A0A060CZB9_MAIZE Loading...

Transcription repressor

Transcriptional repressor that regulates multiple aspects of plant growth and development.

AlphaFold DB , UniProt , Accession A0A060CZB9, Species MAIZE (Zea mays, Maize), Gene OFP2, Length 426 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	52.2	Low	57.5	Low	246 Å²	246	155.3 Å²	155.3	100%	1.212	80%	0.795	S	S	*	*				0	122.9	0	-64.4	175.8	178.6	0	0	108.5
2	R	58.2	Low	56.4	Low	251 Å²	251	161.1 Å²	161.1	95%	0.947	80%	0.802	S	S	*	*			trans	-137.5	109.2	170.5	-94.4	-177.8	167.9	169.8	-4.3	106.8
3	T	68.8	Low	55.9	Low	135 Å²	135	163.6 Å²	163.6	83%	0.828	80%	0.797	S	S	*	*			trans	-77.4	126.9	172.5	46.6	0	0	0	0	109
4	P	70.4	Confident	55.7	Low	112 Å²	112	166.2 Å²	166.2	73%	0.727	79%	0.794	S	S	*	*			trans	-69.5	140.7	173.5	29	-32.9	0	0	0	110.4	V6	P4-V6 PolarHBondContact O-N 3.22Å
5	F	56.2	Low	55.9	Low	190 Å²	190	163 Å²	163	83%	0.833	78%	0.783	S	S	*	*			trans	-68.6	109.1	172.6	176.3	-96.8	0	0	0	109	D7	F5-D7 HydrophobicContact CD1-CB 4.41Å; F5-D7 HydrophobicContact CE1-CB 3.94Å; F5-D7 PolarHBondContact O-N 3.23Å
6	V	70.8	Confident	56.3	Low	105 Å²	105	157.6 Å²	157.6	64%	0.636	77%	0.768	S	S	*	*			trans	-90.8	97.2	173.8	-174.8	0	0	0	0	108.1	P4 K8	P4-V6 PolarHBondContact O-N 3.22Å; V6-K8 HydrophobicContact CG1-CG 3.95Å; V6-K8 PolarHBondContact O-N 3.45Å
7	D	61.8	Low	56.7	Low	108 Å²	108	149.5 Å²	149.5	58%	0.578	73%	0.732	S	S	*	*			trans	-62.2	116.8	166.2	-175.2	-4.1	0	0	0	108.9	F5 S9	F5-D7 HydrophobicContact CD1-CB 4.41Å; F5-D7 HydrophobicContact CE1-CB 3.94Å; F5-D7 PolarHBondContact O-N 3.23Å; D7-S9 WeakPolarHBondContact OD1-CB 3.29Å; D7-S9 PolarHBondContact OD1-N 2.73Å; D7-S9 VanDerWaalsContact OD1-N 3.1Å; D7-S9 PolarHBondContact OD1-OG 3.1Å
8	K	54.2	Low	57.1	Low	182 Å²	182	142.7 Å²	142.7	79%	0.791	70%	0.704	S	S	*	*			trans	-112.6	62.7	174.9	-70.7	-171.1	176.4	-178.6	0	109.7	V6 P10	V6-K8 HydrophobicContact CG1-CG 3.95Å; V6-K8 PolarHBondContact O-N 3.45Å; K8-P10 VanDerWaalsContact O-CD 3.29Å; K8-P10 WeakPolarHBondContact O-CD 3.45Å
9	S	43.8	Very low	58	Low	80 Å²	80	137.2 Å²	137.2	56%	0.559	69%	0.687	S	S	*	*			trans	-78.7	112.1	171.7	-71.8	0	0	0	0	111.2	D7 Q11	D7-S9 WeakPolarHBondContact OD1-CB 3.29Å; D7-S9 PolarHBondContact OD1-N 2.73Å; D7-S9 VanDerWaalsContact OD1-N 3.1Å; D7-S9 PolarHBondContact OD1-OG 3.1Å; S9-Q11 PolarHBondContact O-N 3.29Å
10	P	46.3	Very low	58.9	Low	129 Å²	129	136.1 Å²	136.1	84%	0.838	68%	0.675	S	S	*	*			trans	-92	86.9	-176	35.1	-29.1	0	0	0	110.6	K8	K8-P10 VanDerWaalsContact O-CD 3.29Å; K8-P10 WeakPolarHBondContact O-CD 3.45Å
11	Q	49.9	Very low	59.8	Low	170 Å²	170	129.9 Å²	129.9	79%	0.794	64%	0.644	S	S	*	*			trans	-120.6	8.5	-176.9	-69.8	-151.5	-4.8	0	0	116.4	S9	S9-Q11 PolarHBondContact O-N 3.29Å
12	Y	44	Very low	61	Low	225 Å²	225	124.1 Å²	124.1	88%	0.882	61%	0.612	S	S	*	*	S	Bend	trans	-120.5	38.2	-165.6	-140.9	-92.7	0	0	0	116.8
13	R	50.1	Low	61.9	Low	194 Å²	194	117.5 Å²	117.5	73%	0.732	59%	0.592	S	S	*	*	S	Bend	trans	-137.6	-17.1	174.2	-87.9	-143.4	-171.3	-171.2	7.2	118.4	D15 E426	R13-D15 VanDerWaalsContact C-N 3.34Å; R13-D15 PolarHBondContact O-N 3.49Å; R13-E426 PolarHBondContact NH1-O 3.48Å
14	R	52.5	Low	62.2	Low	200 Å²	200	114.9 Å²	114.9	76%	0.755	57%	0.567	S	S	*	*	T	Hydrogen-bonded Turn	trans	-70.5	-25.7	-175.4	-81.2	-172.6	168.8	127.2	0.8	114.6	S16 A18	R14-S16 VanDerWaalsContact C-N 3.27Å; R14-S16 PolarHBondContact O-N 2.96Å; R14-A18 PolarHBondContact O-N 3.39Å
15	D	58.6	Low	62.5	Low	118 Å²	118	110.6 Å²	110.6	63%	0.631	54%	0.538	S	S	*	.	H	α-helix	trans	-67	-24.1	-174.5	-62.8	-64.4	0	0	0	114.3	R13 G19	R13-D15 VanDerWaalsContact C-N 3.34Å; R13-D15 PolarHBondContact O-N 3.49Å; D15-G19 WeakPolarHBondContact O-CA 3.27Å; D15-G19 PolarHBondContact O-N 2.83Å
16	S	62.5	Low	63.6	Low	77 Å²	77	104 Å²	104	54%	0.538	52%	0.518	S	S	.	.	H	α-helix	trans	-71.9	-34.6	-176.9	-58.6	0	0	0	0	113.4	R14 R20	R14-S16 VanDerWaalsContact C-N 3.27Å; R14-S16 PolarHBondContact O-N 2.96Å; S16-R20 WeakPolarHBondContact O-CB 3.14Å; S16-R20 WeakPolarHBondContact O-CG 3.26Å; S16-R20 PolarHBondContact O-N 3.25Å; S16-R20 PolarHBondContact O-NE 3.37Å
17	A	64	Low	63.7	Low	19 Å²	19	105.5 Å²	105.5	16%	0.157	51%	0.512	C	S	.	.	H	α-helix	trans	-76.7	-51.6	174.3	0	0	0	0	0	110.6	G19 R20 L21	A17-G19 VanDerWaalsContact C-N 3.34Å; A17-G19 PolarHBondContact O-N 3.35Å; A17-R20 PolarHBondContact O-N 3.18Å; A17-L21 PolarHBondContact O-N 3Å
18	A	63.6	Low	64	Low	28 Å²	28	101.6 Å²	101.6	23%	0.231	49%	0.491	C	S	.	.	H	α-helix	trans	-61.1	-38.6	-180	0	0	0	0	0	112.8	R14 L21 K22	R14-A18 PolarHBondContact O-N 3.39Å; A18-L21 PolarHBondContact O-N 3.41Å; A18-K22 WeakPolarHBondContact O-CB 3.48Å; A18-K22 WeakPolarHBondContact O-CD 3.42Å; A18-K22 WeakPolarHBondContact O-CG 3.41Å; A18-K22 PolarHBondContact O-N 3.47Å
19	G	73.3	Confident	64.8	Low	37 Å²	37	96.5 Å²	96.5	38%	0.381	47%	0.472	S	S	.	.	H	α-helix	trans	-66.8	-43.4	175.8	0	0	0	0	0	113	D15 A17 L21 K22 Q23	D15-G19 WeakPolarHBondContact O-CA 3.27Å; D15-G19 PolarHBondContact O-N 2.83Å; A17-G19 VanDerWaalsContact C-N 3.34Å; A17-G19 PolarHBondContact O-N 3.35Å; G19-L21 VanDerWaalsContact C-N 3.35Å; G19-K22 PolarHBondContact O-N 2.88Å; G19-Q23 WeakPolarHBondContact O-CB 3.36Å; G19-Q23 PolarHBondContact O-N 3.48Å
20	R	76.6	Confident	66.1	Low	116 Å²	116	97.5 Å²	97.5	44%	0.438	48%	0.475	S	S	.	.	H	α-helix	trans	-60.9	-43.5	174	-77	-176	-74.1	177.5	4.7	110.9	S16 A17 R24 E426	S16-R20 WeakPolarHBondContact O-CB 3.14Å; S16-R20 WeakPolarHBondContact O-CG 3.26Å; S16-R20 PolarHBondContact O-N 3.25Å; S16-R20 PolarHBondContact O-NE 3.37Å; A17-R20 PolarHBondContact O-N 3.18Å; R20-R24 PolarHBondContact O-N 2.9Å; R20-R24 VanDerWaalsContact O-N 3.11Å; R20-E426 IonicContact CZ-OE2 3.78Å; R20-E426 IonicContact NH1-OE2 3.18Å; R20-E426 PolarHBondContact NH1-OE2 2.89Å; R20-E426 IonicContact NH2-OE2 3.37Å; R20-E426 PolarHBondContact NH2-OE2 3.24Å
21	L	77.4	Confident	66.7	Low	5 Å²	5	102.2 Å²	102.2	3%	0.026	48%	0.476	C	S	.	.	H	α-helix	trans	-63.2	-51.6	175.3	175.8	61.4	0	0	0	112	A17 A18 G19 Q23 R24 L25 F415 E416 W419	A17-L21 PolarHBondContact O-N 3Å; A18-L21 PolarHBondContact O-N 3.41Å; G19-L21 VanDerWaalsContact C-N 3.35Å; L21-Q23 VanDerWaalsContact C-N 3.28Å; L21-Q23 PolarHBondContact O-N 3.04Å; L21-R24 CarbonylContact O-C 3.57Å; L21-R24 WeakPolarHBondContact O-CA 3.2Å; L21-R24 PolarHBondContact O-N 3.36Å; L21-L25 HydrophobicContact CD1-CD1 3.85Å; L21-L25 HydrophobicContact CD1-CD2 4.21Å; L21-L25 HydrophobicContact CD1-CG 3.69Å; L21-L25 HydrophobicContact CD2-CD1 4.32Å; L21-L25 HydrophobicContact CG-CD1 3.81Å; L21-L25 HydrophobicContact CG-CG 4.09Å; L21-L25 PolarHBondContact O-N 2.8Å; L21-F415 HydrophobicContact CD1-CD1 4.34Å; L21-F415 HydrophobicContact CD1-CE1 3.9Å; L21-E416 HydrophobicContact CD2-CB 3.92Å; L21-E416 HydrophobicContact CD2-CG 3.67Å; L21-W419 HydrophobicContact CD1-CB 4.25Å; L21-W419 HydrophobicContact CD1-CD2 3.71Å; L21-W419 HydrophobicContact CD1-CE3 4.16Å; L21-W419 HydrophobicContact CD1-CG 3.7Å; L21-W419 HydrophobicContact CD2-CB 4.11Å; L21-W419 HydrophobicContact CD2-CG 4.04Å; L21-W419 HydrophobicContact CG-CG 4.31Å
22	K	77.3	Confident	67	Low	125 Å²	125	97.2 Å²	97.2	54%	0.543	46%	0.46	S	S	.	.	H	α-helix	trans	-56.5	-41.4	179.5	-74.5	164.3	-173.5	172.7	0	112.1	A18 G19 A26	A18-K22 WeakPolarHBondContact O-CB 3.48Å; A18-K22 WeakPolarHBondContact O-CD 3.42Å; A18-K22 WeakPolarHBondContact O-CG 3.41Å; A18-K22 PolarHBondContact O-N 3.47Å; G19-K22 PolarHBondContact O-N 2.88Å; K22-A26 WeakPolarHBondContact O-CB 3.5Å; K22-A26 PolarHBondContact O-N 3.26Å
23	Q	78.8	Confident	67	Low	112 Å²	112	91.5 Å²	91.5	52%	0.523	45%	0.448	S	S	.	.	H	α-helix	trans	-65.9	-36.1	175.2	-165.9	-171.9	63.6	0	0	112.6	G19 L21 R27	G19-Q23 WeakPolarHBondContact O-CB 3.36Å; G19-Q23 PolarHBondContact O-N 3.48Å; L21-Q23 VanDerWaalsContact C-N 3.28Å; L21-Q23 PolarHBondContact O-N 3.04Å; Q23-R27 VanDerWaalsContact CD-NH2 3.35Å; Q23-R27 WeakPolarHBondContact O-CG 3.19Å; Q23-R27 PolarHBondContact O-N 2.93Å
24	R	73.4	Confident	66.4	Low	81 Å²	81	87.4 Å²	87.4	31%	0.306	45%	0.448	S	S	.	.	H	α-helix	trans	-72.7	-47.4	175.8	-78.9	-177.3	169.6	162.6	-1.7	112.6	R20 L21 A26 R27 I28 V389 E393 W419	R20-R24 PolarHBondContact O-N 2.9Å; R20-R24 VanDerWaalsContact O-N 3.11Å; L21-R24 CarbonylContact O-C 3.57Å; L21-R24 WeakPolarHBondContact O-CA 3.2Å; L21-R24 PolarHBondContact O-N 3.36Å; R24-A26 VanDerWaalsContact C-N 3.26Å; R24-A26 PolarHBondContact O-N 2.94Å; R24-R27 WeakPolarHBondContact O-CA 3.41Å; R24-R27 WeakPolarHBondContact O-CB 3.39Å; R24-R27 PolarHBondContact O-N 3.24Å; R24-I28 WeakPolarHBondContact O-CG1 3.27Å; R24-I28 PolarHBondContact O-N 3.42Å; R24-V389 VanDerWaalsContact CZ-CG1 3.49Å; R24-E393 WeakPolarHBondContact CD-OE1 3.34Å; R24-E393 IonicContact NE-OE1 2.59Å; R24-W419 VanDerWaalsContact NH1-CZ2 3.35Å
25	L	77.3	Confident	65.6	Low	22 Å²	22	83.8 Å²	83.8	12%	0.115	45%	0.449	C	S	.	.	H	α-helix	trans	-55.5	-42.8	173.7	-70.7	178.2	0	0	0	111.4	L21 R27 I28 L29 L396 L412 F415	L21-L25 HydrophobicContact CD1-CD1 3.85Å; L21-L25 HydrophobicContact CD1-CD2 4.21Å; L21-L25 HydrophobicContact CD1-CG 3.69Å; L21-L25 HydrophobicContact CD2-CD1 4.32Å; L21-L25 HydrophobicContact CG-CD1 3.81Å; L21-L25 HydrophobicContact CG-CG 4.09Å; L21-L25 PolarHBondContact O-N 2.8Å; L25-R27 PolarHBondContact O-N 2.96Å; L25-I28 HydrophobicContact CD2-CD1 4.43Å; L25-I28 PolarHBondContact O-N 2.96Å; L25-L29 WeakPolarHBondContact O-CB 3.34Å; L25-L29 VanDerWaalsContact O-CG 3.28Å; L25-L29 WeakPolarHBondContact O-CG 3.49Å; L25-L29 PolarHBondContact O-N 3.49Å; L25-L396 HydrophobicContact CD2-CD2 3.46Å; L25-L396 VanDerWaalsContact CD2-CD2 3.46Å; L25-L412 HydrophobicContact CD2-CD2 4.09Å; L25-F415 HydrophobicContact CD2-CD1 3.91Å; L25-F415 HydrophobicContact CD2-CE1 3.82Å
26	A	78.8	Confident	64.8	Low	51 Å²	51	83.6 Å²	83.6	42%	0.421	45%	0.452	S	S	.	.	H	α-helix	trans	-57.1	-46.3	173.1	0	0	0	0	0	112	K22 R24 T30	K22-A26 WeakPolarHBondContact O-CB 3.5Å; K22-A26 PolarHBondContact O-N 3.26Å; R24-A26 VanDerWaalsContact C-N 3.26Å; R24-A26 PolarHBondContact O-N 2.94Å; A26-T30 WeakPolarHBondContact O-CB 3.33Å; A26-T30 PolarHBondContact O-N 2.99Å; A26-T30 PolarHBondContact O-OG1 3.43Å
27	R	73.7	Confident	63.8	Low	137 Å²	137	87.2 Å²	87.2	52%	0.517	47%	0.465	S	S	.	.	H	α-helix	trans	-62.4	-43.2	175.9	-71.1	173.8	-179.7	130.9	3.1	112.6	Q23 R24 L25 T30 R31	Q23-R27 VanDerWaalsContact CD-NH2 3.35Å; Q23-R27 WeakPolarHBondContact O-CG 3.19Å; Q23-R27 PolarHBondContact O-N 2.93Å; R24-R27 WeakPolarHBondContact O-CA 3.41Å; R24-R27 WeakPolarHBondContact O-CB 3.39Å; R24-R27 PolarHBondContact O-N 3.24Å; L25-R27 PolarHBondContact O-N 2.96Å; R27-T30 PolarHBondContact O-N 2.96Å; R27-R31 WeakPolarHBondContact O-CG 3.34Å; R27-R31 PolarHBondContact O-N 3.02Å
28	I	67.9	Low	62.7	Low	25 Å²	25	93.1 Å²	93.1	13%	0.128	49%	0.494	C	S	.	.	H	α-helix	trans	-61.9	-52	178.9	-64	161.7	0	0	0	109.7	R24 L25 T30 R31 S32 E393 L396	R24-I28 WeakPolarHBondContact O-CG1 3.27Å; R24-I28 PolarHBondContact O-N 3.42Å; L25-I28 HydrophobicContact CD2-CD1 4.43Å; L25-I28 PolarHBondContact O-N 2.96Å; I28-T30 VanDerWaalsContact C-N 3.29Å; I28-T30 PolarHBondContact O-N 2.86Å; I28-R31 PolarHBondContact O-N 3.39Å; I28-R31 VanDerWaalsContact O-N 3.08Å; I28-S32 PolarHBondContact O-N 2.51Å; I28-S32 PolarHBondContact O-OG 3.39Å; I28-S32 VanDerWaalsContact O-OG 3.12Å; I28-E393 HydrophobicContact CD1-CB 4.06Å; I28-E393 HydrophobicContact CD1-CG 3.65Å; I28-E393 HydrophobicContact CG1-CG 4.42Å; I28-L396 HydrophobicContact CD1-CD2 4.26Å; I28-L396 HydrophobicContact CG2-CD2 4.47Å
29	L	71.6	Confident	61.3	Low	76 Å²	76	96.9 Å²	96.9	40%	0.398	53%	0.525	S	S	.	.	H	α-helix	trans	-62.9	-33.2	179.3	-66.1	173.1	0	0	0	112.8	L25 S32 L400	L25-L29 WeakPolarHBondContact O-CB 3.34Å; L25-L29 VanDerWaalsContact O-CG 3.28Å; L25-L29 WeakPolarHBondContact O-CG 3.49Å; L25-L29 PolarHBondContact O-N 3.49Å; L29-S32 WeakPolarHBondContact CA-OG 3.11Å; L29-S32 PolarHBondContact O-OG 3.3Å; L29-L400 HydrophobicContact CD2-CD1 4.39Å
30	T	70.4	Confident	59.7	Low	100 Å²	100	99 Å²	99	61%	0.613	54%	0.54	S	S	*	.	H	α-helix	trans	-71.1	-32.9	174.7	-48.8	0	0	0	0	112.2	A26 R27 I28 T33	A26-T30 WeakPolarHBondContact O-CB 3.33Å; A26-T30 PolarHBondContact O-N 2.99Å; A26-T30 PolarHBondContact O-OG1 3.43Å; R27-T30 PolarHBondContact O-N 2.96Å; I28-T30 VanDerWaalsContact C-N 3.29Å; I28-T30 PolarHBondContact O-N 2.86Å; T30-T33 PolarHBondContact O-OG1 3.29Å
31	R	60.1	Low	57.7	Low	228 Å²	228	98.4 Å²	98.4	86%	0.86	56%	0.559	S	S	*	*	H	α-helix	trans	-82.1	-23.9	177	-66.9	180	96.9	-167.9	6.4	112.9	R27 I28 T33	R27-R31 WeakPolarHBondContact O-CG 3.34Å; R27-R31 PolarHBondContact O-N 3.02Å; I28-R31 PolarHBondContact O-N 3.39Å; I28-R31 VanDerWaalsContact O-N 3.08Å; R31-T33 VanDerWaalsContact C-N 3.3Å; R31-T33 PolarHBondContact O-N 3.38Å
32	S	56.5	Low	55.9	Low	65 Å²	65	102.6 Å²	102.6	46%	0.455	59%	0.594	S	S	.	*	T	Hydrogen-bonded Turn	trans	-91.3	24.2	177.4	66.6	0	0	0	0	113.5	I28 L29 C34	I28-S32 PolarHBondContact O-N 2.51Å; I28-S32 PolarHBondContact O-OG 3.39Å; I28-S32 VanDerWaalsContact O-OG 3.12Å; L29-S32 WeakPolarHBondContact CA-OG 3.11Å; L29-S32 PolarHBondContact O-OG 3.3Å; S32-C34 VanDerWaalsContact C-N 3.25Å; S32-C34 PolarHBondContact O-N 2.91Å
33	T	44	Very low	54.3	Low	105 Å²	105	101.6 Å²	101.6	64%	0.644	60%	0.603	S	S	*	*			trans	-65.5	89.3	166.3	52.8	0	0	0	0	109.1	T30 R31 T35	T30-T33 PolarHBondContact O-OG1 3.29Å; R31-T33 VanDerWaalsContact C-N 3.3Å; R31-T33 PolarHBondContact O-N 3.38Å; T33-T35 PolarHBondContact O-N 2.8Å; T33-T35 VanDerWaalsContact O-N 3.15Å
34	C	37.2	Very low	52.7	Low	108 Å²	108	102.2 Å²	102.2	73%	0.73	62%	0.62	S	S	*	*			trans	-55	119	169.7	50.4	0	0	0	0	109	S32 T36	S32-C34 VanDerWaalsContact C-N 3.25Å; S32-C34 PolarHBondContact O-N 2.91Å; C34-T36 PolarHBondContact O-N 3.3Å
35	T	35.9	Very low	51.2	Low	124 Å²	124	102.3 Å²	102.3	76%	0.761	65%	0.646	S	S	*	*			trans	-61	100.7	170.3	47.6	0	0	0	0	108.2	T33 N37	T33-T35 PolarHBondContact O-N 2.8Å; T33-T35 VanDerWaalsContact O-N 3.15Å; T35-N37 PolarHBondContact O-N 3.46Å; T35-N37 VanDerWaalsContact O-N 3.11Å
36	T	40.7	Very low	49.3	Very low	115 Å²	115	104.7 Å²	104.7	71%	0.706	68%	0.676	S	S	*	*			trans	-62.2	114.9	172.2	47.9	0	0	0	0	108.2	C34 N38	C34-T36 PolarHBondContact O-N 3.3Å; T36-N38 PolarHBondContact O-N 3.32Å
37	N	41.7	Very low	47.7	Very low	153 Å²	153	109 Å²	109	82%	0.818	70%	0.697	S	S	*	*			trans	-67.9	72.7	176.6	-79.2	-21	0	0	0	111.3	T35 A39	T35-N37 PolarHBondContact O-N 3.46Å; T35-N37 VanDerWaalsContact O-N 3.11Å; N37-A39 VanDerWaalsContact C-N 3.3Å; N37-A39 PolarHBondContact O-N 3.21Å
38	N	41.8	Very low	46.1	Very low	143 Å²	143	106.6 Å²	106.6	77%	0.765	71%	0.707	S	S	*	*			trans	-80.9	86.7	155.9	-82.7	-2.3	0	0	0	107.5	T36 A40	T36-N38 PolarHBondContact O-N 3.32Å; N38-A40 PolarHBondContact O-N 2.94Å
39	A	33.7	Very low	44.9	Very low	107 Å²	107	112.2 Å²	112.2	88%	0.884	74%	0.742	S	S	*	*			trans	-68.7	79.7	166.2	0	0	0	0	0	109.2	N37	N37-A39 VanDerWaalsContact C-N 3.3Å; N37-A39 PolarHBondContact O-N 3.21Å
40	A	38.5	Very low	43.4	Very low	82 Å²	82	113.1 Å²	113.1	68%	0.678	76%	0.76	S	S	*	*			trans	-136.6	94.2	-179.6	0	0	0	0	0	110.4	N38	N38-A40 PolarHBondContact O-N 2.94Å
41	A	36.3	Very low	41.8	Very low	103 Å²	103	115.2 Å²	115.2	85%	0.851	77%	0.774	S	S	*	*			trans	44.2	136.2	149	0	0	0	0	0	122.2
42	A	39	Very low	40.9	Very low	92 Å²	92	109 Å²	109	76%	0.76	77%	0.771	S	S	*	*			trans	98.2	114.3	144.4	0	0	0	0	0	120.2
43	S	42.8	Very low	39.8	Very low	105 Å²	105	115.8 Å²	115.8	73%	0.734	79%	0.793	S	S	*	*			trans	56.8	98.5	139.5	58.9	0	0	0	0	120.6
44	S	45.2	Very low	39.8	Very low	125 Å²	125	117.2 Å²	117.2	87%	0.874	80%	0.801	S	S	*	*				29.5	108.3	120.1	60.6	0	0	0	0	119
45	G	42.4	Very low	39.7	Very low	83 Å²	83	117.1 Å²	117.1	86%	0.856	80%	0.801	S	S	*	*			trans	-179.6	118.9	164.4	0	0	0	0	0	110
46	G	38.1	Very low	39.5	Very low	71 Å²	71	119.6 Å²	119.6	73%	0.732	81%	0.809	S	S	*	*			trans	-90.5	-170	-170.7	0	0	0	0	0	115.6
47	T	44.2	Very low	39.5	Very low	141 Å²	141	118.8 Å²	118.8	87%	0.865	81%	0.814	S	S	*	*			trans	63.7	80.4	164.1	58.4	0	0	0	0	118.4
48	A	41.1	Very low	39.2	Very low	88 Å²	88	119.9 Å²	119.9	73%	0.727	81%	0.812	S	S	*	*				47.9	140.2	113.5	0	0	0	0	0	122.4
49	T	41.4	Very low	39.6	Very low	142 Å²	142	119.8 Å²	119.8	87%	0.871	82%	0.817	S	S	*	*			trans	88.5	158.4	157.8	76.5	0	0	0	0	119.3
50	A	41.3	Very low	39.9	Very low	95 Å²	95	121.4 Å²	121.4	79%	0.785	81%	0.81	S	S	*	*			trans	77.3	97.4	173.3	0	0	0	0	0	118.3
51	T	35.4	Very low	40.2	Very low	145 Å²	145	125.4 Å²	125.4	89%	0.89	82%	0.82	S	S	*	*			trans	-60	134.5	156	48.4	0	0	0	0	112.6
52	A	41.9	Very low	40.4	Very low	98 Å²	98	123.8 Å²	123.8	81%	0.81	81%	0.807	S	S	*	*			trans	-157.5	128.3	150.4	0	0	0	0	0	111.4
53	F	32.9	Very low	40.9	Very low	206 Å²	206	127.4 Å²	127.4	90%	0.904	81%	0.808	S	S	*	*			trans	-69.9	154.1	158.6	-76	-108.9	0	0	0	109.2
54	V	44.1	Very low	41	Very low	135 Å²	135	128.9 Å²	128.9	82%	0.818	81%	0.812	S	S	*	*				-171.2	127.1	129.3	139.1	0	0	0	0	112.3
55	S	35.2	Very low	40.6	Very low	106 Å²	106	127.7 Å²	127.7	74%	0.741	81%	0.81	S	S	*	*			trans	39.7	122.3	148.5	-50.3	0	0	0	0	123.4
56	L	31.7	Very low	40.6	Very low	176 Å²	176	128.9 Å²	128.9	92%	0.921	81%	0.812	S	S	*	*			trans	-52.2	130.3	149.3	-176.2	74	0	0	0	112
57	A	41.4	Very low	40.8	Very low	99 Å²	99	131 Å²	131	82%	0.818	82%	0.816	S	S	*	*			trans	-134.6	137.8	163.5	0	0	0	0	0	110.2
58	K	34.9	Very low	41	Very low	176 Å²	176	129.7 Å²	129.7	77%	0.765	81%	0.812	S	S	*	*			trans	-118.2	126	-169.7	168.1	173.4	179.7	164.8	0	110.2
59	T	49.7	Very low	41.4	Very low	141 Å²	141	130.7 Å²	130.7	87%	0.865	81%	0.814	S	S	*	*			trans	-141.3	142.7	156.9	46.7	0	0	0	0	110.4
60	N	41.4	Very low	41.4	Very low	141 Å²	141	132.4 Å²	132.4	75%	0.754	81%	0.812	S	S	*	*			trans	-91.7	148.5	169.9	-38.3	-66.5	0	0	0	108.2
61	N	44.1	Very low	41.9	Very low	165 Å²	165	133.4 Å²	133.4	88%	0.882	81%	0.81	S	S	*	*				-153.3	158.3	128.8	-141.8	-12.3	0	0	0	112.5
62	A	40.3	Very low	42	Very low	69 Å²	69	135 Å²	135	57%	0.57	81%	0.808	S	S	*	*			trans	-99.9	-172.2	-172	0	0	0	0	0	113
63	H	49.2	Very low	42.5	Very low	168 Å²	168	135.6 Å²	135.6	78%	0.778	80%	0.803	S	S	*	*			trans	78.7	138.2	177.6	-50.8	-80.2	0	0	0	114.1
64	T	44.3	Very low	43	Very low	136 Å²	136	134.7 Å²	134.7	83%	0.834	80%	0.802	S	S	*	*			cis	-150.2	161	11.9	-16.1	0	0	0	0	111.3
65	A	36.9	Very low	43.6	Very low	100 Å²	100	132.5 Å²	132.5	83%	0.826	80%	0.798	S	S	*	*			trans	-81.1	145.9	-177.3	0	0	0	0	0	114
66	A	44.3	Very low	44.7	Very low	108 Å²	108	133 Å²	133	89%	0.893	80%	0.799	S	S	*	*			trans	-153.7	142.8	151.9	0	0	0	0	0	110
67	S	42.2	Very low	45.7	Very low	117 Å²	117	130.6 Å²	130.6	82%	0.818	79%	0.793	S	S	*	*			trans	-96.8	139.3	-168.9	51.9	0	0	0	0	114.3
68	S	48.5	Very low	46.1	Very low	112 Å²	112	129.9 Å²	129.9	78%	0.783	78%	0.782	S	S	*	*			trans	-170.1	130.3	141.2	42.5	0	0	0	0	114.6
69	S	49	Very low	46.9	Very low	110 Å²	110	127.2 Å²	127.2	77%	0.769	78%	0.783	S	S	*	*			trans	37.5	112.2	151.3	54.2	0	0	0	0	121.6
70	H	40.2	Very low	46.5	Very low	178 Å²	178	129.1 Å²	129.1	82%	0.824	78%	0.776	S	S	*	*			trans	-53.5	149.3	158.9	-89.8	-103.8	0	0	0	113.6
71	P	52.4	Low	46.5	Very low	116 Å²	116	131.9 Å²	131.9	75%	0.753	78%	0.782	S	S	*	*				-117.1	156	112.4	34.1	-33.3	0	0	0	112.4
72	E	37.4	Very low	46.2	Very low	178 Å²	178	129.2 Å²	129.2	83%	0.832	77%	0.774	S	S	*	*	P	Polyproline II helix	trans	-65.3	137.2	175.2	-93.5	-155.5	124.3	0	0	112.7
73	P	52.9	Low	46.4	Very low	110 Å²	110	131.1 Å²	131.1	71%	0.714	78%	0.779	S	S	*	*	P	Polyproline II helix	trans	-88.8	119.1	155.8	32.6	-25.9	0	0	0	110
74	E	43.9	Very low	46	Very low	187 Å²	187	128.3 Å²	128.3	87%	0.874	78%	0.776	S	S	*	*	P	Polyproline II helix	trans	-54.7	140.7	172	-88.5	-154.4	132.5	0	0	111.7
75	A	55.4	Low	45.7	Very low	90 Å²	90	127.2 Å²	127.2	74%	0.744	77%	0.773	S	S	*	*	P	Polyproline II helix	trans	-67.6	132	177.7	0	0	0	0	0	111
76	P	57.7	Low	45.8	Very low	117 Å²	117	128 Å²	128	76%	0.76	77%	0.767	S	S	*	*	P	Polyproline II helix	trans	-64.6	138.1	177.9	26.6	-34.1	0	0	0	110.6	S78	P76-S78 PolarHBondContact O-N 2.59Å
77	P	54.7	Low	45.6	Very low	124 Å²	124	132.5 Å²	132.5	81%	0.805	76%	0.763	S	S	*	*	P	Polyproline II helix	trans	-61.4	131.2	178	25.2	-33.6	0	0	0	110.3
78	S	49.5	Very low	45.2	Very low	84 Å²	84	134.1 Å²	134.1	59%	0.587	76%	0.762	S	S	*	*	P	Polyproline II helix	trans	-62.7	132.5	-173.4	64.8	0	0	0	0	112.1	P76 Y80	P76-S78 PolarHBondContact O-N 2.59Å; S78-Y80 PolarHBondContact O-N 3.15Å
79	P	50.6	Low	44.8	Very low	121 Å²	121	138.1 Å²	138.1	79%	0.786	76%	0.761	S	S	*	*	S	Bend	trans	-80.5	59.5	-178.6	35.1	-37	0	0	0	111.6
80	Y	41.7	Very low	44.1	Very low	181 Å²	181	141.6 Å²	141.6	71%	0.71	77%	0.765	S	S	*	*			trans	-126.8	43.1	-178.1	-67.8	-61.8	0	0	0	113.3	S78	S78-Y80 PolarHBondContact O-N 3.15Å
81	F	40.6	Very low	43.9	Very low	199 Å²	199	143.9 Å²	143.9	87%	0.873	77%	0.767	S	S	*	*			trans	-131.5	94.2	155.8	-81.6	-80.7	0	0	0	108.7	T83	F81-T83 PolarHBondContact O-N 3.33Å
82	C	38.8	Very low	43.3	Very low	108 Å²	108	143.9 Å²	143.9	73%	0.73	77%	0.767	S	S	*	*			trans	-66.6	113.1	167.3	-174.7	0	0	0	0	107.7
83	T	44.5	Very low	43.3	Very low	110 Å²	110	145.2 Å²	145.2	68%	0.675	77%	0.77	S	S	*	*			trans	-61.4	136.2	168.6	36.5	0	0	0	0	108.9	F81 C85	F81-T83 PolarHBondContact O-N 3.33Å; T83-C85 PolarHBondContact O-N 3.41Å
84	P	41.3	Very low	43	Very low	109 Å²	109	144.6 Å²	144.6	71%	0.708	77%	0.774	S	S	*	*			trans	-64.3	116.2	175.3	26.6	-32.5	0	0	0	108.6	T86	P84-T86 VanDerWaalsContact C-N 3.25Å; P84-T86 PolarHBondContact O-N 3.49Å
85	C	37.7	Very low	43.2	Very low	113 Å²	113	143 Å²	143	76%	0.764	77%	0.771	S	S	*	*			trans	-67	85	172.6	-69.9	0	0	0	0	110	T83 Y87	T83-C85 PolarHBondContact O-N 3.41Å; C85-Y87 VanDerWaalsContact C-N 3.28Å; C85-Y87 PolarHBondContact O-N 3.32Å
86	T	38.7	Very low	42.6	Very low	115 Å²	115	150.4 Å²	150.4	71%	0.706	78%	0.78	S	S	*	*			trans	-71.1	87.6	165.5	51.7	0	0	0	0	108.4	P84 D88	P84-T86 VanDerWaalsContact C-N 3.25Å; P84-T86 PolarHBondContact O-N 3.49Å; T86-D88 PolarHBondContact O-N 3.46Å
87	Y	39.4	Very low	41.8	Very low	204 Å²	204	147.6 Å²	147.6	80%	0.8	77%	0.773	S	S	*	*			trans	-77.9	99.6	170.3	-122	-88.4	0	0	0	108.8	C85 Y89	C85-Y87 VanDerWaalsContact C-N 3.28Å; C85-Y87 PolarHBondContact O-N 3.32Å; Y87-Y89 PolarHBondContact O-N 3.49Å
88	D	35	Very low	41.4	Very low	150 Å²	150	148.8 Å²	148.8	80%	0.802	78%	0.777	S	S	*	*			trans	-68.4	93.9	172.5	-82.5	-60.9	0	0	0	110.2	T86 E90	T86-D88 PolarHBondContact O-N 3.46Å; D88-E90 PolarHBondContact O-N 3.35Å
89	Y	38.7	Very low	41.1	Very low	196 Å²	196	156 Å²	156	77%	0.769	79%	0.792	S	S	*	*			trans	-77.4	96.7	169.1	-119.1	-82.8	0	0	0	109.3	Y87 R91	Y87-Y89 PolarHBondContact O-N 3.49Å; Y89-R91 PolarHBondContact O-N 3.44Å
90	E	34.2	Very low	40.8	Very low	184 Å²	184	155.2 Å²	155.2	86%	0.86	79%	0.787	S	S	*	*			trans	-55.1	108.1	167.6	-92	-98.8	108.5	0	0	109.3	D88 P92	D88-E90 PolarHBondContact O-N 3.35Å; E90-P92 WeakPolarHBondContact O-CD 3.22Å
91	R	37.1	Very low	40.8	Very low	225 Å²	225	158.8 Å²	158.8	85%	0.849	80%	0.799	S	S	*	*			trans	-78.3	118.3	-176.9	-170.2	-177.6	-168.3	-147.9	5.3	109.6	Y89 K93	Y89-R91 PolarHBondContact O-N 3.44Å; R91-K93 PolarHBondContact O-N 2.79Å
92	P	39.6	Very low	41.1	Very low	117 Å²	117	160.2 Å²	160.2	76%	0.76	80%	0.799	S	S	*	*			trans	-57.2	129.2	179.7	-25.4	34.9	0	0	0	111.4	E90 A94	E90-P92 WeakPolarHBondContact O-CD 3.22Å; P92-A94 PolarHBondContact O-N 3.28Å
93	K	38	Very low	41.3	Very low	205 Å²	205	159.8 Å²	159.8	89%	0.891	80%	0.797	S	S	*	*			trans	-71.6	101	176	-72.2	175.9	-176.2	164.2	0	108.8	R91 D95	R91-K93 PolarHBondContact O-N 2.79Å; K93-D95 PolarHBondContact O-N 2.98Å; K93-D95 VanDerWaalsContact O-N 3.1Å
94	A	45.6	Very low	41.5	Very low	97 Å²	97	166.3 Å²	166.3	80%	0.802	81%	0.809	S	S	*	*			trans	-63	110.7	174.8	0	0	0	0	0	110.8	P92	P92-A94 PolarHBondContact O-N 3.28Å
95	D	48	Very low	41.8	Very low	153 Å²	153	166.9 Å²	166.9	82%	0.818	81%	0.81	S	S	*	*			trans	-65.9	151.1	169.5	-170.1	18.7	0	0	0	110.7	K93 G97	K93-D95 PolarHBondContact O-N 2.98Å; K93-D95 VanDerWaalsContact O-N 3.1Å; D95-G97 PolarHBondContact O-N 3.11Å
96	R	42.5	Very low	42.5	Very low	247 Å²	247	172 Å²	172	93%	0.932	81%	0.814	S	S	*	*			trans	-82.3	63.7	-174.4	-75.7	-172.7	172.2	-169.3	0.4	112
97	G	41.6	Very low	42.9	Very low	58 Å²	58	171.3 Å²	171.3	60%	0.598	81%	0.814	S	S	*	*	P	Polyproline II helix	trans	-84.9	145.3	167.9	0	0	0	0	0	113.5	D95 R99	D95-G97 PolarHBondContact O-N 3.11Å; G97-R99 PolarHBondContact O-N 3.03Å
98	T	47.1	Very low	43.6	Very low	148 Å²	148	161.9 Å²	161.9	91%	0.908	78%	0.778	S	S	*	*	P	Polyproline II helix	trans	-50.9	127.3	-177.1	-49.6	0	0	0	0	113.8
99	R	43	Very low	44.5	Very low	237 Å²	237	156.3 Å²	156.3	89%	0.894	75%	0.751	S	S	*	*	P	Polyproline II helix	trans	-78.1	128.1	-175.2	-66.1	-179	173.7	-154.3	-3.1	113.7	G97	G97-R99 PolarHBondContact O-N 3.03Å
100	P	44.1	Very low	45.4	Very low	104 Å²	104	147.8 Å²	147.8	68%	0.675	72%	0.718	S	S	*	*	P	Polyproline II helix	trans	-75.3	154.7	153.6	32.2	-32	0	0	0	110.6	R102	P100-R102 PolarHBondContact O-N 3.08Å
101	R	42	Very low	46.3	Very low	256 Å²	256	139.7 Å²	139.7	97%	0.966	68%	0.681	S	S	*	*			trans	-71	82.9	176.2	-80.6	178.7	158.2	-177.1	-5.3	110.9	S103	R101-S103 PolarHBondContact O-N 3.36Å
102	R	46.1	Very low	47.1	Very low	229 Å²	229	131.3 Å²	131.3	86%	0.864	65%	0.652	S	S	*	*			trans	-64.7	125.5	172.2	-80.1	-169.7	173.6	-171	-2.1	111.1	P100	P100-R102 PolarHBondContact O-N 3.08Å
103	S	43.2	Very low	47.6	Very low	99 Å²	99	125.8 Å²	125.8	69%	0.692	62%	0.616	S	S	*	*			trans	-55.3	143.6	163.8	-176	0	0	0	0	109.9	R101 T105	R101-S103 PolarHBondContact O-N 3.36Å; S103-T105 PolarHBondContact O-N 2.91Å; S103-T105 VanDerWaalsContact O-N 3.08Å
104	R	47.9	Very low	47.7	Very low	247 Å²	247	118.7 Å²	118.7	93%	0.932	59%	0.592	S	S	*	*			trans	-83	66.2	173	-80.7	178.7	162	167.9	-6.6	110.3
105	T	48.5	Very low	47.9	Very low	120 Å²	120	115.7 Å²	115.7	74%	0.736	56%	0.563	S	S	*	*			trans	-68.3	126.7	154.4	33.1	0	0	0	0	107.7	S103	S103-T105 PolarHBondContact O-N 2.91Å; S103-T105 VanDerWaalsContact O-N 3.08Å
106	R	51.5	Low	47.3	Very low	222 Å²	222	115.2 Å²	115.2	84%	0.838	56%	0.561	S	S	*	*			trans	-68.5	140.9	169.4	-71.4	178.2	168.9	-164	-3	107.3	A108	R106-A108 PolarHBondContact O-N 3.38Å
107	S	48.1	Very low	47.1	Very low	100 Å²	100	106.8 Å²	106.8	70%	0.699	54%	0.539	S	S	*	.			trans	-80.6	113.4	176.9	-53.7	0	0	0	0	109.1	S109	S107-S109 PolarHBondContact O-N 3.42Å
108	A	54.6	Low	46.9	Very low	6 Å²	6	109.3 Å²	109.3	5%	0.05	54%	0.543	C	S	.	.	P	Polyproline II helix	trans	-49.7	117.5	177.3	0	0	0	0	0	111.9	R106 G359 M380 E383 R384	R106-A108 PolarHBondContact O-N 3.38Å; A108-G359 WeakPolarHBondContact O-CA 3.4Å; A108-M380 HydrophobicContact CB-SD 3.82Å; A108-E383 WeakPolarHBondContact CA-OE2 3.49Å; A108-E383 HydrophobicContact CB-CB 4.04Å; A108-E383 WeakPolarHBondContact CB-OE2 3.1Å; A108-E383 PolarHBondContact N-OE2 3.37Å; A108-R384 HydrophobicContact CB-CG 4.46Å; A108-R384 PolarHBondContact O-NH2 2.96Å
109	S	54.2	Low	46.2	Very low	33 Å²	33	105.7 Å²	105.7	23%	0.231	54%	0.536	C	S	.	.	P	Polyproline II helix	trans	-74.5	137	174	43.6	0	0	0	0	111.5	S107 M360	S107-S109 PolarHBondContact O-N 3.42Å; S109-M360 WeakPolarHBondContact CA-O 3.24Å; S109-M360 VanDerWaalsContact CB-O 3.26Å; S109-M360 WeakPolarHBondContact CB-O 3.2Å
110	L	56.5	Low	45.7	Very low	16 Å²	16	98.4 Å²	98.4	8%	0.084	53%	0.534	C	S	.	.	P	Polyproline II helix	trans	-89.6	124.8	173.1	-179.6	53.6	0	0	0	107.8	H112 G359 M360 A361 V362 M380 Y399 L402	L110-H112 PolarHBondContact O-N 3.24Å; L110-G359 WeakPolarHBondContact CB-O 3.41Å; L110-M360 PolarHBondContact N-O 3.15Å; L110-M360 CarbonylContact O-C 3.56Å; L110-A361 CarbonylContact O-C 3.58Å; L110-A361 WeakPolarHBondContact O-CA 3.35Å; L110-V362 PolarHBondContact O-N 3.32Å; L110-M380 HydrophobicContact CD1-CE 4.01Å; L110-Y399 HydrophobicContact CD1-CD1 4.27Å; L110-Y399 HydrophobicContact CD1-CD2 4.35Å; L110-Y399 HydrophobicContact CD1-CE1 3.83Å; L110-Y399 HydrophobicContact CD1-CE2 3.92Å; L110-L402 HydrophobicContact CD2-CD1 3.34Å; L110-L402 HydrophobicContact CG-CD1 3.7Å
111	V	54	Low	45.1	Very low	15 Å²	15	98.3 Å²	98.3	9%	0.091	54%	0.542	C	S	.	.	B	Isolated β-bridge	trans	-80.6	116.7	-177	167	0	0	0	0	110.9	I113 S376 Y399	V111-I113 HydrophobicContact CG1-CD1 3.84Å; V111-I113 HydrophobicContact CG1-CG1 3.37Å; V111-S376 WeakPolarHBondContact CB-OG 3.45Å; V111-S376 WeakPolarHBondContact CG2-OG 3.49Å; V111-Y399 HydrophobicContact CB-CE1 4.42Å
112	H	52.4	Low	44.9	Very low	49 Å²	49	90.4 Å²	90.4	23%	0.227	53%	0.532	C	S	.	.			trans	-107.4	90.1	177.5	179.3	-55.5	0	0	0	108.6	L110 S114 A361 V362 V363 L402	L110-H112 PolarHBondContact O-N 3.24Å; H112-S114 PolarHBondContact CE1-OG 3.37Å; H112-S114 PolarHBondContact ND1-OG 3.28Å; H112-S114 PolarHBondContact O-N 3.26Å; H112-A361 HydrophobicContact CB-CB 3.72Å; H112-V362 CarbonylContact C-O 3.42Å; H112-V362 PolarHBondContact N-O 2.99Å; H112-V362 VanDerWaalsContact N-O 3.08Å; H112-V363 VanDerWaalsContact O-CA 3.27Å; H112-V363 WeakPolarHBondContact O-CA 3.27Å; H112-L402 PolarHBondContact CE1-O 3.16Å; H112-L402 PolarHBondContact NE2-O 3.12Å; H112-L402 VanDerWaalsContact NE2-O 3.15Å
113	I	50	Low	44.5	Very low	1 Å²	1	84.4 Å²	84.4	1%	0.005	52%	0.524	C	S	.	.			trans	-81.7	87.3	-176.2	-41.3	-168.3	0	0	0	109.9	V111 V115 K364 D372 F373 N403	V111-I113 HydrophobicContact CG1-CD1 3.84Å; V111-I113 HydrophobicContact CG1-CG1 3.37Å; I113-V115 HydrophobicContact CB-CG2 4.14Å; I113-V115 HydrophobicContact CG2-CG2 3.21Å; I113-V115 PolarHBondContact O-N 3.39Å; I113-K364 WeakPolarHBondContact CG2-O 3.28Å; I113-D372 HydrophobicContact CD1-CB 4.16Å; I113-F373 HydrophobicContact CB-CE1 4.31Å; I113-F373 HydrophobicContact CB-CZ 3.98Å; I113-F373 HydrophobicContact CD1-CD1 3.94Å; I113-F373 HydrophobicContact CD1-CD2 4.21Å; I113-F373 HydrophobicContact CD1-CE1 3.49Å; I113-F373 VanDerWaalsContact CD1-CE1 3.49Å; I113-F373 HydrophobicContact CD1-CE2 3.76Å; I113-F373 HydrophobicContact CD1-CG 4.28Å; I113-F373 HydrophobicContact CD1-CZ 3.38Å; I113-F373 HydrophobicContact CG1-CD1 4.34Å; I113-F373 HydrophobicContact CG1-CE1 3.54Å; I113-F373 HydrophobicContact CG1-CE2 4.46Å; I113-F373 HydrophobicContact CG1-CZ 3.6Å; I113-N403 WeakPolarHBondContact CA-OD1 3.47Å; I113-N403 PolarHBondContact N-OD1 2.83Å
114	S	41.6	Very low	44	Very low	56 Å²	56	84.1 Å²	84.1	39%	0.392	54%	0.537	S	S	.	.			trans	-70.5	93.8	166.5	-54.5	0	0	0	0	109.7	H112	H112-S114 PolarHBondContact CE1-OG 3.37Å; H112-S114 PolarHBondContact ND1-OG 3.28Å; H112-S114 PolarHBondContact O-N 3.26Å
115	V	49.6	Very low	43.7	Very low	33 Å²	33	82.9 Å²	82.9	20%	0.2	53%	0.533	C	S	.	.			trans	-104.7	90.1	177.6	-162.5	0	0	0	0	111.8	I113 C117 H407	I113-V115 HydrophobicContact CB-CG2 4.14Å; I113-V115 HydrophobicContact CG2-CG2 3.21Å; I113-V115 PolarHBondContact O-N 3.39Å; V115-C117 HydrophobicContact CG1-CB 3.53Å; V115-C117 WeakPolarHBondContact CG1-SG 3.49Å; V115-C117 PolarHBondContact O-N 2.7Å; V115-H407 VanDerWaalsContact CB-CE1 3.41Å; V115-H407 WeakPolarHBondContact CB-CE1 3.47Å; V115-H407 WeakPolarHBondContact CB-NE2 3.46Å; V115-H407 WeakPolarHBondContact CG2-CE1 3.27Å; V115-H407 WeakPolarHBondContact CG2-NE2 3.17Å
116	D	33.9	Very low	43	Very low	143 Å²	143	89.5 Å²	89.5	77%	0.765	54%	0.544	S	S	*	.			trans	-68	82.5	147.1	-71.4	-47.6	0	0	0	109.2
117	C	39.5	Very low	42.2	Very low	70 Å²	70	84.6 Å²	84.6	47%	0.473	54%	0.544	S	S	.	.			trans	-111.7	78.2	159.3	-79.6	0	0	0	0	108.2	V115 R406	V115-C117 HydrophobicContact CG1-CB 3.53Å; V115-C117 WeakPolarHBondContact CG1-SG 3.49Å; V115-C117 PolarHBondContact O-N 2.7Å; C117-R406 PolarHBondContact O-NH1 2.93Å; C117-R406 VanDerWaalsContact O-NH1 3.13Å; C117-R406 PolarHBondContact O-NH2 3.03Å; C117-R406 VanDerWaalsContact O-NH2 3.14Å
118	T	37.3	Very low	41.6	Very low	111 Å²	111	83.1 Å²	83.1	68%	0.681	54%	0.538	S	S	*	.			trans	-67.5	126.4	131.1	46.5	0	0	0	0	107
119	G	33	Very low	40.8	Very low	73 Å²	73	91.8 Å²	91.8	75%	0.753	58%	0.577	S	S	*	*			trans	-68.1	140.3	178.3	0	0	0	0	0	110.9	A121	G119-A121 PolarHBondContact O-N 3.29Å
120	G	30.8	Very low	40	Very low	84 Å²	84	94.7 Å²	94.7	87%	0.866	60%	0.597	S	S	*	*			trans	49.5	61.5	153.5	0	0	0	0	0	118.1
121	A	32.5	Very low	39.1	Very low	102 Å²	102	101.3 Å²	101.3	84%	0.843	63%	0.633	S	S	*	*			trans	-105.3	40.6	164.4	0	0	0	0	0	112.3	G119	G119-A121 PolarHBondContact O-N 3.29Å
122	A	36.9	Very low	38.2	Very low	90 Å²	90	104.9 Å²	104.9	74%	0.744	66%	0.664	S	S	*	*	S	Bend	trans	-113.5	125.9	173.5	0	0	0	0	0	110.2
123	S	38.6	Very low	37.6	Very low	102 Å²	102	108.3 Å²	108.3	71%	0.713	69%	0.691	S	S	*	*			trans	67.3	69.6	177.8	-157.7	0	0	0	0	116.6	R125	S123-R125 PolarHBondContact O-N 3.49Å
124	G	32.7	Very low	36.8	Very low	93 Å²	93	114.7 Å²	114.7	96%	0.959	72%	0.724	S	S	*	*			trans	-67.5	62.4	151.3	0	0	0	0	0	112.1
125	R	41.8	Very low	36.4	Very low	222 Å²	222	120 Å²	120	84%	0.838	75%	0.747	S	S	*	*			trans	-120.7	122.4	167.6	-73.8	-166.3	-178.4	-141.9	1.2	109.7	S123	S123-R125 PolarHBondContact O-N 3.49Å
126	R	33.7	Very low	36	Very low	258 Å²	258	127 Å²	127	97%	0.974	78%	0.778	S	S	*	*			trans	-56.4	131.3	-177.8	-59	163.4	-178.1	-96.9	0.1	111
127	S	33.7	Very low	36.2	Very low	119 Å²	119	128 Å²	128	83%	0.832	78%	0.777	S	S	*	*			trans	-143.5	135.4	149.3	-168.3	0	0	0	0	108.6
128	A	37	Very low	36.4	Very low	70 Å²	70	132.2 Å²	132.2	58%	0.579	79%	0.794	S	S	*	*			trans	-89.1	170.4	177.3	0	0	0	0	0	111.1
129	H	36.3	Very low	36.5	Very low	187 Å²	187	135.1 Å²	135.1	87%	0.866	81%	0.805	S	S	*	*			trans	69.8	140.5	-176.3	-46.7	-81.8	0	0	0	112.6
130	S	38.3	Very low	36.8	Very low	95 Å²	95	137.2 Å²	137.2	66%	0.664	81%	0.808	S	S	*	*			cis	-156.4	162.8	11.9	44.5	0	0	0	0	110.9
131	D	37.8	Very low	37.4	Very low	155 Å²	155	142.4 Å²	142.4	83%	0.829	81%	0.809	S	S	*	*			trans	19.7	138.8	134.3	-45.4	-48.3	0	0	0	118.9
132	A	35.7	Very low	38	Very low	90 Å²	90	146.7 Å²	146.7	74%	0.744	81%	0.812	S	S	*	*			cis	-168.1	166.7	1.4	0	0	0	0	0	108.3
133	P	38.4	Very low	38.4	Very low	121 Å²	121	148.8 Å²	148.8	79%	0.786	82%	0.815	S	S	*	*			trans	-80.2	148.4	170.8	34	-34.4	0	0	0	111.4
134	L	34.4	Very low	38.7	Very low	134 Å²	134	149.8 Å²	149.8	70%	0.702	82%	0.82	S	S	*	*			trans	177.7	108.1	147.4	-102.4	174.5	0	0	0	112.2
135	L	31.9	Very low	39.2	Very low	167 Å²	167	149.9 Å²	149.9	87%	0.874	81%	0.811	S	S	*	*			trans	-146.3	60.2	154.9	-84.2	-171.8	0	0	0	110.2
136	Q	41.5	Very low	39.8	Very low	181 Å²	181	150.9 Å²	150.9	85%	0.846	82%	0.815	S	S	*	*	S	Bend	trans	-139.9	14.9	178.4	-145.2	165.6	23.4	0	0	114.7
137	H	39.6	Very low	40.2	Very low	163 Å²	163	146.1 Å²	146.1	76%	0.755	81%	0.809	S	S	*	*			trans	-124.5	9.6	-176.5	-87.7	156	0	0	0	116.2
138	L	41.9	Very low	40.9	Very low	159 Å²	159	147.6 Å²	147.6	83%	0.832	81%	0.812	S	S	*	*	S	Bend	trans	-95.7	17.5	-177.7	-77.3	170.9	0	0	0	115.4
139	L	40.5	Very low	41.3	Very low	173 Å²	173	151.2 Å²	151.2	91%	0.906	83%	0.827	S	S	*	*	S	Bend	trans	-134.7	12.3	-175.6	-75.2	176.2	0	0	0	116.5
140	S	40	Very low	41.7	Very low	116 Å²	116	145.9 Å²	145.9	81%	0.811	82%	0.823	S	S	*	*			trans	-141.7	89.7	175.2	-77.6	0	0	0	0	113.7
141	E	41.6	Very low	41.9	Very low	193 Å²	193	144.4 Å²	144.4	90%	0.902	82%	0.822	S	S	*	*			trans	-144.6	99.8	155.8	-81.7	-155.1	133.2	0	0	110.1
142	Q	45.4	Very low	42.6	Very low	192 Å²	192	143.6 Å²	143.6	90%	0.897	82%	0.823	S	S	*	*			trans	-150.5	145.6	153.5	-72	-158.5	-2.5	0	0	111.9
143	V	45.7	Very low	43.2	Very low	134 Å²	134	147.3 Å²	147.3	81%	0.812	82%	0.822	S	S	*	*			trans	82.6	116.8	166.4	-161.5	0	0	0	0	117.8
144	P	45.9	Very low	43.9	Very low	124 Å²	124	149.7 Å²	149.7	81%	0.805	82%	0.823	S	S	*	*			trans	-95.1	173.1	-179.5	38.6	-36.4	0	0	0	115.1
145	A	42	Very low	44.8	Very low	94 Å²	94	148.4 Å²	148.4	78%	0.777	83%	0.825	S	S	*	*			trans	-72.7	162.6	-168.9	0	0	0	0	0	117.2
146	R	55.2	Low	45.6	Very low	244 Å²	244	150.4 Å²	150.4	92%	0.921	83%	0.827	S	S	*	*			trans	-141.9	135.9	155.8	-70.7	-168.9	168.4	167.4	-2.8	110.6
147	D	40.7	Very low	45.7	Very low	158 Å²	158	145.5 Å²	145.5	85%	0.845	83%	0.825	S	S	*	*			trans	-74.8	144.6	-175.3	-48.7	-98.6	0	0	0	114.1
148	V	49.5	Very low	45.8	Very low	150 Å²	150	141.9 Å²	141.9	91%	0.909	83%	0.831	S	S	*	*			trans	-144	142.7	145	169.6	0	0	0	0	110.2
149	V	45.3	Very low	45.8	Very low	146 Å²	146	138.1 Å²	138.1	89%	0.885	83%	0.832	S	S	*	*			trans	-81.1	147.8	-170.1	165.4	0	0	0	0	114.8
150	G	43.7	Very low	45.9	Very low	75 Å²	75	133.7 Å²	133.7	77%	0.773	83%	0.827	S	S	*	*			trans	136.7	134.2	154.6	0	0	0	0	0	114
151	G	42.5	Very low	46.4	Very low	63 Å²	63	139.1 Å²	139.1	65%	0.649	83%	0.83	S	S	*	*			cis	158	126.3	-7.2	0	0	0	0	0	111.8
152	T	52.4	Low	46.9	Very low	139 Å²	139	133.8 Å²	133.8	85%	0.853	81%	0.814	S	S	*	*			trans	69.7	152.5	173.4	77.9	0	0	0	0	116.3
153	K	49.1	Very low	47.2	Very low	167 Å²	167	133.4 Å²	133.4	73%	0.726	81%	0.809	S	S	*	*			cis	-160.5	147.4	-4.4	-126.5	170	-179.1	177.6	0	110.1
154	Q	53.9	Low	47.3	Very low	171 Å²	171	133.7 Å²	133.7	80%	0.799	81%	0.806	S	S	*	*			trans	35.1	137.9	143.3	-59.7	171.6	27.7	0	0	120.2
155	S	52.2	Low	47.4	Very low	107 Å²	107	132.6 Å²	132.6	75%	0.748	80%	0.797	S	S	*	*				-171.9	128.9	54	-163.9	0	0	0	0	108.4
156	K	48.9	Very low	47.5	Very low	209 Å²	209	134.6 Å²	134.6	91%	0.909	80%	0.799	S	S	*	*				83.8	117.6	71.7	-155.8	-178.2	-176.9	-179.8	0	115.1
157	G	42.8	Very low	46.9	Very low	79 Å²	79	127.5 Å²	127.5	81%	0.814	79%	0.793	S	S	*	*			trans	129.4	117.9	178	0	0	0	0	0	109.8
158	G	41.8	Very low	47	Very low	86 Å²	86	130.1 Å²	130.1	89%	0.887	79%	0.791	S	S	*	*			cis	106.7	124	19	0	0	0	0	0	109.3
159	G	41.8	Very low	46.7	Very low	81 Å²	81	128.9 Å²	128.9	84%	0.835	79%	0.789	S	S	*	*			cis	173.6	157	-6.2	0	0	0	0	0	111.3
160	G	43.8	Very low	46.9	Very low	79 Å²	79	126 Å²	126	81%	0.814	78%	0.775	S	S	*	*			trans	85.4	157.9	173.1	0	0	0	0	0	116
161	R	49.2	Very low	47.1	Very low	231 Å²	231	128.6 Å²	128.6	87%	0.872	78%	0.778	S	S	*	*			cis	-160.9	142.5	-6.8	-147.6	178.4	75	-176	3.6	111.8
162	S	52.4	Low	47	Very low	81 Å²	81	131.6 Å²	131.6	57%	0.566	79%	0.79	S	S	*	*			trans	58.3	115.7	147.3	48.2	0	0	0	0	119.9
163	K	52.9	Low	46.5	Very low	183 Å²	183	129.5 Å²	129.5	80%	0.796	79%	0.786	S	S	*	*				92.1	125.1	81.3	-157.6	179.6	-172	-178.9	0	109
164	L	46.8	Very low	46.6	Very low	140 Å²	140	127 Å²	127	73%	0.733	79%	0.79	S	S	*	*				-156.9	135	74.6	-104.3	86.2	0	0	0	109.7
165	T	47.7	Very low	46.1	Very low	102 Å²	102	128.8 Å²	128.8	63%	0.626	79%	0.789	S	S	*	*				50	134.9	105.3	72.7	0	0	0	0	114.8
166	T	44.9	Very low	45.7	Very low	135 Å²	135	135.2 Å²	135.2	83%	0.828	80%	0.797	S	S	*	*			cis	-161.7	166.4	24.5	-14	0	0	0	0	106.8
167	A	42.9	Very low	45.3	Very low	95 Å²	95	132.9 Å²	132.9	79%	0.785	79%	0.789	S	S	*	*			cis	-143.5	-158.4	9.2	0	0	0	0	0	111.1
168	R	41.4	Very low	44.9	Very low	214 Å²	214	134.9 Å²	134.9	81%	0.808	79%	0.789	S	S	*	*			trans	-153.8	121.9	-179.5	-167.4	-174.8	86.9	-132.5	7.5	112.2	S170	R168-S170 PolarHBondContact NE-OG 3.37Å
169	S	44.3	Very low	44.8	Very low	123 Å²	123	136 Å²	136	86%	0.86	78%	0.784	S	S	*	*			trans	-147.5	96.4	167.7	-53.6	0	0	0	0	106.1
170	S	50.1	Low	44.4	Very low	85 Å²	85	137.8 Å²	137.8	59%	0.594	78%	0.783	S	S	*	*			cis	64	135.8	48	-65.2	0	0	0	0	113.4	R168	R168-S170 PolarHBondContact NE-OG 3.37Å
171	P	48.1	Very low	44.1	Very low	130 Å²	130	139.7 Å²	139.7	84%	0.844	78%	0.784	S	S	*	*				-121.6	177.5	-121.1	41.1	-31.7	0	0	0	113.8
172	S	39	Very low	43.5	Very low	127 Å²	127	134.6 Å²	134.6	89%	0.888	78%	0.784	S	S	*	*			trans	-142.4	138.8	159.5	-159.6	0	0	0	0	111.8
173	A	42.8	Very low	43	Very low	94 Å²	94	135.4 Å²	135.4	78%	0.777	79%	0.79	S	S	*	*			trans	-92.8	148.7	-173.5	0	0	0	0	0	111.8
174	S	51.1	Low	42.4	Very low	114 Å²	114	131 Å²	131	80%	0.797	78%	0.782	S	S	*	*			trans	-136.7	116.5	160.4	-168.1	0	0	0	0	109.7
175	R	43.3	Very low	41.8	Very low	210 Å²	210	135.7 Å²	135.7	79%	0.792	79%	0.79	S	S	*	*			trans	-82.6	132.8	178.8	-59.6	172.2	-175.7	-119.1	2.7	109.1
176	R	44.2	Very low	41.3	Very low	242 Å²	242	134.6 Å²	134.6	91%	0.913	80%	0.799	S	S	*	*			trans	-135.7	112.8	149.7	-68.5	-168.8	-171.4	-111.9	-0.2	109.4
177	H	39.7	Very low	41.2	Very low	159 Å²	159	139 Å²	139	74%	0.736	80%	0.801	S	S	*	*			trans	-80.4	145.5	163	-69	-102.6	0	0	0	108.9
178	C	33.9	Very low	41.1	Very low	122 Å²	122	139.4 Å²	139.4	82%	0.824	80%	0.804	S	S	*	*			trans	-171	102.4	141.2	-98	0	0	0	0	105.5
179	S	39.9	Very low	41.2	Very low	110 Å²	110	140.6 Å²	140.6	77%	0.769	81%	0.808	S	S	*	*				82.2	112.3	77.6	-68	0	0	0	0	112.2
180	S	33.2	Very low	41	Very low	118 Å²	118	139 Å²	139	83%	0.825	80%	0.802	S	S	*	*			trans	-42.9	151.7	170.7	-34	0	0	0	0	114
181	S	37.3	Very low	40.6	Very low	118 Å²	118	146.2 Å²	146.2	83%	0.825	82%	0.817	S	S	*	*			trans	-150.3	105.7	155.3	-77.6	0	0	0	0	111
182	S	37.5	Very low	40.1	Very low	124 Å²	124	150.3 Å²	150.3	87%	0.867	82%	0.815	S	S	*	*			trans	-93.4	127.2	153.5	52.9	0	0	0	0	108.5
183	S	41.9	Very low	40.8	Very low	99 Å²	99	150.6 Å²	150.6	69%	0.692	81%	0.814	S	S	*	*			trans	-158	107.2	171.6	53.3	0	0	0	0	105.1
184	S	40.4	Very low	40.5	Very low	91 Å²	91	150.2 Å²	150.2	64%	0.636	81%	0.806	S	S	*	*			cis	60	101.2	43.8	143.2	0	0	0	0	112.1
185	W	34.8	Very low	40.5	Very low	237 Å²	237	150.5 Å²	150.5	90%	0.898	81%	0.808	S	S	*	*			trans	95.1	110.7	155.9	-54.7	13.3	0	0	0	117.4
186	G	36.4	Very low	40.6	Very low	80 Å²	80	147.2 Å²	147.2	83%	0.825	81%	0.811	S	S	*	*			trans	-145.7	86.3	165.6	0	0	0	0	0	110.1
187	R	42.4	Very low	40.9	Very low	228 Å²	228	141.1 Å²	141.1	86%	0.86	80%	0.803	S	S	*	*			trans	-80.4	119	175.1	-67.2	179.9	-173.4	-114.4	5.1	109.7
188	A	41.6	Very low	41.3	Very low	103 Å²	103	139.4 Å²	139.4	85%	0.851	80%	0.804	S	S	*	*			trans	-106.7	136.5	159.2	0	0	0	0	0	109.6
189	R	42.6	Very low	41.8	Very low	238 Å²	238	139.9 Å²	139.9	90%	0.898	81%	0.806	S	S	*	*			trans	-102.6	171.2	-179.1	-69	-178.3	179.1	-120.8	6.8	111.1
190	A	42	Very low	41.9	Very low	89 Å²	89	144.3 Å²	144.3	74%	0.736	81%	0.807	S	S	*	*			trans	77.3	132.2	169.6	0	0	0	0	0	115.3
191	R	40.2	Very low	42.2	Very low	237 Å²	237	144.1 Å²	144.1	89%	0.894	81%	0.806	S	S	*	*			cis	-144.6	149.9	-0.7	-92.8	140.2	-175.4	-89.9	3.8	109.2
192	R	38.6	Very low	42.2	Very low	217 Å²	217	149 Å²	149	82%	0.819	81%	0.806	S	S	*	*			trans	-80.2	158	164.9	-67.6	174.2	83	-150.1	12.1	110.2
193	P	52.2	Low	42.1	Very low	132 Å²	132	147.9 Å²	147.9	86%	0.857	80%	0.799	S	S	*	*				-121.9	161.2	119.3	32.4	-25.1	0	0	0	111.7
194	S	38	Very low	41.7	Very low	86 Å²	86	148.6 Å²	148.6	60%	0.601	80%	0.803	S	S	*	*			trans	-122.7	133.9	-175.9	54.6	0	0	0	0	111.7
195	S	49.8	Very low	41.7	Very low	120 Å²	120	150.3 Å²	150.3	84%	0.839	82%	0.815	S	S	*	*			trans	-161.1	104	157.5	52	0	0	0	0	111.1
196	T	45.3	Very low	41.9	Very low	142 Å²	142	144.3 Å²	144.3	87%	0.871	81%	0.81	S	S	*	*			trans	-110	145.4	155.4	41.3	0	0	0	0	108
197	P	52.3	Low	42	Very low	113 Å²	113	151.5 Å²	151.5	73%	0.734	81%	0.812	S	S	*	*			trans	-132	119.8	145.4	29.6	-14.1	0	0	0	112.7
198	T	46.6	Very low	42	Very low	124 Å²	124	146 Å²	146	76%	0.761	81%	0.808	S	S	*	*			trans	45.5	123.9	135.8	56.9	0	0	0	0	121.3
199	P	45.9	Very low	42.1	Very low	132 Å²	132	146.3 Å²	146.3	86%	0.857	80%	0.804	S	S	*	*			trans	-77	150.7	152.4	35	-31.5	0	0	0	110.2
200	Y	41.8	Very low	42.1	Very low	202 Å²	202	139.2 Å²	139.2	79%	0.792	80%	0.797	S	S	*	*			trans	-113.6	129.8	167.1	74	-84.5	0	0	0	110.4	W202	Y200-W202 AromaticContact CD2-CD1 3.9Å; Y200-W202 AromaticContact CE2-NE1 3.97Å
201	S	38.7	Very low	42.5	Very low	115 Å²	115	141.4 Å²	141.4	80%	0.804	80%	0.801	S	S	*	*			trans	-125	137.4	166.7	175.5	0	0	0	0	106.3
202	W	38.5	Very low	42.8	Very low	219 Å²	219	134.4 Å²	134.4	83%	0.83	79%	0.794	S	S	*	*			trans	-139.7	138.7	176.4	60.9	-59.7	0	0	0	109	Y200	Y200-W202 AromaticContact CD2-CD1 3.9Å; Y200-W202 AromaticContact CE2-NE1 3.97Å
203	S	34.8	Very low	43.5	Very low	102 Å²	102	130.1 Å²	130.1	71%	0.713	79%	0.792	S	S	*	*			trans	-146.8	139.1	179.3	-68.3	0	0	0	0	108.8
204	S	33.9	Very low	43.6	Very low	113 Å²	113	130.8 Å²	130.8	79%	0.79	79%	0.788	S	S	*	*			trans	54.9	115.5	155.6	-53	0	0	0	0	118.8
205	S	40.1	Very low	44.2	Very low	127 Å²	127	133.6 Å²	133.6	89%	0.888	80%	0.797	S	S	*	*				-170	147.2	108.5	-79.4	0	0	0	0	112.7
206	S	38	Very low	44.3	Very low	112 Å²	112	135.2 Å²	135.2	78%	0.783	79%	0.791	S	S	*	*			trans	-80.9	163.1	-171.8	-33.6	0	0	0	0	114.1
207	R	39.6	Very low	44.7	Very low	231 Å²	231	134.8 Å²	134.8	87%	0.872	78%	0.783	S	S	*	*				163.5	124	120.8	-91	173.2	85.1	-178.3	8.2	115
208	S	41.9	Very low	44.8	Very low	111 Å²	111	133.6 Å²	133.6	78%	0.776	78%	0.782	S	S	*	*			trans	57.8	151.1	145.7	36.4	0	0	0	0	120.8
209	S	43	Very low	44.9	Very low	110 Å²	110	133.3 Å²	133.3	77%	0.769	78%	0.782	S	S	*	*			cis	-168.9	151.9	-4.5	179.4	0	0	0	0	110.8
210	A	43.4	Very low	44.8	Very low	90 Å²	90	137 Å²	137	74%	0.744	79%	0.785	S	S	*	*			trans	63.8	152.9	159.8	0	0	0	0	0	118.3
211	T	51	Low	44.9	Very low	135 Å²	135	133.5 Å²	133.5	83%	0.828	79%	0.791	S	S	*	*			cis	-142.3	167.5	15.2	46.1	0	0	0	0	113.6
212	A	46.2	Very low	45.1	Very low	90 Å²	90	131.8 Å²	131.8	74%	0.744	79%	0.791	S	S	*	*			trans	-26.4	160.1	167.7	0	0	0	0	0	119.2
213	T	52.6	Low	45.5	Very low	127 Å²	127	126 Å²	126	78%	0.779	78%	0.784	S	S	*	*			cis	-143.2	140.9	32.5	49.9	0	0	0	0	111.1
214	D	53.9	Low	46.2	Very low	146 Å²	146	128 Å²	128	78%	0.781	79%	0.787	S	S	*	*				79.3	149.5	69.8	-121	-45.8	0	0	0	116.6
215	D	50.9	Low	47	Very low	145 Å²	145	129.5 Å²	129.5	78%	0.775	79%	0.786	S	S	*	*			trans	66.7	145.9	-176.1	-55.9	-54	0	0	0	118.6
216	E	51.1	Low	47.6	Very low	153 Å²	153	132 Å²	132	72%	0.715	78%	0.783	S	S	*	*			cis	-159.4	160.2	-36.3	-141.1	-152.4	147.7	0	0	109.6
217	L	55.4	Low	48.1	Very low	134 Å²	134	130.5 Å²	130.5	70%	0.702	78%	0.778	S	S	*	*			trans	53.9	102.2	158.8	-57.1	176.4	0	0	0	123.7
218	A	53.7	Low	48.2	Very low	88 Å²	88	123.6 Å²	123.6	73%	0.727	78%	0.779	S	S	*	*				40.2	145.8	115.4	0	0	0	0	0	124.2
219	P	48.4	Very low	48.3	Very low	117 Å²	117	121.7 Å²	121.7	76%	0.76	78%	0.777	S	S	*	*			trans	-105.2	161.3	-170.5	41.2	-34.4	0	0	0	115.4
220	F	43.1	Very low	48.8	Very low	209 Å²	209	125.8 Å²	125.8	92%	0.917	78%	0.784	S	S	*	*			trans	-136	143.5	163.6	-81	-78.2	0	0	0	112.7
221	S	44	Very low	49.1	Very low	130 Å²	130	125.8 Å²	125.8	91%	0.909	78%	0.784	S	S	*	*			trans	-68.5	142.8	174.4	-55.9	0	0	0	0	112.2
222	G	43.4	Very low	48.9	Very low	79 Å²	79	124.2 Å²	124.2	81%	0.814	78%	0.784	S	S	*	*			trans	-139.2	137.5	165.5	0	0	0	0	0	109.1
223	S	46.6	Very low	49.1	Very low	98 Å²	98	125.9 Å²	125.9	69%	0.685	78%	0.781	S	S	*	*			trans	-92.7	-177.5	-173.5	44.4	0	0	0	0	113.2
224	D	50.8	Low	49	Very low	142 Å²	142	129.1 Å²	129.1	76%	0.759	79%	0.79	S	S	*	*			trans	96.2	146.4	153	-48.7	-54	0	0	0	118.4
225	D	49.2	Very low	48.8	Very low	146 Å²	146	133.4 Å²	133.4	78%	0.781	80%	0.795	S	S	*	*			trans	-75.7	162.2	-159.2	-52.6	-102.7	0	0	0	114.8
226	E	53.4	Low	48.8	Very low	178 Å²	178	131.1 Å²	131.1	83%	0.832	79%	0.786	S	S	*	*				177.3	161.3	122.3	-100.1	-61.1	153.6	0	0	114.4
227	A	48.8	Very low	48.7	Very low	82 Å²	82	131.8 Å²	131.8	68%	0.678	79%	0.794	S	S	*	*			trans	56.9	92.1	148.6	0	0	0	0	0	122
228	G	41.7	Very low	48.2	Very low	85 Å²	85	134.7 Å²	134.7	88%	0.876	80%	0.801	S	S	*	*				46.3	109	113.3	0	0	0	0	0	122.5
229	G	43.7	Very low	47.5	Very low	72 Å²	72	135.8 Å²	135.8	74%	0.742	80%	0.803	S	S	*	*			trans	-147.5	106.3	152.7	0	0	0	0	0	109.5
230	Q	53.3	Low	47.2	Very low	195 Å²	195	135.7 Å²	135.7	91%	0.911	81%	0.805	S	S	*	*				62.1	125	87.1	-77.4	-165.9	88.1	0	0	117
231	A	48.9	Very low	47.2	Very low	91 Å²	91	133.1 Å²	133.1	75%	0.752	80%	0.8	S	S	*	*			trans	73.8	100.5	147.7	0	0	0	0	0	120.5
232	A	47	Very low	47.1	Very low	101 Å²	101	132.9 Å²	132.9	84%	0.835	80%	0.799	S	S	*	*				47.5	96.2	121.5	0	0	0	0	0	119.8
233	D	51.4	Low	47	Very low	125 Å²	125	138.9 Å²	138.9	67%	0.668	80%	0.803	S	S	*	*			trans	-155.2	115	133.5	-136.9	-20.1	0	0	0	113.2
234	M	49.7	Very low	46.8	Very low	195 Å²	195	139 Å²	139	96%	0.961	80%	0.804	S	S	*	*			trans	-140.4	42.2	169.7	-80.7	-175.6	67.9	0	0	110.2
235	R	50	Low	46.2	Very low	236 Å²	236	136.9 Å²	136.9	89%	0.891	80%	0.8	S	S	*	*			trans	-124.4	29.1	178.8	-83	-167.5	166.2	111	0.6	114.1
236	T	51.3	Low	45.8	Very low	98 Å²	98	137.3 Å²	137.3	60%	0.601	80%	0.803	S	S	*	*			trans	-138.7	28.9	-169.3	42.9	0	0	0	0	115.3
237	L	48.6	Very low	45.3	Very low	166 Å²	166	134.4 Å²	134.4	87%	0.869	80%	0.799	S	S	*	*	S	Bend	trans	-128.2	45.4	178.4	-68.3	177.5	0	0	0	115
238	F	44.5	Very low	45.1	Very low	196 Å²	196	136.8 Å²	136.8	86%	0.86	81%	0.805	S	S	*	*	S	Bend	trans	-159.3	52.9	157	-122.3	-75.5	0	0	0	113.1
239	S	39.5	Very low	45	Very low	110 Å²	110	138.8 Å²	138.8	77%	0.769	81%	0.806	S	S	*	*			trans	-130.6	44.3	-175.9	-62.3	0	0	0	0	114.1
240	S	42.3	Very low	44.8	Very low	115 Å²	115	140.7 Å²	140.7	80%	0.804	81%	0.808	S	S	*	*			trans	-154	42.8	177.5	-77.5	0	0	0	0	115.1
241	L	43.5	Very low	44.3	Very low	155 Å²	155	139.9 Å²	139.9	81%	0.812	80%	0.804	S	S	*	*			trans	-133.7	82.9	165.4	-75.2	179.4	0	0	0	111.4
242	S	40.9	Very low	44	Very low	125 Å²	125	143.6 Å²	143.6	87%	0.874	80%	0.803	S	S	*	*			trans	-77.9	115.8	166.4	-54.4	0	0	0	0	109.7
243	F	41.9	Very low	43.9	Very low	205 Å²	205	148.7 Å²	148.7	90%	0.899	80%	0.803	S	S	*	*			trans	-109.6	125.6	161.6	-118.4	-86.4	0	0	0	109.9
244	S	41.7	Very low	43.3	Very low	102 Å²	102	154.1 Å²	154.1	71%	0.713	81%	0.813	S	S	*	*			trans	-84.6	129.1	-176.3	171.8	0	0	0	0	111.4
245	S	39.6	Very low	42.7	Very low	96 Å²	96	151.1 Å²	151.1	67%	0.671	81%	0.806	S	S	*	*			trans	41.5	119.5	141	-41.9	0	0	0	0	120
246	D	39.6	Very low	42.3	Very low	156 Å²	156	148.4 Å²	148.4	83%	0.834	81%	0.81	S	S	*	*				-156.2	125.5	115.7	-116	-20.7	0	0	0	111.6
247	P	43.8	Very low	41.6	Very low	116 Å²	116	147.5 Å²	147.5	75%	0.753	82%	0.819	S	S	*	*			trans	-113.5	97.4	-179.2	37	-26.8	0	0	0	113.6
248	T	43.4	Very low	41.2	Very low	133 Å²	133	143.4 Å²	143.4	82%	0.816	82%	0.817	S	S	*	*			trans	-137.6	77.3	173.1	59.1	0	0	0	0	113.9
249	S	40.8	Very low	40.8	Very low	127 Å²	127	146 Å²	146	89%	0.888	82%	0.821	S	S	*	*			trans	-173.7	90.3	150	-173.1	0	0	0	0	109.6
250	S	38.9	Very low	40.9	Very low	111 Å²	111	146.5 Å²	146.5	78%	0.776	83%	0.825	S	S	*	*			trans	-141.5	79.9	-178.4	164.8	0	0	0	0	110.3
251	E	42.2	Very low	41	Very low	178 Å²	178	144.5 Å²	144.5	83%	0.832	82%	0.823	S	S	*	*			trans	-145.7	86	165.3	-87.2	-57.5	156.7	0	0	109.3
252	F	44.2	Very low	41	Very low	170 Å²	170	145.3 Å²	145.3	75%	0.746	83%	0.828	S	S	*	*	S	Bend	trans	-176	143.1	140.8	-119.6	-117.7	0	0	0	109.9
253	Y	43.9	Very low	41.1	Very low	208 Å²	208	142.9 Å²	142.9	82%	0.816	82%	0.823	S	S	*	*			trans	66.8	73.2	179.3	-49.8	-66	0	0	0	117.5
254	R	38.5	Very low	41.1	Very low	238 Å²	238	141.6 Å²	141.6	90%	0.898	83%	0.825	S	S	*	*			trans	-118.5	165.1	143.6	-82.6	-170.2	173.1	-176.5	1	110.8
255	T	38.3	Very low	41.1	Very low	132 Å²	132	141.1 Å²	141.1	81%	0.81	83%	0.828	S	S	*	*			trans	63.7	91	172.1	62.3	0	0	0	0	118.3
256	N	40.7	Very low	41.4	Very low	180 Å²	180	141 Å²	141	96%	0.963	83%	0.826	S	S	*	*				-150.8	116.3	115.3	-111.7	-16.9	0	0	0	110.4
257	G	37.9	Very low	41.8	Very low	78 Å²	78	144.2 Å²	144.2	80%	0.804	83%	0.827	S	S	*	*			trans	174	69.4	-169.4	0	0	0	0	0	110.9	R259	G257-R259 PolarHBondContact O-N 3.44Å
258	G	38.4	Very low	41.7	Very low	80 Å²	80	150.3 Å²	150.3	83%	0.825	84%	0.835	S	S	*	*			trans	-66.3	127.4	-171	0	0	0	0	0	114.2
259	R	37.5	Very low	41.9	Very low	250 Å²	250	147.8 Å²	147.8	94%	0.943	82%	0.823	S	S	*	*			trans	1	119.7	157.2	-69	176.5	168.2	-164	-4	117.3	G257	G257-R259 PolarHBondContact O-N 3.44Å
260	S	42	Very low	42.4	Very low	121 Å²	121	149.7 Å²	149.7	85%	0.846	82%	0.817	S	S	*	*			trans	-124.2	114.7	141.8	-176.3	0	0	0	0	108.3
261	G	42.8	Very low	42.8	Very low	74 Å²	74	154.8 Å²	154.8	76%	0.763	82%	0.819	S	S	*	*			trans	-129.8	105.7	179.4	0	0	0	0	0	109.5	G263	G261-G263 PolarHBondContact O-N 2.97Å
262	N	43.2	Very low	43.1	Very low	172 Å²	172	152.9 Å²	152.9	92%	0.92	82%	0.815	S	S	*	*			trans	-72.7	119.2	174.4	-93	-0.8	0	0	0	110
263	G	44.4	Very low	43.4	Very low	74 Å²	74	150.6 Å²	150.6	76%	0.763	82%	0.815	S	S	*	*			trans	-133.6	106.8	170.9	0	0	0	0	0	109.8	G261	G261-G263 PolarHBondContact O-N 2.97Å
264	N	41.9	Very low	43.5	Very low	178 Å²	178	145 Å²	145	95%	0.952	81%	0.812	S	S	*	*			trans	-81.4	116.1	-175.4	-131.1	-2.3	0	0	0	110.3
265	A	42.2	Very low	44.1	Very low	92 Å²	92	138.1 Å²	138.1	76%	0.76	80%	0.8	S	S	*	*			trans	-155.1	95.7	169.2	0	0	0	0	0	114
266	S	45.4	Very low	44.7	Very low	92 Å²	92	141.6 Å²	141.6	64%	0.643	80%	0.799	S	S	*	*				48.1	107.4	125.7	170.9	0	0	0	0	121
267	R	47.7	Very low	45	Very low	225 Å²	225	141.2 Å²	141.2	85%	0.849	78%	0.784	S	S	*	*			trans	84.6	134.9	130.8	-64.9	173.6	-175.5	-175.5	-0.4	121.3
268	R	42	Very low	45.6	Very low	244 Å²	244	147.9 Å²	147.9	92%	0.921	78%	0.784	S	S	*	*			trans	69.3	154.6	159.2	-69	176.7	170.2	-168.8	-3.6	117
269	S	47.2	Very low	45.9	Very low	80 Å²	80	147.3 Å²	147.3	56%	0.559	78%	0.778	S	S	*	*			cis	-178	159.2	-27.6	-176.8	0	0	0	0	107.4
270	H	50.5	Low	46.5	Very low	166 Å²	166	145.6 Å²	145.6	77%	0.769	77%	0.772	S	S	*	*			trans	71.9	115.5	175.5	-45.7	-75.6	0	0	0	114.6
271	R	47.9	Very low	46.7	Very low	218 Å²	218	150.3 Å²	150.3	82%	0.823	77%	0.771	S	S	*	*			cis	82.7	106.7	41.3	-163.7	-167.7	-144	-178.1	7.9	112.7
272	N	49.2	Very low	47	Very low	139 Å²	139	151 Å²	151	74%	0.743	77%	0.77	S	S	*	*			trans	169.9	108.1	136.5	-82.1	-9.2	0	0	0	108.1
273	T	49.5	Very low	46.9	Very low	122 Å²	122	154.5 Å²	154.5	75%	0.748	77%	0.77	S	S	*	*				67.1	100.7	71.5	65.5	0	0	0	0	116
274	A	46.4	Very low	46.8	Very low	91 Å²	91	155.1 Å²	155.1	75%	0.752	77%	0.768	S	S	*	*			trans	-177.8	114.1	133.5	0	0	0	0	0	109
275	S	50.9	Low	47.2	Very low	93 Å²	93	152.1 Å²	152.1	65%	0.65	76%	0.758	S	S	*	*				60.6	105.8	90.2	111.8	0	0	0	0	112.2
276	R	50.3	Low	47.2	Very low	205 Å²	205	159.2 Å²	159.2	77%	0.774	77%	0.766	S	S	*	*				160.4	160.5	84.8	-86.8	157.4	176.8	-149.8	-0.6	105.1
277	R	48.1	Very low	47.1	Very low	172 Å²	172	166.9 Å²	166.9	65%	0.649	78%	0.78	S	S	*	*			cis	-168.7	148.7	-6.1	-112.4	169.2	171.3	-154.2	0.1	106.6
278	R	50.2	Low	46.8	Very low	217 Å²	217	159.8 Å²	159.8	82%	0.819	77%	0.77	S	S	*	*			trans	48.2	136.1	138.2	-57	167.6	-178.8	-132	-3.8	118.9
279	G	45.2	Very low	47.1	Very low	68 Å²	68	156.2 Å²	156.2	70%	0.701	77%	0.768	S	S	*	*			cis	-171.6	155.8	5.6	0	0	0	0	0	109.6
280	R	49.3	Very low	47	Very low	215 Å²	215	157 Å²	157	81%	0.811	77%	0.773	S	S	*	*				93.9	126.8	74.6	-94.3	-162.1	176.9	-138	1.7	113.8
281	R	47.2	Very low	46.9	Very low	219 Å²	219	160.7 Å²	160.7	83%	0.826	78%	0.781	S	S	*	*			trans	81.3	148.4	163.6	-55.5	161.4	-172.6	-83.2	7.5	115.5
282	A	47.7	Very low	47	Very low	89 Å²	89	155.1 Å²	155.1	74%	0.736	78%	0.776	S	S	*	*			cis	-165.8	131.9	-19.9	0	0	0	0	0	108.1
283	R	42.5	Very low	47	Very low	246 Å²	246	154.7 Å²	154.7	93%	0.928	78%	0.783	S	S	*	*				70.9	111.6	95	-148.9	-173.9	-167.3	-135.8	5.2	115.9
284	A	41	Very low	47	Very low	87 Å²	87	152.5 Å²	152.5	72%	0.719	79%	0.785	S	S	*	*			trans	-73.2	171.5	162.8	0	0	0	0	0	111.1
285	P	50.6	Low	47.2	Very low	115 Å²	115	151.8 Å²	151.8	75%	0.747	79%	0.786	S	S	*	*				-157.8	179.9	54.3	43.5	-20.7	0	0	0	119.5
286	R	42.1	Very low	47	Very low	241 Å²	241	154.9 Å²	154.9	91%	0.909	80%	0.796	S	S	*	*			trans	31.5	126.1	145	-70	-179	166.7	-155.7	-5.4	123.1
287	R	43.1	Very low	47.3	Very low	252 Å²	252	150.8 Å²	150.8	95%	0.951	80%	0.796	S	S	*	*				172	173.7	129.8	-99.8	176.4	175.7	-150.2	-0.5	110.7
288	A	41.5	Very low	47.1	Very low	77 Å²	77	147.4 Å²	147.4	64%	0.636	80%	0.804	S	S	*	*				-176.2	143.6	-70.7	0	0	0	0	0	110.9
289	L	49	Very low	47.2	Very low	168 Å²	168	141.9 Å²	141.9	88%	0.88	81%	0.805	S	S	*	*			trans	72.3	156.6	165.3	-50.6	148	0	0	0	115.9
290	S	45.9	Very low	47.5	Very low	96 Å²	96	144.2 Å²	144.2	67%	0.671	81%	0.808	S	S	*	*			cis	-158.1	153.6	17.2	-36.3	0	0	0	0	114.7
291	R	47.4	Very low	47.6	Very low	244 Å²	244	139.3 Å²	139.3	92%	0.921	80%	0.804	S	S	*	*			trans	65.7	151.8	139.2	-77.8	179	175.8	-158.4	-3.4	121
292	S	49	Very low	47.1	Very low	102 Å²	102	135.9 Å²	135.9	71%	0.713	80%	0.802	S	S	*	*			cis	-168.9	157.5	-0.4	40.4	0	0	0	0	114.7
293	S	50	Low	46.9	Very low	129 Å²	129	136.5 Å²	136.5	90%	0.902	81%	0.807	S	S	*	*			trans	72.3	134.2	152.7	-159	0	0	0	0	118.8
294	G	49.1	Very low	46.5	Very low	76 Å²	76	133.7 Å²	133.7	78%	0.784	80%	0.802	S	S	*	*			cis	171.4	164.2	-4.9	0	0	0	0	0	111.5
295	G	51.8	Low	46.8	Very low	76 Å²	76	139.3 Å²	139.3	78%	0.784	81%	0.805	S	S	*	*			trans	136.2	93.8	172.1	0	0	0	0	0	116.1
296	D	45.3	Very low	45.9	Very low	159 Å²	159	140.2 Å²	140.2	85%	0.85	81%	0.81	S	S	*	*			trans	-89.6	-168.9	178.5	-62.6	-76.4	0	0	0	112.8
297	P	58.4	Low	45.5	Very low	119 Å²	119	135 Å²	135	77%	0.773	80%	0.8	S	S	*	*				-136.2	159	-65.1	38.5	-23.9	0	0	0	114.3
298	A	43.6	Very low	45.4	Very low	100 Å²	100	129.9 Å²	129.9	83%	0.826	80%	0.796	S	S	*	*			trans	-162.8	92.5	157.3	0	0	0	0	0	115.1
299	A	51.1	Low	45	Very low	101 Å²	101	131.3 Å²	131.3	84%	0.835	80%	0.802	S	S	*	*			trans	52.4	150.3	149.8	0	0	0	0	0	123.5
300	P	51.5	Low	44.6	Very low	118 Å²	118	130 Å²	130	77%	0.766	80%	0.8	S	S	*	*			trans	-133.9	-146.6	-158	45.3	-23.8	0	0	0	111.6
301	P	51.6	Low	44.3	Very low	112 Å²	112	133.3 Å²	133.3	73%	0.727	81%	0.805	S	S	*	*			cis	-129.6	165.1	-25.9	31.6	-11.7	0	0	0	115.7
302	D	37	Very low	44	Very low	146 Å²	146	127.7 Å²	127.7	78%	0.781	80%	0.798	S	S	*	*			trans	41.8	127.3	134.2	-156.8	6.8	0	0	0	122.8
303	A	43	Very low	43.5	Very low	103 Å²	103	128.6 Å²	128.6	85%	0.851	80%	0.8	S	S	*	*			trans	-158.6	64.1	163.5	0	0	0	0	0	113.9
304	F	35.5	Very low	42.9	Very low	186 Å²	186	133.6 Å²	133.6	82%	0.816	80%	0.799	S	S	*	*			trans	-95	145.6	155.4	-95.4	-87.6	0	0	0	110.8
305	R	45.8	Very low	42.5	Very low	205 Å²	205	141.8 Å²	141.8	77%	0.774	81%	0.806	S	S	*	*			trans	100.1	124.6	164.4	-59	156.8	170.1	-111.9	-9	117.3	L307	R305-L307 PolarHBondContact O-N 3.32Å
306	P	32.7	Very low	41.7	Very low	134 Å²	134	143.9 Å²	143.9	87%	0.87	80%	0.804	S	S	*	*			trans	-79.9	111.3	157.1	32.2	-28.2	0	0	0	109.3
307	L	32.5	Very low	41.3	Very low	133 Å²	133	142.1 Å²	142.1	70%	0.696	80%	0.799	S	S	*	*			trans	-158.4	97	176.9	-116	151.9	0	0	0	110	R305	R305-L307 PolarHBondContact O-N 3.32Å
308	V	40.7	Very low	40.4	Very low	143 Å²	143	144.6 Å²	144.6	87%	0.867	80%	0.8	S	S	*	*			trans	-152.2	111.6	158.3	-103.3	0	0	0	0	109.2
309	S	33.8	Very low	40.1	Very low	108 Å²	108	151 Å²	151	76%	0.755	80%	0.803	S	S	*	*			trans	-73.5	137.3	162.6	-64.2	0	0	0	0	109	E311	S309-E311 PolarHBondContact O-N 3.34Å
310	V	40.1	Very low	39.7	Very low	139 Å²	139	151.3 Å²	151.3	84%	0.842	80%	0.799	S	S	*	*			trans	-87	90.2	165.8	179.1	0	0	0	0	107.6
311	E	40.2	Very low	39.4	Very low	166 Å²	166	154.3 Å²	154.3	78%	0.776	80%	0.803	S	S	*	*			trans	-101.9	118.2	172.5	-167.4	167.5	-167.5	0	0	109	S309 T313	S309-E311 PolarHBondContact O-N 3.34Å; E311-T313 PolarHBondContact O-N 3.03Å
312	T	41.2	Very low	39.1	Very low	126 Å²	126	160.2 Å²	160.2	77%	0.773	81%	0.81	S	S	*	*			trans	-83.6	76.6	-172.9	44.3	0	0	0	0	111.8	R314	T312-R314 PolarHBondContact O-N 3.44Å; T312-R314 VanDerWaalsContact O-N 3.11Å
313	T	38.6	Very low	39.7	Very low	122 Å²	122	158.3 Å²	158.3	75%	0.748	81%	0.809	S	S	*	*			trans	-61.6	112.6	178.3	-54.6	0	0	0	0	112.1	E311 R315	E311-T313 PolarHBondContact O-N 3.03Å; T313-R315 PolarHBondContact O-N 3.48Å
314	R	38.4	Very low	39.9	Very low	234 Å²	234	160.9 Å²	160.9	88%	0.883	80%	0.801	S	S	*	*	P	Polyproline II helix	trans	-63.7	129.2	169.1	-76.6	177.8	163.7	162.3	-3.5	110.4	T312	T312-R314 PolarHBondContact O-N 3.44Å; T312-R314 VanDerWaalsContact O-N 3.11Å
315	R	40.2	Very low	40.3	Very low	248 Å²	248	158.8 Å²	158.8	94%	0.936	79%	0.793	S	S	*	*	P	Polyproline II helix	trans	-79.1	121.1	171.9	-77.3	-178.5	169.6	171.2	-3.5	111.2	T313	T313-R315 PolarHBondContact O-N 3.48Å
316	T	34.3	Very low	40.8	Very low	119 Å²	119	157.1 Å²	157.1	73%	0.73	80%	0.799	S	S	*	*	P	Polyproline II helix	trans	-93.8	164.3	159.2	43.4	0	0	0	0	110.7
317	T	36.1	Very low	41.4	Very low	122 Å²	122	161 Å²	161	75%	0.748	80%	0.803	S	S	*	*			trans	64.3	135.6	172	52	0	0	0	0	115.3
318	E	39.7	Very low	41.6	Very low	172 Å²	172	157 Å²	157	80%	0.804	79%	0.793	S	S	*	*			cis	-163	166.3	14.2	-134.9	166.6	-125.8	0	0	113.2
319	R	38.4	Very low	42.4	Very low	235 Å²	235	158.2 Å²	158.2	89%	0.887	79%	0.794	S	S	*	*			trans	88.3	133.5	147.5	-155.5	177.2	-176.3	-160.5	0.6	121.8
320	S	42.3	Very low	43.4	Very low	106 Å²	106	159 Å²	159	74%	0.741	79%	0.79	S	S	*	*			trans	110.6	87	148.4	-145	0	0	0	0	118.2
321	E	44.3	Very low	44.2	Very low	182 Å²	182	159.2 Å²	159.2	85%	0.85	79%	0.786	S	S	*	*			trans	-25.7	133.5	153.9	-51.4	168.2	145.1	0	0	116.5
322	R	46.6	Very low	44.9	Very low	236 Å²	236	155.1 Å²	155.1	89%	0.891	78%	0.781	S	S	*	*				-170.6	141.5	118.7	-117.3	-179.9	-171.5	-139.6	-0.4	113
323	S	48.4	Very low	45.5	Very low	106 Å²	106	156.8 Å²	156.8	74%	0.741	78%	0.778	S	S	*	*			trans	41.5	144.7	146.1	57.2	0	0	0	0	121.1
324	K	48.3	Very low	46.1	Very low	157 Å²	157	159 Å²	159	68%	0.683	78%	0.777	S	S	*	*			cis	-176.4	150.6	-15.6	-162.9	179.1	175.2	-120.5	0	103.6
325	E	44.5	Very low	46.7	Very low	142 Å²	142	153.9 Å²	153.9	66%	0.664	77%	0.766	S	S	*	*			trans	47.7	100.4	162	-72.6	143.7	-179.8	0	0	117.9
326	D	54.6	Low	47.4	Very low	169 Å²	169	146.4 Å²	146.4	90%	0.904	75%	0.748	S	S	*	*				-158.6	132.1	121.5	-107.2	-29.9	0	0	0	112.6
327	K	45.2	Very low	48.1	Very low	216 Å²	216	148.1 Å²	148.1	94%	0.939	75%	0.75	S	S	*	*			trans	-109.3	104.1	-178	-73.5	175.9	178	172.4	0	109.8
328	G	38.1	Very low	48.9	Very low	48 Å²	48	146.7 Å²	146.7	50%	0.495	74%	0.741	S	S	.	*			trans	168.9	155.8	166.3	0	0	0	0	0	116.4	N330	G328-N330 PolarHBondContact O-N 3.25Å
329	L	57.1	Low	49.3	Very low	170 Å²	170	145.7 Å²	145.7	89%	0.89	74%	0.738	S	S	*	*			trans	72.3	27.2	147.6	-55	164.1	0	0	0	119.6
330	N	54.9	Low	49.9	Very low	124 Å²	124	141.1 Å²	141.1	66%	0.663	73%	0.73	S	S	*	*			trans	-106.1	5.5	-179	-71.9	-27.7	0	0	0	117	G328	G328-N330 PolarHBondContact O-N 3.25Å
331	N	57.3	Low	50.1	Low	144 Å²	144	138.1 Å²	138.1	77%	0.77	72%	0.717	S	S	*	*	S	Bend	trans	-87.4	-24.4	-173.3	-66.9	3.3	0	0	0	114.5
332	A	55.1	Low	50.4	Low	80 Å²	80	132.4 Å²	132.4	66%	0.661	70%	0.701	S	S	*	*	S	Bend	trans	-78.8	-33.1	-177.8	0	0	0	0	0	113.8	K334	A332-K334 VanDerWaalsContact C-N 3.26Å; A332-K334 PolarHBondContact O-N 2.93Å
333	K	53.2	Low	50.4	Low	161 Å²	161	124.2 Å²	124.2	70%	0.7	68%	0.683	S	S	*	*	H	α-helix	trans	-76.2	-10.6	-177.6	-66	176.8	-179.5	172.4	0	113.9	T336	K333-T336 PolarHBondContact O-OG1 3.46Å
334	K	50.8	Low	50.4	Low	168 Å²	168	121.6 Å²	121.6	73%	0.73	67%	0.668	S	S	*	*	H	α-helix	trans	-82.9	-24.7	-179.5	-164.3	172.3	-177.3	179.4	0	113.3	A332 T338	A332-K334 VanDerWaalsContact C-N 3.26Å; A332-K334 PolarHBondContact O-N 2.93Å; K334-T338 PolarHBondContact O-OG1 2.83Å
335	L	52.4	Low	50.5	Low	127 Å²	127	116.6 Å²	116.6	67%	0.665	66%	0.656	S	S	*	*	H	α-helix	trans	-82.9	-28.5	-179.9	-88.7	141.7	0	0	0	113.4	T338	L335-T338 PolarHBondContact O-OG1 3.43Å
336	T	53	Low	50.9	Low	90 Å²	90	112.6 Å²	112.6	55%	0.552	65%	0.647	S	S	*	*	H	α-helix	trans	-78.9	-34.7	178.7	51.6	0	0	0	0	112.6	K333 T338	K333-T336 PolarHBondContact O-OG1 3.46Å; T336-T338 PolarHBondContact O-N 2.91Å
337	M	49.5	Very low	50.9	Low	155 Å²	155	111.5 Å²	111.5	76%	0.764	64%	0.637	S	S	*	*	H	α-helix	trans	-70	-30.4	178.7	-164	-169.4	167.6	0	0	112.9	G341	M337-G341 PolarHBondContact O-N 3.11Å
338	T	53.1	Low	51.2	Low	92 Å²	92	107.6 Å²	107.6	56%	0.564	62%	0.622	S	S	*	*	H	α-helix	trans	-75.2	-29.2	-179.8	43	0	0	0	0	113.8	K334 L335 T336	K334-T338 PolarHBondContact O-OG1 2.83Å; L335-T338 PolarHBondContact O-OG1 3.43Å; T336-T338 PolarHBondContact O-N 2.91Å
339	M	49	Very low	51.9	Low	151 Å²	151	112.3 Å²	112.3	74%	0.744	63%	0.631	S	S	*	*	H	α-helix	trans	-69.9	-43.7	175.7	-75.4	-68.8	-151.2	0	0	112.2	G341 A342	M339-G341 PolarHBondContact O-N 2.86Å; M339-A342 PolarHBondContact O-N 3.4Å
340	L	50.8	Low	51.7	Low	139 Å²	139	109.2 Å²	109.2	73%	0.728	61%	0.612	S	S	*	*	H	α-helix	trans	-67.4	-32.9	-178.4	-82.8	154.5	0	0	0	113.2
341	G	46.4	Very low	51.5	Low	44 Å²	44	110.2 Å²	110.2	45%	0.454	61%	0.613	S	S	.	*	H	α-helix	trans	-73.6	-28.4	177	0	0	0	0	0	114.5	M337 M339 A345	M337-G341 PolarHBondContact O-N 3.11Å; M339-G341 PolarHBondContact O-N 2.86Å; G341-A345 WeakPolarHBondContact O-CB 3.17Å; G341-A345 PolarHBondContact O-N 3.42Å; G341-A345 VanDerWaalsContact O-N 3.14Å
342	A	50	Low	50.8	Low	62 Å²	62	110.1 Å²	110.1	51%	0.512	61%	0.607	S	S	.	*	H	α-helix	trans	-72.6	-32.4	-177.2	0	0	0	0	0	113.2	M339 A346	M339-A342 PolarHBondContact O-N 3.4Å; A342-A346 PolarHBondContact O-N 3.29Å
343	A	46	Very low	50.4	Low	64 Å²	64	109.2 Å²	109.2	53%	0.529	60%	0.6	S	S	.	*	H	α-helix	trans	-68.6	-46.3	174.9	0	0	0	0	0	111.5	A345 A346 E347	A343-A345 PolarHBondContact O-N 3.18Å; A343-A346 PolarHBondContact O-N 3.04Å; A343-E347 PolarHBondContact O-N 3.11Å
344	A	49	Very low	50.2	Low	51 Å²	51	104.3 Å²	104.3	42%	0.421	58%	0.581	S	S	.	*	H	α-helix	trans	-60.6	-42.5	177.1	0	0	0	0	0	112.4	A346 E347 E348	A344-A346 VanDerWaalsContact C-N 3.29Å; A344-A346 PolarHBondContact O-N 3.41Å; A344-E347 PolarHBondContact O-N 2.87Å; A344-E348 PolarHBondContact O-N 3.31Å
345	A	50.1	Low	50	Low	51 Å²	51	99.7 Å²	99.7	42%	0.421	57%	0.574	S	S	.	*	H	α-helix	trans	-65.6	-27.8	177.6	0	0	0	0	0	113.8	G341 A343 E349	G341-A345 WeakPolarHBondContact O-CB 3.17Å; G341-A345 PolarHBondContact O-N 3.42Å; G341-A345 VanDerWaalsContact O-N 3.14Å; A343-A345 PolarHBondContact O-N 3.18Å; A345-E349 PolarHBondContact O-N 3.19Å
346	A	54	Low	49.6	Very low	58 Å²	58	97.6 Å²	97.6	48%	0.479	58%	0.575	S	S	.	*	H	α-helix	trans	-74.6	-36.4	176.5	0	0	0	0	0	112.3	A342 A343 A344 E350	A342-A346 PolarHBondContact O-N 3.29Å; A343-A346 PolarHBondContact O-N 3.04Å; A344-A346 VanDerWaalsContact C-N 3.29Å; A344-A346 PolarHBondContact O-N 3.41Å; A346-E350 PolarHBondContact O-N 3.16Å
347	E	53	Low	49.3	Very low	147 Å²	147	94.1 Å²	94.1	69%	0.687	56%	0.557	S	S	*	*	H	α-helix	trans	-67.7	-42.2	171.9	-57.6	-76.8	145.7	0	0	110.4	A343 A344 E350 E351	A343-E347 PolarHBondContact O-N 3.11Å; A344-E347 PolarHBondContact O-N 2.87Å; E347-E350 PolarHBondContact O-N 3.16Å; E347-E351 PolarHBondContact O-N 2.88Å
348	E	52.3	Low	49.5	Very low	134 Å²	134	89.9 Å²	89.9	63%	0.626	55%	0.547	S	S	*	.	H	α-helix	trans	-63.3	-39.3	175.1	-74	-178.2	-178.1	0	0	112.8	A344 E350 E351 E352	A344-E348 PolarHBondContact O-N 3.31Å; E348-E350 VanDerWaalsContact C-N 3.3Å; E348-E350 PolarHBondContact O-N 3.05Å; E348-E351 PolarHBondContact O-N 3.26Å; E348-E352 WeakPolarHBondContact O-CB 3.17Å; E348-E352 PolarHBondContact O-N 3.36Å
349	E	52.1	Low	49.7	Very low	146 Å²	146	86.2 Å²	86.2	68%	0.682	53%	0.527	S	S	*	.	H	α-helix	trans	-64.3	-31.5	173.2	-85.7	-159.6	157.2	0	0	112.6	A345 A353	A345-E349 PolarHBondContact O-N 3.19Å; E349-A353 VanDerWaalsContact O-CB 3.22Å; E349-A353 WeakPolarHBondContact O-CB 3.32Å; E349-A353 PolarHBondContact O-N 3.27Å
350	E	53.2	Low	49.8	Very low	106 Å²	106	86 Å²	86	50%	0.495	53%	0.526	S	S	.	.	H	α-helix	trans	-76.2	-36.5	177.7	-150.5	-172.1	128.9	0	0	111.9	A346 E347 E348 A353 I354 K391	A346-E350 PolarHBondContact O-N 3.16Å; E347-E350 PolarHBondContact O-N 3.16Å; E348-E350 VanDerWaalsContact C-N 3.3Å; E348-E350 PolarHBondContact O-N 3.05Å; E350-A353 PolarHBondContact O-N 2.99Å; E350-I354 WeakPolarHBondContact O-CG1 3.38Å; E350-I354 PolarHBondContact O-N 3.05Å; E350-I354 VanDerWaalsContact O-N 3.11Å; E350-K391 IonicContact OE1-NZ 2.66Å; E350-K391 PolarHBondContact OE1-NZ 3.31Å
351	E	50.4	Low	50.4	Low	145 Å²	145	82.2 Å²	82.2	68%	0.678	52%	0.515	S	S	*	.	H	α-helix	trans	-69.8	-42.6	173.6	-164	175	176.5	0	0	111.7	E347 E348 A353 I354 A355	E347-E351 PolarHBondContact O-N 2.88Å; E348-E351 PolarHBondContact O-N 3.26Å; E351-A353 VanDerWaalsContact C-N 3.27Å; E351-A353 PolarHBondContact O-N 3.43Å; E351-I354 PolarHBondContact O-N 3.14Å; E351-I354 VanDerWaalsContact O-N 3.1Å; E351-A355 PolarHBondContact O-N 2.92Å
352	E	44.1	Very low	51.1	Low	141 Å²	141	83.2 Å²	83.2	66%	0.659	51%	0.512	S	S	*	.	H	α-helix	trans	-62.1	-36	172.2	-161.9	-165.9	151.8	0	0	111	E348 I354 A355 A356	E348-E352 WeakPolarHBondContact O-CB 3.17Å; E348-E352 PolarHBondContact O-N 3.36Å; E352-I354 VanDerWaalsContact C-N 3.32Å; E352-I354 PolarHBondContact O-N 3.39Å; E352-A355 PolarHBondContact O-N 2.89Å; E352-A356 WeakPolarHBondContact O-CB 3.31Å; E352-A356 PolarHBondContact O-N 3.19Å
353	A	45.9	Very low	51.8	Low	61 Å²	61	84.6 Å²	84.6	50%	0.504	51%	0.514	S	S	.	.	H	α-helix	trans	-67.4	-29	174.7	0	0	0	0	0	113.4	E349 E350 E351 G357	E349-A353 VanDerWaalsContact O-CB 3.22Å; E349-A353 WeakPolarHBondContact O-CB 3.32Å; E349-A353 PolarHBondContact O-N 3.27Å; E350-A353 PolarHBondContact O-N 2.99Å; E351-A353 VanDerWaalsContact C-N 3.27Å; E351-A353 PolarHBondContact O-N 3.43Å; A353-G357 WeakPolarHBondContact O-CA 3.48Å; A353-G357 PolarHBondContact O-N 3.47Å
354	I	50.2	Low	52.9	Low	58 Å²	58	85.6 Å²	85.6	30%	0.297	51%	0.507	S	S	.	.	H	α-helix	trans	-73.7	-43	173.2	-68.9	164.5	0	0	0	110.4	E350 E351 E352 G357 A358 K391	E350-I354 WeakPolarHBondContact O-CG1 3.38Å; E350-I354 PolarHBondContact O-N 3.05Å; E350-I354 VanDerWaalsContact O-N 3.11Å; E351-I354 PolarHBondContact O-N 3.14Å; E351-I354 VanDerWaalsContact O-N 3.1Å; E352-I354 VanDerWaalsContact C-N 3.32Å; E352-I354 PolarHBondContact O-N 3.39Å; I354-G357 CarbonylContact O-C 3.5Å; I354-G357 WeakPolarHBondContact O-CA 3.1Å; I354-G357 PolarHBondContact O-N 3.39Å; I354-A358 PolarHBondContact O-N 3.07Å; I354-K391 HydrophobicContact CD1-CD 4.08Å; I354-K391 VanDerWaalsContact CD1-CE 3.48Å
355	A	45.6	Very low	54	Low	72 Å²	72	94.5 Å²	94.5	60%	0.595	53%	0.529	S	S	*	.	H	α-helix	trans	-66.3	-48.4	176.3	0	0	0	0	0	112.6	E351 E352 G357 A358	E351-A355 PolarHBondContact O-N 2.92Å; E352-A355 PolarHBondContact O-N 2.89Å; A355-G357 PolarHBondContact O-N 3.48Å; A355-A358 WeakPolarHBondContact O-CB 3.38Å; A355-A358 PolarHBondContact O-N 3.27Å; A355-A358 VanDerWaalsContact O-N 3.12Å
356	A	43.7	Very low	55.1	Low	83 Å²	83	93.7 Å²	93.7	69%	0.686	52%	0.521	S	S	*	.	T	Hydrogen-bonded Turn	trans	-67.1	-15.8	171.7	0	0	0	0	0	112.7	E352	E352-A356 WeakPolarHBondContact O-CB 3.31Å; E352-A356 PolarHBondContact O-N 3.19Å
357	G	46.2	Very low	56.4	Low	17 Å²	17	97.2 Å²	97.2	18%	0.175	54%	0.542	C	S	.	.	T	Hydrogen-bonded Turn	trans	-86.4	6.1	172.4	0	0	0	0	0	114.3	A353 I354 A355 G359 R384	A353-G357 WeakPolarHBondContact O-CA 3.48Å; A353-G357 PolarHBondContact O-N 3.47Å; I354-G357 CarbonylContact O-C 3.5Å; I354-G357 WeakPolarHBondContact O-CA 3.1Å; I354-G357 PolarHBondContact O-N 3.39Å; A355-G357 PolarHBondContact O-N 3.48Å; G357-G359 PolarHBondContact O-N 2.89Å; G357-R384 PolarHBondContact O-NH1 3.43Å; G357-R384 PolarHBondContact O-NH2 2.91Å
358	A	54	Low	58	Low	66 Å²	66	93.3 Å²	93.3	55%	0.545	53%	0.526	S	S	.	.			trans	-43.8	113.1	179.3	0	0	0	0	0	111.6	I354 A355 M360	I354-A358 PolarHBondContact O-N 3.07Å; A355-A358 WeakPolarHBondContact O-CB 3.38Å; A355-A358 PolarHBondContact O-N 3.27Å; A355-A358 VanDerWaalsContact O-N 3.12Å; A358-M360 PolarHBondContact O-N 2.89Å
359	G	56.9	Low	59.8	Low	15 Å²	15	89 Å²	89	16%	0.155	51%	0.509	C	S	.	.			trans	-69.8	134.2	-167.1	0	0	0	0	0	111.3	A108 L110 G357 A361 R384	A108-G359 WeakPolarHBondContact O-CA 3.4Å; L110-G359 WeakPolarHBondContact CB-O 3.41Å; G357-G359 PolarHBondContact O-N 2.89Å; G359-A361 PolarHBondContact O-N 2.98Å; G359-A361 VanDerWaalsContact O-N 3.1Å; G359-R384 VanDerWaalsContact CA-NH2 3.28Å
360	M	52.9	Low	61.7	Low	145 Å²	145	85.3 Å²	85.3	71%	0.714	49%	0.49	S	S	*	.			trans	-60.2	116.4	178.2	-77.3	-70.6	172.4	0	0	110.5	S109 L110 A358 V362	S109-M360 WeakPolarHBondContact CA-O 3.24Å; S109-M360 VanDerWaalsContact CB-O 3.26Å; S109-M360 WeakPolarHBondContact CB-O 3.2Å; L110-M360 PolarHBondContact N-O 3.15Å; L110-M360 CarbonylContact O-C 3.56Å; A358-M360 PolarHBondContact O-N 2.89Å; M360-V362 PolarHBondContact O-N 3.25Å; M360-V362 VanDerWaalsContact O-N 3.09Å
361	A	62.7	Low	63.5	Low	60 Å²	60	84 Å²	84	50%	0.496	49%	0.485	S	S	.	.			trans	-60.1	101.8	176.3	0	0	0	0	0	111.3	L110 H112 G359	L110-A361 CarbonylContact O-C 3.58Å; L110-A361 WeakPolarHBondContact O-CA 3.35Å; H112-A361 HydrophobicContact CB-CB 3.72Å; G359-A361 PolarHBondContact O-N 2.98Å; G359-A361 VanDerWaalsContact O-N 3.1Å
362	V	60	Low	65.5	Low	66 Å²	66	78.3 Å²	78.3	40%	0.4	46%	0.46	S	S	.	.	B	Isolated β-bridge	trans	-98.1	117.6	178.3	178.5	0	0	0	0	111.2	L110 H112 M360 K364	L110-V362 PolarHBondContact O-N 3.32Å; H112-V362 CarbonylContact C-O 3.42Å; H112-V362 PolarHBondContact N-O 2.99Å; H112-V362 VanDerWaalsContact N-O 3.08Å; M360-V362 PolarHBondContact O-N 3.25Å; M360-V362 VanDerWaalsContact O-N 3.09Å; V362-K364 PolarHBondContact O-N 3.41Å
363	V	66.5	Low	67.8	Low	91 Å²	91	71.6 Å²	71.6	55%	0.552	43%	0.428	S	S	*	.			trans	-74.1	112.9	172.1	-179.9	0	0	0	0	110.6	H112	H112-V363 VanDerWaalsContact O-CA 3.27Å; H112-V363 WeakPolarHBondContact O-CA 3.27Å
364	K	68.7	Low	70.1	Confident	85 Å²	85	73 Å²	73	37%	0.37	42%	0.421	S	S	.	.			trans	-110.2	141.8	177.2	-161.1	166.2	-176	-179.6	0	110.4	I113 V362 D372	I113-K364 WeakPolarHBondContact CG2-O 3.28Å; V362-K364 PolarHBondContact O-N 3.41Å; K364-D372 HydrophobicContact CD-CB 4.29Å; K364-D372 VanDerWaalsContact CD-OD2 3.29Å; K364-D372 WeakPolarHBondContact CD-OD2 3.39Å; K364-D372 VanDerWaalsContact CE-CG 3.48Å; K364-D372 WeakPolarHBondContact CE-OD1 3.42Å; K364-D372 WeakPolarHBondContact CE-OD2 3.22Å; K364-D372 IonicContact NZ-OD1 3.47Å; K364-D372 PolarHBondContact NZ-OD1 3.46Å; K364-D372 IonicContact NZ-OD2 3.98Å; K364-D372 PolarHBondContact NZ-OD2 3.47Å
365	R	70.4	Confident	72.1	Confident	237 Å²	237	73.7 Å²	73.7	89%	0.894	43%	0.43	S	S	*	.			trans	-100.8	125.9	162.4	-72.5	-176.4	173.8	179.5	-2.6	107.3
366	S	73.3	Confident	74.3	Confident	35 Å²	35	70.4 Å²	70.4	25%	0.245	40%	0.403	C	S	.	.			trans	-130.4	139.7	-172.4	-165.3	0	0	0	0	112.4	N368 D372	S366-N368 PolarHBondContact OG-N 3.2Å; S366-N368 PolarHBondContact OG-O 3.06Å; S366-D372 WeakPolarHBondContact CB-OD2 3.36Å; S366-D372 PolarHBondContact OG-OD2 2.66Å
367	S	81.3	Confident	76.6	Confident	132 Å²	132	66.5 Å²	66.5	92%	0.923	37%	0.371	S	S	*	.	S	Bend	trans	-83.1	-17.6	164	52.2	0	0	0	0	112.6
368	N	88.4	Confident	78.8	Confident	65 Å²	65	68.9 Å²	68.9	35%	0.348	38%	0.381	S	S	.	.			trans	-139.8	82.6	179.4	-170	-24.9	0	0	0	109.9	S366 Y370 L371 D372	S366-N368 PolarHBondContact OG-N 3.2Å; S366-N368 PolarHBondContact OG-O 3.06Å; N368-Y370 PolarHBondContact O-N 2.58Å; N368-Y370 PolarHBondContact OD1-N 2.7Å; N368-L371 HydrophobicContact CB-CB 4.48Å; N368-L371 HydrophobicContact CB-CD1 4.42Å; N368-L371 VanDerWaalsContact ND2-CD1 3.34Å; N368-L371 WeakPolarHBondContact ND2-CD1 3.31Å; N368-L371 PolarHBondContact O-N 2.9Å; N368-L371 PolarHBondContact OD1-N 3.02Å; N368-D372 PolarHBondContact O-N 3.06Å
369	P	89.4	Confident	80.5	Confident	43 Å²	43	69.8 Å²	69.8	28%	0.279	37%	0.374	S	S	.	.	H	α-helix	trans	-61.4	-32.3	-175	24	-33.9	0	0	0	112.6	D372 F373 A410	P369-D372 PolarHBondContact O-N 2.97Å; P369-F373 HydrophobicContact CB-CD2 4.27Å; P369-F373 HydrophobicContact CB-CE2 4Å; P369-F373 WeakPolarHBondContact O-CD2 3.41Å; P369-F373 WeakPolarHBondContact O-CG 3.45Å; P369-F373 PolarHBondContact O-N 3.41Å; P369-A410 HydrophobicContact CB-CB 4.31Å; P369-A410 HydrophobicContact CG-CB 4.23Å
370	Y	92.1	Very high	82	Confident	69 Å²	69	69.4 Å²	69.4	27%	0.271	37%	0.369	S	S	.	.	H	α-helix	trans	-59	-48.8	177.4	156.2	-94.9	0	0	0	112.1	N368 D372 F373 R374 A413 A414 D417	N368-Y370 PolarHBondContact O-N 2.58Å; N368-Y370 PolarHBondContact OD1-N 2.7Å; Y370-D372 VanDerWaalsContact C-N 3.28Å; Y370-D372 PolarHBondContact O-N 3.12Å; Y370-F373 PolarHBondContact O-N 3.36Å; Y370-R374 VanDerWaalsContact O-CB 3.27Å; Y370-R374 WeakPolarHBondContact O-CB 3.49Å; Y370-R374 PolarHBondContact O-N 2.81Å; Y370-R374 WeakPolarHBondContact OH-CD 3.4Å; Y370-A413 HydrophobicContact CD2-CB 3.99Å; Y370-A413 HydrophobicContact CE2-CB 4.28Å; Y370-A414 HydrophobicContact CD2-CB 4.09Å; Y370-A414 HydrophobicContact CE2-CB 4.38Å; Y370-D417 WeakPolarHBondContact CE2-OD2 3.42Å; Y370-D417 PolarHBondContact OH-OD2 2.97Å
371	L	91.6	Very high	83.8	Confident	78 Å²	78	63.3 Å²	63.3	41%	0.408	34%	0.34	S	S	.	.	H	α-helix	trans	-65	-33.7	178.3	-74	-179.5	0	0	0	112.4	N368 S375	N368-L371 HydrophobicContact CB-CB 4.48Å; N368-L371 HydrophobicContact CB-CD1 4.42Å; N368-L371 VanDerWaalsContact ND2-CD1 3.34Å; N368-L371 WeakPolarHBondContact ND2-CD1 3.31Å; N368-L371 PolarHBondContact O-N 2.9Å; N368-L371 PolarHBondContact OD1-N 3.02Å; L371-S375 WeakPolarHBondContact O-CB 3.27Å; L371-S375 PolarHBondContact O-N 3.24Å; L371-S375 PolarHBondContact O-OG 3.18Å
372	D	90.8	Very high	85.1	Confident	25 Å²	25	65.5 Å²	65.5	13%	0.134	35%	0.346	C	S	.	.	H	α-helix	trans	-71.9	-44.2	179.1	-80.2	-20.7	0	0	0	112.5	I113 K364 S366 N368 P369 Y370 S376	I113-D372 HydrophobicContact CD1-CB 4.16Å; K364-D372 HydrophobicContact CD-CB 4.29Å; K364-D372 VanDerWaalsContact CD-OD2 3.29Å; K364-D372 WeakPolarHBondContact CD-OD2 3.39Å; K364-D372 VanDerWaalsContact CE-CG 3.48Å; K364-D372 WeakPolarHBondContact CE-OD1 3.42Å; K364-D372 WeakPolarHBondContact CE-OD2 3.22Å; K364-D372 IonicContact NZ-OD1 3.47Å; K364-D372 PolarHBondContact NZ-OD1 3.46Å; K364-D372 IonicContact NZ-OD2 3.98Å; K364-D372 PolarHBondContact NZ-OD2 3.47Å; S366-D372 WeakPolarHBondContact CB-OD2 3.36Å; S366-D372 PolarHBondContact OG-OD2 2.66Å; N368-D372 PolarHBondContact O-N 3.06Å; P369-D372 PolarHBondContact O-N 2.97Å; Y370-D372 VanDerWaalsContact C-N 3.28Å; Y370-D372 PolarHBondContact O-N 3.12Å; D372-S376 WeakPolarHBondContact O-CB 3.41Å; D372-S376 PolarHBondContact O-N 3Å
373	F	93.2	Very high	86.3	Confident	0 Å²	0	66.6 Å²	66.6	0%	0	35%	0.347	C	S	.	.	H	α-helix	trans	-62.1	-45.4	171.9	-70.6	-57	0	0	0	111.1	I113 P369 Y370 S375 S376 M377 Y399 N403 H407 A410 I411 A414	I113-F373 HydrophobicContact CB-CE1 4.31Å; I113-F373 HydrophobicContact CB-CZ 3.98Å; I113-F373 HydrophobicContact CD1-CD1 3.94Å; I113-F373 HydrophobicContact CD1-CD2 4.21Å; I113-F373 HydrophobicContact CD1-CE1 3.49Å; I113-F373 VanDerWaalsContact CD1-CE1 3.49Å; I113-F373 HydrophobicContact CD1-CE2 3.76Å; I113-F373 HydrophobicContact CD1-CG 4.28Å; I113-F373 HydrophobicContact CD1-CZ 3.38Å; I113-F373 HydrophobicContact CG1-CD1 4.34Å; I113-F373 HydrophobicContact CG1-CE1 3.54Å; I113-F373 HydrophobicContact CG1-CE2 4.46Å; I113-F373 HydrophobicContact CG1-CZ 3.6Å; P369-F373 HydrophobicContact CB-CD2 4.27Å; P369-F373 HydrophobicContact CB-CE2 4Å; P369-F373 WeakPolarHBondContact O-CD2 3.41Å; P369-F373 WeakPolarHBondContact O-CG 3.45Å; P369-F373 PolarHBondContact O-N 3.41Å; Y370-F373 PolarHBondContact O-N 3.36Å; F373-S375 PolarHBondContact O-N 3.1Å; F373-S376 PolarHBondContact O-N 2.77Å; F373-M377 WeakPolarHBondContact O-CB 3.4Å; F373-M377 VanDerWaalsContact O-CG 3.28Å; F373-M377 WeakPolarHBondContact O-CG 3.45Å; F373-M377 PolarHBondContact O-N 3.32Å; F373-Y399 AromaticContact CD1-CD1 3.82Å; F373-Y399 HydrophobicContact CD1-CD1 3.82Å; F373-Y399 HydrophobicContact CD1-CE1 4.04Å; F373-Y399 HydrophobicContact CE1-CD1 4.12Å; F373-N403 WeakPolarHBondContact CE1-OD1 3.36Å; F373-N403 HydrophobicContact CZ-CB 4.45Å; F373-N403 WeakPolarHBondContact CZ-OD1 3.44Å; F373-H407 HydrophobicContact CE2-CB 3.92Å; F373-H407 HydrophobicContact CZ-CB 3.91Å; F373-A410 HydrophobicContact CD2-CB 4.15Å; F373-A410 HydrophobicContact CE2-CB 4.32Å; F373-I411 HydrophobicContact CD1-CD1 4.5Å; F373-I411 HydrophobicContact CD1-CG1 3.79Å; F373-I411 HydrophobicContact CD2-CG1 3.61Å; F373-I411 HydrophobicContact CE1-CD1 3.95Å; F373-I411 HydrophobicContact CE1-CG1 3.68Å; F373-I411 HydrophobicContact CE2-CD1 4.15Å; F373-I411 HydrophobicContact CE2-CG1 3.52Å; F373-I411 HydrophobicContact CG-CG1 3.77Å; F373-I411 HydrophobicContact CZ-CD1 3.76Å; F373-I411 HydrophobicContact CZ-CG1 3.55Å; F373-A414 HydrophobicContact CB-CB 3.81Å
374	R	94.5	Very high	87.1	Confident	92 Å²	92	65 Å²	65	35%	0.347	33%	0.331	S	S	.	.	H	α-helix	trans	-59.2	-47.4	178.6	-173	174.2	-177.6	-94.8	-0.6	111.7	Y370 S376 M377 V378 A414 D417 V418	Y370-R374 VanDerWaalsContact O-CB 3.27Å; Y370-R374 WeakPolarHBondContact O-CB 3.49Å; Y370-R374 PolarHBondContact O-N 2.81Å; Y370-R374 WeakPolarHBondContact OH-CD 3.4Å; R374-S376 PolarHBondContact O-N 2.89Å; R374-M377 PolarHBondContact O-N 3Å; R374-V378 WeakPolarHBondContact O-CG2 3.43Å; R374-V378 PolarHBondContact O-N 3.45Å; R374-A414 HydrophobicContact CB-CB 3.84Å; R374-D417 IonicContact NE-OD2 3.97Å; R374-V418 HydrophobicContact CG-CG2 4.03Å
375	S	91.6	Very high	87.9	Confident	72 Å²	72	71 Å²	71	50%	0.503	35%	0.352	S	S	.	.	H	α-helix	trans	-62.3	-44.2	178.5	-56.4	0	0	0	0	111.8	L371 F373 V378 E379	L371-S375 WeakPolarHBondContact O-CB 3.27Å; L371-S375 PolarHBondContact O-N 3.24Å; L371-S375 PolarHBondContact O-OG 3.18Å; F373-S375 PolarHBondContact O-N 3.1Å; S375-V378 PolarHBondContact O-N 3.37Å; S375-E379 WeakPolarHBondContact O-CB 3.41Å; S375-E379 PolarHBondContact O-N 3.3Å
376	S	91	Very high	88.7	Confident	3 Å²	3	60.2 Å²	60.2	2%	0.021	31%	0.312	C	S	.	.	H	α-helix	trans	-70	-33.8	179.3	-168.5	0	0	0	0	112.9	V111 D372 F373 R374 M380 Y399	V111-S376 WeakPolarHBondContact CB-OG 3.45Å; V111-S376 WeakPolarHBondContact CG2-OG 3.49Å; D372-S376 WeakPolarHBondContact O-CB 3.41Å; D372-S376 PolarHBondContact O-N 3Å; F373-S376 PolarHBondContact O-N 2.77Å; R374-S376 PolarHBondContact O-N 2.89Å; S376-M380 WeakPolarHBondContact O-CB 3.39Å; S376-M380 WeakPolarHBondContact O-CG 3.37Å; S376-M380 PolarHBondContact O-N 2.91Å; S376-Y399 VanDerWaalsContact C-OH 3.24Å; S376-Y399 VanDerWaalsContact CB-OH 3.31Å; S376-Y399 WeakPolarHBondContact CB-OH 3.28Å; S376-Y399 PolarHBondContact O-OH 2.98Å; S376-Y399 PolarHBondContact OG-OH 2.97Å
377	M	93.2	Very high	89.1	Confident	1 Å²	1	62.2 Å²	62.2	1%	0.005	33%	0.33	C	S	.	.	H	α-helix	trans	-65.1	-45	171.4	-74.7	174.3	-177.4	0	0	111.5	F373 R374 M380 V381 L395 Y399 I411 A414 F415 V418	F373-M377 WeakPolarHBondContact O-CB 3.4Å; F373-M377 VanDerWaalsContact O-CG 3.28Å; F373-M377 WeakPolarHBondContact O-CG 3.45Å; F373-M377 PolarHBondContact O-N 3.32Å; R374-M377 PolarHBondContact O-N 3Å; M377-M380 PolarHBondContact O-N 2.96Å; M377-V381 WeakPolarHBondContact O-CB 3.34Å; M377-V381 VanDerWaalsContact O-CG2 3.22Å; M377-V381 WeakPolarHBondContact O-CG2 3.26Å; M377-V381 PolarHBondContact O-N 3.41Å; M377-L395 HydrophobicContact CB-CD2 4.49Å; M377-L395 HydrophobicContact CG-CD2 4.45Å; M377-Y399 HydrophobicContact CE-CD1 4.5Å; M377-Y399 HydrophobicContact CE-CD2 3.56Å; M377-Y399 HydrophobicContact CE-CE2 3.97Å; M377-Y399 HydrophobicContact CE-CG 3.88Å; M377-Y399 HydrophobicContact CG-CD2 4.04Å; M377-Y399 HydrophobicContact CG-CE2 3.44Å; M377-Y399 VanDerWaalsContact CG-CE2 3.44Å; M377-Y399 PolarHBondContact N-OH 2.96Å; M377-I411 HydrophobicContact CE-CG2 3.71Å; M377-A414 HydrophobicContact SD-CB 4.13Å; M377-F415 HydrophobicContact CE-CB 4.13Å; M377-F415 HydrophobicContact SD-CB 4Å; M377-F415 HydrophobicContact SD-CD2 4.3Å; M377-V418 HydrophobicContact CB-CG1 4.38Å; M377-V418 HydrophobicContact CB-CG2 4.03Å
378	V	92.7	Very high	89.5	Confident	66 Å²	66	58.4 Å²	58.4	40%	0.4	30%	0.304	S	S	.	.	H	α-helix	trans	-61.2	-44.8	175.5	172.3	0	0	0	0	111.3	R374 S375 M380 V381 V382 V418	R374-V378 WeakPolarHBondContact O-CG2 3.43Å; R374-V378 PolarHBondContact O-N 3.45Å; S375-V378 PolarHBondContact O-N 3.37Å; V378-M380 PolarHBondContact O-N 3.16Å; V378-V381 PolarHBondContact O-N 3.19Å; V378-V382 HydrophobicContact CG1-CG2 4.34Å; V378-V382 WeakPolarHBondContact O-CB 3.33Å; V378-V382 WeakPolarHBondContact O-CG2 3.03Å; V378-V382 PolarHBondContact O-N 2.67Å; V378-V418 HydrophobicContact CG2-CG2 3.74Å
379	E	90	Very high	89.6	Confident	85 Å²	85	57.3 Å²	57.3	40%	0.397	30%	0.299	S	S	.	.	H	α-helix	trans	-58.2	-48.1	175.6	-174	174.6	-167.5	0	0	111.2	S375 V381 V382 E383	S375-E379 WeakPolarHBondContact O-CB 3.41Å; S375-E379 PolarHBondContact O-N 3.3Å; E379-V381 PolarHBondContact O-N 3.23Å; E379-V382 PolarHBondContact O-N 3.11Å; E379-E383 HydrophobicContact CG-CG 4.41Å; E379-E383 WeakPolarHBondContact O-CB 3.13Å; E379-E383 WeakPolarHBondContact O-CG 3.37Å; E379-E383 PolarHBondContact O-N 3.43Å
380	M	88	Confident	89.7	Confident	7 Å²	7	56.9 Å²	56.9	3%	0.034	30%	0.302	C	S	.	.	H	α-helix	trans	-61.4	-41.1	176.1	-70.5	-82	-70.7	0	0	112.6	A108 L110 S376 M377 V378 R384 L395	A108-M380 HydrophobicContact CB-SD 3.82Å; L110-M380 HydrophobicContact CD1-CE 4.01Å; S376-M380 WeakPolarHBondContact O-CB 3.39Å; S376-M380 WeakPolarHBondContact O-CG 3.37Å; S376-M380 PolarHBondContact O-N 2.91Å; M377-M380 PolarHBondContact O-N 2.96Å; V378-M380 PolarHBondContact O-N 3.16Å; M380-R384 VanDerWaalsContact CE-CZ 3.46Å; M380-R384 WeakPolarHBondContact O-CB 3.17Å; M380-R384 WeakPolarHBondContact O-CG 3.4Å; M380-R384 PolarHBondContact O-N 3.2Å; M380-R384 PolarHBondContact SD-NE 3.41Å; M380-L395 HydrophobicContact CB-CD1 3.79Å; M380-L395 HydrophobicContact CB-CD2 4.28Å; M380-L395 HydrophobicContact CE-CD1 3.38Å; M380-L395 HydrophobicContact CG-CD1 4.1Å
381	V	90.8	Very high	89.6	Confident	18 Å²	18	55.9 Å²	55.9	11%	0.109	30%	0.299	C	S	.	.	H	α-helix	trans	-64.5	-45.4	178.5	164.4	0	0	0	0	111.4	M377 V378 E379 R385 I386 M392 L395 V418 V422	M377-V381 WeakPolarHBondContact O-CB 3.34Å; M377-V381 VanDerWaalsContact O-CG2 3.22Å; M377-V381 WeakPolarHBondContact O-CG2 3.26Å; M377-V381 PolarHBondContact O-N 3.41Å; V378-V381 PolarHBondContact O-N 3.19Å; E379-V381 PolarHBondContact O-N 3.23Å; V381-R385 CarbonylContact O-C 3.56Å; V381-R385 VanDerWaalsContact O-CA 3.24Å; V381-R385 WeakPolarHBondContact O-CA 3.29Å; V381-R385 PolarHBondContact O-N 3.35Å; V381-I386 HydrophobicContact CB-CB 4.43Å; V381-I386 HydrophobicContact CG2-CB 4.14Å; V381-I386 HydrophobicContact CG2-CG2 4.47Å; V381-I386 PolarHBondContact O-N 3.12Å; V381-M392 HydrophobicContact CG2-CE 3.7Å; V381-M392 HydrophobicContact CG2-SD 4.03Å; V381-L395 HydrophobicContact CG2-CD2 4Å; V381-V418 HydrophobicContact CG2-CG1 4.03Å; V381-V422 HydrophobicContact CG1-CG2 3.92Å
382	V	89.5	Confident	89.6	Confident	105 Å²	105	52.2 Å²	52.2	64%	0.636	28%	0.28	S	S	*	.	H	α-helix	trans	-70.9	-49.5	180	172.6	0	0	0	0	111.4	V378 E379	V378-V382 HydrophobicContact CG1-CG2 4.34Å; V378-V382 WeakPolarHBondContact O-CB 3.33Å; V378-V382 WeakPolarHBondContact O-CG2 3.03Å; V378-V382 PolarHBondContact O-N 2.67Å; E379-V382 PolarHBondContact O-N 3.11Å
383	E	85.6	Confident	89.6	Confident	90 Å²	90	53.9 Å²	53.9	42%	0.421	29%	0.287	S	S	.	.	H	α-helix	trans	-72.3	-34.1	-174.4	-67.5	-158.5	151.9	0	0	112.9	A108 E379	A108-E383 WeakPolarHBondContact CA-OE2 3.49Å; A108-E383 HydrophobicContact CB-CB 4.04Å; A108-E383 WeakPolarHBondContact CB-OE2 3.1Å; A108-E383 PolarHBondContact N-OE2 3.37Å; E379-E383 HydrophobicContact CG-CG 4.41Å; E379-E383 WeakPolarHBondContact O-CB 3.13Å; E379-E383 WeakPolarHBondContact O-CG 3.37Å; E379-E383 PolarHBondContact O-N 3.43Å
384	R	83.4	Confident	89.5	Confident	57 Å²	57	59.6 Å²	59.6	22%	0.215	31%	0.314	C	S	.	.	H	α-helix	trans	-97.2	1.2	178	-53.9	175.3	-175.4	-109.3	-7.1	114	A108 G357 G359 M380 I386	A108-R384 HydrophobicContact CB-CG 4.46Å; A108-R384 PolarHBondContact O-NH2 2.96Å; G357-R384 PolarHBondContact O-NH1 3.43Å; G357-R384 PolarHBondContact O-NH2 2.91Å; G359-R384 VanDerWaalsContact CA-NH2 3.28Å; M380-R384 VanDerWaalsContact CE-CZ 3.46Å; M380-R384 WeakPolarHBondContact O-CB 3.17Å; M380-R384 WeakPolarHBondContact O-CG 3.4Å; M380-R384 PolarHBondContact O-N 3.2Å; M380-R384 PolarHBondContact SD-NE 3.41Å; R384-I386 HydrophobicContact CB-CD1 4.23Å; R384-I386 HydrophobicContact CB-CG1 3.97Å; R384-I386 PolarHBondContact O-N 3.33Å
385	R	85.5	Confident	89.4	Confident	212 Å²	212	55.5 Å²	55.5	80%	0.8	30%	0.299	S	S	*	.	T	Hydrogen-bonded Turn	trans	53.8	48.7	-178.9	-56	-179.7	174.2	-155.4	-5.4	112.7	V381 A387	V381-R385 CarbonylContact O-C 3.56Å; V381-R385 VanDerWaalsContact O-CA 3.24Å; V381-R385 WeakPolarHBondContact O-CA 3.29Å; V381-R385 PolarHBondContact O-N 3.35Å; R385-A387 VanDerWaalsContact C-N 3.31Å; R385-A387 PolarHBondContact O-N 3.08Å
386	I	86.1	Confident	89.5	Confident	10 Å²	10	52.1 Å²	52.1	5%	0.051	28%	0.275	C	S	.	.			trans	-75.3	86.5	178.8	-58.9	172.4	0	0	0	108.7	V381 R384 K391 M392 L395	V381-I386 HydrophobicContact CB-CB 4.43Å; V381-I386 HydrophobicContact CG2-CB 4.14Å; V381-I386 HydrophobicContact CG2-CG2 4.47Å; V381-I386 PolarHBondContact O-N 3.12Å; R384-I386 HydrophobicContact CB-CD1 4.23Å; R384-I386 HydrophobicContact CB-CG1 3.97Å; R384-I386 PolarHBondContact O-N 3.33Å; I386-K391 HydrophobicContact CB-CB 4.49Å; I386-K391 HydrophobicContact CG1-CB 4.34Å; I386-K391 HydrophobicContact CG2-CB 3.81Å; I386-M392 HydrophobicContact CG2-CB 3.85Å; I386-M392 HydrophobicContact CG2-CE 4.42Å; I386-M392 HydrophobicContact CG2-SD 4.26Å; I386-L395 HydrophobicContact CD1-CB 4.29Å; I386-L395 HydrophobicContact CD1-CD1 4.24Å; I386-L395 HydrophobicContact CD1-CD2 3.96Å; I386-L395 HydrophobicContact CD1-CG 4.4Å
387	A	82.2	Confident	89.6	Confident	76 Å²	76	53.5 Å²	53.5	63%	0.628	29%	0.29	S	S	*	.			trans	-105.9	-11.1	172.8	0	0	0	0	0	112.8	R385 F423	R385-A387 VanDerWaalsContact C-N 3.31Å; R385-A387 PolarHBondContact O-N 3.08Å; A387-F423 WeakPolarHBondContact O-CE1 3.39Å
388	S	89.4	Confident	89.5	Confident	53 Å²	53	54.9 Å²	54.9	37%	0.371	30%	0.299	S	S	.	.	S	Bend	trans	-91.4	145.8	177.4	78.9	0	0	0	0	111.8	G390 K391 M392	S388-G390 VanDerWaalsContact C-N 3.32Å; S388-G390 PolarHBondContact O-N 2.64Å; S388-K391 PolarHBondContact O-N 2.93Å; S388-K391 WeakPolarHBondContact OG-CB 3.01Å; S388-K391 WeakPolarHBondContact OG-CG 3.49Å; S388-K391 PolarHBondContact OG-N 3.39Å; S388-M392 WeakPolarHBondContact O-CB 3.46Å; S388-M392 PolarHBondContact O-N 3.46Å; S388-M392 VanDerWaalsContact O-N 3.16Å
389	V	90.7	Very high	89.4	Confident	42 Å²	42	51.7 Å²	51.7	26%	0.255	28%	0.28	S	S	.	.	H	α-helix	trans	-52.1	-49.5	173.1	165.4	0	0	0	0	111.2	R24 M392 E393 W419 F423	R24-V389 VanDerWaalsContact CZ-CG1 3.49Å; V389-M392 WeakPolarHBondContact O-CB 3.22Å; V389-M392 PolarHBondContact O-N 3.34Å; V389-M392 VanDerWaalsContact O-N 3.16Å; V389-E393 HydrophobicContact CG1-CG 4.4Å; V389-E393 WeakPolarHBondContact O-CG 3.42Å; V389-E393 PolarHBondContact O-N 2.98Å; V389-W419 HydrophobicContact CB-CH2 4.36Å; V389-W419 HydrophobicContact CG1-CH2 4.12Å; V389-W419 HydrophobicContact CG2-CH2 4.07Å; V389-F423 HydrophobicContact CG2-CE1 4.45Å; V389-F423 HydrophobicContact CG2-CZ 4.33Å
390	G	91.4	Very high	89.5	Confident	33 Å²	33	48.6 Å²	48.6	34%	0.34	27%	0.266	S	S	.	.	H	α-helix	trans	-59.7	-51.3	-177.1	0	0	0	0	0	112.9	S388 M392 E393 E394	S388-G390 VanDerWaalsContact C-N 3.32Å; S388-G390 PolarHBondContact O-N 2.64Å; G390-M392 PolarHBondContact O-N 3.08Å; G390-E393 PolarHBondContact O-N 3.32Å; G390-E394 WeakPolarHBondContact O-CG 3.5Å; G390-E394 PolarHBondContact O-N 3.03Å
391	K	89.6	Confident	89.6	Confident	49 Å²	49	52.8 Å²	52.8	21%	0.213	30%	0.296	C	S	.	.	H	α-helix	trans	-61.7	-27.9	177.9	-68.5	180	-175.8	-177.7	0	112.4	E350 I354 I386 S388 L395	E350-K391 IonicContact OE1-NZ 2.66Å; E350-K391 PolarHBondContact OE1-NZ 3.31Å; I354-K391 HydrophobicContact CD1-CD 4.08Å; I354-K391 VanDerWaalsContact CD1-CE 3.48Å; I386-K391 HydrophobicContact CB-CB 4.49Å; I386-K391 HydrophobicContact CG1-CB 4.34Å; I386-K391 HydrophobicContact CG2-CB 3.81Å; S388-K391 PolarHBondContact O-N 2.93Å; S388-K391 WeakPolarHBondContact OG-CB 3.01Å; S388-K391 WeakPolarHBondContact OG-CG 3.49Å; S388-K391 PolarHBondContact OG-N 3.39Å; K391-L395 WeakPolarHBondContact O-CB 3.4Å; K391-L395 PolarHBondContact O-N 3.47Å
392	M	91.5	Very high	89.5	Confident	0 Å²	0	54.9 Å²	54.9	0%	0	31%	0.306	C	S	.	.	H	α-helix	trans	-76.6	-38.5	174.6	-172	68	92.6	0	0	112.2	V381 I386 S388 V389 G390 L395 L396 F415 V418 W419 V422 F423	V381-M392 HydrophobicContact CG2-CE 3.7Å; V381-M392 HydrophobicContact CG2-SD 4.03Å; I386-M392 HydrophobicContact CG2-CB 3.85Å; I386-M392 HydrophobicContact CG2-CE 4.42Å; I386-M392 HydrophobicContact CG2-SD 4.26Å; S388-M392 WeakPolarHBondContact O-CB 3.46Å; S388-M392 PolarHBondContact O-N 3.46Å; S388-M392 VanDerWaalsContact O-N 3.16Å; V389-M392 WeakPolarHBondContact O-CB 3.22Å; V389-M392 PolarHBondContact O-N 3.34Å; V389-M392 VanDerWaalsContact O-N 3.16Å; G390-M392 PolarHBondContact O-N 3.08Å; M392-L395 WeakPolarHBondContact O-CB 3.27Å; M392-L395 PolarHBondContact O-N 3.05Å; M392-L395 HydrophobicContact SD-CD2 4.07Å; M392-L396 PolarHBondContact O-N 3.1Å; M392-L396 VanDerWaalsContact O-N 3.11Å; M392-F415 HydrophobicContact CG-CE2 3.57Å; M392-F415 HydrophobicContact CG-CZ 3.69Å; M392-F415 VanDerWaalsContact O-CE2 3.31Å; M392-F415 WeakPolarHBondContact O-CE2 3.42Å; M392-F415 HydrophobicContact SD-CD2 4.47Å; M392-F415 HydrophobicContact SD-CE2 3.74Å; M392-F415 HydrophobicContact SD-CZ 4.42Å; M392-V418 HydrophobicContact CE-CG1 4.07Å; M392-W419 HydrophobicContact CB-CE3 4.38Å; M392-W419 HydrophobicContact CB-CZ3 3.92Å; M392-W419 HydrophobicContact CG-CE3 3.5Å; M392-W419 HydrophobicContact CG-CZ3 3.54Å; M392-V422 HydrophobicContact CE-CB 4.08Å; M392-V422 HydrophobicContact CE-CG1 4.15Å; M392-V422 HydrophobicContact CE-CG2 3.88Å; M392-F423 HydrophobicContact CB-CE2 4.49Å; M392-F423 HydrophobicContact CE-CE2 4.19Å; M392-F423 HydrophobicContact CG-CE2 4.32Å
393	E	92.3	Very high	89.4	Confident	60 Å²	60	50.1 Å²	50.1	28%	0.28	28%	0.278	S	S	.	.	H	α-helix	trans	-66.7	-38.7	172.8	-64.7	-174	170.6	0	0	111.6	R24 I28 V389 G390 L396 G397	R24-E393 WeakPolarHBondContact CD-OE1 3.34Å; R24-E393 IonicContact NE-OE1 2.59Å; I28-E393 HydrophobicContact CD1-CB 4.06Å; I28-E393 HydrophobicContact CD1-CG 3.65Å; I28-E393 HydrophobicContact CG1-CG 4.42Å; V389-E393 HydrophobicContact CG1-CG 4.4Å; V389-E393 WeakPolarHBondContact O-CG 3.42Å; V389-E393 PolarHBondContact O-N 2.98Å; G390-E393 PolarHBondContact O-N 3.32Å; E393-L396 PolarHBondContact O-N 3.46Å; E393-G397 PolarHBondContact O-N 3.04Å
394	E	91.1	Very high	89.4	Confident	121 Å²	121	48.1 Å²	48.1	57%	0.565	27%	0.273	S	S	*	.	H	α-helix	trans	-61.8	-43.4	171	-72.7	162.2	-154.7	0	0	112.2	G390 L396 G397 S398	G390-E394 WeakPolarHBondContact O-CG 3.5Å; G390-E394 PolarHBondContact O-N 3.03Å; E394-L396 VanDerWaalsContact C-N 3.33Å; E394-L396 PolarHBondContact O-N 3.34Å; E394-G397 PolarHBondContact O-N 3.09Å; E394-S398 PolarHBondContact O-N 2.81Å
395	L	92.4	Very high	89.8	Confident	6 Å²	6	50.1 Å²	50.1	3%	0.031	29%	0.294	C	S	.	.	H	α-helix	trans	-56.4	-48	174.6	-176.5	67.1	0	0	0	110.7	M377 M380 V381 I386 K391 M392 S398 Y399	M377-L395 HydrophobicContact CB-CD2 4.49Å; M377-L395 HydrophobicContact CG-CD2 4.45Å; M380-L395 HydrophobicContact CB-CD1 3.79Å; M380-L395 HydrophobicContact CB-CD2 4.28Å; M380-L395 HydrophobicContact CE-CD1 3.38Å; M380-L395 HydrophobicContact CG-CD1 4.1Å; V381-L395 HydrophobicContact CG2-CD2 4Å; I386-L395 HydrophobicContact CD1-CB 4.29Å; I386-L395 HydrophobicContact CD1-CD1 4.24Å; I386-L395 HydrophobicContact CD1-CD2 3.96Å; I386-L395 HydrophobicContact CD1-CG 4.4Å; K391-L395 WeakPolarHBondContact O-CB 3.4Å; K391-L395 PolarHBondContact O-N 3.47Å; M392-L395 WeakPolarHBondContact O-CB 3.27Å; M392-L395 PolarHBondContact O-N 3.05Å; M392-L395 HydrophobicContact SD-CD2 4.07Å; L395-S398 PolarHBondContact O-N 2.83Å; L395-S398 PolarHBondContact O-OG 2.94Å; L395-Y399 HydrophobicContact CD1-CD2 4.32Å; L395-Y399 HydrophobicContact CD1-CE2 3.71Å; L395-Y399 HydrophobicContact CG-CD2 4.22Å; L395-Y399 HydrophobicContact CG-CE2 3.89Å; L395-Y399 VanDerWaalsContact O-CD2 3.27Å; L395-Y399 WeakPolarHBondContact O-CD2 3.27Å; L395-Y399 PolarHBondContact O-N 3.23Å
396	L	94.3	Very high	89.9	Confident	0 Å²	0	48.1 Å²	48.1	0%	0	29%	0.286	C	S	.	.	H	α-helix	trans	-60.5	-45.9	175.8	179.7	60.2	0	0	0	112	L25 I28 M392 E393 E394 S398 Y399 L400 I411 L412 F415	L25-L396 HydrophobicContact CD2-CD2 3.46Å; L25-L396 VanDerWaalsContact CD2-CD2 3.46Å; I28-L396 HydrophobicContact CD1-CD2 4.26Å; I28-L396 HydrophobicContact CG2-CD2 4.47Å; M392-L396 PolarHBondContact O-N 3.1Å; M392-L396 VanDerWaalsContact O-N 3.11Å; E393-L396 PolarHBondContact O-N 3.46Å; E394-L396 VanDerWaalsContact C-N 3.33Å; E394-L396 PolarHBondContact O-N 3.34Å; L396-S398 PolarHBondContact O-N 3.12Å; L396-Y399 PolarHBondContact O-N 2.86Å; L396-Y399 VanDerWaalsContact O-N 3.16Å; L396-L400 HydrophobicContact CD1-CD1 3.98Å; L396-L400 HydrophobicContact CD1-CD2 4.43Å; L396-L400 HydrophobicContact CD1-CG 3.96Å; L396-L400 HydrophobicContact CD2-CD1 4.39Å; L396-L400 HydrophobicContact CG-CD1 3.83Å; L396-L400 HydrophobicContact CG-CG 4.23Å; L396-L400 WeakPolarHBondContact O-CG 3.39Å; L396-L400 PolarHBondContact O-N 3.31Å; L396-I411 HydrophobicContact CD1-CG2 3.84Å; L396-L412 HydrophobicContact CD1-CD2 4.16Å; L396-L412 HydrophobicContact CD2-CD2 4.21Å; L396-F415 HydrophobicContact CB-CD2 3.91Å; L396-F415 HydrophobicContact CB-CE2 3.63Å; L396-F415 HydrophobicContact CB-CG 4.46Å; L396-F415 HydrophobicContact CB-CZ 3.95Å; L396-F415 HydrophobicContact CD1-CB 4.13Å; L396-F415 HydrophobicContact CD1-CD1 4.45Å; L396-F415 HydrophobicContact CD1-CD2 4.08Å; L396-F415 HydrophobicContact CD1-CG 3.97Å; L396-F415 HydrophobicContact CD2-CD1 3.95Å; L396-F415 HydrophobicContact CD2-CD2 4.48Å; L396-F415 HydrophobicContact CD2-CE1 3.83Å; L396-F415 HydrophobicContact CD2-CE2 4.38Å; L396-F415 HydrophobicContact CD2-CG 4.25Å; L396-F415 HydrophobicContact CD2-CZ 4.04Å; L396-F415 HydrophobicContact CG-CD2 4.37Å; L396-F415 HydrophobicContact CG-CE2 4.42Å; L396-F415 HydrophobicContact CG-CG 4.45Å
397	G	92.1	Very high	90.1	Very high	32 Å²	32	48.5 Å²	48.5	33%	0.33	29%	0.288	S	S	.	.	H	α-helix	trans	-56.1	-39	176	0	0	0	0	0	112.7	E393 E394 L400 S401	E393-G397 PolarHBondContact O-N 3.04Å; E394-G397 PolarHBondContact O-N 3.09Å; G397-L400 PolarHBondContact O-N 3.22Å; G397-S401 WeakPolarHBondContact O-CB 3.42Å; G397-S401 PolarHBondContact O-N 3.09Å; G397-S401 PolarHBondContact O-OG 2.9Å
398	S	90.1	Very high	90.6	Very high	30 Å²	30	47.1 Å²	47.1	21%	0.21	27%	0.268	C	S	.	.	H	α-helix	trans	-64.7	-43.5	175.8	81.2	0	0	0	0	112.6	E394 L395 L396 S401 L402	E394-S398 PolarHBondContact O-N 2.81Å; L395-S398 PolarHBondContact O-N 2.83Å; L395-S398 PolarHBondContact O-OG 2.94Å; L396-S398 PolarHBondContact O-N 3.12Å; S398-S401 PolarHBondContact O-OG 3.48Å; S398-S401 VanDerWaalsContact O-OG 3.12Å; S398-L402 WeakPolarHBondContact O-CB 3.37Å; S398-L402 VanDerWaalsContact O-CG 3.25Å; S398-L402 WeakPolarHBondContact O-CG 3.35Å; S398-L402 PolarHBondContact O-N 3.48Å; S398-L402 VanDerWaalsContact O-N 3.16Å
399	Y	92.1	Very high	90.8	Very high	0 Å²	0	49.1 Å²	49.1	0%	0	28%	0.28	C	S	.	.	H	α-helix	trans	-66.4	-42.5	175.6	-77.7	-76	0	0	0	112.6	L110 V111 F373 S376 M377 L395 L396 N403	L110-Y399 HydrophobicContact CD1-CD1 4.27Å; L110-Y399 HydrophobicContact CD1-CD2 4.35Å; L110-Y399 HydrophobicContact CD1-CE1 3.83Å; L110-Y399 HydrophobicContact CD1-CE2 3.92Å; V111-Y399 HydrophobicContact CB-CE1 4.42Å; F373-Y399 AromaticContact CD1-CD1 3.82Å; F373-Y399 HydrophobicContact CD1-CD1 3.82Å; F373-Y399 HydrophobicContact CD1-CE1 4.04Å; F373-Y399 HydrophobicContact CE1-CD1 4.12Å; S376-Y399 VanDerWaalsContact C-OH 3.24Å; S376-Y399 VanDerWaalsContact CB-OH 3.31Å; S376-Y399 WeakPolarHBondContact CB-OH 3.28Å; S376-Y399 PolarHBondContact O-OH 2.98Å; S376-Y399 PolarHBondContact OG-OH 2.97Å; M377-Y399 HydrophobicContact CE-CD1 4.5Å; M377-Y399 HydrophobicContact CE-CD2 3.56Å; M377-Y399 HydrophobicContact CE-CE2 3.97Å; M377-Y399 HydrophobicContact CE-CG 3.88Å; M377-Y399 HydrophobicContact CG-CD2 4.04Å; M377-Y399 HydrophobicContact CG-CE2 3.44Å; M377-Y399 VanDerWaalsContact CG-CE2 3.44Å; M377-Y399 PolarHBondContact N-OH 2.96Å; L395-Y399 HydrophobicContact CD1-CD2 4.32Å; L395-Y399 HydrophobicContact CD1-CE2 3.71Å; L395-Y399 HydrophobicContact CG-CD2 4.22Å; L395-Y399 HydrophobicContact CG-CE2 3.89Å; L395-Y399 VanDerWaalsContact O-CD2 3.27Å; L395-Y399 WeakPolarHBondContact O-CD2 3.27Å; L395-Y399 PolarHBondContact O-N 3.23Å; L396-Y399 PolarHBondContact O-N 2.86Å; L396-Y399 VanDerWaalsContact O-N 3.16Å; Y399-N403 VanDerWaalsContact O-CB 3.31Å; Y399-N403 WeakPolarHBondContact O-CB 3.08Å; Y399-N403 PolarHBondContact O-N 2.74Å; Y399-N403 VanDerWaalsContact O-N 3.09Å; Y399-N403 PolarHBondContact O-ND2 3.4Å
400	L	92.3	Very high	90.9	Very high	20 Å²	20	48 Å²	48	11%	0.105	28%	0.275	C	S	.	.	H	α-helix	trans	-68.3	-33.9	-178.2	-66.6	177.1	0	0	0	112.8	L29 L396 G397 H408 I411	L29-L400 HydrophobicContact CD2-CD1 4.39Å; L396-L400 HydrophobicContact CD1-CD1 3.98Å; L396-L400 HydrophobicContact CD1-CD2 4.43Å; L396-L400 HydrophobicContact CD1-CG 3.96Å; L396-L400 HydrophobicContact CD2-CD1 4.39Å; L396-L400 HydrophobicContact CG-CD1 3.83Å; L396-L400 HydrophobicContact CG-CG 4.23Å; L396-L400 WeakPolarHBondContact O-CG 3.39Å; L396-L400 PolarHBondContact O-N 3.31Å; G397-L400 PolarHBondContact O-N 3.22Å; L400-H408 HydrophobicContact CD2-CB 3.94Å; L400-H408 PolarHBondContact O-CE1 3.44Å; L400-H408 PolarHBondContact O-NE2 3.1Å; L400-I411 HydrophobicContact CD2-CB 4.4Å; L400-I411 HydrophobicContact CD2-CG2 3.91Å; L400-I411 HydrophobicContact CG-CG2 4.42Å
401	S	88.9	Confident	91	Very high	95 Å²	95	46.5 Å²	46.5	66%	0.664	26%	0.259	S	S	*	.	H	α-helix	trans	-77.3	-33.9	177.9	52.3	0	0	0	0	113.6	G397 S398	G397-S401 WeakPolarHBondContact O-CB 3.42Å; G397-S401 PolarHBondContact O-N 3.09Å; G397-S401 PolarHBondContact O-OG 2.9Å; S398-S401 PolarHBondContact O-OG 3.48Å; S398-S401 VanDerWaalsContact O-OG 3.12Å
402	L	88.2	Confident	91.3	Very high	61 Å²	61	46.1 Å²	46.1	32%	0.319	26%	0.26	S	S	.	.	H	α-helix	trans	-82.2	-26.3	178.9	-67	-178.5	0	0	0	114	L110 H112 S398	L110-L402 HydrophobicContact CD2-CD1 3.34Å; L110-L402 HydrophobicContact CG-CD1 3.7Å; H112-L402 PolarHBondContact CE1-O 3.16Å; H112-L402 PolarHBondContact NE2-O 3.12Å; H112-L402 VanDerWaalsContact NE2-O 3.15Å; S398-L402 WeakPolarHBondContact O-CB 3.37Å; S398-L402 VanDerWaalsContact O-CG 3.25Å; S398-L402 WeakPolarHBondContact O-CG 3.35Å; S398-L402 PolarHBondContact O-N 3.48Å; S398-L402 VanDerWaalsContact O-N 3.16Å
403	N	87.9	Confident	91.5	Very high	6 Å²	6	48 Å²	48	3%	0.032	28%	0.275	C	S	.	.	S	Bend	trans	-107	143.9	-173.3	-65.9	-92.5	0	0	0	111.6	I113 F373 Y399 H407 H408 I411	I113-N403 WeakPolarHBondContact CA-OD1 3.47Å; I113-N403 PolarHBondContact N-OD1 2.83Å; F373-N403 WeakPolarHBondContact CE1-OD1 3.36Å; F373-N403 HydrophobicContact CZ-CB 4.45Å; F373-N403 WeakPolarHBondContact CZ-OD1 3.44Å; Y399-N403 VanDerWaalsContact O-CB 3.31Å; Y399-N403 WeakPolarHBondContact O-CB 3.08Å; Y399-N403 PolarHBondContact O-N 2.74Å; Y399-N403 VanDerWaalsContact O-N 3.09Å; Y399-N403 PolarHBondContact O-ND2 3.4Å; N403-H407 HydrophobicContact CB-CB 4.26Å; N403-H408 PolarHBondContact O-NE2 3.02Å; N403-H408 VanDerWaalsContact O-NE2 3.1Å; N403-I411 HydrophobicContact CB-CD1 3.58Å
404	S	86.9	Confident	91.7	Very high	47 Å²	47	45.2 Å²	45.2	33%	0.329	26%	0.262	S	S	.	.			trans	-57.6	149.7	178	83	0	0	0	0	111.8	R406 H407 H408	S404-R406 PolarHBondContact O-N 3.48Å; S404-H407 PolarHBondContact O-N 2.93Å; S404-H407 PolarHBondContact OG-CD2 3.39Å; S404-H407 VanDerWaalsContact OG-CD2 3.31Å; S404-H407 PolarHBondContact OG-NE2 3.06Å; S404-H408 PolarHBondContact O-CD2 3.46Å
405	P	90.5	Very high	91.9	Very high	99 Å²	99	39.5 Å²	39.5	64%	0.643	24%	0.235	S	C	*	.	G	3₁₀ helix	trans	-54.4	-22	178.1	-29.5	36.5	0	0	0	114.8	H407 H408	P405-H407 PolarHBondContact O-N 3.1Å; P405-H408 PolarHBondContact O-N 3.05Å
406	R	88.7	Confident	92	Very high	171 Å²	171	42.5 Å²	42.5	65%	0.645	25%	0.249	S	C	*	.	G	3₁₀ helix	trans	-63.1	-20.1	174.1	-57.1	179.1	71.4	-161	-0	113.1	C117 S404	C117-R406 PolarHBondContact O-NH1 2.93Å; C117-R406 VanDerWaalsContact O-NH1 3.13Å; C117-R406 PolarHBondContact O-NH2 3.03Å; C117-R406 VanDerWaalsContact O-NH2 3.14Å; S404-R406 PolarHBondContact O-N 3.48Å
407	H	89	Confident	92	Very high	18 Å²	18	45 Å²	45	8%	0.083	26%	0.263	C	S	.	.	G	3₁₀ helix	trans	-99.3	-14.5	178	-57.5	-42	0	0	0	113.8	V115 F373 N403 S404 P405 P409 A410 I411	V115-H407 VanDerWaalsContact CB-CE1 3.41Å; V115-H407 WeakPolarHBondContact CB-CE1 3.47Å; V115-H407 WeakPolarHBondContact CB-NE2 3.46Å; V115-H407 WeakPolarHBondContact CG2-CE1 3.27Å; V115-H407 WeakPolarHBondContact CG2-NE2 3.17Å; F373-H407 HydrophobicContact CE2-CB 3.92Å; F373-H407 HydrophobicContact CZ-CB 3.91Å; N403-H407 HydrophobicContact CB-CB 4.26Å; S404-H407 PolarHBondContact O-N 2.93Å; S404-H407 PolarHBondContact OG-CD2 3.39Å; S404-H407 VanDerWaalsContact OG-CD2 3.31Å; S404-H407 PolarHBondContact OG-NE2 3.06Å; P405-H407 PolarHBondContact O-N 3.1Å; H407-P409 VanDerWaalsContact C-CD 3.43Å; H407-P409 VanDerWaalsContact C-N 3.3Å; H407-A410 PolarHBondContact O-N 3.14Å; H407-I411 HydrophobicContact CB-CD1 3.97Å; H407-I411 HydrophobicContact CB-CG1 4.47Å; H407-I411 WeakPolarHBondContact O-CG1 3.45Å; H407-I411 PolarHBondContact O-N 2.93Å
408	H	93.2	Very high	92.1	Very high	47 Å²	47	43.6 Å²	43.6	22%	0.218	25%	0.248	C	C	.	.	H	α-helix	trans	-53.4	-38.9	-177.5	-67.7	-171.5	0	0	0	113.4	L400 N403 S404 P405 A410 I411 L412	L400-H408 HydrophobicContact CD2-CB 3.94Å; L400-H408 PolarHBondContact O-CE1 3.44Å; L400-H408 PolarHBondContact O-NE2 3.1Å; N403-H408 PolarHBondContact O-NE2 3.02Å; N403-H408 VanDerWaalsContact O-NE2 3.1Å; S404-H408 PolarHBondContact O-CD2 3.46Å; P405-H408 PolarHBondContact O-N 3.05Å; H408-A410 PolarHBondContact O-N 3.13Å; H408-I411 PolarHBondContact O-N 3.15Å; H408-L412 WeakPolarHBondContact O-CB 3.17Å; H408-L412 VanDerWaalsContact O-CG 3.27Å; H408-L412 WeakPolarHBondContact O-CG 3.41Å; H408-L412 PolarHBondContact O-N 3.39Å
409	P	93.2	Very high	92.2	Very high	94 Å²	94	42.7 Å²	42.7	61%	0.61	24%	0.24	S	C	*	.	H	α-helix	trans	-61.4	-38.9	174.4	-24.8	35.5	0	0	0	114	H407 A413	H407-P409 VanDerWaalsContact C-CD 3.43Å; H407-P409 VanDerWaalsContact C-N 3.3Å; P409-A413 WeakPolarHBondContact O-CB 3.39Å; P409-A413 PolarHBondContact O-N 2.92Å; P409-A413 VanDerWaalsContact O-N 3.11Å
410	A	93.4	Very high	92.2	Very high	20 Å²	20	47.1 Å²	47.1	17%	0.165	26%	0.26	C	S	.	.	H	α-helix	trans	-74.1	-34.8	178.2	0	0	0	0	0	112.1	P369 F373 H407 H408 A414	P369-A410 HydrophobicContact CB-CB 4.31Å; P369-A410 HydrophobicContact CG-CB 4.23Å; F373-A410 HydrophobicContact CD2-CB 4.15Å; F373-A410 HydrophobicContact CE2-CB 4.32Å; H407-A410 PolarHBondContact O-N 3.14Å; H408-A410 PolarHBondContact O-N 3.13Å; A410-A414 VanDerWaalsContact O-CB 3.27Å; A410-A414 WeakPolarHBondContact O-CB 3.36Å; A410-A414 PolarHBondContact O-N 3.04Å
411	I	94	Very high	92.2	Very high	0 Å²	0	49.8 Å²	49.8	0%	0	29%	0.285	C	S	.	.	H	α-helix	trans	-65.2	-47.2	174.1	-67.4	165.4	0	0	0	110.3	F373 M377 L396 L400 N403 H407 H408 A414 F415	F373-I411 HydrophobicContact CD1-CD1 4.5Å; F373-I411 HydrophobicContact CD1-CG1 3.79Å; F373-I411 HydrophobicContact CD2-CG1 3.61Å; F373-I411 HydrophobicContact CE1-CD1 3.95Å; F373-I411 HydrophobicContact CE1-CG1 3.68Å; F373-I411 HydrophobicContact CE2-CD1 4.15Å; F373-I411 HydrophobicContact CE2-CG1 3.52Å; F373-I411 HydrophobicContact CG-CG1 3.77Å; F373-I411 HydrophobicContact CZ-CD1 3.76Å; F373-I411 HydrophobicContact CZ-CG1 3.55Å; M377-I411 HydrophobicContact CE-CG2 3.71Å; L396-I411 HydrophobicContact CD1-CG2 3.84Å; L400-I411 HydrophobicContact CD2-CB 4.4Å; L400-I411 HydrophobicContact CD2-CG2 3.91Å; L400-I411 HydrophobicContact CG-CG2 4.42Å; N403-I411 HydrophobicContact CB-CD1 3.58Å; H407-I411 HydrophobicContact CB-CD1 3.97Å; H407-I411 HydrophobicContact CB-CG1 4.47Å; H407-I411 WeakPolarHBondContact O-CG1 3.45Å; H407-I411 PolarHBondContact O-N 2.93Å; H408-I411 PolarHBondContact O-N 3.15Å; I411-A414 PolarHBondContact O-N 3.26Å; I411-F415 VanDerWaalsContact O-CB 3.27Å; I411-F415 WeakPolarHBondContact O-CB 3.4Å; I411-F415 PolarHBondContact O-N 2.98Å
412	L	96	Very high	92.2	Very high	42 Å²	42	47.8 Å²	47.8	22%	0.22	27%	0.269	C	S	.	.	H	α-helix	trans	-65.9	-41.4	-179.8	-71.3	168.6	0	0	0	112.1	L25 L396 H408 F415 E416	L25-L412 HydrophobicContact CD2-CD2 4.09Å; L396-L412 HydrophobicContact CD1-CD2 4.16Å; L396-L412 HydrophobicContact CD2-CD2 4.21Å; H408-L412 WeakPolarHBondContact O-CB 3.17Å; H408-L412 VanDerWaalsContact O-CG 3.27Å; H408-L412 WeakPolarHBondContact O-CG 3.41Å; H408-L412 PolarHBondContact O-N 3.39Å; L412-F415 PolarHBondContact O-N 2.98Å; L412-E416 PolarHBondContact O-N 2.99Å
413	A	94.8	Very high	92.2	Very high	40 Å²	40	47.4 Å²	47.4	33%	0.331	27%	0.265	S	S	.	.	H	α-helix	trans	-63.2	-46.1	174.5	0	0	0	0	0	112	Y370 P409 F415 E416 D417	Y370-A413 HydrophobicContact CD2-CB 3.99Å; Y370-A413 HydrophobicContact CE2-CB 4.28Å; P409-A413 WeakPolarHBondContact O-CB 3.39Å; P409-A413 PolarHBondContact O-N 2.92Å; P409-A413 VanDerWaalsContact O-N 3.11Å; A413-F415 VanDerWaalsContact C-N 3.27Å; A413-F415 PolarHBondContact O-N 3.15Å; A413-E416 PolarHBondContact O-N 2.86Å; A413-D417 PolarHBondContact O-N 3.18Å
414	A	95.7	Very high	91.8	Very high	0 Å²	0	48.5 Å²	48.5	0%	0	28%	0.277	C	S	.	.	H	α-helix	trans	-60.7	-37.7	175.1	0	0	0	0	0	112.5	Y370 F373 R374 M377 A410 I411 V418	Y370-A414 HydrophobicContact CD2-CB 4.09Å; Y370-A414 HydrophobicContact CE2-CB 4.38Å; F373-A414 HydrophobicContact CB-CB 3.81Å; R374-A414 HydrophobicContact CB-CB 3.84Å; M377-A414 HydrophobicContact SD-CB 4.13Å; A410-A414 VanDerWaalsContact O-CB 3.27Å; A410-A414 WeakPolarHBondContact O-CB 3.36Å; A410-A414 PolarHBondContact O-N 3.04Å; I411-A414 PolarHBondContact O-N 3.26Å; A414-V418 WeakPolarHBondContact O-CG2 3.48Å; A414-V418 PolarHBondContact O-N 3.11Å
415	F	95.4	Very high	90.6	Very high	1 Å²	1	55.9 Å²	55.9	0%	0.004	31%	0.307	C	S	.	.	H	α-helix	trans	-68.4	-39.4	177.2	-176.5	-98.2	0	0	0	112.6	L21 L25 M377 M392 L396 I411 L412 A413 V418 W419	L21-F415 HydrophobicContact CD1-CD1 4.34Å; L21-F415 HydrophobicContact CD1-CE1 3.9Å; L25-F415 HydrophobicContact CD2-CD1 3.91Å; L25-F415 HydrophobicContact CD2-CE1 3.82Å; M377-F415 HydrophobicContact CE-CB 4.13Å; M377-F415 HydrophobicContact SD-CB 4Å; M377-F415 HydrophobicContact SD-CD2 4.3Å; M392-F415 HydrophobicContact CG-CE2 3.57Å; M392-F415 HydrophobicContact CG-CZ 3.69Å; M392-F415 VanDerWaalsContact O-CE2 3.31Å; M392-F415 WeakPolarHBondContact O-CE2 3.42Å; M392-F415 HydrophobicContact SD-CD2 4.47Å; M392-F415 HydrophobicContact SD-CE2 3.74Å; M392-F415 HydrophobicContact SD-CZ 4.42Å; L396-F415 HydrophobicContact CB-CD2 3.91Å; L396-F415 HydrophobicContact CB-CE2 3.63Å; L396-F415 HydrophobicContact CB-CG 4.46Å; L396-F415 HydrophobicContact CB-CZ 3.95Å; L396-F415 HydrophobicContact CD1-CB 4.13Å; L396-F415 HydrophobicContact CD1-CD1 4.45Å; L396-F415 HydrophobicContact CD1-CD2 4.08Å; L396-F415 HydrophobicContact CD1-CG 3.97Å; L396-F415 HydrophobicContact CD2-CD1 3.95Å; L396-F415 HydrophobicContact CD2-CD2 4.48Å; L396-F415 HydrophobicContact CD2-CE1 3.83Å; L396-F415 HydrophobicContact CD2-CE2 4.38Å; L396-F415 HydrophobicContact CD2-CG 4.25Å; L396-F415 HydrophobicContact CD2-CZ 4.04Å; L396-F415 HydrophobicContact CG-CD2 4.37Å; L396-F415 HydrophobicContact CG-CE2 4.42Å; L396-F415 HydrophobicContact CG-CG 4.45Å; I411-F415 VanDerWaalsContact O-CB 3.27Å; I411-F415 WeakPolarHBondContact O-CB 3.4Å; I411-F415 PolarHBondContact O-N 2.98Å; L412-F415 PolarHBondContact O-N 2.98Å; A413-F415 VanDerWaalsContact C-N 3.27Å; A413-F415 PolarHBondContact O-N 3.15Å; F415-V418 PolarHBondContact O-N 3.49Å; F415-W419 HydrophobicContact CE1-CD2 4.45Å; F415-W419 AromaticContact CE1-CE3 3.72Å; F415-W419 HydrophobicContact CE1-CE3 3.72Å; F415-W419 HydrophobicContact CE1-CZ3 4.42Å; F415-W419 HydrophobicContact CE2-CE3 4.45Å; F415-W419 AromaticContact CZ-CE3 3.54Å; F415-W419 HydrophobicContact CZ-CE3 3.54Å; F415-W419 HydrophobicContact CZ-CZ3 4.01Å; F415-W419 WeakPolarHBondContact O-CB 3.25Å; F415-W419 PolarHBondContact O-N 2.76Å
416	E	95	Very high	88.5	Confident	69 Å²	69	59.2 Å²	59.2	32%	0.322	31%	0.314	S	S	.	.	H	α-helix	trans	-59.8	-45.9	176.3	178.3	159	-143.1	0	0	111.5	L21 L412 A413 V418 W419 E420	L21-E416 HydrophobicContact CD2-CB 3.92Å; L21-E416 HydrophobicContact CD2-CG 3.67Å; L412-E416 PolarHBondContact O-N 2.99Å; A413-E416 PolarHBondContact O-N 2.86Å; E416-V418 PolarHBondContact O-N 3.11Å; E416-W419 PolarHBondContact O-N 2.81Å; E416-E420 PolarHBondContact O-N 3.23Å
417	D	94.7	Very high	88.5	Confident	53 Å²	53	53.7 Å²	53.7	28%	0.283	30%	0.297	S	S	.	.	H	α-helix	trans	-64.8	-38.1	176.5	-67.1	-53.9	0	0	0	113.5	Y370 R374 A413 A421	Y370-D417 WeakPolarHBondContact CE2-OD2 3.42Å; Y370-D417 PolarHBondContact OH-OD2 2.97Å; R374-D417 IonicContact NE-OD2 3.97Å; A413-D417 PolarHBondContact O-N 3.18Å; D417-A421 VanDerWaalsContact O-CB 3.27Å; D417-A421 WeakPolarHBondContact O-CB 3.37Å; D417-A421 PolarHBondContact O-N 2.84Å
418	V	93.9	Very high	88.5	Confident	3 Å²	3	55.5 Å²	55.5	2%	0.018	31%	0.308	C	S	.	.	H	α-helix	trans	-73.1	-34.8	178	174.2	0	0	0	0	110.5	R374 M377 V378 V381 M392 A414 F415 E416 A421 V422	R374-V418 HydrophobicContact CG-CG2 4.03Å; M377-V418 HydrophobicContact CB-CG1 4.38Å; M377-V418 HydrophobicContact CB-CG2 4.03Å; V378-V418 HydrophobicContact CG2-CG2 3.74Å; V381-V418 HydrophobicContact CG2-CG1 4.03Å; M392-V418 HydrophobicContact CE-CG1 4.07Å; A414-V418 WeakPolarHBondContact O-CG2 3.48Å; A414-V418 PolarHBondContact O-N 3.11Å; F415-V418 PolarHBondContact O-N 3.49Å; E416-V418 PolarHBondContact O-N 3.11Å; V418-A421 PolarHBondContact O-N 3.3Å; V418-V422 HydrophobicContact CG1-CG2 4.46Å; V418-V422 WeakPolarHBondContact O-CB 3.27Å; V418-V422 VanDerWaalsContact O-CG2 3.26Å; V418-V422 WeakPolarHBondContact O-CG2 3.35Å; V418-V422 PolarHBondContact O-N 3.22Å
419	W	93	Very high	88.2	Confident	11 Å²	11	56 Å²	56	4%	0.042	31%	0.314	C	S	.	.	H	α-helix	trans	-65.8	-46.7	174.1	-174.8	-76.7	0	0	0	111.8	L21 R24 V389 M392 F415 E416 A421 V422 F423	L21-W419 HydrophobicContact CD1-CB 4.25Å; L21-W419 HydrophobicContact CD1-CD2 3.71Å; L21-W419 HydrophobicContact CD1-CE3 4.16Å; L21-W419 HydrophobicContact CD1-CG 3.7Å; L21-W419 HydrophobicContact CD2-CB 4.11Å; L21-W419 HydrophobicContact CD2-CG 4.04Å; L21-W419 HydrophobicContact CG-CG 4.31Å; R24-W419 VanDerWaalsContact NH1-CZ2 3.35Å; V389-W419 HydrophobicContact CB-CH2 4.36Å; V389-W419 HydrophobicContact CG1-CH2 4.12Å; V389-W419 HydrophobicContact CG2-CH2 4.07Å; M392-W419 HydrophobicContact CB-CE3 4.38Å; M392-W419 HydrophobicContact CB-CZ3 3.92Å; M392-W419 HydrophobicContact CG-CE3 3.5Å; M392-W419 HydrophobicContact CG-CZ3 3.54Å; F415-W419 HydrophobicContact CE1-CD2 4.45Å; F415-W419 AromaticContact CE1-CE3 3.72Å; F415-W419 HydrophobicContact CE1-CE3 3.72Å; F415-W419 HydrophobicContact CE1-CZ3 4.42Å; F415-W419 HydrophobicContact CE2-CE3 4.45Å; F415-W419 AromaticContact CZ-CE3 3.54Å; F415-W419 HydrophobicContact CZ-CE3 3.54Å; F415-W419 HydrophobicContact CZ-CZ3 4.01Å; F415-W419 WeakPolarHBondContact O-CB 3.25Å; F415-W419 PolarHBondContact O-N 2.76Å; E416-W419 PolarHBondContact O-N 2.81Å; W419-A421 VanDerWaalsContact C-N 3.31Å; W419-A421 PolarHBondContact O-N 3.02Å; W419-V422 PolarHBondContact O-N 2.86Å; W419-F423 AromaticContact CD2-CD2 3.62Å; W419-F423 HydrophobicContact CD2-CD2 3.62Å; W419-F423 AromaticContact CD2-CE2 3.96Å; W419-F423 HydrophobicContact CD2-CE2 3.96Å; W419-F423 AromaticContact CE2-CD2 3.45Å; W419-F423 VanDerWaalsContact CE2-CD2 3.45Å; W419-F423 AromaticContact CE2-CE2 3.97Å; W419-F423 HydrophobicContact CE3-CD2 4.05Å; W419-F423 AromaticContact CE3-CE2 3.89Å; W419-F423 HydrophobicContact CE3-CE2 3.89Å; W419-F423 HydrophobicContact CG-CD2 4.02Å; W419-F423 HydrophobicContact CH2-CD2 4.13Å; W419-F423 AromaticContact CH2-CE2 3.83Å; W419-F423 HydrophobicContact CH2-CE2 3.83Å; W419-F423 AromaticContact CZ2-CD2 3.71Å; W419-F423 HydrophobicContact CZ2-CD2 3.71Å; W419-F423 AromaticContact CZ2-CE2 3.9Å; W419-F423 HydrophobicContact CZ2-CE2 3.9Å; W419-F423 HydrophobicContact CZ2-CG 4.36Å; W419-F423 HydrophobicContact CZ3-CD2 4.31Å; W419-F423 AromaticContact CZ3-CE2 3.84Å; W419-F423 HydrophobicContact CZ3-CE2 3.84Å; W419-F423 AromaticContact NE1-CD2 3.78Å; W419-F423 PolarHBondContact O-N 3.34Å
420	E	92	Very high	88	Confident	93 Å²	93	53.8 Å²	53.8	44%	0.435	30%	0.296	S	S	.	.	H	α-helix	trans	-62.9	-38.4	174.4	-169.1	175	179.7	0	0	110.9	E416 V422 G424	E416-E420 PolarHBondContact O-N 3.23Å; E420-V422 VanDerWaalsContact C-N 3.3Å; E420-V422 PolarHBondContact O-N 3.19Å; E420-G424 WeakPolarHBondContact O-CA 3.31Å; E420-G424 PolarHBondContact O-N 3.07Å
421	A	91.1	Very high	87.6	Confident	75 Å²	75	55.9 Å²	55.9	62%	0.62	30%	0.304	S	S	*	.	H	α-helix	trans	-67.2	-24.4	175.8	0	0	0	0	0	114.6	D417 V418 W419	D417-A421 VanDerWaalsContact O-CB 3.27Å; D417-A421 WeakPolarHBondContact O-CB 3.37Å; D417-A421 PolarHBondContact O-N 2.84Å; V418-A421 PolarHBondContact O-N 3.3Å; W419-A421 VanDerWaalsContact C-N 3.31Å; W419-A421 PolarHBondContact O-N 3.02Å
422	V	89.4	Confident	87.2	Confident	54 Å²	54	59.6 Å²	59.6	33%	0.327	32%	0.324	S	S	.	.	H	α-helix	trans	-97.1	-30.3	-179.5	173.5	0	0	0	0	112.7	V381 M392 V418 W419 E420	V381-V422 HydrophobicContact CG1-CG2 3.92Å; M392-V422 HydrophobicContact CE-CB 4.08Å; M392-V422 HydrophobicContact CE-CG1 4.15Å; M392-V422 HydrophobicContact CE-CG2 3.88Å; V418-V422 HydrophobicContact CG1-CG2 4.46Å; V418-V422 WeakPolarHBondContact O-CB 3.27Å; V418-V422 VanDerWaalsContact O-CG2 3.26Å; V418-V422 WeakPolarHBondContact O-CG2 3.35Å; V418-V422 PolarHBondContact O-N 3.22Å; W419-V422 PolarHBondContact O-N 2.86Å; E420-V422 VanDerWaalsContact C-N 3.3Å; E420-V422 PolarHBondContact O-N 3.19Å
423	F	89.2	Confident	86.6	Confident	53 Å²	53	60.9 Å²	60.9	23%	0.232	33%	0.332	C	S	.	.	H	α-helix	trans	-127.1	5.1	-172.3	-58.2	-70.5	0	0	0	114.6	A387 V389 M392 W419	A387-F423 WeakPolarHBondContact O-CE1 3.39Å; V389-F423 HydrophobicContact CG2-CE1 4.45Å; V389-F423 HydrophobicContact CG2-CZ 4.33Å; M392-F423 HydrophobicContact CB-CE2 4.49Å; M392-F423 HydrophobicContact CE-CE2 4.19Å; M392-F423 HydrophobicContact CG-CE2 4.32Å; W419-F423 AromaticContact CD2-CD2 3.62Å; W419-F423 HydrophobicContact CD2-CD2 3.62Å; W419-F423 AromaticContact CD2-CE2 3.96Å; W419-F423 HydrophobicContact CD2-CE2 3.96Å; W419-F423 AromaticContact CE2-CD2 3.45Å; W419-F423 VanDerWaalsContact CE2-CD2 3.45Å; W419-F423 AromaticContact CE2-CE2 3.97Å; W419-F423 HydrophobicContact CE3-CD2 4.05Å; W419-F423 AromaticContact CE3-CE2 3.89Å; W419-F423 HydrophobicContact CE3-CE2 3.89Å; W419-F423 HydrophobicContact CG-CD2 4.02Å; W419-F423 HydrophobicContact CH2-CD2 4.13Å; W419-F423 AromaticContact CH2-CE2 3.83Å; W419-F423 HydrophobicContact CH2-CE2 3.83Å; W419-F423 AromaticContact CZ2-CD2 3.71Å; W419-F423 HydrophobicContact CZ2-CD2 3.71Å; W419-F423 AromaticContact CZ2-CE2 3.9Å; W419-F423 HydrophobicContact CZ2-CE2 3.9Å; W419-F423 HydrophobicContact CZ2-CG 4.36Å; W419-F423 HydrophobicContact CZ3-CD2 4.31Å; W419-F423 AromaticContact CZ3-CE2 3.84Å; W419-F423 HydrophobicContact CZ3-CE2 3.84Å; W419-F423 AromaticContact NE1-CD2 3.78Å; W419-F423 PolarHBondContact O-N 3.34Å
424	G	78.4	Confident	85.9	Confident	29 Å²	29	62.5 Å²	62.5	30%	0.299	33%	0.332	S	S	.	.			trans	-90	1.1	-172.4	0	0	0	0	0	116.6	E420	E420-G424 WeakPolarHBondContact O-CA 3.31Å; E420-G424 PolarHBondContact O-N 3.07Å
425	E	62.3	Low	85.1	Confident	201 Å²	201	67.7 Å²	67.7	94%	0.939	36%	0.36	S	S	*	.			trans	-98.8	18.4	-177.6	-60	-164.5	144.2	0	0	114.5
426	E	46.9	Very low	84.2	Confident	170 Å²	170	73.7 Å²	73.7	79%	0.794	39%	0.392	S	S	*	.			trans	-89.4	0	165.8	-71.9	-169.5	146.4	0	0	113.4	R13 R20	R13-E426 PolarHBondContact NH1-O 3.48Å; R20-E426 IonicContact CZ-OE2 3.78Å; R20-E426 IonicContact NH1-OE2 3.18Å; R20-E426 PolarHBondContact NH1-OE2 2.89Å; R20-E426 IonicContact NH2-OE2 3.37Å; R20-E426 PolarHBondContact NH2-OE2 3.24Å

Retrieved 426 of 426 residues in 115.4 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).