A0A5K4F9K2_SCHMA Loading...

Flap endonuclease 1

Structure-specific nuclease with 5'-flap endonuclease and 5'-3' exonuclease activities involved in DNA replication and repair. During DNA replication, cleaves the 5'-overhanging flap structure that is generated by displacement synthesis when DNA polymerase encounters the 5'-end of a downstream Okazaki fragment. It enters the flap from the 5'-end and then tracks to cleave the flap base, leaving a nick for ligation. Also involved in the long patch base excision repair (LP-BER) pathway, by cleaving within the apurinic/apyrimidinic (AP) site-terminated flap. Acts as a genome stabilization factor that prevents flaps from equilibrating into structures that lead to duplications and deletions. Also possesses 5'-3' exonuclease activity on nicked or gapped double-stranded DNA, and exhibits RNase H activity. Also involved in replication and repair of rDNA and in repairing mitochondrial DNA.

AlphaFold DB , UniProt , Accession A0A5K4F9K2, Species SCHMA (Schistosoma mansoni, Blood fluke), Gene FEN1, Length 388 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	80.4	Confident	93.4	Very high	103 Å²	103	45.4 Å²	45.4	51%	0.507	24%	0.24	S	C	.	.				0	-170.4	0	-67	-144.5	-64.9	0	0	107.2	V3 M37 E178 D179 M180	M1-V3 PolarHBondContact O-N 2.94Å; M1-M37 HydrophobicContact CE-CE 3.66Å; M1-M37 HydrophobicContact CE-SD 3.41Å; M1-M37 WeakPolarHBondContact CE-SD 3.27Å; M1-M37 HydrophobicContact CG-SD 4.39Å; M1-E178 PolarHBondContact N-O 3.26Å; M1-D179 WeakPolarHBondContact CB-OD2 3.43Å; M1-M180 PolarHBondContact O-N 3.37Å
2	G	90.1	Very high	93.6	Very high	12 Å²	12	49.4 Å²	49.4	12%	0.124	26%	0.262	C	S	.	.			trans	71.5	-119.3	-173.1	0	0	0	0	0	112.1	H4 D179 D181	G2-H4 PolarHBondContact O-N 3.49Å; G2-D179 WeakPolarHBondContact CA-OD1 3.18Å; G2-D179 PolarHBondContact N-OD1 2.68Å; G2-D179 PolarHBondContact N-OD2 3.24Å; G2-D179 VanDerWaalsContact N-OD2 3.17Å; G2-D181 WeakPolarHBondContact CA-OD1 3.47Å
3	V	94.7	Very high	93.8	Very high	7 Å²	7	51.9 Å²	51.9	4%	0.042	28%	0.275	C	S	.	.	S	Bend	trans	-67.8	119	-174.4	-166.8	0	0	0	0	112.7	M1 Q5 L6 D181 C227 L230 G231	M1-V3 PolarHBondContact O-N 2.94Å; V3-Q5 PolarHBondContact O-N 3.27Å; V3-L6 HydrophobicContact CB-CB 3.67Å; V3-L6 HydrophobicContact CB-CD2 3.75Å; V3-L6 HydrophobicContact CB-CG 4.33Å; V3-L6 HydrophobicContact CG1-CB 3.68Å; V3-L6 HydrophobicContact CG1-CD2 4.07Å; V3-L6 HydrophobicContact CG1-CG 4.36Å; V3-L6 HydrophobicContact CG2-CD2 3.74Å; V3-L6 PolarHBondContact O-N 3.47Å; V3-D181 WeakPolarHBondContact CG2-OD1 2.83Å; V3-D181 PolarHBondContact N-OD1 3.45Å; V3-C227 HydrophobicContact CG1-CB 4.08Å; V3-C227 HydrophobicContact CG2-CB 3.7Å; V3-L230 HydrophobicContact CG1-CB 3.66Å; V3-L230 HydrophobicContact CG1-CD1 3.89Å; V3-L230 HydrophobicContact CG1-CG 4.41Å; V3-G231 WeakPolarHBondContact CA-O 3.39Å
4	H	92.7	Very high	94	Very high	110 Å²	110	48.6 Å²	48.6	51%	0.509	26%	0.259	S	S	.	.	T	Hydrogen-bonded Turn	trans	-60.5	127.1	179.3	-171.6	68.8	0	0	0	112	G2 L6 L230 G231	G2-H4 PolarHBondContact O-N 3.49Å; H4-L6 PolarHBondContact O-N 3.19Å; H4-L230 WeakPolarHBondContact CB-O 3.4Å; H4-G231 PolarHBondContact N-O 3.14Å
5	Q	93.7	Very high	94	Very high	82 Å²	82	54.8 Å²	54.8	38%	0.383	29%	0.286	S	S	.	.	T	Hydrogen-bonded Turn	trans	57.8	7.5	178.5	-66.9	-175.5	69.5	0	0	116.9	V3 S7 K8 V9 P243	V3-Q5 PolarHBondContact O-N 3.27Å; Q5-S7 VanDerWaalsContact C-N 3.31Å; Q5-S7 PolarHBondContact O-N 3Å; Q5-K8 WeakPolarHBondContact O-CA 3.49Å; Q5-K8 WeakPolarHBondContact O-CB 3.48Å; Q5-K8 PolarHBondContact O-N 3.23Å; Q5-V9 PolarHBondContact O-N 3.5Å; Q5-P243 HydrophobicContact CB-CG 3.99Å
6	L	96.7	Very high	94	Very high	0 Å²	0	63.4 Å²	63.4	0%	0	32%	0.32	C	S	.	.	H	α-helix	trans	-57.4	-42	-177.6	179.5	57.6	0	0	0	113	V3 H4 K8 V9 I10 M180 F223 L230	V3-L6 HydrophobicContact CB-CB 3.67Å; V3-L6 HydrophobicContact CB-CD2 3.75Å; V3-L6 HydrophobicContact CB-CG 4.33Å; V3-L6 HydrophobicContact CG1-CB 3.68Å; V3-L6 HydrophobicContact CG1-CD2 4.07Å; V3-L6 HydrophobicContact CG1-CG 4.36Å; V3-L6 HydrophobicContact CG2-CD2 3.74Å; V3-L6 PolarHBondContact O-N 3.47Å; H4-L6 PolarHBondContact O-N 3.19Å; L6-K8 PolarHBondContact O-N 3.21Å; L6-V9 PolarHBondContact O-N 3.08Å; L6-V9 VanDerWaalsContact O-N 3.13Å; L6-I10 HydrophobicContact CD1-CD1 3.96Å; L6-I10 HydrophobicContact CD1-CG1 4.05Å; L6-I10 HydrophobicContact CG-CD1 3.85Å; L6-I10 HydrophobicContact CG-CG1 4.38Å; L6-I10 WeakPolarHBondContact O-CG1 3.29Å; L6-I10 PolarHBondContact O-N 3.37Å; L6-M180 HydrophobicContact CB-CB 4.42Å; L6-M180 HydrophobicContact CB-CE 4.41Å; L6-M180 HydrophobicContact CD2-CB 4.15Å; L6-M180 HydrophobicContact CD2-CE 4.27Å; L6-M180 HydrophobicContact CG-CE 4.06Å; L6-F223 HydrophobicContact CD1-CE2 3.99Å; L6-F223 HydrophobicContact CD1-CZ 4.13Å; L6-F223 HydrophobicContact CD2-CZ 4Å; L6-L230 HydrophobicContact CB-CD1 4.25Å; L6-L230 HydrophobicContact CD1-CD1 3.95Å
7	S	94.8	Very high	94.2	Very high	35 Å²	35	59.8 Å²	59.8	25%	0.245	30%	0.302	C	S	.	.	H	α-helix	trans	-58.1	-35	176.1	-176.1	0	0	0	0	112.7	Q5 G11 R192	Q5-S7 VanDerWaalsContact C-N 3.31Å; Q5-S7 PolarHBondContact O-N 3Å; S7-G11 PolarHBondContact O-N 2.75Å; S7-R192 PolarHBondContact OG-NH1 3.37Å
8	K	94.6	Very high	94.4	Very high	116 Å²	116	58.8 Å²	58.8	50%	0.504	30%	0.299	S	S	.	.	H	α-helix	trans	-74.2	-42.6	176.6	178.6	178.6	-177.4	-58	0	110.7	Q5 L6 I10 G11 D12	Q5-K8 WeakPolarHBondContact O-CA 3.49Å; Q5-K8 WeakPolarHBondContact O-CB 3.48Å; Q5-K8 PolarHBondContact O-N 3.23Å; L6-K8 PolarHBondContact O-N 3.21Å; K8-I10 VanDerWaalsContact C-N 3.31Å; K8-I10 PolarHBondContact O-N 2.94Å; K8-G11 PolarHBondContact O-N 3.47Å; K8-D12 IonicContact NZ-OD2 3.68Å; K8-D12 PolarHBondContact NZ-OD2 2.94Å; K8-D12 WeakPolarHBondContact O-CB 3.32Å; K8-D12 VanDerWaalsContact O-CG 3.23Å; K8-D12 PolarHBondContact O-N 3.32Å
9	V	96.7	Very high	94.5	Very high	6 Å²	6	61.6 Å²	61.6	4%	0.036	31%	0.31	C	S	.	.	H	α-helix	trans	-57.7	-46	175.5	176.3	0	0	0	0	111.1	Q5 L6 D12 N13 L216 L226 L230 P243	Q5-V9 PolarHBondContact O-N 3.5Å; L6-V9 PolarHBondContact O-N 3.08Å; L6-V9 VanDerWaalsContact O-N 3.13Å; V9-D12 PolarHBondContact O-N 3.14Å; V9-N13 WeakPolarHBondContact O-CB 3.42Å; V9-N13 PolarHBondContact O-N 3.49Å; V9-N13 VanDerWaalsContact O-N 3.08Å; V9-N13 PolarHBondContact O-ND2 3.35Å; V9-L216 HydrophobicContact CG1-CD2 4.19Å; V9-L226 HydrophobicContact CG1-CD2 4.46Å; V9-L230 HydrophobicContact CG2-CD1 4.16Å; V9-L230 HydrophobicContact CG2-CD2 4.22Å; V9-P243 HydrophobicContact CG2-CB 3.47Å; V9-P243 VanDerWaalsContact CG2-CB 3.47Å; V9-P243 HydrophobicContact CG2-CG 4.45Å
10	I	97.3	Very high	94.6	Very high	0 Å²	0	63.1 Å²	63.1	0%	0	33%	0.326	C	S	.	.	H	α-helix	trans	-64.1	-45.9	176.4	-64.5	169.7	0	0	0	110.5	L6 K8 D12 N13 A14 A17 V18 M180 L183 F207 V212	L6-I10 HydrophobicContact CD1-CD1 3.96Å; L6-I10 HydrophobicContact CD1-CG1 4.05Å; L6-I10 HydrophobicContact CG-CD1 3.85Å; L6-I10 HydrophobicContact CG-CG1 4.38Å; L6-I10 WeakPolarHBondContact O-CG1 3.29Å; L6-I10 PolarHBondContact O-N 3.37Å; K8-I10 VanDerWaalsContact C-N 3.31Å; K8-I10 PolarHBondContact O-N 2.94Å; I10-D12 VanDerWaalsContact C-N 3.29Å; I10-D12 PolarHBondContact O-N 3.47Å; I10-N13 PolarHBondContact O-N 3.44Å; I10-A14 HydrophobicContact CG2-CB 4.24Å; I10-A14 CarbonylContact O-C 3.43Å; I10-A14 VanDerWaalsContact O-C 3.24Å; I10-A14 VanDerWaalsContact O-CA 3.31Å; I10-A14 WeakPolarHBondContact O-CA 3.32Å; I10-A14 PolarHBondContact O-N 2.95Å; I10-A17 HydrophobicContact CG2-CB 4.41Å; I10-V18 HydrophobicContact CG2-CG2 3.64Å; I10-M180 HydrophobicContact CD1-CE 3.95Å; I10-L183 HydrophobicContact CD1-CD1 3.77Å; I10-F207 HydrophobicContact CB-CE1 4.46Å; I10-F207 HydrophobicContact CD1-CD1 4.13Å; I10-F207 HydrophobicContact CD1-CE1 4.38Å; I10-F207 HydrophobicContact CG2-CD1 4.06Å; I10-F207 HydrophobicContact CG2-CE1 4.14Å; I10-V212 HydrophobicContact CD1-CG1 3.95Å; I10-V212 HydrophobicContact CD1-CG2 3.99Å; I10-V212 HydrophobicContact CG1-CG1 3.97Å; I10-V212 HydrophobicContact CG1-CG2 4.36Å; I10-V212 HydrophobicContact CG2-CG2 3.88Å
11	G	95.5	Very high	94.6	Very high	28 Å²	28	61.4 Å²	61.4	29%	0.289	32%	0.319	S	S	.	.	H	α-helix	trans	-60.8	-35.3	177.9	0	0	0	0	0	113.7	S7 K8 Q15	S7-G11 PolarHBondContact O-N 2.75Å; K8-G11 PolarHBondContact O-N 3.47Å; G11-Q15 WeakPolarHBondContact O-CG 3.5Å
12	D	95.6	Very high	95.3	Very high	94 Å²	94	63 Å²	63	50%	0.503	33%	0.325	S	S	.	.	H	α-helix	trans	-79.3	-32.4	-178.5	-69.3	-16.3	0	0	0	112.5	K8 V9 I10	K8-D12 IonicContact NZ-OD2 3.68Å; K8-D12 PolarHBondContact NZ-OD2 2.94Å; K8-D12 WeakPolarHBondContact O-CB 3.32Å; K8-D12 VanDerWaalsContact O-CG 3.23Å; K8-D12 PolarHBondContact O-N 3.32Å; V9-D12 PolarHBondContact O-N 3.14Å; I10-D12 VanDerWaalsContact C-N 3.29Å; I10-D12 PolarHBondContact O-N 3.47Å
13	N	96.8	Very high	95.6	Very high	82 Å²	82	63.3 Å²	63.3	44%	0.439	32%	0.324	S	S	.	.	H	α-helix	trans	-116.7	-23.8	-168.7	-60.3	-83.6	0	0	0	114.3	V9 I10 L216 L247	V9-N13 WeakPolarHBondContact O-CB 3.42Å; V9-N13 PolarHBondContact O-N 3.49Å; V9-N13 VanDerWaalsContact O-N 3.08Å; V9-N13 PolarHBondContact O-ND2 3.35Å; I10-N13 PolarHBondContact O-N 3.44Å; N13-L216 HydrophobicContact CB-CD2 3.62Å; N13-L247 HydrophobicContact CB-CD2 4.49Å
14	A	96.2	Very high	95.5	Very high	5 Å²	5	69.9 Å²	69.9	4%	0.041	35%	0.352	C	S	.	.			trans	-133.3	48.5	-173.5	0	0	0	0	0	111.6	I10 K16 A17 L216	I10-A14 HydrophobicContact CG2-CB 4.24Å; I10-A14 CarbonylContact O-C 3.43Å; I10-A14 VanDerWaalsContact O-C 3.24Å; I10-A14 VanDerWaalsContact O-CA 3.31Å; I10-A14 WeakPolarHBondContact O-CA 3.32Å; I10-A14 PolarHBondContact O-N 2.95Å; A14-K16 PolarHBondContact O-N 3.49Å; A14-K16 VanDerWaalsContact O-N 3.09Å; A14-A17 HydrophobicContact CB-CB 4.26Å; A14-A17 WeakPolarHBondContact O-CB 3.27Å; A14-A17 PolarHBondContact O-N 2.96Å; A14-L216 HydrophobicContact CB-CD2 4.44Å; A14-L216 HydrophobicContact CB-CG 4.31Å
15	Q	94.4	Very high	95.6	Very high	142 Å²	142	67.2 Å²	67.2	66%	0.664	35%	0.346	S	S	*	.	G	3₁₀ helix	trans	-51.6	-37.4	-174.4	-70.8	176.6	7.6	0	0	114.3	G11 A17 V18	G11-Q15 WeakPolarHBondContact O-CG 3.5Å; Q15-A17 PolarHBondContact O-N 3.31Å; Q15-V18 PolarHBondContact O-N 3.16Å; Q15-V18 VanDerWaalsContact O-N 3.16Å
16	K	94.7	Very high	95.6	Very high	193 Å²	193	63.5 Å²	63.5	84%	0.839	33%	0.328	S	S	*	.	G	3₁₀ helix	trans	-63.8	-19.8	178.8	-65.9	-177.1	-178.8	177.6	0	113.4	A14 V18	A14-K16 PolarHBondContact O-N 3.49Å; A14-K16 VanDerWaalsContact O-N 3.09Å; K16-V18 VanDerWaalsContact C-N 3.3Å
17	A	97	Very high	95.5	Very high	2 Å²	2	66.9 Å²	66.9	2%	0.017	34%	0.343	C	S	.	.	G	3₁₀ helix	trans	-78.7	-14.3	179.2	0	0	0	0	0	113.6	I10 A14 Q15 F207 N208 S211 V212	I10-A17 HydrophobicContact CG2-CB 4.41Å; A14-A17 HydrophobicContact CB-CB 4.26Å; A14-A17 WeakPolarHBondContact O-CB 3.27Å; A14-A17 PolarHBondContact O-N 2.96Å; Q15-A17 PolarHBondContact O-N 3.31Å; A17-F207 WeakPolarHBondContact O-CA 3.35Å; A17-N208 PolarHBondContact O-N 3.33Å; A17-S211 VanDerWaalsContact CB-C 3.46Å; A17-V212 HydrophobicContact CB-CB 4.27Å; A17-V212 HydrophobicContact CB-CG2 3.58Å
18	V	97.1	Very high	95.4	Very high	41 Å²	41	65.7 Å²	65.7	25%	0.248	34%	0.336	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-110.6	124.7	-177.8	-169.5	0	0	0	0	109.9	I10 Q15 K16 E206 F207	I10-V18 HydrophobicContact CG2-CG2 3.64Å; Q15-V18 PolarHBondContact O-N 3.16Å; Q15-V18 VanDerWaalsContact O-N 3.16Å; K16-V18 VanDerWaalsContact C-N 3.3Å; V18-E206 CarbonylContact C-O 3.44Å; V18-E206 VanDerWaalsContact CA-O 3.3Å; V18-E206 WeakPolarHBondContact CA-O 3.29Å; V18-F207 HydrophobicContact CG1-CE1 4.19Å; V18-F207 HydrophobicContact CG1-CE2 4.38Å; V18-F207 HydrophobicContact CG1-CZ 4.06Å; V18-F207 HydrophobicContact CG2-CD1 3.72Å; V18-F207 HydrophobicContact CG2-CE1 3.53Å; V18-F207 HydrophobicContact CG2-CZ 4.24Å
19	K	96.4	Very high	95.4	Very high	113 Å²	113	60.8 Å²	60.8	49%	0.491	32%	0.315	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-121.5	147.6	174.5	-62	175.4	-173.6	166.1	0	110.4	Q205 E206	K19-Q205 CarbonylContact O-C 3.56Å; K19-Q205 WeakPolarHBondContact O-CA 3.37Å; K19-E206 HydrophobicContact CB-CB 4.31Å; K19-E206 PolarHBondContact N-O 3.19Å; K19-E206 PolarHBondContact O-N 2.94Å
20	S	96.3	Very high	95.5	Very high	90 Å²	90	64.7 Å²	64.7	63%	0.629	33%	0.331	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-107.9	116.2	172.1	-172.7	0	0	0	0	108.1	A203 I204	S20-A203 WeakPolarHBondContact OG-CB 3.21Å; S20-I204 WeakPolarHBondContact CA-O 3.45Å
21	C	95.7	Very high	95.5	Very high	29 Å²	29	64.7 Å²	64.7	20%	0.196	33%	0.331	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-128.7	147.2	-173.8	-60.6	0	0	0	0	111.7	Y26 I204	C21-Y26 HydrophobicContact CB-CE2 3.93Å; C21-I204 PolarHBondContact N-O 3.23Å; C21-I204 PolarHBondContact O-N 3.14Å
22	E	95.3	Very high	95.7	Very high	136 Å²	136	63.4 Å²	63.4	64%	0.636	32%	0.318	S	S	*	.			trans	-71.7	149.9	169.1	-62.4	-169.6	164.9	0	0	110.9	K24 S25	E22-K24 PolarHBondContact O-N 2.95Å; E22-K24 VanDerWaalsContact O-N 3.16Å; E22-S25 WeakPolarHBondContact O-CB 3.3Å; E22-S25 PolarHBondContact O-N 3.48Å; E22-S25 PolarHBondContact O-OG 3.42Å
23	I	95.6	Very high	95.8	Very high	19 Å²	19	58.9 Å²	58.9	10%	0.097	29%	0.294	C	S	.	.	G	3₁₀ helix	trans	-55.7	-33.9	-180	-170	169.5	0	0	0	113.5	S25 Y26 R73 N77 I79 I204	I23-S25 PolarHBondContact O-N 3.3Å; I23-Y26 PolarHBondContact O-N 2.91Å; I23-Y26 VanDerWaalsContact O-N 3.15Å; I23-R73 HydrophobicContact CD1-CG 4.06Å; I23-N77 HydrophobicContact CD1-CB 4.27Å; I23-N77 HydrophobicContact CG1-CB 3.95Å; I23-N77 HydrophobicContact CG2-CB 4.4Å; I23-N77 WeakPolarHBondContact CG2-OD1 3.34Å; I23-I79 HydrophobicContact CD1-CD1 4.25Å; I23-I79 HydrophobicContact CG1-CD1 3.71Å; I23-I204 HydrophobicContact CB-CD1 3.87Å; I23-I204 HydrophobicContact CG1-CD1 3.97Å
24	K	92.6	Very high	95.9	Very high	144 Å²	144	55.3 Å²	55.3	63%	0.626	27%	0.274	S	S	*	.	G	3₁₀ helix	trans	-61.3	-24.3	177.1	-65.6	176.1	-179.1	174.8	0	113.2	E22 Y26 F27 N77	E22-K24 PolarHBondContact O-N 2.95Å; E22-K24 VanDerWaalsContact O-N 3.16Å; K24-Y26 PolarHBondContact O-N 2.78Å; K24-F27 WeakPolarHBondContact O-CB 3.47Å; K24-F27 PolarHBondContact O-N 3.38Å; K24-N77 VanDerWaalsContact CG-OD1 3.23Å; K24-N77 WeakPolarHBondContact CG-OD1 3.35Å
25	S	94.3	Very high	96	Very high	54 Å²	54	55 Å²	55	38%	0.378	27%	0.272	S	S	.	.	G	3₁₀ helix	trans	-63.7	-20.9	178.8	-45.9	0	0	0	0	112.5	E22 I23 R339	E22-S25 WeakPolarHBondContact O-CB 3.3Å; E22-S25 PolarHBondContact O-N 3.48Å; E22-S25 PolarHBondContact O-OG 3.42Å; I23-S25 PolarHBondContact O-N 3.3Å; S25-R339 PolarHBondContact O-NH1 3.18Å
26	Y	95.1	Very high	95.9	Very high	5 Å²	5	48.8 Å²	48.8	2%	0.02	24%	0.244	C	C	.	.	G	3₁₀ helix	trans	-97.3	12.8	-178.1	-56.8	-81.4	0	0	0	113.5	C21 I23 K24 G28 R29 Y173 L191 I204 E206	C21-Y26 HydrophobicContact CB-CE2 3.93Å; I23-Y26 PolarHBondContact O-N 2.91Å; I23-Y26 VanDerWaalsContact O-N 3.15Å; K24-Y26 PolarHBondContact O-N 2.78Å; Y26-G28 PolarHBondContact O-N 2.97Å; Y26-R29 VanDerWaalsContact O-CB 3.27Å; Y26-R29 WeakPolarHBondContact O-CB 3.23Å; Y26-R29 WeakPolarHBondContact O-CG 3.45Å; Y26-R29 PolarHBondContact O-N 3.04Å; Y26-Y173 HydrophobicContact CD1-CE1 4.1Å; Y26-Y173 HydrophobicContact CE1-CE1 4.14Å; Y26-L191 HydrophobicContact CD1-CD1 3.87Å; Y26-L191 HydrophobicContact CD1-CD2 4.48Å; Y26-L191 HydrophobicContact CE1-CD1 3.72Å; Y26-L191 HydrophobicContact CE1-CD2 3.53Å; Y26-L191 HydrophobicContact CE1-CG 4.3Å; Y26-L191 HydrophobicContact CG-CD1 4.48Å; Y26-L191 WeakPolarHBondContact OH-CD2 3.47Å; Y26-I204 HydrophobicContact CD2-CD1 3.88Å; Y26-I204 HydrophobicContact CE2-CB 3.97Å; Y26-I204 HydrophobicContact CE2-CD1 3.72Å; Y26-I204 HydrophobicContact CE2-CG1 4.44Å; Y26-I204 HydrophobicContact CE2-CG2 3.82Å; Y26-E206 WeakPolarHBondContact CE1-OE2 3.44Å
27	F	93.5	Very high	95.9	Very high	70 Å²	70	40.3 Å²	40.3	31%	0.307	21%	0.208	S	C	.	.	T	Hydrogen-bonded Turn	trans	-50.7	129.1	175	-176.6	-88.5	0	0	0	111.4	K24 R29 N77 T336 R339	K24-F27 WeakPolarHBondContact O-CB 3.47Å; K24-F27 PolarHBondContact O-N 3.38Å; F27-R29 VanDerWaalsContact C-N 3.28Å; F27-R29 PolarHBondContact O-N 3.48Å; F27-N77 WeakPolarHBondContact CA-O 3.26Å; F27-N77 WeakPolarHBondContact CD2-O 3.48Å; F27-T336 HydrophobicContact CZ-CG2 4.25Å; F27-R339 WeakPolarHBondContact O-CD 3.31Å
28	G	92.2	Very high	95.9	Very high	10 Å²	10	40.2 Å²	40.2	10%	0.103	21%	0.207	C	C	.	.	T	Hydrogen-bonded Turn	trans	79.1	-2.1	-179.3	0	0	0	0	0	115.2	Y26 G78	Y26-G28 PolarHBondContact O-N 2.97Å; G28-G78 WeakPolarHBondContact CA-O 3.29Å; G28-G78 PolarHBondContact N-O 3.12Å
29	R	95.6	Very high	95.9	Very high	14 Å²	14	38.3 Å²	38.3	5%	0.053	20%	0.195	C	C	.	.			trans	-82.7	139.1	177.1	-60.6	-65.9	-163.8	-170.1	-4.6	110.7	Y26 F27 K80 Y173 D341 N342	Y26-R29 VanDerWaalsContact O-CB 3.27Å; Y26-R29 WeakPolarHBondContact O-CB 3.23Å; Y26-R29 WeakPolarHBondContact O-CG 3.45Å; Y26-R29 PolarHBondContact O-N 3.04Å; F27-R29 VanDerWaalsContact C-N 3.28Å; F27-R29 PolarHBondContact O-N 3.48Å; R29-K80 PolarHBondContact O-N 3.14Å; R29-Y173 HydrophobicContact CB-CD1 4.13Å; R29-Y173 HydrophobicContact CB-CG 4.29Å; R29-Y173 HydrophobicContact CG-CD1 4.01Å; R29-Y173 HydrophobicContact CG-CG 4.14Å; R29-D341 IonicContact CZ-OD2 3.96Å; R29-D341 IonicContact NH2-OD2 3.54Å; R29-D341 PolarHBondContact NH2-OD2 3.18Å; R29-N342 PolarHBondContact NH1-OD1 3.45Å
30	K	97.6	Very high	95.8	Very high	88 Å²	88	36.5 Å²	36.5	38%	0.383	19%	0.186	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-87.3	135.4	166.8	-62.3	173.1	-178.1	177.8	0	108.6	K80 K171 V172 Y173 W298	K30-K80 VanDerWaalsContact CA-O 3.29Å; K30-K80 WeakPolarHBondContact CA-O 3.37Å; K30-K80 HydrophobicContact CB-CB 4.49Å; K30-K80 HydrophobicContact CG-CB 3.98Å; K30-K80 HydrophobicContact CG-CD 4.41Å; K30-K171 WeakPolarHBondContact CD-O 3.4Å; K30-V172 HydrophobicContact CB-CB 4.21Å; K30-V172 HydrophobicContact CB-CG1 4.11Å; K30-Y173 WeakPolarHBondContact O-CB 3.25Å; K30-Y173 PolarHBondContact O-N 2.86Å; K30-W298 HydrophobicContact CD-CH2 4.02Å; K30-W298 HydrophobicContact CD-CZ3 4.32Å; K30-W298 HydrophobicContact CG-CH2 4.06Å
31	V	98.5	Very high	95.8	Very high	0 Å²	0	33.6 Å²	33.6	0%	0	16%	0.163	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-134.7	128.5	-177.6	-178.4	0	0	0	0	109.6	I33 I79 K80 P81 V82 A174 L191 L194	V31-I33 HydrophobicContact CG1-CG1 4.2Å; V31-I79 HydrophobicContact CB-CG2 4.23Å; V31-I79 HydrophobicContact CG2-CG2 3.88Å; V31-K80 PolarHBondContact N-O 3.08Å; V31-P81 CarbonylContact O-C 3.56Å; V31-P81 WeakPolarHBondContact O-CA 3.1Å; V31-V82 PolarHBondContact O-N 2.97Å; V31-A174 WeakPolarHBondContact CA-O 3.01Å; V31-A174 WeakPolarHBondContact CG1-O 3.21Å; V31-L191 HydrophobicContact CG1-CD1 4.32Å; V31-L191 HydrophobicContact CG2-CD1 4.12Å; V31-L194 HydrophobicContact CB-CD2 4.47Å; V31-L194 HydrophobicContact CG1-CD2 3.74Å
32	A	98.8	Very high	95.8	Very high	0 Å²	0	32.5 Å²	32.5	0%	0	15%	0.154	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-85.3	123.5	171.9	0	0	0	0	0	109.8	V82 V84 C163 L166 V172 A174 V175 G176	A32-V82 CarbonylContact C-O 3.56Å; A32-V82 WeakPolarHBondContact CA-O 3.42Å; A32-V82 HydrophobicContact CB-CG1 3.9Å; A32-V84 HydrophobicContact CB-CG2 4.37Å; A32-C163 HydrophobicContact CB-CB 3.91Å; A32-L166 HydrophobicContact CB-CD1 4.21Å; A32-V172 HydrophobicContact CB-CG1 4.26Å; A32-V172 HydrophobicContact CB-CG2 3.8Å; A32-A174 PolarHBondContact N-O 2.93Å; A32-V175 CarbonylContact O-C 3.27Å; A32-V175 VanDerWaalsContact O-CA 3.28Å; A32-V175 WeakPolarHBondContact O-CA 3.18Å; A32-G176 PolarHBondContact O-N 3.21Å
33	I	98.8	Very high	95.7	Very high	0 Å²	0	26.2 Å²	26.2	0%	0	13%	0.125	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-112.5	128.5	-173	-58	177.9	0	0	0	108.8	V31 A35 S38 M74 P81 V82 Y83 V84 G176 L194 T195	V31-I33 HydrophobicContact CG1-CG1 4.2Å; I33-A35 PolarHBondContact O-N 3.26Å; I33-A35 VanDerWaalsContact O-N 3.09Å; I33-S38 WeakPolarHBondContact CG2-OG 3.24Å; I33-M74 HydrophobicContact CD1-CE 3.35Å; I33-M74 HydrophobicContact CD1-SD 3.37Å; I33-M74 WeakPolarHBondContact CD1-SD 3.4Å; I33-P81 HydrophobicContact CD1-CB 3.57Å; I33-P81 HydrophobicContact CG1-CB 4.47Å; I33-V82 PolarHBondContact N-O 3Å; I33-Y83 HydrophobicContact CB-CD1 3.95Å; I33-Y83 HydrophobicContact CB-CE1 3.98Å; I33-Y83 HydrophobicContact CD1-CE1 4.26Å; I33-Y83 HydrophobicContact CD1-CE2 4.39Å; I33-Y83 HydrophobicContact CG2-CD1 3.88Å; I33-Y83 HydrophobicContact CG2-CE1 3.58Å; I33-Y83 CarbonylContact O-C 3.58Å; I33-Y83 WeakPolarHBondContact O-CA 3.36Å; I33-V84 PolarHBondContact O-N 3.3Å; I33-G176 WeakPolarHBondContact CA-O 3.36Å; I33-L194 HydrophobicContact CD1-CD2 4.19Å; I33-L194 HydrophobicContact CG1-CD2 4.31Å; I33-T195 HydrophobicContact CG2-CG2 3.85Å
34	D	98.3	Very high	95.5	Very high	6 Å²	6	27.4 Å²	27.4	3%	0.032	13%	0.131	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-66.6	106.8	171	177	-14.1	0	0	0	109.4	S36 M37 S38 G176 T177	D34-S36 PolarHBondContact OD1-N 2.92Å; D34-M37 HydrophobicContact CB-CB 4.16Å; D34-M37 WeakPolarHBondContact OD1-CB 3.42Å; D34-M37 PolarHBondContact OD1-N 3.49Å; D34-M37 WeakPolarHBondContact OD2-CB 3.41Å; D34-S38 WeakPolarHBondContact O-CB 3.4Å; D34-S38 PolarHBondContact O-N 3.03Å; D34-S38 PolarHBondContact O-OG 3.33Å; D34-G176 PolarHBondContact N-O 3.08Å; D34-G176 VanDerWaalsContact N-O 3.14Å; D34-T177 PolarHBondContact OD2-OG1 3.2Å
35	A	98.2	Very high	95.4	Very high	0 Å²	0	23.1 Å²	23.1	0%	0	12%	0.123	C	C	.	.	H	α-helix	trans	-70	-42.2	-175.8	0	0	0	0	0	111	I33 S38 I39 Y83 V84 F85	I33-A35 PolarHBondContact O-N 3.26Å; I33-A35 VanDerWaalsContact O-N 3.09Å; A35-S38 WeakPolarHBondContact O-CB 3.42Å; A35-S38 PolarHBondContact O-N 2.93Å; A35-S38 VanDerWaalsContact O-N 3.16Å; A35-I39 WeakPolarHBondContact O-CB 3.36Å; A35-I39 WeakPolarHBondContact O-CG1 3.39Å; A35-I39 PolarHBondContact O-N 3.22Å; A35-Y83 HydrophobicContact CB-CD1 4.04Å; A35-V84 WeakPolarHBondContact CB-O 3.5Å; A35-V84 PolarHBondContact N-O 2.82Å; A35-F85 HydrophobicContact CB-CD1 3.78Å; A35-F85 HydrophobicContact CB-CD2 4.06Å; A35-F85 HydrophobicContact CB-CE1 3.83Å; A35-F85 HydrophobicContact CB-CE2 4.08Å; A35-F85 HydrophobicContact CB-CG 3.91Å; A35-F85 HydrophobicContact CB-CZ 3.98Å
36	S	92.8	Very high	95.1	Very high	10 Å²	10	21.3 Å²	21.3	7%	0.07	11%	0.109	C	C	.	.	H	α-helix	trans	-63	-46.6	-177.7	-70.8	0	0	0	0	111.6	D34 S38 I39 Y40 E86	D34-S36 PolarHBondContact OD1-N 2.92Å; S36-S38 VanDerWaalsContact C-N 3.3Å; S36-S38 PolarHBondContact O-N 3.46Å; S36-I39 PolarHBondContact O-N 2.81Å; S36-Y40 WeakPolarHBondContact O-CB 3.38Å; S36-Y40 PolarHBondContact O-N 3.44Å; S36-E86 WeakPolarHBondContact CB-OE1 3.43Å; S36-E86 VanDerWaalsContact OG-CG 3.26Å; S36-E86 WeakPolarHBondContact OG-CG 3.49Å; S36-E86 PolarHBondContact OG-OE1 3.22Å
37	M	94.9	Very high	94.6	Very high	15 Å²	15	23.1 Å²	23.1	7%	0.074	12%	0.116	C	C	.	.	H	α-helix	trans	-63.1	-37.9	175	-176	69.8	-91.2	0	0	111.6	M1 D34 Y40 Q41 E178	M1-M37 HydrophobicContact CE-CE 3.66Å; M1-M37 HydrophobicContact CE-SD 3.41Å; M1-M37 WeakPolarHBondContact CE-SD 3.27Å; M1-M37 HydrophobicContact CG-SD 4.39Å; D34-M37 HydrophobicContact CB-CB 4.16Å; D34-M37 WeakPolarHBondContact OD1-CB 3.42Å; D34-M37 PolarHBondContact OD1-N 3.49Å; D34-M37 WeakPolarHBondContact OD2-CB 3.41Å; M37-Y40 HydrophobicContact CE-CD1 3.57Å; M37-Y40 HydrophobicContact CE-CE1 4.38Å; M37-Y40 HydrophobicContact CE-CG 4.36Å; M37-Q41 HydrophobicContact CE-CG 3.84Å; M37-Q41 VanDerWaalsContact O-CG 3.31Å; M37-Q41 WeakPolarHBondContact O-CG 3.43Å; M37-Q41 PolarHBondContact O-N 3.4Å; M37-Q41 VanDerWaalsContact O-N 3.15Å; M37-E178 HydrophobicContact CG-CB 4.28Å; M37-E178 HydrophobicContact SD-CB 4.35Å
38	S	97	Very high	93.9	Very high	1 Å²	1	25.7 Å²	25.7	1%	0.007	13%	0.129	C	C	.	.	H	α-helix	trans	-66.6	-47.5	177.4	-60.8	0	0	0	0	112.6	I33 D34 A35 S36 Y40 Q41 F42	I33-S38 WeakPolarHBondContact CG2-OG 3.24Å; D34-S38 WeakPolarHBondContact O-CB 3.4Å; D34-S38 PolarHBondContact O-N 3.03Å; D34-S38 PolarHBondContact O-OG 3.33Å; A35-S38 WeakPolarHBondContact O-CB 3.42Å; A35-S38 PolarHBondContact O-N 2.93Å; A35-S38 VanDerWaalsContact O-N 3.16Å; S36-S38 VanDerWaalsContact C-N 3.3Å; S36-S38 PolarHBondContact O-N 3.46Å; S38-Y40 VanDerWaalsContact C-N 3.33Å; S38-Y40 PolarHBondContact O-N 3.35Å; S38-Q41 WeakPolarHBondContact O-CB 3.45Å; S38-Q41 PolarHBondContact O-N 3.06Å; S38-Q41 VanDerWaalsContact O-N 3.16Å; S38-F42 WeakPolarHBondContact O-CD1 3.45Å; S38-F42 VanDerWaalsContact O-CD2 3.28Å; S38-F42 WeakPolarHBondContact O-CD2 3.29Å; S38-F42 WeakPolarHBondContact O-CG 3.49Å; S38-F42 PolarHBondContact O-N 2.97Å
39	I	97.3	Very high	93.1	Very high	0 Å²	0	33.8 Å²	33.8	0%	0	16%	0.164	C	C	.	.	H	α-helix	trans	-60.7	-45.4	179.2	-68	165.2	0	0	0	110.1	A35 S36 Q41 F42 L43 H63 M67 F85 V133 H137 N138 C141	A35-I39 WeakPolarHBondContact O-CB 3.36Å; A35-I39 WeakPolarHBondContact O-CG1 3.39Å; A35-I39 PolarHBondContact O-N 3.22Å; S36-I39 PolarHBondContact O-N 2.81Å; I39-Q41 VanDerWaalsContact C-N 3.31Å; I39-Q41 PolarHBondContact O-N 2.82Å; I39-F42 PolarHBondContact O-N 2.97Å; I39-F42 VanDerWaalsContact O-N 3.12Å; I39-L43 HydrophobicContact CG2-CD1 4.03Å; I39-L43 HydrophobicContact CG2-CG 4.39Å; I39-L43 WeakPolarHBondContact O-CG 3.39Å; I39-L43 PolarHBondContact O-N 2.88Å; I39-H63 HydrophobicContact CG2-CB 3.88Å; I39-M67 HydrophobicContact CD1-CE 4.31Å; I39-M67 HydrophobicContact CG1-CE 3.88Å; I39-F85 HydrophobicContact CD1-CD1 4.45Å; I39-F85 HydrophobicContact CD1-CE1 3.81Å; I39-V133 HydrophobicContact CB-CG1 4.46Å; I39-V133 HydrophobicContact CB-CG2 4.42Å; I39-V133 HydrophobicContact CG2-CG1 3.79Å; I39-V133 HydrophobicContact CG2-CG2 3.97Å; I39-H137 HydrophobicContact CG2-CB 4.23Å; I39-N138 WeakPolarHBondContact CD1-OD1 3.34Å; I39-C141 HydrophobicContact CD1-CB 3.99Å
40	Y	94.6	Very high	92	Very high	75 Å²	75	34.2 Å²	34.2	29%	0.294	17%	0.174	S	C	.	.	H	α-helix	trans	-56.1	-45	175.2	-179.9	-101.9	0	0	0	112	S36 M37 S38 F42 L43 I44 V131 V133	S36-Y40 WeakPolarHBondContact O-CB 3.38Å; S36-Y40 PolarHBondContact O-N 3.44Å; M37-Y40 HydrophobicContact CE-CD1 3.57Å; M37-Y40 HydrophobicContact CE-CE1 4.38Å; M37-Y40 HydrophobicContact CE-CG 4.36Å; S38-Y40 VanDerWaalsContact C-N 3.33Å; S38-Y40 PolarHBondContact O-N 3.35Å; Y40-F42 VanDerWaalsContact C-N 3.35Å; Y40-F42 PolarHBondContact O-N 2.96Å; Y40-L43 PolarHBondContact O-N 3.29Å; Y40-I44 HydrophobicContact CD1-CD1 3.85Å; Y40-I44 HydrophobicContact CD2-CD1 4.4Å; Y40-I44 HydrophobicContact CE1-CD1 3.29Å; Y40-I44 HydrophobicContact CE2-CD1 3.89Å; Y40-I44 HydrophobicContact CG-CD1 4.39Å; Y40-I44 WeakPolarHBondContact O-CG1 3.18Å; Y40-I44 PolarHBondContact O-N 2.81Å; Y40-V131 HydrophobicContact CD2-CG1 4.38Å; Y40-V131 HydrophobicContact CE2-CG1 4.41Å; Y40-V133 HydrophobicContact CD2-CG2 4.37Å
41	Q	94.5	Very high	91.1	Very high	30 Å²	30	35.5 Å²	35.5	14%	0.14	18%	0.184	C	C	.	.	H	α-helix	trans	-64.2	-38.7	176.2	-72.7	171.2	7.6	0	0	113	M37 S38 I39 I44 A45 T195	M37-Q41 HydrophobicContact CE-CG 3.84Å; M37-Q41 VanDerWaalsContact O-CG 3.31Å; M37-Q41 WeakPolarHBondContact O-CG 3.43Å; M37-Q41 PolarHBondContact O-N 3.4Å; M37-Q41 VanDerWaalsContact O-N 3.15Å; S38-Q41 WeakPolarHBondContact O-CB 3.45Å; S38-Q41 PolarHBondContact O-N 3.06Å; S38-Q41 VanDerWaalsContact O-N 3.16Å; I39-Q41 VanDerWaalsContact C-N 3.31Å; I39-Q41 PolarHBondContact O-N 2.82Å; Q41-I44 PolarHBondContact O-N 3.27Å; Q41-A45 WeakPolarHBondContact O-CB 3.42Å; Q41-A45 PolarHBondContact O-N 3.26Å; Q41-T195 PolarHBondContact OE1-OG1 3.3Å
42	F	95.5	Very high	90.4	Very high	5 Å²	5	37.1 Å²	37.1	2%	0.022	19%	0.194	C	C	.	.	H	α-helix	trans	-65.3	-45.7	178.7	-58.5	-24.1	0	0	0	111	S38 I39 Y40 I44 A45 V46 M67 R70	S38-F42 WeakPolarHBondContact O-CD1 3.45Å; S38-F42 VanDerWaalsContact O-CD2 3.28Å; S38-F42 WeakPolarHBondContact O-CD2 3.29Å; S38-F42 WeakPolarHBondContact O-CG 3.49Å; S38-F42 PolarHBondContact O-N 2.97Å; I39-F42 PolarHBondContact O-N 2.97Å; I39-F42 VanDerWaalsContact O-N 3.12Å; Y40-F42 VanDerWaalsContact C-N 3.35Å; Y40-F42 PolarHBondContact O-N 2.96Å; F42-I44 PolarHBondContact O-N 3.41Å; F42-A45 PolarHBondContact O-N 2.99Å; F42-V46 HydrophobicContact CB-CG2 4.32Å; F42-V46 WeakPolarHBondContact O-CA 3.48Å; F42-V46 WeakPolarHBondContact O-CB 3.39Å; F42-V46 WeakPolarHBondContact O-CG2 3.5Å; F42-V46 PolarHBondContact O-N 3.09Å; F42-M67 HydrophobicContact CD2-CB 4.4Å; F42-M67 HydrophobicContact CE2-CB 4.17Å; F42-M67 HydrophobicContact CE2-CE 4.27Å; F42-M67 HydrophobicContact CE2-SD 4.19Å; F42-R70 HydrophobicContact CE1-CB 4.37Å; F42-R70 HydrophobicContact CE1-CG 3.66Å; F42-R70 HydrophobicContact CZ-CB 4.03Å; F42-R70 HydrophobicContact CZ-CG 3.81Å
43	L	94.1	Very high	89.9	Confident	5 Å²	5	38.3 Å²	38.3	3%	0.026	20%	0.201	C	C	.	.	H	α-helix	trans	-60.8	-31.8	176.8	-66.2	170	0	0	0	113.1	I39 Y40 S60 H63 V131 V133	I39-L43 HydrophobicContact CG2-CD1 4.03Å; I39-L43 HydrophobicContact CG2-CG 4.39Å; I39-L43 WeakPolarHBondContact O-CG 3.39Å; I39-L43 PolarHBondContact O-N 2.88Å; Y40-L43 PolarHBondContact O-N 3.29Å; L43-S60 VanDerWaalsContact CD2-OG 3.27Å; L43-S60 WeakPolarHBondContact CD2-OG 3.3Å; L43-H63 HydrophobicContact CD2-CB 4Å; L43-H63 HydrophobicContact CG-CB 4.3Å; L43-V131 HydrophobicContact CB-CG1 3.43Å; L43-V131 VanDerWaalsContact CB-CG1 3.43Å; L43-V131 HydrophobicContact CD1-CG1 4.02Å; L43-V131 HydrophobicContact CG-CG1 4.37Å; L43-V133 HydrophobicContact CD1-CG2 4.12Å
44	I	92	Very high	89.5	Confident	43 Å²	43	43.9 Å²	43.9	22%	0.221	23%	0.228	C	C	.	.	H	α-helix	trans	-79.7	-45.4	176.6	-68.8	175	0	0	0	111.9	Y40 Q41 F42 K128 V131	Y40-I44 HydrophobicContact CD1-CD1 3.85Å; Y40-I44 HydrophobicContact CD2-CD1 4.4Å; Y40-I44 HydrophobicContact CE1-CD1 3.29Å; Y40-I44 HydrophobicContact CE2-CD1 3.89Å; Y40-I44 HydrophobicContact CG-CD1 4.39Å; Y40-I44 WeakPolarHBondContact O-CG1 3.18Å; Y40-I44 PolarHBondContact O-N 2.81Å; Q41-I44 PolarHBondContact O-N 3.27Å; F42-I44 PolarHBondContact O-N 3.41Å; I44-K128 HydrophobicContact CG2-CB 4.47Å; I44-K128 HydrophobicContact CG2-CD 4.38Å; I44-K128 HydrophobicContact CG2-CG 4.31Å; I44-V131 HydrophobicContact CG1-CB 4.02Å; I44-V131 HydrophobicContact CG1-CG1 4.03Å; I44-V131 HydrophobicContact CG1-CG2 4.06Å
45	A	89.6	Confident	89.2	Confident	55 Å²	55	44.3 Å²	44.3	46%	0.455	23%	0.231	S	C	.	.	H	α-helix	trans	-90.1	-26.4	-167.8	0	0	0	0	0	113.9	Q41 F42 R47	Q41-A45 WeakPolarHBondContact O-CB 3.42Å; Q41-A45 PolarHBondContact O-N 3.26Å; F42-A45 PolarHBondContact O-N 2.99Å; A45-R47 PolarHBondContact O-N 3.17Å
46	V	87.4	Confident	88.8	Confident	15 Å²	15	49.9 Å²	49.9	9%	0.091	28%	0.276	C	S	.	.			trans	-94.6	91.5	-176.5	-176.6	0	0	0	0	108.3	F42 L53 S62 M65	F42-V46 HydrophobicContact CB-CG2 4.32Å; F42-V46 WeakPolarHBondContact O-CA 3.48Å; F42-V46 WeakPolarHBondContact O-CB 3.39Å; F42-V46 WeakPolarHBondContact O-CG2 3.5Å; F42-V46 PolarHBondContact O-N 3.09Å; V46-L53 HydrophobicContact CG1-CD1 3.8Å; V46-S62 VanDerWaalsContact O-CB 3.31Å; V46-S62 WeakPolarHBondContact O-CB 3.15Å; V46-S62 PolarHBondContact O-OG 2.88Å; V46-M65 HydrophobicContact CG1-CB 4.32Å; V46-M65 HydrophobicContact CG1-CE 3.21Å
47	R	85.4	Confident	88.6	Confident	43 Å²	43	56.6 Å²	56.6	16%	0.162	31%	0.307	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-137.3	152.4	-177.9	-70.4	-178.8	170.2	-126.6	1.7	109.9	A45 G50 N51 S127	A45-R47 PolarHBondContact O-N 3.17Å; R47-G50 WeakPolarHBondContact CD-O 3.33Å; R47-G50 PolarHBondContact NH1-O 3.15Å; R47-N51 CarbonylContact C-O 3.48Å; R47-N51 WeakPolarHBondContact CA-O 2.94Å; R47-N51 WeakPolarHBondContact CB-O 3.38Å; R47-S127 PolarHBondContact NH1-OG 3.05Å; R47-S127 VanDerWaalsContact NH1-OG 3.08Å
48	Q	78.6	Confident	88.3	Confident	124 Å²	124	58 Å²	58	58%	0.579	33%	0.325	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-116.4	121.7	171.5	-179.3	172.2	4.9	0	0	107.9	G50 N51 L53	Q48-G50 PolarHBondContact O-N 3.17Å; Q48-N51 PolarHBondContact N-O 2.85Å; Q48-N51 WeakPolarHBondContact O-CB 3.44Å; Q48-N51 PolarHBondContact O-N 2.95Å; Q48-L53 HydrophobicContact CB-CD2 3.59Å
49	E	75	Confident	88	Confident	180 Å²	180	62.1 Å²	62.1	84%	0.841	34%	0.344	S	S	*	.	T	Hydrogen-bonded Turn	trans	52.6	40.7	-179.4	-60.8	176.6	-176.7	0	0	113	N51	E49-N51 PolarHBondContact O-N 3.18Å
50	G	74	Confident	87.7	Confident	24 Å²	24	63 Å²	63	25%	0.247	35%	0.35	C	S	.	.	T	Hydrogen-bonded Turn	trans	81	-16.1	-178.4	0	0	0	0	0	114.8	R47 Q48	R47-G50 WeakPolarHBondContact CD-O 3.33Å; R47-G50 PolarHBondContact NH1-O 3.15Å; Q48-G50 PolarHBondContact O-N 3.17Å
51	N	78.7	Confident	87.8	Confident	114 Å²	114	59.7 Å²	59.7	61%	0.61	34%	0.338	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-89.8	145.2	-179.1	-66.3	-39.9	0	0	0	112.5	R47 Q48 E49	R47-N51 CarbonylContact C-O 3.48Å; R47-N51 WeakPolarHBondContact CA-O 2.94Å; R47-N51 WeakPolarHBondContact CB-O 3.38Å; Q48-N51 PolarHBondContact N-O 2.85Å; Q48-N51 WeakPolarHBondContact O-CB 3.44Å; Q48-N51 PolarHBondContact O-N 2.95Å; E49-N51 PolarHBondContact O-N 3.18Å
52	T	83.1	Confident	87.8	Confident	34 Å²	34	58.2 Å²	58.2	21%	0.209	33%	0.331	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-63.7	140	170.1	-53.3	0	0	0	0	109.1	S60	T52-S60 WeakPolarHBondContact CG2-OG 3.27Å
53	L	88	Confident	87.9	Confident	26 Å²	26	58 Å²	58	14%	0.136	33%	0.33	C	S	.	.	P	Polyproline II helix	trans	-68.8	137.3	174.4	-62.9	179.7	0	0	0	109.2	V46 Q48 S60 T61 S62 M65	V46-L53 HydrophobicContact CG1-CD1 3.8Å; Q48-L53 HydrophobicContact CB-CD2 3.59Å; L53-S60 CarbonylContact O-C 3.57Å; L53-S60 VanDerWaalsContact O-CA 3.25Å; L53-S60 WeakPolarHBondContact O-CA 3.49Å; L53-T61 WeakPolarHBondContact CB-OG1 3.47Å; L53-T61 PolarHBondContact O-N 3.3Å; L53-T61 PolarHBondContact O-OG1 2.97Å; L53-S62 PolarHBondContact N-OG 3.08Å; L53-S62 VanDerWaalsContact N-OG 3.12Å; L53-M65 HydrophobicContact CD1-CE 3.24Å; L53-M65 HydrophobicContact CD1-SD 3.91Å
54	M	90.9	Very high	88.1	Confident	116 Å²	116	57.8 Å²	57.8	57%	0.571	33%	0.329	S	S	*	.	B	Isolated β-bridge	trans	-135.1	155.9	-178.9	-64.3	173.6	176.8	0	0	111.3	E59	M54-E59 CarbonylContact C-O 3.59Å; M54-E59 WeakPolarHBondContact CA-O 3.29Å; M54-E59 WeakPolarHBondContact CB-O 3.41Å
55	N	91.4	Very high	88.2	Confident	16 Å²	16	58.3 Å²	58.3	9%	0.086	33%	0.331	C	S	.	.			trans	-82.8	-177.7	166.2	67.4	3.8	0	0	0	110.8	E57 G58 E59 T61	N55-E57 PolarHBondContact O-N 3.22Å; N55-E57 PolarHBondContact OD1-N 2.78Å; N55-E57 VanDerWaalsContact OD1-N 3.1Å; N55-G58 PolarHBondContact O-N 3.23Å; N55-G58 VanDerWaalsContact O-N 3.09Å; N55-G58 PolarHBondContact OD1-N 2.81Å; N55-E59 PolarHBondContact N-O 3.41Å; N55-E59 PolarHBondContact ND2-OE2 3.01Å; N55-E59 WeakPolarHBondContact OD1-CB 3.48Å; N55-E59 PolarHBondContact OD1-N 3.12Å; N55-E59 PolarHBondContact OD1-O 3.38Å; N55-T61 HydrophobicContact CB-CG2 4.01Å
56	A	89.5	Confident	88.5	Confident	116 Å²	116	55.8 Å²	55.8	96%	0.959	31%	0.31	S	S	*	.	T	Hydrogen-bonded Turn	trans	-62.4	-20.6	178.7	0	0	0	0	0	113.7	G58	A56-G58 VanDerWaalsContact C-N 3.34Å
57	E	90.1	Very high	89	Confident	152 Å²	152	55 Å²	55	71%	0.71	31%	0.306	S	S	*	.	T	Hydrogen-bonded Turn	trans	-89	-0.9	179.1	-62.1	176.8	-174.2	0	0	112.5	N55 E59	N55-E57 PolarHBondContact O-N 3.22Å; N55-E57 PolarHBondContact OD1-N 2.78Å; N55-E57 VanDerWaalsContact OD1-N 3.1Å; E57-E59 VanDerWaalsContact C-N 3.31Å; E57-E59 HydrophobicContact CB-CG 4.15Å
58	G	88.5	Confident	89.6	Confident	44 Å²	44	53.1 Å²	53.1	45%	0.454	30%	0.298	S	S	.	.	S	Bend	trans	80.5	10.3	-178.5	0	0	0	0	0	114	N55 A56	N55-G58 PolarHBondContact O-N 3.23Å; N55-G58 VanDerWaalsContact O-N 3.09Å; N55-G58 PolarHBondContact OD1-N 2.81Å; A56-G58 VanDerWaalsContact C-N 3.34Å
59	E	90.1	Very high	90.5	Very high	87 Å²	87	50.9 Å²	50.9	41%	0.407	29%	0.285	S	S	.	.			trans	-81.4	136.3	177	-51.5	-179.6	129.8	0	0	110.2	M54 N55 E57	M54-E59 CarbonylContact C-O 3.59Å; M54-E59 WeakPolarHBondContact CA-O 3.29Å; M54-E59 WeakPolarHBondContact CB-O 3.41Å; N55-E59 PolarHBondContact N-O 3.41Å; N55-E59 PolarHBondContact ND2-OE2 3.01Å; N55-E59 WeakPolarHBondContact OD1-CB 3.48Å; N55-E59 PolarHBondContact OD1-N 3.12Å; N55-E59 PolarHBondContact OD1-O 3.38Å; E57-E59 VanDerWaalsContact C-N 3.31Å; E57-E59 HydrophobicContact CB-CG 4.15Å
60	S	92	Very high	91.5	Very high	19 Å²	19	44.2 Å²	44.2	13%	0.133	25%	0.253	C	S	.	.	B	Isolated β-bridge	trans	-60	139	177.7	166.2	0	0	0	0	111.4	L43 T52 L53 H63	L43-S60 VanDerWaalsContact CD2-OG 3.27Å; L43-S60 WeakPolarHBondContact CD2-OG 3.3Å; T52-S60 WeakPolarHBondContact CG2-OG 3.27Å; L53-S60 CarbonylContact O-C 3.57Å; L53-S60 VanDerWaalsContact O-CA 3.25Å; L53-S60 WeakPolarHBondContact O-CA 3.49Å; S60-H63 PolarHBondContact O-CE1 3.15Å
61	T	95.1	Very high	92.7	Very high	5 Å²	5	43.1 Å²	43.1	3%	0.031	24%	0.241	C	C	.	.			trans	-122.5	1.4	175.2	59.9	0	0	0	0	112.5	L53 N55 H63 L64 M65 H314 F316	L53-T61 WeakPolarHBondContact CB-OG1 3.47Å; L53-T61 PolarHBondContact O-N 3.3Å; L53-T61 PolarHBondContact O-OG1 2.97Å; N55-T61 HydrophobicContact CB-CG2 4.01Å; T61-H63 VanDerWaalsContact C-N 3.31Å; T61-H63 PolarHBondContact O-N 3.02Å; T61-L64 WeakPolarHBondContact O-CB 3.36Å; T61-L64 PolarHBondContact O-N 3.26Å; T61-M65 PolarHBondContact O-N 3.21Å; T61-H314 HydrophobicContact CG2-CB 4.04Å; T61-F316 HydrophobicContact CG2-CE2 4.4Å
62	S	95.8	Very high	93.5	Very high	0 Å²	0	37.9 Å²	37.9	0%	0	21%	0.213	C	C	.	.	H	α-helix	trans	-58.8	-37.1	179.7	-70.6	0	0	0	0	113.5	V46 L53 G66	V46-S62 VanDerWaalsContact O-CB 3.31Å; V46-S62 WeakPolarHBondContact O-CB 3.15Å; V46-S62 PolarHBondContact O-OG 2.88Å; L53-S62 PolarHBondContact N-OG 3.08Å; L53-S62 VanDerWaalsContact N-OG 3.12Å; S62-G66 PolarHBondContact O-N 2.85Å
63	H	96.7	Very high	94.1	Very high	0 Å²	0	37.7 Å²	37.7	0%	0	21%	0.208	C	C	.	.	H	α-helix	trans	-64.9	-42.9	176.5	55.9	-74	0	0	0	112.1	I39 L43 S60 T61 M67 H137 D140	I39-H63 HydrophobicContact CG2-CB 3.88Å; L43-H63 HydrophobicContact CD2-CB 4Å; L43-H63 HydrophobicContact CG-CB 4.3Å; S60-H63 PolarHBondContact O-CE1 3.15Å; T61-H63 VanDerWaalsContact C-N 3.31Å; T61-H63 PolarHBondContact O-N 3.02Å; H63-M67 WeakPolarHBondContact O-CB 3.13Å; H63-M67 PolarHBondContact O-N 3.16Å; H63-H137 AromaticContact CE1-CD2 3.26Å; H63-H137 PolarHBondContact CE1-CD2 3.42Å; H63-H137 AromaticContact CE1-CG 3.95Å; H63-H137 AromaticContact CE1-NE2 3.99Å; H63-H137 AromaticContact ND1-CD2 3.63Å; H63-H137 AromaticContact NE2-CD2 3.73Å; H63-D140 IonicContact CE1-OD2 3.87Å; H63-D140 WeakPolarHBondContact NE2-CB 3.34Å; H63-D140 IonicContact NE2-OD2 3.22Å; H63-D140 PolarHBondContact NE2-OD2 3.27Å
64	L	97.7	Very high	94.5	Very high	0 Å²	0	36.5 Å²	36.5	0%	0	20%	0.202	C	C	.	.	H	α-helix	trans	-63	-48.6	176.8	-70.2	174.6	0	0	0	111.4	T61 G66 M67 F68 D140 L144 F309 L310 H314 F316	T61-L64 WeakPolarHBondContact O-CB 3.36Å; T61-L64 PolarHBondContact O-N 3.26Å; L64-G66 PolarHBondContact O-N 3.32Å; L64-M67 PolarHBondContact O-N 3.01Å; L64-F68 VanDerWaalsContact O-CB 3.26Å; L64-F68 WeakPolarHBondContact O-CB 3.5Å; L64-F68 PolarHBondContact O-N 2.76Å; L64-D140 HydrophobicContact CD2-CB 3.9Å; L64-D140 HydrophobicContact CG-CB 4.37Å; L64-L144 HydrophobicContact CB-CD2 4.47Å; L64-L144 HydrophobicContact CD2-CB 4.01Å; L64-L144 HydrophobicContact CD2-CD2 3.79Å; L64-L144 HydrophobicContact CD2-CG 4.46Å; L64-F309 HydrophobicContact CD1-CE1 4.3Å; L64-F309 HydrophobicContact CD1-CZ 4.42Å; L64-F309 HydrophobicContact CD2-CE1 3.72Å; L64-F309 HydrophobicContact CD2-CZ 4.13Å; L64-L310 HydrophobicContact CB-CD2 4.19Å; L64-L310 HydrophobicContact CD1-CD2 4.2Å; L64-L310 HydrophobicContact CD2-CD2 4.39Å; L64-H314 HydrophobicContact CD1-CB 4.1Å; L64-H314 VanDerWaalsContact CD1-CD2 3.45Å; L64-H314 WeakPolarHBondContact CD1-CD2 3.38Å; L64-F316 HydrophobicContact CB-CE2 3.98Å; L64-F316 HydrophobicContact CB-CZ 4.08Å; L64-F316 HydrophobicContact CD1-CE2 4.18Å
65	M	95.5	Very high	94.8	Very high	54 Å²	54	32.2 Å²	32.2	27%	0.266	18%	0.181	S	C	.	.	H	α-helix	trans	-63.9	-43.2	-179.8	-166.8	166.1	75.9	0	0	111.8	V46 L53 T61 Y69 F316	V46-M65 HydrophobicContact CG1-CB 4.32Å; V46-M65 HydrophobicContact CG1-CE 3.21Å; L53-M65 HydrophobicContact CD1-CE 3.24Å; L53-M65 HydrophobicContact CD1-SD 3.91Å; T61-M65 PolarHBondContact O-N 3.21Å; M65-Y69 HydrophobicContact CG-CD2 3.62Å; M65-Y69 HydrophobicContact CG-CE2 3.68Å; M65-Y69 WeakPolarHBondContact O-CD2 3.28Å; M65-Y69 PolarHBondContact O-N 3.46Å; M65-Y69 HydrophobicContact SD-CE2 4.22Å; M65-F316 HydrophobicContact CB-CE1 3.77Å; M65-F316 HydrophobicContact CB-CZ 3.96Å; M65-F316 HydrophobicContact CG-CE1 4.09Å; M65-F316 HydrophobicContact SD-CE1 4.17Å
66	G	96.2	Very high	94.9	Very high	2 Å²	2	35.9 Å²	35.9	2%	0.021	20%	0.198	C	C	.	.	H	α-helix	trans	-59.9	-52	174.5	0	0	0	0	0	111.6	S62 L64 F68 R70	S62-G66 PolarHBondContact O-N 2.85Å; L64-G66 PolarHBondContact O-N 3.32Å; G66-F68 PolarHBondContact O-N 2.8Å; G66-R70 WeakPolarHBondContact O-CB 3.38Å; G66-R70 WeakPolarHBondContact O-CG 3.37Å; G66-R70 PolarHBondContact O-N 2.9Å
67	M	98	Very high	95.1	Very high	0 Å²	0	31.8 Å²	31.8	0%	0	16%	0.16	C	C	.	.	H	α-helix	trans	-58.7	-49	-179.3	-171.2	64.4	79.5	0	0	111.5	I39 F42 H63 L64 T71 Y83 C141 L144 L145	I39-M67 HydrophobicContact CD1-CE 4.31Å; I39-M67 HydrophobicContact CG1-CE 3.88Å; F42-M67 HydrophobicContact CD2-CB 4.4Å; F42-M67 HydrophobicContact CE2-CB 4.17Å; F42-M67 HydrophobicContact CE2-CE 4.27Å; F42-M67 HydrophobicContact CE2-SD 4.19Å; H63-M67 WeakPolarHBondContact O-CB 3.13Å; H63-M67 PolarHBondContact O-N 3.16Å; L64-M67 PolarHBondContact O-N 3.01Å; M67-T71 WeakPolarHBondContact O-CB 3.1Å; M67-T71 PolarHBondContact O-N 2.67Å; M67-T71 PolarHBondContact O-OG1 3.06Å; M67-Y83 HydrophobicContact CE-CD1 4.02Å; M67-Y83 HydrophobicContact CE-CE1 3.88Å; M67-Y83 HydrophobicContact SD-CD1 3.9Å; M67-Y83 HydrophobicContact SD-CD2 4.44Å; M67-Y83 HydrophobicContact SD-CE1 3.33Å; M67-Y83 WeakPolarHBondContact SD-CE1 3.44Å; M67-Y83 HydrophobicContact SD-CE2 3.94Å; M67-Y83 HydrophobicContact SD-CG 4.4Å; M67-C141 HydrophobicContact CE-CB 4.08Å; M67-L144 HydrophobicContact CB-CD2 3.89Å; M67-L144 HydrophobicContact CG-CD2 4.03Å; M67-L145 HydrophobicContact CG-CD2 4.11Å; M67-L145 HydrophobicContact CG-CG 4.33Å; M67-L145 HydrophobicContact SD-CD2 4.1Å
68	F	97.8	Very high	95.3	Very high	2 Å²	2	25 Å²	25	1%	0.009	13%	0.13	C	C	.	.	H	α-helix	trans	-58.4	-59.4	-178.4	-175.3	-113.4	0	0	0	112.2	L64 G66 R70 T71 I72 L144 M148 L306 L310 I321	L64-F68 VanDerWaalsContact O-CB 3.26Å; L64-F68 WeakPolarHBondContact O-CB 3.5Å; L64-F68 PolarHBondContact O-N 2.76Å; G66-F68 PolarHBondContact O-N 2.8Å; F68-R70 PolarHBondContact O-N 2.82Å; F68-T71 PolarHBondContact O-N 2.76Å; F68-I72 HydrophobicContact CD1-CD1 3.74Å; F68-I72 HydrophobicContact CD2-CD1 4.07Å; F68-I72 HydrophobicContact CE1-CD1 3.45Å; F68-I72 VanDerWaalsContact CE1-CD1 3.45Å; F68-I72 HydrophobicContact CE2-CD1 3.81Å; F68-I72 HydrophobicContact CG-CD1 4.05Å; F68-I72 HydrophobicContact CZ-CD1 3.51Å; F68-I72 VanDerWaalsContact O-CG1 3.29Å; F68-I72 WeakPolarHBondContact O-CG1 3.35Å; F68-I72 PolarHBondContact O-N 3.02Å; F68-L144 HydrophobicContact CB-CD2 4.1Å; F68-L144 HydrophobicContact CD2-CD1 4.09Å; F68-M148 HydrophobicContact CD2-CE 3.68Å; F68-M148 HydrophobicContact CD2-CG 4.26Å; F68-M148 HydrophobicContact CD2-SD 3.79Å; F68-M148 HydrophobicContact CE2-CE 4.19Å; F68-M148 HydrophobicContact CG-CE 4.45Å; F68-M148 WeakPolarHBondContact O-CE 3.48Å; F68-L306 HydrophobicContact CE2-CD1 4.37Å; F68-L306 HydrophobicContact CE2-CD2 4.3Å; F68-L310 HydrophobicContact CD2-CD1 4.02Å; F68-L310 HydrophobicContact CE2-CD1 4.13Å; F68-L310 HydrophobicContact CG-CD1 4.32Å; F68-I321 HydrophobicContact CD1-CD1 4.21Å; F68-I321 HydrophobicContact CE1-CD1 3.76Å; F68-I321 HydrophobicContact CZ-CD1 4.13Å; F68-I321 HydrophobicContact CZ-CG2 4.37Å
69	Y	96.5	Very high	95.7	Very high	78 Å²	78	23 Å²	23	31%	0.306	11%	0.109	S	C	.	.	H	α-helix	trans	-73.2	-30.5	-173.9	-72.4	-66.7	0	0	0	113.5	M65 I72 R73	M65-Y69 HydrophobicContact CG-CD2 3.62Å; M65-Y69 HydrophobicContact CG-CE2 3.68Å; M65-Y69 WeakPolarHBondContact O-CD2 3.28Å; M65-Y69 PolarHBondContact O-N 3.46Å; M65-Y69 HydrophobicContact SD-CE2 4.22Å; Y69-I72 HydrophobicContact CD1-CD1 4.47Å; Y69-R73 WeakPolarHBondContact O-CB 3.24Å; Y69-R73 PolarHBondContact O-N 3.35Å
70	R	96.6	Very high	96	Very high	40 Å²	40	21.9 Å²	21.9	15%	0.151	10%	0.103	C	C	.	.	H	α-helix	trans	-71.4	-39.8	175.9	-62.3	-64.4	178.4	-107.4	-15.8	111.3	F42 G66 F68 R73 M74 T195 F196 S197	F42-R70 HydrophobicContact CE1-CB 4.37Å; F42-R70 HydrophobicContact CE1-CG 3.66Å; F42-R70 HydrophobicContact CZ-CB 4.03Å; F42-R70 HydrophobicContact CZ-CG 3.81Å; G66-R70 WeakPolarHBondContact O-CB 3.38Å; G66-R70 WeakPolarHBondContact O-CG 3.37Å; G66-R70 PolarHBondContact O-N 2.9Å; F68-R70 PolarHBondContact O-N 2.82Å; R70-R73 PolarHBondContact O-N 3.4Å; R70-M74 WeakPolarHBondContact O-CG 3.4Å; R70-M74 PolarHBondContact O-N 2.99Å; R70-M74 VanDerWaalsContact O-N 3.08Å; R70-T195 WeakPolarHBondContact CD-O 3.44Å; R70-T195 PolarHBondContact NE-O 3.24Å; R70-F196 WeakPolarHBondContact CD-O 3.38Å; R70-F196 PolarHBondContact NE-O 3.14Å; R70-S197 PolarHBondContact NH1-OG 3.22Å; R70-S197 VanDerWaalsContact NH2-CA 3.35Å; R70-S197 PolarHBondContact NH2-OG 3.03Å; R70-S197 VanDerWaalsContact NH2-OG 3.13Å
71	T	97.8	Very high	96.3	Very high	0 Å²	0	21 Å²	21	0%	0	10%	0.097	C	C	.	.	H	α-helix	trans	-63.6	-46.5	174.4	-58.3	0	0	0	0	111.2	M67 F68 R73 M74 I75 P81 Y83 M148 V150	M67-T71 WeakPolarHBondContact O-CB 3.1Å; M67-T71 PolarHBondContact O-N 2.67Å; M67-T71 PolarHBondContact O-OG1 3.06Å; F68-T71 PolarHBondContact O-N 2.76Å; T71-R73 VanDerWaalsContact C-N 3.35Å; T71-R73 PolarHBondContact O-N 3.27Å; T71-M74 PolarHBondContact O-N 3.47Å; T71-I75 HydrophobicContact CG2-CD1 3.73Å; T71-I75 HydrophobicContact CG2-CG1 4.48Å; T71-I75 WeakPolarHBondContact O-CG1 3.26Å; T71-I75 PolarHBondContact O-N 2.7Å; T71-P81 HydrophobicContact CG2-CG 4.21Å; T71-Y83 HydrophobicContact CG2-CE2 4.27Å; T71-Y83 WeakPolarHBondContact OG1-CE2 3.4Å; T71-Y83 PolarHBondContact OG1-OH 2.89Å; T71-M148 HydrophobicContact CG2-CE 3.71Å; T71-M148 HydrophobicContact CG2-SD 4.34Å; T71-V150 HydrophobicContact CG2-CG1 4.39Å; T71-V150 HydrophobicContact CG2-CG2 3.76Å
72	I	96.7	Very high	96.5	Very high	4 Å²	4	20.8 Å²	20.8	2%	0.021	10%	0.095	C	C	.	.	H	α-helix	trans	-55	-49.9	173.9	-71.9	166.8	0	0	0	110.9	F68 Y69 M74 I75 E76 M148 K327 L328	F68-I72 HydrophobicContact CD1-CD1 3.74Å; F68-I72 HydrophobicContact CD2-CD1 4.07Å; F68-I72 HydrophobicContact CE1-CD1 3.45Å; F68-I72 VanDerWaalsContact CE1-CD1 3.45Å; F68-I72 HydrophobicContact CE2-CD1 3.81Å; F68-I72 HydrophobicContact CG-CD1 4.05Å; F68-I72 HydrophobicContact CZ-CD1 3.51Å; F68-I72 VanDerWaalsContact O-CG1 3.29Å; F68-I72 WeakPolarHBondContact O-CG1 3.35Å; F68-I72 PolarHBondContact O-N 3.02Å; Y69-I72 HydrophobicContact CD1-CD1 4.47Å; I72-M74 VanDerWaalsContact C-N 3.3Å; I72-M74 PolarHBondContact O-N 3.17Å; I72-I75 PolarHBondContact O-N 3.31Å; I72-I75 VanDerWaalsContact O-N 3.17Å; I72-E76 HydrophobicContact CG2-CG 4.05Å; I72-E76 WeakPolarHBondContact CG2-OE2 3.4Å; I72-E76 WeakPolarHBondContact O-CB 3.4Å; I72-E76 WeakPolarHBondContact O-CG 3.22Å; I72-E76 PolarHBondContact O-N 2.87Å; I72-M148 HydrophobicContact CG1-CE 3.93Å; I72-K327 HydrophobicContact CG2-CB 4.11Å; I72-K327 HydrophobicContact CG2-CD 4.11Å; I72-L328 HydrophobicContact CB-CD2 4.37Å; I72-L328 HydrophobicContact CD1-CG 4.48Å; I72-L328 HydrophobicContact CG1-CD1 4.24Å; I72-L328 HydrophobicContact CG1-CD2 3.59Å; I72-L328 HydrophobicContact CG1-CG 3.79Å
73	R	95.8	Very high	96.6	Very high	30 Å²	30	20.8 Å²	20.8	11%	0.113	10%	0.095	C	C	.	.	H	α-helix	trans	-56.2	-43.7	179.4	178.4	-173.4	174.4	-136.1	-1.4	112	I23 Y69 R70 T71 N77 F196	I23-R73 HydrophobicContact CD1-CG 4.06Å; Y69-R73 WeakPolarHBondContact O-CB 3.24Å; Y69-R73 PolarHBondContact O-N 3.35Å; R70-R73 PolarHBondContact O-N 3.4Å; T71-R73 VanDerWaalsContact C-N 3.35Å; T71-R73 PolarHBondContact O-N 3.27Å; R73-N77 PolarHBondContact O-N 3.4Å; R73-N77 PolarHBondContact O-ND2 3.35Å; R73-F196 PolarHBondContact NH1-O 2.87Å
74	M	96.9	Very high	96.7	Very high	1 Å²	1	20.8 Å²	20.8	1%	0.005	10%	0.095	C	C	.	.	H	α-helix	trans	-63.9	-47.3	178	-72.8	-174.7	-64.4	0	0	111.5	I33 R70 T71 I72 N77 G78 I79 P81 Y83 L194	I33-M74 HydrophobicContact CD1-CE 3.35Å; I33-M74 HydrophobicContact CD1-SD 3.37Å; I33-M74 WeakPolarHBondContact CD1-SD 3.4Å; R70-M74 WeakPolarHBondContact O-CG 3.4Å; R70-M74 PolarHBondContact O-N 2.99Å; R70-M74 VanDerWaalsContact O-N 3.08Å; T71-M74 PolarHBondContact O-N 3.47Å; I72-M74 VanDerWaalsContact C-N 3.3Å; I72-M74 PolarHBondContact O-N 3.17Å; M74-N77 CarbonylContact O-C 3.4Å; M74-N77 PolarHBondContact O-N 3.31Å; M74-N77 VanDerWaalsContact O-N 3.12Å; M74-G78 PolarHBondContact O-N 3.23Å; M74-I79 HydrophobicContact CB-CB 4.08Å; M74-I79 HydrophobicContact CB-CD1 4.49Å; M74-I79 HydrophobicContact CB-CG2 4.36Å; M74-I79 HydrophobicContact CG-CD1 4.44Å; M74-I79 WeakPolarHBondContact O-CB 3.35Å; M74-I79 PolarHBondContact O-N 2.93Å; M74-P81 HydrophobicContact CE-CB 3.94Å; M74-P81 HydrophobicContact CE-CG 4.21Å; M74-P81 HydrophobicContact SD-CB 4.46Å; M74-Y83 HydrophobicContact CE-CE2 4.4Å; M74-Y83 WeakPolarHBondContact CE-OH 3.43Å; M74-L194 HydrophobicContact CG-CD1 4.19Å; M74-L194 HydrophobicContact SD-CD1 4Å; M74-L194 HydrophobicContact SD-CD2 3.93Å; M74-L194 HydrophobicContact SD-CG 3.75Å
75	I	96	Very high	96.8	Very high	27 Å²	27	20.8 Å²	20.8	14%	0.138	10%	0.095	C	C	.	.	H	α-helix	trans	-65.3	-41.3	-179.1	-67.2	171.5	0	0	0	111.4	T71 I72 N77 G78 I79 P81 V150 L328 A331	T71-I75 HydrophobicContact CG2-CD1 3.73Å; T71-I75 HydrophobicContact CG2-CG1 4.48Å; T71-I75 WeakPolarHBondContact O-CG1 3.26Å; T71-I75 PolarHBondContact O-N 2.7Å; I72-I75 PolarHBondContact O-N 3.31Å; I72-I75 VanDerWaalsContact O-N 3.17Å; I75-N77 PolarHBondContact O-N 2.89Å; I75-G78 WeakPolarHBondContact O-CA 3.38Å; I75-G78 PolarHBondContact O-N 2.83Å; I75-I79 WeakPolarHBondContact CA-O 3.41Å; I75-P81 HydrophobicContact CD1-CG 4.37Å; I75-P81 HydrophobicContact CG1-CG 4.09Å; I75-V150 HydrophobicContact CD1-CG2 3.7Å; I75-L328 HydrophobicContact CB-CD2 4.37Å; I75-L328 HydrophobicContact CD1-CD2 3.66Å; I75-L328 HydrophobicContact CG2-CD2 4.33Å; I75-A331 HydrophobicContact CG2-CB 3.61Å
76	E	94.2	Very high	96.8	Very high	92 Å²	92	21.8 Å²	21.8	43%	0.43	10%	0.1	S	C	.	.	H	α-helix	trans	-61.1	-28.6	173.8	-75.4	-171.5	117.4	0	0	112.5	I72 G78 K327	I72-E76 HydrophobicContact CG2-CG 4.05Å; I72-E76 WeakPolarHBondContact CG2-OE2 3.4Å; I72-E76 WeakPolarHBondContact O-CB 3.4Å; I72-E76 WeakPolarHBondContact O-CG 3.22Å; I72-E76 PolarHBondContact O-N 2.87Å; E76-G78 VanDerWaalsContact C-N 3.27Å; E76-K327 HydrophobicContact CG-CB 4.33Å; E76-K327 VanDerWaalsContact OE1-CD 3.27Å; E76-K327 WeakPolarHBondContact OE1-CD 3.44Å; E76-K327 WeakPolarHBondContact OE1-CG 3.49Å; E76-K327 IonicContact OE1-NZ 2.86Å; E76-K327 IonicContact OE2-NZ 2.61Å
77	N	93.9	Very high	96.8	Very high	30 Å²	30	23.2 Å²	23.2	16%	0.16	11%	0.114	C	C	.	.	T	Hydrogen-bonded Turn	trans	-89	10.9	173.2	-74	-85.6	0	0	0	113.1	I23 K24 F27 R73 M74 I75 I79	I23-N77 HydrophobicContact CD1-CB 4.27Å; I23-N77 HydrophobicContact CG1-CB 3.95Å; I23-N77 HydrophobicContact CG2-CB 4.4Å; I23-N77 WeakPolarHBondContact CG2-OD1 3.34Å; K24-N77 VanDerWaalsContact CG-OD1 3.23Å; K24-N77 WeakPolarHBondContact CG-OD1 3.35Å; F27-N77 WeakPolarHBondContact CA-O 3.26Å; F27-N77 WeakPolarHBondContact CD2-O 3.48Å; R73-N77 PolarHBondContact O-N 3.4Å; R73-N77 PolarHBondContact O-ND2 3.35Å; M74-N77 CarbonylContact O-C 3.4Å; M74-N77 PolarHBondContact O-N 3.31Å; M74-N77 VanDerWaalsContact O-N 3.12Å; I75-N77 PolarHBondContact O-N 2.89Å; N77-I79 VanDerWaalsContact C-N 3.29Å; N77-I79 PolarHBondContact O-N 3.2Å
78	G	94.4	Very high	96.6	Very high	9 Å²	9	31.1 Å²	31.1	9%	0.093	15%	0.149	C	C	.	.	T	Hydrogen-bonded Turn	trans	75.2	10.8	176.7	0	0	0	0	0	115.1	G28 M74 I75 E76	G28-G78 WeakPolarHBondContact CA-O 3.29Å; G28-G78 PolarHBondContact N-O 3.12Å; M74-G78 PolarHBondContact O-N 3.23Å; I75-G78 WeakPolarHBondContact O-CA 3.38Å; I75-G78 PolarHBondContact O-N 2.83Å; E76-G78 VanDerWaalsContact C-N 3.27Å
79	I	96.2	Very high	96.4	Very high	2 Å²	2	33.7 Å²	33.7	1%	0.01	17%	0.165	C	C	.	.			trans	-76.4	138.3	172.4	-59.6	173.6	0	0	0	108.2	I23 V31 M74 I75 N77 P81 L194	I23-I79 HydrophobicContact CD1-CD1 4.25Å; I23-I79 HydrophobicContact CG1-CD1 3.71Å; V31-I79 HydrophobicContact CB-CG2 4.23Å; V31-I79 HydrophobicContact CG2-CG2 3.88Å; M74-I79 HydrophobicContact CB-CB 4.08Å; M74-I79 HydrophobicContact CB-CD1 4.49Å; M74-I79 HydrophobicContact CB-CG2 4.36Å; M74-I79 HydrophobicContact CG-CD1 4.44Å; M74-I79 WeakPolarHBondContact O-CB 3.35Å; M74-I79 PolarHBondContact O-N 2.93Å; I75-I79 WeakPolarHBondContact CA-O 3.41Å; N77-I79 VanDerWaalsContact C-N 3.29Å; N77-I79 PolarHBondContact O-N 3.2Å; I79-P81 WeakPolarHBondContact O-CD 3.41Å; I79-L194 HydrophobicContact CD1-CD1 3.84Å
80	K	96.9	Very high	96.4	Very high	65 Å²	65	31.2 Å²	31.2	28%	0.283	16%	0.159	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-104.5	89.5	175.2	-64.8	-176.7	-175.1	179.9	0	109	R29 K30 V31 W298 T336	R29-K80 PolarHBondContact O-N 3.14Å; K30-K80 VanDerWaalsContact CA-O 3.29Å; K30-K80 WeakPolarHBondContact CA-O 3.37Å; K30-K80 HydrophobicContact CB-CB 4.49Å; K30-K80 HydrophobicContact CG-CB 3.98Å; K30-K80 HydrophobicContact CG-CD 4.41Å; V31-K80 PolarHBondContact N-O 3.08Å; K80-W298 HydrophobicContact CB-CD2 4.28Å; K80-W298 HydrophobicContact CB-CH2 4.35Å; K80-W298 HydrophobicContact CB-CZ2 3.77Å; K80-W298 WeakPolarHBondContact O-CZ2 3.45Å; K80-T336 PolarHBondContact NZ-OG1 2.98Å; K80-T336 VanDerWaalsContact NZ-OG1 3.08Å
81	P	98.2	Very high	96.2	Very high	0 Å²	0	34.4 Å²	34.4	0%	0	19%	0.187	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-74.9	141.3	-177.4	30.8	-35.4	0	0	0	111.1	V31 I33 T71 M74 I75 I79 Y83 V150 W298	V31-P81 CarbonylContact O-C 3.56Å; V31-P81 WeakPolarHBondContact O-CA 3.1Å; I33-P81 HydrophobicContact CD1-CB 3.57Å; I33-P81 HydrophobicContact CG1-CB 4.47Å; T71-P81 HydrophobicContact CG2-CG 4.21Å; M74-P81 HydrophobicContact CE-CB 3.94Å; M74-P81 HydrophobicContact CE-CG 4.21Å; M74-P81 HydrophobicContact SD-CB 4.46Å; I75-P81 HydrophobicContact CD1-CG 4.37Å; I75-P81 HydrophobicContact CG1-CG 4.09Å; I79-P81 WeakPolarHBondContact O-CD 3.41Å; P81-Y83 HydrophobicContact CB-CE2 4.13Å; P81-Y83 HydrophobicContact CG-CE2 4.49Å; P81-V150 HydrophobicContact CG-CG1 4.06Å; P81-V150 WeakPolarHBondContact O-CG1 3.38Å; P81-W298 WeakPolarHBondContact O-CZ2 3.48Å; P81-W298 PolarHBondContact O-NE1 3.03Å
82	V	98.6	Very high	96	Very high	0 Å²	0	36.8 Å²	36.8	0%	0	20%	0.199	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-119.6	128.1	159	54.7	0	0	0	0	107.3	V31 A32 I33 P151 V153 V172 L296 W298	V31-V82 PolarHBondContact O-N 2.97Å; A32-V82 CarbonylContact C-O 3.56Å; A32-V82 WeakPolarHBondContact CA-O 3.42Å; A32-V82 HydrophobicContact CB-CG1 3.9Å; I33-V82 PolarHBondContact N-O 3Å; V82-P151 WeakPolarHBondContact CA-O 3.42Å; V82-P151 HydrophobicContact CB-CG 4.16Å; V82-P151 HydrophobicContact CG2-CB 4.31Å; V82-P151 HydrophobicContact CG2-CG 4.25Å; V82-V153 HydrophobicContact CG2-CG2 4Å; V82-V172 HydrophobicContact CG1-CG1 3.79Å; V82-L296 HydrophobicContact CB-CD1 4.35Å; V82-L296 HydrophobicContact CB-CD2 4.28Å; V82-L296 HydrophobicContact CG1-CD1 4.02Å; V82-L296 HydrophobicContact CG2-CD2 3.64Å; V82-W298 HydrophobicContact CB-CZ2 4.35Å
83	Y	98.8	Very high	95.9	Very high	0 Å²	0	37.1 Å²	37.1	0%	0	20%	0.2	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-90.2	140	179	-78.6	-88.9	0	0	0	110.9	I33 A35 M67 T71 M74 P81 L145 V150 P151 F152 V153	I33-Y83 HydrophobicContact CB-CD1 3.95Å; I33-Y83 HydrophobicContact CB-CE1 3.98Å; I33-Y83 HydrophobicContact CD1-CE1 4.26Å; I33-Y83 HydrophobicContact CD1-CE2 4.39Å; I33-Y83 HydrophobicContact CG2-CD1 3.88Å; I33-Y83 HydrophobicContact CG2-CE1 3.58Å; I33-Y83 CarbonylContact O-C 3.58Å; I33-Y83 WeakPolarHBondContact O-CA 3.36Å; A35-Y83 HydrophobicContact CB-CD1 4.04Å; M67-Y83 HydrophobicContact CE-CD1 4.02Å; M67-Y83 HydrophobicContact CE-CE1 3.88Å; M67-Y83 HydrophobicContact SD-CD1 3.9Å; M67-Y83 HydrophobicContact SD-CD2 4.44Å; M67-Y83 HydrophobicContact SD-CE1 3.33Å; M67-Y83 WeakPolarHBondContact SD-CE1 3.44Å; M67-Y83 HydrophobicContact SD-CE2 3.94Å; M67-Y83 HydrophobicContact SD-CG 4.4Å; T71-Y83 HydrophobicContact CG2-CE2 4.27Å; T71-Y83 WeakPolarHBondContact OG1-CE2 3.4Å; T71-Y83 PolarHBondContact OG1-OH 2.89Å; M74-Y83 HydrophobicContact CE-CE2 4.4Å; M74-Y83 WeakPolarHBondContact CE-OH 3.43Å; P81-Y83 HydrophobicContact CB-CE2 4.13Å; P81-Y83 HydrophobicContact CG-CE2 4.49Å; Y83-L145 HydrophobicContact CD2-CD1 3.8Å; Y83-L145 HydrophobicContact CD2-CD2 3.44Å; Y83-L145 VanDerWaalsContact CD2-CD2 3.44Å; Y83-L145 HydrophobicContact CD2-CG 4.29Å; Y83-L145 HydrophobicContact CE2-CD2 3.62Å; Y83-L145 HydrophobicContact CG-CD1 3.74Å; Y83-L145 HydrophobicContact CG-CD2 4.21Å; Y83-V150 HydrophobicContact CD2-CG1 4.03Å; Y83-V150 HydrophobicContact CE2-CG1 4.32Å; Y83-P151 PolarHBondContact N-O 3.4Å; Y83-P151 VanDerWaalsContact N-O 3.14Å; Y83-F152 CarbonylContact O-C 3.24Å; Y83-F152 WeakPolarHBondContact O-CA 3.49Å; Y83-F152 WeakPolarHBondContact O-CB 3.35Å; Y83-V153 PolarHBondContact O-N 2.69Å
84	V	98.7	Very high	95.8	Very high	0 Å²	0	38.4 Å²	38.4	0%	0	22%	0.217	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-119.9	117.5	178	-174.7	0	0	0	0	108.7	A32 I33 A35 V153 A155 A159 Q162 C163 L166	A32-V84 HydrophobicContact CB-CG2 4.37Å; I33-V84 PolarHBondContact O-N 3.3Å; A35-V84 WeakPolarHBondContact CB-O 3.5Å; A35-V84 PolarHBondContact N-O 2.82Å; V84-V153 CarbonylContact C-O 3.52Å; V84-V153 WeakPolarHBondContact CA-O 3.49Å; V84-V153 HydrophobicContact CG2-CB 4.3Å; V84-A155 HydrophobicContact CG1-CB 4.03Å; V84-A159 HydrophobicContact CB-CB 4.5Å; V84-A159 HydrophobicContact CG1-CB 4.15Å; V84-A159 WeakPolarHBondContact O-CB 3.34Å; V84-Q162 HydrophobicContact CG1-CB 3.85Å; V84-Q162 HydrophobicContact CG1-CG 3.75Å; V84-C163 WeakPolarHBondContact CB-SG 3.42Å; V84-C163 WeakPolarHBondContact CG2-SG 3.41Å; V84-L166 HydrophobicContact CG2-CD1 4.14Å
85	F	98.3	Very high	95.5	Very high	0 Å²	0	40.3 Å²	40.3	0%	0	24%	0.237	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-90.6	141.5	176.6	-68.6	-95.2	0	0	0	109.8	A35 I39 N138 C141 R142 L145 F152 V153 A155	A35-F85 HydrophobicContact CB-CD1 3.78Å; A35-F85 HydrophobicContact CB-CD2 4.06Å; A35-F85 HydrophobicContact CB-CE1 3.83Å; A35-F85 HydrophobicContact CB-CE2 4.08Å; A35-F85 HydrophobicContact CB-CG 3.91Å; A35-F85 HydrophobicContact CB-CZ 3.98Å; I39-F85 HydrophobicContact CD1-CD1 4.45Å; I39-F85 HydrophobicContact CD1-CE1 3.81Å; F85-N138 HydrophobicContact CD1-CB 4.19Å; F85-N138 HydrophobicContact CE1-CB 4.3Å; F85-C141 HydrophobicContact CE1-CB 3.94Å; F85-C141 HydrophobicContact CZ-CB 3.86Å; F85-R142 HydrophobicContact CD2-CG 4.14Å; F85-R142 HydrophobicContact CE1-CG 4.14Å; F85-R142 HydrophobicContact CE2-CG 3.71Å; F85-R142 HydrophobicContact CZ-CG 3.71Å; F85-L145 HydrophobicContact CE2-CD1 3.82Å; F85-L145 HydrophobicContact CZ-CD1 3.86Å; F85-F152 HydrophobicContact CD2-CB 4.07Å; F85-F152 HydrophobicContact CD2-CD2 4.09Å; F85-F152 HydrophobicContact CD2-CG 4.32Å; F85-F152 HydrophobicContact CE2-CB 3.74Å; F85-F152 HydrophobicContact CE2-CD2 4.12Å; F85-F152 AromaticContact CE2-CG 3.97Å; F85-F152 HydrophobicContact CE2-CG 3.97Å; F85-V153 PolarHBondContact N-O 3.17Å; F85-A155 WeakPolarHBondContact O-CB 3.45Å; F85-A155 PolarHBondContact O-N 3.42Å
86	E	95.8	Very high	95.4	Very high	76 Å²	76	40.5 Å²	40.5	36%	0.355	24%	0.237	S	C	.	.			trans	-67.9	150.7	176.2	75.7	-161.4	139.8	0	0	111.7	S36 A159	S36-E86 WeakPolarHBondContact CB-OE1 3.43Å; S36-E86 VanDerWaalsContact OG-CG 3.26Å; S36-E86 WeakPolarHBondContact OG-CG 3.49Å; S36-E86 PolarHBondContact OG-OE1 3.22Å; E86-A159 HydrophobicContact CB-CB 4.24Å
87	G	96.1	Very high	95.3	Very high	31 Å²	31	39.4 Å²	39.4	32%	0.32	23%	0.234	S	C	.	.			trans	-104	-137.8	171.2	0	0	0	0	0	111.6	A155 P156 G157	G87-A155 WeakPolarHBondContact CA-O 3.48Å; G87-A155 PolarHBondContact N-O 3.16Å; G87-P156 WeakPolarHBondContact CA-O 3.36Å; G87-G157 PolarHBondContact N-O 3Å
88	K	94.8	Very high	95.3	Very high	167 Å²	167	40.2 Å²	40.2	73%	0.726	25%	0.245	S	C	*	.	S	Bend	trans	-78.8	123.7	179.5	-176.2	-178.8	175	-175.2	0	109.3	P156 G157	K88-P156 PolarHBondContact N-O 3.19Å; K88-G157 WeakPolarHBondContact O-CA 3.36Å
89	P	94.2	Very high	95.2	Very high	56 Å²	56	43.9 Å²	43.9	36%	0.364	26%	0.259	S	S	.	.	P	Polyproline II helix	trans	-63.6	146.5	177.2	26.6	-34.1	0	0	0	110.8	K93 L97	P89-K93 HydrophobicContact CB-CD 4.43Å; P89-L97 HydrophobicContact CB-CD1 4.14Å; P89-L97 HydrophobicContact CG-CD1 3.93Å
90	P	95	Very high	95	Very high	26 Å²	26	46.7 Å²	46.7	17%	0.169	27%	0.269	C	S	.	.	P	Polyproline II helix	trans	-63.7	149.7	175.5	27.5	-32.2	0	0	0	110.3	M92 K93 E158 Y234 L282	P90-M92 PolarHBondContact O-N 3.02Å; P90-M92 VanDerWaalsContact O-N 3.15Å; P90-K93 HydrophobicContact CG-CB 4.18Å; P90-K93 WeakPolarHBondContact O-CB 3.43Å; P90-K93 PolarHBondContact O-N 3.47Å; P90-E158 WeakPolarHBondContact CD-OE1 3.4Å; P90-E158 HydrophobicContact CG-CG 4.43Å; P90-Y234 HydrophobicContact CG-CD1 4.1Å; P90-Y234 HydrophobicContact CG-CE1 3.83Å; P90-L282 HydrophobicContact CB-CD1 4.01Å; P90-L282 HydrophobicContact CB-CD2 4.28Å; P90-L282 HydrophobicContact CG-CD1 4.32Å; P90-L282 HydrophobicContact CG-CD2 3.97Å
91	S	93.9	Very high	94.8	Very high	106 Å²	106	45.6 Å²	45.6	74%	0.741	27%	0.269	S	S	*	.	G	3₁₀ helix	trans	-55.1	-35.5	-178.9	51.8	0	0	0	0	112.8	K93 A94	S91-K93 PolarHBondContact O-N 3.19Å; S91-A94 WeakPolarHBondContact O-CB 3.37Å; S91-A94 PolarHBondContact O-N 3.43Å; S91-A94 VanDerWaalsContact O-N 3.07Å
92	M	93.1	Very high	94.6	Very high	50 Å²	50	50.2 Å²	50.2	25%	0.246	29%	0.294	C	S	.	.	G	3₁₀ helix	trans	-60.3	-27.6	177.2	-71.9	-178.9	-93.4	0	0	113.7	P90 A94 Y234 D278 L282	P90-M92 PolarHBondContact O-N 3.02Å; P90-M92 VanDerWaalsContact O-N 3.15Å; M92-A94 PolarHBondContact O-N 2.95Å; M92-Y234 VanDerWaalsContact O-O 3.14Å; M92-D278 HydrophobicContact CE-CB 4.09Å; M92-D278 WeakPolarHBondContact CE-O 2.88Å; M92-D278 VanDerWaalsContact SD-C 3.52Å; M92-D278 HydrophobicContact SD-CB 3.53Å; M92-D278 VanDerWaalsContact SD-CB 3.53Å; M92-L282 HydrophobicContact CE-CB 3.76Å; M92-L282 HydrophobicContact CE-CD1 4.31Å; M92-L282 HydrophobicContact CE-CD2 4.11Å; M92-L282 HydrophobicContact CE-CG 4.28Å
93	K	94	Very high	94.3	Very high	11 Å²	11	56.4 Å²	56.4	5%	0.048	32%	0.317	C	S	.	.	G	3₁₀ helix	trans	-74.9	-6.9	177.9	-160.3	165.3	-175.9	174.6	0	113	P89 P90 S91 G95 E96 L97 E158 D233 Y234	P89-K93 HydrophobicContact CB-CD 4.43Å; P90-K93 HydrophobicContact CG-CB 4.18Å; P90-K93 WeakPolarHBondContact O-CB 3.43Å; P90-K93 PolarHBondContact O-N 3.47Å; S91-K93 PolarHBondContact O-N 3.19Å; K93-G95 VanDerWaalsContact C-N 3.25Å; K93-G95 PolarHBondContact O-N 3.31Å; K93-E96 PolarHBondContact O-N 3.13Å; K93-L97 HydrophobicContact CG-CG 4.19Å; K93-L97 WeakPolarHBondContact O-CG 3.42Å; K93-L97 PolarHBondContact O-N 3.34Å; K93-E158 WeakPolarHBondContact CD-OE1 3.48Å; K93-E158 WeakPolarHBondContact CE-OE1 3.39Å; K93-E158 IonicContact NZ-OE1 2.84Å; K93-E158 PolarHBondContact NZ-OE1 2.95Å; K93-E158 IonicContact NZ-OE2 2.94Å; K93-E158 PolarHBondContact NZ-OE2 2.85Å; K93-D233 HydrophobicContact CG-CB 4.44Å; K93-Y234 HydrophobicContact CB-CD1 4.19Å; K93-Y234 HydrophobicContact CB-CE1 4.39Å; K93-Y234 HydrophobicContact CD-CE1 4.12Å
94	A	93.6	Very high	94	Very high	58 Å²	58	60 Å²	60	48%	0.479	33%	0.331	S	S	.	.	H	α-helix	trans	-56	-38.1	-178.3	0	0	0	0	0	113	S91 M92 L97 A98	S91-A94 WeakPolarHBondContact O-CB 3.37Å; S91-A94 PolarHBondContact O-N 3.43Å; S91-A94 VanDerWaalsContact O-N 3.07Å; M92-A94 PolarHBondContact O-N 2.95Å; A94-L97 PolarHBondContact O-N 3.41Å; A94-A98 WeakPolarHBondContact O-CB 3.33Å; A94-A98 PolarHBondContact O-N 3.06Å
95	G	91.8	Very high	93.8	Very high	41 Å²	41	64.3 Å²	64.3	42%	0.423	35%	0.353	S	S	.	.	H	α-helix	trans	-63	-47.1	177.1	0	0	0	0	0	113	K93 A98 K99	K93-G95 VanDerWaalsContact C-N 3.25Å; K93-G95 PolarHBondContact O-N 3.31Å; G95-A98 PolarHBondContact O-N 2.94Å; G95-K99 WeakPolarHBondContact O-CG 3.19Å; G95-K99 PolarHBondContact O-N 2.88Å
96	E	92.2	Very high	93.5	Very high	30 Å²	30	68.8 Å²	68.8	14%	0.14	37%	0.374	C	S	.	.	H	α-helix	trans	-68.8	-35.5	176.3	177	53.9	-153.6	0	0	111.9	K93 A98 K99 R100 R103 D233	K93-E96 PolarHBondContact O-N 3.13Å; E96-A98 VanDerWaalsContact C-N 3.34Å; E96-A98 PolarHBondContact O-N 3.49Å; E96-K99 PolarHBondContact O-N 3.11Å; E96-R100 WeakPolarHBondContact O-CB 3.38Å; E96-R100 VanDerWaalsContact O-CG 3.3Å; E96-R100 WeakPolarHBondContact O-CG 3.5Å; E96-R100 PolarHBondContact O-N 3.38Å; E96-R100 WeakPolarHBondContact OE1-CG 3.32Å; E96-R100 IonicContact OE1-CZ 2.76Å; E96-R100 IonicContact OE1-NE 3.47Å; E96-R100 PolarHBondContact OE1-NE 3.36Å; E96-R100 IonicContact OE1-NH2 2.8Å; E96-R103 IonicContact OE1-CZ 3.96Å; E96-R103 IonicContact OE1-NH1 2.63Å; E96-R103 IonicContact OE1-NH2 2.76Å; E96-R103 PolarHBondContact OE1-NH2 3.02Å; E96-D233 HydrophobicContact CB-CB 4.45Å; E96-D233 VanDerWaalsContact CB-O 3.3Å; E96-D233 WeakPolarHBondContact CB-O 3.13Å; E96-D233 HydrophobicContact CG-CB 4.23Å
97	L	92.4	Very high	93.4	Very high	70 Å²	70	65.6 Å²	65.6	37%	0.366	36%	0.36	S	S	.	.	H	α-helix	trans	-63.6	-39.1	173.4	-67.9	175.7	0	0	0	112.2	P89 K93 A94 R100 S101	P89-L97 HydrophobicContact CB-CD1 4.14Å; P89-L97 HydrophobicContact CG-CD1 3.93Å; K93-L97 HydrophobicContact CG-CG 4.19Å; K93-L97 WeakPolarHBondContact O-CG 3.42Å; K93-L97 PolarHBondContact O-N 3.34Å; A94-L97 PolarHBondContact O-N 3.41Å; L97-R100 WeakPolarHBondContact O-CB 3.44Å; L97-R100 PolarHBondContact O-N 3.13Å; L97-S101 PolarHBondContact O-N 3.11Å
98	A	94.1	Very high	93.3	Very high	47 Å²	47	67.8 Å²	67.8	39%	0.388	37%	0.367	S	S	.	.	H	α-helix	trans	-63.6	-49.5	173.8	0	0	0	0	0	110.9	A94 G95 E96 R100 S101 D102	A94-A98 WeakPolarHBondContact O-CB 3.33Å; A94-A98 PolarHBondContact O-N 3.06Å; G95-A98 PolarHBondContact O-N 2.94Å; E96-A98 VanDerWaalsContact C-N 3.34Å; E96-A98 PolarHBondContact O-N 3.49Å; A98-R100 VanDerWaalsContact C-N 3.28Å; A98-R100 PolarHBondContact O-N 3.02Å; A98-S101 CarbonylContact O-C 3.54Å; A98-S101 WeakPolarHBondContact O-CA 3.45Å; A98-S101 VanDerWaalsContact O-CB 3.25Å; A98-S101 WeakPolarHBondContact O-CB 3.5Å; A98-S101 PolarHBondContact O-N 3.44Å; A98-D102 PolarHBondContact O-N 2.91Å
99	K	92.3	Very high	93.3	Very high	86 Å²	86	65.6 Å²	65.6	37%	0.374	36%	0.358	S	S	.	.	H	α-helix	trans	-55.8	-41.7	174.1	-69.2	172.1	-172.7	170.6	0	112	G95 E96 S101 D102 R103 D236	G95-K99 WeakPolarHBondContact O-CG 3.19Å; G95-K99 PolarHBondContact O-N 2.88Å; E96-K99 PolarHBondContact O-N 3.11Å; K99-S101 VanDerWaalsContact C-N 3.28Å; K99-S101 PolarHBondContact O-N 2.82Å; K99-D102 PolarHBondContact O-N 2.97Å; K99-R103 WeakPolarHBondContact O-CB 3.14Å; K99-R103 VanDerWaalsContact O-CG 3.29Å; K99-R103 WeakPolarHBondContact O-CG 3.2Å; K99-R103 PolarHBondContact O-N 2.89Å; K99-D236 IonicContact NZ-OD1 3.88Å; K99-D236 PolarHBondContact NZ-OD1 3.23Å
100	R	91.4	Very high	93.3	Very high	61 Å²	61	66.3 Å²	66.3	23%	0.23	36%	0.357	C	S	.	.	H	α-helix	trans	-62.6	-33.9	173.7	-76.1	173.2	-170.6	-174.1	7.2	112.2	E96 L97 A98 R104 D233	E96-R100 WeakPolarHBondContact O-CB 3.38Å; E96-R100 VanDerWaalsContact O-CG 3.3Å; E96-R100 WeakPolarHBondContact O-CG 3.5Å; E96-R100 PolarHBondContact O-N 3.38Å; E96-R100 WeakPolarHBondContact OE1-CG 3.32Å; E96-R100 IonicContact OE1-CZ 2.76Å; E96-R100 IonicContact OE1-NE 3.47Å; E96-R100 PolarHBondContact OE1-NE 3.36Å; E96-R100 IonicContact OE1-NH2 2.8Å; L97-R100 WeakPolarHBondContact O-CB 3.44Å; L97-R100 PolarHBondContact O-N 3.13Å; A98-R100 VanDerWaalsContact C-N 3.28Å; A98-R100 PolarHBondContact O-N 3.02Å; R100-R104 WeakPolarHBondContact O-CG 3.48Å; R100-R104 PolarHBondContact O-N 3.41Å; R100-R104 PolarHBondContact O-NE 3.2Å; R100-D233 IonicContact CZ-OD2 3.68Å; R100-D233 IonicContact NH2-OD1 3.1Å; R100-D233 PolarHBondContact NH2-OD1 2.89Å; R100-D233 IonicContact NH2-OD2 3.74Å; R100-D233 PolarHBondContact NH2-OD2 2.68Å
101	S	93.1	Very high	93.2	Very high	41 Å²	41	66.1 Å²	66.1	29%	0.287	35%	0.354	S	S	.	.	H	α-helix	trans	-70.8	-46.3	175.2	-157.3	0	0	0	0	112	L97 A98 K99 R103 R104 I105	L97-S101 PolarHBondContact O-N 3.11Å; A98-S101 CarbonylContact O-C 3.54Å; A98-S101 WeakPolarHBondContact O-CA 3.45Å; A98-S101 VanDerWaalsContact O-CB 3.25Å; A98-S101 WeakPolarHBondContact O-CB 3.5Å; A98-S101 PolarHBondContact O-N 3.44Å; K99-S101 VanDerWaalsContact C-N 3.28Å; K99-S101 PolarHBondContact O-N 2.82Å; S101-R103 PolarHBondContact O-N 3.14Å; S101-R104 VanDerWaalsContact CA-NH2 3.32Å; S101-R104 WeakPolarHBondContact O-CA 3.19Å; S101-R104 WeakPolarHBondContact O-CB 3.03Å; S101-R104 PolarHBondContact O-N 3.39Å; S101-R104 PolarHBondContact OG-NH2 3.48Å; S101-I105 PolarHBondContact O-N 3.21Å
102	D	94.7	Very high	93.2	Very high	98 Å²	98	63.6 Å²	63.6	52%	0.524	34%	0.339	S	S	.	.	H	α-helix	trans	-62.7	-42.9	179.4	-62.4	-21.3	0	0	0	111.5	A98 K99 R104 I105 E106	A98-D102 PolarHBondContact O-N 2.91Å; K99-D102 PolarHBondContact O-N 2.97Å; D102-R104 PolarHBondContact O-N 3.35Å; D102-I105 PolarHBondContact O-N 3Å; D102-E106 PolarHBondContact O-N 3.26Å
103	R	92.3	Very high	93.4	Very high	129 Å²	129	66.4 Å²	66.4	49%	0.487	35%	0.35	S	S	.	.	H	α-helix	trans	-58.1	-34	173.3	-72.7	-170.3	-59.2	-112.8	10.9	112.6	E96 K99 S101 S107	E96-R103 IonicContact OE1-CZ 3.96Å; E96-R103 IonicContact OE1-NH1 2.63Å; E96-R103 IonicContact OE1-NH2 2.76Å; E96-R103 PolarHBondContact OE1-NH2 3.02Å; K99-R103 WeakPolarHBondContact O-CB 3.14Å; K99-R103 VanDerWaalsContact O-CG 3.29Å; K99-R103 WeakPolarHBondContact O-CG 3.2Å; K99-R103 PolarHBondContact O-N 2.89Å; S101-R103 PolarHBondContact O-N 3.14Å; R103-S107 VanDerWaalsContact O-CB 3.3Å; R103-S107 WeakPolarHBondContact O-CB 3.34Å; R103-S107 PolarHBondContact O-N 2.95Å; R103-S107 PolarHBondContact O-OG 2.92Å
104	R	92.3	Very high	93.3	Very high	77 Å²	77	66 Å²	66	29%	0.291	35%	0.349	S	S	.	.	H	α-helix	trans	-72.2	-46.6	175.9	-77.2	-178.8	-70	118.5	-1.9	111	R100 S101 D102 E106 S107 T108 L130	R100-R104 WeakPolarHBondContact O-CG 3.48Å; R100-R104 PolarHBondContact O-N 3.41Å; R100-R104 PolarHBondContact O-NE 3.2Å; S101-R104 VanDerWaalsContact CA-NH2 3.32Å; S101-R104 WeakPolarHBondContact O-CA 3.19Å; S101-R104 WeakPolarHBondContact O-CB 3.03Å; S101-R104 PolarHBondContact O-N 3.39Å; S101-R104 PolarHBondContact OG-NH2 3.48Å; D102-R104 PolarHBondContact O-N 3.35Å; R104-E106 VanDerWaalsContact C-N 3.26Å; R104-E106 PolarHBondContact O-N 3.31Å; R104-S107 CarbonylContact O-C 3.58Å; R104-S107 PolarHBondContact O-N 3.49Å; R104-S107 VanDerWaalsContact O-N 3.14Å; R104-T108 PolarHBondContact O-N 3.04Å; R104-T108 PolarHBondContact O-OG1 2.95Å; R104-L130 HydrophobicContact CB-CD2 4.28Å; R104-L130 VanDerWaalsContact O-CD2 3.24Å; R104-L130 WeakPolarHBondContact O-CD2 3.43Å
105	I	93.4	Very high	93.4	Very high	90 Å²	90	68.4 Å²	68.4	46%	0.462	35%	0.351	S	S	.	.	H	α-helix	trans	-54.9	-46.1	176.5	-66.3	167.5	0	0	0	110.4	S101 D102 T108 K109	S101-I105 PolarHBondContact O-N 3.21Å; D102-I105 PolarHBondContact O-N 3Å; I105-T108 WeakPolarHBondContact O-CB 3.49Å; I105-T108 PolarHBondContact O-N 3.46Å; I105-K109 PolarHBondContact O-N 3.44Å
106	E	93.8	Very high	93.5	Very high	93 Å²	93	70.6 Å²	70.6	44%	0.435	37%	0.365	S	S	.	.	H	α-helix	trans	-68	-41.7	178.9	-166	61.7	-174.2	0	0	112.2	D102 R104 T108 K109 E110	D102-E106 PolarHBondContact O-N 3.26Å; R104-E106 VanDerWaalsContact C-N 3.26Å; R104-E106 PolarHBondContact O-N 3.31Å; E106-T108 PolarHBondContact O-N 3.22Å; E106-K109 PolarHBondContact O-N 2.78Å; E106-K109 IonicContact OE2-NZ 3.05Å; E106-K109 PolarHBondContact OE2-NZ 2.67Å; E106-E110 WeakPolarHBondContact O-CG 3.3Å; E106-E110 PolarHBondContact O-N 2.87Å
107	S	92.7	Very high	93.7	Very high	10 Å²	10	74.9 Å²	74.9	7%	0.07	39%	0.385	C	S	.	.	H	α-helix	trans	-63.1	-28.1	174.5	-59.8	0	0	0	0	112.7	R103 R104 L111	R103-S107 VanDerWaalsContact O-CB 3.3Å; R103-S107 WeakPolarHBondContact O-CB 3.34Å; R103-S107 PolarHBondContact O-N 2.95Å; R103-S107 PolarHBondContact O-OG 2.92Å; R104-S107 CarbonylContact O-C 3.58Å; R104-S107 PolarHBondContact O-N 3.49Å; R104-S107 VanDerWaalsContact O-N 3.14Å; S107-L111 VanDerWaalsContact O-CB 3.3Å; S107-L111 WeakPolarHBondContact O-CB 3.33Å; S107-L111 PolarHBondContact O-N 2.9Å
108	T	93.7	Very high	93.6	Very high	76 Å²	76	79.3 Å²	79.3	47%	0.466	40%	0.403	S	S	.	.	H	α-helix	trans	-68.8	-42.2	175.4	-60.9	0	0	0	0	111	R104 I105 E106 L111 A112 L130	R104-T108 PolarHBondContact O-N 3.04Å; R104-T108 PolarHBondContact O-OG1 2.95Å; I105-T108 WeakPolarHBondContact O-CB 3.49Å; I105-T108 PolarHBondContact O-N 3.46Å; E106-T108 PolarHBondContact O-N 3.22Å; T108-L111 PolarHBondContact O-N 3.41Å; T108-A112 PolarHBondContact O-N 2.9Å; T108-L130 VanDerWaalsContact OG1-CD2 3.27Å; T108-L130 WeakPolarHBondContact OG1-CD2 3.49Å
109	K	94.9	Very high	93.6	Very high	121 Å²	121	80.3 Å²	80.3	53%	0.526	40%	0.402	S	S	.	.	H	α-helix	trans	-64.6	-45	176.1	-64	176.4	-166.5	158.6	0	111.5	I105 E106 L111 A112 K113	I105-K109 PolarHBondContact O-N 3.44Å; E106-K109 PolarHBondContact O-N 2.78Å; E106-K109 IonicContact OE2-NZ 3.05Å; E106-K109 PolarHBondContact OE2-NZ 2.67Å; K109-L111 VanDerWaalsContact C-N 3.32Å; K109-L111 PolarHBondContact O-N 3.34Å; K109-A112 PolarHBondContact O-N 3.46Å; K109-K113 PolarHBondContact O-N 2.81Å
110	E	94.6	Very high	93.5	Very high	72 Å²	72	82.7 Å²	82.7	34%	0.336	42%	0.419	S	S	.	.	H	α-helix	trans	-64.8	-36.1	177.7	-69.7	-67.3	130.8	0	0	112.1	E106 K113 A114 F126	E106-E110 WeakPolarHBondContact O-CG 3.3Å; E106-E110 PolarHBondContact O-N 2.87Å; E110-K113 PolarHBondContact O-N 2.87Å; E110-A114 WeakPolarHBondContact O-CB 3.34Å; E110-A114 PolarHBondContact O-N 2.85Å; E110-F126 HydrophobicContact CB-CD1 3.76Å; E110-F126 HydrophobicContact CB-CD2 3.97Å; E110-F126 HydrophobicContact CB-CE1 3.52Å; E110-F126 HydrophobicContact CB-CE2 3.75Å; E110-F126 HydrophobicContact CB-CG 4Å; E110-F126 HydrophobicContact CB-CZ 3.53Å; E110-F126 HydrophobicContact CG-CE1 4.02Å; E110-F126 HydrophobicContact CG-CZ 4.05Å
111	L	93.3	Very high	93.4	Very high	21 Å²	21	87.7 Å²	87.7	11%	0.11	44%	0.444	C	S	.	.	H	α-helix	trans	-62.9	-48.7	172.6	180	61.3	0	0	0	111.3	S107 T108 K109 K113 A114 E115 I123 F126 L130	S107-L111 VanDerWaalsContact O-CB 3.3Å; S107-L111 WeakPolarHBondContact O-CB 3.33Å; S107-L111 PolarHBondContact O-N 2.9Å; T108-L111 PolarHBondContact O-N 3.41Å; K109-L111 VanDerWaalsContact C-N 3.32Å; K109-L111 PolarHBondContact O-N 3.34Å; L111-K113 PolarHBondContact O-N 2.82Å; L111-A114 PolarHBondContact O-N 3.07Å; L111-A114 VanDerWaalsContact O-N 3.1Å; L111-E115 HydrophobicContact CD1-CG 4.17Å; L111-E115 HydrophobicContact CG-CG 4.34Å; L111-E115 WeakPolarHBondContact O-CG 3.48Å; L111-E115 PolarHBondContact O-N 2.94Å; L111-I123 HydrophobicContact CD1-CB 4.3Å; L111-I123 HydrophobicContact CD1-CG1 4.46Å; L111-I123 HydrophobicContact CD1-CG2 4.07Å; L111-F126 HydrophobicContact CB-CB 3.83Å; L111-F126 HydrophobicContact CD1-CB 4.1Å; L111-L130 HydrophobicContact CB-CD1 4.3Å; L111-L130 HydrophobicContact CD2-CD1 3.44Å; L111-L130 VanDerWaalsContact CD2-CD1 3.44Å
112	A	94.5	Very high	93.3	Very high	53 Å²	53	86.4 Å²	86.4	44%	0.438	44%	0.437	S	S	.	.	H	α-helix	trans	-60.5	-36.2	179.5	0	0	0	0	0	112.2	T108 K109 A116	T108-A112 PolarHBondContact O-N 2.9Å; K109-A112 PolarHBondContact O-N 3.46Å; A112-A116 PolarHBondContact O-N 2.86Å; A112-A116 VanDerWaalsContact O-N 3.13Å
113	K	95.7	Very high	93.1	Very high	109 Å²	109	83.8 Å²	83.8	47%	0.474	42%	0.422	S	S	.	.	H	α-helix	trans	-65.8	-47.3	172.9	-175.9	-177.6	171.5	-171.3	0	111.7	K109 E110 L111 E115 A116 E117	K109-K113 PolarHBondContact O-N 2.81Å; E110-K113 PolarHBondContact O-N 2.87Å; L111-K113 PolarHBondContact O-N 2.82Å; K113-E115 VanDerWaalsContact C-N 3.31Å; K113-E115 PolarHBondContact O-N 2.63Å; K113-A116 PolarHBondContact O-N 3.48Å; K113-E117 WeakPolarHBondContact CE-OE1 3.49Å; K113-E117 IonicContact NZ-OE1 3.89Å; K113-E117 WeakPolarHBondContact O-CG 3.33Å; K113-E117 PolarHBondContact O-N 3.33Å
114	A	93.7	Very high	92.9	Very high	4 Å²	4	81.6 Å²	81.6	3%	0.033	42%	0.417	C	S	.	.	H	α-helix	trans	-62.3	-37.4	178.5	0	0	0	0	0	112.5	E110 L111 E117 E118 D119 A122 I123 F126	E110-A114 WeakPolarHBondContact O-CB 3.34Å; E110-A114 PolarHBondContact O-N 2.85Å; L111-A114 PolarHBondContact O-N 3.07Å; L111-A114 VanDerWaalsContact O-N 3.1Å; A114-E117 CarbonylContact O-C 3.55Å; A114-E117 PolarHBondContact O-N 3.49Å; A114-E118 PolarHBondContact O-N 3.45Å; A114-D119 PolarHBondContact O-N 2.98Å; A114-A122 HydrophobicContact CB-CB 3.59Å; A114-I123 HydrophobicContact CB-CG1 3.87Å; A114-F126 HydrophobicContact CB-CD2 4.27Å
115	E	93.7	Very high	92.8	Very high	108 Å²	108	83.1 Å²	83.1	51%	0.505	43%	0.426	S	S	.	.	H	α-helix	trans	-64.4	-41.3	174	-72.9	173.8	169	0	0	111.9	L111 K113 E117 E118 I123	L111-E115 HydrophobicContact CD1-CG 4.17Å; L111-E115 HydrophobicContact CG-CG 4.34Å; L111-E115 WeakPolarHBondContact O-CG 3.48Å; L111-E115 PolarHBondContact O-N 2.94Å; K113-E115 VanDerWaalsContact C-N 3.31Å; K113-E115 PolarHBondContact O-N 2.63Å; E115-E117 VanDerWaalsContact C-N 3.31Å; E115-E117 PolarHBondContact O-N 3.36Å; E115-E118 PolarHBondContact O-N 3.26Å; E115-I123 HydrophobicContact CG-CD1 4.2Å; E115-I123 HydrophobicContact CG-CG1 3.98Å
116	A	95.5	Very high	92.7	Very high	87 Å²	87	79.8 Å²	79.8	72%	0.719	41%	0.408	S	S	*	.	H	α-helix	trans	-68.5	-29	176.1	0	0	0	0	0	113.3	A112 K113	A112-A116 PolarHBondContact O-N 2.86Å; A112-A116 VanDerWaalsContact O-N 3.13Å; K113-A116 PolarHBondContact O-N 3.48Å
117	E	95.4	Very high	92.5	Very high	120 Å²	120	77 Å²	77	56%	0.561	40%	0.399	S	S	*	.	T	Hydrogen-bonded Turn	trans	-90.2	-1.6	177.5	-68.3	173.5	-179.8	0	0	112.9	K113 A114 E115 D119	K113-E117 WeakPolarHBondContact CE-OE1 3.49Å; K113-E117 IonicContact NZ-OE1 3.89Å; K113-E117 WeakPolarHBondContact O-CG 3.33Å; K113-E117 PolarHBondContact O-N 3.33Å; A114-E117 CarbonylContact O-C 3.55Å; A114-E117 PolarHBondContact O-N 3.49Å; E115-E117 VanDerWaalsContact C-N 3.31Å; E115-E117 PolarHBondContact O-N 3.36Å; E117-D119 PolarHBondContact O-N 3.32Å
118	E	91.7	Very high	92.3	Very high	162 Å²	162	79.7 Å²	79.7	76%	0.757	41%	0.41	S	S	*	.	T	Hydrogen-bonded Turn	trans	52.6	28.9	-173.9	-60.7	-176.3	177.7	0	0	113.9	A114 E115 L120	A114-E118 PolarHBondContact O-N 3.45Å; E115-E118 PolarHBondContact O-N 3.26Å; E118-L120 PolarHBondContact O-N 3.47Å
119	D	92.7	Very high	92.1	Very high	69 Å²	69	82 Å²	82	37%	0.369	41%	0.41	S	S	.	.			trans	-79.5	90.4	178	-177.5	-14.7	0	0	0	110.3	A114 E117 E121 A122 I123	A114-D119 PolarHBondContact O-N 2.98Å; E117-D119 PolarHBondContact O-N 3.32Å; D119-E121 VanDerWaalsContact C-N 3.27Å; D119-E121 PolarHBondContact O-N 3.17Å; D119-E121 PolarHBondContact OD1-N 3.4Å; D119-E121 VanDerWaalsContact OD1-N 3.16Å; D119-A122 HydrophobicContact CB-CB 3.92Å; D119-A122 PolarHBondContact O-N 2.88Å; D119-A122 PolarHBondContact OD1-N 3.23Å; D119-A122 WeakPolarHBondContact OD2-CB 3.41Å; D119-I123 WeakPolarHBondContact O-CB 3.14Å; D119-I123 WeakPolarHBondContact O-CG1 3.48Å; D119-I123 PolarHBondContact O-N 3.16Å
120	L	89.9	Confident	91.9	Very high	136 Å²	136	78.4 Å²	78.4	71%	0.712	40%	0.396	S	S	*	.	H	α-helix	trans	-55.4	-36.9	-178	-62.7	178.3	0	0	0	113.7	E118 I123 E124	E118-L120 PolarHBondContact O-N 3.47Å; L120-I123 HydrophobicContact CD2-CD1 4.49Å; L120-E124 PolarHBondContact O-N 3.04Å
121	E	90.3	Very high	91.7	Very high	165 Å²	165	76 Å²	76	77%	0.771	39%	0.386	S	S	*	.	H	α-helix	trans	-70.3	-43.2	-179.8	-67.5	-170.3	176.9	0	0	110.9	D119 K125	D119-E121 VanDerWaalsContact C-N 3.27Å; D119-E121 PolarHBondContact O-N 3.17Å; D119-E121 PolarHBondContact OD1-N 3.4Å; D119-E121 VanDerWaalsContact OD1-N 3.16Å; E121-K125 VanDerWaalsContact O-CB 3.3Å; E121-K125 WeakPolarHBondContact O-CB 3.17Å; E121-K125 PolarHBondContact O-N 3.13Å
122	A	91.5	Very high	91.6	Very high	15 Å²	15	81 Å²	81	12%	0.124	41%	0.407	C	S	.	.	H	α-helix	trans	-66	-42.3	175.4	0	0	0	0	0	111.6	A114 D119 E124 K125 F126	A114-A122 HydrophobicContact CB-CB 3.59Å; D119-A122 HydrophobicContact CB-CB 3.92Å; D119-A122 PolarHBondContact O-N 2.88Å; D119-A122 PolarHBondContact OD1-N 3.23Å; D119-A122 WeakPolarHBondContact OD2-CB 3.41Å; A122-E124 PolarHBondContact O-N 3.35Å; A122-K125 PolarHBondContact O-N 2.6Å; A122-F126 HydrophobicContact CB-CD2 4.1Å; A122-F126 HydrophobicContact CB-CE2 3.92Å; A122-F126 WeakPolarHBondContact O-CD2 3.34Å; A122-F126 PolarHBondContact O-N 2.62Å
123	I	89.8	Confident	91.6	Very high	42 Å²	42	79.8 Å²	79.8	22%	0.215	39%	0.394	C	S	.	.	H	α-helix	trans	-56.2	-51.7	175.6	-69.3	165.2	0	0	0	110.2	L111 A114 E115 D119 L120 K125 F126 S127	L111-I123 HydrophobicContact CD1-CB 4.3Å; L111-I123 HydrophobicContact CD1-CG1 4.46Å; L111-I123 HydrophobicContact CD1-CG2 4.07Å; A114-I123 HydrophobicContact CB-CG1 3.87Å; E115-I123 HydrophobicContact CG-CD1 4.2Å; E115-I123 HydrophobicContact CG-CG1 3.98Å; D119-I123 WeakPolarHBondContact O-CB 3.14Å; D119-I123 WeakPolarHBondContact O-CG1 3.48Å; D119-I123 PolarHBondContact O-N 3.16Å; L120-I123 HydrophobicContact CD2-CD1 4.49Å; I123-K125 VanDerWaalsContact C-N 3.32Å; I123-K125 PolarHBondContact O-N 3.06Å; I123-F126 PolarHBondContact O-N 3.48Å; I123-S127 WeakPolarHBondContact O-CB 3.38Å; I123-S127 PolarHBondContact O-N 3.33Å
124	E	88.1	Confident	91.5	Very high	83 Å²	83	76.9 Å²	76.9	39%	0.388	39%	0.386	S	S	.	.	H	α-helix	trans	-60.5	-43.8	179.6	-170.7	-172.7	174.9	0	0	111.4	L120 A122 K128	L120-E124 PolarHBondContact O-N 3.04Å; A122-E124 PolarHBondContact O-N 3.35Å; E124-K128 HydrophobicContact CG-CD 4.48Å; E124-K128 WeakPolarHBondContact O-CG 2.94Å; E124-K128 PolarHBondContact O-N 2.86Å; E124-K128 VanDerWaalsContact O-N 3.12Å; E124-K128 VanDerWaalsContact OE1-CE 3.27Å; E124-K128 WeakPolarHBondContact OE1-CE 3.29Å; E124-K128 IonicContact OE1-NZ 2.81Å; E124-K128 PolarHBondContact OE1-NZ 3.01Å
125	K	90.3	Very high	91.6	Very high	110 Å²	110	82 Å²	82	48%	0.478	42%	0.418	S	S	.	.	H	α-helix	trans	-62.7	-48.6	-179.9	176.9	-174.8	175.3	-172.5	0	112.3	E121 A122 I123 R129	E121-K125 VanDerWaalsContact O-CB 3.3Å; E121-K125 WeakPolarHBondContact O-CB 3.17Å; E121-K125 PolarHBondContact O-N 3.13Å; A122-K125 PolarHBondContact O-N 2.6Å; I123-K125 VanDerWaalsContact C-N 3.32Å; I123-K125 PolarHBondContact O-N 3.06Å; K125-R129 WeakPolarHBondContact O-CG 3.41Å; K125-R129 PolarHBondContact O-N 3.02Å
126	F	91	Very high	91.7	Very high	19 Å²	19	79.5 Å²	79.5	8%	0.083	42%	0.417	C	S	.	.	H	α-helix	trans	-75	-36.2	-178.4	-64.7	-61.3	0	0	0	111.6	E110 L111 A114 A122 I123 K128 R129 L130	E110-F126 HydrophobicContact CB-CD1 3.76Å; E110-F126 HydrophobicContact CB-CD2 3.97Å; E110-F126 HydrophobicContact CB-CE1 3.52Å; E110-F126 HydrophobicContact CB-CE2 3.75Å; E110-F126 HydrophobicContact CB-CG 4Å; E110-F126 HydrophobicContact CB-CZ 3.53Å; E110-F126 HydrophobicContact CG-CE1 4.02Å; E110-F126 HydrophobicContact CG-CZ 4.05Å; L111-F126 HydrophobicContact CB-CB 3.83Å; L111-F126 HydrophobicContact CD1-CB 4.1Å; A114-F126 HydrophobicContact CB-CD2 4.27Å; A122-F126 HydrophobicContact CB-CD2 4.1Å; A122-F126 HydrophobicContact CB-CE2 3.92Å; A122-F126 WeakPolarHBondContact O-CD2 3.34Å; A122-F126 PolarHBondContact O-N 2.62Å; I123-F126 PolarHBondContact O-N 3.48Å; F126-K128 VanDerWaalsContact C-N 3.3Å; F126-K128 PolarHBondContact O-N 2.91Å; F126-R129 WeakPolarHBondContact O-CB 3.29Å; F126-R129 PolarHBondContact O-N 3.34Å; F126-L130 PolarHBondContact O-N 3.44Å
127	S	88.6	Confident	91.8	Very high	36 Å²	36	76.6 Å²	76.6	25%	0.252	39%	0.388	S	S	.	.	H	α-helix	trans	-54.4	-44.5	171.3	175.3	0	0	0	0	112	R47 I123 R129 L130	R47-S127 PolarHBondContact NH1-OG 3.05Å; R47-S127 VanDerWaalsContact NH1-OG 3.08Å; I123-S127 WeakPolarHBondContact O-CB 3.38Å; I123-S127 PolarHBondContact O-N 3.33Å; S127-R129 VanDerWaalsContact C-N 3.29Å; S127-R129 PolarHBondContact O-N 3.49Å; S127-L130 PolarHBondContact O-N 2.85Å
128	K	89.5	Confident	91.9	Very high	66 Å²	66	71.8 Å²	71.8	29%	0.287	37%	0.366	S	S	.	.	H	α-helix	trans	-62.8	-33.1	176	-75	172.4	-176	166.9	0	113.2	I44 E124 F126 L130 V131	I44-K128 HydrophobicContact CG2-CB 4.47Å; I44-K128 HydrophobicContact CG2-CD 4.38Å; I44-K128 HydrophobicContact CG2-CG 4.31Å; E124-K128 HydrophobicContact CG-CD 4.48Å; E124-K128 WeakPolarHBondContact O-CG 2.94Å; E124-K128 PolarHBondContact O-N 2.86Å; E124-K128 VanDerWaalsContact O-N 3.12Å; E124-K128 VanDerWaalsContact OE1-CE 3.27Å; E124-K128 WeakPolarHBondContact OE1-CE 3.29Å; E124-K128 IonicContact OE1-NZ 2.81Å; E124-K128 PolarHBondContact OE1-NZ 3.01Å; F126-K128 VanDerWaalsContact C-N 3.3Å; F126-K128 PolarHBondContact O-N 2.91Å; K128-L130 VanDerWaalsContact C-N 3.33Å; K128-V131 WeakPolarHBondContact O-CG2 3.36Å
129	R	89.6	Confident	92.1	Very high	124 Å²	124	68.9 Å²	68.9	47%	0.468	35%	0.352	S	S	.	.	H	α-helix	trans	-74.2	-23.4	178.8	-68.7	174.6	177.8	-171.7	-3.6	113.2	K125 F126 S127 V131	K125-R129 WeakPolarHBondContact O-CG 3.41Å; K125-R129 PolarHBondContact O-N 3.02Å; F126-R129 WeakPolarHBondContact O-CB 3.29Å; F126-R129 PolarHBondContact O-N 3.34Å; S127-R129 VanDerWaalsContact C-N 3.29Å; S127-R129 PolarHBondContact O-N 3.49Å; R129-V131 VanDerWaalsContact C-N 3.35Å
130	L	90.7	Very high	92.4	Very high	46 Å²	46	66.6 Å²	66.6	24%	0.241	34%	0.34	C	S	.	.	H	α-helix	trans	-83.9	-9.1	177.9	-65.4	-175.7	0	0	0	114	R104 T108 L111 F126 S127 K128 K132	R104-L130 HydrophobicContact CB-CD2 4.28Å; R104-L130 VanDerWaalsContact O-CD2 3.24Å; R104-L130 WeakPolarHBondContact O-CD2 3.43Å; T108-L130 VanDerWaalsContact OG1-CD2 3.27Å; T108-L130 WeakPolarHBondContact OG1-CD2 3.49Å; L111-L130 HydrophobicContact CB-CD1 4.3Å; L111-L130 HydrophobicContact CD2-CD1 3.44Å; L111-L130 VanDerWaalsContact CD2-CD1 3.44Å; F126-L130 PolarHBondContact O-N 3.44Å; S127-L130 PolarHBondContact O-N 2.85Å; K128-L130 VanDerWaalsContact C-N 3.33Å; L130-K132 PolarHBondContact O-N 3.25Å
131	V	90.7	Very high	92.8	Very high	21 Å²	21	60.1 Å²	60.1	13%	0.127	31%	0.306	C	S	.	.			trans	-56.4	127.8	178	173.7	0	0	0	0	110.4	Y40 L43 I44 K128 R129	Y40-V131 HydrophobicContact CD2-CG1 4.38Å; Y40-V131 HydrophobicContact CE2-CG1 4.41Å; L43-V131 HydrophobicContact CB-CG1 3.43Å; L43-V131 VanDerWaalsContact CB-CG1 3.43Å; L43-V131 HydrophobicContact CD1-CG1 4.02Å; L43-V131 HydrophobicContact CG-CG1 4.37Å; I44-V131 HydrophobicContact CG1-CB 4.02Å; I44-V131 HydrophobicContact CG1-CG1 4.03Å; I44-V131 HydrophobicContact CG1-CG2 4.06Å; K128-V131 WeakPolarHBondContact O-CG2 3.36Å; R129-V131 VanDerWaalsContact C-N 3.35Å
132	K	91.4	Very high	93.2	Very high	126 Å²	126	54.7 Å²	54.7	55%	0.548	28%	0.279	S	S	.	.			trans	-132.4	137.3	176.3	-178.4	-179.8	175.5	-171.8	0	109.6	L130	L130-K132 PolarHBondContact O-N 3.25Å
133	V	93.5	Very high	93.5	Very high	28 Å²	28	57.8 Å²	57.8	17%	0.17	29%	0.291	C	S	.	.			trans	-75.7	130.3	169.9	-175.3	0	0	0	0	108.8	I39 Y40 L43 H137	I39-V133 HydrophobicContact CB-CG1 4.46Å; I39-V133 HydrophobicContact CB-CG2 4.42Å; I39-V133 HydrophobicContact CG2-CG1 3.79Å; I39-V133 HydrophobicContact CG2-CG2 3.97Å; Y40-V133 HydrophobicContact CD2-CG2 4.37Å; L43-V133 HydrophobicContact CD1-CG2 4.12Å; V133-H137 HydrophobicContact CG1-CB 4.32Å
134	T	94	Very high	93.9	Very high	48 Å²	48	55.8 Å²	55.8	29%	0.294	28%	0.28	S	S	.	.			trans	-107.3	159.6	179.4	66.3	0	0	0	0	110	A136 H137 N138	T134-A136 PolarHBondContact O-N 3Å; T134-H137 PolarHBondContact N-ND1 2.91Å; T134-H137 PolarHBondContact O-N 3.2Å; T134-H137 VanDerWaalsContact O-N 3.14Å; T134-H137 PolarHBondContact OG1-CD2 2.8Å; T134-H137 VanDerWaalsContact OG1-CG 3.24Å; T134-H137 PolarHBondContact OG1-N 3.06Å; T134-H137 PolarHBondContact OG1-ND1 3.49Å; T134-N138 PolarHBondContact O-N 3.33Å
135	P	95.4	Very high	94.4	Very high	110 Å²	110	51.8 Å²	51.8	71%	0.714	26%	0.262	S	S	*	.	H	α-helix	trans	-55.8	-34	172	-27	36.1	0	0	0	113.3	N138 E139	P135-N138 WeakPolarHBondContact O-CB 3.36Å; P135-N138 PolarHBondContact O-N 3.13Å; P135-E139 PolarHBondContact O-N 2.97Å
136	A	95.6	Very high	94.8	Very high	57 Å²	57	51.8 Å²	51.8	47%	0.471	27%	0.267	S	S	.	.	H	α-helix	trans	-62	-44.9	175.7	0	0	0	0	0	111.9	T134 N138 E139 D140	T134-A136 PolarHBondContact O-N 3Å; A136-N138 PolarHBondContact O-N 3.39Å; A136-E139 PolarHBondContact O-N 2.96Å; A136-E139 VanDerWaalsContact O-N 3.13Å; A136-D140 WeakPolarHBondContact O-CB 3.06Å; A136-D140 PolarHBondContact O-N 3.14Å
137	H	97.2	Very high	95.1	Very high	26 Å²	26	51.9 Å²	51.9	12%	0.12	27%	0.268	C	S	.	.	H	α-helix	trans	-59.9	-36.1	176	-59.2	158.2	0	0	0	112.5	I39 H63 V133 T134 C141	I39-H137 HydrophobicContact CG2-CB 4.23Å; H63-H137 AromaticContact CE1-CD2 3.26Å; H63-H137 PolarHBondContact CE1-CD2 3.42Å; H63-H137 AromaticContact CE1-CG 3.95Å; H63-H137 AromaticContact CE1-NE2 3.99Å; H63-H137 AromaticContact ND1-CD2 3.63Å; H63-H137 AromaticContact NE2-CD2 3.73Å; V133-H137 HydrophobicContact CG1-CB 4.32Å; T134-H137 PolarHBondContact N-ND1 2.91Å; T134-H137 PolarHBondContact O-N 3.2Å; T134-H137 VanDerWaalsContact O-N 3.14Å; T134-H137 PolarHBondContact OG1-CD2 2.8Å; T134-H137 VanDerWaalsContact OG1-CG 3.24Å; T134-H137 PolarHBondContact OG1-N 3.06Å; T134-H137 PolarHBondContact OG1-ND1 3.49Å; H137-C141 WeakPolarHBondContact O-CB 3.38Å; H137-C141 PolarHBondContact O-N 2.8Å; H137-C141 PolarHBondContact O-SG 3.35Å
138	N	97.4	Very high	95.6	Very high	18 Å²	18	50.4 Å²	50.4	10%	0.096	26%	0.257	C	S	.	.	H	α-helix	trans	-67.9	-43.6	176.8	-72.4	-24	0	0	0	110.9	I39 F85 T134 P135 A136 C141 R142	I39-N138 WeakPolarHBondContact CD1-OD1 3.34Å; F85-N138 HydrophobicContact CD1-CB 4.19Å; F85-N138 HydrophobicContact CE1-CB 4.3Å; T134-N138 PolarHBondContact O-N 3.33Å; P135-N138 WeakPolarHBondContact O-CB 3.36Å; P135-N138 PolarHBondContact O-N 3.13Å; A136-N138 PolarHBondContact O-N 3.39Å; N138-C141 PolarHBondContact O-N 2.93Å; N138-R142 WeakPolarHBondContact O-CG 3.39Å; N138-R142 PolarHBondContact O-N 3.09Å
139	E	97.6	Very high	96	Very high	101 Å²	101	47.4 Å²	47.4	47%	0.472	25%	0.246	S	C	.	.	H	α-helix	trans	-65.1	-45.6	178.9	-168.1	54.2	-151.7	0	0	112.3	P135 A136 C141 R142 Q143	P135-E139 PolarHBondContact O-N 2.97Å; A136-E139 PolarHBondContact O-N 2.96Å; A136-E139 VanDerWaalsContact O-N 3.13Å; E139-C141 VanDerWaalsContact C-N 3.29Å; E139-C141 PolarHBondContact O-N 2.74Å; E139-R142 PolarHBondContact O-N 3.11Å; E139-R142 VanDerWaalsContact O-N 3.13Å; E139-R142 IonicContact OE2-CZ 3.83Å; E139-R142 IonicContact OE2-NH1 3.74Å; E139-R142 PolarHBondContact OE2-NH1 3.31Å; E139-Q143 PolarHBondContact O-N 3.07Å
140	D	97.7	Very high	96.4	Very high	21 Å²	21	41.8 Å²	41.8	11%	0.112	23%	0.225	C	C	.	.	H	α-helix	trans	-55.4	-44.7	173.1	-74.5	-18.2	0	0	0	111.8	H63 L64 A136 Q143 L144 F309 K313 H314	H63-D140 IonicContact CE1-OD2 3.87Å; H63-D140 WeakPolarHBondContact NE2-CB 3.34Å; H63-D140 IonicContact NE2-OD2 3.22Å; H63-D140 PolarHBondContact NE2-OD2 3.27Å; L64-D140 HydrophobicContact CD2-CB 3.9Å; L64-D140 HydrophobicContact CG-CB 4.37Å; A136-D140 WeakPolarHBondContact O-CB 3.06Å; A136-D140 PolarHBondContact O-N 3.14Å; D140-Q143 PolarHBondContact O-N 2.9Å; D140-L144 WeakPolarHBondContact O-CB 3.22Å; D140-L144 PolarHBondContact O-N 3.39Å; D140-F309 HydrophobicContact CB-CZ 4.26Å; D140-K313 IonicContact OD1-NZ 3.75Å; D140-H314 IonicContact OD1-NE2 3.04Å
141	C	98.5	Very high	96.7	Very high	0 Å²	0	40.4 Å²	40.4	0%	0	22%	0.219	C	C	.	.	H	α-helix	trans	-66.1	-39.3	177.5	-72.5	0	0	0	0	112.4	I39 M67 F85 H137 N138 E139 L144 L145	I39-C141 HydrophobicContact CD1-CB 3.99Å; M67-C141 HydrophobicContact CE-CB 4.08Å; F85-C141 HydrophobicContact CE1-CB 3.94Å; F85-C141 HydrophobicContact CZ-CB 3.86Å; H137-C141 WeakPolarHBondContact O-CB 3.38Å; H137-C141 PolarHBondContact O-N 2.8Å; H137-C141 PolarHBondContact O-SG 3.35Å; N138-C141 PolarHBondContact O-N 2.93Å; E139-C141 VanDerWaalsContact C-N 3.29Å; E139-C141 PolarHBondContact O-N 2.74Å; C141-L144 PolarHBondContact O-N 2.91Å; C141-L145 WeakPolarHBondContact O-CB 3.28Å; C141-L145 WeakPolarHBondContact O-CG 3.46Å; C141-L145 PolarHBondContact O-N 3.11Å
142	R	98.4	Very high	97.1	Very high	52 Å²	52	42.5 Å²	42.5	20%	0.196	23%	0.226	C	C	.	.	H	α-helix	trans	-64.2	-45.8	176	-73	-177	-161.5	115	2.6	111.3	F85 N138 E139 L144 L145 N146 F152 N154	F85-R142 HydrophobicContact CD2-CG 4.14Å; F85-R142 HydrophobicContact CE1-CG 4.14Å; F85-R142 HydrophobicContact CE2-CG 3.71Å; F85-R142 HydrophobicContact CZ-CG 3.71Å; N138-R142 WeakPolarHBondContact O-CG 3.39Å; N138-R142 PolarHBondContact O-N 3.09Å; E139-R142 PolarHBondContact O-N 3.11Å; E139-R142 VanDerWaalsContact O-N 3.13Å; E139-R142 IonicContact OE2-CZ 3.83Å; E139-R142 IonicContact OE2-NH1 3.74Å; E139-R142 PolarHBondContact OE2-NH1 3.31Å; R142-L144 VanDerWaalsContact C-N 3.34Å; R142-L144 PolarHBondContact O-N 2.87Å; R142-L145 PolarHBondContact O-N 2.93Å; R142-N146 WeakPolarHBondContact O-CB 3.42Å; R142-N146 PolarHBondContact O-N 3.39Å; R142-F152 HydrophobicContact CB-CE1 4.03Å; R142-F152 HydrophobicContact CB-CE2 4.25Å; R142-F152 HydrophobicContact CB-CZ 3.85Å; R142-F152 HydrophobicContact CG-CD2 4.09Å; R142-F152 HydrophobicContact CG-CE1 4.35Å; R142-F152 HydrophobicContact CG-CE2 3.79Å; R142-F152 HydrophobicContact CG-CZ 3.93Å; R142-N154 PolarHBondContact NE-OD1 3.44Å; R142-N154 PolarHBondContact NH2-OD1 2.81Å
143	Q	98.3	Very high	97.4	Very high	79 Å²	79	37.1 Å²	37.1	37%	0.369	20%	0.204	S	C	.	.	H	α-helix	trans	-59	-47.8	176.2	-177.6	170.7	3.4	0	0	110.5	E139 D140 L145 N146 L147 F309	E139-Q143 PolarHBondContact O-N 3.07Å; D140-Q143 PolarHBondContact O-N 2.9Å; Q143-L145 PolarHBondContact O-N 3.13Å; Q143-N146 PolarHBondContact O-N 3Å; Q143-L147 HydrophobicContact CG-CD1 4.15Å; Q143-L147 VanDerWaalsContact O-CG 3.3Å; Q143-L147 WeakPolarHBondContact O-CG 3.2Å; Q143-L147 PolarHBondContact O-N 3.47Å; Q143-F309 HydrophobicContact CB-CE2 4.35Å; Q143-F309 HydrophobicContact CB-CZ 4.18Å; Q143-F309 VanDerWaalsContact CD-CD2 3.41Å; Q143-F309 HydrophobicContact CG-CD2 4.07Å; Q143-F309 HydrophobicContact CG-CE1 4.48Å; Q143-F309 HydrophobicContact CG-CE2 3.96Å; Q143-F309 HydrophobicContact CG-CG 4.38Å; Q143-F309 HydrophobicContact CG-CZ 4.18Å; Q143-F309 VanDerWaalsContact NE2-CD2 3.35Å
144	L	98.6	Very high	97.6	Very high	0 Å²	0	39.7 Å²	39.7	0%	0	22%	0.217	C	C	.	.	H	α-helix	trans	-56.9	-50.6	175.3	177.2	58.4	0	0	0	112.2	L64 M67 F68 D140 C141 R142 N146 L147 M148 L306 F309 L310	L64-L144 HydrophobicContact CB-CD2 4.47Å; L64-L144 HydrophobicContact CD2-CB 4.01Å; L64-L144 HydrophobicContact CD2-CD2 3.79Å; L64-L144 HydrophobicContact CD2-CG 4.46Å; M67-L144 HydrophobicContact CB-CD2 3.89Å; M67-L144 HydrophobicContact CG-CD2 4.03Å; F68-L144 HydrophobicContact CB-CD2 4.1Å; F68-L144 HydrophobicContact CD2-CD1 4.09Å; D140-L144 WeakPolarHBondContact O-CB 3.22Å; D140-L144 PolarHBondContact O-N 3.39Å; C141-L144 PolarHBondContact O-N 2.91Å; R142-L144 VanDerWaalsContact C-N 3.34Å; R142-L144 PolarHBondContact O-N 2.87Å; L144-N146 VanDerWaalsContact C-N 3.31Å; L144-N146 PolarHBondContact O-N 3.22Å; L144-L147 PolarHBondContact O-N 3.3Å; L144-M148 HydrophobicContact CD1-CG 3.98Å; L144-M148 HydrophobicContact CD1-SD 3.92Å; L144-M148 HydrophobicContact CD2-SD 4.36Å; L144-M148 HydrophobicContact CG-CG 4.31Å; L144-M148 HydrophobicContact CG-SD 3.82Å; L144-M148 VanDerWaalsContact O-CG 3.24Å; L144-M148 WeakPolarHBondContact O-CG 3.38Å; L144-M148 PolarHBondContact O-N 2.96Å; L144-L306 HydrophobicContact CD1-CD2 3.66Å; L144-F309 HydrophobicContact CB-CE1 4.03Å; L144-L310 HydrophobicContact CD1-CD1 3.87Å; L144-L310 HydrophobicContact CD1-CD2 4.12Å; L144-L310 HydrophobicContact CD1-CG 4.24Å
145	L	98.5	Very high	97.8	Very high	0 Å²	0	37.6 Å²	37.6	0%	0	21%	0.205	C	C	.	.	H	α-helix	trans	-62.1	-39.2	-178.3	-72.4	169.8	0	0	0	112.1	M67 Y83 F85 C141 R142 Q143 M148 G149 V150 F152	M67-L145 HydrophobicContact CG-CD2 4.11Å; M67-L145 HydrophobicContact CG-CG 4.33Å; M67-L145 HydrophobicContact SD-CD2 4.1Å; Y83-L145 HydrophobicContact CD2-CD1 3.8Å; Y83-L145 HydrophobicContact CD2-CD2 3.44Å; Y83-L145 VanDerWaalsContact CD2-CD2 3.44Å; Y83-L145 HydrophobicContact CD2-CG 4.29Å; Y83-L145 HydrophobicContact CE2-CD2 3.62Å; Y83-L145 HydrophobicContact CG-CD1 3.74Å; Y83-L145 HydrophobicContact CG-CD2 4.21Å; F85-L145 HydrophobicContact CE2-CD1 3.82Å; F85-L145 HydrophobicContact CZ-CD1 3.86Å; C141-L145 WeakPolarHBondContact O-CB 3.28Å; C141-L145 WeakPolarHBondContact O-CG 3.46Å; C141-L145 PolarHBondContact O-N 3.11Å; R142-L145 PolarHBondContact O-N 2.93Å; Q143-L145 PolarHBondContact O-N 3.13Å; L145-M148 PolarHBondContact O-N 3.17Å; L145-G149 PolarHBondContact O-N 3.01Å; L145-G149 VanDerWaalsContact O-N 3.17Å; L145-V150 CarbonylContact C-O 3.46Å; L145-V150 HydrophobicContact CD2-CB 4.03Å; L145-V150 HydrophobicContact CD2-CG1 3.98Å; L145-V150 PolarHBondContact O-N 2.82Å; L145-F152 HydrophobicContact CB-CD1 4.13Å; L145-F152 HydrophobicContact CD1-CB 4.21Å
146	N	98.2	Very high	97.9	Very high	110 Å²	110	34.2 Å²	34.2	59%	0.588	18%	0.183	S	C	*	.	H	α-helix	trans	-60	-48.3	174.1	-171.3	50.6	0	0	0	111.3	R142 Q143 L144 M148 G149	R142-N146 WeakPolarHBondContact O-CB 3.42Å; R142-N146 PolarHBondContact O-N 3.39Å; Q143-N146 PolarHBondContact O-N 3Å; L144-N146 VanDerWaalsContact C-N 3.31Å; L144-N146 PolarHBondContact O-N 3.22Å; N146-M148 VanDerWaalsContact C-N 3.3Å; N146-M148 PolarHBondContact O-N 3.33Å; N146-G149 PolarHBondContact O-N 2.94Å
147	L	98.3	Very high	97.9	Very high	21 Å²	21	31.7 Å²	31.7	11%	0.11	16%	0.162	C	C	.	.	H	α-helix	trans	-63.5	-33.3	176.5	-67.7	170.4	0	0	0	112.7	Q143 L144 G149 P301 D302 G305 L306 F309	Q143-L147 HydrophobicContact CG-CD1 4.15Å; Q143-L147 VanDerWaalsContact O-CG 3.3Å; Q143-L147 WeakPolarHBondContact O-CG 3.2Å; Q143-L147 PolarHBondContact O-N 3.47Å; L144-L147 PolarHBondContact O-N 3.3Å; L147-G149 PolarHBondContact O-N 2.75Å; L147-P301 CarbonylContact O-C 3.47Å; L147-P301 WeakPolarHBondContact O-CA 3.26Å; L147-D302 HydrophobicContact CD2-CB 4.16Å; L147-D302 PolarHBondContact O-N 3.3Å; L147-G305 WeakPolarHBondContact CD1-O 3.44Å; L147-L306 HydrophobicContact CB-CD2 3.64Å; L147-L306 HydrophobicContact CB-CG 3.93Å; L147-F309 HydrophobicContact CD1-CB 3.58Å; L147-F309 HydrophobicContact CD1-CD1 3.97Å; L147-F309 HydrophobicContact CD1-CG 3.89Å
148	M	98.3	Very high	97.9	Very high	4 Å²	4	31 Å²	31	2%	0.02	16%	0.159	C	C	.	.	T	Hydrogen-bonded Turn	trans	-74.5	-8.4	174.3	-66.8	178.7	80.9	0	0	113.5	F68 T71 I72 L144 L145 N146 V150 L306 L328	F68-M148 HydrophobicContact CD2-CE 3.68Å; F68-M148 HydrophobicContact CD2-CG 4.26Å; F68-M148 HydrophobicContact CD2-SD 3.79Å; F68-M148 HydrophobicContact CE2-CE 4.19Å; F68-M148 HydrophobicContact CG-CE 4.45Å; F68-M148 WeakPolarHBondContact O-CE 3.48Å; T71-M148 HydrophobicContact CG2-CE 3.71Å; T71-M148 HydrophobicContact CG2-SD 4.34Å; I72-M148 HydrophobicContact CG1-CE 3.93Å; L144-M148 HydrophobicContact CD1-CG 3.98Å; L144-M148 HydrophobicContact CD1-SD 3.92Å; L144-M148 HydrophobicContact CD2-SD 4.36Å; L144-M148 HydrophobicContact CG-CG 4.31Å; L144-M148 HydrophobicContact CG-SD 3.82Å; L144-M148 VanDerWaalsContact O-CG 3.24Å; L144-M148 WeakPolarHBondContact O-CG 3.38Å; L144-M148 PolarHBondContact O-N 2.96Å; L145-M148 PolarHBondContact O-N 3.17Å; N146-M148 VanDerWaalsContact C-N 3.3Å; N146-M148 PolarHBondContact O-N 3.33Å; M148-V150 VanDerWaalsContact C-N 3.34Å; M148-V150 HydrophobicContact CB-CG2 4.03Å; M148-L306 HydrophobicContact CG-CD2 3.89Å; M148-L328 HydrophobicContact CB-CD1 4.12Å; M148-L328 HydrophobicContact CE-CD1 3.72Å; M148-L328 HydrophobicContact CE-CD2 4.03Å; M148-L328 HydrophobicContact CE-CG 4.44Å; M148-L328 HydrophobicContact CG-CD1 4.08Å
149	G	97.5	Very high	97.9	Very high	4 Å²	4	30.1 Å²	30.1	4%	0.041	15%	0.154	C	C	.	.	T	Hydrogen-bonded Turn	trans	72.6	24.6	-174.5	0	0	0	0	0	113.7	L145 N146 L147 W298 N299	L145-G149 PolarHBondContact O-N 3.01Å; L145-G149 VanDerWaalsContact O-N 3.17Å; N146-G149 PolarHBondContact O-N 2.94Å; L147-G149 PolarHBondContact O-N 2.75Å; G149-W298 CarbonylContact O-C 3.45Å; G149-W298 WeakPolarHBondContact O-CA 3.39Å; G149-N299 PolarHBondContact O-N 3.13Å
150	V	98.1	Very high	97.9	Very high	6 Å²	6	25.6 Å²	25.6	4%	0.036	13%	0.133	C	C	.	.			trans	-104.6	125.7	-177.5	179.6	0	0	0	0	109.9	T71 I75 P81 Y83 L145 M148	T71-V150 HydrophobicContact CG2-CG1 4.39Å; T71-V150 HydrophobicContact CG2-CG2 3.76Å; I75-V150 HydrophobicContact CD1-CG2 3.7Å; P81-V150 HydrophobicContact CG-CG1 4.06Å; P81-V150 WeakPolarHBondContact O-CG1 3.38Å; Y83-V150 HydrophobicContact CD2-CG1 4.03Å; Y83-V150 HydrophobicContact CE2-CG1 4.32Å; L145-V150 CarbonylContact C-O 3.46Å; L145-V150 HydrophobicContact CD2-CB 4.03Å; L145-V150 HydrophobicContact CD2-CG1 3.98Å; L145-V150 PolarHBondContact O-N 2.82Å; M148-V150 VanDerWaalsContact C-N 3.34Å; M148-V150 HydrophobicContact CB-CG2 4.03Å
151	P	98.1	Very high	97.9	Very high	17 Å²	17	24.7 Å²	24.7	11%	0.11	13%	0.128	C	C	.	.			trans	-69	148.5	-178.8	28.9	-32.8	0	0	0	111	V82 Y83 L296 K297 W298	V82-P151 WeakPolarHBondContact CA-O 3.42Å; V82-P151 HydrophobicContact CB-CG 4.16Å; V82-P151 HydrophobicContact CG2-CB 4.31Å; V82-P151 HydrophobicContact CG2-CG 4.25Å; Y83-P151 PolarHBondContact N-O 3.4Å; Y83-P151 VanDerWaalsContact N-O 3.14Å; P151-L296 HydrophobicContact CB-CD2 4.5Å; P151-K297 WeakPolarHBondContact CB-O 3.47Å; P151-K297 WeakPolarHBondContact CD-O 3.24Å; P151-K297 WeakPolarHBondContact CG-O 3.27Å; P151-W298 VanDerWaalsContact CD-NE1 3.31Å; P151-W298 HydrophobicContact CG-CD2 3.9Å; P151-W298 HydrophobicContact CG-CE3 4.4Å; P151-W298 HydrophobicContact CG-CG 4.28Å; P151-W298 HydrophobicContact CG-CH2 4.31Å; P151-W298 HydrophobicContact CG-CZ2 3.79Å
152	F	98.5	Very high	97.9	Very high	64 Å²	64	24.7 Å²	24.7	28%	0.281	13%	0.128	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-134	160.4	166.9	65	-94.1	0	0	0	111.3	Y83 F85 R142 L145	Y83-F152 CarbonylContact O-C 3.24Å; Y83-F152 WeakPolarHBondContact O-CA 3.49Å; Y83-F152 WeakPolarHBondContact O-CB 3.35Å; F85-F152 HydrophobicContact CD2-CB 4.07Å; F85-F152 HydrophobicContact CD2-CD2 4.09Å; F85-F152 HydrophobicContact CD2-CG 4.32Å; F85-F152 HydrophobicContact CE2-CB 3.74Å; F85-F152 HydrophobicContact CE2-CD2 4.12Å; F85-F152 AromaticContact CE2-CG 3.97Å; F85-F152 HydrophobicContact CE2-CG 3.97Å; R142-F152 HydrophobicContact CB-CE1 4.03Å; R142-F152 HydrophobicContact CB-CE2 4.25Å; R142-F152 HydrophobicContact CB-CZ 3.85Å; R142-F152 HydrophobicContact CG-CD2 4.09Å; R142-F152 HydrophobicContact CG-CE1 4.35Å; R142-F152 HydrophobicContact CG-CE2 3.79Å; R142-F152 HydrophobicContact CG-CZ 3.93Å; L145-F152 HydrophobicContact CB-CD1 4.13Å; L145-F152 HydrophobicContact CD1-CB 4.21Å
153	V	98.2	Very high	97.9	Very high	14 Å²	14	22.2 Å²	22.2	9%	0.085	12%	0.119	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-126.2	138.9	178.5	178.2	0	0	0	0	108	V82 Y83 V84 F85 Q162 I294 L296	V82-V153 HydrophobicContact CG2-CG2 4Å; Y83-V153 PolarHBondContact O-N 2.69Å; V84-V153 CarbonylContact C-O 3.52Å; V84-V153 WeakPolarHBondContact CA-O 3.49Å; V84-V153 HydrophobicContact CG2-CB 4.3Å; F85-V153 PolarHBondContact N-O 3.17Å; V153-Q162 HydrophobicContact CG1-CG 4.24Å; V153-I294 HydrophobicContact CG1-CD1 3.94Å; V153-I294 HydrophobicContact CG2-CG2 3.68Å; V153-L296 HydrophobicContact CG2-CD2 4.17Å
154	N	97.6	Very high	97.9	Very high	81 Å²	81	18.4 Å²	18.4	43%	0.433	10%	0.101	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-96.2	114.2	167.8	-62.2	-58.9	0	0	0	107.8	R142	R142-N154 PolarHBondContact NE-OD1 3.44Å; R142-N154 PolarHBondContact NH2-OD1 2.81Å
155	A	97.9	Very high	97.8	Very high	5 Å²	5	19.6 Å²	19.6	4%	0.041	11%	0.109	C	C	.	.			trans	-70.9	147.8	172.7	0	0	0	0	0	109.7	V84 F85 G87 G157 Q162	V84-A155 HydrophobicContact CG1-CB 4.03Å; F85-A155 WeakPolarHBondContact O-CB 3.45Å; F85-A155 PolarHBondContact O-N 3.42Å; G87-A155 WeakPolarHBondContact CA-O 3.48Å; G87-A155 PolarHBondContact N-O 3.16Å; A155-G157 VanDerWaalsContact C-N 3.33Å; A155-Q162 HydrophobicContact CB-CB 3.6Å; A155-Q162 HydrophobicContact CB-CG 3.97Å
156	P	97.3	Very high	97.8	Very high	39 Å²	39	19.6 Å²	19.6	25%	0.253	11%	0.109	S	C	.	.	S	Bend	trans	-71.4	-31.7	171.4	27.6	-32	0	0	0	111.7	G87 K88 E287	G87-P156 WeakPolarHBondContact CA-O 3.36Å; K88-P156 PolarHBondContact N-O 3.19Å; P156-E287 HydrophobicContact CB-CG 4.03Å; P156-E287 HydrophobicContact CG-CG 4Å; P156-E287 WeakPolarHBondContact CG-O 3.37Å
157	G	96.3	Very high	97.8	Very high	4 Å²	4	14.7 Å²	14.7	4%	0.041	8%	0.083	C	C	.	.	S	Bend	trans	-125.3	-122.5	175.9	0	0	0	0	0	112.8	G87 K88 A155	G87-G157 PolarHBondContact N-O 3Å; K88-G157 WeakPolarHBondContact O-CA 3.36Å; A155-G157 VanDerWaalsContact C-N 3.33Å
158	E	96.7	Very high	97.8	Very high	10 Å²	10	18.9 Å²	18.9	5%	0.047	10%	0.101	C	C	.	.			trans	-71.7	134.9	-176.2	-59.7	-68.2	-174.6	0	0	112.7	P90 K93 A161 Q162	P90-E158 WeakPolarHBondContact CD-OE1 3.4Å; P90-E158 HydrophobicContact CG-CG 4.43Å; K93-E158 WeakPolarHBondContact CD-OE1 3.48Å; K93-E158 WeakPolarHBondContact CE-OE1 3.39Å; K93-E158 IonicContact NZ-OE1 2.84Å; K93-E158 PolarHBondContact NZ-OE1 2.95Å; K93-E158 IonicContact NZ-OE2 2.94Å; K93-E158 PolarHBondContact NZ-OE2 2.85Å; E158-A161 HydrophobicContact CB-CB 3.98Å; E158-A161 PolarHBondContact O-N 3.26Å; E158-Q162 PolarHBondContact O-N 2.88Å
159	A	97.8	Very high	97.7	Very high	0 Å²	0	21.5 Å²	21.5	0%	0	12%	0.119	C	C	.	.	H	α-helix	trans	-66.4	-42.6	-177.9	0	0	0	0	0	111.8	V84 E86 A161 Q162 C163	V84-A159 HydrophobicContact CB-CB 4.5Å; V84-A159 HydrophobicContact CG1-CB 4.15Å; V84-A159 WeakPolarHBondContact O-CB 3.34Å; E86-A159 HydrophobicContact CB-CB 4.24Å; A159-A161 VanDerWaalsContact C-N 3.3Å; A159-A161 PolarHBondContact O-N 2.93Å; A159-Q162 PolarHBondContact O-N 3.16Å; A159-C163 WeakPolarHBondContact O-CB 3.47Å; A159-C163 PolarHBondContact O-N 2.86Å; A159-C163 PolarHBondContact O-SG 3.45Å
160	E	96.6	Very high	97.6	Very high	7 Å²	7	24.1 Å²	24.1	3%	0.033	15%	0.146	C	C	.	.	H	α-helix	trans	-64.3	-33.9	178.9	66.8	-81.4	-166.3	0	0	112.3	C163 A164 A182 F185	E160-C163 PolarHBondContact O-N 2.8Å; E160-A164 WeakPolarHBondContact O-CB 3.28Å; E160-A164 PolarHBondContact O-N 2.92Å; E160-A182 HydrophobicContact CB-CB 4.25Å; E160-F185 HydrophobicContact CG-CD2 3.84Å; E160-F185 HydrophobicContact CG-CE2 3.77Å
161	A	97.8	Very high	97.5	Very high	1 Å²	1	26.7 Å²	26.7	1%	0.008	16%	0.157	C	C	.	.	H	α-helix	trans	-67.9	-47	174.8	0	0	0	0	0	111.2	E158 A159 C163 A164 V165 F185 P286 V288	E158-A161 HydrophobicContact CB-CB 3.98Å; E158-A161 PolarHBondContact O-N 3.26Å; A159-A161 VanDerWaalsContact C-N 3.3Å; A159-A161 PolarHBondContact O-N 2.93Å; A161-C163 VanDerWaalsContact C-N 3.32Å; A161-C163 PolarHBondContact O-N 3.19Å; A161-A164 PolarHBondContact O-N 3.18Å; A161-V165 WeakPolarHBondContact O-CG2 3.21Å; A161-V165 PolarHBondContact O-N 3.46Å; A161-V165 VanDerWaalsContact O-N 3.09Å; A161-F185 HydrophobicContact CB-CD1 3.66Å; A161-F185 HydrophobicContact CB-CD2 3.91Å; A161-F185 HydrophobicContact CB-CE1 3.7Å; A161-F185 HydrophobicContact CB-CE2 3.94Å; A161-F185 HydrophobicContact CB-CG 3.78Å; A161-F185 HydrophobicContact CB-CZ 3.83Å; A161-P286 HydrophobicContact CB-CB 3.79Å; A161-P286 HydrophobicContact CB-CG 4.11Å; A161-V288 HydrophobicContact CB-CG1 4.23Å
162	Q	98.4	Very high	97.5	Very high	0 Å²	0	26.1 Å²	26.1	0%	0	15%	0.153	C	C	.	.	H	α-helix	trans	-62.3	-40.1	175.2	180	67.3	67.8	0	0	111.7	V84 V153 A155 E158 A159 V165 L166 V288 T289	V84-Q162 HydrophobicContact CG1-CB 3.85Å; V84-Q162 HydrophobicContact CG1-CG 3.75Å; V153-Q162 HydrophobicContact CG1-CG 4.24Å; A155-Q162 HydrophobicContact CB-CB 3.6Å; A155-Q162 HydrophobicContact CB-CG 3.97Å; E158-Q162 PolarHBondContact O-N 2.88Å; A159-Q162 PolarHBondContact O-N 3.16Å; Q162-V165 PolarHBondContact O-N 2.96Å; Q162-L166 WeakPolarHBondContact O-CG 3.38Å; Q162-L166 PolarHBondContact O-N 2.79Å; Q162-V288 HydrophobicContact CB-CG1 4.37Å; Q162-T289 PolarHBondContact NE2-O 3.37Å; Q162-T289 VanDerWaalsContact NE2-O 3.1Å
163	C	98.7	Very high	97.5	Very high	0 Å²	0	26 Å²	26	0%	0	15%	0.151	C	C	.	.	H	α-helix	trans	-60	-46.6	173.8	-70.4	0	0	0	0	111.4	A32 V84 A159 E160 A161 V165 L166 A167 V175	A32-C163 HydrophobicContact CB-CB 3.91Å; V84-C163 WeakPolarHBondContact CB-SG 3.42Å; V84-C163 WeakPolarHBondContact CG2-SG 3.41Å; A159-C163 WeakPolarHBondContact O-CB 3.47Å; A159-C163 PolarHBondContact O-N 2.86Å; A159-C163 PolarHBondContact O-SG 3.45Å; E160-C163 PolarHBondContact O-N 2.8Å; A161-C163 VanDerWaalsContact C-N 3.32Å; A161-C163 PolarHBondContact O-N 3.19Å; C163-V165 VanDerWaalsContact C-N 3.27Å; C163-V165 PolarHBondContact O-N 3.16Å; C163-L166 WeakPolarHBondContact O-CB 3.15Å; C163-L166 PolarHBondContact O-N 3.44Å; C163-A167 PolarHBondContact O-N 2.94Å; C163-V175 HydrophobicContact CB-CB 4.19Å; C163-V175 HydrophobicContact CB-CG1 3.56Å; C163-V175 HydrophobicContact CB-CG2 3.6Å; C163-V175 WeakPolarHBondContact O-CG2 3.44Å
164	A	98.3	Very high	97.5	Very high	0 Å²	0	25.3 Å²	25.3	0%	0	15%	0.147	C	C	.	.	H	α-helix	trans	-59.6	-39.6	179.5	0	0	0	0	0	111.5	E160 A161 A167 K168 F185	E160-A164 WeakPolarHBondContact O-CB 3.28Å; E160-A164 PolarHBondContact O-N 2.92Å; A161-A164 PolarHBondContact O-N 3.18Å; A164-A167 PolarHBondContact O-N 3.21Å; A164-K168 WeakPolarHBondContact O-CB 3.41Å; A164-K168 WeakPolarHBondContact O-CG 3.37Å; A164-K168 PolarHBondContact O-N 3.09Å; A164-F185 HydrophobicContact CB-CB 3.77Å
165	V	97.7	Very high	97.5	Very high	25 Å²	25	21.4 Å²	21.4	15%	0.152	13%	0.127	C	C	.	.	H	α-helix	trans	-69.1	-37.9	177.4	170.4	0	0	0	0	112.4	A161 Q162 C163 A167 K168 S169 V288 P291	A161-V165 WeakPolarHBondContact O-CG2 3.21Å; A161-V165 PolarHBondContact O-N 3.46Å; A161-V165 VanDerWaalsContact O-N 3.09Å; Q162-V165 PolarHBondContact O-N 2.96Å; C163-V165 VanDerWaalsContact C-N 3.27Å; C163-V165 PolarHBondContact O-N 3.16Å; V165-A167 VanDerWaalsContact C-N 3.29Å; V165-A167 PolarHBondContact O-N 3.47Å; V165-K168 PolarHBondContact O-N 3.12Å; V165-S169 WeakPolarHBondContact O-CB 3.31Å; V165-S169 PolarHBondContact O-N 3.18Å; V165-S169 PolarHBondContact O-OG 2.84Å; V165-V288 HydrophobicContact CG1-CG2 4.33Å; V165-V288 HydrophobicContact CG2-CB 4.48Å; V165-V288 HydrophobicContact CG2-CG1 4.16Å; V165-V288 HydrophobicContact CG2-CG2 4.06Å; V165-P291 HydrophobicContact CG1-CB 4.23Å; V165-P291 HydrophobicContact CG1-CG 3.71Å
166	L	98.4	Very high	97.6	Very high	0 Å²	0	21.3 Å²	21.3	0%	0	13%	0.126	C	C	.	.	H	α-helix	trans	-61.8	-37.7	170.9	-70.4	172.8	0	0	0	111.9	A32 V84 Q162 C163 S169 K171 V172 P291 I294	A32-L166 HydrophobicContact CB-CD1 4.21Å; V84-L166 HydrophobicContact CG2-CD1 4.14Å; Q162-L166 WeakPolarHBondContact O-CG 3.38Å; Q162-L166 PolarHBondContact O-N 2.79Å; C163-L166 WeakPolarHBondContact O-CB 3.15Å; C163-L166 PolarHBondContact O-N 3.44Å; L166-S169 PolarHBondContact O-OG 3.32Å; L166-K171 HydrophobicContact CD2-CB 4.32Å; L166-K171 HydrophobicContact CD2-CD 4.26Å; L166-K171 PolarHBondContact O-N 3.37Å; L166-K171 VanDerWaalsContact O-N 3.11Å; L166-V172 HydrophobicContact CB-CG2 3.97Å; L166-V172 PolarHBondContact O-N 2.61Å; L166-P291 HydrophobicContact CD2-CB 4.24Å; L166-I294 HydrophobicContact CD2-CB 4.43Å; L166-I294 HydrophobicContact CD2-CD1 3.91Å; L166-I294 HydrophobicContact CD2-CG2 4.35Å
167	A	98.2	Very high	97.6	Very high	7 Å²	7	19.6 Å²	19.6	6%	0.058	12%	0.115	C	C	.	.	H	α-helix	trans	-72.5	-45.2	177.6	0	0	0	0	0	112	C163 A164 V165 S169 G170 V172 V175	C163-A167 PolarHBondContact O-N 2.94Å; A164-A167 PolarHBondContact O-N 3.21Å; V165-A167 VanDerWaalsContact C-N 3.29Å; V165-A167 PolarHBondContact O-N 3.47Å; A167-S169 VanDerWaalsContact C-N 3.29Å; A167-S169 PolarHBondContact O-N 3.09Å; A167-G170 PolarHBondContact O-N 2.87Å; A167-V172 HydrophobicContact CB-CG2 3.87Å; A167-V175 HydrophobicContact CB-CG2 3.99Å
168	K	97	Very high	97.6	Very high	109 Å²	109	20 Å²	20	47%	0.474	12%	0.115	S	C	.	.	H	α-helix	trans	-58	-39.2	175.7	-75.4	-180	-175.9	178.1	0	112.9	A164 V165 G170 F185 G186 P188	A164-K168 WeakPolarHBondContact O-CB 3.41Å; A164-K168 WeakPolarHBondContact O-CG 3.37Å; A164-K168 PolarHBondContact O-N 3.09Å; V165-K168 PolarHBondContact O-N 3.12Å; K168-G170 PolarHBondContact O-N 2.89Å; K168-F185 WeakPolarHBondContact CE-O 3.44Å; K168-F185 PolarHBondContact NZ-O 3.1Å; K168-G186 VanDerWaalsContact CE-CA 3.41Å; K168-G186 WeakPolarHBondContact CE-O 3.12Å; K168-G186 WeakPolarHBondContact CG-O 3.31Å; K168-P188 HydrophobicContact CG-CG 4.33Å
169	S	96.6	Very high	97.6	Very high	58 Å²	58	19.9 Å²	19.9	41%	0.406	12%	0.115	S	C	.	.	T	Hydrogen-bonded Turn	trans	-75.7	-3.8	178.5	59.3	0	0	0	0	114.1	V165 L166 A167 K171 P291	V165-S169 WeakPolarHBondContact O-CB 3.31Å; V165-S169 PolarHBondContact O-N 3.18Å; V165-S169 PolarHBondContact O-OG 2.84Å; L166-S169 PolarHBondContact O-OG 3.32Å; A167-S169 VanDerWaalsContact C-N 3.29Å; A167-S169 PolarHBondContact O-N 3.09Å; S169-K171 PolarHBondContact O-N 2.61Å; S169-P291 VanDerWaalsContact OG-CB 3.29Å; S169-P291 WeakPolarHBondContact OG-CB 3.27Å
170	G	96	Very high	97.6	Very high	60 Å²	60	20.2 Å²	20.2	62%	0.619	12%	0.117	S	C	*	.	T	Hydrogen-bonded Turn	trans	75.5	5.5	-177.7	0	0	0	0	0	114.7	A167 K168 V172	A167-G170 PolarHBondContact O-N 2.87Å; K168-G170 PolarHBondContact O-N 2.89Å; G170-V172 VanDerWaalsContact C-N 3.26Å; G170-V172 PolarHBondContact O-N 3.26Å
171	K	96.4	Very high	97.5	Very high	59 Å²	59	19.9 Å²	19.9	26%	0.257	12%	0.115	S	C	.	.	S	Bend	trans	-66	-31.7	174.8	-72.6	-157.6	168.1	-163.4	0	112.1	K30 L166 S169 P291 S292 I294	K30-K171 WeakPolarHBondContact CD-O 3.4Å; L166-K171 HydrophobicContact CD2-CB 4.32Å; L166-K171 HydrophobicContact CD2-CD 4.26Å; L166-K171 PolarHBondContact O-N 3.37Å; L166-K171 VanDerWaalsContact O-N 3.11Å; S169-K171 PolarHBondContact O-N 2.61Å; K171-P291 HydrophobicContact CD-CB 4.37Å; K171-P291 VanDerWaalsContact CD-O 3.29Å; K171-P291 WeakPolarHBondContact CD-O 3.44Å; K171-P291 WeakPolarHBondContact CE-O 3.49Å; K171-P291 PolarHBondContact NZ-O 2.73Å; K171-S292 PolarHBondContact NZ-O 3.27Å; K171-I294 PolarHBondContact NZ-O 3.12Å
172	V	97.8	Very high	97.5	Very high	6 Å²	6	19.8 Å²	19.8	4%	0.036	12%	0.115	C	C	.	.	S	Bend	trans	-129.5	159.2	170.3	-56.9	0	0	0	0	110.5	K30 A32 V82 L166 A167 G170 L296	K30-V172 HydrophobicContact CB-CB 4.21Å; K30-V172 HydrophobicContact CB-CG1 4.11Å; A32-V172 HydrophobicContact CB-CG1 4.26Å; A32-V172 HydrophobicContact CB-CG2 3.8Å; V82-V172 HydrophobicContact CG1-CG1 3.79Å; L166-V172 HydrophobicContact CB-CG2 3.97Å; L166-V172 PolarHBondContact O-N 2.61Å; A167-V172 HydrophobicContact CB-CG2 3.87Å; G170-V172 VanDerWaalsContact C-N 3.26Å; G170-V172 PolarHBondContact O-N 3.26Å; V172-L296 HydrophobicContact CG1-CD1 4.05Å
173	Y	97.7	Very high	97.5	Very high	60 Å²	60	19.8 Å²	19.8	24%	0.235	12%	0.115	C	C	.	.	S	Bend	trans	-75.3	-41	177.9	165.5	-103.8	0	0	0	112.3	Y26 R29 K30 V189 E206	Y26-Y173 HydrophobicContact CD1-CE1 4.1Å; Y26-Y173 HydrophobicContact CE1-CE1 4.14Å; R29-Y173 HydrophobicContact CB-CD1 4.13Å; R29-Y173 HydrophobicContact CB-CG 4.29Å; R29-Y173 HydrophobicContact CG-CD1 4.01Å; R29-Y173 HydrophobicContact CG-CG 4.14Å; K30-Y173 WeakPolarHBondContact O-CB 3.25Å; K30-Y173 PolarHBondContact O-N 2.86Å; Y173-V189 HydrophobicContact CE1-CG1 4.05Å; Y173-V189 HydrophobicContact CE2-CG2 4.5Å; Y173-E206 PolarHBondContact OH-OE2 3.2Å
174	A	98.4	Very high	97.5	Very high	0 Å²	0	19.8 Å²	19.8	0%	0	12%	0.115	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-152.3	167.9	-172.4	0	0	0	0	0	112.1	V31 A32 V189 L191	V31-A174 WeakPolarHBondContact CA-O 3.01Å; V31-A174 WeakPolarHBondContact CG1-O 3.21Å; A32-A174 PolarHBondContact N-O 2.93Å; A174-V189 WeakPolarHBondContact CA-O 3.08Å; A174-V189 HydrophobicContact CB-CB 3.69Å; A174-V189 HydrophobicContact CB-CG1 3.62Å; A174-V189 WeakPolarHBondContact CB-O 3.48Å; A174-L191 HydrophobicContact CB-CD1 3.84Å; A174-L191 HydrophobicContact CB-CD2 4.44Å; A174-L191 HydrophobicContact CB-CG 3.74Å
175	V	98.7	Very high	97.5	Very high	0 Å²	0	19.9 Å²	19.9	0%	0	12%	0.115	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-100.6	132.3	170	177.4	0	0	0	0	109.8	A32 C163 A167 T177 A182 T187 V189 L190 L191	A32-V175 CarbonylContact O-C 3.27Å; A32-V175 VanDerWaalsContact O-CA 3.28Å; A32-V175 WeakPolarHBondContact O-CA 3.18Å; C163-V175 HydrophobicContact CB-CB 4.19Å; C163-V175 HydrophobicContact CB-CG1 3.56Å; C163-V175 HydrophobicContact CB-CG2 3.6Å; C163-V175 WeakPolarHBondContact O-CG2 3.44Å; A167-V175 HydrophobicContact CB-CG2 3.99Å; V175-T177 HydrophobicContact CG1-CG2 3.9Å; V175-A182 HydrophobicContact CG1-CB 4.34Å; V175-T187 HydrophobicContact CB-CG2 4.49Å; V175-T187 HydrophobicContact CG2-CG2 4.49Å; V175-T187 WeakPolarHBondContact CG2-OG1 3.24Å; V175-V189 PolarHBondContact N-O 3.31Å; V175-L190 HydrophobicContact CG1-CD1 4.41Å; V175-L190 CarbonylContact O-C 3.56Å; V175-L190 WeakPolarHBondContact O-CA 3.28Å; V175-L191 PolarHBondContact O-N 2.91Å
176	G	98.4	Very high	97.5	Very high	2 Å²	2	19 Å²	19	2%	0.021	11%	0.11	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-103.5	99.3	172	0	0	0	0	0	111.1	A32 I33 D34 L191	A32-G176 PolarHBondContact O-N 3.21Å; I33-G176 WeakPolarHBondContact CA-O 3.36Å; D34-G176 PolarHBondContact N-O 3.08Å; D34-G176 VanDerWaalsContact N-O 3.14Å; G176-L191 WeakPolarHBondContact CA-O 3.43Å
177	T	98.2	Very high	97.5	Very high	4 Å²	4	19 Å²	19	3%	0.025	11%	0.11	C	C	.	.			trans	-152.6	158.6	174.5	-173.7	0	0	0	0	110.4	D34 V175 D179 A182 L190 L191 R192	D34-T177 PolarHBondContact OD2-OG1 3.2Å; V175-T177 HydrophobicContact CG1-CG2 3.9Å; T177-D179 VanDerWaalsContact C-N 3.31Å; T177-D179 HydrophobicContact CG2-CB 4.15Å; T177-D179 VanDerWaalsContact CG2-O 3.28Å; T177-D179 WeakPolarHBondContact CG2-O 3.14Å; T177-D179 PolarHBondContact OG1-N 2.66Å; T177-D179 VanDerWaalsContact OG1-N 3.1Å; T177-A182 HydrophobicContact CG2-CB 3.81Å; T177-L190 HydrophobicContact CG2-CD1 3.53Å; T177-L191 PolarHBondContact N-O 3.43Å; T177-R192 WeakPolarHBondContact O-CG 3.26Å
178	E	96.4	Very high	97.5	Very high	12 Å²	12	20.8 Å²	20.8	6%	0.056	12%	0.122	C	C	.	.	S	Bend	trans	-89.4	-2.1	166.9	-64.9	-53	134.8	0	0	112.9	M1 M37 R192 H193 F196	M1-E178 PolarHBondContact N-O 3.26Å; M37-E178 HydrophobicContact CG-CB 4.28Å; M37-E178 HydrophobicContact SD-CB 4.35Å; E178-R192 IonicContact OE2-CZ 2.77Å; E178-R192 VanDerWaalsContact OE2-CZ 3.28Å; E178-R192 IonicContact OE2-NE 3.81Å; E178-R192 PolarHBondContact OE2-NE 3.13Å; E178-R192 IonicContact OE2-NH2 3.69Å; E178-R192 PolarHBondContact OE2-NH2 2.73Å; E178-H193 WeakPolarHBondContact OE1-CA 3.37Å; E178-H193 IonicContact OE1-CD2 3.76Å; E178-H193 PolarHBondContact OE1-N 3.02Å; E178-H193 IonicContact OE2-CD2 3.42Å; E178-H193 IonicContact OE2-NE2 2.69Å; E178-F196 HydrophobicContact CG-CE1 3.87Å; E178-F196 HydrophobicContact CG-CZ 4.18Å
179	D	96.1	Very high	97.6	Very high	8 Å²	8	16 Å²	16	4%	0.043	10%	0.102	C	C	.	.			trans	-81.6	119.9	176.1	-150.2	-53.3	0	0	0	111.2	M1 G2 T177 D181	M1-D179 WeakPolarHBondContact CB-OD2 3.43Å; G2-D179 WeakPolarHBondContact CA-OD1 3.18Å; G2-D179 PolarHBondContact N-OD1 2.68Å; G2-D179 PolarHBondContact N-OD2 3.24Å; G2-D179 VanDerWaalsContact N-OD2 3.17Å; T177-D179 VanDerWaalsContact C-N 3.31Å; T177-D179 HydrophobicContact CG2-CB 4.15Å; T177-D179 VanDerWaalsContact CG2-O 3.28Å; T177-D179 WeakPolarHBondContact CG2-O 3.14Å; T177-D179 PolarHBondContact OG1-N 2.66Å; T177-D179 VanDerWaalsContact OG1-N 3.1Å; D179-D181 VanDerWaalsContact C-N 3.26Å; D179-D181 PolarHBondContact O-N 3.1Å; D179-D181 WeakPolarHBondContact OD1-CB 3.49Å; D179-D181 PolarHBondContact OD1-N 3.09Å
180	M	96.9	Very high	97.7	Very high	6 Å²	6	13.3 Å²	13.3	3%	0.03	8%	0.083	C	C	.	.	T	Hydrogen-bonded Turn	trans	-77.5	-15.3	-178.2	-66.8	-66.1	-60.3	0	0	112	M1 L6 I10 A182 L183 L190 R192 F207	M1-M180 PolarHBondContact O-N 3.37Å; L6-M180 HydrophobicContact CB-CB 4.42Å; L6-M180 HydrophobicContact CB-CE 4.41Å; L6-M180 HydrophobicContact CD2-CB 4.15Å; L6-M180 HydrophobicContact CD2-CE 4.27Å; L6-M180 HydrophobicContact CG-CE 4.06Å; I10-M180 HydrophobicContact CD1-CE 3.95Å; M180-A182 PolarHBondContact O-N 3.48Å; M180-A182 VanDerWaalsContact O-N 3.17Å; M180-L183 HydrophobicContact CE-CD1 3.73Å; M180-L183 PolarHBondContact O-N 2.86Å; M180-L183 VanDerWaalsContact O-N 3.07Å; M180-L190 HydrophobicContact SD-CD2 4Å; M180-R192 VanDerWaalsContact SD-CD 3.58Å; M180-F207 HydrophobicContact CE-CD1 4.3Å; M180-F207 HydrophobicContact CE-CE1 4.08Å; M180-F207 HydrophobicContact CE-CZ 4.41Å
181	D	96	Very high	97.8	Very high	0 Å²	0	10.4 Å²	10.4	0%	0	5%	0.053	C	C	.	.	H	α-helix	trans	-61.3	-22.6	176	-76.8	8.5	0	0	0	111.6	G2 V3 D179 L183 A184 F185 F283	G2-D181 WeakPolarHBondContact CA-OD1 3.47Å; V3-D181 WeakPolarHBondContact CG2-OD1 2.83Å; V3-D181 PolarHBondContact N-OD1 3.45Å; D179-D181 VanDerWaalsContact C-N 3.26Å; D179-D181 PolarHBondContact O-N 3.1Å; D179-D181 WeakPolarHBondContact OD1-CB 3.49Å; D179-D181 PolarHBondContact OD1-N 3.09Å; D181-L183 PolarHBondContact O-N 3.19Å; D181-L183 VanDerWaalsContact O-N 3.15Å; D181-A184 CarbonylContact O-C 3.56Å; D181-A184 WeakPolarHBondContact O-CA 3.05Å; D181-A184 WeakPolarHBondContact O-CB 3.44Å; D181-A184 PolarHBondContact O-N 3.32Å; D181-F185 HydrophobicContact CB-CD2 4.4Å; D181-F185 HydrophobicContact CB-CE2 4.21Å; D181-F185 VanDerWaalsContact O-CD2 3.24Å; D181-F185 WeakPolarHBondContact O-CD2 3.33Å; D181-F185 PolarHBondContact O-N 3.23Å; D181-F283 HydrophobicContact CB-CE1 4.18Å
182	A	98	Very high	97.8	Very high	0 Å²	0	9.5 Å²	9.5	0%	0	5%	0.048	C	C	.	.	H	α-helix	trans	-53.5	-35.2	172.5	0	0	0	0	0	113	E160 V175 T177 M180 G186 T187 L190	E160-A182 HydrophobicContact CB-CB 4.25Å; V175-A182 HydrophobicContact CG1-CB 4.34Å; T177-A182 HydrophobicContact CG2-CB 3.81Å; M180-A182 PolarHBondContact O-N 3.48Å; M180-A182 VanDerWaalsContact O-N 3.17Å; A182-G186 PolarHBondContact O-N 2.87Å; A182-T187 HydrophobicContact CB-CG2 4.07Å; A182-T187 VanDerWaalsContact O-CG2 3.22Å; A182-T187 WeakPolarHBondContact O-CG2 3.41Å; A182-T187 PolarHBondContact O-N 3.07Å; A182-L190 HydrophobicContact CB-CD1 4.05Å
183	L	98.2	Very high	97.8	Very high	0 Å²	0	9.9 Å²	9.9	0%	0	5%	0.049	C	C	.	.	H	α-helix	trans	-70.3	-37.3	174.1	-70.9	174	0	0	0	111.8	I10 M180 D181 F185 G186 T187 L190 F207 L209 F223	I10-L183 HydrophobicContact CD1-CD1 3.77Å; M180-L183 HydrophobicContact CE-CD1 3.73Å; M180-L183 PolarHBondContact O-N 2.86Å; M180-L183 VanDerWaalsContact O-N 3.07Å; D181-L183 PolarHBondContact O-N 3.19Å; D181-L183 VanDerWaalsContact O-N 3.15Å; L183-F185 VanDerWaalsContact C-N 3.33Å; L183-G186 VanDerWaalsContact O-CA 3.28Å; L183-G186 WeakPolarHBondContact O-CA 3.49Å; L183-G186 PolarHBondContact O-N 2.87Å; L183-T187 HydrophobicContact CD2-CG2 3.99Å; L183-L190 HydrophobicContact CD1-CD2 4.18Å; L183-L190 HydrophobicContact CD2-CB 4.03Å; L183-L190 HydrophobicContact CG-CB 4.31Å; L183-L190 HydrophobicContact CG-CD2 3.92Å; L183-F207 HydrophobicContact CD1-CB 4.25Å; L183-F207 HydrophobicContact CD1-CD1 4.43Å; L183-F207 HydrophobicContact CD2-CB 4.38Å; L183-L209 HydrophobicContact CB-CD1 4.46Å; L183-L209 HydrophobicContact CD2-CB 4.16Å; L183-L209 HydrophobicContact CD2-CD1 4.22Å; L183-F223 HydrophobicContact CB-CE1 3.96Å; L183-F223 HydrophobicContact CB-CZ 4.12Å
184	A	98	Very high	97.7	Very high	0 Å²	0	7.1 Å²	7.1	0%	0	4%	0.039	C	C	.	.	H	α-helix	trans	-68	-33.9	175.7	0	0	0	0	0	111.7	D181 G186 M220 C227 F283	D181-A184 CarbonylContact O-C 3.56Å; D181-A184 WeakPolarHBondContact O-CA 3.05Å; D181-A184 WeakPolarHBondContact O-CB 3.44Å; D181-A184 PolarHBondContact O-N 3.32Å; A184-G186 PolarHBondContact O-N 3.45Å; A184-M220 WeakPolarHBondContact O-CE 3.49Å; A184-C227 HydrophobicContact CB-CB 4.08Å; A184-F283 HydrophobicContact CB-CD1 3.56Å; A184-F283 HydrophobicContact CB-CE1 3.43Å; A184-F283 VanDerWaalsContact CB-CE1 3.43Å; A184-F283 HydrophobicContact CB-CE2 4.49Å; A184-F283 HydrophobicContact CB-CG 4.16Å; A184-F283 HydrophobicContact CB-CZ 3.92Å
185	F	98.1	Very high	97.6	Very high	2 Å²	2	7.4 Å²	7.4	1%	0.009	4%	0.041	C	C	.	.	T	Hydrogen-bonded Turn	trans	-69.8	-2.4	166	-70.6	-62.2	0	0	0	113.5	E160 A161 A164 K168 D181 L183 Y234 F283 P286	E160-F185 HydrophobicContact CG-CD2 3.84Å; E160-F185 HydrophobicContact CG-CE2 3.77Å; A161-F185 HydrophobicContact CB-CD1 3.66Å; A161-F185 HydrophobicContact CB-CD2 3.91Å; A161-F185 HydrophobicContact CB-CE1 3.7Å; A161-F185 HydrophobicContact CB-CE2 3.94Å; A161-F185 HydrophobicContact CB-CG 3.78Å; A161-F185 HydrophobicContact CB-CZ 3.83Å; A164-F185 HydrophobicContact CB-CB 3.77Å; K168-F185 WeakPolarHBondContact CE-O 3.44Å; K168-F185 PolarHBondContact NZ-O 3.1Å; D181-F185 HydrophobicContact CB-CD2 4.4Å; D181-F185 HydrophobicContact CB-CE2 4.21Å; D181-F185 VanDerWaalsContact O-CD2 3.24Å; D181-F185 WeakPolarHBondContact O-CD2 3.33Å; D181-F185 PolarHBondContact O-N 3.23Å; L183-F185 VanDerWaalsContact C-N 3.33Å; F185-Y234 WeakPolarHBondContact CE2-OH 3.49Å; F185-Y234 HydrophobicContact CZ-CE2 4.17Å; F185-Y234 AromaticContact CZ-CZ 3.97Å; F185-Y234 VanDerWaalsContact CZ-OH 3.24Å; F185-Y234 WeakPolarHBondContact CZ-OH 3.47Å; F185-F283 AromaticContact CD1-CD1 3.82Å; F185-F283 HydrophobicContact CD1-CD1 3.82Å; F185-F283 HydrophobicContact CD2-CD1 4.26Å; F185-F283 HydrophobicContact CD2-CE1 4.28Å; F185-F283 AromaticContact CE1-CD1 3.66Å; F185-F283 HydrophobicContact CE1-CD1 3.66Å; F185-F283 HydrophobicContact CE1-CE1 4.24Å; F185-F283 HydrophobicContact CE2-CD1 4.13Å; F185-F283 AromaticContact CE2-CE1 3.94Å; F185-F283 HydrophobicContact CE2-CE1 3.94Å; F185-F283 HydrophobicContact CG-CD1 4.11Å; F185-F283 AromaticContact CZ-CD1 3.83Å; F185-F283 HydrophobicContact CZ-CD1 3.83Å; F185-F283 AromaticContact CZ-CE1 3.92Å; F185-F283 HydrophobicContact CZ-CE1 3.92Å; F185-P286 HydrophobicContact CD1-CB 4.04Å; F185-P286 HydrophobicContact CD1-CG 3.97Å; F185-P286 HydrophobicContact CE1-CB 3.8Å; F185-P286 HydrophobicContact CE1-CG 4.25Å
186	G	97.8	Very high	97.4	Very high	5 Å²	5	8.8 Å²	8.8	5%	0.052	5%	0.046	C	C	.	.	T	Hydrogen-bonded Turn	trans	83.2	25.4	170.3	0	0	0	0	0	115.1	K168 A182 L183 A184	K168-G186 VanDerWaalsContact CE-CA 3.41Å; K168-G186 WeakPolarHBondContact CE-O 3.12Å; K168-G186 WeakPolarHBondContact CG-O 3.31Å; A182-G186 PolarHBondContact O-N 2.87Å; L183-G186 VanDerWaalsContact O-CA 3.28Å; L183-G186 WeakPolarHBondContact O-CA 3.49Å; L183-G186 PolarHBondContact O-N 2.87Å; A184-G186 PolarHBondContact O-N 3.45Å
187	T	98.3	Very high	97	Very high	0 Å²	0	10.3 Å²	10.3	0%	0	6%	0.057	C	C	.	.			trans	-57.5	129.9	173.4	-174.2	0	0	0	0	110.6	V175 A182 L183 V189 L190 L209	V175-T187 HydrophobicContact CB-CG2 4.49Å; V175-T187 HydrophobicContact CG2-CG2 4.49Å; V175-T187 WeakPolarHBondContact CG2-OG1 3.24Å; A182-T187 HydrophobicContact CB-CG2 4.07Å; A182-T187 VanDerWaalsContact O-CG2 3.22Å; A182-T187 WeakPolarHBondContact O-CG2 3.41Å; A182-T187 PolarHBondContact O-N 3.07Å; L183-T187 HydrophobicContact CD2-CG2 3.99Å; T187-V189 VanDerWaalsContact C-N 3.29Å; T187-V189 PolarHBondContact O-N 3.06Å; T187-V189 PolarHBondContact OG1-O 3.2Å; T187-L190 HydrophobicContact CG2-CB 3.92Å; T187-L209 VanDerWaalsContact O-CB 3.24Å; T187-L209 WeakPolarHBondContact O-CB 3.39Å; T187-L209 WeakPolarHBondContact O-CD2 3.36Å
188	P	98.2	Very high	96.5	Very high	46 Å²	46	16.3 Å²	16.3	30%	0.299	9%	0.085	S	C	.	.	S	Bend	trans	-62.2	-37.6	178.4	-23.7	33.8	0	0	0	112.9	K168 L209	K168-P188 HydrophobicContact CG-CG 4.33Å; P188-L209 PolarHBondContact O-N 2.84Å
189	V	98.5	Very high	96.2	Very high	9 Å²	9	19.8 Å²	19.8	6%	0.055	12%	0.115	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-135.9	128.5	-179.7	-177	0	0	0	0	109.7	Y173 A174 V175 T187 L191 E206 F207	Y173-V189 HydrophobicContact CE1-CG1 4.05Å; Y173-V189 HydrophobicContact CE2-CG2 4.5Å; A174-V189 WeakPolarHBondContact CA-O 3.08Å; A174-V189 HydrophobicContact CB-CB 3.69Å; A174-V189 HydrophobicContact CB-CG1 3.62Å; A174-V189 WeakPolarHBondContact CB-O 3.48Å; V175-V189 PolarHBondContact N-O 3.31Å; T187-V189 VanDerWaalsContact C-N 3.29Å; T187-V189 PolarHBondContact O-N 3.06Å; T187-V189 PolarHBondContact OG1-O 3.2Å; V189-L191 HydrophobicContact CG1-CD2 3.93Å; V189-L191 HydrophobicContact CG1-CG 4.47Å; V189-E206 HydrophobicContact CG1-CG 3.61Å; V189-F207 WeakPolarHBondContact CA-O 3.36Å
190	L	98.6	Very high	95.9	Very high	0 Å²	0	25.6 Å²	25.6	0%	0	14%	0.137	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-114.4	128.4	173.1	170.6	66.8	0	0	0	109.7	V175 T177 M180 A182 L183 T187 R192 E206 F207	V175-L190 HydrophobicContact CG1-CD1 4.41Å; V175-L190 CarbonylContact O-C 3.56Å; V175-L190 WeakPolarHBondContact O-CA 3.28Å; T177-L190 HydrophobicContact CG2-CD1 3.53Å; M180-L190 HydrophobicContact SD-CD2 4Å; A182-L190 HydrophobicContact CB-CD1 4.05Å; L183-L190 HydrophobicContact CD1-CD2 4.18Å; L183-L190 HydrophobicContact CD2-CB 4.03Å; L183-L190 HydrophobicContact CG-CB 4.31Å; L183-L190 HydrophobicContact CG-CD2 3.92Å; T187-L190 HydrophobicContact CG2-CB 3.92Å; L190-R192 HydrophobicContact CD2-CG 4.26Å; L190-R192 HydrophobicContact CG-CG 4.2Å; L190-E206 CarbonylContact O-C 3.6Å; L190-E206 WeakPolarHBondContact O-CA 3.22Å; L190-F207 HydrophobicContact CB-CB 4.21Å; L190-F207 PolarHBondContact N-O 3.05Å; L190-F207 PolarHBondContact O-N 2.9Å
191	L	98.5	Very high	95.4	Very high	0 Å²	0	34.5 Å²	34.5	0%	0	18%	0.175	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-110.9	107.3	178	-57	-175.8	0	0	0	110.2	Y26 V31 A174 V175 G176 T177 V189 I204 Q205 E206	Y26-L191 HydrophobicContact CD1-CD1 3.87Å; Y26-L191 HydrophobicContact CD1-CD2 4.48Å; Y26-L191 HydrophobicContact CE1-CD1 3.72Å; Y26-L191 HydrophobicContact CE1-CD2 3.53Å; Y26-L191 HydrophobicContact CE1-CG 4.3Å; Y26-L191 HydrophobicContact CG-CD1 4.48Å; Y26-L191 WeakPolarHBondContact OH-CD2 3.47Å; V31-L191 HydrophobicContact CG1-CD1 4.32Å; V31-L191 HydrophobicContact CG2-CD1 4.12Å; A174-L191 HydrophobicContact CB-CD1 3.84Å; A174-L191 HydrophobicContact CB-CD2 4.44Å; A174-L191 HydrophobicContact CB-CG 3.74Å; V175-L191 PolarHBondContact O-N 2.91Å; G176-L191 WeakPolarHBondContact CA-O 3.43Å; T177-L191 PolarHBondContact N-O 3.43Å; V189-L191 HydrophobicContact CG1-CD2 3.93Å; V189-L191 HydrophobicContact CG1-CG 4.47Å; L191-I204 HydrophobicContact CB-CG2 4.01Å; L191-I204 HydrophobicContact CD2-CG2 4.21Å; L191-Q205 WeakPolarHBondContact CA-O 3.39Å; L191-E206 HydrophobicContact CD2-CB 3.82Å; L191-E206 HydrophobicContact CD2-CG 3.72Å
192	R	97.6	Very high	95.3	Very high	39 Å²	39	38.6 Å²	38.6	15%	0.147	20%	0.195	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-92.9	154.7	171.7	-60.4	-171	58.9	-159.3	-7	110.9	S7 T177 E178 M180 L190 L194 I204 Q205 F207	S7-R192 PolarHBondContact OG-NH1 3.37Å; T177-R192 WeakPolarHBondContact O-CG 3.26Å; E178-R192 IonicContact OE2-CZ 2.77Å; E178-R192 VanDerWaalsContact OE2-CZ 3.28Å; E178-R192 IonicContact OE2-NE 3.81Å; E178-R192 PolarHBondContact OE2-NE 3.13Å; E178-R192 IonicContact OE2-NH2 3.69Å; E178-R192 PolarHBondContact OE2-NH2 2.73Å; M180-R192 VanDerWaalsContact SD-CD 3.58Å; L190-R192 HydrophobicContact CD2-CG 4.26Å; L190-R192 HydrophobicContact CG-CG 4.2Å; R192-L194 PolarHBondContact O-N 2.74Å; R192-I204 CarbonylContact O-C 3.46Å; R192-I204 WeakPolarHBondContact O-CA 3.47Å; R192-I204 WeakPolarHBondContact O-CG2 3.48Å; R192-Q205 HydrophobicContact CB-CB 4.22Å; R192-Q205 PolarHBondContact N-O 3.1Å; R192-Q205 PolarHBondContact O-N 3.47Å; R192-F207 HydrophobicContact CG-CD2 4.38Å; R192-F207 HydrophobicContact CG-CE2 4.1Å
193	H	96.5	Very high	95.1	Very high	14 Å²	14	40.3 Å²	40.3	7%	0.065	21%	0.21	C	C	.	.	S	Bend	trans	67.2	11.7	-176.4	-44	151.7	0	0	0	114.7	E178 T195 F196 A203 Q205	E178-H193 WeakPolarHBondContact OE1-CA 3.37Å; E178-H193 IonicContact OE1-CD2 3.76Å; E178-H193 PolarHBondContact OE1-N 3.02Å; E178-H193 IonicContact OE2-CD2 3.42Å; E178-H193 IonicContact OE2-NE2 2.69Å; H193-T195 PolarHBondContact O-N 3.27Å; H193-F196 HydrophobicContact CB-CB 4.47Å; H193-F196 HydrophobicContact CB-CD2 3.71Å; H193-F196 HydrophobicContact CB-CE2 4.07Å; H193-F196 HydrophobicContact CB-CG 4.07Å; H193-F196 AromaticContact CD2-CD2 3.82Å; H193-F196 AromaticContact CD2-CE2 3.21Å; H193-F196 WeakPolarHBondContact CD2-CE2 3.33Å; H193-F196 AromaticContact CD2-CZ 3.58Å; H193-F196 AromaticContact CG-CD2 3.88Å; H193-F196 AromaticContact CG-CE2 3.76Å; H193-F196 AromaticContact NE2-CE2 3.94Å; H193-F196 WeakPolarHBondContact O-CB 3.48Å; H193-F196 PolarHBondContact O-N 3.26Å; H193-A203 PolarHBondContact ND1-O 3.17Å; H193-Q205 VanDerWaalsContact CE1-CD 3.49Å
194	L	97	Very high	95.1	Very high	3 Å²	3	40.4 Å²	40.4	2%	0.016	21%	0.21	C	C	.	.	T	Hydrogen-bonded Turn	trans	-62.5	-42.2	-178.7	178.7	62.7	0	0	0	112.1	V31 I33 M74 I79 R192 F196 I204	V31-L194 HydrophobicContact CB-CD2 4.47Å; V31-L194 HydrophobicContact CG1-CD2 3.74Å; I33-L194 HydrophobicContact CD1-CD2 4.19Å; I33-L194 HydrophobicContact CG1-CD2 4.31Å; M74-L194 HydrophobicContact CG-CD1 4.19Å; M74-L194 HydrophobicContact SD-CD1 4Å; M74-L194 HydrophobicContact SD-CD2 3.93Å; M74-L194 HydrophobicContact SD-CG 3.75Å; I79-L194 HydrophobicContact CD1-CD1 3.84Å; R192-L194 PolarHBondContact O-N 2.74Å; L194-F196 VanDerWaalsContact C-N 3.35Å; L194-I204 HydrophobicContact CD1-CD1 3.63Å
195	T	95.5	Very high	95	Very high	6 Å²	6	43.4 Å²	43.4	4%	0.037	22%	0.224	C	C	.	.	T	Hydrogen-bonded Turn	trans	-90.1	1.7	-177.7	56	0	0	0	0	113.5	I33 Q41 R70 H193	I33-T195 HydrophobicContact CG2-CG2 3.85Å; Q41-T195 PolarHBondContact OE1-OG1 3.3Å; R70-T195 WeakPolarHBondContact CD-O 3.44Å; R70-T195 PolarHBondContact NE-O 3.24Å; H193-T195 PolarHBondContact O-N 3.27Å
196	F	94.2	Very high	95	Very high	28 Å²	28	44 Å²	44	12%	0.123	23%	0.227	C	C	.	.	S	Bend	trans	-67.7	158.1	177.6	-76.4	11.7	0	0	0	111.8	R70 R73 E178 H193 L194 M202	R70-F196 WeakPolarHBondContact CD-O 3.38Å; R70-F196 PolarHBondContact NE-O 3.14Å; R73-F196 PolarHBondContact NH1-O 2.87Å; E178-F196 HydrophobicContact CG-CE1 3.87Å; E178-F196 HydrophobicContact CG-CZ 4.18Å; H193-F196 HydrophobicContact CB-CB 4.47Å; H193-F196 HydrophobicContact CB-CD2 3.71Å; H193-F196 HydrophobicContact CB-CE2 4.07Å; H193-F196 HydrophobicContact CB-CG 4.07Å; H193-F196 AromaticContact CD2-CD2 3.82Å; H193-F196 AromaticContact CD2-CE2 3.21Å; H193-F196 WeakPolarHBondContact CD2-CE2 3.33Å; H193-F196 AromaticContact CD2-CZ 3.58Å; H193-F196 AromaticContact CG-CD2 3.88Å; H193-F196 AromaticContact CG-CE2 3.76Å; H193-F196 AromaticContact NE2-CE2 3.94Å; H193-F196 WeakPolarHBondContact O-CB 3.48Å; H193-F196 PolarHBondContact O-N 3.26Å; L194-F196 VanDerWaalsContact C-N 3.35Å; F196-M202 HydrophobicContact CD2-SD 3.84Å; F196-M202 HydrophobicContact CE2-CE 4.26Å; F196-M202 HydrophobicContact CE2-SD 3.97Å
197	S	90.7	Very high	95.1	Very high	34 Å²	34	43.8 Å²	43.8	24%	0.238	22%	0.224	C	C	.	.			trans	-62.6	136.7	173.6	-164.1	0	0	0	0	112.1	R70 A199 R200	R70-S197 PolarHBondContact NH1-OG 3.22Å; R70-S197 VanDerWaalsContact NH2-CA 3.35Å; R70-S197 PolarHBondContact NH2-OG 3.03Å; R70-S197 VanDerWaalsContact NH2-OG 3.13Å; S197-A199 PolarHBondContact O-N 3.25Å; S197-A199 PolarHBondContact OG-N 2.88Å; S197-R200 WeakPolarHBondContact O-CB 3.28Å; S197-R200 PolarHBondContact O-N 3.5Å
198	E	88.3	Confident	95	Very high	131 Å²	131	45.8 Å²	45.8	61%	0.612	24%	0.235	S	C	*	.	G	3₁₀ helix	trans	-55.9	-34	169.3	-174.3	170.6	-166.9	0	0	111.4	R200 K201	E198-R200 PolarHBondContact O-N 2.91Å; E198-R200 VanDerWaalsContact O-N 3.11Å; E198-K201 PolarHBondContact O-N 3.46Å
199	A	89.7	Confident	95	Very high	84 Å²	84	44.2 Å²	44.2	69%	0.694	22%	0.224	S	C	*	.	G	3₁₀ helix	trans	-58.9	-24.3	175.8	0	0	0	0	0	113.6	S197 K201	S197-A199 PolarHBondContact O-N 3.25Å; S197-A199 PolarHBondContact OG-N 2.88Å; A199-K201 PolarHBondContact O-N 3.15Å
200	R	88.4	Confident	95	Very high	131 Å²	131	47.4 Å²	47.4	49%	0.494	24%	0.244	S	C	.	.	G	3₁₀ helix	trans	-73.1	-15.1	175.5	-68.4	-170.9	175.8	-171.6	-1.6	113	S197 E198 M202	S197-R200 WeakPolarHBondContact O-CB 3.28Å; S197-R200 PolarHBondContact O-N 3.5Å; E198-R200 PolarHBondContact O-N 2.91Å; E198-R200 VanDerWaalsContact O-N 3.11Å; R200-M202 HydrophobicContact CB-CG 4.09Å; R200-M202 HydrophobicContact CB-SD 4.36Å; R200-M202 PolarHBondContact O-N 3.07Å
201	K	88.3	Confident	95	Very high	193 Å²	193	49.2 Å²	49.2	84%	0.839	26%	0.256	S	S	*	.			trans	49.9	29.9	-178.5	-59.4	-179.1	-180	178.6	0	113.5	E198 A199	E198-K201 PolarHBondContact O-N 3.46Å; A199-K201 PolarHBondContact O-N 3.15Å
202	M	92.1	Very high	95	Very high	85 Å²	85	49.2 Å²	49.2	42%	0.419	26%	0.256	S	S	.	.	P	Polyproline II helix	trans	-88.6	131.7	177.4	-67.9	-178.5	74.4	0	0	109.6	F196 R200	F196-M202 HydrophobicContact CD2-SD 3.84Å; F196-M202 HydrophobicContact CE2-CE 4.26Å; F196-M202 HydrophobicContact CE2-SD 3.97Å; R200-M202 HydrophobicContact CB-CG 4.09Å; R200-M202 HydrophobicContact CB-SD 4.36Å; R200-M202 PolarHBondContact O-N 3.07Å
203	A	95	Very high	95	Very high	37 Å²	37	48.9 Å²	48.9	31%	0.306	26%	0.257	S	S	.	.	P	Polyproline II helix	trans	-70.7	154.2	170.7	0	0	0	0	0	111	S20 H193 Q205	S20-A203 WeakPolarHBondContact OG-CB 3.21Å; H193-A203 PolarHBondContact ND1-O 3.17Å; A203-Q205 PolarHBondContact O-N 2.99Å
204	I	97.4	Very high	95.1	Very high	2 Å²	2	54.1 Å²	54.1	1%	0.01	28%	0.282	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-74	126.5	176.4	-63.2	174.6	0	0	0	107.6	S20 C21 I23 Y26 L191 R192 L194	S20-I204 WeakPolarHBondContact CA-O 3.45Å; C21-I204 PolarHBondContact N-O 3.23Å; C21-I204 PolarHBondContact O-N 3.14Å; I23-I204 HydrophobicContact CB-CD1 3.87Å; I23-I204 HydrophobicContact CG1-CD1 3.97Å; Y26-I204 HydrophobicContact CD2-CD1 3.88Å; Y26-I204 HydrophobicContact CE2-CB 3.97Å; Y26-I204 HydrophobicContact CE2-CD1 3.72Å; Y26-I204 HydrophobicContact CE2-CG1 4.44Å; Y26-I204 HydrophobicContact CE2-CG2 3.82Å; L191-I204 HydrophobicContact CB-CG2 4.01Å; L191-I204 HydrophobicContact CD2-CG2 4.21Å; R192-I204 CarbonylContact O-C 3.46Å; R192-I204 WeakPolarHBondContact O-CA 3.47Å; R192-I204 WeakPolarHBondContact O-CG2 3.48Å; L194-I204 HydrophobicContact CD1-CD1 3.63Å
205	Q	97	Very high	95.1	Very high	62 Å²	62	55.8 Å²	55.8	29%	0.29	30%	0.3	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-91	114.5	173.7	-71.8	-175.4	-7.6	0	0	109.4	K19 L191 R192 H193 A203 F207	K19-Q205 CarbonylContact O-C 3.56Å; K19-Q205 WeakPolarHBondContact O-CA 3.37Å; L191-Q205 WeakPolarHBondContact CA-O 3.39Å; R192-Q205 HydrophobicContact CB-CB 4.22Å; R192-Q205 PolarHBondContact N-O 3.1Å; R192-Q205 PolarHBondContact O-N 3.47Å; H193-Q205 VanDerWaalsContact CE1-CD 3.49Å; A203-Q205 PolarHBondContact O-N 2.99Å; Q205-F207 HydrophobicContact CB-CE2 3.94Å
206	E	98.1	Very high	95.2	Very high	14 Å²	14	55.8 Å²	55.8	7%	0.065	30%	0.3	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-93.7	128.2	174.1	-175.5	178.4	101.4	0	0	109.7	V18 K19 Y26 Y173 V189 L190 L191	V18-E206 CarbonylContact C-O 3.44Å; V18-E206 VanDerWaalsContact CA-O 3.3Å; V18-E206 WeakPolarHBondContact CA-O 3.29Å; K19-E206 HydrophobicContact CB-CB 4.31Å; K19-E206 PolarHBondContact N-O 3.19Å; K19-E206 PolarHBondContact O-N 2.94Å; Y26-E206 WeakPolarHBondContact CE1-OE2 3.44Å; Y173-E206 PolarHBondContact OH-OE2 3.2Å; V189-E206 HydrophobicContact CG1-CG 3.61Å; L190-E206 CarbonylContact O-C 3.6Å; L190-E206 WeakPolarHBondContact O-CA 3.22Å; L191-E206 HydrophobicContact CD2-CB 3.82Å; L191-E206 HydrophobicContact CD2-CG 3.72Å
207	F	98.4	Very high	95.3	Very high	1 Å²	1	57.1 Å²	57.1	0%	0.004	32%	0.322	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-111	125.2	169.5	-65.7	-105.2	0	0	0	108.4	I10 A17 V18 M180 L183 V189 L190 R192 Q205	I10-F207 HydrophobicContact CB-CE1 4.46Å; I10-F207 HydrophobicContact CD1-CD1 4.13Å; I10-F207 HydrophobicContact CD1-CE1 4.38Å; I10-F207 HydrophobicContact CG2-CD1 4.06Å; I10-F207 HydrophobicContact CG2-CE1 4.14Å; A17-F207 WeakPolarHBondContact O-CA 3.35Å; V18-F207 HydrophobicContact CG1-CE1 4.19Å; V18-F207 HydrophobicContact CG1-CE2 4.38Å; V18-F207 HydrophobicContact CG1-CZ 4.06Å; V18-F207 HydrophobicContact CG2-CD1 3.72Å; V18-F207 HydrophobicContact CG2-CE1 3.53Å; V18-F207 HydrophobicContact CG2-CZ 4.24Å; M180-F207 HydrophobicContact CE-CD1 4.3Å; M180-F207 HydrophobicContact CE-CE1 4.08Å; M180-F207 HydrophobicContact CE-CZ 4.41Å; L183-F207 HydrophobicContact CD1-CB 4.25Å; L183-F207 HydrophobicContact CD1-CD1 4.43Å; L183-F207 HydrophobicContact CD2-CB 4.38Å; V189-F207 WeakPolarHBondContact CA-O 3.36Å; L190-F207 HydrophobicContact CB-CB 4.21Å; L190-F207 PolarHBondContact N-O 3.05Å; L190-F207 PolarHBondContact O-N 2.9Å; R192-F207 HydrophobicContact CG-CD2 4.38Å; R192-F207 HydrophobicContact CG-CE2 4.1Å; Q205-F207 HydrophobicContact CB-CE2 3.94Å
208	N	98.2	Very high	95.7	Very high	43 Å²	43	56 Å²	56	23%	0.23	31%	0.313	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-101.5	116.1	173.5	-179.1	-79.7	0	0	0	110.1	A17 T210 S211 V212	A17-N208 PolarHBondContact O-N 3.33Å; N208-T210 VanDerWaalsContact C-N 3.33Å; N208-T210 PolarHBondContact O-N 3.34Å; N208-T210 WeakPolarHBondContact OD1-CB 3.45Å; N208-T210 PolarHBondContact OD1-N 3.42Å; N208-T210 VanDerWaalsContact OD1-N 3.17Å; N208-S211 PolarHBondContact O-N 3.35Å; N208-S211 PolarHBondContact OD1-N 3.15Å; N208-S211 PolarHBondContact OD1-OG 3.15Å; N208-V212 WeakPolarHBondContact O-CG2 3.41Å; N208-V212 PolarHBondContact O-N 3.36Å
209	L	98.2	Very high	96.1	Very high	13 Å²	13	53.4 Å²	53.4	7%	0.068	31%	0.306	C	S	.	.	H	α-helix	trans	-61	-39.4	-173.5	178.5	63.1	0	0	0	112.6	L183 T187 P188 S211 V212 L213 M220 F223	L183-L209 HydrophobicContact CB-CD1 4.46Å; L183-L209 HydrophobicContact CD2-CB 4.16Å; L183-L209 HydrophobicContact CD2-CD1 4.22Å; T187-L209 VanDerWaalsContact O-CB 3.24Å; T187-L209 WeakPolarHBondContact O-CB 3.39Å; T187-L209 WeakPolarHBondContact O-CD2 3.36Å; P188-L209 PolarHBondContact O-N 2.84Å; L209-S211 PolarHBondContact O-N 3.03Å; L209-V212 WeakPolarHBondContact O-CB 3.31Å; L209-V212 PolarHBondContact O-N 3.2Å; L209-V212 VanDerWaalsContact O-N 3.11Å; L209-L213 HydrophobicContact CD1-CD1 4.45Å; L209-L213 HydrophobicContact CD1-CD2 4.38Å; L209-L213 HydrophobicContact CD1-CG 4.12Å; L209-L213 HydrophobicContact CG-CD1 4.25Å; L209-L213 HydrophobicContact CG-CG 4.33Å; L209-L213 WeakPolarHBondContact O-CG 3.4Å; L209-L213 PolarHBondContact O-N 3.4Å; L209-M220 HydrophobicContact CD1-SD 4.42Å; L209-M220 HydrophobicContact CD2-SD 4.03Å; L209-F223 HydrophobicContact CD1-CD1 4.26Å; L209-F223 HydrophobicContact CD1-CE1 4Å; L209-F223 HydrophobicContact CD1-CZ 4.49Å
210	T	97.6	Very high	96.5	Very high	76 Å²	76	51.8 Å²	51.8	47%	0.466	29%	0.285	S	S	.	.	H	α-helix	trans	-60.3	-48.1	177.8	-52.9	0	0	0	0	111	N208 V212 L213 E214	N208-T210 VanDerWaalsContact C-N 3.33Å; N208-T210 PolarHBondContact O-N 3.34Å; N208-T210 WeakPolarHBondContact OD1-CB 3.45Å; N208-T210 PolarHBondContact OD1-N 3.42Å; N208-T210 VanDerWaalsContact OD1-N 3.17Å; T210-V212 VanDerWaalsContact C-N 3.29Å; T210-V212 PolarHBondContact O-N 2.77Å; T210-L213 PolarHBondContact O-N 3.44Å; T210-E214 WeakPolarHBondContact O-CB 3.27Å; T210-E214 WeakPolarHBondContact O-CG 3.35Å; T210-E214 PolarHBondContact O-N 2.92Å
211	S	97.9	Very high	96.9	Very high	37 Å²	37	49.4 Å²	49.4	26%	0.259	28%	0.282	S	S	.	.	H	α-helix	trans	-65.9	-29.7	174.9	-59.1	0	0	0	0	113.2	A17 N208 L209 G215	A17-S211 VanDerWaalsContact CB-C 3.46Å; N208-S211 PolarHBondContact O-N 3.35Å; N208-S211 PolarHBondContact OD1-N 3.15Å; N208-S211 PolarHBondContact OD1-OG 3.15Å; L209-S211 PolarHBondContact O-N 3.03Å; S211-G215 PolarHBondContact O-N 2.94Å
212	V	98.3	Very high	97.4	Very high	0 Å²	0	41.1 Å²	41.1	0%	0	25%	0.246	C	C	.	.	H	α-helix	trans	-64	-51.7	172.6	168.9	0	0	0	0	109.9	I10 A17 N208 L209 T210 E214 G215 L216 F223	I10-V212 HydrophobicContact CD1-CG1 3.95Å; I10-V212 HydrophobicContact CD1-CG2 3.99Å; I10-V212 HydrophobicContact CG1-CG1 3.97Å; I10-V212 HydrophobicContact CG1-CG2 4.36Å; I10-V212 HydrophobicContact CG2-CG2 3.88Å; A17-V212 HydrophobicContact CB-CB 4.27Å; A17-V212 HydrophobicContact CB-CG2 3.58Å; N208-V212 WeakPolarHBondContact O-CG2 3.41Å; N208-V212 PolarHBondContact O-N 3.36Å; L209-V212 WeakPolarHBondContact O-CB 3.31Å; L209-V212 PolarHBondContact O-N 3.2Å; L209-V212 VanDerWaalsContact O-N 3.11Å; T210-V212 VanDerWaalsContact C-N 3.29Å; T210-V212 PolarHBondContact O-N 2.77Å; V212-E214 PolarHBondContact O-N 3.4Å; V212-G215 PolarHBondContact O-N 3.2Å; V212-L216 HydrophobicContact CG1-CD1 3.75Å; V212-L216 HydrophobicContact CG1-CG 4.4Å; V212-L216 WeakPolarHBondContact O-CB 3.45Å; V212-L216 VanDerWaalsContact O-CG 3.29Å; V212-L216 WeakPolarHBondContact O-CG 3.3Å; V212-L216 PolarHBondContact O-N 2.91Å; V212-F223 HydrophobicContact CG1-CD2 4.28Å; V212-F223 HydrophobicContact CG1-CE2 3.61Å; V212-F223 HydrophobicContact CG1-CZ 4.02Å
213	L	98.3	Very high	97.7	Very high	32 Å²	32	37.1 Å²	37.1	17%	0.168	23%	0.226	C	C	.	.	H	α-helix	trans	-60.7	-45.9	-179.8	-67.1	179.5	0	0	0	111.4	L209 T210 L216 G217 L218 M220 F223	L209-L213 HydrophobicContact CD1-CD1 4.45Å; L209-L213 HydrophobicContact CD1-CD2 4.38Å; L209-L213 HydrophobicContact CD1-CG 4.12Å; L209-L213 HydrophobicContact CG-CD1 4.25Å; L209-L213 HydrophobicContact CG-CG 4.33Å; L209-L213 WeakPolarHBondContact O-CG 3.4Å; L209-L213 PolarHBondContact O-N 3.4Å; T210-L213 PolarHBondContact O-N 3.44Å; L213-L216 PolarHBondContact O-N 3.08Å; L213-G217 PolarHBondContact O-N 3.35Å; L213-L218 WeakPolarHBondContact CB-O 3.45Å; L213-L218 PolarHBondContact O-N 2.85Å; L213-M220 HydrophobicContact CD1-CB 4.39Å; L213-M220 HydrophobicContact CD1-SD 4.32Å; L213-F223 HydrophobicContact CD2-CB 3.38Å; L213-F223 HydrophobicContact CD2-CD1 4.21Å; L213-F223 HydrophobicContact CD2-CD2 4.09Å; L213-F223 HydrophobicContact CD2-CG 3.64Å
214	E	97.6	Very high	97.8	Very high	124 Å²	124	35.4 Å²	35.4	58%	0.579	21%	0.212	S	C	*	.	H	α-helix	trans	-61.4	-47.7	175.8	-73.4	174.1	-179.5	0	0	112.2	T210 V212 L216 G217	T210-E214 WeakPolarHBondContact O-CB 3.27Å; T210-E214 WeakPolarHBondContact O-CG 3.35Å; T210-E214 PolarHBondContact O-N 2.92Å; V212-E214 PolarHBondContact O-N 3.4Å; E214-L216 VanDerWaalsContact C-N 3.32Å; E214-L216 PolarHBondContact O-N 3.42Å; E214-G217 PolarHBondContact O-N 3.02Å; E214-G217 VanDerWaalsContact O-N 3.15Å
215	G	97.3	Very high	97.9	Very high	39 Å²	39	35.4 Å²	35.4	40%	0.402	21%	0.212	S	C	.	.	H	α-helix	trans	-67.5	-31.8	-178.8	0	0	0	0	0	113.3	S211 V212	S211-G215 PolarHBondContact O-N 2.94Å; V212-G215 PolarHBondContact O-N 3.2Å
216	L	97.6	Very high	97.9	Very high	5 Å²	5	32.4 Å²	32.4	3%	0.026	20%	0.198	C	C	.	.	H	α-helix	trans	-83.5	-13.9	173.8	-65.9	178.7	0	0	0	113	V9 N13 A14 V212 L213 E214 L218 F223 L226 L247 H251	V9-L216 HydrophobicContact CG1-CD2 4.19Å; N13-L216 HydrophobicContact CB-CD2 3.62Å; A14-L216 HydrophobicContact CB-CD2 4.44Å; A14-L216 HydrophobicContact CB-CG 4.31Å; V212-L216 HydrophobicContact CG1-CD1 3.75Å; V212-L216 HydrophobicContact CG1-CG 4.4Å; V212-L216 WeakPolarHBondContact O-CB 3.45Å; V212-L216 VanDerWaalsContact O-CG 3.29Å; V212-L216 WeakPolarHBondContact O-CG 3.3Å; V212-L216 PolarHBondContact O-N 2.91Å; L213-L216 PolarHBondContact O-N 3.08Å; E214-L216 VanDerWaalsContact C-N 3.32Å; E214-L216 PolarHBondContact O-N 3.42Å; L216-L218 VanDerWaalsContact C-N 3.32Å; L216-L218 HydrophobicContact CB-CB 4.43Å; L216-L218 HydrophobicContact CB-CD1 4.05Å; L216-L218 HydrophobicContact CB-CG 3.98Å; L216-L218 HydrophobicContact CD1-CD1 4.39Å; L216-F223 HydrophobicContact CD1-CD2 3.89Å; L216-F223 HydrophobicContact CD1-CE2 3.82Å; L216-L226 HydrophobicContact CD1-CD2 4.06Å; L216-L247 HydrophobicContact CD2-CD1 4.45Å; L216-L247 HydrophobicContact CD2-CD2 4.35Å; L216-H251 PolarHBondContact O-CE1 3.03Å; L216-H251 PolarHBondContact O-NE2 3.18Å
217	G	97.4	Very high	97.9	Very high	57 Å²	57	31.8 Å²	31.8	59%	0.588	20%	0.195	S	C	*	.	T	Hydrogen-bonded Turn	trans	62.4	37.7	-173.8	0	0	0	0	0	112.8	L213 E214	L213-G217 PolarHBondContact O-N 3.35Å; E214-G217 PolarHBondContact O-N 3.02Å; E214-G217 VanDerWaalsContact O-N 3.15Å
218	L	98	Very high	97.9	Very high	11 Å²	11	31.7 Å²	31.7	6%	0.058	20%	0.195	C	C	.	.			trans	-121.5	145.7	-177.2	-61.1	179.6	0	0	0	111.1	L213 L216 Q222 L226 L247	L213-L218 WeakPolarHBondContact CB-O 3.45Å; L213-L218 PolarHBondContact O-N 2.85Å; L216-L218 VanDerWaalsContact C-N 3.32Å; L216-L218 HydrophobicContact CB-CB 4.43Å; L216-L218 HydrophobicContact CB-CD1 4.05Å; L216-L218 HydrophobicContact CB-CG 3.98Å; L216-L218 HydrophobicContact CD1-CD1 4.39Å; L218-Q222 HydrophobicContact CB-CB 4.03Å; L218-Q222 HydrophobicContact CD2-CB 4.08Å; L218-Q222 HydrophobicContact CG-CB 4.49Å; L218-L226 HydrophobicContact CD1-CB 4.22Å; L218-L226 HydrophobicContact CD1-CD2 3.76Å; L218-L247 HydrophobicContact CD1-CD1 3.94Å; L218-L247 HydrophobicContact CG-CD1 4.47Å
219	T	97.8	Very high	97.8	Very high	76 Å²	76	29.7 Å²	29.7	47%	0.466	18%	0.184	S	C	.	.			trans	-73.1	167.4	162.9	61.4	0	0	0	0	110.9	D221 Q222 F223	T219-D221 VanDerWaalsContact C-N 3.32Å; T219-D221 PolarHBondContact O-N 3.12Å; T219-Q222 PolarHBondContact O-N 3.23Å; T219-Q222 WeakPolarHBondContact OG1-CB 3.5Å; T219-Q222 VanDerWaalsContact OG1-CD 3.29Å; T219-Q222 VanDerWaalsContact OG1-CG 3.24Å; T219-Q222 WeakPolarHBondContact OG1-CG 3.38Å; T219-Q222 PolarHBondContact OG1-N 3.13Å; T219-Q222 PolarHBondContact OG1-OE1 3.39Å; T219-F223 WeakPolarHBondContact O-CB 3.1Å; T219-F223 PolarHBondContact O-N 2.94Å
220	M	97.5	Very high	97.8	Very high	49 Å²	49	29.6 Å²	29.6	24%	0.241	18%	0.184	C	C	.	.	H	α-helix	trans	-59.7	-42.1	176.7	-173.4	63.8	-163	0	0	112.1	A184 L209 L213 Q222 F223 I224	A184-M220 WeakPolarHBondContact O-CE 3.49Å; L209-M220 HydrophobicContact CD1-SD 4.42Å; L209-M220 HydrophobicContact CD2-SD 4.03Å; L213-M220 HydrophobicContact CD1-CB 4.39Å; L213-M220 HydrophobicContact CD1-SD 4.32Å; M220-Q222 VanDerWaalsContact C-N 3.32Å; M220-Q222 PolarHBondContact O-N 3.25Å; M220-F223 HydrophobicContact CE-CD1 4.42Å; M220-F223 WeakPolarHBondContact O-CB 3.38Å; M220-F223 PolarHBondContact O-N 2.87Å; M220-F223 HydrophobicContact SD-CD1 4.35Å; M220-I224 HydrophobicContact CE-CD1 4Å; M220-I224 HydrophobicContact CE-CG1 3.94Å; M220-I224 HydrophobicContact CG-CD1 4.44Å; M220-I224 WeakPolarHBondContact O-CG1 3.16Å; M220-I224 PolarHBondContact O-N 2.75Å
221	D	97.5	Very high	97.6	Very high	81 Å²	81	26.4 Å²	26.4	43%	0.433	17%	0.166	S	C	.	.	H	α-helix	trans	-62.6	-40.1	178	-67.3	-47.1	0	0	0	112	T219 F223 I224 D225	T219-D221 VanDerWaalsContact C-N 3.32Å; T219-D221 PolarHBondContact O-N 3.12Å; D221-F223 VanDerWaalsContact C-N 3.34Å; D221-I224 PolarHBondContact O-N 3.08Å; D221-D225 PolarHBondContact O-N 3.07Å
222	Q	98.1	Very high	97.5	Very high	20 Å²	20	25.3 Å²	25.3	9%	0.093	16%	0.158	C	C	.	.	H	α-helix	trans	-70.5	-32.4	175.8	-73.2	170.7	-30.1	0	0	112.7	L218 T219 M220 D225 L226 Q254	L218-Q222 HydrophobicContact CB-CB 4.03Å; L218-Q222 HydrophobicContact CD2-CB 4.08Å; L218-Q222 HydrophobicContact CG-CB 4.49Å; T219-Q222 PolarHBondContact O-N 3.23Å; T219-Q222 WeakPolarHBondContact OG1-CB 3.5Å; T219-Q222 VanDerWaalsContact OG1-CD 3.29Å; T219-Q222 VanDerWaalsContact OG1-CG 3.24Å; T219-Q222 WeakPolarHBondContact OG1-CG 3.38Å; T219-Q222 PolarHBondContact OG1-N 3.13Å; T219-Q222 PolarHBondContact OG1-OE1 3.39Å; M220-Q222 VanDerWaalsContact C-N 3.32Å; M220-Q222 PolarHBondContact O-N 3.25Å; Q222-D225 WeakPolarHBondContact O-CB 3.47Å; Q222-D225 PolarHBondContact O-N 3.38Å; Q222-L226 PolarHBondContact O-N 3.24Å; Q222-Q254 VanDerWaalsContact CG-O 3.27Å; Q222-Q254 WeakPolarHBondContact CG-O 3.44Å; Q222-Q254 PolarHBondContact NE2-O 3.47Å; Q222-Q254 VanDerWaalsContact NE2-O 3.14Å
223	F	98.3	Very high	97.3	Very high	0 Å²	0	26 Å²	26	0%	0	16%	0.161	C	C	.	.	H	α-helix	trans	-69.1	-38.2	175.5	-179.2	-104.2	0	0	0	111.5	L6 L183 L209 V212 L213 L216 T219 M220 D221 L226 C227	L6-F223 HydrophobicContact CD1-CE2 3.99Å; L6-F223 HydrophobicContact CD1-CZ 4.13Å; L6-F223 HydrophobicContact CD2-CZ 4Å; L183-F223 HydrophobicContact CB-CE1 3.96Å; L183-F223 HydrophobicContact CB-CZ 4.12Å; L209-F223 HydrophobicContact CD1-CD1 4.26Å; L209-F223 HydrophobicContact CD1-CE1 4Å; L209-F223 HydrophobicContact CD1-CZ 4.49Å; V212-F223 HydrophobicContact CG1-CD2 4.28Å; V212-F223 HydrophobicContact CG1-CE2 3.61Å; V212-F223 HydrophobicContact CG1-CZ 4.02Å; L213-F223 HydrophobicContact CD2-CB 3.38Å; L213-F223 HydrophobicContact CD2-CD1 4.21Å; L213-F223 HydrophobicContact CD2-CD2 4.09Å; L213-F223 HydrophobicContact CD2-CG 3.64Å; L216-F223 HydrophobicContact CD1-CD2 3.89Å; L216-F223 HydrophobicContact CD1-CE2 3.82Å; T219-F223 WeakPolarHBondContact O-CB 3.1Å; T219-F223 PolarHBondContact O-N 2.94Å; M220-F223 HydrophobicContact CE-CD1 4.42Å; M220-F223 WeakPolarHBondContact O-CB 3.38Å; M220-F223 PolarHBondContact O-N 2.87Å; M220-F223 HydrophobicContact SD-CD1 4.35Å; D221-F223 VanDerWaalsContact C-N 3.34Å; F223-L226 HydrophobicContact CD2-CD2 4.41Å; F223-L226 WeakPolarHBondContact O-CB 3.24Å; F223-L226 PolarHBondContact O-N 3.24Å; F223-C227 PolarHBondContact O-N 3.04Å; F223-C227 PolarHBondContact O-SG 3.4Å
224	I	98.2	Very high	97.1	Very high	1 Å²	1	24.8 Å²	24.8	1%	0.005	16%	0.155	C	C	.	.	H	α-helix	trans	-62.6	-45.1	171	-67.1	168.4	0	0	0	110.2	M220 D221 L226 C227 I228 K280 F283 L284	M220-I224 HydrophobicContact CE-CD1 4Å; M220-I224 HydrophobicContact CE-CG1 3.94Å; M220-I224 HydrophobicContact CG-CD1 4.44Å; M220-I224 WeakPolarHBondContact O-CG1 3.16Å; M220-I224 PolarHBondContact O-N 2.75Å; D221-I224 PolarHBondContact O-N 3.08Å; I224-L226 VanDerWaalsContact C-N 3.26Å; I224-L226 PolarHBondContact O-N 3.05Å; I224-C227 WeakPolarHBondContact O-CB 3.35Å; I224-C227 PolarHBondContact O-N 3.16Å; I224-I228 HydrophobicContact CG2-CD1 3.99Å; I224-I228 WeakPolarHBondContact O-CG1 3.41Å; I224-I228 PolarHBondContact O-N 2.79Å; I224-K280 HydrophobicContact CG2-CB 4.36Å; I224-K280 HydrophobicContact CG2-CG 3.96Å; I224-F283 HydrophobicContact CD1-CB 4.07Å; I224-F283 HydrophobicContact CG1-CB 4.25Å; I224-F283 HydrophobicContact CG2-CB 3.83Å; I224-F283 HydrophobicContact CG2-CD2 3.82Å; I224-F283 HydrophobicContact CG2-CG 4.15Å; I224-L284 HydrophobicContact CD1-CD2 3.47Å; I224-L284 VanDerWaalsContact CD1-CD2 3.47Å; I224-L284 HydrophobicContact CD1-CG 3.83Å
225	D	98	Very high	97	Very high	2 Å²	2	19.6 Å²	19.6	1%	0.011	13%	0.132	C	C	.	.	H	α-helix	trans	-57.4	-40.1	174.1	-78.1	0.3	0	0	0	111.8	D221 Q222 I228 L229 L250 S255 I256 K280	D221-D225 PolarHBondContact O-N 3.07Å; Q222-D225 WeakPolarHBondContact O-CB 3.47Å; Q222-D225 PolarHBondContact O-N 3.38Å; D225-I228 PolarHBondContact O-N 3.24Å; D225-L229 WeakPolarHBondContact O-CG 3.38Å; D225-L229 PolarHBondContact O-N 3.42Å; D225-L250 HydrophobicContact CB-CD1 4.22Å; D225-L250 HydrophobicContact CB-CD2 3.88Å; D225-S255 WeakPolarHBondContact OD2-CA 3.5Å; D225-I256 HydrophobicContact CB-CD1 3.93Å; D225-I256 HydrophobicContact CB-CG1 3.77Å; D225-I256 PolarHBondContact OD2-N 3.37Å; D225-K280 VanDerWaalsContact CG-NZ 3.25Å; D225-K280 WeakPolarHBondContact OD1-CD 3.45Å; D225-K280 VanDerWaalsContact OD1-CE 3.26Å; D225-K280 WeakPolarHBondContact OD1-CE 3.42Å; D225-K280 IonicContact OD1-NZ 3.77Å; D225-K280 PolarHBondContact OD1-NZ 3.27Å; D225-K280 IonicContact OD2-NZ 2.7Å; D225-K280 PolarHBondContact OD2-NZ 3.23Å; D225-K280 VanDerWaalsContact OD2-NZ 3.1Å
226	L	98.1	Very high	96.7	Very high	0 Å²	0	21.8 Å²	21.8	0%	0	13%	0.134	C	C	.	.	H	α-helix	trans	-62.2	-46.3	174.3	177.9	65.4	0	0	0	110.8	V9 L216 L218 Q222 F223 I224 I228 L229 L230 A246 L247 L250	V9-L226 HydrophobicContact CG1-CD2 4.46Å; L216-L226 HydrophobicContact CD1-CD2 4.06Å; L218-L226 HydrophobicContact CD1-CB 4.22Å; L218-L226 HydrophobicContact CD1-CD2 3.76Å; Q222-L226 PolarHBondContact O-N 3.24Å; F223-L226 HydrophobicContact CD2-CD2 4.41Å; F223-L226 WeakPolarHBondContact O-CB 3.24Å; F223-L226 PolarHBondContact O-N 3.24Å; I224-L226 VanDerWaalsContact C-N 3.26Å; I224-L226 PolarHBondContact O-N 3.05Å; L226-I228 VanDerWaalsContact C-N 3.3Å; L226-I228 PolarHBondContact O-N 3.17Å; L226-L229 PolarHBondContact O-N 3.16Å; L226-L230 HydrophobicContact CD1-CD1 4.21Å; L226-L230 HydrophobicContact CD1-CD2 4.45Å; L226-L230 HydrophobicContact CD1-CG 4.07Å; L226-L230 HydrophobicContact CG-CD1 3.97Å; L226-L230 HydrophobicContact CG-CG 4.24Å; L226-L230 WeakPolarHBondContact O-CB 3.37Å; L226-L230 VanDerWaalsContact O-CG 3.23Å; L226-L230 WeakPolarHBondContact O-CG 3.24Å; L226-L230 PolarHBondContact O-N 2.96Å; L226-A246 HydrophobicContact CD1-CB 3.93Å; L226-L247 HydrophobicContact CD1-CB 4.43Å; L226-L247 HydrophobicContact CD2-CD1 4.2Å; L226-L250 HydrophobicContact CB-CD1 3.49Å; L226-L250 VanDerWaalsContact CB-CD1 3.49Å; L226-L250 HydrophobicContact CD1-CD1 4.04Å; L226-L250 HydrophobicContact CG-CD1 4.37Å; L226-L250 VanDerWaalsContact N-CD1 3.31Å
227	C	97.9	Very high	96.5	Very high	0 Å²	0	24.7 Å²	24.7	0%	0	15%	0.152	C	C	.	.	H	α-helix	trans	-59.9	-41.7	179.5	-65.8	0	0	0	0	111.9	V3 A184 F223 I224 L230 G231	V3-C227 HydrophobicContact CG1-CB 4.08Å; V3-C227 HydrophobicContact CG2-CB 3.7Å; A184-C227 HydrophobicContact CB-CB 4.08Å; F223-C227 PolarHBondContact O-N 3.04Å; F223-C227 PolarHBondContact O-SG 3.4Å; I224-C227 WeakPolarHBondContact O-CB 3.35Å; I224-C227 PolarHBondContact O-N 3.16Å; C227-L230 PolarHBondContact O-N 2.88Å; C227-G231 PolarHBondContact O-N 2.86Å; C227-G231 VanDerWaalsContact O-N 3.13Å
228	I	97.4	Very high	96.3	Very high	0 Å²	0	22 Å²	22	0%	0	12%	0.124	C	C	.	.	H	α-helix	trans	-64.6	-46.4	175.5	-67.2	165.2	0	0	0	111.1	I224 D225 L226 L230 G231 V235 I256 W274 A279 K280 F283	I224-I228 HydrophobicContact CG2-CD1 3.99Å; I224-I228 WeakPolarHBondContact O-CG1 3.41Å; I224-I228 PolarHBondContact O-N 2.79Å; D225-I228 PolarHBondContact O-N 3.24Å; L226-I228 VanDerWaalsContact C-N 3.3Å; L226-I228 PolarHBondContact O-N 3.17Å; I228-L230 VanDerWaalsContact C-N 3.32Å; I228-L230 PolarHBondContact O-N 2.75Å; I228-G231 PolarHBondContact O-N 3.26Å; I228-G231 VanDerWaalsContact O-N 3.15Å; I228-V235 HydrophobicContact CG2-CG2 3.75Å; I228-I256 HydrophobicContact CB-CD1 3.98Å; I228-I256 HydrophobicContact CD1-CD1 4.34Å; I228-I256 HydrophobicContact CG2-CD1 3.83Å; I228-W274 HydrophobicContact CG2-CH2 4.22Å; I228-W274 HydrophobicContact CG2-CZ2 3.82Å; I228-A279 HydrophobicContact CD1-CB 4.13Å; I228-A279 HydrophobicContact CG1-CB 4.34Å; I228-K280 HydrophobicContact CD1-CB 3.87Å; I228-F283 HydrophobicContact CG1-CD2 4.44Å; I228-F283 HydrophobicContact CG1-CE2 4.21Å
229	L	97.2	Very high	96.1	Very high	1 Å²	1	30.7 Å²	30.7	1%	0.005	16%	0.156	C	C	.	.	H	α-helix	trans	-64.6	-34	178.9	-74	174	0	0	0	113.3	D225 L226 G231 I238 A246 L250 I256 W274	D225-L229 WeakPolarHBondContact O-CG 3.38Å; D225-L229 PolarHBondContact O-N 3.42Å; L226-L229 PolarHBondContact O-N 3.16Å; L229-G231 VanDerWaalsContact C-N 3.3Å; L229-I238 HydrophobicContact CD2-CD1 4Å; L229-A246 HydrophobicContact CB-CB 3.96Å; L229-A246 HydrophobicContact CD1-CB 4.45Å; L229-L250 HydrophobicContact CD1-CD1 3.86Å; L229-L250 HydrophobicContact CD1-CD2 3.99Å; L229-L250 HydrophobicContact CD1-CG 3.75Å; L229-I256 HydrophobicContact CD1-CG1 4.27Å; L229-I256 HydrophobicContact CD2-CG1 4.35Å; L229-I256 HydrophobicContact CG-CD1 4.29Å; L229-I256 HydrophobicContact CG-CG1 4.07Å; L229-W274 HydrophobicContact CD2-CH2 3.92Å
230	L	96.8	Very high	95.8	Very high	11 Å²	11	30 Å²	30	6%	0.058	16%	0.164	C	C	.	.	H	α-helix	trans	-69.3	-31.3	175	-71.9	179	0	0	0	112.2	V3 H4 L6 V9 L226 C227 I228 P243 A246	V3-L230 HydrophobicContact CG1-CB 3.66Å; V3-L230 HydrophobicContact CG1-CD1 3.89Å; V3-L230 HydrophobicContact CG1-CG 4.41Å; H4-L230 WeakPolarHBondContact CB-O 3.4Å; L6-L230 HydrophobicContact CB-CD1 4.25Å; L6-L230 HydrophobicContact CD1-CD1 3.95Å; V9-L230 HydrophobicContact CG2-CD1 4.16Å; V9-L230 HydrophobicContact CG2-CD2 4.22Å; L226-L230 HydrophobicContact CD1-CD1 4.21Å; L226-L230 HydrophobicContact CD1-CD2 4.45Å; L226-L230 HydrophobicContact CD1-CG 4.07Å; L226-L230 HydrophobicContact CG-CD1 3.97Å; L226-L230 HydrophobicContact CG-CG 4.24Å; L226-L230 WeakPolarHBondContact O-CB 3.37Å; L226-L230 VanDerWaalsContact O-CG 3.23Å; L226-L230 WeakPolarHBondContact O-CG 3.24Å; L226-L230 PolarHBondContact O-N 2.96Å; C227-L230 PolarHBondContact O-N 2.88Å; I228-L230 VanDerWaalsContact C-N 3.32Å; I228-L230 PolarHBondContact O-N 2.75Å; L230-P243 VanDerWaalsContact CD2-CA 3.42Å; L230-P243 HydrophobicContact CD2-CB 3.6Å; L230-P243 HydrophobicContact CD2-CG 3.95Å; L230-A246 HydrophobicContact CD2-CB 4.28Å
231	G	94.9	Very high	95.7	Very high	9 Å²	9	28.2 Å²	28.2	9%	0.093	16%	0.156	C	C	.	.			trans	110.8	107	-177.5	0	0	0	0	0	111.3	V3 H4 C227 I228 L229	V3-G231 WeakPolarHBondContact CA-O 3.39Å; H4-G231 PolarHBondContact N-O 3.14Å; C227-G231 PolarHBondContact O-N 2.86Å; C227-G231 VanDerWaalsContact O-N 3.13Å; I228-G231 PolarHBondContact O-N 3.26Å; I228-G231 VanDerWaalsContact O-N 3.15Å; L229-G231 VanDerWaalsContact C-N 3.3Å
232	C	94.8	Very high	95.5	Very high	13 Å²	13	25.9 Å²	25.9	9%	0.088	15%	0.151	C	C	.	.			trans	-103.9	178.1	170.4	64.8	0	0	0	0	110.8	Y234 F283	C232-Y234 HydrophobicContact CB-CD2 4.29Å; C232-Y234 PolarHBondContact O-N 2.95Å; C232-F283 HydrophobicContact CB-CE2 4.08Å; C232-F283 HydrophobicContact CB-CZ 3.88Å
233	D	94.3	Very high	95.4	Very high	14 Å²	14	26.3 Å²	26.3	8%	0.075	16%	0.155	C	C	.	.	S	Bend	trans	-74.1	-9.5	-178.6	-83.6	1.7	0	0	0	114.1	K93 E96 R100	K93-D233 HydrophobicContact CG-CB 4.44Å; E96-D233 HydrophobicContact CB-CB 4.45Å; E96-D233 VanDerWaalsContact CB-O 3.3Å; E96-D233 WeakPolarHBondContact CB-O 3.13Å; E96-D233 HydrophobicContact CG-CB 4.23Å; R100-D233 IonicContact CZ-OD2 3.68Å; R100-D233 IonicContact NH2-OD1 3.1Å; R100-D233 PolarHBondContact NH2-OD1 2.89Å; R100-D233 IonicContact NH2-OD2 3.74Å; R100-D233 PolarHBondContact NH2-OD2 2.68Å
234	Y	95.2	Very high	95.2	Very high	8 Å²	8	34.3 Å²	34.3	3%	0.031	19%	0.19	C	C	.	.	S	Bend	trans	-102.2	-22.3	-167.5	-49.3	-64.3	0	0	0	114.6	P90 M92 K93 F185 C232 L282 F283	P90-Y234 HydrophobicContact CG-CD1 4.1Å; P90-Y234 HydrophobicContact CG-CE1 3.83Å; M92-Y234 VanDerWaalsContact O-O 3.14Å; K93-Y234 HydrophobicContact CB-CD1 4.19Å; K93-Y234 HydrophobicContact CB-CE1 4.39Å; K93-Y234 HydrophobicContact CD-CE1 4.12Å; F185-Y234 WeakPolarHBondContact CE2-OH 3.49Å; F185-Y234 HydrophobicContact CZ-CE2 4.17Å; F185-Y234 AromaticContact CZ-CZ 3.97Å; F185-Y234 VanDerWaalsContact CZ-OH 3.24Å; F185-Y234 WeakPolarHBondContact CZ-OH 3.47Å; C232-Y234 HydrophobicContact CB-CD2 4.29Å; C232-Y234 PolarHBondContact O-N 2.95Å; Y234-L282 HydrophobicContact CD1-CD2 3.36Å; Y234-L282 HydrophobicContact CD2-CD2 3.83Å; Y234-L282 HydrophobicContact CE1-CD2 3.53Å; Y234-L282 HydrophobicContact CE2-CD2 3.98Å; Y234-L282 HydrophobicContact CG-CD2 3.52Å; Y234-F283 HydrophobicContact CD2-CE1 4.2Å; Y234-F283 AromaticContact CD2-CE2 3.78Å; Y234-F283 HydrophobicContact CD2-CE2 3.78Å; Y234-F283 AromaticContact CD2-CZ 3.56Å; Y234-F283 HydrophobicContact CD2-CZ 3.56Å; Y234-F283 HydrophobicContact CE2-CD1 4.41Å; Y234-F283 AromaticContact CE2-CE1 3.57Å; Y234-F283 HydrophobicContact CE2-CE1 3.57Å; Y234-F283 HydrophobicContact CE2-CE2 4.03Å; Y234-F283 AromaticContact CE2-CZ 3.36Å; Y234-F283 HydrophobicContact CE2-CZ 3.36Å
235	V	94	Very high	95.1	Very high	15 Å²	15	38 Å²	38	9%	0.091	21%	0.206	C	C	.	.	S	Bend	trans	-147.6	153.8	-179.2	-73.8	0	0	0	0	111.1	I228 P275 A279	I228-V235 HydrophobicContact CG2-CG2 3.75Å; V235-P275 HydrophobicContact CG1-CG 3.82Å; V235-A279 HydrophobicContact CB-CB 4.43Å; V235-A279 HydrophobicContact CG1-CB 3.78Å; V235-A279 HydrophobicContact CG2-CB 3.77Å
236	D	91.9	Very high	95.1	Very high	84 Å²	84	37.9 Å²	37.9	45%	0.449	21%	0.205	S	C	.	.	P	Polyproline II helix	trans	-66.7	166.4	175.5	-76.9	-43.2	0	0	0	112.7	K99 P271 W274	K99-D236 IonicContact NZ-OD1 3.88Å; K99-D236 PolarHBondContact NZ-OD1 3.23Å; D236-P271 HydrophobicContact CB-CG 4.2Å; D236-W274 PolarHBondContact O-NE1 3.41Å
237	T	93.2	Very high	95.1	Very high	66 Å²	66	38.3 Å²	38.3	41%	0.405	21%	0.208	S	C	.	.	P	Polyproline II helix	trans	-96.9	157.4	177	51.5	0	0	0	0	111.7	R239	T237-R239 PolarHBondContact O-N 3.46Å
238	I	94.2	Very high	95	Very high	2 Å²	2	42 Å²	42	1%	0.01	23%	0.227	C	C	.	.	P	Polyproline II helix	trans	-78.6	119.1	168.7	-58.7	173.9	0	0	0	108.9	L229 G240 I241 L260 V270 W274	L229-I238 HydrophobicContact CD2-CD1 4Å; I238-G240 PolarHBondContact O-N 3.22Å; I238-I241 HydrophobicContact CB-CB 4.45Å; I238-I241 HydrophobicContact CB-CD1 3.87Å; I238-I241 HydrophobicContact CB-CG1 4.2Å; I238-I241 HydrophobicContact CD1-CD1 3.96Å; I238-I241 HydrophobicContact CG2-CD1 3.64Å; I238-I241 HydrophobicContact CG2-CG1 3.92Å; I238-I241 PolarHBondContact O-N 2.76Å; I238-L260 HydrophobicContact CD1-CD2 3.89Å; I238-V270 HydrophobicContact CD1-CG2 4.35Å; I238-V270 HydrophobicContact CG2-CG2 4.49Å; I238-W274 HydrophobicContact CD1-CE3 4.24Å; I238-W274 HydrophobicContact CD1-CH2 3.68Å; I238-W274 HydrophobicContact CD1-CZ2 4.46Å; I238-W274 HydrophobicContact CD1-CZ3 3.55Å; I238-W274 HydrophobicContact CG1-CE3 4.31Å; I238-W274 HydrophobicContact CG1-CH2 3.84Å; I238-W274 HydrophobicContact CG1-CZ2 4.13Å; I238-W274 HydrophobicContact CG1-CZ3 3.94Å
239	R	92.1	Very high	95	Very high	192 Å²	192	42.4 Å²	42.4	73%	0.725	23%	0.229	S	C	*	.	T	Hydrogen-bonded Turn	trans	-58.9	129.1	-179	-173.5	178.3	178.4	-172.4	-0.5	110.8	T237	T237-R239 PolarHBondContact O-N 3.46Å
240	G	92.8	Very high	95	Very high	61 Å²	61	42.3 Å²	42.3	63%	0.629	23%	0.229	S	C	*	.	T	Hydrogen-bonded Turn	trans	88.7	-4.5	177.3	0	0	0	0	0	115.1	I238 G242	I238-G240 PolarHBondContact O-N 3.22Å; G240-G242 PolarHBondContact O-N 3.42Å
241	I	94.7	Very high	95.1	Very high	13 Å²	13	45.7 Å²	45.7	7%	0.067	24%	0.244	C	C	.	.			trans	-92.5	97.1	169.8	-59.6	-173.8	0	0	0	108.5	I238 K245 A246 L249 Y268	I238-I241 HydrophobicContact CB-CB 4.45Å; I238-I241 HydrophobicContact CB-CD1 3.87Å; I238-I241 HydrophobicContact CB-CG1 4.2Å; I238-I241 HydrophobicContact CD1-CD1 3.96Å; I238-I241 HydrophobicContact CG2-CD1 3.64Å; I238-I241 HydrophobicContact CG2-CG1 3.92Å; I238-I241 PolarHBondContact O-N 2.76Å; I241-K245 HydrophobicContact CG2-CB 4.47Å; I241-K245 HydrophobicContact CG2-CG 4.46Å; I241-A246 HydrophobicContact CG2-CB 3.88Å; I241-L249 HydrophobicContact CD1-CD1 3.78Å; I241-L249 HydrophobicContact CG1-CD1 4.34Å; I241-L249 HydrophobicContact CG2-CD1 4.17Å; I241-Y268 HydrophobicContact CD1-CD1 4.34Å; I241-Y268 HydrophobicContact CD1-CG 4.47Å; I241-Y268 HydrophobicContact CG1-CD1 3.62Å; I241-Y268 HydrophobicContact CG1-CE1 4.04Å; I241-Y268 HydrophobicContact CG1-CG 4.23Å
242	G	93.5	Very high	95.2	Very high	32 Å²	32	52.1 Å²	52.1	33%	0.33	27%	0.269	S	S	.	.			trans	-88.2	177.9	173.4	0	0	0	0	0	113	G240 K244 K245 A246	G240-G242 PolarHBondContact O-N 3.42Å; G242-K244 PolarHBondContact O-N 3.32Å; G242-K245 PolarHBondContact O-N 3.46Å; G242-A246 PolarHBondContact O-N 3.17Å
243	P	95.5	Very high	95.3	Very high	29 Å²	29	53.5 Å²	53.5	19%	0.188	27%	0.273	C	S	.	.	H	α-helix	trans	-58.1	-46	-168.6	-25.4	32	0	0	0	116	Q5 V9 L230 K245 A246 L247	Q5-P243 HydrophobicContact CB-CG 3.99Å; V9-P243 HydrophobicContact CG2-CB 3.47Å; V9-P243 VanDerWaalsContact CG2-CB 3.47Å; V9-P243 HydrophobicContact CG2-CG 4.45Å; L230-P243 VanDerWaalsContact CD2-CA 3.42Å; L230-P243 HydrophobicContact CD2-CB 3.6Å; L230-P243 HydrophobicContact CD2-CG 3.95Å; P243-K245 VanDerWaalsContact C-N 3.32Å; P243-K245 PolarHBondContact O-N 3.28Å; P243-A246 PolarHBondContact O-N 3.02Å; P243-L247 PolarHBondContact O-N 3.18Å
244	K	95.7	Very high	95.4	Very high	167 Å²	167	57.8 Å²	57.8	73%	0.726	29%	0.293	S	S	*	.	H	α-helix	trans	-59.3	-45	175.1	-178	178.1	179.2	178.5	0	111.4	G242 L247 D248	G242-K244 PolarHBondContact O-N 3.32Å; K244-L247 PolarHBondContact O-N 3.25Å; K244-D248 PolarHBondContact O-N 3.45Å
245	K	96.1	Very high	95.5	Very high	79 Å²	79	58.6 Å²	58.6	34%	0.343	30%	0.299	S	S	.	.	H	α-helix	trans	-69.4	-38.4	-176.9	-172.5	58.9	177.3	175.2	0	111.8	I241 G242 P243 D248 L249	I241-K245 HydrophobicContact CG2-CB 4.47Å; I241-K245 HydrophobicContact CG2-CG 4.46Å; G242-K245 PolarHBondContact O-N 3.46Å; P243-K245 VanDerWaalsContact C-N 3.32Å; P243-K245 PolarHBondContact O-N 3.28Å; K245-D248 PolarHBondContact O-N 3.36Å; K245-L249 HydrophobicContact CD-CD1 4.42Å; K245-L249 HydrophobicContact CD-CG 4.26Å; K245-L249 HydrophobicContact CG-CD1 3.98Å; K245-L249 HydrophobicContact CG-CG 4.31Å; K245-L249 VanDerWaalsContact O-CB 3.3Å; K245-L249 WeakPolarHBondContact O-CB 2.86Å; K245-L249 WeakPolarHBondContact O-CG 3.08Å; K245-L249 PolarHBondContact O-N 3.33Å
246	A	97.1	Very high	95.7	Very high	0 Å²	0	57.9 Å²	57.9	0%	0	30%	0.295	C	S	.	.	H	α-helix	trans	-58.7	-47.8	175	0	0	0	0	0	111	L226 L229 L230 I241 G242 P243 L249 L250	L226-A246 HydrophobicContact CD1-CB 3.93Å; L229-A246 HydrophobicContact CB-CB 3.96Å; L229-A246 HydrophobicContact CD1-CB 4.45Å; L230-A246 HydrophobicContact CD2-CB 4.28Å; I241-A246 HydrophobicContact CG2-CB 3.88Å; G242-A246 PolarHBondContact O-N 3.17Å; P243-A246 PolarHBondContact O-N 3.02Å; A246-L249 PolarHBondContact O-N 2.97Å; A246-L250 PolarHBondContact O-N 2.85Å
247	L	97	Very high	95.9	Very high	9 Å²	9	56.8 Å²	56.8	5%	0.047	29%	0.289	C	S	.	.	H	α-helix	trans	-62.3	-49.2	177.3	-171	62.8	0	0	0	111.8	N13 L216 L218 L226 P243 K244 L249 L250 H251	N13-L247 HydrophobicContact CB-CD2 4.49Å; L216-L247 HydrophobicContact CD2-CD1 4.45Å; L216-L247 HydrophobicContact CD2-CD2 4.35Å; L218-L247 HydrophobicContact CD1-CD1 3.94Å; L218-L247 HydrophobicContact CG-CD1 4.47Å; L226-L247 HydrophobicContact CD1-CB 4.43Å; L226-L247 HydrophobicContact CD2-CD1 4.2Å; P243-L247 PolarHBondContact O-N 3.18Å; K244-L247 PolarHBondContact O-N 3.25Å; L247-L249 VanDerWaalsContact C-N 3.27Å; L247-L249 PolarHBondContact O-N 3Å; L247-L250 PolarHBondContact O-N 3.43Å; L247-L250 VanDerWaalsContact O-N 3.17Å; L247-H251 PolarHBondContact O-N 2.85Å
248	D	97	Very high	96	Very high	77 Å²	77	55.9 Å²	55.9	41%	0.412	29%	0.285	S	S	.	.	H	α-helix	trans	-56.9	-41.2	177.3	-67.1	-19.7	0	0	0	112.1	K244 K245 K252	K244-D248 PolarHBondContact O-N 3.45Å; K245-D248 PolarHBondContact O-N 3.36Å; D248-K252 WeakPolarHBondContact O-CB 3.34Å; D248-K252 PolarHBondContact O-N 3.01Å
249	L	97.2	Very high	96.1	Very high	8 Å²	8	55.8 Å²	55.8	4%	0.042	29%	0.285	C	S	.	.	H	α-helix	trans	-67.4	-40.1	179.7	-76.4	172.6	0	0	0	111.7	I241 K245 A246 L247 K252 Y253 V259 I263	I241-L249 HydrophobicContact CD1-CD1 3.78Å; I241-L249 HydrophobicContact CG1-CD1 4.34Å; I241-L249 HydrophobicContact CG2-CD1 4.17Å; K245-L249 HydrophobicContact CD-CD1 4.42Å; K245-L249 HydrophobicContact CD-CG 4.26Å; K245-L249 HydrophobicContact CG-CD1 3.98Å; K245-L249 HydrophobicContact CG-CG 4.31Å; K245-L249 VanDerWaalsContact O-CB 3.3Å; K245-L249 WeakPolarHBondContact O-CB 2.86Å; K245-L249 WeakPolarHBondContact O-CG 3.08Å; K245-L249 PolarHBondContact O-N 3.33Å; A246-L249 PolarHBondContact O-N 2.97Å; L247-L249 VanDerWaalsContact C-N 3.27Å; L247-L249 PolarHBondContact O-N 3Å; L249-K252 PolarHBondContact O-N 3.18Å; L249-Y253 HydrophobicContact CD2-CD2 3.9Å; L249-Y253 HydrophobicContact CD2-CE2 3.63Å; L249-Y253 WeakPolarHBondContact O-CB 3.34Å; L249-Y253 WeakPolarHBondContact O-CD2 3.35Å; L249-Y253 PolarHBondContact O-N 3.32Å; L249-V259 HydrophobicContact CB-CG1 4.35Å; L249-V259 HydrophobicContact CB-CG2 3.99Å; L249-V259 HydrophobicContact CD1-CG1 4.05Å; L249-I263 HydrophobicContact CD1-CG2 4.25Å; L249-I263 HydrophobicContact CD2-CG2 4.03Å
250	L	97.5	Very high	96.2	Very high	0 Å²	0	48 Å²	48	0%	0	26%	0.257	C	S	.	.	H	α-helix	trans	-73	-37	177.5	-74.4	174.3	0	0	0	112.7	D225 L226 L229 A246 L247 K252 Q254 V259	D225-L250 HydrophobicContact CB-CD1 4.22Å; D225-L250 HydrophobicContact CB-CD2 3.88Å; L226-L250 HydrophobicContact CB-CD1 3.49Å; L226-L250 VanDerWaalsContact CB-CD1 3.49Å; L226-L250 HydrophobicContact CD1-CD1 4.04Å; L226-L250 HydrophobicContact CG-CD1 4.37Å; L226-L250 VanDerWaalsContact N-CD1 3.31Å; L229-L250 HydrophobicContact CD1-CD1 3.86Å; L229-L250 HydrophobicContact CD1-CD2 3.99Å; L229-L250 HydrophobicContact CD1-CG 3.75Å; A246-L250 PolarHBondContact O-N 2.85Å; L247-L250 PolarHBondContact O-N 3.43Å; L247-L250 VanDerWaalsContact O-N 3.17Å; L250-K252 PolarHBondContact O-N 2.86Å; L250-Q254 WeakPolarHBondContact O-CA 3.48Å; L250-Q254 PolarHBondContact O-N 3.03Å; L250-V259 HydrophobicContact CD2-CG2 4.39Å
251	H	97.6	Very high	96.3	Very high	82 Å²	82	52.9 Å²	52.9	38%	0.38	26%	0.261	S	S	.	.	H	α-helix	trans	-61.4	-37.3	170.1	-70.4	161.2	0	0	0	111.7	L216 L247 Q254	L216-H251 PolarHBondContact O-CE1 3.03Å; L216-H251 PolarHBondContact O-NE2 3.18Å; L247-H251 PolarHBondContact O-N 2.85Å; H251-Q254 PolarHBondContact O-NE2 3.47Å
252	K	97.5	Very high	96.3	Very high	143 Å²	143	56.6 Å²	56.6	62%	0.622	28%	0.281	S	S	*	.	H	α-helix	trans	-76.4	-44.7	-179.7	-170.4	177.4	179.4	-165.5	0	113.6	D248 L249 L250	D248-K252 WeakPolarHBondContact O-CB 3.34Å; D248-K252 PolarHBondContact O-N 3.01Å; L249-K252 PolarHBondContact O-N 3.18Å; L250-K252 PolarHBondContact O-N 2.86Å
253	Y	97.5	Very high	96.3	Very high	43 Å²	43	55.9 Å²	55.9	17%	0.169	27%	0.27	C	S	.	.	H	α-helix	trans	-113.3	-6.4	-167.7	-59.2	-55.5	0	0	0	114.1	L249 S255 C258 V259 N262	L249-Y253 HydrophobicContact CD2-CD2 3.9Å; L249-Y253 HydrophobicContact CD2-CE2 3.63Å; L249-Y253 WeakPolarHBondContact O-CB 3.34Å; L249-Y253 WeakPolarHBondContact O-CD2 3.35Å; L249-Y253 PolarHBondContact O-N 3.32Å; Y253-S255 PolarHBondContact O-N 3.36Å; Y253-C258 WeakPolarHBondContact O-CB 3.41Å; Y253-V259 HydrophobicContact CD2-CG2 4.05Å; Y253-V259 HydrophobicContact CG-CG2 4.47Å; Y253-N262 HydrophobicContact CD1-CB 3.99Å; Y253-N262 HydrophobicContact CD2-CB 4.37Å; Y253-N262 HydrophobicContact CE1-CB 3.47Å; Y253-N262 VanDerWaalsContact CE1-CB 3.47Å; Y253-N262 HydrophobicContact CE2-CB 3.86Å; Y253-N262 HydrophobicContact CG-CB 4.42Å
254	Q	96.7	Very high	96.2	Very high	104 Å²	104	58.5 Å²	58.5	49%	0.486	28%	0.282	S	S	.	.	S	Bend	trans	66.9	-13.5	169.1	-54.1	-72.2	-57.5	0	0	117.1	Q222 L250 H251	Q222-Q254 VanDerWaalsContact CG-O 3.27Å; Q222-Q254 WeakPolarHBondContact CG-O 3.44Å; Q222-Q254 PolarHBondContact NE2-O 3.47Å; Q222-Q254 VanDerWaalsContact NE2-O 3.14Å; L250-Q254 WeakPolarHBondContact O-CA 3.48Å; L250-Q254 PolarHBondContact O-N 3.03Å; H251-Q254 PolarHBondContact O-NE2 3.47Å
255	S	97.4	Very high	95.9	Very high	24 Å²	24	57.3 Å²	57.3	17%	0.168	28%	0.277	C	S	.	.	S	Bend	trans	-156.7	158.3	177.3	61.8	0	0	0	0	111.9	D225 Y253 D257 C258 V259	D225-S255 WeakPolarHBondContact OD2-CA 3.5Å; Y253-S255 PolarHBondContact O-N 3.36Å; S255-D257 VanDerWaalsContact C-N 3.29Å; S255-D257 PolarHBondContact O-N 2.84Å; S255-C258 PolarHBondContact O-N 3.4Å; S255-C258 WeakPolarHBondContact OG-CB 3.09Å; S255-C258 PolarHBondContact OG-N 2.9Å; S255-C258 PolarHBondContact OG-SG 3.03Å; S255-C258 VanDerWaalsContact OG-SG 3.4Å; S255-V259 VanDerWaalsContact O-CG2 3.27Å; S255-V259 WeakPolarHBondContact O-CG2 3.43Å; S255-V259 PolarHBondContact O-N 3.04Å
256	I	96.9	Very high	95.6	Very high	0 Å²	0	58.3 Å²	58.3	0%	0	29%	0.294	C	S	.	.	H	α-helix	trans	-58.4	-40.9	173.7	-66.9	171.8	0	0	0	111.4	D225 I228 L229 C258 V259 L260 W274 Y276	D225-I256 HydrophobicContact CB-CD1 3.93Å; D225-I256 HydrophobicContact CB-CG1 3.77Å; D225-I256 PolarHBondContact OD2-N 3.37Å; I228-I256 HydrophobicContact CB-CD1 3.98Å; I228-I256 HydrophobicContact CD1-CD1 4.34Å; I228-I256 HydrophobicContact CG2-CD1 3.83Å; L229-I256 HydrophobicContact CD1-CG1 4.27Å; L229-I256 HydrophobicContact CD2-CG1 4.35Å; L229-I256 HydrophobicContact CG-CD1 4.29Å; L229-I256 HydrophobicContact CG-CG1 4.07Å; I256-C258 VanDerWaalsContact C-N 3.31Å; I256-C258 PolarHBondContact O-N 3.08Å; I256-V259 WeakPolarHBondContact O-CA 3.48Å; I256-V259 WeakPolarHBondContact O-CB 3.02Å; I256-V259 PolarHBondContact O-N 3.06Å; I256-V259 VanDerWaalsContact O-N 3.08Å; I256-L260 HydrophobicContact CG2-CD1 3.9Å; I256-L260 HydrophobicContact CG2-CG 4.01Å; I256-L260 WeakPolarHBondContact O-CG 3.19Å; I256-L260 PolarHBondContact O-N 3.45Å; I256-W274 HydrophobicContact CD1-CH2 4.45Å; I256-W274 HydrophobicContact CG2-CH2 4.06Å; I256-W274 HydrophobicContact CG2-CZ3 3.64Å; I256-Y276 HydrophobicContact CB-CD2 3.83Å; I256-Y276 HydrophobicContact CB-CE2 3.74Å; I256-Y276 HydrophobicContact CD1-CD2 3.89Å; I256-Y276 HydrophobicContact CD1-CG 4.35Å; I256-Y276 HydrophobicContact CG1-CD2 4.47Å; I256-Y276 HydrophobicContact CG2-CD1 4.02Å; I256-Y276 HydrophobicContact CG2-CD2 3.53Å; I256-Y276 HydrophobicContact CG2-CE1 3.98Å; I256-Y276 HydrophobicContact CG2-CE2 3.51Å; I256-Y276 HydrophobicContact CG2-CG 3.79Å
257	D	95.7	Very high	95.3	Very high	62 Å²	62	64.8 Å²	64.8	33%	0.332	32%	0.322	S	S	.	.	H	α-helix	trans	-54.1	-47.5	177.9	-61.4	-66.8	0	0	0	112.2	S255 K261 Y276	S255-D257 VanDerWaalsContact C-N 3.29Å; S255-D257 PolarHBondContact O-N 2.84Å; D257-K261 VanDerWaalsContact O-CG 3.32Å; D257-K261 WeakPolarHBondContact O-CG 3.37Å; D257-K261 PolarHBondContact O-N 3.41Å; D257-Y276 PolarHBondContact OD1-OH 3.3Å
258	C	96.4	Very high	95.1	Very high	47 Å²	47	65.6 Å²	65.6	32%	0.318	33%	0.325	S	S	.	.	H	α-helix	trans	-72.4	-34.2	179.1	-71.2	0	0	0	0	111.7	Y253 S255 I256 K261 N262	Y253-C258 WeakPolarHBondContact O-CB 3.41Å; S255-C258 PolarHBondContact O-N 3.4Å; S255-C258 WeakPolarHBondContact OG-CB 3.09Å; S255-C258 PolarHBondContact OG-N 2.9Å; S255-C258 PolarHBondContact OG-SG 3.03Å; S255-C258 VanDerWaalsContact OG-SG 3.4Å; I256-C258 VanDerWaalsContact C-N 3.31Å; I256-C258 PolarHBondContact O-N 3.08Å; C258-K261 PolarHBondContact O-N 2.77Å; C258-N262 WeakPolarHBondContact O-CB 3.24Å; C258-N262 PolarHBondContact O-N 2.79Å; C258-N262 PolarHBondContact O-ND2 2.96Å
259	V	96.1	Very high	94.8	Very high	0 Å²	0	66.9 Å²	66.9	0%	0	33%	0.331	C	S	.	.	H	α-helix	trans	-58.9	-53	171.8	172.5	0	0	0	0	109.7	L249 L250 Y253 S255 I256 K261 N262 I263	L249-V259 HydrophobicContact CB-CG1 4.35Å; L249-V259 HydrophobicContact CB-CG2 3.99Å; L249-V259 HydrophobicContact CD1-CG1 4.05Å; L250-V259 HydrophobicContact CD2-CG2 4.39Å; Y253-V259 HydrophobicContact CD2-CG2 4.05Å; Y253-V259 HydrophobicContact CG-CG2 4.47Å; S255-V259 VanDerWaalsContact O-CG2 3.27Å; S255-V259 WeakPolarHBondContact O-CG2 3.43Å; S255-V259 PolarHBondContact O-N 3.04Å; I256-V259 WeakPolarHBondContact O-CA 3.48Å; I256-V259 WeakPolarHBondContact O-CB 3.02Å; I256-V259 PolarHBondContact O-N 3.06Å; I256-V259 VanDerWaalsContact O-N 3.08Å; V259-K261 PolarHBondContact O-N 3.14Å; V259-N262 PolarHBondContact O-N 2.86Å; V259-I263 HydrophobicContact CG1-CG2 3.61Å; V259-I263 WeakPolarHBondContact O-CG1 3.36Å; V259-I263 VanDerWaalsContact O-CG2 3.31Å; V259-I263 WeakPolarHBondContact O-CG2 3.37Å; V259-I263 PolarHBondContact O-N 3.4Å
260	L	94.9	Very high	94.5	Very high	28 Å²	28	68.2 Å²	68.2	15%	0.147	34%	0.339	C	S	.	.	H	α-helix	trans	-60.7	-31	-177.8	-68.5	178.8	0	0	0	113.7	I238 I256 I263 K265 V270 W274 Y276	I238-L260 HydrophobicContact CD1-CD2 3.89Å; I256-L260 HydrophobicContact CG2-CD1 3.9Å; I256-L260 HydrophobicContact CG2-CG 4.01Å; I256-L260 WeakPolarHBondContact O-CG 3.19Å; I256-L260 PolarHBondContact O-N 3.45Å; L260-I263 HydrophobicContact CD2-CD1 4.04Å; L260-K265 WeakPolarHBondContact O-CE 3.28Å; L260-V270 HydrophobicContact CD2-CG1 3.95Å; L260-V270 HydrophobicContact CD2-CG2 3.67Å; L260-W274 HydrophobicContact CD1-CE3 4.22Å; L260-W274 HydrophobicContact CD1-CZ3 4.17Å; L260-W274 HydrophobicContact CD2-CE3 4.31Å; L260-W274 HydrophobicContact CD2-CZ3 4.06Å; L260-W274 HydrophobicContact CG-CZ3 4.44Å; L260-Y276 HydrophobicContact CD1-CD1 4.11Å; L260-Y276 HydrophobicContact CD1-CE1 3.39Å
261	K	94.4	Very high	94.1	Very high	163 Å²	163	70 Å²	70	71%	0.709	35%	0.351	S	S	*	.	H	α-helix	trans	-72.8	-25.9	174.9	-72.4	169.3	-174.9	170.4	0	113.6	D257 C258 V259	D257-K261 VanDerWaalsContact O-CG 3.32Å; D257-K261 WeakPolarHBondContact O-CG 3.37Å; D257-K261 PolarHBondContact O-N 3.41Å; C258-K261 PolarHBondContact O-N 2.77Å; V259-K261 PolarHBondContact O-N 3.14Å
262	N	95	Very high	93.5	Very high	91 Å²	91	73.6 Å²	73.6	49%	0.487	37%	0.372	S	S	.	.	H	α-helix	trans	-117.5	-4.6	-169.3	-70.3	-85.5	0	0	0	114.9	Y253 C258 V259	Y253-N262 HydrophobicContact CD1-CB 3.99Å; Y253-N262 HydrophobicContact CD2-CB 4.37Å; Y253-N262 HydrophobicContact CE1-CB 3.47Å; Y253-N262 VanDerWaalsContact CE1-CB 3.47Å; Y253-N262 HydrophobicContact CE2-CB 3.86Å; Y253-N262 HydrophobicContact CG-CB 4.42Å; C258-N262 WeakPolarHBondContact O-CB 3.24Å; C258-N262 PolarHBondContact O-N 2.79Å; C258-N262 PolarHBondContact O-ND2 2.96Å; V259-N262 PolarHBondContact O-N 2.86Å
263	I	93	Very high	93	Very high	17 Å²	17	74.5 Å²	74.5	9%	0.087	38%	0.384	C	S	.	.	S	Bend	trans	-81.5	150	174.3	59.5	175.8	0	0	0	111.4	L249 V259 L260 K265 Y268 V270	L249-I263 HydrophobicContact CD1-CG2 4.25Å; L249-I263 HydrophobicContact CD2-CG2 4.03Å; V259-I263 HydrophobicContact CG1-CG2 3.61Å; V259-I263 WeakPolarHBondContact O-CG1 3.36Å; V259-I263 VanDerWaalsContact O-CG2 3.31Å; V259-I263 WeakPolarHBondContact O-CG2 3.37Å; V259-I263 PolarHBondContact O-N 3.4Å; L260-I263 HydrophobicContact CD2-CD1 4.04Å; I263-K265 PolarHBondContact O-N 3.07Å; I263-K265 VanDerWaalsContact O-N 3.14Å; I263-Y268 HydrophobicContact CB-CD2 4.19Å; I263-V270 HydrophobicContact CD1-CG2 3.98Å
264	D	92.6	Very high	92.8	Very high	85 Å²	85	73.4 Å²	73.4	46%	0.455	38%	0.38	S	S	.	.			trans	-72.6	101.8	169.3	176.8	4.5	0	0	0	110	S266 K267 Y268	D264-S266 VanDerWaalsContact CG-OG 3.29Å; D264-S266 PolarHBondContact O-N 3.43Å; D264-S266 WeakPolarHBondContact OD1-CB 3.26Å; D264-S266 PolarHBondContact OD1-N 2.93Å; D264-S266 PolarHBondContact OD1-OG 2.69Å; D264-S266 PolarHBondContact OD2-OG 3.24Å; D264-K267 HydrophobicContact CB-CB 4.25Å; D264-K267 PolarHBondContact O-N 3.4Å; D264-K267 VanDerWaalsContact O-N 3.11Å; D264-Y268 WeakPolarHBondContact O-CD2 3.47Å; D264-Y268 PolarHBondContact O-N 3.33Å
265	K	89.5	Confident	92.7	Very high	141 Å²	141	71.1 Å²	71.1	61%	0.613	37%	0.374	S	S	*	.	T	Hydrogen-bonded Turn	trans	-67.4	-16	-178.9	-62.9	-173.6	179.6	-174	0	113.7	L260 I263 K267	L260-K265 WeakPolarHBondContact O-CE 3.28Å; I263-K265 PolarHBondContact O-N 3.07Å; I263-K265 VanDerWaalsContact O-N 3.14Å; K265-K267 VanDerWaalsContact C-N 3.34Å
266	S	89.6	Confident	92.6	Very high	101 Å²	101	71.1 Å²	71.1	71%	0.706	37%	0.37	S	S	*	.	T	Hydrogen-bonded Turn	trans	-74.2	-30.5	172.7	75.6	0	0	0	0	111.7	D264	D264-S266 VanDerWaalsContact CG-OG 3.29Å; D264-S266 PolarHBondContact O-N 3.43Å; D264-S266 WeakPolarHBondContact OD1-CB 3.26Å; D264-S266 PolarHBondContact OD1-N 2.93Å; D264-S266 PolarHBondContact OD1-OG 2.69Å; D264-S266 PolarHBondContact OD2-OG 3.24Å
267	K	92.1	Very high	92.5	Very high	135 Å²	135	76.9 Å²	76.9	59%	0.587	40%	0.397	S	S	*	.	T	Hydrogen-bonded Turn	trans	-92.7	-41.6	179.8	-178.4	176.4	-179.8	177.4	0	112.9	D264 K265	D264-K267 HydrophobicContact CB-CB 4.25Å; D264-K267 PolarHBondContact O-N 3.4Å; D264-K267 VanDerWaalsContact O-N 3.11Å; K265-K267 VanDerWaalsContact C-N 3.34Å
268	Y	92.7	Very high	92.5	Very high	27 Å²	27	78.1 Å²	78.1	11%	0.106	40%	0.404	C	S	.	.	S	Bend	trans	-108.7	92.3	-177.5	-58.2	-68.6	0	0	0	108.8	I241 I263 D264 V270	I241-Y268 HydrophobicContact CD1-CD1 4.34Å; I241-Y268 HydrophobicContact CD1-CG 4.47Å; I241-Y268 HydrophobicContact CG1-CD1 3.62Å; I241-Y268 HydrophobicContact CG1-CE1 4.04Å; I241-Y268 HydrophobicContact CG1-CG 4.23Å; I263-Y268 HydrophobicContact CB-CD2 4.19Å; D264-Y268 WeakPolarHBondContact O-CD2 3.47Å; D264-Y268 PolarHBondContact O-N 3.33Å; Y268-V270 PolarHBondContact O-N 2.91Å
269	I	90.4	Very high	92.5	Very high	104 Å²	104	75.9 Å²	75.9	53%	0.533	39%	0.389	S	S	.	.			trans	-72.5	111	-179.2	-55.4	172.9	0	0	0	107.9
270	V	90.6	Very high	92.6	Very high	35 Å²	35	77.8 Å²	77.8	21%	0.212	40%	0.397	C	S	.	.	P	Polyproline II helix	trans	-81	133.4	173.5	-174.5	0	0	0	0	107.4	I238 L260 I263 Y268 W274	I238-V270 HydrophobicContact CD1-CG2 4.35Å; I238-V270 HydrophobicContact CG2-CG2 4.49Å; L260-V270 HydrophobicContact CD2-CG1 3.95Å; L260-V270 HydrophobicContact CD2-CG2 3.67Å; I263-V270 HydrophobicContact CD1-CG2 3.98Å; Y268-V270 PolarHBondContact O-N 2.91Å; V270-W274 HydrophobicContact CG1-CB 4.23Å; V270-W274 HydrophobicContact CG1-CD2 4.43Å; V270-W274 HydrophobicContact CG1-CE3 3.94Å
271	P	89.1	Confident	92.7	Very high	38 Å²	38	83 Å²	83	25%	0.247	42%	0.419	C	S	.	.	P	Polyproline II helix	trans	-55.5	142.8	173.3	-23.3	33.3	0	0	0	111.6	D236 W274	D236-P271 HydrophobicContact CB-CG 4.2Å; P271-W274 HydrophobicContact CB-CB 4.13Å; P271-W274 HydrophobicContact CB-CG 4.36Å; P271-W274 HydrophobicContact CG-CG 4.26Å; P271-W274 WeakPolarHBondContact O-CB 3.43Å; P271-W274 PolarHBondContact O-N 3.38Å
272	D	85	Confident	92.8	Very high	157 Å²	157	76.3 Å²	76.3	84%	0.84	39%	0.391	S	S	*	.	T	Hydrogen-bonded Turn	trans	-62.8	139.7	171.5	-64.2	-34.4	0	0	0	109.2	W274	D272-W274 PolarHBondContact O-N 2.89Å
273	D	88.1	Confident	92.9	Very high	163 Å²	163	72 Å²	72	87%	0.872	37%	0.368	S	S	*	.	T	Hydrogen-bonded Turn	trans	51.1	35.7	-177	-60.7	-32.9	0	0	0	114.9	P275	D273-P275 WeakPolarHBondContact O-CD 3.13Å
274	W	92.7	Very high	93.1	Very high	20 Å²	20	74.6 Å²	74.6	8%	0.076	38%	0.381	C	S	.	.			trans	-61.3	104.8	-177.7	-171.4	45.4	0	0	0	112.7	I228 L229 D236 I238 I256 L260 V270 P271 D272 Y276	I228-W274 HydrophobicContact CG2-CH2 4.22Å; I228-W274 HydrophobicContact CG2-CZ2 3.82Å; L229-W274 HydrophobicContact CD2-CH2 3.92Å; D236-W274 PolarHBondContact O-NE1 3.41Å; I238-W274 HydrophobicContact CD1-CE3 4.24Å; I238-W274 HydrophobicContact CD1-CH2 3.68Å; I238-W274 HydrophobicContact CD1-CZ2 4.46Å; I238-W274 HydrophobicContact CD1-CZ3 3.55Å; I238-W274 HydrophobicContact CG1-CE3 4.31Å; I238-W274 HydrophobicContact CG1-CH2 3.84Å; I238-W274 HydrophobicContact CG1-CZ2 4.13Å; I238-W274 HydrophobicContact CG1-CZ3 3.94Å; I256-W274 HydrophobicContact CD1-CH2 4.45Å; I256-W274 HydrophobicContact CG2-CH2 4.06Å; I256-W274 HydrophobicContact CG2-CZ3 3.64Å; L260-W274 HydrophobicContact CD1-CE3 4.22Å; L260-W274 HydrophobicContact CD1-CZ3 4.17Å; L260-W274 HydrophobicContact CD2-CE3 4.31Å; L260-W274 HydrophobicContact CD2-CZ3 4.06Å; L260-W274 HydrophobicContact CG-CZ3 4.44Å; V270-W274 HydrophobicContact CG1-CB 4.23Å; V270-W274 HydrophobicContact CG1-CD2 4.43Å; V270-W274 HydrophobicContact CG1-CE3 3.94Å; P271-W274 HydrophobicContact CB-CB 4.13Å; P271-W274 HydrophobicContact CB-CG 4.36Å; P271-W274 HydrophobicContact CG-CG 4.26Å; P271-W274 WeakPolarHBondContact O-CB 3.43Å; P271-W274 PolarHBondContact O-N 3.38Å; D272-W274 PolarHBondContact O-N 2.89Å; W274-Y276 HydrophobicContact CD2-CD1 4.13Å; W274-Y276 AromaticContact CE3-CD1 3.55Å; W274-Y276 HydrophobicContact CE3-CD1 3.55Å; W274-Y276 HydrophobicContact CE3-CE1 4.34Å; W274-Y276 HydrophobicContact CE3-CG 4.15Å; W274-Y276 HydrophobicContact CH2-CG 4.49Å; W274-Y276 AromaticContact CZ3-CD1 3.82Å; W274-Y276 HydrophobicContact CZ3-CD1 3.82Å; W274-Y276 HydrophobicContact CZ3-CG 4.08Å; W274-Y276 WeakPolarHBondContact O-CD1 3.4Å; W274-Y276 PolarHBondContact O-N 3.47Å
275	P	94.1	Very high	93.2	Very high	56 Å²	56	76.3 Å²	76.3	36%	0.364	39%	0.39	S	S	.	.			trans	-89.8	51.8	-167	35.3	-29.4	0	0	0	111.5	V235 D273 E277 D278 A279	V235-P275 HydrophobicContact CG1-CG 3.82Å; D273-P275 WeakPolarHBondContact O-CD 3.13Å; P275-E277 PolarHBondContact O-N 3.23Å; P275-D278 HydrophobicContact CB-CB 4.49Å; P275-D278 PolarHBondContact O-N 2.88Å; P275-A279 PolarHBondContact O-N 3.13Å
276	Y	95.3	Very high	93.5	Very high	23 Å²	23	70.7 Å²	70.7	9%	0.09	37%	0.368	C	S	.	.	H	α-helix	trans	-63.5	-29.6	-177.3	71.6	-89.8	0	0	0	112.8	I256 D257 L260 W274 D278 A279 K280	I256-Y276 HydrophobicContact CB-CD2 3.83Å; I256-Y276 HydrophobicContact CB-CE2 3.74Å; I256-Y276 HydrophobicContact CD1-CD2 3.89Å; I256-Y276 HydrophobicContact CD1-CG 4.35Å; I256-Y276 HydrophobicContact CG1-CD2 4.47Å; I256-Y276 HydrophobicContact CG2-CD1 4.02Å; I256-Y276 HydrophobicContact CG2-CD2 3.53Å; I256-Y276 HydrophobicContact CG2-CE1 3.98Å; I256-Y276 HydrophobicContact CG2-CE2 3.51Å; I256-Y276 HydrophobicContact CG2-CG 3.79Å; D257-Y276 PolarHBondContact OD1-OH 3.3Å; L260-Y276 HydrophobicContact CD1-CD1 4.11Å; L260-Y276 HydrophobicContact CD1-CE1 3.39Å; W274-Y276 HydrophobicContact CD2-CD1 4.13Å; W274-Y276 AromaticContact CE3-CD1 3.55Å; W274-Y276 HydrophobicContact CE3-CD1 3.55Å; W274-Y276 HydrophobicContact CE3-CE1 4.34Å; W274-Y276 HydrophobicContact CE3-CG 4.15Å; W274-Y276 HydrophobicContact CH2-CG 4.49Å; W274-Y276 AromaticContact CZ3-CD1 3.82Å; W274-Y276 HydrophobicContact CZ3-CD1 3.82Å; W274-Y276 HydrophobicContact CZ3-CG 4.08Å; W274-Y276 WeakPolarHBondContact O-CD1 3.4Å; W274-Y276 PolarHBondContact O-N 3.47Å; Y276-D278 VanDerWaalsContact C-N 3.33Å; Y276-A279 PolarHBondContact O-N 3.15Å; Y276-K280 WeakPolarHBondContact O-CB 3.27Å; Y276-K280 PolarHBondContact O-N 3.42Å
277	E	96	Very high	93.9	Very high	121 Å²	121	72.3 Å²	72.3	57%	0.565	37%	0.365	S	S	*	.	H	α-helix	trans	-63	-40.8	176.8	-65.7	-175.5	-178.9	0	0	111.4	P275 K280 K281	P275-E277 PolarHBondContact O-N 3.23Å; E277-K280 PolarHBondContact O-N 3.26Å; E277-K281 WeakPolarHBondContact O-CB 3.45Å; E277-K281 PolarHBondContact O-N 3.46Å
278	D	95.9	Very high	94.1	Very high	88 Å²	88	67.9 Å²	67.9	47%	0.471	35%	0.349	S	S	.	.	H	α-helix	trans	-67.5	-41	176.7	-69.1	-41.4	0	0	0	111.2	M92 P275 Y276 K280 K281 L282	M92-D278 HydrophobicContact CE-CB 4.09Å; M92-D278 WeakPolarHBondContact CE-O 2.88Å; M92-D278 VanDerWaalsContact SD-C 3.52Å; M92-D278 HydrophobicContact SD-CB 3.53Å; M92-D278 VanDerWaalsContact SD-CB 3.53Å; P275-D278 HydrophobicContact CB-CB 4.49Å; P275-D278 PolarHBondContact O-N 2.88Å; Y276-D278 VanDerWaalsContact C-N 3.33Å; D278-K280 VanDerWaalsContact C-N 3.35Å; D278-K280 PolarHBondContact O-N 2.94Å; D278-K281 WeakPolarHBondContact O-CB 3.39Å; D278-K281 PolarHBondContact O-N 3Å; D278-L282 PolarHBondContact O-N 3.41Å
279	A	96.1	Very high	94.3	Very high	0 Å²	0	69 Å²	69	0%	0	36%	0.358	C	S	.	.	H	α-helix	trans	-62.3	-41.7	173.8	0	0	0	0	0	112	I228 V235 P275 Y276 K281 L282 F283	I228-A279 HydrophobicContact CD1-CB 4.13Å; I228-A279 HydrophobicContact CG1-CB 4.34Å; V235-A279 HydrophobicContact CB-CB 4.43Å; V235-A279 HydrophobicContact CG1-CB 3.78Å; V235-A279 HydrophobicContact CG2-CB 3.77Å; P275-A279 PolarHBondContact O-N 3.13Å; Y276-A279 PolarHBondContact O-N 3.15Å; A279-K281 VanDerWaalsContact C-N 3.34Å; A279-K281 PolarHBondContact O-N 3.29Å; A279-L282 WeakPolarHBondContact O-CB 3.43Å; A279-L282 PolarHBondContact O-N 3.18Å; A279-F283 VanDerWaalsContact O-CD2 3.26Å; A279-F283 WeakPolarHBondContact O-CD2 3.42Å; A279-F283 PolarHBondContact O-N 3.43Å; A279-F283 VanDerWaalsContact O-N 3.08Å
280	K	97	Very high	94.6	Very high	41 Å²	41	68.2 Å²	68.2	18%	0.178	36%	0.356	C	S	.	.	H	α-helix	trans	-61.2	-44.7	174.5	-174.8	174.3	-168.8	157.1	0	111	I224 D225 I228 Y276 E277 D278 L282 F283 L284	I224-K280 HydrophobicContact CG2-CB 4.36Å; I224-K280 HydrophobicContact CG2-CG 3.96Å; D225-K280 VanDerWaalsContact CG-NZ 3.25Å; D225-K280 WeakPolarHBondContact OD1-CD 3.45Å; D225-K280 VanDerWaalsContact OD1-CE 3.26Å; D225-K280 WeakPolarHBondContact OD1-CE 3.42Å; D225-K280 IonicContact OD1-NZ 3.77Å; D225-K280 PolarHBondContact OD1-NZ 3.27Å; D225-K280 IonicContact OD2-NZ 2.7Å; D225-K280 PolarHBondContact OD2-NZ 3.23Å; D225-K280 VanDerWaalsContact OD2-NZ 3.1Å; I228-K280 HydrophobicContact CD1-CB 3.87Å; Y276-K280 WeakPolarHBondContact O-CB 3.27Å; Y276-K280 PolarHBondContact O-N 3.42Å; E277-K280 PolarHBondContact O-N 3.26Å; D278-K280 VanDerWaalsContact C-N 3.35Å; D278-K280 PolarHBondContact O-N 2.94Å; K280-L282 VanDerWaalsContact C-N 3.32Å; K280-L282 PolarHBondContact O-N 3.36Å; K280-F283 PolarHBondContact O-N 2.84Å; K280-L284 HydrophobicContact CG-CD1 4.06Å; K280-L284 WeakPolarHBondContact O-CG 3.3Å; K280-L284 PolarHBondContact O-N 3.43Å
281	K	97.1	Very high	94.9	Very high	137 Å²	137	67.6 Å²	67.6	60%	0.596	35%	0.352	S	S	*	.	H	α-helix	trans	-61.4	-39.2	176.3	-174.3	179.5	178.1	-177.9	0	112.1	E277 D278 A279 L284 N285	E277-K281 WeakPolarHBondContact O-CB 3.45Å; E277-K281 PolarHBondContact O-N 3.46Å; D278-K281 WeakPolarHBondContact O-CB 3.39Å; D278-K281 PolarHBondContact O-N 3Å; A279-K281 VanDerWaalsContact C-N 3.34Å; A279-K281 PolarHBondContact O-N 3.29Å; K281-L284 PolarHBondContact O-N 2.87Å; K281-N285 PolarHBondContact O-N 3Å
282	L	96.8	Very high	95.2	Very high	23 Å²	23	69.7 Å²	69.7	12%	0.12	37%	0.368	C	S	.	.	H	α-helix	trans	-61.9	-45.6	175.5	-179	72.5	0	0	0	112	P90 M92 Y234 D278 A279 K280 L284 N285 P286	P90-L282 HydrophobicContact CB-CD1 4.01Å; P90-L282 HydrophobicContact CB-CD2 4.28Å; P90-L282 HydrophobicContact CG-CD1 4.32Å; P90-L282 HydrophobicContact CG-CD2 3.97Å; M92-L282 HydrophobicContact CE-CB 3.76Å; M92-L282 HydrophobicContact CE-CD1 4.31Å; M92-L282 HydrophobicContact CE-CD2 4.11Å; M92-L282 HydrophobicContact CE-CG 4.28Å; Y234-L282 HydrophobicContact CD1-CD2 3.36Å; Y234-L282 HydrophobicContact CD2-CD2 3.83Å; Y234-L282 HydrophobicContact CE1-CD2 3.53Å; Y234-L282 HydrophobicContact CE2-CD2 3.98Å; Y234-L282 HydrophobicContact CG-CD2 3.52Å; D278-L282 PolarHBondContact O-N 3.41Å; A279-L282 WeakPolarHBondContact O-CB 3.43Å; A279-L282 PolarHBondContact O-N 3.18Å; K280-L282 VanDerWaalsContact C-N 3.32Å; K280-L282 PolarHBondContact O-N 3.36Å; L282-L284 VanDerWaalsContact C-N 3.35Å; L282-N285 CarbonylContact O-C 3.57Å; L282-P286 VanDerWaalsContact O-CA 3.28Å; L282-P286 WeakPolarHBondContact O-CA 3.23Å; L282-P286 WeakPolarHBondContact O-CD 3.49Å
283	F	97.4	Very high	95.7	Very high	1 Å²	1	66 Å²	66	0%	0.004	35%	0.354	C	S	.	.	H	α-helix	trans	-65.5	-38	177.3	-78.8	-61.1	0	0	0	112.8	D181 A184 F185 I224 I228 C232 Y234 A279 K280	D181-F283 HydrophobicContact CB-CE1 4.18Å; A184-F283 HydrophobicContact CB-CD1 3.56Å; A184-F283 HydrophobicContact CB-CE1 3.43Å; A184-F283 VanDerWaalsContact CB-CE1 3.43Å; A184-F283 HydrophobicContact CB-CE2 4.49Å; A184-F283 HydrophobicContact CB-CG 4.16Å; A184-F283 HydrophobicContact CB-CZ 3.92Å; F185-F283 AromaticContact CD1-CD1 3.82Å; F185-F283 HydrophobicContact CD1-CD1 3.82Å; F185-F283 HydrophobicContact CD2-CD1 4.26Å; F185-F283 HydrophobicContact CD2-CE1 4.28Å; F185-F283 AromaticContact CE1-CD1 3.66Å; F185-F283 HydrophobicContact CE1-CD1 3.66Å; F185-F283 HydrophobicContact CE1-CE1 4.24Å; F185-F283 HydrophobicContact CE2-CD1 4.13Å; F185-F283 AromaticContact CE2-CE1 3.94Å; F185-F283 HydrophobicContact CE2-CE1 3.94Å; F185-F283 HydrophobicContact CG-CD1 4.11Å; F185-F283 AromaticContact CZ-CD1 3.83Å; F185-F283 HydrophobicContact CZ-CD1 3.83Å; F185-F283 AromaticContact CZ-CE1 3.92Å; F185-F283 HydrophobicContact CZ-CE1 3.92Å; I224-F283 HydrophobicContact CD1-CB 4.07Å; I224-F283 HydrophobicContact CG1-CB 4.25Å; I224-F283 HydrophobicContact CG2-CB 3.83Å; I224-F283 HydrophobicContact CG2-CD2 3.82Å; I224-F283 HydrophobicContact CG2-CG 4.15Å; I228-F283 HydrophobicContact CG1-CD2 4.44Å; I228-F283 HydrophobicContact CG1-CE2 4.21Å; C232-F283 HydrophobicContact CB-CE2 4.08Å; C232-F283 HydrophobicContact CB-CZ 3.88Å; Y234-F283 HydrophobicContact CD2-CE1 4.2Å; Y234-F283 AromaticContact CD2-CE2 3.78Å; Y234-F283 HydrophobicContact CD2-CE2 3.78Å; Y234-F283 AromaticContact CD2-CZ 3.56Å; Y234-F283 HydrophobicContact CD2-CZ 3.56Å; Y234-F283 HydrophobicContact CE2-CD1 4.41Å; Y234-F283 AromaticContact CE2-CE1 3.57Å; Y234-F283 HydrophobicContact CE2-CE1 3.57Å; Y234-F283 HydrophobicContact CE2-CE2 4.03Å; Y234-F283 AromaticContact CE2-CZ 3.36Å; Y234-F283 HydrophobicContact CE2-CZ 3.36Å; A279-F283 VanDerWaalsContact O-CD2 3.26Å; A279-F283 WeakPolarHBondContact O-CD2 3.42Å; A279-F283 PolarHBondContact O-N 3.43Å; A279-F283 VanDerWaalsContact O-N 3.08Å; K280-F283 PolarHBondContact O-N 2.84Å
284	L	96.6	Very high	96.1	Very high	71 Å²	71	59.1 Å²	59.1	37%	0.372	32%	0.317	S	S	.	.	H	α-helix	trans	-72	-42	178.8	-72.3	172	0	0	0	112.5	I224 K280 K281 L282	I224-L284 HydrophobicContact CD1-CD2 3.47Å; I224-L284 VanDerWaalsContact CD1-CD2 3.47Å; I224-L284 HydrophobicContact CD1-CG 3.83Å; K280-L284 HydrophobicContact CG-CD1 4.06Å; K280-L284 WeakPolarHBondContact O-CG 3.3Å; K280-L284 PolarHBondContact O-N 3.43Å; K281-L284 PolarHBondContact O-N 2.87Å; L282-L284 VanDerWaalsContact C-N 3.35Å
285	N	95.8	Very high	96.3	Very high	121 Å²	121	64.7 Å²	64.7	65%	0.647	34%	0.344	S	S	*	.	S	Bend	trans	-132.2	67.8	-174.5	-57.6	-68.3	0	0	0	111	K281 L282	K281-N285 PolarHBondContact O-N 3Å; L282-N285 CarbonylContact O-C 3.57Å
286	P	96	Very high	96.4	Very high	23 Å²	23	63.4 Å²	63.4	15%	0.149	33%	0.334	C	S	.	.			trans	-67.6	153.5	178	28.2	-34.7	0	0	0	111.2	A161 F185 L282 V288	A161-P286 HydrophobicContact CB-CB 3.79Å; A161-P286 HydrophobicContact CB-CG 4.11Å; F185-P286 HydrophobicContact CD1-CB 4.04Å; F185-P286 HydrophobicContact CD1-CG 3.97Å; F185-P286 HydrophobicContact CE1-CB 3.8Å; F185-P286 HydrophobicContact CE1-CG 4.25Å; L282-P286 VanDerWaalsContact O-CA 3.28Å; L282-P286 WeakPolarHBondContact O-CA 3.23Å; L282-P286 WeakPolarHBondContact O-CD 3.49Å; P286-V288 HydrophobicContact CB-CG1 4.11Å; P286-V288 HydrophobicContact CG-CG1 3.97Å; P286-V288 PolarHBondContact O-N 3.3Å; P286-V288 VanDerWaalsContact O-N 3.16Å
287	E	96.4	Very high	96.4	Very high	134 Å²	134	67.6 Å²	67.6	63%	0.626	35%	0.353	S	S	*	.			trans	-70.5	109.1	168.7	-169.1	-179.8	176.2	0	0	109.1	P156	P156-E287 HydrophobicContact CB-CG 4.03Å; P156-E287 HydrophobicContact CG-CG 4Å; P156-E287 WeakPolarHBondContact CG-O 3.37Å
288	V	97.4	Very high	96.3	Very high	43 Å²	43	64.5 Å²	64.5	26%	0.261	34%	0.336	S	S	.	.			trans	-140.7	151.5	-177.3	-66.6	0	0	0	0	110.4	A161 Q162 V165 P286	A161-V288 HydrophobicContact CB-CG1 4.23Å; Q162-V288 HydrophobicContact CB-CG1 4.37Å; V165-V288 HydrophobicContact CG1-CG2 4.33Å; V165-V288 HydrophobicContact CG2-CB 4.48Å; V165-V288 HydrophobicContact CG2-CG1 4.16Å; V165-V288 HydrophobicContact CG2-CG2 4.06Å; P286-V288 HydrophobicContact CB-CG1 4.11Å; P286-V288 HydrophobicContact CG-CG1 3.97Å; P286-V288 PolarHBondContact O-N 3.3Å; P286-V288 VanDerWaalsContact O-N 3.16Å
289	T	97.3	Very high	96.3	Very high	49 Å²	49	64.9 Å²	64.9	30%	0.301	34%	0.338	S	S	.	.			trans	-71.3	134.4	166	-57.6	0	0	0	0	109.3	Q162 P291 S293 I294	Q162-T289 PolarHBondContact NE2-O 3.37Å; Q162-T289 VanDerWaalsContact NE2-O 3.1Å; T289-P291 VanDerWaalsContact O-N 3.17Å; T289-S293 WeakPolarHBondContact CG2-OG 3.37Å; T289-I294 HydrophobicContact CG2-CD1 3.96Å; T289-I294 HydrophobicContact CG2-CG1 3.95Å
290	D	96.7	Very high	96.3	Very high	89 Å²	89	70.9 Å²	70.9	48%	0.476	37%	0.366	S	S	.	.			trans	-54.2	121.1	176.5	174.6	3.2	0	0	0	109.4	S292 S293	D290-S292 PolarHBondContact O-N 3.41Å; D290-S292 VanDerWaalsContact O-N 3.13Å; D290-S292 WeakPolarHBondContact OD1-CB 3.38Å; D290-S292 PolarHBondContact OD1-N 3.03Å; D290-S292 PolarHBondContact OD1-OG 2.91Å; D290-S292 PolarHBondContact OD2-OG 3.48Å; D290-S293 PolarHBondContact O-N 2.94Å; D290-S293 VanDerWaalsContact O-N 3.16Å; D290-S293 PolarHBondContact O-OG 3.04Å
291	P	95.9	Very high	96.3	Very high	21 Å²	21	70 Å²	70	14%	0.136	36%	0.364	C	S	.	.	G	3₁₀ helix	trans	-55.8	-33.5	-179.5	22.2	-33.1	0	0	0	111.5	V165 L166 S169 K171 T289 S293 I294	V165-P291 HydrophobicContact CG1-CB 4.23Å; V165-P291 HydrophobicContact CG1-CG 3.71Å; L166-P291 HydrophobicContact CD2-CB 4.24Å; S169-P291 VanDerWaalsContact OG-CB 3.29Å; S169-P291 WeakPolarHBondContact OG-CB 3.27Å; K171-P291 HydrophobicContact CD-CB 4.37Å; K171-P291 VanDerWaalsContact CD-O 3.29Å; K171-P291 WeakPolarHBondContact CD-O 3.44Å; K171-P291 WeakPolarHBondContact CE-O 3.49Å; K171-P291 PolarHBondContact NZ-O 2.73Å; T289-P291 VanDerWaalsContact O-N 3.17Å; P291-S293 PolarHBondContact O-N 3.45Å; P291-I294 PolarHBondContact O-N 3.01Å
292	S	95.2	Very high	96.3	Very high	83 Å²	83	67.3 Å²	67.3	58%	0.58	36%	0.357	S	S	*	.	G	3₁₀ helix	trans	-55.2	-39.8	-178.6	84.6	0	0	0	0	112.7	K171 D290 I294	K171-S292 PolarHBondContact NZ-O 3.27Å; D290-S292 PolarHBondContact O-N 3.41Å; D290-S292 VanDerWaalsContact O-N 3.13Å; D290-S292 WeakPolarHBondContact OD1-CB 3.38Å; D290-S292 PolarHBondContact OD1-N 3.03Å; D290-S292 PolarHBondContact OD1-OG 2.91Å; D290-S292 PolarHBondContact OD2-OG 3.48Å; S292-I294 VanDerWaalsContact C-N 3.3Å; S292-I294 PolarHBondContact O-N 3.28Å
293	S	96.5	Very high	96.3	Very high	80 Å²	80	68.8 Å²	68.8	56%	0.559	36%	0.363	S	S	*	.	G	3₁₀ helix	trans	-71.4	-17.5	-179.7	73.6	0	0	0	0	114.7	T289 D290 P291 E295	T289-S293 WeakPolarHBondContact CG2-OG 3.37Å; D290-S293 PolarHBondContact O-N 2.94Å; D290-S293 VanDerWaalsContact O-N 3.16Å; D290-S293 PolarHBondContact O-OG 3.04Å; P291-S293 PolarHBondContact O-N 3.45Å; S293-E295 PolarHBondContact O-N 2.85Å
294	I	96.3	Very high	96.3	Very high	18 Å²	18	74.1 Å²	74.1	9%	0.092	39%	0.388	C	S	.	.			trans	-89.3	107.9	-173.7	-61.3	170.4	0	0	0	111.2	V153 L166 K171 T289 P291 S292 L296	V153-I294 HydrophobicContact CG1-CD1 3.94Å; V153-I294 HydrophobicContact CG2-CG2 3.68Å; L166-I294 HydrophobicContact CD2-CB 4.43Å; L166-I294 HydrophobicContact CD2-CD1 3.91Å; L166-I294 HydrophobicContact CD2-CG2 4.35Å; K171-I294 PolarHBondContact NZ-O 3.12Å; T289-I294 HydrophobicContact CG2-CD1 3.96Å; T289-I294 HydrophobicContact CG2-CG1 3.95Å; P291-I294 PolarHBondContact O-N 3.01Å; S292-I294 VanDerWaalsContact C-N 3.3Å; S292-I294 PolarHBondContact O-N 3.28Å; I294-L296 HydrophobicContact CG2-CD2 3.63Å; I294-L296 HydrophobicContact CG2-CG 4.28Å
295	E	95.5	Very high	96.4	Very high	136 Å²	136	71.4 Å²	71.4	64%	0.636	38%	0.377	S	S	*	.			trans	-90.1	124.3	172.5	-164	-178	-166.5	0	0	111.3	S293 K297	S293-E295 PolarHBondContact O-N 2.85Å; E295-K297 HydrophobicContact CG-CG 4.41Å; E295-K297 WeakPolarHBondContact OE1-CE 3.3Å; E295-K297 IonicContact OE1-NZ 2.78Å; E295-K297 PolarHBondContact OE1-NZ 3.42Å; E295-K297 WeakPolarHBondContact OE2-CE 3.3Å; E295-K297 IonicContact OE2-NZ 2.91Å; E295-K297 PolarHBondContact OE2-NZ 3.3Å
296	L	96.4	Very high	96.5	Very high	30 Å²	30	65.7 Å²	65.7	16%	0.157	35%	0.346	C	S	.	.			trans	-103.9	112.8	-179.8	-57.7	-177.1	0	0	0	110.5	V82 P151 V153 V172 I294 W298	V82-L296 HydrophobicContact CB-CD1 4.35Å; V82-L296 HydrophobicContact CB-CD2 4.28Å; V82-L296 HydrophobicContact CG1-CD1 4.02Å; V82-L296 HydrophobicContact CG2-CD2 3.64Å; P151-L296 HydrophobicContact CB-CD2 4.5Å; V153-L296 HydrophobicContact CG2-CD2 4.17Å; V172-L296 HydrophobicContact CG1-CD1 4.05Å; I294-L296 HydrophobicContact CG2-CD2 3.63Å; I294-L296 HydrophobicContact CG2-CG 4.28Å; L296-W298 HydrophobicContact CB-CH2 3.72Å; L296-W298 HydrophobicContact CB-CZ3 3.65Å; L296-W298 HydrophobicContact CD1-CH2 4.11Å
297	K	95.7	Very high	96.6	Very high	110 Å²	110	64.8 Å²	64.8	48%	0.478	34%	0.34	S	S	.	.			trans	-124.6	132.2	178.8	-76	173.7	167.6	148.7	0	110.8	P151 E295	P151-K297 WeakPolarHBondContact CB-O 3.47Å; P151-K297 WeakPolarHBondContact CD-O 3.24Å; P151-K297 WeakPolarHBondContact CG-O 3.27Å; E295-K297 HydrophobicContact CG-CG 4.41Å; E295-K297 WeakPolarHBondContact OE1-CE 3.3Å; E295-K297 IonicContact OE1-NZ 2.78Å; E295-K297 PolarHBondContact OE1-NZ 3.42Å; E295-K297 WeakPolarHBondContact OE2-CE 3.3Å; E295-K297 IonicContact OE2-NZ 2.91Å; E295-K297 PolarHBondContact OE2-NZ 3.3Å
298	W	95.2	Very high	96.6	Very high	57 Å²	57	63.8 Å²	63.8	22%	0.216	34%	0.336	C	S	.	.			trans	-105.1	108.6	174.6	-71.2	-97.3	0	0	0	109.2	K30 K80 P81 V82 G149 P151 L296 K332	K30-W298 HydrophobicContact CD-CH2 4.02Å; K30-W298 HydrophobicContact CD-CZ3 4.32Å; K30-W298 HydrophobicContact CG-CH2 4.06Å; K80-W298 HydrophobicContact CB-CD2 4.28Å; K80-W298 HydrophobicContact CB-CH2 4.35Å; K80-W298 HydrophobicContact CB-CZ2 3.77Å; K80-W298 WeakPolarHBondContact O-CZ2 3.45Å; P81-W298 WeakPolarHBondContact O-CZ2 3.48Å; P81-W298 PolarHBondContact O-NE1 3.03Å; V82-W298 HydrophobicContact CB-CZ2 4.35Å; G149-W298 CarbonylContact O-C 3.45Å; G149-W298 WeakPolarHBondContact O-CA 3.39Å; P151-W298 VanDerWaalsContact CD-NE1 3.31Å; P151-W298 HydrophobicContact CG-CD2 3.9Å; P151-W298 HydrophobicContact CG-CE3 4.4Å; P151-W298 HydrophobicContact CG-CG 4.28Å; P151-W298 HydrophobicContact CG-CH2 4.31Å; P151-W298 HydrophobicContact CG-CZ2 3.79Å; L296-W298 HydrophobicContact CB-CH2 3.72Å; L296-W298 HydrophobicContact CB-CZ3 3.65Å; L296-W298 HydrophobicContact CD1-CH2 4.11Å; W298-K332 PolarHBondContact O-NZ 3.3Å
299	N	95.4	Very high	96.7	Very high	95 Å²	95	62 Å²	62	51%	0.508	33%	0.325	S	S	.	.			trans	-91.2	174.8	-173.4	-63	-32.1	0	0	0	111.5	G149 K332	G149-N299 PolarHBondContact O-N 3.13Å; N299-K332 WeakPolarHBondContact O-CD 3.44Å; N299-K332 PolarHBondContact O-NZ 3.22Å
300	E	94.8	Very high	96.7	Very high	127 Å²	127	59.8 Å²	59.8	59%	0.593	31%	0.311	S	S	*	.			trans	-73.7	144	173	-64.7	-172.3	170.7	0	0	108.6	K332	E300-K332 HydrophobicContact CG-CD 3.9Å; E300-K332 VanDerWaalsContact CG-CE 3.49Å
301	P	96.8	Very high	96.6	Very high	21 Å²	21	56.2 Å²	56.2	14%	0.136	29%	0.293	C	S	.	.			trans	-67.2	136.8	174.6	30.1	-35.2	0	0	0	110.1	L147 E303 L306 L328 L329	L147-P301 CarbonylContact O-C 3.47Å; L147-P301 WeakPolarHBondContact O-CA 3.26Å; P301-E303 PolarHBondContact O-N 3.27Å; P301-L306 HydrophobicContact CB-CD1 4.37Å; P301-L328 HydrophobicContact CB-CB 4.15Å; P301-L328 HydrophobicContact CB-CD1 4.06Å; P301-L328 HydrophobicContact CG-CB 3.88Å; P301-L329 HydrophobicContact CG-CB 4.17Å
302	D	97.6	Very high	96.6	Very high	82 Å²	82	61 Å²	61	44%	0.439	31%	0.313	S	S	.	.			trans	-83.9	93.9	170.1	-179.7	1.8	0	0	0	108.9	L147 E304 G305 L306	L147-D302 HydrophobicContact CD2-CB 4.16Å; L147-D302 PolarHBondContact O-N 3.3Å; D302-E304 PolarHBondContact OD1-N 3.1Å; D302-G305 PolarHBondContact O-N 3.1Å; D302-G305 PolarHBondContact OD1-N 3.2Å; D302-L306 WeakPolarHBondContact O-CB 3.33Å; D302-L306 VanDerWaalsContact O-CG 3.24Å; D302-L306 WeakPolarHBondContact O-CG 3.45Å; D302-L306 PolarHBondContact O-N 3.01Å
303	E	97.2	Very high	96.5	Very high	53 Å²	53	61.7 Å²	61.7	25%	0.248	31%	0.306	C	S	.	.	H	α-helix	trans	-60.5	-45.8	-176.7	-178	173.4	162.5	0	0	112.2	P301 L306 V307 R322 A325	P301-E303 PolarHBondContact O-N 3.27Å; E303-L306 WeakPolarHBondContact O-CB 3.47Å; E303-L306 PolarHBondContact O-N 2.88Å; E303-V307 WeakPolarHBondContact O-CG2 3.45Å; E303-V307 PolarHBondContact O-N 3.44Å; E303-R322 IonicContact OE1-CZ 3.57Å; E303-R322 IonicContact OE1-NH1 3.47Å; E303-R322 PolarHBondContact OE1-NH1 2.87Å; E303-A325 HydrophobicContact CB-CB 4.16Å; E303-A325 HydrophobicContact CG-CB 3.87Å
304	E	97.7	Very high	96.4	Very high	113 Å²	113	58 Å²	58	53%	0.528	28%	0.28	S	S	.	.	H	α-helix	trans	-71.2	-38.9	-178.1	-63.2	-52.5	129.5	0	0	111.2	D302 L306 V307 E308 R322	D302-E304 PolarHBondContact OD1-N 3.1Å; E304-L306 VanDerWaalsContact C-N 3.32Å; E304-L306 PolarHBondContact O-N 2.76Å; E304-V307 PolarHBondContact O-N 3.5Å; E304-E308 PolarHBondContact O-N 3.25Å; E304-R322 IonicContact OE1-CZ 3.79Å; E304-R322 IonicContact OE1-NH1 3Å; E304-R322 PolarHBondContact OE1-NH1 2.91Å; E304-R322 IonicContact OE1-NH2 3.71Å; E304-R322 PolarHBondContact OE1-NH2 3.48Å; E304-R322 IonicContact OE2-NH1 2.8Å; E304-R322 IonicContact OE2-NH2 3.28Å; E304-R322 PolarHBondContact OE2-NH2 3.35Å
305	G	98	Very high	96.3	Very high	15 Å²	15	60.2 Å²	60.2	16%	0.155	31%	0.307	C	S	.	.	H	α-helix	trans	-63.4	-36.1	173.1	0	0	0	0	0	113.1	L147 D302 F309	L147-G305 WeakPolarHBondContact CD1-O 3.44Å; D302-G305 PolarHBondContact O-N 3.1Å; D302-G305 PolarHBondContact OD1-N 3.2Å; G305-F309 VanDerWaalsContact O-CB 3.27Å; G305-F309 WeakPolarHBondContact O-CB 3.14Å; G305-F309 PolarHBondContact O-N 2.89Å
306	L	98.2	Very high	96.3	Very high	0 Å²	0	55.3 Å²	55.3	0%	0	28%	0.283	C	S	.	.	H	α-helix	trans	-64.2	-41.2	172.6	-77	170.2	0	0	0	112.3	F68 L144 L147 M148 P301 D302 E303 E304 L310 I321 A325	F68-L306 HydrophobicContact CE2-CD1 4.37Å; F68-L306 HydrophobicContact CE2-CD2 4.3Å; L144-L306 HydrophobicContact CD1-CD2 3.66Å; L147-L306 HydrophobicContact CB-CD2 3.64Å; L147-L306 HydrophobicContact CB-CG 3.93Å; M148-L306 HydrophobicContact CG-CD2 3.89Å; P301-L306 HydrophobicContact CB-CD1 4.37Å; D302-L306 WeakPolarHBondContact O-CB 3.33Å; D302-L306 VanDerWaalsContact O-CG 3.24Å; D302-L306 WeakPolarHBondContact O-CG 3.45Å; D302-L306 PolarHBondContact O-N 3.01Å; E303-L306 WeakPolarHBondContact O-CB 3.47Å; E303-L306 PolarHBondContact O-N 2.88Å; E304-L306 VanDerWaalsContact C-N 3.32Å; E304-L306 PolarHBondContact O-N 2.76Å; L306-L310 HydrophobicContact CD2-CD1 4.28Å; L306-L310 VanDerWaalsContact O-CB 3.28Å; L306-L310 WeakPolarHBondContact O-CB 3.03Å; L306-L310 PolarHBondContact O-N 3.29Å; L306-I321 HydrophobicContact CB-CG2 4.1Å; L306-A325 HydrophobicContact CD1-CB 4.05Å
307	V	97.9	Very high	96.2	Very high	4 Å²	4	57.9 Å²	57.9	2%	0.024	30%	0.297	C	S	.	.	I	π-helix	trans	-66.6	-47.8	177.8	170.9	0	0	0	0	110.6	E303 E304 F309 C311 H312 E318 I321 R322	E303-V307 WeakPolarHBondContact O-CG2 3.45Å; E303-V307 PolarHBondContact O-N 3.44Å; E304-V307 PolarHBondContact O-N 3.5Å; V307-F309 VanDerWaalsContact C-N 3.35Å; V307-F309 PolarHBondContact O-N 3.15Å; V307-C311 HydrophobicContact CG1-CB 4.24Å; V307-C311 WeakPolarHBondContact O-CA 3.27Å; V307-C311 WeakPolarHBondContact O-CB 3.39Å; V307-C311 PolarHBondContact O-N 3.35Å; V307-H312 PolarHBondContact O-N 2.98Å; V307-E318 HydrophobicContact CG1-CG 3.93Å; V307-E318 HydrophobicContact CG2-CG 4.33Å; V307-I321 HydrophobicContact CG2-CG2 4.28Å; V307-R322 HydrophobicContact CG2-CG 3.79Å
308	E	97.6	Very high	96.3	Very high	113 Å²	113	56.7 Å²	56.7	53%	0.528	29%	0.293	S	S	.	.	I	π-helix	trans	-56.5	-49.7	176.3	-177.2	62.3	-153.7	0	0	111.2	E304 H312 K313	E304-E308 PolarHBondContact O-N 3.25Å; E308-H312 WeakPolarHBondContact O-CB 3.36Å; E308-H312 PolarHBondContact O-N 3.32Å; E308-H312 IonicContact OE1-ND1 2.75Å; E308-H312 IonicContact OE2-CE1 3.98Å; E308-H312 PolarHBondContact OE2-CE1 3.25Å; E308-H312 IonicContact OE2-CG 2.75Å; E308-H312 IonicContact OE2-ND1 2.84Å; E308-H312 PolarHBondContact OE2-ND1 2.96Å; E308-K313 PolarHBondContact O-N 3.28Å
309	F	97.8	Very high	96.4	Very high	7 Å²	7	60.4 Å²	60.4	3%	0.031	31%	0.313	C	S	.	.	I	π-helix	trans	-70.9	-50.1	-176.2	-178.5	-113.8	0	0	0	113.1	L64 D140 Q143 L144 L147 G305 V307 K313 H314	L64-F309 HydrophobicContact CD1-CE1 4.3Å; L64-F309 HydrophobicContact CD1-CZ 4.42Å; L64-F309 HydrophobicContact CD2-CE1 3.72Å; L64-F309 HydrophobicContact CD2-CZ 4.13Å; D140-F309 HydrophobicContact CB-CZ 4.26Å; Q143-F309 HydrophobicContact CB-CE2 4.35Å; Q143-F309 HydrophobicContact CB-CZ 4.18Å; Q143-F309 VanDerWaalsContact CD-CD2 3.41Å; Q143-F309 HydrophobicContact CG-CD2 4.07Å; Q143-F309 HydrophobicContact CG-CE1 4.48Å; Q143-F309 HydrophobicContact CG-CE2 3.96Å; Q143-F309 HydrophobicContact CG-CG 4.38Å; Q143-F309 HydrophobicContact CG-CZ 4.18Å; Q143-F309 VanDerWaalsContact NE2-CD2 3.35Å; L144-F309 HydrophobicContact CB-CE1 4.03Å; L147-F309 HydrophobicContact CD1-CB 3.58Å; L147-F309 HydrophobicContact CD1-CD1 3.97Å; L147-F309 HydrophobicContact CD1-CG 3.89Å; G305-F309 VanDerWaalsContact O-CB 3.27Å; G305-F309 WeakPolarHBondContact O-CB 3.14Å; G305-F309 PolarHBondContact O-N 2.89Å; V307-F309 VanDerWaalsContact C-N 3.35Å; V307-F309 PolarHBondContact O-N 3.15Å; F309-K313 HydrophobicContact CD2-CD 4.05Å; F309-K313 HydrophobicContact CE2-CD 4.06Å; F309-K313 WeakPolarHBondContact O-CB 3.3Å; F309-H314 AromaticContact CE2-CD2 3.82Å; F309-H314 AromaticContact CE2-NE2 3.5Å; F309-H314 WeakPolarHBondContact CE2-NE2 3.33Å; F309-H314 AromaticContact CZ-CD2 3.82Å; F309-H314 AromaticContact CZ-NE2 3.57Å; F309-H314 PolarHBondContact O-CD2 3.26Å; F309-H314 PolarHBondContact O-N 3.4Å
310	L	97.5	Very high	96.4	Very high	2 Å²	2	63.9 Å²	63.9	1%	0.01	32%	0.319	C	S	.	.	I	π-helix	trans	-81.4	-42.9	-175.4	-65.6	175.7	0	0	0	111.6	L64 F68 L144 L306 H314 G315 F316 I321	L64-L310 HydrophobicContact CB-CD2 4.19Å; L64-L310 HydrophobicContact CD1-CD2 4.2Å; L64-L310 HydrophobicContact CD2-CD2 4.39Å; F68-L310 HydrophobicContact CD2-CD1 4.02Å; F68-L310 HydrophobicContact CE2-CD1 4.13Å; F68-L310 HydrophobicContact CG-CD1 4.32Å; L144-L310 HydrophobicContact CD1-CD1 3.87Å; L144-L310 HydrophobicContact CD1-CD2 4.12Å; L144-L310 HydrophobicContact CD1-CG 4.24Å; L306-L310 HydrophobicContact CD2-CD1 4.28Å; L306-L310 VanDerWaalsContact O-CB 3.28Å; L306-L310 WeakPolarHBondContact O-CB 3.03Å; L306-L310 PolarHBondContact O-N 3.29Å; L310-H314 CarbonylContact O-C 3.55Å; L310-H314 VanDerWaalsContact O-C 3.27Å; L310-H314 WeakPolarHBondContact O-CA 3.4Å; L310-H314 WeakPolarHBondContact O-CB 3.32Å; L310-H314 PolarHBondContact O-N 2.92Å; L310-G315 PolarHBondContact O-N 2.78Å; L310-G315 VanDerWaalsContact O-N 3.13Å; L310-F316 HydrophobicContact CB-CB 4.13Å; L310-F316 HydrophobicContact CB-CD2 3.77Å; L310-F316 HydrophobicContact CB-CG 4.27Å; L310-F316 HydrophobicContact CD2-CD2 3.86Å; L310-F316 HydrophobicContact CD2-CE2 3.9Å; L310-F316 HydrophobicContact CG-CD2 4.39Å; L310-F316 WeakPolarHBondContact O-CB 3.25Å; L310-F316 VanDerWaalsContact O-CD2 3.22Å; L310-F316 WeakPolarHBondContact O-CD2 3.39Å; L310-F316 PolarHBondContact O-N 3.21Å; L310-I321 HydrophobicContact CB-CD1 4.12Å; L310-I321 HydrophobicContact CB-CG1 4.01Å; L310-I321 HydrophobicContact CB-CG2 4.47Å; L310-I321 HydrophobicContact CD1-CD1 3.62Å; L310-I321 HydrophobicContact CD1-CG1 4.19Å; L310-I321 HydrophobicContact CD1-CG2 4.08Å
311	C	96	Very high	96.5	Very high	14 Å²	14	58 Å²	58	10%	0.095	29%	0.291	C	S	.	.	I	π-helix	trans	-83.5	-55.6	-172.8	-55.6	0	0	0	0	111.6	V307 G315 F316 E318 I321	V307-C311 HydrophobicContact CG1-CB 4.24Å; V307-C311 WeakPolarHBondContact O-CA 3.27Å; V307-C311 WeakPolarHBondContact O-CB 3.39Å; V307-C311 PolarHBondContact O-N 3.35Å; C311-G315 VanDerWaalsContact O-CA 3.29Å; C311-G315 WeakPolarHBondContact O-CA 3.45Å; C311-G315 PolarHBondContact O-N 3.4Å; C311-F316 WeakPolarHBondContact CA-O 3.33Å; C311-F316 WeakPolarHBondContact CB-O 3.16Å; C311-F316 PolarHBondContact SG-O 3.3Å; C311-E318 HydrophobicContact CB-CB 4.45Å; C311-E318 WeakPolarHBondContact SG-CA 3.3Å; C311-I321 VanDerWaalsContact SG-CG1 3.51Å
312	H	94.5	Very high	96.6	Very high	121 Å²	121	59.6 Å²	59.6	56%	0.56	30%	0.295	S	S	*	.	I	π-helix	trans	-72.9	-44.1	-174.1	-58.2	165.9	0	0	0	112	V307 E308	V307-H312 PolarHBondContact O-N 2.98Å; E308-H312 WeakPolarHBondContact O-CB 3.36Å; E308-H312 PolarHBondContact O-N 3.32Å; E308-H312 IonicContact OE1-ND1 2.75Å; E308-H312 IonicContact OE2-CE1 3.98Å; E308-H312 PolarHBondContact OE2-CE1 3.25Å; E308-H312 IonicContact OE2-CG 2.75Å; E308-H312 IonicContact OE2-ND1 2.84Å; E308-H312 PolarHBondContact OE2-ND1 2.96Å
313	K	94.3	Very high	96.5	Very high	98 Å²	98	59.1 Å²	59.1	43%	0.426	29%	0.293	S	S	.	.	I	π-helix	trans	-83	-42.6	-179.2	-177.4	-171.6	178.1	-154.5	0	113.7	D140 E308 F309	D140-K313 IonicContact OD1-NZ 3.75Å; E308-K313 PolarHBondContact O-N 3.28Å; F309-K313 HydrophobicContact CD2-CD 4.05Å; F309-K313 HydrophobicContact CE2-CD 4.06Å; F309-K313 WeakPolarHBondContact O-CB 3.3Å
314	H	94.5	Very high	96.5	Very high	3 Å²	3	56.7 Å²	56.7	1%	0.014	28%	0.282	C	S	.	.	T	Hydrogen-bonded Turn	trans	-107.4	4.3	-172.9	-68.2	-68.5	0	0	0	114.9	T61 L64 D140 F309 L310 F316	T61-H314 HydrophobicContact CG2-CB 4.04Å; L64-H314 HydrophobicContact CD1-CB 4.1Å; L64-H314 VanDerWaalsContact CD1-CD2 3.45Å; L64-H314 WeakPolarHBondContact CD1-CD2 3.38Å; D140-H314 IonicContact OD1-NE2 3.04Å; F309-H314 AromaticContact CE2-CD2 3.82Å; F309-H314 AromaticContact CE2-NE2 3.5Å; F309-H314 WeakPolarHBondContact CE2-NE2 3.33Å; F309-H314 AromaticContact CZ-CD2 3.82Å; F309-H314 AromaticContact CZ-NE2 3.57Å; F309-H314 PolarHBondContact O-CD2 3.26Å; F309-H314 PolarHBondContact O-N 3.4Å; L310-H314 CarbonylContact O-C 3.55Å; L310-H314 VanDerWaalsContact O-C 3.27Å; L310-H314 WeakPolarHBondContact O-CA 3.4Å; L310-H314 WeakPolarHBondContact O-CB 3.32Å; L310-H314 PolarHBondContact O-N 2.92Å; H314-F316 VanDerWaalsContact C-N 3.34Å; H314-F316 HydrophobicContact CB-CD2 3.85Å; H314-F316 HydrophobicContact CB-CE2 3.84Å; H314-F316 PolarHBondContact O-N 3.23Å
315	G	94	Very high	96.5	Very high	64 Å²	64	51.4 Å²	51.4	66%	0.66	26%	0.257	S	S	*	.			trans	72.3	20.3	171.1	0	0	0	0	0	115.2	L310 C311	L310-G315 PolarHBondContact O-N 2.78Å; L310-G315 VanDerWaalsContact O-N 3.13Å; C311-G315 VanDerWaalsContact O-CA 3.29Å; C311-G315 WeakPolarHBondContact O-CA 3.45Å; C311-G315 PolarHBondContact O-N 3.4Å
316	F	94.9	Very high	96.4	Very high	32 Å²	32	56.2 Å²	56.2	14%	0.14	27%	0.274	C	S	.	.			trans	-73.6	151.5	175.1	-72.3	-77.7	0	0	0	112.4	T61 L64 M65 L310 C311 H314 E318 I321	T61-F316 HydrophobicContact CG2-CE2 4.4Å; L64-F316 HydrophobicContact CB-CE2 3.98Å; L64-F316 HydrophobicContact CB-CZ 4.08Å; L64-F316 HydrophobicContact CD1-CE2 4.18Å; M65-F316 HydrophobicContact CB-CE1 3.77Å; M65-F316 HydrophobicContact CB-CZ 3.96Å; M65-F316 HydrophobicContact CG-CE1 4.09Å; M65-F316 HydrophobicContact SD-CE1 4.17Å; L310-F316 HydrophobicContact CB-CB 4.13Å; L310-F316 HydrophobicContact CB-CD2 3.77Å; L310-F316 HydrophobicContact CB-CG 4.27Å; L310-F316 HydrophobicContact CD2-CD2 3.86Å; L310-F316 HydrophobicContact CD2-CE2 3.9Å; L310-F316 HydrophobicContact CG-CD2 4.39Å; L310-F316 WeakPolarHBondContact O-CB 3.25Å; L310-F316 VanDerWaalsContact O-CD2 3.22Å; L310-F316 WeakPolarHBondContact O-CD2 3.39Å; L310-F316 PolarHBondContact O-N 3.21Å; C311-F316 WeakPolarHBondContact CA-O 3.33Å; C311-F316 WeakPolarHBondContact CB-O 3.16Å; C311-F316 PolarHBondContact SG-O 3.3Å; H314-F316 VanDerWaalsContact C-N 3.34Å; H314-F316 HydrophobicContact CB-CD2 3.85Å; H314-F316 HydrophobicContact CB-CE2 3.84Å; H314-F316 PolarHBondContact O-N 3.23Å; F316-E318 PolarHBondContact O-N 2.93Å; F316-I321 HydrophobicContact CB-CD1 4.04Å; F316-I321 HydrophobicContact CB-CG1 3.95Å; F316-I321 HydrophobicContact CG-CD1 4.45Å
317	N	95.5	Very high	96.2	Very high	84 Å²	84	60.8 Å²	60.8	45%	0.449	29%	0.294	S	S	.	.			trans	-68.3	121.1	176.2	174.9	-85.9	0	0	0	111.7	E319 R320 I321	N317-E319 PolarHBondContact O-N 3.4Å; N317-E319 WeakPolarHBondContact OD1-CB 3.29Å; N317-E319 PolarHBondContact OD1-N 2.82Å; N317-R320 HydrophobicContact CB-CB 4.38Å; N317-R320 HydrophobicContact CB-CG 4.3Å; N317-R320 PolarHBondContact O-N 3.19Å; N317-R320 WeakPolarHBondContact OD1-CG 3.47Å; N317-R320 PolarHBondContact OD1-N 3.04Å; N317-I321 PolarHBondContact O-N 3.17Å; N317-I321 VanDerWaalsContact O-N 3.15Å
318	E	97.1	Very high	96.1	Very high	85 Å²	85	60.9 Å²	60.9	40%	0.397	29%	0.294	S	S	.	.	H	α-helix	trans	-58.5	-45.7	-175.5	-173.6	179.3	167.1	0	0	113.9	V307 C311 F316 R320 I321 R322	V307-E318 HydrophobicContact CG1-CG 3.93Å; V307-E318 HydrophobicContact CG2-CG 4.33Å; C311-E318 HydrophobicContact CB-CB 4.45Å; C311-E318 WeakPolarHBondContact SG-CA 3.3Å; F316-E318 PolarHBondContact O-N 2.93Å; E318-R320 VanDerWaalsContact C-N 3.25Å; E318-R320 PolarHBondContact O-N 2.89Å; E318-I321 PolarHBondContact O-N 3.03Å; E318-I321 VanDerWaalsContact O-N 3.08Å; E318-R322 HydrophobicContact CG-CG 4.23Å; E318-R322 WeakPolarHBondContact O-CG 3.47Å; E318-R322 PolarHBondContact O-N 2.97Å; E318-R322 IonicContact OE1-CZ 2.75Å; E318-R322 IonicContact OE1-NE 3.95Å; E318-R322 PolarHBondContact OE1-NE 3.35Å; E318-R322 IonicContact OE1-NH2 3.35Å; E318-R322 PolarHBondContact OE1-NH2 2.97Å
319	E	96.9	Very high	95.9	Very high	136 Å²	136	58.6 Å²	58.6	64%	0.636	29%	0.285	S	S	*	.	H	α-helix	trans	-56.9	-42.5	179.5	-171	-168.6	165.6	0	0	111.3	N317 N323	N317-E319 PolarHBondContact O-N 3.4Å; N317-E319 WeakPolarHBondContact OD1-CB 3.29Å; N317-E319 PolarHBondContact OD1-N 2.82Å; E319-N323 VanDerWaalsContact O-CB 3.3Å; E319-N323 WeakPolarHBondContact O-CB 3.44Å; E319-N323 PolarHBondContact O-N 3.43Å; E319-N323 PolarHBondContact O-ND2 3.35Å; E319-N323 VanDerWaalsContact O-ND2 3.14Å
320	R	95.6	Very high	95.7	Very high	167 Å²	167	65.8 Å²	65.8	63%	0.63	32%	0.316	S	S	*	.	H	α-helix	trans	-66	-41	177.1	-69.9	-178.5	-174.5	-175	1.3	112.4	N317 E318 N323 G324	N317-R320 HydrophobicContact CB-CB 4.38Å; N317-R320 HydrophobicContact CB-CG 4.3Å; N317-R320 PolarHBondContact O-N 3.19Å; N317-R320 WeakPolarHBondContact OD1-CG 3.47Å; N317-R320 PolarHBondContact OD1-N 3.04Å; E318-R320 VanDerWaalsContact C-N 3.25Å; E318-R320 PolarHBondContact O-N 2.89Å; R320-N323 PolarHBondContact O-N 3.27Å; R320-G324 PolarHBondContact O-N 2.86Å
321	I	97.5	Very high	95.3	Very high	3 Å²	3	66.6 Å²	66.6	2%	0.015	32%	0.323	C	S	.	.	H	α-helix	trans	-66.4	-47.6	178.4	-62.4	-46.5	0	0	0	110.8	F68 L306 V307 L310 C311 F316 N317 E318 N323 G324 A325	F68-I321 HydrophobicContact CD1-CD1 4.21Å; F68-I321 HydrophobicContact CE1-CD1 3.76Å; F68-I321 HydrophobicContact CZ-CD1 4.13Å; F68-I321 HydrophobicContact CZ-CG2 4.37Å; L306-I321 HydrophobicContact CB-CG2 4.1Å; V307-I321 HydrophobicContact CG2-CG2 4.28Å; L310-I321 HydrophobicContact CB-CD1 4.12Å; L310-I321 HydrophobicContact CB-CG1 4.01Å; L310-I321 HydrophobicContact CB-CG2 4.47Å; L310-I321 HydrophobicContact CD1-CD1 3.62Å; L310-I321 HydrophobicContact CD1-CG1 4.19Å; L310-I321 HydrophobicContact CD1-CG2 4.08Å; C311-I321 VanDerWaalsContact SG-CG1 3.51Å; F316-I321 HydrophobicContact CB-CD1 4.04Å; F316-I321 HydrophobicContact CB-CG1 3.95Å; F316-I321 HydrophobicContact CG-CD1 4.45Å; N317-I321 PolarHBondContact O-N 3.17Å; N317-I321 VanDerWaalsContact O-N 3.15Å; E318-I321 PolarHBondContact O-N 3.03Å; E318-I321 VanDerWaalsContact O-N 3.08Å; I321-N323 VanDerWaalsContact C-N 3.32Å; I321-N323 PolarHBondContact O-N 3.39Å; I321-G324 CarbonylContact O-C 3.56Å; I321-G324 WeakPolarHBondContact O-CA 2.91Å; I321-G324 PolarHBondContact O-N 3.37Å; I321-A325 PolarHBondContact O-N 2.88Å
322	R	97.8	Very high	94.8	Very high	56 Å²	56	69.9 Å²	69.9	21%	0.211	34%	0.336	C	S	.	.	H	α-helix	trans	-59.9	-41.3	175.9	-69.1	-170.5	177.9	-76.9	-1.6	112.1	E303 E304 V307 E318 G324 A325 K326	E303-R322 IonicContact OE1-CZ 3.57Å; E303-R322 IonicContact OE1-NH1 3.47Å; E303-R322 PolarHBondContact OE1-NH1 2.87Å; E304-R322 IonicContact OE1-CZ 3.79Å; E304-R322 IonicContact OE1-NH1 3Å; E304-R322 PolarHBondContact OE1-NH1 2.91Å; E304-R322 IonicContact OE1-NH2 3.71Å; E304-R322 PolarHBondContact OE1-NH2 3.48Å; E304-R322 IonicContact OE2-NH1 2.8Å; E304-R322 IonicContact OE2-NH2 3.28Å; E304-R322 PolarHBondContact OE2-NH2 3.35Å; V307-R322 HydrophobicContact CG2-CG 3.79Å; E318-R322 HydrophobicContact CG-CG 4.23Å; E318-R322 WeakPolarHBondContact O-CG 3.47Å; E318-R322 PolarHBondContact O-N 2.97Å; E318-R322 IonicContact OE1-CZ 2.75Å; E318-R322 IonicContact OE1-NE 3.95Å; E318-R322 PolarHBondContact OE1-NE 3.35Å; E318-R322 IonicContact OE1-NH2 3.35Å; E318-R322 PolarHBondContact OE1-NH2 2.97Å; R322-G324 VanDerWaalsContact C-N 3.3Å; R322-G324 PolarHBondContact O-N 2.63Å; R322-A325 PolarHBondContact O-N 3.01Å; R322-K326 WeakPolarHBondContact O-CG 3.39Å; R322-K326 PolarHBondContact O-N 2.94Å
323	N	97	Very high	94.1	Very high	72 Å²	72	69.3 Å²	69.3	39%	0.385	34%	0.337	S	S	.	.	H	α-helix	trans	-63	-37	173.9	-74.2	-25.4	0	0	0	112.3	E319 R320 I321 K327	E319-N323 VanDerWaalsContact O-CB 3.3Å; E319-N323 WeakPolarHBondContact O-CB 3.44Å; E319-N323 PolarHBondContact O-N 3.43Å; E319-N323 PolarHBondContact O-ND2 3.35Å; E319-N323 VanDerWaalsContact O-ND2 3.14Å; R320-N323 PolarHBondContact O-N 3.27Å; I321-N323 VanDerWaalsContact C-N 3.32Å; I321-N323 PolarHBondContact O-N 3.39Å; N323-K327 WeakPolarHBondContact O-CG 3.4Å; N323-K327 PolarHBondContact O-N 3.44Å
324	G	96.6	Very high	93.5	Very high	2 Å²	2	68 Å²	68	2%	0.021	34%	0.337	C	S	.	.	H	α-helix	trans	-64.7	-45.6	172.2	0	0	0	0	0	113.2	R320 I321 R322 K326 K327 L328	R320-G324 PolarHBondContact O-N 2.86Å; I321-G324 CarbonylContact O-C 3.56Å; I321-G324 WeakPolarHBondContact O-CA 2.91Å; I321-G324 PolarHBondContact O-N 3.37Å; R322-G324 VanDerWaalsContact C-N 3.3Å; R322-G324 PolarHBondContact O-N 2.63Å; G324-K326 PolarHBondContact O-N 3Å; G324-K327 WeakPolarHBondContact O-CB 3.14Å; G324-K327 PolarHBondContact O-N 3.41Å; G324-K327 VanDerWaalsContact O-N 3.16Å; G324-L328 PolarHBondContact O-N 3.14Å; G324-L328 VanDerWaalsContact O-N 3.09Å
325	A	96.5	Very high	92.1	Very high	1 Å²	1	74.1 Å²	74.1	1%	0.008	38%	0.375	C	S	.	.	H	α-helix	trans	-60.6	-43.9	176.6	0	0	0	0	0	112	E303 L306 I321 R322 K327 L328 L329	E303-A325 HydrophobicContact CB-CB 4.16Å; E303-A325 HydrophobicContact CG-CB 3.87Å; L306-A325 HydrophobicContact CD1-CB 4.05Å; I321-A325 PolarHBondContact O-N 2.88Å; R322-A325 PolarHBondContact O-N 3.01Å; A325-K327 VanDerWaalsContact C-N 3.28Å; A325-K327 PolarHBondContact O-N 3.18Å; A325-L328 WeakPolarHBondContact O-CB 3.32Å; A325-L328 PolarHBondContact O-N 3.49Å; A325-L328 VanDerWaalsContact O-N 3.14Å; A325-L329 PolarHBondContact O-N 2.84Å
326	K	95.8	Very high	90.7	Very high	117 Å²	117	73.5 Å²	73.5	51%	0.509	36%	0.359	S	S	.	.	H	α-helix	trans	-57.7	-39.1	173.9	-73.3	172.6	-174.8	173.3	0	112.8	R322 G324 L329 K330	R322-K326 WeakPolarHBondContact O-CG 3.39Å; R322-K326 PolarHBondContact O-N 2.94Å; G324-K326 PolarHBondContact O-N 3Å; K326-L329 PolarHBondContact O-N 3.25Å; K326-K330 VanDerWaalsContact O-CB 3.32Å; K326-K330 WeakPolarHBondContact O-CB 3.49Å; K326-K330 PolarHBondContact O-N 2.97Å
327	K	95.4	Very high	89.3	Confident	96 Å²	96	79.7 Å²	79.7	42%	0.417	39%	0.388	S	S	.	.	H	α-helix	trans	-65.3	-43.6	175.8	-72.7	171.6	165.5	-154.9	0	112	I72 E76 N323 G324 A325 K330 A331	I72-K327 HydrophobicContact CG2-CB 4.11Å; I72-K327 HydrophobicContact CG2-CD 4.11Å; E76-K327 HydrophobicContact CG-CB 4.33Å; E76-K327 VanDerWaalsContact OE1-CD 3.27Å; E76-K327 WeakPolarHBondContact OE1-CD 3.44Å; E76-K327 WeakPolarHBondContact OE1-CG 3.49Å; E76-K327 IonicContact OE1-NZ 2.86Å; E76-K327 IonicContact OE2-NZ 2.61Å; N323-K327 WeakPolarHBondContact O-CG 3.4Å; N323-K327 PolarHBondContact O-N 3.44Å; G324-K327 WeakPolarHBondContact O-CB 3.14Å; G324-K327 PolarHBondContact O-N 3.41Å; G324-K327 VanDerWaalsContact O-N 3.16Å; A325-K327 VanDerWaalsContact C-N 3.28Å; A325-K327 PolarHBondContact O-N 3.18Å; K327-K330 PolarHBondContact O-N 2.97Å; K327-A331 VanDerWaalsContact O-CB 3.29Å; K327-A331 WeakPolarHBondContact O-CB 3.47Å; K327-A331 PolarHBondContact O-N 3.48Å
328	L	95.1	Very high	87.9	Confident	5 Å²	5	77.7 Å²	77.7	3%	0.026	39%	0.387	C	S	.	.	H	α-helix	trans	-58.6	-48.9	174.8	-67.2	172.4	0	0	0	111.2	I72 I75 M148 P301 G324 A325 K330 A331 K332	I72-L328 HydrophobicContact CB-CD2 4.37Å; I72-L328 HydrophobicContact CD1-CG 4.48Å; I72-L328 HydrophobicContact CG1-CD1 4.24Å; I72-L328 HydrophobicContact CG1-CD2 3.59Å; I72-L328 HydrophobicContact CG1-CG 3.79Å; I75-L328 HydrophobicContact CB-CD2 4.37Å; I75-L328 HydrophobicContact CD1-CD2 3.66Å; I75-L328 HydrophobicContact CG2-CD2 4.33Å; M148-L328 HydrophobicContact CB-CD1 4.12Å; M148-L328 HydrophobicContact CE-CD1 3.72Å; M148-L328 HydrophobicContact CE-CD2 4.03Å; M148-L328 HydrophobicContact CE-CG 4.44Å; M148-L328 HydrophobicContact CG-CD1 4.08Å; P301-L328 HydrophobicContact CB-CB 4.15Å; P301-L328 HydrophobicContact CB-CD1 4.06Å; P301-L328 HydrophobicContact CG-CB 3.88Å; G324-L328 PolarHBondContact O-N 3.14Å; G324-L328 VanDerWaalsContact O-N 3.09Å; A325-L328 WeakPolarHBondContact O-CB 3.32Å; A325-L328 PolarHBondContact O-N 3.49Å; A325-L328 VanDerWaalsContact O-N 3.14Å; L328-K330 PolarHBondContact O-N 3.32Å; L328-A331 PolarHBondContact O-N 3.06Å; L328-K332 WeakPolarHBondContact O-CB 3.5Å; L328-K332 PolarHBondContact O-N 3.27Å
329	L	93.8	Very high	86.8	Confident	65 Å²	65	77.8 Å²	77.8	34%	0.34	38%	0.384	S	S	.	.	H	α-helix	trans	-61.6	-45.9	-180	-174.3	63.5	0	0	0	111.6	P301 A325 K326 A331 K332 N333	P301-L329 HydrophobicContact CG-CB 4.17Å; A325-L329 PolarHBondContact O-N 2.84Å; K326-L329 PolarHBondContact O-N 3.25Å; L329-A331 PolarHBondContact O-N 3.03Å; L329-K332 PolarHBondContact O-N 2.53Å; L329-N333 PolarHBondContact O-N 3.07Å; L329-N333 VanDerWaalsContact O-N 3.14Å; L329-N333 PolarHBondContact O-ND2 3.22Å
330	K	93.1	Very high	85.8	Confident	158 Å²	158	76.8 Å²	76.8	69%	0.687	38%	0.382	S	S	*	.	H	α-helix	trans	-60.9	-44.1	176.7	-177.5	-179.4	178	-178.7	0	112.3	K326 K327 L328 N333 T334	K326-K330 VanDerWaalsContact O-CB 3.32Å; K326-K330 WeakPolarHBondContact O-CB 3.49Å; K326-K330 PolarHBondContact O-N 2.97Å; K327-K330 PolarHBondContact O-N 2.97Å; L328-K330 PolarHBondContact O-N 3.32Å; K330-N333 PolarHBondContact O-N 3.31Å; K330-T334 PolarHBondContact O-N 2.86Å; K330-T334 PolarHBondContact O-OG1 2.8Å
331	A	89.8	Confident	84.9	Confident	19 Å²	19	71.8 Å²	71.8	16%	0.157	37%	0.368	C	S	.	.	H	α-helix	trans	-68.7	-35.8	-179.4	0	0	0	0	0	112.1	I75 K327 L328 L329 N333 T334	I75-A331 HydrophobicContact CG2-CB 3.61Å; K327-A331 VanDerWaalsContact O-CB 3.29Å; K327-A331 WeakPolarHBondContact O-CB 3.47Å; K327-A331 PolarHBondContact O-N 3.48Å; L328-A331 PolarHBondContact O-N 3.06Å; L329-A331 PolarHBondContact O-N 3.03Å; A331-N333 VanDerWaalsContact C-N 3.35Å; A331-N333 PolarHBondContact O-N 3.19Å; A331-T334 WeakPolarHBondContact O-CB 3.07Å; A331-T334 PolarHBondContact O-N 3.08Å
332	K	84.3	Confident	83.7	Confident	83 Å²	83	75.5 Å²	75.5	36%	0.361	39%	0.387	S	S	.	.	H	α-helix	trans	-62	-40.9	172.5	176	168.2	169.9	158.6	0	112.6	W298 N299 E300 L328 L329 T334	W298-K332 PolarHBondContact O-NZ 3.3Å; N299-K332 WeakPolarHBondContact O-CD 3.44Å; N299-K332 PolarHBondContact O-NZ 3.22Å; E300-K332 HydrophobicContact CG-CD 3.9Å; E300-K332 VanDerWaalsContact CG-CE 3.49Å; L328-K332 WeakPolarHBondContact O-CB 3.5Å; L328-K332 PolarHBondContact O-N 3.27Å; L329-K332 PolarHBondContact O-N 2.53Å; K332-T334 PolarHBondContact O-N 2.95Å
333	N	81.7	Confident	82.4	Confident	109 Å²	109	80 Å²	80	58%	0.583	41%	0.409	S	S	*	.	H	α-helix	trans	-74.5	-11.7	178.7	-69.2	-18.1	0	0	0	113.5	L329 K330 A331 T335	L329-N333 PolarHBondContact O-N 3.07Å; L329-N333 VanDerWaalsContact O-N 3.14Å; L329-N333 PolarHBondContact O-ND2 3.22Å; K330-N333 PolarHBondContact O-N 3.31Å; A331-N333 VanDerWaalsContact C-N 3.35Å; A331-N333 PolarHBondContact O-N 3.19Å; N333-T335 PolarHBondContact O-N 3.28Å
334	T	80.2	Confident	81.2	Confident	70 Å²	70	83.2 Å²	83.2	43%	0.429	42%	0.419	S	S	.	.	S	Bend	trans	-75.1	111.6	175.2	-57.5	0	0	0	0	108.6	K330 A331 K332 T336	K330-T334 PolarHBondContact O-N 2.86Å; K330-T334 PolarHBondContact O-OG1 2.8Å; A331-T334 WeakPolarHBondContact O-CB 3.07Å; A331-T334 PolarHBondContact O-N 3.08Å; K332-T334 PolarHBondContact O-N 2.95Å; T334-T336 PolarHBondContact O-N 3.46Å
335	T	64.8	Low	79.9	Confident	133 Å²	133	89.3 Å²	89.3	82%	0.816	46%	0.456	S	S	*	.			trans	-55.2	112.3	177.5	38.3	0	0	0	0	110.4	N333 Q337	N333-T335 PolarHBondContact O-N 3.28Å; T335-Q337 PolarHBondContact O-N 3.21Å
336	T	65.4	Low	78.2	Confident	51 Å²	51	94.2 Å²	94.2	31%	0.313	49%	0.489	S	S	.	.			trans	-76.1	104.9	173.5	55.3	0	0	0	0	108.8	F27 K80 T334 G338	F27-T336 HydrophobicContact CZ-CG2 4.25Å; K80-T336 PolarHBondContact NZ-OG1 2.98Å; K80-T336 VanDerWaalsContact NZ-OG1 3.08Å; T334-T336 PolarHBondContact O-N 3.46Å; T336-G338 PolarHBondContact O-N 2.72Å
337	Q	66.5	Low	76.7	Confident	162 Å²	162	94.5 Å²	94.5	76%	0.757	50%	0.501	S	S	*	.	P	Polyproline II helix	trans	-56.9	124.2	166	-171.7	79.1	25	0	0	108.3	T335 R339	T335-Q337 PolarHBondContact O-N 3.21Å; Q337-R339 PolarHBondContact O-N 2.93Å
338	G	65.9	Low	74.9	Confident	42 Å²	42	94.4 Å²	94.4	43%	0.433	51%	0.51	S	S	.	.	P	Polyproline II helix	trans	-62.6	134.1	175.2	0	0	0	0	0	110.7	T336	T336-G338 PolarHBondContact O-N 2.72Å
339	R	73	Confident	72.9	Confident	87 Å²	87	99.6 Å²	99.6	33%	0.328	55%	0.547	S	S	.	.	P	Polyproline II helix	trans	-75.5	139	172.1	-64	-168.2	76.3	112.4	-1.9	110.1	S25 F27 Q337 D341 N342 F343	S25-R339 PolarHBondContact O-NH1 3.18Å; F27-R339 WeakPolarHBondContact O-CD 3.31Å; Q337-R339 PolarHBondContact O-N 2.93Å; R339-D341 VanDerWaalsContact C-N 3.26Å; R339-D341 IonicContact NE-OD2 3.63Å; R339-D341 PolarHBondContact O-N 3.05Å; R339-N342 WeakPolarHBondContact O-CB 3.43Å; R339-N342 PolarHBondContact O-N 3.28Å; R339-F343 VanDerWaalsContact O-CD2 3.26Å; R339-F343 WeakPolarHBondContact O-CD2 3.34Å; R339-F343 WeakPolarHBondContact O-CE2 3.47Å
340	I	75.4	Confident	70.5	Confident	114 Å²	114	106 Å²	106	59%	0.585	57%	0.572	S	S	*	*	G	3₁₀ helix	trans	-58.5	-38.9	-179.7	-160.6	164.9	0	0	0	111.9	N342 F343 F344	I340-N342 PolarHBondContact O-N 3.46Å; I340-N342 VanDerWaalsContact O-N 3.08Å; I340-F343 WeakPolarHBondContact O-CB 3.41Å; I340-F343 PolarHBondContact O-N 3.14Å; I340-F344 HydrophobicContact CD1-CE2 4.18Å; I340-F344 HydrophobicContact CG1-CD2 3.73Å; I340-F344 HydrophobicContact CG1-CE2 3.59Å; I340-F344 WeakPolarHBondContact O-CD2 3.34Å; I340-F344 PolarHBondContact O-N 3.27Å
341	D	77.3	Confident	68.3	Low	63 Å²	63	103.3 Å²	103.3	34%	0.337	57%	0.573	S	S	.	*	G	3₁₀ helix	trans	-68	-8.3	179	-21.7	-56.5	0	0	0	113.8	R29 R339 F343	R29-D341 IonicContact CZ-OD2 3.96Å; R29-D341 IonicContact NH2-OD2 3.54Å; R29-D341 PolarHBondContact NH2-OD2 3.18Å; R339-D341 VanDerWaalsContact C-N 3.26Å; R339-D341 IonicContact NE-OD2 3.63Å; R339-D341 PolarHBondContact O-N 3.05Å; D341-F343 VanDerWaalsContact C-N 3.3Å
342	N	72	Confident	65.9	Low	81 Å²	81	109.5 Å²	109.5	43%	0.433	60%	0.604	S	S	.	*	G	3₁₀ helix	trans	-78.2	-18.3	169.3	-71.9	-18.2	0	0	0	111.9	R29 R339 I340	R29-N342 PolarHBondContact NH1-OD1 3.45Å; R339-N342 WeakPolarHBondContact O-CB 3.43Å; R339-N342 PolarHBondContact O-N 3.28Å; I340-N342 PolarHBondContact O-N 3.46Å; I340-N342 VanDerWaalsContact O-N 3.08Å
343	F	70.2	Confident	63.8	Low	150 Å²	150	111.4 Å²	111.4	66%	0.658	63%	0.627	S	S	*	*	T	Hydrogen-bonded Turn	trans	-100.2	-21.2	-176.6	-60.5	-85.2	0	0	0	113	R339 I340 D341	R339-F343 VanDerWaalsContact O-CD2 3.26Å; R339-F343 WeakPolarHBondContact O-CD2 3.34Å; R339-F343 WeakPolarHBondContact O-CE2 3.47Å; I340-F343 WeakPolarHBondContact O-CB 3.41Å; I340-F343 PolarHBondContact O-N 3.14Å; D341-F343 VanDerWaalsContact C-N 3.3Å
344	F	73.2	Confident	61.7	Low	139 Å²	139	110.4 Å²	110.4	61%	0.61	63%	0.629	S	S	*	*	S	Bend	trans	-125.2	143.2	-176.7	-56.3	-78	0	0	0	110.3	I340	I340-F344 HydrophobicContact CD1-CE2 4.18Å; I340-F344 HydrophobicContact CG1-CD2 3.73Å; I340-F344 HydrophobicContact CG1-CE2 3.59Å; I340-F344 WeakPolarHBondContact O-CD2 3.34Å; I340-F344 PolarHBondContact O-N 3.27Å
345	T	67.7	Low	59.5	Low	130 Å²	130	116.2 Å²	116.2	80%	0.798	65%	0.653	S	S	*	*	P	Polyproline II helix	trans	-75	128	168.2	47.9	0	0	0	0	109.3	V347	T345-V347 PolarHBondContact O-N 3.11Å
346	C	62.7	Low	58.3	Low	104 Å²	104	115.6 Å²	115.6	70%	0.703	66%	0.655	S	S	*	*	P	Polyproline II helix	trans	-67.7	116.6	174.4	-69.4	0	0	0	0	109.7
347	V	64.3	Low	57.1	Low	124 Å²	124	119.3 Å²	119.3	75%	0.752	68%	0.677	S	S	*	*	P	Polyproline II helix	trans	-81.7	132.7	165.3	-175.1	0	0	0	0	107.5	T345 S349	T345-V347 PolarHBondContact O-N 3.11Å; V347-S349 PolarHBondContact O-N 2.88Å
348	P	55.9	Low	55.7	Low	93 Å²	93	117.7 Å²	117.7	60%	0.604	68%	0.681	S	S	*	*	P	Polyproline II helix	trans	-53.5	131.7	175.9	-23.4	32.5	0	0	0	110.4	K350	P348-K350 PolarHBondContact O-N 3.18Å
349	S	53.2	Low	54.4	Low	114 Å²	114	123 Å²	123	80%	0.797	70%	0.699	S	S	*	*	P	Polyproline II helix	trans	-62.6	123.5	172.2	50.8	0	0	0	0	108.3	V347 S351	V347-S349 PolarHBondContact O-N 2.88Å; S349-S351 PolarHBondContact O-N 2.6Å
350	K	44.9	Very low	52.6	Low	200 Å²	200	123.4 Å²	123.4	87%	0.87	72%	0.715	S	S	*	*			trans	-60	107.3	166.7	-68.3	-176.8	-179.5	-179.8	0	106.2	P348 D352	P348-K350 PolarHBondContact O-N 3.18Å; K350-D352 PolarHBondContact O-N 3.3Å; K350-D352 VanDerWaalsContact O-N 3.12Å
351	S	46.2	Very low	50.9	Low	102 Å²	102	125.4 Å²	125.4	71%	0.713	73%	0.727	S	S	*	*			trans	-62.3	115.6	168.7	53.7	0	0	0	0	107.3	S349 S353	S349-S351 PolarHBondContact O-N 2.6Å; S351-S353 PolarHBondContact O-N 2.98Å
352	D	38.1	Very low	49.1	Very low	149 Å²	149	129.4 Å²	129.4	80%	0.797	75%	0.749	S	S	*	*			trans	-54.7	103.5	175.5	-77.2	-36.7	0	0	0	109.8	K350 S354	K350-D352 PolarHBondContact O-N 3.3Å; K350-D352 VanDerWaalsContact O-N 3.12Å; D352-S354 VanDerWaalsContact C-N 3.26Å
353	S	42	Very low	47.4	Very low	123 Å²	123	135.8 Å²	135.8	86%	0.86	77%	0.772	S	S	*	*			trans	-95	26.5	167.7	50.2	0	0	0	0	111.4	S351	S351-S353 PolarHBondContact O-N 2.98Å
354	S	36.3	Very low	45.7	Very low	87 Å²	87	137.9 Å²	137.9	61%	0.608	78%	0.781	S	S	*	*			trans	-141.9	90.5	177.4	63.5	0	0	0	0	112.2	D352	D352-S354 VanDerWaalsContact C-N 3.26Å
355	M	34.3	Very low	44.2	Very low	192 Å²	192	137.7 Å²	137.7	95%	0.946	79%	0.791	S	S	*	*			trans	-176.9	91.4	143.2	-102.2	-176	-166.1	0	0	110
356	S	39.1	Very low	42.7	Very low	121 Å²	121	135.9 Å²	135.9	85%	0.846	78%	0.784	S	S	*	*			trans	-141	73.6	157.7	53.5	0	0	0	0	109.2
357	T	40.1	Very low	41.6	Very low	129 Å²	129	138.6 Å²	138.6	79%	0.791	79%	0.792	S	S	*	*			trans	-79.7	125.9	157.9	39.7	0	0	0	0	108.7
358	P	37.3	Very low	40.2	Very low	127 Å²	127	138.1 Å²	138.1	83%	0.825	79%	0.794	S	S	*	*			trans	-82.6	126	177	32	-28.5	0	0	0	109
359	N	38.5	Very low	39.5	Very low	153 Å²	153	138.9 Å²	138.9	82%	0.818	81%	0.808	S	S	*	*			trans	-127.2	117	166.8	-150.4	11.4	0	0	0	110.4
360	S	35.5	Very low	38.8	Very low	96 Å²	96	138.8 Å²	138.8	67%	0.671	81%	0.807	S	S	*	*			trans	-72.1	134.3	169.4	50.8	0	0	0	0	109.3
361	N	40	Very low	38.6	Very low	157 Å²	157	135.7 Å²	135.7	84%	0.84	80%	0.8	S	S	*	*			trans	-168.7	124.9	137.7	-101.3	-29.9	0	0	0	112.9
362	N	38.7	Very low	38.3	Very low	147 Å²	147	141.9 Å²	141.9	79%	0.786	81%	0.808	S	S	*	*			trans	-41.9	142.1	164.1	-92.6	-40.8	0	0	0	114.4
363	K	38.2	Very low	38.3	Very low	214 Å²	214	144.5 Å²	144.5	93%	0.93	81%	0.812	S	S	*	*				-161.1	114.8	129.4	-111.5	169.7	-176.8	177.4	0	111.9
364	K	34.2	Very low	38.2	Very low	194 Å²	194	150.2 Å²	150.2	84%	0.843	82%	0.815	S	S	*	*			trans	-67.5	146	169.5	-72.6	171.3	169.1	175.4	0	111.9
365	V	40.4	Very low	38.3	Very low	135 Å²	135	155.5 Å²	155.5	82%	0.818	83%	0.827	S	S	*	*			trans	-162.6	94.5	140.2	-173.7	0	0	0	0	108.2
366	S	36.6	Very low	38.4	Very low	92 Å²	92	151.6 Å²	151.6	64%	0.643	82%	0.818	S	S	*	*				40	117.2	107.3	67.1	0	0	0	0	118.9
367	N	39.4	Very low	38.4	Very low	162 Å²	162	153.3 Å²	153.3	87%	0.866	82%	0.818	S	S	*	*				-179	142.8	111.8	-97.2	-10.5	0	0	0	114.3
368	S	34.7	Very low	38.4	Very low	114 Å²	114	153.5 Å²	153.5	80%	0.797	82%	0.819	S	S	*	*			trans	-80.3	148.2	-178.4	49.1	0	0	0	0	114.4
369	A	41.2	Very low	38.5	Very low	109 Å²	109	151 Å²	151	90%	0.901	82%	0.816	S	S	*	*			trans	-157.8	138.6	146.7	0	0	0	0	0	111.1
370	S	38.9	Very low	38.7	Very low	112 Å²	112	148.4 Å²	148.4	78%	0.783	82%	0.816	S	S	*	*			trans	-96	167	-166.7	46.6	0	0	0	0	113.8
371	D	40.8	Very low	38.9	Very low	135 Å²	135	148.8 Å²	148.8	72%	0.722	82%	0.819	S	S	*	*			trans	99.8	106.1	135.4	-133.5	13.1	0	0	0	119.3
372	R	40.3	Very low	39	Very low	232 Å²	232	148.7 Å²	148.7	88%	0.875	82%	0.818	S	S	*	*				164.2	121.3	111.5	-85.5	172.8	-160.2	-178.4	7.8	114.1
373	K	37.2	Very low	39.2	Very low	203 Å²	203	145 Å²	145	88%	0.883	82%	0.815	S	S	*	*			trans	-80.7	148.4	163.1	-87.4	173.2	169.9	171.4	0	111.6
374	R	40.1	Very low	39.8	Very low	243 Å²	243	145.8 Å²	145.8	92%	0.917	81%	0.814	S	S	*	*			trans	-177.3	109.3	140.6	-101.4	169.5	-174.5	-165.5	1.7	108.8
375	K	39.7	Very low	40.3	Very low	199 Å²	199	146.3 Å²	146.3	87%	0.865	82%	0.816	S	S	*	*				91.7	114.3	85.7	-103.5	-172.4	177.8	-177	0	113.9
376	S	36.5	Very low	40.6	Very low	109 Å²	109	151.6 Å²	151.6	76%	0.762	82%	0.822	S	S	*	*			trans	-22.2	144.1	159.5	53.8	0	0	0	0	119.3
377	N	39.1	Very low	41.4	Very low	158 Å²	158	152.4 Å²	152.4	85%	0.845	82%	0.824	S	S	*	*				-157.5	147.3	127.6	-140.8	7.9	0	0	0	113.6
378	T	39	Very low	42	Very low	133 Å²	133	158 Å²	158	82%	0.816	84%	0.841	S	S	*	*			trans	-85	157.8	-176.3	43.8	0	0	0	0	114.4
379	G	39.9	Very low	42.4	Very low	73 Å²	73	160.2 Å²	160.2	75%	0.753	84%	0.843	S	S	*	*			trans	158.7	102.5	160.7	0	0	0	0	0	111.1
380	A	42.1	Very low	42.5	Very low	99 Å²	99	162.9 Å²	162.9	82%	0.818	84%	0.84	S	S	*	*				100.4	110.1	81.3	0	0	0	0	0	112.4
381	S	39.4	Very low	42.7	Very low	104 Å²	104	165.7 Å²	165.7	73%	0.727	84%	0.843	S	S	*	*			trans	22.2	130.2	148.2	62	0	0	0	0	121.5
382	N	42.9	Very low	42.8	Very low	156 Å²	156	167.5 Å²	167.5	83%	0.834	85%	0.85	S	S	*	*				-159.9	125.7	117.9	-109.1	-12.1	0	0	0	112.2
383	G	42	Very low	42.9	Very low	70 Å²	70	163.5 Å²	163.5	72%	0.722	85%	0.849	S	S	*	*			trans	-88.9	150.3	171.5	0	0	0	0	0	111.6
384	Y	51	Low	43.3	Very low	230 Å²	230	160.9 Å²	160.9	90%	0.902	85%	0.847	S	S	*	*			trans	-125.3	109.3	165	-103.4	-94.6	0	0	0	109.1
385	K	45.3	Very low	43.6	Very low	205 Å²	205	155 Å²	155	89%	0.891	84%	0.842	S	S	*	*			trans	-134.3	131.3	155.1	-102	-169.8	178.2	-177.1	0	106.3
386	R	47.3	Very low	43.8	Very low	246 Å²	246	151.6 Å²	151.6	93%	0.928	84%	0.84	S	S	*	*			trans	-155.7	158.9	161.5	-104.7	-149.8	152.8	-179.9	-5.6	110.8
387	P	53.4	Low	44.5	Very low	108 Å²	108	155.2 Å²	155.2	70%	0.701	85%	0.846	S	S	*	*				-130.6	155.5	-127.5	37.2	-18.9	0	0	0	114.5
388	K	52.2	Low	45	Very low	280 Å²	280	154.9 Å²	154.9	100%	1.217	85%	0.846	S	S	*	*				-171.7	0	119.5	-106.4	-173.3	179.4	-177.2	0	108.7

Retrieved 388 of 388 residues in 118.9 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).