A0A077YX18_TRITR Loading...

Uncharacterized protein

AlphaFold DB , UniProt , Accession A0A077YX18, Species TRITR (Trichuris trichiura, Whipworm), Gene n/a, Length 284 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	54.2	Low	71.6	Confident	242 Å²	242	125.5 Å²	125.5	100%	1.192	67%	0.669	S	S	*	*				0	56.6	0	-64.7	173.6	162	0	0	112
2	K	58.8	Low	72	Confident	189 Å²	189	120.7 Å²	120.7	82%	0.822	65%	0.652	S	S	*	*			trans	-116.8	-13.2	-175.4	-70.4	179.7	178.5	173.9	0	114.9	S4	K2-S4 VanDerWaalsContact C-N 3.31Å; K2-S4 PolarHBondContact O-N 3.06Å
3	A	57.9	Low	72.4	Confident	82 Å²	82	118.4 Å²	118.4	68%	0.678	64%	0.637	S	S	*	*	H	α-helix	trans	-72.8	-22	-179.9	0	0	0	0	0	113.6	L5	A3-L5 PolarHBondContact O-N 3.4Å
4	S	74.8	Confident	72.7	Confident	87 Å²	87	120.9 Å²	120.9	61%	0.608	63%	0.634	S	S	*	*	H	α-helix	trans	-66.7	-36.4	-174.8	179.2	0	0	0	0	113.5	K2 L8	K2-S4 VanDerWaalsContact C-N 3.31Å; K2-S4 PolarHBondContact O-N 3.06Å; S4-L8 PolarHBondContact O-N 3.36Å
5	L	74.8	Confident	72.7	Confident	121 Å²	121	119.6 Å²	119.6	63%	0.634	62%	0.623	S	S	*	*	H	α-helix	trans	-71	-37	-174.7	-163.4	78	0	0	0	112.6	A3 L8 I9	A3-L5 PolarHBondContact O-N 3.4Å; L5-L8 PolarHBondContact O-N 3.18Å; L5-I9 HydrophobicContact CG-CD1 4.21Å; L5-I9 WeakPolarHBondContact O-CG1 2.89Å; L5-I9 PolarHBondContact O-N 3.09Å; L5-I9 VanDerWaalsContact O-N 3.15Å
6	F	75.3	Confident	72.4	Confident	159 Å²	159	120 Å²	120	70%	0.697	62%	0.624	S	S	*	*	H	α-helix	trans	-69	-39.5	-179.9	-83.9	-82.3	0	0	0	112.4	L8 I9 S10	F6-L8 VanDerWaalsContact C-N 3.29Å; F6-L8 PolarHBondContact O-N 3.14Å; F6-I9 PolarHBondContact O-N 3.15Å; F6-S10 PolarHBondContact O-N 3.3Å; F6-S10 VanDerWaalsContact O-N 3.11Å; F6-S10 PolarHBondContact O-OG 2.98Å
7	V	77.8	Confident	72	Confident	106 Å²	106	122.2 Å²	122.2	64%	0.642	63%	0.63	S	S	*	*	H	α-helix	trans	-64.7	-37.7	177	179.5	0	0	0	0	111	S10 F11	V7-S10 PolarHBondContact O-N 3.01Å; V7-F11 PolarHBondContact O-N 3.11Å
8	L	76.9	Confident	71.6	Confident	108 Å²	108	118.9 Å²	118.9	57%	0.565	62%	0.62	S	S	*	*	H	α-helix	trans	-69	-40.4	-179.6	-143.8	129	0	0	0	112.2	S4 L5 F6 F11 C12	S4-L8 PolarHBondContact O-N 3.36Å; L5-L8 PolarHBondContact O-N 3.18Å; F6-L8 VanDerWaalsContact C-N 3.29Å; F6-L8 PolarHBondContact O-N 3.14Å; L8-F11 PolarHBondContact O-N 3.25Å; L8-C12 PolarHBondContact O-N 3.36Å; L8-C12 VanDerWaalsContact O-N 3.17Å; L8-C12 PolarHBondContact O-SG 3.1Å
9	I	79.6	Confident	70.4	Confident	87 Å²	87	115.8 Å²	115.8	45%	0.446	61%	0.613	S	S	.	*	H	α-helix	trans	-65.6	-43.8	176.1	-66.5	167.1	0	0	0	110.7	L5 F6 F11 C12 I13	L5-I9 HydrophobicContact CG-CD1 4.21Å; L5-I9 WeakPolarHBondContact O-CG1 2.89Å; L5-I9 PolarHBondContact O-N 3.09Å; L5-I9 VanDerWaalsContact O-N 3.15Å; F6-I9 PolarHBondContact O-N 3.15Å; I9-F11 VanDerWaalsContact C-N 3.35Å; I9-F11 PolarHBondContact O-N 3.31Å; I9-C12 PolarHBondContact O-N 3.09Å; I9-I13 HydrophobicContact CG2-CD1 4Å; I9-I13 WeakPolarHBondContact O-CG1 3.44Å; I9-I13 PolarHBondContact O-N 3.44Å; I9-I13 VanDerWaalsContact O-N 3.15Å
10	S	78.3	Confident	69.5	Low	78 Å²	78	116.1 Å²	116.1	55%	0.545	62%	0.622	S	S	.	*	H	α-helix	trans	-64.1	-37.7	178.4	-62.3	0	0	0	0	112.7	F6 V7 I13 W14	F6-S10 PolarHBondContact O-N 3.3Å; F6-S10 VanDerWaalsContact O-N 3.11Å; F6-S10 PolarHBondContact O-OG 2.98Å; V7-S10 PolarHBondContact O-N 3.01Å; S10-I13 PolarHBondContact O-N 3.18Å; S10-W14 PolarHBondContact O-N 3.45Å; S10-W14 VanDerWaalsContact O-N 3.12Å
11	F	78.8	Confident	68.6	Low	121 Å²	121	116.8 Å²	116.8	53%	0.531	63%	0.63	S	S	.	*	H	α-helix	trans	-66.7	-37.9	176.4	-165.1	-97.2	0	0	0	112.3	V7 L8 I9 W14 Q15	V7-F11 PolarHBondContact O-N 3.11Å; L8-F11 PolarHBondContact O-N 3.25Å; I9-F11 VanDerWaalsContact C-N 3.35Å; I9-F11 PolarHBondContact O-N 3.31Å; F11-W14 HydrophobicContact CE2-CE3 4.29Å; F11-W14 HydrophobicContact CE2-CZ3 4.36Å; F11-W14 PolarHBondContact O-N 3.08Å; F11-Q15 HydrophobicContact CD1-CG 4.22Å; F11-Q15 HydrophobicContact CE1-CG 4.01Å; F11-Q15 WeakPolarHBondContact O-CG 3.27Å; F11-Q15 PolarHBondContact O-N 3.35Å; F11-Q15 VanDerWaalsContact O-N 3.1Å
12	C	77.1	Confident	68.4	Low	68 Å²	68	110.7 Å²	110.7	46%	0.459	61%	0.609	S	S	.	*	H	α-helix	trans	-64.9	-41.6	176	-71	0	0	0	0	112.7	L8 I9 W14 Q15 I16	L8-C12 PolarHBondContact O-N 3.36Å; L8-C12 VanDerWaalsContact O-N 3.17Å; L8-C12 PolarHBondContact O-SG 3.1Å; I9-C12 PolarHBondContact O-N 3.09Å; C12-W14 VanDerWaalsContact C-N 3.34Å; C12-Q15 PolarHBondContact O-N 3.36Å; C12-I16 WeakPolarHBondContact O-CG1 3.36Å; C12-I16 PolarHBondContact O-N 2.85Å
13	I	77.5	Confident	67.9	Low	91 Å²	91	109.7 Å²	109.7	47%	0.467	61%	0.611	S	S	.	*	H	α-helix	trans	-66.9	-39	178	-63.2	167.6	0	0	0	110.4	I9 S10 Q15 I16 H17	I9-I13 HydrophobicContact CG2-CD1 4Å; I9-I13 WeakPolarHBondContact O-CG1 3.44Å; I9-I13 PolarHBondContact O-N 3.44Å; I9-I13 VanDerWaalsContact O-N 3.15Å; S10-I13 PolarHBondContact O-N 3.18Å; I13-Q15 PolarHBondContact O-N 3.12Å; I13-I16 PolarHBondContact O-N 2.93Å; I13-H17 PolarHBondContact O-N 3.25Å
14	W	75.9	Confident	67.3	Low	154 Å²	154	111.7 Å²	111.7	58%	0.583	62%	0.617	S	S	*	*	H	α-helix	trans	-63.3	-39.9	177	-174.4	68.4	0	0	0	112.8	S10 F11 C12 I16 H17 S18	S10-W14 PolarHBondContact O-N 3.45Å; S10-W14 VanDerWaalsContact O-N 3.12Å; F11-W14 HydrophobicContact CE2-CE3 4.29Å; F11-W14 HydrophobicContact CE2-CZ3 4.36Å; F11-W14 PolarHBondContact O-N 3.08Å; C12-W14 VanDerWaalsContact C-N 3.34Å; W14-I16 VanDerWaalsContact C-N 3.34Å; W14-I16 PolarHBondContact O-N 3.42Å; W14-H17 PolarHBondContact O-N 3.42Å; W14-S18 WeakPolarHBondContact O-CB 3.36Å; W14-S18 PolarHBondContact O-N 3.38Å; W14-S18 VanDerWaalsContact O-N 3.07Å; W14-S18 PolarHBondContact O-OG 3.49Å
15	Q	72.7	Confident	65.7	Low	101 Å²	101	118.1 Å²	118.1	47%	0.472	63%	0.629	S	S	.	*	H	α-helix	trans	-63.6	-35.4	175.8	-74.3	-80	-28.1	0	0	112.9	F11 C12 I13 A19	F11-Q15 HydrophobicContact CD1-CG 4.22Å; F11-Q15 HydrophobicContact CE1-CG 4.01Å; F11-Q15 WeakPolarHBondContact O-CG 3.27Å; F11-Q15 PolarHBondContact O-N 3.35Å; F11-Q15 VanDerWaalsContact O-N 3.1Å; C12-Q15 PolarHBondContact O-N 3.36Å; I13-Q15 PolarHBondContact O-N 3.12Å; Q15-A19 PolarHBondContact O-N 3.06Å
16	I	67.8	Low	64	Low	126 Å²	126	121.6 Å²	121.6	65%	0.646	64%	0.642	S	S	*	*	H	α-helix	trans	-71.2	-35.2	179.6	-63.9	164.8	0	0	0	111.8	C12 I13 W14	C12-I16 WeakPolarHBondContact O-CG1 3.36Å; C12-I16 PolarHBondContact O-N 2.85Å; I13-I16 PolarHBondContact O-N 2.93Å; W14-I16 VanDerWaalsContact C-N 3.34Å; W14-I16 PolarHBondContact O-N 3.42Å
17	H	66.6	Low	62.6	Low	157 Å²	157	121.1 Å²	121.1	73%	0.727	64%	0.641	S	S	*	*	H	α-helix	trans	-81.6	-21.9	177.6	-74.1	-9.2	0	0	0	114	I13 W14	I13-H17 PolarHBondContact O-N 3.25Å; W14-H17 PolarHBondContact O-N 3.42Å
18	S	64.9	Low	60.8	Low	63 Å²	63	124.4 Å²	124.4	44%	0.441	65%	0.65	S	S	.	*	H	α-helix	trans	-89.2	-9.2	-179.5	-50.5	0	0	0	0	113.2	W14 P20	W14-S18 WeakPolarHBondContact O-CB 3.36Å; W14-S18 PolarHBondContact O-N 3.38Å; W14-S18 VanDerWaalsContact O-N 3.07Å; W14-S18 PolarHBondContact O-OG 3.49Å; S18-P20 VanDerWaalsContact O-CD 3.25Å; S18-P20 WeakPolarHBondContact O-CD 3.34Å
19	A	48.4	Very low	59	Low	60 Å²	60	130.9 Å²	130.9	50%	0.496	67%	0.668	S	S	.	*	S	Bend	trans	-72.1	115.1	178.6	0	0	0	0	0	110.4	Q15 V21	Q15-A19 PolarHBondContact O-N 3.06Å; A19-V21 PolarHBondContact O-N 3.04Å
20	P	51.7	Low	56.9	Low	122 Å²	122	135 Å²	135	79%	0.792	69%	0.686	S	S	*	*	P	Polyproline II helix	trans	-67.9	117.4	178.3	26.6	-31.6	0	0	0	109.8	S18 P22	S18-P20 VanDerWaalsContact O-CD 3.25Å; S18-P20 WeakPolarHBondContact O-CD 3.34Å; P20-P22 WeakPolarHBondContact O-CD 3.35Å
21	V	51.7	Low	55.1	Low	130 Å²	130	138.9 Å²	138.9	79%	0.788	70%	0.701	S	S	*	*	P	Polyproline II helix	trans	-70.1	119.3	174.4	178.5	0	0	0	0	108.5	A19 L23	A19-V21 PolarHBondContact O-N 3.04Å; V21-L23 PolarHBondContact O-N 3.25Å
22	P	50.2	Low	53	Low	115 Å²	115	136.5 Å²	136.5	75%	0.747	71%	0.71	S	S	*	*	P	Polyproline II helix	trans	-75.7	122.5	179.8	29.1	-31	0	0	0	110.4	P20 P24	P20-P22 WeakPolarHBondContact O-CD 3.35Å; P22-P24 WeakPolarHBondContact O-CD 3.25Å
23	L	47.5	Very low	51.4	Low	167 Å²	167	139 Å²	139	87%	0.874	73%	0.725	S	S	*	*	P	Polyproline II helix	trans	-83.8	116.5	169.8	-74.5	162.5	0	0	0	109.2	V21	V21-L23 PolarHBondContact O-N 3.25Å
24	P	45.2	Very low	49.9	Very low	124 Å²	124	140 Å²	140	81%	0.805	74%	0.736	S	S	*	*	P	Polyproline II helix	trans	-73.2	150.1	170.4	27.9	-30.2	0	0	0	111.9	P22	P22-P24 WeakPolarHBondContact O-CD 3.25Å
25	R	42.2	Very low	48.2	Very low	223 Å²	223	140 Å²	140	84%	0.842	74%	0.742	S	S	*	*	P	Polyproline II helix	trans	-68.1	153.3	-158.5	-71.6	171.9	175.2	159.8	-2.2	116.3
26	Q	37.5	Very low	46.9	Very low	194 Å²	194	143.1 Å²	143.1	91%	0.907	76%	0.757	S	S	*	*	P	Polyproline II helix	trans	-53.9	125.6	152	-66.3	164	-38.2	0	0	110.5
27	E	47.7	Very low	45.7	Very low	148 Å²	148	146 Å²	146	69%	0.692	77%	0.768	S	S	*	*			trans	-149.5	101.4	162.3	-101.8	164.1	-160.2	0	0	105.4
28	E	38.2	Very low	44.5	Very low	175 Å²	175	146.6 Å²	146.6	82%	0.818	77%	0.77	S	S	*	*				71.2	88.6	103.7	-77.7	-176.2	162.5	0	0	113.2
29	Y	40	Very low	43.1	Very low	244 Å²	244	150.2 Å²	150.2	96%	0.957	79%	0.79	S	S	*	*			trans	-136.4	96.9	144.9	-94.3	-82.2	0	0	0	108.6
30	Q	35.8	Very low	42.6	Very low	173 Å²	173	151 Å²	151	81%	0.808	81%	0.805	S	S	*	*			trans	-85.1	142.6	169.2	-179.5	-178	48.1	0	0	108.3
31	D	40.8	Very low	42	Very low	161 Å²	161	150.5 Å²	150.5	86%	0.861	80%	0.804	S	S	*	*			trans	-174.6	117.8	140.6	-92.4	-26.6	0	0	0	110
32	G	34.6	Very low	41.5	Very low	71 Å²	71	150.4 Å²	150.4	73%	0.732	80%	0.803	S	S	*	*			trans	-88	-139.7	-173.4	0	0	0	0	0	114.4
33	P	42.6	Very low	41.3	Very low	119 Å²	119	152.7 Å²	152.7	77%	0.773	80%	0.804	S	S	*	*			cis	-137.1	-166.7	-16.5	27.8	-2.3	0	0	0	113.5
34	V	45.3	Very low	41.2	Very low	114 Å²	114	154.1 Å²	154.1	69%	0.691	81%	0.806	S	S	*	*			trans	86.1	129.1	159	-165.6	0	0	0	0	114.4
35	Q	41.8	Very low	41.3	Very low	152 Å²	152	153.3 Å²	153.3	71%	0.71	80%	0.798	S	S	*	*			cis	-162.3	151.2	19.9	-131.8	152.3	5.7	0	0	109.9
36	E	44.5	Very low	41.3	Very low	168 Å²	168	150.6 Å²	150.6	79%	0.785	80%	0.801	S	S	*	*			trans	22.6	128.4	138.7	-61	163.7	172.6	0	0	118.3
37	E	41.8	Very low	42.3	Very low	187 Å²	187	146.3 Å²	146.3	87%	0.874	79%	0.787	S	S	*	*				-170.4	147.4	69.8	-130.5	177.5	162.8	0	0	113.5
38	Q	42.3	Very low	42.5	Very low	168 Å²	168	148.1 Å²	148.1	79%	0.785	80%	0.796	S	S	*	*			trans	-25.5	133.8	169	-83.6	171.2	-11.3	0	0	122.1
39	T	35	Very low	43	Very low	139 Å²	139	150.7 Å²	150.7	85%	0.853	80%	0.798	S	S	*	*				35.1	120.3	124.3	21.4	0	0	0	0	121.2
40	G	38.6	Very low	43.3	Very low	78 Å²	78	147.2 Å²	147.2	80%	0.804	80%	0.796	S	S	*	*			trans	-166.9	108.8	156	0	0	0	0	0	110.9
41	S	39.1	Very low	44.1	Very low	110 Å²	110	142.3 Å²	142.3	77%	0.769	79%	0.785	S	S	*	*			trans	-67.4	170.9	-178.8	47.8	0	0	0	0	115
42	V	41.9	Very low	44.9	Very low	128 Å²	128	143.8 Å²	143.8	78%	0.776	79%	0.787	S	S	*	*			trans	85.9	117.7	165.4	-162.3	0	0	0	0	111.1
43	E	45.9	Very low	45.9	Very low	164 Å²	164	146 Å²	146	77%	0.766	78%	0.781	S	S	*	*				-165.6	139.5	55.2	-153.2	163.6	-179.2	0	0	108.9	V45	E43-V45 PolarHBondContact O-N 3.22Å
44	E	44.3	Very low	46.5	Very low	196 Å²	196	144.1 Å²	144.1	92%	0.916	77%	0.769	S	S	*	*			trans	-71.3	95.4	174.7	-169.6	171.1	-163	0	0	108.7
45	V	46.9	Very low	47.2	Very low	107 Å²	107	142.5 Å²	142.5	65%	0.648	77%	0.767	S	S	*	*			trans	-97.1	99.3	175.1	173.6	0	0	0	0	108.3	E43 V47	E43-V45 PolarHBondContact O-N 3.22Å; V45-V47 HydrophobicContact CG1-CB 4.26Å; V45-V47 HydrophobicContact CG1-CG2 3.36Å; V45-V47 PolarHBondContact O-N 3.2Å
46	D	43.1	Very low	48	Very low	166 Å²	166	142.8 Å²	142.8	89%	0.888	77%	0.768	S	S	*	*			trans	-71.7	95.2	166.8	-155.6	8.2	0	0	0	107.9
47	V	57.6	Low	48.5	Very low	104 Å²	104	139.7 Å²	139.7	63%	0.63	76%	0.757	S	S	*	*			trans	-119.1	112.7	172.2	167.4	0	0	0	0	107.6	V45 R49	V45-V47 HydrophobicContact CG1-CB 4.26Å; V45-V47 HydrophobicContact CG1-CG2 3.36Å; V45-V47 PolarHBondContact O-N 3.2Å; V47-R49 PolarHBondContact O-N 3.4Å; V47-R49 VanDerWaalsContact O-N 3.09Å
48	E	51.8	Low	49.3	Very low	186 Å²	186	133.6 Å²	133.6	87%	0.869	73%	0.732	S	S	*	*			trans	-35.1	112.2	164.9	-73.2	177.3	132.8	0	0	110.4	D50	E48-D50 PolarHBondContact O-N 3.12Å; E48-D50 VanDerWaalsContact O-N 3.15Å
49	R	49	Very low	50.1	Low	230 Å²	230	131.8 Å²	131.8	87%	0.868	72%	0.723	S	S	*	*			trans	-74.8	98.3	-178	-84.2	-173.9	177.5	-166.9	0.2	111.1	V47 A51	V47-R49 PolarHBondContact O-N 3.4Å; V47-R49 VanDerWaalsContact O-N 3.09Å; R49-A51 VanDerWaalsContact C-N 3.28Å; R49-A51 PolarHBondContact O-N 3.17Å
50	D	47.2	Very low	51.2	Low	170 Å²	170	131.3 Å²	131.3	91%	0.909	71%	0.711	S	S	*	*			trans	-88.2	71.3	149.3	-78.3	-29.3	0	0	0	108.9	E48 E52	E48-D50 PolarHBondContact O-N 3.12Å; E48-D50 VanDerWaalsContact O-N 3.15Å; D50-E52 PolarHBondContact O-N 3.36Å
51	A	52.2	Low	52.4	Low	70 Å²	70	130.7 Å²	130.7	58%	0.579	70%	0.695	S	S	*	*			trans	-89.2	92.2	173.3	0	0	0	0	0	109.2	R49 I53	R49-A51 VanDerWaalsContact C-N 3.28Å; R49-A51 PolarHBondContact O-N 3.17Å; A51-I53 PolarHBondContact O-N 3.35Å; A51-I53 VanDerWaalsContact O-N 3.11Å
52	E	56.8	Low	53.6	Low	193 Å²	193	130.7 Å²	130.7	90%	0.902	68%	0.683	S	S	*	*			trans	-54.5	111.8	170.5	-145.7	170.6	-161.6	0	0	109.2	D50	D50-E52 PolarHBondContact O-N 3.36Å
53	I	56.1	Low	54.5	Low	118 Å²	118	129.7 Å²	129.7	61%	0.605	67%	0.673	S	S	*	*			trans	-70	130.2	-174	-59.2	171.2	0	0	0	108.7	A51 A55 L57 V58	A51-I53 PolarHBondContact O-N 3.35Å; A51-I53 VanDerWaalsContact O-N 3.11Å; I53-A55 PolarHBondContact O-N 2.87Å; I53-L57 HydrophobicContact CG2-CB 4.16Å; I53-V58 HydrophobicContact CB-CG2 4.43Å; I53-V58 HydrophobicContact CG2-CG2 3.95Å
54	P	55.7	Low	55.3	Low	79 Å²	79	126.7 Å²	126.7	51%	0.513	66%	0.661	S	S	.	*			trans	-53.9	129.9	175.7	-22.7	30.6	0	0	0	111.2	E56 L57	P54-E56 PolarHBondContact O-N 3.04Å; P54-L57 HydrophobicContact CG-CD1 4.25Å; P54-L57 PolarHBondContact O-N 3.47Å
55	A	58.8	Low	56.6	Low	79 Å²	79	122.1 Å²	122.1	65%	0.653	64%	0.64	S	S	*	*	H	α-helix	trans	-54.7	-26.1	-175.2	0	0	0	0	0	113.8	I53 V58 Q59	I53-A55 PolarHBondContact O-N 2.87Å; A55-V58 PolarHBondContact O-N 2.99Å; A55-Q59 PolarHBondContact O-N 3.4Å; A55-Q59 VanDerWaalsContact O-N 3.1Å
56	E	59.2	Low	57.6	Low	159 Å²	159	123 Å²	123	74%	0.743	64%	0.637	S	S	*	*	H	α-helix	trans	-69.5	-35.1	179.2	-61.7	-175.4	167.3	0	0	113.1	P54 Q59 Q60	P54-E56 PolarHBondContact O-N 3.04Å; E56-Q59 PolarHBondContact O-N 3.27Å; E56-Q60 PolarHBondContact O-N 3.09Å; E56-Q60 VanDerWaalsContact O-N 3.09Å
57	L	55	Low	58.2	Low	103 Å²	103	124.5 Å²	124.5	54%	0.539	63%	0.63	S	S	.	*	H	α-helix	trans	-71.9	-33.4	176.5	-84.6	158.6	0	0	0	111.7	I53 P54 S61	I53-L57 HydrophobicContact CG2-CB 4.16Å; P54-L57 HydrophobicContact CG-CD1 4.25Å; P54-L57 PolarHBondContact O-N 3.47Å; L57-S61 PolarHBondContact O-N 3.21Å
58	V	58.3	Low	58.6	Low	59 Å²	59	127 Å²	127	36%	0.358	63%	0.628	S	S	.	*	H	α-helix	trans	-66.5	-42.2	172.8	-177.7	0	0	0	0	110.3	I53 A55 S61 Q62	I53-V58 HydrophobicContact CB-CG2 4.43Å; I53-V58 HydrophobicContact CG2-CG2 3.95Å; A55-V58 PolarHBondContact O-N 2.99Å; V58-S61 PolarHBondContact O-N 3.45Å; V58-S61 PolarHBondContact O-OG 3.35Å; V58-Q62 WeakPolarHBondContact O-CG 3.44Å; V58-Q62 PolarHBondContact O-N 3.07Å
59	Q	59.1	Low	59.3	Low	129 Å²	129	126.1 Å²	126.1	60%	0.603	62%	0.617	S	S	*	*	H	α-helix	trans	-63.6	-41.5	177.6	-112.9	176.1	10	0	0	113.4	A55 E56 Q62 L63	A55-Q59 PolarHBondContact O-N 3.4Å; A55-Q59 VanDerWaalsContact O-N 3.1Å; E56-Q59 PolarHBondContact O-N 3.27Å; Q59-Q62 PolarHBondContact O-N 3.25Å; Q59-L63 PolarHBondContact O-N 3.43Å; Q59-L63 VanDerWaalsContact O-N 3.08Å
60	Q	58.7	Low	59.7	Low	129 Å²	129	117.1 Å²	117.1	60%	0.603	59%	0.592	S	S	*	*	H	α-helix	trans	-69.8	-36.7	179.7	-156.9	178.9	16.2	0	0	112	E56 L63 L64	E56-Q60 PolarHBondContact O-N 3.09Å; E56-Q60 VanDerWaalsContact O-N 3.09Å; Q60-L63 PolarHBondContact O-N 2.99Å; Q60-L64 PolarHBondContact O-N 3.22Å
61	S	63.5	Low	60.3	Low	66 Å²	66	116 Å²	116	46%	0.462	58%	0.579	S	S	.	*	H	α-helix	trans	-64.7	-39.1	173.3	77.7	0	0	0	0	112.1	L57 V58 L64 E65	L57-S61 PolarHBondContact O-N 3.21Å; V58-S61 PolarHBondContact O-N 3.45Å; V58-S61 PolarHBondContact O-OG 3.35Å; S61-L64 PolarHBondContact O-N 3.09Å; S61-E65 PolarHBondContact O-N 3.16Å
62	Q	64	Low	60.5	Low	109 Å²	109	120.5 Å²	120.5	51%	0.509	58%	0.581	S	S	.	*	H	α-helix	trans	-65.4	-41.8	177.2	-75.3	178.3	3.2	0	0	112.4	V58 Q59 L64 E65 E66	V58-Q62 WeakPolarHBondContact O-CG 3.44Å; V58-Q62 PolarHBondContact O-N 3.07Å; Q59-Q62 PolarHBondContact O-N 3.25Å; Q62-L64 VanDerWaalsContact C-N 3.33Å; Q62-L64 PolarHBondContact O-N 2.91Å; Q62-E65 PolarHBondContact O-N 3.33Å; Q62-E66 WeakPolarHBondContact O-CB 3.47Å; Q62-E66 WeakPolarHBondContact O-CG 3.27Å; Q62-E66 PolarHBondContact O-N 3.42Å
63	L	61.1	Low	60.6	Low	108 Å²	108	117.5 Å²	117.5	57%	0.565	57%	0.567	S	S	*	*	H	α-helix	trans	-64.6	-35	177.1	-75.5	171.8	0	0	0	113.1	Q59 Q60 R67	Q59-L63 PolarHBondContact O-N 3.43Å; Q59-L63 VanDerWaalsContact O-N 3.08Å; Q60-L63 PolarHBondContact O-N 2.99Å; L63-R67 WeakPolarHBondContact O-CB 3.48Å; L63-R67 PolarHBondContact O-N 3.07Å
64	L	63.4	Low	60.3	Low	100 Å²	100	115 Å²	115	52%	0.524	56%	0.564	S	S	.	*	H	α-helix	trans	-69.6	-40.9	174.4	-92.6	157.4	0	0	0	112	Q60 S61 Q62 R67 R68	Q60-L64 PolarHBondContact O-N 3.22Å; S61-L64 PolarHBondContact O-N 3.09Å; Q62-L64 VanDerWaalsContact C-N 3.33Å; Q62-L64 PolarHBondContact O-N 2.91Å; L64-R67 PolarHBondContact O-N 2.75Å; L64-R68 WeakPolarHBondContact O-CG 3.48Å; L64-R68 PolarHBondContact O-N 3.28Å; L64-R68 VanDerWaalsContact O-N 3.09Å
65	E	72	Confident	60	Low	101 Å²	101	117.1 Å²	117.1	47%	0.472	57%	0.567	S	S	.	*	H	α-helix	trans	-64.2	-44.4	175.3	-161.4	75.2	-160	0	0	111.2	S61 Q62 R68 R69	S61-E65 PolarHBondContact O-N 3.16Å; Q62-E65 PolarHBondContact O-N 3.33Å; E65-R68 PolarHBondContact O-N 3.4Å; E65-R69 PolarHBondContact O-N 3.26Å
66	E	66.3	Low	59.7	Low	124 Å²	124	120 Å²	120	58%	0.579	57%	0.572	S	S	*	*	H	α-helix	trans	-62.7	-41.9	175.7	-77.1	-170.1	165.5	0	0	112.4	Q62 R68 R69 A70	Q62-E66 WeakPolarHBondContact O-CB 3.47Å; Q62-E66 WeakPolarHBondContact O-CG 3.27Å; Q62-E66 PolarHBondContact O-N 3.42Å; E66-R68 VanDerWaalsContact C-N 3.32Å; E66-R68 PolarHBondContact O-N 3.47Å; E66-R69 PolarHBondContact O-N 2.99Å; E66-A70 WeakPolarHBondContact O-CB 3.37Å; E66-A70 PolarHBondContact O-N 3.35Å
67	R	55.5	Low	59.4	Low	198 Å²	198	116.8 Å²	116.8	75%	0.747	56%	0.559	S	S	*	*	H	α-helix	trans	-60.2	-40.2	173.3	-92.7	-171.9	175.9	-173.1	0.9	112.3	L63 L64 K71	L63-R67 WeakPolarHBondContact O-CB 3.48Å; L63-R67 PolarHBondContact O-N 3.07Å; L64-R67 PolarHBondContact O-N 2.75Å; R67-K71 WeakPolarHBondContact O-CB 3.5Å; R67-K71 PolarHBondContact O-N 3.31Å
68	R	66.6	Low	59	Low	156 Å²	156	119.4 Å²	119.4	59%	0.589	57%	0.569	S	S	*	*	H	α-helix	trans	-67.1	-38.9	177.2	-75.7	-179.8	175.7	179.8	-0.2	111.7	L64 E65 E66 K71 R72	L64-R68 WeakPolarHBondContact O-CG 3.48Å; L64-R68 PolarHBondContact O-N 3.28Å; L64-R68 VanDerWaalsContact O-N 3.09Å; E65-R68 PolarHBondContact O-N 3.4Å; E66-R68 VanDerWaalsContact C-N 3.32Å; E66-R68 PolarHBondContact O-N 3.47Å; R68-K71 PolarHBondContact O-N 3.44Å; R68-R72 WeakPolarHBondContact O-CG 3.47Å; R68-R72 PolarHBondContact O-N 3.47Å
69	R	67.4	Low	58.6	Low	168 Å²	168	124.6 Å²	124.6	63%	0.634	59%	0.589	S	S	*	*	H	α-helix	trans	-64.4	-48	174.4	-71.7	-178.7	-172.9	177.9	2.6	111.8	E65 E66 K71 R72 Q73	E65-R69 PolarHBondContact O-N 3.26Å; E66-R69 PolarHBondContact O-N 2.99Å; R69-K71 VanDerWaalsContact C-N 3.29Å; R69-K71 PolarHBondContact O-N 3.42Å; R69-R72 PolarHBondContact O-N 2.7Å; R69-Q73 WeakPolarHBondContact O-CB 3.48Å; R69-Q73 PolarHBondContact O-N 3.38Å
70	A	56.9	Low	58.2	Low	41 Å²	41	124.7 Å²	124.7	34%	0.339	60%	0.599	S	S	.	*	H	α-helix	trans	-60.3	-38.6	177.2	0	0	0	0	0	112.3	E66 Q73 A74	E66-A70 WeakPolarHBondContact O-CB 3.37Å; E66-A70 PolarHBondContact O-N 3.35Å; A70-Q73 PolarHBondContact O-N 3.28Å; A70-A74 WeakPolarHBondContact O-CB 3.45Å; A70-A74 PolarHBondContact O-N 3.21Å
71	K	60.3	Low	57.8	Low	146 Å²	146	124.2 Å²	124.2	64%	0.635	60%	0.599	S	S	*	*	H	α-helix	trans	-67.1	-42.4	177.1	-170.2	177.3	-180	-178.5	0	112.8	R67 R68 R69 A74 Q75	R67-K71 WeakPolarHBondContact O-CB 3.5Å; R67-K71 PolarHBondContact O-N 3.31Å; R68-K71 PolarHBondContact O-N 3.44Å; R69-K71 VanDerWaalsContact C-N 3.29Å; R69-K71 PolarHBondContact O-N 3.42Å; K71-A74 PolarHBondContact O-N 2.87Å; K71-Q75 PolarHBondContact O-N 2.95Å
72	R	56.5	Low	57.2	Low	166 Å²	166	125.2 Å²	125.2	63%	0.626	60%	0.599	S	S	*	*	H	α-helix	trans	-65.3	-42.4	174.9	-70.7	-178.1	-164	170	5.5	111.3	R68 R69 A74 Q75 D76	R68-R72 WeakPolarHBondContact O-CG 3.47Å; R68-R72 PolarHBondContact O-N 3.47Å; R69-R72 PolarHBondContact O-N 2.7Å; R72-A74 VanDerWaalsContact C-N 3.3Å; R72-A74 PolarHBondContact O-N 3.46Å; R72-Q75 PolarHBondContact O-N 3.04Å; R72-D76 PolarHBondContact O-N 3.1Å
73	Q	58.2	Low	56.5	Low	129 Å²	129	122.9 Å²	122.9	60%	0.603	60%	0.598	S	S	*	*	H	α-helix	trans	-63.9	-35.4	179.1	-155	165.2	17.4	0	0	112.4	R69 A70 Q75 D76 D77	R69-Q73 WeakPolarHBondContact O-CB 3.48Å; R69-Q73 PolarHBondContact O-N 3.38Å; A70-Q73 PolarHBondContact O-N 3.28Å; Q73-Q75 VanDerWaalsContact C-N 3.35Å; Q73-D76 PolarHBondContact O-N 3.13Å; Q73-D77 WeakPolarHBondContact O-CB 3.37Å; Q73-D77 PolarHBondContact O-N 2.99Å; Q73-D77 VanDerWaalsContact O-N 3.09Å
74	A	50	Low	56	Low	67 Å²	67	122.9 Å²	122.9	55%	0.554	60%	0.599	S	S	*	*	H	α-helix	trans	-70.4	-27.1	173.4	0	0	0	0	0	113.8	A70 K71 R72	A70-A74 WeakPolarHBondContact O-CB 3.45Å; A70-A74 PolarHBondContact O-N 3.21Å; K71-A74 PolarHBondContact O-N 2.87Å; R72-A74 VanDerWaalsContact C-N 3.3Å; R72-A74 PolarHBondContact O-N 3.46Å
75	Q	49.8	Very low	55.8	Low	123 Å²	123	124.4 Å²	124.4	58%	0.575	60%	0.604	S	S	*	*	H	α-helix	trans	-79.2	-33.2	174.5	-74.6	-176.3	-54.9	0	0	112.1	K71 R72 Q73 E78	K71-Q75 PolarHBondContact O-N 2.95Å; R72-Q75 PolarHBondContact O-N 3.04Å; Q73-Q75 VanDerWaalsContact C-N 3.35Å; Q75-E78 WeakPolarHBondContact O-CB 3.39Å; Q75-E78 PolarHBondContact O-N 3.48Å
76	D	52	Low	54.6	Low	140 Å²	140	123.4 Å²	123.4	75%	0.749	60%	0.598	S	S	*	*	H	α-helix	trans	-74.8	-26.1	174.9	-65.6	-29.2	0	0	0	112.4	R72 Q73 E78	R72-D76 PolarHBondContact O-N 3.1Å; Q73-D76 PolarHBondContact O-N 3.13Å; D76-E78 VanDerWaalsContact C-N 3.28Å
77	D	52.5	Low	53.7	Low	90 Å²	90	125.4 Å²	125.4	48%	0.481	60%	0.6	S	S	.	*	T	Hydrogen-bonded Turn	trans	-84	6.1	174.6	-87.6	-36.9	0	0	0	113.3	Q73 E79 K269	Q73-D77 WeakPolarHBondContact O-CB 3.37Å; Q73-D77 PolarHBondContact O-N 2.99Å; Q73-D77 VanDerWaalsContact O-N 3.09Å; D77-E79 PolarHBondContact O-N 3.37Å; D77-K269 IonicContact OD1-NZ 2.76Å; D77-K269 PolarHBondContact OD1-NZ 2.95Å
78	E	46.3	Very low	53.6	Low	159 Å²	159	118.3 Å²	118.3	74%	0.743	58%	0.581	S	S	*	*			trans	-74.8	55	172.7	-155.6	171.4	-159.2	0	0	110.5	Q75 D76 T80	Q75-E78 WeakPolarHBondContact O-CB 3.39Å; Q75-E78 PolarHBondContact O-N 3.48Å; D76-E78 VanDerWaalsContact C-N 3.28Å; E78-T80 PolarHBondContact O-N 3.48Å; E78-T80 VanDerWaalsContact O-N 3.07Å
79	E	50.8	Low	52.8	Low	167 Å²	167	115.1 Å²	115.1	78%	0.78	57%	0.572	S	S	*	*			trans	-72.1	102.3	173.1	-150.8	171.6	-160.4	0	0	106.8	D77 I81	D77-E79 PolarHBondContact O-N 3.37Å; E79-I81 PolarHBondContact O-N 2.93Å
80	T	50.3	Low	51.7	Low	131 Å²	131	108.6 Å²	108.6	80%	0.804	55%	0.551	S	S	*	*			trans	-40.7	109.4	175.9	23	0	0	0	0	110.8	E78 D82	E78-T80 PolarHBondContact O-N 3.48Å; E78-T80 VanDerWaalsContact O-N 3.07Å; T80-D82 PolarHBondContact O-N 3.27Å
81	I	49.6	Very low	51	Low	120 Å²	120	112.9 Å²	112.9	62%	0.615	56%	0.564	S	S	*	*			trans	-55.3	116.7	166.3	-64.7	170.8	0	0	0	106.4	E79 A83 W113	E79-I81 PolarHBondContact O-N 2.93Å; I81-A83 PolarHBondContact O-N 3.11Å; I81-W113 HydrophobicContact CD1-CZ2 4.34Å
82	D	52.2	Low	50.2	Low	87 Å²	87	113.5 Å²	113.5	47%	0.465	56%	0.563	S	S	.	*			trans	-62.5	112	178.2	-173.3	-7.7	0	0	0	108.7	T80 D84 E85 F86	T80-D82 PolarHBondContact O-N 3.27Å; D82-D84 PolarHBondContact O-N 3.22Å; D82-D84 WeakPolarHBondContact OD1-CB 3.48Å; D82-D84 PolarHBondContact OD1-N 2.77Å; D82-E85 HydrophobicContact CB-CB 3.99Å; D82-E85 PolarHBondContact O-N 3.48Å; D82-E85 VanDerWaalsContact O-N 3.11Å; D82-F86 PolarHBondContact O-N 2.99Å; D82-F86 VanDerWaalsContact O-N 3.15Å
83	A	48.7	Very low	49.5	Very low	59 Å²	59	105.8 Å²	105.8	49%	0.488	53%	0.534	S	S	.	.	H	α-helix	trans	-60	-25.5	179.1	0	0	0	0	0	111.6	I81 R87	I81-A83 PolarHBondContact O-N 3.11Å; A83-R87 WeakPolarHBondContact O-CG 3.36Å; A83-R87 PolarHBondContact O-N 3.31Å; A83-R87 VanDerWaalsContact O-N 3.11Å
84	D	50.7	Low	48.5	Very low	109 Å²	109	109.2 Å²	109.2	58%	0.583	54%	0.542	S	S	*	.	H	α-helix	trans	-77.1	-36.5	177.5	-69.4	-24.2	0	0	0	111.6	D82 F86 R87 S88	D82-D84 PolarHBondContact O-N 3.22Å; D82-D84 WeakPolarHBondContact OD1-CB 3.48Å; D82-D84 PolarHBondContact OD1-N 2.77Å; D84-F86 VanDerWaalsContact C-N 3.34Å; D84-F86 PolarHBondContact O-N 3.15Å; D84-R87 PolarHBondContact O-N 3.29Å; D84-S88 WeakPolarHBondContact O-CB 3.41Å; D84-S88 PolarHBondContact O-N 3.17Å
85	E	58.7	Low	48.1	Very low	132 Å²	132	116.6 Å²	116.6	62%	0.617	56%	0.555	S	S	*	*	H	α-helix	trans	-61.3	-45	172	-172	172.3	-163.4	0	0	110.4	D82 R87 S88 E89	D82-E85 HydrophobicContact CB-CB 3.99Å; D82-E85 PolarHBondContact O-N 3.48Å; D82-E85 VanDerWaalsContact O-N 3.11Å; E85-R87 PolarHBondContact O-N 2.85Å; E85-S88 PolarHBondContact O-N 3.06Å; E85-S88 PolarHBondContact O-OG 3.23Å; E85-E89 PolarHBondContact O-N 3.47Å
86	F	47.3	Very low	47.7	Very low	79 Å²	79	117.7 Å²	117.7	35%	0.346	56%	0.56	S	S	.	*	H	α-helix	trans	-59.8	-46.3	175.6	176.3	-112.7	0	0	0	112.6	D82 D84 S88 E89 V90 W113	D82-F86 PolarHBondContact O-N 2.99Å; D82-F86 VanDerWaalsContact O-N 3.15Å; D84-F86 VanDerWaalsContact C-N 3.34Å; D84-F86 PolarHBondContact O-N 3.15Å; F86-S88 VanDerWaalsContact C-N 3.27Å; F86-S88 PolarHBondContact O-N 3.47Å; F86-E89 PolarHBondContact O-N 3.41Å; F86-V90 HydrophobicContact CD1-CG2 4.43Å; F86-V90 HydrophobicContact CD2-CG2 4.11Å; F86-V90 HydrophobicContact CE1-CG2 3.97Å; F86-V90 HydrophobicContact CE2-CG2 3.53Å; F86-V90 HydrophobicContact CZ-CG2 3.5Å; F86-V90 VanDerWaalsContact CZ-CG2 3.5Å; F86-V90 WeakPolarHBondContact O-CG2 3.35Å; F86-V90 PolarHBondContact O-N 3.36Å; F86-W113 AromaticContact CD2-CH2 3.79Å; F86-W113 HydrophobicContact CD2-CH2 3.79Å; F86-W113 AromaticContact CD2-CZ3 3.71Å; F86-W113 HydrophobicContact CD2-CZ3 3.71Å; F86-W113 AromaticContact CE2-CH2 3.83Å; F86-W113 HydrophobicContact CE2-CH2 3.83Å; F86-W113 AromaticContact CE2-CZ3 3.36Å; F86-W113 HydrophobicContact CE2-CZ3 3.36Å; F86-W113 HydrophobicContact CG-CH2 4.3Å; F86-W113 HydrophobicContact CZ-CH2 4.28Å; F86-W113 AromaticContact CZ-CZ3 3.94Å; F86-W113 HydrophobicContact CZ-CZ3 3.94Å
87	R	48.3	Very low	46.6	Very low	167 Å²	167	114.6 Å²	114.6	63%	0.63	56%	0.561	S	S	*	*	H	α-helix	trans	-61.3	-38.4	177.1	-75.8	176.5	-169.4	-144	4.7	111.7	A83 D84 E85 Q91	A83-R87 WeakPolarHBondContact O-CG 3.36Å; A83-R87 PolarHBondContact O-N 3.31Å; A83-R87 VanDerWaalsContact O-N 3.11Å; D84-R87 PolarHBondContact O-N 3.29Å; E85-R87 PolarHBondContact O-N 2.85Å; R87-Q91 WeakPolarHBondContact O-CB 3.33Å; R87-Q91 WeakPolarHBondContact O-CG 3.48Å; R87-Q91 PolarHBondContact O-N 3.44Å
88	S	51.8	Low	45.8	Very low	49 Å²	49	112.5 Å²	112.5	34%	0.343	55%	0.554	S	S	.	*	H	α-helix	trans	-65.2	-39.9	179.3	83.1	0	0	0	0	112	D84 E85 F86 Q91 R92	D84-S88 WeakPolarHBondContact O-CB 3.41Å; D84-S88 PolarHBondContact O-N 3.17Å; E85-S88 PolarHBondContact O-N 3.06Å; E85-S88 PolarHBondContact O-OG 3.23Å; F86-S88 VanDerWaalsContact C-N 3.27Å; F86-S88 PolarHBondContact O-N 3.47Å; S88-Q91 PolarHBondContact O-N 3.44Å; S88-R92 PolarHBondContact O-N 3.33Å
89	E	50.7	Low	45.3	Very low	88 Å²	88	111.4 Å²	111.4	41%	0.411	55%	0.548	S	S	.	.	H	α-helix	trans	-74	-38	-179.5	-159.2	59.3	-154.9	0	0	111.4	E85 F86 Q91 R92 S93	E85-E89 PolarHBondContact O-N 3.47Å; F86-E89 PolarHBondContact O-N 3.41Å; E89-Q91 VanDerWaalsContact C-N 3.33Å; E89-Q91 PolarHBondContact O-N 3.12Å; E89-R92 PolarHBondContact O-N 3.06Å; E89-R92 IonicContact OE2-NH1 3.65Å; E89-S93 PolarHBondContact O-N 3.44Å
90	V	43.6	Very low	44.8	Very low	32 Å²	32	110 Å²	110	19%	0.194	54%	0.536	C	S	.	.	H	α-helix	trans	-60.9	-42	170.6	172.9	0	0	0	0	110.9	F86 S93 R94 Y102	F86-V90 HydrophobicContact CD1-CG2 4.43Å; F86-V90 HydrophobicContact CD2-CG2 4.11Å; F86-V90 HydrophobicContact CE1-CG2 3.97Å; F86-V90 HydrophobicContact CE2-CG2 3.53Å; F86-V90 HydrophobicContact CZ-CG2 3.5Å; F86-V90 VanDerWaalsContact CZ-CG2 3.5Å; F86-V90 WeakPolarHBondContact O-CG2 3.35Å; F86-V90 PolarHBondContact O-N 3.36Å; V90-S93 PolarHBondContact O-N 3.23Å; V90-S93 PolarHBondContact O-OG 3Å; V90-R94 PolarHBondContact O-N 3.23Å; V90-Y102 HydrophobicContact CG2-CD2 4.14Å; V90-Y102 HydrophobicContact CG2-CE2 4.5Å; V90-Y102 HydrophobicContact CG2-CG 4.29Å
91	Q	42.7	Very low	44.4	Very low	130 Å²	130	106.2 Å²	106.2	61%	0.607	51%	0.511	S	S	*	.	H	α-helix	trans	-68.3	-39.9	176.4	-76.7	-174.8	5	0	0	113.1	R87 S88 E89 S93 R94 R95	R87-Q91 WeakPolarHBondContact O-CB 3.33Å; R87-Q91 WeakPolarHBondContact O-CG 3.48Å; R87-Q91 PolarHBondContact O-N 3.44Å; S88-Q91 PolarHBondContact O-N 3.44Å; E89-Q91 VanDerWaalsContact C-N 3.33Å; E89-Q91 PolarHBondContact O-N 3.12Å; Q91-S93 VanDerWaalsContact C-N 3.29Å; Q91-S93 PolarHBondContact O-N 3.16Å; Q91-R94 PolarHBondContact O-N 3.09Å; Q91-R95 PolarHBondContact O-N 3.33Å
92	R	43.7	Very low	43.8	Very low	159 Å²	159	104.2 Å²	104.2	60%	0.6	50%	0.496	S	S	*	.	H	α-helix	trans	-59.1	-40.9	173.9	-87	-178.8	173.9	160.6	-0.1	111.9	S88 E89 R94 R95 H96	S88-R92 PolarHBondContact O-N 3.33Å; E89-R92 PolarHBondContact O-N 3.06Å; E89-R92 IonicContact OE2-NH1 3.65Å; R92-R94 VanDerWaalsContact C-N 3.28Å; R92-R94 PolarHBondContact O-N 3.49Å; R92-R95 PolarHBondContact O-N 2.87Å; R92-H96 PolarHBondContact O-CD2 3.46Å
93	S	41.5	Very low	43	Very low	4 Å²	4	105.1 Å²	105.1	3%	0.028	49%	0.493	C	S	.	.	H	α-helix	trans	-60.2	-37.2	177.9	84.8	0	0	0	0	113.3	E89 V90 Q91 R95 H96 Y102	E89-S93 PolarHBondContact O-N 3.44Å; V90-S93 PolarHBondContact O-N 3.23Å; V90-S93 PolarHBondContact O-OG 3Å; Q91-S93 VanDerWaalsContact C-N 3.29Å; Q91-S93 PolarHBondContact O-N 3.16Å; S93-R95 VanDerWaalsContact C-N 3.31Å; S93-R95 PolarHBondContact O-N 3.37Å; S93-H96 PolarHBondContact O-N 3.47Å; S93-Y102 WeakPolarHBondContact CB-OH 3.42Å; S93-Y102 VanDerWaalsContact OG-CE2 3.29Å; S93-Y102 WeakPolarHBondContact OG-CE2 3.46Å
94	R	38	Very low	42.4	Very low	201 Å²	201	106.7 Å²	106.7	76%	0.758	49%	0.493	S	S	*	.	H	α-helix	trans	-67.6	-31.4	-179.4	-75.1	-175.6	170.6	-172.6	-1.9	111.9	V90 Q91 R92 H96	V90-R94 PolarHBondContact O-N 3.23Å; Q91-R94 PolarHBondContact O-N 3.09Å; R92-R94 VanDerWaalsContact C-N 3.28Å; R92-R94 PolarHBondContact O-N 3.49Å; R94-H96 VanDerWaalsContact C-N 3.26Å; R94-H96 PolarHBondContact O-N 3.44Å
95	R	41	Very low	41.7	Very low	223 Å²	223	102.9 Å²	102.9	84%	0.842	47%	0.474	S	S	*	.	H	α-helix	trans	-70.7	-18.8	178	-71.4	-173	178.3	-168.3	0.5	113.5	Q91 R92 S93	Q91-R95 PolarHBondContact O-N 3.33Å; R92-R95 PolarHBondContact O-N 2.87Å; S93-R95 VanDerWaalsContact C-N 3.31Å; S93-R95 PolarHBondContact O-N 3.37Å
96	H	40.7	Very low	40.3	Very low	145 Å²	145	103.1 Å²	103.1	67%	0.671	47%	0.474	S	S	*	.	T	Hydrogen-bonded Turn	trans	-94.4	14.5	-176.2	-75.1	-62.3	0	0	0	115.4	R92 S93 R94 S98	R92-H96 PolarHBondContact O-CD2 3.46Å; S93-H96 PolarHBondContact O-N 3.47Å; R94-H96 VanDerWaalsContact C-N 3.26Å; R94-H96 PolarHBondContact O-N 3.44Å; H96-S98 PolarHBondContact O-N 3.44Å
97	G	29.4	Very low	39.9	Very low	76 Å²	76	101.3 Å²	101.3	78%	0.784	47%	0.469	S	S	*	.	T	Hydrogen-bonded Turn	trans	66.6	-3.9	171.7	0	0	0	0	0	115.5
98	S	35.3	Very low	39.2	Very low	46 Å²	46	98.8 Å²	98.8	32%	0.322	47%	0.474	S	S	.	.			trans	-85.6	111.3	161	59.8	0	0	0	0	107.5	H96 R100	H96-S98 PolarHBondContact O-N 3.44Å; S98-R100 PolarHBondContact O-N 3.45Å; S98-R100 WeakPolarHBondContact OG-CG 3.41Å; S98-R100 PolarHBondContact OG-NE 2.79Å; S98-R100 VanDerWaalsContact OG-NE 3.16Å
99	H	36.7	Very low	38.6	Very low	136 Å²	136	101.1 Å²	101.1	63%	0.63	49%	0.488	S	S	*	.			trans	-62.1	85.5	163.5	-115.3	-81.9	0	0	0	107.6	D101	H99-D101 IonicContact ND1-OD1 3.42Å; H99-D101 PolarHBondContact ND1-OD1 3.49Å; H99-D101 PolarHBondContact O-N 2.91Å
100	R	40.5	Very low	37.9	Very low	136 Å²	136	103.3 Å²	103.3	51%	0.513	50%	0.496	S	S	.	.			trans	-82.3	97.7	170.6	-59.2	-166.4	-166.7	175.6	-4.7	105.5	S98 Y102	S98-R100 PolarHBondContact O-N 3.45Å; S98-R100 WeakPolarHBondContact OG-CG 3.41Å; S98-R100 PolarHBondContact OG-NE 2.79Å; S98-R100 VanDerWaalsContact OG-NE 3.16Å; R100-Y102 VanDerWaalsContact C-N 3.34Å; R100-Y102 HydrophobicContact CB-CD2 4.1Å; R100-Y102 HydrophobicContact CB-CE2 3.52Å; R100-Y102 VanDerWaalsContact O-CD2 3.29Å; R100-Y102 WeakPolarHBondContact O-CD2 3.44Å; R100-Y102 PolarHBondContact O-N 3.07Å; R100-Y102 VanDerWaalsContact O-N 3.11Å
101	D	40.7	Very low	37.6	Very low	52 Å²	52	104.5 Å²	104.5	28%	0.278	51%	0.505	S	S	.	.			trans	-78.8	91.6	172.5	-67.6	-25.9	0	0	0	106.7	H99 R103 R120	H99-D101 IonicContact ND1-OD1 3.42Å; H99-D101 PolarHBondContact ND1-OD1 3.49Å; H99-D101 PolarHBondContact O-N 2.91Å; D101-R103 PolarHBondContact O-N 3.11Å; D101-R120 IonicContact OD2-CZ 3.68Å; D101-R120 IonicContact OD2-NE 3.61Å; D101-R120 PolarHBondContact OD2-NE 3.37Å; D101-R120 IonicContact OD2-NH2 3.08Å; D101-R120 PolarHBondContact OD2-NH2 3.27Å
102	Y	37.9	Very low	37.5	Very low	78 Å²	78	102.2 Å²	102.2	31%	0.306	50%	0.496	S	S	.	.			trans	-67.3	118.8	171.9	-65.6	-97.2	0	0	0	107.9	V90 S93 R100	V90-Y102 HydrophobicContact CG2-CD2 4.14Å; V90-Y102 HydrophobicContact CG2-CE2 4.5Å; V90-Y102 HydrophobicContact CG2-CG 4.29Å; S93-Y102 WeakPolarHBondContact CB-OH 3.42Å; S93-Y102 VanDerWaalsContact OG-CE2 3.29Å; S93-Y102 WeakPolarHBondContact OG-CE2 3.46Å; R100-Y102 VanDerWaalsContact C-N 3.34Å; R100-Y102 HydrophobicContact CB-CD2 4.1Å; R100-Y102 HydrophobicContact CB-CE2 3.52Å; R100-Y102 VanDerWaalsContact O-CD2 3.29Å; R100-Y102 WeakPolarHBondContact O-CD2 3.44Å; R100-Y102 PolarHBondContact O-N 3.07Å; R100-Y102 VanDerWaalsContact O-N 3.11Å
103	R	35.8	Very low	37.3	Very low	107 Å²	107	100.1 Å²	100.1	40%	0.404	49%	0.489	S	S	.	.			trans	-114.5	121.8	168.5	-75.3	-175.2	163	-173.3	-8.5	108.3	D101 C105 C200	D101-R103 PolarHBondContact O-N 3.11Å; R103-C105 PolarHBondContact O-N 3.15Å; R103-C200 PolarHBondContact NH1-SG 3.02Å
104	L	35.3	Very low	37.1	Very low	92 Å²	92	102.5 Å²	102.5	48%	0.482	50%	0.504	S	S	.	.	P	Polyproline II helix	trans	-77.2	116.7	171	-164.6	83.8	0	0	0	107.3	F106 W113	L104-F106 HydrophobicContact CD2-CD2 4.08Å; L104-F106 HydrophobicContact CD2-CE2 3.66Å; L104-W113 HydrophobicContact CD1-CD2 3.48Å; L104-W113 VanDerWaalsContact CD1-CD2 3.48Å; L104-W113 VanDerWaalsContact CD1-CE2 3.41Å; L104-W113 HydrophobicContact CD1-CE3 3.54Å; L104-W113 HydrophobicContact CD1-CG 4.25Å; L104-W113 HydrophobicContact CD1-CH2 3.52Å; L104-W113 HydrophobicContact CD1-CZ2 3.46Å; L104-W113 VanDerWaalsContact CD1-CZ2 3.46Å; L104-W113 HydrophobicContact CD1-CZ3 3.54Å
105	C	35.7	Very low	36.8	Very low	29 Å²	29	102.7 Å²	102.7	20%	0.196	51%	0.507	C	S	.	.	P	Polyproline II helix	trans	-101.4	133.3	171.8	-67.5	0	0	0	0	108.4	R103 L112 C114 W202	R103-C105 PolarHBondContact O-N 3.15Å; C105-L112 CarbonylContact C-O 3.59Å; C105-L112 CarbonylContact O-C 3.45Å; C105-L112 PolarHBondContact O-N 3.31Å; C105-C114 HydrophobicContact CB-CB 4.1Å; C105-W202 HydrophobicContact CB-CH2 4.42Å
106	F	29.8	Very low	36.7	Very low	137 Å²	137	94.3 Å²	94.3	60%	0.601	48%	0.478	S	S	*	.	P	Polyproline II helix	trans	-98.5	122	169.6	-98.3	-94	0	0	0	107.8	L104 P111	L104-F106 HydrophobicContact CD2-CD2 4.08Å; L104-F106 HydrophobicContact CD2-CE2 3.66Å; F106-P111 HydrophobicContact CD1-CB 3.86Å; F106-P111 HydrophobicContact CD2-CB 4.42Å; F106-P111 HydrophobicContact CE1-CB 3.66Å; F106-P111 HydrophobicContact CE1-CG 4.05Å; F106-P111 HydrophobicContact CE2-CB 4.24Å; F106-P111 HydrophobicContact CG-CB 4.25Å; F106-P111 HydrophobicContact CZ-CB 3.87Å; F106-P111 HydrophobicContact CZ-CG 4.38Å
107	V	39.6	Very low	36.1	Very low	40 Å²	40	97 Å²	97	24%	0.242	48%	0.484	C	S	.	.	B	Isolated β-bridge	trans	-119.5	89.8	174.1	-179.7	0	0	0	0	107.8	F110 L112 W202	V107-F110 CarbonylContact C-O 3.19Å; V107-F110 PolarHBondContact N-O 3.17Å; V107-F110 VanDerWaalsContact N-O 3.11Å; V107-F110 CarbonylContact O-C 3.36Å; V107-F110 PolarHBondContact O-N 3.45Å; V107-L112 HydrophobicContact CB-CB 4.16Å; V107-L112 HydrophobicContact CB-CD1 3.97Å; V107-L112 HydrophobicContact CB-CG 4.32Å; V107-L112 HydrophobicContact CG1-CD1 4.17Å; V107-L112 HydrophobicContact CG2-CB 4.06Å; V107-L112 HydrophobicContact CG2-CD1 4.28Å; V107-W202 HydrophobicContact CG2-CH2 3.88Å; V107-W202 HydrophobicContact CG2-CZ3 3.92Å
108	P	33.7	Very low	36.4	Very low	114 Å²	114	97.4 Å²	97.4	74%	0.74	47%	0.465	S	S	*	.	T	Hydrogen-bonded Turn	trans	-49.7	136.2	-177.1	-26.1	33.7	0	0	0	112.3
109	P	37.9	Very low	36.1	Very low	99 Å²	99	103.9 Å²	103.9	64%	0.643	49%	0.488	S	S	*	.	T	Hydrogen-bonded Turn	cis	-86.6	-0.2	8.4	31.8	-31.1	0	0	0	115.2
110	F	36.9	Very low	35.9	Very low	133 Å²	133	104.7 Å²	104.7	58%	0.583	49%	0.485	S	S	*	.	B	Isolated β-bridge	trans	-118.2	134.5	-173	-59.1	-72	0	0	0	113.3	V107 L112	V107-F110 CarbonylContact C-O 3.19Å; V107-F110 PolarHBondContact N-O 3.17Å; V107-F110 VanDerWaalsContact N-O 3.11Å; V107-F110 CarbonylContact O-C 3.36Å; V107-F110 PolarHBondContact O-N 3.45Å; F110-L112 VanDerWaalsContact C-N 3.31Å; F110-L112 PolarHBondContact O-N 3.44Å
111	P	37	Very low	35.6	Very low	57 Å²	57	106.9 Å²	106.9	37%	0.37	49%	0.494	S	S	.	.			trans	-62.8	94	165.4	24.2	-29.1	0	0	0	109.6	F106 W113	F106-P111 HydrophobicContact CD1-CB 3.86Å; F106-P111 HydrophobicContact CD2-CB 4.42Å; F106-P111 HydrophobicContact CE1-CB 3.66Å; F106-P111 HydrophobicContact CE1-CG 4.05Å; F106-P111 HydrophobicContact CE2-CB 4.24Å; F106-P111 HydrophobicContact CG-CB 4.25Å; F106-P111 HydrophobicContact CZ-CB 3.87Å; F106-P111 HydrophobicContact CZ-CG 4.38Å; P111-W113 VanDerWaalsContact O-CD1 3.29Å; P111-W113 PolarHBondContact O-N 3.21Å
112	L	40.1	Very low	35.2	Very low	82 Å²	82	108 Å²	108	43%	0.429	51%	0.506	S	S	.	.			trans	-83.2	110.8	172.4	-77.4	174.4	0	0	0	108.6	C105 V107 F110 C114	C105-L112 CarbonylContact C-O 3.59Å; C105-L112 CarbonylContact O-C 3.45Å; C105-L112 PolarHBondContact O-N 3.31Å; V107-L112 HydrophobicContact CB-CB 4.16Å; V107-L112 HydrophobicContact CB-CD1 3.97Å; V107-L112 HydrophobicContact CB-CG 4.32Å; V107-L112 HydrophobicContact CG1-CD1 4.17Å; V107-L112 HydrophobicContact CG2-CB 4.06Å; V107-L112 HydrophobicContact CG2-CD1 4.28Å; F110-L112 VanDerWaalsContact C-N 3.31Å; F110-L112 PolarHBondContact O-N 3.44Å; L112-C114 PolarHBondContact O-N 3.07Å; L112-C114 PolarHBondContact O-SG 3.25Å; L112-C114 VanDerWaalsContact O-SG 3.37Å
113	W	39.3	Very low	35	Very low	116 Å²	116	109.2 Å²	109.2	44%	0.439	52%	0.521	S	S	.	.			trans	-69.8	98.9	175.8	-66.3	67.5	0	0	0	109.2	I81 F86 L104 P111	I81-W113 HydrophobicContact CD1-CZ2 4.34Å; F86-W113 AromaticContact CD2-CH2 3.79Å; F86-W113 HydrophobicContact CD2-CH2 3.79Å; F86-W113 AromaticContact CD2-CZ3 3.71Å; F86-W113 HydrophobicContact CD2-CZ3 3.71Å; F86-W113 AromaticContact CE2-CH2 3.83Å; F86-W113 HydrophobicContact CE2-CH2 3.83Å; F86-W113 AromaticContact CE2-CZ3 3.36Å; F86-W113 HydrophobicContact CE2-CZ3 3.36Å; F86-W113 HydrophobicContact CG-CH2 4.3Å; F86-W113 HydrophobicContact CZ-CH2 4.28Å; F86-W113 AromaticContact CZ-CZ3 3.94Å; F86-W113 HydrophobicContact CZ-CZ3 3.94Å; L104-W113 HydrophobicContact CD1-CD2 3.48Å; L104-W113 VanDerWaalsContact CD1-CD2 3.48Å; L104-W113 VanDerWaalsContact CD1-CE2 3.41Å; L104-W113 HydrophobicContact CD1-CE3 3.54Å; L104-W113 HydrophobicContact CD1-CG 4.25Å; L104-W113 HydrophobicContact CD1-CH2 3.52Å; L104-W113 HydrophobicContact CD1-CZ2 3.46Å; L104-W113 VanDerWaalsContact CD1-CZ2 3.46Å; L104-W113 HydrophobicContact CD1-CZ3 3.54Å; P111-W113 VanDerWaalsContact O-CD1 3.29Å; P111-W113 PolarHBondContact O-N 3.21Å
114	C	37.4	Very low	34.8	Very low	53 Å²	53	110.1 Å²	110.1	36%	0.358	54%	0.539	S	S	.	.			trans	-86.7	124.1	176.4	-54	0	0	0	0	109.8	C105 L112 D116	C105-C114 HydrophobicContact CB-CB 4.1Å; L112-C114 PolarHBondContact O-N 3.07Å; L112-C114 PolarHBondContact O-SG 3.25Å; L112-C114 VanDerWaalsContact O-SG 3.37Å; C114-D116 PolarHBondContact O-N 2.76Å
115	Y	32.9	Very low	34.7	Very low	205 Å²	205	111.2 Å²	111.2	80%	0.804	55%	0.549	S	S	*	.			trans	-79.7	109.1	169.4	-70.5	-83.9	0	0	0	109.2	Y117	Y115-Y117 PolarHBondContact O-N 3.32Å
116	D	37.7	Very low	34.7	Very low	47 Å²	47	115.3 Å²	115.3	25%	0.251	57%	0.574	S	S	.	*			trans	-82.3	102.4	169.9	-155.7	-13.7	0	0	0	109.2	C114 H118	C114-D116 PolarHBondContact O-N 2.76Å; D116-H118 PolarHBondContact O-N 3.19Å; D116-H118 IonicContact OD1-CD2 3.38Å; D116-H118 IonicContact OD1-CE1 3.37Å; D116-H118 PolarHBondContact OD1-CE1 3.12Å; D116-H118 IonicContact OD1-CG 2.71Å; D116-H118 IonicContact OD1-ND1 3.23Å; D116-H118 IonicContact OD1-NE2 3.72Å; D116-H118 IonicContact OD2-CD2 3.55Å; D116-H118 PolarHBondContact OD2-CD2 3.29Å; D116-H118 IonicContact OD2-CE1 3.4Å; D116-H118 IonicContact OD2-NE2 3.52Å; D116-H118 PolarHBondContact OD2-NE2 3.4Å; D116-H118 VanDerWaalsContact OD2-NE2 3.08Å
117	Y	29.7	Very low	35	Very low	203 Å²	203	114.2 Å²	114.2	80%	0.796	58%	0.578	S	S	*	*			trans	-80.1	73	175.4	-161.3	-90.4	0	0	0	109.7	Y115 K119	Y115-Y117 PolarHBondContact O-N 3.32Å; Y117-K119 HydrophobicContact CE1-CB 4.35Å; Y117-K119 PolarHBondContact O-N 2.98Å
118	H	34.4	Very low	34.8	Very low	83 Å²	83	117.5 Å²	117.5	38%	0.384	60%	0.599	S	S	.	*			trans	-81.7	96.9	169.7	-79.2	-35.6	0	0	0	110.6	D116 R120 W203	D116-H118 PolarHBondContact O-N 3.19Å; D116-H118 IonicContact OD1-CD2 3.38Å; D116-H118 IonicContact OD1-CE1 3.37Å; D116-H118 PolarHBondContact OD1-CE1 3.12Å; D116-H118 IonicContact OD1-CG 2.71Å; D116-H118 IonicContact OD1-ND1 3.23Å; D116-H118 IonicContact OD1-NE2 3.72Å; D116-H118 IonicContact OD2-CD2 3.55Å; D116-H118 PolarHBondContact OD2-CD2 3.29Å; D116-H118 IonicContact OD2-CE1 3.4Å; D116-H118 IonicContact OD2-NE2 3.52Å; D116-H118 PolarHBondContact OD2-NE2 3.4Å; D116-H118 VanDerWaalsContact OD2-NE2 3.08Å; H118-R120 PolarHBondContact O-N 3.37Å; H118-W203 AromaticContact CE1-CZ2 3.92Å; H118-W203 AromaticContact CE1-NE1 3.92Å
119	K	29.9	Very low	34.8	Very low	182 Å²	182	118.1 Å²	118.1	79%	0.791	60%	0.6	S	S	*	*			trans	-68.9	84.1	160.4	-168.6	176.6	-175.8	176.8	0	108.3	Y117 R121	Y117-K119 HydrophobicContact CE1-CB 4.35Å; Y117-K119 PolarHBondContact O-N 2.98Å; K119-R121 PolarHBondContact O-N 3Å
120	R	31.5	Very low	34.5	Very low	154 Å²	154	117.3 Å²	117.3	58%	0.581	59%	0.594	S	S	*	*			trans	-57.7	104.9	173.8	-76.8	-175.7	179.8	-130.3	4.2	109.2	D101 H118 S122	D101-R120 IonicContact OD2-CZ 3.68Å; D101-R120 IonicContact OD2-NE 3.61Å; D101-R120 PolarHBondContact OD2-NE 3.37Å; D101-R120 IonicContact OD2-NH2 3.08Å; D101-R120 PolarHBondContact OD2-NH2 3.27Å; H118-R120 PolarHBondContact O-N 3.37Å; R120-S122 VanDerWaalsContact C-N 3.35Å; R120-S122 PolarHBondContact O-N 3.08Å; R120-S122 VanDerWaalsContact O-N 3.15Å
121	R	34	Very low	34.2	Very low	182 Å²	182	116.6 Å²	116.6	69%	0.687	60%	0.602	S	S	*	*			trans	-79.4	89	165.2	-170.1	177.9	-172.6	177.1	1.1	107.2	K119 T123	K119-R121 PolarHBondContact O-N 3Å; R121-T123 PolarHBondContact O-N 3.07Å; R121-T123 VanDerWaalsContact O-N 3.12Å; R121-T123 PolarHBondContact O-OG1 2.98Å
122	S	33.6	Very low	33.8	Very low	76 Å²	76	119.5 Å²	119.5	53%	0.531	61%	0.614	S	S	.	*			trans	-59.7	116.6	171.9	-47.9	0	0	0	0	108.9	R120	R120-S122 VanDerWaalsContact C-N 3.35Å; R120-S122 PolarHBondContact O-N 3.08Å; R120-S122 VanDerWaalsContact O-N 3.15Å
123	T	33.6	Very low	33.4	Very low	103 Å²	103	120.2 Å²	120.2	63%	0.632	63%	0.625	S	S	*	*			trans	-111.8	113.2	173.5	-46.9	0	0	0	0	106.3	R121	R121-T123 PolarHBondContact O-N 3.07Å; R121-T123 VanDerWaalsContact O-N 3.12Å; R121-T123 PolarHBondContact O-OG1 2.98Å
124	T	31.8	Very low	32.8	Very low	126 Å²	126	121.6 Å²	121.6	77%	0.773	64%	0.642	S	S	*	*			trans	-91.3	117.9	176.2	-51.4	0	0	0	0	107.7
125	T	33.4	Very low	32.5	Very low	115 Å²	115	123.4 Å²	123.4	71%	0.706	65%	0.647	S	S	*	*			trans	-101.7	117.5	172.4	-49.3	0	0	0	0	107.7
126	T	34.8	Very low	32.4	Very low	115 Å²	115	120.5 Å²	120.5	71%	0.706	65%	0.651	S	S	*	*			trans	-107.1	114.9	173.6	-52.6	0	0	0	0	107.5
127	T	36.1	Very low	32.1	Very low	114 Å²	114	124.3 Å²	124.3	70%	0.699	68%	0.676	S	S	*	*			trans	-103.8	118.8	174.8	-48.6	0	0	0	0	108.1
128	T	35.4	Very low	32.1	Very low	109 Å²	109	125.9 Å²	125.9	67%	0.669	68%	0.68	S	S	*	*			trans	-113.6	112.8	172.7	-50.7	0	0	0	0	107.5	T130	T128-T130 HydrophobicContact CG2-CG2 4.26Å
129	T	34.2	Very low	32.1	Very low	126 Å²	126	128 Å²	128	77%	0.773	70%	0.699	S	S	*	*			trans	-104.8	112.1	169.6	35.7	0	0	0	0	108.1
130	T	32	Very low	32.2	Very low	82 Å²	82	125.6 Å²	125.6	50%	0.503	70%	0.7	S	S	.	*			trans	-114.1	125.2	174.3	32.3	0	0	0	0	108.9	T128 I132 I135	T128-T130 HydrophobicContact CG2-CG2 4.26Å; T130-I132 PolarHBondContact O-N 2.82Å; T130-I135 HydrophobicContact CG2-CD1 3.44Å; T130-I135 VanDerWaalsContact CG2-CD1 3.44Å; T130-I135 WeakPolarHBondContact OG1-CD1 3.42Å
131	P	29.4	Very low	32	Very low	118 Å²	118	130 Å²	130	77%	0.766	72%	0.716	S	S	*	*			trans	-72.3	125.7	174.3	29.9	-30.2	0	0	0	109.1
132	I	28.4	Very low	31.8	Very low	118 Å²	118	126.7 Å²	126.7	61%	0.605	72%	0.721	S	S	*	*	S	Bend	trans	26.6	102.1	152.3	-54.3	168.9	0	0	0	115.3	T130	T130-I132 PolarHBondContact O-N 2.82Å
133	S	32.1	Very low	31.8	Very low	97 Å²	97	134.7 Å²	134.7	68%	0.678	74%	0.74	S	S	*	*	S	Bend	trans	138.3	111.3	152.9	68.6	0	0	0	0	111
134	D	26.8	Very low	32	Very low	146 Å²	146	138 Å²	138	78%	0.781	74%	0.74	S	S	*	*			trans	45.6	96.8	165.9	-62.7	-22	0	0	0	119.1
135	I	31	Very low	32.2	Very low	91 Å²	91	136.5 Å²	136.5	47%	0.467	73%	0.731	S	S	.	*			trans	-125.9	104.6	170.6	-62.9	171.7	0	0	0	111.7	T130 T137	T130-I135 HydrophobicContact CG2-CD1 3.44Å; T130-I135 VanDerWaalsContact CG2-CD1 3.44Å; T130-I135 WeakPolarHBondContact OG1-CD1 3.42Å; I135-T137 PolarHBondContact O-N 3.04Å
136	T	29.8	Very low	32.3	Very low	144 Å²	144	136.5 Å²	136.5	88%	0.883	73%	0.732	S	S	*	*			trans	-68.2	115.8	163.7	7	0	0	0	0	109.3
137	T	33	Very low	32.6	Very low	127 Å²	127	136.3 Å²	136.3	78%	0.779	73%	0.73	S	S	*	*			trans	-94.6	105.4	177.1	-0.8	0	0	0	0	110.5	I135	I135-T137 PolarHBondContact O-N 3.04Å
138	R	28.5	Very low	32.7	Very low	236 Å²	236	136 Å²	136	89%	0.891	73%	0.729	S	S	*	*			trans	-85.5	117.3	171.3	-176.1	176.4	177.7	176.9	-0.6	109.6
139	T	35.9	Very low	32.9	Very low	128 Å²	128	136.6 Å²	136.6	79%	0.785	73%	0.732	S	S	*	*			trans	-99.2	119.9	-178.8	-32.6	0	0	0	0	111.2
140	T	30	Very low	33.3	Very low	130 Å²	130	135.9 Å²	135.9	80%	0.798	73%	0.728	S	S	*	*			trans	-108.5	129.4	163.9	30.2	0	0	0	0	109.7
141	R	27.8	Very low	33.6	Very low	246 Å²	246	138.1 Å²	138.1	93%	0.928	74%	0.741	S	S	*	*			trans	-93.9	133	-166.5	-173.3	-177.9	-173.9	-174	3	111.9
142	S	31.1	Very low	33.9	Very low	113 Å²	113	138.4 Å²	138.4	79%	0.79	74%	0.741	S	S	*	*			trans	-140.3	144.1	154.3	-179	0	0	0	0	110.3	R144	S142-R144 PolarHBondContact O-N 3.42Å
143	R	32.9	Very low	34.1	Very low	245 Å²	245	138.2 Å²	138.2	93%	0.925	75%	0.748	S	S	*	*	S	Bend	trans	-60.7	89	-171.3	-84.1	174.5	161.5	173	-5.5	112.8
144	R	36.7	Very low	34.1	Very low	171 Å²	171	142.8 Å²	142.8	65%	0.645	76%	0.756	S	S	*	*	S	Bend	trans	-163.6	138.2	158	-127.3	171.5	176.2	175.8	-2.9	110.4	S142 T146	S142-R144 PolarHBondContact O-N 3.42Å; R144-T146 PolarHBondContact O-N 3.46Å; R144-T146 PolarHBondContact O-OG1 3.44Å
145	T	36.3	Very low	34.3	Very low	95 Å²	95	139.6 Å²	139.6	58%	0.583	75%	0.745	S	S	*	*			trans	-48.1	121.8	180	29.5	0	0	0	0	112
146	T	36.4	Very low	34.1	Very low	116 Å²	116	142.2 Å²	142.2	71%	0.712	76%	0.76	S	S	*	*			trans	-109.5	127.6	177.8	-30.7	0	0	0	0	108.4	R144	R144-T146 PolarHBondContact O-N 3.46Å; R144-T146 PolarHBondContact O-OG1 3.44Å
147	T	39.9	Very low	34	Very low	110 Å²	110	141.3 Å²	141.3	68%	0.675	75%	0.748	S	S	*	*			trans	-104.2	125.2	170.1	-50.2	0	0	0	0	107.3
148	T	39.6	Very low	33.7	Very low	109 Å²	109	141 Å²	141	67%	0.669	75%	0.746	S	S	*	*			trans	-115.1	118.4	179.3	-52.2	0	0	0	0	108.1
149	T	39.9	Very low	33.6	Very low	121 Å²	121	135.4 Å²	135.4	74%	0.742	74%	0.738	S	S	*	*			trans	-109.3	121.6	173.2	-51.8	0	0	0	0	107.9
150	T	41	Very low	33.1	Very low	110 Å²	110	140.2 Å²	140.2	68%	0.675	74%	0.742	S	S	*	*			trans	-117.4	124.3	178.6	-54.2	0	0	0	0	108.4	T152	T150-T152 HydrophobicContact CG2-CG2 4.23Å
151	T	40.1	Very low	33	Very low	129 Å²	129	140 Å²	140	79%	0.791	74%	0.741	S	S	*	*			trans	-125.8	110.2	172.8	11.3	0	0	0	0	107.5
152	T	35.7	Very low	32.9	Very low	124 Å²	124	134.8 Å²	134.8	76%	0.761	74%	0.736	S	S	*	*			trans	-106.5	122.8	177	43.4	0	0	0	0	109.7	T150	T150-T152 HydrophobicContact CG2-CG2 4.23Å
153	P	32.1	Very low	32.8	Very low	114 Å²	114	139 Å²	139	74%	0.74	74%	0.735	S	S	*	*			trans	-95	93.6	169.8	33.2	-25.3	0	0	0	109.3
154	F	31.8	Very low	32.7	Very low	194 Å²	194	139.5 Å²	139.5	85%	0.851	74%	0.737	S	S	*	*	S	Bend	trans	59.8	141.5	169.4	-67	-91.8	0	0	0	117.9
155	S	31.4	Very low	32.4	Very low	78 Å²	78	135.9 Å²	135.9	55%	0.545	73%	0.734	S	S	.	*	S	Bend	trans	67.3	112.7	-176.4	48.5	0	0	0	0	118.5
156	D	27.3	Very low	32.2	Very low	147 Å²	147	138 Å²	138	79%	0.786	75%	0.747	S	S	*	*			trans	52.9	108.6	163.6	-56.9	-18.8	0	0	0	120.4
157	I	27.9	Very low	31.8	Very low	125 Å²	125	138 Å²	138	64%	0.641	75%	0.746	S	S	*	*				171	113.1	124.3	-82.9	157.4	0	0	0	110.2
158	T	25.8	Very low	31.4	Very low	121 Å²	121	139 Å²	139	74%	0.742	75%	0.753	S	S	*	*			trans	-55.9	138.9	152.3	10.6	0	0	0	0	109.6
159	T	26.5	Very low	31	Very low	117 Å²	117	138.7 Å²	138.7	72%	0.718	75%	0.751	S	S	*	*				175.5	147.9	56.1	-10.1	0	0	0	0	109.9
160	R	25	Very low	30.6	Very low	230 Å²	230	139.3 Å²	139.3	87%	0.868	76%	0.755	S	S	*	*			trans	39.9	119.8	135.1	-162.2	174	-172.8	168.3	1.5	118.9
161	T	28.2	Very low	30	Very low	125 Å²	125	139.6 Å²	139.6	77%	0.767	76%	0.756	S	S	*	*				178.6	135.9	113.9	-64.1	0	0	0	0	112.9
162	T	26.4	Very low	29.5	Very low	136 Å²	136	137.8 Å²	137.8	83%	0.834	75%	0.747	S	S	*	*			trans	-42.8	123.5	175.4	32.3	0	0	0	0	118
163	R	28.6	Very low	29.2	Very low	201 Å²	201	141 Å²	141	76%	0.758	75%	0.751	S	S	*	*			trans	-166.5	125.2	141.6	-157.2	169.2	179	-176.7	-1.6	112.6	T165	R163-T165 PolarHBondContact O-N 3.26Å; R163-T165 VanDerWaalsContact O-N 3.12Å; R163-T165 PolarHBondContact O-OG1 3.18Å
164	R	30	Very low	28.9	Very low	257 Å²	257	138.6 Å²	138.6	97%	0.97	74%	0.737	S	S	*	*			trans	-22.2	101.7	176.9	-160.9	177.1	-167.3	174	2.7	114
165	T	31.3	Very low	28.9	Very low	95 Å²	95	137.8 Å²	137.8	58%	0.583	74%	0.741	S	S	*	*			trans	-118.8	118.8	176.2	-13.9	0	0	0	0	106.6	R163 T167	R163-T165 PolarHBondContact O-N 3.26Å; R163-T165 VanDerWaalsContact O-N 3.12Å; R163-T165 PolarHBondContact O-OG1 3.18Å; T165-T167 PolarHBondContact O-N 2.91Å; T165-T167 VanDerWaalsContact O-N 3.12Å
166	T	30.7	Very low	28.6	Very low	139 Å²	139	140.4 Å²	140.4	85%	0.853	75%	0.747	S	S	*	*			trans	-73.2	97.4	167.2	-0.5	0	0	0	0	106.7	T168	T166-T168 PolarHBondContact O-N 3.12Å
167	T	28.7	Very low	28.5	Very low	115 Å²	115	139.6 Å²	139.6	71%	0.706	75%	0.748	S	S	*	*			trans	-82.5	98.9	175.2	-28.2	0	0	0	0	107.8	T165 T169	T165-T167 PolarHBondContact O-N 2.91Å; T165-T167 VanDerWaalsContact O-N 3.12Å; T167-T169 PolarHBondContact O-N 2.91Å
168	T	30.8	Very low	28.5	Very low	133 Å²	133	139.9 Å²	139.9	82%	0.816	76%	0.756	S	S	*	*			trans	-85.5	91.8	164.9	-42.9	0	0	0	0	106.9	T166	T166-T168 PolarHBondContact O-N 3.12Å
169	T	31.4	Very low	28.4	Very low	102 Å²	102	145 Å²	145	63%	0.626	76%	0.762	S	S	*	*			trans	-95.8	114.8	170.4	-48.4	0	0	0	0	107.8	T167 T171	T167-T169 PolarHBondContact O-N 2.91Å; T169-T171 PolarHBondContact O-N 2.86Å
170	T	32.5	Very low	28.4	Very low	134 Å²	134	145.7 Å²	145.7	82%	0.822	77%	0.766	S	S	*	*			trans	-68.8	101.1	164.3	38.7	0	0	0	0	109.4
171	T	27.7	Very low	28.5	Very low	115 Å²	115	141.1 Å²	141.1	71%	0.706	76%	0.763	S	S	*	*			trans	-85.2	171.8	148	53.6	0	0	0	0	107.8	T169	T169-T171 PolarHBondContact O-N 2.86Å
172	P	30.9	Very low	28.2	Very low	91 Å²	91	145.5 Å²	145.5	59%	0.591	77%	0.766	S	S	*	*			cis	-138.9	-177.5	-22.9	23.8	2.2	0	0	0	113.4
173	F	27.6	Very low	28.1	Very low	193 Å²	193	150.5 Å²	150.5	85%	0.846	77%	0.77	S	S	*	*			trans	75.4	137.5	163.7	-58.7	-73	0	0	0	116.9
174	S	27.1	Very low	27.8	Very low	63 Å²	63	145.9 Å²	145.9	44%	0.441	76%	0.764	S	S	.	*			cis	-160.9	132.3	31.2	54.5	0	0	0	0	110	I176	S174-I176 PolarHBondContact O-N 3.12Å; S174-I176 PolarHBondContact OG-O 3.37Å
175	D	31.1	Very low	27.6	Very low	176 Å²	176	140.4 Å²	140.4	94%	0.941	76%	0.759	S	S	*	*	S	Bend		-49.8	92.9	102.6	-90.7	-24.5	0	0	0	110.9
176	I	25.3	Very low	27.2	Very low	133 Å²	133	140.9 Å²	140.9	68%	0.682	76%	0.762	S	S	*	*	S	Bend	trans	179.2	88.7	151.2	-82	166.1	0	0	0	100.1	S174	S174-I176 PolarHBondContact O-N 3.12Å; S174-I176 PolarHBondContact OG-O 3.37Å
177	T	24.8	Very low	27	Very low	130 Å²	130	140.2 Å²	140.2	80%	0.798	76%	0.758	S	S	*	*			trans	51.6	92.2	151.4	-16.7	0	0	0	0	117.7
178	T	27.8	Very low	26.8	Very low	132 Å²	132	140.7 Å²	140.7	81%	0.81	76%	0.761	S	S	*	*			trans	-156.1	138.8	148.8	-12.1	0	0	0	0	113.6
179	R	25	Very low	26.3	Very low	229 Å²	229	139.7 Å²	139.7	86%	0.864	76%	0.756	S	S	*	*			trans	-77.7	122	-163	176	176.3	163.2	175.6	-3.9	112.8
180	T	25.7	Very low	25.9	Very low	130 Å²	130	144.1 Å²	144.1	80%	0.798	77%	0.767	S	S	*	*			trans	-68.3	128.8	172.3	-40	0	0	0	0	111.5
181	T	27.4	Very low	25.5	Very low	134 Å²	134	142.8 Å²	142.8	82%	0.822	76%	0.764	S	S	*	*			trans	-137.5	123.5	151.5	-17.6	0	0	0	0	109.3
182	R	22.5	Very low	25.3	Very low	217 Å²	217	144.2 Å²	144.2	82%	0.819	77%	0.767	S	S	*	*			trans	-94.5	139	-169.8	-178.6	-175.3	-174.3	-173.1	3.2	109.9
183	R	23.7	Very low	24.9	Very low	242 Å²	242	147 Å²	147	91%	0.913	78%	0.776	S	S	*	*			trans	-149.5	129.8	150.5	-150	173.3	-172.1	173.8	2.1	112.6
184	T	23	Very low	24.7	Very low	103 Å²	103	143.3 Å²	143.3	63%	0.632	77%	0.769	S	S	*	*			trans	-81.6	146	-177.7	-15.9	0	0	0	0	111.3
185	T	25.5	Very low	24.7	Very low	142 Å²	142	146 Å²	146	87%	0.871	78%	0.783	S	S	*	*			trans	-152	144.9	159	-32.2	0	0	0	0	110.3
186	T	22.4	Very low	24.5	Very low	106 Å²	106	141.1 Å²	141.1	65%	0.65	76%	0.763	S	S	*	*			trans	-128.9	149.7	-162.5	-51.9	0	0	0	0	111
187	T	26.3	Very low	24.4	Very low	125 Å²	125	146.3 Å²	146.3	77%	0.767	77%	0.773	S	S	*	*			trans	67.5	148.3	158.6	38.2	0	0	0	0	118.3
188	T	23.9	Very low	24.4	Very low	124 Å²	124	148.5 Å²	148.5	76%	0.761	77%	0.768	S	S	*	*			cis	-153.5	167.4	30.4	21.8	0	0	0	0	111.4	F190	T188-F190 PolarHBondContact O-N 3.23Å
189	P	21.4	Very low	24.3	Very low	112 Å²	112	145.9 Å²	145.9	73%	0.727	75%	0.753	S	S	*	*			trans	-87.7	94.8	-171.4	34.6	-30.6	0	0	0	112
190	F	22.8	Very low	24.3	Very low	195 Å²	195	138.5 Å²	138.5	86%	0.855	74%	0.736	S	S	*	*	S	Bend	trans	-158.3	109.3	148.3	-90.2	-74.6	0	0	0	107.1	T188 D192	T188-F190 PolarHBondContact O-N 3.23Å; F190-D192 PolarHBondContact O-N 3.28Å
191	S	24.8	Very low	24.4	Very low	107 Å²	107	137.2 Å²	137.2	75%	0.748	72%	0.721	S	S	*	*			trans	8.8	94	161.7	45.6	0	0	0	0	116.5	I193	S191-I193 PolarHBondContact O-N 3.11Å
192	D	22.1	Very low	24.7	Very low	145 Å²	145	137.1 Å²	137.1	78%	0.775	71%	0.706	S	S	*	*			trans	-52.4	105.6	160	-69.6	-47.7	0	0	0	109.9	F190 T194	F190-D192 PolarHBondContact O-N 3.28Å; D192-T194 VanDerWaalsContact C-N 3.26Å
193	I	23.5	Very low	24.9	Very low	150 Å²	150	135 Å²	135	77%	0.769	70%	0.698	S	S	*	*			trans	-93.7	73	149.7	-54	178.3	0	0	0	105.7	S191 T195	S191-I193 PolarHBondContact O-N 3.11Å; I193-T195 VanDerWaalsContact C-N 3.3Å; I193-T195 HydrophobicContact CG2-CG2 4.24Å; I193-T195 PolarHBondContact O-N 3.04Å
194	T	23.4	Very low	25.2	Very low	115 Å²	115	130.7 Å²	130.7	71%	0.706	68%	0.682	S	S	*	*			trans	-66.1	99.9	154.6	44.6	0	0	0	0	106.4	D192 S196	D192-T194 VanDerWaalsContact C-N 3.26Å; T194-S196 PolarHBondContact O-N 2.71Å
195	T	26.1	Very low	25.3	Very low	120 Å²	120	134.1 Å²	134.1	74%	0.736	69%	0.693	S	S	*	*			trans	-63	86.1	164.4	25.7	0	0	0	0	108.2	I193 R197	I193-T195 VanDerWaalsContact C-N 3.3Å; I193-T195 HydrophobicContact CG2-CG2 4.24Å; I193-T195 PolarHBondContact O-N 3.04Å; T195-R197 PolarHBondContact O-N 3.42Å
196	S	26.3	Very low	25.4	Very low	73 Å²	73	131.1 Å²	131.1	51%	0.51	68%	0.676	S	S	.	*			trans	-55	108.4	152.6	57.9	0	0	0	0	106.3	T194 Y198	T194-S196 PolarHBondContact O-N 2.71Å; S196-Y198 WeakPolarHBondContact O-CD2 3.45Å; S196-Y198 PolarHBondContact O-N 3.11Å; S196-Y198 WeakPolarHBondContact OG-CE2 3.28Å
197	R	23.8	Very low	25.5	Very low	241 Å²	241	131.8 Å²	131.8	91%	0.909	69%	0.686	S	S	*	*			trans	-55.1	101.8	167	-72.5	178.6	178.8	-169.3	-0.5	106.9	T195 P199	T195-R197 PolarHBondContact O-N 3.42Å; R197-P199 VanDerWaalsContact O-CD 3.28Å; R197-P199 WeakPolarHBondContact O-CD 3.36Å
198	Y	26.1	Very low	25.5	Very low	177 Å²	177	130.7 Å²	130.7	69%	0.694	68%	0.683	S	S	*	*			trans	-71.9	116.4	165.3	-75	-84.1	0	0	0	106.8	S196 C200	S196-Y198 WeakPolarHBondContact O-CD2 3.45Å; S196-Y198 PolarHBondContact O-N 3.11Å; S196-Y198 WeakPolarHBondContact OG-CE2 3.28Å; Y198-C200 PolarHBondContact O-N 3.17Å
199	P	25.7	Very low	25.7	Very low	76 Å²	76	130.1 Å²	130.1	49%	0.494	68%	0.679	S	S	.	*			trans	-56.5	139.9	168.7	23.6	-29.3	0	0	0	108	R197 H201	R197-P199 VanDerWaalsContact O-CD 3.28Å; R197-P199 WeakPolarHBondContact O-CD 3.36Å; P199-H201 PolarHBondContact O-CD2 3.29Å; P199-H201 PolarHBondContact O-N 3.06Å
200	C	24.7	Very low	26	Very low	75 Å²	75	130 Å²	130	51%	0.507	68%	0.677	S	S	.	*			trans	-57.2	102.9	169.1	-63.4	0	0	0	0	107.6	R103 Y198 W202	R103-C200 PolarHBondContact NH1-SG 3.02Å; Y198-C200 PolarHBondContact O-N 3.17Å; C200-W202 PolarHBondContact O-N 3.15Å
201	H	28	Very low	26.3	Very low	103 Å²	103	125.5 Å²	125.5	48%	0.477	67%	0.666	S	S	.	*			trans	-80.7	116.3	169.3	-73.8	-75.1	0	0	0	107.2	P199 W203	P199-H201 PolarHBondContact O-CD2 3.29Å; P199-H201 PolarHBondContact O-N 3.06Å; H201-W203 HydrophobicContact CB-CD2 4.3Å; H201-W203 HydrophobicContact CB-CE3 4.4Å; H201-W203 HydrophobicContact CB-CH2 3.73Å; H201-W203 HydrophobicContact CB-CZ2 3.57Å; H201-W203 HydrophobicContact CB-CZ3 4.14Å; H201-W203 PolarHBondContact O-NE1 3.16Å; H201-W203 VanDerWaalsContact O-NE1 3.16Å
202	W	32.1	Very low	26.6	Very low	132 Å²	132	125.5 Å²	125.5	50%	0.5	66%	0.661	S	S	.	*			trans	-80.1	115.9	169.8	-66.6	61.7	0	0	0	106.9	C105 V107 C200 W204	C105-W202 HydrophobicContact CB-CH2 4.42Å; V107-W202 HydrophobicContact CG2-CH2 3.88Å; V107-W202 HydrophobicContact CG2-CZ3 3.92Å; C200-W202 PolarHBondContact O-N 3.15Å; W202-W204 AromaticContact CE3-CE2 3.89Å; W202-W204 AromaticContact CE3-CZ2 3.54Å; W202-W204 HydrophobicContact CE3-CZ2 3.54Å; W202-W204 AromaticContact CE3-NE1 3.88Å; W202-W204 HydrophobicContact CZ3-CH2 4.43Å; W202-W204 AromaticContact CZ3-CZ2 3.72Å; W202-W204 HydrophobicContact CZ3-CZ2 3.72Å
203	W	27.7	Very low	27	Very low	172 Å²	172	123.4 Å²	123.4	65%	0.652	65%	0.654	S	S	*	*			trans	-99.8	100.4	172.7	-22.3	81.6	0	0	0	107.2	H118 H201	H118-W203 AromaticContact CE1-CZ2 3.92Å; H118-W203 AromaticContact CE1-NE1 3.92Å; H201-W203 HydrophobicContact CB-CD2 4.3Å; H201-W203 HydrophobicContact CB-CE3 4.4Å; H201-W203 HydrophobicContact CB-CH2 3.73Å; H201-W203 HydrophobicContact CB-CZ2 3.57Å; H201-W203 HydrophobicContact CB-CZ3 4.14Å; H201-W203 PolarHBondContact O-NE1 3.16Å; H201-W203 VanDerWaalsContact O-NE1 3.16Å
204	W	29.5	Very low	27.3	Very low	151 Å²	151	120 Å²	120	57%	0.572	64%	0.64	S	S	*	*			trans	-85.7	119.2	164.1	-59.4	94.7	0	0	0	106.8	W202 C206	W202-W204 AromaticContact CE3-CE2 3.89Å; W202-W204 AromaticContact CE3-CZ2 3.54Å; W202-W204 HydrophobicContact CE3-CZ2 3.54Å; W202-W204 AromaticContact CE3-NE1 3.88Å; W202-W204 HydrophobicContact CZ3-CH2 4.43Å; W202-W204 AromaticContact CZ3-CZ2 3.72Å; W202-W204 HydrophobicContact CZ3-CZ2 3.72Å; W204-C206 VanDerWaalsContact C-N 3.32Å; W204-C206 PolarHBondContact O-N 2.76Å
205	M	26.2	Very low	27.5	Very low	176 Å²	176	120.4 Å²	120.4	87%	0.867	65%	0.645	S	S	*	*			trans	-69.2	95.2	168.6	-72.8	-167.9	-171.5	0	0	107.8
206	C	26.9	Very low	27.6	Very low	78 Å²	78	120.6 Å²	120.6	53%	0.527	64%	0.64	S	S	.	*			trans	-114.4	119.1	173	-62.9	0	0	0	0	108.6	W204 S208	W204-C206 VanDerWaalsContact C-N 3.32Å; W204-C206 PolarHBondContact O-N 2.76Å; C206-S208 PolarHBondContact O-N 2.69Å
207	S	25.1	Very low	27.7	Very low	121 Å²	121	121.5 Å²	121.5	85%	0.846	65%	0.646	S	S	*	*			trans	-75.8	111	161.9	59	0	0	0	0	107.9
208	S	25.5	Very low	28	Very low	101 Å²	101	117.3 Å²	117.3	71%	0.706	64%	0.642	S	S	*	*			trans	-84.3	120.9	173.2	70.5	0	0	0	0	110.4	C206	C206-S208 PolarHBondContact O-N 2.69Å
209	T	28.5	Very low	28	Very low	112 Å²	112	113.8 Å²	113.8	69%	0.687	64%	0.639	S	S	*	*			trans	-89.8	114.7	157.9	25.4	0	0	0	0	108.2	T227	T209-T227 HydrophobicContact CG2-CG2 4.09Å
210	T	28.4	Very low	28.3	Very low	109 Å²	109	116 Å²	116	67%	0.669	65%	0.653	S	S	*	*			trans	-106.6	117	175.7	-3.5	0	0	0	0	108.9
211	T	27.6	Very low	28.4	Very low	102 Å²	102	116.1 Å²	116.1	63%	0.626	65%	0.648	S	S	*	*			trans	-101.6	116.2	172	-48.2	0	0	0	0	107.4	T223	T211-T223 HydrophobicContact CG2-CG2 4.36Å
212	T	31.5	Very low	28.4	Very low	106 Å²	106	117.4 Å²	117.4	65%	0.65	66%	0.663	S	S	*	*			trans	-107.4	113.2	179	-46.5	0	0	0	0	109.4
213	T	30	Very low	28.3	Very low	102 Å²	102	115.3 Å²	115.3	63%	0.626	67%	0.665	S	S	*	*			trans	-107.6	105.8	169.3	5.9	0	0	0	0	107.7	P215	T213-P215 WeakPolarHBondContact O-CD 3.42Å
214	T	29.7	Very low	28.4	Very low	78 Å²	78	113 Å²	113	48%	0.479	67%	0.67	S	S	.	*			trans	-91.9	113.8	174.4	28.1	0	0	0	0	109.8	I216 I221	T214-I216 PolarHBondContact O-N 3.43Å; T214-I221 WeakPolarHBondContact O-CD1 3.29Å; T214-I221 VanDerWaalsContact O-CG1 3.27Å; T214-I221 WeakPolarHBondContact O-CG1 3.45Å
215	P	27.4	Very low	28.5	Very low	124 Å²	124	110.9 Å²	110.9	81%	0.805	67%	0.674	S	S	*	*			trans	-75.8	108.6	167.4	29.8	-28.4	0	0	0	108.8	T213	T213-P215 WeakPolarHBondContact O-CD 3.42Å
216	I	28.9	Very low	28.6	Very low	123 Å²	123	107.7 Å²	107.7	63%	0.631	66%	0.664	S	S	*	*			trans	-107.4	132.8	163.2	-69.1	172.3	0	0	0	106.7	T214 D218	T214-I216 PolarHBondContact O-N 3.43Å; I216-D218 PolarHBondContact O-N 3.45Å
217	S	28.4	Very low	28.7	Very low	92 Å²	92	109.1 Å²	109.1	64%	0.643	67%	0.671	S	S	*	*	T	Hydrogen-bonded Turn	trans	-34	127.3	171.5	-154	0	0	0	0	112.2	V219	S217-V219 PolarHBondContact O-N 3.01Å; S217-V219 VanDerWaalsContact O-N 3.14Å
218	D	29.8	Very low	28.9	Very low	154 Å²	154	109.4 Å²	109.4	82%	0.824	67%	0.667	S	S	*	*	T	Hydrogen-bonded Turn	trans	60.1	20.7	158.4	-52.1	-50.1	0	0	0	119.6	I216	I216-D218 PolarHBondContact O-N 3.45Å
219	V	27.7	Very low	28.9	Very low	103 Å²	103	110 Å²	110	62%	0.624	67%	0.669	S	S	*	*	S	Bend	trans	-139	130.5	173	-168.5	0	0	0	0	111.5	S217 I221	S217-V219 PolarHBondContact O-N 3.01Å; S217-V219 VanDerWaalsContact O-N 3.14Å; V219-I221 PolarHBondContact O-N 3.33Å
220	P	30.7	Very low	28.8	Very low	122 Å²	122	113.5 Å²	113.5	79%	0.792	68%	0.675	S	S	*	*	P	Polyproline II helix	trans	-63.9	123.9	-177.3	23.8	-32.6	0	0	0	112.2
221	I	27.8	Very low	28.9	Very low	78 Å²	78	113.3 Å²	113.3	40%	0.4	68%	0.678	S	S	.	*	P	Polyproline II helix	trans	-85.3	116.1	-178.6	-61.7	123.6	0	0	0	110.8	T214 V219	T214-I221 WeakPolarHBondContact O-CD1 3.29Å; T214-I221 VanDerWaalsContact O-CG1 3.27Å; T214-I221 WeakPolarHBondContact O-CG1 3.45Å; V219-I221 PolarHBondContact O-N 3.33Å
222	T	27.9	Very low	28.8	Very low	129 Å²	129	115.3 Å²	115.3	79%	0.791	69%	0.685	S	S	*	*	P	Polyproline II helix	trans	-71.5	127.2	162.8	23.2	0	0	0	0	111.6
223	T	29.6	Very low	28.9	Very low	88 Å²	88	119.1 Å²	119.1	54%	0.54	69%	0.693	S	S	.	*	P	Polyproline II helix	trans	-88.2	125.7	177.2	-34.3	0	0	0	0	111.1	T211	T211-T223 HydrophobicContact CG2-CG2 4.36Å
224	T	29.6	Very low	28.8	Very low	124 Å²	124	119.7 Å²	119.7	76%	0.761	70%	0.698	S	S	*	*			trans	-114.7	125.6	173.2	-53	0	0	0	0	109.5
225	T	30.8	Very low	28.7	Very low	106 Å²	106	122.7 Å²	122.7	65%	0.65	72%	0.717	S	S	*	*			trans	-105.6	131.4	179.1	-49.8	0	0	0	0	109.9
226	T	28.4	Very low	28.8	Very low	109 Å²	109	122.9 Å²	122.9	67%	0.669	72%	0.716	S	S	*	*			trans	-134.8	131.1	175.8	-56.3	0	0	0	0	110.5	T228	T226-T228 HydrophobicContact CG2-CG2 4.44Å
227	T	30	Very low	28.6	Very low	109 Å²	109	124 Å²	124	67%	0.669	73%	0.728	S	S	*	*			trans	-118.3	123	176	24.3	0	0	0	0	109.7	T209	T209-T227 HydrophobicContact CG2-CG2 4.09Å
228	T	28.2	Very low	28.7	Very low	126 Å²	126	125.9 Å²	125.9	77%	0.773	74%	0.736	S	S	*	*			trans	-123.3	128.2	176	47.1	0	0	0	0	111.5	T226	T226-T228 HydrophobicContact CG2-CG2 4.44Å
229	P	26	Very low	28.5	Very low	113 Å²	113	124.8 Å²	124.8	73%	0.734	74%	0.735	S	S	*	*			trans	-81.5	134.9	172.8	31.4	-30.4	0	0	0	111.4
230	F	27.4	Very low	28.4	Very low	186 Å²	186	124.7 Å²	124.7	82%	0.816	74%	0.737	S	S	*	*			trans	37.6	105.7	165.7	-59.7	-81.4	0	0	0	118.3
231	S	28.8	Very low	28.2	Very low	105 Å²	105	128.2 Å²	128.2	73%	0.734	74%	0.74	S	S	*	*			trans	-118.1	135	158.5	175.7	0	0	0	0	108.9
232	D	26	Very low	28	Very low	145 Å²	145	129.5 Å²	129.5	78%	0.775	76%	0.756	S	S	*	*			trans	-52.4	176.6	169.6	-65.8	-49.3	0	0	0	111.5
233	F	33	Very low	27.8	Very low	186 Å²	186	130.1 Å²	130.1	82%	0.816	75%	0.754	S	S	*	*			trans	104.6	169.2	172.1	-51.9	-62.7	0	0	0	116.4
234	P	28.6	Very low	27.8	Very low	113 Å²	113	133.6 Å²	133.6	73%	0.734	77%	0.768	S	S	*	*			cis	-126.3	163.8	-47.1	28.6	-11.3	0	0	0	112.5
235	T	27.6	Very low	27.6	Very low	142 Å²	142	133.4 Å²	133.4	87%	0.871	77%	0.767	S	S	*	*			trans	-72.1	116.8	176.1	38.6	0	0	0	0	113.5
236	T	29.1	Very low	27.5	Very low	128 Å²	128	135.3 Å²	135.3	79%	0.785	77%	0.772	S	S	*	*			trans	-150.9	138.5	157.4	19.7	0	0	0	0	111.7
237	T	26	Very low	27.4	Very low	145 Å²	145	135.9 Å²	135.9	89%	0.89	78%	0.776	S	S	*	*			trans	-80.2	127.1	-170.3	-37	0	0	0	0	111.8
238	T	30.7	Very low	27.3	Very low	133 Å²	133	136.5 Å²	136.5	82%	0.816	78%	0.784	S	S	*	*			trans	-146.8	141	167.1	22.4	0	0	0	0	111.7
239	T	25.1	Very low	27.3	Very low	131 Å²	131	134.5 Å²	134.5	80%	0.804	79%	0.789	S	S	*	*			trans	-60.3	142	-177.5	40.3	0	0	0	0	112.9
240	P	24.7	Very low	27.3	Very low	101 Å²	101	133.7 Å²	133.7	66%	0.656	79%	0.786	S	S	*	*	S	Bend	trans	-87.2	134.5	-178.5	36.1	-31.6	0	0	0	110.9
241	F	26.1	Very low	27.3	Very low	196 Å²	196	130.8 Å²	130.8	86%	0.86	78%	0.783	S	S	*	*	S	Bend	trans	76.6	80.7	168.7	-52.9	-77.2	0	0	0	117.8
242	S	23.9	Very low	27.3	Very low	104 Å²	104	130 Å²	130	73%	0.727	78%	0.775	S	S	*	*	S	Bend	trans	-162	129.3	141.4	-12.4	0	0	0	0	107.9
243	D	24.1	Very low	27.4	Very low	142 Å²	142	134.5 Å²	134.5	76%	0.759	78%	0.781	S	S	*	*			trans	67.9	80.3	159.1	-49.1	-25.9	0	0	0	118.5
244	I	29	Very low	27.3	Very low	162 Å²	162	129.1 Å²	129.1	83%	0.831	76%	0.76	S	S	*	*			trans	-105	83.8	142.9	-57	175.9	0	0	0	106.7	L246	I244-L246 PolarHBondContact O-N 3.46Å
245	T	25.6	Very low	27.2	Very low	120 Å²	120	133.6 Å²	133.6	74%	0.736	76%	0.763	S	S	*	*			trans	-67.6	107.7	159.3	26.2	0	0	0	0	107.5	T247	T245-T247 VanDerWaalsContact C-N 3.33Å; T245-T247 PolarHBondContact O-N 3.02Å
246	L	28.9	Very low	27.3	Very low	145 Å²	145	132 Å²	132	76%	0.759	74%	0.744	S	S	*	*			trans	-66.8	92.4	171.1	-79.3	156.3	0	0	0	108.5	I244 S248	I244-L246 PolarHBondContact O-N 3.46Å; L246-S248 PolarHBondContact O-N 3.29Å; L246-S248 VanDerWaalsContact O-N 3.12Å
247	T	27	Very low	27.3	Very low	121 Å²	121	133.5 Å²	133.5	74%	0.742	74%	0.742	S	S	*	*			trans	-58.4	113.8	162.5	30.9	0	0	0	0	108.6	T245	T245-T247 VanDerWaalsContact C-N 3.33Å; T245-T247 PolarHBondContact O-N 3.02Å
248	S	27.7	Very low	27.4	Very low	122 Å²	122	134.3 Å²	134.3	85%	0.853	74%	0.736	S	S	*	*	S	Bend	trans	-3.7	118	164.7	57.6	0	0	0	0	116.5	L246	L246-S248 PolarHBondContact O-N 3.29Å; L246-S248 VanDerWaalsContact O-N 3.12Å
249	G	28.5	Very low	27.4	Very low	84 Å²	84	131.4 Å²	131.4	87%	0.866	73%	0.725	S	S	*	*	S	Bend	trans	130.2	-7.6	148.5	0	0	0	0	0	118.3
250	S	25.7	Very low	27.5	Very low	97 Å²	97	130.9 Å²	130.9	68%	0.678	72%	0.721	S	S	*	*			trans	-145.9	84.8	-176.2	55.4	0	0	0	0	112.6	P252	S250-P252 WeakPolarHBondContact O-CD 3.29Å
251	V	27	Very low	27.7	Very low	125 Å²	125	130.4 Å²	130.4	76%	0.758	72%	0.716	S	S	*	*			trans	-76.3	117.6	165	-179	0	0	0	0	107.7	R253	V251-R253 PolarHBondContact O-N 3.05Å
252	P	29.8	Very low	27.8	Very low	87 Å²	87	130.2 Å²	130.2	57%	0.565	72%	0.715	S	S	*	*			trans	-65.6	117.9	175.6	24.4	-30.3	0	0	0	109.8	S250 I254	S250-P252 WeakPolarHBondContact O-CD 3.29Å; P252-I254 PolarHBondContact O-N 3.49Å
253	R	27.8	Very low	27.9	Very low	240 Å²	240	128.5 Å²	128.5	91%	0.906	71%	0.707	S	S	*	*			trans	-64.5	114.9	170	-87.9	-179.4	168.7	170.5	-3.1	109.6	V251	V251-R253 PolarHBondContact O-N 3.05Å
254	I	29.6	Very low	28	Very low	73 Å²	73	128.9 Å²	128.9	37%	0.374	71%	0.709	S	S	.	*			trans	-94.5	110.2	177.2	-59.6	173.2	0	0	0	108.4	P252 F256	P252-I254 PolarHBondContact O-N 3.49Å; I254-F256 HydrophobicContact CG2-CZ 4.38Å
255	R	27	Very low	28	Very low	208 Å²	208	130.7 Å²	130.7	79%	0.785	71%	0.711	S	S	*	*			trans	-81.7	124.2	169	-83.4	-175.1	170.7	-168.9	-0.5	110.2	E257	R255-E257 PolarHBondContact O-N 3.15Å
256	F	30.2	Very low	28.2	Very low	109 Å²	109	134.5 Å²	134.5	48%	0.478	72%	0.717	S	S	.	*			trans	-85.7	96.6	172.1	-64.1	-83.1	0	0	0	110.6	I254 L277	I254-F256 HydrophobicContact CG2-CZ 4.38Å; F256-L277 HydrophobicContact CZ-CD2 4.2Å
257	E	28.8	Very low	28.5	Very low	158 Å²	158	132.2 Å²	132.2	74%	0.738	71%	0.705	S	S	*	*			trans	-92.9	113.9	170.3	-77	-171.6	170.9	0	0	111.8	R255	R255-E257 PolarHBondContact O-N 3.15Å
258	H	28.3	Very low	28.7	Very low	163 Å²	163	131.2 Å²	131.2	76%	0.755	70%	0.703	S	S	*	*			trans	39.9	79.2	152.6	-69.7	-103.7	0	0	0	118.9	V260	H258-V260 PolarHBondContact O-N 2.71Å
259	A	29.8	Very low	29.3	Very low	72 Å²	72	131.2 Å²	131.2	60%	0.595	69%	0.688	S	S	*	*			trans	-75.3	102.7	157.1	0	0	0	0	0	110.1	V261 F274	A259-V261 PolarHBondContact O-N 3.18Å; A259-V261 VanDerWaalsContact O-N 3.07Å; A259-F274 HydrophobicContact CB-CZ 4.45Å
260	V	27.8	Very low	29.6	Very low	120 Å²	120	128.5 Å²	128.5	73%	0.727	66%	0.657	S	S	*	*			trans	-66	99.4	178.6	177.9	0	0	0	0	110.4	H258 K262	H258-V260 PolarHBondContact O-N 2.71Å; V260-K262 PolarHBondContact O-N 2.97Å
261	V	29.1	Very low	30.1	Very low	91 Å²	91	127.8 Å²	127.8	55%	0.552	65%	0.652	S	S	*	*			trans	-76.9	98	168.6	-174.5	0	0	0	0	108.7	A259 A263 L267	A259-V261 PolarHBondContact O-N 3.18Å; A259-V261 VanDerWaalsContact O-N 3.07Å; V261-A263 PolarHBondContact O-N 3.45Å; V261-L267 HydrophobicContact CB-CD2 4.23Å; V261-L267 HydrophobicContact CG1-CD1 4.28Å; V261-L267 HydrophobicContact CG1-CD2 3.95Å
262	K	28.6	Very low	30.6	Very low	192 Å²	192	126.6 Å²	126.6	84%	0.835	64%	0.642	S	S	*	*			trans	-78.6	102.7	173.6	-118.1	-176.8	-178.9	-179.6	0	110.3	V260	V260-K262 PolarHBondContact O-N 2.97Å
263	A	25.8	Very low	31.1	Very low	67 Å²	67	127.4 Å²	127.4	55%	0.554	64%	0.64	S	S	*	*			trans	50.9	105.9	141	0	0	0	0	0	119.7	V261	V261-A263 PolarHBondContact O-N 3.45Å
264	N	26.2	Very low	31.6	Very low	150 Å²	150	120.2 Å²	120.2	80%	0.802	62%	0.615	S	S	*	*				170.2	122.9	99.4	-99.4	-40.4	0	0	0	110.8
265	K	27.7	Very low	31.9	Very low	200 Å²	200	118.1 Å²	118.1	87%	0.87	61%	0.612	S	S	*	*	S	Bend	trans	69.6	117.2	174	-61.5	-178	176.6	-179.7	0	116.2
266	K	30.8	Very low	32.2	Very low	201 Å²	201	114.5 Å²	114.5	87%	0.874	60%	0.599	S	S	*	*			trans	77.1	52.4	171.5	-55.4	-173.8	179	-179.2	0	117.8	S268	K266-S268 VanDerWaalsContact C-N 3.28Å; K266-S268 PolarHBondContact O-N 3.37Å
267	L	34.8	Very low	32.6	Very low	96 Å²	96	111.7 Å²	111.7	50%	0.503	59%	0.589	S	S	.	*	T	Hydrogen-bonded Turn	trans	-84.2	30.5	172.7	-97.6	166	0	0	0	114.8	V261 A270	V261-L267 HydrophobicContact CB-CD2 4.23Å; V261-L267 HydrophobicContact CG1-CD1 4.28Å; V261-L267 HydrophobicContact CG1-CD2 3.95Å; L267-A270 HydrophobicContact CD2-CB 3.43Å; L267-A270 VanDerWaalsContact CD2-CB 3.43Å
268	S	32.5	Very low	32.9	Very low	100 Å²	100	110.9 Å²	110.9	70%	0.699	58%	0.583	S	S	*	*	T	Hydrogen-bonded Turn	trans	-83	-13	172.9	95.9	0	0	0	0	113.3	K266 S271	K266-S268 VanDerWaalsContact C-N 3.28Å; K266-S268 PolarHBondContact O-N 3.37Å; S268-S271 PolarHBondContact O-OG 3.23Å
269	K	38.5	Very low	33.2	Very low	123 Å²	123	111 Å²	111	54%	0.535	58%	0.577	S	S	.	*	S	Bend	trans	-102.1	-18.8	-175.4	-69.2	-169.2	175.8	-169.8	0	114.7	D77 S271 N272	D77-K269 IonicContact OD1-NZ 2.76Å; D77-K269 PolarHBondContact OD1-NZ 2.95Å; K269-S271 VanDerWaalsContact C-N 3.32Å; K269-S271 PolarHBondContact O-N 2.9Å; K269-N272 WeakPolarHBondContact O-CB 3.37Å; K269-N272 PolarHBondContact O-N 3.25Å
270	A	35.2	Very low	33.4	Very low	27 Å²	27	113.4 Å²	113.4	22%	0.223	57%	0.572	C	S	.	*	H	α-helix	trans	-73.8	-21.2	178.5	0	0	0	0	0	113.8	L267 N272 I273 F274	L267-A270 HydrophobicContact CD2-CB 3.43Å; L267-A270 VanDerWaalsContact CD2-CB 3.43Å; A270-N272 PolarHBondContact O-N 3.32Å; A270-I273 PolarHBondContact O-N 3.11Å; A270-F274 WeakPolarHBondContact O-CD2 3.35Å
271	S	35.9	Very low	33.8	Very low	82 Å²	82	111.9 Å²	111.9	57%	0.573	56%	0.557	S	S	*	*	H	α-helix	trans	-64.7	-25.4	170.9	51.7	0	0	0	0	112.5	S268 K269 G275	S268-S271 PolarHBondContact O-OG 3.23Å; K269-S271 VanDerWaalsContact C-N 3.32Å; K269-S271 PolarHBondContact O-N 2.9Å; S271-G275 PolarHBondContact O-N 3.31Å; S271-G275 VanDerWaalsContact O-N 3.13Å
272	N	38.9	Very low	34	Very low	99 Å²	99	114.8 Å²	114.8	53%	0.529	56%	0.564	S	S	.	*	H	α-helix	trans	-75.6	-32.6	-179.1	-135	-5.7	0	0	0	111.9	K269 A270 G275 Y276	K269-N272 WeakPolarHBondContact O-CB 3.37Å; K269-N272 PolarHBondContact O-N 3.25Å; A270-N272 PolarHBondContact O-N 3.32Å; N272-G275 PolarHBondContact O-N 2.94Å; N272-Y276 WeakPolarHBondContact O-CD2 3.37Å; N272-Y276 PolarHBondContact O-N 2.85Å
273	I	40.4	Very low	34.4	Very low	104 Å²	104	112.9 Å²	112.9	53%	0.533	56%	0.558	S	S	.	*	H	α-helix	trans	-65.6	-41.4	176.5	-68	169.3	0	0	0	110.9	A270 Y276 L277	A270-I273 PolarHBondContact O-N 3.11Å; I273-Y276 PolarHBondContact O-N 3.37Å; I273-L277 HydrophobicContact CG2-CD1 3.94Å; I273-L277 WeakPolarHBondContact O-CB 3.47Å; I273-L277 WeakPolarHBondContact O-CD1 3.45Å; I273-L277 WeakPolarHBondContact O-CG 3.37Å; I273-L277 PolarHBondContact O-N 3.39Å
274	F	37.9	Very low	34.7	Very low	89 Å²	89	120.6 Å²	120.6	39%	0.39	58%	0.575	S	S	.	*	H	α-helix	trans	-67.3	-36.3	172.9	-74.9	-77.8	0	0	0	112.3	A259 A270 K278	A259-F274 HydrophobicContact CB-CZ 4.45Å; A270-F274 WeakPolarHBondContact O-CD2 3.35Å; F274-K278 VanDerWaalsContact O-CB 3.27Å; F274-K278 WeakPolarHBondContact O-CB 2.89Å; F274-K278 PolarHBondContact O-N 3.44Å
275	G	35.1	Very low	35.1	Very low	30 Å²	30	119.1 Å²	119.1	31%	0.309	56%	0.563	S	S	.	*	H	α-helix	trans	-63.9	-40.7	174.4	0	0	0	0	0	113.6	S271 N272 R279	S271-G275 PolarHBondContact O-N 3.31Å; S271-G275 VanDerWaalsContact O-N 3.13Å; N272-G275 PolarHBondContact O-N 2.94Å; G275-R279 WeakPolarHBondContact O-CG 3.32Å; G275-R279 PolarHBondContact O-N 3.22Å; G275-R279 VanDerWaalsContact O-N 3.16Å
276	Y	34.1	Very low	35.5	Very low	131 Å²	131	114.8 Å²	114.8	51%	0.514	55%	0.547	S	S	.	.	H	α-helix	trans	-71.8	-38.1	177.6	-93.6	-87.8	0	0	0	112.6	N272 I273 R279 Y280	N272-Y276 WeakPolarHBondContact O-CD2 3.37Å; N272-Y276 PolarHBondContact O-N 2.85Å; I273-Y276 PolarHBondContact O-N 3.37Å; Y276-R279 PolarHBondContact O-N 3.45Å; Y276-Y280 PolarHBondContact O-N 3.23Å; Y276-Y280 VanDerWaalsContact O-N 3.09Å
277	L	37.4	Very low	35.8	Very low	51 Å²	51	110.1 Å²	110.1	27%	0.267	53%	0.529	S	S	.	.	H	α-helix	trans	-68	-37.2	174.7	-71.9	164.6	0	0	0	111.9	F256 I273 R279 Y280 E281	F256-L277 HydrophobicContact CZ-CD2 4.2Å; I273-L277 HydrophobicContact CG2-CD1 3.94Å; I273-L277 WeakPolarHBondContact O-CB 3.47Å; I273-L277 WeakPolarHBondContact O-CD1 3.45Å; I273-L277 WeakPolarHBondContact O-CG 3.37Å; I273-L277 PolarHBondContact O-N 3.39Å; L277-R279 VanDerWaalsContact C-N 3.31Å; L277-R279 PolarHBondContact O-N 3.33Å; L277-Y280 WeakPolarHBondContact O-CB 3.34Å; L277-Y280 PolarHBondContact O-N 3.27Å; L277-E281 PolarHBondContact O-N 3.42Å; L277-E281 VanDerWaalsContact O-N 3.12Å
278	K	36.4	Very low	35.8	Very low	141 Å²	141	110.9 Å²	110.9	61%	0.613	53%	0.53	S	S	*	.	H	α-helix	trans	-66.9	-29	174.7	-163.3	177.7	-176.3	-177.6	0	113.1	F274	F274-K278 VanDerWaalsContact O-CB 3.27Å; F274-K278 WeakPolarHBondContact O-CB 2.89Å; F274-K278 PolarHBondContact O-N 3.44Å
279	R	33.5	Very low	36	Very low	166 Å²	166	111.6 Å²	111.6	63%	0.626	52%	0.52	S	S	*	.	H	α-helix	trans	-75.3	-33.6	171.8	-74	-176.6	-169.9	-163.1	2.7	112.4	G275 Y276 L277 E281 Q282 Q283	G275-R279 WeakPolarHBondContact O-CG 3.32Å; G275-R279 PolarHBondContact O-N 3.22Å; G275-R279 VanDerWaalsContact O-N 3.16Å; Y276-R279 PolarHBondContact O-N 3.45Å; L277-R279 VanDerWaalsContact C-N 3.31Å; L277-R279 PolarHBondContact O-N 3.33Å; R279-E281 VanDerWaalsContact C-N 3.31Å; R279-Q282 PolarHBondContact O-N 2.9Å; R279-Q282 VanDerWaalsContact O-N 3.17Å; R279-Q283 PolarHBondContact O-N 3.46Å
280	Y	35.3	Very low	35.9	Very low	121 Å²	121	110.8 Å²	110.8	48%	0.475	52%	0.519	S	S	.	.	H	α-helix	trans	-65.4	-34.8	173.8	-113.2	-92.1	0	0	0	112.2	Y276 L277 Q282 Q283 Y284	Y276-Y280 PolarHBondContact O-N 3.23Å; Y276-Y280 VanDerWaalsContact O-N 3.09Å; L277-Y280 WeakPolarHBondContact O-CB 3.34Å; L277-Y280 PolarHBondContact O-N 3.27Å; Y280-Q282 PolarHBondContact O-N 3.34Å; Y280-Q283 PolarHBondContact O-N 3.47Å; Y280-Y284 HydrophobicContact CD1-CD2 4.17Å; Y280-Y284 AromaticContact CD1-CE2 3.93Å; Y280-Y284 HydrophobicContact CD1-CE2 3.93Å; Y280-Y284 AromaticContact CE1-CE2 3.81Å; Y280-Y284 HydrophobicContact CE1-CE2 3.81Å
281	E	34.9	Very low	35.9	Very low	88 Å²	88	116.8 Å²	116.8	41%	0.411	54%	0.54	S	S	.	.	T	Hydrogen-bonded Turn	trans	-69.7	-15	173.6	-158.6	-176.6	178.1	0	0	113.4	L277 R279	L277-E281 PolarHBondContact O-N 3.42Å; L277-E281 VanDerWaalsContact O-N 3.12Å; R279-E281 VanDerWaalsContact C-N 3.31Å
282	Q	34.9	Very low	35.9	Very low	153 Å²	153	119.5 Å²	119.5	72%	0.715	54%	0.538	S	S	*	.	T	Hydrogen-bonded Turn	trans	-95.8	-10.9	176.4	-73.3	-177.9	-22.8	0	0	113.6	R279 Y280	R279-Q282 PolarHBondContact O-N 2.9Å; R279-Q282 VanDerWaalsContact O-N 3.17Å; Y280-Q282 PolarHBondContact O-N 3.34Å
283	Q	35.6	Very low	35.7	Very low	152 Å²	152	121.2 Å²	121.2	71%	0.71	54%	0.538	S	S	*	.			trans	-102.9	-3.7	-177.4	-75.9	-177.6	-20.6	0	0	113.9	R279 Y280	R279-Q283 PolarHBondContact O-N 3.46Å; Y280-Q283 PolarHBondContact O-N 3.47Å
284	Y	32.4	Very low	35.2	Very low	228 Å²	228	122.7 Å²	122.7	89%	0.894	54%	0.539	S	S	*	.			trans	-136.7	0	178.2	-69.6	-83.5	0	0	0	111	Y280	Y280-Y284 HydrophobicContact CD1-CD2 4.17Å; Y280-Y284 AromaticContact CD1-CE2 3.93Å; Y280-Y284 HydrophobicContact CD1-CE2 3.93Å; Y280-Y284 AromaticContact CE1-CE2 3.81Å; Y280-Y284 HydrophobicContact CE1-CE2 3.81Å

Retrieved 284 of 284 residues in 68.7 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).