A0A087YN90_POEFO Loading...

Zinc finger and BTB domain-containing protein 20

May be a transcription factor that may be involved in hematopoiesis, oncogenesis, and immune responses. Plays a role in postnatal myogenesis, may be involved in the regulation of satellite cells self-renewal.

AlphaFold DB , UniProt , Accession A0A087YN90, Species POEFO (Poecilia formosa, Amazon molly), Gene n/a, Length 692 aa.

Structure Viewer

Loading PAE data...

(Predicted Aligned Error values between residue pairs)

Download Structure PDB PAE Table

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	30.6	Very low	26.1	Very low	236 Å²	236	139.7 Å²	139.7	100%	1.163	80%	0.802	S	S	*	*				0	124.8	0	-77	176.8	-179.6	0	0	106.7
2	L	26	Very low	26.1	Very low	168 Å²	168	138 Å²	138	88%	0.88	80%	0.802	S	S	*	*			cis	-138.3	153	5.7	-90.7	157	0	0	0	111.8
3	L	28.9	Very low	26.2	Very low	143 Å²	143	142.2 Å²	142.2	75%	0.749	81%	0.805	S	S	*	*			trans	-102.2	157	157	-102.6	166.3	0	0	0	106.7
4	P	34.4	Very low	26.6	Very low	124 Å²	124	136.5 Å²	136.5	81%	0.805	79%	0.794	S	S	*	*				-149.2	172.8	91.2	38.9	-21	0	0	0	115.9
5	C	22.3	Very low	26.6	Very low	106 Å²	106	139.9 Å²	139.9	72%	0.716	80%	0.802	S	S	*	*			trans	-85.1	163.8	176.2	-43.2	0	0	0	0	112.6
6	V	24.9	Very low	26.8	Very low	149 Å²	149	140 Å²	140	90%	0.903	81%	0.807	S	S	*	*			trans	-122.5	137.7	148.3	179.3	0	0	0	0	108
7	K	26.1	Very low	26.9	Very low	158 Å²	158	142.3 Å²	142.3	69%	0.687	81%	0.808	S	S	*	*			trans	-89.7	148.5	176.1	-73.2	176.1	151.1	-144.4	0	111.3	D9	K7-D9 IonicContact NZ-OD1 2.8Å; K7-D9 PolarHBondContact NZ-OD1 3.31Å; K7-D9 IonicContact NZ-OD2 3.51Å
8	G	24	Very low	27.3	Very low	77 Å²	77	145.8 Å²	145.8	79%	0.794	81%	0.807	S	S	*	*			trans	-123.3	109.6	148.4	0	0	0	0	0	108.4	I10	G8-I10 PolarHBondContact O-N 2.94Å
9	D	23.2	Very low	27.7	Very low	124 Å²	124	143.2 Å²	143.2	66%	0.663	79%	0.79	S	S	*	*			trans	-82.4	109	-176.4	-66.5	-80.4	0	0	0	110.9	K7	K7-D9 IonicContact NZ-OD1 2.8Å; K7-D9 PolarHBondContact NZ-OD1 3.31Å; K7-D9 IonicContact NZ-OD2 3.51Å
10	I	24.3	Very low	28.2	Very low	159 Å²	159	141 Å²	141	82%	0.815	77%	0.773	S	S	*	*			trans	-102.2	104.9	158.9	-62	-179.4	0	0	0	107.6	G8 C12	G8-I10 PolarHBondContact O-N 2.94Å; I10-C12 PolarHBondContact O-N 2.79Å
11	S	22.8	Very low	28.6	Very low	93 Å²	93	139 Å²	139	65%	0.65	76%	0.762	S	S	*	*			trans	-86.6	85.7	-174.6	-161.1	0	0	0	0	111.6	K13	S11-K13 PolarHBondContact O-N 2.95Å
12	C	25.2	Very low	29	Very low	119 Å²	119	129.3 Å²	129.3	80%	0.804	71%	0.714	S	S	*	*			trans	-70.2	71	166.8	-67.3	0	0	0	0	110.9	I10 G14	I10-C12 PolarHBondContact O-N 2.79Å; C12-G14 PolarHBondContact O-N 3.49Å
13	K	28.3	Very low	29.5	Very low	192 Å²	192	126.1 Å²	126.1	84%	0.835	70%	0.698	S	S	*	*			trans	-67.9	98.6	170.6	-87.5	-179.7	175.7	176.1	0	109.9	S11	S11-K13 PolarHBondContact O-N 2.95Å
14	G	31.5	Very low	30.2	Very low	63 Å²	63	122.3 Å²	122.3	65%	0.649	68%	0.678	S	S	*	*			trans	104.3	88	162.3	0	0	0	0	0	114.9	C12	C12-G14 PolarHBondContact O-N 3.49Å
15	M	26.9	Very low	30.3	Very low	187 Å²	187	123.5 Å²	123.5	92%	0.921	67%	0.673	S	S	*	*			trans	-165.8	76.4	141.2	-106	173.8	-138.8	0	0	109
16	T	29.3	Very low	31.1	Very low	142 Å²	142	123.7 Å²	123.7	87%	0.871	67%	0.667	S	S	*	*			trans	-112.9	26.4	167.4	58.7	0	0	0	0	111.6	R18	T16-R18 PolarHBondContact O-N 2.78Å
17	E	29.4	Very low	32	Very low	179 Å²	179	120.2 Å²	120.2	84%	0.836	64%	0.639	S	S	*	*			trans	-77	104.8	167.8	-63.9	-154.6	139.6	0	0	109	I19	E17-I19 PolarHBondContact O-N 3.01Å; E17-I19 VanDerWaalsContact O-N 3.15Å
18	R	32.4	Very low	32.8	Very low	206 Å²	206	115.4 Å²	115.4	78%	0.777	63%	0.626	S	S	*	*			trans	-63.2	113.6	165.3	-56	176.3	-167.2	164.6	1.4	106.8	T16 H20	T16-R18 PolarHBondContact O-N 2.78Å; R18-H20 PolarHBondContact O-N 3.27Å; R18-H20 PolarHBondContact O-ND1 3.21Å
19	I	36.7	Very low	33.8	Very low	96 Å²	96	116.5 Å²	116.5	49%	0.492	61%	0.614	S	S	.	*			trans	-61	95.2	-176.3	-55	174.8	0	0	0	110.2	E17 I22	E17-I19 PolarHBondContact O-N 3.01Å; E17-I19 VanDerWaalsContact O-N 3.15Å; I19-I22 HydrophobicContact CG2-CD1 4.16Å; I19-I22 HydrophobicContact CG2-CG1 3.71Å
20	H	37.6	Very low	34.7	Very low	98 Å²	98	114.1 Å²	114.1	45%	0.454	61%	0.607	S	S	.	*			trans	-96.8	113.6	-179.7	-84.2	59.4	0	0	0	109.6	R18	R18-H20 PolarHBondContact O-N 3.27Å; R18-H20 PolarHBondContact O-ND1 3.21Å
21	N	35.2	Very low	36	Very low	99 Å²	99	108.9 Å²	108.9	53%	0.529	58%	0.582	S	S	.	*			trans	75.8	88.7	-175.4	-42	-79.2	0	0	0	114.3	H52	N21-H52 PolarHBondContact OD1-NE2 3.5Å
22	I	39.4	Very low	37.4	Very low	33 Å²	33	106.4 Å²	106.4	17%	0.169	56%	0.561	C	S	.	*			trans	-86.5	118.8	149.9	-51.1	176.3	0	0	0	106.6	I19 F27 V31	I19-I22 HydrophobicContact CG2-CD1 4.16Å; I19-I22 HydrophobicContact CG2-CG1 3.71Å; I22-F27 HydrophobicContact CB-CD2 4.35Å; I22-F27 HydrophobicContact CB-CE2 4.34Å; I22-F27 HydrophobicContact CD1-CE2 3.96Å; I22-F27 HydrophobicContact CD1-CZ 4.44Å; I22-F27 HydrophobicContact CG2-CD2 3.51Å; I22-F27 HydrophobicContact CG2-CE2 3.86Å; I22-F27 HydrophobicContact CG2-CG 4.32Å; I22-V31 HydrophobicContact CD1-CG1 4.49Å
23	N	37.5	Very low	38.6	Very low	102 Å²	102	107 Å²	107	55%	0.545	55%	0.552	S	S	.	*			trans	-80.2	124.3	175.6	-165.3	7.3	0	0	0	108.6	H25 N26	N23-H25 PolarHBondContact O-N 2.89Å; N23-N26 PolarHBondContact O-N 3.03Å
24	L	41.7	Very low	39.9	Very low	62 Å²	62	101.2 Å²	101.2	33%	0.325	53%	0.533	S	S	.	.	G	3₁₀ helix	trans	-63.8	-24.3	-164.1	-142.3	115.2	0	0	0	113.8	N26 F27 M55	L24-N26 PolarHBondContact O-N 3.38Å; L24-F27 WeakPolarHBondContact O-CB 3.45Å; L24-F27 PolarHBondContact O-N 2.7Å; L24-M55 HydrophobicContact CB-CE 4.34Å; L24-M55 HydrophobicContact CB-SD 3.77Å; L24-M55 HydrophobicContact CD1-CE 4.49Å; L24-M55 HydrophobicContact CD2-CE 4.07Å; L24-M55 HydrophobicContact CD2-SD 4.38Å
25	H	37	Very low	40.7	Very low	150 Å²	150	99.4 Å²	99.4	69%	0.694	51%	0.508	S	S	*	.	G	3₁₀ helix	trans	-63.2	-24	172.9	-168.2	-79	0	0	0	113.5	N23	N23-H25 PolarHBondContact O-N 2.89Å
26	N	38.5	Very low	41.8	Very low	109 Å²	109	93.4 Å²	93.4	58%	0.583	48%	0.48	S	S	*	.	G	3₁₀ helix	trans	-112.5	23	-177.4	-66.4	22.2	0	0	0	112	N23 L24 S28	N23-N26 PolarHBondContact O-N 3.03Å; L24-N26 PolarHBondContact O-N 3.38Å; N26-S28 PolarHBondContact O-N 2.68Å
27	F	45.1	Very low	42.9	Very low	76 Å²	76	91 Å²	91	33%	0.333	46%	0.459	S	S	.	.			trans	-77.8	72.1	178.8	-147.1	-70.1	0	0	0	110.7	I22 L24 L32	I22-F27 HydrophobicContact CB-CD2 4.35Å; I22-F27 HydrophobicContact CB-CE2 4.34Å; I22-F27 HydrophobicContact CD1-CE2 3.96Å; I22-F27 HydrophobicContact CD1-CZ 4.44Å; I22-F27 HydrophobicContact CG2-CD2 3.51Å; I22-F27 HydrophobicContact CG2-CE2 3.86Å; I22-F27 HydrophobicContact CG2-CG 4.32Å; L24-F27 WeakPolarHBondContact O-CB 3.45Å; L24-F27 PolarHBondContact O-N 2.7Å; F27-L32 HydrophobicContact CE1-CD1 4.17Å
28	S	43.1	Very low	43.9	Very low	58 Å²	58	85.5 Å²	85.5	41%	0.406	43%	0.433	S	S	.	.			trans	-75	157.7	-174.2	74.3	0	0	0	0	113	N26 S30 V31 L32	N26-S28 PolarHBondContact O-N 2.68Å; S28-S30 PolarHBondContact O-N 3.33Å; S28-V31 PolarHBondContact O-N 2.95Å; S28-V31 VanDerWaalsContact O-N 3.16Å; S28-L32 PolarHBondContact O-N 3.19Å
29	N	43.6	Very low	44.5	Very low	100 Å²	100	80.8 Å²	80.8	54%	0.535	42%	0.416	S	S	.	.	H	α-helix	trans	-57.3	-35.5	177.2	-63	-42.7	0	0	0	111.9	V31 L32 E33 K94	N29-V31 VanDerWaalsContact C-N 3.31Å; N29-V31 PolarHBondContact O-N 3.39Å; N29-L32 WeakPolarHBondContact O-CB 3.35Å; N29-L32 PolarHBondContact O-N 2.73Å; N29-L32 VanDerWaalsContact O-N 3.08Å; N29-E33 VanDerWaalsContact O-CB 3.3Å; N29-E33 WeakPolarHBondContact O-CB 3.27Å; N29-E33 PolarHBondContact O-N 3.02Å; N29-K94 PolarHBondContact OD1-NZ 3.17Å
30	S	43.9	Very low	45.1	Very low	74 Å²	74	81.1 Å²	81.1	52%	0.517	42%	0.418	S	S	.	.	H	α-helix	trans	-60	-35.6	178.6	171.5	0	0	0	0	113.3	S28 T34	S28-S30 PolarHBondContact O-N 3.33Å; S30-T34 WeakPolarHBondContact O-CB 3.32Å; S30-T34 PolarHBondContact O-N 3.22Å; S30-T34 PolarHBondContact O-OG1 3.39Å
31	V	50.9	Low	45.8	Very low	48 Å²	48	83.3 Å²	83.3	29%	0.291	42%	0.423	S	S	.	.	H	α-helix	trans	-68.6	-41.4	174.6	179.4	0	0	0	0	110.7	I22 S28 N29 L35	I22-V31 HydrophobicContact CD1-CG1 4.49Å; S28-V31 PolarHBondContact O-N 2.95Å; S28-V31 VanDerWaalsContact O-N 3.16Å; N29-V31 VanDerWaalsContact C-N 3.31Å; N29-V31 PolarHBondContact O-N 3.39Å; V31-L35 HydrophobicContact CG1-CD1 4.26Å; V31-L35 VanDerWaalsContact O-CG 3.32Å; V31-L35 WeakPolarHBondContact O-CG 3.38Å; V31-L35 PolarHBondContact O-N 3.32Å; V31-L35 VanDerWaalsContact O-N 3.07Å
32	L	52	Low	45.9	Very low	42 Å²	42	81 Å²	81	22%	0.22	42%	0.423	C	S	.	.	H	α-helix	trans	-65.4	-41.7	178	-163.4	75.5	0	0	0	111.7	F27 S28 N29 L35 N36 F98	F27-L32 HydrophobicContact CE1-CD1 4.17Å; S28-L32 PolarHBondContact O-N 3.19Å; N29-L32 WeakPolarHBondContact O-CB 3.35Å; N29-L32 PolarHBondContact O-N 2.73Å; N29-L32 VanDerWaalsContact O-N 3.08Å; L32-L35 PolarHBondContact O-N 2.86Å; L32-N36 WeakPolarHBondContact O-CB 3.42Å; L32-N36 PolarHBondContact O-N 3.36Å; L32-F98 HydrophobicContact CD1-CD2 3.65Å; L32-F98 HydrophobicContact CD1-CE2 3.45Å; L32-F98 VanDerWaalsContact CD1-CE2 3.45Å; L32-F98 HydrophobicContact CD1-CG 4.48Å; L32-F98 HydrophobicContact CD1-CZ 4.15Å; L32-F98 HydrophobicContact CG-CE2 4.24Å
33	E	51.3	Low	46	Very low	130 Å²	130	84.8 Å²	84.8	61%	0.607	44%	0.439	S	S	*	.	H	α-helix	trans	-66.1	-47	178.3	-167.9	157.8	-130.1	0	0	111.1	N29 L35 N36 E37	N29-E33 VanDerWaalsContact O-CB 3.3Å; N29-E33 WeakPolarHBondContact O-CB 3.27Å; N29-E33 PolarHBondContact O-N 3.02Å; E33-L35 VanDerWaalsContact C-N 3.35Å; E33-L35 PolarHBondContact O-N 3.04Å; E33-N36 PolarHBondContact O-N 3.06Å; E33-E37 WeakPolarHBondContact O-CB 3.49Å; E33-E37 PolarHBondContact O-N 3.36Å
34	T	53.9	Low	46	Very low	72 Å²	72	89.6 Å²	89.6	44%	0.442	46%	0.456	S	S	.	.	H	α-helix	trans	-56.1	-46.8	172.9	-56.7	0	0	0	0	111.6	S30 E37 Q38	S30-T34 WeakPolarHBondContact O-CB 3.32Å; S30-T34 PolarHBondContact O-N 3.22Å; S30-T34 PolarHBondContact O-OG1 3.39Å; T34-E37 PolarHBondContact O-N 2.92Å; T34-Q38 WeakPolarHBondContact O-CG 3.45Å; T34-Q38 PolarHBondContact O-N 2.91Å
35	L	50.1	Low	45.9	Very low	24 Å²	24	89.6 Å²	89.6	13%	0.126	46%	0.46	C	S	.	.	H	α-helix	trans	-65.2	-39.3	178.5	-72.6	171.5	0	0	0	112.5	V31 L32 E33 R39 C45 V47	V31-L35 HydrophobicContact CG1-CD1 4.26Å; V31-L35 VanDerWaalsContact O-CG 3.32Å; V31-L35 WeakPolarHBondContact O-CG 3.38Å; V31-L35 PolarHBondContact O-N 3.32Å; V31-L35 VanDerWaalsContact O-N 3.07Å; L32-L35 PolarHBondContact O-N 2.86Å; E33-L35 VanDerWaalsContact C-N 3.35Å; E33-L35 PolarHBondContact O-N 3.04Å; L35-R39 PolarHBondContact O-N 3.44Å; L35-C45 HydrophobicContact CD2-CB 4.49Å; L35-V47 HydrophobicContact CD1-CG2 4.33Å; L35-V47 HydrophobicContact CD2-CG2 3.85Å
36	N	49.7	Very low	45.7	Very low	62 Å²	62	88.8 Å²	88.8	33%	0.332	46%	0.461	S	S	.	.	H	α-helix	trans	-64.7	-40.6	174.9	-174.2	38.2	0	0	0	111.6	L32 E33 R39 N40	L32-N36 WeakPolarHBondContact O-CB 3.42Å; L32-N36 PolarHBondContact O-N 3.36Å; E33-N36 PolarHBondContact O-N 3.06Å; N36-R39 WeakPolarHBondContact O-CB 3.46Å; N36-R39 PolarHBondContact O-N 2.95Å; N36-R39 PolarHBondContact OD1-NH2 3.33Å; N36-N40 WeakPolarHBondContact O-CB 3.48Å; N36-N40 PolarHBondContact O-N 3.19Å; N36-N40 PolarHBondContact O-ND2 2.7Å; N36-N40 PolarHBondContact O-OD1 3.47Å
37	E	52.9	Low	45.7	Very low	92 Å²	92	84.7 Å²	84.7	43%	0.43	44%	0.439	S	S	.	.	H	α-helix	trans	-69.2	-37.1	179.4	-147.5	-173.6	128.9	0	0	112.2	E33 T34 N40 R41	E33-E37 WeakPolarHBondContact O-CB 3.49Å; E33-E37 PolarHBondContact O-N 3.36Å; T34-E37 PolarHBondContact O-N 2.92Å; E37-N40 PolarHBondContact O-N 3.16Å; E37-R41 VanDerWaalsContact CD-NH1 3.35Å; E37-R41 WeakPolarHBondContact O-CG 3.35Å; E37-R41 PolarHBondContact O-N 3.24Å; E37-R41 IonicContact OE1-CZ 3.68Å; E37-R41 IonicContact OE1-NH1 2.74Å; E37-R41 PolarHBondContact OE1-NH1 2.83Å; E37-R41 IonicContact OE1-NH2 3.62Å; E37-R41 PolarHBondContact OE1-NH2 3.08Å
38	Q	48.7	Very low	45.3	Very low	63 Å²	63	84.3 Å²	84.3	29%	0.294	44%	0.443	S	S	.	.	H	α-helix	trans	-67.8	-38.8	172.3	-63.5	-55.7	-22.5	0	0	112.4	T34 N40 R41 G42 H43	T34-Q38 WeakPolarHBondContact O-CG 3.45Å; T34-Q38 PolarHBondContact O-N 2.91Å; Q38-N40 VanDerWaalsContact C-N 3.33Å; Q38-N40 PolarHBondContact O-N 3.47Å; Q38-R41 PolarHBondContact O-N 3.24Å; Q38-G42 PolarHBondContact O-N 3.18Å; Q38-H43 PolarHBondContact O-N 3.24Å
39	R	45.6	Very low	45	Very low	107 Å²	107	83.5 Å²	83.5	40%	0.404	44%	0.436	S	S	.	.	H	α-helix	trans	-59.1	-45	171	-175.7	-162.9	70.6	165.3	2.2	111.2	L35 N36 R41 G42	L35-R39 PolarHBondContact O-N 3.44Å; N36-R39 WeakPolarHBondContact O-CB 3.46Å; N36-R39 PolarHBondContact O-N 2.95Å; N36-R39 PolarHBondContact OD1-NH2 3.33Å; R39-R41 PolarHBondContact O-N 2.79Å; R39-G42 WeakPolarHBondContact O-CA 3.47Å; R39-G42 PolarHBondContact O-N 3.26Å
40	N	50.2	Low	44.6	Very low	103 Å²	103	85.7 Å²	85.7	55%	0.551	44%	0.437	S	S	*	.	H	α-helix	trans	-69	-20	180	-61.7	-12.2	0	0	0	112.5	N36 E37 Q38 G42	N36-N40 WeakPolarHBondContact O-CB 3.48Å; N36-N40 PolarHBondContact O-N 3.19Å; N36-N40 PolarHBondContact O-ND2 2.7Å; N36-N40 PolarHBondContact O-OD1 3.47Å; E37-N40 PolarHBondContact O-N 3.16Å; Q38-N40 VanDerWaalsContact C-N 3.33Å; Q38-N40 PolarHBondContact O-N 3.47Å; N40-G42 VanDerWaalsContact C-N 3.3Å
41	R	51.7	Low	44.4	Very low	144 Å²	144	84.9 Å²	84.9	54%	0.543	43%	0.426	S	S	.	.	T	Hydrogen-bonded Turn	trans	-82.5	2.1	166.9	-71.4	-177.9	176.5	102	9.2	114.3	E37 Q38 R39	E37-R41 VanDerWaalsContact CD-NH1 3.35Å; E37-R41 WeakPolarHBondContact O-CG 3.35Å; E37-R41 PolarHBondContact O-N 3.24Å; E37-R41 IonicContact OE1-CZ 3.68Å; E37-R41 IonicContact OE1-NH1 2.74Å; E37-R41 PolarHBondContact OE1-NH1 2.83Å; E37-R41 IonicContact OE1-NH2 3.62Å; E37-R41 PolarHBondContact OE1-NH2 3.08Å; Q38-R41 PolarHBondContact O-N 3.24Å; R39-R41 PolarHBondContact O-N 2.79Å
42	G	36.5	Very low	43.7	Very low	51 Å²	51	87.2 Å²	87.2	53%	0.526	43%	0.434	S	S	.	.	T	Hydrogen-bonded Turn	trans	82.7	10.1	179.6	0	0	0	0	0	114.9	Q38 R39 N40	Q38-G42 PolarHBondContact O-N 3.18Å; R39-G42 WeakPolarHBondContact O-CA 3.47Å; R39-G42 PolarHBondContact O-N 3.26Å; N40-G42 VanDerWaalsContact C-N 3.3Å
43	H	42.1	Very low	42.6	Very low	111 Å²	111	87.4 Å²	87.4	51%	0.514	45%	0.446	S	S	.	.			trans	-89.4	109.9	176.7	-63.1	-45.9	0	0	0	111	Q38 C45	Q38-H43 PolarHBondContact O-N 3.24Å; H43-C45 PolarHBondContact O-N 3.06Å; H43-C45 VanDerWaalsContact O-N 3.14Å
44	F	36.9	Very low	41.9	Very low	204 Å²	204	84.9 Å²	84.9	90%	0.895	44%	0.442	S	S	*	.			trans	-76.8	94.9	173.1	-71.3	-85.4	0	0	0	110.7
45	C	39.9	Very low	41.2	Very low	61 Å²	61	84.2 Å²	84.2	41%	0.412	44%	0.435	S	S	.	.			trans	-85	118	172	-61.5	0	0	0	0	110.7	L35 H43 V47	L35-C45 HydrophobicContact CD2-CB 4.49Å; H43-C45 PolarHBondContact O-N 3.06Å; H43-C45 VanDerWaalsContact O-N 3.14Å; C45-V47 HydrophobicContact CB-CG2 4.24Å; C45-V47 PolarHBondContact O-N 3.04Å
46	D	34	Very low	40.7	Very low	134 Å²	134	85.6 Å²	85.6	72%	0.717	44%	0.442	S	S	*	.			trans	-85.8	89.9	-179.1	-160.6	22.4	0	0	0	110.8	T48	D46-T48 PolarHBondContact O-N 3.12Å
47	V	38.3	Very low	40	Very low	22 Å²	22	90.4 Å²	90.4	13%	0.133	46%	0.456	C	S	.	.			trans	-92.1	100.4	-168.5	-176.5	0	0	0	0	112	L35 C45 V49	L35-V47 HydrophobicContact CD1-CG2 4.33Å; L35-V47 HydrophobicContact CD2-CG2 3.85Å; C45-V47 HydrophobicContact CB-CG2 4.24Å; C45-V47 PolarHBondContact O-N 3.04Å; V47-V49 HydrophobicContact CG1-CG2 4.15Å; V47-V49 PolarHBondContact O-N 3.41Å
48	T	35.7	Very low	39.2	Very low	68 Å²	68	88.9 Å²	88.9	42%	0.417	46%	0.459	S	S	.	.			trans	-89.4	100.7	178.6	15.4	0	0	0	0	112.5	D46 R50	D46-T48 PolarHBondContact O-N 3.12Å; T48-R50 PolarHBondContact O-N 3.34Å
49	V	37.8	Very low	38.6	Very low	42 Å²	42	88.1 Å²	88.1	26%	0.255	46%	0.455	S	S	.	.			trans	-85.8	102.9	-179	-176.5	0	0	0	0	111.6	V47 L104	V47-V49 HydrophobicContact CG1-CG2 4.15Å; V47-V49 PolarHBondContact O-N 3.41Å; V49-L104 HydrophobicContact CG2-CD2 4.22Å
50	R	35.6	Very low	38	Very low	145 Å²	145	91.2 Å²	91.2	55%	0.547	47%	0.467	S	S	.	.			trans	-87.8	111.6	174.4	-69.1	-174.8	-179.4	159.8	5.4	112.4	T48 H52	T48-R50 PolarHBondContact O-N 3.34Å; R50-H52 PolarHBondContact O-N 2.9Å
51	I	39.1	Very low	37.1	Very low	58 Å²	58	90.3 Å²	90.3	30%	0.297	47%	0.468	S	S	.	.			trans	-75.8	120.7	173.7	-57	177	0	0	0	109.8	M55 I114	I51-M55 HydrophobicContact CG2-CE 4.13Å; I51-I114 HydrophobicContact CD1-CG1 3.88Å
52	H	35	Very low	36.5	Very low	96 Å²	96	87.4 Å²	87.4	44%	0.444	47%	0.466	S	S	.	.			trans	-78.4	136.3	179.2	-87.3	-92.7	0	0	0	112.9	N21 R50 S54 M55	N21-H52 PolarHBondContact OD1-NE2 3.5Å; R50-H52 PolarHBondContact O-N 2.9Å; H52-S54 PolarHBondContact O-N 3.36Å; H52-M55 PolarHBondContact O-N 2.84Å
53	G	30.7	Very low	36.4	Very low	46 Å²	46	89.2 Å²	89.2	47%	0.474	46%	0.463	S	S	.	.	T	Hydrogen-bonded Turn	trans	-68.2	7.3	179.6	0	0	0	0	0	116.1
54	S	36.6	Very low	35.9	Very low	77 Å²	77	86.5 Å²	86.5	54%	0.538	46%	0.46	S	S	.	.	T	Hydrogen-bonded Turn	trans	-76.9	-42.7	163.4	46.5	0	0	0	0	111.4	H52 R57 A58	H52-S54 PolarHBondContact O-N 3.36Å; S54-R57 WeakPolarHBondContact O-CA 3.38Å; S54-R57 VanDerWaalsContact O-CB 3.24Å; S54-R57 WeakPolarHBondContact O-CB 3.28Å; S54-R57 PolarHBondContact O-N 2.98Å; S54-A58 PolarHBondContact O-N 3.02Å; S54-A58 VanDerWaalsContact O-N 3.07Å
55	M	39.3	Very low	35.8	Very low	58 Å²	58	79.8 Å²	79.8	29%	0.286	44%	0.442	S	S	.	.	H	α-helix	trans	-66.2	-42.7	-177.2	-152.5	173.4	87.2	0	0	111.3	L24 I51 H52 R57 A58 H59	L24-M55 HydrophobicContact CB-CE 4.34Å; L24-M55 HydrophobicContact CB-SD 3.77Å; L24-M55 HydrophobicContact CD1-CE 4.49Å; L24-M55 HydrophobicContact CD2-CE 4.07Å; L24-M55 HydrophobicContact CD2-SD 4.38Å; I51-M55 HydrophobicContact CG2-CE 4.13Å; H52-M55 PolarHBondContact O-N 2.84Å; M55-R57 PolarHBondContact O-N 3.18Å; M55-A58 PolarHBondContact O-N 3.19Å; M55-H59 PolarHBondContact O-N 3.2Å
56	L	37.9	Very low	35.4	Very low	54 Å²	54	80.2 Å²	80.2	28%	0.283	46%	0.456	S	S	.	.	H	α-helix	trans	-63.7	-17.8	172	-56	-179.4	0	0	0	113.5	R60 A117	L56-R60 WeakPolarHBondContact O-CB 3.3Å; L56-R60 PolarHBondContact O-N 3.33Å; L56-A117 HydrophobicContact CD2-CB 3.49Å; L56-A117 VanDerWaalsContact CD2-CB 3.49Å
57	R	36.4	Very low	35.2	Very low	163 Å²	163	75.9 Å²	75.9	62%	0.615	44%	0.437	S	S	*	.	H	α-helix	trans	-87.1	-40.3	178.1	-161.6	178.3	-56.9	-119.5	-2.3	111.5	S54 M55 R60 C61	S54-R57 WeakPolarHBondContact O-CA 3.38Å; S54-R57 VanDerWaalsContact O-CB 3.24Å; S54-R57 WeakPolarHBondContact O-CB 3.28Å; S54-R57 PolarHBondContact O-N 2.98Å; M55-R57 PolarHBondContact O-N 3.18Å; R57-R60 PolarHBondContact O-N 2.93Å; R57-C61 PolarHBondContact O-N 3.3Å; R57-C61 VanDerWaalsContact O-N 3.07Å; R57-C61 PolarHBondContact O-SG 3.28Å
58	A	35.1	Very low	35.2	Very low	59 Å²	59	80 Å²	80	49%	0.488	46%	0.464	S	S	.	.	H	α-helix	trans	-57.4	-50.9	171.8	0	0	0	0	0	110.9	S54 M55 R60 C61 V62	S54-A58 PolarHBondContact O-N 3.02Å; S54-A58 VanDerWaalsContact O-N 3.07Å; M55-A58 PolarHBondContact O-N 3.19Å; A58-R60 VanDerWaalsContact C-N 3.34Å; A58-R60 PolarHBondContact O-N 3.42Å; A58-C61 WeakPolarHBondContact O-CA 3.37Å; A58-C61 WeakPolarHBondContact O-CB 3.43Å; A58-C61 PolarHBondContact O-N 2.66Å; A58-V62 PolarHBondContact O-N 2.74Å
59	H	36.4	Very low	35	Very low	48 Å²	48	85.8 Å²	85.8	22%	0.222	48%	0.483	C	S	.	.	H	α-helix	trans	-64.3	-33.6	176.7	-77	-77.3	0	0	0	113.6	M55 C61 V62 L63 L121	M55-H59 PolarHBondContact O-N 3.2Å; H59-C61 VanDerWaalsContact C-N 3.26Å; H59-C61 PolarHBondContact O-N 3.35Å; H59-V62 PolarHBondContact O-N 3.44Å; H59-L63 WeakPolarHBondContact O-CB 3.29Å; H59-L63 WeakPolarHBondContact O-CD1 3.44Å; H59-L63 VanDerWaalsContact O-CG 3.31Å; H59-L63 WeakPolarHBondContact O-CG 3.47Å; H59-L63 PolarHBondContact O-N 3.14Å; H59-L121 HydrophobicContact CB-CD2 3.86Å; H59-L121 WeakPolarHBondContact ND1-CD2 3.48Å
60	R	33.5	Very low	34.7	Very low	172 Å²	172	89.6 Å²	89.6	65%	0.649	50%	0.497	S	S	*	.	H	α-helix	trans	-63.4	-29.2	170.6	-97.3	-177.2	163.3	164.4	-2.5	113.5	L56 R57 A58 A64	L56-R60 WeakPolarHBondContact O-CB 3.3Å; L56-R60 PolarHBondContact O-N 3.33Å; R57-R60 PolarHBondContact O-N 2.93Å; A58-R60 VanDerWaalsContact C-N 3.34Å; A58-R60 PolarHBondContact O-N 3.42Å; R60-A64 WeakPolarHBondContact O-CB 3.42Å; R60-A64 PolarHBondContact O-N 3.08Å
61	C	30.9	Very low	34.8	Very low	84 Å²	84	89.3 Å²	89.3	57%	0.568	50%	0.502	S	S	*	.	H	α-helix	trans	-74.9	-42.4	172.4	-68.5	0	0	0	0	111.7	R57 A58 H59 L63 A64 A65	R57-C61 PolarHBondContact O-N 3.3Å; R57-C61 VanDerWaalsContact O-N 3.07Å; R57-C61 PolarHBondContact O-SG 3.28Å; A58-C61 WeakPolarHBondContact O-CA 3.37Å; A58-C61 WeakPolarHBondContact O-CB 3.43Å; A58-C61 PolarHBondContact O-N 2.66Å; H59-C61 VanDerWaalsContact C-N 3.26Å; H59-C61 PolarHBondContact O-N 3.35Å; C61-L63 PolarHBondContact O-N 3.17Å; C61-A64 PolarHBondContact O-N 3.03Å; C61-A65 PolarHBondContact O-N 3.19Å
62	V	38.7	Very low	34.6	Very low	82 Å²	82	93.7 Å²	93.7	50%	0.497	53%	0.526	S	S	.	.	H	α-helix	trans	-60.5	-44.7	175.5	176.3	0	0	0	0	111.4	A58 H59 A64 A65 G66	A58-V62 PolarHBondContact O-N 2.74Å; H59-V62 PolarHBondContact O-N 3.44Å; V62-A64 VanDerWaalsContact C-N 3.28Å; V62-A64 PolarHBondContact O-N 3.38Å; V62-A65 WeakPolarHBondContact O-CB 3.29Å; V62-A65 PolarHBondContact O-N 2.86Å; V62-G66 PolarHBondContact O-N 3.03Å; V62-G66 VanDerWaalsContact O-N 3.12Å
63	L	34.1	Very low	34.5	Very low	90 Å²	90	97.9 Å²	97.9	47%	0.471	54%	0.543	S	S	.	.	H	α-helix	trans	-68.5	-24.3	177.9	-69.2	161.3	0	0	0	113.4	H59 C61 I120	H59-L63 WeakPolarHBondContact O-CB 3.29Å; H59-L63 WeakPolarHBondContact O-CD1 3.44Å; H59-L63 VanDerWaalsContact O-CG 3.31Å; H59-L63 WeakPolarHBondContact O-CG 3.47Å; H59-L63 PolarHBondContact O-N 3.14Å; C61-L63 PolarHBondContact O-N 3.17Å; L63-I120 HydrophobicContact CD1-CG2 3.45Å; L63-I120 VanDerWaalsContact CD1-CG2 3.45Å; L63-I120 WeakPolarHBondContact CD1-O 3.4Å
64	A	32.5	Very low	34.5	Very low	54 Å²	54	102.5 Å²	102.5	45%	0.446	56%	0.556	S	S	.	*	H	α-helix	trans	-76.3	-35.5	171.6	0	0	0	0	0	112.1	R60 C61 V62 G66 S67	R60-A64 WeakPolarHBondContact O-CB 3.42Å; R60-A64 PolarHBondContact O-N 3.08Å; C61-A64 PolarHBondContact O-N 3.03Å; V62-A64 VanDerWaalsContact C-N 3.28Å; V62-A64 PolarHBondContact O-N 3.38Å; A64-G66 VanDerWaalsContact C-N 3.29Å; A64-G66 PolarHBondContact O-N 3.07Å; A64-S67 PolarHBondContact O-N 2.9Å; A64-S67 PolarHBondContact O-OG 3.1Å
65	A	33.5	Very low	34.4	Very low	63 Å²	63	106.2 Å²	106.2	52%	0.521	57%	0.569	S	S	.	*	H	α-helix	trans	-67.5	-27.9	174.8	0	0	0	0	0	112.7	C61 V62 S67	C61-A65 PolarHBondContact O-N 3.19Å; V62-A65 WeakPolarHBondContact O-CB 3.29Å; V62-A65 PolarHBondContact O-N 2.86Å; A65-S67 PolarHBondContact O-N 3.14Å; A65-S67 VanDerWaalsContact O-N 3.14Å
66	G	33.2	Very low	34.2	Very low	69 Å²	69	110.3 Å²	110.3	71%	0.711	59%	0.591	S	S	*	*	T	Hydrogen-bonded Turn	trans	-72.8	11.4	172.9	0	0	0	0	0	115.8	V62 A64	V62-G66 PolarHBondContact O-N 3.03Å; V62-G66 VanDerWaalsContact O-N 3.12Å; A64-G66 VanDerWaalsContact C-N 3.29Å; A64-G66 PolarHBondContact O-N 3.07Å
67	S	29.7	Very low	34	Very low	44 Å²	44	111.2 Å²	111.2	31%	0.308	61%	0.613	S	S	.	*	S	Bend	trans	-91.4	142	174.8	65.7	0	0	0	0	111.3	A64 A65 F69 F70	A64-S67 PolarHBondContact O-N 2.9Å; A64-S67 PolarHBondContact O-OG 3.1Å; A65-S67 PolarHBondContact O-N 3.14Å; A65-S67 VanDerWaalsContact O-N 3.14Å; S67-F69 PolarHBondContact O-N 3.42Å; S67-F70 PolarHBondContact O-N 2.9Å
68	P	37.8	Very low	33.5	Very low	109 Å²	109	113.7 Å²	113.7	71%	0.708	62%	0.624	S	S	*	*	T	Hydrogen-bonded Turn	trans	-65.3	-5.9	-176.5	26.5	-35.3	0	0	0	114	F70	P68-F70 VanDerWaalsContact C-N 3.27Å; P68-F70 PolarHBondContact O-N 2.87Å
69	F	32.4	Very low	33.1	Very low	188 Å²	188	116.1 Å²	116.1	83%	0.825	64%	0.638	S	S	*	*	T	Hydrogen-bonded Turn	trans	-78.9	-5.2	177.8	-144.2	-91.5	0	0	0	113.9	S67	S67-F69 PolarHBondContact O-N 3.42Å
70	F	29.9	Very low	32.6	Very low	122 Å²	122	121.5 Å²	121.5	54%	0.535	67%	0.668	S	S	.	*	S	Bend	trans	-113	-8.1	-175.6	-91.9	-85.4	0	0	0	115.7	S67 P68 K73	S67-F70 PolarHBondContact O-N 2.9Å; P68-F70 VanDerWaalsContact C-N 3.27Å; P68-F70 PolarHBondContact O-N 2.87Å; F70-K73 PolarHBondContact O-N 3.34Å
71	Q	38.1	Very low	32.3	Very low	139 Å²	139	120 Å²	120	65%	0.65	67%	0.671	S	S	*	*	G	3₁₀ helix	trans	-66.4	-41.2	-178.1	-69.2	179.9	-63.3	0	0	112.2	K73 L74	Q71-K73 PolarHBondContact O-N 3.39Å; Q71-L74 PolarHBondContact O-N 3.36Å
72	D	35.1	Very low	32	Very low	151 Å²	151	125 Å²	125	81%	0.807	69%	0.687	S	S	*	*	G	3₁₀ helix	trans	-62.3	-5.9	-179	-70.3	-10	0	0	0	115.6
73	K	32.4	Very low	31.3	Very low	183 Å²	183	127.1 Å²	127.1	80%	0.796	69%	0.694	S	S	*	*	G	3₁₀ helix	trans	-124.6	8.1	179.1	-65.2	-156.4	173.7	-163.8	0	115.4	F70 Q71	F70-K73 PolarHBondContact O-N 3.34Å; Q71-K73 PolarHBondContact O-N 3.39Å
74	L	31.5	Very low	31	Very low	143 Å²	143	127.7 Å²	127.7	75%	0.749	70%	0.703	S	S	*	*	S	Bend	trans	-89.2	-5.5	168.2	-81.4	162.8	0	0	0	113.3	Q71 L76	Q71-L74 PolarHBondContact O-N 3.36Å; L74-L76 PolarHBondContact O-N 3.36Å
75	L	33.8	Very low	30.9	Very low	155 Å²	155	130.2 Å²	130.2	81%	0.812	72%	0.717	S	S	*	*			trans	-81.4	17.4	-179.8	-114.3	158.2	0	0	0	114.7
76	L	35	Very low	31	Very low	145 Å²	145	133.4 Å²	133.4	76%	0.759	73%	0.73	S	S	*	*	S	Bend	trans	-127.3	69.6	178.6	-79	171.9	0	0	0	112.1	L74 Y78	L74-L76 PolarHBondContact O-N 3.36Å; L76-Y78 WeakPolarHBondContact O-CD2 3.41Å; L76-Y78 PolarHBondContact O-N 3.16Å; L76-Y78 VanDerWaalsContact O-N 3.16Å
77	G	33.4	Very low	31.2	Very low	72 Å²	72	132.7 Å²	132.7	74%	0.742	71%	0.711	S	S	*	*			trans	57.9	39.4	140.5	0	0	0	0	0	119.2
78	Y	26.5	Very low	31.8	Very low	216 Å²	216	132.9 Å²	132.9	85%	0.847	71%	0.713	S	S	*	*			trans	-123.2	68.3	166.4	-77	-83.9	0	0	0	111.3	L76 D80	L76-Y78 WeakPolarHBondContact O-CD2 3.41Å; L76-Y78 PolarHBondContact O-N 3.16Å; L76-Y78 VanDerWaalsContact O-N 3.16Å; Y78-D80 PolarHBondContact O-N 3.07Å; Y78-D80 VanDerWaalsContact O-N 3.16Å
79	S	27.5	Very low	31.9	Very low	110 Å²	110	133.4 Å²	133.4	77%	0.769	71%	0.714	S	S	*	*			trans	-69.9	93.9	155.8	49.8	0	0	0	0	108.7
80	D	26	Very low	32.3	Very low	161 Å²	161	131.3 Å²	131.3	86%	0.861	71%	0.706	S	S	*	*			trans	178.1	62.4	151.8	-89.6	-14.3	0	0	0	109.7	Y78	Y78-D80 PolarHBondContact O-N 3.07Å; Y78-D80 VanDerWaalsContact O-N 3.16Å
81	I	26.1	Very low	33.2	Very low	139 Å²	139	128.3 Å²	128.3	71%	0.713	70%	0.701	S	S	*	*			trans	-126.5	90	164.2	-56.7	-179.8	0	0	0	106.7	I83	I81-I83 HydrophobicContact CG2-CG1 4.22Å; I81-I83 PolarHBondContact O-N 3.42Å
82	E	24.8	Very low	33.7	Very low	191 Å²	191	123.6 Å²	123.6	89%	0.893	68%	0.679	S	S	*	*			trans	-61.3	110.1	163.6	-68.4	-166.6	140	0	0	108.5	P84	E82-P84 WeakPolarHBondContact O-CD 3.41Å
83	I	24.1	Very low	34.2	Very low	126 Å²	126	121 Å²	121	65%	0.646	66%	0.662	S	S	*	*			trans	-85	114.2	171.8	-59.7	175.8	0	0	0	106.6	I81 S85	I81-I83 HydrophobicContact CG2-CG1 4.22Å; I81-I83 PolarHBondContact O-N 3.42Å; I83-S85 PolarHBondContact O-N 2.94Å
84	P	28.1	Very low	35.2	Very low	102 Å²	102	116.1 Å²	116.1	66%	0.662	64%	0.641	S	S	*	*			trans	-57	135.6	178	-25.5	36.2	0	0	0	110.7	E82	E82-P84 WeakPolarHBondContact O-CD 3.41Å
85	S	30.6	Very low	36.1	Very low	107 Å²	107	113 Å²	113	75%	0.748	63%	0.625	S	S	*	*			trans	-60.1	149.4	-157.1	55.7	0	0	0	0	115.2	I83 V87	I83-S85 PolarHBondContact O-N 2.94Å; S85-V87 PolarHBondContact O-N 3.23Å
86	V	34.3	Very low	37	Very low	130 Å²	130	106.5 Å²	106.5	79%	0.788	59%	0.591	S	S	*	*			trans	-32.8	127.7	164.4	-179.7	0	0	0	0	112.2	S88	V86-S88 PolarHBondContact O-N 2.96Å
87	V	39.3	Very low	37.8	Very low	53 Å²	53	103.5 Å²	103.5	32%	0.321	58%	0.576	S	S	.	*			trans	-58.3	111.7	168.8	178.6	0	0	0	0	108	S85 I92	S85-V87 PolarHBondContact O-N 3.23Å; V87-I92 HydrophobicContact CG1-CD1 4.44Å; V87-I92 HydrophobicContact CG1-CG1 4.14Å
88	S	40.7	Very low	38.8	Very low	48 Å²	48	101.6 Å²	101.6	34%	0.336	55%	0.547	S	S	.	.			trans	-62.7	147.2	-168.9	86.1	0	0	0	0	112	V86 Q90 S91 I92	V86-S88 PolarHBondContact O-N 2.96Å; S88-Q90 PolarHBondContact O-N 3.49Å; S88-S91 WeakPolarHBondContact O-CA 3.42Å; S88-S91 VanDerWaalsContact O-CB 3.29Å; S88-S91 WeakPolarHBondContact O-CB 3.19Å; S88-S91 PolarHBondContact O-N 3.01Å; S88-S91 PolarHBondContact OG-N 3.38Å; S88-S91 PolarHBondContact OG-OG 3.4Å; S88-I92 PolarHBondContact O-N 3.36Å
89	V	40	Very low	39.9	Very low	120 Å²	120	92.5 Å²	92.5	73%	0.727	51%	0.512	S	S	*	.	H	α-helix	trans	-58.5	-32.8	175.6	-178	0	0	0	0	110.9	S91 I92 Q93	V89-S91 PolarHBondContact O-N 3.44Å; V89-I92 PolarHBondContact O-N 2.99Å; V89-Q93 PolarHBondContact O-N 3.07Å
90	Q	41.1	Very low	40.7	Very low	144 Å²	144	94 Å²	94	67%	0.673	50%	0.502	S	S	*	.	H	α-helix	trans	-65.8	-34.4	173.3	-65.7	-177.2	-4.2	0	0	113.1	S88 I92 K94	S88-Q90 PolarHBondContact O-N 3.49Å; Q90-I92 VanDerWaalsContact C-N 3.32Å; Q90-K94 WeakPolarHBondContact O-CB 3.3Å; Q90-K94 VanDerWaalsContact O-CG 3.27Å; Q90-K94 WeakPolarHBondContact O-CG 3.27Å; Q90-K94 PolarHBondContact O-N 3.06Å
91	S	48.3	Very low	41.9	Very low	60 Å²	60	88.7 Å²	88.7	42%	0.42	48%	0.478	S	S	.	.	H	α-helix	trans	-66.5	-36.1	174.3	-53.8	0	0	0	0	111.5	S88 V89 L95	S88-S91 WeakPolarHBondContact O-CA 3.42Å; S88-S91 VanDerWaalsContact O-CB 3.29Å; S88-S91 WeakPolarHBondContact O-CB 3.19Å; S88-S91 PolarHBondContact O-N 3.01Å; S88-S91 PolarHBondContact OG-N 3.38Å; S88-S91 PolarHBondContact OG-OG 3.4Å; V89-S91 PolarHBondContact O-N 3.44Å; S91-L95 PolarHBondContact O-N 3.04Å
92	I	48.5	Very low	42.8	Very low	39 Å²	39	84.6 Å²	84.6	20%	0.2	47%	0.47	C	S	.	.	H	α-helix	trans	-72.8	-44.8	176.5	-62	165.9	0	0	0	110.3	V87 S88 V89 Q90 K94 L95 I96 I123 V126	V87-I92 HydrophobicContact CG1-CD1 4.44Å; V87-I92 HydrophobicContact CG1-CG1 4.14Å; S88-I92 PolarHBondContact O-N 3.36Å; V89-I92 PolarHBondContact O-N 2.99Å; Q90-I92 VanDerWaalsContact C-N 3.32Å; I92-K94 PolarHBondContact O-N 3.42Å; I92-L95 WeakPolarHBondContact O-CB 3.5Å; I92-L95 PolarHBondContact O-N 3.5Å; I92-I96 HydrophobicContact CG2-CD1 4.04Å; I92-I96 WeakPolarHBondContact O-CG1 3.38Å; I92-I96 PolarHBondContact O-N 3.4Å; I92-I96 VanDerWaalsContact O-N 3.08Å; I92-I123 HydrophobicContact CD1-CD1 3.94Å; I92-I123 HydrophobicContact CG2-CG2 4.23Å; I92-V126 HydrophobicContact CG2-CG2 4.17Å
93	Q	45.7	Very low	43.9	Very low	96 Å²	96	77.3 Å²	77.3	45%	0.449	44%	0.436	S	S	.	.	H	α-helix	trans	-60.4	-46.5	176.3	-171.6	60.3	49.5	0	0	111.4	V89 L95 I96 D97	V89-Q93 PolarHBondContact O-N 3.07Å; Q93-L95 VanDerWaalsContact C-N 3.25Å; Q93-L95 PolarHBondContact O-N 3.15Å; Q93-I96 WeakPolarHBondContact O-CA 3.47Å; Q93-I96 WeakPolarHBondContact O-CB 3.36Å; Q93-I96 PolarHBondContact O-N 3.16Å; Q93-D97 PolarHBondContact NE2-OD1 2.7Å; Q93-D97 PolarHBondContact O-N 3Å
94	K	52.8	Low	44.8	Very low	81 Å²	81	72.8 Å²	72.8	35%	0.352	41%	0.413	S	S	.	.	H	α-helix	trans	-58.2	-34.9	175.6	-76.5	172.8	177.7	176.2	0	113	N29 Q90 I92 F98	N29-K94 PolarHBondContact OD1-NZ 3.17Å; Q90-K94 WeakPolarHBondContact O-CB 3.3Å; Q90-K94 VanDerWaalsContact O-CG 3.27Å; Q90-K94 WeakPolarHBondContact O-CG 3.27Å; Q90-K94 PolarHBondContact O-N 3.06Å; I92-K94 PolarHBondContact O-N 3.42Å; K94-F98 WeakPolarHBondContact O-CB 3.32Å; K94-F98 PolarHBondContact O-N 2.94Å
95	L	51.1	Low	45.6	Very low	78 Å²	78	78.1 Å²	78.1	41%	0.408	42%	0.421	S	S	.	.	H	α-helix	trans	-67.6	-41.6	174.8	-175.9	66.5	0	0	0	111.7	S91 I92 Q93 F98 M99 L104	S91-L95 PolarHBondContact O-N 3.04Å; I92-L95 WeakPolarHBondContact O-CB 3.5Å; I92-L95 PolarHBondContact O-N 3.5Å; Q93-L95 VanDerWaalsContact C-N 3.25Å; Q93-L95 PolarHBondContact O-N 3.15Å; L95-F98 PolarHBondContact O-N 3.09Å; L95-M99 WeakPolarHBondContact O-CG 3.34Å; L95-M99 PolarHBondContact O-N 3.12Å; L95-L104 HydrophobicContact CD1-CD1 4.19Å
96	I	51.9	Low	46.4	Very low	19 Å²	19	75 Å²	75	10%	0.097	40%	0.396	C	S	.	.	H	α-helix	trans	-64.7	-46.8	176.3	-67.4	166.5	0	0	0	110.6	I92 Q93 F98 M99 Y100 V126	I92-I96 HydrophobicContact CG2-CD1 4.04Å; I92-I96 WeakPolarHBondContact O-CG1 3.38Å; I92-I96 PolarHBondContact O-N 3.4Å; I92-I96 VanDerWaalsContact O-N 3.08Å; Q93-I96 WeakPolarHBondContact O-CA 3.47Å; Q93-I96 WeakPolarHBondContact O-CB 3.36Å; Q93-I96 PolarHBondContact O-N 3.16Å; I96-F98 VanDerWaalsContact C-N 3.27Å; I96-F98 PolarHBondContact O-N 3.21Å; I96-M99 WeakPolarHBondContact O-CB 3.44Å; I96-M99 PolarHBondContact O-N 3.48Å; I96-M99 VanDerWaalsContact O-N 3.12Å; I96-Y100 HydrophobicContact CG2-CD2 3.7Å; I96-Y100 HydrophobicContact CG2-CE2 3.42Å; I96-Y100 VanDerWaalsContact CG2-CE2 3.42Å; I96-Y100 VanDerWaalsContact O-CD2 3.32Å; I96-Y100 WeakPolarHBondContact O-CD2 3.37Å; I96-Y100 PolarHBondContact O-N 3.14Å; I96-V126 HydrophobicContact CD1-CG2 3.87Å; I96-V126 HydrophobicContact CG1-CG2 4Å
97	D	53.2	Low	46.9	Very low	82 Å²	82	71.1 Å²	71.1	44%	0.439	38%	0.375	S	S	.	.	H	α-helix	trans	-60	-39	177.2	-58.3	-24.2	0	0	0	111.2	Q93 Y100 S101	Q93-D97 PolarHBondContact NE2-OD1 2.7Å; Q93-D97 PolarHBondContact O-N 3Å; D97-Y100 PolarHBondContact O-N 2.89Å; D97-S101 WeakPolarHBondContact O-CB 3.35Å; D97-S101 PolarHBondContact O-N 3.42Å
98	F	53.4	Low	46.9	Very low	31 Å²	31	74.4 Å²	74.4	14%	0.136	39%	0.387	C	S	.	.	H	α-helix	trans	-71.2	-30.3	177.4	-139.7	-102	0	0	0	112.8	L32 K94 L95 I96 S101 I103 L104	L32-F98 HydrophobicContact CD1-CD2 3.65Å; L32-F98 HydrophobicContact CD1-CE2 3.45Å; L32-F98 VanDerWaalsContact CD1-CE2 3.45Å; L32-F98 HydrophobicContact CD1-CG 4.48Å; L32-F98 HydrophobicContact CD1-CZ 4.15Å; L32-F98 HydrophobicContact CG-CE2 4.24Å; K94-F98 WeakPolarHBondContact O-CB 3.32Å; K94-F98 PolarHBondContact O-N 2.94Å; L95-F98 PolarHBondContact O-N 3.09Å; I96-F98 VanDerWaalsContact C-N 3.27Å; I96-F98 PolarHBondContact O-N 3.21Å; F98-S101 WeakPolarHBondContact CA-OG 3.43Å; F98-S101 PolarHBondContact O-OG 3.21Å; F98-I103 HydrophobicContact CD1-CB 4.08Å; F98-I103 HydrophobicContact CD1-CD1 4.49Å; F98-I103 HydrophobicContact CD1-CG2 4.32Å; F98-I103 HydrophobicContact CD2-CD1 4.34Å; F98-I103 HydrophobicContact CE1-CB 3.68Å; F98-I103 HydrophobicContact CE1-CD1 3.96Å; F98-I103 HydrophobicContact CE1-CG1 4.45Å; F98-I103 HydrophobicContact CE1-CG2 3.48Å; F98-I103 VanDerWaalsContact CE1-CG2 3.48Å; F98-I103 HydrophobicContact CE2-CD1 3.77Å; F98-I103 HydrophobicContact CZ-CB 4.18Å; F98-I103 HydrophobicContact CZ-CD1 3.57Å; F98-I103 HydrophobicContact CZ-CG1 4.5Å; F98-I103 HydrophobicContact CZ-CG2 3.9Å; F98-L104 HydrophobicContact CB-CD1 4.32Å; F98-L104 HydrophobicContact CD1-CD1 3.83Å; F98-L104 HydrophobicContact CD1-CG 3.9Å
99	M	50.1	Low	47.1	Very low	25 Å²	25	75.7 Å²	75.7	12%	0.123	40%	0.396	C	S	.	.	H	α-helix	trans	-65.9	-47.8	168.7	-73.2	169.3	51.9	0	0	111.4	L95 I96 S101 G102 L104 E129 I133	L95-M99 WeakPolarHBondContact O-CG 3.34Å; L95-M99 PolarHBondContact O-N 3.12Å; I96-M99 WeakPolarHBondContact O-CB 3.44Å; I96-M99 PolarHBondContact O-N 3.48Å; I96-M99 VanDerWaalsContact O-N 3.12Å; M99-S101 VanDerWaalsContact C-N 3.25Å; M99-S101 PolarHBondContact O-N 3.18Å; M99-G102 PolarHBondContact O-N 2.93Å; M99-L104 HydrophobicContact CG-CD1 4.45Å; M99-E129 HydrophobicContact CE-CG 4.02Å; M99-I133 HydrophobicContact CE-CD1 3.55Å
100	Y	44.2	Very low	47.8	Very low	142 Å²	142	72.2 Å²	72.2	56%	0.557	37%	0.372	S	S	*	.	H	α-helix	trans	-64.6	-27.8	176.2	-74	-58.9	0	0	0	113.4	I96 D97 G102 E129	I96-Y100 HydrophobicContact CG2-CD2 3.7Å; I96-Y100 HydrophobicContact CG2-CE2 3.42Å; I96-Y100 VanDerWaalsContact CG2-CE2 3.42Å; I96-Y100 VanDerWaalsContact O-CD2 3.32Å; I96-Y100 WeakPolarHBondContact O-CD2 3.37Å; I96-Y100 PolarHBondContact O-N 3.14Å; D97-Y100 PolarHBondContact O-N 2.89Å; Y100-G102 PolarHBondContact O-N 3.48Å; Y100-E129 VanDerWaalsContact CE1-OE1 3.3Å; Y100-E129 WeakPolarHBondContact CE1-OE1 3.39Å; Y100-E129 VanDerWaalsContact OH-CD 3.3Å; Y100-E129 PolarHBondContact OH-OE2 3Å
101	S	52.1	Low	48.4	Very low	49 Å²	49	65.7 Å²	65.7	34%	0.343	34%	0.342	S	S	.	.	T	Hydrogen-bonded Turn	trans	-68.4	-7.8	175.9	80.7	0	0	0	0	114.9	D97 F98 M99 I103	D97-S101 WeakPolarHBondContact O-CB 3.35Å; D97-S101 PolarHBondContact O-N 3.42Å; F98-S101 WeakPolarHBondContact CA-OG 3.43Å; F98-S101 PolarHBondContact O-OG 3.21Å; M99-S101 VanDerWaalsContact C-N 3.25Å; M99-S101 PolarHBondContact O-N 3.18Å; S101-I103 PolarHBondContact O-N 3.36Å; S101-I103 VanDerWaalsContact OG-CD1 3.28Å; S101-I103 WeakPolarHBondContact OG-CD1 3.38Å; S101-I103 VanDerWaalsContact OG-CG1 3.29Å; S101-I103 WeakPolarHBondContact OG-CG1 3.24Å
102	G	45	Very low	48.5	Very low	53 Å²	53	67.6 Å²	67.6	55%	0.546	35%	0.348	S	S	.	.	T	Hydrogen-bonded Turn	trans	74.2	0.7	178.9	0	0	0	0	0	115.6	M99 Y100	M99-G102 PolarHBondContact O-N 2.93Å; Y100-G102 PolarHBondContact O-N 3.48Å
103	I	46.8	Very low	48.7	Very low	38 Å²	38	71.3 Å²	71.3	20%	0.195	36%	0.364	C	S	.	.			trans	-73.2	-35.9	-179.4	-55.4	166.9	0	0	0	111.1	F98 S101 R105	F98-I103 HydrophobicContact CD1-CB 4.08Å; F98-I103 HydrophobicContact CD1-CD1 4.49Å; F98-I103 HydrophobicContact CD1-CG2 4.32Å; F98-I103 HydrophobicContact CD2-CD1 4.34Å; F98-I103 HydrophobicContact CE1-CB 3.68Å; F98-I103 HydrophobicContact CE1-CD1 3.96Å; F98-I103 HydrophobicContact CE1-CG1 4.45Å; F98-I103 HydrophobicContact CE1-CG2 3.48Å; F98-I103 VanDerWaalsContact CE1-CG2 3.48Å; F98-I103 HydrophobicContact CE2-CD1 3.77Å; F98-I103 HydrophobicContact CZ-CB 4.18Å; F98-I103 HydrophobicContact CZ-CD1 3.57Å; F98-I103 HydrophobicContact CZ-CG1 4.5Å; F98-I103 HydrophobicContact CZ-CG2 3.9Å; S101-I103 PolarHBondContact O-N 3.36Å; S101-I103 VanDerWaalsContact OG-CD1 3.28Å; S101-I103 WeakPolarHBondContact OG-CD1 3.38Å; S101-I103 VanDerWaalsContact OG-CG1 3.29Å; S101-I103 WeakPolarHBondContact OG-CG1 3.24Å; I103-R105 PolarHBondContact O-N 3.23Å
104	L	44.2	Very low	49.2	Very low	31 Å²	31	68.6 Å²	68.6	16%	0.162	35%	0.352	C	S	.	.			trans	-87.3	99.3	177.9	-88	166.9	0	0	0	112.2	V49 L95 F98 M99 V106	V49-L104 HydrophobicContact CG2-CD2 4.22Å; L95-L104 HydrophobicContact CD1-CD1 4.19Å; F98-L104 HydrophobicContact CB-CD1 4.32Å; F98-L104 HydrophobicContact CD1-CD1 3.83Å; F98-L104 HydrophobicContact CD1-CG 3.9Å; M99-L104 HydrophobicContact CG-CD1 4.45Å; L104-V106 HydrophobicContact CB-CG2 4.38Å; L104-V106 PolarHBondContact O-N 2.93Å
105	R	43.7	Very low	49.2	Very low	215 Å²	215	66.4 Å²	66.4	81%	0.811	34%	0.344	S	S	*	.			trans	-85.5	94.8	164.3	-72.1	-174.2	173.8	-171.1	-2.3	110.3	I103	I103-R105 PolarHBondContact O-N 3.23Å
106	V	48.4	Very low	49.2	Very low	40 Å²	40	66.3 Å²	66.3	24%	0.242	35%	0.347	C	S	.	.			trans	-84.3	124.8	178.8	-172.3	0	0	0	0	110.1	L104 E110 A111 I114	L104-V106 HydrophobicContact CB-CG2 4.38Å; L104-V106 PolarHBondContact O-N 2.93Å; V106-E110 HydrophobicContact CG1-CB 3.83Å; V106-A111 HydrophobicContact CG1-CB 3.82Å; V106-A111 VanDerWaalsContact CG1-N 3.32Å; V106-I114 HydrophobicContact CG1-CD1 3.84Å; V106-I114 HydrophobicContact CG2-CD1 4.49Å
107	S	45	Very low	49.3	Very low	49 Å²	49	65.9 Å²	65.9	34%	0.343	35%	0.346	S	S	.	.			trans	-70.4	155.6	175.4	73.9	0	0	0	0	111.7	S109 E110 A111	S107-S109 PolarHBondContact O-N 3.17Å; S107-S109 VanDerWaalsContact O-N 3.12Å; S107-S109 PolarHBondContact OG-OG 2.81Å; S107-E110 WeakPolarHBondContact CB-OE2 3.31Å; S107-E110 PolarHBondContact N-OE2 3.47Å; S107-E110 PolarHBondContact O-N 3.4Å; S107-E110 VanDerWaalsContact OG-CD 3.25Å; S107-E110 WeakPolarHBondContact OG-CG 3.49Å; S107-E110 PolarHBondContact OG-OE2 3.13Å; S107-A111 WeakPolarHBondContact O-CB 3.37Å; S107-A111 PolarHBondContact O-N 3.24Å
108	Q	39.1	Very low	49.3	Very low	123 Å²	123	62.2 Å²	62.2	58%	0.575	33%	0.327	S	S	*	.	H	α-helix	trans	-57.4	-33.3	-174.2	-164.3	-177.3	26.2	0	0	113.4	L112 V134	Q108-L112 PolarHBondContact O-N 3.17Å; Q108-L112 VanDerWaalsContact O-N 3.16Å; Q108-V134 HydrophobicContact CG-CG1 4.33Å
109	S	44.3	Very low	49	Very low	75 Å²	75	63.6 Å²	63.6	52%	0.524	34%	0.341	S	S	.	.	H	α-helix	trans	-78.8	-27.1	177.6	56.2	0	0	0	0	113.5	S107 Q113	S107-S109 PolarHBondContact O-N 3.17Å; S107-S109 VanDerWaalsContact O-N 3.12Å; S107-S109 PolarHBondContact OG-OG 2.81Å; S109-Q113 WeakPolarHBondContact O-CG 3.31Å; S109-Q113 PolarHBondContact O-N 3.15Å; S109-Q113 PolarHBondContact O-NE2 3.43Å
110	E	54	Low	48.9	Very low	47 Å²	47	64.3 Å²	64.3	22%	0.22	35%	0.345	C	S	.	.	H	α-helix	trans	-79.4	-38.6	172.5	-70.5	164.9	143.1	0	0	110.8	V106 S107 L112 Q113 I114	V106-E110 HydrophobicContact CG1-CB 3.83Å; S107-E110 WeakPolarHBondContact CB-OE2 3.31Å; S107-E110 PolarHBondContact N-OE2 3.47Å; S107-E110 PolarHBondContact O-N 3.4Å; S107-E110 VanDerWaalsContact OG-CD 3.25Å; S107-E110 WeakPolarHBondContact OG-CG 3.49Å; S107-E110 PolarHBondContact OG-OE2 3.13Å; E110-L112 VanDerWaalsContact C-N 3.29Å; E110-L112 PolarHBondContact O-N 3.47Å; E110-Q113 WeakPolarHBondContact O-CB 3.46Å; E110-Q113 PolarHBondContact O-N 3.24Å; E110-I114 WeakPolarHBondContact O-CG1 3.35Å; E110-I114 PolarHBondContact O-N 3.07Å
111	A	53.8	Low	49.2	Very low	6 Å²	6	60.7 Å²	60.7	5%	0.05	33%	0.334	C	S	.	.	H	α-helix	trans	-58.9	-41.7	172.8	0	0	0	0	0	110.9	V106 S107 Q113 I114 L115 V134	V106-A111 HydrophobicContact CG1-CB 3.82Å; V106-A111 VanDerWaalsContact CG1-N 3.32Å; S107-A111 WeakPolarHBondContact O-CB 3.37Å; S107-A111 PolarHBondContact O-N 3.24Å; A111-Q113 VanDerWaalsContact C-N 3.31Å; A111-Q113 PolarHBondContact O-N 3.31Å; A111-I114 PolarHBondContact O-N 3.37Å; A111-L115 VanDerWaalsContact O-CB 3.25Å; A111-L115 WeakPolarHBondContact O-CB 3.13Å; A111-L115 PolarHBondContact O-N 3.34Å; A111-V134 HydrophobicContact CB-CG2 3.61Å
112	L	50.6	Low	49	Very low	101 Å²	101	66.3 Å²	66.3	53%	0.529	36%	0.355	S	S	.	.	H	α-helix	trans	-64.4	-33	175	-142.7	77.4	0	0	0	113.1	Q108 E110 T116	Q108-L112 PolarHBondContact O-N 3.17Å; Q108-L112 VanDerWaalsContact O-N 3.16Å; E110-L112 VanDerWaalsContact C-N 3.29Å; E110-L112 PolarHBondContact O-N 3.47Å; L112-T116 WeakPolarHBondContact O-CB 3.2Å; L112-T116 PolarHBondContact O-N 2.81Å; L112-T116 PolarHBondContact O-OG1 3.49Å
113	Q	53.4	Low	49.5	Very low	117 Å²	117	65.6 Å²	65.6	55%	0.547	34%	0.339	S	S	.	.	H	α-helix	trans	-72.4	-42	175.4	-73.4	168.4	77.6	0	0	111.7	S109 E110 A111 T116 A117	S109-Q113 WeakPolarHBondContact O-CG 3.31Å; S109-Q113 PolarHBondContact O-N 3.15Å; S109-Q113 PolarHBondContact O-NE2 3.43Å; E110-Q113 WeakPolarHBondContact O-CB 3.46Å; E110-Q113 PolarHBondContact O-N 3.24Å; A111-Q113 VanDerWaalsContact C-N 3.31Å; A111-Q113 PolarHBondContact O-N 3.31Å; Q113-T116 PolarHBondContact O-N 2.92Å; Q113-A117 WeakPolarHBondContact O-CB 3.49Å; Q113-A117 PolarHBondContact O-N 3.41Å
114	I	56.5	Low	49.4	Very low	38 Å²	38	70.7 Å²	70.7	20%	0.195	36%	0.359	C	S	.	.	H	α-helix	trans	-63.3	-44	173.5	-66.8	164	0	0	0	110.2	I51 V106 E110 A111 T116 A117 A118 V126	I51-I114 HydrophobicContact CD1-CG1 3.88Å; V106-I114 HydrophobicContact CG1-CD1 3.84Å; V106-I114 HydrophobicContact CG2-CD1 4.49Å; E110-I114 WeakPolarHBondContact O-CG1 3.35Å; E110-I114 PolarHBondContact O-N 3.07Å; A111-I114 PolarHBondContact O-N 3.37Å; I114-T116 VanDerWaalsContact C-N 3.34Å; I114-T116 PolarHBondContact O-N 2.81Å; I114-A117 WeakPolarHBondContact O-CB 3.42Å; I114-A117 PolarHBondContact O-N 3.5Å; I114-A117 VanDerWaalsContact O-N 3.15Å; I114-A118 WeakPolarHBondContact O-CB 3.44Å; I114-A118 PolarHBondContact O-N 3.12Å; I114-V126 HydrophobicContact CG2-CG1 4.31Å
115	L	53.3	Low	49.9	Very low	35 Å²	35	73.7 Å²	73.7	18%	0.183	38%	0.379	C	S	.	.	H	α-helix	trans	-60.1	-43.4	175.8	-163.1	79.9	0	0	0	111.8	A111 A117 A118 S119 I127 C130 T131	A111-L115 VanDerWaalsContact O-CB 3.25Å; A111-L115 WeakPolarHBondContact O-CB 3.13Å; A111-L115 PolarHBondContact O-N 3.34Å; L115-A117 VanDerWaalsContact C-N 3.34Å; L115-A118 PolarHBondContact O-N 3.36Å; L115-S119 VanDerWaalsContact O-CB 3.28Å; L115-S119 WeakPolarHBondContact O-CB 3.44Å; L115-S119 PolarHBondContact O-N 3.22Å; L115-S119 PolarHBondContact O-OG 3.36Å; L115-I127 HydrophobicContact CD1-CB 4.35Å; L115-I127 HydrophobicContact CD1-CG2 3.93Å; L115-I127 WeakPolarHBondContact CD1-O 3.48Å; L115-C130 HydrophobicContact CD1-CB 3.69Å; L115-T131 WeakPolarHBondContact CD1-OG1 3.24Å
116	T	51.1	Low	50.4	Low	77 Å²	77	63.9 Å²	63.9	47%	0.472	34%	0.343	S	S	.	.	H	α-helix	trans	-64.3	-39.5	175.5	-57.8	0	0	0	0	111.2	L112 Q113 I114 I120	L112-T116 WeakPolarHBondContact O-CB 3.2Å; L112-T116 PolarHBondContact O-N 2.81Å; L112-T116 PolarHBondContact O-OG1 3.49Å; Q113-T116 PolarHBondContact O-N 2.92Å; I114-T116 VanDerWaalsContact C-N 3.34Å; I114-T116 PolarHBondContact O-N 2.81Å; T116-I120 HydrophobicContact CG2-CD1 4.25Å; T116-I120 WeakPolarHBondContact O-CD1 3.39Å; T116-I120 VanDerWaalsContact O-CG1 3.29Å; T116-I120 WeakPolarHBondContact O-CG1 3.35Å; T116-I120 PolarHBondContact O-N 3.13Å; T116-I120 VanDerWaalsContact O-N 3.11Å
117	A	52.6	Low	50.7	Low	10 Å²	10	63.8 Å²	63.8	8%	0.083	34%	0.341	C	S	.	.	H	α-helix	trans	-66.3	-48.9	176.2	0	0	0	0	0	112	L56 Q113 I114 L115 S119 I120 L121	L56-A117 HydrophobicContact CD2-CB 3.49Å; L56-A117 VanDerWaalsContact CD2-CB 3.49Å; Q113-A117 WeakPolarHBondContact O-CB 3.49Å; Q113-A117 PolarHBondContact O-N 3.41Å; I114-A117 WeakPolarHBondContact O-CB 3.42Å; I114-A117 PolarHBondContact O-N 3.5Å; I114-A117 VanDerWaalsContact O-N 3.15Å; L115-A117 VanDerWaalsContact C-N 3.34Å; A117-S119 VanDerWaalsContact C-N 3.31Å; A117-S119 PolarHBondContact O-N 3.14Å; A117-I120 WeakPolarHBondContact O-CB 3.25Å; A117-I120 PolarHBondContact O-N 2.9Å; A117-I120 VanDerWaalsContact O-N 3.17Å; A117-L121 WeakPolarHBondContact O-CG 3.49Å; A117-L121 PolarHBondContact O-N 3.33Å
118	A	54	Low	51.2	Low	4 Å²	4	65.7 Å²	65.7	3%	0.033	35%	0.347	C	S	.	.	H	α-helix	trans	-62.3	-37.3	177.3	0	0	0	0	0	112.1	I114 L115 L121 Q122 I123 V126 I127	I114-A118 WeakPolarHBondContact O-CB 3.44Å; I114-A118 PolarHBondContact O-N 3.12Å; L115-A118 PolarHBondContact O-N 3.36Å; A118-L121 CarbonylContact O-C 3.55Å; A118-L121 PolarHBondContact O-N 3.5Å; A118-L121 VanDerWaalsContact O-N 3.15Å; A118-Q122 PolarHBondContact O-N 2.91Å; A118-I123 HydrophobicContact CB-CB 4.46Å; A118-I123 PolarHBondContact O-N 3.28Å; A118-V126 HydrophobicContact CB-CB 4.01Å; A118-V126 HydrophobicContact CB-CG1 3.73Å; A118-I127 HydrophobicContact CB-CG1 3.74Å
119	S	47	Very low	52.1	Low	60 Å²	60	60.7 Å²	60.7	42%	0.42	32%	0.324	S	S	.	.	H	α-helix	trans	-63	-39.4	173.1	-59.5	0	0	0	0	112.9	L115 A117 L121 Q122	L115-S119 VanDerWaalsContact O-CB 3.28Å; L115-S119 WeakPolarHBondContact O-CB 3.44Å; L115-S119 PolarHBondContact O-N 3.22Å; L115-S119 PolarHBondContact O-OG 3.36Å; A117-S119 VanDerWaalsContact C-N 3.31Å; A117-S119 PolarHBondContact O-N 3.14Å; S119-L121 VanDerWaalsContact C-N 3.29Å; S119-L121 PolarHBondContact O-N 3.12Å; S119-Q122 PolarHBondContact O-N 3.04Å
120	I	47.4	Very low	52.5	Low	41 Å²	41	57.4 Å²	57.4	21%	0.21	30%	0.301	C	S	.	.	H	α-helix	trans	-66	-35	173.5	-71.6	165.6	0	0	0	110.7	L63 T116 A117	L63-I120 HydrophobicContact CD1-CG2 3.45Å; L63-I120 VanDerWaalsContact CD1-CG2 3.45Å; L63-I120 WeakPolarHBondContact CD1-O 3.4Å; T116-I120 HydrophobicContact CG2-CD1 4.25Å; T116-I120 WeakPolarHBondContact O-CD1 3.39Å; T116-I120 VanDerWaalsContact O-CG1 3.29Å; T116-I120 WeakPolarHBondContact O-CG1 3.35Å; T116-I120 PolarHBondContact O-N 3.13Å; T116-I120 VanDerWaalsContact O-N 3.11Å; A117-I120 WeakPolarHBondContact O-CB 3.25Å; A117-I120 PolarHBondContact O-N 2.9Å; A117-I120 VanDerWaalsContact O-N 3.17Å
121	L	50.8	Low	52.6	Low	65 Å²	65	58 Å²	58	34%	0.34	31%	0.307	S	S	.	.	T	Hydrogen-bonded Turn	trans	-87.9	1.3	-180	-62.3	173.5	0	0	0	114.5	H59 A117 A118 S119 I123	H59-L121 HydrophobicContact CB-CD2 3.86Å; H59-L121 WeakPolarHBondContact ND1-CD2 3.48Å; A117-L121 WeakPolarHBondContact O-CG 3.49Å; A117-L121 PolarHBondContact O-N 3.33Å; A118-L121 CarbonylContact O-C 3.55Å; A118-L121 PolarHBondContact O-N 3.5Å; A118-L121 VanDerWaalsContact O-N 3.15Å; S119-L121 VanDerWaalsContact C-N 3.29Å; S119-L121 PolarHBondContact O-N 3.12Å; L121-I123 HydrophobicContact CB-CD1 3.68Å; L121-I123 HydrophobicContact CB-CG1 3.7Å; L121-I123 HydrophobicContact CD1-CD1 3.81Å; L121-I123 HydrophobicContact CG-CD1 4.4Å; L121-I123 PolarHBondContact O-N 3.48Å; L121-I123 VanDerWaalsContact O-N 3.17Å
122	Q	49	Very low	53	Low	168 Å²	168	62.3 Å²	62.3	79%	0.785	32%	0.322	S	S	*	.	T	Hydrogen-bonded Turn	trans	52.8	25.4	-172.6	-58.7	-166.6	-4.5	0	0	115.5	A118 S119 K124	A118-Q122 PolarHBondContact O-N 2.91Å; S119-Q122 PolarHBondContact O-N 3.04Å; Q122-K124 VanDerWaalsContact C-N 3.26Å; Q122-K124 PolarHBondContact O-N 3.01Å
123	I	55.4	Low	53.3	Low	37 Å²	37	59.6 Å²	59.6	19%	0.19	31%	0.308	C	S	.	.			trans	-79.9	75.8	-179	-51.6	168.2	0	0	0	109.4	I92 A118 L121 T125 V126 I127	I92-I123 HydrophobicContact CD1-CD1 3.94Å; I92-I123 HydrophobicContact CG2-CG2 4.23Å; A118-I123 HydrophobicContact CB-CB 4.46Å; A118-I123 PolarHBondContact O-N 3.28Å; L121-I123 HydrophobicContact CB-CD1 3.68Å; L121-I123 HydrophobicContact CB-CG1 3.7Å; L121-I123 HydrophobicContact CD1-CD1 3.81Å; L121-I123 HydrophobicContact CG-CD1 4.4Å; L121-I123 PolarHBondContact O-N 3.48Å; L121-I123 VanDerWaalsContact O-N 3.17Å; I123-T125 VanDerWaalsContact C-N 3.27Å; I123-T125 PolarHBondContact O-N 3.04Å; I123-T125 VanDerWaalsContact O-N 3.17Å; I123-V126 HydrophobicContact CB-CB 4.39Å; I123-V126 HydrophobicContact CB-CG2 4.49Å; I123-V126 HydrophobicContact CG2-CB 3.92Å; I123-V126 HydrophobicContact CG2-CG2 3.58Å; I123-V126 PolarHBondContact O-N 3.3Å; I123-I127 WeakPolarHBondContact O-CG1 3.43Å; I123-I127 PolarHBondContact O-N 3.2Å; I123-I127 VanDerWaalsContact O-N 3.14Å
124	K	44.4	Very low	53.3	Low	146 Å²	146	55.4 Å²	55.4	64%	0.635	29%	0.29	S	S	*	.	H	α-helix	trans	-50.4	-42.7	-173	-176	175.3	177.7	-176.6	0	113.6	Q122 V126 I127 D128	Q122-K124 VanDerWaalsContact C-N 3.26Å; Q122-K124 PolarHBondContact O-N 3.01Å; K124-V126 VanDerWaalsContact C-N 3.33Å; K124-V126 PolarHBondContact O-N 3.27Å; K124-I127 WeakPolarHBondContact O-CB 3.47Å; K124-I127 PolarHBondContact O-N 3.07Å; K124-I127 VanDerWaalsContact O-N 3.1Å; K124-D128 WeakPolarHBondContact CE-OD2 3.28Å; K124-D128 WeakPolarHBondContact CG-OD2 3.48Å; K124-D128 PolarHBondContact O-N 3.38Å
125	T	54.3	Low	53.3	Low	94 Å²	94	57.1 Å²	57.1	58%	0.577	31%	0.306	S	S	*	.	H	α-helix	trans	-59	-39.5	179.2	48.9	0	0	0	0	113.4	I123 E129	I123-T125 VanDerWaalsContact C-N 3.27Å; I123-T125 PolarHBondContact O-N 3.04Å; I123-T125 VanDerWaalsContact O-N 3.17Å; T125-E129 VanDerWaalsContact O-CB 3.27Å; T125-E129 WeakPolarHBondContact O-CB 3.43Å; T125-E129 PolarHBondContact O-N 3.37Å
126	V	54.1	Low	53.3	Low	9 Å²	9	61.1 Å²	61.1	6%	0.055	32%	0.324	C	S	.	.	H	α-helix	trans	-75.1	-32.9	176.4	176.1	0	0	0	0	111.1	I92 I96 I114 A118 I123 K124 C130	I92-V126 HydrophobicContact CG2-CG2 4.17Å; I96-V126 HydrophobicContact CD1-CG2 3.87Å; I96-V126 HydrophobicContact CG1-CG2 4Å; I114-V126 HydrophobicContact CG2-CG1 4.31Å; A118-V126 HydrophobicContact CB-CB 4.01Å; A118-V126 HydrophobicContact CB-CG1 3.73Å; I123-V126 HydrophobicContact CB-CB 4.39Å; I123-V126 HydrophobicContact CB-CG2 4.49Å; I123-V126 HydrophobicContact CG2-CB 3.92Å; I123-V126 HydrophobicContact CG2-CG2 3.58Å; I123-V126 PolarHBondContact O-N 3.3Å; K124-V126 VanDerWaalsContact C-N 3.33Å; K124-V126 PolarHBondContact O-N 3.27Å; V126-C130 VanDerWaalsContact O-CB 3.24Å; V126-C130 WeakPolarHBondContact O-CB 3.43Å; V126-C130 PolarHBondContact O-N 3.17Å; V126-C130 PolarHBondContact O-SG 2.83Å; V126-C130 VanDerWaalsContact O-SG 3.42Å
127	I	55	Low	53	Low	37 Å²	37	62.2 Å²	62.2	19%	0.19	33%	0.327	C	S	.	.	H	α-helix	trans	-65	-52	176	-59.2	166.4	0	0	0	110.2	L115 A118 I123 K124 E129 T131	L115-I127 HydrophobicContact CD1-CB 4.35Å; L115-I127 HydrophobicContact CD1-CG2 3.93Å; L115-I127 WeakPolarHBondContact CD1-O 3.48Å; A118-I127 HydrophobicContact CB-CG1 3.74Å; I123-I127 WeakPolarHBondContact O-CG1 3.43Å; I123-I127 PolarHBondContact O-N 3.2Å; I123-I127 VanDerWaalsContact O-N 3.14Å; K124-I127 WeakPolarHBondContact O-CB 3.47Å; K124-I127 PolarHBondContact O-N 3.07Å; K124-I127 VanDerWaalsContact O-N 3.1Å; I127-E129 VanDerWaalsContact C-N 3.34Å; I127-E129 PolarHBondContact O-N 2.71Å; I127-T131 VanDerWaalsContact O-CB 3.31Å; I127-T131 WeakPolarHBondContact O-CB 3.29Å; I127-T131 PolarHBondContact O-N 3.39Å; I127-T131 PolarHBondContact O-OG1 3.11Å
128	D	54.3	Low	52.7	Low	90 Å²	90	65.8 Å²	65.8	48%	0.481	35%	0.347	S	S	.	.	H	α-helix	trans	-62.2	-42.9	-177.9	-65.2	-18.7	0	0	0	110.5	K124 T131 R132	K124-D128 WeakPolarHBondContact CE-OD2 3.28Å; K124-D128 WeakPolarHBondContact CG-OD2 3.48Å; K124-D128 PolarHBondContact O-N 3.38Å; D128-T131 PolarHBondContact O-N 3.48Å; D128-R132 WeakPolarHBondContact O-CB 3.43Å; D128-R132 PolarHBondContact O-N 3.02Å
129	E	58.8	Low	52.1	Low	17 Å²	17	68.7 Å²	68.7	8%	0.079	38%	0.377	C	S	.	.	H	α-helix	trans	-72.6	-43.7	-179.2	-178.7	56.3	-161.2	0	0	113.9	M99 Y100 T125 I127 T131 R132 I133	M99-E129 HydrophobicContact CE-CG 4.02Å; Y100-E129 VanDerWaalsContact CE1-OE1 3.3Å; Y100-E129 WeakPolarHBondContact CE1-OE1 3.39Å; Y100-E129 VanDerWaalsContact OH-CD 3.3Å; Y100-E129 PolarHBondContact OH-OE2 3Å; T125-E129 VanDerWaalsContact O-CB 3.27Å; T125-E129 WeakPolarHBondContact O-CB 3.43Å; T125-E129 PolarHBondContact O-N 3.37Å; I127-E129 VanDerWaalsContact C-N 3.34Å; I127-E129 PolarHBondContact O-N 2.71Å; E129-T131 VanDerWaalsContact C-N 3.26Å; E129-T131 PolarHBondContact O-N 2.59Å; E129-R132 WeakPolarHBondContact O-CB 3.32Å; E129-R132 PolarHBondContact O-N 2.95Å; E129-R132 IonicContact OE1-CZ 3.65Å; E129-R132 IonicContact OE1-NE 3Å; E129-R132 PolarHBondContact OE1-NE 3.34Å; E129-R132 IonicContact OE1-NH2 3.68Å; E129-R132 PolarHBondContact OE1-NH2 3.43Å; E129-R132 IonicContact OE2-CZ 2.8Å; E129-R132 IonicContact OE2-NE 3.75Å; E129-R132 PolarHBondContact OE2-NE 3.06Å; E129-R132 IonicContact OE2-NH2 3.1Å; E129-I133 HydrophobicContact CG-CD1 4.33Å; E129-I133 WeakPolarHBondContact O-CG1 3.4Å; E129-I133 PolarHBondContact O-N 2.81Å
130	C	53.6	Low	51.9	Low	7 Å²	7	73.1 Å²	73.1	5%	0.047	40%	0.395	C	S	.	.	H	α-helix	trans	-63.4	-34.6	173	-75.6	0	0	0	0	111.7	L115 V126 I133 V134	L115-C130 HydrophobicContact CD1-CB 3.69Å; V126-C130 VanDerWaalsContact O-CB 3.24Å; V126-C130 WeakPolarHBondContact O-CB 3.43Å; V126-C130 PolarHBondContact O-N 3.17Å; V126-C130 PolarHBondContact O-SG 2.83Å; V126-C130 VanDerWaalsContact O-SG 3.42Å; C130-I133 PolarHBondContact O-N 3.15Å; C130-V134 WeakPolarHBondContact O-CG2 3.46Å; C130-V134 PolarHBondContact O-N 2.79Å; C130-V134 VanDerWaalsContact O-N 3.07Å
131	T	55	Low	51.5	Low	58 Å²	58	75.6 Å²	75.6	36%	0.356	42%	0.422	S	S	.	.	H	α-helix	trans	-64.4	-45.8	173.8	-56.4	0	0	0	0	110.6	L115 I127 D128 E129 I133 V134 S135	L115-T131 WeakPolarHBondContact CD1-OG1 3.24Å; I127-T131 VanDerWaalsContact O-CB 3.31Å; I127-T131 WeakPolarHBondContact O-CB 3.29Å; I127-T131 PolarHBondContact O-N 3.39Å; I127-T131 PolarHBondContact O-OG1 3.11Å; D128-T131 PolarHBondContact O-N 3.48Å; E129-T131 VanDerWaalsContact C-N 3.26Å; E129-T131 PolarHBondContact O-N 2.59Å; T131-I133 VanDerWaalsContact C-N 3.33Å; T131-I133 PolarHBondContact O-N 2.82Å; T131-V134 PolarHBondContact O-N 3.39Å; T131-S135 PolarHBondContact O-N 3.12Å; T131-S135 PolarHBondContact O-OG 3.37Å; T131-S135 VanDerWaalsContact O-OG 3.09Å
132	R	62.3	Low	50.6	Low	97 Å²	97	75.4 Å²	75.4	37%	0.366	44%	0.436	S	S	.	.	H	α-helix	trans	-54.1	-46.3	175.8	-166.2	-169.4	68.4	68.1	4.2	112.2	D128 E129 S135 Q136	D128-R132 WeakPolarHBondContact O-CB 3.43Å; D128-R132 PolarHBondContact O-N 3.02Å; E129-R132 WeakPolarHBondContact O-CB 3.32Å; E129-R132 PolarHBondContact O-N 2.95Å; E129-R132 IonicContact OE1-CZ 3.65Å; E129-R132 IonicContact OE1-NE 3Å; E129-R132 PolarHBondContact OE1-NE 3.34Å; E129-R132 IonicContact OE1-NH2 3.68Å; E129-R132 PolarHBondContact OE1-NH2 3.43Å; E129-R132 IonicContact OE2-CZ 2.8Å; E129-R132 IonicContact OE2-NE 3.75Å; E129-R132 PolarHBondContact OE2-NE 3.06Å; E129-R132 IonicContact OE2-NH2 3.1Å; R132-S135 PolarHBondContact O-N 2.86Å; R132-Q136 VanDerWaalsContact NH1-NE2 3.15Å; R132-Q136 WeakPolarHBondContact O-CG 3.45Å; R132-Q136 PolarHBondContact O-N 3.07Å
133	I	57.2	Low	50.1	Low	44 Å²	44	74 Å²	74	23%	0.226	44%	0.441	C	S	.	.	H	α-helix	trans	-66.9	-42.5	179.5	-67	164.6	0	0	0	111.6	M99 E129 C130 T131 S135 Q136 N137	M99-I133 HydrophobicContact CE-CD1 3.55Å; E129-I133 HydrophobicContact CG-CD1 4.33Å; E129-I133 WeakPolarHBondContact O-CG1 3.4Å; E129-I133 PolarHBondContact O-N 2.81Å; C130-I133 PolarHBondContact O-N 3.15Å; T131-I133 VanDerWaalsContact C-N 3.33Å; T131-I133 PolarHBondContact O-N 2.82Å; I133-S135 VanDerWaalsContact C-N 3.35Å; I133-S135 PolarHBondContact O-N 3.45Å; I133-Q136 PolarHBondContact O-N 2.99Å; I133-N137 PolarHBondContact O-N 3.06Å; I133-N137 VanDerWaalsContact O-N 3.14Å; I133-N137 PolarHBondContact O-ND2 3.44Å; I133-N137 VanDerWaalsContact O-ND2 3.13Å
134	V	53.3	Low	49.3	Very low	29 Å²	29	76.2 Å²	76.2	18%	0.176	47%	0.474	C	S	.	.	H	α-helix	trans	-62.8	-42.2	175.4	170.9	0	0	0	0	111	Q108 A111 C130 T131 N137 V138	Q108-V134 HydrophobicContact CG-CG1 4.33Å; A111-V134 HydrophobicContact CB-CG2 3.61Å; C130-V134 WeakPolarHBondContact O-CG2 3.46Å; C130-V134 PolarHBondContact O-N 2.79Å; C130-V134 VanDerWaalsContact O-N 3.07Å; T131-V134 PolarHBondContact O-N 3.39Å; V134-N137 PolarHBondContact O-N 2.9Å; V134-V138 WeakPolarHBondContact O-CG2 3.37Å; V134-V138 PolarHBondContact O-N 3Å; V134-V138 VanDerWaalsContact O-N 3.12Å
135	S	55.9	Low	48.6	Very low	75 Å²	75	72.8 Å²	72.8	52%	0.524	48%	0.48	S	S	.	.	H	α-helix	trans	-63.1	-41.5	177.1	-62.7	0	0	0	0	112.8	T131 R132 I133 N137 V138 G139	T131-S135 PolarHBondContact O-N 3.12Å; T131-S135 PolarHBondContact O-OG 3.37Å; T131-S135 VanDerWaalsContact O-OG 3.09Å; R132-S135 PolarHBondContact O-N 2.86Å; I133-S135 VanDerWaalsContact C-N 3.35Å; I133-S135 PolarHBondContact O-N 3.45Å; S135-N137 PolarHBondContact O-N 3.33Å; S135-V138 PolarHBondContact O-N 2.72Å; S135-G139 PolarHBondContact O-N 3.16Å; S135-G139 VanDerWaalsContact O-N 3.13Å
136	Q	54.5	Low	47.4	Very low	119 Å²	119	77.9 Å²	77.9	56%	0.556	49%	0.494	S	S	*	.	H	α-helix	trans	-64.2	-39	176.6	-76	-175.5	-28.1	0	0	112.5	R132 I133 G139	R132-Q136 VanDerWaalsContact NH1-NE2 3.15Å; R132-Q136 WeakPolarHBondContact O-CG 3.45Å; R132-Q136 PolarHBondContact O-N 3.07Å; I133-Q136 PolarHBondContact O-N 2.99Å; Q136-G139 PolarHBondContact O-N 3.37Å
137	N	43.6	Very low	46.5	Very low	100 Å²	100	83.1 Å²	83.1	54%	0.535	53%	0.528	S	S	.	.	H	α-helix	trans	-70.1	-29.9	177.1	-72.7	-41.5	0	0	0	113.3	I133 V134 S135	I133-N137 PolarHBondContact O-N 3.06Å; I133-N137 VanDerWaalsContact O-N 3.14Å; I133-N137 PolarHBondContact O-ND2 3.44Å; I133-N137 VanDerWaalsContact O-ND2 3.13Å; V134-N137 PolarHBondContact O-N 2.9Å; S135-N137 PolarHBondContact O-N 3.33Å
138	V	46.1	Very low	45.3	Very low	85 Å²	85	87.8 Å²	87.8	52%	0.515	56%	0.558	S	S	.	*	H	α-helix	trans	-74	-30.7	174.5	171.8	0	0	0	0	111.9	V134 S135 L140 A141	V134-V138 WeakPolarHBondContact O-CG2 3.37Å; V134-V138 PolarHBondContact O-N 3Å; V134-V138 VanDerWaalsContact O-N 3.12Å; S135-V138 PolarHBondContact O-N 2.72Å; V138-L140 PolarHBondContact O-N 3.46Å; V138-L140 VanDerWaalsContact O-N 3.12Å; V138-A141 PolarHBondContact O-N 2.98Å
139	G	41.4	Very low	44.2	Very low	64 Å²	64	90.7 Å²	90.7	66%	0.66	57%	0.572	S	S	*	*	T	Hydrogen-bonded Turn	trans	-65	-11	179.6	0	0	0	0	0	115.8	S135 Q136	S135-G139 PolarHBondContact O-N 3.16Å; S135-G139 VanDerWaalsContact O-N 3.13Å; Q136-G139 PolarHBondContact O-N 3.37Å
140	L	42.7	Very low	43.1	Very low	153 Å²	153	95.8 Å²	95.8	80%	0.801	61%	0.607	S	S	*	*	T	Hydrogen-bonded Turn	trans	-94.4	6	-179	-66	173.6	0	0	0	114.2	V138	V138-L140 PolarHBondContact O-N 3.46Å; V138-L140 VanDerWaalsContact O-N 3.12Å
141	A	40.6	Very low	41.9	Very low	94 Å²	94	99.1 Å²	99.1	78%	0.777	64%	0.643	S	S	*	*			trans	-117	44.8	-177.6	0	0	0	0	0	113.3	V138	V138-A141 PolarHBondContact O-N 2.98Å
142	G	31.7	Very low	40.6	Very low	61 Å²	61	103.9 Å²	103.9	63%	0.629	67%	0.666	S	S	*	*	S	Bend	trans	-125.1	139.4	172.7	0	0	0	0	0	111.7
143	P	38.9	Very low	39.2	Very low	137 Å²	137	104.6 Å²	104.6	89%	0.89	69%	0.686	S	S	*	*			trans	-83.9	126.7	-171.8	31.7	-34.2	0	0	0	113.6
144	G	38.3	Very low	37.8	Very low	85 Å²	85	105.7 Å²	105.7	88%	0.876	71%	0.708	S	S	*	*			trans	81.1	89.9	155.5	0	0	0	0	0	117.1
145	G	29.4	Very low	36.8	Very low	74 Å²	74	113.3 Å²	113.3	76%	0.763	74%	0.742	S	S	*	*			trans	-163.2	120.6	165	0	0	0	0	0	111
146	F	29.6	Very low	35.5	Very low	200 Å²	200	118.4 Å²	118.4	88%	0.877	76%	0.757	S	S	*	*	P	Polyproline II helix	trans	-76.6	145	177	-79.7	-95.8	0	0	0	111	V148	F146-V148 PolarHBondContact O-N 3.28Å
147	P	33.7	Very low	34.3	Very low	119 Å²	119	118.9 Å²	118.9	77%	0.773	77%	0.768	S	S	*	*	P	Polyproline II helix	trans	-72.1	121.3	174.1	29.7	-33.2	0	0	0	110.7
148	V	29.6	Very low	34.6	Very low	135 Å²	135	119.3 Å²	119.3	82%	0.818	78%	0.777	S	S	*	*	P	Polyproline II helix	trans	-87.1	129.1	167.5	177.6	0	0	0	0	108.6	F146	F146-V148 PolarHBondContact O-N 3.28Å
149	I	32.5	Very low	33.8	Very low	151 Å²	151	127.5 Å²	127.5	77%	0.774	80%	0.798	S	S	*	*	P	Polyproline II helix	trans	-81.6	126.3	178.3	-58.2	173	0	0	0	109	G151	I149-G151 PolarHBondContact O-N 2.83Å
150	P	35.5	Very low	33.2	Very low	124 Å²	124	128.1 Å²	128.1	81%	0.805	80%	0.804	S	S	*	*	P	Polyproline II helix	trans	-71	118.8	166.4	-13.6	29.5	0	0	0	109.8
151	G	27.3	Very low	32.8	Very low	78 Å²	78	127.3 Å²	127.3	80%	0.804	81%	0.806	S	S	*	*	P	Polyproline II helix	trans	-88.1	151	165.4	0	0	0	0	0	111	I149	I149-G151 PolarHBondContact O-N 2.83Å
152	D	28.1	Very low	33.3	Very low	157 Å²	157	128.2 Å²	128.2	84%	0.84	80%	0.804	S	S	*	*			trans	-135.1	167.1	179.8	-178.6	37.1	0	0	0	110.9
153	S	33.3	Very low	33.3	Very low	113 Å²	113	134 Å²	134	79%	0.79	82%	0.815	S	S	*	*			trans	81.9	124.2	174.8	-65.3	0	0	0	0	118.6
154	G	28.8	Very low	33.1	Very low	67 Å²	67	133.7 Å²	133.7	69%	0.691	82%	0.816	S	S	*	*			trans	137.6	84	178	0	0	0	0	0	111
155	Q	31.2	Very low	32.7	Very low	188 Å²	188	132.7 Å²	132.7	88%	0.879	81%	0.805	S	S	*	*				54	125.7	80.8	-70.2	-172.6	-17.4	0	0	112.8
156	E	29.1	Very low	32.9	Very low	183 Å²	183	135.9 Å²	135.9	86%	0.855	81%	0.81	S	S	*	*			cis	-137.2	-157.1	19.2	-65.3	-166.2	111.4	0	0	115.1
157	T	29.3	Very low	32.9	Very low	128 Å²	128	132 Å²	132	79%	0.785	81%	0.808	S	S	*	*			trans	-125.1	-157.8	-167.8	67.8	0	0	0	0	110.9
158	P	48.9	Very low	32.6	Very low	109 Å²	109	129.5 Å²	129.5	71%	0.708	80%	0.804	S	S	*	*			cis	-130.9	163.4	-39.1	33.5	-17	0	0	0	114.8
159	R	30.5	Very low	33.4	Very low	258 Å²	258	129 Å²	129	97%	0.974	80%	0.804	S	S	*	*			trans	156.8	146.7	147.6	-92.5	165.4	167.4	170.6	-3.9	110
160	G	28.8	Very low	33.3	Very low	76 Å²	76	127 Å²	127	78%	0.784	80%	0.803	S	S	*	*			cis	-166.3	-178.6	-1.7	0	0	0	0	0	112
161	T	33.1	Very low	33.3	Very low	136 Å²	136	125.2 Å²	125.2	83%	0.834	79%	0.793	S	S	*	*			trans	-101.5	179.6	-172.4	51.7	0	0	0	0	114
162	P	52.9	Low	33.4	Very low	114 Å²	114	128.9 Å²	128.9	74%	0.74	79%	0.794	S	S	*	*			cis	-112.6	-110.5	-23.1	26.4	-4.8	0	0	0	112.6
163	E	31	Very low	33.7	Very low	182 Å²	182	125.8 Å²	125.8	85%	0.85	79%	0.791	S	S	*	*			cis	-119.5	-130.5	6.7	-67	-163.2	117.8	0	0	113.9
164	S	34.2	Very low	33.4	Very low	130 Å²	130	129.7 Å²	129.7	91%	0.909	80%	0.797	S	S	*	*			trans	-146.8	161.8	-159.5	-59.3	0	0	0	0	116.3
165	G	29.9	Very low	33.5	Very low	64 Å²	64	131.8 Å²	131.8	66%	0.66	80%	0.801	S	S	*	*			trans	139.6	111.3	158.5	0	0	0	0	0	113.3
166	T	32.8	Very low	33.2	Very low	141 Å²	141	126.4 Å²	126.4	87%	0.865	80%	0.795	S	S	*	*				54.2	126.9	60.2	74.2	0	0	0	0	113.4
167	S	31.2	Very low	33.1	Very low	120 Å²	120	127.3 Å²	127.3	84%	0.839	79%	0.792	S	S	*	*			cis	-158.3	175.8	23.8	54.3	0	0	0	0	113.2
168	G	27.7	Very low	33	Very low	66 Å²	66	127.5 Å²	127.5	68%	0.68	79%	0.786	S	S	*	*			trans	-87.7	-150.4	164.6	0	0	0	0	0	112.2
169	P	45.1	Very low	32.1	Very low	125 Å²	125	130.1 Å²	130.1	81%	0.812	79%	0.789	S	S	*	*			cis	-140.5	-165.2	4.4	42	-22.1	0	0	0	115.2
170	S	30.3	Very low	31.7	Very low	109 Å²	109	123.4 Å²	123.4	76%	0.762	78%	0.776	S	S	*	*			trans	69.4	156.8	152.6	-109.1	0	0	0	0	119.8
171	S	35	Very low	31.6	Very low	86 Å²	86	125.3 Å²	125.3	60%	0.601	77%	0.773	S	S	*	*			cis	-166.4	146.7	-15.6	24.3	0	0	0	0	112.3
172	D	30.5	Very low	31.4	Very low	154 Å²	154	123.2 Å²	123.2	82%	0.824	76%	0.764	S	S	*	*			trans	51.9	148.2	138	-50.8	-43.1	0	0	0	126.2
173	A	33.3	Very low	30.2	Very low	93 Å²	93	125 Å²	125	77%	0.769	76%	0.762	S	S	*	*			trans	73.5	156	152.3	0	0	0	0	0	119.4
174	E	28.6	Very low	30	Very low	195 Å²	195	124.5 Å²	124.5	91%	0.911	76%	0.76	S	S	*	*			cis	-146.6	-166	2	-143.2	-177.7	103.4	0	0	113.9
175	S	29.7	Very low	29.5	Very low	111 Å²	111	122.9 Å²	122.9	78%	0.776	75%	0.748	S	S	*	*			trans	-97.2	171.3	-167.3	-174	0	0	0	0	114.9
176	G	26.3	Very low	29.3	Very low	74 Å²	74	126 Å²	126	76%	0.763	75%	0.754	S	S	*	*			trans	178.5	61.4	178.1	0	0	0	0	0	121.5
177	Y	25.8	Very low	29	Very low	202 Å²	202	126.2 Å²	126.2	79%	0.792	75%	0.75	S	S	*	*			trans	36.7	129.4	145.6	-107.2	-114.1	0	0	0	125.4
178	M	27	Very low	28.8	Very low	133 Å²	133	132.1 Å²	132.1	66%	0.655	75%	0.754	S	S	*	*			trans	44.3	119.5	143.1	-61.1	-61.1	179.5	0	0	122.3
179	Q	29.4	Very low	28.9	Very low	163 Å²	163	134.9 Å²	134.9	76%	0.762	76%	0.758	S	S	*	*				74.8	144.5	84.5	-115.5	-168.8	74.2	0	0	115.3
180	V	23.7	Very low	27.8	Very low	118 Å²	118	139.3 Å²	139.3	72%	0.715	76%	0.76	S	S	*	*			cis	-120.1	-126.7	10.3	-152.8	0	0	0	0	112.4
181	T	27.1	Very low	27.6	Very low	115 Å²	115	139.8 Å²	139.8	71%	0.706	76%	0.758	S	S	*	*			cis	-151.3	150	6.7	49.5	0	0	0	0	113.2
182	S	27.6	Very low	27.1	Very low	93 Å²	93	140.7 Å²	140.7	65%	0.65	77%	0.765	S	S	*	*			trans	54.7	127.8	148.8	65.2	0	0	0	0	124.3
183	Q	27.8	Very low	26.8	Very low	152 Å²	152	140 Å²	140	71%	0.71	76%	0.761	S	S	*	*			trans	52	125.4	140.7	-93.5	71.4	-6.9	0	0	123.7
184	Q	27	Very low	26.5	Very low	170 Å²	170	146.8 Å²	146.8	79%	0.794	77%	0.768	S	S	*	*				38.5	139.5	117.9	-64.6	173.5	-9.6	0	0	120.5
185	S	23.8	Very low	26.3	Very low	96 Å²	96	141.7 Å²	141.7	67%	0.671	75%	0.754	S	S	*	*			cis	-173.4	173.9	-3.8	51.6	0	0	0	0	112
186	V	26	Very low	26.1	Very low	129 Å²	129	147.1 Å²	147.1	78%	0.782	76%	0.759	S	S	*	*			trans	64.5	142.2	165.9	-79.5	0	0	0	0	122.2
187	D	25.8	Very low	26.8	Very low	146 Å²	146	149.1 Å²	149.1	78%	0.781	76%	0.758	S	S	*	*			trans	54.7	102.6	160.3	-69.9	-43	0	0	0	121.7
188	R	26.9	Very low	26.8	Very low	245 Å²	245	143 Å²	143	93%	0.925	76%	0.757	S	S	*	*				-152.9	114.7	116.9	-112	165.7	-167.7	-177.7	3.7	115.2
189	T	29.4	Very low	27	Very low	124 Å²	124	145.7 Å²	145.7	76%	0.761	77%	0.773	S	S	*	*			trans	6.2	115.2	147.3	-39.5	0	0	0	0	119.5
190	Y	22.9	Very low	26.8	Very low	218 Å²	218	142.9 Å²	142.9	86%	0.855	77%	0.771	S	S	*	*			trans	17.4	116.3	131.1	-120.9	-97.1	0	0	0	118.7
191	T	25.8	Very low	27.1	Very low	118 Å²	118	144.6 Å²	144.6	72%	0.724	78%	0.776	S	S	*	*				151.3	145.7	118.8	-58.7	0	0	0	0	111.5
192	S	23.9	Very low	27.2	Very low	105 Å²	105	146.5 Å²	146.5	73%	0.734	78%	0.776	S	S	*	*			trans	70.9	149	179.6	-66.3	0	0	0	0	114.9
193	L	25.2	Very low	27.3	Very low	141 Å²	141	149.5 Å²	149.5	74%	0.738	79%	0.785	S	S	*	*			cis	-119.2	130.7	15.4	-72.2	157.9	0	0	0	113.9
194	Y	25.9	Very low	27.4	Very low	235 Å²	235	145 Å²	145	92%	0.922	78%	0.78	S	S	*	*				-76.3	117.2	129.2	-101.4	-97.6	0	0	0	105.9
195	S	24.5	Very low	27.4	Very low	87 Å²	87	143.3 Å²	143.3	61%	0.608	78%	0.781	S	S	*	*			trans	-90.3	126.3	178.9	-65.3	0	0	0	0	111
196	Y	26.6	Very low	27.7	Very low	226 Å²	226	149.4 Å²	149.4	89%	0.886	79%	0.789	S	S	*	*			trans	-128	150	151.4	-103.1	-97.3	0	0	0	108.4
197	P	41	Very low	27.7	Very low	116 Å²	116	149.9 Å²	149.9	75%	0.753	78%	0.783	S	S	*	*			trans	-97.5	148.2	-153.3	35.9	-34.5	0	0	0	114.8
198	G	26	Very low	27.7	Very low	74 Å²	74	153 Å²	153	76%	0.763	78%	0.784	S	S	*	*			trans	71.5	114.1	135.9	0	0	0	0	0	119.4
199	L	30.6	Very low	27.6	Very low	189 Å²	189	146 Å²	146	99%	0.99	77%	0.772	S	S	*	*				-153.6	161.6	118.2	-105.3	170.5	0	0	0	109.4
200	S	25.3	Very low	27.4	Very low	104 Å²	104	146.8 Å²	146.8	73%	0.727	77%	0.771	S	S	*	*			trans	-113.8	151.1	-167.4	-174.2	0	0	0	0	112.8
201	L	30.3	Very low	27.5	Very low	154 Å²	154	146 Å²	146	81%	0.806	77%	0.768	S	S	*	*			trans	145.5	99.2	159.4	-81.8	159.5	0	0	0	107.4
202	Q	29.8	Very low	27.4	Very low	155 Å²	155	145.9 Å²	145.9	72%	0.724	77%	0.767	S	S	*	*				83.3	124	62.5	-171.3	-179.9	82.7	0	0	113.1
203	N	28.9	Very low	27.5	Very low	155 Å²	155	148 Å²	148	83%	0.829	77%	0.77	S	S	*	*			trans	65.8	145.5	177.2	-58.5	-21.1	0	0	0	117.1
204	G	28.8	Very low	28.6	Very low	58 Å²	58	146 Å²	146	60%	0.598	77%	0.765	S	S	*	*			cis	170.9	132.9	-11.5	0	0	0	0	0	115.8
205	T	28.1	Very low	28.7	Very low	134 Å²	134	142.9 Å²	142.9	82%	0.822	76%	0.764	S	S	*	*			trans	64	139.5	150.7	58.1	0	0	0	0	122.2
206	R	29.3	Very low	28.8	Very low	224 Å²	224	144 Å²	144	85%	0.845	77%	0.772	S	S	*	*			trans	72.2	152.2	156	-72.4	179.5	166.5	156.2	-1.5	119.4
207	E	26.3	Very low	28.7	Very low	139 Å²	139	137 Å²	137	65%	0.65	76%	0.76	S	S	*	*			cis	171.4	150	-40.4	-111	-169.5	123.1	0	0	107.6
208	R	26.4	Very low	28	Very low	213 Å²	213	138.5 Å²	138.5	80%	0.804	76%	0.762	S	S	*	*			trans	59.7	120.6	171.6	-74.5	177.8	161.5	107.5	-5.8	115.4
209	S	24.1	Very low	27.9	Very low	97 Å²	97	146.2 Å²	146.2	68%	0.678	77%	0.77	S	S	*	*			cis	66.4	115.1	36.6	-162.1	0	0	0	0	114.3
210	L	25.3	Very low	27.6	Very low	140 Å²	140	143.8 Å²	143.8	73%	0.733	76%	0.758	S	S	*	*				-174.8	144.4	107.5	-89.4	173.8	0	0	0	111.9
211	Y	24.7	Very low	28.4	Very low	201 Å²	201	143.4 Å²	143.4	79%	0.788	75%	0.753	S	S	*	*			trans	12.2	157.9	141.2	-75.7	-116.2	0	0	0	122.9
212	V	24.8	Very low	28.1	Very low	117 Å²	117	141.4 Å²	141.4	71%	0.709	75%	0.752	S	S	*	*			cis	-171.4	137.9	-32.2	90.6	0	0	0	0	110.9
213	N	26	Very low	27.9	Very low	148 Å²	148	141.8 Å²	141.8	79%	0.791	76%	0.759	S	S	*	*			trans	67.6	-179.3	152.2	-129.5	22.1	0	0	0	118.4
214	P	48.8	Very low	28.1	Very low	99 Å²	99	143.1 Å²	143.1	64%	0.643	76%	0.76	S	S	*	*				-136.1	-175.6	-109.4	44.2	-25.7	0	0	0	115.8
215	L	26.9	Very low	28	Very low	171 Å²	171	149.1 Å²	149.1	90%	0.895	77%	0.77	S	S	*	*			trans	-164.9	163	148	-110.1	168.1	0	0	0	112.7
216	S	25.9	Very low	28.2	Very low	111 Å²	111	149.4 Å²	149.4	78%	0.776	77%	0.766	S	S	*	*			trans	-84.7	177.7	-175.6	-44.2	0	0	0	0	112.7
217	A	25.2	Very low	28.2	Very low	78 Å²	78	147.5 Å²	147.5	65%	0.645	77%	0.767	S	S	*	*			cis	-161.4	-179.5	16.8	0	0	0	0	0	113.5
218	N	26.1	Very low	28.5	Very low	148 Å²	148	149.2 Å²	149.2	79%	0.791	78%	0.775	S	S	*	*			trans	69.7	97.6	155.4	-55.5	-21.3	0	0	0	120.3
219	Y	23.4	Very low	28.5	Very low	236 Å²	236	144.4 Å²	144.4	93%	0.925	77%	0.774	S	S	*	*				-168.2	154.9	106.7	-133.7	-98.1	0	0	0	112.3
220	D	25.1	Very low	29.1	Very low	138 Å²	138	148.4 Å²	148.4	74%	0.738	78%	0.782	S	S	*	*			trans	-159.7	151.8	172.9	-163	45.3	0	0	0	106
221	P	41.7	Very low	29.4	Very low	96 Å²	96	147.4 Å²	147.4	62%	0.623	78%	0.777	S	S	*	*			cis	-132.7	-171.3	10.3	43.6	-27.1	0	0	0	116.3
222	S	24.3	Very low	30.1	Very low	112 Å²	112	141 Å²	141	78%	0.783	76%	0.76	S	S	*	*			trans	76.9	101.3	158.3	70.9	0	0	0	0	118.9
223	N	26.2	Very low	30.8	Very low	163 Å²	163	140.3 Å²	140.3	87%	0.872	76%	0.758	S	S	*	*				-161.8	155.4	91.2	-150.5	-22.6	0	0	0	110.8
224	Q	31.9	Very low	31.4	Very low	182 Å²	182	140.7 Å²	140.7	85%	0.85	75%	0.749	S	S	*	*			trans	-86.2	134.5	171.6	-77.2	-177.9	-26.2	0	0	110.6
225	K	27.3	Very low	30.8	Very low	185 Å²	185	139.1 Å²	139.1	80%	0.804	73%	0.734	S	S	*	*			trans	-158.4	129.6	146.7	-112.5	-176.5	178.3	-178.6	0	112.6
226	D	32.2	Very low	31.5	Very low	139 Å²	139	136 Å²	136	74%	0.743	72%	0.719	S	S	*	*			trans	39.4	89.6	147.5	-48.9	-35.3	0	0	0	118.4
227	Q	29.6	Very low	32.2	Very low	185 Å²	185	139 Å²	139	86%	0.864	71%	0.713	S	S	*	*			trans	-127.7	119.4	147.4	-164.7	61.1	68.7	0	0	110.5	S229	Q227-S229 PolarHBondContact O-N 2.83Å
228	Q	32.3	Very low	33.1	Very low	175 Å²	175	139.9 Å²	139.9	82%	0.818	71%	0.706	S	S	*	*			trans	-80.2	112.2	-168	-167.5	171.8	14.9	0	0	111.5
229	S	27.5	Very low	33.8	Very low	112 Å²	112	138.5 Å²	138.5	78%	0.783	69%	0.694	S	S	*	*	P	Polyproline II helix	trans	-75.3	135.6	170.6	-171.1	0	0	0	0	110.2	Q227	Q227-S229 PolarHBondContact O-N 2.83Å
230	Q	35.2	Very low	34.6	Very low	181 Å²	181	133 Å²	133	85%	0.846	68%	0.677	S	S	*	*	P	Polyproline II helix	trans	-94.9	126.9	175.6	-69.1	-171.8	-6.1	0	0	111.1
231	D	31.9	Very low	35.4	Very low	118 Å²	118	135.3 Å²	135.3	63%	0.631	68%	0.676	S	S	*	*	P	Polyproline II helix	trans	-72.2	143.7	174	-77.4	-57.5	0	0	0	112.5	I235	D231-I235 HydrophobicContact CB-CD1 4.42Å
232	P	40	Very low	35.4	Very low	66 Å²	66	133.8 Å²	133.8	43%	0.429	67%	0.667	S	S	.	*	P	Polyproline II helix	trans	-64.4	145.7	-176.9	-26.2	36.2	0	0	0	114.8	W234 I235	P232-W234 PolarHBondContact O-N 3.1Å; P232-I235 PolarHBondContact O-N 2.78Å
233	P	39.6	Very low	36.2	Very low	103 Å²	103	132.6 Å²	132.6	67%	0.669	65%	0.649	S	S	*	*	T	Hydrogen-bonded Turn	trans	-68.7	15.8	-168.3	-21.8	34.5	0	0	0	118.3
234	W	38.4	Very low	36.9	Very low	157 Å²	157	130.4 Å²	130.4	60%	0.595	63%	0.634	S	S	*	*	T	Hydrogen-bonded Turn	trans	-101.9	-26.4	174.7	71.1	-85	0	0	0	112.7	P232 R237 I238	P232-W234 PolarHBondContact O-N 3.1Å; W234-R237 PolarHBondContact O-N 3.37Å; W234-I238 HydrophobicContact CE3-CD1 3.71Å; W234-I238 HydrophobicContact CZ3-CD1 3.55Å; W234-I238 PolarHBondContact O-N 3Å
235	I	36.8	Very low	37.4	Very low	65 Å²	65	125.7 Å²	125.7	33%	0.333	62%	0.617	S	S	.	*	H	α-helix	trans	-63.9	-45.5	177.9	-64.7	177.2	0	0	0	110.1	D231 P232 R237 I238 Q239	D231-I235 HydrophobicContact CB-CD1 4.42Å; P232-I235 PolarHBondContact O-N 2.78Å; I235-R237 VanDerWaalsContact C-N 3.26Å; I235-R237 PolarHBondContact O-N 3.36Å; I235-I238 PolarHBondContact O-N 2.71Å; I235-Q239 PolarHBondContact O-N 2.89Å
236	N	41.2	Very low	37.9	Very low	107 Å²	107	123.4 Å²	123.4	57%	0.572	61%	0.609	S	S	*	*	H	α-helix	trans	-56.6	-36.4	176.2	-69.5	-21.7	0	0	0	113	I238 Q239 E240	N236-I238 VanDerWaalsContact C-N 3.27Å; N236-I238 PolarHBondContact O-N 3.41Å; N236-Q239 PolarHBondContact O-N 3.47Å; N236-E240 WeakPolarHBondContact O-CB 3.01Å; N236-E240 PolarHBondContact O-N 3.39Å
237	R	40.5	Very low	38.1	Very low	173 Å²	173	124.6 Å²	124.6	65%	0.653	60%	0.604	S	S	*	*	H	α-helix	trans	-74	-12.6	177.3	-86.3	-172.3	-78.1	-178.3	-7.7	114.5	W234 I235	W234-R237 PolarHBondContact O-N 3.37Å; I235-R237 VanDerWaalsContact C-N 3.26Å; I235-R237 PolarHBondContact O-N 3.36Å
238	I	42.7	Very low	38.6	Very low	97 Å²	97	124.2 Å²	124.2	50%	0.497	60%	0.599	S	S	.	*	H	α-helix	trans	-86.8	-46.5	167.8	-63.2	177.6	0	0	0	109.1	W234 I235 N236 E240 R241 S242	W234-I238 HydrophobicContact CE3-CD1 3.71Å; W234-I238 HydrophobicContact CZ3-CD1 3.55Å; W234-I238 PolarHBondContact O-N 3Å; I235-I238 PolarHBondContact O-N 2.71Å; N236-I238 VanDerWaalsContact C-N 3.27Å; N236-I238 PolarHBondContact O-N 3.41Å; I238-E240 PolarHBondContact O-N 2.98Å; I238-R241 PolarHBondContact O-N 3.04Å; I238-R241 VanDerWaalsContact O-N 3.15Å; I238-S242 PolarHBondContact O-N 3.2Å; I238-S242 PolarHBondContact O-OG 3.35Å
239	Q	41.9	Very low	38.8	Very low	118 Å²	118	123.6 Å²	123.6	55%	0.551	60%	0.599	S	S	*	*	H	α-helix	trans	-56.2	-47.7	177.8	-157.6	74.9	-13	0	0	112.3	I235 N236 R241 S242 Q243	I235-Q239 PolarHBondContact O-N 2.89Å; N236-Q239 PolarHBondContact O-N 3.47Å; Q239-R241 VanDerWaalsContact C-N 3.32Å; Q239-R241 PolarHBondContact O-N 3.03Å; Q239-S242 PolarHBondContact O-N 2.93Å; Q239-Q243 PolarHBondContact O-N 2.99Å
240	E	40.8	Very low	39.2	Very low	122 Å²	122	122.7 Å²	122.7	57%	0.57	59%	0.592	S	S	*	*	H	α-helix	trans	-62.5	-36.5	178	-177.2	174.3	-130.2	0	0	112.4	N236 I238 Q243 Q244	N236-E240 WeakPolarHBondContact O-CB 3.01Å; N236-E240 PolarHBondContact O-N 3.39Å; I238-E240 PolarHBondContact O-N 2.98Å; E240-Q243 PolarHBondContact O-N 2.88Å; E240-Q244 PolarHBondContact O-N 2.24Å
241	R	41.6	Very low	39.1	Very low	185 Å²	185	118.2 Å²	118.2	70%	0.698	58%	0.581	S	S	*	*	H	α-helix	trans	-75.5	-34.6	178.5	-158.8	175.4	-168.5	-171.4	2.9	112.4	I238 Q239 Q244 V245	I238-R241 PolarHBondContact O-N 3.04Å; I238-R241 VanDerWaalsContact O-N 3.15Å; Q239-R241 VanDerWaalsContact C-N 3.32Å; Q239-R241 PolarHBondContact O-N 3.03Å; R241-Q244 PolarHBondContact O-N 3.23Å; R241-V245 PolarHBondContact O-N 3.21Å
242	S	41.2	Very low	39.3	Very low	64 Å²	64	117.5 Å²	117.5	45%	0.448	59%	0.591	S	S	.	*	H	α-helix	trans	-65	-41.3	169.5	-63.4	0	0	0	0	111.5	I238 Q239 Q244 V245 E246	I238-S242 PolarHBondContact O-N 3.2Å; I238-S242 PolarHBondContact O-OG 3.35Å; Q239-S242 PolarHBondContact O-N 2.93Å; S242-Q244 VanDerWaalsContact C-N 3.31Å; S242-Q244 PolarHBondContact O-N 2.75Å; S242-V245 WeakPolarHBondContact O-CB 3.18Å; S242-V245 PolarHBondContact O-N 2.74Å; S242-E246 PolarHBondContact O-N 3.49Å
243	Q	40.4	Very low	38.9	Very low	88 Å²	88	123.7 Å²	123.7	41%	0.411	62%	0.615	S	S	.	*	H	α-helix	trans	-64.4	-31.3	174.2	-73	-171.6	11.5	0	0	113.3	Q239 E240 V245 R247	Q239-Q243 PolarHBondContact O-N 2.99Å; E240-Q243 PolarHBondContact O-N 2.88Å; Q243-V245 VanDerWaalsContact C-N 3.34Å; Q243-R247 WeakPolarHBondContact O-CB 3.4Å; Q243-R247 VanDerWaalsContact O-CG 3.25Å; Q243-R247 WeakPolarHBondContact O-CG 3.42Å; Q243-R247 PolarHBondContact O-N 3.1Å
244	Q	42.3	Very low	38.6	Very low	116 Å²	116	124.1 Å²	124.1	54%	0.542	62%	0.62	S	S	.	*	H	α-helix	trans	-64.4	-37.4	169.8	-77.9	-173.4	-14.6	0	0	112.4	E240 R241 S242 F248	E240-Q244 PolarHBondContact O-N 2.24Å; R241-Q244 PolarHBondContact O-N 3.23Å; S242-Q244 VanDerWaalsContact C-N 3.31Å; S242-Q244 PolarHBondContact O-N 2.75Å; Q244-F248 PolarHBondContact O-N 3.19Å; Q244-F248 VanDerWaalsContact O-N 3.1Å
245	V	41.2	Very low	38.3	Very low	84 Å²	84	123.7 Å²	123.7	51%	0.509	64%	0.635	S	S	.	*	H	α-helix	trans	-68.1	-45.4	176.8	174.7	0	0	0	0	111.2	R241 S242 Q243 R247 F248 M249	R241-V245 PolarHBondContact O-N 3.21Å; S242-V245 WeakPolarHBondContact O-CB 3.18Å; S242-V245 PolarHBondContact O-N 2.74Å; Q243-V245 VanDerWaalsContact C-N 3.34Å; V245-R247 PolarHBondContact O-N 3.36Å; V245-F248 WeakPolarHBondContact O-CB 3.42Å; V245-F248 PolarHBondContact O-N 3.26Å; V245-F248 VanDerWaalsContact O-N 3.17Å; V245-M249 HydrophobicContact CG1-SD 4.41Å; V245-M249 PolarHBondContact O-N 2.78Å
246	E	37.4	Very low	38.1	Very low	136 Å²	136	128.2 Å²	128.2	64%	0.636	65%	0.654	S	S	*	*	H	α-helix	trans	-65.9	-36.1	177.3	-70.3	-166	149.3	0	0	112.9	S242 F248 M249 S250	S242-E246 PolarHBondContact O-N 3.49Å; E246-F248 VanDerWaalsContact C-N 3.32Å; E246-F248 PolarHBondContact O-N 3.33Å; E246-M249 PolarHBondContact O-N 2.96Å; E246-S250 WeakPolarHBondContact O-CB 3.28Å; E246-S250 PolarHBondContact O-N 3.24Å; E246-S250 PolarHBondContact O-OG 2.83Å
247	R	38.3	Very low	37.3	Very low	164 Å²	164	128.9 Å²	128.9	62%	0.619	67%	0.666	S	S	*	*	H	α-helix	trans	-62.1	-39.4	171.8	-73.4	174.3	-164.3	157.1	12.6	111.8	Q243 V245 M249 S250 S251	Q243-R247 WeakPolarHBondContact O-CB 3.4Å; Q243-R247 VanDerWaalsContact O-CG 3.25Å; Q243-R247 WeakPolarHBondContact O-CG 3.42Å; Q243-R247 PolarHBondContact O-N 3.1Å; V245-R247 PolarHBondContact O-N 3.36Å; R247-M249 VanDerWaalsContact C-N 3.32Å; R247-M249 PolarHBondContact O-N 3.13Å; R247-S250 PolarHBondContact O-N 3.39Å; R247-S251 PolarHBondContact O-N 3.5Å
248	F	38.7	Very low	36.9	Very low	177 Å²	177	130.8 Å²	130.8	78%	0.776	67%	0.673	S	S	*	*	H	α-helix	trans	-68.5	-26.1	174.1	-105.6	-80.1	0	0	0	114	Q244 V245 E246	Q244-F248 PolarHBondContact O-N 3.19Å; Q244-F248 VanDerWaalsContact O-N 3.1Å; V245-F248 WeakPolarHBondContact O-CB 3.42Å; V245-F248 PolarHBondContact O-N 3.26Å; V245-F248 VanDerWaalsContact O-N 3.17Å; E246-F248 VanDerWaalsContact C-N 3.32Å; E246-F248 PolarHBondContact O-N 3.33Å
249	M	36.4	Very low	36.3	Very low	163 Å²	163	135.5 Å²	135.5	80%	0.803	69%	0.69	S	S	*	*	H	α-helix	trans	-86.2	-10.2	174.2	-67.9	-171.9	67.8	0	0	113.5	V245 E246 R247	V245-M249 HydrophobicContact CG1-SD 4.41Å; V245-M249 PolarHBondContact O-N 2.78Å; E246-M249 PolarHBondContact O-N 2.96Å; R247-M249 VanDerWaalsContact C-N 3.32Å; R247-M249 PolarHBondContact O-N 3.13Å
250	S	37.3	Very low	35.8	Very low	92 Å²	92	137.1 Å²	137.1	64%	0.643	70%	0.698	S	S	*	*	H	α-helix	trans	-100.6	-11.1	-176.8	-57.3	0	0	0	0	114.3	E246 R247 A252	E246-S250 WeakPolarHBondContact O-CB 3.28Å; E246-S250 PolarHBondContact O-N 3.24Å; E246-S250 PolarHBondContact O-OG 2.83Å; R247-S250 PolarHBondContact O-N 3.39Å; S250-A252 PolarHBondContact O-N 3.02Å; S250-A252 VanDerWaalsContact O-N 3.08Å
251	S	32	Very low	35.2	Very low	87 Å²	87	136.7 Å²	136.7	61%	0.608	71%	0.705	S	S	*	*			trans	-81.3	82.4	179.7	59.3	0	0	0	0	112.1	R247 E253	R247-S251 PolarHBondContact O-N 3.5Å; S251-E253 PolarHBondContact O-N 3.32Å
252	A	37.3	Very low	34.6	Very low	103 Å²	103	139.1 Å²	139.1	85%	0.851	72%	0.715	S	S	*	*			trans	-85	82	178.7	0	0	0	0	0	112.7	S250	S250-A252 PolarHBondContact O-N 3.02Å; S250-A252 VanDerWaalsContact O-N 3.08Å
253	E	30.3	Very low	34	Very low	197 Å²	197	141.9 Å²	141.9	92%	0.921	73%	0.731	S	S	*	*			trans	-116	133.3	163.5	-74.7	-163.9	123.2	0	0	111.2	S251	S251-E253 PolarHBondContact O-N 3.32Å
254	S	32.8	Very low	33.4	Very low	111 Å²	111	144.4 Å²	144.4	78%	0.776	75%	0.752	S	S	*	*			trans	-104.3	130	-167.8	65.2	0	0	0	0	113.2
255	T	32	Very low	32.7	Very low	149 Å²	149	149.6 Å²	149.6	91%	0.914	77%	0.767	S	S	*	*			trans	-126.8	127.9	151.3	49.8	0	0	0	0	109.4
256	H	32.8	Very low	32.3	Very low	159 Å²	159	152.8 Å²	152.8	74%	0.736	78%	0.779	S	S	*	*			trans	-114.9	106.9	-161.3	-175	-88.2	0	0	0	111.3
257	C	24.4	Very low	31.8	Very low	121 Å²	121	154.6 Å²	154.6	82%	0.818	79%	0.788	S	S	*	*			trans	-146.7	76.3	174.7	-106.1	0	0	0	0	113.4	K259	C257-K259 PolarHBondContact O-N 3.16Å
258	R	32.6	Very low	31.5	Very low	214 Å²	214	153.4 Å²	153.4	81%	0.808	80%	0.799	S	S	*	*			trans	-61.9	125.8	159	-82.5	176.1	162.5	160.8	-6.5	109.6
259	K	30.8	Very low	30.9	Very low	196 Å²	196	148.5 Å²	148.5	85%	0.852	80%	0.798	S	S	*	*			trans	-121.2	106	156.3	-77	-174.2	177.6	177	0	108.7	C257	C257-K259 PolarHBondContact O-N 3.16Å
260	Q	30.2	Very low	30.4	Very low	152 Å²	152	144.4 Å²	144.4	71%	0.71	80%	0.797	S	S	*	*	P	Polyproline II helix	trans	-63.8	148.7	168.6	-67.5	-72.3	16.9	0	0	109.9
261	P	29.9	Very low	29.8	Very low	113 Å²	113	148.5 Å²	148.5	73%	0.734	81%	0.809	S	S	*	*	P	Polyproline II helix	trans	-61.4	139.7	163.6	28.9	-33.5	0	0	0	109.4
262	R	27.9	Very low	29.6	Very low	236 Å²	236	152.7 Å²	152.7	89%	0.891	82%	0.818	S	S	*	*	P	Polyproline II helix	trans	-93.4	132.3	172.2	-69.8	-171.3	178.3	-153.5	0.6	109.4
263	P	28.5	Very low	29.1	Very low	122 Å²	122	154.8 Å²	154.8	79%	0.792	81%	0.814	S	S	*	*	P	Polyproline II helix	trans	-68	135.2	168.4	29	-33.2	0	0	0	109.8	R265	P263-R265 PolarHBondContact O-N 3.32Å
264	V	28.1	Very low	28.9	Very low	140 Å²	140	153.2 Å²	153.2	85%	0.848	80%	0.804	S	S	*	*			trans	-80.7	107.8	173.7	177.3	0	0	0	0	108.4	I266	V264-I266 PolarHBondContact O-N 3.15Å
265	R	27.6	Very low	28.5	Very low	226 Å²	226	154.1 Å²	154.1	85%	0.853	80%	0.796	S	S	*	*			trans	-86.3	108.9	174.5	-169.7	175.9	-166	148.9	4.8	109.3	P263	P263-R265 PolarHBondContact O-N 3.32Å
266	I	32.8	Very low	28.2	Very low	151 Å²	151	154.4 Å²	154.4	77%	0.774	79%	0.787	S	S	*	*			trans	-63.3	133.2	166.3	-58.8	173.5	0	0	0	107.7	V264	V264-I266 PolarHBondContact O-N 3.15Å
267	Q	27.6	Very low	27.9	Very low	174 Å²	174	151 Å²	151	81%	0.813	79%	0.786	S	S	*	*			trans	-133.6	109.2	175.7	-168.8	165.2	4.4	0	0	109.6
268	T	30.8	Very low	28	Very low	138 Å²	138	153.2 Å²	153.2	85%	0.847	78%	0.784	S	S	*	*			trans	-91.1	143.2	-175.5	-41.5	0	0	0	0	111
269	G	26.8	Very low	27.7	Very low	75 Å²	75	150.2 Å²	150.2	77%	0.773	78%	0.784	S	S	*	*			trans	136.9	110	175.7	0	0	0	0	0	111.5
270	G	26.9	Very low	27.5	Very low	76 Å²	76	148.5 Å²	148.5	78%	0.784	78%	0.779	S	S	*	*			cis	120.2	121.2	-2.5	0	0	0	0	0	111.9
271	M	24.6	Very low	27.4	Very low	178 Å²	178	150.5 Å²	150.5	88%	0.877	79%	0.786	S	S	*	*			trans	-147.5	130.8	176.8	-95.7	-178.2	69	0	0	112.9
272	H	26.8	Very low	27.1	Very low	176 Å²	176	151.7 Å²	151.7	82%	0.815	79%	0.791	S	S	*	*			trans	71.2	151.8	155.4	-102.2	-93.4	0	0	0	122.5
273	I	26.9	Very low	27	Very low	147 Å²	147	145.6 Å²	145.6	75%	0.754	78%	0.784	S	S	*	*			trans	-134.9	134.8	-169.5	-56.3	165.9	0	0	0	107.7
274	K	26.1	Very low	26.8	Very low	163 Å²	163	150.7 Å²	150.7	71%	0.709	79%	0.789	S	S	*	*			trans	169.5	131.1	135.5	-96.9	-179.1	177.6	-94.1	0	109.3
275	Q	24.6	Very low	26.8	Very low	131 Å²	131	151.3 Å²	151.3	61%	0.612	79%	0.787	S	S	*	*				57.2	128.8	93.6	-78.9	177.4	-92.1	0	0	112
276	E	25.3	Very low	27.2	Very low	154 Å²	154	149.2 Å²	149.2	72%	0.72	79%	0.79	S	S	*	*			cis	-126.2	156.3	7.4	-98	120.1	-160.7	0	0	110.6
277	A	26.6	Very low	27	Very low	87 Å²	87	145.3 Å²	145.3	72%	0.719	79%	0.786	S	S	*	*				57.5	148.4	97.3	0	0	0	0	0	114.1
278	E	27.5	Very low	27	Very low	169 Å²	169	144.2 Å²	144.2	79%	0.79	79%	0.786	S	S	*	*			cis	-139.6	163.2	19.2	-64.6	169.8	147.1	0	0	110.8
279	D	26.3	Very low	26.8	Very low	150 Å²	150	143 Å²	143	80%	0.802	78%	0.782	S	S	*	*			trans	53.3	165.3	149.4	-58.3	-10.2	0	0	0	121.3
280	E	26.7	Very low	26.9	Very low	161 Å²	161	147.9 Å²	147.9	75%	0.752	79%	0.785	S	S	*	*			cis	-161.8	127.2	-37	169	179.4	-144.2	0	0	104.7
281	F	26.8	Very low	26.9	Very low	194 Å²	194	150 Å²	150	85%	0.851	78%	0.778	S	S	*	*			trans	-167.4	99.9	157.4	-116.1	-70.9	0	0	0	112.6
282	T	25.1	Very low	27.1	Very low	137 Å²	137	148.1 Å²	148.1	84%	0.84	77%	0.771	S	S	*	*			trans	-118.1	112	156.6	48	0	0	0	0	108.8
283	C	24.6	Very low	27.3	Very low	109 Å²	109	144.5 Å²	144.5	74%	0.736	76%	0.762	S	S	*	*			trans	-111.5	129.2	167	58.6	0	0	0	0	109.7
284	Y	25.2	Very low	27.5	Very low	229 Å²	229	143.4 Å²	143.4	90%	0.898	76%	0.758	S	S	*	*			trans	-126.7	130.1	170	-119.4	-72.5	0	0	0	108.9
285	D	27.8	Very low	28	Very low	152 Å²	152	143.5 Å²	143.5	81%	0.813	76%	0.76	S	S	*	*			trans	68.4	164.3	161.6	-130.3	-22.8	0	0	0	119.2
286	M	35.2	Very low	28.3	Very low	183 Å²	183	143.5 Å²	143.5	90%	0.901	76%	0.764	S	S	*	*			trans	-102.9	160.6	-170.2	-59.2	-169.5	-62.6	0	0	113.6
287	G	29.7	Very low	28.8	Very low	68 Å²	68	144.1 Å²	144.1	70%	0.701	77%	0.767	S	S	*	*			trans	-171.7	96.4	169.8	0	0	0	0	0	114.6
288	D	27.6	Very low	29.1	Very low	151 Å²	151	143.4 Å²	143.4	81%	0.807	77%	0.769	S	S	*	*			trans	46.3	108.1	146.5	-54.4	-29.7	0	0	0	122.3
289	C	26.3	Very low	29.4	Very low	113 Å²	113	141.3 Å²	141.3	76%	0.764	77%	0.767	S	S	*	*				60.2	150.6	118.2	-60.3	0	0	0	0	123.6
290	Q	28.3	Very low	29.7	Very low	178 Å²	178	143.3 Å²	143.3	83%	0.832	77%	0.771	S	S	*	*			trans	70	145.3	169.3	-63.9	-170.4	-98.9	0	0	116.1
291	D	27.3	Very low	30	Very low	121 Å²	121	138.8 Å²	138.8	65%	0.647	77%	0.768	S	S	*	*			cis	-152.2	-179.9	-14.4	-137.2	-39.5	0	0	0	108.5
292	D	29	Very low	30.1	Very low	138 Å²	138	139 Å²	139	74%	0.738	77%	0.772	S	S	*	*			trans	64.3	160.1	163.4	-73.3	-57.9	0	0	0	119
293	T	31.1	Very low	30.4	Very low	99 Å²	99	137.3 Å²	137.3	61%	0.607	77%	0.765	S	S	*	*			cis	-170.1	134.3	-37.9	-92.4	0	0	0	0	106.3
294	D	30.2	Very low	30.6	Very low	125 Å²	125	141.1 Å²	141.1	67%	0.668	77%	0.769	S	S	*	*			trans	33.5	124.6	163.6	-53.2	-23	0	0	0	122.2
295	H	36.2	Very low	30.7	Very low	165 Å²	165	134.9 Å²	134.9	76%	0.764	76%	0.755	S	S	*	*				171.7	128.4	100.9	-84.2	85.4	0	0	0	108.4
296	N	32.7	Very low	30.7	Very low	130 Å²	130	136.3 Å²	136.3	70%	0.695	76%	0.756	S	S	*	*				67.8	127.8	65.4	-147.1	40.9	0	0	0	111.3
297	E	35.5	Very low	30.3	Very low	167 Å²	167	135.3 Å²	135.3	78%	0.78	76%	0.755	S	S	*	*			cis	-134.3	159.1	16.5	-67.4	172.8	155.8	0	0	110.4
298	G	32.6	Very low	30.1	Very low	73 Å²	73	141.4 Å²	141.4	75%	0.753	76%	0.762	S	S	*	*				107.3	153.8	78.3	0	0	0	0	0	110.7
299	V	34.4	Very low	29.9	Very low	124 Å²	124	141.6 Å²	141.6	75%	0.752	76%	0.763	S	S	*	*			cis	-150.8	139.5	3.5	167.6	0	0	0	0	109.4
300	E	31.8	Very low	30.2	Very low	192 Å²	192	141.4 Å²	141.4	90%	0.897	76%	0.763	S	S	*	*			trans	23	149.8	152.4	-59	161.3	-166.5	0	0	122.9
301	G	32	Very low	30	Very low	66 Å²	66	136.3 Å²	136.3	68%	0.68	76%	0.759	S	S	*	*			cis	166.3	175.1	-2.1	0	0	0	0	0	114.4
302	E	30.2	Very low	29.9	Very low	200 Å²	200	137 Å²	137	94%	0.935	77%	0.767	S	S	*	*			trans	68.5	141.9	164.3	-56.1	-149.8	132.9	0	0	119.4
303	S	30.5	Very low	29.8	Very low	100 Å²	100	135.7 Å²	135.7	70%	0.699	77%	0.769	S	S	*	*			cis	-155.6	153.8	-4.5	57.6	0	0	0	0	113.4
304	K	29.5	Very low	29.6	Very low	190 Å²	190	137 Å²	137	83%	0.826	78%	0.782	S	S	*	*			trans	60.9	149.3	148.4	-100.9	-175.1	169.5	-176	0	120.2
305	V	27.2	Very low	29.5	Very low	97 Å²	97	136.9 Å²	136.9	59%	0.588	79%	0.791	S	S	*	*			cis	-142.8	156.8	2.1	-149	0	0	0	0	109.9
306	E	28.5	Very low	29.2	Very low	182 Å²	182	136.4 Å²	136.4	85%	0.85	79%	0.792	S	S	*	*			trans	41.5	118.3	148.9	-81	152.8	-130.9	0	0	121.4
307	N	26	Very low	28.8	Very low	163 Å²	163	135.4 Å²	135.4	87%	0.872	80%	0.795	S	S	*	*			trans	-149.7	162.5	138.5	-150.3	-2	0	0	0	111.8
308	F	25.8	Very low	28.4	Very low	195 Å²	195	131.9 Å²	131.9	86%	0.855	79%	0.786	S	S	*	*			trans	-66.5	146.7	175.2	-88.8	-129.3	0	0	0	112.4
309	D	23.6	Very low	28.2	Very low	155 Å²	155	136.1 Å²	136.1	83%	0.829	79%	0.786	S	S	*	*				-154.2	-177	110.7	-140.9	-47.4	0	0	0	111
310	S	31.9	Very low	27.8	Very low	109 Å²	109	136.1 Å²	136.1	76%	0.762	79%	0.786	S	S	*	*			trans	-96.9	154.4	-158.9	52.2	0	0	0	0	114.6
311	G	25	Very low	27.6	Very low	71 Å²	71	133.7 Å²	133.7	73%	0.732	78%	0.779	S	S	*	*			trans	-178.4	160	157.6	0	0	0	0	0	111.6
312	V	25.1	Very low	27.4	Very low	135 Å²	135	136 Å²	136	82%	0.818	78%	0.781	S	S	*	*			cis	-163	152.2	-15.7	116.8	0	0	0	0	106.3
313	S	25.2	Very low	27.5	Very low	111 Å²	111	134.8 Å²	134.8	78%	0.776	78%	0.777	S	S	*	*			trans	45.1	122.8	164.9	-64.4	0	0	0	0	121.1
314	S	28.1	Very low	27.4	Very low	127 Å²	127	137.2 Å²	137.2	89%	0.888	78%	0.777	S	S	*	*			trans	-54.3	149.7	158.1	-39.1	0	0	0	0	113.1
315	S	28.6	Very low	27.3	Very low	122 Å²	122	135.1 Å²	135.1	85%	0.853	77%	0.77	S	S	*	*			trans	-126.4	157.8	163.4	54.6	0	0	0	0	111.7
316	I	28.4	Very low	27.3	Very low	156 Å²	156	137.8 Å²	137.8	80%	0.8	78%	0.776	S	S	*	*			trans	-87	143.2	-163.4	-68.8	158.3	0	0	0	113.1	T318	I316-T318 HydrophobicContact CG2-CG2 4.25Å
317	S	24.2	Very low	28.2	Very low	108 Å²	108	134 Å²	134	76%	0.755	77%	0.768	S	S	*	*			trans	-177	110.6	139.7	-94.8	0	0	0	0	107.8
318	T	27.1	Very low	28.2	Very low	94 Å²	94	135.4 Å²	135.4	58%	0.577	76%	0.762	S	S	*	*				73.5	135.4	77.2	62	0	0	0	0	115.2	I316	I316-T318 HydrophobicContact CG2-CG2 4.25Å
319	E	28.6	Very low	28.3	Very low	161 Å²	161	134.4 Å²	134.4	75%	0.752	77%	0.765	S	S	*	*			trans	53.1	152	152.7	76.5	-139	114.5	0	0	121.7
320	T	27.5	Very low	28.5	Very low	124 Å²	124	132 Å²	132	76%	0.761	76%	0.756	S	S	*	*			cis	-162.9	163.5	-24.5	22.9	0	0	0	0	109.4
321	D	26.6	Very low	28.6	Very low	141 Å²	141	131 Å²	131	75%	0.754	75%	0.749	S	S	*	*			trans	72.8	-169.9	150.6	-105.1	-62.2	0	0	0	122.1
322	T	27.9	Very low	28.6	Very low	116 Å²	116	136.8 Å²	136.8	71%	0.712	75%	0.754	S	S	*	*				-124.4	141.3	-128.8	35.4	0	0	0	0	117.7
323	M	32.2	Very low	28.7	Very low	173 Å²	173	135.9 Å²	135.9	85%	0.852	75%	0.754	S	S	*	*			trans	68	158.8	130.9	-156.4	163.4	166.9	0	0	122.2
324	E	29	Very low	29.1	Very low	151 Å²	151	141.9 Å²	141.9	71%	0.706	76%	0.76	S	S	*	*			trans	73.7	148.4	171.8	-58.1	-139.9	88.2	0	0	117.2
325	Q	26.4	Very low	29	Very low	147 Å²	147	144 Å²	144	69%	0.687	76%	0.761	S	S	*	*			cis	-149.8	143	-1.1	-114	158.9	34.2	0	0	108.2
326	Q	27.8	Very low	29.1	Very low	152 Å²	152	142.3 Å²	142.3	71%	0.71	75%	0.754	S	S	*	*				55.7	158.6	97.2	-69.6	-80.9	-14.4	0	0	116.6
327	P	46.7	Very low	29	Very low	104 Å²	104	142.3 Å²	142.3	68%	0.675	76%	0.761	S	S	*	*			cis	-139.2	171.1	1.8	21.1	6.2	0	0	0	119.5
328	Y	27.3	Very low	29.2	Very low	192 Å²	192	140 Å²	140	75%	0.753	76%	0.755	S	S	*	*			trans	40.8	135.7	146.1	-75.6	-69.9	0	0	0	126.8
329	L	28	Very low	29.3	Very low	173 Å²	173	145.5 Å²	145.5	91%	0.906	77%	0.774	S	S	*	*				-154.1	164.9	122	-111	178.1	0	0	0	111.6
330	T	27.3	Very low	29.2	Very low	105 Å²	105	141 Å²	141	64%	0.644	77%	0.77	S	S	*	*			trans	-148.9	157.1	-161.4	-30.8	0	0	0	0	113.9
331	S	32.6	Very low	29.5	Very low	89 Å²	89	143.2 Å²	143.2	62%	0.622	77%	0.772	S	S	*	*				141.7	172.1	126.6	68.6	0	0	0	0	118
332	F	25.7	Very low	29.6	Very low	192 Å²	192	145.3 Å²	145.3	84%	0.842	78%	0.777	S	S	*	*			trans	78	132.8	-179.4	-53.3	-69.8	0	0	0	117
333	S	26.9	Very low	29.7	Very low	115 Å²	115	143 Å²	143	80%	0.804	78%	0.777	S	S	*	*			cis	-148.7	171.8	-0.4	-109.2	0	0	0	0	113.2
334	R	33.2	Very low	29.6	Very low	238 Å²	238	142.1 Å²	142.1	90%	0.898	77%	0.774	S	S	*	*			trans	-98.1	164.4	-175.1	-71.6	174	163.9	163.2	-7	113.7
335	D	27.8	Very low	29.6	Very low	171 Å²	171	144.1 Å²	144.1	91%	0.914	78%	0.783	S	S	*	*				-148.9	166.5	122.9	-121.2	-33.7	0	0	0	111.3
336	A	29.1	Very low	29.7	Very low	86 Å²	86	141 Å²	141	71%	0.711	79%	0.791	S	S	*	*			trans	-150.9	146.8	-161.9	0	0	0	0	0	118.6
337	V	27.1	Very low	29.6	Very low	157 Å²	157	138.3 Å²	138.3	95%	0.952	79%	0.794	S	S	*	*			trans	-152.4	139.7	155.2	-174.6	0	0	0	0	106.3
338	G	28.7	Very low	29.7	Very low	60 Å²	60	139 Å²	139	62%	0.619	80%	0.798	S	S	*	*			cis	175.1	144.6	-8.1	0	0	0	0	0	110.1
339	E	27.9	Very low	29.6	Very low	208 Å²	208	135 Å²	135	97%	0.972	79%	0.794	S	S	*	*			trans	62.7	145.3	175.4	-49.1	-169.3	134.6	0	0	117.2
340	G	28.4	Very low	29.5	Very low	66 Å²	66	134.5 Å²	134.5	68%	0.68	79%	0.787	S	S	*	*			cis	-170.2	144.9	-8.6	0	0	0	0	0	113.6
341	Q	32	Very low	29.4	Very low	171 Å²	171	135.5 Å²	135.5	80%	0.799	79%	0.787	S	S	*	*			trans	56.1	119.5	158.3	-72.1	162.4	-53.5	0	0	122.8
342	Q	30.4	Very low	29	Very low	185 Å²	185	139.5 Å²	139.5	86%	0.864	80%	0.796	S	S	*	*			trans	62.7	132.6	133.3	-59.3	169.9	-2.2	0	0	120.2
343	G	29	Very low	29	Very low	68 Å²	68	135.6 Å²	135.6	70%	0.701	79%	0.788	S	S	*	*			cis	159.2	163.9	-9.4	0	0	0	0	0	114.4
344	I	30.6	Very low	28.8	Very low	154 Å²	154	134.9 Å²	134.9	79%	0.79	78%	0.783	S	S	*	*			trans	74.5	108.1	159.7	-60	178.3	0	0	0	118.4
345	E	28	Very low	28.3	Very low	194 Å²	194	130.5 Å²	130.5	91%	0.907	78%	0.777	S	S	*	*			trans	53.5	157.7	137.6	-57.5	178.4	154.7	0	0	122.7
346	G	28.6	Very low	28.2	Very low	82 Å²	82	127 Å²	127	85%	0.845	77%	0.766	S	S	*	*			trans	125.2	96.3	160.7	0	0	0	0	0	116.1
347	A	26.1	Very low	28.3	Very low	94 Å²	94	128.2 Å²	128.2	78%	0.777	77%	0.769	S	S	*	*			trans	-125.3	175.1	161.3	0	0	0	0	0	108.1
348	P	48	Very low	29.1	Very low	118 Å²	118	125.6 Å²	125.6	77%	0.766	76%	0.755	S	S	*	*			cis	-128.1	-143.7	-16	20.3	6.2	0	0	0	110.5
349	V	26.4	Very low	29.2	Very low	110 Å²	110	129.7 Å²	129.7	67%	0.667	76%	0.759	S	S	*	*			trans	97.1	97.2	148.6	176.8	0	0	0	0	119.4
350	Q	25	Very low	29.3	Very low	161 Å²	161	127.7 Å²	127.7	75%	0.752	74%	0.742	S	S	*	*				84.9	149.7	128.3	-78.9	179.1	6	0	0	124.8
351	I	25.4	Very low	29.2	Very low	127 Å²	127	133.5 Å²	133.5	65%	0.651	75%	0.754	S	S	*	*			trans	75	111.2	142.2	-76.6	164.6	0	0	0	119.1
352	E	24.6	Very low	29.4	Very low	172 Å²	172	132 Å²	132	80%	0.804	75%	0.747	S	S	*	*			trans	58.6	165.9	136.3	-61.8	-167.5	179.9	0	0	119.9
353	V	26	Very low	29.4	Very low	110 Å²	110	131.2 Å²	131.2	67%	0.667	74%	0.741	S	S	*	*			cis	-152.9	150.8	-28.5	131.2	0	0	0	0	107.3
354	S	23.2	Very low	29.5	Very low	100 Å²	100	132.3 Å²	132.3	70%	0.699	73%	0.734	S	S	*	*			trans	65.9	148.2	160.1	66.7	0	0	0	0	122.2
355	D	21.7	Very low	29.8	Very low	147 Å²	147	132.7 Å²	132.7	79%	0.786	73%	0.732	S	S	*	*				107.9	151.2	127.9	-126.9	-47.8	0	0	0	120.6
356	S	27	Very low	29.9	Very low	96 Å²	96	130.9 Å²	130.9	67%	0.671	73%	0.729	S	S	*	*			trans	73.1	81.9	153.2	-65.5	0	0	0	0	118.5
357	S	29.9	Very low	30.1	Very low	112 Å²	112	130 Å²	130	78%	0.783	72%	0.72	S	S	*	*			trans	-61.6	154.5	131.6	-177	0	0	0	0	109.6
358	P	44.2	Very low	30.1	Very low	102 Å²	102	132.6 Å²	132.6	66%	0.662	72%	0.72	S	S	*	*				-146.4	149.1	115.1	36.4	-22.1	0	0	0	115.9
359	E	31	Very low	29.3	Very low	147 Å²	147	131.9 Å²	131.9	69%	0.687	71%	0.714	S	S	*	*			trans	61.2	153.2	138.7	-70.7	-160.5	113.8	0	0	121.3
360	R	29.9	Very low	29.5	Very low	165 Å²	165	131.1 Å²	131.1	62%	0.623	71%	0.713	S	S	*	*			cis	-178.4	146.8	-18	164.3	168.3	174.7	-176.2	0.2	109.7
361	M	26.6	Very low	29.8	Very low	188 Å²	188	131.8 Å²	131.8	93%	0.926	72%	0.716	S	S	*	*				-167.5	156.4	128.6	-103.4	175.2	83.3	0	0	111.7
362	Q	36.7	Very low	30	Very low	141 Å²	141	130.6 Å²	130.6	66%	0.659	72%	0.719	S	S	*	*			trans	-95.5	177	-164.4	-68.5	167.9	-97.8	0	0	110.3
363	K	29.5	Very low	30.2	Very low	168 Å²	168	128.5 Å²	128.5	73%	0.73	72%	0.719	S	S	*	*			cis	-178.7	138.1	49.5	-163.7	-161.4	160.4	-170.7	0	113.4
364	T	31.5	Very low	30.4	Very low	91 Å²	91	128.4 Å²	128.4	56%	0.558	72%	0.723	S	S	*	*			trans	60.4	159.3	151.6	48.4	0	0	0	0	119.3
365	E	35.7	Very low	30.5	Very low	162 Å²	162	131.4 Å²	131.4	76%	0.757	73%	0.731	S	S	*	*			cis	-167.2	154.7	-2.3	-113.7	143.4	-157.4	0	0	106.6
366	D	31.6	Very low	31	Very low	156 Å²	156	129.4 Å²	129.4	83%	0.834	73%	0.728	S	S	*	*			cis	-163.5	167.3	-41.4	-139	-50.2	0	0	0	110.8
367	G	31.4	Very low	30.9	Very low	63 Å²	63	130.9 Å²	130.9	65%	0.649	74%	0.739	S	S	*	*			trans	80.6	147.9	171.1	0	0	0	0	0	118.7
368	D	26.7	Very low	31.1	Very low	148 Å²	148	133.7 Å²	133.7	79%	0.791	74%	0.742	S	S	*	*			cis	-158.4	145	-6.1	-144.1	-25.7	0	0	0	113.5
369	T	30.6	Very low	30.4	Very low	104 Å²	104	137.1 Å²	137.1	64%	0.638	75%	0.751	S	S	*	*			trans	15.4	105.8	150.5	-55.2	0	0	0	0	118.1
370	S	30.9	Very low	30.4	Very low	93 Å²	93	138.9 Å²	138.9	65%	0.65	76%	0.759	S	S	*	*				66.1	132.6	63.3	90.2	0	0	0	0	116.4
371	H	31.6	Very low	30.9	Very low	175 Å²	175	136.9 Å²	136.9	81%	0.81	77%	0.767	S	S	*	*				176.9	150.3	121.6	-100.7	-72.6	0	0	0	113.4
372	S	30.4	Very low	31.1	Very low	103 Å²	103	135.3 Å²	135.3	72%	0.72	76%	0.762	S	S	*	*			trans	-145.6	132.3	179.9	57.5	0	0	0	0	111.3
373	T	28.3	Very low	31.3	Very low	128 Å²	128	133.4 Å²	133.4	79%	0.785	76%	0.762	S	S	*	*			trans	-167.8	117.8	161.7	34.6	0	0	0	0	106.1
374	S	30.9	Very low	31.3	Very low	108 Å²	108	132.6 Å²	132.6	76%	0.755	77%	0.765	S	S	*	*				74	116.7	60.7	75	0	0	0	0	114.3
375	D	24.8	Very low	31	Very low	162 Å²	162	132.7 Å²	132.7	87%	0.866	77%	0.77	S	S	*	*				-157.5	171.5	120.2	-139.4	-30	0	0	0	112
376	S	31.2	Very low	30.6	Very low	105 Å²	105	130.8 Å²	130.8	73%	0.734	77%	0.769	S	S	*	*			trans	-129.9	151.4	-172.2	-58.2	0	0	0	0	113.3
377	S	26.2	Very low	30.4	Very low	128 Å²	128	132.1 Å²	132.1	90%	0.895	77%	0.767	S	S	*	*			trans	-157.7	150.4	161.3	-68.6	0	0	0	0	110.7
378	M	34.5	Very low	30	Very low	171 Å²	171	136.6 Å²	136.6	84%	0.842	78%	0.775	S	S	*	*			trans	-115.3	159.7	-178.4	-63.2	176.1	171.3	0	0	111.9
379	M	29	Very low	30.2	Very low	173 Å²	173	134 Å²	134	85%	0.852	77%	0.768	S	S	*	*				169.1	159.8	120.2	-85.5	-54.5	167.2	0	0	113.1
380	H	30.1	Very low	30.3	Very low	185 Å²	185	135 Å²	135	86%	0.856	78%	0.777	S	S	*	*			trans	-98.7	-173.7	175.7	-69.1	-93.4	0	0	0	111
381	P	41.5	Very low	30	Very low	123 Å²	123	138.9 Å²	138.9	80%	0.799	79%	0.787	S	S	*	*			cis	-135	-165.9	-1.5	30.5	-4.9	0	0	0	116.3
382	L	30.3	Very low	29.9	Very low	155 Å²	155	134.5 Å²	134.5	81%	0.812	78%	0.776	S	S	*	*			trans	-65.4	176.2	170.1	-105.2	74.4	0	0	0	113.9
383	P	41.8	Very low	29.7	Very low	101 Å²	101	137 Å²	137	66%	0.656	78%	0.776	S	S	*	*			cis	-155.6	-179.4	38.7	45	-23.2	0	0	0	120.9
384	N	27.9	Very low	29.6	Very low	150 Å²	150	139.5 Å²	139.5	80%	0.802	77%	0.773	S	S	*	*			trans	59.1	159.8	143.8	-75.7	1.7	0	0	0	122.2
385	S	26.9	Very low	29.2	Very low	94 Å²	94	140 Å²	140	66%	0.657	77%	0.765	S	S	*	*			cis	-172.5	-163.8	-16.3	56.5	0	0	0	0	110.8
386	V	27.1	Very low	29.3	Very low	121 Å²	121	141.8 Å²	141.8	73%	0.733	76%	0.759	S	S	*	*			trans	76.9	115.6	166.2	168.8	0	0	0	0	115.4
387	K	25.7	Very low	29.1	Very low	184 Å²	184	144.8 Å²	144.8	80%	0.8	76%	0.761	S	S	*	*				66.5	148.3	79.5	-74.3	-176.5	-179.8	-174	0	112.8
388	L	23.6	Very low	29	Very low	157 Å²	157	145.5 Å²	145.5	82%	0.822	75%	0.754	S	S	*	*			cis	-155.8	174.8	9.8	-126.6	163.3	0	0	0	110.2
389	S	30.3	Very low	28.6	Very low	93 Å²	93	144.8 Å²	144.8	65%	0.65	75%	0.748	S	S	*	*			trans	-101.9	169	167.2	-176.6	0	0	0	0	110.4
390	P	32.8	Very low	28.4	Very low	125 Å²	125	140.2 Å²	140.2	81%	0.812	73%	0.733	S	S	*	*				-146.4	162.7	114.3	38.8	-24.5	0	0	0	117.3
391	M	26	Very low	28.4	Very low	176 Å²	176	139.6 Å²	139.6	87%	0.867	73%	0.731	S	S	*	*			trans	-73.6	172.2	163.1	-140.8	78.1	155	0	0	109.4
392	S	29.6	Very low	27.6	Very low	83 Å²	83	139.2 Å²	139.2	58%	0.58	73%	0.726	S	S	*	*			cis	178.9	-170.6	33.3	50.4	0	0	0	0	111.4
393	Q	26.5	Very low	27.6	Very low	154 Å²	154	136.3 Å²	136.3	72%	0.72	72%	0.719	S	S	*	*			trans	75	146.1	161.8	-63.7	173.6	20.8	0	0	116.9
394	Y	24.3	Very low	27	Very low	182 Å²	182	137.7 Å²	137.7	71%	0.714	72%	0.721	S	S	*	*			cis	-160.6	-168.7	-3.3	-117.4	-32.4	0	0	0	109.8
395	M	24.1	Very low	27	Very low	119 Å²	119	137.7 Å²	137.7	59%	0.586	72%	0.72	S	S	*	*			cis	-147.5	-80.3	7.9	-136.9	-58.4	159.6	0	0	115.5
396	R	26.3	Very low	27	Very low	198 Å²	198	144 Å²	144	75%	0.747	73%	0.729	S	S	*	*			trans	-149.6	160.3	-166.6	-84	168.1	-168.7	-178.8	3.1	110.9
397	Q	26.1	Very low	27.1	Very low	168 Å²	168	146.2 Å²	146.2	79%	0.785	73%	0.734	S	S	*	*			cis	109.9	159.9	21.6	-155.8	-176.9	17.2	0	0	112.4
398	I	24.8	Very low	28.2	Very low	143 Å²	143	142.5 Å²	142.5	73%	0.733	73%	0.728	S	S	*	*			trans	80.6	139.6	176.1	-59	171.8	0	0	0	114.5
399	E	26.1	Very low	28.4	Very low	157 Å²	157	142 Å²	142	73%	0.734	73%	0.725	S	S	*	*			cis	-157.1	149.4	-25	-104.4	-159.6	72.4	0	0	108.4
400	S	25.5	Very low	28.2	Very low	76 Å²	76	143.3 Å²	143.3	53%	0.531	73%	0.729	S	S	.	*				82.5	140.4	80.1	109.4	0	0	0	0	117.7
401	H	28.7	Very low	28.1	Very low	173 Å²	173	143.1 Å²	143.1	80%	0.801	73%	0.725	S	S	*	*			trans	166.3	108.9	159	-88.6	-50.6	0	0	0	108.2
402	T	25.8	Very low	28.9	Very low	114 Å²	114	140.1 Å²	140.1	70%	0.699	72%	0.719	S	S	*	*				64.7	134.2	71.8	65.2	0	0	0	0	115.5
403	S	30.2	Very low	28.8	Very low	95 Å²	95	141.6 Å²	141.6	66%	0.664	73%	0.729	S	S	*	*			cis	-174	-174.8	-10.2	54.3	0	0	0	0	110.8
404	N	28.1	Very low	28.9	Very low	130 Å²	130	141.5 Å²	141.5	70%	0.695	73%	0.733	S	S	*	*			trans	121	105.9	155.9	-56.5	-19.1	0	0	0	114.3
405	L	28.5	Very low	29.2	Very low	149 Å²	149	137.6 Å²	137.6	78%	0.78	73%	0.733	S	S	*	*				76.4	135.4	79.4	-70.7	167.3	0	0	0	112.8
406	R	27.3	Very low	29.4	Very low	228 Å²	228	140.1 Å²	140.1	86%	0.86	74%	0.743	S	S	*	*			cis	-160.9	159.6	14	-155.9	173	176.8	146	-3.9	111.5
407	M	29.3	Very low	29.6	Very low	167 Å²	167	136.4 Å²	136.4	82%	0.823	74%	0.742	S	S	*	*			trans	-103.9	-161.8	167.6	-57.5	171.6	62.1	0	0	110.4
408	P	47.6	Very low	29.7	Very low	105 Å²	105	137.3 Å²	137.3	68%	0.682	75%	0.749	S	S	*	*			cis	-120.1	-163.4	-29	18.4	7	0	0	0	112.1
409	I	28.5	Very low	29.9	Very low	147 Å²	147	134.2 Å²	134.2	75%	0.754	75%	0.752	S	S	*	*				-175.5	170.1	68.6	-83.9	178.5	0	0	0	111.9
410	T	26.5	Very low	30.3	Very low	120 Å²	120	133.3 Å²	133.3	74%	0.736	76%	0.757	S	S	*	*			trans	-65.2	-174.2	177	45.5	0	0	0	0	114.9
411	V	31	Very low	30.4	Very low	122 Å²	122	134.6 Å²	134.6	74%	0.739	77%	0.772	S	S	*	*			cis	-153.4	-134.8	41	-138.2	0	0	0	0	114.5
412	P	41.7	Very low	30.3	Very low	112 Å²	112	130 Å²	130	73%	0.727	77%	0.772	S	S	*	*				-96.3	-175.8	-107.9	30.3	-8.8	0	0	0	114.4
413	S	27.6	Very low	30.7	Very low	114 Å²	114	129.6 Å²	129.6	80%	0.797	77%	0.774	S	S	*	*			cis	-164.9	-169.7	46.3	-52.4	0	0	0	0	115.3
414	N	28.2	Very low	31.3	Very low	152 Å²	152	129.9 Å²	129.9	81%	0.813	78%	0.776	S	S	*	*			trans	-104.6	156	-169.7	-66.9	-38.2	0	0	0	117
415	S	30.6	Very low	31.3	Very low	100 Å²	100	133.8 Å²	133.8	70%	0.699	79%	0.787	S	S	*	*			trans	49.7	133.9	134.1	70	0	0	0	0	124.1
416	Q	29.3	Very low	31.7	Very low	173 Å²	173	134.4 Å²	134.4	81%	0.808	79%	0.79	S	S	*	*				174.2	128.9	114	-92.2	-171.7	43.1	0	0	110.8
417	V	30.4	Very low	32.6	Very low	119 Å²	119	129 Å²	129	72%	0.721	78%	0.784	S	S	*	*				92.8	119.4	95.4	172.7	0	0	0	0	116.1
418	M	28.3	Very low	32.8	Very low	188 Å²	188	126.4 Å²	126.4	93%	0.926	78%	0.779	S	S	*	*			trans	19.5	130.4	144.1	-150.3	93.2	108.6	0	0	120.9
419	G	29.5	Very low	31.9	Very low	77 Å²	77	129.4 Å²	129.4	79%	0.794	79%	0.788	S	S	*	*			trans	161.2	109.1	159.3	0	0	0	0	0	117.3
420	T	33.6	Very low	31.9	Very low	139 Å²	139	131.2 Å²	131.2	85%	0.853	79%	0.79	S	S	*	*			trans	-66.7	151	-177.6	46.8	0	0	0	0	118.6
421	A	28.6	Very low	33.2	Very low	102 Å²	102	130.8 Å²	130.8	84%	0.843	79%	0.79	S	S	*	*			trans	83.9	124.5	140.4	0	0	0	0	0	123
422	G	26.7	Very low	33.1	Very low	78 Å²	78	131 Å²	131	80%	0.804	79%	0.792	S	S	*	*			trans	77.6	151.9	154.6	0	0	0	0	0	118
423	S	33	Very low	32.6	Very low	105 Å²	105	133.5 Å²	133.5	73%	0.734	79%	0.794	S	S	*	*			cis	-168.6	139.3	-17.8	48.8	0	0	0	0	111.1
424	S	42.8	Very low	33.4	Very low	101 Å²	101	133.1 Å²	133.1	71%	0.706	79%	0.789	S	S	*	*			trans	42.5	129.1	151.3	61.7	0	0	0	0	122.5
425	F	27.7	Very low	33.3	Very low	211 Å²	211	130.4 Å²	130.4	93%	0.925	78%	0.782	S	S	*	*			trans	-150.6	153.9	143.4	-94.1	-70.4	0	0	0	112.3
426	L	36.6	Very low	33.3	Very low	163 Å²	163	136.4 Å²	136.4	85%	0.853	79%	0.789	S	S	*	*			trans	-111.9	-180	174.9	-66.7	171.7	0	0	0	110.3
427	P	47.3	Very low	33.3	Very low	113 Å²	113	134.2 Å²	134.2	73%	0.734	78%	0.782	S	S	*	*				-156.2	144.5	99.7	38.8	-20	0	0	0	119
428	T	32.8	Very low	33.3	Very low	114 Å²	114	137.5 Å²	137.5	70%	0.699	79%	0.79	S	S	*	*			trans	54.5	145.7	145.9	50.5	0	0	0	0	121.9
429	L	28.5	Very low	33.3	Very low	167 Å²	167	137.9 Å²	137.9	87%	0.874	79%	0.786	S	S	*	*				-149.4	176.6	57.9	-83.6	165.8	0	0	0	115.4
430	F	29.3	Very low	34.3	Very low	185 Å²	185	139.1 Å²	139.1	81%	0.811	78%	0.78	S	S	*	*			trans	-104.1	-179.6	-171.3	-86.9	-89	0	0	0	113.2
431	P	54.4	Low	34	Very low	112 Å²	112	141.3 Å²	141.3	73%	0.727	78%	0.778	S	S	*	*			cis	-119.7	-156.9	1.8	22.7	4.2	0	0	0	112.2
432	T	27.6	Very low	34	Very low	127 Å²	127	143.4 Å²	143.4	78%	0.779	77%	0.774	S	S	*	*			cis	-145.1	-142.7	19.6	61.1	0	0	0	0	113.5
433	Q	32.8	Very low	34	Very low	164 Å²	164	149.4 Å²	149.4	77%	0.766	77%	0.774	S	S	*	*			trans	-156.8	172.3	-174.1	-94.5	-89.4	-32.4	0	0	107.2
434	P	42.7	Very low	34	Very low	106 Å²	106	150.8 Å²	150.8	69%	0.688	77%	0.772	S	S	*	*			cis	-146.5	172.9	25.2	44.8	-25.4	0	0	0	121.1
435	S	27.6	Very low	34.1	Very low	95 Å²	95	152 Å²	152	66%	0.664	78%	0.778	S	S	*	*			trans	97.8	125.9	135.3	73.5	0	0	0	0	124.5
436	R	29.9	Very low	34	Very low	226 Å²	226	145.4 Å²	145.4	85%	0.853	77%	0.769	S	S	*	*			trans	77	103.1	140.8	-72.4	-174.4	166	160.8	-0.3	124.1
437	D	30	Very low	34	Very low	126 Å²	126	145.4 Å²	145.4	67%	0.674	77%	0.765	S	S	*	*				47.7	113.7	114.9	-50.6	-43.4	0	0	0	121.9
438	H	30.2	Very low	33.3	Very low	189 Å²	189	148.1 Å²	148.1	88%	0.875	77%	0.768	S	S	*	*				174.1	171	102.6	-90.7	-64.8	0	0	0	114.2
439	K	27.4	Very low	33.8	Very low	196 Å²	196	152.1 Å²	152.1	85%	0.852	78%	0.778	S	S	*	*			trans	-128.7	177.9	175.7	-79.1	-176.5	176.7	178.8	0	107.9
440	P	51.1	Low	34	Very low	102 Å²	102	149.4 Å²	149.4	66%	0.662	77%	0.771	S	S	*	*			cis	-139.3	-175.6	-48.7	40.9	-24.3	0	0	0	114.3
441	F	26.6	Very low	34.1	Very low	186 Å²	186	148.9 Å²	148.9	82%	0.816	77%	0.771	S	S	*	*			trans	72.9	131.3	147.7	-88.7	-62.1	0	0	0	123.9
442	L	29	Very low	33	Very low	146 Å²	146	153.4 Å²	153.4	76%	0.764	78%	0.78	S	S	*	*			trans	67.9	153.3	158.8	-54.6	178.7	0	0	0	117.3
443	Y	26.4	Very low	33.5	Very low	204 Å²	204	153.4 Å²	153.4	80%	0.8	78%	0.779	S	S	*	*			cis	-142.3	-174.9	20	-155.6	-98.9	0	0	0	112.6
444	L	32.7	Very low	33.5	Very low	133 Å²	133	149.6 Å²	149.6	70%	0.696	78%	0.776	S	S	*	*			trans	-76.3	-179.9	178.8	-62.1	77.4	0	0	0	112.9
445	P	44.8	Very low	33.5	Very low	128 Å²	128	151 Å²	151	83%	0.831	78%	0.782	S	S	*	*			cis	-135.5	-179.8	-2.9	42.4	-25.7	0	0	0	116.2
446	G	27.2	Very low	34.2	Very low	71 Å²	71	151.5 Å²	151.5	73%	0.732	78%	0.783	S	S	*	*			trans	133	135.8	142.2	0	0	0	0	0	120
447	Q	35.3	Very low	34.8	Very low	164 Å²	164	146.1 Å²	146.1	77%	0.766	78%	0.778	S	S	*	*			trans	33.8	133.7	142.2	-72.3	-92.7	-14.1	0	0	122.6
448	Q	33.3	Very low	35.2	Very low	170 Å²	170	146.3 Å²	146.3	79%	0.794	79%	0.785	S	S	*	*			trans	77.9	136.8	153.1	-67.1	166.3	41.8	0	0	119.5
449	Q	43.8	Very low	35.5	Very low	197 Å²	197	142.1 Å²	142.1	92%	0.921	78%	0.783	S	S	*	*			trans	-98.1	140.1	-178.7	-63.8	173.2	-19.8	0	0	111.1
450	P	32.2	Very low	36.2	Very low	110 Å²	110	140.7 Å²	140.7	71%	0.714	78%	0.782	S	S	*	*			trans	-126.8	132.9	158.8	34.4	-21.3	0	0	0	113.9
451	Q	32	Very low	35.6	Very low	174 Å²	174	141.4 Å²	141.4	81%	0.813	79%	0.787	S	S	*	*			trans	48.5	90.3	141.8	-57.6	-62.9	-20	0	0	118.7
452	F	29.7	Very low	35.8	Very low	207 Å²	207	138 Å²	138	91%	0.908	79%	0.786	S	S	*	*			trans	-88.1	109	153.4	-109.8	-88.7	0	0	0	109.9	A454	F452-A454 PolarHBondContact O-N 3.34Å
453	V	38.8	Very low	36.2	Very low	128 Å²	128	140.3 Å²	140.3	78%	0.776	79%	0.79	S	S	*	*			trans	-80.8	98.5	169.1	178.4	0	0	0	0	108.6
454	A	33.3	Very low	36.6	Very low	83 Å²	83	136 Å²	136	69%	0.686	79%	0.787	S	S	*	*	P	Polyproline II helix	trans	-92.9	126.5	170.3	0	0	0	0	0	110.1	F452	F452-A454 PolarHBondContact O-N 3.34Å
455	V	42.1	Very low	36.9	Very low	135 Å²	135	136.3 Å²	136.3	82%	0.818	79%	0.79	S	S	*	*	P	Polyproline II helix	trans	-72.6	126.1	174.2	179.4	0	0	0	0	108.9
456	P	41.5	Very low	36.5	Very low	107 Å²	107	136.4 Å²	136.4	70%	0.695	79%	0.79	S	S	*	*	P	Polyproline II helix	trans	-76.6	145.3	-176.9	30.1	-34.8	0	0	0	112.4
457	P	43.2	Very low	36.8	Very low	113 Å²	113	140.8 Å²	140.8	73%	0.734	79%	0.794	S	S	*	*	P	Polyproline II helix	trans	-69.6	160	168.9	31	-35	0	0	0	111.6
458	P	39.4	Very low	36.9	Very low	129 Å²	129	138.3 Å²	138.3	84%	0.838	79%	0.794	S	S	*	*	P	Polyproline II helix	trans	-64.2	138	-177.9	26.4	-35	0	0	0	112.4
459	A	35.7	Very low	37.4	Very low	101 Å²	101	135 Å²	135	84%	0.835	79%	0.785	S	S	*	*	P	Polyproline II helix	trans	-73.1	134.5	-177.1	0	0	0	0	0	112.8
460	M	42.1	Very low	37.1	Very low	167 Å²	167	130.3 Å²	130.3	82%	0.823	77%	0.772	S	S	*	*	P	Polyproline II helix	trans	-67.3	143.7	162.3	-72.8	-83.2	-80.6	0	0	109.8	S462	M460-S462 PolarHBondContact O-N 3.47Å
461	P	38.6	Very low	37.3	Very low	117 Å²	117	133.8 Å²	133.8	76%	0.76	78%	0.779	S	S	*	*	P	Polyproline II helix	trans	-65.7	132.4	175.4	27.7	-33.9	0	0	0	110.8
462	S	31.7	Very low	37.8	Very low	115 Å²	115	128.6 Å²	128.6	80%	0.804	77%	0.766	S	S	*	*	P	Polyproline II helix	trans	-61.3	136.7	-175.8	-48	0	0	0	0	112.8	M460	M460-S462 PolarHBondContact O-N 3.47Å
463	F	35.5	Very low	37.9	Very low	194 Å²	194	124.4 Å²	124.4	85%	0.851	76%	0.759	S	S	*	*	P	Polyproline II helix	trans	-61.5	133.7	160.9	-71.8	-86.3	0	0	0	109.5	N465	F463-N465 PolarHBondContact O-N 2.85Å
464	P	35	Very low	37.9	Very low	114 Å²	114	123.7 Å²	123.7	74%	0.74	76%	0.76	S	S	*	*	P	Polyproline II helix	trans	-63	133	166.7	-20	32.6	0	0	0	110.2
465	N	38.9	Very low	38.3	Very low	139 Å²	139	128.3 Å²	128.3	74%	0.743	77%	0.767	S	S	*	*	P	Polyproline II helix	trans	-54.5	155.7	163.2	-79.5	-20.9	0	0	0	110.2	F463 M467	F463-N465 PolarHBondContact O-N 2.85Å; N465-M467 WeakPolarHBondContact O-CG 3.46Å; N465-M467 PolarHBondContact O-N 2.8Å
466	P	36.9	Very low	38.2	Very low	129 Å²	129	130.1 Å²	130.1	84%	0.838	77%	0.767	S	S	*	*			trans	-58.3	99.8	174.4	25	-34.5	0	0	0	109.8	S468	P466-S468 PolarHBondContact O-N 3.09Å
467	M	33.1	Very low	38.4	Very low	164 Å²	164	134.6 Å²	134.6	81%	0.808	78%	0.778	S	S	*	*	P	Polyproline II helix	trans	-68.4	124.9	-167.6	-78.4	-119.3	-76.3	0	0	111.3	N465 V469	N465-M467 WeakPolarHBondContact O-CG 3.46Å; N465-M467 PolarHBondContact O-N 2.8Å; M467-V469 PolarHBondContact O-N 3.24Å
468	S	37	Very low	38.2	Very low	112 Å²	112	137.7 Å²	137.7	78%	0.783	78%	0.783	S	S	*	*	P	Polyproline II helix	trans	-49	125.2	167.5	-58.5	0	0	0	0	110	P466 P470	P466-S468 PolarHBondContact O-N 3.09Å; S468-P470 WeakPolarHBondContact O-CD 3.27Å
469	V	43.9	Very low	38.4	Very low	100 Å²	100	136.6 Å²	136.6	61%	0.606	79%	0.785	S	S	*	*	P	Polyproline II helix	trans	-54.4	127.4	172.5	178.8	0	0	0	0	108.2	M467 Q471	M467-V469 PolarHBondContact O-N 3.24Å; V469-Q471 PolarHBondContact O-N 3.31Å
470	P	37.8	Very low	38.5	Very low	98 Å²	98	136.7 Å²	136.7	64%	0.636	79%	0.786	S	S	*	*			trans	-52.3	112.7	174.9	-28.7	36	0	0	0	110	S468 A472	S468-P470 WeakPolarHBondContact O-CD 3.27Å; P470-A472 PolarHBondContact O-N 2.88Å
471	Q	37.9	Very low	38.2	Very low	184 Å²	184	132.8 Å²	132.8	86%	0.86	79%	0.788	S	S	*	*			trans	-70.7	115.2	-174.5	-167.2	166.1	-1.3	0	0	107.5	V469	V469-Q471 PolarHBondContact O-N 3.31Å
472	A	41.5	Very low	38.4	Very low	65 Å²	65	130.7 Å²	130.7	54%	0.537	79%	0.787	S	S	.	*			trans	-57.9	135.9	-177.8	0	0	0	0	0	109.6	P470 S474	P470-A472 PolarHBondContact O-N 2.88Å; A472-S474 PolarHBondContact O-N 3.49Å
473	P	32.3	Very low	38.8	Very low	118 Å²	118	133.6 Å²	133.6	77%	0.766	79%	0.792	S	S	*	*			trans	-60	127.8	-176.5	24	-33.5	0	0	0	110.2	Q475	P473-Q475 PolarHBondContact O-N 3.41Å
474	S	37.8	Very low	39.2	Very low	114 Å²	114	127.4 Å²	127.4	80%	0.797	78%	0.783	S	S	*	*			trans	-60.2	102.2	177.5	-51.8	0	0	0	0	109.7	A472 Q476	A472-S474 PolarHBondContact O-N 3.49Å; S474-Q476 PolarHBondContact O-N 3.34Å
475	Q	42.7	Very low	39.8	Very low	180 Å²	180	128.7 Å²	128.7	84%	0.841	79%	0.792	S	S	*	*			trans	-66.4	105	176.4	-75.2	-169.2	-22.4	0	0	109.5	P473	P473-Q475 PolarHBondContact O-N 3.41Å
476	Q	39.8	Very low	40.6	Very low	172 Å²	172	124.9 Å²	124.9	80%	0.804	79%	0.785	S	S	*	*			trans	-57.7	140.1	167.6	-88	-178.2	-32.3	0	0	109.9	S474 Q478	S474-Q476 PolarHBondContact O-N 3.34Å; Q476-Q478 PolarHBondContact O-N 3.23Å
477	Q	45.2	Very low	41.6	Very low	201 Å²	201	125.3 Å²	125.3	94%	0.939	78%	0.776	S	S	*	*			trans	-83.2	100.5	-174.6	-156.3	169.7	20	0	0	109.4
478	Q	40	Very low	42.9	Very low	179 Å²	179	126.6 Å²	126.6	84%	0.836	78%	0.777	S	S	*	*			trans	-126.7	138.7	166.3	-68	-169.8	-0.9	0	0	109.3	Q476	Q476-Q478 PolarHBondContact O-N 3.23Å
479	A	44.1	Very low	44.6	Very low	106 Å²	106	125.5 Å²	125.5	88%	0.876	76%	0.758	S	S	*	*			trans	-124.3	121.5	-171.8	0	0	0	0	0	110.9
480	A	37.8	Very low	46.2	Very low	103 Å²	103	124.2 Å²	124.2	85%	0.851	75%	0.752	S	S	*	*			trans	-160.4	144.1	167	0	0	0	0	0	109.6
481	G	35.1	Very low	48.4	Very low	85 Å²	85	123 Å²	123	88%	0.876	74%	0.735	S	S	*	*			trans	68.9	115.2	166.6	0	0	0	0	0	116.4
482	G	41.7	Very low	50.7	Low	72 Å²	72	119 Å²	119	74%	0.742	72%	0.716	S	S	*	*			trans	-104.8	157.2	169.8	0	0	0	0	0	112.5
483	I	41.4	Very low	53	Low	176 Å²	176	115.9 Å²	115.9	90%	0.903	69%	0.691	S	S	*	*			trans	-164.1	125.4	143	-97.2	149.2	0	0	0	107.8
484	G	43.4	Very low	55.4	Low	64 Å²	64	116.1 Å²	116.1	66%	0.66	69%	0.69	S	S	*	*	S	Bend	trans	73.2	151	168.4	0	0	0	0	0	117.6	G486	G484-G486 PolarHBondContact O-N 3.14Å
485	P	47.4	Very low	57.5	Low	142 Å²	142	115.7 Å²	115.7	92%	0.922	68%	0.679	S	S	*	*			trans	-78.8	60.8	169.9	34.9	-35.5	0	0	0	110.9	E487	P485-E487 PolarHBondContact O-N 3.48Å
486	G	55.6	Low	59.6	Low	59 Å²	59	109.5 Å²	109.5	61%	0.608	66%	0.655	S	S	*	*			trans	-64.4	129.2	174.8	0	0	0	0	0	111.2	G484 K488	G484-G486 PolarHBondContact O-N 3.14Å; G486-K488 PolarHBondContact O-N 3.15Å
487	E	57.9	Low	61.7	Low	138 Å²	138	105.3 Å²	105.3	65%	0.645	64%	0.644	S	S	*	*			trans	-54.3	106.6	175	-67.3	-175.6	144	0	0	110.6	P485 K489	P485-E487 PolarHBondContact O-N 3.48Å; E487-K489 PolarHBondContact O-N 3.42Å; E487-K489 VanDerWaalsContact O-N 3.12Å; E487-K489 WeakPolarHBondContact OE2-CE 3.42Å; E487-K489 IonicContact OE2-NZ 3.3Å; E487-K489 PolarHBondContact OE2-NZ 2.84Å
488	K	60.3	Low	63.6	Low	190 Å²	190	101.5 Å²	101.5	83%	0.826	63%	0.625	S	S	*	*			trans	-62.2	119.5	171.8	-65.8	-173	179.6	-176	0	108.3	G486 P490	G486-K488 PolarHBondContact O-N 3.15Å; K488-P490 WeakPolarHBondContact O-CD 3.49Å
489	K	72.6	Confident	65.8	Low	90 Å²	90	96.4 Å²	96.4	39%	0.391	61%	0.606	S	S	.	*			trans	-110.6	72.2	177.8	-73.5	164.6	-178.4	159.9	0	109.5	E487 Y491 F500 T501	E487-K489 PolarHBondContact O-N 3.42Å; E487-K489 VanDerWaalsContact O-N 3.12Å; E487-K489 WeakPolarHBondContact OE2-CE 3.42Å; E487-K489 IonicContact OE2-NZ 3.3Å; E487-K489 PolarHBondContact OE2-NZ 2.84Å; K489-Y491 PolarHBondContact O-N 2.43Å; K489-F500 CarbonylContact C-O 3.56Å; K489-F500 WeakPolarHBondContact CA-O 3.38Å; K489-T501 HydrophobicContact CD-CG2 4.37Å; K489-T501 HydrophobicContact CG-CG2 3.61Å
490	P	78.7	Confident	67.9	Low	73 Å²	73	93.4 Å²	93.4	47%	0.474	57%	0.573	S	S	.	*			trans	-74.8	5.3	-166.3	32.9	-38.9	0	0	0	114.6	K488	K488-P490 WeakPolarHBondContact O-CD 3.49Å
491	Y	82.6	Confident	70.3	Confident	71 Å²	71	92 Å²	92	28%	0.278	55%	0.554	S	S	.	*	E	Extended strand (participates in β ladder)	trans	-119.4	96.9	179.4	-51.4	-70.3	0	0	0	109.8	K489 T499 F500 A502 K503	K489-Y491 PolarHBondContact O-N 2.43Å; Y491-T499 CarbonylContact O-C 3.58Å; Y491-T499 WeakPolarHBondContact O-CA 3.34Å; Y491-F500 PolarHBondContact N-O 3.27Å; Y491-F500 WeakPolarHBondContact O-CD2 3.42Å; Y491-F500 PolarHBondContact O-N 3.17Å; Y491-A502 VanDerWaalsContact CD2-C 3.44Å; Y491-K503 HydrophobicContact CD1-CB 4.25Å; Y491-K503 HydrophobicContact CD1-CG 4.33Å; Y491-K503 HydrophobicContact CD2-CB 4.33Å; Y491-K503 VanDerWaalsContact CD2-N 3.25Å; Y491-K503 HydrophobicContact CE1-CB 3.81Å; Y491-K503 HydrophobicContact CE1-CD 4.34Å; Y491-K503 HydrophobicContact CE1-CG 3.99Å; Y491-K503 HydrophobicContact CE2-CB 3.87Å; Y491-K503 HydrophobicContact CG-CB 4.5Å
492	E	87.8	Confident	72.8	Confident	101 Å²	101	89.6 Å²	89.6	47%	0.472	53%	0.526	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-97.7	140.5	173.7	-171	174.2	163.7	0	0	111.3	S497 K498 T499 Y506	E492-S497 WeakPolarHBondContact OE1-CA 3.23Å; E492-S497 WeakPolarHBondContact OE1-CB 3.43Å; E492-S497 PolarHBondContact OE1-OG 3.23Å; E492-K498 WeakPolarHBondContact CA-O 3.34Å; E492-T499 HydrophobicContact CB-CG2 4.03Å; E492-T499 HydrophobicContact CG-CG2 3.85Å; E492-Y506 WeakPolarHBondContact O-CE2 3.48Å
493	C	87.9	Confident	74.8	Confident	0 Å²	0	92 Å²	92	0%	0	52%	0.516	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-87.8	110	167.9	-175.6	0	0	0	0	111.3	L495 C496 S497 K498 Y506 H509 M510	C493-L495 PolarHBondContact O-N 3.14Å; C493-C496 PolarHBondContact O-N 2.39Å; C493-C496 VanDerWaalsContact O-N 3.16Å; C493-S497 VanDerWaalsContact O-CA 3.29Å; C493-S497 WeakPolarHBondContact O-CA 3.44Å; C493-S497 PolarHBondContact O-N 2.64Å; C493-K498 PolarHBondContact N-O 3.1Å; C493-Y506 HydrophobicContact CB-CD2 4.43Å; C493-Y506 HydrophobicContact CB-CE2 4.04Å; C493-H509 WeakPolarHBondContact CB-NE2 3.3Å; C493-H509 PolarHBondContact SG-NE2 3.35Å; C493-H509 VanDerWaalsContact SG-NE2 3.44Å; C493-M510 VanDerWaalsContact SG-SD 3.64Å
494	T	83	Confident	76.9	Confident	123 Å²	123	90.1 Å²	90.1	76%	0.755	50%	0.503	S	S	*	.	T	Hydrogen-bonded Turn	trans	-59.4	-14.8	175.8	52.9	0	0	0	0	114.5
495	L	83.2	Confident	78.9	Confident	105 Å²	105	90.6 Å²	90.6	55%	0.55	49%	0.491	S	S	.	.	T	Hydrogen-bonded Turn	trans	-94.4	-8.9	-179	-56.3	177.5	0	0	0	114	C493 M510 H513	C493-L495 PolarHBondContact O-N 3.14Å; L495-M510 HydrophobicContact CD1-CE 3.98Å; L495-H513 HydrophobicContact CD1-CB 3.63Å
496	C	86.6	Confident	80.8	Confident	50 Å²	50	85.5 Å²	85.5	34%	0.338	45%	0.453	S	S	.	.	T	Hydrogen-bonded Turn	trans	-157.3	16.6	173.4	66.6	0	0	0	0	115.5	C493 K498 H509 H513	C493-C496 PolarHBondContact O-N 2.39Å; C493-C496 VanDerWaalsContact O-N 3.16Å; C496-K498 PolarHBondContact O-N 3.46Å; C496-K498 VanDerWaalsContact O-N 3.08Å; C496-H509 VanDerWaalsContact SG-CE1 3.53Å; C496-H509 PolarHBondContact SG-NE2 2.88Å; C496-H513 PolarHBondContact SG-NE2 3.44Å; C496-H513 VanDerWaalsContact SG-NE2 3.4Å
497	S	84.1	Confident	82.2	Confident	84 Å²	84	85.5 Å²	85.5	59%	0.587	44%	0.441	S	S	*	.	T	Hydrogen-bonded Turn	trans	48.7	30.5	-178.3	-67.7	0	0	0	0	115.8	E492 C493	E492-S497 WeakPolarHBondContact OE1-CA 3.23Å; E492-S497 WeakPolarHBondContact OE1-CB 3.43Å; E492-S497 PolarHBondContact OE1-OG 3.23Å; C493-S497 VanDerWaalsContact O-CA 3.29Å; C493-S497 WeakPolarHBondContact O-CA 3.44Å; C493-S497 PolarHBondContact O-N 2.64Å
498	K	84.4	Confident	83.5	Confident	121 Å²	121	82.6 Å²	82.6	53%	0.526	43%	0.427	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-85.9	123.4	175.5	-71	-179.8	-171.9	173	0	110.4	E492 C493 C496 F500	E492-K498 WeakPolarHBondContact CA-O 3.34Å; C493-K498 PolarHBondContact N-O 3.1Å; C496-K498 PolarHBondContact O-N 3.46Å; C496-K498 VanDerWaalsContact O-N 3.08Å; K498-F500 HydrophobicContact CB-CE2 3.7Å; K498-F500 HydrophobicContact CB-CZ 3.9Å; K498-F500 WeakPolarHBondContact O-CD2 3.4Å; K498-F500 WeakPolarHBondContact O-CE2 3.45Å
499	T	87.1	Confident	84.8	Confident	72 Å²	72	74.7 Å²	74.7	44%	0.442	39%	0.393	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-98.2	138.1	-179.9	57.5	0	0	0	0	111.5	Y491 E492	Y491-T499 CarbonylContact O-C 3.58Å; Y491-T499 WeakPolarHBondContact O-CA 3.34Å; E492-T499 HydrophobicContact CB-CG2 4.03Å; E492-T499 HydrophobicContact CG-CG2 3.85Å
500	F	88.1	Confident	85.5	Confident	43 Å²	43	72.2 Å²	72.2	19%	0.189	38%	0.383	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-127.6	140.3	-176	-59.1	-92.4	0	0	0	110.6	K489 Y491 K498 A502 N505 Y506 H509	K489-F500 CarbonylContact C-O 3.56Å; K489-F500 WeakPolarHBondContact CA-O 3.38Å; Y491-F500 PolarHBondContact N-O 3.27Å; Y491-F500 WeakPolarHBondContact O-CD2 3.42Å; Y491-F500 PolarHBondContact O-N 3.17Å; K498-F500 HydrophobicContact CB-CE2 3.7Å; K498-F500 HydrophobicContact CB-CZ 3.9Å; K498-F500 WeakPolarHBondContact O-CD2 3.4Å; K498-F500 WeakPolarHBondContact O-CE2 3.45Å; F500-A502 VanDerWaalsContact C-N 3.33Å; F500-N505 HydrophobicContact CD1-CB 3.97Å; F500-Y506 HydrophobicContact CD2-CD2 4.19Å; F500-H509 HydrophobicContact CE1-CB 4.1Å; F500-H509 HydrophobicContact CE2-CB 4.22Å; F500-H509 AromaticContact CE2-CD2 3.21Å; F500-H509 WeakPolarHBondContact CE2-CD2 3.49Å; F500-H509 AromaticContact CE2-CG 3.88Å; F500-H509 AromaticContact CE2-NE2 3.92Å; F500-H509 HydrophobicContact CZ-CB 3.65Å; F500-H509 AromaticContact CZ-CD2 3.25Å; F500-H509 WeakPolarHBondContact CZ-CD2 3.25Å; F500-H509 AromaticContact CZ-CG 3.43Å; F500-H509 VanDerWaalsContact CZ-CG 3.43Å; F500-H509 AromaticContact CZ-NE2 3.95Å
501	T	87.6	Confident	85.9	Confident	72 Å²	72	71.3 Å²	71.3	44%	0.442	37%	0.372	S	S	.	.	S	Bend	trans	-70.2	-27.9	174.4	47.8	0	0	0	0	113	K489	K489-T501 HydrophobicContact CD-CG2 4.37Å; K489-T501 HydrophobicContact CG-CG2 3.61Å
502	A	86.9	Confident	86	Confident	36 Å²	36	73.1 Å²	73.1	30%	0.298	39%	0.39	S	S	.	.	S	Bend	trans	-130.8	133.3	-171.2	0	0	0	0	0	113.2	Y491 F500 Q504 N505 Y506	Y491-A502 VanDerWaalsContact CD2-C 3.44Å; F500-A502 VanDerWaalsContact C-N 3.33Å; A502-Q504 PolarHBondContact O-N 3.48Å; A502-Q504 VanDerWaalsContact O-N 3.13Å; A502-N505 PolarHBondContact O-N 2.97Å; A502-Y506 PolarHBondContact O-N 3.48Å
503	K	85.1	Confident	85.8	Confident	121 Å²	121	71.9 Å²	71.9	53%	0.526	38%	0.384	S	S	.	.	H	α-helix	trans	-53.3	-37.2	-179.6	-167.9	176.1	179.9	178.8	0	112.7	Y491 N505 Y506 V507	Y491-K503 HydrophobicContact CD1-CB 4.25Å; Y491-K503 HydrophobicContact CD1-CG 4.33Å; Y491-K503 HydrophobicContact CD2-CB 4.33Å; Y491-K503 VanDerWaalsContact CD2-N 3.25Å; Y491-K503 HydrophobicContact CE1-CB 3.81Å; Y491-K503 HydrophobicContact CE1-CD 4.34Å; Y491-K503 HydrophobicContact CE1-CG 3.99Å; Y491-K503 HydrophobicContact CE2-CB 3.87Å; Y491-K503 HydrophobicContact CG-CB 4.5Å; K503-N505 VanDerWaalsContact C-N 3.33Å; K503-N505 PolarHBondContact O-N 2.77Å; K503-Y506 PolarHBondContact O-N 3.44Å; K503-V507 HydrophobicContact CG-CG2 4.45Å; K503-V507 WeakPolarHBondContact O-CG2 3.41Å; K503-V507 PolarHBondContact O-N 2.99Å
504	Q	83.8	Confident	85.5	Confident	138 Å²	138	75.3 Å²	75.3	65%	0.645	41%	0.405	S	S	*	.	H	α-helix	trans	-62.1	-39	178	-61.2	-174.2	14.5	0	0	112.3	A502 K508	A502-Q504 PolarHBondContact O-N 3.48Å; A502-Q504 VanDerWaalsContact O-N 3.13Å; Q504-K508 WeakPolarHBondContact O-CB 3.4Å; Q504-K508 WeakPolarHBondContact O-CG 2.91Å; Q504-K508 PolarHBondContact O-N 3.15Å
505	N	86	Confident	85.5	Confident	74 Å²	74	71.3 Å²	71.3	40%	0.396	39%	0.388	S	S	.	.	H	α-helix	trans	-74.2	-37.1	-179.9	-68	-17.8	0	0	0	111.2	F500 A502 K503 K508 H509	F500-N505 HydrophobicContact CD1-CB 3.97Å; A502-N505 PolarHBondContact O-N 2.97Å; K503-N505 VanDerWaalsContact C-N 3.33Å; K503-N505 PolarHBondContact O-N 2.77Å; N505-K508 PolarHBondContact O-N 3.25Å; N505-H509 VanDerWaalsContact O-CB 3.31Å; N505-H509 WeakPolarHBondContact O-CB 3.36Å; N505-H509 PolarHBondContact O-N 3.22Å
506	Y	88.5	Confident	85.5	Confident	34 Å²	34	71.3 Å²	71.3	13%	0.133	39%	0.385	C	S	.	.	H	α-helix	trans	-59.2	-50.8	170	170.2	-112.8	0	0	0	112.1	E492 C493 F500 A502 K503 K508 H509 M510	E492-Y506 WeakPolarHBondContact O-CE2 3.48Å; C493-Y506 HydrophobicContact CB-CD2 4.43Å; C493-Y506 HydrophobicContact CB-CE2 4.04Å; F500-Y506 HydrophobicContact CD2-CD2 4.19Å; A502-Y506 PolarHBondContact O-N 3.48Å; K503-Y506 PolarHBondContact O-N 3.44Å; Y506-K508 PolarHBondContact O-N 2.86Å; Y506-H509 WeakPolarHBondContact O-CA 3.42Å; Y506-H509 WeakPolarHBondContact O-CB 3.24Å; Y506-H509 PolarHBondContact O-N 3.4Å; Y506-M510 HydrophobicContact CD2-CG 4.42Å; Y506-M510 HydrophobicContact CE1-CG 4.36Å; Y506-M510 HydrophobicContact CE2-CG 3.93Å; Y506-M510 HydrophobicContact CE2-SD 3.74Å; Y506-M510 PolarHBondContact O-N 3.25Å
507	V	84.6	Confident	85.5	Confident	59 Å²	59	74.9 Å²	74.9	36%	0.358	40%	0.395	S	S	.	.	H	α-helix	trans	-61.7	-43.6	177.3	172.4	0	0	0	0	111.6	K503 H509 M510	K503-V507 HydrophobicContact CG-CG2 4.45Å; K503-V507 WeakPolarHBondContact O-CG2 3.41Å; K503-V507 PolarHBondContact O-N 2.99Å; V507-H509 PolarHBondContact O-N 3.09Å; V507-M510 PolarHBondContact O-N 3.47Å
508	K	85.8	Confident	85.5	Confident	78 Å²	78	74.8 Å²	74.8	34%	0.339	39%	0.393	S	S	.	.	H	α-helix	trans	-60.5	-30.3	174.3	-72.9	174.7	-177.3	179.6	0	112.9	Q504 N505 Y506 L530	Q504-K508 WeakPolarHBondContact O-CB 3.4Å; Q504-K508 WeakPolarHBondContact O-CG 2.91Å; Q504-K508 PolarHBondContact O-N 3.15Å; N505-K508 PolarHBondContact O-N 3.25Å; Y506-K508 PolarHBondContact O-N 2.86Å; K508-L530 HydrophobicContact CB-CD1 4.48Å; K508-L530 HydrophobicContact CB-CD2 4.01Å; K508-L530 HydrophobicContact CD-CD1 4.36Å; K508-L530 HydrophobicContact CD-CD2 4.31Å; K508-L530 HydrophobicContact CG-CD1 4.45Å; K508-L530 HydrophobicContact CG-CD2 3.69Å
509	H	87.6	Confident	85.6	Confident	23 Å²	23	72 Å²	72	11%	0.106	38%	0.381	C	S	.	.	H	α-helix	trans	-77.9	-34.2	176	163.9	51.2	0	0	0	112.7	C493 C496 F500 N505 Y506 V507 F511 V512 H513	C493-H509 WeakPolarHBondContact CB-NE2 3.3Å; C493-H509 PolarHBondContact SG-NE2 3.35Å; C493-H509 VanDerWaalsContact SG-NE2 3.44Å; C496-H509 VanDerWaalsContact SG-CE1 3.53Å; C496-H509 PolarHBondContact SG-NE2 2.88Å; F500-H509 HydrophobicContact CE1-CB 4.1Å; F500-H509 HydrophobicContact CE2-CB 4.22Å; F500-H509 AromaticContact CE2-CD2 3.21Å; F500-H509 WeakPolarHBondContact CE2-CD2 3.49Å; F500-H509 AromaticContact CE2-CG 3.88Å; F500-H509 AromaticContact CE2-NE2 3.92Å; F500-H509 HydrophobicContact CZ-CB 3.65Å; F500-H509 AromaticContact CZ-CD2 3.25Å; F500-H509 WeakPolarHBondContact CZ-CD2 3.25Å; F500-H509 AromaticContact CZ-CG 3.43Å; F500-H509 VanDerWaalsContact CZ-CG 3.43Å; F500-H509 AromaticContact CZ-NE2 3.95Å; N505-H509 VanDerWaalsContact O-CB 3.31Å; N505-H509 WeakPolarHBondContact O-CB 3.36Å; N505-H509 PolarHBondContact O-N 3.22Å; Y506-H509 WeakPolarHBondContact O-CA 3.42Å; Y506-H509 WeakPolarHBondContact O-CB 3.24Å; Y506-H509 PolarHBondContact O-N 3.4Å; V507-H509 PolarHBondContact O-N 3.09Å; H509-F511 PolarHBondContact O-N 3.37Å; H509-V512 WeakPolarHBondContact O-CB 3.5Å; H509-V512 WeakPolarHBondContact O-CG2 3.42Å; H509-V512 PolarHBondContact O-N 3.38Å; H509-H513 AromaticContact CE1-CD2 3.59Å; H509-H513 AromaticContact CE1-NE2 3.29Å; H509-H513 PolarHBondContact CE1-NE2 2.9Å; H509-H513 VanDerWaalsContact CE1-NE2 3.29Å; H509-H513 AromaticContact NE2-CD2 3.89Å; H509-H513 AromaticContact NE2-NE2 3.61Å
510	M	86.4	Confident	85.8	Confident	38 Å²	38	73.4 Å²	73.4	19%	0.187	38%	0.383	C	S	.	.	H	α-helix	trans	-59.1	-29.7	177.4	-71	-55.8	-62.2	0	0	113.2	C493 L495 Y506 V507 V512 H513 T514	C493-M510 VanDerWaalsContact SG-SD 3.64Å; L495-M510 HydrophobicContact CD1-CE 3.98Å; Y506-M510 HydrophobicContact CD2-CG 4.42Å; Y506-M510 HydrophobicContact CE1-CG 4.36Å; Y506-M510 HydrophobicContact CE2-CG 3.93Å; Y506-M510 HydrophobicContact CE2-SD 3.74Å; Y506-M510 PolarHBondContact O-N 3.25Å; V507-M510 PolarHBondContact O-N 3.47Å; M510-V512 PolarHBondContact O-N 2.95Å; M510-V512 VanDerWaalsContact O-N 3.12Å; M510-H513 WeakPolarHBondContact O-CA 3.32Å; M510-H513 PolarHBondContact O-N 3.38Å; M510-T514 PolarHBondContact O-N 3.05Å
511	F	86.5	Confident	85.8	Confident	54 Å²	54	71.3 Å²	71.3	24%	0.237	37%	0.374	C	S	.	.	H	α-helix	trans	-60.6	-17.2	171.2	-60.9	-50.2	0	0	0	114.6	H509 G515 E516 L530	H509-F511 PolarHBondContact O-N 3.37Å; F511-G515 WeakPolarHBondContact O-CA 3.13Å; F511-G515 PolarHBondContact O-N 3.05Å; F511-E516 HydrophobicContact CD1-CB 4.07Å; F511-L530 HydrophobicContact CD2-CD2 4.04Å; F511-L530 HydrophobicContact CE2-CD2 4.29Å
512	V	84.6	Confident	85.8	Confident	109 Å²	109	72.3 Å²	72.3	66%	0.661	38%	0.383	S	S	*	.	H	α-helix	trans	-73.7	-32.1	171.1	-176	0	0	0	0	110.9	H509 M510	H509-V512 WeakPolarHBondContact O-CB 3.5Å; H509-V512 WeakPolarHBondContact O-CG2 3.42Å; H509-V512 PolarHBondContact O-N 3.38Å; M510-V512 PolarHBondContact O-N 2.95Å; M510-V512 VanDerWaalsContact O-N 3.12Å
513	H	84.3	Confident	85.7	Confident	75 Å²	75	74.9 Å²	74.9	35%	0.347	39%	0.391	S	S	.	.	H	α-helix	trans	-89.2	-39.3	179.8	-70.9	-79.6	0	0	0	113	L495 C496 H509 M510 G515	L495-H513 HydrophobicContact CD1-CB 3.63Å; C496-H513 PolarHBondContact SG-NE2 3.44Å; C496-H513 VanDerWaalsContact SG-NE2 3.4Å; H509-H513 AromaticContact CE1-CD2 3.59Å; H509-H513 AromaticContact CE1-NE2 3.29Å; H509-H513 PolarHBondContact CE1-NE2 2.9Å; H509-H513 VanDerWaalsContact CE1-NE2 3.29Å; H509-H513 AromaticContact NE2-CD2 3.89Å; H509-H513 AromaticContact NE2-NE2 3.61Å; M510-H513 WeakPolarHBondContact O-CA 3.32Å; M510-H513 PolarHBondContact O-N 3.38Å; H513-G515 VanDerWaalsContact C-N 3.27Å
514	T	82.1	Confident	85.8	Confident	73 Å²	73	71.4 Å²	71.4	45%	0.448	38%	0.381	S	S	.	.	H	α-helix	trans	-75.2	-18.7	174.6	64.1	0	0	0	0	112.6	M510 E516	M510-T514 PolarHBondContact O-N 3.05Å; T514-E516 PolarHBondContact O-N 3.41Å; T514-E516 VanDerWaalsContact O-N 3.15Å; T514-E516 WeakPolarHBondContact OG1-CB 3.26Å; T514-E516 WeakPolarHBondContact OG1-CG 3.45Å; T514-E516 PolarHBondContact OG1-N 3.05Å; T514-E516 PolarHBondContact OG1-OE2 2.88Å
515	G	83.2	Confident	86	Confident	38 Å²	38	73.1 Å²	73.1	39%	0.392	38%	0.382	S	S	.	.			trans	70.9	-0.7	-176.2	0	0	0	0	0	114.5	F511 H513 K517	F511-G515 WeakPolarHBondContact O-CA 3.13Å; F511-G515 PolarHBondContact O-N 3.05Å; H513-G515 VanDerWaalsContact C-N 3.27Å; G515-K517 WeakPolarHBondContact O-CE 3.3Å
516	E	82.3	Confident	86.1	Confident	105 Å²	105	77.6 Å²	77.6	49%	0.491	39%	0.394	S	S	.	.			trans	-61	136.3	-175.2	-71.2	168.2	146.4	0	0	112.3	F511 T514 S529	F511-E516 HydrophobicContact CD1-CB 4.07Å; T514-E516 PolarHBondContact O-N 3.41Å; T514-E516 VanDerWaalsContact O-N 3.15Å; T514-E516 WeakPolarHBondContact OG1-CB 3.26Å; T514-E516 WeakPolarHBondContact OG1-CG 3.45Å; T514-E516 PolarHBondContact OG1-N 3.05Å; T514-E516 PolarHBondContact OG1-OE2 2.88Å; E516-S529 WeakPolarHBondContact O-CB 3.42Å
517	K	86.8	Confident	86.2	Confident	125 Å²	125	78 Å²	78	54%	0.543	40%	0.401	S	S	.	.			trans	-134	70.1	-176.2	-72.6	154.5	-171.3	157.4	0	109.9	G515 H519 S527 F528	G515-K517 WeakPolarHBondContact O-CE 3.3Å; K517-H519 PolarHBondContact O-N 3.26Å; K517-H519 VanDerWaalsContact O-N 3.14Å; K517-S527 WeakPolarHBondContact O-CB 3.33Å; K517-F528 CarbonylContact C-O 3.28Å; K517-F528 VanDerWaalsContact C-O 3.24Å; K517-F528 VanDerWaalsContact CA-O 3.28Å; K517-F528 WeakPolarHBondContact CA-O 3.44Å
518	P	82.9	Confident	86.4	Confident	83 Å²	83	76.8 Å²	76.8	54%	0.539	39%	0.391	S	S	.	.			trans	-69.6	-7.6	-173.6	28.6	-36	0	0	0	114.3
519	H	87.4	Confident	86.4	Confident	62 Å²	62	74.4 Å²	74.4	29%	0.287	38%	0.384	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-109.3	91.7	-176.7	-58	-58.4	0	0	0	111.5	K517 F528 K531 L534	K517-H519 PolarHBondContact O-N 3.26Å; K517-H519 VanDerWaalsContact O-N 3.14Å; H519-F528 HydrophobicContact CB-CB 4.49Å; H519-F528 WeakPolarHBondContact CB-O 3.23Å; H519-F528 PolarHBondContact N-O 2.99Å; H519-F528 VanDerWaalsContact N-O 3.07Å; H519-F528 PolarHBondContact O-N 3.36Å; H519-K531 PolarHBondContact CD2-N 3.21Å; H519-K531 PolarHBondContact NE2-N 3.41Å; H519-L534 HydrophobicContact CB-CB 4.14Å; H519-L534 HydrophobicContact CB-CD2 3.9Å
520	Q	90.4	Very high	86.4	Confident	101 Å²	101	74.6 Å²	74.6	47%	0.472	39%	0.386	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-84.4	141.9	178.7	-165.1	170	37.5	0	0	112.9	W525 S527 L534	Q520-W525 HydrophobicContact CG-CE3 4.48Å; Q520-W525 WeakPolarHBondContact CG-O 3.25Å; Q520-W525 PolarHBondContact NE2-O 3.41Å; Q520-S527 WeakPolarHBondContact CG-OG 3.49Å; Q520-L534 WeakPolarHBondContact O-CD2 3.38Å
521	C	89.8	Confident	86.3	Confident	0 Å²	0	79.1 Å²	79.1	0%	0	41%	0.405	C	S	.	.			trans	-79.2	124	170.6	179.6	0	0	0	0	111.1	I523 C524 W525 R526 F528 L534 H537 M538 H541	C521-I523 PolarHBondContact O-N 3.15Å; C521-C524 VanDerWaalsContact SG-SG 3.7Å; C521-W525 WeakPolarHBondContact O-CA 3.14Å; C521-W525 PolarHBondContact O-N 2.88Å; C521-R526 VanDerWaalsContact CB-O 3.32Å; C521-R526 WeakPolarHBondContact CB-O 3.32Å; C521-R526 PolarHBondContact N-O 3.22Å; C521-F528 HydrophobicContact CB-CE2 4.41Å; C521-L534 HydrophobicContact CB-CD1 3.74Å; C521-H537 PolarHBondContact SG-NE2 2.84Å; C521-H537 VanDerWaalsContact SG-NE2 3.4Å; C521-M538 VanDerWaalsContact SG-SD 3.63Å; C521-H541 PolarHBondContact SG-NE2 2.87Å
522	S	86.5	Confident	86.1	Confident	92 Å²	92	80.4 Å²	80.4	64%	0.643	41%	0.414	S	S	*	.	T	Hydrogen-bonded Turn	trans	-71.6	-7.4	178.9	53.7	0	0	0	0	115
523	I	84.8	Confident	86.2	Confident	91 Å²	91	80.9 Å²	80.9	47%	0.467	41%	0.405	S	S	.	.	T	Hydrogen-bonded Turn	trans	-101.7	-40.9	-177.4	-58.3	176.3	0	0	0	111.8	C521 M538 H541	C521-I523 PolarHBondContact O-N 3.15Å; I523-M538 HydrophobicContact CD1-CE 3.56Å; I523-M538 HydrophobicContact CD1-SD 4.4Å; I523-M538 HydrophobicContact CG1-CE 4.13Å; I523-H541 HydrophobicContact CD1-CB 3.65Å; I523-H541 HydrophobicContact CG2-CB 4.48Å
524	C	87.9	Confident	86.4	Confident	47 Å²	47	78.6 Å²	78.6	32%	0.318	40%	0.395	S	S	.	.	T	Hydrogen-bonded Turn	trans	-125.3	10.2	-178	71.3	0	0	0	0	114.2	C521 R526 H537 H541	C521-C524 VanDerWaalsContact SG-SG 3.7Å; C524-R526 PolarHBondContact O-N 3.42Å; C524-H537 PolarHBondContact SG-NE2 3.45Å; C524-H541 WeakPolarHBondContact CB-CE1 3.15Å; C524-H541 VanDerWaalsContact CB-NE2 3.3Å; C524-H541 WeakPolarHBondContact CB-NE2 3.36Å; C524-H541 VanDerWaalsContact SG-CE1 3.57Å; C524-H541 PolarHBondContact SG-NE2 3.01Å
525	W	88.5	Confident	86.5	Confident	174 Å²	174	79.6 Å²	79.6	66%	0.659	40%	0.396	S	S	*	.			trans	58.2	6.8	176.3	-52.6	96.9	0	0	0	115.9	Q520 C521	Q520-W525 HydrophobicContact CG-CE3 4.48Å; Q520-W525 WeakPolarHBondContact CG-O 3.25Å; Q520-W525 PolarHBondContact NE2-O 3.41Å; C521-W525 WeakPolarHBondContact O-CA 3.14Å; C521-W525 PolarHBondContact O-N 2.88Å
526	R	88	Confident	86.5	Confident	169 Å²	169	82.6 Å²	82.6	64%	0.638	40%	0.399	S	S	*	.			trans	-71	130.7	175.6	-170.2	172.3	-174.1	151.6	3.7	110.9	C521 C524 F528	C521-R526 VanDerWaalsContact CB-O 3.32Å; C521-R526 WeakPolarHBondContact CB-O 3.32Å; C521-R526 PolarHBondContact N-O 3.22Å; C524-R526 PolarHBondContact O-N 3.42Å; R526-F528 HydrophobicContact CB-CE2 4.2Å; R526-F528 HydrophobicContact CB-CZ 4.47Å; R526-F528 HydrophobicContact CG-CE2 4.07Å; R526-F528 HydrophobicContact CG-CZ 3.98Å; R526-F528 WeakPolarHBondContact O-CD2 3.41Å; R526-F528 VanDerWaalsContact O-CE2 3.28Å; R526-F528 WeakPolarHBondContact O-CE2 3.45Å
527	S	89.1	Confident	86.7	Confident	42 Å²	42	78.9 Å²	78.9	29%	0.294	38%	0.382	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-104.7	144.9	-174.9	-50.4	0	0	0	0	113.4	K517 Q520	K517-S527 WeakPolarHBondContact O-CB 3.33Å; Q520-S527 WeakPolarHBondContact CG-OG 3.49Å
528	F	88.6	Confident	86.5	Confident	34 Å²	34	75.7 Å²	75.7	15%	0.149	37%	0.369	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-126.5	147	-175.7	-60.3	-92.7	0	0	0	111.3	K517 H519 C521 R526 L534 H537	K517-F528 CarbonylContact C-O 3.28Å; K517-F528 VanDerWaalsContact C-O 3.24Å; K517-F528 VanDerWaalsContact CA-O 3.28Å; K517-F528 WeakPolarHBondContact CA-O 3.44Å; H519-F528 HydrophobicContact CB-CB 4.49Å; H519-F528 WeakPolarHBondContact CB-O 3.23Å; H519-F528 PolarHBondContact N-O 2.99Å; H519-F528 VanDerWaalsContact N-O 3.07Å; H519-F528 PolarHBondContact O-N 3.36Å; C521-F528 HydrophobicContact CB-CE2 4.41Å; R526-F528 HydrophobicContact CB-CE2 4.2Å; R526-F528 HydrophobicContact CB-CZ 4.47Å; R526-F528 HydrophobicContact CG-CE2 4.07Å; R526-F528 HydrophobicContact CG-CZ 3.98Å; R526-F528 WeakPolarHBondContact O-CD2 3.41Å; R526-F528 VanDerWaalsContact O-CE2 3.28Å; R526-F528 WeakPolarHBondContact O-CE2 3.45Å; F528-L534 HydrophobicContact CB-CB 4.4Å; F528-L534 HydrophobicContact CD2-CB 4.09Å; F528-L534 HydrophobicContact CD2-CD1 4.13Å; F528-L534 HydrophobicContact CE2-CD1 4.32Å; F528-L534 HydrophobicContact CG-CB 4.4Å; F528-H537 HydrophobicContact CE1-CB 4.09Å; F528-H537 HydrophobicContact CE2-CB 4.09Å; F528-H537 AromaticContact CE2-CD2 3.26Å; F528-H537 WeakPolarHBondContact CE2-CD2 3.49Å; F528-H537 AromaticContact CE2-CG 3.8Å; F528-H537 HydrophobicContact CZ-CB 3.62Å; F528-H537 AromaticContact CZ-CD2 3.32Å; F528-H537 WeakPolarHBondContact CZ-CD2 3.38Å; F528-H537 AromaticContact CZ-CG 3.4Å
529	S	87.3	Confident	86.4	Confident	28 Å²	28	73.5 Å²	73.5	20%	0.196	35%	0.354	C	S	.	.	S	Bend	trans	-71.5	-29.9	176.6	48.9	0	0	0	0	113.4	E516	E516-S529 WeakPolarHBondContact O-CB 3.42Å
530	L	86.6	Confident	86.1	Confident	27 Å²	27	74.7 Å²	74.7	14%	0.141	37%	0.366	C	S	.	.	S	Bend	trans	-125.5	138.6	-179.3	-56.1	-177.7	0	0	0	112.2	K508 F511 D532 Y533 L534	K508-L530 HydrophobicContact CB-CD1 4.48Å; K508-L530 HydrophobicContact CB-CD2 4.01Å; K508-L530 HydrophobicContact CD-CD1 4.36Å; K508-L530 HydrophobicContact CD-CD2 4.31Å; K508-L530 HydrophobicContact CG-CD1 4.45Å; K508-L530 HydrophobicContact CG-CD2 3.69Å; F511-L530 HydrophobicContact CD2-CD2 4.04Å; F511-L530 HydrophobicContact CE2-CD2 4.29Å; L530-D532 PolarHBondContact O-N 3.06Å; L530-Y533 HydrophobicContact CB-CD2 3.76Å; L530-Y533 HydrophobicContact CB-CE2 4.13Å; L530-Y533 HydrophobicContact CB-CG 4.33Å; L530-Y533 HydrophobicContact CD1-CD2 4.16Å; L530-Y533 HydrophobicContact CD1-CE2 3.64Å; L530-Y533 HydrophobicContact CG-CD2 4.08Å; L530-Y533 HydrophobicContact CG-CE2 3.98Å; L530-Y533 WeakPolarHBondContact O-CB 3.5Å; L530-Y533 PolarHBondContact O-N 2.96Å; L530-L534 PolarHBondContact O-N 3.37Å
531	K	84.3	Confident	85.6	Confident	133 Å²	133	73.9 Å²	73.9	58%	0.578	36%	0.362	S	S	*	.	H	α-helix	trans	-54.5	-36.8	176.7	-170.4	179.5	179.9	-179.7	0	112.3	H519 Y533 L534 I535	H519-K531 PolarHBondContact CD2-N 3.21Å; H519-K531 PolarHBondContact NE2-N 3.41Å; K531-Y533 VanDerWaalsContact C-N 3.28Å; K531-Y533 PolarHBondContact O-N 3.45Å; K531-L534 WeakPolarHBondContact O-CB 3.2Å; K531-L534 PolarHBondContact O-N 3.22Å; K531-I535 HydrophobicContact CG-CD1 4.06Å; K531-I535 WeakPolarHBondContact O-CG1 3.48Å; K531-I535 PolarHBondContact O-N 3.26Å
532	D	83.7	Confident	84.9	Confident	81 Å²	81	78.1 Å²	78.1	43%	0.433	39%	0.388	S	S	.	.	H	α-helix	trans	-64.1	-31.7	178.4	-53.4	-30.3	0	0	0	112.7	L530 K536	L530-D532 PolarHBondContact O-N 3.06Å; D532-K536 WeakPolarHBondContact O-CB 3.32Å; D532-K536 WeakPolarHBondContact O-CD 3.48Å; D532-K536 VanDerWaalsContact O-CG 3.23Å; D532-K536 WeakPolarHBondContact O-CG 3.28Å; D532-K536 PolarHBondContact O-N 3.31Å
533	Y	86.1	Confident	84.3	Confident	118 Å²	118	76 Å²	76	46%	0.463	38%	0.381	S	S	.	.	H	α-helix	trans	-76.2	-38.7	175.1	-62.7	-36.1	0	0	0	111.5	L530 K531 K536 H537	L530-Y533 HydrophobicContact CB-CD2 3.76Å; L530-Y533 HydrophobicContact CB-CE2 4.13Å; L530-Y533 HydrophobicContact CB-CG 4.33Å; L530-Y533 HydrophobicContact CD1-CD2 4.16Å; L530-Y533 HydrophobicContact CD1-CE2 3.64Å; L530-Y533 HydrophobicContact CG-CD2 4.08Å; L530-Y533 HydrophobicContact CG-CE2 3.98Å; L530-Y533 WeakPolarHBondContact O-CB 3.5Å; L530-Y533 PolarHBondContact O-N 2.96Å; K531-Y533 VanDerWaalsContact C-N 3.28Å; K531-Y533 PolarHBondContact O-N 3.45Å; Y533-K536 PolarHBondContact O-N 3.25Å; Y533-H537 VanDerWaalsContact O-CB 3.3Å; Y533-H537 WeakPolarHBondContact O-CB 3.49Å; Y533-H537 PolarHBondContact O-N 2.8Å
534	L	87.3	Confident	83.7	Confident	28 Å²	28	74.9 Å²	74.9	15%	0.147	38%	0.378	C	S	.	.	H	α-helix	trans	-59.1	-47.7	169.8	172	58.9	0	0	0	110.9	H519 Q520 C521 F528 L530 K531 K536 H537 M538	H519-L534 HydrophobicContact CB-CB 4.14Å; H519-L534 HydrophobicContact CB-CD2 3.9Å; Q520-L534 WeakPolarHBondContact O-CD2 3.38Å; C521-L534 HydrophobicContact CB-CD1 3.74Å; F528-L534 HydrophobicContact CB-CB 4.4Å; F528-L534 HydrophobicContact CD2-CB 4.09Å; F528-L534 HydrophobicContact CD2-CD1 4.13Å; F528-L534 HydrophobicContact CE2-CD1 4.32Å; F528-L534 HydrophobicContact CG-CB 4.4Å; L530-L534 PolarHBondContact O-N 3.37Å; K531-L534 WeakPolarHBondContact O-CB 3.2Å; K531-L534 PolarHBondContact O-N 3.22Å; L534-K536 PolarHBondContact O-N 2.76Å; L534-H537 CarbonylContact O-C 3.6Å; L534-H537 WeakPolarHBondContact O-CA 3.34Å; L534-H537 WeakPolarHBondContact O-CB 3.48Å; L534-H537 PolarHBondContact O-N 3.08Å; L534-H537 VanDerWaalsContact O-N 3.09Å; L534-M538 HydrophobicContact CD1-CG 4.19Å; L534-M538 HydrophobicContact CD1-SD 4.25Å; L534-M538 WeakPolarHBondContact O-CG 3.46Å; L534-M538 PolarHBondContact O-N 2.88Å
535	I	84.8	Confident	83.3	Confident	93 Å²	93	79.8 Å²	79.8	48%	0.477	39%	0.39	S	S	.	.	H	α-helix	trans	-59.9	-46.4	178.3	-68.3	166.1	0	0	0	111.1	K531 H537 M538	K531-I535 HydrophobicContact CG-CD1 4.06Å; K531-I535 WeakPolarHBondContact O-CG1 3.48Å; K531-I535 PolarHBondContact O-N 3.26Å; I535-H537 VanDerWaalsContact C-N 3.26Å; I535-H537 PolarHBondContact O-N 3.18Å; I535-M538 PolarHBondContact O-N 3Å
536	K	83.6	Confident	82.7	Confident	102 Å²	102	74.5 Å²	74.5	44%	0.443	38%	0.383	S	S	.	.	H	α-helix	trans	-61.8	-32.8	175.1	-73.4	167.4	-174.1	173.4	0	112.7	D532 Y533 L534 V539	D532-K536 WeakPolarHBondContact O-CB 3.32Å; D532-K536 WeakPolarHBondContact O-CD 3.48Å; D532-K536 VanDerWaalsContact O-CG 3.23Å; D532-K536 WeakPolarHBondContact O-CG 3.28Å; D532-K536 PolarHBondContact O-N 3.31Å; Y533-K536 PolarHBondContact O-N 3.25Å; L534-K536 PolarHBondContact O-N 2.76Å; K536-V539 WeakPolarHBondContact O-CB 3.28Å
537	H	86.2	Confident	82.5	Confident	27 Å²	27	70.9 Å²	70.9	13%	0.125	37%	0.37	C	S	.	.	H	α-helix	trans	-74.6	-34.1	175.1	169.3	53.3	0	0	0	113.1	C521 C524 F528 Y533 L534 I535 V539 T540 H541	C521-H537 PolarHBondContact SG-NE2 2.84Å; C521-H537 VanDerWaalsContact SG-NE2 3.4Å; C524-H537 PolarHBondContact SG-NE2 3.45Å; F528-H537 HydrophobicContact CE1-CB 4.09Å; F528-H537 HydrophobicContact CE2-CB 4.09Å; F528-H537 AromaticContact CE2-CD2 3.26Å; F528-H537 WeakPolarHBondContact CE2-CD2 3.49Å; F528-H537 AromaticContact CE2-CG 3.8Å; F528-H537 HydrophobicContact CZ-CB 3.62Å; F528-H537 AromaticContact CZ-CD2 3.32Å; F528-H537 WeakPolarHBondContact CZ-CD2 3.38Å; F528-H537 AromaticContact CZ-CG 3.4Å; Y533-H537 VanDerWaalsContact O-CB 3.3Å; Y533-H537 WeakPolarHBondContact O-CB 3.49Å; Y533-H537 PolarHBondContact O-N 2.8Å; L534-H537 CarbonylContact O-C 3.6Å; L534-H537 WeakPolarHBondContact O-CA 3.34Å; L534-H537 WeakPolarHBondContact O-CB 3.48Å; L534-H537 PolarHBondContact O-N 3.08Å; L534-H537 VanDerWaalsContact O-N 3.09Å; I535-H537 VanDerWaalsContact C-N 3.26Å; I535-H537 PolarHBondContact O-N 3.18Å; H537-V539 PolarHBondContact O-N 3.46Å; H537-V539 VanDerWaalsContact O-N 3.09Å; H537-T540 PolarHBondContact ND1-OG1 3.22Å; H537-T540 VanDerWaalsContact ND1-OG1 3.15Å; H537-T540 PolarHBondContact O-N 3.17Å; H537-T540 PolarHBondContact O-OG1 2.98Å; H537-H541 AromaticContact CD2-NE2 3.6Å; H537-H541 AromaticContact CE1-CD2 3.7Å; H537-H541 AromaticContact CE1-NE2 2.64Å; H537-H541 PolarHBondContact CE1-NE2 3.07Å; H537-H541 AromaticContact ND1-NE2 3.82Å; H537-H541 AromaticContact NE2-CD2 3.65Å; H537-H541 AromaticContact NE2-NE2 2.39Å; H537-H541 PolarHBondContact NE2-NE2 3.2Å
538	M	82.1	Confident	82.3	Confident	58 Å²	58	73 Å²	73	29%	0.286	38%	0.376	S	S	.	.	H	α-helix	trans	-60.4	-21.9	173.2	-66.2	-59.8	-70.3	0	0	112.7	C521 I523 L534 I535 T540 H541 T542	C521-M538 VanDerWaalsContact SG-SD 3.63Å; I523-M538 HydrophobicContact CD1-CE 3.56Å; I523-M538 HydrophobicContact CD1-SD 4.4Å; I523-M538 HydrophobicContact CG1-CE 4.13Å; L534-M538 HydrophobicContact CD1-CG 4.19Å; L534-M538 HydrophobicContact CD1-SD 4.25Å; L534-M538 WeakPolarHBondContact O-CG 3.46Å; L534-M538 PolarHBondContact O-N 2.88Å; I535-M538 PolarHBondContact O-N 3Å; M538-T540 VanDerWaalsContact C-N 3.29Å; M538-T540 PolarHBondContact O-N 3.03Å; M538-H541 PolarHBondContact O-N 2.84Å; M538-T542 PolarHBondContact O-N 3.22Å; M538-T542 VanDerWaalsContact O-N 3.13Å; M538-T542 PolarHBondContact O-OG1 3.26Å
539	V	81.7	Confident	82.3	Confident	36 Å²	36	71.4 Å²	71.4	22%	0.218	37%	0.369	C	S	.	.	H	α-helix	trans	-66.3	-28.3	170.7	-168	0	0	0	0	112.3	K536 H537 T542 G543 V544 T557	K536-V539 WeakPolarHBondContact O-CB 3.28Å; H537-V539 PolarHBondContact O-N 3.46Å; H537-V539 VanDerWaalsContact O-N 3.09Å; V539-T542 WeakPolarHBondContact CA-OG1 3.4Å; V539-T542 PolarHBondContact O-OG1 2.72Å; V539-G543 PolarHBondContact O-N 3.04Å; V539-G543 VanDerWaalsContact O-N 3.1Å; V539-V544 HydrophobicContact CG1-CB 4.47Å; V539-V544 VanDerWaalsContact CG1-O 3.23Å; V539-V544 WeakPolarHBondContact CG1-O 3.42Å; V539-T557 HydrophobicContact CG1-CG2 3.83Å
540	T	81.6	Confident	82.1	Confident	88 Å²	88	74.9 Å²	74.9	54%	0.54	39%	0.393	S	S	.	.	H	α-helix	trans	-73.9	-31.3	176.5	69.8	0	0	0	0	112.4	H537 M538	H537-T540 PolarHBondContact ND1-OG1 3.22Å; H537-T540 VanDerWaalsContact ND1-OG1 3.15Å; H537-T540 PolarHBondContact O-N 3.17Å; H537-T540 PolarHBondContact O-OG1 2.98Å; M538-T540 VanDerWaalsContact C-N 3.29Å; M538-T540 PolarHBondContact O-N 3.03Å
541	H	79.1	Confident	81.9	Confident	84 Å²	84	78.4 Å²	78.4	39%	0.389	41%	0.411	S	S	.	.	H	α-helix	trans	-76.9	-34.6	174.7	-72	-59.9	0	0	0	113.3	C521 I523 C524 H537 M538	C521-H541 PolarHBondContact SG-NE2 2.87Å; I523-H541 HydrophobicContact CD1-CB 3.65Å; I523-H541 HydrophobicContact CG2-CB 4.48Å; C524-H541 WeakPolarHBondContact CB-CE1 3.15Å; C524-H541 VanDerWaalsContact CB-NE2 3.3Å; C524-H541 WeakPolarHBondContact CB-NE2 3.36Å; C524-H541 VanDerWaalsContact SG-CE1 3.57Å; C524-H541 PolarHBondContact SG-NE2 3.01Å; H537-H541 AromaticContact CD2-NE2 3.6Å; H537-H541 AromaticContact CE1-CD2 3.7Å; H537-H541 AromaticContact CE1-NE2 2.64Å; H537-H541 PolarHBondContact CE1-NE2 3.07Å; H537-H541 AromaticContact ND1-NE2 3.82Å; H537-H541 AromaticContact NE2-CD2 3.65Å; H537-H541 AromaticContact NE2-NE2 2.39Å; H537-H541 PolarHBondContact NE2-NE2 3.2Å; M538-H541 PolarHBondContact O-N 2.84Å
542	T	75.9	Confident	81.9	Confident	88 Å²	88	74 Å²	74	54%	0.54	40%	0.396	S	S	.	.	H	α-helix	trans	-85.3	-7.9	178.9	52.7	0	0	0	0	113.6	M538 V539 V544	M538-T542 PolarHBondContact O-N 3.22Å; M538-T542 VanDerWaalsContact O-N 3.13Å; M538-T542 PolarHBondContact O-OG1 3.26Å; V539-T542 WeakPolarHBondContact CA-OG1 3.4Å; V539-T542 PolarHBondContact O-OG1 2.72Å; T542-V544 WeakPolarHBondContact O-CG2 3.49Å; T542-V544 PolarHBondContact O-N 2.85Å
543	G	73.9	Confident	81.8	Confident	48 Å²	48	75.1 Å²	75.1	50%	0.495	40%	0.402	S	S	.	.			trans	66.6	1.4	179.4	0	0	0	0	0	115.6	V539 R545	V539-G543 PolarHBondContact O-N 3.04Å; V539-G543 VanDerWaalsContact O-N 3.1Å; G543-R545 PolarHBondContact O-N 3.34Å
544	V	71.2	Confident	81.7	Confident	68 Å²	68	75.6 Å²	75.6	41%	0.412	41%	0.407	S	S	.	.			trans	-69.9	94.9	-168	-178.8	0	0	0	0	111.7	V539 T542 A546	V539-V544 HydrophobicContact CG1-CB 4.47Å; V539-V544 VanDerWaalsContact CG1-O 3.23Å; V539-V544 WeakPolarHBondContact CG1-O 3.42Å; T542-V544 WeakPolarHBondContact O-CG2 3.49Å; T542-V544 PolarHBondContact O-N 2.85Å; V544-A546 HydrophobicContact CG1-CB 4.34Å; V544-A546 PolarHBondContact O-N 3.34Å
545	R	79.1	Confident	81.5	Confident	149 Å²	149	80.3 Å²	80.3	56%	0.562	42%	0.423	S	S	*	.			trans	-86.9	79.7	172	-68.1	169.7	172.2	-147.8	10.4	110	G543 Y547 R555 F556 T557	G543-R545 PolarHBondContact O-N 3.34Å; R545-Y547 VanDerWaalsContact C-N 3.35Å; R545-R555 HydrophobicContact CB-CB 3.57Å; R545-R555 WeakPolarHBondContact CD-O 3.04Å; R545-R555 PolarHBondContact NH1-O 2.96Å; R545-R555 PolarHBondContact O-NE 2.75Å; R545-R555 PolarHBondContact O-NH2 3.06Å; R545-R555 VanDerWaalsContact O-NH2 3.1Å; R545-F556 CarbonylContact C-O 3.16Å; R545-F556 VanDerWaalsContact C-O 3.28Å; R545-F556 VanDerWaalsContact CA-O 3.27Å; R545-F556 WeakPolarHBondContact CA-O 3.44Å; R545-T557 HydrophobicContact CG-CG2 3.87Å
546	A	77.6	Confident	81.4	Confident	63 Å²	63	78.1 Å²	78.1	52%	0.521	41%	0.41	S	S	.	.			trans	-70.9	-23.1	-175.7	0	0	0	0	0	114.6	V544 F556	V544-A546 HydrophobicContact CG1-CB 4.34Å; V544-A546 PolarHBondContact O-N 3.34Å; A546-F556 PolarHBondContact N-O 2.99Å
547	Y	81.8	Confident	81.3	Confident	94 Å²	94	75.4 Å²	75.4	37%	0.369	40%	0.402	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-105.1	102.8	-171.2	-58.9	-79.9	0	0	0	110.8	R545 R555 F556 K559	R545-Y547 VanDerWaalsContact C-N 3.35Å; Y547-R555 CarbonylContact O-C 3.24Å; Y547-R555 WeakPolarHBondContact O-CA 3.27Å; Y547-F556 PolarHBondContact N-O 3.07Å; Y547-F556 PolarHBondContact O-N 3.07Å; Y547-K559 HydrophobicContact CD1-CB 3.88Å; Y547-K559 HydrophobicContact CD1-CG 4.24Å; Y547-K559 HydrophobicContact CE1-CB 3.63Å; Y547-K559 HydrophobicContact CE1-CD 4.46Å; Y547-K559 HydrophobicContact CE1-CG 4.17Å; Y547-K559 HydrophobicContact CG-CB 4.42Å
548	Q	86.3	Confident	81	Confident	87 Å²	87	77.4 Å²	77.4	41%	0.407	41%	0.411	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-90.9	139.7	179.9	-174	158.3	-34.4	0	0	111.5	N553 R555 L562	Q548-N553 PolarHBondContact NE2-OD1 3.24Å; Q548-R555 HydrophobicContact CB-CG 4.17Å; Q548-R555 HydrophobicContact CG-CG 4.08Å; Q548-L562 WeakPolarHBondContact O-CD2 3.35Å
549	C	87.4	Confident	81.1	Confident	0 Å²	0	80.9 Å²	80.9	0%	0	43%	0.425	C	S	.	.			trans	-76	126.3	166.7	176.2	0	0	0	0	110.2	I551 C552 N553 K554 F556 L562 H565 M566 H569	C549-I551 VanDerWaalsContact C-N 3.25Å; C549-I551 PolarHBondContact O-N 2.96Å; C549-I551 PolarHBondContact SG-N 3.13Å; C549-I551 VanDerWaalsContact SG-N 3.37Å; C549-C552 PolarHBondContact SG-N 3.18Å; C549-N553 WeakPolarHBondContact O-CA 3.43Å; C549-N553 PolarHBondContact O-N 3.15Å; C549-K554 WeakPolarHBondContact CB-O 3.41Å; C549-K554 PolarHBondContact N-O 3.06Å; C549-F556 HydrophobicContact CB-CE2 4.41Å; C549-L562 HydrophobicContact CB-CD1 3.91Å; C549-H565 PolarHBondContact SG-NE2 2.94Å; C549-H565 VanDerWaalsContact SG-NE2 3.41Å; C549-M566 HydrophobicContact CB-SD 4.32Å; C549-H569 VanDerWaalsContact SG-CD2 3.59Å; C549-H569 PolarHBondContact SG-NE2 3.44Å
550	S	83.7	Confident	81.1	Confident	100 Å²	100	82.3 Å²	82.3	70%	0.699	44%	0.436	S	S	*	.	T	Hydrogen-bonded Turn	trans	-69.5	-17.5	177.1	49.3	0	0	0	0	114.5
551	I	83.3	Confident	81.3	Confident	101 Å²	101	80.3 Å²	80.3	52%	0.518	43%	0.425	S	S	.	.	T	Hydrogen-bonded Turn	trans	-98.5	-36.6	-172.5	-60.9	172.5	0	0	0	112.2	C549 M566 H569	C549-I551 VanDerWaalsContact C-N 3.25Å; C549-I551 PolarHBondContact O-N 2.96Å; C549-I551 PolarHBondContact SG-N 3.13Å; C549-I551 VanDerWaalsContact SG-N 3.37Å; I551-M566 HydrophobicContact CD1-CE 3.62Å; I551-M566 HydrophobicContact CG1-CE 4.08Å; I551-H569 HydrophobicContact CD1-CB 3.57Å; I551-H569 HydrophobicContact CG2-CB 4.36Å
552	C	84.2	Confident	81.6	Confident	41 Å²	41	77.3 Å²	77.3	28%	0.277	41%	0.412	S	S	.	.	T	Hydrogen-bonded Turn	trans	-134.4	19.6	-180	78.9	0	0	0	0	114.2	C549 K554 H565 H569	C549-C552 PolarHBondContact SG-N 3.18Å; C552-K554 PolarHBondContact O-N 3.16Å; C552-H565 PolarHBondContact SG-NE2 3.19Å; C552-H565 VanDerWaalsContact SG-NE2 3.36Å; C552-H569 WeakPolarHBondContact CB-CE1 3.44Å; C552-H569 PolarHBondContact SG-CE1 3.23Å; C552-H569 PolarHBondContact SG-NE2 3.38Å
553	N	81.4	Confident	82	Confident	104 Å²	104	77.5 Å²	77.5	56%	0.556	41%	0.41	S	S	*	.			trans	54.4	5.4	174.9	-68.8	-45.9	0	0	0	117.5	Q548 C549 R555	Q548-N553 PolarHBondContact NE2-OD1 3.24Å; C549-N553 WeakPolarHBondContact O-CA 3.43Å; C549-N553 PolarHBondContact O-N 3.15Å; N553-R555 WeakPolarHBondContact O-CG 3.32Å; N553-R555 PolarHBondContact O-N 3.38Å
554	K	83.1	Confident	82.3	Confident	128 Å²	128	77.3 Å²	77.3	56%	0.557	40%	0.399	S	S	*	.			trans	-63.2	130.8	175.4	-69.1	-177.7	-162.5	-62.5	0	109.8	C549 C552 F556	C549-K554 WeakPolarHBondContact CB-O 3.41Å; C549-K554 PolarHBondContact N-O 3.06Å; C552-K554 PolarHBondContact O-N 3.16Å; K554-F556 HydrophobicContact CB-CE2 3.98Å; K554-F556 HydrophobicContact CB-CZ 4.14Å; K554-F556 WeakPolarHBondContact O-CD2 3.48Å; K554-F556 VanDerWaalsContact O-CE2 3.28Å; K554-F556 WeakPolarHBondContact O-CE2 3.43Å
555	R	82.8	Confident	83	Confident	128 Å²	128	75 Å²	75	48%	0.483	38%	0.384	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-106	137.4	-175	-53.9	-179.4	62.8	140.2	-1	111.7	R545 Y547 Q548 N553	R545-R555 HydrophobicContact CB-CB 3.57Å; R545-R555 WeakPolarHBondContact CD-O 3.04Å; R545-R555 PolarHBondContact NH1-O 2.96Å; R545-R555 PolarHBondContact O-NE 2.75Å; R545-R555 PolarHBondContact O-NH2 3.06Å; R545-R555 VanDerWaalsContact O-NH2 3.1Å; Y547-R555 CarbonylContact O-C 3.24Å; Y547-R555 WeakPolarHBondContact O-CA 3.27Å; Q548-R555 HydrophobicContact CB-CG 4.17Å; Q548-R555 HydrophobicContact CG-CG 4.08Å; N553-R555 WeakPolarHBondContact O-CG 3.32Å; N553-R555 PolarHBondContact O-N 3.38Å
556	F	83.6	Confident	83	Confident	47 Å²	47	69.9 Å²	69.9	21%	0.206	37%	0.367	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-122.6	153.6	-174.4	-59.9	-89.8	0	0	0	111.7	R545 A546 Y547 C549 K554 L562 H565	R545-F556 CarbonylContact C-O 3.16Å; R545-F556 VanDerWaalsContact C-O 3.28Å; R545-F556 VanDerWaalsContact CA-O 3.27Å; R545-F556 WeakPolarHBondContact CA-O 3.44Å; A546-F556 PolarHBondContact N-O 2.99Å; Y547-F556 PolarHBondContact N-O 3.07Å; Y547-F556 PolarHBondContact O-N 3.07Å; C549-F556 HydrophobicContact CB-CE2 4.41Å; K554-F556 HydrophobicContact CB-CE2 3.98Å; K554-F556 HydrophobicContact CB-CZ 4.14Å; K554-F556 WeakPolarHBondContact O-CD2 3.48Å; K554-F556 VanDerWaalsContact O-CE2 3.28Å; K554-F556 WeakPolarHBondContact O-CE2 3.43Å; F556-L562 HydrophobicContact CB-CB 4.48Å; F556-L562 HydrophobicContact CD2-CB 4.15Å; F556-L562 HydrophobicContact CD2-CD1 4Å; F556-L562 HydrophobicContact CE2-CD1 4.18Å; F556-L562 HydrophobicContact CG-CB 4.45Å; F556-H565 HydrophobicContact CE1-CB 4.07Å; F556-H565 HydrophobicContact CE2-CB 4.01Å; F556-H565 AromaticContact CE2-CD2 3.34Å; F556-H565 WeakPolarHBondContact CE2-CD2 3.48Å; F556-H565 AromaticContact CE2-CG 3.72Å; F556-H565 AromaticContact CE2-NE2 3.98Å; F556-H565 HydrophobicContact CZ-CB 3.55Å; F556-H565 AromaticContact CZ-CD2 3.43Å; F556-H565 VanDerWaalsContact CZ-CD2 3.43Å; F556-H565 WeakPolarHBondContact CZ-CD2 3.37Å; F556-H565 AromaticContact CZ-CG 3.32Å; F556-H565 AromaticContact CZ-ND1 3.86Å; F556-H565 AromaticContact CZ-NE2 3.98Å
557	T	81.1	Confident	83.2	Confident	45 Å²	45	69.2 Å²	69.2	28%	0.276	35%	0.351	S	S	.	.	S	Bend	trans	-83.8	-14.3	177.3	52.1	0	0	0	0	113.6	V539 R545	V539-T557 HydrophobicContact CG1-CG2 3.83Å; R545-T557 HydrophobicContact CG-CG2 3.87Å
558	Q	81.1	Confident	83	Confident	68 Å²	68	69.5 Å²	69.5	32%	0.318	36%	0.358	S	S	.	.	S	Bend	trans	-138.9	141.7	-178.7	-54.6	-175.3	29.4	0	0	112	S560 S561 L562	Q558-S560 VanDerWaalsContact C-N 3.26Å; Q558-S560 WeakPolarHBondContact CB-OG 3.44Å; Q558-S560 PolarHBondContact O-N 3.04Å; Q558-S560 PolarHBondContact OE1-OG 2.99Å; Q558-S561 WeakPolarHBondContact O-CB 3.47Å; Q558-S561 PolarHBondContact O-N 3.45Å; Q558-S561 VanDerWaalsContact O-N 3.15Å; Q558-L562 PolarHBondContact O-N 3.29Å; Q558-L562 VanDerWaalsContact O-N 3.16Å
559	K	82.4	Confident	82.5	Confident	132 Å²	132	69.2 Å²	69.2	57%	0.574	36%	0.357	S	S	*	.	H	α-helix	trans	-60.1	-34.8	175.9	-167.2	175.2	-178.7	177.6	0	112.5	Y547 L562 N563	Y547-K559 HydrophobicContact CD1-CB 3.88Å; Y547-K559 HydrophobicContact CD1-CG 4.24Å; Y547-K559 HydrophobicContact CE1-CB 3.63Å; Y547-K559 HydrophobicContact CE1-CD 4.46Å; Y547-K559 HydrophobicContact CE1-CG 4.17Å; Y547-K559 HydrophobicContact CG-CB 4.42Å; K559-L562 PolarHBondContact O-N 3Å; K559-N563 PolarHBondContact O-N 2.76Å; K559-N563 PolarHBondContact O-OD1 3.42Å
560	S	83.4	Confident	81.9	Confident	66 Å²	66	77.8 Å²	77.8	46%	0.462	39%	0.389	S	S	.	.	H	α-helix	trans	-57.9	-47.6	173.2	45.2	0	0	0	0	112	Q558 N563 V564	Q558-S560 VanDerWaalsContact C-N 3.26Å; Q558-S560 WeakPolarHBondContact CB-OG 3.44Å; Q558-S560 PolarHBondContact O-N 3.04Å; Q558-S560 PolarHBondContact OE1-OG 2.99Å; S560-N563 PolarHBondContact O-N 2.78Å; S560-V564 WeakPolarHBondContact O-CG2 3.49Å; S560-V564 PolarHBondContact O-N 3.24Å
561	S	84.2	Confident	81.2	Confident	45 Å²	45	75.3 Å²	75.3	32%	0.315	38%	0.38	S	S	.	.	H	α-helix	trans	-63.7	-39.7	177	-52.9	0	0	0	0	112.2	Q558 V564 H565	Q558-S561 WeakPolarHBondContact O-CB 3.47Å; Q558-S561 PolarHBondContact O-N 3.45Å; Q558-S561 VanDerWaalsContact O-N 3.15Å; S561-V564 PolarHBondContact O-N 3.03Å; S561-H565 WeakPolarHBondContact O-CB 3.31Å; S561-H565 PolarHBondContact O-N 3.14Å
562	L	86.4	Confident	80.5	Confident	22 Å²	22	74.2 Å²	74.2	12%	0.115	37%	0.372	C	S	.	.	H	α-helix	trans	-61.8	-50	172.4	174.1	59.2	0	0	0	111.1	Q548 C549 F556 Q558 K559 V564 H565 M566	Q548-L562 WeakPolarHBondContact O-CD2 3.35Å; C549-L562 HydrophobicContact CB-CD1 3.91Å; F556-L562 HydrophobicContact CB-CB 4.48Å; F556-L562 HydrophobicContact CD2-CB 4.15Å; F556-L562 HydrophobicContact CD2-CD1 4Å; F556-L562 HydrophobicContact CE2-CD1 4.18Å; F556-L562 HydrophobicContact CG-CB 4.45Å; Q558-L562 PolarHBondContact O-N 3.29Å; Q558-L562 VanDerWaalsContact O-N 3.16Å; K559-L562 PolarHBondContact O-N 3Å; L562-V564 VanDerWaalsContact C-N 3.3Å; L562-V564 PolarHBondContact O-N 3.33Å; L562-H565 CarbonylContact O-C 3.58Å; L562-H565 WeakPolarHBondContact O-CA 3.49Å; L562-H565 WeakPolarHBondContact O-CB 3.39Å; L562-H565 PolarHBondContact O-N 3.24Å; L562-M566 HydrophobicContact CD1-CG 3.94Å; L562-M566 HydrophobicContact CD1-SD 3.94Å; L562-M566 HydrophobicContact CG-CG 4.27Å; L562-M566 WeakPolarHBondContact O-CG 2.99Å; L562-M566 PolarHBondContact O-N 3.29Å
563	N	84.1	Confident	79.8	Confident	92 Å²	92	78.4 Å²	78.4	49%	0.492	39%	0.386	S	S	.	.	H	α-helix	trans	-60.1	-37.7	178.8	-75.6	23.6	0	0	0	112.6	K559 S560 M566 R567	K559-N563 PolarHBondContact O-N 2.76Å; K559-N563 PolarHBondContact O-OD1 3.42Å; S560-N563 PolarHBondContact O-N 2.78Å; N563-M566 PolarHBondContact O-N 3.21Å; N563-R567 PolarHBondContact O-N 3.19Å
564	V	80.4	Confident	79.6	Confident	43 Å²	43	76.9 Å²	76.9	26%	0.261	38%	0.383	S	S	.	.	H	α-helix	trans	-63.4	-42.1	172.4	172.3	0	0	0	0	111.1	S560 S561 L562 R567	S560-V564 WeakPolarHBondContact O-CG2 3.49Å; S560-V564 PolarHBondContact O-N 3.24Å; S561-V564 PolarHBondContact O-N 3.03Å; L562-V564 VanDerWaalsContact C-N 3.3Å; L562-V564 PolarHBondContact O-N 3.33Å; V564-R567 PolarHBondContact O-N 3.27Å
565	H	84.6	Confident	79.2	Confident	19 Å²	19	74.1 Å²	74.1	9%	0.088	37%	0.37	C	S	.	.	H	α-helix	trans	-67.7	-38	177.2	171.6	65.9	0	0	0	113.2	C549 C552 F556 S561 L562 R567 L568 H569	C549-H565 PolarHBondContact SG-NE2 2.94Å; C549-H565 VanDerWaalsContact SG-NE2 3.41Å; C552-H565 PolarHBondContact SG-NE2 3.19Å; C552-H565 VanDerWaalsContact SG-NE2 3.36Å; F556-H565 HydrophobicContact CE1-CB 4.07Å; F556-H565 HydrophobicContact CE2-CB 4.01Å; F556-H565 AromaticContact CE2-CD2 3.34Å; F556-H565 WeakPolarHBondContact CE2-CD2 3.48Å; F556-H565 AromaticContact CE2-CG 3.72Å; F556-H565 AromaticContact CE2-NE2 3.98Å; F556-H565 HydrophobicContact CZ-CB 3.55Å; F556-H565 AromaticContact CZ-CD2 3.43Å; F556-H565 VanDerWaalsContact CZ-CD2 3.43Å; F556-H565 WeakPolarHBondContact CZ-CD2 3.37Å; F556-H565 AromaticContact CZ-CG 3.32Å; F556-H565 AromaticContact CZ-ND1 3.86Å; F556-H565 AromaticContact CZ-NE2 3.98Å; S561-H565 WeakPolarHBondContact O-CB 3.31Å; S561-H565 PolarHBondContact O-N 3.14Å; L562-H565 CarbonylContact O-C 3.58Å; L562-H565 WeakPolarHBondContact O-CA 3.49Å; L562-H565 WeakPolarHBondContact O-CB 3.39Å; L562-H565 PolarHBondContact O-N 3.24Å; H565-R567 PolarHBondContact O-N 3.06Å; H565-L568 VanDerWaalsContact O-CB 3.25Å; H565-L568 WeakPolarHBondContact O-CB 3.4Å; H565-L568 WeakPolarHBondContact O-CG 3.12Å; H565-L568 PolarHBondContact O-N 3.3Å; H565-H569 AromaticContact CD2-NE2 3.21Å; H565-H569 PolarHBondContact CD2-NE2 3.47Å; H565-H569 AromaticContact CE1-NE2 2.75Å; H565-H569 PolarHBondContact CE1-NE2 3.45Å; H565-H569 AromaticContact ND1-NE2 3.8Å; H565-H569 AromaticContact NE2-CD2 3.82Å; H565-H569 AromaticContact NE2-NE2 2.24Å; H565-H569 PolarHBondContact NE2-NE2 2.92Å
566	M	80.9	Confident	79.2	Confident	42 Å²	42	71.7 Å²	71.7	21%	0.207	36%	0.364	C	S	.	.	H	α-helix	trans	-61.7	-28.1	177.2	-66	-54.9	-69.2	0	0	112.9	C549 I551 L562 N563 L568 H569 R570	C549-M566 HydrophobicContact CB-SD 4.32Å; I551-M566 HydrophobicContact CD1-CE 3.62Å; I551-M566 HydrophobicContact CG1-CE 4.08Å; L562-M566 HydrophobicContact CD1-CG 3.94Å; L562-M566 HydrophobicContact CD1-SD 3.94Å; L562-M566 HydrophobicContact CG-CG 4.27Å; L562-M566 WeakPolarHBondContact O-CG 2.99Å; L562-M566 PolarHBondContact O-N 3.29Å; N563-M566 PolarHBondContact O-N 3.21Å; M566-L568 PolarHBondContact O-N 3.14Å; M566-H569 PolarHBondContact O-N 2.82Å; M566-R570 PolarHBondContact O-N 2.81Å
567	R	81.5	Confident	79.2	Confident	49 Å²	49	69.5 Å²	69.5	19%	0.185	35%	0.354	C	S	.	.	H	α-helix	trans	-65.1	-22.6	172.4	-71.1	-167.6	-77.4	-176	-8.6	113.8	N563 V564 H565 G571 E572 S574 Y575	N563-R567 PolarHBondContact O-N 3.19Å; V564-R567 PolarHBondContact O-N 3.27Å; H565-R567 PolarHBondContact O-N 3.06Å; R567-G571 PolarHBondContact O-N 3.39Å; R567-E572 HydrophobicContact CB-CB 4.01Å; R567-E572 HydrophobicContact CG-CB 4.02Å; R567-E572 WeakPolarHBondContact CG-OE2 3.3Å; R567-E572 PolarHBondContact O-N 3.43Å; R567-S574 PolarHBondContact NH1-OG 2.93Å; R567-Y575 PolarHBondContact NH1-OH 3.07Å
568	L	77.2	Confident	79.4	Confident	101 Å²	101	75.6 Å²	75.6	53%	0.529	37%	0.373	S	S	.	.	H	α-helix	trans	-68.9	-46.4	173	-55.9	176.2	0	0	0	110.6	H565 M566 R570 G571 S585	H565-L568 VanDerWaalsContact O-CB 3.25Å; H565-L568 WeakPolarHBondContact O-CB 3.4Å; H565-L568 WeakPolarHBondContact O-CG 3.12Å; H565-L568 PolarHBondContact O-N 3.3Å; M566-L568 PolarHBondContact O-N 3.14Å; L568-R570 VanDerWaalsContact C-N 3.32Å; L568-R570 PolarHBondContact O-N 2.96Å; L568-G571 PolarHBondContact O-N 3.18Å; L568-G571 VanDerWaalsContact O-N 3.14Å; L568-S585 VanDerWaalsContact CD2-OG 3.24Å; L568-S585 WeakPolarHBondContact CD2-OG 3.25Å
569	H	76.1	Confident	79.5	Confident	81 Å²	81	76.4 Å²	76.4	38%	0.375	38%	0.379	S	S	.	.	H	α-helix	trans	-64.8	-33.5	178.7	-66.1	-59	0	0	0	113.3	C549 I551 C552 H565 M566 G571	C549-H569 VanDerWaalsContact SG-CD2 3.59Å; C549-H569 PolarHBondContact SG-NE2 3.44Å; I551-H569 HydrophobicContact CD1-CB 3.57Å; I551-H569 HydrophobicContact CG2-CB 4.36Å; C552-H569 WeakPolarHBondContact CB-CE1 3.44Å; C552-H569 PolarHBondContact SG-CE1 3.23Å; C552-H569 PolarHBondContact SG-NE2 3.38Å; H565-H569 AromaticContact CD2-NE2 3.21Å; H565-H569 PolarHBondContact CD2-NE2 3.47Å; H565-H569 AromaticContact CE1-NE2 2.75Å; H565-H569 PolarHBondContact CE1-NE2 3.45Å; H565-H569 AromaticContact ND1-NE2 3.8Å; H565-H569 AromaticContact NE2-CD2 3.82Å; H565-H569 AromaticContact NE2-NE2 2.24Å; H565-H569 PolarHBondContact NE2-NE2 2.92Å; M566-H569 PolarHBondContact O-N 2.82Å; H569-G571 VanDerWaalsContact C-N 3.33Å
570	R	74.1	Confident	79.7	Confident	179 Å²	179	72.6 Å²	72.6	68%	0.675	37%	0.368	S	S	*	.	T	Hydrogen-bonded Turn	trans	-83.1	-4.2	175.5	-65.5	-173	171	-166.9	-7.3	114.5	M566 L568 E572	M566-R570 PolarHBondContact O-N 2.81Å; L568-R570 VanDerWaalsContact C-N 3.32Å; L568-R570 PolarHBondContact O-N 2.96Å; R570-E572 HydrophobicContact CB-CB 4.4Å; R570-E572 HydrophobicContact CB-CG 3.82Å; R570-E572 WeakPolarHBondContact CD-OE1 3.41Å; R570-E572 IonicContact CZ-OE1 3.73Å; R570-E572 IonicContact NE-OE1 2.81Å; R570-E572 IonicContact NH1-OE1 3.21Å; R570-E572 PolarHBondContact NH1-OE1 3.12Å; R570-E572 PolarHBondContact O-N 2.94Å; R570-E572 VanDerWaalsContact O-N 3.15Å
571	G	68.6	Low	79.7	Confident	49 Å²	49	75.4 Å²	75.4	51%	0.505	37%	0.372	S	S	.	.	T	Hydrogen-bonded Turn	trans	63.6	12.6	-171.5	0	0	0	0	0	115	R567 L568 H569 K573	R567-G571 PolarHBondContact O-N 3.39Å; L568-G571 PolarHBondContact O-N 3.18Å; L568-G571 VanDerWaalsContact O-N 3.14Å; H569-G571 VanDerWaalsContact C-N 3.33Å; G571-K573 VanDerWaalsContact C-N 3.3Å; G571-K573 PolarHBondContact O-N 3.42Å
572	E	69.5	Low	79.4	Confident	77 Å²	77	79.7 Å²	79.7	36%	0.36	39%	0.385	S	S	.	.			trans	-67.8	78.4	-175.4	-79.5	179.2	-157.9	0	0	111.9	R567 R570 S574	R567-E572 HydrophobicContact CB-CB 4.01Å; R567-E572 HydrophobicContact CG-CB 4.02Å; R567-E572 WeakPolarHBondContact CG-OE2 3.3Å; R567-E572 PolarHBondContact O-N 3.43Å; R570-E572 HydrophobicContact CB-CB 4.4Å; R570-E572 HydrophobicContact CB-CG 3.82Å; R570-E572 WeakPolarHBondContact CD-OE1 3.41Å; R570-E572 IonicContact CZ-OE1 3.73Å; R570-E572 IonicContact NE-OE1 2.81Å; R570-E572 IonicContact NH1-OE1 3.21Å; R570-E572 PolarHBondContact NH1-OE1 3.12Å; R570-E572 PolarHBondContact O-N 2.94Å; R570-E572 VanDerWaalsContact O-N 3.15Å; E572-S574 VanDerWaalsContact C-N 3.29Å; E572-S574 PolarHBondContact O-N 3.49Å
573	K	70.3	Confident	79.1	Confident	130 Å²	130	84.2 Å²	84.2	57%	0.565	40%	0.404	S	S	*	.			trans	-83.4	67.7	176.2	-68.5	170.9	174.4	177.7	0	110.9	G571 Y575 K583 F584	G571-K573 VanDerWaalsContact C-N 3.3Å; G571-K573 PolarHBondContact O-N 3.42Å; K573-Y575 VanDerWaalsContact C-N 3.26Å; K573-Y575 PolarHBondContact O-N 2.94Å; K573-K583 HydrophobicContact CB-CB 3.61Å; K573-K583 HydrophobicContact CD-CB 4.27Å; K573-K583 WeakPolarHBondContact CD-O 3.15Å; K573-F584 CarbonylContact C-O 3.39Å; K573-F584 WeakPolarHBondContact CA-O 3.43Å
574	S	75.6	Confident	78.9	Confident	71 Å²	71	81.8 Å²	81.8	50%	0.497	39%	0.389	S	S	.	.			trans	-71.8	-2.4	-171.7	65.7	0	0	0	0	116.5	R567 E572 F584	R567-S574 PolarHBondContact NH1-OG 2.93Å; E572-S574 VanDerWaalsContact C-N 3.29Å; E572-S574 PolarHBondContact O-N 3.49Å; S574-F584 PolarHBondContact N-O 2.87Å
575	Y	75.2	Confident	78.7	Confident	71 Å²	71	80.5 Å²	80.5	28%	0.278	38%	0.382	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-121.6	106.4	-177.4	-55.5	-78.8	0	0	0	110.7	R567 K573 K583 F584 H586 K587	R567-Y575 PolarHBondContact NH1-OH 3.07Å; K573-Y575 VanDerWaalsContact C-N 3.26Å; K573-Y575 PolarHBondContact O-N 2.94Å; Y575-K583 CarbonylContact O-C 3.48Å; Y575-F584 PolarHBondContact N-O 3.49Å; Y575-F584 PolarHBondContact O-N 2.98Å; Y575-H586 VanDerWaalsContact CD2-C 3.43Å; Y575-K587 HydrophobicContact CD1-CB 4.2Å; Y575-K587 HydrophobicContact CE1-CB 3.99Å
576	E	82.3	Confident	78.4	Confident	77 Å²	77	82.2 Å²	82.2	36%	0.36	39%	0.39	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-92	138.1	-179.4	-173.2	174.6	115	0	0	112	Y578 K581 K583	E576-Y578 PolarHBondContact O-N 3.47Å; E576-K581 HydrophobicContact CG-CD 4.34Å; E576-K581 WeakPolarHBondContact OE1-CD 3.32Å; E576-K581 IonicContact OE1-NZ 2.66Å; E576-K581 PolarHBondContact OE1-NZ 3.01Å; E576-K583 HydrophobicContact CB-CG 4.35Å; E576-K583 HydrophobicContact CG-CG 4.2Å; E576-K583 WeakPolarHBondContact OE2-CE 3.29Å; E576-K583 IonicContact OE2-NZ 3.37Å; E576-K583 PolarHBondContact OE2-NZ 3.15Å
577	C	85.3	Confident	78.4	Confident	0 Å²	0	85.5 Å²	85.5	0%	0	40%	0.403	C	S	.	.			trans	-72.4	117.7	164.3	169.1	0	0	0	0	110	I579 C580 K581 K582 F584 L590 M594	C577-I579 PolarHBondContact O-N 3.34Å; C577-I579 PolarHBondContact SG-N 3.25Å; C577-C580 PolarHBondContact SG-N 3.26Å; C577-K581 WeakPolarHBondContact O-CA 3.25Å; C577-K581 PolarHBondContact O-N 3.21Å; C577-K582 WeakPolarHBondContact CB-O 3.35Å; C577-K582 PolarHBondContact N-O 3.49Å; C577-F584 HydrophobicContact CB-CE2 4.22Å; C577-L590 HydrophobicContact CB-CD1 3.96Å; C577-M594 HydrophobicContact CB-CE 3.77Å; C577-M594 WeakPolarHBondContact SG-CE 3.33Å
578	Y	85.3	Confident	78.5	Confident	173 Å²	173	86.4 Å²	86.4	68%	0.678	41%	0.414	S	S	*	.	T	Hydrogen-bonded Turn	trans	-65.2	-29.1	178.7	68.5	-87.5	0	0	0	113.2	E576 M594	E576-Y578 PolarHBondContact O-N 3.47Å; Y578-M594 HydrophobicContact CD1-SD 4.04Å; Y578-M594 HydrophobicContact CE1-SD 3.69Å
579	I	82.3	Confident	78.7	Confident	85 Å²	85	84.7 Å²	84.7	44%	0.436	41%	0.405	S	S	.	.	T	Hydrogen-bonded Turn	trans	-77.4	-54.8	-175.4	-54.1	173.5	0	0	0	112.3	C577 H597	C577-I579 PolarHBondContact O-N 3.34Å; C577-I579 PolarHBondContact SG-N 3.25Å; I579-H597 HydrophobicContact CD1-CB 3.48Å; I579-H597 VanDerWaalsContact CD1-CB 3.48Å
580	C	85.9	Confident	79.1	Confident	52 Å²	52	82 Å²	82	35%	0.351	39%	0.394	S	S	.	.	T	Hydrogen-bonded Turn	trans	-119.5	14.9	-175.4	77.1	0	0	0	0	114.6	C577 K582 H593 H597	C577-C580 PolarHBondContact SG-N 3.26Å; C580-K582 PolarHBondContact O-N 3.48Å; C580-H593 PolarHBondContact SG-NE2 2.62Å; C580-H597 VanDerWaalsContact SG-CE1 3.54Å; C580-H597 PolarHBondContact SG-NE2 3.45Å
581	K	83.1	Confident	79.7	Confident	126 Å²	126	77.8 Å²	77.8	55%	0.548	38%	0.382	S	S	.	.			trans	60.4	2.8	171.2	-58.4	-56.9	-167.1	175.9	0	117.4	E576 C577 K583	E576-K581 HydrophobicContact CG-CD 4.34Å; E576-K581 WeakPolarHBondContact OE1-CD 3.32Å; E576-K581 IonicContact OE1-NZ 2.66Å; E576-K581 PolarHBondContact OE1-NZ 3.01Å; C577-K581 WeakPolarHBondContact O-CA 3.25Å; C577-K581 PolarHBondContact O-N 3.21Å; K581-K583 PolarHBondContact O-N 3.29Å
582	K	78.6	Confident	80.4	Confident	135 Å²	135	83.8 Å²	83.8	59%	0.587	39%	0.389	S	S	*	.			trans	-61	130.8	171.9	-69.6	-173.4	177.6	-176.5	0	110.8	C577 C580 F584	C577-K582 WeakPolarHBondContact CB-O 3.35Å; C577-K582 PolarHBondContact N-O 3.49Å; C580-K582 PolarHBondContact O-N 3.48Å; K582-F584 HydrophobicContact CB-CE2 3.88Å; K582-F584 HydrophobicContact CB-CZ 4Å; K582-F584 WeakPolarHBondContact O-CD2 3.46Å; K582-F584 VanDerWaalsContact O-CE2 3.25Å; K582-F584 WeakPolarHBondContact O-CE2 3.44Å
583	K	80.3	Confident	81.2	Confident	116 Å²	116	81.3 Å²	81.3	50%	0.504	38%	0.377	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-103.8	137.3	-177.3	-52.1	-169.4	-175.3	-157.3	0	111.5	K573 Y575 E576 K581	K573-K583 HydrophobicContact CB-CB 3.61Å; K573-K583 HydrophobicContact CD-CB 4.27Å; K573-K583 WeakPolarHBondContact CD-O 3.15Å; Y575-K583 CarbonylContact O-C 3.48Å; E576-K583 HydrophobicContact CB-CG 4.35Å; E576-K583 HydrophobicContact CG-CG 4.2Å; E576-K583 WeakPolarHBondContact OE2-CE 3.29Å; E576-K583 IonicContact OE2-NZ 3.37Å; E576-K583 PolarHBondContact OE2-NZ 3.15Å; K581-K583 PolarHBondContact O-N 3.29Å
584	F	79.4	Confident	81.8	Confident	41 Å²	41	76.8 Å²	76.8	18%	0.18	36%	0.359	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-124.3	148.1	-174.3	-59.5	-89.7	0	0	0	111.4	K573 S574 Y575 C577 K582 L589 L590 H593	K573-F584 CarbonylContact C-O 3.39Å; K573-F584 WeakPolarHBondContact CA-O 3.43Å; S574-F584 PolarHBondContact N-O 2.87Å; Y575-F584 PolarHBondContact N-O 3.49Å; Y575-F584 PolarHBondContact O-N 2.98Å; C577-F584 HydrophobicContact CB-CE2 4.22Å; K582-F584 HydrophobicContact CB-CE2 3.88Å; K582-F584 HydrophobicContact CB-CZ 4Å; K582-F584 WeakPolarHBondContact O-CD2 3.46Å; K582-F584 VanDerWaalsContact O-CE2 3.25Å; K582-F584 WeakPolarHBondContact O-CE2 3.44Å; F584-L589 HydrophobicContact CB-CB 4.35Å; F584-L589 HydrophobicContact CD1-CB 3.96Å; F584-L589 HydrophobicContact CG-CB 4.45Å; F584-L590 HydrophobicContact CB-CB 4.42Å; F584-L590 HydrophobicContact CD2-CB 4.1Å; F584-L590 HydrophobicContact CD2-CD1 4.02Å; F584-L590 HydrophobicContact CE2-CD1 4.18Å; F584-L590 HydrophobicContact CG-CB 4.38Å; F584-H593 HydrophobicContact CE1-CB 4.16Å; F584-H593 HydrophobicContact CE2-CB 4.19Å; F584-H593 AromaticContact CE2-CD2 3.35Å; F584-H593 WeakPolarHBondContact CE2-CD2 3.21Å; F584-H593 AromaticContact CE2-CG 3.87Å; F584-H593 HydrophobicContact CZ-CB 3.69Å; F584-H593 AromaticContact CZ-CD2 3.32Å; F584-H593 WeakPolarHBondContact CZ-CD2 3.21Å; F584-H593 AromaticContact CZ-CG 3.39Å; F584-H593 AromaticContact CZ-ND1 3.99Å; F584-H593 AromaticContact CZ-NE2 3.88Å
585	S	77.6	Confident	82.2	Confident	17 Å²	17	75.7 Å²	75.7	12%	0.119	35%	0.354	C	S	.	.	S	Bend	trans	-81.8	-9.7	177	52.3	0	0	0	0	114.1	L568	L568-S585 VanDerWaalsContact CD2-OG 3.24Å; L568-S585 WeakPolarHBondContact CD2-OG 3.25Å
586	H	77.6	Confident	82.5	Confident	54 Å²	54	76.8 Å²	76.8	25%	0.25	36%	0.364	C	S	.	.	S	Bend	trans	-145.5	140.3	-178.6	-158.8	-110.5	0	0	0	113.6	Y575 T588 L589 L590	Y575-H586 VanDerWaalsContact CD2-C 3.43Å; H586-T588 VanDerWaalsContact C-N 3.3Å; H586-T588 PolarHBondContact ND1-OG1 3.2Å; H586-T588 PolarHBondContact O-N 3.08Å; H586-L589 HydrophobicContact CB-CD1 4.2Å; H586-L589 HydrophobicContact CB-CG 4.25Å; H586-L589 WeakPolarHBondContact O-CB 3.49Å; H586-L589 PolarHBondContact O-N 2.85Å; H586-L590 PolarHBondContact O-N 3.25Å
587	K	80.6	Confident	82.3	Confident	112 Å²	112	74.8 Å²	74.8	49%	0.487	35%	0.354	S	S	.	.	H	α-helix	trans	-57.2	-40.4	-178.4	-167.9	176.6	-172.3	-89.5	0	112.4	Y575 L589 L590 E591	Y575-K587 HydrophobicContact CD1-CB 4.2Å; Y575-K587 HydrophobicContact CE1-CB 3.99Å; K587-L589 VanDerWaalsContact C-N 3.26Å; K587-L589 PolarHBondContact O-N 3.01Å; K587-L590 CarbonylContact O-C 3.57Å; K587-L590 WeakPolarHBondContact O-CB 3.33Å; K587-L590 PolarHBondContact O-N 2.86Å; K587-L590 VanDerWaalsContact O-N 3.14Å; K587-E591 HydrophobicContact CG-CG 4.29Å; K587-E591 IonicContact NZ-OE1 2.62Å; K587-E591 PolarHBondContact NZ-OE1 3.22Å; K587-E591 WeakPolarHBondContact O-CG 3.14Å; K587-E591 PolarHBondContact O-N 3.44Å
588	T	82.9	Confident	81.9	Confident	68 Å²	68	78.4 Å²	78.4	42%	0.417	38%	0.38	S	S	.	.	H	α-helix	trans	-70.2	-19.2	179.8	64.6	0	0	0	0	114.5	H586 E591 R592	H586-T588 VanDerWaalsContact C-N 3.3Å; H586-T588 PolarHBondContact ND1-OG1 3.2Å; H586-T588 PolarHBondContact O-N 3.08Å; T588-E591 VanDerWaalsContact CA-OE2 3.27Å; T588-E591 WeakPolarHBondContact CA-OE2 3.36Å; T588-R592 WeakPolarHBondContact O-CB 3.22Å; T588-R592 PolarHBondContact O-N 2.9Å
589	L	81.8	Confident	80.7	Confident	64 Å²	64	75.5 Å²	75.5	34%	0.335	38%	0.376	S	S	.	.	H	α-helix	trans	-79.1	-40.3	170.7	-63.7	176	0	0	0	110.4	F584 H586 K587 H593	F584-L589 HydrophobicContact CB-CB 4.35Å; F584-L589 HydrophobicContact CD1-CB 3.96Å; F584-L589 HydrophobicContact CG-CB 4.45Å; H586-L589 HydrophobicContact CB-CD1 4.2Å; H586-L589 HydrophobicContact CB-CG 4.25Å; H586-L589 WeakPolarHBondContact O-CB 3.49Å; H586-L589 PolarHBondContact O-N 2.85Å; K587-L589 VanDerWaalsContact C-N 3.26Å; K587-L589 PolarHBondContact O-N 3.01Å; L589-H593 VanDerWaalsContact O-CB 3.29Å; L589-H593 WeakPolarHBondContact O-CB 3.48Å; L589-H593 PolarHBondContact O-N 2.8Å
590	L	85.6	Confident	79.3	Confident	26 Å²	26	73.7 Å²	73.7	14%	0.136	37%	0.374	C	S	.	.	H	α-helix	trans	-61	-47.1	169.9	173.8	60.6	0	0	0	111.1	C577 F584 H586 K587 R592 H593 M594	C577-L590 HydrophobicContact CB-CD1 3.96Å; F584-L590 HydrophobicContact CB-CB 4.42Å; F584-L590 HydrophobicContact CD2-CB 4.1Å; F584-L590 HydrophobicContact CD2-CD1 4.02Å; F584-L590 HydrophobicContact CE2-CD1 4.18Å; F584-L590 HydrophobicContact CG-CB 4.38Å; H586-L590 PolarHBondContact O-N 3.25Å; K587-L590 CarbonylContact O-C 3.57Å; K587-L590 WeakPolarHBondContact O-CB 3.33Å; K587-L590 PolarHBondContact O-N 2.86Å; K587-L590 VanDerWaalsContact O-N 3.14Å; L590-R592 PolarHBondContact O-N 2.76Å; L590-H593 CarbonylContact O-C 3.55Å; L590-H593 WeakPolarHBondContact O-CA 3.36Å; L590-H593 WeakPolarHBondContact O-CB 3.25Å; L590-H593 PolarHBondContact O-N 3.08Å; L590-H593 VanDerWaalsContact O-N 3.08Å; L590-M594 HydrophobicContact CD1-CE 3.6Å; L590-M594 HydrophobicContact CD1-CG 4.1Å; L590-M594 HydrophobicContact CD1-SD 4.13Å; L590-M594 HydrophobicContact CG-CG 4.31Å; L590-M594 WeakPolarHBondContact O-CG 3.35Å; L590-M594 PolarHBondContact O-N 3.45Å
591	E	85.9	Confident	77.3	Confident	90 Å²	90	74.8 Å²	74.8	42%	0.421	38%	0.382	S	S	.	.	H	α-helix	trans	-59.8	-44.7	179	-71.5	163.9	156.1	0	0	112.2	K587 T588 H593 M594 A595	K587-E591 HydrophobicContact CG-CG 4.29Å; K587-E591 IonicContact NZ-OE1 2.62Å; K587-E591 PolarHBondContact NZ-OE1 3.22Å; K587-E591 WeakPolarHBondContact O-CG 3.14Å; K587-E591 PolarHBondContact O-N 3.44Å; T588-E591 VanDerWaalsContact CA-OE2 3.27Å; T588-E591 WeakPolarHBondContact CA-OE2 3.36Å; E591-H593 VanDerWaalsContact C-N 3.3Å; E591-H593 PolarHBondContact O-N 2.78Å; E591-M594 PolarHBondContact O-N 2.98Å; E591-A595 PolarHBondContact O-N 3.18Å
592	R	84.5	Confident	75.3	Confident	174 Å²	174	72.9 Å²	72.9	66%	0.657	39%	0.39	S	S	*	.	H	α-helix	trans	-61.5	-39.9	173	-171.2	-169	-56.6	159.2	1.4	111.8	T588 L590 A595	T588-R592 WeakPolarHBondContact O-CB 3.22Å; T588-R592 PolarHBondContact O-N 2.9Å; L590-R592 PolarHBondContact O-N 2.76Å; R592-A595 WeakPolarHBondContact O-CB 3.34Å; R592-A595 PolarHBondContact O-N 3.15Å
593	H	85.6	Confident	74	Confident	26 Å²	26	72.6 Å²	72.6	12%	0.12	39%	0.393	C	S	.	.	H	α-helix	trans	-69.7	-32.2	176.5	175.9	62.9	0	0	0	112.6	C580 F584 L589 L590 E591 A595 L596 H597	C580-H593 PolarHBondContact SG-NE2 2.62Å; F584-H593 HydrophobicContact CE1-CB 4.16Å; F584-H593 HydrophobicContact CE2-CB 4.19Å; F584-H593 AromaticContact CE2-CD2 3.35Å; F584-H593 WeakPolarHBondContact CE2-CD2 3.21Å; F584-H593 AromaticContact CE2-CG 3.87Å; F584-H593 HydrophobicContact CZ-CB 3.69Å; F584-H593 AromaticContact CZ-CD2 3.32Å; F584-H593 WeakPolarHBondContact CZ-CD2 3.21Å; F584-H593 AromaticContact CZ-CG 3.39Å; F584-H593 AromaticContact CZ-ND1 3.99Å; F584-H593 AromaticContact CZ-NE2 3.88Å; L589-H593 VanDerWaalsContact O-CB 3.29Å; L589-H593 WeakPolarHBondContact O-CB 3.48Å; L589-H593 PolarHBondContact O-N 2.8Å; L590-H593 CarbonylContact O-C 3.55Å; L590-H593 WeakPolarHBondContact O-CA 3.36Å; L590-H593 WeakPolarHBondContact O-CB 3.25Å; L590-H593 PolarHBondContact O-N 3.08Å; L590-H593 VanDerWaalsContact O-N 3.08Å; E591-H593 VanDerWaalsContact C-N 3.3Å; E591-H593 PolarHBondContact O-N 2.78Å; H593-A595 VanDerWaalsContact C-N 3.31Å; H593-A595 PolarHBondContact O-N 3.48Å; H593-L596 WeakPolarHBondContact O-CB 3.48Å; H593-L596 PolarHBondContact O-N 3.48Å; H593-H597 AromaticContact CD2-NE2 3.76Å; H593-H597 AromaticContact CE1-CD2 3.97Å; H593-H597 AromaticContact CE1-NE2 3.2Å; H593-H597 PolarHBondContact CE1-NE2 3.32Å; H593-H597 AromaticContact NE2-CD2 3.79Å; H593-H597 AromaticContact NE2-NE2 3.01Å; H593-H597 PolarHBondContact NE2-NE2 3.12Å; H593-H597 PolarHBondContact O-CD2 2.95Å; H593-H597 VanDerWaalsContact O-CD2 3.24Å
594	M	82.4	Confident	72.2	Confident	35 Å²	35	72.6 Å²	72.6	17%	0.172	40%	0.403	C	S	.	.	H	α-helix	trans	-64.1	-38	173.8	-68.7	-59.5	84.4	0	0	111.1	C577 Y578 L590 E591 L596 H597 S598	C577-M594 HydrophobicContact CB-CE 3.77Å; C577-M594 WeakPolarHBondContact SG-CE 3.33Å; Y578-M594 HydrophobicContact CD1-SD 4.04Å; Y578-M594 HydrophobicContact CE1-SD 3.69Å; L590-M594 HydrophobicContact CD1-CE 3.6Å; L590-M594 HydrophobicContact CD1-CG 4.1Å; L590-M594 HydrophobicContact CD1-SD 4.13Å; L590-M594 HydrophobicContact CG-CG 4.31Å; L590-M594 WeakPolarHBondContact O-CG 3.35Å; L590-M594 PolarHBondContact O-N 3.45Å; E591-M594 PolarHBondContact O-N 2.98Å; M594-L596 PolarHBondContact O-N 3.34Å; M594-H597 PolarHBondContact O-N 3.29Å; M594-S598 PolarHBondContact O-N 2.88Å; M594-S598 PolarHBondContact O-OG 3.2Å
595	A	84.4	Confident	70.4	Confident	47 Å²	47	74 Å²	74	39%	0.388	43%	0.429	S	S	.	.	H	α-helix	trans	-59.3	-31.8	174.6	0	0	0	0	0	113	E591 R592 H593 S598 N599	E591-A595 PolarHBondContact O-N 3.18Å; R592-A595 WeakPolarHBondContact O-CB 3.34Å; R592-A595 PolarHBondContact O-N 3.15Å; H593-A595 VanDerWaalsContact C-N 3.31Å; H593-A595 PolarHBondContact O-N 3.48Å; A595-S598 PolarHBondContact O-N 2.88Å; A595-N599 WeakPolarHBondContact O-CB 3.43Å; A595-N599 PolarHBondContact O-N 2.79Å; A595-N599 PolarHBondContact O-OD1 3.05Å
596	L	80.9	Confident	68.5	Low	95 Å²	95	80.7 Å²	80.7	50%	0.497	46%	0.463	S	S	.	.	H	α-helix	trans	-65.2	-42	174	-56.6	176.9	0	0	0	111.5	H593 M594 N599 A600	H593-L596 WeakPolarHBondContact O-CB 3.48Å; H593-L596 PolarHBondContact O-N 3.48Å; M594-L596 PolarHBondContact O-N 3.34Å; L596-N599 PolarHBondContact O-N 3.44Å; L596-A600 WeakPolarHBondContact O-CB 3.5Å; L596-A600 PolarHBondContact O-N 3.18Å
597	H	79.3	Confident	66.5	Low	34 Å²	34	83.9 Å²	83.9	16%	0.157	49%	0.491	C	S	.	.	H	α-helix	trans	-66.9	-38.1	173.7	-64.4	-79.8	0	0	0	112.2	I579 C580 H593 M594 N599 A600 S601	I579-H597 HydrophobicContact CD1-CB 3.48Å; I579-H597 VanDerWaalsContact CD1-CB 3.48Å; C580-H597 VanDerWaalsContact SG-CE1 3.54Å; C580-H597 PolarHBondContact SG-NE2 3.45Å; H593-H597 AromaticContact CD2-NE2 3.76Å; H593-H597 AromaticContact CE1-CD2 3.97Å; H593-H597 AromaticContact CE1-NE2 3.2Å; H593-H597 PolarHBondContact CE1-NE2 3.32Å; H593-H597 AromaticContact NE2-CD2 3.79Å; H593-H597 AromaticContact NE2-NE2 3.01Å; H593-H597 PolarHBondContact NE2-NE2 3.12Å; H593-H597 PolarHBondContact O-CD2 2.95Å; H593-H597 VanDerWaalsContact O-CD2 3.24Å; M594-H597 PolarHBondContact O-N 3.29Å; H597-N599 VanDerWaalsContact C-N 3.32Å; H597-N599 PolarHBondContact O-N 2.89Å; H597-A600 PolarHBondContact O-N 2.94Å; H597-S601 WeakPolarHBondContact O-CB 3.46Å; H597-S601 PolarHBondContact O-N 2.93Å; H597-S601 PolarHBondContact O-OG 2.96Å
598	S	75.1	Confident	64.2	Low	77 Å²	77	85.1 Å²	85.1	54%	0.538	51%	0.507	S	S	.	.	H	α-helix	trans	-61.5	-40	174	-56.9	0	0	0	0	112.2	M594 A595 S601	M594-S598 PolarHBondContact O-N 2.88Å; M594-S598 PolarHBondContact O-OG 3.2Å; A595-S598 PolarHBondContact O-N 2.88Å; S598-S601 PolarHBondContact O-N 3.25Å
599	N	60.1	Low	61.9	Low	112 Å²	112	86.8 Å²	86.8	60%	0.599	52%	0.522	S	S	*	.	H	α-helix	trans	-69.9	-44.1	176.9	-67.3	0.5	0	0	0	111.5	A595 L596 H597 S601 A602	A595-N599 WeakPolarHBondContact O-CB 3.43Å; A595-N599 PolarHBondContact O-N 2.79Å; A595-N599 PolarHBondContact O-OD1 3.05Å; L596-N599 PolarHBondContact O-N 3.44Å; H597-N599 VanDerWaalsContact C-N 3.32Å; H597-N599 PolarHBondContact O-N 2.89Å; N599-S601 VanDerWaalsContact C-N 3.28Å; N599-S601 PolarHBondContact O-N 3.3Å; N599-A602 WeakPolarHBondContact O-CB 3.49Å; N599-A602 PolarHBondContact O-N 2.8Å
600	A	54.7	Low	59.7	Low	46 Å²	46	91 Å²	91	38%	0.38	55%	0.55	S	S	.	.	H	α-helix	trans	-61.3	-35.7	173.8	0	0	0	0	0	112.6	L596 H597 A602 I603	L596-A600 WeakPolarHBondContact O-CB 3.5Å; L596-A600 PolarHBondContact O-N 3.18Å; H597-A600 PolarHBondContact O-N 2.94Å; A600-A602 PolarHBondContact O-N 3.26Å; A600-I603 WeakPolarHBondContact O-CB 3.48Å; A600-I603 PolarHBondContact O-N 3.23Å
601	S	43.1	Very low	57.1	Low	76 Å²	76	93 Å²	93	53%	0.531	58%	0.577	S	S	.	*	T	Hydrogen-bonded Turn	trans	-63.5	-19.6	177.2	-58.1	0	0	0	0	113.7	H597 S598 N599 I603 T604	H597-S601 WeakPolarHBondContact O-CB 3.46Å; H597-S601 PolarHBondContact O-N 2.93Å; H597-S601 PolarHBondContact O-OG 2.96Å; S598-S601 PolarHBondContact O-N 3.25Å; N599-S601 VanDerWaalsContact C-N 3.28Å; N599-S601 PolarHBondContact O-N 3.3Å; S601-I603 VanDerWaalsContact C-N 3.3Å; S601-T604 WeakPolarHBondContact CA-OG1 3.5Å; S601-T604 PolarHBondContact O-OG1 3.26Å
602	A	41.1	Very low	54.7	Low	85 Å²	85	95.2 Å²	95.2	70%	0.702	60%	0.597	S	S	*	*	T	Hydrogen-bonded Turn	trans	-75.6	-19.4	174	0	0	0	0	0	112.8	N599 A600	N599-A602 WeakPolarHBondContact O-CB 3.49Å; N599-A602 PolarHBondContact O-N 2.8Å; A600-A602 PolarHBondContact O-N 3.26Å
603	I	50.2	Low	52.5	Low	129 Å²	129	93.5 Å²	93.5	66%	0.662	61%	0.608	S	S	*	*	T	Hydrogen-bonded Turn	trans	-88.8	-29.3	-178.7	-48.2	179	0	0	0	110.6	A600 S601 G605	A600-I603 WeakPolarHBondContact O-CB 3.48Å; A600-I603 PolarHBondContact O-N 3.23Å; S601-I603 VanDerWaalsContact C-N 3.3Å; I603-G605 PolarHBondContact O-N 2.94Å
604	T	43.7	Very low	49.8	Very low	116 Å²	116	95.3 Å²	95.3	71%	0.712	63%	0.634	S	S	*	*	T	Hydrogen-bonded Turn	trans	-72.5	17.3	179.1	50.6	0	0	0	0	115	S601	S601-T604 WeakPolarHBondContact CA-OG1 3.5Å; S601-T604 PolarHBondContact O-OG1 3.26Å
605	G	40.3	Very low	48	Very low	70 Å²	70	99.6 Å²	99.6	72%	0.722	67%	0.665	S	S	*	*	T	Hydrogen-bonded Turn	trans	-85.6	-10.9	175.7	0	0	0	0	0	115	I603	I603-G605 PolarHBondContact O-N 2.94Å
606	L	38.2	Very low	45.3	Very low	159 Å²	159	103.6 Å²	103.6	83%	0.832	68%	0.684	S	S	*	*			trans	-103.5	100.1	-179.9	-83.1	152.7	0	0	0	110.9	V608	L606-V608 PolarHBondContact O-N 3.38Å
607	S	37.1	Very low	42.7	Very low	120 Å²	120	104.2 Å²	104.2	84%	0.839	70%	0.696	S	S	*	*			trans	-76.6	104.5	175.8	57.2	0	0	0	0	111.7
608	V	31.6	Very low	40.5	Very low	138 Å²	138	110.3 Å²	110.3	84%	0.836	73%	0.728	S	S	*	*			trans	-124.4	118.9	156.5	-177.8	0	0	0	0	107.6	L606	L606-V608 PolarHBondContact O-N 3.38Å
609	S	35.2	Very low	38.3	Very low	104 Å²	104	112 Å²	112	73%	0.727	74%	0.738	S	S	*	*			trans	-108.8	163.9	174.5	55.4	0	0	0	0	110.4
610	V	33.8	Very low	36.9	Very low	151 Å²	151	115.1 Å²	115.1	92%	0.915	75%	0.751	S	S	*	*			trans	73.2	131.2	177.8	-166.9	0	0	0	0	114.8
611	G	31.5	Very low	35.9	Very low	68 Å²	68	119 Å²	119	70%	0.701	77%	0.771	S	S	*	*			trans	145.7	93.9	168.7	0	0	0	0	0	114.4
612	T	36.3	Very low	35.1	Very low	137 Å²	137	123.3 Å²	123.3	84%	0.84	79%	0.787	S	S	*	*			trans	-63.5	140.7	166.9	45.1	0	0	0	0	111.5	G614	T612-G614 PolarHBondContact O-N 3.26Å; T612-G614 VanDerWaalsContact O-N 3.13Å
613	P	37.1	Very low	34.5	Very low	138 Å²	138	123.6 Å²	123.6	90%	0.896	79%	0.789	S	S	*	*			trans	-75.9	104	-179.3	30.1	-34	0	0	0	112.3
614	G	29	Very low	33.5	Very low	64 Å²	64	124 Å²	124	66%	0.66	80%	0.797	S	S	*	*			trans	-111.7	144.3	156.7	0	0	0	0	0	109.4	T612	T612-G614 PolarHBondContact O-N 3.26Å; T612-G614 VanDerWaalsContact O-N 3.13Å
615	P	45.2	Very low	32.9	Very low	126 Å²	126	124 Å²	124	82%	0.818	80%	0.799	S	S	*	*			trans	-86.9	159.8	-168.4	34.3	-36.5	0	0	0	114.3
616	V	28.5	Very low	32.4	Very low	130 Å²	130	129.3 Å²	129.3	79%	0.788	81%	0.806	S	S	*	*			trans	138.3	132.6	138.3	170.3	0	0	0	0	114.6
617	S	26.7	Very low	32.4	Very low	108 Å²	108	127.8 Å²	127.8	76%	0.755	81%	0.805	S	S	*	*			trans	69.2	114.5	160.4	-70	0	0	0	0	121.8
618	I	33.2	Very low	31.9	Very low	162 Å²	162	126 Å²	126	83%	0.831	81%	0.805	S	S	*	*	P	Polyproline II helix	trans	-89	131.4	156.1	-62.2	160.9	0	0	0	108.8
619	P	28.6	Very low	31.7	Very low	114 Å²	114	124.7 Å²	124.7	74%	0.74	81%	0.809	S	S	*	*	P	Polyproline II helix	trans	-84	135	157.8	-9.1	27.3	0	0	0	110.7
620	M	29.3	Very low	31.2	Very low	177 Å²	177	122.9 Å²	122.9	87%	0.872	81%	0.807	S	S	*	*	P	Polyproline II helix	trans	-70.7	150.9	172	-87.2	-173	160.1	0	0	112.2
621	P	34.6	Very low	30.9	Very low	126 Å²	126	122.2 Å²	122.2	82%	0.818	80%	0.803	S	S	*	*	P	Polyproline II helix	trans	-72.2	148.4	176.4	30.7	-35.1	0	0	0	112.4
622	I	27.2	Very low	30.8	Very low	167 Å²	167	126 Å²	126	86%	0.856	81%	0.812	S	S	*	*	P	Polyproline II helix	trans	-77.4	138.8	176.8	-65.3	171.1	0	0	0	110.1
623	A	26.6	Very low	30.3	Very low	91 Å²	91	124 Å²	124	75%	0.752	81%	0.81	S	S	*	*	P	Polyproline II helix	trans	-77.9	152.3	179	0	0	0	0	0	113.2
624	V	29.5	Very low	29.9	Very low	137 Å²	137	126 Å²	126	83%	0.83	81%	0.812	S	S	*	*	P	Polyproline II helix	trans	-99.5	135.9	170.4	-179.5	0	0	0	0	108.3
625	P	32.1	Very low	29.8	Very low	116 Å²	116	126.7 Å²	126.7	75%	0.753	81%	0.811	S	S	*	*	P	Polyproline II helix	trans	-86.5	150.8	-169.7	33.6	-36.4	0	0	0	114.4
626	E	29.6	Very low	29	Very low	183 Å²	183	129.3 Å²	129.3	86%	0.855	82%	0.815	S	S	*	*	P	Polyproline II helix	trans	-93	156.6	163.3	-73.1	-142.2	124.5	0	0	111.7
627	P	37.2	Very low	29.7	Very low	126 Å²	126	127.9 Å²	127.9	82%	0.818	81%	0.808	S	S	*	*	P	Polyproline II helix	trans	-76.6	140.5	-174.4	30.9	-35.7	0	0	0	113.1
628	G	26.4	Very low	29.9	Very low	82 Å²	82	129.3 Å²	129.3	85%	0.845	81%	0.812	S	S	*	*	P	Polyproline II helix	trans	-96.1	162.6	-174	0	0	0	0	0	115.9
629	A	27.9	Very low	29.7	Very low	111 Å²	111	127 Å²	127	92%	0.917	81%	0.811	S	S	*	*			trans	-151	150	163.5	0	0	0	0	0	109.9
630	G	25.9	Very low	29.7	Very low	66 Å²	66	125.6 Å²	125.6	68%	0.68	82%	0.816	S	S	*	*			trans	99.5	65.7	156.2	0	0	0	0	0	119.9
631	V	26.5	Very low	29.7	Very low	137 Å²	137	120.6 Å²	120.6	83%	0.83	81%	0.81	S	S	*	*			trans	59.1	156.2	135	-59.6	0	0	0	0	123.3
632	V	29.5	Very low	29.3	Very low	148 Å²	148	119.9 Å²	119.9	90%	0.897	82%	0.815	S	S	*	*			trans	60.3	135.9	167	-66.6	0	0	0	0	119.7
633	A	25.8	Very low	29.3	Very low	96 Å²	96	115.9 Å²	115.9	79%	0.793	81%	0.814	S	S	*	*			trans	-120.9	158.9	177.7	0	0	0	0	0	110.5
634	L	28.9	Very low	29.4	Very low	180 Å²	180	118.9 Å²	118.9	94%	0.942	82%	0.823	S	S	*	*			trans	-160.6	165.7	144.2	-108.1	167.8	0	0	0	110
635	A	26.6	Very low	29.3	Very low	78 Å²	78	116.3 Å²	116.3	65%	0.645	82%	0.824	S	S	*	*			trans	-110.9	147.3	-150	0	0	0	0	0	116.1
636	M	29.1	Very low	29.1	Very low	181 Å²	181	116 Å²	116	89%	0.892	83%	0.831	S	S	*	*			trans	68.8	174.1	137.3	-77.8	-171.5	171.8	0	0	118.5
637	P	43.5	Very low	29	Very low	99 Å²	99	110.9 Å²	110.9	64%	0.643	83%	0.828	S	S	*	*				-139.9	-172.1	-67.7	39.8	-20.7	0	0	0	114.8
638	V	30	Very low	28.5	Very low	139 Å²	139	111.4 Å²	111.4	84%	0.842	83%	0.829	S	S	*	*			trans	61.7	155.8	164.4	-107.9	0	0	0	0	117.7
639	S	28.6	Very low	28.6	Very low	114 Å²	114	111.2 Å²	111.2	80%	0.797	83%	0.827	S	S	*	*			cis	-159.2	173.9	11.8	49	0	0	0	0	113.1
640	G	29.1	Very low	28.6	Very low	83 Å²	83	112.1 Å²	112.1	86%	0.856	82%	0.821	S	S	*	*			trans	98.7	132.6	171.1	0	0	0	0	0	113.8
641	G	28.9	Very low	28.6	Very low	72 Å²	72	112.7 Å²	112.7	74%	0.742	83%	0.827	S	S	*	*			cis	133.2	73.2	6.1	0	0	0	0	0	110.2
642	A	27	Very low	28.7	Very low	112 Å²	112	113.2 Å²	113.2	93%	0.926	83%	0.831	S	S	*	*				67.8	111.2	95.1	0	0	0	0	0	114.1
643	G	27.1	Very low	28.5	Very low	82 Å²	82	109.5 Å²	109.5	85%	0.845	82%	0.822	S	S	*	*			trans	-170	73.2	-175.4	0	0	0	0	0	113.5
644	V	27.9	Very low	28.6	Very low	154 Å²	154	111.9 Å²	111.9	93%	0.933	83%	0.826	S	S	*	*			trans	-64.3	151.8	-179.6	-73.5	0	0	0	0	114.3
645	G	27.6	Very low	28.4	Very low	83 Å²	83	107.8 Å²	107.8	86%	0.856	82%	0.818	S	S	*	*			trans	176.2	99.1	168.4	0	0	0	0	0	112.9
646	A	27.4	Very low	28.5	Very low	109 Å²	109	108.7 Å²	108.7	90%	0.901	83%	0.826	S	S	*	*			trans	-111.3	147.9	-179.7	0	0	0	0	0	111.9
647	G	27.3	Very low	28.5	Very low	77 Å²	77	109.6 Å²	109.6	79%	0.794	83%	0.828	S	S	*	*			trans	-160.6	115.6	172.8	0	0	0	0	0	110.5
648	V	27.6	Very low	27.7	Very low	136 Å²	136	109.2 Å²	109.2	82%	0.824	83%	0.834	S	S	*	*			trans	-119.9	131.7	-178.3	-179.9	0	0	0	0	109	T650	V648-T650 HydrophobicContact CG1-CG2 4.16Å
649	G	27.9	Very low	27.6	Very low	79 Å²	79	107.1 Å²	107.1	81%	0.814	83%	0.825	S	S	*	*			trans	-141.6	109.2	171.8	0	0	0	0	0	110
650	T	27.8	Very low	27.6	Very low	130 Å²	130	107 Å²	107	80%	0.798	82%	0.823	S	S	*	*			trans	-100.7	129.6	-174.9	49.1	0	0	0	0	112.4	V648	V648-T650 HydrophobicContact CG1-CG2 4.16Å
651	G	26.3	Very low	28.1	Very low	78 Å²	78	109 Å²	109	80%	0.804	81%	0.81	S	S	*	*			trans	-133.9	136.8	162.1	0	0	0	0	0	109.3
652	V	27.9	Very low	28.7	Very low	148 Å²	148	113.3 Å²	113.3	90%	0.897	81%	0.811	S	S	*	*			trans	-122.2	132.6	-168.3	178.4	0	0	0	0	110.6
653	G	25.6	Very low	29.6	Very low	70 Å²	70	109.9 Å²	109.9	72%	0.722	79%	0.786	S	S	*	*			trans	-167.2	92.2	-180	0	0	0	0	0	113.5
654	V	27.6	Very low	30.9	Very low	145 Å²	145	110.1 Å²	110.1	88%	0.879	77%	0.772	S	S	*	*			trans	-26.1	152.3	165.6	-106.6	0	0	0	0	117.1
655	A	25.6	Very low	32.9	Very low	94 Å²	94	106.9 Å²	106.9	78%	0.777	75%	0.752	S	S	*	*			cis	-151.9	159.4	14.4	0	0	0	0	0	114.1
656	A	28.4	Very low	35	Very low	98 Å²	98	106 Å²	106	81%	0.81	72%	0.723	S	S	*	*			trans	-134.2	146	160.4	0	0	0	0	0	109.2	A658	A656-A658 PolarHBondContact O-N 3.4Å
657	E	28.8	Very low	37.4	Very low	199 Å²	199	104.6 Å²	104.6	93%	0.93	70%	0.704	S	S	*	*			trans	-74.3	109	-174.7	-65.9	-169.5	106.7	0	0	112.2	S659	E657-S659 PolarHBondContact O-N 3.43Å
658	A	26.7	Very low	39.8	Very low	92 Å²	92	101.4 Å²	101.4	76%	0.76	67%	0.669	S	S	*	*			trans	-71.9	95.2	174.5	0	0	0	0	0	111.1	A656 C660	A656-A658 PolarHBondContact O-N 3.4Å; A658-C660 PolarHBondContact O-N 2.87Å
659	S	28.6	Very low	42	Very low	94 Å²	94	100 Å²	100	66%	0.657	67%	0.665	S	S	*	*			trans	-71.8	92.5	172.6	-169.9	0	0	0	0	110.8	E657 Q661	E657-S659 PolarHBondContact O-N 3.43Å; S659-Q661 PolarHBondContact O-N 3.3Å
660	C	29.2	Very low	44.3	Very low	112 Å²	112	100.7 Å²	100.7	76%	0.757	65%	0.654	S	S	*	*			trans	-68.8	91.1	172.8	-62	0	0	0	0	110.7	A658 E662	A658-C660 PolarHBondContact O-N 2.87Å; C660-E662 PolarHBondContact O-N 3.05Å
661	Q	39.3	Very low	46.8	Very low	125 Å²	125	96.4 Å²	96.4	58%	0.584	63%	0.628	S	S	*	*			trans	-82.7	89.7	173	-64.4	-171.8	27.4	0	0	110.6	S659 G663 Q677	S659-Q661 PolarHBondContact O-N 3.3Å; Q661-G663 PolarHBondContact O-N 2.96Å; Q661-Q677 VanDerWaalsContact OE1-NE2 3.09Å
662	E	41.4	Very low	49.1	Very low	162 Å²	162	98.7 Å²	98.7	76%	0.757	63%	0.629	S	S	*	*			trans	-87.2	89.2	167.8	-69.6	179.2	174.2	0	0	109	C660	C660-E662 PolarHBondContact O-N 3.05Å
663	G	45.3	Very low	51.4	Low	40 Å²	40	93 Å²	93	41%	0.412	60%	0.597	S	S	.	*			trans	-72	126	-166.5	0	0	0	0	0	115.2	Q661 T665	Q661-G663 PolarHBondContact O-N 2.96Å; G663-T665 PolarHBondContact O-N 2.93Å
664	T	54.4	Low	54.1	Low	88 Å²	88	96.6 Å²	96.6	54%	0.54	59%	0.593	S	S	.	*			trans	-77.9	103.2	156.5	50.3	0	0	0	0	108.5	Y666	T664-Y666 WeakPolarHBondContact O-CD2 3.42Å; T664-Y666 VanDerWaalsContact O-CE2 3.27Å; T664-Y666 WeakPolarHBondContact O-CE2 3.31Å; T664-Y666 PolarHBondContact O-N 3.26Å; T664-Y666 VanDerWaalsContact O-N 3.07Å; T664-Y666 WeakPolarHBondContact OG1-CE2 3.35Å; T664-Y666 VanDerWaalsContact OG1-CZ 3.26Å; T664-Y666 PolarHBondContact OG1-OH 2.81Å; T664-Y666 VanDerWaalsContact OG1-OH 3.08Å
665	T	69.3	Low	56.6	Low	85 Å²	85	91.7 Å²	91.7	52%	0.521	56%	0.56	S	S	.	*			trans	-65.9	106.1	-178.5	40.2	0	0	0	0	111.9	G663 D676	G663-T665 PolarHBondContact O-N 2.93Å; T665-D676 VanDerWaalsContact CG2-OD1 3.26Å; T665-D676 WeakPolarHBondContact CG2-OD1 3.46Å
666	Y	73.3	Confident	58.9	Low	65 Å²	65	91.8 Å²	91.8	26%	0.255	55%	0.547	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-82.3	117.9	172.8	-58.3	-74.2	0	0	0	109.5	T664 K674 F675 M678 F681	T664-Y666 WeakPolarHBondContact O-CD2 3.42Å; T664-Y666 VanDerWaalsContact O-CE2 3.27Å; T664-Y666 WeakPolarHBondContact O-CE2 3.31Å; T664-Y666 PolarHBondContact O-N 3.26Å; T664-Y666 VanDerWaalsContact O-N 3.07Å; T664-Y666 WeakPolarHBondContact OG1-CE2 3.35Å; T664-Y666 VanDerWaalsContact OG1-CZ 3.26Å; T664-Y666 PolarHBondContact OG1-OH 2.81Å; T664-Y666 VanDerWaalsContact OG1-OH 3.08Å; Y666-K674 CarbonylContact O-C 3.56Å; Y666-K674 WeakPolarHBondContact O-CA 3.27Å; Y666-F675 WeakPolarHBondContact CD2-O 3.42Å; Y666-F675 PolarHBondContact N-O 3.17Å; Y666-F675 PolarHBondContact O-N 3.49Å; Y666-M678 HydrophobicContact CD1-CE 4.1Å; Y666-M678 HydrophobicContact CD1-SD 4.3Å; Y666-M678 HydrophobicContact CD2-CB 4.34Å; Y666-M678 HydrophobicContact CE1-CE 3.37Å; Y666-M678 HydrophobicContact CE1-SD 4.03Å; Y666-M678 HydrophobicContact CE2-CB 3.67Å; Y666-M678 VanDerWaalsContact CE2-N 3.3Å; Y666-F681 HydrophobicContact CD2-CB 4.43Å; Y666-F681 HydrophobicContact CG-CB 4.21Å; Y666-F681 HydrophobicContact CG-CG 4.23Å
667	V	78	Confident	60.9	Low	80 Å²	80	90.8 Å²	90.8	49%	0.485	53%	0.526	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-100.7	130.5	-178.5	-171.1	0	0	0	0	109.5	K674 F681	V667-K674 HydrophobicContact CG1-CG 4.34Å; V667-K674 HydrophobicContact CG2-CD 4.47Å; V667-K674 HydrophobicContact CG2-CG 4.17Å; V667-F681 WeakPolarHBondContact O-CE2 3.48Å
668	C	76.9	Confident	63	Low	9 Å²	9	85.5 Å²	85.5	6%	0.061	50%	0.502	C	S	.	.	P	Polyproline II helix	trans	-66.9	140.2	174.3	-178.9	0	0	0	0	111	V670 C671 A673 H684 M685 H688	C668-V670 PolarHBondContact SG-N 3.26Å; C668-C671 WeakPolarHBondContact CB-O 3.47Å; C668-C671 VanDerWaalsContact O-O 3.11Å; C668-A673 HydrophobicContact CB-CB 4.5Å; C668-A673 PolarHBondContact N-O 3.07Å; C668-H684 WeakPolarHBondContact CB-NE2 3.26Å; C668-H684 PolarHBondContact SG-NE2 3.36Å; C668-H684 VanDerWaalsContact SG-NE2 3.4Å; C668-M685 VanDerWaalsContact SG-SD 3.65Å; C668-H688 PolarHBondContact SG-NE2 3.2Å; C668-H688 VanDerWaalsContact SG-NE2 3.38Å
669	S	74.6	Confident	65.4	Low	108 Å²	108	88.2 Å²	88.2	76%	0.755	50%	0.499	S	S	*	.	S	Bend	trans	-85.2	-8.8	176.3	58.4	0	0	0	0	113.9
670	V	75.3	Confident	67.6	Low	93 Å²	93	88.3 Å²	88.3	56%	0.564	49%	0.492	S	S	*	.	S	Bend	trans	-107.7	-28.2	-174.7	-170.1	0	0	0	0	111.8	C668 M685 H688	C668-V670 PolarHBondContact SG-N 3.26Å; V670-M685 HydrophobicContact CG2-CE 4.43Å; V670-H688 WeakPolarHBondContact CG1-ND1 3.39Å; V670-H688 HydrophobicContact CG2-CB 4.4Å
671	C	79.9	Confident	70.2	Confident	39 Å²	39	84.9 Å²	84.9	26%	0.264	46%	0.464	S	S	.	.	S	Bend	trans	-145.6	164.8	178.3	82.3	0	0	0	0	110.7	C668 A673 H684	C668-C671 WeakPolarHBondContact CB-O 3.47Å; C668-C671 VanDerWaalsContact O-O 3.11Å; C671-A673 PolarHBondContact O-N 3.19Å; C671-A673 VanDerWaalsContact SG-CB 3.6Å; C671-H684 VanDerWaalsContact SG-CE1 3.5Å; C671-H684 PolarHBondContact SG-NE2 3.19Å
672	P	74.4	Confident	72.1	Confident	126 Å²	126	82.5 Å²	82.5	82%	0.818	46%	0.455	S	S	*	.	S	Bend	trans	-74	11.3	-173.1	30.9	-36.5	0	0	0	115.4
673	A	77.8	Confident	74	Confident	28 Å²	28	78.7 Å²	78.7	23%	0.231	44%	0.44	C	S	.	.			trans	-69.1	144.1	-178.5	0	0	0	0	0	112.7	C668 C671 F675	C668-A673 HydrophobicContact CB-CB 4.5Å; C668-A673 PolarHBondContact N-O 3.07Å; C671-A673 PolarHBondContact O-N 3.19Å; C671-A673 VanDerWaalsContact SG-CB 3.6Å; A673-F675 HydrophobicContact CB-CE2 3.57Å; A673-F675 HydrophobicContact CB-CZ 3.66Å
674	K	80.4	Confident	75.8	Confident	147 Å²	147	78.7 Å²	78.7	64%	0.639	43%	0.429	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-128.8	143.8	179.5	-55.1	-175.7	-177.2	175.1	0	109.4	Y666 V667	Y666-K674 CarbonylContact O-C 3.56Å; Y666-K674 WeakPolarHBondContact O-CA 3.27Å; V667-K674 HydrophobicContact CG1-CG 4.34Å; V667-K674 HydrophobicContact CG2-CD 4.47Å; V667-K674 HydrophobicContact CG2-CG 4.17Å
675	F	81.2	Confident	76.9	Confident	41 Å²	41	76.7 Å²	76.7	18%	0.18	42%	0.415	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-137.9	129.6	-174.9	-55.9	-88.5	0	0	0	110.4	Y666 A673 Q677 L680 F681 H684	Y666-F675 WeakPolarHBondContact CD2-O 3.42Å; Y666-F675 PolarHBondContact N-O 3.17Å; Y666-F675 PolarHBondContact O-N 3.49Å; A673-F675 HydrophobicContact CB-CE2 3.57Å; A673-F675 HydrophobicContact CB-CZ 3.66Å; F675-Q677 PolarHBondContact O-N 3.46Å; F675-L680 HydrophobicContact CB-CB 4.42Å; F675-L680 HydrophobicContact CD1-CB 3.89Å; F675-L680 HydrophobicContact CG-CB 4.47Å; F675-F681 HydrophobicContact CB-CB 4.1Å; F675-F681 HydrophobicContact CD2-CB 4.3Å; F675-F681 HydrophobicContact CD2-CD2 4.09Å; F675-F681 HydrophobicContact CG-CB 4.33Å; F675-H684 HydrophobicContact CE1-CB 4.01Å; F675-H684 HydrophobicContact CE2-CB 3.88Å; F675-H684 AromaticContact CE2-CD2 3.31Å; F675-H684 WeakPolarHBondContact CE2-CD2 3.17Å; F675-H684 AromaticContact CE2-CG 3.53Å; F675-H684 AromaticContact CE2-NE2 3.82Å; F675-H684 HydrophobicContact CZ-CB 3.52Å; F675-H684 AromaticContact CZ-CD2 3.51Å; F675-H684 AromaticContact CZ-CE1 3.91Å; F675-H684 AromaticContact CZ-CG 3.22Å; F675-H684 AromaticContact CZ-ND1 3.53Å; F675-H684 AromaticContact CZ-NE2 3.92Å
676	D	73.4	Confident	77.5	Confident	96 Å²	96	80.6 Å²	80.6	51%	0.513	42%	0.42	S	S	.	.	S	Bend	trans	-81.2	-7.4	179.4	-53.4	-62.9	0	0	0	113	T665	T665-D676 VanDerWaalsContact CG2-OD1 3.26Å; T665-D676 WeakPolarHBondContact CG2-OD1 3.46Å
677	Q	71.8	Confident	77.3	Confident	78 Å²	78	82.9 Å²	82.9	36%	0.364	43%	0.434	S	S	.	.	S	Bend	trans	-126.3	134.9	-179.7	-59.6	-175.7	5.4	0	0	111.5	Q661 F675 E679 L680 F681	Q661-Q677 VanDerWaalsContact OE1-NE2 3.09Å; F675-Q677 PolarHBondContact O-N 3.46Å; Q677-E679 PolarHBondContact O-N 3.06Å; Q677-L680 HydrophobicContact CB-CD1 4.19Å; Q677-L680 HydrophobicContact CB-CG 4.25Å; Q677-L680 PolarHBondContact O-N 3.49Å; Q677-F681 PolarHBondContact O-N 3.24Å; Q677-F681 VanDerWaalsContact O-N 3.15Å
678	M	71.1	Confident	77.3	Confident	88 Å²	88	81.2 Å²	81.2	43%	0.433	42%	0.421	S	S	.	.	H	α-helix	trans	-62.4	-30.9	-178.9	178.1	62	91.9	0	0	112.4	Y666 F681 N682	Y666-M678 HydrophobicContact CD1-CE 4.1Å; Y666-M678 HydrophobicContact CD1-SD 4.3Å; Y666-M678 HydrophobicContact CD2-CB 4.34Å; Y666-M678 HydrophobicContact CE1-CE 3.37Å; Y666-M678 HydrophobicContact CE1-SD 4.03Å; Y666-M678 HydrophobicContact CE2-CB 3.67Å; Y666-M678 VanDerWaalsContact CE2-N 3.3Å; M678-F681 PolarHBondContact O-N 3.41Å; M678-F681 HydrophobicContact SD-CD1 4.07Å; M678-N682 WeakPolarHBondContact CG-ND2 3.39Å; M678-N682 PolarHBondContact O-N 3.4Å; M678-N682 PolarHBondContact O-ND2 2.77Å; M678-N682 PolarHBondContact SD-ND2 3.16Å
679	E	77.3	Confident	76.9	Confident	149 Å²	149	86.3 Å²	86.3	70%	0.696	45%	0.451	S	S	*	.	H	α-helix	trans	-71.2	-50.2	-177.1	-62.6	-178.8	172.6	0	0	110.4	Q677 F681 N682 D683	Q677-E679 PolarHBondContact O-N 3.06Å; E679-F681 VanDerWaalsContact C-N 3.28Å; E679-F681 PolarHBondContact O-N 2.92Å; E679-N682 PolarHBondContact O-N 3.21Å; E679-D683 PolarHBondContact O-N 3.04Å
680	L	75.9	Confident	76.2	Confident	95 Å²	95	85.1 Å²	85.1	50%	0.497	44%	0.443	S	S	.	.	H	α-helix	trans	-56.2	-39.9	171.7	-60	177.6	0	0	0	112.5	F675 Q677 H684	F675-L680 HydrophobicContact CB-CB 4.42Å; F675-L680 HydrophobicContact CD1-CB 3.89Å; F675-L680 HydrophobicContact CG-CB 4.47Å; Q677-L680 HydrophobicContact CB-CD1 4.19Å; Q677-L680 HydrophobicContact CB-CG 4.25Å; Q677-L680 PolarHBondContact O-N 3.49Å; L680-H684 VanDerWaalsContact O-CB 3.25Å; L680-H684 WeakPolarHBondContact O-CB 3.39Å; L680-H684 PolarHBondContact O-N 2.98Å
681	F	82.6	Confident	75.1	Confident	41 Å²	41	87.1 Å²	87.1	18%	0.18	45%	0.451	C	S	.	.	H	α-helix	trans	-62.6	-43.4	173.7	173.3	-99.6	0	0	0	112.7	Y666 V667 F675 Q677 M678 E679 H684 M685	Y666-F681 HydrophobicContact CD2-CB 4.43Å; Y666-F681 HydrophobicContact CG-CB 4.21Å; Y666-F681 HydrophobicContact CG-CG 4.23Å; V667-F681 WeakPolarHBondContact O-CE2 3.48Å; F675-F681 HydrophobicContact CB-CB 4.1Å; F675-F681 HydrophobicContact CD2-CB 4.3Å; F675-F681 HydrophobicContact CD2-CD2 4.09Å; F675-F681 HydrophobicContact CG-CB 4.33Å; Q677-F681 PolarHBondContact O-N 3.24Å; Q677-F681 VanDerWaalsContact O-N 3.15Å; M678-F681 PolarHBondContact O-N 3.41Å; M678-F681 HydrophobicContact SD-CD1 4.07Å; E679-F681 VanDerWaalsContact C-N 3.28Å; E679-F681 PolarHBondContact O-N 2.92Å; F681-H684 PolarHBondContact O-N 3.32Å; F681-M685 HydrophobicContact CD1-CG 4.33Å; F681-M685 HydrophobicContact CD2-CG 4.32Å; F681-M685 HydrophobicContact CE1-CG 3.88Å; F681-M685 HydrophobicContact CE2-CG 3.89Å; F681-M685 HydrophobicContact CE2-SD 4.23Å; F681-M685 HydrophobicContact CZ-CG 3.64Å; F681-M685 HydrophobicContact CZ-SD 4.18Å; F681-M685 WeakPolarHBondContact O-CB 3.4Å; F681-M685 VanDerWaalsContact O-CG 3.3Å; F681-M685 WeakPolarHBondContact O-CG 3.26Å; F681-M685 PolarHBondContact O-N 3.45Å
682	N	80.7	Confident	73.2	Confident	74 Å²	74	91.5 Å²	91.5	40%	0.396	50%	0.503	S	S	.	.	H	α-helix	trans	-68.3	-39.5	179.8	-83.5	-81.8	0	0	0	112.1	M678 E679 M685 R686	M678-N682 WeakPolarHBondContact CG-ND2 3.39Å; M678-N682 PolarHBondContact O-N 3.4Å; M678-N682 PolarHBondContact O-ND2 2.77Å; M678-N682 PolarHBondContact SD-ND2 3.16Å; E679-N682 PolarHBondContact O-N 3.21Å; N682-M685 PolarHBondContact O-N 3.08Å; N682-R686 WeakPolarHBondContact O-CG 3.46Å; N682-R686 PolarHBondContact O-N 2.7Å
683	D	80.8	Confident	73.2	Confident	83 Å²	83	89.8 Å²	89.8	44%	0.444	49%	0.487	S	S	.	.	H	α-helix	trans	-71.5	-35.6	176.7	-71.1	-33.7	0	0	0	111.9	E679 R686 M687	E679-D683 PolarHBondContact O-N 3.04Å; D683-R686 WeakPolarHBondContact O-CB 3.37Å; D683-R686 PolarHBondContact O-N 2.96Å; D683-R686 VanDerWaalsContact O-N 3.15Å; D683-R686 WeakPolarHBondContact OD1-CD 3.29Å; D683-R686 IonicContact OD1-CZ 2.68Å; D683-R686 IonicContact OD1-NE 2.78Å; D683-R686 IonicContact OD1-NH1 2.7Å; D683-R686 PolarHBondContact OD1-NH1 3.48Å; D683-M687 PolarHBondContact O-N 2.91Å
684	H	82.3	Confident	72.9	Confident	39 Å²	39	93.1 Å²	93.1	18%	0.181	50%	0.501	C	S	.	.	H	α-helix	trans	-62	-41.9	168	177.3	74.9	0	0	0	112.7	C668 C671 F675 L680 F681 R686 M687 H688	C668-H684 WeakPolarHBondContact CB-NE2 3.26Å; C668-H684 PolarHBondContact SG-NE2 3.36Å; C668-H684 VanDerWaalsContact SG-NE2 3.4Å; C671-H684 VanDerWaalsContact SG-CE1 3.5Å; C671-H684 PolarHBondContact SG-NE2 3.19Å; F675-H684 HydrophobicContact CE1-CB 4.01Å; F675-H684 HydrophobicContact CE2-CB 3.88Å; F675-H684 AromaticContact CE2-CD2 3.31Å; F675-H684 WeakPolarHBondContact CE2-CD2 3.17Å; F675-H684 AromaticContact CE2-CG 3.53Å; F675-H684 AromaticContact CE2-NE2 3.82Å; F675-H684 HydrophobicContact CZ-CB 3.52Å; F675-H684 AromaticContact CZ-CD2 3.51Å; F675-H684 AromaticContact CZ-CE1 3.91Å; F675-H684 AromaticContact CZ-CG 3.22Å; F675-H684 AromaticContact CZ-ND1 3.53Å; F675-H684 AromaticContact CZ-NE2 3.92Å; L680-H684 VanDerWaalsContact O-CB 3.25Å; L680-H684 WeakPolarHBondContact O-CB 3.39Å; L680-H684 PolarHBondContact O-N 2.98Å; F681-H684 PolarHBondContact O-N 3.32Å; H684-R686 PolarHBondContact O-N 3.33Å; H684-M687 WeakPolarHBondContact O-CB 3.46Å; H684-M687 PolarHBondContact O-N 3.45Å; H684-M687 VanDerWaalsContact O-N 3.16Å; H684-H688 AromaticContact CD2-CD2 3.95Å; H684-H688 AromaticContact CD2-NE2 3.65Å; H684-H688 AromaticContact CE1-NE2 3.26Å; H684-H688 PolarHBondContact CE1-NE2 2.99Å; H684-H688 VanDerWaalsContact CE1-NE2 3.26Å; H684-H688 AromaticContact NE2-CD2 3.71Å; H684-H688 AromaticContact NE2-NE2 2.94Å; H684-H688 PolarHBondContact NE2-NE2 3.18Å; H684-H688 PolarHBondContact O-CD2 3.42Å; H684-H688 VanDerWaalsContact O-CD2 3.25Å; H684-H688 PolarHBondContact O-N 2.94Å
685	M	78.4	Confident	72.5	Confident	46 Å²	46	90.1 Å²	90.1	23%	0.227	49%	0.493	C	S	.	.	H	α-helix	trans	-66.2	-23.5	174.3	-73.5	-58.5	-56.1	0	0	113	C668 V670 F681 N682 V689	C668-M685 VanDerWaalsContact SG-SD 3.65Å; V670-M685 HydrophobicContact CG2-CE 4.43Å; F681-M685 HydrophobicContact CD1-CG 4.33Å; F681-M685 HydrophobicContact CD2-CG 4.32Å; F681-M685 HydrophobicContact CE1-CG 3.88Å; F681-M685 HydrophobicContact CE2-CG 3.89Å; F681-M685 HydrophobicContact CE2-SD 4.23Å; F681-M685 HydrophobicContact CZ-CG 3.64Å; F681-M685 HydrophobicContact CZ-SD 4.18Å; F681-M685 WeakPolarHBondContact O-CB 3.4Å; F681-M685 VanDerWaalsContact O-CG 3.3Å; F681-M685 WeakPolarHBondContact O-CG 3.26Å; F681-M685 PolarHBondContact O-N 3.45Å; N682-M685 PolarHBondContact O-N 3.08Å; M685-V689 WeakPolarHBondContact O-CG2 3.4Å; M685-V689 PolarHBondContact O-N 3.17Å
686	R	80.8	Confident	72	Confident	167 Å²	167	92.9 Å²	92.9	63%	0.63	51%	0.511	S	S	*	.	H	α-helix	trans	-71.9	-35.4	170.6	-71.5	166.8	-178.4	-179.4	-6	112.5	N682 D683 H684 H688 V689 S690	N682-R686 WeakPolarHBondContact O-CG 3.46Å; N682-R686 PolarHBondContact O-N 2.7Å; D683-R686 WeakPolarHBondContact O-CB 3.37Å; D683-R686 PolarHBondContact O-N 2.96Å; D683-R686 VanDerWaalsContact O-N 3.15Å; D683-R686 WeakPolarHBondContact OD1-CD 3.29Å; D683-R686 IonicContact OD1-CZ 2.68Å; D683-R686 IonicContact OD1-NE 2.78Å; D683-R686 IonicContact OD1-NH1 2.7Å; D683-R686 PolarHBondContact OD1-NH1 3.48Å; H684-R686 PolarHBondContact O-N 3.33Å; R686-H688 VanDerWaalsContact C-N 3.33Å; R686-H688 PolarHBondContact O-N 3.33Å; R686-V689 CarbonylContact O-C 3.34Å; R686-V689 WeakPolarHBondContact O-CA 3.47Å; R686-V689 PolarHBondContact O-N 2.88Å; R686-S690 PolarHBondContact O-N 3.02Å; R686-S690 PolarHBondContact O-OG 3.13Å
687	M	70.9	Confident	71.9	Confident	113 Å²	113	92.8 Å²	92.8	56%	0.557	51%	0.511	S	S	*	.	H	α-helix	trans	-58.2	-45.1	174.8	-65	-61.7	-59.3	0	0	111.6	D683 H684 V689 S690 D691	D683-M687 PolarHBondContact O-N 2.91Å; H684-M687 WeakPolarHBondContact O-CB 3.46Å; H684-M687 PolarHBondContact O-N 3.45Å; H684-M687 VanDerWaalsContact O-N 3.16Å; M687-V689 PolarHBondContact O-N 3.38Å; M687-S690 WeakPolarHBondContact CA-OG 3.46Å; M687-S690 PolarHBondContact O-N 3.25Å; M687-S690 PolarHBondContact O-OG 2.95Å; M687-D691 PolarHBondContact O-N 3.28Å
688	H	76.4	Confident	72	Confident	45 Å²	45	93.7 Å²	93.7	21%	0.208	52%	0.521	C	S	.	.	H	α-helix	trans	-62.2	-28.6	174.8	-65.8	-70.8	0	0	0	113.4	C668 V670 H684 R686	C668-H688 PolarHBondContact SG-NE2 3.2Å; C668-H688 VanDerWaalsContact SG-NE2 3.38Å; V670-H688 WeakPolarHBondContact CG1-ND1 3.39Å; V670-H688 HydrophobicContact CG2-CB 4.4Å; H684-H688 AromaticContact CD2-CD2 3.95Å; H684-H688 AromaticContact CD2-NE2 3.65Å; H684-H688 AromaticContact CE1-NE2 3.26Å; H684-H688 PolarHBondContact CE1-NE2 2.99Å; H684-H688 VanDerWaalsContact CE1-NE2 3.26Å; H684-H688 AromaticContact NE2-CD2 3.71Å; H684-H688 AromaticContact NE2-NE2 2.94Å; H684-H688 PolarHBondContact NE2-NE2 3.18Å; H684-H688 PolarHBondContact O-CD2 3.42Å; H684-H688 VanDerWaalsContact O-CD2 3.25Å; H684-H688 PolarHBondContact O-N 2.94Å; R686-H688 VanDerWaalsContact C-N 3.33Å; R686-H688 PolarHBondContact O-N 3.33Å
689	V	69.8	Low	72	Confident	116 Å²	116	94.1 Å²	94.1	70%	0.703	53%	0.527	S	S	*	.	H	α-helix	trans	-81.6	-16.2	177	173.9	0	0	0	0	112.4	M685 R686 M687	M685-V689 WeakPolarHBondContact O-CG2 3.4Å; M685-V689 PolarHBondContact O-N 3.17Å; R686-V689 CarbonylContact O-C 3.34Å; R686-V689 WeakPolarHBondContact O-CA 3.47Å; R686-V689 PolarHBondContact O-N 2.88Å; M687-V689 PolarHBondContact O-N 3.38Å
690	S	58.7	Low	71.6	Confident	84 Å²	84	89.9 Å²	89.9	59%	0.587	51%	0.514	S	S	*	.	H	α-helix	trans	-86.7	-17.9	168.9	43.1	0	0	0	0	114.2	R686 M687	R686-S690 PolarHBondContact O-N 3.02Å; R686-S690 PolarHBondContact O-OG 3.13Å; M687-S690 WeakPolarHBondContact CA-OG 3.46Å; M687-S690 PolarHBondContact O-N 3.25Å; M687-S690 PolarHBondContact O-OG 2.95Å
691	D	53.5	Low	71.3	Confident	134 Å²	134	89.5 Å²	89.5	72%	0.717	52%	0.516	S	S	*	.			trans	-93.9	-7.1	-175.6	-74.1	-20.3	0	0	0	114.7	M687	M687-D691 PolarHBondContact O-N 3.28Å
692	G	40.2	Very low	70.2	Confident	132 Å²	132	93.9 Å²	93.9	100%	1.361	55%	0.546	S	S	*	.			trans	176	0	175.5	0	0	0	0	0	117.1

Retrieved 692 of 692 residues in 88.6 ms (Link to these results)

U.S. Privacy Notice - Disclaimer / Registrations / Copyright Statement - Linking Policy - Notice of Privacy Practices (HIPAA) - Notice of Non‑Discrimination
© Copyright 2026 St. Jude Children's Research Hospital, a not-for-profit, section 501(c)(3).