Å²	73	43%	0.43	43%	0.426	S	S	.	.	S	Bend	trans	-76.2	132.7	178.9	-170.4	72.1	23.9	0	0	109.5	C255 G259 C260 H277	C255-Q257 VanDerWaalsContact C-N 3.33Å; Q257-G259 PolarHBondContact O-N 3.3Å; Q257-C260 HydrophobicContact CB-CB 4.02Å; Q257-C260 WeakPolarHBondContact O-CB 3.44Å; Q257-C260 PolarHBondContact O-N 2.96Å; Q257-H277 HydrophobicContact CG-CB 4.39Å
258	P	89.8	Confident	88.6	Confident	114 Å²	114	74.2 Å²	74.2	74%	0.74	43%	0.434	S	S	*	.	T	Hydrogen-bonded Turn	trans	-56.1	133.1	176.4	21.3	-33.1	0	0	0	111.3	C260	P258-C260 VanDerWaalsContact C-N 3.28Å; P258-C260 PolarHBondContact O-N 2.91Å
259	G	91	Very high	89.1	Confident	87 Å²	87	72 Å²	72	90%	0.897	42%	0.418	S	S	*	.	T	Hydrogen-bonded Turn	trans	79.4	-0.8	-175.7	0	0	0	0	0	115.1	Q257	Q257-G259 PolarHBondContact O-N 3.3Å
260	C	91.7	Very high	89.6	Confident	19 Å²	19	71 Å²	71	13%	0.128	40%	0.399	C	S	.	.			trans	-108.3	119.8	176.9	-167.3	0	0	0	0	112.1	C255 Q257 P258 A262 H273	C255-C260 HydrophobicContact CB-CB 4.39Å; Q257-C260 HydrophobicContact CB-CB 4.02Å; Q257-C260 WeakPolarHBondContact O-CB 3.44Å; Q257-C260 PolarHBondContact O-N 2.96Å; P258-C260 VanDerWaalsContact C-N 3.28Å; P258-C260 PolarHBondContact O-N 2.91Å; C260-A262 VanDerWaalsContact SG-CB 3.59Å; C260-H273 PolarHBondContact SG-NE2 2.88Å
261	N	90.5	Very high	90	Very high	159 Å²	159	72 Å²	72	85%	0.85	40%	0.404	S	S	*	.			trans	-105.3	21.6	176.8	-64.7	-33.2	0	0	0	112.6
262	A	92.8	Very high	90.1	Very high	26 Å²	26	71.6 Å²	71.6	22%	0.215	40%	0.4	C	S	.	.			trans	-72.8	132.2	-175.6	0	0	0	0	0	111.6	C255 C260 F264	C255-A262 HydrophobicContact CB-CB 4.34Å; C255-A262 WeakPolarHBondContact CB-O 3.27Å; C255-A262 PolarHBondContact N-O 2.98Å; C260-A262 VanDerWaalsContact SG-CB 3.59Å; A262-F264 HydrophobicContact CB-CE2 3.74Å; A262-F264 HydrophobicContact CB-CZ 3.76Å
263	R	92.4	Very high	90.6	Very high	145 Å²	145	70.5 Å²	70.5	55%	0.547	39%	0.389	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-125.6	144	177.3	-54.3	178.5	73.4	148.5	4.2	110.5	K251 H253 L254	K251-R263 HydrophobicContact CB-CB 3.62Å; K251-R263 HydrophobicContact CD-CB 4.06Å; K251-R263 HydrophobicContact CG-CB 4.48Å; K251-R263 PolarHBondContact O-NE 3.5Å; H253-R263 CarbonylContact O-C 3.45Å; H253-R263 WeakPolarHBondContact O-CA 3.47Å; L254-R263 HydrophobicContact CB-CG 4.42Å
264	F	90	Very high	90.7	Very high	37 Å²	37	74.8 Å²	74.8	16%	0.162	40%	0.403	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-130.7	150.8	-172.7	-56.7	-83.2	0	0	0	111.5	K251 H253 A262 R266 Q269 L270 H273	K251-F264 CarbonylContact C-O 3.43Å; K251-F264 WeakPolarHBondContact CA-O 3.23Å; H253-F264 HydrophobicContact CB-CB 4.2Å; H253-F264 PolarHBondContact N-O 3.37Å; H253-F264 VanDerWaalsContact N-O 3.1Å; H253-F264 PolarHBondContact O-N 2.93Å; A262-F264 HydrophobicContact CB-CE2 3.74Å; A262-F264 HydrophobicContact CB-CZ 3.76Å; F264-R266 VanDerWaalsContact C-N 3.28Å; F264-Q269 HydrophobicContact CB-CB 3.94Å; F264-Q269 HydrophobicContact CD1-CB 3.71Å; F264-Q269 HydrophobicContact CG-CB 4.01Å; F264-L270 HydrophobicContact CB-CB 4.41Å; F264-L270 HydrophobicContact CD2-CB 3.77Å; F264-L270 HydrophobicContact CD2-CD1 3.82Å; F264-L270 HydrophobicContact CD2-CG 4.4Å; F264-L270 HydrophobicContact CE2-CB 4.49Å; F264-L270 HydrophobicContact CE2-CD1 3.93Å; F264-L270 HydrophobicContact CG-CB 4.28Å; F264-H273 HydrophobicContact CE1-CB 3.99Å; F264-H273 HydrophobicContact CE2-CB 3.71Å; F264-H273 AromaticContact CE2-CD2 3.56Å; F264-H273 AromaticContact CE2-CG 3.59Å; F264-H273 HydrophobicContact CZ-CB 3.31Å; F264-H273 AromaticContact CZ-CD2 3.69Å; F264-H273 AromaticContact CZ-CG 3.24Å; F264-H273 AromaticContact CZ-ND1 3.61Å
265	T	83.2	Confident	90.5	Very high	22 Å²	22	74 Å²	74	14%	0.135	39%	0.394	C	S	.	.	S	Bend	trans	-79	-15.1	175.4	55.6	0	0	0	0	112.3	H245 K251	H245-T265 HydrophobicContact CB-CG2 4.09Å; H245-T265 PolarHBondContact CD2-O 3.32Å; K251-T265 HydrophobicContact CG-CG2 4Å
266	R	86.9	Confident	90.2	Very high	74 Å²	74	76.1 Å²	76.1	28%	0.279	41%	0.412	S	S	.	.	S	Bend	trans	-139.5	150.2	-176.4	-42.4	-167.8	-50.5	-171.8	0.1	113.5	E242 H253 F264 D268 Q269 L270	E242-R266 HydrophobicContact CG-CG 3.9Å; E242-R266 WeakPolarHBondContact OE1-CD 3.41Å; E242-R266 IonicContact OE1-CZ 2.64Å; E242-R266 IonicContact OE1-NE 3.42Å; E242-R266 IonicContact OE1-NH1 3.39Å; E242-R266 PolarHBondContact OE1-NH1 2.97Å; H253-R266 WeakPolarHBondContact CD2-CA 3.45Å; H253-R266 PolarHBondContact CD2-N 3.18Å; F264-R266 VanDerWaalsContact C-N 3.28Å; R266-D268 WeakPolarHBondContact CB-OD1 3.37Å; R266-D268 IonicContact CZ-OD1 3.46Å; R266-D268 IonicContact CZ-OD2 3.79Å; R266-D268 IonicContact NE-OD1 3.59Å; R266-D268 PolarHBondContact NE-OD1 3.5Å; R266-D268 IonicContact NE-OD2 3.73Å; R266-D268 IonicContact NH2-OD1 2.71Å; R266-D268 PolarHBondContact NH2-OD1 3.33Å; R266-D268 IonicContact NH2-OD2 3Å; R266-D268 PolarHBondContact NH2-OD2 2.97Å; R266-D268 PolarHBondContact O-N 3.48Å; R266-Q269 HydrophobicContact CB-CG 4.08Å; R266-Q269 HydrophobicContact CG-CG 4.41Å; R266-Q269 PolarHBondContact O-N 3.47Å; R266-L270 PolarHBondContact O-N 3.45Å
267	A	89.2	Confident	90.2	Very high	59 Å²	59	73 Å²	73	49%	0.488	39%	0.393	S	S	.	.	H	α-helix	trans	-64.4	-38.1	178.3	0	0	0	0	0	113.4	H253 Q269 L270 S271	H253-A267 PolarHBondContact CD2-N 3.17Å; H253-A267 VanDerWaalsContact CD2-N 3.32Å; H253-A267 PolarHBondContact NE2-N 3.4Å; A267-Q269 VanDerWaalsContact C-N 3.3Å; A267-Q269 PolarHBondContact O-N 3.22Å; A267-L270 PolarHBondContact O-N 2.98Å; A267-S271 WeakPolarHBondContact O-CB 3.3Å; A267-S271 PolarHBondContact O-N 3.42Å
268	D	88.4	Confident	90.1	Very high	77 Å²	77	73.1 Å²	73.1	41%	0.412	40%	0.4	S	S	.	.	H	α-helix	trans	-65.1	-35.1	179.3	72.6	-51.4	0	0	0	112.1	R266 S271 R272	R266-D268 WeakPolarHBondContact CB-OD1 3.37Å; R266-D268 IonicContact CZ-OD1 3.46Å; R266-D268 IonicContact CZ-OD2 3.79Å; R266-D268 IonicContact NE-OD1 3.59Å; R266-D268 PolarHBondContact NE-OD1 3.5Å; R266-D268 IonicContact NE-OD2 3.73Å; R266-D268 IonicContact NH2-OD1 2.71Å; R266-D268 PolarHBondContact NH2-OD1 3.33Å; R266-D268 IonicContact NH2-OD2 3Å; R266-D268 PolarHBondContact NH2-OD2 2.97Å; R266-D268 PolarHBondContact O-N 3.48Å; D268-S271 PolarHBondContact O-N 3.32Å; D268-R272 WeakPolarHBondContact O-CB 3.47Å; D268-R272 PolarHBondContact O-N 3.13Å
269	Q	91.4	Very high	89.9	Confident	47 Å²	47	69.2 Å²	69.2	22%	0.22	38%	0.38	C	S	.	.	H	α-helix	trans	-66.6	-44.7	175.6	-64.8	178.2	3.2	0	0	111.3	F264 R266 A267 R272 H273	F264-Q269 HydrophobicContact CB-CB 3.94Å; F264-Q269 HydrophobicContact CD1-CB 3.71Å; F264-Q269 HydrophobicContact CG-CB 4.01Å; R266-Q269 HydrophobicContact CB-CG 4.08Å; R266-Q269 HydrophobicContact CG-CG 4.41Å; R266-Q269 PolarHBondContact O-N 3.47Å; A267-Q269 VanDerWaalsContact C-N 3.3Å; A267-Q269 PolarHBondContact O-N 3.22Å; Q269-R272 PolarHBondContact O-N 3.25Å; Q269-H273 WeakPolarHBondContact O-CB 3.32Å; Q269-H273 PolarHBondContact O-N 3.28Å
270	L	93.8	Very high	89.7	Confident	29 Å²	29	69.5 Å²	69.5	15%	0.152	36%	0.359	C	S	.	.	H	α-helix	trans	-60.9	-46.9	173.9	172.9	61.1	0	0	0	111.1	H253 L254 C255 F264 R266 A267 R272 H273 R274	H253-L270 HydrophobicContact CB-CB 4.04Å; H253-L270 HydrophobicContact CB-CD2 3.91Å; L254-L270 WeakPolarHBondContact O-CD1 2.83Å; L254-L270 VanDerWaalsContact O-CD2 3.25Å; L254-L270 WeakPolarHBondContact O-CD2 3.47Å; C255-L270 HydrophobicContact CB-CD1 3.98Å; F264-L270 HydrophobicContact CB-CB 4.41Å; F264-L270 HydrophobicContact CD2-CB 3.77Å; F264-L270 HydrophobicContact CD2-CD1 3.82Å; F264-L270 HydrophobicContact CD2-CG 4.4Å; F264-L270 HydrophobicContact CE2-CB 4.49Å; F264-L270 HydrophobicContact CE2-CD1 3.93Å; F264-L270 HydrophobicContact CG-CB 4.28Å; R266-L270 PolarHBondContact O-N 3.45Å; A267-L270 PolarHBondContact O-N 2.98Å; L270-R272 VanDerWaalsContact C-N 3.34Å; L270-R272 PolarHBondContact O-N 2.86Å; L270-H273 WeakPolarHBondContact O-CB 3.29Å; L270-H273 PolarHBondContact O-N 2.88Å; L270-H273 VanDerWaalsContact O-N 3.13Å; L270-R274 HydrophobicContact CD1-CG 4.25Å; L270-R274 WeakPolarHBondContact O-CG 3.38Å; L270-R274 PolarHBondContact O-N 2.96Å
271	S	90.7	Very high	89.5	Confident	59 Å²	59	74.8 Å²	74.8	41%	0.413	38%	0.376	S	S	.	.	H	α-helix	trans	-57.4	-46.2	177.7	179.9	0	0	0	0	111.8	A267 D268 H273 R274 R275	A267-S271 WeakPolarHBondContact O-CB 3.3Å; A267-S271 PolarHBondContact O-N 3.42Å; D268-S271 PolarHBondContact O-N 3.32Å; S271-H273 PolarHBondContact O-N 2.96Å; S271-R274 PolarHBondContact O-N 3.47Å; S271-R275 PolarHBondContact O-N 3.15Å
272	R	89.6	Confident	89.4	Confident	100 Å²	100	70.4 Å²	70.4	38%	0.377	35%	0.352	S	S	.	.	H	α-helix	trans	-63.2	-40	175.1	-178.7	175.5	65.3	-158	-2.2	112.5	D268 Q269 L270 R275 R294	D268-R272 WeakPolarHBondContact O-CB 3.47Å; D268-R272 PolarHBondContact O-N 3.13Å; Q269-R272 PolarHBondContact O-N 3.25Å; L270-R272 VanDerWaalsContact C-N 3.34Å; L270-R272 PolarHBondContact O-N 2.86Å; R272-R275 WeakPolarHBondContact O-CB 3.39Å; R272-R275 PolarHBondContact O-N 3.21Å; R272-R294 HydrophobicContact CG-CG 4.17Å
273	H	93.2	Very high	89.2	Confident	42 Å²	42	72 Å²	72	19%	0.194	36%	0.355	C	S	.	.	H	α-helix	trans	-63.8	-40.3	176.3	167.8	78.9	0	0	0	111.7	C255 C260 F264 Q269 L270 S271 R275 A276 H277	C255-H273 PolarHBondContact SG-NE2 3.4Å; C260-H273 PolarHBondContact SG-NE2 2.88Å; F264-H273 HydrophobicContact CE1-CB 3.99Å; F264-H273 HydrophobicContact CE2-CB 3.71Å; F264-H273 AromaticContact CE2-CD2 3.56Å; F264-H273 AromaticContact CE2-CG 3.59Å; F264-H273 HydrophobicContact CZ-CB 3.31Å; F264-H273 AromaticContact CZ-CD2 3.69Å; F264-H273 AromaticContact CZ-CG 3.24Å; F264-H273 AromaticContact CZ-ND1 3.61Å; Q269-H273 WeakPolarHBondContact O-CB 3.32Å; Q269-H273 PolarHBondContact O-N 3.28Å; L270-H273 WeakPolarHBondContact O-CB 3.29Å; L270-H273 PolarHBondContact O-N 2.88Å; L270-H273 VanDerWaalsContact O-N 3.13Å; S271-H273 PolarHBondContact O-N 2.96Å; H273-R275 PolarHBondContact O-N 3.13Å; H273-A276 WeakPolarHBondContact O-CA 3.2Å; H273-A276 WeakPolarHBondContact O-CB 3.37Å; H273-A276 PolarHBondContact O-N 3.24Å; H273-H277 AromaticContact CD2-NE2 3.93Å; H273-H277 AromaticContact CE1-NE2 3.74Å; H273-H277 AromaticContact NE2-CD2 3.99Å; H273-H277 AromaticContact NE2-NE2 3.18Å; H273-H277 PolarHBondContact NE2-NE2 3.16Å; H273-H277 VanDerWaalsContact NE2-NE2 3.18Å
274	R	91.4	Very high	89.1	Confident	151 Å²	151	69.3 Å²	69.3	57%	0.57	35%	0.348	S	S	*	.	H	α-helix	trans	-58.9	-32.5	176.4	-72.7	-177.4	66.7	-154.9	-1.9	113.2	L270 S271 A276 H277 T278	L270-R274 HydrophobicContact CD1-CG 4.25Å; L270-R274 WeakPolarHBondContact O-CG 3.38Å; L270-R274 PolarHBondContact O-N 2.96Å; S271-R274 PolarHBondContact O-N 3.47Å; R274-A276 PolarHBondContact O-N 2.85Å; R274-H277 WeakPolarHBondContact O-CB 3.32Å; R274-H277 PolarHBondContact O-N 3.38Å; R274-T278 PolarHBondContact O-N 3.33Å
275	R	88.9	Confident	89.2	Confident	63 Å²	63	67.6 Å²	67.6	24%	0.238	34%	0.34	C	S	.	.	H	α-helix	trans	-64.3	-18	172.7	-59.4	179.3	-170.9	172.3	-0.1	113.4	S271 R272 H273 T278 G279	S271-R275 PolarHBondContact O-N 3.15Å; R272-R275 WeakPolarHBondContact O-CB 3.39Å; R272-R275 PolarHBondContact O-N 3.21Å; H273-R275 PolarHBondContact O-N 3.13Å; R275-T278 WeakPolarHBondContact CA-OG1 3.36Å; R275-G279 PolarHBondContact O-N 2.94Å
276	A	88.5	Confident	89.4	Confident	55 Å²	55	72.8 Å²	72.8	46%	0.455	37%	0.367	S	S	.	.	H	α-helix	trans	-68.1	-39.8	171	0	0	0	0	0	111.1	H273 R274	H273-A276 WeakPolarHBondContact O-CA 3.2Å; H273-A276 WeakPolarHBondContact O-CB 3.37Å; H273-A276 PolarHBondContact O-N 3.24Å; R274-A276 PolarHBondContact O-N 2.85Å
277	H	90	Very high	89.3	Confident	77 Å²	77	72.8 Å²	72.8	36%	0.356	38%	0.376	S	S	.	.	H	α-helix	trans	-71.6	-45.7	178.1	-62.4	-55.9	0	0	0	112.9	C255 Q257 H273 R274 G279	C255-H277 PolarHBondContact SG-NE2 3.09Å; C255-H277 VanDerWaalsContact SG-NE2 3.44Å; Q257-H277 HydrophobicContact CG-CB 4.39Å; H273-H277 AromaticContact CD2-NE2 3.93Å; H273-H277 AromaticContact CE1-NE2 3.74Å; H273-H277 AromaticContact NE2-CD2 3.99Å; H273-H277 AromaticContact NE2-NE2 3.18Å; H273-H277 PolarHBondContact NE2-NE2 3.16Å; H273-H277 VanDerWaalsContact NE2-NE2 3.18Å; R274-H277 WeakPolarHBondContact O-CB 3.32Å; R274-H277 PolarHBondContact O-N 3.38Å; H277-G279 VanDerWaalsContact C-N 3.28Å; H277-G279 PolarHBondContact O-N 3.31Å
278	T	88.3	Confident	89.3	Confident	93 Å²	93	72.1 Å²	72.1	57%	0.571	37%	0.367	S	S	*	.	H	α-helix	trans	-75.7	-18	-178.3	59.8	0	0	0	0	113.2	R274 R275 E280	R274-T278 PolarHBondContact O-N 3.33Å; R275-T278 WeakPolarHBondContact CA-OG1 3.36Å; T278-E280 PolarHBondContact O-N 3.16Å; T278-E280 WeakPolarHBondContact OG1-CB 3.42Å; T278-E280 PolarHBondContact OG1-N 2.89Å
279	G	86.3	Confident	89.3	Confident	32 Å²	32	74.5 Å²	74.5	33%	0.33	38%	0.379	S	S	.	.			trans	71.8	7	-172.8	0	0	0	0	0	114.2	R275 H277 R281	R275-G279 PolarHBondContact O-N 2.94Å; H277-G279 VanDerWaalsContact C-N 3.28Å; H277-G279 PolarHBondContact O-N 3.31Å; G279-R281 PolarHBondContact O-N 2.94Å
280	E	86.5	Confident	89.2	Confident	94 Å²	94	78.3 Å²	78.3	44%	0.439	40%	0.395	S	S	.	.			trans	-60.8	131.8	-174.9	-150.5	-166.3	158.8	0	0	112	T278 N282	T278-E280 PolarHBondContact O-N 3.16Å; T278-E280 WeakPolarHBondContact OG1-CB 3.42Å; T278-E280 PolarHBondContact OG1-N 2.89Å; E280-N282 WeakPolarHBondContact CG-OD1 3.48Å; E280-N282 VanDerWaalsContact OE1-CG 3.26Å; E280-N282 PolarHBondContact OE1-ND2 3.49Å; E280-N282 PolarHBondContact OE1-OD1 3.41Å; E280-N282 VanDerWaalsContact OE1-OD1 3.08Å
281	R	88.2	Confident	89.1	Confident	130 Å²	130	84.4 Å²	84.4	49%	0.491	42%	0.416	S	S	.	.			trans	-128.5	88.5	-179.9	-65.5	178	175.7	114.6	-6.7	110.1	G279 R291 F292 K293	G279-R281 PolarHBondContact O-N 2.94Å; R281-R291 HydrophobicContact CB-CB 3.6Å; R281-R291 HydrophobicContact CG-CB 4.38Å; R281-R291 PolarHBondContact O-NE 3.13Å; R281-R291 PolarHBondContact O-NH2 3.18Å; R281-F292 CarbonylContact C-O 3.32Å; R281-F292 WeakPolarHBondContact CA-O 3.31Å; R281-K293 HydrophobicContact CG-CG 3.83Å
282	N	87.6	Confident	89	Confident	67 Å²	67	82.9 Å²	82.9	36%	0.358	40%	0.402	S	S	.	.			trans	-84.2	-18.4	-168.8	-53.1	34.8	0	0	0	112.5	E280 F292	E280-N282 WeakPolarHBondContact CG-OD1 3.48Å; E280-N282 VanDerWaalsContact OE1-CG 3.26Å; E280-N282 PolarHBondContact OE1-ND2 3.49Å; E280-N282 PolarHBondContact OE1-OD1 3.41Å; E280-N282 VanDerWaalsContact OE1-OD1 3.08Å; N282-F292 PolarHBondContact N-O 2.92Å
283	F	89.7	Confident	88.9	Confident	60 Å²	60	81.5 Å²	81.5	26%	0.263	40%	0.399	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-102.5	136.9	-178.3	-54.5	-77.7	0	0	0	108.7	R291 F292 L298	F283-R291 CarbonylContact O-C 3.5Å; F283-R291 VanDerWaalsContact O-CA 3.26Å; F283-R291 WeakPolarHBondContact O-CA 3.5Å; F283-F292 HydrophobicContact CB-CB 4.24Å; F283-F292 PolarHBondContact N-O 3.07Å; F283-F292 PolarHBondContact O-N 3.08Å; F283-L298 HydrophobicContact CB-CB 4.2Å; F283-L298 HydrophobicContact CB-CD2 3.93Å
284	H	90.4	Very high	88.7	Confident	88 Å²	88	83.2 Å²	83.2	41%	0.407	40%	0.403	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-138.5	152.2	177.5	64.2	-78.2	0	0	0	111	N286 K290 R291 L298	H284-N286 PolarHBondContact CD2-OD1 3.49Å; H284-N286 PolarHBondContact NE2-OD1 3.32Å; H284-K290 CarbonylContact C-O 3.46Å; H284-K290 VanDerWaalsContact CA-O 3.26Å; H284-K290 WeakPolarHBondContact CA-O 3.36Å; H284-R291 HydrophobicContact CB-CG 4.13Å; H284-L298 WeakPolarHBondContact O-CD2 2.95Å
285	C	90.5	Very high	88.7	Confident	0 Å²	0	78.7 Å²	78.7	0%	0	40%	0.395	C	S	.	.			trans	-80.4	127.1	169.5	179	0	0	0	0	109.2	V287 C288 L289 K290 F292 L298 H301 C307	C285-V287 PolarHBondContact O-N 3.06Å; C285-V287 PolarHBondContact SG-N 3.41Å; C285-C288 PolarHBondContact SG-N 3.04Å; C285-C288 VanDerWaalsContact SG-SG 3.69Å; C285-L289 WeakPolarHBondContact O-CA 3.34Å; C285-L289 PolarHBondContact O-N 3.04Å; C285-K290 PolarHBondContact N-O 3.29Å; C285-F292 HydrophobicContact CB-CE2 4.46Å; C285-L298 HydrophobicContact CB-CD1 4.06Å; C285-H301 VanDerWaalsContact CB-NE2 3.33Å; C285-H301 WeakPolarHBondContact CB-NE2 3.06Å; C285-C307 PolarHBondContact SG-SG 3.08Å
286	N	87.7	Confident	88.8	Confident	131 Å²	131	78.5 Å²	78.5	70%	0.701	40%	0.398	S	S	*	.	T	Hydrogen-bonded Turn	trans	-73.8	-11.4	177.6	-63	-4.9	0	0	0	113.2	H284	H284-N286 PolarHBondContact CD2-OD1 3.49Å; H284-N286 PolarHBondContact NE2-OD1 3.32Å
287	V	86	Confident	89	Confident	75 Å²	75	79.9 Å²	79.9	46%	0.455	40%	0.395	S	S	.	.	T	Hydrogen-bonded Turn	trans	-90.8	-55.8	179.6	-177.2	0	0	0	0	111.1	C285 C307	C285-V287 PolarHBondContact O-N 3.06Å; C285-V287 PolarHBondContact SG-N 3.41Å; V287-C307 HydrophobicContact CB-CB 3.92Å; V287-C307 HydrophobicContact CG1-CB 3.91Å
288	C	88.9	Confident	89	Confident	45 Å²	45	77.4 Å²	77.4	30%	0.304	38%	0.384	S	S	.	.	T	Hydrogen-bonded Turn	trans	-104.5	3.7	-177.1	71.3	0	0	0	0	114.3	C285 K290 H301 C307	C285-C288 PolarHBondContact SG-N 3.04Å; C285-C288 VanDerWaalsContact SG-SG 3.69Å; C288-K290 PolarHBondContact O-N 3.18Å; C288-K290 VanDerWaalsContact SG-CB 3.54Å; C288-H301 PolarHBondContact SG-CE1 2.98Å; C288-H301 PolarHBondContact SG-NE2 2.99Å; C288-C307 HydrophobicContact CB-CB 4.22Å
289	L	88.3	Confident	89.2	Confident	127 Å²	127	79.7 Å²	79.7	67%	0.665	39%	0.387	S	S	*	.			trans	58.9	7.9	-179.4	-55.4	178.5	0	0	0	115.6	C285 R291	C285-L289 WeakPolarHBondContact O-CA 3.34Å; C285-L289 PolarHBondContact O-N 3.04Å; L289-R291 PolarHBondContact O-N 3.21Å
290	K	89.4	Confident	89.4	Confident	127 Å²	127	81 Å²	81	55%	0.552	39%	0.388	S	S	*	.			trans	-64	130.7	177.9	-168.3	167.6	-173.3	168.3	0	110.7	H284 C285 C288 F292	H284-K290 CarbonylContact C-O 3.46Å; H284-K290 VanDerWaalsContact CA-O 3.26Å; H284-K290 WeakPolarHBondContact CA-O 3.36Å; C285-K290 PolarHBondContact N-O 3.29Å; C288-K290 PolarHBondContact O-N 3.18Å; C288-K290 VanDerWaalsContact SG-CB 3.54Å; K290-F292 HydrophobicContact CB-CE2 4.09Å; K290-F292 HydrophobicContact CB-CZ 4.16Å; K290-F292 HydrophobicContact CD-CE1 4.48Å; K290-F292 HydrophobicContact CD-CZ 3.98Å; K290-F292 HydrophobicContact CG-CE1 4.5Å; K290-F292 HydrophobicContact CG-CE2 4.14Å; K290-F292 HydrophobicContact CG-CZ 3.87Å; K290-F292 WeakPolarHBondContact O-CD2 3.44Å; K290-F292 WeakPolarHBondContact O-CE2 3.41Å
291	R	91.2	Very high	89.5	Confident	156 Å²	156	77.2 Å²	77.2	59%	0.589	37%	0.37	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-98.8	143.2	-177.4	-52	-178.5	68.7	150.6	1.4	111.9	R281 F283 H284 L289	R281-R291 HydrophobicContact CB-CB 3.6Å; R281-R291 HydrophobicContact CG-CB 4.38Å; R281-R291 PolarHBondContact O-NE 3.13Å; R281-R291 PolarHBondContact O-NH2 3.18Å; F283-R291 CarbonylContact O-C 3.5Å; F283-R291 VanDerWaalsContact O-CA 3.26Å; F283-R291 WeakPolarHBondContact O-CA 3.5Å; H284-R291 HydrophobicContact CB-CG 4.13Å; L289-R291 PolarHBondContact O-N 3.21Å
292	F	88.5	Confident	89.5	Confident	28 Å²	28	74.9 Å²	74.9	12%	0.123	37%	0.367	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-129.6	145	-176	-57.7	-90	0	0	0	110.8	R281 N282 F283 C285 K290 R294 H297 L298 H301	R281-F292 CarbonylContact C-O 3.32Å; R281-F292 WeakPolarHBondContact CA-O 3.31Å; N282-F292 PolarHBondContact N-O 2.92Å; F283-F292 HydrophobicContact CB-CB 4.24Å; F283-F292 PolarHBondContact N-O 3.07Å; F283-F292 PolarHBondContact O-N 3.08Å; C285-F292 HydrophobicContact CB-CE2 4.46Å; K290-F292 HydrophobicContact CB-CE2 4.09Å; K290-F292 HydrophobicContact CB-CZ 4.16Å; K290-F292 HydrophobicContact CD-CE1 4.48Å; K290-F292 HydrophobicContact CD-CZ 3.98Å; K290-F292 HydrophobicContact CG-CE1 4.5Å; K290-F292 HydrophobicContact CG-CE2 4.14Å; K290-F292 HydrophobicContact CG-CZ 3.87Å; K290-F292 WeakPolarHBondContact O-CD2 3.44Å; K290-F292 WeakPolarHBondContact O-CE2 3.41Å; F292-R294 VanDerWaalsContact C-N 3.32Å; F292-H297 HydrophobicContact CB-CB 4.36Å; F292-H297 HydrophobicContact CD1-CB 3.87Å; F292-H297 HydrophobicContact CG-CB 4.42Å; F292-L298 HydrophobicContact CB-CB 4.44Å; F292-L298 HydrophobicContact CD2-CB 3.91Å; F292-L298 HydrophobicContact CD2-CD1 3.83Å; F292-L298 HydrophobicContact CD2-CG 4.44Å; F292-L298 HydrophobicContact CE2-CB 4.49Å; F292-L298 HydrophobicContact CE2-CD1 3.78Å; F292-L298 HydrophobicContact CG-CB 4.23Å; F292-H301 HydrophobicContact CE1-CB 3.97Å; F292-H301 HydrophobicContact CE2-CB 4.23Å; F292-H301 AromaticContact CE2-CD2 3.47Å; F292-H301 VanDerWaalsContact CE2-CD2 3.47Å; F292-H301 WeakPolarHBondContact CE2-CD2 3.33Å; F292-H301 AromaticContact CE2-CG 3.93Å; F292-H301 AromaticContact CE2-NE2 3.87Å; F292-H301 HydrophobicContact CZ-CB 3.55Å; F292-H301 AromaticContact CZ-CD2 3.34Å; F292-H301 WeakPolarHBondContact CZ-CD2 3.4Å; F292-H301 AromaticContact CZ-CE1 3.98Å; F292-H301 AromaticContact CZ-CG 3.32Å; F292-H301 AromaticContact CZ-ND1 3.76Å; F292-H301 AromaticContact CZ-NE2 3.7Å
293	K	88.5	Confident	89.4	Confident	71 Å²	71	76.8 Å²	76.8	31%	0.309	38%	0.381	S	S	.	.	S	Bend	trans	-75.3	-21.3	176	-60.3	-167.5	177.1	-170.7	0	113	R281	R281-K293 HydrophobicContact CG-CG 3.83Å
294	R	88.6	Confident	89.1	Confident	78 Å²	78	82.7 Å²	82.7	29%	0.294	40%	0.402	S	S	.	.	S	Bend	trans	-136	147.6	-176	-57.9	164.3	49.4	168.2	2.7	111.6	R272 F292 D296 H297 L298	R272-R294 HydrophobicContact CG-CG 4.17Å; F292-R294 VanDerWaalsContact C-N 3.32Å; R294-D296 WeakPolarHBondContact CB-OD1 3.36Å; R294-D296 IonicContact CZ-OD1 3.49Å; R294-D296 IonicContact CZ-OD2 3.25Å; R294-D296 VanDerWaalsContact CZ-OD2 3.25Å; R294-D296 IonicContact NE-OD1 2.83Å; R294-D296 PolarHBondContact NE-OD1 2.92Å; R294-D296 IonicContact NE-OD2 3.43Å; R294-D296 PolarHBondContact NE-OD2 3.44Å; R294-D296 VanDerWaalsContact NH2-CG 3.35Å; R294-D296 IonicContact NH2-OD1 2.78Å; R294-D296 PolarHBondContact NH2-OD1 3.48Å; R294-D296 IonicContact NH2-OD2 3.46Å; R294-D296 PolarHBondContact NH2-OD2 2.94Å; R294-H297 WeakPolarHBondContact CD-NE2 3.14Å; R294-H297 PolarHBondContact O-N 3.13Å; R294-L298 PolarHBondContact O-N 2.83Å
295	S	91.9	Very high	88	Confident	56 Å²	56	83.2 Å²	83.2	39%	0.392	41%	0.407	S	S	.	.	H	α-helix	trans	-69.5	-33.1	-179.3	56.3	0	0	0	0	113.1	H297 L298 K299	S295-H297 VanDerWaalsContact C-N 3.33Å; S295-H297 PolarHBondContact O-N 3.01Å; S295-L298 WeakPolarHBondContact O-CB 3.22Å; S295-L298 PolarHBondContact O-N 3.49Å; S295-K299 WeakPolarHBondContact O-CG 3.17Å; S295-K299 PolarHBondContact O-N 3.33Å
296	D	91	Very high	87	Confident	58 Å²	58	86.8 Å²	86.8	31%	0.31	43%	0.429	S	S	.	.	H	α-helix	trans	-67.8	-33.5	177.6	62.6	-53.5	0	0	0	112.3	R294 K299 V300	R294-D296 WeakPolarHBondContact CB-OD1 3.36Å; R294-D296 IonicContact CZ-OD1 3.49Å; R294-D296 IonicContact CZ-OD2 3.25Å; R294-D296 VanDerWaalsContact CZ-OD2 3.25Å; R294-D296 IonicContact NE-OD1 2.83Å; R294-D296 PolarHBondContact NE-OD1 2.92Å; R294-D296 IonicContact NE-OD2 3.43Å; R294-D296 PolarHBondContact NE-OD2 3.44Å; R294-D296 VanDerWaalsContact NH2-CG 3.35Å; R294-D296 IonicContact NH2-OD1 2.78Å; R294-D296 PolarHBondContact NH2-OD1 3.48Å; R294-D296 IonicContact NH2-OD2 3.46Å; R294-D296 PolarHBondContact NH2-OD2 2.94Å; D296-K299 PolarHBondContact O-N 3.23Å; D296-V300 WeakPolarHBondContact O-CB 3.49Å; D296-V300 VanDerWaalsContact O-CG2 3.31Å; D296-V300 WeakPolarHBondContact O-CG2 2.94Å; D296-V300 PolarHBondContact O-N 2.99Å
297	H	91.1	Very high	86	Confident	85 Å²	85	80.9 Å²	80.9	39%	0.394	40%	0.398	S	S	.	.	H	α-helix	trans	-66.3	-39.8	171	-64.5	-33.8	0	0	0	112.3	F292 R294 S295 V300 H301	F292-H297 HydrophobicContact CB-CB 4.36Å; F292-H297 HydrophobicContact CD1-CB 3.87Å; F292-H297 HydrophobicContact CG-CB 4.42Å; R294-H297 WeakPolarHBondContact CD-NE2 3.14Å; R294-H297 PolarHBondContact O-N 3.13Å; S295-H297 VanDerWaalsContact C-N 3.33Å; S295-H297 PolarHBondContact O-N 3.01Å; H297-V300 PolarHBondContact O-N 3.48Å; H297-H301 WeakPolarHBondContact O-CB 3.5Å; H297-H301 PolarHBondContact O-N 3.16Å
298	L	91.5	Very high	84.7	Confident	24 Å²	24	81.1 Å²	81.1	13%	0.126	40%	0.399	C	S	.	.	H	α-helix	trans	-62.3	-46.6	171.5	173.7	61.5	0	0	0	110.8	F283 H284 C285 F292 R294 S295 V300 H301 L302	F283-L298 HydrophobicContact CB-CB 4.2Å; F283-L298 HydrophobicContact CB-CD2 3.93Å; H284-L298 WeakPolarHBondContact O-CD2 2.95Å; C285-L298 HydrophobicContact CB-CD1 4.06Å; F292-L298 HydrophobicContact CB-CB 4.44Å; F292-L298 HydrophobicContact CD2-CB 3.91Å; F292-L298 HydrophobicContact CD2-CD1 3.83Å; F292-L298 HydrophobicContact CD2-CG 4.44Å; F292-L298 HydrophobicContact CE2-CB 4.49Å; F292-L298 HydrophobicContact CE2-CD1 3.78Å; F292-L298 HydrophobicContact CG-CB 4.23Å; R294-L298 PolarHBondContact O-N 2.83Å; S295-L298 WeakPolarHBondContact O-CB 3.22Å; S295-L298 PolarHBondContact O-N 3.49Å; L298-V300 VanDerWaalsContact C-N 3.34Å; L298-V300 PolarHBondContact O-N 3.37Å; L298-H301 WeakPolarHBondContact O-CB 3.48Å; L298-H301 PolarHBondContact O-N 3.16Å; L298-H301 VanDerWaalsContact O-N 3.1Å; L298-L302 HydrophobicContact CD1-CD1 3.99Å; L298-L302 HydrophobicContact CD1-CD2 4.3Å; L298-L302 HydrophobicContact CD1-CG 3.92Å; L298-L302 HydrophobicContact CG-CD1 3.94Å; L298-L302 HydrophobicContact CG-CG 4.3Å; L298-L302 VanDerWaalsContact O-CG 3.31Å; L298-L302 WeakPolarHBondContact O-CG 3.35Å; L298-L302 PolarHBondContact O-N 3.03Å
299	K	90.9	Very high	83	Confident	142 Å²	142	87.7 Å²	87.7	62%	0.617	42%	0.423	S	S	*	.	H	α-helix	trans	-55.8	-48.6	176.9	-74.7	-176.7	-179	-172.8	0	111.7	S295 D296 H301 L302 T303	S295-K299 WeakPolarHBondContact O-CG 3.17Å; S295-K299 PolarHBondContact O-N 3.33Å; D296-K299 PolarHBondContact O-N 3.23Å; K299-H301 VanDerWaalsContact C-N 3.29Å; K299-H301 PolarHBondContact O-N 3.33Å; K299-L302 PolarHBondContact O-N 3.06Å; K299-T303 WeakPolarHBondContact O-CG2 3.49Å; K299-T303 PolarHBondContact O-N 3.28Å; K299-T303 PolarHBondContact O-OG1 3.17Å
300	V	90.4	Very high	81.4	Confident	58 Å²	58	89.5 Å²	89.5	35%	0.352	43%	0.426	S	S	.	.	H	α-helix	trans	-60.9	-38.8	177	167.9	0	0	0	0	112	D296 H297 L298 T303 R304	D296-V300 WeakPolarHBondContact O-CB 3.49Å; D296-V300 VanDerWaalsContact O-CG2 3.31Å; D296-V300 WeakPolarHBondContact O-CG2 2.94Å; D296-V300 PolarHBondContact O-N 2.99Å; H297-V300 PolarHBondContact O-N 3.48Å; L298-V300 VanDerWaalsContact C-N 3.34Å; L298-V300 PolarHBondContact O-N 3.37Å; V300-T303 WeakPolarHBondContact CA-OG1 3.39Å; V300-T303 PolarHBondContact O-OG1 3.08Å; V300-R304 HydrophobicContact CG1-CG 4.5Å; V300-R304 VanDerWaalsContact O-CB 3.3Å; V300-R304 WeakPolarHBondContact O-CB 3.06Å; V300-R304 WeakPolarHBondContact O-CG 3.11Å; V300-R304 PolarHBondContact O-N 2.73Å
301	H	89.6	Confident	79.2	Confident	16 Å²	16	89.6 Å²	89.6	7%	0.074	43%	0.432	C	S	.	.	H	α-helix	trans	-65.8	-39.9	176.5	167.7	74.5	0	0	0	112.5	C285 C288 F292 H297 L298 K299 C307	C285-H301 VanDerWaalsContact CB-NE2 3.33Å; C285-H301 WeakPolarHBondContact CB-NE2 3.06Å; C288-H301 PolarHBondContact SG-CE1 2.98Å; C288-H301 PolarHBondContact SG-NE2 2.99Å; F292-H301 HydrophobicContact CE1-CB 3.97Å; F292-H301 HydrophobicContact CE2-CB 4.23Å; F292-H301 AromaticContact CE2-CD2 3.47Å; F292-H301 VanDerWaalsContact CE2-CD2 3.47Å; F292-H301 WeakPolarHBondContact CE2-CD2 3.33Å; F292-H301 AromaticContact CE2-CG 3.93Å; F292-H301 AromaticContact CE2-NE2 3.87Å; F292-H301 HydrophobicContact CZ-CB 3.55Å; F292-H301 AromaticContact CZ-CD2 3.34Å; F292-H301 WeakPolarHBondContact CZ-CD2 3.4Å; F292-H301 AromaticContact CZ-CE1 3.98Å; F292-H301 AromaticContact CZ-CG 3.32Å; F292-H301 AromaticContact CZ-ND1 3.76Å; F292-H301 AromaticContact CZ-NE2 3.7Å; H297-H301 WeakPolarHBondContact O-CB 3.5Å; H297-H301 PolarHBondContact O-N 3.16Å; L298-H301 WeakPolarHBondContact O-CB 3.48Å; L298-H301 PolarHBondContact O-N 3.16Å; L298-H301 VanDerWaalsContact O-N 3.1Å; K299-H301 VanDerWaalsContact C-N 3.29Å; K299-H301 PolarHBondContact O-N 3.33Å; H301-C307 PolarHBondContact CD2-SG 3Å; H301-C307 PolarHBondContact CE1-SG 2.71Å; H301-C307 PolarHBondContact NE2-SG 2.96Å
302	L	86.9	Confident	76.7	Confident	80 Å²	80	93.3 Å²	93.3	42%	0.419	46%	0.462	S	S	.	.	H	α-helix	trans	-69.6	-44.7	175.8	-65.1	173.1	0	0	0	111.6	L298 K299 R304 N305	L298-L302 HydrophobicContact CD1-CD1 3.99Å; L298-L302 HydrophobicContact CD1-CD2 4.3Å; L298-L302 HydrophobicContact CD1-CG 3.92Å; L298-L302 HydrophobicContact CG-CD1 3.94Å; L298-L302 HydrophobicContact CG-CG 4.3Å; L298-L302 VanDerWaalsContact O-CG 3.31Å; L298-L302 WeakPolarHBondContact O-CG 3.35Å; L298-L302 PolarHBondContact O-N 3.03Å; K299-L302 PolarHBondContact O-N 3.06Å; L302-R304 VanDerWaalsContact C-N 3.34Å; L302-R304 PolarHBondContact O-N 3.41Å; L302-N305 PolarHBondContact O-N 2.98Å
303	T	87.2	Confident	76.1	Confident	107 Å²	107	96.6 Å²	96.6	66%	0.656	48%	0.479	S	S	*	.	H	α-helix	trans	-69.4	-30.8	-178.5	55.7	0	0	0	0	113.2	K299 V300 N305	K299-T303 WeakPolarHBondContact O-CG2 3.49Å; K299-T303 PolarHBondContact O-N 3.28Å; K299-T303 PolarHBondContact O-OG1 3.17Å; V300-T303 WeakPolarHBondContact CA-OG1 3.39Å; V300-T303 PolarHBondContact O-OG1 3.08Å; T303-N305 PolarHBondContact O-N 3.44Å
304	R	82.8	Confident	75.5	Confident	185 Å²	185	97.9 Å²	97.9	70%	0.698	49%	0.488	S	S	*	.	T	Hydrogen-bonded Turn	trans	-79.8	4.4	176.9	-73	-176.8	166.5	136.9	0.9	113.9	V300 L302 V306	V300-R304 HydrophobicContact CG1-CG 4.5Å; V300-R304 VanDerWaalsContact O-CB 3.3Å; V300-R304 WeakPolarHBondContact O-CB 3.06Å; V300-R304 WeakPolarHBondContact O-CG 3.11Å; V300-R304 PolarHBondContact O-N 2.73Å; L302-R304 VanDerWaalsContact C-N 3.34Å; L302-R304 PolarHBondContact O-N 3.41Å; R304-V306 HydrophobicContact CB-CG2 3.74Å; R304-V306 PolarHBondContact O-N 3.45Å
305	N	67.1	Low	74.8	Confident	99 Å²	99	99 Å²	99	53%	0.529	50%	0.499	S	S	.	.	T	Hydrogen-bonded Turn	trans	49.8	30.2	-179.6	-71.9	-54.9	0	0	0	113.4	L302 T303 C307 T308	L302-N305 PolarHBondContact O-N 2.98Å; T303-N305 PolarHBondContact O-N 3.44Å; N305-C307 PolarHBondContact O-N 3.39Å; N305-T308 HydrophobicContact CB-CG2 4.38Å; N305-T308 PolarHBondContact O-N 3.41Å; N305-T308 PolarHBondContact O-OG1 2.91Å
306	V	69.4	Low	73.8	Confident	75 Å²	75	101.5 Å²	101.5	46%	0.455	51%	0.506	S	S	.	.	T	Hydrogen-bonded Turn	trans	-65.1	-25.9	-178.7	-176.8	0	0	0	0	110.5	R304	R304-V306 HydrophobicContact CB-CG2 3.74Å; R304-V306 PolarHBondContact O-N 3.45Å
307	C	67.1	Low	72.7	Confident	6 Å²	6	104.3 Å²	104.3	4%	0.041	52%	0.518	C	S	.	.	T	Hydrogen-bonded Turn	trans	-82.5	-25.1	-177.7	-28.2	0	0	0	0	113.7	C285 V287 C288 H301 N305 K309 F310	C285-C307 PolarHBondContact SG-SG 3.08Å; V287-C307 HydrophobicContact CB-CB 3.92Å; V287-C307 HydrophobicContact CG1-CB 3.91Å; C288-C307 HydrophobicContact CB-CB 4.22Å; H301-C307 PolarHBondContact CD2-SG 3Å; H301-C307 PolarHBondContact CE1-SG 2.71Å; H301-C307 PolarHBondContact NE2-SG 2.96Å; N305-C307 PolarHBondContact O-N 3.39Å; C307-K309 PolarHBondContact O-N 2.66Å; C307-F310 PolarHBondContact O-N 2.87Å
308	T	58.4	Low	71.5	Confident	80 Å²	80	105.5 Å²	105.5	49%	0.491	53%	0.526	S	S	.	.	G	3₁₀ helix	trans	-75.5	-7.5	-174.5	59.2	0	0	0	0	112.5	N305 F310	N305-T308 HydrophobicContact CB-CG2 4.38Å; N305-T308 PolarHBondContact O-N 3.41Å; N305-T308 PolarHBondContact O-OG1 2.91Å; T308-F310 PolarHBondContact O-N 2.93Å
309	K	54.2	Low	70	Confident	184 Å²	184	111.4 Å²	111.4	80%	0.8	56%	0.555	S	S	*	*	G	3₁₀ helix	trans	-76.5	-1.4	172.1	-74.9	-170.4	174.7	-172.8	0	114.8	C307	C307-K309 PolarHBondContact O-N 2.66Å
310	F	53.2	Low	68.4	Low	165 Å²	165	109 Å²	109	72%	0.724	55%	0.55	S	S	*	.	G	3₁₀ helix	trans	-117.6	14.4	-175.9	-72.3	-81	0	0	0	114.4	C307 T308	C307-F310 PolarHBondContact O-N 2.87Å; T308-F310 PolarHBondContact O-N 2.93Å
311	N	44.2	Very low	66.6	Low	129 Å²	129	113.3 Å²	113.3	69%	0.69	57%	0.566	S	S	*	*			trans	-128.3	30.5	177.3	-90.3	-18.5	0	0	0	113
312	L	38.9	Very low	64.5	Low	233 Å²	233	122.1 Å²	122.1	100%	1.22	61%	0.611	S	S	*	*			trans	-120.1	0	164.7	-86.7	166.9	0	0	0	109.5

Retrieved 312 of 312 residues in 62.5 ms (Link to these results)

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