A0A096MPE7_PAPAN Loading...

Lysosomal acid phosphatase

AlphaFold DB (A0A2K5X7N9), UniProt , Accession A0A096MPE7, Species PAPAN (Papio anubis, Olive baboon), Gene ACP2, Length 433 aa.

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(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	35.8	Very low	39.6	Very low	244 Å²	244	164.4 Å²	164.4	100%	1.202	90%	0.896	S	S	*	*				0	129.8	0	-70.7	179.7	-170.4	0	0	108.1
2	A	37.4	Very low	40.4	Very low	109 Å²	109	158.4 Å²	158.4	90%	0.901	89%	0.885	S	S	*	*			trans	42.7	118.6	165.1	0	0	0	0	0	117.9
3	G	36.6	Very low	40.7	Very low	70 Å²	70	158.9 Å²	158.9	72%	0.722	88%	0.883	S	S	*	*			cis	109.5	116.6	40.9	0	0	0	0	0	109.7
4	K	38.5	Very low	40.6	Very low	211 Å²	211	159.9 Å²	159.9	92%	0.917	89%	0.885	S	S	*	*			trans	161.9	100.1	156.5	-92.6	165.2	-175.2	-175.5	0	107.6
5	R	40.5	Very low	41	Very low	247 Å²	247	161.9 Å²	161.9	93%	0.932	89%	0.885	S	S	*	*				61.9	133.7	71	-78.8	-164.5	179.4	-167	1.6	116.1
6	S	38.8	Very low	41.4	Very low	132 Å²	132	161.5 Å²	161.5	92%	0.923	88%	0.881	S	S	*	*			trans	94.4	123.9	162.1	-160.3	0	0	0	0	114.9
7	G	35.9	Very low	41.7	Very low	63 Å²	63	162.1 Å²	162.1	65%	0.649	88%	0.881	S	S	*	*			cis	171.3	113.2	2.3	0	0	0	0	0	107
8	W	38.1	Very low	41.9	Very low	263 Å²	263	163.3 Å²	163.3	100%	0.996	89%	0.886	S	S	*	*			trans	-94.9	100	170.8	-78.2	21.8	0	0	0	107.3
9	S	43.1	Very low	42.1	Very low	121 Å²	121	157.7 Å²	157.7	85%	0.846	87%	0.871	S	S	*	*			trans	-79.1	123.9	171.4	-110.7	0	0	0	0	109.6	A11	S9-A11 PolarHBondContact O-N 3.22Å
10	R	50.3	Low	42.5	Very low	248 Å²	248	154.2 Å²	154.2	94%	0.936	86%	0.863	S	S	*	*			trans	-26.3	108.4	159.9	-63.7	170.1	168.6	-160.9	-5.1	113.1
11	A	40.8	Very low	42.6	Very low	100 Å²	100	154.2 Å²	154.2	83%	0.826	86%	0.861	S	S	*	*			trans	-154.8	41.7	157.8	0	0	0	0	0	110.7	S9	S9-A11 PolarHBondContact O-N 3.22Å
12	A	48.6	Very low	43.2	Very low	93 Å²	93	149.5 Å²	149.5	77%	0.769	84%	0.84	S	S	*	*			trans	-105	79.9	164	0	0	0	0	0	107.3
13	L	45.1	Very low	43.7	Very low	165 Å²	165	152 Å²	152	86%	0.864	84%	0.835	S	S	*	*			trans	177.2	70.9	156.2	-119.3	108.7	0	0	0	109.7
14	L	38.6	Very low	44.3	Very low	173 Å²	173	154.3 Å²	154.3	91%	0.906	84%	0.835	S	S	*	*			trans	-161.3	43.6	161.5	-104.5	136.1	0	0	0	109.9
15	Q	47.3	Very low	44.6	Very low	189 Å²	189	151.3 Å²	151.3	88%	0.883	83%	0.826	S	S	*	*			trans	-99	93.4	153.1	-83.4	-168	-18.4	0	0	107
16	L	47.1	Very low	45.1	Very low	156 Å²	156	144.5 Å²	144.5	82%	0.817	81%	0.814	S	S	*	*	S	Bend	trans	167.7	132.3	152.3	-96.9	142.2	0	0	0	106.3
17	L	46.7	Very low	45.8	Very low	171 Å²	171	143.8 Å²	143.8	90%	0.895	81%	0.806	S	S	*	*			trans	97.1	33.5	-174.5	-49.1	173.3	0	0	0	116.9	G19	L17-G19 PolarHBondContact O-N 3.12Å
18	L	45.7	Very low	46.8	Very low	184 Å²	184	147.2 Å²	147.2	96%	0.963	82%	0.815	S	S	*	*			trans	-79.7	74.9	136.3	-93.5	114.1	0	0	0	107.4	A20	L18-A20 PolarHBondContact O-N 3.43Å; L18-A20 VanDerWaalsContact O-N 3.11Å
19	G	45.8	Very low	47.8	Very low	58 Å²	58	140.7 Å²	140.7	60%	0.598	80%	0.795	S	S	*	*			trans	-63.4	108.3	160.5	0	0	0	0	0	106.6	L17 N21	L17-G19 PolarHBondContact O-N 3.12Å; G19-N21 PolarHBondContact O-N 3.03Å
20	A	50.4	Low	49.6	Very low	86 Å²	86	137.8 Å²	137.8	71%	0.711	78%	0.779	S	S	*	*			trans	-59.8	93	164.3	0	0	0	0	0	107.1	L18 L22	L18-A20 PolarHBondContact O-N 3.43Å; L18-A20 VanDerWaalsContact O-N 3.11Å; A20-L22 HydrophobicContact CB-CD1 4.35Å; A20-L22 PolarHBondContact O-N 3.44Å
21	N	43.3	Very low	51.6	Low	156 Å²	156	129.6 Å²	129.6	83%	0.834	75%	0.748	S	S	*	*			trans	-66	78.6	157.7	-82.9	-47.3	0	0	0	106.1	G19 M23	G19-N21 PolarHBondContact O-N 3.03Å; N21-M23 PolarHBondContact O-N 2.85Å
22	L	49	Very low	54.2	Low	145 Å²	145	126.7 Å²	126.7	76%	0.759	72%	0.722	S	S	*	*			trans	-59.3	95.5	148.9	-103.8	85.9	0	0	0	104.2	A20 V24	A20-L22 HydrophobicContact CB-CD1 4.35Å; A20-L22 PolarHBondContact O-N 3.44Å; L22-V24 PolarHBondContact O-N 3.3Å
23	M	47.8	Very low	56.6	Low	160 Å²	160	123.9 Å²	123.9	79%	0.788	69%	0.694	S	S	*	*			trans	-57.8	99.7	153.6	-79.5	-159.6	168.6	0	0	105	N21 M25	N21-M23 PolarHBondContact O-N 2.85Å; M23-M25 PolarHBondContact O-N 2.99Å
24	V	48.9	Very low	59.1	Low	120 Å²	120	121.5 Å²	121.5	73%	0.727	67%	0.673	S	S	*	*			trans	-60.5	92.3	159.1	178.3	0	0	0	0	103.7	L22 P26	L22-V24 PolarHBondContact O-N 3.3Å; V24-P26 VanDerWaalsContact O-N 3.16Å
25	M	45.5	Very low	61.9	Low	147 Å²	147	113.3 Å²	113.3	72%	0.724	63%	0.63	S	S	*	*	P	Polyproline II helix	trans	-49.7	123.2	163	-74.7	-85.7	165.3	0	0	104.6	M23	M23-M25 PolarHBondContact O-N 2.99Å
26	P	50.8	Low	64.4	Low	105 Å²	105	104.3 Å²	104.3	68%	0.682	59%	0.588	S	S	*	*	P	Polyproline II helix	trans	-51.3	136.2	172.7	21.2	-29.8	0	0	0	106.5	V24 T28	V24-P26 VanDerWaalsContact O-N 3.16Å; P26-T28 PolarHBondContact O-N 3.47Å
27	P	53.3	Low	66.8	Low	117 Å²	117	96.9 Å²	96.9	76%	0.76	55%	0.549	S	S	*	.	P	Polyproline II helix	trans	-49.2	122.9	179.4	19.2	-30	0	0	0	106.9	Q29	P27-Q29 VanDerWaalsContact C-N 3.29Å; P27-Q29 PolarHBondContact O-N 3.48Å
28	T	56	Low	69.3	Low	135 Å²	135	88.7 Å²	88.7	83%	0.828	51%	0.507	S	S	*	.			trans	-54.5	106.1	169.7	42.2	0	0	0	0	105	P26 A30	P26-T28 PolarHBondContact O-N 3.47Å; T28-A30 PolarHBondContact O-N 3.49Å
29	Q	60	Low	71.9	Confident	125 Å²	125	80 Å²	80	58%	0.584	46%	0.461	S	S	*	.			trans	-55.1	112.6	-176.9	-144.4	162.4	27	0	0	105.9	P27 R31 D319	P27-Q29 VanDerWaalsContact C-N 3.29Å; P27-Q29 PolarHBondContact O-N 3.48Å; Q29-R31 PolarHBondContact O-N 3.49Å; Q29-D319 VanDerWaalsContact C-OD2 3.29Å; Q29-D319 VanDerWaalsContact CA-OD2 3.25Å; Q29-D319 WeakPolarHBondContact CA-OD2 3.29Å; Q29-D319 HydrophobicContact CG-CB 3.98Å; Q29-D319 WeakPolarHBondContact CG-OD2 3.09Å
30	A	79.9	Confident	74.4	Confident	61 Å²	61	77.2 Å²	77.2	50%	0.504	43%	0.432	S	S	.	.			trans	-66.1	136.3	-179.5	0	0	0	0	0	106.3	T28 D319	T28-A30 PolarHBondContact O-N 3.49Å; A30-D319 WeakPolarHBondContact CB-OD1 3.44Å; A30-D319 PolarHBondContact N-OD2 2.75Å; A30-D319 PolarHBondContact O-N 2.85Å
31	R	93.1	Very high	76.7	Confident	75 Å²	75	73.3 Å²	73.3	28%	0.283	40%	0.399	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-141.6	153.3	177.1	70.2	178	-166.4	171.4	5.1	108.6	Q29 Y316 Q317 E326	Q29-R31 PolarHBondContact O-N 3.49Å; R31-Y316 HydrophobicContact CG-CD1 3.98Å; R31-Q317 WeakPolarHBondContact CA-O 3.3Å; R31-E326 IonicContact CZ-OE1 2.78Å; R31-E326 VanDerWaalsContact CZ-OE1 3.29Å; R31-E326 IonicContact CZ-OE2 2.76Å; R31-E326 IonicContact NH1-OE1 3.25Å; R31-E326 PolarHBondContact NH1-OE1 3.44Å; R31-E326 IonicContact NH1-OE2 3.7Å; R31-E326 VanDerWaalsContact NH2-CD 3.32Å; R31-E326 IonicContact NH2-OE1 3.87Å; R31-E326 PolarHBondContact NH2-OE1 3.13Å; R31-E326 IonicContact NH2-OE2 3.89Å; R31-E326 PolarHBondContact NH2-OE2 2.99Å
32	S	95.8	Very high	79.3	Confident	40 Å²	40	66 Å²	66	28%	0.28	36%	0.36	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-121.8	127.6	-178.9	55.6	0	0	0	0	109.9	R34 Y316 Q317	S32-R34 PolarHBondContact O-N 2.98Å; S32-R34 PolarHBondContact OG-NE 3.25Å; S32-Y316 CarbonylContact O-C 3.6Å; S32-Y316 WeakPolarHBondContact O-CA 3.4Å; S32-Q317 PolarHBondContact N-O 3.29Å; S32-Q317 PolarHBondContact O-N 2.63Å
33	L	97.8	Very high	81.7	Confident	34 Å²	34	59.1 Å²	59.1	18%	0.178	32%	0.324	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-67.7	126.3	168.9	-178.2	62	0	0	0	108.1	V36 Y87 F90 E314 Y316	L33-V36 HydrophobicContact CD1-CG2 4.06Å; L33-V36 HydrophobicContact CD2-CG2 3.83Å; L33-V36 HydrophobicContact CG-CG2 4.19Å; L33-Y87 HydrophobicContact CD2-CD1 3.74Å; L33-Y87 HydrophobicContact CD2-CE1 3.89Å; L33-F90 HydrophobicContact CB-CD2 4.05Å; L33-F90 HydrophobicContact CB-CE2 4.34Å; L33-F90 HydrophobicContact CB-CG 4.48Å; L33-F90 HydrophobicContact CD2-CB 4.11Å; L33-F90 HydrophobicContact CD2-CD1 3.72Å; L33-F90 HydrophobicContact CD2-CD2 4.01Å; L33-F90 HydrophobicContact CD2-CE1 4.13Å; L33-F90 HydrophobicContact CD2-CE2 4.39Å; L33-F90 HydrophobicContact CD2-CG 3.67Å; L33-F90 HydrophobicContact CD2-CZ 4.44Å; L33-F90 HydrophobicContact CG-CD1 4.29Å; L33-F90 HydrophobicContact CG-CD2 3.9Å; L33-F90 HydrophobicContact CG-CE1 4.33Å; L33-F90 HydrophobicContact CG-CE2 3.94Å; L33-F90 HydrophobicContact CG-CG 4.09Å; L33-F90 HydrophobicContact CG-CZ 4.16Å; L33-F90 WeakPolarHBondContact O-CD2 3.36Å; L33-F90 WeakPolarHBondContact O-CE2 3.43Å; L33-E314 HydrophobicContact CD1-CB 3.75Å; L33-E314 HydrophobicContact CD1-CG 4.04Å; L33-Y316 HydrophobicContact CB-CD1 4.15Å; L33-Y316 HydrophobicContact CB-CE1 3.84Å; L33-Y316 HydrophobicContact CD1-CD1 4.31Å; L33-Y316 HydrophobicContact CD1-CD2 4.48Å; L33-Y316 HydrophobicContact CD1-CE1 3.95Å; L33-Y316 HydrophobicContact CD1-CE2 4.14Å; L33-Y316 HydrophobicContact CG-CE1 4.45Å
34	R	97.8	Very high	84.1	Confident	115 Å²	115	51.5 Å²	51.5	43%	0.434	29%	0.287	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-111	-30.7	-176.3	-66.4	-56.3	-167.5	168.3	-1.5	113.1	S32 M271 L315 Q317 F323	S32-R34 PolarHBondContact O-N 2.98Å; S32-R34 PolarHBondContact OG-NE 3.25Å; R34-M271 WeakPolarHBondContact O-CE 3.46Å; R34-L315 PolarHBondContact N-O 2.9Å; R34-Q317 HydrophobicContact CG-CB 3.71Å; R34-F323 HydrophobicContact CB-CE1 4.41Å; R34-F323 HydrophobicContact CG-CE1 4.06Å
35	F	98.6	Very high	86.5	Confident	0 Å²	0	46.2 Å²	46.2	0%	0	25%	0.254	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-159.2	145.7	-174.4	176.9	-109.1	0	0	0	111.9	T37 N267 L268 M271 L277 P278 K279 L281 L315	F35-T37 WeakPolarHBondContact CE1-OG1 3.32Å; F35-T37 WeakPolarHBondContact CZ-OG1 3.27Å; F35-N267 HydrophobicContact CE1-CB 4.02Å; F35-N267 HydrophobicContact CZ-CB 3.95Å; F35-L268 HydrophobicContact CD1-CD2 3.95Å; F35-L268 HydrophobicContact CE1-CD2 4.26Å; F35-M271 HydrophobicContact CB-CB 4.07Å; F35-M271 HydrophobicContact CB-CE 4.04Å; F35-M271 HydrophobicContact CB-CG 3.91Å; F35-M271 HydrophobicContact CD1-CG 4.21Å; F35-M271 HydrophobicContact CD2-CE 4.18Å; F35-M271 HydrophobicContact CD2-CG 3.57Å; F35-M271 HydrophobicContact CD2-SD 4.3Å; F35-M271 HydrophobicContact CE2-CG 4Å; F35-M271 HydrophobicContact CG-CB 4.18Å; F35-M271 HydrophobicContact CG-CE 4.49Å; F35-M271 HydrophobicContact CG-CG 3.65Å; F35-M271 HydrophobicContact CZ-CG 4.49Å; F35-L277 HydrophobicContact CE2-CB 4.17Å; F35-L277 HydrophobicContact CE2-CD1 4.46Å; F35-L277 HydrophobicContact CZ-CD1 4.35Å; F35-P278 WeakPolarHBondContact CD2-O 3.19Å; F35-P278 WeakPolarHBondContact CE2-O 3.42Å; F35-K279 WeakPolarHBondContact CA-O 3.17Å; F35-L281 HydrophobicContact CE2-CB 4.5Å; F35-L281 HydrophobicContact CE2-CD1 4Å; F35-L281 HydrophobicContact CE2-CG 3.7Å; F35-L281 HydrophobicContact CZ-CB 4.27Å; F35-L281 HydrophobicContact CZ-CD1 3.54Å; F35-L281 HydrophobicContact CZ-CG 3.66Å; F35-L315 HydrophobicContact CB-CB 3.98Å; F35-L315 HydrophobicContact CB-CD2 4.13Å; F35-L315 HydrophobicContact CD1-CB 4.47Å; F35-L315 PolarHBondContact N-O 3.27Å; F35-L315 PolarHBondContact O-N 3.47Å
36	V	98.8	Very high	89	Confident	0 Å²	0	39.4 Å²	39.4	0%	0	22%	0.22	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-131.1	133.1	178.2	-179	0	0	0	0	109.8	L33 L38 Y87 F90 K279 L280 L281 I312 F313 E314	L33-V36 HydrophobicContact CD1-CG2 4.06Å; L33-V36 HydrophobicContact CD2-CG2 3.83Å; L33-V36 HydrophobicContact CG-CG2 4.19Å; V36-L38 HydrophobicContact CG1-CD2 3.62Å; V36-L38 HydrophobicContact CG1-CG 3.98Å; V36-Y87 HydrophobicContact CG1-CE1 4.2Å; V36-Y87 HydrophobicContact CG1-CE2 3.99Å; V36-Y87 WeakPolarHBondContact CG1-OH 3.45Å; V36-Y87 HydrophobicContact CG2-CD1 4.1Å; V36-Y87 HydrophobicContact CG2-CE1 3.64Å; V36-F90 HydrophobicContact CB-CE1 4.4Å; V36-F90 HydrophobicContact CG2-CD1 4.19Å; V36-F90 HydrophobicContact CG2-CE1 3.62Å; V36-F90 HydrophobicContact CG2-CZ 4.28Å; V36-K279 PolarHBondContact N-O 3.4Å; V36-L280 HydrophobicContact CB-CD1 3.9Å; V36-L280 HydrophobicContact CG1-CD1 3.8Å; V36-L280 WeakPolarHBondContact O-CA 3.29Å; V36-L281 PolarHBondContact O-N 3.09Å; V36-I312 HydrophobicContact CG1-CG2 4.44Å; V36-F313 VanDerWaalsContact CA-O 3.3Å; V36-F313 WeakPolarHBondContact CA-O 3.1Å; V36-E314 HydrophobicContact CG2-CG 4.27Å
37	T	98.9	Very high	91.3	Very high	0 Å²	0	34.4 Å²	34.4	0%	0	19%	0.188	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-115.3	126	164.2	-62	0	0	0	0	109.5	F35 I264 L281 Y283 F313	F35-T37 WeakPolarHBondContact CE1-OG1 3.32Å; F35-T37 WeakPolarHBondContact CZ-OG1 3.27Å; T37-I264 HydrophobicContact CG2-CG1 4.34Å; T37-L281 CarbonylContact C-O 3.54Å; T37-L281 WeakPolarHBondContact CA-O 3.48Å; T37-Y283 HydrophobicContact CG2-CD2 3.84Å; T37-Y283 HydrophobicContact CG2-CE2 3.72Å; T37-F313 PolarHBondContact N-O 2.91Å; T37-F313 PolarHBondContact O-N 3.39Å
38	L	98.9	Very high	93.4	Very high	0 Å²	0	31.1 Å²	31.1	0%	0	17%	0.165	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-108.4	133.9	174.3	-55.1	-179.7	0	0	0	109.2	V36 L83 Y87 L280 L281 V282 Y283 I312	V36-L38 HydrophobicContact CG1-CD2 3.62Å; V36-L38 HydrophobicContact CG1-CG 3.98Å; L38-L83 HydrophobicContact CD1-CD1 3.63Å; L38-L83 HydrophobicContact CD1-CD2 3.83Å; L38-L83 HydrophobicContact CD1-CG 4.29Å; L38-L83 HydrophobicContact CD2-CD2 4.03Å; L38-Y87 HydrophobicContact CD2-CE2 4.25Å; L38-L280 HydrophobicContact CD1-CD1 3.73Å; L38-L280 HydrophobicContact CG-CD1 3.78Å; L38-L281 PolarHBondContact N-O 3.17Å; L38-V282 HydrophobicContact CB-CG1 4.46Å; L38-V282 HydrophobicContact CB-CG2 4.49Å; L38-V282 HydrophobicContact CD1-CG2 4.2Å; L38-V282 CarbonylContact O-C 3.55Å; L38-Y283 PolarHBondContact O-N 3Å; L38-I312 HydrophobicContact CD2-CB 4.23Å; L38-I312 HydrophobicContact CD2-CD1 4.42Å; L38-I312 HydrophobicContact CD2-CG1 3.84Å; L38-I312 HydrophobicContact CD2-CG2 3.92Å
39	L	98.9	Very high	95.2	Very high	0 Å²	0	29.6 Å²	29.6	0%	0	15%	0.147	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-124.5	120	166.8	173.1	68.6	0	0	0	107.7	L152 L260 Y283 A285 T289 L290 L293 C310 H311	L39-L152 HydrophobicContact CD1-CD2 4.17Å; L39-L260 HydrophobicContact CD1-CD2 4.37Å; L39-L260 HydrophobicContact CD2-CD2 3.8Å; L39-Y283 WeakPolarHBondContact CA-O 3.25Å; L39-A285 HydrophobicContact CD1-CB 3.98Å; L39-T289 HydrophobicContact CD1-CG2 3.77Å; L39-T289 HydrophobicContact CD2-CG2 4.12Å; L39-L290 HydrophobicContact CB-CD2 4.47Å; L39-L290 HydrophobicContact CD2-CD2 3.88Å; L39-L290 HydrophobicContact CD2-CG 4.47Å; L39-L290 HydrophobicContact CG-CD2 3.87Å; L39-L290 HydrophobicContact CG-CG 4.48Å; L39-L290 WeakPolarHBondContact O-CD2 3.47Å; L39-L293 HydrophobicContact CD2-CB 4.23Å; L39-L293 HydrophobicContact CD2-CD2 3.5Å; L39-C310 CarbonylContact O-C 3.59Å; L39-C310 WeakPolarHBondContact O-CA 3.42Å; L39-H311 PolarHBondContact N-O 3.44Å; L39-H311 PolarHBondContact O-N 3.45Å
40	Y	98.8	Very high	97	Very high	1 Å²	1	25 Å²	25	0%	0.004	13%	0.128	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-128.8	150.3	177.8	50.5	-116.8	0	0	0	113.4	H76 L79 A114 V282 Y283 S284 A285 S309	Y40-H76 AromaticContact CD2-CE1 3.37Å; Y40-H76 WeakPolarHBondContact CD2-CE1 3.48Å; Y40-H76 AromaticContact CE2-CE1 3.64Å; Y40-H76 AromaticContact CE2-ND1 3.97Å; Y40-H76 AromaticContact CG-CE1 3.94Å; Y40-L79 HydrophobicContact CD1-CD2 4.08Å; Y40-L79 HydrophobicContact CG-CD2 4.26Å; Y40-A114 WeakPolarHBondContact OH-CA 3.45Å; Y40-V282 HydrophobicContact CD1-CG1 4.16Å; Y40-V282 HydrophobicContact CE1-CG1 3.17Å; Y40-V282 VanDerWaalsContact CZ-CG1 3.41Å; Y40-V282 WeakPolarHBondContact OH-CG1 3.4Å; Y40-Y283 PolarHBondContact N-O 3.13Å; Y40-S284 VanDerWaalsContact CE2-CA 3.49Å; Y40-S284 VanDerWaalsContact CE2-OG 3.3Å; Y40-S284 WeakPolarHBondContact CE2-OG 3.35Å; Y40-A285 CarbonylContact O-C 3.58Å; Y40-A285 PolarHBondContact O-N 3.47Å; Y40-S309 WeakPolarHBondContact CA-O 3.39Å; Y40-S309 WeakPolarHBondContact CB-O 3.38Å
41	R	98.9	Very high	97.7	Very high	4 Å²	4	22.4 Å²	22.4	2%	0.015	11%	0.105	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-72.6	146.3	164.9	-175.2	-175.5	-173.2	-160.4	-1.7	108.3	H76 D287 L290 A305 P306 Y307 A308 S309	R41-H76 PolarHBondContact O-CE1 2.94Å; R41-H76 VanDerWaalsContact O-CE1 3.23Å; R41-H76 PolarHBondContact O-NE2 3.43Å; R41-D287 HydrophobicContact CG-CB 4.38Å; R41-D287 IonicContact CZ-OD2 2.91Å; R41-D287 VanDerWaalsContact CZ-OD2 3.25Å; R41-D287 IonicContact NE-OD2 3.16Å; R41-D287 PolarHBondContact NE-OD2 2.89Å; R41-D287 IonicContact NH2-OD2 2.72Å; R41-D287 PolarHBondContact NH2-OD2 3.34Å; R41-L290 HydrophobicContact CB-CD1 3.81Å; R41-A305 VanDerWaalsContact CD-O 3.3Å; R41-A305 WeakPolarHBondContact CD-O 3.29Å; R41-A305 PolarHBondContact NH1-O 2.81Å; R41-P306 WeakPolarHBondContact CD-O 3.41Å; R41-Y307 VanDerWaalsContact CZ-CD1 3.43Å; R41-Y307 VanDerWaalsContact CZ-CE1 3.42Å; R41-Y307 VanDerWaalsContact NH2-CE1 3.26Å; R41-A308 WeakPolarHBondContact O-CA 3.31Å; R41-S309 PolarHBondContact N-O 3.29Å
42	H	98.9	Very high	97.9	Very high	2 Å²	2	23.2 Å²	23.2	1%	0.009	12%	0.12	C	C	.	.			trans	-54.1	165.8	166.2	62.5	74.4	0	0	0	113	R45 H76 R109 T110 S113 A285 H286 Y307 A308	H42-R45 VanDerWaalsContact CE1-CD 3.46Å; H42-R45 WeakPolarHBondContact CE1-CD 3.26Å; H42-R45 PolarHBondContact CE1-NE 3.23Å; H42-R45 VanDerWaalsContact CE1-NE 3.26Å; H42-H76 VanDerWaalsContact CA-NE2 3.35Å; H42-H76 WeakPolarHBondContact CA-NE2 3.34Å; H42-R109 HydrophobicContact CB-CG 4.44Å; H42-R109 PolarHBondContact NE2-NE 2.91Å; H42-T110 HydrophobicContact CB-CG2 3.94Å; H42-S113 WeakPolarHBondContact CA-OG 3.24Å; H42-S113 WeakPolarHBondContact CB-OG 3.44Å; H42-A285 PolarHBondContact N-O 3.39Å; H42-H286 AromaticContact CD2-ND1 3.75Å; H42-Y307 AromaticContact CE1-CE1 3.81Å; H42-A308 PolarHBondContact O-N 2.93Å
43	G	98.8	Very high	98	Very high	0 Å²	0	27.3 Å²	27.3	0%	0	13%	0.133	C	C	.	.			trans	-75.6	-176.6	177	0	0	0	0	0	112.9	H76 S113 Y307	G43-H76 PolarHBondContact N-CD2 3.13Å; G43-H76 PolarHBondContact N-NE2 3.18Å; G43-S113 PolarHBondContact N-OG 2.93Å; G43-S113 VanDerWaalsContact N-OG 3.12Å; G43-Y307 VanDerWaalsContact O-CD1 3.28Å; G43-Y307 WeakPolarHBondContact O-CD1 3.33Å
44	D	98.8	Very high	98	Very high	1 Å²	1	26 Å²	26	1%	0.005	13%	0.126	C	C	.	.			trans	-50.3	140.8	172	179.3	-92.6	0	0	0	113	L68 T69 E71 G72 H216 Y307	D44-L68 WeakPolarHBondContact O-CD1 3.47Å; D44-T69 PolarHBondContact O-N 3.21Å; D44-T69 PolarHBondContact O-OG1 2.82Å; D44-T69 WeakPolarHBondContact OD1-CB 3.19Å; D44-T69 WeakPolarHBondContact OD1-CG2 3.39Å; D44-T69 PolarHBondContact OD1-OG1 2.98Å; D44-E71 HydrophobicContact CB-CB 4.31Å; D44-E71 HydrophobicContact CB-CG 4.08Å; D44-G72 WeakPolarHBondContact O-CA 3.16Å; D44-H216 IonicContact OD1-CE1 3.21Å; D44-H216 PolarHBondContact OD1-CE1 3.44Å; D44-H216 IonicContact OD1-NE2 3.93Å; D44-H216 PolarHBondContact OD1-NE2 3.36Å; D44-H216 IonicContact OD2-CE1 2.76Å; D44-Y307 VanDerWaalsContact CA-CD2 3.46Å; D44-Y307 HydrophobicContact CB-CD2 3.73Å; D44-Y307 HydrophobicContact CB-CE2 4.01Å; D44-Y307 HydrophobicContact CB-CG 4.26Å; D44-Y307 WeakPolarHBondContact OD2-CE2 3.34Å
45	R	98.7	Very high	97.9	Very high	9 Å²	9	24.5 Å²	24.5	3%	0.034	13%	0.131	C	C	.	.	B	Isolated β-bridge	trans	-148.1	164	-172.4	60	157.7	174.8	73.5	4.7	111.6	H42 Q67 D208 Y307	H42-R45 VanDerWaalsContact CE1-CD 3.46Å; H42-R45 WeakPolarHBondContact CE1-CD 3.26Å; H42-R45 PolarHBondContact CE1-NE 3.23Å; H42-R45 VanDerWaalsContact CE1-NE 3.26Å; R45-Q67 CarbonylContact C-O 3.59Å; R45-Q67 WeakPolarHBondContact CA-O 3.19Å; R45-Q67 WeakPolarHBondContact CB-O 3.38Å; R45-D208 IonicContact CZ-OD1 3.43Å; R45-D208 IonicContact CZ-OD2 3.29Å; R45-D208 IonicContact NH1-OD1 2.81Å; R45-D208 PolarHBondContact NH1-OD1 3.26Å; R45-D208 IonicContact NH1-OD2 3.21Å; R45-D208 PolarHBondContact NH1-OD2 3.02Å; R45-D208 IonicContact NH2-OD1 2.64Å; R45-D208 PolarHBondContact NH2-OD1 3.47Å; R45-D208 IonicContact NH2-OD2 3.06Å; R45-D208 PolarHBondContact NH2-OD2 3.18Å; R45-Y307 HydrophobicContact CG-CE1 3.99Å
46	S	98.5	Very high	97.9	Very high	4 Å²	4	26.5 Å²	26.5	3%	0.028	14%	0.139	C	C	.	.			trans	-65.3	160.8	163	59	0	0	0	0	111.8	G64 G66 Q67	S46-G64 WeakPolarHBondContact CB-O 3.4Å; S46-G64 PolarHBondContact OG-O 3.38Å; S46-G66 PolarHBondContact OG-N 3.24Å; S46-Q67 PolarHBondContact N-O 3.4Å; S46-Q67 PolarHBondContact OG-N 2.74Å; S46-Q67 PolarHBondContact OG-O 3.08Å
47	P	98.1	Very high	97.7	Very high	0 Å²	0	29.9 Å²	29.9	0%	0	16%	0.155	C	C	.	.			trans	-51.6	143.5	171.8	-22.1	28.6	0	0	0	110.7	K49 W61 F65 G66 C212	P47-K49 WeakPolarHBondContact CB-O 3.39Å; P47-K49 PolarHBondContact O-N 3.47Å; P47-W61 VanDerWaalsContact CD-CH2 3.46Å; P47-W61 HydrophobicContact CG-CD2 4.49Å; P47-W61 HydrophobicContact CG-CH2 4.1Å; P47-W61 HydrophobicContact CG-CZ2 3.46Å; P47-W61 VanDerWaalsContact CG-CZ2 3.46Å; P47-F65 HydrophobicContact CB-CD1 4.15Å; P47-F65 HydrophobicContact CB-CE1 4.29Å; P47-F65 HydrophobicContact CG-CD1 4.49Å; P47-F65 HydrophobicContact CG-CE1 4.41Å; P47-F65 CarbonylContact O-C 3.47Å; P47-F65 VanDerWaalsContact O-CA 3.26Å; P47-F65 WeakPolarHBondContact O-CA 3.37Å; P47-F65 WeakPolarHBondContact O-CB 3.35Å; P47-F65 VanDerWaalsContact O-CD1 3.32Å; P47-F65 WeakPolarHBondContact O-CD1 3.37Å; P47-G66 PolarHBondContact O-N 3.47Å; P47-C212 HydrophobicContact CG-CB 3.72Å
48	V	96.7	Very high	97.7	Very high	47 Å²	47	34.3 Å²	34.3	29%	0.285	18%	0.176	S	C	.	.	S	Bend	trans	-72.4	-19.5	174.6	-71.4	0	0	0	0	113.3	W204	V48-W204 HydrophobicContact CG2-CH2 4.33Å; V48-W204 HydrophobicContact CG2-CZ3 4.15Å
49	K	95.1	Very high	97.5	Very high	103 Å²	103	41.9 Å²	41.9	45%	0.448	21%	0.211	S	C	.	.			trans	-171.2	176.9	173.2	59.8	-177.3	177.4	178.4	0	108	P47 N205 T209	P47-K49 WeakPolarHBondContact CB-O 3.39Å; P47-K49 PolarHBondContact O-N 3.47Å; K49-N205 WeakPolarHBondContact CE-OD1 3.33Å; K49-N205 PolarHBondContact NZ-OD1 2.98Å; K49-T209 PolarHBondContact O-OG1 3.26Å
50	T	96.4	Very high	97.4	Very high	30 Å²	30	47.7 Å²	47.7	18%	0.184	24%	0.238	C	C	.	.			trans	-130.9	177.2	173	-165.5	0	0	0	0	113.2	D54 F65 T209	T50-D54 WeakPolarHBondContact CB-OD2 3.43Å; T50-D54 HydrophobicContact CG2-CB 4.18Å; T50-D54 WeakPolarHBondContact OG1-CB 3.48Å; T50-D54 PolarHBondContact OG1-OD2 2.97Å; T50-F65 HydrophobicContact CG2-CE2 4.16Å; T50-F65 HydrophobicContact CG2-CZ 3.67Å; T50-T209 WeakPolarHBondContact OG1-CG2 3.49Å
51	Y	96.6	Very high	97.3	Very high	6 Å²	6	48.4 Å²	48.4	2%	0.024	24%	0.241	C	C	.	.			trans	-96.1	154.3	176.6	54.9	-92.9	0	0	0	112.3	K53 D54 T193 V206 T209 L210 W223	Y51-K53 VanDerWaalsContact C-N 3.27Å; Y51-K53 HydrophobicContact CD2-CB 4.41Å; Y51-K53 PolarHBondContact O-N 2.97Å; Y51-K53 VanDerWaalsContact O-N 3.08Å; Y51-D54 HydrophobicContact CD1-CB 4.34Å; Y51-D54 HydrophobicContact CD2-CB 3.79Å; Y51-D54 HydrophobicContact CE1-CB 4.1Å; Y51-D54 HydrophobicContact CE2-CB 3.55Å; Y51-D54 VanDerWaalsContact CE2-N 3.34Å; Y51-D54 HydrophobicContact CG-CB 4.17Å; Y51-D54 VanDerWaalsContact O-CB 3.29Å; Y51-D54 WeakPolarHBondContact O-CB 3.19Å; Y51-D54 PolarHBondContact O-N 2.86Å; Y51-T193 HydrophobicContact CD1-CG2 4.08Å; Y51-T193 HydrophobicContact CD2-CG2 3.72Å; Y51-T193 HydrophobicContact CE1-CG2 4.39Å; Y51-T193 HydrophobicContact CE2-CG2 4.02Å; Y51-T193 HydrophobicContact CG-CG2 3.76Å; Y51-V206 HydrophobicContact CD1-CG1 4.41Å; Y51-V206 HydrophobicContact CE1-CG1 4.44Å; Y51-T209 HydrophobicContact CD1-CG2 3.99Å; Y51-T209 HydrophobicContact CE1-CG2 3.69Å; Y51-L210 HydrophobicContact CE1-CD2 4.29Å; Y51-L210 HydrophobicContact CE1-CG 4.36Å; Y51-L210 WeakPolarHBondContact OH-CD2 3.44Å; Y51-W223 HydrophobicContact CE2-CZ2 4.24Å; Y51-W223 AromaticContact CZ-CZ2 3.91Å
52	P	97	Very high	97.2	Very high	91 Å²	91	53.4 Å²	53.4	59%	0.591	27%	0.274	S	S	*	.	T	Hydrogen-bonded Turn	trans	-55.7	-31.8	-169.9	-30.2	35.8	0	0	0	116.7	T193 L195	P52-T193 WeakPolarHBondContact CD-O 3.39Å; P52-L195 HydrophobicContact CG-CD2 4.42Å
53	K	97.5	Very high	97.1	Very high	127 Å²	127	58.8 Å²	58.8	55%	0.552	30%	0.299	S	S	*	.	T	Hydrogen-bonded Turn	trans	-94.3	3.6	-179	-68.2	-177.6	175.3	-178.8	0	114.4	Y51 N191 E192 T193	Y51-K53 VanDerWaalsContact C-N 3.27Å; Y51-K53 HydrophobicContact CD2-CB 4.41Å; Y51-K53 PolarHBondContact O-N 2.97Å; Y51-K53 VanDerWaalsContact O-N 3.08Å; K53-N191 PolarHBondContact NZ-O 3.49Å; K53-E192 WeakPolarHBondContact CB-O 3.48Å; K53-E192 WeakPolarHBondContact CD-O 3.45Å; K53-T193 WeakPolarHBondContact CB-O 3.39Å; K53-T193 PolarHBondContact N-O 3.31Å
54	D	97.8	Very high	97.1	Very high	6 Å²	6	59.3 Å²	59.3	3%	0.032	30%	0.304	C	S	.	.			trans	-68	128.3	176.8	178.4	24.3	0	0	0	110.4	T50 Y51 Y56 Q57	T50-D54 WeakPolarHBondContact CB-OD2 3.43Å; T50-D54 HydrophobicContact CG2-CB 4.18Å; T50-D54 WeakPolarHBondContact OG1-CB 3.48Å; T50-D54 PolarHBondContact OG1-OD2 2.97Å; Y51-D54 HydrophobicContact CD1-CB 4.34Å; Y51-D54 HydrophobicContact CD2-CB 3.79Å; Y51-D54 HydrophobicContact CE1-CB 4.1Å; Y51-D54 HydrophobicContact CE2-CB 3.55Å; Y51-D54 VanDerWaalsContact CE2-N 3.34Å; Y51-D54 HydrophobicContact CG-CB 4.17Å; Y51-D54 VanDerWaalsContact O-CB 3.29Å; Y51-D54 WeakPolarHBondContact O-CB 3.19Å; Y51-D54 PolarHBondContact O-N 2.86Å; D54-Y56 VanDerWaalsContact CG-N 3.34Å; D54-Y56 PolarHBondContact O-N 3.36Å; D54-Y56 PolarHBondContact OD1-N 2.88Å; D54-Q57 PolarHBondContact O-NE2 2.98Å
55	P	95.9	Very high	97.1	Very high	84 Å²	84	61 Å²	61	55%	0.545	31%	0.312	S	S	.	.	S	Bend	trans	-66.2	-21.6	171.8	27.7	-36.9	0	0	0	113.7	Q57	P55-Q57 PolarHBondContact O-N 2.9Å
56	Y	97.1	Very high	97	Very high	41 Å²	41	60.8 Å²	60.8	16%	0.161	31%	0.313	C	S	.	.			trans	-98.1	75.6	-172.9	-54.3	-61.6	0	0	0	113.1	D54 E60 E213 L218 H219	D54-Y56 VanDerWaalsContact CG-N 3.34Å; D54-Y56 PolarHBondContact O-N 3.36Å; D54-Y56 PolarHBondContact OD1-N 2.88Å; Y56-E60 HydrophobicContact CD1-CG 4.25Å; Y56-E213 HydrophobicContact CD2-CG 4.02Å; Y56-L218 HydrophobicContact CD1-CD1 4.07Å; Y56-L218 HydrophobicContact CD2-CB 4.38Å; Y56-L218 HydrophobicContact CD2-CD1 4.16Å; Y56-L218 HydrophobicContact CE1-CD1 4.41Å; Y56-L218 HydrophobicContact CE1-CD2 4.34Å; Y56-L218 HydrophobicContact CE2-CB 3.94Å; Y56-L218 HydrophobicContact CE2-CD1 4.47Å; Y56-L218 HydrophobicContact CG-CD1 3.94Å; Y56-H219 WeakPolarHBondContact CE2-O 3.4Å; Y56-H219 PolarHBondContact OH-N 3.28Å; Y56-H219 PolarHBondContact OH-O 3.11Å; Y56-H219 VanDerWaalsContact OH-O 3.12Å
57	Q	96.6	Very high	97	Very high	72 Å²	72	62.7 Å²	62.7	34%	0.336	32%	0.321	S	S	.	.			trans	-70.9	178.2	176.7	-60.4	-58.1	-51.8	0	0	112.5	D54 P55 E59 E60	D54-Q57 PolarHBondContact O-NE2 2.98Å; P55-Q57 PolarHBondContact O-N 2.9Å; Q57-E59 VanDerWaalsContact CB-OE2 3.27Å; Q57-E59 WeakPolarHBondContact CB-OE2 3.27Å; Q57-E59 PolarHBondContact O-N 3Å; Q57-E59 VanDerWaalsContact O-N 3.07Å; Q57-E60 WeakPolarHBondContact O-CB 3.46Å; Q57-E60 PolarHBondContact O-N 3.25Å
58	E	96.9	Very high	97.1	Very high	93 Å²	93	62.8 Å²	62.8	44%	0.435	32%	0.322	S	S	.	.	G	3₁₀ helix	trans	-55.4	-32.7	-171	-172	162.1	-148.3	0	0	113.1	E60 W61 F65	E58-E60 PolarHBondContact O-N 3.14Å; E58-W61 PolarHBondContact O-N 2.84Å; E58-F65 HydrophobicContact CB-CD2 3.72Å; E58-F65 HydrophobicContact CB-CE1 4.45Å; E58-F65 HydrophobicContact CB-CE2 3.55Å; E58-F65 HydrophobicContact CB-CG 4.26Å; E58-F65 HydrophobicContact CB-CZ 3.94Å; E58-F65 HydrophobicContact CG-CB 4.46Å; E58-F65 HydrophobicContact CG-CD2 3.81Å; E58-F65 HydrophobicContact CG-CE2 4.18Å; E58-F65 HydrophobicContact CG-CG 4.01Å; E58-F65 VanDerWaalsContact N-CZ 3.33Å; E58-F65 PolarHBondContact OE1-N 3.24Å
59	E	96.4	Very high	97.2	Very high	159 Å²	159	61.3 Å²	61.3	74%	0.743	31%	0.313	S	S	*	.	G	3₁₀ helix	trans	-66.6	-22	-177.9	-57.9	78.5	-169.9	0	0	113.7	Q57 W61	Q57-E59 VanDerWaalsContact CB-OE2 3.27Å; Q57-E59 WeakPolarHBondContact CB-OE2 3.27Å; Q57-E59 PolarHBondContact O-N 3Å; Q57-E59 VanDerWaalsContact O-N 3.07Å; E59-W61 PolarHBondContact O-N 3.48Å
60	E	95.8	Very high	97.3	Very high	122 Å²	122	64.8 Å²	64.8	57%	0.57	33%	0.328	S	S	*	.	G	3₁₀ helix	trans	-75.2	-15.4	175.4	-64.1	-64.5	142.5	0	0	112	Y56 Q57 E58	Y56-E60 HydrophobicContact CD1-CG 4.25Å; Q57-E60 WeakPolarHBondContact O-CB 3.46Å; Q57-E60 PolarHBondContact O-N 3.25Å; E58-E60 PolarHBondContact O-N 3.14Å
61	W	97.1	Very high	97.4	Very high	15 Å²	15	67.6 Å²	67.6	6%	0.057	34%	0.339	C	S	.	.	S	Bend	trans	-96.9	119.7	179.2	-63.5	89.2	0	0	0	109.9	P47 E58 E59 Q63 G64 F65 C212 E213 H216 L218	P47-W61 VanDerWaalsContact CD-CH2 3.46Å; P47-W61 HydrophobicContact CG-CD2 4.49Å; P47-W61 HydrophobicContact CG-CH2 4.1Å; P47-W61 HydrophobicContact CG-CZ2 3.46Å; P47-W61 VanDerWaalsContact CG-CZ2 3.46Å; E58-W61 PolarHBondContact O-N 2.84Å; E59-W61 PolarHBondContact O-N 3.48Å; W61-Q63 PolarHBondContact O-N 3.31Å; W61-G64 PolarHBondContact O-N 3.4Å; W61-F65 AromaticContact CD1-CD1 3.85Å; W61-F65 AromaticContact CD1-CE1 3.45Å; W61-F65 VanDerWaalsContact CD1-CE1 3.45Å; W61-F65 HydrophobicContact CG-CD1 4.35Å; W61-F65 HydrophobicContact CG-CE1 4.35Å; W61-F65 AromaticContact NE1-CE1 3.66Å; W61-C212 HydrophobicContact CH2-CB 4.04Å; W61-E213 HydrophobicContact CZ2-CG 4.02Å; W61-H216 HydrophobicContact CH2-CB 4.17Å; W61-H216 AromaticContact CH2-CG 3.97Å; W61-H216 AromaticContact CH2-ND1 3.87Å; W61-H216 HydrophobicContact CZ3-CB 4.23Å; W61-H216 AromaticContact CZ3-CD2 3.96Å; W61-H216 AromaticContact CZ3-CE1 3.99Å; W61-H216 AromaticContact CZ3-CG 3.69Å; W61-H216 AromaticContact CZ3-ND1 3.71Å; W61-L218 HydrophobicContact CH2-CD1 4.39Å; W61-L218 HydrophobicContact CZ2-CD1 4.03Å
62	P	96.4	Very high	97.5	Very high	110 Å²	110	67.3 Å²	67.3	71%	0.714	34%	0.338	S	S	*	.	T	Hydrogen-bonded Turn	trans	-56.4	-22.1	-171.9	-32.4	38.7	0	0	0	116.4
63	Q	97.2	Very high	97.6	Very high	114 Å²	114	66.2 Å²	66.2	53%	0.533	33%	0.326	S	S	.	.	T	Hydrogen-bonded Turn	trans	-117.9	5	177.5	-72.5	73.4	75.7	0	0	112.2	W61 Q67	W61-Q63 PolarHBondContact O-N 3.31Å; Q63-Q67 HydrophobicContact CB-CB 3.63Å; Q63-Q67 HydrophobicContact CB-CG 3.91Å; Q63-Q67 VanDerWaalsContact O-CG 3.3Å; Q63-Q67 WeakPolarHBondContact O-CG 3.47Å
64	G	98.1	Very high	97.7	Very high	11 Å²	11	63.7 Å²	63.7	11%	0.113	32%	0.317	C	S	.	.			trans	77.1	-166.9	-168.9	0	0	0	0	0	113.2	S46 W61	S46-G64 WeakPolarHBondContact CB-O 3.4Å; S46-G64 PolarHBondContact OG-O 3.38Å; W61-G64 PolarHBondContact O-N 3.4Å
65	F	98.4	Very high	97.7	Very high	37 Å²	37	64.9 Å²	64.9	16%	0.162	32%	0.323	C	S	.	.	T	Hydrogen-bonded Turn	trans	-79.1	148.2	-173.4	-72.5	-37.7	0	0	0	113.8	P47 T50 E58 W61 Q67	P47-F65 HydrophobicContact CB-CD1 4.15Å; P47-F65 HydrophobicContact CB-CE1 4.29Å; P47-F65 HydrophobicContact CG-CD1 4.49Å; P47-F65 HydrophobicContact CG-CE1 4.41Å; P47-F65 CarbonylContact O-C 3.47Å; P47-F65 VanDerWaalsContact O-CA 3.26Å; P47-F65 WeakPolarHBondContact O-CA 3.37Å; P47-F65 WeakPolarHBondContact O-CB 3.35Å; P47-F65 VanDerWaalsContact O-CD1 3.32Å; P47-F65 WeakPolarHBondContact O-CD1 3.37Å; T50-F65 HydrophobicContact CG2-CE2 4.16Å; T50-F65 HydrophobicContact CG2-CZ 3.67Å; E58-F65 HydrophobicContact CB-CD2 3.72Å; E58-F65 HydrophobicContact CB-CE1 4.45Å; E58-F65 HydrophobicContact CB-CE2 3.55Å; E58-F65 HydrophobicContact CB-CG 4.26Å; E58-F65 HydrophobicContact CB-CZ 3.94Å; E58-F65 HydrophobicContact CG-CB 4.46Å; E58-F65 HydrophobicContact CG-CD2 3.81Å; E58-F65 HydrophobicContact CG-CE2 4.18Å; E58-F65 HydrophobicContact CG-CG 4.01Å; E58-F65 VanDerWaalsContact N-CZ 3.33Å; E58-F65 PolarHBondContact OE1-N 3.24Å; W61-F65 AromaticContact CD1-CD1 3.85Å; W61-F65 AromaticContact CD1-CE1 3.45Å; W61-F65 VanDerWaalsContact CD1-CE1 3.45Å; W61-F65 HydrophobicContact CG-CD1 4.35Å; W61-F65 HydrophobicContact CG-CE1 4.35Å; W61-F65 AromaticContact NE1-CE1 3.66Å; F65-Q67 PolarHBondContact O-N 2.89Å
66	G	98.1	Very high	97.9	Very high	5 Å²	5	60.9 Å²	60.9	5%	0.052	30%	0.297	C	S	.	.	T	Hydrogen-bonded Turn	trans	70.4	14.2	173.7	0	0	0	0	0	115.2	S46 P47 R109	S46-G66 PolarHBondContact OG-N 3.24Å; P47-G66 PolarHBondContact O-N 3.47Å; G66-R109 WeakPolarHBondContact O-CD 3.44Å; G66-R109 PolarHBondContact O-NH1 3.44Å
67	Q	98.8	Very high	97.9	Very high	44 Å²	44	64 Å²	64	21%	0.206	31%	0.309	C	S	.	.	P	Polyproline II helix	trans	-97.4	143.6	-174.4	-69.1	-60.6	-28.2	0	0	112.2	R45 S46 Q63 F65 D108	R45-Q67 CarbonylContact C-O 3.59Å; R45-Q67 WeakPolarHBondContact CA-O 3.19Å; R45-Q67 WeakPolarHBondContact CB-O 3.38Å; S46-Q67 PolarHBondContact N-O 3.4Å; S46-Q67 PolarHBondContact OG-N 2.74Å; S46-Q67 PolarHBondContact OG-O 3.08Å; Q63-Q67 HydrophobicContact CB-CB 3.63Å; Q63-Q67 HydrophobicContact CB-CG 3.91Å; Q63-Q67 VanDerWaalsContact O-CG 3.3Å; Q63-Q67 WeakPolarHBondContact O-CG 3.47Å; F65-Q67 PolarHBondContact O-N 2.89Å; Q67-D108 PolarHBondContact NE2-OD2 3.07Å; Q67-D108 PolarHBondContact OE1-OD2 3.37Å
68	L	98.8	Very high	98	Very high	2 Å²	2	64.4 Å²	64.4	1%	0.01	31%	0.31	C	S	.	.	B	Isolated β-bridge	trans	-68.4	132.6	178.9	-167.2	75.9	0	0	0	110.3	D44 M73 R109 M112 S113	D44-L68 WeakPolarHBondContact O-CD1 3.47Å; L68-M73 HydrophobicContact CD2-CG 3.71Å; L68-M73 HydrophobicContact CG-CG 4.32Å; L68-R109 HydrophobicContact CB-CB 4.08Å; L68-R109 HydrophobicContact CD1-CB 4.44Å; L68-M112 HydrophobicContact CD2-CB 3.67Å; L68-S113 WeakPolarHBondContact CD1-OG 3.43Å
69	T	98.7	Very high	98.1	Very high	16 Å²	16	60 Å²	60	10%	0.098	29%	0.29	C	S	.	.	P	Polyproline II helix	trans	-88.8	172.7	179.3	72.7	0	0	0	0	111.3	D44 E71 G72 M73 H216	D44-T69 PolarHBondContact O-N 3.21Å; D44-T69 PolarHBondContact O-OG1 2.82Å; D44-T69 WeakPolarHBondContact OD1-CB 3.19Å; D44-T69 WeakPolarHBondContact OD1-CG2 3.39Å; D44-T69 PolarHBondContact OD1-OG1 2.98Å; T69-E71 PolarHBondContact O-N 3.34Å; T69-E71 PolarHBondContact OG1-N 2.9Å; T69-G72 PolarHBondContact O-N 2.99Å; T69-G72 VanDerWaalsContact O-N 3.17Å; T69-G72 PolarHBondContact OG1-N 3.42Å; T69-G72 VanDerWaalsContact OG1-N 3.11Å; T69-M73 WeakPolarHBondContact O-CG 3.23Å; T69-M73 PolarHBondContact O-N 3.41Å; T69-H216 VanDerWaalsContact CG2-NE2 3.33Å; T69-H216 WeakPolarHBondContact CG2-NE2 3.37Å
70	K	98.3	Very high	98.2	Very high	175 Å²	175	52.4 Å²	52.4	76%	0.761	25%	0.254	S	S	*	.	H	α-helix	trans	-60.3	-35.7	171.8	-66.4	179.5	-177.9	174.6	0	112.1	M73 L74	K70-M73 PolarHBondContact O-N 2.92Å; K70-L74 PolarHBondContact O-N 3.4Å
71	E	98.4	Very high	98.3	Very high	90 Å²	90	49.9 Å²	49.9	42%	0.421	24%	0.243	S	C	.	.	H	α-helix	trans	-64.9	-44.3	174.7	177.9	55.4	-150.5	0	0	110.2	D44 T69 M73 L74 Q75	D44-E71 HydrophobicContact CB-CB 4.31Å; D44-E71 HydrophobicContact CB-CG 4.08Å; T69-E71 PolarHBondContact O-N 3.34Å; T69-E71 PolarHBondContact OG1-N 2.9Å; E71-M73 VanDerWaalsContact C-N 3.32Å; E71-M73 PolarHBondContact O-N 2.73Å; E71-L74 WeakPolarHBondContact O-CB 3.24Å; E71-L74 PolarHBondContact O-N 2.78Å; E71-L74 VanDerWaalsContact O-N 3.11Å; E71-Q75 VanDerWaalsContact O-CG 3.29Å; E71-Q75 WeakPolarHBondContact O-CG 3.24Å; E71-Q75 PolarHBondContact O-N 2.85Å; E71-Q75 WeakPolarHBondContact OE1-CG 3.46Å; E71-Q75 PolarHBondContact OE1-NE2 3.43Å
72	G	98.8	Very high	98.4	Very high	0 Å²	0	50.7 Å²	50.7	0%	0	25%	0.253	C	S	.	.	H	α-helix	trans	-62	-36.4	176	0	0	0	0	0	114	D44 T69 H76	D44-G72 WeakPolarHBondContact O-CA 3.16Å; T69-G72 PolarHBondContact O-N 2.99Å; T69-G72 VanDerWaalsContact O-N 3.17Å; T69-G72 PolarHBondContact OG1-N 3.42Å; T69-G72 VanDerWaalsContact OG1-N 3.11Å; G72-H76 PolarHBondContact O-N 3.39Å
73	M	98.9	Very high	98.5	Very high	68 Å²	68	45.7 Å²	45.7	34%	0.335	22%	0.219	S	C	.	.	H	α-helix	trans	-63.1	-45.8	171.8	-63.9	173.9	-156.1	0	0	111.5	L68 T69 K70 E71 H76 W77 M112 A116	L68-M73 HydrophobicContact CD2-CG 3.71Å; L68-M73 HydrophobicContact CG-CG 4.32Å; T69-M73 WeakPolarHBondContact O-CG 3.23Å; T69-M73 PolarHBondContact O-N 3.41Å; K70-M73 PolarHBondContact O-N 2.92Å; E71-M73 VanDerWaalsContact C-N 3.32Å; E71-M73 PolarHBondContact O-N 2.73Å; M73-H76 PolarHBondContact O-N 3.3Å; M73-W77 WeakPolarHBondContact O-CB 3.31Å; M73-W77 PolarHBondContact O-N 3.24Å; M73-M112 HydrophobicContact CE-CE 3.53Å; M73-A116 HydrophobicContact CB-CB 4.42Å
74	L	98.7	Very high	98.5	Very high	73 Å²	73	41.8 Å²	41.8	38%	0.382	20%	0.2	S	C	.	.	H	α-helix	trans	-62	-47.5	178.6	179.3	60.7	0	0	0	111.2	K70 E71 H76 W77 E78	K70-L74 PolarHBondContact O-N 3.4Å; E71-L74 WeakPolarHBondContact O-CB 3.24Å; E71-L74 PolarHBondContact O-N 2.78Å; E71-L74 VanDerWaalsContact O-N 3.11Å; L74-H76 VanDerWaalsContact C-N 3.29Å; L74-H76 PolarHBondContact O-N 3.34Å; L74-W77 HydrophobicContact CD1-CE3 4.01Å; L74-W77 WeakPolarHBondContact O-CB 3.47Å; L74-W77 PolarHBondContact O-N 3.21Å; L74-W77 VanDerWaalsContact O-N 3.12Å; L74-E78 HydrophobicContact CD1-CG 4.14Å; L74-E78 HydrophobicContact CG-CG 4.38Å; L74-E78 WeakPolarHBondContact O-CG 3.29Å; L74-E78 PolarHBondContact O-N 2.91Å
75	Q	98.8	Very high	98.4	Very high	32 Å²	32	48.8 Å²	48.8	15%	0.15	23%	0.23	C	C	.	.	H	α-helix	trans	-54.8	-43.6	177.4	-72	169.5	-3.8	0	0	112.3	E71 L79 A308	E71-Q75 VanDerWaalsContact O-CG 3.29Å; E71-Q75 WeakPolarHBondContact O-CG 3.24Å; E71-Q75 PolarHBondContact O-N 2.85Å; E71-Q75 WeakPolarHBondContact OE1-CG 3.46Å; E71-Q75 PolarHBondContact OE1-NE2 3.43Å; Q75-L79 WeakPolarHBondContact O-CB 3.4Å; Q75-L79 PolarHBondContact O-N 2.75Å; Q75-A308 HydrophobicContact CB-CB 3.83Å
76	H	98.9	Very high	98.4	Very high	0 Å²	0	51.2 Å²	51.2	0%	0	24%	0.238	C	C	.	.	H	α-helix	trans	-71.6	-38.5	177.5	-95.1	-74.8	0	0	0	113.2	Y40 R41 H42 G43 G72 M73 L74 E78 L79 G80 S113 A116 N117	Y40-H76 AromaticContact CD2-CE1 3.37Å; Y40-H76 WeakPolarHBondContact CD2-CE1 3.48Å; Y40-H76 AromaticContact CE2-CE1 3.64Å; Y40-H76 AromaticContact CE2-ND1 3.97Å; Y40-H76 AromaticContact CG-CE1 3.94Å; R41-H76 PolarHBondContact O-CE1 2.94Å; R41-H76 VanDerWaalsContact O-CE1 3.23Å; R41-H76 PolarHBondContact O-NE2 3.43Å; H42-H76 VanDerWaalsContact CA-NE2 3.35Å; H42-H76 WeakPolarHBondContact CA-NE2 3.34Å; G43-H76 PolarHBondContact N-CD2 3.13Å; G43-H76 PolarHBondContact N-NE2 3.18Å; G72-H76 PolarHBondContact O-N 3.39Å; M73-H76 PolarHBondContact O-N 3.3Å; L74-H76 VanDerWaalsContact C-N 3.29Å; L74-H76 PolarHBondContact O-N 3.34Å; H76-E78 VanDerWaalsContact C-N 3.34Å; H76-L79 PolarHBondContact O-N 3.19Å; H76-G80 PolarHBondContact O-N 3.49Å; H76-S113 WeakPolarHBondContact CB-O 3.38Å; H76-S113 WeakPolarHBondContact CD2-CB 3.37Å; H76-S113 PolarHBondContact CD2-OG 2.86Å; H76-S113 VanDerWaalsContact CD2-OG 3.26Å; H76-S113 PolarHBondContact ND1-O 2.91Å; H76-S113 WeakPolarHBondContact NE2-CB 3.46Å; H76-S113 PolarHBondContact NE2-OG 3.5Å; H76-A116 HydrophobicContact CB-CB 3.95Å; H76-N117 HydrophobicContact CB-CB 4.18Å; H76-N117 VanDerWaalsContact O-CA 3.24Å; H76-N117 WeakPolarHBondContact O-CA 3.3Å; H76-N117 PolarHBondContact O-ND2 2.95Å
77	W	98.8	Very high	98.4	Very high	107 Å²	107	51.1 Å²	51.1	41%	0.405	24%	0.236	S	C	.	.	H	α-helix	trans	-59.6	-45.3	173.4	178.4	84.9	0	0	0	111.3	M73 L74 G80 Q81 A116	M73-W77 WeakPolarHBondContact O-CB 3.31Å; M73-W77 PolarHBondContact O-N 3.24Å; L74-W77 HydrophobicContact CD1-CE3 4.01Å; L74-W77 WeakPolarHBondContact O-CB 3.47Å; L74-W77 PolarHBondContact O-N 3.21Å; L74-W77 VanDerWaalsContact O-N 3.12Å; W77-G80 WeakPolarHBondContact O-CA 3.45Å; W77-G80 PolarHBondContact O-N 2.93Å; W77-G80 VanDerWaalsContact O-N 3.11Å; W77-Q81 HydrophobicContact CD2-CG 4.22Å; W77-Q81 HydrophobicContact CE3-CG 4.31Å; W77-Q81 HydrophobicContact CH2-CG 4.14Å; W77-Q81 HydrophobicContact CZ2-CG 4.04Å; W77-Q81 HydrophobicContact CZ3-CG 4.27Å; W77-Q81 WeakPolarHBondContact O-CG 3.48Å; W77-Q81 PolarHBondContact O-N 3.4Å; W77-A116 WeakPolarHBondContact CA-O 3.22Å
78	E	98.6	Very high	98.3	Very high	79 Å²	79	55.9 Å²	55.9	37%	0.369	26%	0.258	S	S	.	.	H	α-helix	trans	-64.3	-42.2	175.8	-70.3	-177.7	163.7	0	0	112.4	L74 H76 G80 Q81 A82	L74-E78 HydrophobicContact CD1-CG 4.14Å; L74-E78 HydrophobicContact CG-CG 4.38Å; L74-E78 WeakPolarHBondContact O-CG 3.29Å; L74-E78 PolarHBondContact O-N 2.91Å; H76-E78 VanDerWaalsContact C-N 3.34Å; E78-G80 PolarHBondContact O-N 2.96Å; E78-Q81 WeakPolarHBondContact O-CB 3.46Å; E78-Q81 PolarHBondContact O-N 3.08Å; E78-A82 PolarHBondContact O-N 2.95Å
79	L	98.8	Very high	98.1	Very high	0 Å²	0	59.4 Å²	59.4	0%	0	30%	0.295	C	S	.	.	H	α-helix	trans	-57.3	-42.5	171.1	175.4	65.8	0	0	0	110.6	Y40 Q75 H76 Q81 A82 L83 N117 A308 C310	Y40-L79 HydrophobicContact CD1-CD2 4.08Å; Y40-L79 HydrophobicContact CG-CD2 4.26Å; Q75-L79 WeakPolarHBondContact O-CB 3.4Å; Q75-L79 PolarHBondContact O-N 2.75Å; H76-L79 PolarHBondContact O-N 3.19Å; L79-Q81 VanDerWaalsContact C-N 3.34Å; L79-Q81 PolarHBondContact O-N 3.02Å; L79-A82 PolarHBondContact O-N 3.42Å; L79-L83 HydrophobicContact CD1-CD1 4.16Å; L79-L83 HydrophobicContact CD1-CG 4.2Å; L79-L83 HydrophobicContact CG-CD1 3.89Å; L79-L83 HydrophobicContact CG-CG 4.39Å; L79-L83 WeakPolarHBondContact O-CB 3.49Å; L79-L83 WeakPolarHBondContact O-CD1 3.47Å; L79-L83 WeakPolarHBondContact O-CG 3.36Å; L79-L83 PolarHBondContact O-N 2.95Å; L79-N117 WeakPolarHBondContact CG-ND2 3.45Å; L79-A308 WeakPolarHBondContact CD2-O 3.15Å; L79-C310 HydrophobicContact CD1-CB 4.11Å; L79-C310 HydrophobicContact CD2-CB 4.25Å
80	G	98.6	Very high	98	Very high	0 Å²	0	60 Å²	60	0%	0	30%	0.296	C	S	.	.	H	α-helix	trans	-59.1	-43.8	176.4	0	0	0	0	0	112.3	H76 W77 E78 L83 R84 N117	H76-G80 PolarHBondContact O-N 3.49Å; W77-G80 WeakPolarHBondContact O-CA 3.45Å; W77-G80 PolarHBondContact O-N 2.93Å; W77-G80 VanDerWaalsContact O-N 3.11Å; E78-G80 PolarHBondContact O-N 2.96Å; G80-L83 PolarHBondContact O-N 2.83Å; G80-R84 WeakPolarHBondContact O-CB 3.17Å; G80-R84 PolarHBondContact O-N 3.37Å; G80-N117 WeakPolarHBondContact CA-ND2 3.16Å; G80-N117 WeakPolarHBondContact CA-O 3.38Å; G80-N117 PolarHBondContact N-ND2 3.49Å; G80-N117 VanDerWaalsContact N-ND2 3.12Å
81	Q	98	Very high	97.9	Very high	70 Å²	70	52 Å²	52	33%	0.327	26%	0.261	S	S	.	.	H	α-helix	trans	-65	-42.5	176	-66	-76	32.5	0	0	112.3	W77 E78 L79 L83 R84 Q85 G120	W77-Q81 HydrophobicContact CD2-CG 4.22Å; W77-Q81 HydrophobicContact CE3-CG 4.31Å; W77-Q81 HydrophobicContact CH2-CG 4.14Å; W77-Q81 HydrophobicContact CZ2-CG 4.04Å; W77-Q81 HydrophobicContact CZ3-CG 4.27Å; W77-Q81 WeakPolarHBondContact O-CG 3.48Å; W77-Q81 PolarHBondContact O-N 3.4Å; E78-Q81 WeakPolarHBondContact O-CB 3.46Å; E78-Q81 PolarHBondContact O-N 3.08Å; L79-Q81 VanDerWaalsContact C-N 3.34Å; L79-Q81 PolarHBondContact O-N 3.02Å; Q81-L83 VanDerWaalsContact C-N 3.34Å; Q81-L83 PolarHBondContact O-N 3.36Å; Q81-R84 WeakPolarHBondContact O-CB 3.3Å; Q81-R84 PolarHBondContact O-N 2.9Å; Q81-Q85 PolarHBondContact O-N 3.3Å; Q81-G120 PolarHBondContact OE1-O 3.36Å
82	A	98.1	Very high	97.7	Very high	32 Å²	32	50.9 Å²	50.9	26%	0.264	26%	0.258	S	S	.	.	H	α-helix	trans	-62.7	-41.5	176.2	0	0	0	0	0	111.6	E78 L79 Q85 R86	E78-A82 PolarHBondContact O-N 2.95Å; L79-A82 PolarHBondContact O-N 3.42Å; A82-Q85 PolarHBondContact O-N 3.47Å; A82-R86 WeakPolarHBondContact O-CB 3.42Å; A82-R86 PolarHBondContact O-N 3.01Å
83	L	98.4	Very high	97.4	Very high	4 Å²	4	54.9 Å²	54.9	2%	0.021	28%	0.283	C	S	.	.	H	α-helix	trans	-66.6	-37.9	175.1	-66.7	165.7	0	0	0	111.6	L38 L79 G80 Q81 Q85 R86 Y87 L121 I312	L38-L83 HydrophobicContact CD1-CD1 3.63Å; L38-L83 HydrophobicContact CD1-CD2 3.83Å; L38-L83 HydrophobicContact CD1-CG 4.29Å; L38-L83 HydrophobicContact CD2-CD2 4.03Å; L79-L83 HydrophobicContact CD1-CD1 4.16Å; L79-L83 HydrophobicContact CD1-CG 4.2Å; L79-L83 HydrophobicContact CG-CD1 3.89Å; L79-L83 HydrophobicContact CG-CG 4.39Å; L79-L83 WeakPolarHBondContact O-CB 3.49Å; L79-L83 WeakPolarHBondContact O-CD1 3.47Å; L79-L83 WeakPolarHBondContact O-CG 3.36Å; L79-L83 PolarHBondContact O-N 2.95Å; G80-L83 PolarHBondContact O-N 2.83Å; Q81-L83 VanDerWaalsContact C-N 3.34Å; Q81-L83 PolarHBondContact O-N 3.36Å; L83-Q85 VanDerWaalsContact C-N 3.31Å; L83-Q85 PolarHBondContact O-N 3.04Å; L83-R86 PolarHBondContact O-N 3.31Å; L83-Y87 HydrophobicContact CB-CD2 4.38Å; L83-Y87 HydrophobicContact CD2-CD2 4.5Å; L83-Y87 HydrophobicContact CD2-CE2 3.82Å; L83-Y87 VanDerWaalsContact O-CD2 3.25Å; L83-Y87 WeakPolarHBondContact O-CD2 3.49Å; L83-Y87 PolarHBondContact O-N 3.48Å; L83-L121 HydrophobicContact CB-CD1 4.01Å; L83-I312 HydrophobicContact CD2-CD1 4.48Å
84	R	97.6	Very high	97.1	Very high	33 Å²	33	52.9 Å²	52.9	13%	0.125	28%	0.276	C	S	.	.	H	α-helix	trans	-59.8	-43.1	174.1	176.9	55.6	-172.7	163.3	13	111.5	G80 Q81 H88 L91 N92 T93 L121	G80-R84 WeakPolarHBondContact O-CB 3.17Å; G80-R84 PolarHBondContact O-N 3.37Å; Q81-R84 WeakPolarHBondContact O-CB 3.3Å; Q81-R84 PolarHBondContact O-N 2.9Å; R84-H88 PolarHBondContact O-N 3.31Å; R84-L91 PolarHBondContact NH1-O 2.86Å; R84-N92 PolarHBondContact NH1-O 2.84Å; R84-T93 PolarHBondContact NH2-OG1 2.92Å; R84-L121 HydrophobicContact CB-CD1 3.85Å; R84-L121 WeakPolarHBondContact CD-O 3.31Å
85	Q	97	Very high	97	Very high	157 Å²	157	50.8 Å²	50.8	73%	0.734	26%	0.263	S	S	*	.	H	α-helix	trans	-66.7	-46.8	175.9	-173.4	178.5	10.4	0	0	111.3	Q81 A82 L83 Y87 H88	Q81-Q85 PolarHBondContact O-N 3.3Å; A82-Q85 PolarHBondContact O-N 3.47Å; L83-Q85 VanDerWaalsContact C-N 3.31Å; L83-Q85 PolarHBondContact O-N 3.04Å; Q85-Y87 VanDerWaalsContact C-N 3.32Å; Q85-Y87 PolarHBondContact O-N 3.21Å; Q85-H88 VanDerWaalsContact O-CB 3.31Å; Q85-H88 WeakPolarHBondContact O-CB 3.38Å; Q85-H88 PolarHBondContact O-N 3.24Å
86	R	97.6	Very high	96.8	Very high	89 Å²	89	52.9 Å²	52.9	34%	0.336	27%	0.272	S	S	.	.	H	α-helix	trans	-59.7	-41.8	-179.7	-177.3	176	-178.7	85.3	4	112.5	A82 L83 E314	A82-R86 WeakPolarHBondContact O-CB 3.42Å; A82-R86 PolarHBondContact O-N 3.01Å; L83-R86 PolarHBondContact O-N 3.31Å; R86-E314 IonicContact CZ-OE1 2.87Å; R86-E314 IonicContact NE-OE1 3.25Å; R86-E314 PolarHBondContact NE-OE1 3.32Å; R86-E314 VanDerWaalsContact NH2-CD 3.29Å; R86-E314 IonicContact NH2-OE1 3.27Å; R86-E314 PolarHBondContact NH2-OE1 3.21Å; R86-E314 IonicContact NH2-OE2 2.65Å; R86-E314 PolarHBondContact NH2-OE2 3.25Å
87	Y	98.1	Very high	96.6	Very high	3 Å²	3	62 Å²	62	1%	0.012	31%	0.307	C	S	.	.	T	Hydrogen-bonded Turn	trans	-99.9	21.8	-177	-58.7	-55	0	0	0	113.4	L33 V36 L38 L83 Q85 G89 F90 L91 I312 E314	L33-Y87 HydrophobicContact CD2-CD1 3.74Å; L33-Y87 HydrophobicContact CD2-CE1 3.89Å; V36-Y87 HydrophobicContact CG1-CE1 4.2Å; V36-Y87 HydrophobicContact CG1-CE2 3.99Å; V36-Y87 WeakPolarHBondContact CG1-OH 3.45Å; V36-Y87 HydrophobicContact CG2-CD1 4.1Å; V36-Y87 HydrophobicContact CG2-CE1 3.64Å; L38-Y87 HydrophobicContact CD2-CE2 4.25Å; L83-Y87 HydrophobicContact CB-CD2 4.38Å; L83-Y87 HydrophobicContact CD2-CD2 4.5Å; L83-Y87 HydrophobicContact CD2-CE2 3.82Å; L83-Y87 VanDerWaalsContact O-CD2 3.25Å; L83-Y87 WeakPolarHBondContact O-CD2 3.49Å; L83-Y87 PolarHBondContact O-N 3.48Å; Q85-Y87 VanDerWaalsContact C-N 3.32Å; Q85-Y87 PolarHBondContact O-N 3.21Å; Y87-G89 PolarHBondContact O-N 2.81Å; Y87-F90 HydrophobicContact CD1-CD1 4.22Å; Y87-F90 HydrophobicContact CG-CD1 4.44Å; Y87-F90 PolarHBondContact O-N 3.35Å; Y87-F90 VanDerWaalsContact O-N 3.09Å; Y87-L91 HydrophobicContact CD2-CD1 4.45Å; Y87-L91 HydrophobicContact CG-CD1 4.42Å; Y87-L91 PolarHBondContact O-N 2.85Å; Y87-I312 WeakPolarHBondContact OH-CG2 3.33Å; Y87-E314 HydrophobicContact CE1-CG 4.38Å; Y87-E314 VanDerWaalsContact CE1-OE1 3.26Å; Y87-E314 WeakPolarHBondContact CE1-OE1 3.41Å; Y87-E314 PolarHBondContact OH-OE1 3.37Å
88	H	95.9	Very high	96.4	Very high	143 Å²	143	63.4 Å²	63.4	66%	0.662	32%	0.318	S	S	*	.	B	Isolated β-bridge	trans	-57.4	130.8	169.5	-175.3	81.8	0	0	0	110.2	R84 Q85 F90	R84-H88 PolarHBondContact O-N 3.31Å; Q85-H88 VanDerWaalsContact O-CB 3.31Å; Q85-H88 WeakPolarHBondContact O-CB 3.38Å; Q85-H88 PolarHBondContact O-N 3.24Å; H88-F90 PolarHBondContact O-N 2.8Å
89	G	94.9	Very high	96.3	Very high	76 Å²	76	61 Å²	61	78%	0.784	31%	0.307	S	S	*	.	T	Hydrogen-bonded Turn	trans	82	-19.4	-176.3	0	0	0	0	0	114.9	Y87	Y87-G89 PolarHBondContact O-N 2.81Å
90	F	97.1	Very high	96.3	Very high	28 Å²	28	61.2 Å²	61.2	12%	0.123	31%	0.308	C	S	.	.	T	Hydrogen-bonded Turn	trans	-88.1	-48.5	171	175	-116	0	0	0	111.7	L33 V36 Y87 H88 K279	L33-F90 HydrophobicContact CB-CD2 4.05Å; L33-F90 HydrophobicContact CB-CE2 4.34Å; L33-F90 HydrophobicContact CB-CG 4.48Å; L33-F90 HydrophobicContact CD2-CB 4.11Å; L33-F90 HydrophobicContact CD2-CD1 3.72Å; L33-F90 HydrophobicContact CD2-CD2 4.01Å; L33-F90 HydrophobicContact CD2-CE1 4.13Å; L33-F90 HydrophobicContact CD2-CE2 4.39Å; L33-F90 HydrophobicContact CD2-CG 3.67Å; L33-F90 HydrophobicContact CD2-CZ 4.44Å; L33-F90 HydrophobicContact CG-CD1 4.29Å; L33-F90 HydrophobicContact CG-CD2 3.9Å; L33-F90 HydrophobicContact CG-CE1 4.33Å; L33-F90 HydrophobicContact CG-CE2 3.94Å; L33-F90 HydrophobicContact CG-CG 4.09Å; L33-F90 HydrophobicContact CG-CZ 4.16Å; L33-F90 WeakPolarHBondContact O-CD2 3.36Å; L33-F90 WeakPolarHBondContact O-CE2 3.43Å; V36-F90 HydrophobicContact CB-CE1 4.4Å; V36-F90 HydrophobicContact CG2-CD1 4.19Å; V36-F90 HydrophobicContact CG2-CE1 3.62Å; V36-F90 HydrophobicContact CG2-CZ 4.28Å; Y87-F90 HydrophobicContact CD1-CD1 4.22Å; Y87-F90 HydrophobicContact CG-CD1 4.44Å; Y87-F90 PolarHBondContact O-N 3.35Å; Y87-F90 VanDerWaalsContact O-N 3.09Å; H88-F90 PolarHBondContact O-N 2.8Å; F90-K279 HydrophobicContact CE1-CB 3.95Å; F90-K279 HydrophobicContact CE2-CB 4.36Å; F90-K279 HydrophobicContact CE2-CD 4.25Å; F90-K279 HydrophobicContact CE2-CG 4.31Å; F90-K279 HydrophobicContact CZ-CB 3.61Å; F90-K279 HydrophobicContact CZ-CD 4.27Å; F90-K279 HydrophobicContact CZ-CG 4.05Å; F90-K279 PolarHBondContact O-NZ 3.39Å
91	L	96.9	Very high	96.3	Very high	7 Å²	7	65.6 Å²	65.6	4%	0.037	33%	0.325	C	S	.	.	B	Isolated β-bridge	trans	-94.5	139.4	175.7	-61	175.4	0	0	0	110.7	R84 Y87 L121 F122 K279 L280	R84-L91 PolarHBondContact NH1-O 2.86Å; Y87-L91 HydrophobicContact CD2-CD1 4.45Å; Y87-L91 HydrophobicContact CG-CD1 4.42Å; Y87-L91 PolarHBondContact O-N 2.85Å; L91-L121 HydrophobicContact CD1-CD1 4.48Å; L91-F122 HydrophobicContact CD1-CZ 4.3Å; L91-K279 HydrophobicContact CD2-CB 4.15Å; L91-L280 HydrophobicContact CD1-CD2 3.9Å; L91-L280 HydrophobicContact CD2-CB 4.04Å
92	N	93.2	Very high	96.3	Very high	68 Å²	68	62.3 Å²	62.3	36%	0.364	31%	0.31	S	S	.	.			trans	-58.9	152.7	172.2	-77.9	-38.5	0	0	0	111.5	R84 S94 H96 E99	R84-N92 PolarHBondContact NH1-O 2.84Å; N92-S94 WeakPolarHBondContact CB-O 3.25Å; N92-S94 PolarHBondContact O-N 2.91Å; N92-H96 PolarHBondContact ND2-CD2 3.25Å; N92-E99 WeakPolarHBondContact CB-OE2 3.48Å; N92-E99 PolarHBondContact ND2-OE1 2.89Å; N92-E99 PolarHBondContact ND2-OE2 2.94Å
93	T	92	Very high	96.3	Very high	84 Å²	84	62 Å²	62	52%	0.515	30%	0.302	S	S	.	.	S	Bend	trans	-67.3	-29.1	177.5	-52.8	0	0	0	0	113.1	R84 N125	R84-T93 PolarHBondContact NH2-OG1 2.92Å; T93-N125 PolarHBondContact O-ND2 3.23Å
94	S	93.2	Very high	96.4	Very high	26 Å²	26	61.8 Å²	61.8	18%	0.182	30%	0.301	C	S	.	.	S	Bend	trans	-98.7	149.8	172.4	-68.9	0	0	0	0	110	N92 H96 N125 Q128	N92-S94 WeakPolarHBondContact CB-O 3.25Å; N92-S94 PolarHBondContact O-N 2.91Å; S94-H96 PolarHBondContact O-CD2 3.5Å; S94-N125 PolarHBondContact OG-OD1 2.9Å; S94-Q128 VanDerWaalsContact CA-OE1 3.28Å; S94-Q128 PolarHBondContact OG-OE1 3.23Å
95	Y	96.6	Very high	96.4	Very high	28 Å²	28	60.3 Å²	60.3	11%	0.11	30%	0.295	C	S	.	.			trans	-67.1	134.6	173.4	164.3	-102.8	0	0	0	110.3	R97 V100 F122 Q128 I139 P140	Y95-R97 HydrophobicContact CE1-CB 4.25Å; Y95-R97 WeakPolarHBondContact OH-CA 3.34Å; Y95-V100 HydrophobicContact CD2-CB 4.31Å; Y95-V100 HydrophobicContact CD2-CG2 4.37Å; Y95-V100 HydrophobicContact CE2-CB 3.94Å; Y95-V100 HydrophobicContact CE2-CG1 4.47Å; Y95-V100 HydrophobicContact CE2-CG2 4.47Å; Y95-F122 HydrophobicContact CD2-CD2 4.4Å; Y95-F122 HydrophobicContact CD2-CE2 4.46Å; Y95-Q128 PolarHBondContact O-NE2 3.14Å; Y95-I139 HydrophobicContact CD1-CD1 4.46Å; Y95-I139 HydrophobicContact CD1-CG1 4.1Å; Y95-I139 HydrophobicContact CD2-CD1 3.8Å; Y95-I139 HydrophobicContact CD2-CG1 4.07Å; Y95-I139 HydrophobicContact CD2-CG2 3.99Å; Y95-I139 HydrophobicContact CE1-CG1 4.4Å; Y95-I139 HydrophobicContact CE2-CD1 4.45Å; Y95-I139 HydrophobicContact CE2-CG1 4.36Å; Y95-I139 HydrophobicContact CE2-CG2 3.56Å; Y95-I139 HydrophobicContact CG-CD1 3.8Å; Y95-I139 HydrophobicContact CG-CG1 3.93Å; Y95-P140 WeakPolarHBondContact OH-CD 3.41Å
96	H	95.2	Very high	96.5	Very high	76 Å²	76	55.7 Å²	55.7	35%	0.352	28%	0.276	S	S	.	.			trans	-128.5	125.9	170.9	-69.3	-83.4	0	0	0	109.9	N92 S94 Q98 E99 V100	N92-H96 PolarHBondContact ND2-CD2 3.25Å; S94-H96 PolarHBondContact O-CD2 3.5Å; H96-Q98 PolarHBondContact O-N 2.88Å; H96-Q98 VanDerWaalsContact O-N 3.08Å; H96-E99 HydrophobicContact CB-CB 4.36Å; H96-E99 HydrophobicContact CB-CG 4.09Å; H96-E99 PolarHBondContact O-N 3.06Å; H96-V100 PolarHBondContact O-N 3.42Å
97	R	94.6	Very high	96.6	Very high	191 Å²	191	53.8 Å²	53.8	72%	0.721	27%	0.27	S	S	*	.	T	Hydrogen-bonded Turn	trans	-60.9	-21.2	-176.2	68	169.7	-71.8	-178.1	-0.8	114.8	Y95	Y95-R97 HydrophobicContact CE1-CB 4.25Å; Y95-R97 WeakPolarHBondContact OH-CA 3.34Å
98	Q	94.9	Very high	96.6	Very high	137 Å²	137	57.8 Å²	57.8	64%	0.64	29%	0.292	S	S	*	.	T	Hydrogen-bonded Turn	trans	-83.6	-15.3	176.9	-61.8	84.9	-6.8	0	0	112.6	H96 P278	H96-Q98 PolarHBondContact O-N 2.88Å; H96-Q98 VanDerWaalsContact O-N 3.08Å; Q98-P278 WeakPolarHBondContact O-CA 3.15Å
99	E	95.8	Very high	96.7	Very high	28 Å²	28	52.4 Å²	52.4	13%	0.131	27%	0.266	C	S	.	.	T	Hydrogen-bonded Turn	trans	-101.9	-18.8	-175.9	-64.3	-165.9	143.8	0	0	113.7	N92 H96 P278 K279 L280	N92-E99 WeakPolarHBondContact CB-OE2 3.48Å; N92-E99 PolarHBondContact ND2-OE1 2.89Å; N92-E99 PolarHBondContact ND2-OE2 2.94Å; H96-E99 HydrophobicContact CB-CB 4.36Å; H96-E99 HydrophobicContact CB-CG 4.09Å; H96-E99 PolarHBondContact O-N 3.06Å; E99-P278 VanDerWaalsContact C-CB 3.42Å; E99-P278 CarbonylContact O-C 3.52Å; E99-P278 WeakPolarHBondContact O-CB 3.29Å; E99-K279 HydrophobicContact CB-CB 4.47Å; E99-K279 HydrophobicContact CB-CD 4.42Å; E99-K279 HydrophobicContact CG-CD 4.21Å; E99-K279 PolarHBondContact O-N 2.82Å; E99-K279 VanDerWaalsContact OE1-CE 3.27Å; E99-K279 WeakPolarHBondContact OE1-CE 3.42Å; E99-K279 IonicContact OE1-NZ 3.53Å; E99-K279 PolarHBondContact OE1-NZ 2.99Å; E99-L280 PolarHBondContact O-N 2.83Å
100	V	98.2	Very high	96.9	Very high	6 Å²	6	48.8 Å²	48.8	4%	0.036	23%	0.228	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-134.7	132.8	-174	-175.6	0	0	0	0	110.9	Y95 H96 V102 F122 L280	Y95-V100 HydrophobicContact CD2-CB 4.31Å; Y95-V100 HydrophobicContact CD2-CG2 4.37Å; Y95-V100 HydrophobicContact CE2-CB 3.94Å; Y95-V100 HydrophobicContact CE2-CG1 4.47Å; Y95-V100 HydrophobicContact CE2-CG2 4.47Å; H96-V100 PolarHBondContact O-N 3.42Å; V100-V102 HydrophobicContact CG1-CG2 4Å; V100-F122 HydrophobicContact CG1-CE2 4.26Å; V100-F122 HydrophobicContact CG2-CE2 3.85Å; V100-F122 HydrophobicContact CG2-CZ 3.54Å; V100-L280 WeakPolarHBondContact CA-O 3.37Å; V100-L280 HydrophobicContact CG1-CD2 4.15Å; V100-L280 HydrophobicContact CG1-CG 4.47Å; V100-L280 HydrophobicContact CG2-CB 4.37Å; V100-L280 HydrophobicContact CG2-CD2 4.43Å
101	Y	98.6	Very high	97	Very high	92 Å²	92	49 Å²	49	36%	0.361	23%	0.231	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-132	136.6	168.1	175.4	-85.3	0	0	0	110.3	R103 H142 L280 L281 V282	Y101-R103 HydrophobicContact CE1-CB 3.95Å; Y101-H142 AromaticContact CD2-CD2 3.66Å; Y101-H142 AromaticContact CD2-NE2 3.93Å; Y101-H142 HydrophobicContact CE2-CB 4.37Å; Y101-H142 AromaticContact CE2-CD2 3.19Å; Y101-H142 WeakPolarHBondContact CE2-CD2 3.39Å; Y101-H142 AromaticContact CE2-CG 3.79Å; Y101-H142 AromaticContact CE2-NE2 3.65Å; Y101-H142 AromaticContact CZ-CD2 3.73Å; Y101-L280 PolarHBondContact N-O 2.91Å; Y101-L281 HydrophobicContact CD1-CD2 3.95Å; Y101-L281 HydrophobicContact CG-CD2 4.18Å; Y101-L281 WeakPolarHBondContact O-CA 3.31Å; Y101-V282 PolarHBondContact O-N 3.02Å
102	V	98.9	Very high	97.1	Very high	1 Å²	1	51.6 Å²	51.6	1%	0.006	24%	0.243	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-126.6	129.3	-175.9	-174	0	0	0	0	109.3	V100 A114 L118 V141 H142 V282	V100-V102 HydrophobicContact CG1-CG2 4Å; V102-A114 HydrophobicContact CG1-CB 4.12Å; V102-L118 HydrophobicContact CG1-CD1 4.44Å; V102-L118 HydrophobicContact CG2-CD1 4.05Å; V102-L118 HydrophobicContact CG2-CD2 4.03Å; V102-L118 HydrophobicContact CG2-CG 4.49Å; V102-V141 HydrophobicContact CG1-CG1 4.15Å; V102-V141 HydrophobicContact CG1-CG2 4.22Å; V102-H142 WeakPolarHBondContact O-CB 3.5Å; V102-H142 PolarHBondContact O-CD2 3.3Å; V102-H142 PolarHBondContact O-N 3.19Å; V102-V282 WeakPolarHBondContact CA-O 3.2Å; V102-V282 HydrophobicContact CB-CB 4.33Å; V102-V282 HydrophobicContact CG1-CB 4.04Å; V102-V282 HydrophobicContact CG1-CG1 4.18Å; V102-V282 HydrophobicContact CG2-CB 4.01Å; V102-V282 HydrophobicContact CG2-CG2 4.22Å
103	R	98.8	Very high	97.4	Very high	25 Å²	25	48.4 Å²	48.4	9%	0.094	23%	0.226	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-123.6	136.2	171.8	-179.8	-172.9	-170.7	-77.1	3.2	109.7	Y101 H142 D149 L152 V282 Y283 S284	Y101-R103 HydrophobicContact CE1-CB 3.95Å; R103-H142 CarbonylContact C-O 3.48Å; R103-H142 VanDerWaalsContact CA-O 3.22Å; R103-H142 WeakPolarHBondContact CA-O 3.13Å; R103-D149 IonicContact CZ-OD2 3.31Å; R103-D149 VanDerWaalsContact CZ-OD2 3.3Å; R103-D149 IonicContact NH1-OD1 3.3Å; R103-D149 IonicContact NH1-OD2 2.71Å; R103-D149 PolarHBondContact NH1-OD2 3.06Å; R103-D149 IonicContact NH2-OD1 2.73Å; R103-D149 IonicContact NH2-OD2 3.45Å; R103-D149 PolarHBondContact NH2-OD2 2.96Å; R103-L152 HydrophobicContact CG-CD1 4.15Å; R103-V282 PolarHBondContact N-O 2.53Å; R103-Y283 HydrophobicContact CB-CD1 4.03Å; R103-Y283 HydrophobicContact CB-CE1 4.24Å; R103-Y283 CarbonylContact O-C 3.57Å; R103-Y283 VanDerWaalsContact O-CA 3.29Å; R103-Y283 WeakPolarHBondContact O-CA 3.47Å; R103-S284 PolarHBondContact O-N 3.23Å
104	S	98.9	Very high	97.7	Very high	0 Å²	0	44.4 Å²	44.4	0%	0	20%	0.202	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-118.9	156.2	173.6	-174.6	0	0	0	0	110.5	T110 L111 H142 T143 S284	S104-T110 VanDerWaalsContact OG-CB 3.23Å; S104-T110 WeakPolarHBondContact OG-CB 3.38Å; S104-T110 PolarHBondContact OG-O 2.91Å; S104-T110 PolarHBondContact OG-OG1 3.04Å; S104-L111 PolarHBondContact OG-N 2.82Å; S104-H142 PolarHBondContact N-O 2.92Å; S104-T143 WeakPolarHBondContact O-CB 3.3Å; S104-T143 PolarHBondContact O-OG1 3.38Å; S104-S284 VanDerWaalsContact CA-O 3.31Å; S104-S284 WeakPolarHBondContact CA-O 3.3Å
105	T	98.9	Very high	98	Very high	1 Å²	1	47.9 Å²	47.9	1%	0.006	22%	0.215	C	C	.	.			trans	-64.5	156.5	155.6	54.7	0	0	0	0	110.3	F107 T110 L152 K153 S284 A285 H286	T105-F107 PolarHBondContact O-N 2.86Å; T105-T110 PolarHBondContact O-OG1 3.4Å; T105-T110 WeakPolarHBondContact OG1-CB 3.34Å; T105-T110 WeakPolarHBondContact OG1-CG2 3.37Å; T105-T110 PolarHBondContact OG1-OG1 3.45Å; T105-L152 HydrophobicContact CG2-CB 3.47Å; T105-L152 VanDerWaalsContact CG2-CB 3.47Å; T105-K153 HydrophobicContact CG2-CB 4.31Å; T105-S284 PolarHBondContact N-O 3.29Å; T105-A285 HydrophobicContact CG2-CB 4.4Å; T105-H286 PolarHBondContact OG1-NE2 2.92Å
106	D	98.8	Very high	98.1	Very high	60 Å²	60	47.4 Å²	47.4	32%	0.321	22%	0.217	S	C	.	.	S	Bend	trans	-83.6	63.1	-178.6	-173.1	32.8	0	0	0	111.2	T143 V144 I146	D106-T143 WeakPolarHBondContact CA-OG1 3.48Å; D106-T143 HydrophobicContact CB-CG2 4.36Å; D106-T143 PolarHBondContact N-OG1 3.18Å; D106-V144 VanDerWaalsContact CB-O 3.24Å; D106-V144 WeakPolarHBondContact CB-O 3.21Å; D106-I146 HydrophobicContact CB-CG1 3.88Å; D106-I146 VanDerWaalsContact O-CD1 3.24Å; D106-I146 WeakPolarHBondContact O-CD1 3.39Å; D106-I146 WeakPolarHBondContact O-CG1 3.47Å
107	F	98.8	Very high	98.3	Very high	50 Å²	50	43.8 Å²	43.8	22%	0.219	20%	0.2	C	C	.	.	S	Bend	trans	-130.8	138.4	169.6	-68.5	-94.5	0	0	0	108.4	T105 R109 T110 L111 I146 H286	T105-F107 PolarHBondContact O-N 2.86Å; F107-R109 HydrophobicContact CB-CG 4.22Å; F107-R109 PolarHBondContact O-N 3.43Å; F107-R109 VanDerWaalsContact O-N 3.14Å; F107-T110 PolarHBondContact O-N 3.42Å; F107-T110 PolarHBondContact O-OG1 3.37Å; F107-L111 PolarHBondContact O-N 3.5Å; F107-I146 HydrophobicContact CD1-CD1 4.36Å; F107-I146 HydrophobicContact CE1-CD1 3.99Å; F107-I146 HydrophobicContact CE2-CD1 4.18Å; F107-I146 HydrophobicContact CE2-CG1 4.22Å; F107-I146 HydrophobicContact CE2-CG2 4.42Å; F107-I146 HydrophobicContact CZ-CD1 3.89Å; F107-I146 HydrophobicContact CZ-CG1 4.36Å; F107-I146 HydrophobicContact CZ-CG2 4.24Å; F107-H286 AromaticContact CD2-CE1 3.56Å; F107-H286 AromaticContact CD2-NE2 3.52Å; F107-H286 AromaticContact CE2-CE1 3.95Å; F107-H286 AromaticContact CE2-NE2 3.68Å
108	D	98.8	Very high	98.5	Very high	87 Å²	87	35 Å²	35	47%	0.465	17%	0.167	S	C	.	.	H	α-helix	trans	-48.8	-47.4	179.6	-61.2	-9.6	0	0	0	111.6	Q67 T110 L111 M112	Q67-D108 PolarHBondContact NE2-OD2 3.07Å; Q67-D108 PolarHBondContact OE1-OD2 3.37Å; D108-T110 VanDerWaalsContact C-N 3.31Å; D108-T110 PolarHBondContact O-N 2.97Å; D108-L111 PolarHBondContact O-N 3.36Å; D108-M112 HydrophobicContact CB-SD 4.24Å; D108-M112 VanDerWaalsContact O-CB 3.28Å; D108-M112 WeakPolarHBondContact O-CB 3.4Å; D108-M112 WeakPolarHBondContact O-CG 3.23Å; D108-M112 PolarHBondContact O-N 3.35Å
109	R	98.8	Very high	98.7	Very high	29 Å²	29	29.6 Å²	29.6	11%	0.109	15%	0.146	C	C	.	.	H	α-helix	trans	-60.7	-32.4	-179.4	64.8	177.3	173.5	-75.6	-7.6	115.1	H42 G66 L68 F107 S113	H42-R109 HydrophobicContact CB-CG 4.44Å; H42-R109 PolarHBondContact NE2-NE 2.91Å; G66-R109 WeakPolarHBondContact O-CD 3.44Å; G66-R109 PolarHBondContact O-NH1 3.44Å; L68-R109 HydrophobicContact CB-CB 4.08Å; L68-R109 HydrophobicContact CD1-CB 4.44Å; F107-R109 HydrophobicContact CB-CG 4.22Å; F107-R109 PolarHBondContact O-N 3.43Å; F107-R109 VanDerWaalsContact O-N 3.14Å; R109-S113 WeakPolarHBondContact O-CB 3.35Å; R109-S113 PolarHBondContact O-N 3.44Å; R109-S113 PolarHBondContact O-OG 3.43Å
110	T	98.9	Very high	98.8	Very high	0 Å²	0	28.2 Å²	28.2	0%	0	14%	0.14	C	C	.	.	H	α-helix	trans	-85	-37.1	178.6	46.3	0	0	0	0	111.2	H42 S104 T105 F107 D108 S113 A114 S284 A285	H42-T110 HydrophobicContact CB-CG2 3.94Å; S104-T110 VanDerWaalsContact OG-CB 3.23Å; S104-T110 WeakPolarHBondContact OG-CB 3.38Å; S104-T110 PolarHBondContact OG-O 2.91Å; S104-T110 PolarHBondContact OG-OG1 3.04Å; T105-T110 PolarHBondContact O-OG1 3.4Å; T105-T110 WeakPolarHBondContact OG1-CB 3.34Å; T105-T110 WeakPolarHBondContact OG1-CG2 3.37Å; T105-T110 PolarHBondContact OG1-OG1 3.45Å; F107-T110 PolarHBondContact O-N 3.42Å; F107-T110 PolarHBondContact O-OG1 3.37Å; D108-T110 VanDerWaalsContact C-N 3.31Å; D108-T110 PolarHBondContact O-N 2.97Å; T110-S113 PolarHBondContact O-N 3.09Å; T110-A114 PolarHBondContact O-N 3.43Å; T110-S284 PolarHBondContact O-OG 3.37Å; T110-A285 WeakPolarHBondContact CG2-O 3.28Å
111	L	98.9	Very high	98.8	Very high	33 Å²	33	28 Å²	28	17%	0.173	14%	0.138	C	C	.	.	H	α-helix	trans	-62	-52.4	173.5	-71.2	165.7	0	0	0	111.1	S104 F107 D108 S113 A114 E115 V141 T143	S104-L111 PolarHBondContact OG-N 2.82Å; F107-L111 PolarHBondContact O-N 3.5Å; D108-L111 PolarHBondContact O-N 3.36Å; L111-S113 VanDerWaalsContact C-N 3.31Å; L111-S113 PolarHBondContact O-N 2.7Å; L111-A114 WeakPolarHBondContact O-CB 3.19Å; L111-A114 PolarHBondContact O-N 3.05Å; L111-A114 VanDerWaalsContact O-N 3.08Å; L111-E115 WeakPolarHBondContact O-CG 3.36Å; L111-E115 PolarHBondContact O-N 3.34Å; L111-V141 HydrophobicContact CD2-CG1 3.81Å; L111-T143 HydrophobicContact CD2-CG2 4.48Å
112	M	98.9	Very high	98.7	Very high	62 Å²	62	23.7 Å²	23.7	31%	0.305	12%	0.122	S	C	.	.	H	α-helix	trans	-64.1	-35	178.8	-65.6	170.2	72	0	0	112.3	L68 M73 D108 A114 E115 A116	L68-M112 HydrophobicContact CD2-CB 3.67Å; M73-M112 HydrophobicContact CE-CE 3.53Å; D108-M112 HydrophobicContact CB-SD 4.24Å; D108-M112 VanDerWaalsContact O-CB 3.28Å; D108-M112 WeakPolarHBondContact O-CB 3.4Å; D108-M112 WeakPolarHBondContact O-CG 3.23Å; D108-M112 PolarHBondContact O-N 3.35Å; M112-A114 VanDerWaalsContact C-N 3.33Å; M112-A114 PolarHBondContact O-N 2.95Å; M112-E115 PolarHBondContact O-N 2.88Å; M112-A116 WeakPolarHBondContact O-CB 3.45Å; M112-A116 PolarHBondContact O-N 2.9Å
113	S	98.9	Very high	98.6	Very high	0 Å²	0	26.2 Å²	26.2	0%	0	14%	0.138	C	C	.	.	H	α-helix	trans	-62.1	-41.5	172.8	-72.7	0	0	0	0	111.7	H42 G43 L68 H76 R109 T110 L111 N117	H42-S113 WeakPolarHBondContact CA-OG 3.24Å; H42-S113 WeakPolarHBondContact CB-OG 3.44Å; G43-S113 PolarHBondContact N-OG 2.93Å; G43-S113 VanDerWaalsContact N-OG 3.12Å; L68-S113 WeakPolarHBondContact CD1-OG 3.43Å; H76-S113 WeakPolarHBondContact CB-O 3.38Å; H76-S113 WeakPolarHBondContact CD2-CB 3.37Å; H76-S113 PolarHBondContact CD2-OG 2.86Å; H76-S113 VanDerWaalsContact CD2-OG 3.26Å; H76-S113 PolarHBondContact ND1-O 2.91Å; H76-S113 WeakPolarHBondContact NE2-CB 3.46Å; H76-S113 PolarHBondContact NE2-OG 3.5Å; R109-S113 WeakPolarHBondContact O-CB 3.35Å; R109-S113 PolarHBondContact O-N 3.44Å; R109-S113 PolarHBondContact O-OG 3.43Å; T110-S113 PolarHBondContact O-N 3.09Å; L111-S113 VanDerWaalsContact C-N 3.31Å; L111-S113 PolarHBondContact O-N 2.7Å; S113-N117 VanDerWaalsContact O-CB 3.23Å; S113-N117 WeakPolarHBondContact O-CB 3.4Å; S113-N117 PolarHBondContact O-N 3.26Å
114	A	98.9	Very high	98.5	Very high	0 Å²	0	25.1 Å²	25.1	0%	0	13%	0.134	C	C	.	.	H	α-helix	trans	-64.9	-43.3	176.5	0	0	0	0	0	111.6	Y40 V102 T110 L111 M112 N117 L118 V141	Y40-A114 WeakPolarHBondContact OH-CA 3.45Å; V102-A114 HydrophobicContact CG1-CB 4.12Å; T110-A114 PolarHBondContact O-N 3.43Å; L111-A114 WeakPolarHBondContact O-CB 3.19Å; L111-A114 PolarHBondContact O-N 3.05Å; L111-A114 VanDerWaalsContact O-N 3.08Å; M112-A114 VanDerWaalsContact C-N 3.33Å; M112-A114 PolarHBondContact O-N 2.95Å; A114-N117 PolarHBondContact O-N 3.27Å; A114-L118 WeakPolarHBondContact O-CB 3.4Å; A114-L118 WeakPolarHBondContact O-CD1 3.4Å; A114-L118 WeakPolarHBondContact O-CG 3.19Å; A114-L118 PolarHBondContact O-N 3.43Å; A114-V141 HydrophobicContact CB-CG1 3.91Å; A114-V141 HydrophobicContact CB-CG2 3.92Å
115	E	98.9	Very high	98.1	Very high	99 Å²	99	27.7 Å²	27.7	46%	0.463	15%	0.148	S	C	.	.	H	α-helix	trans	-63.4	-45.7	177.4	-68.2	173.8	172.9	0	0	112.4	L111 M112 N117 L118 A119 V141	L111-E115 WeakPolarHBondContact O-CG 3.36Å; L111-E115 PolarHBondContact O-N 3.34Å; M112-E115 PolarHBondContact O-N 2.88Å; E115-N117 VanDerWaalsContact C-N 3.33Å; E115-N117 PolarHBondContact O-N 3.38Å; E115-L118 PolarHBondContact O-N 2.88Å; E115-A119 PolarHBondContact O-N 3.26Å; E115-V141 HydrophobicContact CG-CG2 4.12Å
116	A	98.9	Very high	97.8	Very high	18 Å²	18	30.5 Å²	30.5	15%	0.149	18%	0.177	C	C	.	.	H	α-helix	trans	-62.4	-41.1	175.8	0	0	0	0	0	111.5	M73 H76 W77 M112 A119 G120	M73-A116 HydrophobicContact CB-CB 4.42Å; H76-A116 HydrophobicContact CB-CB 3.95Å; W77-A116 WeakPolarHBondContact CA-O 3.22Å; M112-A116 WeakPolarHBondContact O-CB 3.45Å; M112-A116 PolarHBondContact O-N 2.9Å; A116-A119 WeakPolarHBondContact O-CB 3.25Å; A116-A119 PolarHBondContact O-N 3.48Å; A116-G120 PolarHBondContact O-N 3.46Å
117	N	98.9	Very high	97.5	Very high	0 Å²	0	36.7 Å²	36.7	0%	0	21%	0.206	C	C	.	.	H	α-helix	trans	-62.1	-45.3	175.3	-171.8	-95.3	0	0	0	112.3	H76 L79 G80 S113 A114 E115 A119 G120 L121	H76-N117 HydrophobicContact CB-CB 4.18Å; H76-N117 VanDerWaalsContact O-CA 3.24Å; H76-N117 WeakPolarHBondContact O-CA 3.3Å; H76-N117 PolarHBondContact O-ND2 2.95Å; L79-N117 WeakPolarHBondContact CG-ND2 3.45Å; G80-N117 WeakPolarHBondContact CA-ND2 3.16Å; G80-N117 WeakPolarHBondContact CA-O 3.38Å; G80-N117 PolarHBondContact N-ND2 3.49Å; G80-N117 VanDerWaalsContact N-ND2 3.12Å; S113-N117 VanDerWaalsContact O-CB 3.23Å; S113-N117 WeakPolarHBondContact O-CB 3.4Å; S113-N117 PolarHBondContact O-N 3.26Å; A114-N117 PolarHBondContact O-N 3.27Å; E115-N117 VanDerWaalsContact C-N 3.33Å; E115-N117 PolarHBondContact O-N 3.38Å; N117-A119 VanDerWaalsContact C-N 3.29Å; N117-A119 PolarHBondContact O-N 3.23Å; N117-G120 PolarHBondContact O-N 3.28Å; N117-G120 VanDerWaalsContact O-N 3.14Å; N117-L121 WeakPolarHBondContact O-CB 3.2Å; N117-L121 PolarHBondContact O-N 2.97Å
118	L	98.8	Very high	97.3	Very high	7 Å²	7	36.7 Å²	36.7	4%	0.037	21%	0.207	C	C	.	.	H	α-helix	trans	-65.2	-32.7	177.7	-72.9	167.5	0	0	0	112.6	V102 A114 E115 G120 L121 F122 I139 V141	V102-L118 HydrophobicContact CG1-CD1 4.44Å; V102-L118 HydrophobicContact CG2-CD1 4.05Å; V102-L118 HydrophobicContact CG2-CD2 4.03Å; V102-L118 HydrophobicContact CG2-CG 4.49Å; A114-L118 WeakPolarHBondContact O-CB 3.4Å; A114-L118 WeakPolarHBondContact O-CD1 3.4Å; A114-L118 WeakPolarHBondContact O-CG 3.19Å; A114-L118 PolarHBondContact O-N 3.43Å; E115-L118 PolarHBondContact O-N 2.88Å; L118-G120 VanDerWaalsContact C-N 3.31Å; L118-G120 PolarHBondContact O-N 3.14Å; L118-L121 PolarHBondContact O-N 2.64Å; L118-F122 HydrophobicContact CD2-CD2 4.05Å; L118-F122 HydrophobicContact CD2-CE2 4.27Å; L118-F122 PolarHBondContact O-N 3.12Å; L118-I139 HydrophobicContact CB-CD1 4.32Å; L118-I139 HydrophobicContact CD1-CB 4.01Å; L118-I139 HydrophobicContact CD1-CG2 3.75Å; L118-I139 HydrophobicContact CD2-CD1 4.35Å; L118-I139 HydrophobicContact CD2-CG2 4.05Å; L118-I139 HydrophobicContact CG-CG2 4.4Å; L118-V141 HydrophobicContact CD1-CG2 3.78Å
119	A	98.4	Very high	97.1	Very high	23 Å²	23	38.8 Å²	38.8	19%	0.19	21%	0.208	C	C	.	.	H	α-helix	trans	-64	-35.4	173	0	0	0	0	0	112.5	E115 A116 N117	E115-A119 PolarHBondContact O-N 3.26Å; A116-A119 WeakPolarHBondContact O-CB 3.25Å; A116-A119 PolarHBondContact O-N 3.48Å; N117-A119 VanDerWaalsContact C-N 3.29Å; N117-A119 PolarHBondContact O-N 3.23Å
120	G	97.9	Very high	96.9	Very high	0 Å²	0	43.4 Å²	43.4	0%	0	23%	0.229	C	C	.	.	H	α-helix	trans	-76.7	-35.9	172.2	0	0	0	0	0	113.1	Q81 A116 N117 L118	Q81-G120 PolarHBondContact OE1-O 3.36Å; A116-G120 PolarHBondContact O-N 3.46Å; N117-G120 PolarHBondContact O-N 3.28Å; N117-G120 VanDerWaalsContact O-N 3.14Å; L118-G120 VanDerWaalsContact C-N 3.31Å; L118-G120 PolarHBondContact O-N 3.14Å
121	L	98.2	Very high	96.8	Very high	1 Å²	1	45.9 Å²	45.9	1%	0.005	24%	0.243	C	C	.	.	H	α-helix	trans	-76.6	-36.7	-176.5	-175.5	58	0	0	0	113.2	L83 R84 L91 N117 L118 P123 L280	L83-L121 HydrophobicContact CB-CD1 4.01Å; R84-L121 HydrophobicContact CB-CD1 3.85Å; R84-L121 WeakPolarHBondContact CD-O 3.31Å; L91-L121 HydrophobicContact CD1-CD1 4.48Å; N117-L121 WeakPolarHBondContact O-CB 3.2Å; N117-L121 PolarHBondContact O-N 2.97Å; L118-L121 PolarHBondContact O-N 2.64Å; L121-P123 VanDerWaalsContact C-CD 3.49Å; L121-L280 HydrophobicContact CD2-CD2 3.81Å
122	F	97.8	Very high	96.5	Very high	2 Å²	2	49.5 Å²	49.5	1%	0.009	27%	0.268	C	S	.	.			trans	-131.4	60.9	-175.1	-65.1	-70.8	0	0	0	113.2	L91 Y95 V100 L118 Q137 I139	L91-F122 HydrophobicContact CD1-CZ 4.3Å; Y95-F122 HydrophobicContact CD2-CD2 4.4Å; Y95-F122 HydrophobicContact CD2-CE2 4.46Å; V100-F122 HydrophobicContact CG1-CE2 4.26Å; V100-F122 HydrophobicContact CG2-CE2 3.85Å; V100-F122 HydrophobicContact CG2-CZ 3.54Å; L118-F122 HydrophobicContact CD2-CD2 4.05Å; L118-F122 HydrophobicContact CD2-CE2 4.27Å; L118-F122 PolarHBondContact O-N 3.12Å; F122-Q137 PolarHBondContact O-NE2 2.99Å; F122-I139 HydrophobicContact CB-CD1 3.61Å; F122-I139 HydrophobicContact CD2-CD1 3.76Å; F122-I139 HydrophobicContact CG-CD1 3.99Å
123	P	96.4	Very high	96.4	Very high	53 Å²	53	53.6 Å²	53.6	34%	0.344	29%	0.291	S	S	.	.			trans	-59.3	128.7	172.8	25.7	-33.8	0	0	0	110.2	L121	L121-P123 VanDerWaalsContact C-CD 3.49Å
124	P	95.8	Very high	96.1	Very high	2 Å²	2	56.9 Å²	56.9	1%	0.013	31%	0.308	C	S	.	.			trans	-67.5	140.9	-174	29.1	-36.7	0	0	0	111.6	Q128 R129 S135 Q137	P124-Q128 HydrophobicContact CB-CB 4.26Å; P124-R129 HydrophobicContact CB-CG 3.85Å; P124-R129 HydrophobicContact CG-CG 4.16Å; P124-R129 WeakPolarHBondContact O-CG 3.38Å; P124-R129 PolarHBondContact O-NE 3.38Å; P124-S135 VanDerWaalsContact CD-C 3.47Å; P124-S135 WeakPolarHBondContact CD-O 3.4Å; P124-Q137 HydrophobicContact CB-CB 4.1Å; P124-Q137 HydrophobicContact CB-CG 4.2Å; P124-Q137 HydrophobicContact CG-CB 4.4Å
125	N	91.4	Very high	95.8	Very high	55 Å²	55	61 Å²	61	29%	0.294	34%	0.336	S	S	.	.			trans	-136.7	158.4	175.5	64.6	70.5	0	0	0	110.2	T93 S94 M127 Q128	T93-N125 PolarHBondContact O-ND2 3.23Å; S94-N125 PolarHBondContact OG-OD1 2.9Å; N125-M127 PolarHBondContact O-N 3.44Å; N125-Q128 PolarHBondContact O-N 2.95Å
126	G	91.8	Very high	95.6	Very high	60 Å²	60	61.5 Å²	61.5	62%	0.619	33%	0.334	S	S	*	.	G	3₁₀ helix	trans	49.1	-125.8	178.3	0	0	0	0	0	112.8	Q128 R129	G126-Q128 PolarHBondContact O-N 3.5Å; G126-R129 PolarHBondContact O-N 2.85Å
127	M	92.9	Very high	95.5	Very high	190 Å²	190	61.5 Å²	61.5	94%	0.936	33%	0.331	S	S	*	.	G	3₁₀ helix	trans	-67.5	-16.7	-177.3	-63.4	-58.3	-62.3	0	0	114.7	N125 R129	N125-M127 PolarHBondContact O-N 3.44Å; M127-R129 VanDerWaalsContact C-N 3.28Å
128	Q	94	Very high	95.4	Very high	49 Å²	49	65.4 Å²	65.4	23%	0.229	36%	0.357	C	S	.	.	G	3₁₀ helix	trans	-80.3	-10.4	175.7	-69.4	-165.7	-38.2	0	0	113.1	S94 Y95 P124 N125 G126 F130	S94-Q128 VanDerWaalsContact CA-OE1 3.28Å; S94-Q128 PolarHBondContact OG-OE1 3.23Å; Y95-Q128 PolarHBondContact O-NE2 3.14Å; P124-Q128 HydrophobicContact CB-CB 4.26Å; N125-Q128 PolarHBondContact O-N 2.95Å; G126-Q128 PolarHBondContact O-N 3.5Å; Q128-F130 PolarHBondContact O-N 2.87Å; Q128-F130 VanDerWaalsContact O-N 3.13Å
129	R	96	Very high	95.4	Very high	131 Å²	131	66 Å²	66	49%	0.494	36%	0.36	S	S	.	.			trans	-77.3	96.6	170.2	-70.4	-174.5	176.8	-173.1	-2.7	109.4	P124 G126 M127 N131	P124-R129 HydrophobicContact CB-CG 3.85Å; P124-R129 HydrophobicContact CG-CG 4.16Å; P124-R129 WeakPolarHBondContact O-CG 3.38Å; P124-R129 PolarHBondContact O-NE 3.38Å; G126-R129 PolarHBondContact O-N 2.85Å; M127-R129 VanDerWaalsContact C-N 3.28Å; R129-N131 VanDerWaalsContact C-N 3.28Å
130	F	94.9	Very high	95.4	Very high	127 Å²	127	68 Å²	68	56%	0.557	37%	0.371	S	S	*	.	S	Bend	trans	-73.3	-22.4	174.8	76.3	-89.3	0	0	0	112.7	Q128 I134 W136	Q128-F130 PolarHBondContact O-N 2.87Å; Q128-F130 VanDerWaalsContact O-N 3.13Å; F130-I134 HydrophobicContact CZ-CD1 4.35Å; F130-I134 HydrophobicContact CZ-CG2 4.43Å; F130-W136 AromaticContact CE1-CE3 3.94Å; F130-W136 HydrophobicContact CE1-CE3 3.94Å; F130-W136 HydrophobicContact CE1-CZ3 4.07Å; F130-W136 VanDerWaalsContact CE1-O 3.31Å; F130-W136 WeakPolarHBondContact CE1-O 3.43Å; F130-W136 HydrophobicContact CZ-CE3 4.16Å; F130-W136 HydrophobicContact CZ-CZ3 4.12Å
131	N	95.2	Very high	95.5	Very high	52 Å²	52	69.4 Å²	69.4	28%	0.278	38%	0.379	S	S	.	.	S	Bend	trans	-140.4	126.1	176	-176.6	-31.9	0	0	0	109.7	R129 N133 I134	R129-N131 VanDerWaalsContact C-N 3.28Å; N131-N133 PolarHBondContact O-N 2.96Å; N131-N133 PolarHBondContact OD1-N 2.93Å; N131-I134 HydrophobicContact CB-CB 4.24Å; N131-I134 HydrophobicContact CB-CD1 4.19Å; N131-I134 HydrophobicContact CB-CG1 4.29Å; N131-I134 PolarHBondContact O-N 3.02Å
132	P	93.3	Very high	95.5	Very high	108 Å²	108	73.1 Å²	73.1	70%	0.701	40%	0.396	S	S	*	.	T	Hydrogen-bonded Turn	trans	-66.9	-20.3	-176.6	27.6	-35.9	0	0	0	114.3
133	N	96	Very high	95.6	Very high	149 Å²	149	75.7 Å²	75.7	80%	0.797	41%	0.412	S	S	*	.	T	Hydrogen-bonded Turn	trans	-91.4	-2.6	-179.8	-62.6	-31.2	0	0	0	113	N131	N131-N133 PolarHBondContact O-N 2.96Å; N131-N133 PolarHBondContact OD1-N 2.93Å
134	I	93.7	Very high	95.7	Very high	68 Å²	68	75.4 Å²	75.4	35%	0.349	41%	0.409	S	S	.	.			trans	-123.2	112	-176.2	-59.4	177.3	0	0	0	109	F130 N131 W136	F130-I134 HydrophobicContact CZ-CD1 4.35Å; F130-I134 HydrophobicContact CZ-CG2 4.43Å; N131-I134 HydrophobicContact CB-CB 4.24Å; N131-I134 HydrophobicContact CB-CD1 4.19Å; N131-I134 HydrophobicContact CB-CG1 4.29Å; N131-I134 PolarHBondContact O-N 3.02Å; I134-W136 HydrophobicContact CG2-CB 3.82Å; I134-W136 HydrophobicContact CG2-CE3 4.38Å; I134-W136 PolarHBondContact O-N 2.84Å; I134-W136 VanDerWaalsContact O-N 3.14Å
135	S	92.3	Very high	95.8	Very high	86 Å²	86	78 Å²	78	60%	0.601	43%	0.426	S	S	*	.			trans	-86.1	41.2	175.3	-62.7	0	0	0	0	112.2	P124	P124-S135 VanDerWaalsContact CD-C 3.47Å; P124-S135 WeakPolarHBondContact CD-O 3.4Å
136	W	95.9	Very high	96	Very high	110 Å²	110	78 Å²	78	42%	0.417	43%	0.426	S	S	.	.			trans	-138.6	150.8	-179.7	169.1	92.9	0	0	0	109.9	F130 I134 P138	F130-W136 AromaticContact CE1-CE3 3.94Å; F130-W136 HydrophobicContact CE1-CE3 3.94Å; F130-W136 HydrophobicContact CE1-CZ3 4.07Å; F130-W136 VanDerWaalsContact CE1-O 3.31Å; F130-W136 WeakPolarHBondContact CE1-O 3.43Å; F130-W136 HydrophobicContact CZ-CE3 4.16Å; F130-W136 HydrophobicContact CZ-CZ3 4.12Å; I134-W136 HydrophobicContact CG2-CB 3.82Å; I134-W136 HydrophobicContact CG2-CE3 4.38Å; I134-W136 PolarHBondContact O-N 2.84Å; I134-W136 VanDerWaalsContact O-N 3.14Å; W136-P138 HydrophobicContact CH2-CB 3.6Å; W136-P138 HydrophobicContact CH2-CG 4.2Å; W136-P138 HydrophobicContact CZ2-CB 4.04Å; W136-P138 HydrophobicContact CZ3-CB 4.25Å; W136-P138 HydrophobicContact CZ3-CG 4.37Å
137	Q	96.6	Very high	96.2	Very high	18 Å²	18	80.2 Å²	80.2	8%	0.084	43%	0.427	C	S	.	.			trans	-135.6	146.7	171.8	60.1	-179	-42.3	0	0	110.4	F122 P124 I139	F122-Q137 PolarHBondContact O-NE2 2.99Å; P124-Q137 HydrophobicContact CB-CB 4.1Å; P124-Q137 HydrophobicContact CB-CG 4.2Å; P124-Q137 HydrophobicContact CG-CB 4.4Å; Q137-I139 HydrophobicContact CG-CD1 4.33Å; Q137-I139 HydrophobicContact CG-CG1 4.27Å; Q137-I139 PolarHBondContact O-N 2.65Å
138	P	96.9	Very high	96.4	Very high	83 Å²	83	77.2 Å²	77.2	54%	0.539	41%	0.411	S	S	.	.			trans	-68.9	126	175.5	27.2	-32.2	0	0	0	110.5	W136	W136-P138 HydrophobicContact CH2-CB 3.6Å; W136-P138 HydrophobicContact CH2-CG 4.2Å; W136-P138 HydrophobicContact CZ2-CB 4.04Å; W136-P138 HydrophobicContact CZ3-CB 4.25Å; W136-P138 HydrophobicContact CZ3-CG 4.37Å
139	I	98.4	Very high	96.5	Very high	20 Å²	20	75 Å²	75	10%	0.103	40%	0.401	C	S	.	.			trans	-125.5	128.6	171.7	-64.3	175.7	0	0	0	107.3	Y95 L118 F122 Q137 V141	Y95-I139 HydrophobicContact CD1-CD1 4.46Å; Y95-I139 HydrophobicContact CD1-CG1 4.1Å; Y95-I139 HydrophobicContact CD2-CD1 3.8Å; Y95-I139 HydrophobicContact CD2-CG1 4.07Å; Y95-I139 HydrophobicContact CD2-CG2 3.99Å; Y95-I139 HydrophobicContact CE1-CG1 4.4Å; Y95-I139 HydrophobicContact CE2-CD1 4.45Å; Y95-I139 HydrophobicContact CE2-CG1 4.36Å; Y95-I139 HydrophobicContact CE2-CG2 3.56Å; Y95-I139 HydrophobicContact CG-CD1 3.8Å; Y95-I139 HydrophobicContact CG-CG1 3.93Å; L118-I139 HydrophobicContact CB-CD1 4.32Å; L118-I139 HydrophobicContact CD1-CB 4.01Å; L118-I139 HydrophobicContact CD1-CG2 3.75Å; L118-I139 HydrophobicContact CD2-CD1 4.35Å; L118-I139 HydrophobicContact CD2-CG2 4.05Å; L118-I139 HydrophobicContact CG-CG2 4.4Å; F122-I139 HydrophobicContact CB-CD1 3.61Å; F122-I139 HydrophobicContact CD2-CD1 3.76Å; F122-I139 HydrophobicContact CG-CD1 3.99Å; Q137-I139 HydrophobicContact CG-CD1 4.33Å; Q137-I139 HydrophobicContact CG-CG1 4.27Å; Q137-I139 PolarHBondContact O-N 2.65Å; I139-V141 PolarHBondContact O-N 3.04Å
140	P	98.6	Very high	96.6	Very high	64 Å²	64	74 Å²	74	42%	0.416	40%	0.397	S	S	.	.			trans	-66.2	129.9	-174.3	25.3	-33.9	0	0	0	112.1	Y95	Y95-P140 WeakPolarHBondContact OH-CD 3.41Å
141	V	98.9	Very high	96.7	Very high	29 Å²	29	69.2 Å²	69.2	18%	0.176	38%	0.377	C	S	.	.			trans	-109.2	115.7	168.6	-179.3	0	0	0	0	107.8	V102 L111 A114 E115 L118 I139	V102-V141 HydrophobicContact CG1-CG1 4.15Å; V102-V141 HydrophobicContact CG1-CG2 4.22Å; L111-V141 HydrophobicContact CD2-CG1 3.81Å; A114-V141 HydrophobicContact CB-CG1 3.91Å; A114-V141 HydrophobicContact CB-CG2 3.92Å; E115-V141 HydrophobicContact CG-CG2 4.12Å; L118-V141 HydrophobicContact CD1-CG2 3.78Å; I139-V141 PolarHBondContact O-N 3.04Å
142	H	98.8	Very high	96.9	Very high	80 Å²	80	66.8 Å²	66.8	37%	0.37	36%	0.364	S	S	.	.	B	Isolated β-bridge	trans	-87.1	148.2	-179.1	-60.7	-77.8	0	0	0	111	Y101 V102 R103 S104	Y101-H142 AromaticContact CD2-CD2 3.66Å; Y101-H142 AromaticContact CD2-NE2 3.93Å; Y101-H142 HydrophobicContact CE2-CB 4.37Å; Y101-H142 AromaticContact CE2-CD2 3.19Å; Y101-H142 WeakPolarHBondContact CE2-CD2 3.39Å; Y101-H142 AromaticContact CE2-CG 3.79Å; Y101-H142 AromaticContact CE2-NE2 3.65Å; Y101-H142 AromaticContact CZ-CD2 3.73Å; V102-H142 WeakPolarHBondContact O-CB 3.5Å; V102-H142 PolarHBondContact O-CD2 3.3Å; V102-H142 PolarHBondContact O-N 3.19Å; R103-H142 CarbonylContact C-O 3.48Å; R103-H142 VanDerWaalsContact CA-O 3.22Å; R103-H142 WeakPolarHBondContact CA-O 3.13Å; S104-H142 PolarHBondContact N-O 2.92Å
143	T	98.8	Very high	97.1	Very high	56 Å²	56	65.3 Å²	65.3	34%	0.344	35%	0.347	S	S	.	.			trans	-146.5	172.7	174.9	-160.9	0	0	0	0	111.2	S104 D106 L111	S104-T143 WeakPolarHBondContact O-CB 3.3Å; S104-T143 PolarHBondContact O-OG1 3.38Å; D106-T143 WeakPolarHBondContact CA-OG1 3.48Å; D106-T143 HydrophobicContact CB-CG2 4.36Å; D106-T143 PolarHBondContact N-OG1 3.18Å; L111-T143 HydrophobicContact CD2-CG2 4.48Å
144	V	98.4	Very high	97.2	Very high	46 Å²	46	58.7 Å²	58.7	28%	0.279	31%	0.311	S	S	.	.			trans	-134.7	150.4	169.3	-55.9	0	0	0	0	107.9	D106 D149	D106-V144 VanDerWaalsContact CB-O 3.24Å; D106-V144 WeakPolarHBondContact CB-O 3.21Å; V144-D149 HydrophobicContact CG2-CB 3.8Å
145	P	98.3	Very high	97.4	Very high	57 Å²	57	58.3 Å²	58.3	37%	0.37	31%	0.312	S	S	.	.			trans	-52	144.4	-179.6	-27.2	35	0	0	0	113.2	T147 E148 D149	P145-T147 PolarHBondContact O-N 3.27Å; P145-E148 HydrophobicContact CB-CB 4.42Å; P145-E148 HydrophobicContact CB-CG 4.41Å; P145-E148 CarbonylContact O-C 3.59Å; P145-E148 WeakPolarHBondContact O-CA 3.39Å; P145-E148 PolarHBondContact O-N 3.29Å; P145-D149 PolarHBondContact O-N 3.03Å
146	I	96.6	Very high	97.6	Very high	55 Å²	55	54.5 Å²	54.5	28%	0.282	29%	0.286	S	S	.	.	T	Hydrogen-bonded Turn	trans	-50.1	-38.5	-178.4	-60.1	176.5	0	0	0	112.9	D106 F107 E148 K153	D106-I146 HydrophobicContact CB-CG1 3.88Å; D106-I146 VanDerWaalsContact O-CD1 3.24Å; D106-I146 WeakPolarHBondContact O-CD1 3.39Å; D106-I146 WeakPolarHBondContact O-CG1 3.47Å; F107-I146 HydrophobicContact CD1-CD1 4.36Å; F107-I146 HydrophobicContact CE1-CD1 3.99Å; F107-I146 HydrophobicContact CE2-CD1 4.18Å; F107-I146 HydrophobicContact CE2-CG1 4.22Å; F107-I146 HydrophobicContact CE2-CG2 4.42Å; F107-I146 HydrophobicContact CZ-CD1 3.89Å; F107-I146 HydrophobicContact CZ-CG1 4.36Å; F107-I146 HydrophobicContact CZ-CG2 4.24Å; I146-E148 VanDerWaalsContact C-N 3.29Å; I146-E148 PolarHBondContact O-N 3.09Å; I146-K153 HydrophobicContact CG2-CD 3.91Å
147	T	95.8	Very high	97.4	Very high	106 Å²	106	50.9 Å²	50.9	65%	0.65	28%	0.282	S	S	*	.	T	Hydrogen-bonded Turn	trans	-74.2	-20.1	-178.4	48.3	0	0	0	0	113.4	P145 R150	P145-T147 PolarHBondContact O-N 3.27Å; T147-R150 PolarHBondContact O-NH1 2.85Å; T147-R150 PolarHBondContact O-NH2 3.24Å
148	E	96.5	Very high	97.3	Very high	127 Å²	127	54.8 Å²	54.8	59%	0.593	31%	0.309	S	S	*	.	T	Hydrogen-bonded Turn	trans	-105.4	-9.9	-178	-64.5	178.1	-157.9	0	0	112.6	P145 I146 R150	P145-E148 HydrophobicContact CB-CB 4.42Å; P145-E148 HydrophobicContact CB-CG 4.41Å; P145-E148 CarbonylContact O-C 3.59Å; P145-E148 WeakPolarHBondContact O-CA 3.39Å; P145-E148 PolarHBondContact O-N 3.29Å; I146-E148 VanDerWaalsContact C-N 3.29Å; I146-E148 PolarHBondContact O-N 3.09Å; E148-R150 PolarHBondContact O-N 2.77Å
149	D	97.4	Very high	97.3	Very high	4 Å²	4	51 Å²	51	2%	0.021	28%	0.284	C	S	.	.			trans	-65.6	120.5	176.2	-162	-58	0	0	0	110.3	R103 V144 P145 L151 L152 K153	R103-D149 IonicContact CZ-OD2 3.31Å; R103-D149 VanDerWaalsContact CZ-OD2 3.3Å; R103-D149 IonicContact NH1-OD1 3.3Å; R103-D149 IonicContact NH1-OD2 2.71Å; R103-D149 PolarHBondContact NH1-OD2 3.06Å; R103-D149 IonicContact NH2-OD1 2.73Å; R103-D149 IonicContact NH2-OD2 3.45Å; R103-D149 PolarHBondContact NH2-OD2 2.96Å; V144-D149 HydrophobicContact CG2-CB 3.8Å; P145-D149 PolarHBondContact O-N 3.03Å; D149-L151 PolarHBondContact OD1-N 2.9Å; D149-L152 PolarHBondContact OD1-N 2.88Å; D149-K153 HydrophobicContact CB-CB 4.11Å; D149-K153 PolarHBondContact OD1-N 2.85Å
150	R	96.5	Very high	97.3	Very high	110 Å²	110	52.8 Å²	52.8	42%	0.415	30%	0.297	S	S	.	.			trans	-121.8	19.1	178	-61.5	-65.5	178.1	-90	-3.8	112.1	T147 E148 V259	T147-R150 PolarHBondContact O-NH1 2.85Å; T147-R150 PolarHBondContact O-NH2 3.24Å; E148-R150 PolarHBondContact O-N 2.77Å; R150-V259 WeakPolarHBondContact O-CG1 3.2Å
151	L	98.2	Very high	97.3	Very high	26 Å²	26	51.5 Å²	51.5	14%	0.136	28%	0.284	C	S	.	.	S	Bend	trans	-135.5	-44.1	-170.8	-174.5	65.3	0	0	0	114.5	D149 F154 L260 Q263 Y283	D149-L151 PolarHBondContact OD1-N 2.9Å; L151-F154 WeakPolarHBondContact O-CE2 3.34Å; L151-F154 WeakPolarHBondContact O-CZ 3.5Å; L151-L260 HydrophobicContact CD1-CB 4.34Å; L151-L260 HydrophobicContact CD1-CD1 3.73Å; L151-L260 HydrophobicContact CG-CD1 4.02Å; L151-Q263 HydrophobicContact CD1-CB 3.81Å; L151-Q263 HydrophobicContact CD1-CG 4.18Å; L151-Q263 HydrophobicContact CD2-CG 4.35Å; L151-Y283 HydrophobicContact CD2-CE1 4.28Å
152	L	98.6	Very high	97.2	Very high	0 Å²	0	50.4 Å²	50.4	0%	0	28%	0.277	C	S	.	.	S	Bend	trans	-118.2	-16.4	-171.4	-63.2	-176.9	0	0	0	113.8	L39 R103 T105 D149 L260 Y283 A285 T289	L39-L152 HydrophobicContact CD1-CD2 4.17Å; R103-L152 HydrophobicContact CG-CD1 4.15Å; T105-L152 HydrophobicContact CG2-CB 3.47Å; T105-L152 VanDerWaalsContact CG2-CB 3.47Å; D149-L152 PolarHBondContact OD1-N 2.88Å; L152-L260 HydrophobicContact CD2-CD1 3.9Å; L152-L260 HydrophobicContact CD2-CD2 4.05Å; L152-Y283 HydrophobicContact CD1-CD1 3.8Å; L152-Y283 HydrophobicContact CD1-CG 4.19Å; L152-Y283 HydrophobicContact CD2-CD1 4Å; L152-Y283 HydrophobicContact CD2-CD2 4.43Å; L152-Y283 HydrophobicContact CD2-CG 3.83Å; L152-Y283 HydrophobicContact CG-CD1 4.38Å; L152-A285 HydrophobicContact CB-CB 4.16Å; L152-T289 HydrophobicContact CB-CG2 4.45Å; L152-T289 HydrophobicContact CD2-CG2 4.21Å; L152-T289 VanDerWaalsContact O-CG2 3.29Å; L152-T289 WeakPolarHBondContact O-CG2 3.25Å; L152-T289 PolarHBondContact O-OG1 3.44Å
153	K	97.8	Very high	97.2	Very high	77 Å²	77	51.6 Å²	51.6	34%	0.335	28%	0.283	S	S	.	.	S	Bend	trans	-96.3	103.5	177.5	-173.4	-148	178.1	-171.6	0	110.8	T105 I146 D149 L156	T105-K153 HydrophobicContact CG2-CB 4.31Å; I146-K153 HydrophobicContact CG2-CD 3.91Å; D149-K153 HydrophobicContact CB-CB 4.11Å; D149-K153 PolarHBondContact OD1-N 2.85Å; K153-L156 WeakPolarHBondContact O-CD2 3.42Å
154	F	97.9	Very high	97.2	Very high	11 Å²	11	52.3 Å²	52.3	5%	0.048	28%	0.282	C	S	.	.	S	Bend	trans	-105.3	148.5	178.2	-68.3	-83.1	0	0	0	112.6	L151 L156 F244 Q256 L260 T288 T289 A292	L151-F154 WeakPolarHBondContact O-CE2 3.34Å; L151-F154 WeakPolarHBondContact O-CZ 3.5Å; F154-L156 HydrophobicContact CD1-CD1 4.38Å; F154-L156 HydrophobicContact CD1-CD2 4.38Å; F154-L156 HydrophobicContact CD1-CG 3.79Å; F154-L156 HydrophobicContact CE1-CD1 3.69Å; F154-L156 HydrophobicContact CE1-CD2 4.16Å; F154-L156 HydrophobicContact CE1-CG 3.58Å; F154-L156 HydrophobicContact CZ-CD1 4.42Å; F154-L156 HydrophobicContact CZ-CG 4.46Å; F154-F244 HydrophobicContact CB-CE1 4.42Å; F154-F244 HydrophobicContact CB-CZ 4.11Å; F154-Q256 HydrophobicContact CD1-CB 4.27Å; F154-Q256 HydrophobicContact CE1-CB 4.41Å; F154-Q256 VanDerWaalsContact CE1-O 3.27Å; F154-Q256 WeakPolarHBondContact CE1-O 3.3Å; F154-L260 HydrophobicContact CE2-CB 4.35Å; F154-L260 HydrophobicContact CE2-CD2 4.31Å; F154-L260 HydrophobicContact CZ-CB 4.05Å; F154-T288 PolarHBondContact O-OG1 3.02Å; F154-T288 VanDerWaalsContact O-OG1 3.13Å; F154-T289 HydrophobicContact CD2-CG2 3.75Å; F154-T289 HydrophobicContact CE2-CG2 3.76Å; F154-A292 HydrophobicContact CB-CB 4.2Å; F154-A292 HydrophobicContact CD1-CB 3.9Å; F154-A292 HydrophobicContact CD2-CB 4.09Å; F154-A292 HydrophobicContact CE1-CB 4.34Å; F154-A292 HydrophobicContact CE2-CB 4.46Å; F154-A292 HydrophobicContact CG-CB 3.77Å
155	P	97.8	Very high	97.2	Very high	59 Å²	59	50.1 Å²	50.1	38%	0.383	27%	0.269	S	S	.	.	S	Bend	cis	-71.4	149.9	-3.5	30.2	-35.1	0	0	0	113	Y162 Q256	P155-Y162 HydrophobicContact CB-CE1 3.86Å; P155-Q256 VanDerWaalsContact CA-OE1 3.27Å
156	L	96.8	Very high	97.2	Very high	7 Å²	7	48.9 Å²	48.9	4%	0.037	26%	0.258	C	S	.	.			trans	-73.9	138.1	173.8	-62.5	178	0	0	0	110.3	K153 F154 Q256 V259 W366	K153-L156 WeakPolarHBondContact O-CD2 3.42Å; F154-L156 HydrophobicContact CD1-CD1 4.38Å; F154-L156 HydrophobicContact CD1-CD2 4.38Å; F154-L156 HydrophobicContact CD1-CG 3.79Å; F154-L156 HydrophobicContact CE1-CD1 3.69Å; F154-L156 HydrophobicContact CE1-CD2 4.16Å; F154-L156 HydrophobicContact CE1-CG 3.58Å; F154-L156 HydrophobicContact CZ-CD1 4.42Å; F154-L156 HydrophobicContact CZ-CG 4.46Å; L156-Q256 PolarHBondContact O-NE2 2.78Å; L156-V259 HydrophobicContact CD1-CB 3.83Å; L156-V259 HydrophobicContact CD1-CG1 4.15Å; L156-V259 HydrophobicContact CD1-CG2 3.59Å; L156-W366 HydrophobicContact CB-CZ2 3.85Å
157	G	91.4	Very high	97.2	Very high	33 Å²	33	50.2 Å²	50.2	34%	0.34	27%	0.266	S	S	.	.			trans	-161.7	168.8	175.2	0	0	0	0	0	112.3
158	P	94.5	Very high	97.4	Very high	101 Å²	101	47.1 Å²	47.1	66%	0.656	24%	0.244	S	C	*	.	S	Bend	cis	-71.2	140.2	-2.5	29.7	-34.8	0	0	0	112.5	W366	P158-W366 WeakPolarHBondContact O-CH2 3.39Å
159	C	97.5	Very high	97.5	Very high	2 Å²	2	41.1 Å²	41.1	1%	0.014	22%	0.216	C	C	.	.			trans	-149.2	91.4	178.2	-175.3	0	0	0	0	110.7	R161 Y162 E163 W366 C370	C159-R161 VanDerWaalsContact C-N 3.31Å; C159-R161 PolarHBondContact O-N 2.95Å; C159-Y162 WeakPolarHBondContact O-CB 3.36Å; C159-Y162 PolarHBondContact O-N 2.86Å; C159-E163 PolarHBondContact O-N 3.42Å; C159-E163 VanDerWaalsContact O-N 3.11Å; C159-W366 HydrophobicContact CB-CH2 4.05Å; C159-W366 HydrophobicContact CB-CZ2 3.89Å; C159-C370 HydrophobicContact CB-CB 3.96Å; C159-C370 WeakPolarHBondContact CB-SG 3.44Å; C159-C370 VanDerWaalsContact SG-CA 3.55Å; C159-C370 WeakPolarHBondContact SG-CB 3.41Å; C159-C370 CovalentContact SG-SG 2.04Å; C159-C370 PolarHBondContact SG-SG 3.41Å
160	P	98	Very high	97.5	Very high	58 Å²	58	44.2 Å²	44.2	38%	0.377	23%	0.227	S	C	.	.	H	α-helix	trans	-54.5	-39.8	-175.8	-31	37.1	0	0	0	114.6	Y162 E163 Q164 C370 L372	P160-Y162 VanDerWaalsContact C-N 3.33Å; P160-Y162 PolarHBondContact O-N 2.83Å; P160-E163 PolarHBondContact O-N 3.47Å; P160-Q164 PolarHBondContact O-N 3.18Å; P160-C370 WeakPolarHBondContact CD-O 3.4Å; P160-L372 HydrophobicContact CB-CD1 4.16Å; P160-L372 HydrophobicContact CB-CD2 4.18Å; P160-L372 HydrophobicContact CB-CG 3.79Å
161	R	98	Very high	97.6	Very high	38 Å²	38	46.7 Å²	46.7	14%	0.143	24%	0.241	C	C	.	.	H	α-helix	trans	-62.9	-39.2	176.5	-177.6	59.6	-176.4	144.6	8.9	112.4	C159 Q164 L165 E168 E251 L255 C370 L372	C159-R161 VanDerWaalsContact C-N 3.31Å; C159-R161 PolarHBondContact O-N 2.95Å; R161-Q164 WeakPolarHBondContact O-CB 3.33Å; R161-Q164 PolarHBondContact O-N 2.97Å; R161-L165 WeakPolarHBondContact O-CG 3.4Å; R161-L165 PolarHBondContact O-N 2.87Å; R161-E168 IonicContact NH1-OE1 2.66Å; R161-E168 IonicContact NH1-OE2 3.14Å; R161-E251 IonicContact CZ-OE1 3.18Å; R161-E251 VanDerWaalsContact CZ-OE1 3.25Å; R161-E251 IonicContact CZ-OE2 2.71Å; R161-E251 IonicContact NE-OE1 3.09Å; R161-E251 PolarHBondContact NE-OE1 3.39Å; R161-E251 IonicContact NE-OE2 2.63Å; R161-E251 IonicContact NH2-OE1 3.6Å; R161-E251 PolarHBondContact NH2-OE1 2.97Å; R161-E251 IonicContact NH2-OE2 3.53Å; R161-E251 PolarHBondContact NH2-OE2 3.27Å; R161-L255 HydrophobicContact CB-CD1 4.02Å; R161-L255 HydrophobicContact CG-CD1 3.79Å; R161-C370 WeakPolarHBondContact CB-O 3.45Å; R161-C370 PolarHBondContact N-O 3.15Å; R161-L372 HydrophobicContact CB-CD2 4.5Å
162	Y	98.3	Very high	97.6	Very high	6 Å²	6	46.2 Å²	46.2	2%	0.024	24%	0.239	C	C	.	.	H	α-helix	trans	-67	-39.1	176.2	177.5	-109.7	0	0	0	112	P155 C159 P160 Q164 L165 Q166 L243 K252 Q256	P155-Y162 HydrophobicContact CB-CE1 3.86Å; C159-Y162 WeakPolarHBondContact O-CB 3.36Å; C159-Y162 PolarHBondContact O-N 2.86Å; P160-Y162 VanDerWaalsContact C-N 3.33Å; P160-Y162 PolarHBondContact O-N 2.83Å; Y162-Q164 VanDerWaalsContact C-N 3.33Å; Y162-Q164 PolarHBondContact O-N 3.4Å; Y162-L165 PolarHBondContact O-N 3.11Å; Y162-Q166 HydrophobicContact CE1-CG 4.16Å; Y162-Q166 VanDerWaalsContact CE1-NE2 3.25Å; Y162-Q166 HydrophobicContact CE2-CG 4.41Å; Y162-Q166 WeakPolarHBondContact O-CG 3.38Å; Y162-Q166 PolarHBondContact O-N 2.92Å; Y162-L243 WeakPolarHBondContact CE2-O 3.07Å; Y162-L243 PolarHBondContact OH-O 3.21Å; Y162-K252 HydrophobicContact CD2-CG 4.42Å; Y162-K252 HydrophobicContact CE2-CD 4.5Å; Y162-K252 HydrophobicContact CE2-CG 4.29Å; Y162-Q256 HydrophobicContact CD2-CG 3.78Å; Y162-Q256 HydrophobicContact CE2-CG 3.51Å; Y162-Q256 HydrophobicContact CG-CG 4.43Å; Y162-Q256 VanDerWaalsContact CG-NE2 3.25Å
163	E	98.1	Very high	97.6	Very high	105 Å²	105	50.8 Å²	50.8	49%	0.491	27%	0.269	S	S	.	.	H	α-helix	trans	-61.6	-41.1	172.8	-67.7	172	-164.5	0	0	111.7	C159 P160 Q166 N167	C159-E163 PolarHBondContact O-N 3.42Å; C159-E163 VanDerWaalsContact O-N 3.11Å; P160-E163 PolarHBondContact O-N 3.47Å; E163-Q166 PolarHBondContact O-N 2.97Å; E163-N167 PolarHBondContact O-N 2.85Å; E163-N167 PolarHBondContact O-ND2 2.94Å
164	Q	98.3	Very high	97.6	Very high	71 Å²	71	50.5 Å²	50.5	33%	0.332	27%	0.269	S	S	.	.	H	α-helix	trans	-60.6	-45.4	172.8	-172.6	-173.4	8.2	0	0	111.7	P160 R161 Y162 Q166 N167 E168 L372	P160-Q164 PolarHBondContact O-N 3.18Å; R161-Q164 WeakPolarHBondContact O-CB 3.33Å; R161-Q164 PolarHBondContact O-N 2.97Å; Y162-Q164 VanDerWaalsContact C-N 3.33Å; Y162-Q164 PolarHBondContact O-N 3.4Å; Q164-Q166 VanDerWaalsContact C-N 3.3Å; Q164-Q166 PolarHBondContact O-N 2.95Å; Q164-N167 WeakPolarHBondContact O-CB 3.47Å; Q164-N167 PolarHBondContact O-N 3.06Å; Q164-N167 VanDerWaalsContact O-N 3.12Å; Q164-E168 HydrophobicContact CG-CG 4.48Å; Q164-E168 WeakPolarHBondContact CG-OE1 3.38Å; Q164-E168 PolarHBondContact NE2-OE1 2.84Å; Q164-E168 WeakPolarHBondContact O-CG 3.37Å; Q164-E168 PolarHBondContact O-N 3.28Å; Q164-L372 HydrophobicContact CB-CD2 4.07Å; Q164-L372 VanDerWaalsContact OE1-CD2 3.25Å
165	L	98.4	Very high	97.6	Very high	0 Å²	0	50.9 Å²	50.9	0%	0	27%	0.27	C	S	.	.	H	α-helix	trans	-61.7	-37	177.2	-73.5	172.9	0	0	0	112.5	R161 Y162 E168 T169 Y247 Q248 E251 K252 L255	R161-L165 WeakPolarHBondContact O-CG 3.4Å; R161-L165 PolarHBondContact O-N 2.87Å; Y162-L165 PolarHBondContact O-N 3.11Å; L165-E168 PolarHBondContact O-N 3.28Å; L165-T169 WeakPolarHBondContact O-CB 3.32Å; L165-T169 PolarHBondContact O-N 3.41Å; L165-T169 PolarHBondContact O-OG1 3.46Å; L165-Y247 HydrophobicContact CD2-CD1 4.3Å; L165-Y247 HydrophobicContact CD2-CE1 4.22Å; L165-Q248 HydrophobicContact CD2-CB 4.01Å; L165-Q248 HydrophobicContact CD2-CG 4.42Å; L165-E251 HydrophobicContact CD1-CB 4.15Å; L165-E251 HydrophobicContact CD1-CG 3.89Å; L165-K252 HydrophobicContact CB-CG 4.26Å; L165-K252 HydrophobicContact CD1-CG 3.91Å; L165-L255 HydrophobicContact CD1-CD1 3.93Å
166	Q	98.1	Very high	97.6	Very high	30 Å²	30	52.4 Å²	52.4	14%	0.14	27%	0.272	C	S	.	.	H	α-helix	trans	-63.7	-44.2	172.7	-71.7	-175.6	95.7	0	0	111.2	Y162 E163 Q164 E168 T169 R170 F242	Y162-Q166 HydrophobicContact CE1-CG 4.16Å; Y162-Q166 VanDerWaalsContact CE1-NE2 3.25Å; Y162-Q166 HydrophobicContact CE2-CG 4.41Å; Y162-Q166 WeakPolarHBondContact O-CG 3.38Å; Y162-Q166 PolarHBondContact O-N 2.92Å; E163-Q166 PolarHBondContact O-N 2.97Å; Q164-Q166 VanDerWaalsContact C-N 3.3Å; Q164-Q166 PolarHBondContact O-N 2.95Å; Q166-E168 VanDerWaalsContact C-N 3.34Å; Q166-E168 PolarHBondContact O-N 3.46Å; Q166-T169 WeakPolarHBondContact O-CB 3.46Å; Q166-T169 PolarHBondContact O-N 3.33Å; Q166-R170 WeakPolarHBondContact O-CG 3.35Å; Q166-R170 PolarHBondContact O-N 2.81Å; Q166-F242 HydrophobicContact CB-CE1 4.49Å; Q166-F242 HydrophobicContact CB-CZ 3.95Å; Q166-F242 HydrophobicContact CG-CE1 4.31Å; Q166-F242 HydrophobicContact CG-CZ 4.23Å
167	N	98.3	Very high	97.7	Very high	83 Å²	83	56.3 Å²	56.3	44%	0.444	29%	0.293	S	S	.	.	H	α-helix	trans	-61.7	-39.7	175	-72.1	-30.4	0	0	0	112.9	E163 Q164 R170	E163-N167 PolarHBondContact O-N 2.85Å; E163-N167 PolarHBondContact O-ND2 2.94Å; Q164-N167 WeakPolarHBondContact O-CB 3.47Å; Q164-N167 PolarHBondContact O-N 3.06Å; Q164-N167 VanDerWaalsContact O-N 3.12Å; N167-R170 PolarHBondContact O-N 2.85Å; N167-R170 PolarHBondContact OD1-NH1 3.07Å
168	E	98.5	Very high	98	Very high	42 Å²	42	56.5 Å²	56.5	20%	0.196	29%	0.285	C	S	.	.	H	α-helix	trans	-68	-37.2	174.9	-70.5	167.7	-176.7	0	0	111.2	R161 Q164 L165 Q166 R170 K171 T172 Y247	R161-E168 IonicContact NH1-OE1 2.66Å; R161-E168 IonicContact NH1-OE2 3.14Å; Q164-E168 HydrophobicContact CG-CG 4.48Å; Q164-E168 WeakPolarHBondContact CG-OE1 3.38Å; Q164-E168 PolarHBondContact NE2-OE1 2.84Å; Q164-E168 WeakPolarHBondContact O-CG 3.37Å; Q164-E168 PolarHBondContact O-N 3.28Å; L165-E168 PolarHBondContact O-N 3.28Å; Q166-E168 VanDerWaalsContact C-N 3.34Å; Q166-E168 PolarHBondContact O-N 3.46Å; E168-R170 VanDerWaalsContact C-N 3.32Å; E168-R170 PolarHBondContact O-N 3.19Å; E168-K171 WeakPolarHBondContact O-CB 3.21Å; E168-K171 PolarHBondContact O-N 3.42Å; E168-T172 PolarHBondContact O-N 3.46Å; E168-Y247 HydrophobicContact CB-CD1 3.79Å; E168-Y247 HydrophobicContact CB-CE1 3.52Å; E168-Y247 HydrophobicContact CG-CE1 4.37Å; E168-Y247 WeakPolarHBondContact OE2-CE1 3.17Å
169	T	98.5	Very high	98.2	Very high	0 Å²	0	53.7 Å²	53.7	0%	0	27%	0.267	C	S	.	.	H	α-helix	trans	-59.2	-43.1	174.2	-54.6	0	0	0	0	111.4	L165 Q166 K171 T172 Y175 F242 I246 K252	L165-T169 WeakPolarHBondContact O-CB 3.32Å; L165-T169 PolarHBondContact O-N 3.41Å; L165-T169 PolarHBondContact O-OG1 3.46Å; Q166-T169 WeakPolarHBondContact O-CB 3.46Å; Q166-T169 PolarHBondContact O-N 3.33Å; T169-K171 PolarHBondContact O-N 3.44Å; T169-K171 VanDerWaalsContact O-N 3.15Å; T169-T172 WeakPolarHBondContact O-CB 3.5Å; T169-T172 WeakPolarHBondContact O-CG2 3.39Å; T169-T172 PolarHBondContact O-N 2.84Å; T169-T172 PolarHBondContact O-OG1 3.36Å; T169-Y175 WeakPolarHBondContact O-CB 3.37Å; T169-F242 HydrophobicContact CG2-CD2 3.6Å; T169-F242 HydrophobicContact CG2-CE2 3.9Å; T169-I246 HydrophobicContact CG2-CB 3.83Å; T169-I246 HydrophobicContact CG2-CD1 4.4Å; T169-I246 HydrophobicContact CG2-CG2 3.79Å; T169-K252 WeakPolarHBondContact OG1-CE 3.23Å; T169-K252 PolarHBondContact OG1-NZ 2.99Å
170	R	98.4	Very high	98.2	Very high	69 Å²	69	57.7 Å²	57.7	26%	0.26	30%	0.295	S	S	.	.	H	α-helix	trans	-58.9	-27	176.8	-66.4	-178.9	-173.7	98.6	2.1	112.6	Q166 N167 E168 Y175 Q176 E201 F242	Q166-R170 WeakPolarHBondContact O-CG 3.35Å; Q166-R170 PolarHBondContact O-N 2.81Å; N167-R170 PolarHBondContact O-N 2.85Å; N167-R170 PolarHBondContact OD1-NH1 3.07Å; E168-R170 VanDerWaalsContact C-N 3.32Å; E168-R170 PolarHBondContact O-N 3.19Å; R170-Y175 HydrophobicContact CB-CD1 4.22Å; R170-Y175 HydrophobicContact CB-CE1 4.12Å; R170-Y175 HydrophobicContact CG-CD1 4.5Å; R170-Y175 HydrophobicContact CG-CE1 4.05Å; R170-Y175 HydrophobicContact CG-CE2 4.2Å; R170-Y175 WeakPolarHBondContact O-CD1 3.23Å; R170-Q176 PolarHBondContact O-NE2 3.07Å; R170-E201 IonicContact CZ-OE1 2.71Å; R170-E201 IonicContact CZ-OE2 3.66Å; R170-E201 IonicContact NE-OE1 3.8Å; R170-E201 PolarHBondContact NE-OE1 2.93Å; R170-E201 IonicContact NE-OE2 3.29Å; R170-E201 VanDerWaalsContact NH2-CD 3.31Å; R170-E201 IonicContact NH2-OE1 3.78Å; R170-E201 PolarHBondContact NH2-OE1 2.96Å; R170-E201 IonicContact NH2-OE2 3.38Å; R170-E201 PolarHBondContact NH2-OE2 3.28Å; R170-F242 HydrophobicContact CG-CE2 3.81Å; R170-F242 HydrophobicContact CG-CZ 4.23Å
171	K	98.4	Very high	98.2	Very high	162 Å²	162	62.2 Å²	62.2	70%	0.704	31%	0.305	S	S	*	.	T	Hydrogen-bonded Turn	trans	-84.2	-9	179.5	-62	174.1	-175.1	176.3	0	113.4	E168 T169	E168-K171 WeakPolarHBondContact O-CB 3.21Å; E168-K171 PolarHBondContact O-N 3.42Å; T169-K171 PolarHBondContact O-N 3.44Å; T169-K171 VanDerWaalsContact O-N 3.15Å
172	T	98.6	Very high	98.2	Very high	17 Å²	17	60.8 Å²	60.8	10%	0.104	30%	0.3	C	S	.	.	S	Bend	trans	-69.6	150	-178.9	62.8	0	0	0	0	112.2	E168 T169 E174 Y175 Q176 Y247	E168-T172 PolarHBondContact O-N 3.46Å; T169-T172 WeakPolarHBondContact O-CB 3.5Å; T169-T172 WeakPolarHBondContact O-CG2 3.39Å; T169-T172 PolarHBondContact O-N 2.84Å; T169-T172 PolarHBondContact O-OG1 3.36Å; T172-E174 PolarHBondContact O-N 2.98Å; T172-Y175 PolarHBondContact O-N 2.93Å; T172-Y175 PolarHBondContact OG1-N 3.32Å; T172-Q176 WeakPolarHBondContact O-CG 3.13Å; T172-Q176 PolarHBondContact O-N 3.33Å; T172-Y247 HydrophobicContact CG2-CD2 3.75Å; T172-Y247 HydrophobicContact CG2-CG 4Å
173	P	98.4	Very high	98.2	Very high	95 Å²	95	62.5 Å²	62.5	62%	0.617	32%	0.315	S	S	*	.	H	α-helix	trans	-56.8	-36.6	173.6	-26.2	35	0	0	0	113.2	Q176 N177	P173-Q176 PolarHBondContact O-N 2.82Å; P173-N177 WeakPolarHBondContact O-CB 3.36Å; P173-N177 PolarHBondContact O-N 3.46Å; P173-N177 PolarHBondContact O-ND2 3.41Å
174	E	97.8	Very high	98.1	Very high	72 Å²	72	65.6 Å²	65.6	34%	0.336	33%	0.33	S	S	.	.	H	α-helix	trans	-59.2	-50.8	178.4	-175.2	172.5	160.9	0	0	111.4	T172 E178 F238 R241 I246	T172-E174 PolarHBondContact O-N 2.98Å; E174-E178 PolarHBondContact O-N 3.36Å; E174-F238 HydrophobicContact CG-CE2 4.41Å; E174-R241 IonicContact OE1-CZ 2.75Å; E174-R241 IonicContact OE1-NE 3.34Å; E174-R241 IonicContact OE1-NH2 3.46Å; E174-R241 PolarHBondContact OE1-NH2 2.76Å; E174-I246 HydrophobicContact CB-CG2 4.12Å; E174-I246 HydrophobicContact CG-CG2 4.31Å
175	Y	98.1	Very high	98.1	Very high	19 Å²	19	63 Å²	63	8%	0.075	32%	0.318	C	S	.	.	H	α-helix	trans	-65.9	-46.6	177.8	-173.6	-81.7	0	0	0	112.5	T169 R170 T172 N177 E178 S179 L200 E201 F238 F242	T169-Y175 WeakPolarHBondContact O-CB 3.37Å; R170-Y175 HydrophobicContact CB-CD1 4.22Å; R170-Y175 HydrophobicContact CB-CE1 4.12Å; R170-Y175 HydrophobicContact CG-CD1 4.5Å; R170-Y175 HydrophobicContact CG-CE1 4.05Å; R170-Y175 HydrophobicContact CG-CE2 4.2Å; R170-Y175 WeakPolarHBondContact O-CD1 3.23Å; T172-Y175 PolarHBondContact O-N 2.93Å; T172-Y175 PolarHBondContact OG1-N 3.32Å; Y175-N177 VanDerWaalsContact C-N 3.3Å; Y175-N177 PolarHBondContact O-N 3.47Å; Y175-E178 PolarHBondContact O-N 2.88Å; Y175-S179 WeakPolarHBondContact O-CB 3.17Å; Y175-S179 PolarHBondContact O-N 3.28Å; Y175-L200 HydrophobicContact CD2-CD1 4.38Å; Y175-L200 HydrophobicContact CE1-CD1 4.36Å; Y175-L200 HydrophobicContact CE2-CB 4.4Å; Y175-L200 HydrophobicContact CE2-CD1 4.13Å; Y175-E201 HydrophobicContact CE2-CG 4.44Å; Y175-E201 PolarHBondContact OH-OE1 3.04Å; Y175-F238 AromaticContact CD2-CE1 3.84Å; Y175-F238 HydrophobicContact CD2-CE1 3.84Å; Y175-F238 HydrophobicContact CD2-CZ 4.06Å; Y175-F238 HydrophobicContact CE2-CE1 4.26Å; Y175-F242 AromaticContact CD2-CD2 3.63Å; Y175-F242 HydrophobicContact CD2-CD2 3.63Å; Y175-F242 HydrophobicContact CD2-CE2 4.05Å; Y175-F242 AromaticContact CE2-CD2 3.52Å; Y175-F242 HydrophobicContact CE2-CD2 3.52Å; Y175-F242 AromaticContact CE2-CE2 3.71Å; Y175-F242 HydrophobicContact CE2-CE2 3.71Å; Y175-F242 HydrophobicContact CE2-CG 4.32Å
176	Q	98.3	Very high	98.1	Very high	91 Å²	91	63.6 Å²	63.6	43%	0.425	32%	0.321	S	S	.	.	H	α-helix	trans	-61.8	-39.2	-179.3	-70.1	-65.2	-32.5	0	0	112	R170 T172 P173 S179 S180	R170-Q176 PolarHBondContact O-NE2 3.07Å; T172-Q176 WeakPolarHBondContact O-CG 3.13Å; T172-Q176 PolarHBondContact O-N 3.33Å; P173-Q176 PolarHBondContact O-N 2.82Å; Q176-S179 PolarHBondContact O-N 3.45Å; Q176-S180 WeakPolarHBondContact O-CB 3.35Å; Q176-S180 PolarHBondContact O-N 3.07Å; Q176-S180 PolarHBondContact O-OG 2.86Å
177	N	98.3	Very high	98.1	Very high	89 Å²	89	66.9 Å²	66.9	48%	0.476	34%	0.339	S	S	.	.	H	α-helix	trans	-69.2	-40.1	176.1	-71.4	-18	0	0	0	112	P173 Y175 S179 R181	P173-N177 WeakPolarHBondContact O-CB 3.36Å; P173-N177 PolarHBondContact O-N 3.46Å; P173-N177 PolarHBondContact O-ND2 3.41Å; Y175-N177 VanDerWaalsContact C-N 3.3Å; Y175-N177 PolarHBondContact O-N 3.47Å; N177-S179 VanDerWaalsContact C-N 3.34Å; N177-R181 VanDerWaalsContact O-CB 3.29Å; N177-R181 WeakPolarHBondContact O-CB 3.26Å; N177-R181 VanDerWaalsContact O-CG 3.28Å; N177-R181 WeakPolarHBondContact O-CG 3.27Å; N177-R181 PolarHBondContact O-N 3.06Å; N177-R181 PolarHBondContact O-NE 2.89Å
178	E	98.1	Very high	98.1	Very high	37 Å²	37	65.9 Å²	65.9	17%	0.173	33%	0.333	C	S	.	.	H	α-helix	trans	-65.5	-40.3	175.8	-160.7	62.3	-146.2	0	0	111.1	E174 Y175 R181 N182 L200 L235 F238	E174-E178 PolarHBondContact O-N 3.36Å; Y175-E178 PolarHBondContact O-N 2.88Å; E178-R181 IonicContact OE2-CZ 3.25Å; E178-R181 VanDerWaalsContact OE2-CZ 3.25Å; E178-R181 IonicContact OE2-NH1 2.82Å; E178-R181 PolarHBondContact OE2-NH1 2.67Å; E178-R181 IonicContact OE2-NH2 2.74Å; E178-R181 PolarHBondContact OE2-NH2 3.05Å; E178-N182 WeakPolarHBondContact O-CB 3.32Å; E178-N182 PolarHBondContact O-N 3.02Å; E178-N182 VanDerWaalsContact O-N 3.16Å; E178-N182 PolarHBondContact O-ND2 2.91Å; E178-N182 PolarHBondContact OE1-ND2 3.45Å; E178-L200 HydrophobicContact CB-CD1 4.07Å; E178-L200 HydrophobicContact CG-CD1 4.24Å; E178-L200 HydrophobicContact CG-CD2 4.39Å; E178-L235 HydrophobicContact CG-CD2 4.49Å; E178-F238 HydrophobicContact CB-CD2 4.41Å; E178-F238 HydrophobicContact CB-CE1 4.3Å; E178-F238 HydrophobicContact CB-CE2 3.88Å; E178-F238 HydrophobicContact CB-CZ 3.83Å; E178-F238 HydrophobicContact CG-CD1 4.21Å; E178-F238 HydrophobicContact CG-CD2 3.83Å; E178-F238 HydrophobicContact CG-CE1 4.22Å; E178-F238 HydrophobicContact CG-CE2 3.83Å; E178-F238 HydrophobicContact CG-CG 4.03Å; E178-F238 HydrophobicContact CG-CZ 4.03Å
179	S	97	Very high	98.1	Very high	41 Å²	41	63.9 Å²	63.9	29%	0.287	32%	0.324	S	S	.	.	H	α-helix	trans	-62.6	-52.4	176.8	-177.1	0	0	0	0	110.7	Y175 Q176 N177 R181 N182 A183	Y175-S179 WeakPolarHBondContact O-CB 3.17Å; Y175-S179 PolarHBondContact O-N 3.28Å; Q176-S179 PolarHBondContact O-N 3.45Å; N177-S179 VanDerWaalsContact C-N 3.34Å; S179-R181 VanDerWaalsContact C-N 3.34Å; S179-R181 PolarHBondContact O-N 2.98Å; S179-N182 CarbonylContact O-C 3.5Å; S179-N182 PolarHBondContact O-N 3Å; S179-A183 PolarHBondContact O-N 2.98Å
180	S	97.8	Very high	98.1	Very high	86 Å²	86	64.7 Å²	64.7	60%	0.601	33%	0.33	S	S	*	.	H	α-helix	trans	-60.4	-41	-179.9	-57.6	0	0	0	0	112.5	Q176 N182	Q176-S180 WeakPolarHBondContact O-CB 3.35Å; Q176-S180 PolarHBondContact O-N 3.07Å; Q176-S180 PolarHBondContact O-OG 2.86Å; S180-N182 VanDerWaalsContact C-N 3.25Å; S180-N182 PolarHBondContact O-N 3.45Å
181	R	98.1	Very high	98.1	Very high	154 Å²	154	66.8 Å²	66.8	58%	0.581	35%	0.347	S	S	*	.	H	α-helix	trans	-67.5	-24	177.9	-79.5	178.5	-75.6	152.4	5.2	113.4	N177 E178 S179 R231	N177-R181 VanDerWaalsContact O-CB 3.29Å; N177-R181 WeakPolarHBondContact O-CB 3.26Å; N177-R181 VanDerWaalsContact O-CG 3.28Å; N177-R181 WeakPolarHBondContact O-CG 3.27Å; N177-R181 PolarHBondContact O-N 3.06Å; N177-R181 PolarHBondContact O-NE 2.89Å; E178-R181 IonicContact OE2-CZ 3.25Å; E178-R181 VanDerWaalsContact OE2-CZ 3.25Å; E178-R181 IonicContact OE2-NH1 2.82Å; E178-R181 PolarHBondContact OE2-NH1 2.67Å; E178-R181 IonicContact OE2-NH2 2.74Å; E178-R181 PolarHBondContact OE2-NH2 3.05Å; S179-R181 VanDerWaalsContact C-N 3.34Å; S179-R181 PolarHBondContact O-N 2.98Å; R181-R231 PolarHBondContact O-NH2 3.15Å
182	N	98.1	Very high	98.1	Very high	8 Å²	8	63.1 Å²	63.1	4%	0.043	33%	0.332	C	S	.	.	H	α-helix	trans	-111.2	-0.1	-176.1	-66.9	-75.9	0	0	0	114.2	E178 S179 S180 Q184 F185 L186 L200 R231 L235	E178-N182 WeakPolarHBondContact O-CB 3.32Å; E178-N182 PolarHBondContact O-N 3.02Å; E178-N182 VanDerWaalsContact O-N 3.16Å; E178-N182 PolarHBondContact O-ND2 2.91Å; E178-N182 PolarHBondContact OE1-ND2 3.45Å; S179-N182 CarbonylContact O-C 3.5Å; S179-N182 PolarHBondContact O-N 3Å; S180-N182 VanDerWaalsContact C-N 3.25Å; S180-N182 PolarHBondContact O-N 3.45Å; N182-Q184 PolarHBondContact O-N 3.11Å; N182-F185 WeakPolarHBondContact O-CA 3.41Å; N182-F185 WeakPolarHBondContact O-CB 3.33Å; N182-F185 PolarHBondContact O-N 3.17Å; N182-L186 HydrophobicContact CB-CD1 4.49Å; N182-L186 HydrophobicContact CB-CG 4.45Å; N182-L186 WeakPolarHBondContact O-CG 3.34Å; N182-L186 PolarHBondContact O-N 3.38Å; N182-L200 HydrophobicContact CB-CD2 4.41Å; N182-R231 VanDerWaalsContact OD1-CZ 3.3Å; N182-R231 PolarHBondContact OD1-NE 3.27Å; N182-R231 PolarHBondContact OD1-NH2 3.43Å; N182-L235 HydrophobicContact CB-CD1 4.33Å; N182-L235 HydrophobicContact CB-CD2 4.35Å
183	A	97.7	Very high	98	Very high	41 Å²	41	62.3 Å²	62.3	34%	0.339	33%	0.327	S	S	.	.	H	α-helix	trans	-50.7	-57.3	-177.2	0	0	0	0	0	112.9	S179 F185 L186 D187	S179-A183 PolarHBondContact O-N 2.98Å; A183-F185 PolarHBondContact O-N 3.31Å; A183-L186 PolarHBondContact O-N 2.58Å; A183-L186 VanDerWaalsContact O-N 3.13Å; A183-D187 VanDerWaalsContact O-CG 3.31Å; A183-D187 PolarHBondContact O-N 3.31Å
184	Q	97.9	Very high	98	Very high	170 Å²	170	59.1 Å²	59.1	79%	0.794	31%	0.312	S	S	*	.	H	α-helix	trans	-60.7	-31.8	179	-67.2	179.9	-6.5	0	0	113.4	N182 M188	N182-Q184 PolarHBondContact O-N 3.11Å; Q184-M188 PolarHBondContact O-N 3.01Å; Q184-M188 VanDerWaalsContact O-N 3.1Å
185	F	98.4	Very high	97.9	Very high	17 Å²	17	58.2 Å²	58.2	8%	0.075	31%	0.309	C	S	.	.	H	α-helix	trans	-72.1	-43.7	177.6	174.8	-102.6	0	0	0	111.1	N182 A183 D187 M188 V189 T228 R231 L232 L235	N182-F185 WeakPolarHBondContact O-CA 3.41Å; N182-F185 WeakPolarHBondContact O-CB 3.33Å; N182-F185 PolarHBondContact O-N 3.17Å; A183-F185 PolarHBondContact O-N 3.31Å; F185-D187 VanDerWaalsContact C-N 3.33Å; F185-M188 HydrophobicContact CD2-CE 3.61Å; F185-M188 HydrophobicContact CE2-CE 3.57Å; F185-M188 PolarHBondContact O-N 3.01Å; F185-V189 HydrophobicContact CD1-CG2 4.34Å; F185-V189 HydrophobicContact CD2-CG2 4.49Å; F185-V189 HydrophobicContact CE1-CG2 3.92Å; F185-V189 HydrophobicContact CE2-CG2 4.09Å; F185-V189 HydrophobicContact CZ-CG2 3.79Å; F185-V189 VanDerWaalsContact O-CG2 3.32Å; F185-V189 WeakPolarHBondContact O-CG2 3.19Å; F185-V189 PolarHBondContact O-N 3.11Å; F185-T228 HydrophobicContact CE2-CG2 4Å; F185-T228 HydrophobicContact CZ-CG2 4.05Å; F185-R231 HydrophobicContact CD1-CG 4.1Å; F185-R231 HydrophobicContact CD2-CG 4.46Å; F185-R231 HydrophobicContact CE1-CB 4.27Å; F185-R231 HydrophobicContact CE1-CG 3.81Å; F185-R231 HydrophobicContact CE2-CB 4.23Å; F185-R231 HydrophobicContact CE2-CG 4.19Å; F185-R231 HydrophobicContact CG-CG 4.41Å; F185-R231 HydrophobicContact CZ-CB 3.86Å; F185-R231 HydrophobicContact CZ-CG 3.85Å; F185-L232 HydrophobicContact CE1-CD2 3.94Å; F185-L232 HydrophobicContact CE1-CG 4.34Å; F185-L232 HydrophobicContact CZ-CD2 4.03Å; F185-L232 HydrophobicContact CZ-CG 4.01Å; F185-L235 HydrophobicContact CD1-CD1 3.85Å; F185-L235 HydrophobicContact CE1-CD1 3.82Å
186	L	98.2	Very high	97.7	Very high	12 Å²	12	64.5 Å²	64.5	6%	0.063	35%	0.349	C	S	.	.	H	α-helix	trans	-64	-39.1	175.2	-66.8	173.8	0	0	0	111.1	N182 A183 M188 V189 A190 L198 L200 V203 L235	N182-L186 HydrophobicContact CB-CD1 4.49Å; N182-L186 HydrophobicContact CB-CG 4.45Å; N182-L186 WeakPolarHBondContact O-CG 3.34Å; N182-L186 PolarHBondContact O-N 3.38Å; A183-L186 PolarHBondContact O-N 2.58Å; A183-L186 VanDerWaalsContact O-N 3.13Å; L186-M188 VanDerWaalsContact C-N 3.34Å; L186-M188 PolarHBondContact O-N 2.88Å; L186-V189 PolarHBondContact O-N 3.06Å; L186-A190 VanDerWaalsContact O-CB 3.26Å; L186-A190 WeakPolarHBondContact O-CB 3.16Å; L186-A190 PolarHBondContact O-N 2.97Å; L186-L198 HydrophobicContact CD2-CD2 4.16Å; L186-L198 HydrophobicContact CD2-CG 4.29Å; L186-L200 HydrophobicContact CD1-CD2 4.03Å; L186-L200 HydrophobicContact CD1-CG 4.36Å; L186-V203 HydrophobicContact CD2-CB 4.03Å; L186-V203 HydrophobicContact CD2-CG2 3.83Å; L186-L235 HydrophobicContact CD2-CD1 4.03Å
187	D	97.8	Very high	97.2	Very high	100 Å²	100	66 Å²	66	54%	0.535	36%	0.36	S	S	.	.	H	α-helix	trans	-60.9	-43.3	174.5	-67.6	-24.1	0	0	0	111.7	A183 F185 A190 N191	A183-D187 VanDerWaalsContact O-CG 3.31Å; A183-D187 PolarHBondContact O-N 3.31Å; F185-D187 VanDerWaalsContact C-N 3.33Å; D187-A190 PolarHBondContact O-N 3.35Å; D187-N191 WeakPolarHBondContact O-CB 3.45Å; D187-N191 VanDerWaalsContact O-CG 3.28Å; D187-N191 PolarHBondContact O-N 3.12Å; D187-N191 PolarHBondContact O-ND2 2.74Å
188	M	98	Very high	97	Very high	62 Å²	62	62.9 Å²	62.9	31%	0.305	34%	0.343	S	S	.	.	H	α-helix	trans	-61.4	-50	174.6	177.2	-82.1	-66.5	0	0	111	Q184 F185 L186 A190 N191 E192 W223	Q184-M188 PolarHBondContact O-N 3.01Å; Q184-M188 VanDerWaalsContact O-N 3.1Å; F185-M188 HydrophobicContact CD2-CE 3.61Å; F185-M188 HydrophobicContact CE2-CE 3.57Å; F185-M188 PolarHBondContact O-N 3.01Å; L186-M188 VanDerWaalsContact C-N 3.34Å; L186-M188 PolarHBondContact O-N 2.88Å; M188-A190 VanDerWaalsContact C-N 3.32Å; M188-A190 PolarHBondContact O-N 3.43Å; M188-N191 PolarHBondContact O-N 3.29Å; M188-E192 HydrophobicContact CG-CG 4.49Å; M188-E192 WeakPolarHBondContact O-CG 3.45Å; M188-E192 PolarHBondContact O-N 3.28Å; M188-E192 HydrophobicContact SD-CG 3.88Å; M188-W223 HydrophobicContact SD-CE3 4.48Å
189	V	98.4	Very high	96.9	Very high	0 Å²	0	63 Å²	63	0%	0	35%	0.347	C	S	.	.	H	α-helix	trans	-62.5	-40.6	179.8	177.4	0	0	0	0	110.9	F185 L186 N191 E192 T193 L198 V206 W223 L232	F185-V189 HydrophobicContact CD1-CG2 4.34Å; F185-V189 HydrophobicContact CD2-CG2 4.49Å; F185-V189 HydrophobicContact CE1-CG2 3.92Å; F185-V189 HydrophobicContact CE2-CG2 4.09Å; F185-V189 HydrophobicContact CZ-CG2 3.79Å; F185-V189 VanDerWaalsContact O-CG2 3.32Å; F185-V189 WeakPolarHBondContact O-CG2 3.19Å; F185-V189 PolarHBondContact O-N 3.11Å; L186-V189 PolarHBondContact O-N 3.06Å; V189-N191 VanDerWaalsContact C-N 3.34Å; V189-N191 PolarHBondContact O-N 3.38Å; V189-E192 PolarHBondContact O-N 3.41Å; V189-T193 HydrophobicContact CG1-CG2 3.86Å; V189-T193 VanDerWaalsContact O-CB 3.26Å; V189-T193 WeakPolarHBondContact O-CB 3.49Å; V189-T193 WeakPolarHBondContact O-CG2 3.29Å; V189-T193 PolarHBondContact O-N 3.05Å; V189-T193 PolarHBondContact O-OG1 3.14Å; V189-L198 HydrophobicContact CB-CD2 3.63Å; V189-L198 HydrophobicContact CG1-CD2 3.46Å; V189-L198 VanDerWaalsContact CG1-CD2 3.46Å; V189-V206 HydrophobicContact CG1-CB 4.43Å; V189-V206 HydrophobicContact CG1-CG1 3.89Å; V189-V206 HydrophobicContact CG1-CG2 4.21Å; V189-W223 HydrophobicContact CG1-CH2 4.3Å; V189-W223 HydrophobicContact CG1-CZ3 4.22Å; V189-W223 HydrophobicContact CG2-CZ3 4.27Å; V189-L232 HydrophobicContact CG1-CD2 4.43Å; V189-L232 HydrophobicContact CG2-CD2 4.28Å
190	A	98.1	Very high	96.9	Very high	17 Å²	17	61.1 Å²	61.1	14%	0.14	33%	0.334	C	S	.	.	H	α-helix	trans	-59	-45.1	175.6	0	0	0	0	0	111.5	L186 D187 M188 T193 G194 L195 L198	L186-A190 VanDerWaalsContact O-CB 3.26Å; L186-A190 WeakPolarHBondContact O-CB 3.16Å; L186-A190 PolarHBondContact O-N 2.97Å; D187-A190 PolarHBondContact O-N 3.35Å; M188-A190 VanDerWaalsContact C-N 3.32Å; M188-A190 PolarHBondContact O-N 3.43Å; A190-T193 PolarHBondContact O-N 3.01Å; A190-T193 PolarHBondContact O-OG1 2.85Å; A190-G194 WeakPolarHBondContact O-CA 3.38Å; A190-G194 PolarHBondContact O-N 3.19Å; A190-L195 WeakPolarHBondContact CB-O 3.4Å; A190-L195 PolarHBondContact O-N 3.11Å; A190-L198 HydrophobicContact CB-CB 4.13Å; A190-L198 HydrophobicContact CB-CD2 4.3Å
191	N	98.2	Very high	96.7	Very high	113 Å²	113	59 Å²	59	60%	0.604	31%	0.314	S	S	*	.	H	α-helix	trans	-63.8	-43.5	176.7	-73.6	-28.7	0	0	0	112.6	K53 D187 M188 V189	K53-N191 PolarHBondContact NZ-O 3.49Å; D187-N191 WeakPolarHBondContact O-CB 3.45Å; D187-N191 VanDerWaalsContact O-CG 3.28Å; D187-N191 PolarHBondContact O-N 3.12Å; D187-N191 PolarHBondContact O-ND2 2.74Å; M188-N191 PolarHBondContact O-N 3.29Å; V189-N191 VanDerWaalsContact C-N 3.34Å; V189-N191 PolarHBondContact O-N 3.38Å
192	E	98.1	Very high	96.5	Very high	84 Å²	84	53.8 Å²	53.8	39%	0.393	30%	0.299	S	S	.	.	H	α-helix	trans	-71.1	-31.9	-179.8	-68.5	-61.5	160.9	0	0	112.8	K53 M188 V189 W223	K53-E192 WeakPolarHBondContact CB-O 3.48Å; K53-E192 WeakPolarHBondContact CD-O 3.45Å; M188-E192 HydrophobicContact CG-CG 4.49Å; M188-E192 WeakPolarHBondContact O-CG 3.45Å; M188-E192 PolarHBondContact O-N 3.28Å; M188-E192 HydrophobicContact SD-CG 3.88Å; V189-E192 PolarHBondContact O-N 3.41Å; E192-W223 HydrophobicContact CB-CB 4.45Å; E192-W223 HydrophobicContact CB-CD2 3.73Å; E192-W223 HydrophobicContact CB-CE3 4.3Å; E192-W223 HydrophobicContact CB-CG 3.76Å; E192-W223 HydrophobicContact CB-CZ2 4.4Å; E192-W223 HydrophobicContact CG-CB 3.82Å; E192-W223 HydrophobicContact CG-CD2 4.05Å; E192-W223 HydrophobicContact CG-CG 3.68Å
193	T	98	Very high	96.5	Very high	0 Å²	0	53.4 Å²	53.4	0%	0	30%	0.297	C	S	.	.	H	α-helix	trans	-91.5	-22.1	-178.1	59.2	0	0	0	0	113.5	Y51 P52 K53 V189 A190 L195 V206 W223	Y51-T193 HydrophobicContact CD1-CG2 4.08Å; Y51-T193 HydrophobicContact CD2-CG2 3.72Å; Y51-T193 HydrophobicContact CE1-CG2 4.39Å; Y51-T193 HydrophobicContact CE2-CG2 4.02Å; Y51-T193 HydrophobicContact CG-CG2 3.76Å; P52-T193 WeakPolarHBondContact CD-O 3.39Å; K53-T193 WeakPolarHBondContact CB-O 3.39Å; K53-T193 PolarHBondContact N-O 3.31Å; V189-T193 HydrophobicContact CG1-CG2 3.86Å; V189-T193 VanDerWaalsContact O-CB 3.26Å; V189-T193 WeakPolarHBondContact O-CB 3.49Å; V189-T193 WeakPolarHBondContact O-CG2 3.29Å; V189-T193 PolarHBondContact O-N 3.05Å; V189-T193 PolarHBondContact O-OG1 3.14Å; A190-T193 PolarHBondContact O-N 3.01Å; A190-T193 PolarHBondContact O-OG1 2.85Å; T193-L195 VanDerWaalsContact C-N 3.33Å; T193-L195 WeakPolarHBondContact OG1-CG 3.19Å; T193-L195 PolarHBondContact OG1-N 2.86Å; T193-V206 HydrophobicContact CG2-CG1 3.83Å; T193-V206 HydrophobicContact CG2-CG2 4.06Å; T193-W223 HydrophobicContact CG2-CH2 3.75Å; T193-W223 HydrophobicContact CG2-CZ2 3.77Å
194	G	97.6	Very high	96.4	Very high	29 Å²	29	55.7 Å²	55.7	30%	0.299	30%	0.297	S	S	.	.	T	Hydrogen-bonded Turn	trans	78.4	14.1	-172.8	0	0	0	0	0	114	A190	A190-G194 WeakPolarHBondContact O-CA 3.38Å; A190-G194 PolarHBondContact O-N 3.19Å
195	L	96.4	Very high	96.3	Very high	53 Å²	53	48.6 Å²	48.6	28%	0.277	27%	0.265	S	S	.	.			trans	-81.1	135.5	177.3	-67.1	172.5	0	0	0	110.9	P52 A190 T193 L198 V206	P52-L195 HydrophobicContact CG-CD2 4.42Å; A190-L195 WeakPolarHBondContact CB-O 3.4Å; A190-L195 PolarHBondContact O-N 3.11Å; T193-L195 VanDerWaalsContact C-N 3.33Å; T193-L195 WeakPolarHBondContact OG1-CG 3.19Å; T193-L195 PolarHBondContact OG1-N 2.86Å; L195-L198 HydrophobicContact CB-CB 4.5Å; L195-L198 HydrophobicContact CD1-CD1 3.89Å; L195-V206 HydrophobicContact CD1-CG2 3.61Å
196	T	92.5	Very high	96.3	Very high	151 Å²	151	47.9 Å²	47.9	93%	0.926	26%	0.262	S	S	*	.	S	Bend	trans	-94.4	-17.2	-178.3	55.3	0	0	0	0	114.3
197	D	88.1	Confident	96.3	Very high	123 Å²	123	48.5 Å²	48.5	66%	0.658	26%	0.263	S	S	*	.	S	Bend	trans	-134.2	59.3	-176.8	-169.3	19.5	0	0	0	110.9	T202	D197-T202 PolarHBondContact O-OG1 3.12Å; D197-T202 VanDerWaalsContact O-OG1 3.13Å
198	L	94.8	Very high	96.3	Very high	22 Å²	22	44 Å²	44	12%	0.115	24%	0.24	C	C	.	.			trans	-87.2	116.2	177.3	-168.7	70	0	0	0	110.1	L186 V189 A190 L195 V203 V206	L186-L198 HydrophobicContact CD2-CD2 4.16Å; L186-L198 HydrophobicContact CD2-CG 4.29Å; V189-L198 HydrophobicContact CB-CD2 3.63Å; V189-L198 HydrophobicContact CG1-CD2 3.46Å; V189-L198 VanDerWaalsContact CG1-CD2 3.46Å; A190-L198 HydrophobicContact CB-CB 4.13Å; A190-L198 HydrophobicContact CB-CD2 4.3Å; L195-L198 HydrophobicContact CB-CB 4.5Å; L195-L198 HydrophobicContact CD1-CD1 3.89Å; L198-V203 HydrophobicContact CD1-CB 4.15Å; L198-V203 HydrophobicContact CD1-CG2 4.44Å; L198-V203 HydrophobicContact CG-CB 4.49Å; L198-V206 HydrophobicContact CD1-CG2 3.94Å
199	T	95.3	Very high	96.3	Very high	40 Å²	40	41.2 Å²	41.2	25%	0.245	23%	0.226	C	C	.	.			trans	-123.9	172.2	-179.4	69.3	0	0	0	0	110.3	E201 T202 V203	T199-E201 PolarHBondContact O-N 3.38Å; T199-E201 PolarHBondContact OG1-N 3.35Å; T199-T202 PolarHBondContact N-OG1 2.92Å; T199-T202 PolarHBondContact O-N 2.9Å; T199-T202 VanDerWaalsContact O-N 3.14Å; T199-T202 PolarHBondContact OG1-N 3.46Å; T199-T202 PolarHBondContact OG1-OG1 2.98Å; T199-V203 WeakPolarHBondContact O-CB 3.42Å; T199-V203 PolarHBondContact O-N 3.35Å
200	L	96.8	Very high	96.3	Very high	2 Å²	2	41.2 Å²	41.2	1%	0.01	23%	0.226	C	C	.	.	T	Hydrogen-bonded Turn	trans	-55.5	-22.1	170.3	-66.9	179.3	0	0	0	113.3	Y175 E178 N182 L186 L235 F238	Y175-L200 HydrophobicContact CD2-CD1 4.38Å; Y175-L200 HydrophobicContact CE1-CD1 4.36Å; Y175-L200 HydrophobicContact CE2-CB 4.4Å; Y175-L200 HydrophobicContact CE2-CD1 4.13Å; E178-L200 HydrophobicContact CB-CD1 4.07Å; E178-L200 HydrophobicContact CG-CD1 4.24Å; E178-L200 HydrophobicContact CG-CD2 4.39Å; N182-L200 HydrophobicContact CB-CD2 4.41Å; L186-L200 HydrophobicContact CD1-CD2 4.03Å; L186-L200 HydrophobicContact CD1-CG 4.36Å; L200-L235 HydrophobicContact CD2-CD1 4.49Å; L200-L235 HydrophobicContact CD2-CD2 3.88Å; L200-F238 HydrophobicContact CB-CD1 4.36Å; L200-F238 HydrophobicContact CB-CE1 4.4Å; L200-F238 HydrophobicContact CD1-CD1 4.25Å; L200-F238 HydrophobicContact CD1-CE1 3.76Å
201	E	94.1	Very high	96.3	Very high	40 Å²	40	42.9 Å²	42.9	19%	0.187	23%	0.23	C	C	.	.	T	Hydrogen-bonded Turn	trans	-94.5	-19.6	-176.8	-60.5	166.5	-139.5	0	0	112.9	R170 Y175 T199 W204 F242	R170-E201 IonicContact CZ-OE1 2.71Å; R170-E201 IonicContact CZ-OE2 3.66Å; R170-E201 IonicContact NE-OE1 3.8Å; R170-E201 PolarHBondContact NE-OE1 2.93Å; R170-E201 IonicContact NE-OE2 3.29Å; R170-E201 VanDerWaalsContact NH2-CD 3.31Å; R170-E201 IonicContact NH2-OE1 3.78Å; R170-E201 PolarHBondContact NH2-OE1 2.96Å; R170-E201 IonicContact NH2-OE2 3.38Å; R170-E201 PolarHBondContact NH2-OE2 3.28Å; Y175-E201 HydrophobicContact CE2-CG 4.44Å; Y175-E201 PolarHBondContact OH-OE1 3.04Å; T199-E201 PolarHBondContact O-N 3.38Å; T199-E201 PolarHBondContact OG1-N 3.35Å; E201-W204 PolarHBondContact O-NE1 3.47Å; E201-W204 VanDerWaalsContact O-NE1 3.12Å; E201-F242 HydrophobicContact CG-CD1 3.74Å; E201-F242 HydrophobicContact CG-CE1 3.58Å; E201-F242 HydrophobicContact CG-CE2 4.45Å; E201-F242 HydrophobicContact CG-CG 4.24Å; E201-F242 HydrophobicContact CG-CZ 3.96Å; E201-F242 WeakPolarHBondContact OE1-CZ 3.4Å; E201-F242 WeakPolarHBondContact OE2-CE1 3.26Å
202	T	94.9	Very high	96.3	Very high	45 Å²	45	37.5 Å²	37.5	28%	0.276	20%	0.201	S	C	.	.	T	Hydrogen-bonded Turn	trans	-109.8	-13.1	-178.7	61	0	0	0	0	112.9	D197 T199 W204 N205	D197-T202 PolarHBondContact O-OG1 3.12Å; D197-T202 VanDerWaalsContact O-OG1 3.13Å; T199-T202 PolarHBondContact N-OG1 2.92Å; T199-T202 PolarHBondContact O-N 2.9Å; T199-T202 VanDerWaalsContact O-N 3.14Å; T199-T202 PolarHBondContact OG1-N 3.46Å; T199-T202 PolarHBondContact OG1-OG1 2.98Å; T202-W204 PolarHBondContact O-N 3.19Å; T202-N205 WeakPolarHBondContact O-CB 3.46Å; T202-N205 PolarHBondContact O-N 3.37Å; T202-N205 PolarHBondContact O-ND2 3.04Å
203	V	96.6	Very high	96.3	Very high	0 Å²	0	33.5 Å²	33.5	0%	0	18%	0.183	C	C	.	.	T	Hydrogen-bonded Turn	trans	-62.1	-23.9	179.7	68.7	0	0	0	0	114.2	L186 L198 T199 N205 V206 Y207 L232 L235	L186-V203 HydrophobicContact CD2-CB 4.03Å; L186-V203 HydrophobicContact CD2-CG2 3.83Å; L198-V203 HydrophobicContact CD1-CB 4.15Å; L198-V203 HydrophobicContact CD1-CG2 4.44Å; L198-V203 HydrophobicContact CG-CB 4.49Å; T199-V203 WeakPolarHBondContact O-CB 3.42Å; T199-V203 PolarHBondContact O-N 3.35Å; V203-N205 PolarHBondContact O-N 3.26Å; V203-V206 PolarHBondContact O-N 3.23Å; V203-V206 VanDerWaalsContact O-N 3.12Å; V203-Y207 PolarHBondContact O-N 3.45Å; V203-L232 HydrophobicContact CG2-CD2 3.5Å; V203-L232 VanDerWaalsContact CG2-CD2 3.5Å; V203-L235 HydrophobicContact CG1-CB 3.67Å; V203-L235 HydrophobicContact CG1-CD1 4.37Å; V203-L235 HydrophobicContact CG2-CD1 4.37Å
204	W	95.7	Very high	96.3	Very high	90 Å²	90	38.5 Å²	38.5	34%	0.341	21%	0.206	S	C	.	.	H	α-helix	trans	-58.3	-28.6	173.4	71.7	-97.1	0	0	0	112.7	V48 E201 T202 V206 Y207 D208 K236	V48-W204 HydrophobicContact CG2-CH2 4.33Å; V48-W204 HydrophobicContact CG2-CZ3 4.15Å; E201-W204 PolarHBondContact O-NE1 3.47Å; E201-W204 VanDerWaalsContact O-NE1 3.12Å; T202-W204 PolarHBondContact O-N 3.19Å; W204-V206 VanDerWaalsContact C-N 3.32Å; W204-V206 PolarHBondContact O-N 3.39Å; W204-Y207 PolarHBondContact O-N 3.24Å; W204-D208 HydrophobicContact CE3-CB 4.25Å; W204-D208 HydrophobicContact CZ3-CB 4.44Å; W204-D208 WeakPolarHBondContact O-CB 3.41Å; W204-D208 PolarHBondContact O-N 2.91Å; W204-K236 HydrophobicContact CB-CB 3.97Å; W204-K236 HydrophobicContact CB-CG 3.62Å
205	N	95.8	Very high	96.2	Very high	21 Å²	21	40.5 Å²	40.5	11%	0.112	21%	0.212	C	C	.	.	H	α-helix	trans	-62.1	-43.1	178.1	-65.4	-68.8	0	0	0	110.7	K49 T202 V203 D208 T209	K49-N205 WeakPolarHBondContact CE-OD1 3.33Å; K49-N205 PolarHBondContact NZ-OD1 2.98Å; T202-N205 WeakPolarHBondContact O-CB 3.46Å; T202-N205 PolarHBondContact O-N 3.37Å; T202-N205 PolarHBondContact O-ND2 3.04Å; V203-N205 PolarHBondContact O-N 3.26Å; N205-D208 PolarHBondContact O-N 3.06Å; N205-T209 PolarHBondContact O-N 3.15Å; N205-T209 VanDerWaalsContact O-N 3.13Å; N205-T209 PolarHBondContact O-OG1 2.8Å
206	V	98.3	Very high	96.2	Very high	1 Å²	1	41.2 Å²	41.2	1%	0.006	21%	0.214	C	C	.	.	H	α-helix	trans	-66.1	-42.8	178.1	-178.9	0	0	0	0	110.5	Y51 V189 T193 L195 L198 V203 W204 L210 W223 L232	Y51-V206 HydrophobicContact CD1-CG1 4.41Å; Y51-V206 HydrophobicContact CE1-CG1 4.44Å; V189-V206 HydrophobicContact CG1-CB 4.43Å; V189-V206 HydrophobicContact CG1-CG1 3.89Å; V189-V206 HydrophobicContact CG1-CG2 4.21Å; T193-V206 HydrophobicContact CG2-CG1 3.83Å; T193-V206 HydrophobicContact CG2-CG2 4.06Å; L195-V206 HydrophobicContact CD1-CG2 3.61Å; L198-V206 HydrophobicContact CD1-CG2 3.94Å; V203-V206 PolarHBondContact O-N 3.23Å; V203-V206 VanDerWaalsContact O-N 3.12Å; W204-V206 VanDerWaalsContact C-N 3.32Å; W204-V206 PolarHBondContact O-N 3.39Å; V206-L210 HydrophobicContact CG1-CD1 3.99Å; V206-L210 WeakPolarHBondContact O-CG 3.48Å; V206-L210 PolarHBondContact O-N 2.76Å; V206-W223 HydrophobicContact CG1-CH2 3.7Å; V206-W223 HydrophobicContact CG1-CZ3 4.49Å; V206-L232 HydrophobicContact CG1-CD1 4.2Å; V206-L232 HydrophobicContact CG1-CD2 4.45Å
207	Y	98.3	Very high	96.4	Very high	26 Å²	26	36.9 Å²	36.9	10%	0.102	20%	0.199	C	C	.	.	H	α-helix	trans	-60.6	-46.6	175.1	178.5	-104	0	0	0	112.1	V203 W204 T209 L210 F211 M229 L232 S233 K236	V203-Y207 PolarHBondContact O-N 3.45Å; W204-Y207 PolarHBondContact O-N 3.24Å; Y207-T209 PolarHBondContact O-N 2.79Å; Y207-L210 PolarHBondContact O-N 2.81Å; Y207-F211 HydrophobicContact CE1-CB 4.25Å; Y207-F211 HydrophobicContact CE1-CG 4.41Å; Y207-F211 WeakPolarHBondContact O-CB 3.28Å; Y207-F211 PolarHBondContact O-N 3.13Å; Y207-M229 HydrophobicContact CD2-CE 4.34Å; Y207-M229 HydrophobicContact CE2-CE 4.25Å; Y207-L232 HydrophobicContact CD2-CB 3.77Å; Y207-L232 HydrophobicContact CG-CB 4.34Å; Y207-S233 PolarHBondContact OH-OG 3.49Å; Y207-S233 VanDerWaalsContact OH-OG 3.12Å; Y207-K236 HydrophobicContact CD1-CB 4.04Å; Y207-K236 HydrophobicContact CD1-CD 4.26Å; Y207-K236 HydrophobicContact CD1-CG 3.85Å; Y207-K236 HydrophobicContact CE1-CD 4.37Å; Y207-K236 VanDerWaalsContact CE1-CE 3.49Å; Y207-K236 HydrophobicContact CE1-CG 4.44Å; Y207-K236 HydrophobicContact CG-CB 4.27Å
208	D	98	Very high	96.8	Very high	6 Å²	6	33.5 Å²	33.5	3%	0.032	18%	0.181	C	C	.	.	H	α-helix	trans	-59.2	-47.1	-178.4	-171.8	75.8	0	0	0	111.7	R45 W204 N205 F211 C212	R45-D208 IonicContact CZ-OD1 3.43Å; R45-D208 IonicContact CZ-OD2 3.29Å; R45-D208 IonicContact NH1-OD1 2.81Å; R45-D208 PolarHBondContact NH1-OD1 3.26Å; R45-D208 IonicContact NH1-OD2 3.21Å; R45-D208 PolarHBondContact NH1-OD2 3.02Å; R45-D208 IonicContact NH2-OD1 2.64Å; R45-D208 PolarHBondContact NH2-OD1 3.47Å; R45-D208 IonicContact NH2-OD2 3.06Å; R45-D208 PolarHBondContact NH2-OD2 3.18Å; W204-D208 HydrophobicContact CE3-CB 4.25Å; W204-D208 HydrophobicContact CZ3-CB 4.44Å; W204-D208 WeakPolarHBondContact O-CB 3.41Å; W204-D208 PolarHBondContact O-N 2.91Å; N205-D208 PolarHBondContact O-N 3.06Å; D208-F211 PolarHBondContact O-N 2.65Å; D208-C212 WeakPolarHBondContact O-CB 3.5Å; D208-C212 PolarHBondContact O-N 3.21Å; D208-C212 PolarHBondContact O-SG 2.87Å
209	T	98.2	Very high	96.9	Very high	2 Å²	2	40 Å²	40	1%	0.012	21%	0.21	C	C	.	.	H	α-helix	trans	-55.1	-59.9	175.6	-61.1	0	0	0	0	111.5	K49 T50 Y51 N205 Y207 F211 C212 E213	K49-T209 PolarHBondContact O-OG1 3.26Å; T50-T209 WeakPolarHBondContact OG1-CG2 3.49Å; Y51-T209 HydrophobicContact CD1-CG2 3.99Å; Y51-T209 HydrophobicContact CE1-CG2 3.69Å; N205-T209 PolarHBondContact O-N 3.15Å; N205-T209 VanDerWaalsContact O-N 3.13Å; N205-T209 PolarHBondContact O-OG1 2.8Å; Y207-T209 PolarHBondContact O-N 2.79Å; T209-F211 VanDerWaalsContact C-N 3.29Å; T209-F211 PolarHBondContact O-N 3.12Å; T209-C212 PolarHBondContact O-N 2.9Å; T209-E213 WeakPolarHBondContact CG2-OE1 3.37Å; T209-E213 WeakPolarHBondContact O-CG 3.35Å; T209-E213 PolarHBondContact O-N 2.65Å
210	L	98.6	Very high	97.1	Very high	0 Å²	0	40 Å²	40	0%	0	21%	0.209	C	C	.	.	H	α-helix	trans	-64	-34.9	-177.7	-65.8	170.2	0	0	0	112.4	Y51 V206 Y207 Q214 L220 P221 W223 A224 M229 L232	Y51-L210 HydrophobicContact CE1-CD2 4.29Å; Y51-L210 HydrophobicContact CE1-CG 4.36Å; Y51-L210 WeakPolarHBondContact OH-CD2 3.44Å; V206-L210 HydrophobicContact CG1-CD1 3.99Å; V206-L210 WeakPolarHBondContact O-CG 3.48Å; V206-L210 PolarHBondContact O-N 2.76Å; Y207-L210 PolarHBondContact O-N 2.81Å; L210-Q214 VanDerWaalsContact O-CB 3.22Å; L210-Q214 WeakPolarHBondContact O-CB 3.19Å; L210-Q214 PolarHBondContact O-N 3.19Å; L210-L220 HydrophobicContact CB-CD2 4.38Å; L210-L220 HydrophobicContact CD2-CD2 4.04Å; L210-L220 WeakPolarHBondContact O-CD2 3.45Å; L210-P221 HydrophobicContact CD2-CG 4.2Å; L210-W223 HydrophobicContact CD1-CH2 3.58Å; L210-W223 HydrophobicContact CD1-CZ2 4.2Å; L210-W223 HydrophobicContact CD1-CZ3 4.09Å; L210-W223 HydrophobicContact CD2-CZ2 4.46Å; L210-A224 HydrophobicContact CD1-CB 3.89Å; L210-A224 HydrophobicContact CD2-CB 3.95Å; L210-M229 HydrophobicContact CB-CE 3.67Å; L210-M229 HydrophobicContact CB-SD 3.57Å; L210-M229 VanDerWaalsContact CB-SD 3.57Å; L210-M229 HydrophobicContact CD1-SD 3.67Å; L210-M229 HydrophobicContact CG-SD 4.26Å; L210-L232 HydrophobicContact CD1-CD1 3.67Å
211	F	98	Very high	97.1	Very high	53 Å²	53	41 Å²	41	23%	0.232	22%	0.215	C	C	.	.	H	α-helix	trans	-64.6	-46.1	176.7	172.7	-99.4	0	0	0	110.9	Y207 D208 T209 Q214 T215 Y307	Y207-F211 HydrophobicContact CE1-CB 4.25Å; Y207-F211 HydrophobicContact CE1-CG 4.41Å; Y207-F211 WeakPolarHBondContact O-CB 3.28Å; Y207-F211 PolarHBondContact O-N 3.13Å; D208-F211 PolarHBondContact O-N 2.65Å; T209-F211 VanDerWaalsContact C-N 3.29Å; T209-F211 PolarHBondContact O-N 3.12Å; F211-Q214 PolarHBondContact O-N 3.31Å; F211-T215 WeakPolarHBondContact O-CB 3.17Å; F211-T215 PolarHBondContact O-N 3.4Å; F211-T215 PolarHBondContact O-OG1 2.88Å; F211-Y307 HydrophobicContact CE1-CD2 4.42Å; F211-Y307 AromaticContact CE1-CE2 3.65Å; F211-Y307 HydrophobicContact CE1-CE2 3.65Å; F211-Y307 HydrophobicContact CZ-CE2 4.43Å
212	C	98.3	Very high	97.2	Very high	0 Å²	0	45.5 Å²	45.5	0%	0	25%	0.248	C	C	.	.	H	α-helix	trans	-64	-46.3	177.6	-65.3	0	0	0	0	111	P47 W61 D208 T209 Q214 T215 H216	P47-C212 HydrophobicContact CG-CB 3.72Å; W61-C212 HydrophobicContact CH2-CB 4.04Å; D208-C212 WeakPolarHBondContact O-CB 3.5Å; D208-C212 PolarHBondContact O-N 3.21Å; D208-C212 PolarHBondContact O-SG 2.87Å; T209-C212 PolarHBondContact O-N 2.9Å; C212-Q214 PolarHBondContact O-N 2.98Å; C212-T215 PolarHBondContact O-N 3.42Å; C212-H216 PolarHBondContact O-N 2.88Å; C212-H216 PolarHBondContact O-ND1 2.96Å
213	E	98.3	Very high	97.4	Very high	0 Å²	0	44.9 Å²	44.9	0%	0	24%	0.241	C	C	.	.	H	α-helix	trans	-55.1	-49.1	175.2	-74.1	165.9	-161	0	0	112	Y56 W61 T209 T215 H216 G217 L218 L220	Y56-E213 HydrophobicContact CD2-CG 4.02Å; W61-E213 HydrophobicContact CZ2-CG 4.02Å; T209-E213 WeakPolarHBondContact CG2-OE1 3.37Å; T209-E213 WeakPolarHBondContact O-CG 3.35Å; T209-E213 PolarHBondContact O-N 2.65Å; E213-T215 PolarHBondContact O-N 2.76Å; E213-H216 CarbonylContact O-C 3.6Å; E213-H216 PolarHBondContact O-N 2.91Å; E213-H216 VanDerWaalsContact O-N 3.13Å; E213-G217 PolarHBondContact O-N 2.74Å; E213-G217 VanDerWaalsContact O-N 3.17Å; E213-L218 HydrophobicContact CB-CB 4.02Å; E213-L218 HydrophobicContact CB-CD1 4.29Å; E213-L218 HydrophobicContact CG-CD1 4.03Å; E213-L218 WeakPolarHBondContact O-CB 3.49Å; E213-L218 PolarHBondContact O-N 2.04Å; E213-L220 HydrophobicContact CB-CD2 3.7Å; E213-L220 WeakPolarHBondContact OE2-CD2 3.46Å
214	Q	97.3	Very high	97.4	Very high	104 Å²	104	45.3 Å²	45.3	49%	0.486	24%	0.244	S	C	.	.	H	α-helix	trans	-60.8	-45.4	179	-173.8	174.1	34.5	0	0	111.8	L210 F211 C212 H216 G217 L220	L210-Q214 VanDerWaalsContact O-CB 3.22Å; L210-Q214 WeakPolarHBondContact O-CB 3.19Å; L210-Q214 PolarHBondContact O-N 3.19Å; F211-Q214 PolarHBondContact O-N 3.31Å; C212-Q214 PolarHBondContact O-N 2.98Å; Q214-H216 PolarHBondContact O-N 2.54Å; Q214-G217 PolarHBondContact O-N 2.93Å; Q214-G217 VanDerWaalsContact O-N 3.09Å; Q214-L220 HydrophobicContact CB-CD1 4.13Å; Q214-L220 HydrophobicContact CB-CD2 4.22Å; Q214-L220 HydrophobicContact CB-CG 4.38Å; Q214-L220 HydrophobicContact CG-CD1 4.43Å
215	T	96.3	Very high	97.5	Very high	71 Å²	71	43 Å²	43	44%	0.436	24%	0.241	S	C	.	.	H	α-helix	trans	-60.8	-30.8	177.5	-66.3	0	0	0	0	111.9	F211 C212 E213 G217	F211-T215 WeakPolarHBondContact O-CB 3.17Å; F211-T215 PolarHBondContact O-N 3.4Å; F211-T215 PolarHBondContact O-OG1 2.88Å; C212-T215 PolarHBondContact O-N 3.42Å; E213-T215 PolarHBondContact O-N 2.76Å; T215-G217 VanDerWaalsContact C-N 3.35Å
216	H	97.3	Very high	97.6	Very high	69 Å²	69	47.4 Å²	47.4	32%	0.319	27%	0.271	S	S	.	.	T	Hydrogen-bonded Turn	trans	-93.5	10.3	178.8	-67.9	77.9	0	0	0	113.6	D44 W61 T69 C212 E213 Q214 L218	D44-H216 IonicContact OD1-CE1 3.21Å; D44-H216 PolarHBondContact OD1-CE1 3.44Å; D44-H216 IonicContact OD1-NE2 3.93Å; D44-H216 PolarHBondContact OD1-NE2 3.36Å; D44-H216 IonicContact OD2-CE1 2.76Å; W61-H216 HydrophobicContact CH2-CB 4.17Å; W61-H216 AromaticContact CH2-CG 3.97Å; W61-H216 AromaticContact CH2-ND1 3.87Å; W61-H216 HydrophobicContact CZ3-CB 4.23Å; W61-H216 AromaticContact CZ3-CD2 3.96Å; W61-H216 AromaticContact CZ3-CE1 3.99Å; W61-H216 AromaticContact CZ3-CG 3.69Å; W61-H216 AromaticContact CZ3-ND1 3.71Å; T69-H216 VanDerWaalsContact CG2-NE2 3.33Å; T69-H216 WeakPolarHBondContact CG2-NE2 3.37Å; C212-H216 PolarHBondContact O-N 2.88Å; C212-H216 PolarHBondContact O-ND1 2.96Å; E213-H216 CarbonylContact O-C 3.6Å; E213-H216 PolarHBondContact O-N 2.91Å; E213-H216 VanDerWaalsContact O-N 3.13Å; Q214-H216 PolarHBondContact O-N 2.54Å; H216-L218 VanDerWaalsContact C-N 3.28Å; H216-L218 PolarHBondContact O-N 3.01Å
217	G	96.7	Very high	97.6	Very high	60 Å²	60	54.9 Å²	54.9	62%	0.619	31%	0.306	S	S	*	.	T	Hydrogen-bonded Turn	trans	72.2	17.8	175.6	0	0	0	0	0	114.5	E213 Q214 T215	E213-G217 PolarHBondContact O-N 2.74Å; E213-G217 VanDerWaalsContact O-N 3.17Å; Q214-G217 PolarHBondContact O-N 2.93Å; Q214-G217 VanDerWaalsContact O-N 3.09Å; T215-G217 VanDerWaalsContact C-N 3.35Å
218	L	96.6	Very high	97.6	Very high	52 Å²	52	54.4 Å²	54.4	27%	0.272	31%	0.306	S	S	.	.			trans	-74.9	150.7	172.5	-60.5	-178.4	0	0	0	110.6	Y56 W61 E213 H216 L220	Y56-L218 HydrophobicContact CD1-CD1 4.07Å; Y56-L218 HydrophobicContact CD2-CB 4.38Å; Y56-L218 HydrophobicContact CD2-CD1 4.16Å; Y56-L218 HydrophobicContact CE1-CD1 4.41Å; Y56-L218 HydrophobicContact CE1-CD2 4.34Å; Y56-L218 HydrophobicContact CE2-CB 3.94Å; Y56-L218 HydrophobicContact CE2-CD1 4.47Å; Y56-L218 HydrophobicContact CG-CD1 3.94Å; W61-L218 HydrophobicContact CH2-CD1 4.39Å; W61-L218 HydrophobicContact CZ2-CD1 4.03Å; E213-L218 HydrophobicContact CB-CB 4.02Å; E213-L218 HydrophobicContact CB-CD1 4.29Å; E213-L218 HydrophobicContact CG-CD1 4.03Å; E213-L218 WeakPolarHBondContact O-CB 3.49Å; E213-L218 PolarHBondContact O-N 2.04Å; H216-L218 VanDerWaalsContact C-N 3.28Å; H216-L218 PolarHBondContact O-N 3.01Å; L218-L220 PolarHBondContact O-N 3.24Å
219	H	96.8	Very high	97.6	Very high	157 Å²	157	54.7 Å²	54.7	73%	0.727	31%	0.307	S	S	*	.			trans	-82.7	110.6	-177.4	-69.3	86.9	0	0	0	109.6	Y56	Y56-H219 WeakPolarHBondContact CE2-O 3.4Å; Y56-H219 PolarHBondContact OH-N 3.28Å; Y56-H219 PolarHBondContact OH-O 3.11Å; Y56-H219 VanDerWaalsContact OH-O 3.12Å
220	L	97.9	Very high	97.6	Very high	40 Å²	40	59.9 Å²	59.9	21%	0.209	33%	0.331	C	S	.	.			trans	-64.6	148.5	176.6	-57.5	-170	0	0	0	111.4	L210 E213 Q214 L218 A224 M229	L210-L220 HydrophobicContact CB-CD2 4.38Å; L210-L220 HydrophobicContact CD2-CD2 4.04Å; L210-L220 WeakPolarHBondContact O-CD2 3.45Å; E213-L220 HydrophobicContact CB-CD2 3.7Å; E213-L220 WeakPolarHBondContact OE2-CD2 3.46Å; Q214-L220 HydrophobicContact CB-CD1 4.13Å; Q214-L220 HydrophobicContact CB-CD2 4.22Å; Q214-L220 HydrophobicContact CB-CG 4.38Å; Q214-L220 HydrophobicContact CG-CD1 4.43Å; L218-L220 PolarHBondContact O-N 3.24Å; L220-A224 HydrophobicContact CB-CB 4.04Å; L220-A224 HydrophobicContact CD1-CB 4.25Å; L220-M229 HydrophobicContact CD1-CE 4.4Å; L220-M229 HydrophobicContact CD1-CG 4.15Å; L220-M229 HydrophobicContact CD1-SD 4.15Å
221	P	97.3	Very high	97.6	Very high	23 Å²	23	64.1 Å²	64.1	15%	0.149	35%	0.347	C	S	.	.			trans	-62.5	153.1	175.3	27.2	-36.1	0	0	0	111.5	L210 W223 A224	L210-P221 HydrophobicContact CD2-CG 4.2Å; P221-W223 HydrophobicContact CG-CD2 4.46Å; P221-W223 HydrophobicContact CG-CZ2 4.1Å; P221-W223 PolarHBondContact O-N 2.94Å; P221-A224 HydrophobicContact CG-CB 4.08Å; P221-A224 WeakPolarHBondContact O-CB 3.3Å; P221-A224 PolarHBondContact O-N 3.23Å
222	P	97.1	Very high	97.6	Very high	135 Å²	135	61.6 Å²	61.6	88%	0.877	34%	0.336	S	S	*	.	T	Hydrogen-bonded Turn	trans	-56	-28.8	-172.4	-28.7	35.6	0	0	0	115.8	A224	P222-A224 VanDerWaalsContact C-N 3.31Å
223	W	97.7	Very high	97.6	Very high	33 Å²	33	62.9 Å²	62.9	13%	0.125	35%	0.345	C	S	.	.	T	Hydrogen-bonded Turn	trans	-72.1	-24.4	178.5	67.2	-99.5	0	0	0	112.9	Y51 M188 V189 E192 T193 V206 L210 P221 S225 T228 L232	Y51-W223 HydrophobicContact CE2-CZ2 4.24Å; Y51-W223 AromaticContact CZ-CZ2 3.91Å; M188-W223 HydrophobicContact SD-CE3 4.48Å; V189-W223 HydrophobicContact CG1-CH2 4.3Å; V189-W223 HydrophobicContact CG1-CZ3 4.22Å; V189-W223 HydrophobicContact CG2-CZ3 4.27Å; E192-W223 HydrophobicContact CB-CB 4.45Å; E192-W223 HydrophobicContact CB-CD2 3.73Å; E192-W223 HydrophobicContact CB-CE3 4.3Å; E192-W223 HydrophobicContact CB-CG 3.76Å; E192-W223 HydrophobicContact CB-CZ2 4.4Å; E192-W223 HydrophobicContact CG-CB 3.82Å; E192-W223 HydrophobicContact CG-CD2 4.05Å; E192-W223 HydrophobicContact CG-CG 3.68Å; T193-W223 HydrophobicContact CG2-CH2 3.75Å; T193-W223 HydrophobicContact CG2-CZ2 3.77Å; V206-W223 HydrophobicContact CG1-CH2 3.7Å; V206-W223 HydrophobicContact CG1-CZ3 4.49Å; L210-W223 HydrophobicContact CD1-CH2 3.58Å; L210-W223 HydrophobicContact CD1-CZ2 4.2Å; L210-W223 HydrophobicContact CD1-CZ3 4.09Å; L210-W223 HydrophobicContact CD2-CZ2 4.46Å; P221-W223 HydrophobicContact CG-CD2 4.46Å; P221-W223 HydrophobicContact CG-CZ2 4.1Å; P221-W223 PolarHBondContact O-N 2.94Å; W223-S225 PolarHBondContact O-N 3.19Å; W223-T228 HydrophobicContact CE3-CG2 3.92Å; W223-T228 HydrophobicContact CZ3-CG2 3.95Å; W223-T228 WeakPolarHBondContact O-CB 3.39Å; W223-T228 WeakPolarHBondContact O-CG2 3.26Å; W223-T228 PolarHBondContact O-OG1 2.98Å; W223-L232 HydrophobicContact CZ3-CD1 4.37Å
224	A	97.9	Very high	97.6	Very high	8 Å²	8	70.1 Å²	70.1	7%	0.066	37%	0.373	C	S	.	.			trans	-82.2	49.8	178.7	0	0	0	0	0	111.9	L210 L220 P221 P222	L210-A224 HydrophobicContact CD1-CB 3.89Å; L210-A224 HydrophobicContact CD2-CB 3.95Å; L220-A224 HydrophobicContact CB-CB 4.04Å; L220-A224 HydrophobicContact CD1-CB 4.25Å; P221-A224 HydrophobicContact CG-CB 4.08Å; P221-A224 WeakPolarHBondContact O-CB 3.3Å; P221-A224 PolarHBondContact O-N 3.23Å; P222-A224 VanDerWaalsContact C-N 3.31Å
225	S	97.8	Very high	97.7	Very high	41 Å²	41	65.3 Å²	65.3	29%	0.287	35%	0.35	S	S	.	.			trans	-58.6	162.6	175	77.3	0	0	0	0	112.2	W223 Q227 T228 M229	W223-S225 PolarHBondContact O-N 3.19Å; S225-Q227 PolarHBondContact O-N 3.2Å; S225-Q227 VanDerWaalsContact O-N 3.11Å; S225-Q227 PolarHBondContact OG-N 3.01Å; S225-T228 WeakPolarHBondContact O-CA 3.47Å; S225-T228 WeakPolarHBondContact O-CB 3.12Å; S225-T228 PolarHBondContact O-N 2.91Å; S225-T228 PolarHBondContact OG-N 2.88Å; S225-T228 VanDerWaalsContact OG-N 3.17Å; S225-T228 PolarHBondContact OG-OG1 2.95Å; S225-M229 PolarHBondContact O-N 3.44Å
226	P	97.8	Very high	97.7	Very high	114 Å²	114	62.1 Å²	62.1	74%	0.74	33%	0.33	S	S	*	.	H	α-helix	trans	-53.9	-33.9	174.5	-28.3	35.9	0	0	0	114.1	Q230	P226-Q230 WeakPolarHBondContact O-CB 3.39Å; P226-Q230 PolarHBondContact O-N 2.73Å
227	Q	97.9	Very high	97.8	Very high	159 Å²	159	60 Å²	60	74%	0.743	32%	0.321	S	S	*	.	H	α-helix	trans	-71.4	-40.7	176.8	-64.8	172.3	7.3	0	0	111.5	S225 Q230 R231	S225-Q227 PolarHBondContact O-N 3.2Å; S225-Q227 VanDerWaalsContact O-N 3.11Å; S225-Q227 PolarHBondContact OG-N 3.01Å; Q227-Q230 PolarHBondContact O-N 3.28Å; Q227-R231 PolarHBondContact O-N 2.72Å
228	T	98.3	Very high	97.8	Very high	15 Å²	15	57.9 Å²	57.9	9%	0.092	30%	0.295	C	S	.	.	H	α-helix	trans	-60.3	-49	172.9	-54.6	0	0	0	0	110.3	F185 W223 S225 Q230 R231 L232	F185-T228 HydrophobicContact CE2-CG2 4Å; F185-T228 HydrophobicContact CZ-CG2 4.05Å; W223-T228 HydrophobicContact CE3-CG2 3.92Å; W223-T228 HydrophobicContact CZ3-CG2 3.95Å; W223-T228 WeakPolarHBondContact O-CB 3.39Å; W223-T228 WeakPolarHBondContact O-CG2 3.26Å; W223-T228 PolarHBondContact O-OG1 2.98Å; S225-T228 WeakPolarHBondContact O-CA 3.47Å; S225-T228 WeakPolarHBondContact O-CB 3.12Å; S225-T228 PolarHBondContact O-N 2.91Å; S225-T228 PolarHBondContact OG-N 2.88Å; S225-T228 VanDerWaalsContact OG-N 3.17Å; S225-T228 PolarHBondContact OG-OG1 2.95Å; T228-Q230 PolarHBondContact O-N 3.39Å; T228-R231 PolarHBondContact O-N 2.97Å; T228-R231 VanDerWaalsContact O-N 3.12Å; T228-L232 HydrophobicContact CG2-CD1 4.11Å; T228-L232 HydrophobicContact CG2-CG 4.38Å; T228-L232 WeakPolarHBondContact O-CG 3.32Å; T228-L232 PolarHBondContact O-N 3.48Å
229	M	98.3	Very high	97.9	Very high	12 Å²	12	55.8 Å²	55.8	6%	0.059	29%	0.285	C	S	.	.	H	α-helix	trans	-60.1	-43.3	178.5	-73	-58.9	-73.2	0	0	112.3	Y207 L210 L220 S225 R231 L232 S233	Y207-M229 HydrophobicContact CD2-CE 4.34Å; Y207-M229 HydrophobicContact CE2-CE 4.25Å; L210-M229 HydrophobicContact CB-CE 3.67Å; L210-M229 HydrophobicContact CB-SD 3.57Å; L210-M229 VanDerWaalsContact CB-SD 3.57Å; L210-M229 HydrophobicContact CD1-SD 3.67Å; L210-M229 HydrophobicContact CG-SD 4.26Å; L220-M229 HydrophobicContact CD1-CE 4.4Å; L220-M229 HydrophobicContact CD1-CG 4.15Å; L220-M229 HydrophobicContact CD1-SD 4.15Å; S225-M229 PolarHBondContact O-N 3.44Å; M229-R231 VanDerWaalsContact C-N 3.32Å; M229-R231 PolarHBondContact O-N 3.08Å; M229-L232 PolarHBondContact O-N 3.12Å; M229-L232 HydrophobicContact SD-CD1 4.23Å; M229-S233 WeakPolarHBondContact O-CB 3.34Å; M229-S233 PolarHBondContact O-N 3.23Å
230	Q	98.1	Very high	97.9	Very high	111 Å²	111	48.9 Å²	48.9	52%	0.519	25%	0.252	S	S	.	.	H	α-helix	trans	-61.4	-41.5	175	-174.3	-179.3	56	0	0	111.8	P226 Q227 T228 S233 R234	P226-Q230 WeakPolarHBondContact O-CB 3.39Å; P226-Q230 PolarHBondContact O-N 2.73Å; Q227-Q230 PolarHBondContact O-N 3.28Å; T228-Q230 PolarHBondContact O-N 3.39Å; Q230-S233 WeakPolarHBondContact O-CB 3.46Å; Q230-S233 PolarHBondContact O-N 2.65Å; Q230-R234 WeakPolarHBondContact O-CG 3.29Å; Q230-R234 PolarHBondContact O-N 2.91Å; Q230-R234 VanDerWaalsContact O-N 3.1Å
231	R	98.3	Very high	97.9	Very high	89 Å²	89	52 Å²	52	34%	0.336	26%	0.262	S	S	.	.	H	α-helix	trans	-68.4	-44	178.8	-169.5	168.1	-177	172.3	3.2	111.8	R181 N182 F185 Q227 T228 M229 S233 R234 L235	R181-R231 PolarHBondContact O-NH2 3.15Å; N182-R231 VanDerWaalsContact OD1-CZ 3.3Å; N182-R231 PolarHBondContact OD1-NE 3.27Å; N182-R231 PolarHBondContact OD1-NH2 3.43Å; F185-R231 HydrophobicContact CD1-CG 4.1Å; F185-R231 HydrophobicContact CD2-CG 4.46Å; F185-R231 HydrophobicContact CE1-CB 4.27Å; F185-R231 HydrophobicContact CE1-CG 3.81Å; F185-R231 HydrophobicContact CE2-CB 4.23Å; F185-R231 HydrophobicContact CE2-CG 4.19Å; F185-R231 HydrophobicContact CG-CG 4.41Å; F185-R231 HydrophobicContact CZ-CB 3.86Å; F185-R231 HydrophobicContact CZ-CG 3.85Å; Q227-R231 PolarHBondContact O-N 2.72Å; T228-R231 PolarHBondContact O-N 2.97Å; T228-R231 VanDerWaalsContact O-N 3.12Å; M229-R231 VanDerWaalsContact C-N 3.32Å; M229-R231 PolarHBondContact O-N 3.08Å; R231-S233 VanDerWaalsContact C-N 3.29Å; R231-S233 PolarHBondContact O-N 2.78Å; R231-R234 PolarHBondContact O-N 2.74Å; R231-L235 WeakPolarHBondContact O-CG 3.42Å; R231-L235 PolarHBondContact O-N 3.35Å
232	L	98.6	Very high	97.9	Very high	0 Å²	0	51 Å²	51	0%	0	26%	0.255	C	S	.	.	H	α-helix	trans	-56.9	-43.7	172.7	-74.2	174.8	0	0	0	111.4	F185 V189 V203 V206 Y207 L210 W223 T228 M229 R234 L235 K236	F185-L232 HydrophobicContact CE1-CD2 3.94Å; F185-L232 HydrophobicContact CE1-CG 4.34Å; F185-L232 HydrophobicContact CZ-CD2 4.03Å; F185-L232 HydrophobicContact CZ-CG 4.01Å; V189-L232 HydrophobicContact CG1-CD2 4.43Å; V189-L232 HydrophobicContact CG2-CD2 4.28Å; V203-L232 HydrophobicContact CG2-CD2 3.5Å; V203-L232 VanDerWaalsContact CG2-CD2 3.5Å; V206-L232 HydrophobicContact CG1-CD1 4.2Å; V206-L232 HydrophobicContact CG1-CD2 4.45Å; Y207-L232 HydrophobicContact CD2-CB 3.77Å; Y207-L232 HydrophobicContact CG-CB 4.34Å; L210-L232 HydrophobicContact CD1-CD1 3.67Å; W223-L232 HydrophobicContact CZ3-CD1 4.37Å; T228-L232 HydrophobicContact CG2-CD1 4.11Å; T228-L232 HydrophobicContact CG2-CG 4.38Å; T228-L232 WeakPolarHBondContact O-CG 3.32Å; T228-L232 PolarHBondContact O-N 3.48Å; M229-L232 PolarHBondContact O-N 3.12Å; M229-L232 HydrophobicContact SD-CD1 4.23Å; L232-R234 PolarHBondContact O-N 2.64Å; L232-L235 PolarHBondContact O-N 2.8Å; L232-K236 WeakPolarHBondContact O-CB 3.5Å; L232-K236 PolarHBondContact O-N 3.41Å
233	S	98.1	Very high	98	Very high	27 Å²	27	46.1 Å²	46.1	19%	0.189	22%	0.221	C	C	.	.	H	α-helix	trans	-58.3	-48.1	176.8	-164.8	0	0	0	0	111.8	Y207 M229 Q230 R231 L235 K236 D237	Y207-S233 PolarHBondContact OH-OG 3.49Å; Y207-S233 VanDerWaalsContact OH-OG 3.12Å; M229-S233 WeakPolarHBondContact O-CB 3.34Å; M229-S233 PolarHBondContact O-N 3.23Å; Q230-S233 WeakPolarHBondContact O-CB 3.46Å; Q230-S233 PolarHBondContact O-N 2.65Å; R231-S233 VanDerWaalsContact C-N 3.29Å; R231-S233 PolarHBondContact O-N 2.78Å; S233-L235 VanDerWaalsContact C-N 3.34Å; S233-L235 PolarHBondContact O-N 2.9Å; S233-K236 WeakPolarHBondContact O-CB 3.35Å; S233-K236 PolarHBondContact O-N 3.14Å; S233-K236 PolarHBondContact O-NZ 3.01Å; S233-D237 PolarHBondContact O-N 3.36Å
234	R	98.2	Very high	98	Very high	153 Å²	153	44.8 Å²	44.8	58%	0.577	22%	0.216	S	C	*	.	H	α-helix	trans	-60	-41.7	176.6	-70.1	176.7	-173.8	164.9	6	112.5	Q230 R231 L232 K236 D237 F238	Q230-R234 WeakPolarHBondContact O-CG 3.29Å; Q230-R234 PolarHBondContact O-N 2.91Å; Q230-R234 VanDerWaalsContact O-N 3.1Å; R231-R234 PolarHBondContact O-N 2.74Å; L232-R234 PolarHBondContact O-N 2.64Å; R234-K236 VanDerWaalsContact C-N 3.33Å; R234-D237 PolarHBondContact O-N 3.31Å; R234-F238 PolarHBondContact O-N 3.21Å
235	L	98.3	Very high	97.9	Very high	2 Å²	2	44.4 Å²	44.4	1%	0.01	21%	0.213	C	C	.	.	H	α-helix	trans	-68.4	-34.5	177.9	-63.8	-176	0	0	0	112.3	E178 N182 F185 L186 L200 V203 R231 L232 S233 F238 S239	E178-L235 HydrophobicContact CG-CD2 4.49Å; N182-L235 HydrophobicContact CB-CD1 4.33Å; N182-L235 HydrophobicContact CB-CD2 4.35Å; F185-L235 HydrophobicContact CD1-CD1 3.85Å; F185-L235 HydrophobicContact CE1-CD1 3.82Å; L186-L235 HydrophobicContact CD2-CD1 4.03Å; L200-L235 HydrophobicContact CD2-CD1 4.49Å; L200-L235 HydrophobicContact CD2-CD2 3.88Å; V203-L235 HydrophobicContact CG1-CB 3.67Å; V203-L235 HydrophobicContact CG1-CD1 4.37Å; V203-L235 HydrophobicContact CG2-CD1 4.37Å; R231-L235 WeakPolarHBondContact O-CG 3.42Å; R231-L235 PolarHBondContact O-N 3.35Å; L232-L235 PolarHBondContact O-N 2.8Å; S233-L235 VanDerWaalsContact C-N 3.34Å; S233-L235 PolarHBondContact O-N 2.9Å; L235-F238 WeakPolarHBondContact O-CB 3.27Å; L235-F238 PolarHBondContact O-N 2.95Å; L235-S239 PolarHBondContact O-N 3.41Å
236	K	97.7	Very high	97.9	Very high	4 Å²	4	44.2 Å²	44.2	2%	0.017	21%	0.209	C	C	.	.	H	α-helix	trans	-63.1	-41.2	170.6	175.7	-85.8	-49.9	106.1	0	111.6	W204 Y207 L232 S233 R234 F238 S239 F240 Q304	W204-K236 HydrophobicContact CB-CB 3.97Å; W204-K236 HydrophobicContact CB-CG 3.62Å; Y207-K236 HydrophobicContact CD1-CB 4.04Å; Y207-K236 HydrophobicContact CD1-CD 4.26Å; Y207-K236 HydrophobicContact CD1-CG 3.85Å; Y207-K236 HydrophobicContact CE1-CD 4.37Å; Y207-K236 VanDerWaalsContact CE1-CE 3.49Å; Y207-K236 HydrophobicContact CE1-CG 4.44Å; Y207-K236 HydrophobicContact CG-CB 4.27Å; L232-K236 WeakPolarHBondContact O-CB 3.5Å; L232-K236 PolarHBondContact O-N 3.41Å; S233-K236 WeakPolarHBondContact O-CB 3.35Å; S233-K236 PolarHBondContact O-N 3.14Å; S233-K236 PolarHBondContact O-NZ 3.01Å; R234-K236 VanDerWaalsContact C-N 3.33Å; K236-F238 VanDerWaalsContact C-N 3.32Å; K236-F238 PolarHBondContact O-N 3.28Å; K236-S239 PolarHBondContact O-N 2.84Å; K236-S239 VanDerWaalsContact O-N 3.15Å; K236-S239 PolarHBondContact O-OG 3.44Å; K236-F240 HydrophobicContact CD-CD2 4.05Å; K236-F240 HydrophobicContact CD-CE2 3.62Å; K236-F240 PolarHBondContact O-N 3.14Å; K236-Q304 HydrophobicContact CD-CB 3.93Å; K236-Q304 HydrophobicContact CD-CG 4.29Å
237	D	97.6	Very high	97.9	Very high	25 Å²	25	42.7 Å²	42.7	13%	0.134	19%	0.189	C	C	.	.	H	α-helix	trans	-65	-38.7	173.6	-73.6	-36.8	0	0	0	112	S233 R234 S239 F240 R241 G302 E303 Q304	S233-D237 PolarHBondContact O-N 3.36Å; R234-D237 PolarHBondContact O-N 3.31Å; D237-S239 VanDerWaalsContact C-N 3.29Å; D237-S239 PolarHBondContact O-N 3.25Å; D237-F240 WeakPolarHBondContact O-CB 3.25Å; D237-F240 PolarHBondContact O-N 2.91Å; D237-R241 PolarHBondContact O-N 2.74Å; D237-G302 WeakPolarHBondContact CB-O 3.33Å; D237-E303 WeakPolarHBondContact OD1-CA 3.47Å; D237-Q304 PolarHBondContact OD1-N 3.14Å
238	F	98.1	Very high	97.9	Very high	16 Å²	16	39.1 Å²	39.1	7%	0.07	17%	0.172	C	C	.	.	H	α-helix	trans	-59.7	-39.7	171.7	-175.9	-90.2	0	0	0	111.9	E174 Y175 E178 L200 R234 L235 K236 F240 R241 F242 I246	E174-F238 HydrophobicContact CG-CE2 4.41Å; Y175-F238 AromaticContact CD2-CE1 3.84Å; Y175-F238 HydrophobicContact CD2-CE1 3.84Å; Y175-F238 HydrophobicContact CD2-CZ 4.06Å; Y175-F238 HydrophobicContact CE2-CE1 4.26Å; E178-F238 HydrophobicContact CB-CD2 4.41Å; E178-F238 HydrophobicContact CB-CE1 4.3Å; E178-F238 HydrophobicContact CB-CE2 3.88Å; E178-F238 HydrophobicContact CB-CZ 3.83Å; E178-F238 HydrophobicContact CG-CD1 4.21Å; E178-F238 HydrophobicContact CG-CD2 3.83Å; E178-F238 HydrophobicContact CG-CE1 4.22Å; E178-F238 HydrophobicContact CG-CE2 3.83Å; E178-F238 HydrophobicContact CG-CG 4.03Å; E178-F238 HydrophobicContact CG-CZ 4.03Å; L200-F238 HydrophobicContact CB-CD1 4.36Å; L200-F238 HydrophobicContact CB-CE1 4.4Å; L200-F238 HydrophobicContact CD1-CD1 4.25Å; L200-F238 HydrophobicContact CD1-CE1 3.76Å; R234-F238 PolarHBondContact O-N 3.21Å; L235-F238 WeakPolarHBondContact O-CB 3.27Å; L235-F238 PolarHBondContact O-N 2.95Å; K236-F238 VanDerWaalsContact C-N 3.32Å; K236-F238 PolarHBondContact O-N 3.28Å; F238-F240 VanDerWaalsContact C-N 3.27Å; F238-F240 PolarHBondContact O-N 3.47Å; F238-R241 CarbonylContact O-C 3.44Å; F238-R241 WeakPolarHBondContact O-CB 3.2Å; F238-R241 PolarHBondContact O-N 3.18Å; F238-R241 VanDerWaalsContact O-N 3.12Å; F238-F242 HydrophobicContact CE1-CB 4.49Å; F238-F242 PolarHBondContact O-N 3.27Å; F238-I246 HydrophobicContact CD2-CD1 4.46Å; F238-I246 HydrophobicContact CE1-CD1 4.25Å; F238-I246 HydrophobicContact CE2-CD1 3.66Å; F238-I246 HydrophobicContact CZ-CD1 3.52Å
239	S	97.4	Very high	97.9	Very high	7 Å²	7	41.2 Å²	41.2	5%	0.049	18%	0.181	C	C	.	.	H	α-helix	trans	-62.2	-33.7	177.2	75.9	0	0	0	0	113	L235 K236 D237 F242 L243	L235-S239 PolarHBondContact O-N 3.41Å; K236-S239 PolarHBondContact O-N 2.84Å; K236-S239 VanDerWaalsContact O-N 3.15Å; K236-S239 PolarHBondContact O-OG 3.44Å; D237-S239 VanDerWaalsContact C-N 3.29Å; D237-S239 PolarHBondContact O-N 3.25Å; S239-F242 WeakPolarHBondContact O-CB 3.39Å; S239-F242 PolarHBondContact O-N 2.94Å; S239-L243 WeakPolarHBondContact O-CG 3.44Å; S239-L243 PolarHBondContact O-N 3.36Å
240	F	97.8	Very high	97.9	Very high	12 Å²	12	43.2 Å²	43.2	5%	0.053	20%	0.199	C	C	.	.	H	α-helix	trans	-65.9	-44.1	172.7	-80.8	-53.8	0	0	0	111.9	K236 D237 F238 F242 L243 F244 D287 T288 V291 Q304	K236-F240 HydrophobicContact CD-CD2 4.05Å; K236-F240 HydrophobicContact CD-CE2 3.62Å; K236-F240 PolarHBondContact O-N 3.14Å; D237-F240 WeakPolarHBondContact O-CB 3.25Å; D237-F240 PolarHBondContact O-N 2.91Å; F238-F240 VanDerWaalsContact C-N 3.27Å; F238-F240 PolarHBondContact O-N 3.47Å; F240-F242 VanDerWaalsContact C-N 3.3Å; F240-F242 PolarHBondContact O-N 3.15Å; F240-L243 PolarHBondContact O-N 3.06Å; F240-F244 HydrophobicContact CD1-CE2 4.44Å; F240-F244 WeakPolarHBondContact O-CD2 3.04Å; F240-F244 PolarHBondContact O-N 2.93Å; F240-D287 HydrophobicContact CZ-CB 4.18Å; F240-T288 HydrophobicContact CE1-CG2 3.72Å; F240-V291 HydrophobicContact CB-CG1 3.93Å; F240-V291 HydrophobicContact CD1-CB 4.14Å; F240-V291 HydrophobicContact CD1-CG1 4.01Å; F240-V291 HydrophobicContact CD1-CG2 3.92Å; F240-V291 HydrophobicContact CD2-CG2 4.42Å; F240-V291 HydrophobicContact CE1-CG2 4.15Å; F240-V291 HydrophobicContact CG-CG1 4.14Å; F240-V291 HydrophobicContact CG-CG2 4.08Å; F240-Q304 HydrophobicContact CD2-CB 4.37Å; F240-Q304 HydrophobicContact CE2-CB 3.79Å; F240-Q304 HydrophobicContact CE2-CG 3.68Å; F240-Q304 HydrophobicContact CZ-CG 4.21Å
241	R	97.4	Very high	97.9	Very high	106 Å²	106	40.3 Å²	40.3	40%	0.4	19%	0.186	S	C	.	.	H	α-helix	trans	-62	-38.8	174.2	-72.6	178.6	56.2	138.9	-1.7	111.8	E174 D237 F238 G245 I246	E174-R241 IonicContact OE1-CZ 2.75Å; E174-R241 IonicContact OE1-NE 3.34Å; E174-R241 IonicContact OE1-NH2 3.46Å; E174-R241 PolarHBondContact OE1-NH2 2.76Å; D237-R241 PolarHBondContact O-N 2.74Å; F238-R241 CarbonylContact O-C 3.44Å; F238-R241 WeakPolarHBondContact O-CB 3.2Å; F238-R241 PolarHBondContact O-N 3.18Å; F238-R241 VanDerWaalsContact O-N 3.12Å; R241-G245 CarbonylContact O-C 3.57Å; R241-G245 WeakPolarHBondContact O-CA 3.15Å; R241-G245 PolarHBondContact O-N 3.13Å; R241-I246 HydrophobicContact CB-CD1 4.26Å; R241-I246 HydrophobicContact CB-CG1 4.11Å
242	F	98.1	Very high	98	Very high	2 Å²	2	36 Å²	36	1%	0.009	17%	0.17	C	C	.	.	H	α-helix	trans	-59.2	-46.4	173.8	167.5	-94.9	0	0	0	111.8	Q166 T169 R170 Y175 E201 F238 S239 F240 F244 I246 K252	Q166-F242 HydrophobicContact CB-CE1 4.49Å; Q166-F242 HydrophobicContact CB-CZ 3.95Å; Q166-F242 HydrophobicContact CG-CE1 4.31Å; Q166-F242 HydrophobicContact CG-CZ 4.23Å; T169-F242 HydrophobicContact CG2-CD2 3.6Å; T169-F242 HydrophobicContact CG2-CE2 3.9Å; R170-F242 HydrophobicContact CG-CE2 3.81Å; R170-F242 HydrophobicContact CG-CZ 4.23Å; Y175-F242 AromaticContact CD2-CD2 3.63Å; Y175-F242 HydrophobicContact CD2-CD2 3.63Å; Y175-F242 HydrophobicContact CD2-CE2 4.05Å; Y175-F242 AromaticContact CE2-CD2 3.52Å; Y175-F242 HydrophobicContact CE2-CD2 3.52Å; Y175-F242 AromaticContact CE2-CE2 3.71Å; Y175-F242 HydrophobicContact CE2-CE2 3.71Å; Y175-F242 HydrophobicContact CE2-CG 4.32Å; E201-F242 HydrophobicContact CG-CD1 3.74Å; E201-F242 HydrophobicContact CG-CE1 3.58Å; E201-F242 HydrophobicContact CG-CE2 4.45Å; E201-F242 HydrophobicContact CG-CG 4.24Å; E201-F242 HydrophobicContact CG-CZ 3.96Å; E201-F242 WeakPolarHBondContact OE1-CZ 3.4Å; E201-F242 WeakPolarHBondContact OE2-CE1 3.26Å; F238-F242 HydrophobicContact CE1-CB 4.49Å; F238-F242 PolarHBondContact O-N 3.27Å; S239-F242 WeakPolarHBondContact O-CB 3.39Å; S239-F242 PolarHBondContact O-N 2.94Å; F240-F242 VanDerWaalsContact C-N 3.3Å; F240-F242 PolarHBondContact O-N 3.15Å; F242-F244 PolarHBondContact O-N 3.09Å; F242-I246 HydrophobicContact CB-CD1 4.28Å; F242-K252 PolarHBondContact O-NZ 2.76Å
243	L	98	Very high	98	Very high	32 Å²	32	36.3 Å²	36.3	17%	0.168	17%	0.172	C	C	.	.	H	α-helix	trans	-62.4	-42.2	-178.2	-72.8	172.8	0	0	0	112.7	Y162 S239 F240	Y162-L243 WeakPolarHBondContact CE2-O 3.07Å; Y162-L243 PolarHBondContact OH-O 3.21Å; S239-L243 WeakPolarHBondContact O-CG 3.44Å; S239-L243 PolarHBondContact O-N 3.36Å; F240-L243 PolarHBondContact O-N 3.06Å
244	F	98.4	Very high	98	Very high	5 Å²	5	37 Å²	37	2%	0.022	17%	0.17	C	C	.	.	H	α-helix	trans	-119.9	-10.5	-166.6	-54.6	-61.4	0	0	0	115.1	F154 F240 F242 Q256 V291 A292 M295	F154-F244 HydrophobicContact CB-CE1 4.42Å; F154-F244 HydrophobicContact CB-CZ 4.11Å; F240-F244 HydrophobicContact CD1-CE2 4.44Å; F240-F244 WeakPolarHBondContact O-CD2 3.04Å; F240-F244 PolarHBondContact O-N 2.93Å; F242-F244 PolarHBondContact O-N 3.09Å; F244-Q256 HydrophobicContact CD1-CB 3.97Å; F244-Q256 HydrophobicContact CD1-CG 4.19Å; F244-Q256 HydrophobicContact CE1-CB 4.04Å; F244-Q256 HydrophobicContact CE1-CG 4.2Å; F244-V291 HydrophobicContact CD2-CB 4.34Å; F244-V291 HydrophobicContact CD2-CG1 3.61Å; F244-V291 HydrophobicContact CE2-CB 4.3Å; F244-V291 HydrophobicContact CE2-CG1 4.02Å; F244-A292 HydrophobicContact CD1-CB 4.02Å; F244-A292 HydrophobicContact CD2-CB 4.45Å; F244-A292 HydrophobicContact CE1-CB 3.68Å; F244-A292 HydrophobicContact CE2-CB 4.13Å; F244-A292 HydrophobicContact CG-CB 4.39Å; F244-A292 HydrophobicContact CZ-CB 3.74Å; F244-M295 HydrophobicContact CB-CB 3.89Å; F244-M295 HydrophobicContact CB-CE 4.32Å; F244-M295 HydrophobicContact CB-CG 3.91Å
245	G	96.9	Very high	98	Very high	0 Å²	0	29.8 Å²	29.8	0%	0	14%	0.143	C	C	.	.	S	Bend	trans	-138.3	-140.9	-176.3	0	0	0	0	0	113	R241 Y247 K252	R241-G245 CarbonylContact O-C 3.57Å; R241-G245 WeakPolarHBondContact O-CA 3.15Å; R241-G245 PolarHBondContact O-N 3.13Å; G245-Y247 PolarHBondContact O-N 3.34Å; G245-K252 PolarHBondContact O-NZ 3.19Å
246	I	96.4	Very high	98	Very high	38 Å²	38	29.7 Å²	29.7	20%	0.195	14%	0.143	C	C	.	.	S	Bend	trans	61.8	-55.7	-174.8	-59.8	-179.7	0	0	0	113.6	T169 E174 F238 R241 F242	T169-I246 HydrophobicContact CG2-CB 3.83Å; T169-I246 HydrophobicContact CG2-CD1 4.4Å; T169-I246 HydrophobicContact CG2-CG2 3.79Å; E174-I246 HydrophobicContact CB-CG2 4.12Å; E174-I246 HydrophobicContact CG-CG2 4.31Å; F238-I246 HydrophobicContact CD2-CD1 4.46Å; F238-I246 HydrophobicContact CE1-CD1 4.25Å; F238-I246 HydrophobicContact CE2-CD1 3.66Å; F238-I246 HydrophobicContact CZ-CD1 3.52Å; R241-I246 HydrophobicContact CB-CD1 4.26Å; R241-I246 HydrophobicContact CB-CG1 4.11Å; F242-I246 HydrophobicContact CB-CD1 4.28Å
247	Y	98.1	Very high	98.1	Very high	81 Å²	81	29.6 Å²	29.6	32%	0.318	14%	0.142	S	C	.	.	S	Bend	trans	-129.7	127	-177.8	-173.7	-106.3	0	0	0	110.2	L165 E168 T172 G245 Q249 K252	L165-Y247 HydrophobicContact CD2-CD1 4.3Å; L165-Y247 HydrophobicContact CD2-CE1 4.22Å; E168-Y247 HydrophobicContact CB-CD1 3.79Å; E168-Y247 HydrophobicContact CB-CE1 3.52Å; E168-Y247 HydrophobicContact CG-CE1 4.37Å; E168-Y247 WeakPolarHBondContact OE2-CE1 3.17Å; T172-Y247 HydrophobicContact CG2-CD2 3.75Å; T172-Y247 HydrophobicContact CG2-CG 4Å; G245-Y247 PolarHBondContact O-N 3.34Å; Y247-Q249 VanDerWaalsContact C-N 3.31Å; Y247-Q249 PolarHBondContact O-N 2.82Å; Y247-K252 VanDerWaalsContact O-CE 3.31Å; Y247-K252 WeakPolarHBondContact O-CE 3.28Å
248	Q	98.1	Very high	98.1	Very high	85 Å²	85	28.4 Å²	28.4	40%	0.397	14%	0.136	S	C	.	.	S	Bend	trans	45.2	51.9	-178.8	-60.6	-149.1	61.7	0	0	113.4	L165 A250 E251 K252	L165-Q248 HydrophobicContact CD2-CB 4.01Å; L165-Q248 HydrophobicContact CD2-CG 4.42Å; Q248-A250 VanDerWaalsContact C-N 3.25Å; Q248-A250 PolarHBondContact O-N 2.88Å; Q248-E251 HydrophobicContact CB-CB 4.12Å; Q248-E251 PolarHBondContact O-N 2.72Å; Q248-E251 PolarHBondContact OE1-OE2 2.65Å; Q248-E251 VanDerWaalsContact OE1-OE2 3.08Å; Q248-K252 PolarHBondContact O-N 3.03Å
249	Q	98.3	Very high	98.2	Very high	58 Å²	58	28.9 Å²	28.9	27%	0.271	14%	0.14	S	C	.	.	H	α-helix	trans	-51.9	-42.2	-178.8	177.9	170.3	-42.3	0	0	112.6	Y247 E251 K252 A253 M295 D298	Y247-Q249 VanDerWaalsContact C-N 3.31Å; Y247-Q249 PolarHBondContact O-N 2.82Å; Q249-E251 PolarHBondContact O-N 3.19Å; Q249-K252 PolarHBondContact O-N 3.31Å; Q249-A253 VanDerWaalsContact O-CB 3.29Å; Q249-A253 WeakPolarHBondContact O-CB 3.21Å; Q249-A253 PolarHBondContact O-N 2.87Å; Q249-M295 HydrophobicContact CG-CE 4.33Å; Q249-M295 PolarHBondContact NE2-O 2.71Å; Q249-M295 VanDerWaalsContact NE2-O 3.1Å; Q249-D298 PolarHBondContact NE2-OD1 2.87Å
250	A	98.4	Very high	98.2	Very high	55 Å²	55	28.6 Å²	28.6	46%	0.455	14%	0.138	S	C	.	.	H	α-helix	trans	-61.6	-42.4	178.4	0	0	0	0	0	112.1	Q248 A253 R254 V361	Q248-A250 VanDerWaalsContact C-N 3.25Å; Q248-A250 PolarHBondContact O-N 2.88Å; A250-A253 WeakPolarHBondContact O-CB 3.36Å; A250-A253 PolarHBondContact O-N 2.89Å; A250-R254 WeakPolarHBondContact O-CG 3.24Å; A250-R254 PolarHBondContact O-N 3.18Å; A250-R254 VanDerWaalsContact O-N 3.08Å; A250-V361 HydrophobicContact CB-CG1 4.33Å
251	E	98.6	Very high	98.3	Very high	49 Å²	49	28 Å²	28	23%	0.229	14%	0.136	C	C	.	.	H	α-helix	trans	-69.4	-43.3	177.4	-164.8	-179.9	-177.4	0	0	111.4	R161 L165 Q248 Q249 A253 R254 L255	R161-E251 IonicContact CZ-OE1 3.18Å; R161-E251 VanDerWaalsContact CZ-OE1 3.25Å; R161-E251 IonicContact CZ-OE2 2.71Å; R161-E251 IonicContact NE-OE1 3.09Å; R161-E251 PolarHBondContact NE-OE1 3.39Å; R161-E251 IonicContact NE-OE2 2.63Å; R161-E251 IonicContact NH2-OE1 3.6Å; R161-E251 PolarHBondContact NH2-OE1 2.97Å; R161-E251 IonicContact NH2-OE2 3.53Å; R161-E251 PolarHBondContact NH2-OE2 3.27Å; L165-E251 HydrophobicContact CD1-CB 4.15Å; L165-E251 HydrophobicContact CD1-CG 3.89Å; Q248-E251 HydrophobicContact CB-CB 4.12Å; Q248-E251 PolarHBondContact O-N 2.72Å; Q248-E251 PolarHBondContact OE1-OE2 2.65Å; Q248-E251 VanDerWaalsContact OE1-OE2 3.08Å; Q249-E251 PolarHBondContact O-N 3.19Å; E251-A253 VanDerWaalsContact C-N 3.26Å; E251-A253 PolarHBondContact O-N 3.12Å; E251-R254 WeakPolarHBondContact O-CB 3.23Å; E251-R254 PolarHBondContact O-N 2.82Å; E251-L255 WeakPolarHBondContact O-CG 3.5Å; E251-L255 PolarHBondContact O-N 3.07Å
252	K	98.7	Very high	98.4	Very high	0 Å²	0	24.3 Å²	24.3	0%	0	13%	0.128	C	C	.	.	H	α-helix	trans	-57.7	-40.8	171.8	-73	-175.2	176.5	179	0	111.8	Y162 L165 T169 F242 G245 Y247 Q248 Q249 L255 Q256	Y162-K252 HydrophobicContact CD2-CG 4.42Å; Y162-K252 HydrophobicContact CE2-CD 4.5Å; Y162-K252 HydrophobicContact CE2-CG 4.29Å; L165-K252 HydrophobicContact CB-CG 4.26Å; L165-K252 HydrophobicContact CD1-CG 3.91Å; T169-K252 WeakPolarHBondContact OG1-CE 3.23Å; T169-K252 PolarHBondContact OG1-NZ 2.99Å; F242-K252 PolarHBondContact O-NZ 2.76Å; G245-K252 PolarHBondContact O-NZ 3.19Å; Y247-K252 VanDerWaalsContact O-CE 3.31Å; Y247-K252 WeakPolarHBondContact O-CE 3.28Å; Q248-K252 PolarHBondContact O-N 3.03Å; Q249-K252 PolarHBondContact O-N 3.31Å; K252-L255 CarbonylContact O-C 3.5Å; K252-L255 PolarHBondContact O-N 2.88Å; K252-Q256 WeakPolarHBondContact O-CB 3.34Å; K252-Q256 VanDerWaalsContact O-CG 3.3Å; K252-Q256 WeakPolarHBondContact O-CG 3.48Å; K252-Q256 PolarHBondContact O-N 2.88Å
253	A	98.8	Very high	98.4	Very high	5 Å²	5	27 Å²	27	4%	0.041	14%	0.14	C	C	.	.	H	α-helix	trans	-59.8	-48	176.8	0	0	0	0	0	110.7	Q249 A250 E251 L255 Q256 G257 G258 A296 V361	Q249-A253 VanDerWaalsContact O-CB 3.29Å; Q249-A253 WeakPolarHBondContact O-CB 3.21Å; Q249-A253 PolarHBondContact O-N 2.87Å; A250-A253 WeakPolarHBondContact O-CB 3.36Å; A250-A253 PolarHBondContact O-N 2.89Å; E251-A253 VanDerWaalsContact C-N 3.26Å; E251-A253 PolarHBondContact O-N 3.12Å; A253-L255 PolarHBondContact O-N 3.36Å; A253-Q256 CarbonylContact O-C 3.46Å; A253-Q256 VanDerWaalsContact O-C 3.28Å; A253-Q256 PolarHBondContact O-N 3.37Å; A253-G257 PolarHBondContact O-N 2.83Å; A253-G258 WeakPolarHBondContact O-CA 3.36Å; A253-G258 PolarHBondContact O-N 3.22Å; A253-A296 HydrophobicContact CB-CB 3.79Å; A253-V361 CarbonylContact C-O 3.46Å; A253-V361 HydrophobicContact CB-CB 3.97Å; A253-V361 HydrophobicContact CB-CG1 4.19Å
254	R	98.8	Very high	98.4	Very high	42 Å²	42	25.4 Å²	25.4	16%	0.158	13%	0.132	C	C	.	.	H	α-helix	trans	-55.1	-37.9	176.4	-64.9	174.6	72	68.6	14.6	112.7	A250 E251 P360 V361 V362 P363 E369	A250-R254 WeakPolarHBondContact O-CG 3.24Å; A250-R254 PolarHBondContact O-N 3.18Å; A250-R254 VanDerWaalsContact O-N 3.08Å; E251-R254 WeakPolarHBondContact O-CB 3.23Å; E251-R254 PolarHBondContact O-N 2.82Å; R254-P360 VanDerWaalsContact CD-O 3.28Å; R254-P360 WeakPolarHBondContact CD-O 3.47Å; R254-P360 WeakPolarHBondContact CG-O 3.45Å; R254-P360 PolarHBondContact NH1-O 3.29Å; R254-V361 WeakPolarHBondContact CA-O 3.22Å; R254-V361 PolarHBondContact N-O 2.84Å; R254-V362 PolarHBondContact NH1-O 3.46Å; R254-V362 PolarHBondContact NH2-O 2.96Å; R254-V362 VanDerWaalsContact NH2-O 3.08Å; R254-P363 WeakPolarHBondContact O-CB 3.29Å; R254-P363 VanDerWaalsContact O-CD 3.28Å; R254-P363 WeakPolarHBondContact O-CD 3.47Å; R254-P363 WeakPolarHBondContact O-CG 3.49Å; R254-E369 IonicContact CZ-OE1 3.69Å; R254-E369 IonicContact CZ-OE2 3.07Å; R254-E369 IonicContact NE-OE2 3.71Å; R254-E369 PolarHBondContact NE-OE2 3.05Å; R254-E369 IonicContact NH2-OE1 2.85Å; R254-E369 PolarHBondContact NH2-OE1 2.83Å; R254-E369 IonicContact NH2-OE2 3.88Å; R254-E369 PolarHBondContact NH2-OE2 3.44Å
255	L	98.7	Very high	98.4	Very high	2 Å²	2	26.6 Å²	26.6	1%	0.01	14%	0.137	C	C	.	.	H	α-helix	trans	-85.1	-11.6	180	-56.2	178.1	0	0	0	113.7	R161 L165 E251 K252 A253 W366 E369	R161-L255 HydrophobicContact CB-CD1 4.02Å; R161-L255 HydrophobicContact CG-CD1 3.79Å; L165-L255 HydrophobicContact CD1-CD1 3.93Å; E251-L255 WeakPolarHBondContact O-CG 3.5Å; E251-L255 PolarHBondContact O-N 3.07Å; K252-L255 CarbonylContact O-C 3.5Å; K252-L255 PolarHBondContact O-N 2.88Å; A253-L255 PolarHBondContact O-N 3.36Å; L255-W366 PolarHBondContact O-NE1 3.42Å; L255-E369 HydrophobicContact CD2-CB 3.82Å
256	Q	98.7	Very high	98.5	Very high	0 Å²	0	32.4 Å²	32.4	0%	0	16%	0.162	C	C	.	.	T	Hydrogen-bonded Turn	trans	-130	-112.6	-173.5	-59.1	-62.5	-29.5	0	0	110.6	F154 P155 L156 Y162 F244 K252 A253 G258 V259	F154-Q256 HydrophobicContact CD1-CB 4.27Å; F154-Q256 HydrophobicContact CE1-CB 4.41Å; F154-Q256 VanDerWaalsContact CE1-O 3.27Å; F154-Q256 WeakPolarHBondContact CE1-O 3.3Å; P155-Q256 VanDerWaalsContact CA-OE1 3.27Å; L156-Q256 PolarHBondContact O-NE2 2.78Å; Y162-Q256 HydrophobicContact CD2-CG 3.78Å; Y162-Q256 HydrophobicContact CE2-CG 3.51Å; Y162-Q256 HydrophobicContact CG-CG 4.43Å; Y162-Q256 VanDerWaalsContact CG-NE2 3.25Å; F244-Q256 HydrophobicContact CD1-CB 3.97Å; F244-Q256 HydrophobicContact CD1-CG 4.19Å; F244-Q256 HydrophobicContact CE1-CB 4.04Å; F244-Q256 HydrophobicContact CE1-CG 4.2Å; K252-Q256 WeakPolarHBondContact O-CB 3.34Å; K252-Q256 VanDerWaalsContact O-CG 3.3Å; K252-Q256 WeakPolarHBondContact O-CG 3.48Å; K252-Q256 PolarHBondContact O-N 2.88Å; A253-Q256 CarbonylContact O-C 3.46Å; A253-Q256 VanDerWaalsContact O-C 3.28Å; A253-Q256 PolarHBondContact O-N 3.37Å; Q256-G258 PolarHBondContact O-N 2.88Å; Q256-V259 WeakPolarHBondContact O-CB 3.48Å; Q256-V259 PolarHBondContact O-N 3.44Å
257	G	98.6	Very high	98.6	Very high	1 Å²	1	30.9 Å²	30.9	1%	0.01	15%	0.154	C	C	.	.	H	α-helix	trans	-58.3	-22.3	-171.8	0	0	0	0	0	115.3	A253 V259 L260 L261 A292	A253-G257 PolarHBondContact O-N 2.83Å; G257-V259 PolarHBondContact O-N 2.93Å; G257-L260 PolarHBondContact O-N 2.85Å; G257-L261 PolarHBondContact O-N 2.9Å; G257-A292 WeakPolarHBondContact CA-O 3.44Å
258	G	98.8	Very high	98.6	Very high	0 Å²	0	27.1 Å²	27.1	0%	0	14%	0.139	C	C	.	.	H	α-helix	trans	-58.2	-29.2	171	0	0	0	0	0	113.9	A253 Q256 L261 A262 V361	A253-G258 WeakPolarHBondContact O-CA 3.36Å; A253-G258 PolarHBondContact O-N 3.22Å; Q256-G258 PolarHBondContact O-N 2.88Å; G258-L261 PolarHBondContact O-N 3.07Å; G258-A262 WeakPolarHBondContact O-CB 3.23Å; G258-A262 PolarHBondContact O-N 2.83Å; G258-V361 VanDerWaalsContact CA-O 3.23Å; G258-V361 WeakPolarHBondContact CA-O 3.33Å
259	V	98.8	Very high	98.6	Very high	27 Å²	27	25.4 Å²	25.4	16%	0.164	14%	0.135	C	C	.	.	H	α-helix	trans	-64.8	-46	174.2	176.6	0	0	0	0	110.9	R150 L156 Q256 G257 A262 Q263 P363 W366	R150-V259 WeakPolarHBondContact O-CG1 3.2Å; L156-V259 HydrophobicContact CD1-CB 3.83Å; L156-V259 HydrophobicContact CD1-CG1 4.15Å; L156-V259 HydrophobicContact CD1-CG2 3.59Å; Q256-V259 WeakPolarHBondContact O-CB 3.48Å; Q256-V259 PolarHBondContact O-N 3.44Å; G257-V259 PolarHBondContact O-N 2.93Å; V259-A262 WeakPolarHBondContact O-CB 3.38Å; V259-A262 PolarHBondContact O-N 3.29Å; V259-Q263 PolarHBondContact O-N 2.98Å; V259-P363 HydrophobicContact CG2-CG 3.82Å; V259-W366 HydrophobicContact CG2-CG 4.12Å
260	L	98.9	Very high	98.6	Very high	0 Å²	0	25.3 Å²	25.3	0%	0	14%	0.136	C	C	.	.	H	α-helix	trans	-67.2	-40.8	175.5	178.2	54.8	0	0	0	111.1	L39 L151 L152 F154 G257 A262 Q263 I264 Y283 T289 L293	L39-L260 HydrophobicContact CD1-CD2 4.37Å; L39-L260 HydrophobicContact CD2-CD2 3.8Å; L151-L260 HydrophobicContact CD1-CB 4.34Å; L151-L260 HydrophobicContact CD1-CD1 3.73Å; L151-L260 HydrophobicContact CG-CD1 4.02Å; L152-L260 HydrophobicContact CD2-CD1 3.9Å; L152-L260 HydrophobicContact CD2-CD2 4.05Å; F154-L260 HydrophobicContact CE2-CB 4.35Å; F154-L260 HydrophobicContact CE2-CD2 4.31Å; F154-L260 HydrophobicContact CZ-CB 4.05Å; G257-L260 PolarHBondContact O-N 2.85Å; L260-A262 VanDerWaalsContact C-N 3.29Å; L260-A262 PolarHBondContact O-N 3.06Å; L260-Q263 WeakPolarHBondContact O-CB 3.41Å; L260-Q263 PolarHBondContact O-N 2.69Å; L260-Q263 VanDerWaalsContact O-N 3.15Å; L260-I264 HydrophobicContact CD1-CD1 4.28Å; L260-I264 HydrophobicContact CD1-CG1 4.46Å; L260-I264 HydrophobicContact CG-CD1 4.02Å; L260-I264 WeakPolarHBondContact O-CG1 3.41Å; L260-I264 PolarHBondContact O-N 3.36Å; L260-Y283 HydrophobicContact CD1-CD2 4.32Å; L260-Y283 HydrophobicContact CD1-CE2 4.18Å; L260-T289 HydrophobicContact CD2-CG2 3.91Å; L260-L293 HydrophobicContact CD2-CB 4.37Å; L260-L293 HydrophobicContact CD2-CD2 4.28Å; L260-L293 HydrophobicContact CG-CD1 4.42Å
261	L	98.9	Very high	98.5	Very high	0 Å²	0	23.3 Å²	23.3	0%	0	12%	0.117	C	C	.	.	H	α-helix	trans	-60.4	-38.3	174.8	-176.6	53.4	0	0	0	111.9	G257 G258 Q263 I264 R265 L293 A296 L297 F354 T358 V361 V362	G257-L261 PolarHBondContact O-N 2.9Å; G258-L261 PolarHBondContact O-N 3.07Å; L261-Q263 VanDerWaalsContact C-N 3.32Å; L261-Q263 PolarHBondContact O-N 3.09Å; L261-I264 PolarHBondContact O-N 2.8Å; L261-R265 HydrophobicContact CD1-CG 4.23Å; L261-R265 HydrophobicContact CG-CG 4.39Å; L261-R265 WeakPolarHBondContact O-CB 3.27Å; L261-R265 VanDerWaalsContact O-CG 3.23Å; L261-R265 WeakPolarHBondContact O-CG 3.13Å; L261-R265 PolarHBondContact O-N 3.3Å; L261-L293 HydrophobicContact CB-CD1 3.98Å; L261-L293 HydrophobicContact CD1-CD1 4.39Å; L261-A296 HydrophobicContact CD2-CB 4.4Å; L261-L297 HydrophobicContact CD1-CD2 3.69Å; L261-L297 HydrophobicContact CD1-CG 4.3Å; L261-L297 HydrophobicContact CD2-CD2 3.89Å; L261-L297 HydrophobicContact CD2-CG 4.2Å; L261-L297 HydrophobicContact CG-CD2 4.46Å; L261-F354 HydrophobicContact CD1-CE1 4.39Å; L261-F354 HydrophobicContact CD1-CZ 4.11Å; L261-T358 HydrophobicContact CD1-CG2 4.46Å; L261-T358 HydrophobicContact CD2-CG2 3.98Å; L261-V361 HydrophobicContact CD2-CG2 3.85Å; L261-V362 HydrophobicContact CB-CG2 4.15Å; L261-V362 HydrophobicContact CD2-CG2 4.11Å; L261-V362 HydrophobicContact CG-CG2 3.91Å
262	A	98.8	Very high	98.3	Very high	29 Å²	29	21.9 Å²	21.9	24%	0.24	11%	0.114	C	C	.	.	H	α-helix	trans	-57.3	-45.4	174	0	0	0	0	0	111.7	G258 V259 L260 R265 K266 V362	G258-A262 WeakPolarHBondContact O-CB 3.23Å; G258-A262 PolarHBondContact O-N 2.83Å; V259-A262 WeakPolarHBondContact O-CB 3.38Å; V259-A262 PolarHBondContact O-N 3.29Å; L260-A262 VanDerWaalsContact C-N 3.29Å; L260-A262 PolarHBondContact O-N 3.06Å; A262-R265 PolarHBondContact O-N 3.21Å; A262-K266 WeakPolarHBondContact O-CB 3.38Å; A262-K266 PolarHBondContact O-N 3.45Å; A262-V362 HydrophobicContact CB-CG1 3.43Å; A262-V362 VanDerWaalsContact CB-CG1 3.43Å; A262-V362 HydrophobicContact CB-CG2 4.45Å
263	Q	98.6	Very high	98.1	Very high	57 Å²	57	26.5 Å²	26.5	27%	0.266	14%	0.142	S	C	.	.	H	α-helix	trans	-66.1	-39.6	177.7	-175.2	59.2	47.6	0	0	111.8	L151 V259 L260 L261 K266 N267	L151-Q263 HydrophobicContact CD1-CB 3.81Å; L151-Q263 HydrophobicContact CD1-CG 4.18Å; L151-Q263 HydrophobicContact CD2-CG 4.35Å; V259-Q263 PolarHBondContact O-N 2.98Å; L260-Q263 WeakPolarHBondContact O-CB 3.41Å; L260-Q263 PolarHBondContact O-N 2.69Å; L260-Q263 VanDerWaalsContact O-N 3.15Å; L261-Q263 VanDerWaalsContact C-N 3.32Å; L261-Q263 PolarHBondContact O-N 3.09Å; Q263-K266 PolarHBondContact O-N 3.06Å; Q263-N267 PolarHBondContact NE2-OD1 2.64Å; Q263-N267 WeakPolarHBondContact O-CB 3.47Å; Q263-N267 PolarHBondContact O-N 3.43Å; Q263-N267 PolarHBondContact O-ND2 3.16Å; Q263-N267 PolarHBondContact O-OD1 3.3Å
264	I	98.8	Very high	97.8	Very high	0 Å²	0	29.1 Å²	29.1	0%	0	16%	0.158	C	C	.	.	H	α-helix	trans	-63.7	-48.7	175.8	-68	163	0	0	0	110.5	T37 L260 L261 K266 N267 L268 L293 F313	T37-I264 HydrophobicContact CG2-CG1 4.34Å; L260-I264 HydrophobicContact CD1-CD1 4.28Å; L260-I264 HydrophobicContact CD1-CG1 4.46Å; L260-I264 HydrophobicContact CG-CD1 4.02Å; L260-I264 WeakPolarHBondContact O-CG1 3.41Å; L260-I264 PolarHBondContact O-N 3.36Å; L261-I264 PolarHBondContact O-N 2.8Å; I264-K266 VanDerWaalsContact C-N 3.34Å; I264-K266 PolarHBondContact O-N 2.98Å; I264-N267 PolarHBondContact O-N 3.4Å; I264-N267 VanDerWaalsContact O-N 3.11Å; I264-L268 HydrophobicContact CG2-CD1 3.87Å; I264-L268 HydrophobicContact CG2-CG 4.32Å; I264-L268 VanDerWaalsContact O-CG 3.3Å; I264-L268 WeakPolarHBondContact O-CG 3.41Å; I264-L268 PolarHBondContact O-N 3.04Å; I264-L293 HydrophobicContact CD1-CD1 3.93Å; I264-L293 HydrophobicContact CD1-CD2 3.82Å; I264-F313 HydrophobicContact CD1-CD2 4.33Å; I264-F313 HydrophobicContact CD1-CE2 3.69Å; I264-F313 HydrophobicContact CD1-CZ 4Å; I264-F313 HydrophobicContact CG2-CD1 4.08Å; I264-F313 HydrophobicContact CG2-CD2 4.26Å; I264-F313 HydrophobicContact CG2-CE1 4.18Å; I264-F313 HydrophobicContact CG2-CE2 4.36Å; I264-F313 HydrophobicContact CG2-CG 4.14Å; I264-F313 HydrophobicContact CG2-CZ 4.32Å
265	R	98.7	Very high	97.3	Very high	30 Å²	30	31.4 Å²	31.4	11%	0.113	18%	0.18	C	C	.	.	H	α-helix	trans	-54.8	-49.2	175.5	-70.6	170.1	76.3	-145.4	-1.4	111.2	L261 A262 N267 L268 T269 F354 L355 T358 E359 V362	L261-R265 HydrophobicContact CD1-CG 4.23Å; L261-R265 HydrophobicContact CG-CG 4.39Å; L261-R265 WeakPolarHBondContact O-CB 3.27Å; L261-R265 VanDerWaalsContact O-CG 3.23Å; L261-R265 WeakPolarHBondContact O-CG 3.13Å; L261-R265 PolarHBondContact O-N 3.3Å; A262-R265 PolarHBondContact O-N 3.21Å; R265-N267 VanDerWaalsContact C-N 3.32Å; R265-N267 PolarHBondContact O-N 2.78Å; R265-L268 PolarHBondContact O-N 3.27Å; R265-T269 PolarHBondContact O-N 2.98Å; R265-T269 PolarHBondContact O-OG1 3.25Å; R265-T269 VanDerWaalsContact O-OG1 3.06Å; R265-F354 HydrophobicContact CG-CE1 4.05Å; R265-L355 HydrophobicContact CB-CD2 3.68Å; R265-L355 HydrophobicContact CG-CD2 3.86Å; R265-L355 PolarHBondContact NH2-O 3.26Å; R265-T358 VanDerWaalsContact CD-OG1 3.29Å; R265-T358 WeakPolarHBondContact CD-OG1 3.49Å; R265-T358 PolarHBondContact NE-OG1 2.93Å; R265-T358 VanDerWaalsContact NE-OG1 3.12Å; R265-E359 IonicContact CZ-OE2 2.82Å; R265-E359 IonicContact NH1-OE2 3.74Å; R265-E359 PolarHBondContact NH1-OE2 3.49Å; R265-E359 IonicContact NH2-OE2 2.83Å; R265-E359 PolarHBondContact NH2-OE2 3.08Å; R265-V362 VanDerWaalsContact NH1-CG1 3.33Å
266	K	98.4	Very high	96.7	Very high	122 Å²	122	38.6 Å²	38.6	53%	0.53	21%	0.214	S	C	.	.	H	α-helix	trans	-56	-45.8	176	179.7	179.6	176.9	-179.5	0	111.7	A262 Q263 I264 T269 L270	A262-K266 WeakPolarHBondContact O-CB 3.38Å; A262-K266 PolarHBondContact O-N 3.45Å; Q263-K266 PolarHBondContact O-N 3.06Å; I264-K266 VanDerWaalsContact C-N 3.34Å; I264-K266 PolarHBondContact O-N 2.98Å; K266-T269 PolarHBondContact O-N 3.32Å; K266-L270 HydrophobicContact CG-CD1 3.99Å; K266-L270 HydrophobicContact CG-CG 4.47Å; K266-L270 WeakPolarHBondContact O-CB 3.46Å; K266-L270 VanDerWaalsContact O-CG 3.3Å; K266-L270 WeakPolarHBondContact O-CG 3.2Å; K266-L270 PolarHBondContact O-N 3.19Å
267	N	98.4	Very high	96.4	Very high	6 Å²	6	40.7 Å²	40.7	3%	0.032	23%	0.225	C	C	.	.	H	α-helix	trans	-65	-44.1	-179.8	-69.2	-14.7	0	0	0	112.3	F35 Q263 I264 R265 T269 L270 M271 L277 L281 Y283	F35-N267 HydrophobicContact CE1-CB 4.02Å; F35-N267 HydrophobicContact CZ-CB 3.95Å; Q263-N267 PolarHBondContact NE2-OD1 2.64Å; Q263-N267 WeakPolarHBondContact O-CB 3.47Å; Q263-N267 PolarHBondContact O-N 3.43Å; Q263-N267 PolarHBondContact O-ND2 3.16Å; Q263-N267 PolarHBondContact O-OD1 3.3Å; I264-N267 PolarHBondContact O-N 3.4Å; I264-N267 VanDerWaalsContact O-N 3.11Å; R265-N267 VanDerWaalsContact C-N 3.32Å; R265-N267 PolarHBondContact O-N 2.78Å; N267-T269 PolarHBondContact O-N 3.35Å; N267-L270 PolarHBondContact O-N 3.34Å; N267-M271 PolarHBondContact O-N 2.02Å; N267-L277 HydrophobicContact CB-CD1 3.61Å; N267-L281 HydrophobicContact CB-CD1 4.34Å; N267-L281 WeakPolarHBondContact ND2-CD1 3.42Å; N267-Y283 PolarHBondContact ND2-OH 3.04Å
268	L	98.4	Very high	96.3	Very high	1 Å²	1	41.9 Å²	41.9	1%	0.005	23%	0.232	C	C	.	.	H	α-helix	trans	-60.1	-46.4	176.2	-65.7	167.9	0	0	0	111	F35 I264 R265 M271 A272 L315 V325 L351 F354	F35-L268 HydrophobicContact CD1-CD2 3.95Å; F35-L268 HydrophobicContact CE1-CD2 4.26Å; I264-L268 HydrophobicContact CG2-CD1 3.87Å; I264-L268 HydrophobicContact CG2-CG 4.32Å; I264-L268 VanDerWaalsContact O-CG 3.3Å; I264-L268 WeakPolarHBondContact O-CG 3.41Å; I264-L268 PolarHBondContact O-N 3.04Å; R265-L268 PolarHBondContact O-N 3.27Å; L268-M271 PolarHBondContact O-N 3.02Å; L268-A272 WeakPolarHBondContact O-CB 3.35Å; L268-A272 PolarHBondContact O-N 3.34Å; L268-L315 HydrophobicContact CD2-CB 3.82Å; L268-L315 HydrophobicContact CD2-CD1 4.05Å; L268-L315 HydrophobicContact CD2-CD2 4.45Å; L268-L315 HydrophobicContact CD2-CG 4.32Å; L268-V325 HydrophobicContact CD1-CG1 4.24Å; L268-V325 HydrophobicContact CD1-CG2 4.05Å; L268-V325 HydrophobicContact CD2-CG2 4.48Å; L268-L351 HydrophobicContact CB-CD1 3.93Å; L268-F354 HydrophobicContact CD1-CD1 4.3Å; L268-F354 HydrophobicContact CD1-CE1 3.91Å
269	T	98	Very high	96.2	Very high	50 Å²	50	44.9 Å²	44.9	31%	0.307	25%	0.245	S	C	.	.	H	α-helix	trans	-62.6	-45.1	176.9	-57.9	0	0	0	0	112	R265 K266 N267 M271 A272 T273	R265-T269 PolarHBondContact O-N 2.98Å; R265-T269 PolarHBondContact O-OG1 3.25Å; R265-T269 VanDerWaalsContact O-OG1 3.06Å; K266-T269 PolarHBondContact O-N 3.32Å; N267-T269 PolarHBondContact O-N 3.35Å; T269-M271 VanDerWaalsContact C-N 3.32Å; T269-M271 PolarHBondContact O-N 3.23Å; T269-A272 PolarHBondContact O-N 2.96Å; T269-T273 HydrophobicContact CG2-CG2 4.4Å; T269-T273 WeakPolarHBondContact O-CB 2.82Å; T269-T273 WeakPolarHBondContact O-CG2 3.3Å; T269-T273 PolarHBondContact O-N 2.94Å; T269-T273 PolarHBondContact O-OG1 3.08Å
270	L	97.3	Very high	96.2	Very high	56 Å²	56	43.6 Å²	43.6	29%	0.293	24%	0.238	S	C	.	.	H	α-helix	trans	-61.6	-40.8	178.1	-76.6	172.7	0	0	0	111.7	K266 N267 T273 T274 S275 L277	K266-L270 HydrophobicContact CG-CD1 3.99Å; K266-L270 HydrophobicContact CG-CG 4.47Å; K266-L270 WeakPolarHBondContact O-CB 3.46Å; K266-L270 VanDerWaalsContact O-CG 3.3Å; K266-L270 WeakPolarHBondContact O-CG 3.2Å; K266-L270 PolarHBondContact O-N 3.19Å; N267-L270 PolarHBondContact O-N 3.34Å; L270-T273 PolarHBondContact O-N 2.76Å; L270-T273 PolarHBondContact O-OG1 2.87Å; L270-T274 PolarHBondContact O-N 2.84Å; L270-T274 PolarHBondContact O-OG1 2.92Å; L270-S275 PolarHBondContact O-N 3Å; L270-L277 HydrophobicContact CB-CD1 4.12Å; L270-L277 HydrophobicContact CB-CG 4.4Å; L270-L277 HydrophobicContact CD1-CD1 4.45Å
271	M	96.4	Very high	96.2	Very high	12 Å²	12	44 Å²	44	6%	0.059	24%	0.24	C	C	.	.	H	α-helix	trans	-68.2	-41.4	176.8	-79.7	-58.6	-71.6	0	0	113.2	R34 F35 N267 L268 T269 T273 S275 L277 L315	R34-M271 WeakPolarHBondContact O-CE 3.46Å; F35-M271 HydrophobicContact CB-CB 4.07Å; F35-M271 HydrophobicContact CB-CE 4.04Å; F35-M271 HydrophobicContact CB-CG 3.91Å; F35-M271 HydrophobicContact CD1-CG 4.21Å; F35-M271 HydrophobicContact CD2-CE 4.18Å; F35-M271 HydrophobicContact CD2-CG 3.57Å; F35-M271 HydrophobicContact CD2-SD 4.3Å; F35-M271 HydrophobicContact CE2-CG 4Å; F35-M271 HydrophobicContact CG-CB 4.18Å; F35-M271 HydrophobicContact CG-CE 4.49Å; F35-M271 HydrophobicContact CG-CG 3.65Å; F35-M271 HydrophobicContact CZ-CG 4.49Å; N267-M271 PolarHBondContact O-N 2.02Å; L268-M271 PolarHBondContact O-N 3.02Å; T269-M271 VanDerWaalsContact C-N 3.32Å; T269-M271 PolarHBondContact O-N 3.23Å; M271-T273 VanDerWaalsContact C-N 3.25Å; M271-T273 PolarHBondContact O-N 3.12Å; M271-S275 PolarHBondContact O-N 2.96Å; M271-S275 PolarHBondContact O-OG 2.71Å; M271-L277 HydrophobicContact CG-CB 3.78Å; M271-L277 HydrophobicContact CG-CD1 4.07Å; M271-L277 HydrophobicContact CG-CG 4.22Å; M271-L277 HydrophobicContact SD-CB 3.49Å; M271-L277 WeakPolarHBondContact SD-CB 3.3Å; M271-L277 HydrophobicContact SD-CG 4.27Å; M271-L277 PolarHBondContact SD-N 3.03Å; M271-L277 VanDerWaalsContact SD-O 3.36Å; M271-L315 HydrophobicContact CB-CD2 3.81Å
272	A	95.6	Very high	96.2	Very high	20 Å²	20	44.1 Å²	44.1	17%	0.165	24%	0.24	C	C	.	.	H	α-helix	trans	-64.5	-29.1	177.3	0	0	0	0	0	113.2	L268 T269 L315 F323 L351	L268-A272 WeakPolarHBondContact O-CB 3.35Å; L268-A272 PolarHBondContact O-N 3.34Å; T269-A272 PolarHBondContact O-N 2.96Å; A272-L315 HydrophobicContact CB-CD2 4.43Å; A272-F323 HydrophobicContact CB-CB 4.45Å; A272-F323 HydrophobicContact CB-CD1 4.08Å; A272-F323 HydrophobicContact CB-CD2 3.67Å; A272-F323 HydrophobicContact CB-CE1 4.2Å; A272-F323 HydrophobicContact CB-CE2 3.83Å; A272-F323 HydrophobicContact CB-CG 3.81Å; A272-F323 HydrophobicContact CB-CZ 4.09Å; A272-F323 VanDerWaalsContact O-CE2 3.25Å; A272-F323 WeakPolarHBondContact O-CE2 3.35Å; A272-F323 WeakPolarHBondContact O-CZ 3.32Å; A272-L351 HydrophobicContact CB-CD2 3.51Å
273	T	94.5	Very high	96.2	Very high	96 Å²	96	43.2 Å²	43.2	59%	0.589	23%	0.231	S	C	*	.	H	α-helix	trans	-103.6	-40.9	-172.4	53.7	0	0	0	0	114.3	T269 L270 M271	T269-T273 HydrophobicContact CG2-CG2 4.4Å; T269-T273 WeakPolarHBondContact O-CB 2.82Å; T269-T273 WeakPolarHBondContact O-CG2 3.3Å; T269-T273 PolarHBondContact O-N 2.94Å; T269-T273 PolarHBondContact O-OG1 3.08Å; L270-T273 PolarHBondContact O-N 2.76Å; L270-T273 PolarHBondContact O-OG1 2.87Å; M271-T273 VanDerWaalsContact C-N 3.25Å; M271-T273 PolarHBondContact O-N 3.12Å
274	T	91.1	Very high	96.2	Very high	61 Å²	61	40.5 Å²	40.5	37%	0.374	22%	0.218	S	C	.	.	T	Hydrogen-bonded Turn	trans	-121.2	-17.4	-170.7	66.5	0	0	0	0	113.8	L270 Q276	L270-T274 PolarHBondContact O-N 2.84Å; L270-T274 PolarHBondContact O-OG1 2.92Å; T274-Q276 PolarHBondContact O-N 3.37Å
275	S	88.4	Confident	96.2	Very high	89 Å²	89	40.5 Å²	40.5	62%	0.622	22%	0.218	S	C	*	.			trans	54.1	32.4	-174.6	-61.2	0	0	0	0	114	L270 M271	L270-S275 PolarHBondContact O-N 3Å; M271-S275 PolarHBondContact O-N 2.96Å; M271-S275 PolarHBondContact O-OG 2.71Å
276	Q	87	Confident	96.2	Very high	153 Å²	153	39.6 Å²	39.6	72%	0.715	22%	0.215	S	C	*	.			trans	-93.5	5	-174.9	-72.6	179.7	4.2	0	0	115.3	T274	T274-Q276 PolarHBondContact O-N 3.37Å
277	L	93.2	Very high	96.2	Very high	44 Å²	44	34.7 Å²	34.7	23%	0.23	19%	0.194	C	C	.	.	S	Bend	trans	-104.1	157.4	176.1	-58.7	176.6	0	0	0	111.6	F35 N267 L270 M271	F35-L277 HydrophobicContact CE2-CB 4.17Å; F35-L277 HydrophobicContact CE2-CD1 4.46Å; F35-L277 HydrophobicContact CZ-CD1 4.35Å; N267-L277 HydrophobicContact CB-CD1 3.61Å; L270-L277 HydrophobicContact CB-CD1 4.12Å; L270-L277 HydrophobicContact CB-CG 4.4Å; L270-L277 HydrophobicContact CD1-CD1 4.45Å; M271-L277 HydrophobicContact CG-CB 3.78Å; M271-L277 HydrophobicContact CG-CD1 4.07Å; M271-L277 HydrophobicContact CG-CG 4.22Å; M271-L277 HydrophobicContact SD-CB 3.49Å; M271-L277 WeakPolarHBondContact SD-CB 3.3Å; M271-L277 HydrophobicContact SD-CG 4.27Å; M271-L277 PolarHBondContact SD-N 3.03Å; M271-L277 VanDerWaalsContact SD-O 3.36Å
278	P	95.3	Very high	96.2	Very high	26 Å²	26	35.7 Å²	35.7	17%	0.169	20%	0.201	C	C	.	.			trans	-55.1	149.1	167.3	-21.7	32.9	0	0	0	111.1	F35 Q98 E99 L280 L281	F35-P278 WeakPolarHBondContact CD2-O 3.19Å; F35-P278 WeakPolarHBondContact CE2-O 3.42Å; Q98-P278 WeakPolarHBondContact O-CA 3.15Å; E99-P278 VanDerWaalsContact C-CB 3.42Å; E99-P278 CarbonylContact O-C 3.52Å; E99-P278 WeakPolarHBondContact O-CB 3.29Å; P278-L280 PolarHBondContact O-N 2.93Å; P278-L281 HydrophobicContact CB-CD2 4.37Å; P278-L281 HydrophobicContact CG-CD2 4.18Å
279	K	97.4	Very high	96.3	Very high	64 Å²	64	35.6 Å²	35.6	28%	0.278	20%	0.201	S	C	.	.	S	Bend	trans	-56.2	-34.6	176.6	-73.8	-179	177.5	171.7	0	113	F35 V36 F90 L91 E99	F35-K279 WeakPolarHBondContact CA-O 3.17Å; V36-K279 PolarHBondContact N-O 3.4Å; F90-K279 HydrophobicContact CE1-CB 3.95Å; F90-K279 HydrophobicContact CE2-CB 4.36Å; F90-K279 HydrophobicContact CE2-CD 4.25Å; F90-K279 HydrophobicContact CE2-CG 4.31Å; F90-K279 HydrophobicContact CZ-CB 3.61Å; F90-K279 HydrophobicContact CZ-CD 4.27Å; F90-K279 HydrophobicContact CZ-CG 4.05Å; F90-K279 PolarHBondContact O-NZ 3.39Å; L91-K279 HydrophobicContact CD2-CB 4.15Å; E99-K279 HydrophobicContact CB-CB 4.47Å; E99-K279 HydrophobicContact CB-CD 4.42Å; E99-K279 HydrophobicContact CG-CD 4.21Å; E99-K279 PolarHBondContact O-N 2.82Å; E99-K279 VanDerWaalsContact OE1-CE 3.27Å; E99-K279 WeakPolarHBondContact OE1-CE 3.42Å; E99-K279 IonicContact OE1-NZ 3.53Å; E99-K279 PolarHBondContact OE1-NZ 2.99Å
280	L	98.7	Very high	96.3	Very high	0 Å²	0	33.3 Å²	33.3	0%	0	19%	0.186	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-125.9	123.1	-178.2	176	65.1	0	0	0	110.7	V36 L38 L91 E99 V100 Y101 L121 P278 V282	V36-L280 HydrophobicContact CB-CD1 3.9Å; V36-L280 HydrophobicContact CG1-CD1 3.8Å; V36-L280 WeakPolarHBondContact O-CA 3.29Å; L38-L280 HydrophobicContact CD1-CD1 3.73Å; L38-L280 HydrophobicContact CG-CD1 3.78Å; L91-L280 HydrophobicContact CD1-CD2 3.9Å; L91-L280 HydrophobicContact CD2-CB 4.04Å; E99-L280 PolarHBondContact O-N 2.83Å; V100-L280 WeakPolarHBondContact CA-O 3.37Å; V100-L280 HydrophobicContact CG1-CD2 4.15Å; V100-L280 HydrophobicContact CG1-CG 4.47Å; V100-L280 HydrophobicContact CG2-CB 4.37Å; V100-L280 HydrophobicContact CG2-CD2 4.43Å; Y101-L280 PolarHBondContact N-O 2.91Å; L121-L280 HydrophobicContact CD2-CD2 3.81Å; P278-L280 PolarHBondContact O-N 2.93Å; L280-V282 HydrophobicContact CD1-CG2 4.02Å; L280-V282 HydrophobicContact CD2-CG2 3.88Å; L280-V282 HydrophobicContact CG-CG2 3.73Å
281	L	98.7	Very high	96.4	Very high	9 Å²	9	30.6 Å²	30.6	5%	0.047	17%	0.172	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-107.7	135.5	163.3	-63.4	-172.9	0	0	0	110.2	F35 V36 T37 L38 Y101 N267 P278	F35-L281 HydrophobicContact CE2-CB 4.5Å; F35-L281 HydrophobicContact CE2-CD1 4Å; F35-L281 HydrophobicContact CE2-CG 3.7Å; F35-L281 HydrophobicContact CZ-CB 4.27Å; F35-L281 HydrophobicContact CZ-CD1 3.54Å; F35-L281 HydrophobicContact CZ-CG 3.66Å; V36-L281 PolarHBondContact O-N 3.09Å; T37-L281 CarbonylContact C-O 3.54Å; T37-L281 WeakPolarHBondContact CA-O 3.48Å; L38-L281 PolarHBondContact N-O 3.17Å; Y101-L281 HydrophobicContact CD1-CD2 3.95Å; Y101-L281 HydrophobicContact CG-CD2 4.18Å; Y101-L281 WeakPolarHBondContact O-CA 3.31Å; N267-L281 HydrophobicContact CB-CD1 4.34Å; N267-L281 WeakPolarHBondContact ND2-CD1 3.42Å; P278-L281 HydrophobicContact CB-CD2 4.37Å; P278-L281 HydrophobicContact CG-CD2 4.18Å
282	V	98.9	Very high	96.5	Very high	1 Å²	1	30.1 Å²	30.1	1%	0.006	17%	0.17	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-124.7	130.1	179.6	-175.3	0	0	0	0	110.2	L38 Y40 Y101 V102 R103 L280	L38-V282 HydrophobicContact CB-CG1 4.46Å; L38-V282 HydrophobicContact CB-CG2 4.49Å; L38-V282 HydrophobicContact CD1-CG2 4.2Å; L38-V282 CarbonylContact O-C 3.55Å; Y40-V282 HydrophobicContact CD1-CG1 4.16Å; Y40-V282 HydrophobicContact CE1-CG1 3.17Å; Y40-V282 VanDerWaalsContact CZ-CG1 3.41Å; Y40-V282 WeakPolarHBondContact OH-CG1 3.4Å; Y101-V282 PolarHBondContact O-N 3.02Å; V102-V282 WeakPolarHBondContact CA-O 3.2Å; V102-V282 HydrophobicContact CB-CB 4.33Å; V102-V282 HydrophobicContact CG1-CB 4.04Å; V102-V282 HydrophobicContact CG1-CG1 4.18Å; V102-V282 HydrophobicContact CG2-CB 4.01Å; V102-V282 HydrophobicContact CG2-CG2 4.22Å; R103-V282 PolarHBondContact N-O 2.53Å; L280-V282 HydrophobicContact CD1-CG2 4.02Å; L280-V282 HydrophobicContact CD2-CG2 3.88Å; L280-V282 HydrophobicContact CG-CG2 3.73Å
283	Y	98.9	Very high	96.6	Very high	10 Å²	10	29.1 Å²	29.1	4%	0.039	16%	0.162	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-114.8	111.5	173	-63.1	-51.6	0	0	0	110	T37 L38 L39 Y40 R103 L151 L152 L260 N267	T37-Y283 HydrophobicContact CG2-CD2 3.84Å; T37-Y283 HydrophobicContact CG2-CE2 3.72Å; L38-Y283 PolarHBondContact O-N 3Å; L39-Y283 WeakPolarHBondContact CA-O 3.25Å; Y40-Y283 PolarHBondContact N-O 3.13Å; R103-Y283 HydrophobicContact CB-CD1 4.03Å; R103-Y283 HydrophobicContact CB-CE1 4.24Å; R103-Y283 CarbonylContact O-C 3.57Å; R103-Y283 VanDerWaalsContact O-CA 3.29Å; R103-Y283 WeakPolarHBondContact O-CA 3.47Å; L151-Y283 HydrophobicContact CD2-CE1 4.28Å; L152-Y283 HydrophobicContact CD1-CD1 3.8Å; L152-Y283 HydrophobicContact CD1-CG 4.19Å; L152-Y283 HydrophobicContact CD2-CD1 4Å; L152-Y283 HydrophobicContact CD2-CD2 4.43Å; L152-Y283 HydrophobicContact CD2-CG 3.83Å; L152-Y283 HydrophobicContact CG-CD1 4.38Å; L260-Y283 HydrophobicContact CD1-CD2 4.32Å; L260-Y283 HydrophobicContact CD1-CE2 4.18Å; N267-Y283 PolarHBondContact ND2-OH 3.04Å
284	S	98.9	Very high	96.8	Very high	0 Å²	0	24.7 Å²	24.7	0%	0	13%	0.134	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-94.4	118.3	172.8	-175.7	0	0	0	0	110.5	Y40 R103 S104 T105 T110	Y40-S284 VanDerWaalsContact CE2-CA 3.49Å; Y40-S284 VanDerWaalsContact CE2-OG 3.3Å; Y40-S284 WeakPolarHBondContact CE2-OG 3.35Å; R103-S284 PolarHBondContact O-N 3.23Å; S104-S284 VanDerWaalsContact CA-O 3.31Å; S104-S284 WeakPolarHBondContact CA-O 3.3Å; T105-S284 PolarHBondContact N-O 3.29Å; T110-S284 PolarHBondContact O-OG 3.37Å
285	A	98.9	Very high	97.2	Very high	0 Å²	0	22.5 Å²	22.5	0%	0	12%	0.12	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-153.5	-145.4	-169	0	0	0	0	0	112.8	L39 Y40 H42 T105 T110 L152 T289	L39-A285 HydrophobicContact CD1-CB 3.98Å; Y40-A285 CarbonylContact O-C 3.58Å; Y40-A285 PolarHBondContact O-N 3.47Å; H42-A285 PolarHBondContact N-O 3.39Å; T105-A285 HydrophobicContact CG2-CB 4.4Å; T110-A285 WeakPolarHBondContact CG2-O 3.28Å; L152-A285 HydrophobicContact CB-CB 4.16Å; A285-T289 HydrophobicContact CB-CG2 3.71Å; A285-T289 WeakPolarHBondContact CB-OG1 3.23Å
286	H	98.8	Very high	97.7	Very high	12 Å²	12	18.5 Å²	18.5	6%	0.056	9%	0.092	C	C	.	.			trans	-120.1	168.9	-168.7	-51.3	-75.2	0	0	0	111.7	H42 T105 F107 T288 T289 L290	H42-H286 AromaticContact CD2-ND1 3.75Å; T105-H286 PolarHBondContact OG1-NE2 2.92Å; F107-H286 AromaticContact CD2-CE1 3.56Å; F107-H286 AromaticContact CD2-NE2 3.52Å; F107-H286 AromaticContact CE2-CE1 3.95Å; F107-H286 AromaticContact CE2-NE2 3.68Å; H286-T288 VanDerWaalsContact C-N 3.31Å; H286-T289 PolarHBondContact N-OG1 3.29Å; H286-T289 VanDerWaalsContact N-OG1 3.15Å; H286-T289 VanDerWaalsContact O-CB 3.3Å; H286-T289 WeakPolarHBondContact O-CB 3.44Å; H286-T289 PolarHBondContact O-N 2.95Å; H286-T289 PolarHBondContact O-OG1 3.44Å; H286-L290 PolarHBondContact O-N 3.43Å
287	D	98.4	Very high	98.3	Very high	18 Å²	18	11.3 Å²	11.3	10%	0.096	6%	0.059	C	C	.	.	H	α-helix	trans	-58.3	-44	167.7	38.7	20.4	0	0	0	111.1	R41 F240 T289 L290 V291 Q304	R41-D287 HydrophobicContact CG-CB 4.38Å; R41-D287 IonicContact CZ-OD2 2.91Å; R41-D287 VanDerWaalsContact CZ-OD2 3.25Å; R41-D287 IonicContact NE-OD2 3.16Å; R41-D287 PolarHBondContact NE-OD2 2.89Å; R41-D287 IonicContact NH2-OD2 2.72Å; R41-D287 PolarHBondContact NH2-OD2 3.34Å; F240-D287 HydrophobicContact CZ-CB 4.18Å; D287-T289 PolarHBondContact O-N 2.99Å; D287-L290 PolarHBondContact O-N 3.08Å; D287-L290 VanDerWaalsContact O-N 3.12Å; D287-V291 VanDerWaalsContact O-CG2 3.29Å; D287-V291 WeakPolarHBondContact O-CG2 3.35Å; D287-V291 PolarHBondContact O-N 3.06Å; D287-Q304 HydrophobicContact CB-CG 4.2Å; D287-Q304 PolarHBondContact OD2-NE2 3.3Å
288	T	98.4	Very high	98.5	Very high	27 Å²	27	14 Å²	14	17%	0.166	7%	0.073	C	C	.	.	H	α-helix	trans	-54.7	-36.1	174.6	56.4	0	0	0	0	112.2	F154 F240 H286 A292	F154-T288 PolarHBondContact O-OG1 3.02Å; F154-T288 VanDerWaalsContact O-OG1 3.13Å; F240-T288 HydrophobicContact CE1-CG2 3.72Å; H286-T288 VanDerWaalsContact C-N 3.31Å; T288-A292 WeakPolarHBondContact O-CB 3.18Å; T288-A292 PolarHBondContact O-N 3.48Å
289	T	98.9	Very high	98.6	Very high	0 Å²	0	13.8 Å²	13.8	0%	0	7%	0.072	C	C	.	.	H	α-helix	trans	-67.4	-46	177.7	-40	0	0	0	0	112	L39 L152 F154 L260 A285 H286 D287 L293	L39-T289 HydrophobicContact CD1-CG2 3.77Å; L39-T289 HydrophobicContact CD2-CG2 4.12Å; L152-T289 HydrophobicContact CB-CG2 4.45Å; L152-T289 HydrophobicContact CD2-CG2 4.21Å; L152-T289 VanDerWaalsContact O-CG2 3.29Å; L152-T289 WeakPolarHBondContact O-CG2 3.25Å; L152-T289 PolarHBondContact O-OG1 3.44Å; F154-T289 HydrophobicContact CD2-CG2 3.75Å; F154-T289 HydrophobicContact CE2-CG2 3.76Å; L260-T289 HydrophobicContact CD2-CG2 3.91Å; A285-T289 HydrophobicContact CB-CG2 3.71Å; A285-T289 WeakPolarHBondContact CB-OG1 3.23Å; H286-T289 PolarHBondContact N-OG1 3.29Å; H286-T289 VanDerWaalsContact N-OG1 3.15Å; H286-T289 VanDerWaalsContact O-CB 3.3Å; H286-T289 WeakPolarHBondContact O-CB 3.44Å; H286-T289 PolarHBondContact O-N 2.95Å; H286-T289 PolarHBondContact O-OG1 3.44Å; D287-T289 PolarHBondContact O-N 2.99Å; T289-L293 WeakPolarHBondContact O-CB 3.14Å; T289-L293 PolarHBondContact O-N 3.32Å; T289-L293 VanDerWaalsContact O-N 3.12Å
290	L	98.8	Very high	98.7	Very high	1 Å²	1	12.3 Å²	12.3	1%	0.005	7%	0.065	C	C	.	.	H	α-helix	trans	-61.7	-48.4	175.3	-76.3	171.3	0	0	0	111.1	L39 R41 H286 D287 L293 Q294 A305 S309 H311 F329	L39-L290 HydrophobicContact CB-CD2 4.47Å; L39-L290 HydrophobicContact CD2-CD2 3.88Å; L39-L290 HydrophobicContact CD2-CG 4.47Å; L39-L290 HydrophobicContact CG-CD2 3.87Å; L39-L290 HydrophobicContact CG-CG 4.48Å; L39-L290 WeakPolarHBondContact O-CD2 3.47Å; R41-L290 HydrophobicContact CB-CD1 3.81Å; H286-L290 PolarHBondContact O-N 3.43Å; D287-L290 PolarHBondContact O-N 3.08Å; D287-L290 VanDerWaalsContact O-N 3.12Å; L290-L293 PolarHBondContact O-N 2.81Å; L290-Q294 WeakPolarHBondContact O-CB 3.2Å; L290-Q294 VanDerWaalsContact O-CG 3.25Å; L290-Q294 WeakPolarHBondContact O-CG 3.43Å; L290-Q294 PolarHBondContact O-N 3.45Å; L290-A305 HydrophobicContact CB-CB 4.27Å; L290-A305 HydrophobicContact CD1-CB 3.57Å; L290-S309 VanDerWaalsContact CD1-OG 3.3Å; L290-S309 WeakPolarHBondContact CD1-OG 3.26Å; L290-H311 HydrophobicContact CD2-CB 3.63Å; L290-F329 HydrophobicContact CD1-CE2 4.34Å; L290-F329 HydrophobicContact CD2-CE2 4.48Å
291	V	98.6	Very high	98.6	Very high	0 Å²	0	16.1 Å²	16.1	0%	0	9%	0.085	C	C	.	.	H	α-helix	trans	-62	-47.4	179.9	176.7	0	0	0	0	110.5	F240 F244 D287 L293 Q294 M295 Y300	F240-V291 HydrophobicContact CB-CG1 3.93Å; F240-V291 HydrophobicContact CD1-CB 4.14Å; F240-V291 HydrophobicContact CD1-CG1 4.01Å; F240-V291 HydrophobicContact CD1-CG2 3.92Å; F240-V291 HydrophobicContact CD2-CG2 4.42Å; F240-V291 HydrophobicContact CE1-CG2 4.15Å; F240-V291 HydrophobicContact CG-CG1 4.14Å; F240-V291 HydrophobicContact CG-CG2 4.08Å; F244-V291 HydrophobicContact CD2-CB 4.34Å; F244-V291 HydrophobicContact CD2-CG1 3.61Å; F244-V291 HydrophobicContact CE2-CB 4.3Å; F244-V291 HydrophobicContact CE2-CG1 4.02Å; D287-V291 VanDerWaalsContact O-CG2 3.29Å; D287-V291 WeakPolarHBondContact O-CG2 3.35Å; D287-V291 PolarHBondContact O-N 3.06Å; V291-L293 VanDerWaalsContact C-N 3.32Å; V291-L293 PolarHBondContact O-N 2.96Å; V291-Q294 PolarHBondContact O-N 3.17Å; V291-M295 HydrophobicContact CG1-CG 3.95Å; V291-M295 VanDerWaalsContact O-CB 3.26Å; V291-M295 WeakPolarHBondContact O-CB 3.49Å; V291-M295 WeakPolarHBondContact O-CG 3.48Å; V291-M295 PolarHBondContact O-N 3.2Å; V291-Y300 HydrophobicContact CB-CE2 4.32Å; V291-Y300 HydrophobicContact CG1-CD2 4.36Å; V291-Y300 HydrophobicContact CG1-CE1 4.3Å; V291-Y300 HydrophobicContact CG1-CE2 4.07Å; V291-Y300 HydrophobicContact CG2-CD2 4.4Å; V291-Y300 HydrophobicContact CG2-CE2 3.68Å
292	A	98.8	Very high	98.5	Very high	1 Å²	1	16.9 Å²	16.9	1%	0.008	10%	0.095	C	C	.	.	H	α-helix	trans	-56.7	-47.1	179.2	0	0	0	0	0	111.4	F154 F244 G257 T288 A296	F154-A292 HydrophobicContact CB-CB 4.2Å; F154-A292 HydrophobicContact CD1-CB 3.9Å; F154-A292 HydrophobicContact CD2-CB 4.09Å; F154-A292 HydrophobicContact CE1-CB 4.34Å; F154-A292 HydrophobicContact CE2-CB 4.46Å; F154-A292 HydrophobicContact CG-CB 3.77Å; F244-A292 HydrophobicContact CD1-CB 4.02Å; F244-A292 HydrophobicContact CD2-CB 4.45Å; F244-A292 HydrophobicContact CE1-CB 3.68Å; F244-A292 HydrophobicContact CE2-CB 4.13Å; F244-A292 HydrophobicContact CG-CB 4.39Å; F244-A292 HydrophobicContact CZ-CB 3.74Å; G257-A292 WeakPolarHBondContact CA-O 3.44Å; T288-A292 WeakPolarHBondContact O-CB 3.18Å; T288-A292 PolarHBondContact O-N 3.48Å; A292-A296 WeakPolarHBondContact O-CB 3.16Å; A292-A296 PolarHBondContact O-N 3.13Å; A292-A296 VanDerWaalsContact O-N 3.07Å
293	L	98.9	Very high	98.3	Very high	0 Å²	0	22.7 Å²	22.7	0%	0	12%	0.122	C	C	.	.	H	α-helix	trans	-64.7	-47.5	178	179.2	62.3	0	0	0	112.1	L39 L260 L261 I264 T289 L290 V291 M295 A296 L297 F313	L39-L293 HydrophobicContact CD2-CB 4.23Å; L39-L293 HydrophobicContact CD2-CD2 3.5Å; L260-L293 HydrophobicContact CD2-CB 4.37Å; L260-L293 HydrophobicContact CD2-CD2 4.28Å; L260-L293 HydrophobicContact CG-CD1 4.42Å; L261-L293 HydrophobicContact CB-CD1 3.98Å; L261-L293 HydrophobicContact CD1-CD1 4.39Å; I264-L293 HydrophobicContact CD1-CD1 3.93Å; I264-L293 HydrophobicContact CD1-CD2 3.82Å; T289-L293 WeakPolarHBondContact O-CB 3.14Å; T289-L293 PolarHBondContact O-N 3.32Å; T289-L293 VanDerWaalsContact O-N 3.12Å; L290-L293 PolarHBondContact O-N 2.81Å; V291-L293 VanDerWaalsContact C-N 3.32Å; V291-L293 PolarHBondContact O-N 2.96Å; L293-M295 VanDerWaalsContact C-N 3.32Å; L293-M295 PolarHBondContact O-N 3.12Å; L293-A296 WeakPolarHBondContact O-CB 3.26Å; L293-A296 PolarHBondContact O-N 3.06Å; L293-L297 HydrophobicContact CD1-CD1 3.91Å; L293-L297 HydrophobicContact CD1-CG 4.42Å; L293-L297 HydrophobicContact CG-CD1 3.82Å; L293-L297 WeakPolarHBondContact O-CG 3.49Å; L293-L297 PolarHBondContact O-N 3.46Å; L293-F313 HydrophobicContact CD2-CE2 3.85Å; L293-F313 HydrophobicContact CD2-CZ 4.01Å
294	Q	98.8	Very high	98.2	Very high	2 Å²	2	23.7 Å²	23.7	1%	0.009	13%	0.127	C	C	.	.	H	α-helix	trans	-68.1	-31.8	-177.9	-70.4	-179.9	4	0	0	112.5	L290 V291 L297 D298 V299 Y300 H311 F329	L290-Q294 WeakPolarHBondContact O-CB 3.2Å; L290-Q294 VanDerWaalsContact O-CG 3.25Å; L290-Q294 WeakPolarHBondContact O-CG 3.43Å; L290-Q294 PolarHBondContact O-N 3.45Å; V291-Q294 PolarHBondContact O-N 3.17Å; Q294-L297 PolarHBondContact O-N 3.39Å; Q294-D298 PolarHBondContact O-N 2.83Å; Q294-V299 HydrophobicContact CB-CG2 4.13Å; Q294-V299 HydrophobicContact CG-CG2 4.21Å; Q294-V299 PolarHBondContact O-N 2.75Å; Q294-Y300 HydrophobicContact CB-CD2 4.34Å; Q294-Y300 PolarHBondContact O-N 3.39Å; Q294-H311 PolarHBondContact NE2-ND1 3.17Å; Q294-F329 VanDerWaalsContact NE2-CD2 3.33Å
295	M	98.6	Very high	98	Very high	15 Å²	15	23.8 Å²	23.8	7%	0.074	13%	0.128	C	C	.	.	H	α-helix	trans	-70.1	-36.6	172.1	-72.3	-70.3	-69.2	0	0	111.9	F244 Q249 V291 L293 L297 D298 Y300	F244-M295 HydrophobicContact CB-CB 3.89Å; F244-M295 HydrophobicContact CB-CE 4.32Å; F244-M295 HydrophobicContact CB-CG 3.91Å; Q249-M295 HydrophobicContact CG-CE 4.33Å; Q249-M295 PolarHBondContact NE2-O 2.71Å; Q249-M295 VanDerWaalsContact NE2-O 3.1Å; V291-M295 HydrophobicContact CG1-CG 3.95Å; V291-M295 VanDerWaalsContact O-CB 3.26Å; V291-M295 WeakPolarHBondContact O-CB 3.49Å; V291-M295 WeakPolarHBondContact O-CG 3.48Å; V291-M295 PolarHBondContact O-N 3.2Å; L293-M295 VanDerWaalsContact C-N 3.32Å; L293-M295 PolarHBondContact O-N 3.12Å; M295-L297 VanDerWaalsContact C-N 3.34Å; M295-D298 PolarHBondContact O-N 3.3Å; M295-Y300 HydrophobicContact CG-CD1 4.07Å; M295-Y300 HydrophobicContact CG-CG 4.1Å; M295-Y300 HydrophobicContact SD-CD1 3.37Å; M295-Y300 WeakPolarHBondContact SD-CD1 3.23Å; M295-Y300 HydrophobicContact SD-CE1 4.3Å; M295-Y300 HydrophobicContact SD-CG 3.81Å
296	A	98.8	Very high	98	Very high	5 Å²	5	26.4 Å²	26.4	4%	0.041	15%	0.145	C	C	.	.	H	α-helix	trans	-66.5	-37.3	173.5	0	0	0	0	0	112.1	A253 L261 A292 L293 D298 V361	A253-A296 HydrophobicContact CB-CB 3.79Å; L261-A296 HydrophobicContact CD2-CB 4.4Å; A292-A296 WeakPolarHBondContact O-CB 3.16Å; A292-A296 PolarHBondContact O-N 3.13Å; A292-A296 VanDerWaalsContact O-N 3.07Å; L293-A296 WeakPolarHBondContact O-CB 3.26Å; L293-A296 PolarHBondContact O-N 3.06Å; A296-D298 VanDerWaalsContact C-N 3.28Å; A296-V361 WeakPolarHBondContact O-CG2 3.47Å
297	L	98.8	Very high	97.9	Very high	3 Å²	3	27.1 Å²	27.1	2%	0.016	15%	0.148	C	C	.	.	T	Hydrogen-bonded Turn	trans	-78.9	-9.3	175	-71.5	162.2	0	0	0	113.7	L261 L293 Q294 M295 V299 F313 M327 L342 F354 T358	L261-L297 HydrophobicContact CD1-CD2 3.69Å; L261-L297 HydrophobicContact CD1-CG 4.3Å; L261-L297 HydrophobicContact CD2-CD2 3.89Å; L261-L297 HydrophobicContact CD2-CG 4.2Å; L261-L297 HydrophobicContact CG-CD2 4.46Å; L293-L297 HydrophobicContact CD1-CD1 3.91Å; L293-L297 HydrophobicContact CD1-CG 4.42Å; L293-L297 HydrophobicContact CG-CD1 3.82Å; L293-L297 WeakPolarHBondContact O-CG 3.49Å; L293-L297 PolarHBondContact O-N 3.46Å; Q294-L297 PolarHBondContact O-N 3.39Å; M295-L297 VanDerWaalsContact C-N 3.34Å; L297-V299 VanDerWaalsContact C-N 3.31Å; L297-V299 HydrophobicContact CB-CG1 4.39Å; L297-V299 HydrophobicContact CB-CG2 3.76Å; L297-V299 HydrophobicContact CD1-CG2 4.46Å; L297-V299 PolarHBondContact O-N 2.86Å; L297-F313 HydrophobicContact CD1-CE1 4.17Å; L297-F313 HydrophobicContact CD1-CZ 3.75Å; L297-M327 HydrophobicContact CD1-SD 4.08Å; L297-M327 HydrophobicContact CD2-SD 4.18Å; L297-L342 HydrophobicContact CB-CD1 4.38Å; L297-L342 HydrophobicContact CD2-CD1 3.95Å; L297-L342 VanDerWaalsContact O-CD1 3.26Å; L297-L342 WeakPolarHBondContact O-CD1 3.42Å; L297-F354 HydrophobicContact CD2-CE2 4.22Å; L297-F354 HydrophobicContact CD2-CZ 4.13Å; L297-T358 HydrophobicContact CD2-CG2 4Å
298	D	98.3	Very high	98	Very high	99 Å²	99	26.5 Å²	26.5	53%	0.529	15%	0.145	S	C	.	.	T	Hydrogen-bonded Turn	trans	55.5	42.8	-173.5	-159.1	43.1	0	0	0	113.6	Q249 Q294 M295 A296 P343	Q249-D298 PolarHBondContact NE2-OD1 2.87Å; Q294-D298 PolarHBondContact O-N 2.83Å; M295-D298 PolarHBondContact O-N 3.3Å; A296-D298 VanDerWaalsContact C-N 3.28Å; D298-P343 HydrophobicContact CB-CG 4.07Å
299	V	98.4	Very high	98	Very high	22 Å²	22	25.3 Å²	25.3	13%	0.133	14%	0.137	C	C	.	.			trans	-126	9.8	178	-59.4	0	0	0	0	113.1	Q294 L297 M327 L340	Q294-V299 HydrophobicContact CB-CG2 4.13Å; Q294-V299 HydrophobicContact CG-CG2 4.21Å; Q294-V299 PolarHBondContact O-N 2.75Å; L297-V299 VanDerWaalsContact C-N 3.31Å; L297-V299 HydrophobicContact CB-CG1 4.39Å; L297-V299 HydrophobicContact CB-CG2 3.76Å; L297-V299 HydrophobicContact CD1-CG2 4.46Å; L297-V299 PolarHBondContact O-N 2.86Å; V299-M327 HydrophobicContact CG1-CE 4.37Å; V299-L340 HydrophobicContact CB-CD1 4.46Å; V299-L340 HydrophobicContact CG2-CD1 4.03Å
300	Y	98.2	Very high	98	Very high	33 Å²	33	25.3 Å²	25.3	13%	0.129	14%	0.137	C	C	.	.			trans	-68.4	131.5	177.6	-179.5	-122.6	0	0	0	110.9	V291 Q294 M295 G302 E303	V291-Y300 HydrophobicContact CB-CE2 4.32Å; V291-Y300 HydrophobicContact CG1-CD2 4.36Å; V291-Y300 HydrophobicContact CG1-CE1 4.3Å; V291-Y300 HydrophobicContact CG1-CE2 4.07Å; V291-Y300 HydrophobicContact CG2-CD2 4.4Å; V291-Y300 HydrophobicContact CG2-CE2 3.68Å; Q294-Y300 HydrophobicContact CB-CD2 4.34Å; Q294-Y300 PolarHBondContact O-N 3.39Å; M295-Y300 HydrophobicContact CG-CD1 4.07Å; M295-Y300 HydrophobicContact CG-CG 4.1Å; M295-Y300 HydrophobicContact SD-CD1 3.37Å; M295-Y300 WeakPolarHBondContact SD-CD1 3.23Å; M295-Y300 HydrophobicContact SD-CE1 4.3Å; M295-Y300 HydrophobicContact SD-CG 3.81Å; Y300-G302 VanDerWaalsContact C-N 3.3Å; Y300-G302 VanDerWaalsContact CZ-C 3.46Å; Y300-G302 PolarHBondContact O-N 2.83Å; Y300-E303 VanDerWaalsContact CE2-O 3.22Å; Y300-E303 WeakPolarHBondContact CE2-O 3.3Å; Y300-E303 PolarHBondContact OH-N 3.13Å; Y300-E303 PolarHBondContact OH-O 2.9Å
301	N	96.4	Very high	98	Very high	80 Å²	80	25.2 Å²	25.2	43%	0.428	14%	0.137	S	C	.	.			trans	-83	-3.5	-176.7	68.9	-11.5	0	0	0	113.9	E303	N301-E303 PolarHBondContact OD1-N 3.28Å; N301-E303 PolarHBondContact OD1-O 3.2Å
302	G	96.4	Very high	98	Very high	25 Å²	25	25.3 Å²	25.3	26%	0.258	14%	0.137	S	C	.	.	S	Bend	trans	93.6	-4.3	-179.4	0	0	0	0	0	115	D237 Y300	D237-G302 WeakPolarHBondContact CB-O 3.33Å; Y300-G302 VanDerWaalsContact C-N 3.3Å; Y300-G302 VanDerWaalsContact CZ-C 3.46Å; Y300-G302 PolarHBondContact O-N 2.83Å
303	E	96.3	Very high	98	Very high	123 Å²	123	25.2 Å²	25.2	58%	0.575	14%	0.137	S	C	*	.	S	Bend	trans	-120.9	142.8	-173.2	-61.6	-179	164.9	0	0	112.4	D237 Y300 N301 A305	D237-E303 WeakPolarHBondContact OD1-CA 3.47Å; Y300-E303 VanDerWaalsContact CE2-O 3.22Å; Y300-E303 WeakPolarHBondContact CE2-O 3.3Å; Y300-E303 PolarHBondContact OH-N 3.13Å; Y300-E303 PolarHBondContact OH-O 2.9Å; N301-E303 PolarHBondContact OD1-N 3.28Å; N301-E303 PolarHBondContact OD1-O 3.2Å; E303-A305 PolarHBondContact O-N 3.12Å
304	Q	95.6	Very high	98	Very high	31 Å²	31	25.3 Å²	25.3	15%	0.145	14%	0.137	C	C	.	.	P	Polyproline II helix	trans	-54.1	126.1	173.9	-177.2	-179.7	29.8	0	0	110.7	K236 D237 F240 D287 P306	K236-Q304 HydrophobicContact CD-CB 3.93Å; K236-Q304 HydrophobicContact CD-CG 4.29Å; D237-Q304 PolarHBondContact OD1-N 3.14Å; F240-Q304 HydrophobicContact CD2-CB 4.37Å; F240-Q304 HydrophobicContact CE2-CB 3.79Å; F240-Q304 HydrophobicContact CE2-CG 3.68Å; F240-Q304 HydrophobicContact CZ-CG 4.21Å; D287-Q304 HydrophobicContact CB-CG 4.2Å; D287-Q304 PolarHBondContact OD2-NE2 3.3Å; Q304-P306 WeakPolarHBondContact O-CD 3.29Å
305	A	95.9	Very high	98	Very high	2 Å²	2	25.2 Å²	25.2	2%	0.017	14%	0.137	C	C	.	.	P	Polyproline II helix	trans	-60	124.2	176.6	0	0	0	0	0	110.8	R41 L290 E303 S309 F329	R41-A305 VanDerWaalsContact CD-O 3.3Å; R41-A305 WeakPolarHBondContact CD-O 3.29Å; R41-A305 PolarHBondContact NH1-O 2.81Å; L290-A305 HydrophobicContact CB-CB 4.27Å; L290-A305 HydrophobicContact CD1-CB 3.57Å; E303-A305 PolarHBondContact O-N 3.12Å; A305-S309 WeakPolarHBondContact CB-OG 3.08Å; A305-F329 HydrophobicContact CB-CE2 4.46Å; A305-F329 HydrophobicContact CB-CZ 3.85Å
306	P	97.2	Very high	98	Very high	56 Å²	56	25.8 Å²	25.8	36%	0.364	14%	0.138	S	C	.	.	P	Polyproline II helix	trans	-58.7	164.9	177.9	-26.6	36.2	0	0	0	113.4	R41 Q304 S309 N331	R41-P306 WeakPolarHBondContact CD-O 3.41Å; Q304-P306 WeakPolarHBondContact O-CD 3.29Å; P306-S309 WeakPolarHBondContact O-CB 3.44Å; P306-S309 PolarHBondContact O-N 3.21Å; P306-S309 PolarHBondContact O-OG 2.87Å; P306-N331 HydrophobicContact CG-CB 4.35Å
307	Y	98.6	Very high	97.9	Very high	27 Å²	27	28 Å²	28	11%	0.106	15%	0.148	C	C	.	.	T	Hydrogen-bonded Turn	trans	-56.4	144.4	173.3	-68.9	-50	0	0	0	111.6	R41 H42 G43 D44 R45 F211 S309	R41-Y307 VanDerWaalsContact CZ-CD1 3.43Å; R41-Y307 VanDerWaalsContact CZ-CE1 3.42Å; R41-Y307 VanDerWaalsContact NH2-CE1 3.26Å; H42-Y307 AromaticContact CE1-CE1 3.81Å; G43-Y307 VanDerWaalsContact O-CD1 3.28Å; G43-Y307 WeakPolarHBondContact O-CD1 3.33Å; D44-Y307 VanDerWaalsContact CA-CD2 3.46Å; D44-Y307 HydrophobicContact CB-CD2 3.73Å; D44-Y307 HydrophobicContact CB-CE2 4.01Å; D44-Y307 HydrophobicContact CB-CG 4.26Å; D44-Y307 WeakPolarHBondContact OD2-CE2 3.34Å; R45-Y307 HydrophobicContact CG-CE1 3.99Å; F211-Y307 HydrophobicContact CE1-CD2 4.42Å; F211-Y307 AromaticContact CE1-CE2 3.65Å; F211-Y307 HydrophobicContact CE1-CE2 3.65Å; F211-Y307 HydrophobicContact CZ-CE2 4.43Å; Y307-S309 PolarHBondContact O-N 3.22Å
308	A	98.6	Very high	97.8	Very high	4 Å²	4	29.1 Å²	29.1	3%	0.033	15%	0.153	C	C	.	.	T	Hydrogen-bonded Turn	trans	53.4	19	-175.2	0	0	0	0	0	115.4	R41 H42 Q75 L79	R41-A308 WeakPolarHBondContact O-CA 3.31Å; H42-A308 PolarHBondContact O-N 2.93Å; Q75-A308 HydrophobicContact CB-CB 3.83Å; L79-A308 WeakPolarHBondContact CD2-O 3.15Å
309	S	98.6	Very high	97.5	Very high	2 Å²	2	29 Å²	29	1%	0.014	15%	0.152	C	C	.	.			trans	-67.6	146.1	170.5	57.7	0	0	0	0	110.9	Y40 R41 L290 A305 P306 Y307 R330	Y40-S309 WeakPolarHBondContact CA-O 3.39Å; Y40-S309 WeakPolarHBondContact CB-O 3.38Å; R41-S309 PolarHBondContact N-O 3.29Å; L290-S309 VanDerWaalsContact CD1-OG 3.3Å; L290-S309 WeakPolarHBondContact CD1-OG 3.26Å; A305-S309 WeakPolarHBondContact CB-OG 3.08Å; P306-S309 WeakPolarHBondContact O-CB 3.44Å; P306-S309 PolarHBondContact O-N 3.21Å; P306-S309 PolarHBondContact O-OG 2.87Å; Y307-S309 PolarHBondContact O-N 3.22Å; S309-R330 CarbonylContact C-O 3.56Å; S309-R330 WeakPolarHBondContact CA-O 3.44Å; S309-R330 WeakPolarHBondContact CB-O 3.34Å
310	C	98.9	Very high	97.2	Very high	0 Å²	0	31.7 Å²	31.7	0%	0	17%	0.172	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-136.5	122.4	-171	-174	0	0	0	0	111.1	L39 L79 F329 R330	L39-C310 CarbonylContact O-C 3.59Å; L39-C310 WeakPolarHBondContact O-CA 3.42Å; L79-C310 HydrophobicContact CD1-CB 4.11Å; L79-C310 HydrophobicContact CD2-CB 4.25Å; C310-F329 WeakPolarHBondContact O-CA 3.08Å; C310-R330 HydrophobicContact CB-CB 4.44Å; C310-R330 PolarHBondContact N-O 2.65Å; C310-R330 PolarHBondContact O-N 2.79Å
311	H	98.9	Very high	96.9	Very high	0 Å²	0	31.9 Å²	31.9	0%	0	18%	0.184	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-92.4	131.8	167.3	-169.3	105.6	0	0	0	109.3	L39 L290 Q294 F313 Y328 F329 L340	L39-H311 PolarHBondContact N-O 3.44Å; L39-H311 PolarHBondContact O-N 3.45Å; L290-H311 HydrophobicContact CD2-CB 3.63Å; Q294-H311 PolarHBondContact NE2-ND1 3.17Å; H311-F313 AromaticContact CD2-CD2 3.82Å; H311-F313 AromaticContact CD2-CE2 3.18Å; H311-F313 WeakPolarHBondContact CD2-CE2 3.02Å; H311-F313 AromaticContact CD2-CZ 3.55Å; H311-F313 AromaticContact NE2-CE1 3.88Å; H311-F313 AromaticContact NE2-CE2 3.44Å; H311-F313 WeakPolarHBondContact NE2-CE2 3.4Å; H311-F313 AromaticContact NE2-CZ 3.23Å; H311-F313 WeakPolarHBondContact NE2-CZ 3.4Å; H311-Y328 CarbonylContact C-O 3.58Å; H311-Y328 WeakPolarHBondContact CA-O 3.35Å; H311-F329 HydrophobicContact CB-CD2 4.26Å; H311-L340 WeakPolarHBondContact CE1-CD1 3.4Å
312	I	98.9	Very high	96.9	Very high	1 Å²	1	33.4 Å²	33.4	1%	0.005	19%	0.192	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-123.6	130	-167.7	-55.6	179.4	0	0	0	108.6	V36 L38 L83 Y87 E314 M327 Y328 P337	V36-I312 HydrophobicContact CG1-CG2 4.44Å; L38-I312 HydrophobicContact CD2-CB 4.23Å; L38-I312 HydrophobicContact CD2-CD1 4.42Å; L38-I312 HydrophobicContact CD2-CG1 3.84Å; L38-I312 HydrophobicContact CD2-CG2 3.92Å; L83-I312 HydrophobicContact CD2-CD1 4.48Å; Y87-I312 WeakPolarHBondContact OH-CG2 3.33Å; I312-E314 HydrophobicContact CG2-CG 3.93Å; I312-M327 CarbonylContact O-C 3.57Å; I312-M327 VanDerWaalsContact O-CA 3.25Å; I312-M327 WeakPolarHBondContact O-CA 3.17Å; I312-Y328 HydrophobicContact CG2-CD2 4.43Å; I312-Y328 PolarHBondContact N-O 3.12Å; I312-Y328 PolarHBondContact O-N 3.24Å; I312-P337 HydrophobicContact CD1-CB 4.39Å; I312-P337 HydrophobicContact CD1-CG 4.24Å
313	F	98.9	Very high	96.9	Very high	0 Å²	0	33.9 Å²	33.9	0%	0	19%	0.187	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-111.7	130.8	164.6	-61.3	-97.9	0	0	0	109.4	V36 T37 I264 L293 L297 H311 V325 M327 F354	V36-F313 VanDerWaalsContact CA-O 3.3Å; V36-F313 WeakPolarHBondContact CA-O 3.1Å; T37-F313 PolarHBondContact N-O 2.91Å; T37-F313 PolarHBondContact O-N 3.39Å; I264-F313 HydrophobicContact CD1-CD2 4.33Å; I264-F313 HydrophobicContact CD1-CE2 3.69Å; I264-F313 HydrophobicContact CD1-CZ 4Å; I264-F313 HydrophobicContact CG2-CD1 4.08Å; I264-F313 HydrophobicContact CG2-CD2 4.26Å; I264-F313 HydrophobicContact CG2-CE1 4.18Å; I264-F313 HydrophobicContact CG2-CE2 4.36Å; I264-F313 HydrophobicContact CG2-CG 4.14Å; I264-F313 HydrophobicContact CG2-CZ 4.32Å; L293-F313 HydrophobicContact CD2-CE2 3.85Å; L293-F313 HydrophobicContact CD2-CZ 4.01Å; L297-F313 HydrophobicContact CD1-CE1 4.17Å; L297-F313 HydrophobicContact CD1-CZ 3.75Å; H311-F313 AromaticContact CD2-CD2 3.82Å; H311-F313 AromaticContact CD2-CE2 3.18Å; H311-F313 WeakPolarHBondContact CD2-CE2 3.02Å; H311-F313 AromaticContact CD2-CZ 3.55Å; H311-F313 AromaticContact NE2-CE1 3.88Å; H311-F313 AromaticContact NE2-CE2 3.44Å; H311-F313 WeakPolarHBondContact NE2-CE2 3.4Å; H311-F313 AromaticContact NE2-CZ 3.23Å; H311-F313 WeakPolarHBondContact NE2-CZ 3.4Å; F313-V325 HydrophobicContact CD1-CG1 4.26Å; F313-M327 HydrophobicContact CD1-CG 3.66Å; F313-M327 HydrophobicContact CD1-SD 4.02Å; F313-M327 HydrophobicContact CE1-CG 3.71Å; F313-M327 HydrophobicContact CE1-SD 3.42Å; F313-M327 WeakPolarHBondContact CE1-SD 3.44Å; F313-M327 HydrophobicContact CZ-SD 4.18Å; F313-F354 HydrophobicContact CD1-CZ 4.38Å; F313-F354 HydrophobicContact CE1-CE2 4.42Å; F313-F354 HydrophobicContact CE1-CZ 4Å
314	E	98.9	Very high	97.1	Very high	1 Å²	1	28.2 Å²	28.2	1%	0.005	16%	0.161	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-121.4	124.2	175.5	-71.9	173.2	-178.2	0	0	109.3	L33 V36 R86 Y87 I312 Y316 V325 E326 Y328	L33-E314 HydrophobicContact CD1-CB 3.75Å; L33-E314 HydrophobicContact CD1-CG 4.04Å; V36-E314 HydrophobicContact CG2-CG 4.27Å; R86-E314 IonicContact CZ-OE1 2.87Å; R86-E314 IonicContact NE-OE1 3.25Å; R86-E314 PolarHBondContact NE-OE1 3.32Å; R86-E314 VanDerWaalsContact NH2-CD 3.29Å; R86-E314 IonicContact NH2-OE1 3.27Å; R86-E314 PolarHBondContact NH2-OE1 3.21Å; R86-E314 IonicContact NH2-OE2 2.65Å; R86-E314 PolarHBondContact NH2-OE2 3.25Å; Y87-E314 HydrophobicContact CE1-CG 4.38Å; Y87-E314 VanDerWaalsContact CE1-OE1 3.26Å; Y87-E314 WeakPolarHBondContact CE1-OE1 3.41Å; Y87-E314 PolarHBondContact OH-OE1 3.37Å; I312-E314 HydrophobicContact CG2-CG 3.93Å; E314-Y316 HydrophobicContact CB-CD2 4.17Å; E314-Y316 HydrophobicContact CB-CE2 3.47Å; E314-Y316 VanDerWaalsContact CB-CE2 3.47Å; E314-Y316 HydrophobicContact CG-CE2 4.47Å; E314-Y316 PolarHBondContact OE2-OH 3.3Å; E314-V325 WeakPolarHBondContact O-CA 3.38Å; E314-E326 PolarHBondContact N-O 3.36Å; E314-E326 PolarHBondContact O-N 3.03Å; E314-Y328 WeakPolarHBondContact OE2-CE2 3.28Å
315	L	98.8	Very high	97.2	Very high	0 Å²	0	26.9 Å²	26.9	0%	0	16%	0.155	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-99	117.3	174.3	-176	73	0	0	0	109.1	R34 F35 L268 M271 A272 F323 S324 V325 L351	R34-L315 PolarHBondContact N-O 2.9Å; F35-L315 HydrophobicContact CB-CB 3.98Å; F35-L315 HydrophobicContact CB-CD2 4.13Å; F35-L315 HydrophobicContact CD1-CB 4.47Å; F35-L315 PolarHBondContact N-O 3.27Å; F35-L315 PolarHBondContact O-N 3.47Å; L268-L315 HydrophobicContact CD2-CB 3.82Å; L268-L315 HydrophobicContact CD2-CD1 4.05Å; L268-L315 HydrophobicContact CD2-CD2 4.45Å; L268-L315 HydrophobicContact CD2-CG 4.32Å; M271-L315 HydrophobicContact CB-CD2 3.81Å; A272-L315 HydrophobicContact CB-CD2 4.43Å; L315-F323 HydrophobicContact CD1-CB 4.02Å; L315-F323 HydrophobicContact CD1-CD1 4.11Å; L315-F323 HydrophobicContact CD1-CG 4.46Å; L315-F323 HydrophobicContact CD2-CD1 4.01Å; L315-F323 HydrophobicContact CD2-CE1 4.35Å; L315-F323 HydrophobicContact CG-CD1 3.89Å; L315-S324 WeakPolarHBondContact CA-O 3.39Å; L315-V325 HydrophobicContact CD1-CG2 4Å; L315-L351 HydrophobicContact CD1-CD1 4.26Å; L315-L351 HydrophobicContact CD1-CD2 4.26Å
316	Y	98.4	Very high	97.3	Very high	27 Å²	27	26.9 Å²	26.9	11%	0.106	16%	0.155	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-104	141.8	176	-68.3	-89.6	0	0	0	110.5	R31 S32 L33 E314 F323 S324 E326	R31-Y316 HydrophobicContact CG-CD1 3.98Å; S32-Y316 CarbonylContact O-C 3.6Å; S32-Y316 WeakPolarHBondContact O-CA 3.4Å; L33-Y316 HydrophobicContact CB-CD1 4.15Å; L33-Y316 HydrophobicContact CB-CE1 3.84Å; L33-Y316 HydrophobicContact CD1-CD1 4.31Å; L33-Y316 HydrophobicContact CD1-CD2 4.48Å; L33-Y316 HydrophobicContact CD1-CE1 3.95Å; L33-Y316 HydrophobicContact CD1-CE2 4.14Å; L33-Y316 HydrophobicContact CG-CE1 4.45Å; E314-Y316 HydrophobicContact CB-CD2 4.17Å; E314-Y316 HydrophobicContact CB-CE2 3.47Å; E314-Y316 VanDerWaalsContact CB-CE2 3.47Å; E314-Y316 HydrophobicContact CG-CE2 4.47Å; E314-Y316 PolarHBondContact OE2-OH 3.3Å; Y316-F323 CarbonylContact O-C 3.58Å; Y316-F323 WeakPolarHBondContact O-CA 3.36Å; Y316-F323 WeakPolarHBondContact O-CD1 3.31Å; Y316-S324 PolarHBondContact N-O 3.23Å; Y316-S324 PolarHBondContact O-N 2.8Å; Y316-E326 HydrophobicContact CD2-CG 4.22Å; Y316-E326 HydrophobicContact CE2-CB 4.19Å; Y316-E326 HydrophobicContact CE2-CG 4.13Å; Y316-E326 VanDerWaalsContact CE2-OE2 3.32Å; Y316-E326 WeakPolarHBondContact CE2-OE2 3.25Å
317	Q	97.6	Very high	97.4	Very high	51 Å²	51	24.5 Å²	24.5	24%	0.238	14%	0.139	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-96.5	121.4	160.9	-172.6	177.9	29.8	0	0	108.5	R31 S32 R34 F323	R31-Q317 WeakPolarHBondContact CA-O 3.3Å; S32-Q317 PolarHBondContact N-O 3.29Å; S32-Q317 PolarHBondContact O-N 2.63Å; R34-Q317 HydrophobicContact CG-CB 3.71Å; Q317-F323 HydrophobicContact CB-CD1 4.03Å; Q317-F323 HydrophobicContact CB-CE1 3.71Å; Q317-F323 HydrophobicContact CB-CZ 4.19Å; Q317-F323 HydrophobicContact CG-CD1 4.5Å; Q317-F323 HydrophobicContact CG-CE1 4.08Å; Q317-F323 HydrophobicContact CG-CE2 4.46Å; Q317-F323 HydrophobicContact CG-CZ 4.05Å
318	E	95.9	Very high	97.4	Very high	27 Å²	27	24.6 Å²	24.6	13%	0.126	14%	0.139	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-82.9	161.2	179.7	-54.1	-58.8	161	0	0	111.1	S320 G321 N322 S324	E318-S320 PolarHBondContact O-N 2.71Å; E318-G321 WeakPolarHBondContact O-CA 3.11Å; E318-G321 PolarHBondContact O-N 2.73Å; E318-N322 PolarHBondContact N-O 3.2Å; E318-S324 WeakPolarHBondContact OE1-CB 3.35Å; E318-S324 PolarHBondContact OE1-OG 3.45Å
319	D	92.6	Very high	97.4	Very high	96 Å²	96	24.8 Å²	24.8	51%	0.513	14%	0.14	S	C	.	.	T	Hydrogen-bonded Turn	trans	-53.2	-29.8	175.7	-80.3	-30.4	0	0	0	114	Q29 A30 G321	Q29-D319 VanDerWaalsContact C-OD2 3.29Å; Q29-D319 VanDerWaalsContact CA-OD2 3.25Å; Q29-D319 WeakPolarHBondContact CA-OD2 3.29Å; Q29-D319 HydrophobicContact CG-CB 3.98Å; Q29-D319 WeakPolarHBondContact CG-OD2 3.09Å; A30-D319 WeakPolarHBondContact CB-OD1 3.44Å; A30-D319 PolarHBondContact N-OD2 2.75Å; A30-D319 PolarHBondContact O-N 2.85Å; D319-G321 PolarHBondContact O-N 2.76Å
320	S	91.4	Very high	97.4	Very high	80 Å²	80	25.7 Å²	25.7	56%	0.559	14%	0.143	S	C	*	.	T	Hydrogen-bonded Turn	trans	-67.8	-9.3	176.1	63	0	0	0	0	113.8	E318 N322	E318-S320 PolarHBondContact O-N 2.71Å; S320-N322 PolarHBondContact O-N 3.45Å; S320-N322 WeakPolarHBondContact OG-CB 3.36Å; S320-N322 PolarHBondContact OG-N 2.77Å
321	G	92.2	Very high	97.3	Very high	36 Å²	36	27.5 Å²	27.5	37%	0.371	15%	0.152	S	C	.	.	S	Bend	trans	84.8	-14.1	-169.6	0	0	0	0	0	113.7	E318 D319	E318-G321 WeakPolarHBondContact O-CA 3.11Å; E318-G321 PolarHBondContact O-N 2.73Å; D319-G321 PolarHBondContact O-N 2.76Å
322	N	95.7	Very high	97	Very high	112 Å²	112	30.4 Å²	30.4	60%	0.599	17%	0.166	S	C	*	.			trans	-72.6	165.9	175.3	-66.4	-28.7	0	0	0	112	E318 S320	E318-N322 PolarHBondContact N-O 3.2Å; S320-N322 PolarHBondContact O-N 3.45Å; S320-N322 WeakPolarHBondContact OG-CB 3.36Å; S320-N322 PolarHBondContact OG-N 2.77Å
323	F	98.1	Very high	96.5	Very high	35 Å²	35	33.7 Å²	33.7	15%	0.154	19%	0.189	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-113	146.3	179.8	-69.4	-94.6	0	0	0	112.3	R34 A272 L315 Y316 Q317 L351	R34-F323 HydrophobicContact CB-CE1 4.41Å; R34-F323 HydrophobicContact CG-CE1 4.06Å; A272-F323 HydrophobicContact CB-CB 4.45Å; A272-F323 HydrophobicContact CB-CD1 4.08Å; A272-F323 HydrophobicContact CB-CD2 3.67Å; A272-F323 HydrophobicContact CB-CE1 4.2Å; A272-F323 HydrophobicContact CB-CE2 3.83Å; A272-F323 HydrophobicContact CB-CG 3.81Å; A272-F323 HydrophobicContact CB-CZ 4.09Å; A272-F323 VanDerWaalsContact O-CE2 3.25Å; A272-F323 WeakPolarHBondContact O-CE2 3.35Å; A272-F323 WeakPolarHBondContact O-CZ 3.32Å; L315-F323 HydrophobicContact CD1-CB 4.02Å; L315-F323 HydrophobicContact CD1-CD1 4.11Å; L315-F323 HydrophobicContact CD1-CG 4.46Å; L315-F323 HydrophobicContact CD2-CD1 4.01Å; L315-F323 HydrophobicContact CD2-CE1 4.35Å; L315-F323 HydrophobicContact CG-CD1 3.89Å; Y316-F323 CarbonylContact O-C 3.58Å; Y316-F323 WeakPolarHBondContact O-CA 3.36Å; Y316-F323 WeakPolarHBondContact O-CD1 3.31Å; Q317-F323 HydrophobicContact CB-CD1 4.03Å; Q317-F323 HydrophobicContact CB-CE1 3.71Å; Q317-F323 HydrophobicContact CB-CZ 4.19Å; Q317-F323 HydrophobicContact CG-CD1 4.5Å; Q317-F323 HydrophobicContact CG-CE1 4.08Å; Q317-F323 HydrophobicContact CG-CE2 4.46Å; Q317-F323 HydrophobicContact CG-CZ 4.05Å; F323-L351 HydrophobicContact CB-CB 3.95Å; F323-L351 HydrophobicContact CB-CD2 3.97Å; F323-L351 WeakPolarHBondContact O-CB 3.33Å; F323-L351 PolarHBondContact O-N 2.86Å
324	S	98.4	Very high	96	Very high	5 Å²	5	40.2 Å²	40.2	4%	0.035	22%	0.224	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-128	155.8	170.7	75.6	0	0	0	0	111	L315 Y316 E318 C349	L315-S324 WeakPolarHBondContact CA-O 3.39Å; Y316-S324 PolarHBondContact N-O 3.23Å; Y316-S324 PolarHBondContact O-N 2.8Å; E318-S324 WeakPolarHBondContact OE1-CB 3.35Å; E318-S324 PolarHBondContact OE1-OG 3.45Å; S324-C349 CarbonylContact C-O 3.28Å; S324-C349 VanDerWaalsContact CA-O 3.24Å; S324-C349 WeakPolarHBondContact CA-O 3.48Å; S324-C349 WeakPolarHBondContact CB-O 3.41Å
325	V	98.8	Very high	95.7	Very high	3 Å²	3	44.5 Å²	44.5	2%	0.018	24%	0.242	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-117.3	127.8	177.7	-175	0	0	0	0	108.1	L268 F313 E314 L315 C349 L351 F354	L268-V325 HydrophobicContact CD1-CG1 4.24Å; L268-V325 HydrophobicContact CD1-CG2 4.05Å; L268-V325 HydrophobicContact CD2-CG2 4.48Å; F313-V325 HydrophobicContact CD1-CG1 4.26Å; E314-V325 WeakPolarHBondContact O-CA 3.38Å; L315-V325 HydrophobicContact CD1-CG2 4Å; V325-C349 PolarHBondContact N-O 3.3Å; V325-C349 WeakPolarHBondContact O-CB 3.34Å; V325-C349 PolarHBondContact O-N 2.89Å; V325-L351 HydrophobicContact CG2-CB 4.43Å; V325-L351 HydrophobicContact CG2-CD1 3.63Å; V325-F354 HydrophobicContact CB-CD2 4.32Å; V325-F354 HydrophobicContact CB-CG 4.36Å; V325-F354 HydrophobicContact CG1-CD2 4.26Å; V325-F354 HydrophobicContact CG1-CE2 4.29Å; V325-F354 HydrophobicContact CG2-CB 4.38Å; V325-F354 HydrophobicContact CG2-CD1 4.48Å; V325-F354 HydrophobicContact CG2-CG 4.28Å
326	E	98.8	Very high	95.5	Very high	2 Å²	2	48.4 Å²	48.4	1%	0.009	27%	0.274	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-113.7	139.5	169.4	-66	-175.5	168.2	0	0	109.3	R31 E314 Y316 Y328 H347 R348	R31-E326 IonicContact CZ-OE1 2.78Å; R31-E326 VanDerWaalsContact CZ-OE1 3.29Å; R31-E326 IonicContact CZ-OE2 2.76Å; R31-E326 IonicContact NH1-OE1 3.25Å; R31-E326 PolarHBondContact NH1-OE1 3.44Å; R31-E326 IonicContact NH1-OE2 3.7Å; R31-E326 VanDerWaalsContact NH2-CD 3.32Å; R31-E326 IonicContact NH2-OE1 3.87Å; R31-E326 PolarHBondContact NH2-OE1 3.13Å; R31-E326 IonicContact NH2-OE2 3.89Å; R31-E326 PolarHBondContact NH2-OE2 2.99Å; E314-E326 PolarHBondContact N-O 3.36Å; E314-E326 PolarHBondContact O-N 3.03Å; Y316-E326 HydrophobicContact CD2-CG 4.22Å; Y316-E326 HydrophobicContact CE2-CB 4.19Å; Y316-E326 HydrophobicContact CE2-CG 4.13Å; Y316-E326 VanDerWaalsContact CE2-OE2 3.32Å; Y316-E326 WeakPolarHBondContact CE2-OE2 3.25Å; E326-Y328 HydrophobicContact CB-CE2 3.83Å; E326-Y328 PolarHBondContact OE2-OH 3.05Å; E326-H347 IonicContact OE1-ND1 2.96Å; E326-H347 IonicContact OE2-CE1 3.99Å; E326-R348 VanDerWaalsContact OE1-CG 3.23Å; E326-R348 WeakPolarHBondContact OE1-CG 3.35Å; E326-R348 IonicContact OE1-NE 2.84Å; E326-R348 PolarHBondContact OE1-NE 2.91Å
327	M	98.8	Very high	95.4	Very high	5 Å²	5	48.2 Å²	48.2	3%	0.025	28%	0.277	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-114.7	147.2	176.2	-62	-177.4	-61.4	0	0	110.9	L297 V299 I312 F313 L340 L342 H347 F354	L297-M327 HydrophobicContact CD1-SD 4.08Å; L297-M327 HydrophobicContact CD2-SD 4.18Å; V299-M327 HydrophobicContact CG1-CE 4.37Å; I312-M327 CarbonylContact O-C 3.57Å; I312-M327 VanDerWaalsContact O-CA 3.25Å; I312-M327 WeakPolarHBondContact O-CA 3.17Å; F313-M327 HydrophobicContact CD1-CG 3.66Å; F313-M327 HydrophobicContact CD1-SD 4.02Å; F313-M327 HydrophobicContact CE1-CG 3.71Å; F313-M327 HydrophobicContact CE1-SD 3.42Å; F313-M327 WeakPolarHBondContact CE1-SD 3.44Å; F313-M327 HydrophobicContact CZ-SD 4.18Å; M327-L340 HydrophobicContact CB-CB 3.89Å; M327-L340 HydrophobicContact CE-CB 4.5Å; M327-L340 PolarHBondContact O-N 3.48Å; M327-L342 HydrophobicContact CE-CB 3.96Å; M327-H347 PolarHBondContact O-NE2 3.4Å; M327-F354 HydrophobicContact CE-CE2 4.5Å; M327-F354 HydrophobicContact SD-CE2 3.94Å
328	Y	98.8	Very high	95.4	Very high	30 Å²	30	51.5 Å²	51.5	12%	0.118	29%	0.287	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-142.2	156	173.5	-54	-95.9	0	0	0	111.9	H311 I312 E314 E326 P337 W338 P339 H347	H311-Y328 CarbonylContact C-O 3.58Å; H311-Y328 WeakPolarHBondContact CA-O 3.35Å; I312-Y328 HydrophobicContact CG2-CD2 4.43Å; I312-Y328 PolarHBondContact N-O 3.12Å; I312-Y328 PolarHBondContact O-N 3.24Å; E314-Y328 WeakPolarHBondContact OE2-CE2 3.28Å; E326-Y328 HydrophobicContact CB-CE2 3.83Å; E326-Y328 PolarHBondContact OE2-OH 3.05Å; Y328-P337 HydrophobicContact CD1-CB 4.37Å; Y328-P337 HydrophobicContact CG-CB 4.34Å; Y328-W338 CarbonylContact C-O 3.53Å; Y328-W338 WeakPolarHBondContact CA-O 3.47Å; Y328-P339 HydrophobicContact CD1-CB 4.23Å; Y328-P339 HydrophobicContact CE1-CB 4.2Å; Y328-H347 AromaticContact CE1-CE1 3.83Å; Y328-H347 AromaticContact CE1-NE2 3.79Å; Y328-H347 AromaticContact CZ-CE1 3.6Å; Y328-H347 AromaticContact CZ-NE2 3.81Å; Y328-H347 PolarHBondContact OH-CE1 3.44Å
329	F	98.6	Very high	95.5	Very high	8 Å²	8	54 Å²	54	4%	0.035	31%	0.306	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-128.3	115.8	170.5	-174.7	-133.8	0	0	0	110.6	L290 Q294 A305 C310 H311 N331 W338 L340	L290-F329 HydrophobicContact CD1-CE2 4.34Å; L290-F329 HydrophobicContact CD2-CE2 4.48Å; Q294-F329 VanDerWaalsContact NE2-CD2 3.33Å; A305-F329 HydrophobicContact CB-CE2 4.46Å; A305-F329 HydrophobicContact CB-CZ 3.85Å; C310-F329 WeakPolarHBondContact O-CA 3.08Å; H311-F329 HydrophobicContact CB-CD2 4.26Å; F329-N331 HydrophobicContact CD1-CB 3.99Å; F329-N331 HydrophobicContact CE1-CB 3.58Å; F329-N331 HydrophobicContact CZ-CB 3.9Å; F329-W338 PolarHBondContact N-O 3.18Å; F329-W338 VanDerWaalsContact O-CD1 3.31Å; F329-W338 PolarHBondContact O-N 2.76Å; F329-L340 HydrophobicContact CB-CD1 3.7Å; F329-L340 HydrophobicContact CB-CD2 4.46Å; F329-L340 HydrophobicContact CB-CG 4.12Å
330	R	98.1	Very high	95.8	Very high	21 Å²	21	50.9 Å²	50.9	8%	0.079	29%	0.289	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-94.6	105.7	171.5	-172.2	-178.4	-179.1	-92	9.3	108.4	S309 C310 S333 P337	S309-R330 CarbonylContact C-O 3.56Å; S309-R330 WeakPolarHBondContact CA-O 3.44Å; S309-R330 WeakPolarHBondContact CB-O 3.34Å; C310-R330 HydrophobicContact CB-CB 4.44Å; C310-R330 PolarHBondContact N-O 2.65Å; C310-R330 PolarHBondContact O-N 2.79Å; R330-S333 PolarHBondContact NH2-O 3.28Å; R330-P337 HydrophobicContact CB-CB 4.06Å; R330-P337 HydrophobicContact CB-CG 4.04Å; R330-P337 HydrophobicContact CG-CG 4.34Å
331	N	96.1	Very high	96.1	Very high	37 Å²	37	50 Å²	50	20%	0.198	28%	0.283	C	S	.	.			trans	-117.6	-0	177	64.8	-20.1	0	0	0	113.1	P306 F329 W338	P306-N331 HydrophobicContact CG-CB 4.35Å; F329-N331 HydrophobicContact CD1-CB 3.99Å; F329-N331 HydrophobicContact CE1-CB 3.58Å; F329-N331 HydrophobicContact CZ-CB 3.9Å; N331-W338 PolarHBondContact OD1-NE1 3.39Å
332	E	93.3	Very high	96.4	Very high	62 Å²	62	48.7 Å²	48.7	29%	0.29	27%	0.267	S	S	.	.			trans	-133.9	138.5	178.1	-65.9	-177.9	-105.6	0	0	109.1	K335 W338	E332-K335 HydrophobicContact CB-CB 4.25Å; E332-K335 HydrophobicContact CB-CD 4.37Å; E332-K335 HydrophobicContact CB-CG 4.43Å; E332-K335 VanDerWaalsContact CD-NZ 3.28Å; E332-K335 IonicContact OE1-NZ 3.61Å; E332-K335 PolarHBondContact OE1-NZ 2.85Å; E332-K335 VanDerWaalsContact OE1-NZ 3.14Å; E332-K335 WeakPolarHBondContact OE2-CD 3.37Å; E332-K335 WeakPolarHBondContact OE2-CE 3.39Å; E332-K335 IonicContact OE2-NZ 3.82Å; E332-K335 PolarHBondContact OE2-NZ 3.42Å; E332-W338 WeakPolarHBondContact OE1-CZ2 3.47Å
333	S	89.2	Confident	96.5	Very high	70 Å²	70	46.4 Å²	46.4	49%	0.49	26%	0.258	S	S	.	.	S	Bend	trans	-76.8	-32	-171.1	-76.8	0	0	0	0	114.1	R330	R330-S333 PolarHBondContact NH2-O 3.28Å
334	D	88.4	Confident	96.4	Very high	136 Å²	136	48.5 Å²	48.5	73%	0.727	29%	0.289	S	S	*	.	S	Bend	trans	-93.2	-4.4	-174.1	63.8	-31.9	0	0	0	113.8
335	K	91.9	Very high	96.4	Very high	92 Å²	92	48.9 Å²	48.9	40%	0.4	29%	0.292	S	S	.	.	S	Bend	trans	-112.8	155.4	-179.2	-64.3	-177.8	-170.6	161.3	0	112.5	E332 W338	E332-K335 HydrophobicContact CB-CB 4.25Å; E332-K335 HydrophobicContact CB-CD 4.37Å; E332-K335 HydrophobicContact CB-CG 4.43Å; E332-K335 VanDerWaalsContact CD-NZ 3.28Å; E332-K335 IonicContact OE1-NZ 3.61Å; E332-K335 PolarHBondContact OE1-NZ 2.85Å; E332-K335 VanDerWaalsContact OE1-NZ 3.14Å; E332-K335 WeakPolarHBondContact OE2-CD 3.37Å; E332-K335 WeakPolarHBondContact OE2-CE 3.39Å; E332-K335 IonicContact OE2-NZ 3.82Å; E332-K335 PolarHBondContact OE2-NZ 3.42Å; K335-W338 HydrophobicContact CD-CZ2 4.03Å
336	A	93.8	Very high	96.3	Very high	81 Å²	81	52.7 Å²	52.7	67%	0.669	32%	0.317	S	S	*	.	P	Polyproline II helix	trans	-62.7	147.1	168.5	0	0	0	0	0	110.2	W338	A336-W338 PolarHBondContact O-N 2.74Å
337	P	97.4	Very high	96.3	Very high	24 Å²	24	54.8 Å²	54.8	16%	0.156	33%	0.326	C	S	.	.	P	Polyproline II helix	trans	-55.7	133.7	175	-24.3	33.6	0	0	0	111.9	I312 Y328 R330	I312-P337 HydrophobicContact CD1-CB 4.39Å; I312-P337 HydrophobicContact CD1-CG 4.24Å; Y328-P337 HydrophobicContact CD1-CB 4.37Å; Y328-P337 HydrophobicContact CG-CB 4.34Å; R330-P337 HydrophobicContact CB-CB 4.06Å; R330-P337 HydrophobicContact CB-CG 4.04Å; R330-P337 HydrophobicContact CG-CG 4.34Å
338	W	97.4	Very high	96.2	Very high	119 Å²	119	61 Å²	61	45%	0.451	35%	0.35	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-69.6	129.1	179.4	-60.2	95.3	0	0	0	110.3	Y328 F329 N331 E332 K335 A336	Y328-W338 CarbonylContact C-O 3.53Å; Y328-W338 WeakPolarHBondContact CA-O 3.47Å; F329-W338 PolarHBondContact N-O 3.18Å; F329-W338 VanDerWaalsContact O-CD1 3.31Å; F329-W338 PolarHBondContact O-N 2.76Å; N331-W338 PolarHBondContact OD1-NE1 3.39Å; E332-W338 WeakPolarHBondContact OE1-CZ2 3.47Å; K335-W338 HydrophobicContact CD-CZ2 4.03Å; A336-W338 PolarHBondContact O-N 2.74Å
339	P	98.1	Very high	96.2	Very high	81 Å²	81	59.8 Å²	59.8	53%	0.526	35%	0.346	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-67.3	134.6	174.9	27.9	-33	0	0	0	110.4	Y328 H347	Y328-P339 HydrophobicContact CD1-CB 4.23Å; Y328-P339 HydrophobicContact CE1-CB 4.2Å; P339-H347 WeakPolarHBondContact CB-NE2 3.22Å
340	L	98.4	Very high	96.2	Very high	29 Å²	29	61.8 Å²	61.8	15%	0.152	36%	0.359	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-113.6	130.9	174.4	-64.3	-179.1	0	0	0	109.8	V299 H311 M327 F329 H347	V299-L340 HydrophobicContact CB-CD1 4.46Å; V299-L340 HydrophobicContact CG2-CD1 4.03Å; H311-L340 WeakPolarHBondContact CE1-CD1 3.4Å; M327-L340 HydrophobicContact CB-CB 3.89Å; M327-L340 HydrophobicContact CE-CB 4.5Å; M327-L340 PolarHBondContact O-N 3.48Å; F329-L340 HydrophobicContact CB-CD1 3.7Å; F329-L340 HydrophobicContact CB-CD2 4.46Å; F329-L340 HydrophobicContact CB-CG 4.12Å; L340-H347 PolarHBondContact O-CD2 3.23Å
341	S	97.9	Very high	96.2	Very high	62 Å²	62	61.2 Å²	61.2	43%	0.434	36%	0.358	S	S	.	.			trans	-111.2	128	176	-60.9	0	0	0	0	109.3
342	L	97.8	Very high	96.3	Very high	9 Å²	9	66 Å²	66	5%	0.047	38%	0.379	C	S	.	.			trans	-63.4	134.7	171.7	-172.4	70.8	0	0	0	109.1	L297 M327 G344 C345 F354 L357 T358	L297-L342 HydrophobicContact CB-CD1 4.38Å; L297-L342 HydrophobicContact CD2-CD1 3.95Å; L297-L342 VanDerWaalsContact O-CD1 3.26Å; L297-L342 WeakPolarHBondContact O-CD1 3.42Å; M327-L342 HydrophobicContact CE-CB 3.96Å; L342-G344 PolarHBondContact O-N 3.1Å; L342-C345 HydrophobicContact CB-CB 4.06Å; L342-C345 PolarHBondContact O-N 3.45Å; L342-F354 HydrophobicContact CD2-CD2 3.99Å; L342-F354 HydrophobicContact CD2-CE2 4.4Å; L342-L357 HydrophobicContact CD2-CB 3.57Å; L342-L357 HydrophobicContact CD2-CD1 3.94Å; L342-L357 HydrophobicContact CD2-CG 4.42Å; L342-T358 HydrophobicContact CD1-CG2 4.11Å; L342-T358 HydrophobicContact CD2-CG2 3.81Å
343	P	97.8	Very high	96.5	Very high	64 Å²	64	66.7 Å²	66.7	42%	0.416	39%	0.385	S	S	.	.	T	Hydrogen-bonded Turn	trans	-54	129.2	176.7	-28.5	37.2	0	0	0	111.8	D298 C345	D298-P343 HydrophobicContact CB-CG 4.07Å; P343-C345 VanDerWaalsContact C-N 3.32Å
344	G	97.3	Very high	97	Very high	78 Å²	78	63.4 Å²	63.4	80%	0.804	36%	0.362	S	S	*	.	T	Hydrogen-bonded Turn	trans	80.8	4	-175.9	0	0	0	0	0	115.4	L342	L342-G344 PolarHBondContact O-N 3.1Å
345	C	97.7	Very high	97.5	Very high	14 Å²	14	58 Å²	58	10%	0.095	33%	0.333	C	S	.	.	S	Bend	trans	-124.2	145.5	175.3	-141.6	0	0	0	0	111.8	L342 P343 C349 L357	L342-C345 HydrophobicContact CB-CB 4.06Å; L342-C345 PolarHBondContact O-N 3.45Å; P343-C345 VanDerWaalsContact C-N 3.32Å; C345-C349 HydrophobicContact CB-CB 3.87Å; C345-C349 WeakPolarHBondContact CB-SG 3.38Å; C345-C349 WeakPolarHBondContact SG-CA 3.44Å; C345-C349 WeakPolarHBondContact SG-CB 3.37Å; C345-C349 CovalentContact SG-SG 2.02Å; C345-C349 PolarHBondContact SG-SG 2.88Å; C345-L357 HydrophobicContact CB-CD1 3.68Å
346	P	97.4	Very high	97.8	Very high	82 Å²	82	60.5 Å²	60.5	53%	0.532	35%	0.345	S	S	.	.			trans	-62.4	161.2	165.6	27.9	-35.9	0	0	0	111	R348 C349	P346-R348 CarbonylContact O-C 3.16Å; P346-R348 PolarHBondContact O-N 3.28Å; P346-C349 WeakPolarHBondContact O-CA 3.45Å; P346-C349 WeakPolarHBondContact O-CB 3.48Å; P346-C349 PolarHBondContact O-N 3.26Å; P346-C349 VanDerWaalsContact O-N 3.16Å
347	H	97.4	Very high	98.1	Very high	46 Å²	46	59.8 Å²	59.8	21%	0.213	33%	0.33	C	S	.	.	S	Bend	trans	-54	-40.9	175	177.4	-105.9	0	0	0	111.8	E326 M327 Y328 P339 L340 C349	E326-H347 IonicContact OE1-ND1 2.96Å; E326-H347 IonicContact OE2-CE1 3.99Å; M327-H347 PolarHBondContact O-NE2 3.4Å; Y328-H347 AromaticContact CE1-CE1 3.83Å; Y328-H347 AromaticContact CE1-NE2 3.79Å; Y328-H347 AromaticContact CZ-CE1 3.6Å; Y328-H347 AromaticContact CZ-NE2 3.81Å; Y328-H347 PolarHBondContact OH-CE1 3.44Å; P339-H347 WeakPolarHBondContact CB-NE2 3.22Å; L340-H347 PolarHBondContact O-CD2 3.23Å; H347-C349 VanDerWaalsContact C-N 3.27Å; H347-C349 PolarHBondContact O-N 3.37Å; H347-C349 VanDerWaalsContact O-N 3.09Å
348	R	97.2	Very high	98.1	Very high	137 Å²	137	58.8 Å²	58.8	52%	0.517	32%	0.323	S	S	.	.	S	Bend	trans	-81.2	69.5	167.5	-49.4	-154.2	174.5	160.5	1.5	110.5	E326 P346 P350	E326-R348 VanDerWaalsContact OE1-CG 3.23Å; E326-R348 WeakPolarHBondContact OE1-CG 3.35Å; E326-R348 IonicContact OE1-NE 2.84Å; E326-R348 PolarHBondContact OE1-NE 2.91Å; P346-R348 CarbonylContact O-C 3.16Å; P346-R348 PolarHBondContact O-N 3.28Å; R348-P350 WeakPolarHBondContact O-CD 3.45Å
349	C	98.5	Very high	98.2	Very high	4 Å²	4	56.7 Å²	56.7	3%	0.027	32%	0.319	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-74	119.3	-170.9	-172.9	0	0	0	0	110.5	S324 V325 C345 P346 H347 L351	S324-C349 CarbonylContact C-O 3.28Å; S324-C349 VanDerWaalsContact CA-O 3.24Å; S324-C349 WeakPolarHBondContact CA-O 3.48Å; S324-C349 WeakPolarHBondContact CB-O 3.41Å; V325-C349 PolarHBondContact N-O 3.3Å; V325-C349 WeakPolarHBondContact O-CB 3.34Å; V325-C349 PolarHBondContact O-N 2.89Å; C345-C349 HydrophobicContact CB-CB 3.87Å; C345-C349 WeakPolarHBondContact CB-SG 3.38Å; C345-C349 WeakPolarHBondContact SG-CA 3.44Å; C345-C349 WeakPolarHBondContact SG-CB 3.37Å; C345-C349 CovalentContact SG-SG 2.02Å; C345-C349 PolarHBondContact SG-SG 2.88Å; P346-C349 WeakPolarHBondContact O-CA 3.45Å; P346-C349 WeakPolarHBondContact O-CB 3.48Å; P346-C349 PolarHBondContact O-N 3.26Å; P346-C349 VanDerWaalsContact O-N 3.16Å; H347-C349 VanDerWaalsContact C-N 3.27Å; H347-C349 PolarHBondContact O-N 3.37Å; H347-C349 VanDerWaalsContact O-N 3.09Å; C349-L351 PolarHBondContact O-N 3.21Å
350	P	98.4	Very high	98.2	Very high	49 Å²	49	56.7 Å²	56.7	32%	0.318	32%	0.319	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-55	137.3	174.4	-25.6	36.5	0	0	0	110.6	R348 Q352 D353 F354	R348-P350 WeakPolarHBondContact O-CD 3.45Å; P350-Q352 PolarHBondContact O-N 3.27Å; P350-Q352 VanDerWaalsContact O-N 3.14Å; P350-D353 HydrophobicContact CB-CB 4.32Å; P350-D353 VanDerWaalsContact CG-OD2 3.3Å; P350-D353 WeakPolarHBondContact CG-OD2 3.41Å; P350-D353 PolarHBondContact O-N 3.33Å; P350-F354 PolarHBondContact O-N 2.83Å
351	L	98.6	Very high	98.2	Very high	10 Å²	10	56.4 Å²	56.4	5%	0.052	32%	0.318	C	S	.	.	H	α-helix	trans	-56.3	-38.4	-172.9	175.8	62.7	0	0	0	112.1	L268 A272 L315 F323 V325 C349 F354 L355	L268-L351 HydrophobicContact CB-CD1 3.93Å; A272-L351 HydrophobicContact CB-CD2 3.51Å; L315-L351 HydrophobicContact CD1-CD1 4.26Å; L315-L351 HydrophobicContact CD1-CD2 4.26Å; F323-L351 HydrophobicContact CB-CB 3.95Å; F323-L351 HydrophobicContact CB-CD2 3.97Å; F323-L351 WeakPolarHBondContact O-CB 3.33Å; F323-L351 PolarHBondContact O-N 2.86Å; V325-L351 HydrophobicContact CG2-CB 4.43Å; V325-L351 HydrophobicContact CG2-CD1 3.63Å; C349-L351 PolarHBondContact O-N 3.21Å; L351-F354 WeakPolarHBondContact O-CB 3.33Å; L351-F354 PolarHBondContact O-N 3.12Å; L351-L355 HydrophobicContact CD1-CD1 4.36Å; L351-L355 HydrophobicContact CD1-CG 4.22Å; L351-L355 HydrophobicContact CG-CD1 4.19Å; L351-L355 HydrophobicContact CG-CG 4.47Å; L351-L355 VanDerWaalsContact O-CG 3.23Å; L351-L355 WeakPolarHBondContact O-CG 3.34Å; L351-L355 PolarHBondContact O-N 2.72Å
352	Q	98.3	Very high	98.2	Very high	138 Å²	138	53.8 Å²	53.8	65%	0.645	30%	0.299	S	S	*	.	H	α-helix	trans	-66.8	-39.1	178.5	-64.1	-59.3	-17.6	0	0	112.5	P350 L355 H356	P350-Q352 PolarHBondContact O-N 3.27Å; P350-Q352 VanDerWaalsContact O-N 3.14Å; Q352-L355 PolarHBondContact O-N 2.87Å; Q352-H356 WeakPolarHBondContact O-CB 3.21Å; Q352-H356 PolarHBondContact O-N 3.34Å
353	D	98.6	Very high	98.2	Very high	76 Å²	76	54.2 Å²	54.2	41%	0.406	30%	0.303	S	S	.	.	H	α-helix	trans	-67.7	-42.2	176.3	-61.6	-19.2	0	0	0	110.3	P350 L355 H356 L357	P350-D353 HydrophobicContact CB-CB 4.32Å; P350-D353 VanDerWaalsContact CG-OD2 3.3Å; P350-D353 WeakPolarHBondContact CG-OD2 3.41Å; P350-D353 PolarHBondContact O-N 3.33Å; D353-L355 VanDerWaalsContact C-N 3.33Å; D353-L355 PolarHBondContact O-N 3.46Å; D353-H356 PolarHBondContact O-N 2.65Å; D353-L357 VanDerWaalsContact O-CB 3.31Å; D353-L357 WeakPolarHBondContact O-CB 3.31Å; D353-L357 VanDerWaalsContact O-CG 3.25Å; D353-L357 WeakPolarHBondContact O-CG 3.42Å; D353-L357 PolarHBondContact O-N 3.25Å
354	F	98.8	Very high	98.2	Very high	1 Å²	1	59.4 Å²	59.4	0%	0.004	32%	0.318	C	S	.	.	H	α-helix	trans	-55.7	-48.4	173.1	-177.1	-91.8	0	0	0	111.2	L261 R265 L268 L297 F313 V325 M327 L342 P350 L351 H356 T358	L261-F354 HydrophobicContact CD1-CE1 4.39Å; L261-F354 HydrophobicContact CD1-CZ 4.11Å; R265-F354 HydrophobicContact CG-CE1 4.05Å; L268-F354 HydrophobicContact CD1-CD1 4.3Å; L268-F354 HydrophobicContact CD1-CE1 3.91Å; L297-F354 HydrophobicContact CD2-CE2 4.22Å; L297-F354 HydrophobicContact CD2-CZ 4.13Å; F313-F354 HydrophobicContact CD1-CZ 4.38Å; F313-F354 HydrophobicContact CE1-CE2 4.42Å; F313-F354 HydrophobicContact CE1-CZ 4Å; V325-F354 HydrophobicContact CB-CD2 4.32Å; V325-F354 HydrophobicContact CB-CG 4.36Å; V325-F354 HydrophobicContact CG1-CD2 4.26Å; V325-F354 HydrophobicContact CG1-CE2 4.29Å; V325-F354 HydrophobicContact CG2-CB 4.38Å; V325-F354 HydrophobicContact CG2-CD1 4.48Å; V325-F354 HydrophobicContact CG2-CG 4.28Å; M327-F354 HydrophobicContact CE-CE2 4.5Å; M327-F354 HydrophobicContact SD-CE2 3.94Å; L342-F354 HydrophobicContact CD2-CD2 3.99Å; L342-F354 HydrophobicContact CD2-CE2 4.4Å; P350-F354 PolarHBondContact O-N 2.83Å; L351-F354 WeakPolarHBondContact O-CB 3.33Å; L351-F354 PolarHBondContact O-N 3.12Å; F354-H356 PolarHBondContact O-N 3.46Å; F354-T358 HydrophobicContact CE1-CG2 4.32Å; F354-T358 HydrophobicContact CE2-CG2 4.32Å; F354-T358 HydrophobicContact CZ-CG2 4.17Å; F354-T358 WeakPolarHBondContact O-CB 3.4Å; F354-T358 WeakPolarHBondContact O-CG2 3.48Å; F354-T358 PolarHBondContact O-N 3.12Å; F354-T358 VanDerWaalsContact O-N 3.12Å; F354-T358 PolarHBondContact O-OG1 3.05Å
355	L	98.8	Very high	98.1	Very high	23 Å²	23	58.9 Å²	58.9	12%	0.12	30%	0.297	C	S	.	.	H	α-helix	trans	-64	-39.9	178.7	-69	174	0	0	0	112.1	R265 L351 Q352 D353 T358 E359	R265-L355 HydrophobicContact CB-CD2 3.68Å; R265-L355 HydrophobicContact CG-CD2 3.86Å; R265-L355 PolarHBondContact NH2-O 3.26Å; L351-L355 HydrophobicContact CD1-CD1 4.36Å; L351-L355 HydrophobicContact CD1-CG 4.22Å; L351-L355 HydrophobicContact CG-CD1 4.19Å; L351-L355 HydrophobicContact CG-CG 4.47Å; L351-L355 VanDerWaalsContact O-CG 3.23Å; L351-L355 WeakPolarHBondContact O-CG 3.34Å; L351-L355 PolarHBondContact O-N 2.72Å; Q352-L355 PolarHBondContact O-N 2.87Å; D353-L355 VanDerWaalsContact C-N 3.33Å; D353-L355 PolarHBondContact O-N 3.46Å; L355-T358 PolarHBondContact O-OG1 2.89Å; L355-E359 PolarHBondContact O-N 3.45Å
356	H	98.7	Very high	98.1	Very high	143 Å²	143	60.1 Å²	60.1	66%	0.662	30%	0.3	S	S	*	.	H	α-helix	trans	-68.3	-49.5	179.3	179.4	65	0	0	0	112	Q352 D353 F354 T358 E359	Q352-H356 WeakPolarHBondContact O-CB 3.21Å; Q352-H356 PolarHBondContact O-N 3.34Å; D353-H356 PolarHBondContact O-N 2.65Å; F354-H356 PolarHBondContact O-N 3.46Å; H356-T358 VanDerWaalsContact C-N 3.27Å; H356-T358 PolarHBondContact O-N 2.66Å; H356-E359 WeakPolarHBondContact O-CB 3.45Å; H356-E359 PolarHBondContact O-N 3.17Å
357	L	98.8	Very high	98	Very high	67 Å²	67	62.7 Å²	62.7	35%	0.351	31%	0.305	S	S	.	.	H	α-helix	trans	-65.5	-29.5	-178.1	-70.1	169.1	0	0	0	112.6	L342 C345 D353	L342-L357 HydrophobicContact CD2-CB 3.57Å; L342-L357 HydrophobicContact CD2-CD1 3.94Å; L342-L357 HydrophobicContact CD2-CG 4.42Å; C345-L357 HydrophobicContact CB-CD1 3.68Å; D353-L357 VanDerWaalsContact O-CB 3.31Å; D353-L357 WeakPolarHBondContact O-CB 3.31Å; D353-L357 VanDerWaalsContact O-CG 3.25Å; D353-L357 WeakPolarHBondContact O-CG 3.42Å; D353-L357 PolarHBondContact O-N 3.25Å
358	T	98.7	Very high	98	Very high	2 Å²	2	66.6 Å²	66.6	1%	0.012	32%	0.323	C	S	.	.	T	Hydrogen-bonded Turn	trans	-91.9	-5.5	178.1	57.5	0	0	0	0	114.4	L261 R265 L297 L342 F354 L355 H356 V361 V362	L261-T358 HydrophobicContact CD1-CG2 4.46Å; L261-T358 HydrophobicContact CD2-CG2 3.98Å; R265-T358 VanDerWaalsContact CD-OG1 3.29Å; R265-T358 WeakPolarHBondContact CD-OG1 3.49Å; R265-T358 PolarHBondContact NE-OG1 2.93Å; R265-T358 VanDerWaalsContact NE-OG1 3.12Å; L297-T358 HydrophobicContact CD2-CG2 4Å; L342-T358 HydrophobicContact CD1-CG2 4.11Å; L342-T358 HydrophobicContact CD2-CG2 3.81Å; F354-T358 HydrophobicContact CE1-CG2 4.32Å; F354-T358 HydrophobicContact CE2-CG2 4.32Å; F354-T358 HydrophobicContact CZ-CG2 4.17Å; F354-T358 WeakPolarHBondContact O-CB 3.4Å; F354-T358 WeakPolarHBondContact O-CG2 3.48Å; F354-T358 PolarHBondContact O-N 3.12Å; F354-T358 VanDerWaalsContact O-N 3.12Å; F354-T358 PolarHBondContact O-OG1 3.05Å; L355-T358 PolarHBondContact O-OG1 2.89Å; H356-T358 VanDerWaalsContact C-N 3.27Å; H356-T358 PolarHBondContact O-N 2.66Å; T358-V361 WeakPolarHBondContact O-CG2 3.33Å; T358-V361 PolarHBondContact O-N 3.14Å; T358-V362 WeakPolarHBondContact O-CG2 3.4Å
359	E	98.4	Very high	98	Very high	76 Å²	76	62.3 Å²	62.3	36%	0.355	31%	0.309	S	S	.	.	G	3₁₀ helix	trans	-60.1	-42.6	-180	-179.2	62.4	-168.4	0	0	113.9	R265 L355 H356 V361 V362	R265-E359 IonicContact CZ-OE2 2.82Å; R265-E359 IonicContact NH1-OE2 3.74Å; R265-E359 PolarHBondContact NH1-OE2 3.49Å; R265-E359 IonicContact NH2-OE2 2.83Å; R265-E359 PolarHBondContact NH2-OE2 3.08Å; L355-E359 PolarHBondContact O-N 3.45Å; H356-E359 WeakPolarHBondContact O-CB 3.45Å; H356-E359 PolarHBondContact O-N 3.17Å; E359-V361 PolarHBondContact O-N 2.89Å; E359-V361 VanDerWaalsContact O-N 3.15Å; E359-V362 PolarHBondContact O-N 3.23Å
360	P	98.5	Very high	97.9	Very high	81 Å²	81	62.4 Å²	62.4	53%	0.526	31%	0.31	S	S	.	.	G	3₁₀ helix	trans	-62.5	-25.9	-176.9	-24.9	36.1	0	0	0	114.3	R254	R254-P360 VanDerWaalsContact CD-O 3.28Å; R254-P360 WeakPolarHBondContact CD-O 3.47Å; R254-P360 WeakPolarHBondContact CG-O 3.45Å; R254-P360 PolarHBondContact NH1-O 3.29Å
361	V	98.6	Very high	97.8	Very high	22 Å²	22	66.3 Å²	66.3	13%	0.133	32%	0.324	C	S	.	.	G	3₁₀ helix	trans	-98.8	2.9	-174.9	-65.4	0	0	0	0	113.6	A250 A253 R254 G258 L261 A296 T358 E359	A250-V361 HydrophobicContact CB-CG1 4.33Å; A253-V361 CarbonylContact C-O 3.46Å; A253-V361 HydrophobicContact CB-CB 3.97Å; A253-V361 HydrophobicContact CB-CG1 4.19Å; R254-V361 WeakPolarHBondContact CA-O 3.22Å; R254-V361 PolarHBondContact N-O 2.84Å; G258-V361 VanDerWaalsContact CA-O 3.23Å; G258-V361 WeakPolarHBondContact CA-O 3.33Å; L261-V361 HydrophobicContact CD2-CG2 3.85Å; A296-V361 WeakPolarHBondContact O-CG2 3.47Å; T358-V361 WeakPolarHBondContact O-CG2 3.33Å; T358-V361 PolarHBondContact O-N 3.14Å; E359-V361 PolarHBondContact O-N 2.89Å; E359-V361 VanDerWaalsContact O-N 3.15Å
362	V	98.4	Very high	97.4	Very high	7 Å²	7	70.3 Å²	70.3	4%	0.042	35%	0.345	C	S	.	.	S	Bend	trans	-107.4	129.6	-179.3	164.3	0	0	0	0	110.7	R254 L261 A262 R265 T358 E359	R254-V362 PolarHBondContact NH1-O 3.46Å; R254-V362 PolarHBondContact NH2-O 2.96Å; R254-V362 VanDerWaalsContact NH2-O 3.08Å; L261-V362 HydrophobicContact CB-CG2 4.15Å; L261-V362 HydrophobicContact CD2-CG2 4.11Å; L261-V362 HydrophobicContact CG-CG2 3.91Å; A262-V362 HydrophobicContact CB-CG1 3.43Å; A262-V362 VanDerWaalsContact CB-CG1 3.43Å; A262-V362 HydrophobicContact CB-CG2 4.45Å; R265-V362 VanDerWaalsContact NH1-CG1 3.33Å; T358-V362 WeakPolarHBondContact O-CG2 3.4Å; E359-V362 PolarHBondContact O-N 3.23Å
363	P	97.9	Very high	96.4	Very high	19 Å²	19	68.4 Å²	68.4	12%	0.123	35%	0.353	C	S	.	.			trans	-66.9	145.3	179.5	28.4	-33.7	0	0	0	111.4	R254 V259 W366 E369	R254-P363 WeakPolarHBondContact O-CB 3.29Å; R254-P363 VanDerWaalsContact O-CD 3.28Å; R254-P363 WeakPolarHBondContact O-CD 3.47Å; R254-P363 WeakPolarHBondContact O-CG 3.49Å; V259-P363 HydrophobicContact CG2-CG 3.82Å; P363-W366 HydrophobicContact CB-CB 4.2Å; P363-W366 HydrophobicContact CG-CB 4.42Å; P363-E369 WeakPolarHBondContact CA-OE1 3.22Å
364	K	96.4	Very high	94.8	Very high	172 Å²	172	69.7 Å²	69.7	75%	0.748	37%	0.368	S	S	*	.	S	Bend	trans	-89.1	-46.3	170	-67	-177.9	179.7	-179.9	0	110.3	E369	K364-E369 PolarHBondContact N-OE1 3.24Å
365	D	97	Very high	92.9	Very high	68 Å²	68	70.7 Å²	70.7	36%	0.364	38%	0.378	S	S	.	.			trans	-139.7	100	173.8	-175.3	-35.4	0	0	0	107.7	Q367 Q368 E369	D365-Q367 VanDerWaalsContact C-N 3.31Å; D365-Q367 PolarHBondContact O-N 3.12Å; D365-Q367 PolarHBondContact OD1-N 3.15Å; D365-Q367 VanDerWaalsContact OD1-N 3.09Å; D365-Q367 PolarHBondContact OD1-OE1 3.17Å; D365-Q368 HydrophobicContact CB-CB 3.96Å; D365-Q368 PolarHBondContact O-N 3.49Å; D365-Q368 PolarHBondContact OD1-N 2.63Å; D365-E369 PolarHBondContact N-OE1 2.75Å; D365-E369 WeakPolarHBondContact O-CB 3.17Å; D365-E369 WeakPolarHBondContact O-CG 3.26Å; D365-E369 PolarHBondContact O-N 3.31Å
366	W	97.2	Very high	91	Very high	40 Å²	40	74.7 Å²	74.7	15%	0.152	41%	0.405	C	S	.	.	H	α-helix	trans	-64.7	-37.1	-175.3	-176.1	90.9	0	0	0	111.9	L156 P158 C159 L255 V259 P363 E369 C370	L156-W366 HydrophobicContact CB-CZ2 3.85Å; P158-W366 WeakPolarHBondContact O-CH2 3.39Å; C159-W366 HydrophobicContact CB-CH2 4.05Å; C159-W366 HydrophobicContact CB-CZ2 3.89Å; L255-W366 PolarHBondContact O-NE1 3.42Å; V259-W366 HydrophobicContact CG2-CG 4.12Å; P363-W366 HydrophobicContact CB-CB 4.2Å; P363-W366 HydrophobicContact CG-CB 4.42Å; W366-E369 PolarHBondContact O-N 3.39Å; W366-C370 VanDerWaalsContact CH2-SG 3.58Å; W366-C370 WeakPolarHBondContact CZ2-SG 3.45Å; W366-C370 WeakPolarHBondContact O-CB 3.15Å; W366-C370 PolarHBondContact O-N 2.79Å; W366-C370 PolarHBondContact O-SG 3.2Å
367	Q	95.8	Very high	89.1	Confident	135 Å²	135	70.7 Å²	70.7	63%	0.631	40%	0.397	S	S	*	.	H	α-helix	trans	-64.3	-43.4	178.9	-70.9	90.2	-12.4	0	0	111.3	D365 Q371	D365-Q367 VanDerWaalsContact C-N 3.31Å; D365-Q367 PolarHBondContact O-N 3.12Å; D365-Q367 PolarHBondContact OD1-N 3.15Å; D365-Q367 VanDerWaalsContact OD1-N 3.09Å; D365-Q367 PolarHBondContact OD1-OE1 3.17Å; Q367-Q371 WeakPolarHBondContact O-CG 3.26Å
368	Q	96.6	Very high	87.4	Confident	128 Å²	128	71.7 Å²	71.7	60%	0.598	40%	0.403	S	S	*	.	H	α-helix	trans	-67.4	-45.4	176.8	-171.8	-179.8	24.6	0	0	111.5	D365 C370 Q371	D365-Q368 HydrophobicContact CB-CB 3.96Å; D365-Q368 PolarHBondContact O-N 3.49Å; D365-Q368 PolarHBondContact OD1-N 2.63Å; Q368-C370 PolarHBondContact O-N 2.88Å; Q368-Q371 WeakPolarHBondContact O-CB 3.4Å; Q368-Q371 PolarHBondContact O-N 2.82Å; Q368-Q371 VanDerWaalsContact O-N 3.07Å
369	E	97	Very high	85.9	Confident	47 Å²	47	75.3 Å²	75.3	22%	0.22	43%	0.425	C	S	.	.	H	α-helix	trans	-66.1	-23.2	-179.1	-69.8	179.9	-127.1	0	0	113	R254 L255 P363 K364 D365 W366 Q371	R254-E369 IonicContact CZ-OE1 3.69Å; R254-E369 IonicContact CZ-OE2 3.07Å; R254-E369 IonicContact NE-OE2 3.71Å; R254-E369 PolarHBondContact NE-OE2 3.05Å; R254-E369 IonicContact NH2-OE1 2.85Å; R254-E369 PolarHBondContact NH2-OE1 2.83Å; R254-E369 IonicContact NH2-OE2 3.88Å; R254-E369 PolarHBondContact NH2-OE2 3.44Å; L255-E369 HydrophobicContact CD2-CB 3.82Å; P363-E369 WeakPolarHBondContact CA-OE1 3.22Å; K364-E369 PolarHBondContact N-OE1 3.24Å; D365-E369 PolarHBondContact N-OE1 2.75Å; D365-E369 WeakPolarHBondContact O-CB 3.17Å; D365-E369 WeakPolarHBondContact O-CG 3.26Å; D365-E369 PolarHBondContact O-N 3.31Å; W366-E369 PolarHBondContact O-N 3.39Å; E369-Q371 VanDerWaalsContact C-N 3.33Å
370	C	96.8	Very high	84.7	Confident	6 Å²	6	78.5 Å²	78.5	4%	0.041	44%	0.44	C	S	.	.	T	Hydrogen-bonded Turn	trans	-77.1	-13.7	173.1	-84	0	0	0	0	114.6	C159 P160 R161 W366 Q368	C159-C370 HydrophobicContact CB-CB 3.96Å; C159-C370 WeakPolarHBondContact CB-SG 3.44Å; C159-C370 VanDerWaalsContact SG-CA 3.55Å; C159-C370 WeakPolarHBondContact SG-CB 3.41Å; C159-C370 CovalentContact SG-SG 2.04Å; C159-C370 PolarHBondContact SG-SG 3.41Å; P160-C370 WeakPolarHBondContact CD-O 3.4Å; R161-C370 WeakPolarHBondContact CB-O 3.45Å; R161-C370 PolarHBondContact N-O 3.15Å; W366-C370 VanDerWaalsContact CH2-SG 3.58Å; W366-C370 WeakPolarHBondContact CZ2-SG 3.45Å; W366-C370 WeakPolarHBondContact O-CB 3.15Å; W366-C370 PolarHBondContact O-N 2.79Å; W366-C370 PolarHBondContact O-SG 3.2Å; Q368-C370 PolarHBondContact O-N 2.88Å
371	Q	95.3	Very high	83.6	Confident	131 Å²	131	78.7 Å²	78.7	61%	0.612	44%	0.44	S	S	*	.	S	Bend	trans	-73	146	179.6	-64.4	175.2	6.5	0	0	110.9	Q367 Q368 E369	Q367-Q371 WeakPolarHBondContact O-CG 3.26Å; Q368-Q371 WeakPolarHBondContact O-CB 3.4Å; Q368-Q371 PolarHBondContact O-N 2.82Å; Q368-Q371 VanDerWaalsContact O-N 3.07Å; E369-Q371 VanDerWaalsContact C-N 3.33Å
372	L	91.1	Very high	82.6	Confident	94 Å²	94	83 Å²	83	49%	0.492	46%	0.461	S	S	.	.	P	Polyproline II helix	trans	-76.2	141.9	168.1	-61	177.5	0	0	0	108.7	P160 R161 Q164 S374	P160-L372 HydrophobicContact CB-CD1 4.16Å; P160-L372 HydrophobicContact CB-CD2 4.18Å; P160-L372 HydrophobicContact CB-CG 3.79Å; R161-L372 HydrophobicContact CB-CD2 4.5Å; Q164-L372 HydrophobicContact CB-CD2 4.07Å; Q164-L372 VanDerWaalsContact OE1-CD2 3.25Å; L372-S374 PolarHBondContact O-N 2.84Å
373	A	77	Confident	81.8	Confident	99 Å²	99	86.6 Å²	86.6	82%	0.818	48%	0.483	S	S	*	.	P	Polyproline II helix	trans	-60	127.8	170.4	0	0	0	0	0	109.1	G375	A373-G375 PolarHBondContact O-N 3.04Å
374	S	64.6	Low	81.1	Confident	102 Å²	102	88.2 Å²	88.2	71%	0.713	50%	0.497	S	S	*	.	P	Polyproline II helix	trans	-56.4	124.7	176	-38	0	0	0	0	109.5	L372	L372-S374 PolarHBondContact O-N 2.84Å
375	G	59.2	Low	80.7	Confident	22 Å²	22	85.6 Å²	85.6	23%	0.227	49%	0.491	C	S	.	.	P	Polyproline II helix	trans	-72.9	162.3	-180	0	0	0	0	0	112	A373 A377 D378 T379	A373-G375 PolarHBondContact O-N 3.04Å; G375-A377 PolarHBondContact O-N 3.15Å; G375-D378 PolarHBondContact N-OD2 3.02Å; G375-D378 PolarHBondContact O-N 2.7Å; G375-D378 VanDerWaalsContact O-N 3.14Å; G375-T379 PolarHBondContact O-N 2.72Å; G375-T379 PolarHBondContact O-OG1 3.43Å
376	P	59	Low	80.3	Confident	107 Å²	107	85 Å²	85	70%	0.695	50%	0.496	S	S	*	.	H	α-helix	trans	-55.7	-36.2	168.4	-20.2	30.6	0	0	0	111.7	D378 T379 E380	P376-D378 PolarHBondContact O-N 3.02Å; P376-T379 WeakPolarHBondContact O-CB 3.34Å; P376-T379 PolarHBondContact O-N 2.96Å; P376-T379 VanDerWaalsContact O-N 3.15Å; P376-E380 WeakPolarHBondContact O-CG 3.45Å; P376-E380 PolarHBondContact O-N 2.96Å
377	A	58.8	Low	80.1	Confident	59 Å²	59	86.8 Å²	86.8	49%	0.488	51%	0.511	S	S	.	.	H	α-helix	trans	-62.2	-37.8	177.4	0	0	0	0	0	113	G375 T379 E380 V381	G375-A377 PolarHBondContact O-N 3.15Å; A377-T379 VanDerWaalsContact C-N 3.29Å; A377-T379 PolarHBondContact O-N 3.4Å; A377-E380 PolarHBondContact O-N 3.32Å; A377-V381 VanDerWaalsContact O-CG2 3.27Å; A377-V381 WeakPolarHBondContact O-CG2 3.42Å; A377-V381 PolarHBondContact O-N 2.77Å
378	D	64.2	Low	80	Confident	89 Å²	89	84.2 Å²	84.2	48%	0.476	51%	0.507	S	S	.	.	H	α-helix	trans	-67.7	-36.3	176.4	-60.4	-39	0	0	0	110.6	G375 P376 V381 I382	G375-D378 PolarHBondContact N-OD2 3.02Å; G375-D378 PolarHBondContact O-N 2.7Å; G375-D378 VanDerWaalsContact O-N 3.14Å; P376-D378 PolarHBondContact O-N 3.02Å; D378-V381 PolarHBondContact O-N 2.92Å; D378-I382 WeakPolarHBondContact O-CB 3.43Å; D378-I382 WeakPolarHBondContact O-CD1 3.48Å; D378-I382 WeakPolarHBondContact O-CG1 3.36Å; D378-I382 PolarHBondContact O-N 2.87Å
379	T	67.3	Low	79.8	Confident	78 Å²	78	80 Å²	80	48%	0.479	50%	0.498	S	S	.	.	H	α-helix	trans	-67.3	-42.8	176	-50.4	0	0	0	0	110.9	G375 P376 A377 I382 V383	G375-T379 PolarHBondContact O-N 2.72Å; G375-T379 PolarHBondContact O-OG1 3.43Å; P376-T379 WeakPolarHBondContact O-CB 3.34Å; P376-T379 PolarHBondContact O-N 2.96Å; P376-T379 VanDerWaalsContact O-N 3.15Å; A377-T379 VanDerWaalsContact C-N 3.29Å; A377-T379 PolarHBondContact O-N 3.4Å; T379-I382 PolarHBondContact O-N 2.99Å; T379-V383 HydrophobicContact CG2-CG2 4.46Å; T379-V383 WeakPolarHBondContact O-CB 3.4Å; T379-V383 WeakPolarHBondContact O-CG2 3.45Å; T379-V383 PolarHBondContact O-N 3.22Å
380	E	73	Confident	79.5	Confident	142 Å²	142	81.1 Å²	81.1	66%	0.664	51%	0.511	S	S	*	.	H	α-helix	trans	-62.8	-41.7	175.2	-73.3	179.8	-179	0	0	112.2	P376 A377 V383 A384	P376-E380 WeakPolarHBondContact O-CG 3.45Å; P376-E380 PolarHBondContact O-N 2.96Å; A377-E380 PolarHBondContact O-N 3.32Å; E380-V383 PolarHBondContact O-N 3.19Å; E380-A384 VanDerWaalsContact O-CB 3.23Å; E380-A384 WeakPolarHBondContact O-CB 3.48Å; E380-A384 PolarHBondContact O-N 3.01Å
381	V	75.4	Confident	79.4	Confident	86 Å²	86	85.1 Å²	85.1	52%	0.521	53%	0.531	S	S	.	.	H	α-helix	trans	-66.4	-43.7	176.5	171.9	0	0	0	0	111.3	A377 D378 A384 L385	A377-V381 VanDerWaalsContact O-CG2 3.27Å; A377-V381 WeakPolarHBondContact O-CG2 3.42Å; A377-V381 PolarHBondContact O-N 2.77Å; D378-V381 PolarHBondContact O-N 2.92Å; V381-A384 PolarHBondContact O-N 3.4Å; V381-L385 HydrophobicContact CG1-CD1 4.01Å; V381-L385 HydrophobicContact CG1-CG 4.43Å; V381-L385 WeakPolarHBondContact O-CB 3.41Å; V381-L385 VanDerWaalsContact O-CG 3.29Å; V381-L385 WeakPolarHBondContact O-CG 3.45Å; V381-L385 PolarHBondContact O-N 3.46Å
382	I	76.9	Confident	79.4	Confident	113 Å²	113	83.9 Å²	83.9	58%	0.579	53%	0.528	S	S	*	.	H	α-helix	trans	-62.6	-44.1	176.7	-70.2	164.9	0	0	0	110.6	D378 T379 L385 A386	D378-I382 WeakPolarHBondContact O-CB 3.43Å; D378-I382 WeakPolarHBondContact O-CD1 3.48Å; D378-I382 WeakPolarHBondContact O-CG1 3.36Å; D378-I382 PolarHBondContact O-N 2.87Å; T379-I382 PolarHBondContact O-N 2.99Å; I382-L385 PolarHBondContact O-N 3.11Å; I382-A386 WeakPolarHBondContact O-CB 3.47Å; I382-A386 PolarHBondContact O-N 3.1Å
383	V	81.5	Confident	79.5	Confident	82 Å²	82	85.9 Å²	85.9	50%	0.497	53%	0.533	S	S	.	.	H	α-helix	trans	-64.1	-44.4	176.5	170.6	0	0	0	0	110.7	T379 E380 L385 A386 V387	T379-V383 HydrophobicContact CG2-CG2 4.46Å; T379-V383 WeakPolarHBondContact O-CB 3.4Å; T379-V383 WeakPolarHBondContact O-CG2 3.45Å; T379-V383 PolarHBondContact O-N 3.22Å; E380-V383 PolarHBondContact O-N 3.19Å; V383-L385 PolarHBondContact O-N 2.79Å; V383-A386 PolarHBondContact O-N 3.46Å; V383-V387 HydrophobicContact CG1-CG2 4.31Å; V383-V387 WeakPolarHBondContact O-CB 3.44Å; V383-V387 VanDerWaalsContact O-CG2 3.26Å; V383-V387 WeakPolarHBondContact O-CG2 3.49Å; V383-V387 PolarHBondContact O-N 3.3Å
384	A	83.4	Confident	80.4	Confident	52 Å²	52	86.5 Å²	86.5	43%	0.43	52%	0.522	S	S	.	.	H	α-helix	trans	-61.1	-44.1	177.4	0	0	0	0	0	111.8	E380 V381 V387 C388	E380-A384 VanDerWaalsContact O-CB 3.23Å; E380-A384 WeakPolarHBondContact O-CB 3.48Å; E380-A384 PolarHBondContact O-N 3.01Å; V381-A384 PolarHBondContact O-N 3.4Å; A384-V387 PolarHBondContact O-N 2.84Å; A384-C388 WeakPolarHBondContact O-CB 3.36Å; A384-C388 PolarHBondContact O-N 3.42Å; A384-C388 PolarHBondContact O-SG 3.12Å
385	L	87.8	Confident	81.8	Confident	118 Å²	118	86.7 Å²	86.7	62%	0.618	51%	0.514	S	S	*	.	H	α-helix	trans	-63.7	-41.5	175.7	-72.5	172.4	0	0	0	112	V381 I382 V383 C388 G389	V381-L385 HydrophobicContact CG1-CD1 4.01Å; V381-L385 HydrophobicContact CG1-CG 4.43Å; V381-L385 WeakPolarHBondContact O-CB 3.41Å; V381-L385 VanDerWaalsContact O-CG 3.29Å; V381-L385 WeakPolarHBondContact O-CG 3.45Å; V381-L385 PolarHBondContact O-N 3.46Å; I382-L385 PolarHBondContact O-N 3.11Å; V383-L385 PolarHBondContact O-N 2.79Å; L385-C388 PolarHBondContact O-N 3.28Å; L385-G389 PolarHBondContact O-N 2.94Å
386	A	88.4	Confident	83.4	Confident	56 Å²	56	89.6 Å²	89.6	46%	0.463	52%	0.523	S	S	.	.	H	α-helix	trans	-64.7	-40.9	176.5	0	0	0	0	0	112.3	I382 V383 S390	I382-A386 WeakPolarHBondContact O-CB 3.47Å; I382-A386 PolarHBondContact O-N 3.1Å; V383-A386 PolarHBondContact O-N 3.46Å; A386-S390 WeakPolarHBondContact O-CB 3.34Å; A386-S390 PolarHBondContact O-N 3.42Å; A386-S390 PolarHBondContact O-OG 3.43Å
387	V	93.4	Very high	85.1	Confident	77 Å²	77	87.5 Å²	87.5	47%	0.467	51%	0.509	S	S	.	.	H	α-helix	trans	-66	-48.7	175.9	170.7	0	0	0	0	110.7	V383 A384 G389 S390 I391	V383-V387 HydrophobicContact CG1-CG2 4.31Å; V383-V387 WeakPolarHBondContact O-CB 3.44Å; V383-V387 VanDerWaalsContact O-CG2 3.26Å; V383-V387 WeakPolarHBondContact O-CG2 3.49Å; V383-V387 PolarHBondContact O-N 3.3Å; A384-V387 PolarHBondContact O-N 2.84Å; V387-G389 VanDerWaalsContact C-N 3.34Å; V387-G389 PolarHBondContact O-N 3.44Å; V387-S390 PolarHBondContact O-N 2.89Å; V387-I391 HydrophobicContact CG1-CD1 3.78Å; V387-I391 HydrophobicContact CG1-CG1 4.46Å; V387-I391 VanDerWaalsContact O-CG1 3.31Å; V387-I391 WeakPolarHBondContact O-CG1 3.39Å; V387-I391 PolarHBondContact O-N 3.02Å
388	C	92.6	Very high	86.7	Confident	80 Å²	80	89.9 Å²	89.9	54%	0.541	51%	0.512	S	S	.	.	H	α-helix	trans	-59.5	-43.5	176.6	-73.4	0	0	0	0	111.9	A384 L385 S390 I391 L392	A384-C388 WeakPolarHBondContact O-CB 3.36Å; A384-C388 PolarHBondContact O-N 3.42Å; A384-C388 PolarHBondContact O-SG 3.12Å; L385-C388 PolarHBondContact O-N 3.28Å; C388-S390 PolarHBondContact O-N 3.42Å; C388-I391 PolarHBondContact O-N 3.1Å; C388-L392 WeakPolarHBondContact O-CB 3.46Å; C388-L392 PolarHBondContact O-N 3.45Å
389	G	92.5	Very high	88	Confident	40 Å²	40	90.7 Å²	90.7	41%	0.412	52%	0.516	S	S	.	.	H	α-helix	trans	-62	-41	175.3	0	0	0	0	0	112.7	L385 V387 L392 F393	L385-G389 PolarHBondContact O-N 2.94Å; V387-G389 VanDerWaalsContact C-N 3.34Å; V387-G389 PolarHBondContact O-N 3.44Å; G389-L392 PolarHBondContact O-N 2.89Å; G389-F393 WeakPolarHBondContact O-CB 3.48Å; G389-F393 PolarHBondContact O-N 3.05Å
390	S	92.1	Very high	89.2	Confident	70 Å²	70	90.9 Å²	90.9	49%	0.49	51%	0.514	S	S	.	.	H	α-helix	trans	-66.9	-41.4	177.4	-58.7	0	0	0	0	112.3	A386 V387 C388 F393 L394	A386-S390 WeakPolarHBondContact O-CB 3.34Å; A386-S390 PolarHBondContact O-N 3.42Å; A386-S390 PolarHBondContact O-OG 3.43Å; V387-S390 PolarHBondContact O-N 2.89Å; C388-S390 PolarHBondContact O-N 3.42Å; S390-F393 PolarHBondContact O-N 3.25Å; S390-L394 WeakPolarHBondContact O-CG 3.32Å; S390-L394 PolarHBondContact O-N 2.81Å
391	I	94	Very high	89.9	Confident	90 Å²	90	87.6 Å²	87.6	46%	0.462	50%	0.504	S	S	.	.	H	α-helix	trans	-63.6	-45.7	175.5	-68.1	167.1	0	0	0	110.3	V387 C388 F393 L394 L395	V387-I391 HydrophobicContact CG1-CD1 3.78Å; V387-I391 HydrophobicContact CG1-CG1 4.46Å; V387-I391 VanDerWaalsContact O-CG1 3.31Å; V387-I391 WeakPolarHBondContact O-CG1 3.39Å; V387-I391 PolarHBondContact O-N 3.02Å; C388-I391 PolarHBondContact O-N 3.1Å; I391-F393 VanDerWaalsContact C-N 3.32Å; I391-F393 PolarHBondContact O-N 2.91Å; I391-L394 PolarHBondContact O-N 3.11Å; I391-L395 HydrophobicContact CG2-CD1 4.01Å; I391-L395 HydrophobicContact CG2-CG 4.42Å; I391-L395 WeakPolarHBondContact O-CG 3.4Å; I391-L395 PolarHBondContact O-N 3.22Å
392	L	94.5	Very high	90.5	Very high	106 Å²	106	86.8 Å²	86.8	56%	0.555	50%	0.499	S	S	*	.	H	α-helix	trans	-60.2	-43.6	177.5	-176.2	65.8	0	0	0	111.3	C388 G389 L394 L395 I396	C388-L392 WeakPolarHBondContact O-CB 3.46Å; C388-L392 PolarHBondContact O-N 3.45Å; G389-L392 PolarHBondContact O-N 2.89Å; L392-L394 PolarHBondContact O-N 3.13Å; L392-L395 PolarHBondContact O-N 2.86Å; L392-I396 HydrophobicContact CG-CD1 4.12Å; L392-I396 VanDerWaalsContact O-CG1 3.29Å; L392-I396 WeakPolarHBondContact O-CG1 3.48Å; L392-I396 PolarHBondContact O-N 2.87Å
393	F	94.8	Very high	90.9	Very high	136 Å²	136	85.4 Å²	85.4	60%	0.596	49%	0.492	S	S	*	.	H	α-helix	trans	-60.1	-45.4	176	-178.9	-101.5	0	0	0	112.1	G389 S390 I391 L395 I396 V397	G389-F393 WeakPolarHBondContact O-CB 3.48Å; G389-F393 PolarHBondContact O-N 3.05Å; S390-F393 PolarHBondContact O-N 3.25Å; I391-F393 VanDerWaalsContact C-N 3.32Å; I391-F393 PolarHBondContact O-N 2.91Å; F393-L395 PolarHBondContact O-N 2.86Å; F393-I396 PolarHBondContact O-N 3.48Å; F393-V397 HydrophobicContact CD1-CG2 4.37Å; F393-V397 HydrophobicContact CE1-CG2 3.99Å; F393-V397 HydrophobicContact CE2-CG2 4.5Å; F393-V397 HydrophobicContact CZ-CG2 4.06Å; F393-V397 WeakPolarHBondContact O-CG2 3.39Å; F393-V397 PolarHBondContact O-N 3.21Å
394	L	94.3	Very high	91	Very high	112 Å²	112	88.1 Å²	88.1	59%	0.586	50%	0.498	S	S	*	.	H	α-helix	trans	-62.4	-41.8	176.5	-73.1	170.7	0	0	0	112.2	S390 I391 L392 I396 V397 L398	S390-L394 WeakPolarHBondContact O-CG 3.32Å; S390-L394 PolarHBondContact O-N 2.81Å; I391-L394 PolarHBondContact O-N 3.11Å; L392-L394 PolarHBondContact O-N 3.13Å; L394-I396 VanDerWaalsContact C-N 3.32Å; L394-I396 PolarHBondContact O-N 3.02Å; L394-V397 PolarHBondContact O-N 3.04Å; L394-L398 WeakPolarHBondContact O-CB 3.44Å; L394-L398 PolarHBondContact O-N 3.29Å
395	L	93.9	Very high	90.8	Very high	105 Å²	105	95.4 Å²	95.4	55%	0.55	51%	0.514	S	S	.	.	H	α-helix	trans	-63	-39.2	176.4	-71.9	171.9	0	0	0	111.9	I391 L392 F393 L398 L399	I391-L395 HydrophobicContact CG2-CD1 4.01Å; I391-L395 HydrophobicContact CG2-CG 4.42Å; I391-L395 WeakPolarHBondContact O-CG 3.4Å; I391-L395 PolarHBondContact O-N 3.22Å; L392-L395 PolarHBondContact O-N 2.86Å; F393-L395 PolarHBondContact O-N 2.86Å; L395-L398 PolarHBondContact O-N 3.29Å; L395-L399 WeakPolarHBondContact O-CB 3.41Å; L395-L399 PolarHBondContact O-N 2.98Å
396	I	93.9	Very high	90.2	Very high	83 Å²	83	95.8 Å²	95.8	43%	0.426	51%	0.514	S	S	.	.	H	α-helix	trans	-63.6	-46.3	174.7	-69.4	165.7	0	0	0	110.5	L392 F393 L394 L398 L399 L400	L392-I396 HydrophobicContact CG-CD1 4.12Å; L392-I396 VanDerWaalsContact O-CG1 3.29Å; L392-I396 WeakPolarHBondContact O-CG1 3.48Å; L392-I396 PolarHBondContact O-N 2.87Å; F393-I396 PolarHBondContact O-N 3.48Å; L394-I396 VanDerWaalsContact C-N 3.32Å; L394-I396 PolarHBondContact O-N 3.02Å; I396-L398 VanDerWaalsContact C-N 3.28Å; I396-L398 PolarHBondContact O-N 3.49Å; I396-L399 PolarHBondContact O-N 3.37Å; I396-L400 HydrophobicContact CG2-CD1 3.93Å; I396-L400 HydrophobicContact CG2-CG 4.4Å; I396-L400 WeakPolarHBondContact O-CB 3.38Å; I396-L400 VanDerWaalsContact O-CG 3.27Å; I396-L400 WeakPolarHBondContact O-CG 3.42Å; I396-L400 PolarHBondContact O-N 2.97Å
397	V	93.6	Very high	89.2	Confident	63 Å²	63	100.8 Å²	100.8	38%	0.382	53%	0.528	S	S	.	.	H	α-helix	trans	-60.9	-40	176.8	172.1	0	0	0	0	111.3	F393 L394 L400 T401	F393-V397 HydrophobicContact CD1-CG2 4.37Å; F393-V397 HydrophobicContact CE1-CG2 3.99Å; F393-V397 HydrophobicContact CE2-CG2 4.5Å; F393-V397 HydrophobicContact CZ-CG2 4.06Å; F393-V397 WeakPolarHBondContact O-CG2 3.39Å; F393-V397 PolarHBondContact O-N 3.21Å; L394-V397 PolarHBondContact O-N 3.04Å; V397-L400 PolarHBondContact O-N 3.19Å; V397-T401 PolarHBondContact O-N 3.38Å; V397-T401 PolarHBondContact O-OG1 2.75Å
398	L	92.8	Very high	87.7	Confident	109 Å²	109	100.8 Å²	100.8	57%	0.571	54%	0.536	S	S	*	.	H	α-helix	trans	-69.1	-41.8	179.5	-150.3	145.9	0	0	0	111.5	L394 L395 I396 T401 V402	L394-L398 WeakPolarHBondContact O-CB 3.44Å; L394-L398 PolarHBondContact O-N 3.29Å; L395-L398 PolarHBondContact O-N 3.29Å; I396-L398 VanDerWaalsContact C-N 3.28Å; I396-L398 PolarHBondContact O-N 3.49Å; L398-T401 VanDerWaalsContact CA-OG1 3.26Å; L398-T401 WeakPolarHBondContact CA-OG1 3.45Å; L398-T401 PolarHBondContact O-N 3.02Å; L398-T401 PolarHBondContact O-OG1 3.5Å; L398-V402 HydrophobicContact CD2-CG2 4.32Å; L398-V402 WeakPolarHBondContact O-CG2 3.43Å; L398-V402 PolarHBondContact O-N 3.38Å
399	L	92.3	Very high	86	Confident	106 Å²	106	104.3 Å²	104.3	56%	0.555	55%	0.545	S	S	*	.	H	α-helix	trans	-61.5	-46.8	173.2	-177.9	67.1	0	0	0	111.3	L395 I396 T401 V402 L403	L395-L399 WeakPolarHBondContact O-CB 3.41Å; L395-L399 PolarHBondContact O-N 2.98Å; I396-L399 PolarHBondContact O-N 3.37Å; L399-T401 PolarHBondContact O-N 3.17Å; L399-V402 PolarHBondContact O-N 3.45Å; L399-L403 HydrophobicContact CG-CD1 4.12Å; L399-L403 VanDerWaalsContact O-CG 3.32Å; L399-L403 WeakPolarHBondContact O-CG 3.48Å; L399-L403 PolarHBondContact O-N 2.8Å
400	L	91.4	Very high	84.2	Confident	83 Å²	83	107.7 Å²	107.7	44%	0.435	56%	0.559	S	S	.	*	H	α-helix	trans	-60.9	-44.8	177.6	-72.6	171.8	0	0	0	111.2	I396 V397 V402 L403 F404	I396-L400 HydrophobicContact CG2-CD1 3.93Å; I396-L400 HydrophobicContact CG2-CG 4.4Å; I396-L400 WeakPolarHBondContact O-CB 3.38Å; I396-L400 VanDerWaalsContact O-CG 3.27Å; I396-L400 WeakPolarHBondContact O-CG 3.42Å; I396-L400 PolarHBondContact O-N 2.97Å; V397-L400 PolarHBondContact O-N 3.19Å; L400-V402 VanDerWaalsContact C-N 3.34Å; L400-V402 PolarHBondContact O-N 3.01Å; L400-L403 PolarHBondContact O-N 2.94Å; L400-F404 HydrophobicContact CB-CD2 4.48Å; L400-F404 WeakPolarHBondContact O-CB 3.36Å; L400-F404 WeakPolarHBondContact O-CD2 3.43Å; L400-F404 PolarHBondContact O-N 3.16Å
401	T	88.6	Confident	82.3	Confident	73 Å²	73	110.8 Å²	110.8	45%	0.448	58%	0.578	S	S	.	*	H	α-helix	trans	-64.1	-36.5	177.2	40.2	0	0	0	0	113	V397 L398 L399 R405	V397-T401 PolarHBondContact O-N 3.38Å; V397-T401 PolarHBondContact O-OG1 2.75Å; L398-T401 VanDerWaalsContact CA-OG1 3.26Å; L398-T401 WeakPolarHBondContact CA-OG1 3.45Å; L398-T401 PolarHBondContact O-N 3.02Å; L398-T401 PolarHBondContact O-OG1 3.5Å; L399-T401 PolarHBondContact O-N 3.17Å; T401-R405 WeakPolarHBondContact O-CB 3.29Å; T401-R405 WeakPolarHBondContact O-CG 3.39Å; T401-R405 PolarHBondContact O-N 3.03Å
402	V	87.6	Confident	80	Confident	68 Å²	68	109.9 Å²	109.9	41%	0.412	59%	0.591	S	S	.	*	H	α-helix	trans	-64.2	-47.5	171.9	170.6	0	0	0	0	111	L398 L399 L400 F404 R405 M406	L398-V402 HydrophobicContact CD2-CG2 4.32Å; L398-V402 WeakPolarHBondContact O-CG2 3.43Å; L398-V402 PolarHBondContact O-N 3.38Å; L399-V402 PolarHBondContact O-N 3.45Å; L400-V402 VanDerWaalsContact C-N 3.34Å; L400-V402 PolarHBondContact O-N 3.01Å; V402-F404 PolarHBondContact O-N 3.33Å; V402-R405 PolarHBondContact O-N 2.79Å; V402-R405 VanDerWaalsContact O-N 3.13Å; V402-M406 HydrophobicContact CG1-CG 4.36Å; V402-M406 HydrophobicContact CG1-SD 4.07Å; V402-M406 WeakPolarHBondContact O-CG 3.28Å; V402-M406 PolarHBondContact O-N 2.74Å
403	L	86.6	Confident	77.5	Confident	84 Å²	84	115.5 Å²	115.5	44%	0.44	61%	0.606	S	S	.	*	H	α-helix	trans	-60.4	-43.3	178.1	-70.8	171.5	0	0	0	111.9	L399 L400 R405 M406 Q407	L399-L403 HydrophobicContact CG-CD1 4.12Å; L399-L403 VanDerWaalsContact O-CG 3.32Å; L399-L403 WeakPolarHBondContact O-CG 3.48Å; L399-L403 PolarHBondContact O-N 2.8Å; L400-L403 PolarHBondContact O-N 2.94Å; L403-R405 VanDerWaalsContact C-N 3.35Å; L403-R405 PolarHBondContact O-N 2.88Å; L403-M406 PolarHBondContact O-N 3.36Å; L403-Q407 PolarHBondContact O-N 3.06Å
404	F	83.4	Confident	75.2	Confident	140 Å²	140	120.4 Å²	120.4	61%	0.614	62%	0.62	S	S	*	*	H	α-helix	trans	-63.1	-38.4	174.3	-83.5	-66.7	0	0	0	112.3	L400 V402 Q407 A408	L400-F404 HydrophobicContact CB-CD2 4.48Å; L400-F404 WeakPolarHBondContact O-CB 3.36Å; L400-F404 WeakPolarHBondContact O-CD2 3.43Å; L400-F404 PolarHBondContact O-N 3.16Å; V402-F404 PolarHBondContact O-N 3.33Å; F404-Q407 PolarHBondContact O-N 2.93Å; F404-A408 WeakPolarHBondContact O-CB 3.38Å; F404-A408 PolarHBondContact O-N 2.94Å; F404-A408 VanDerWaalsContact O-N 3.12Å
405	R	78.3	Confident	72.7	Confident	205 Å²	205	124.1 Å²	124.1	77%	0.774	63%	0.634	S	S	*	*	H	α-helix	trans	-69.6	-35.4	175	-79.3	-170.5	177.3	-156.4	1.3	113.1	T401 V402 L403 A408 Q409	T401-R405 WeakPolarHBondContact O-CB 3.29Å; T401-R405 WeakPolarHBondContact O-CG 3.39Å; T401-R405 PolarHBondContact O-N 3.03Å; V402-R405 PolarHBondContact O-N 2.79Å; V402-R405 VanDerWaalsContact O-N 3.13Å; L403-R405 VanDerWaalsContact C-N 3.35Å; L403-R405 PolarHBondContact O-N 2.88Å; R405-A408 PolarHBondContact O-N 2.89Å; R405-Q409 PolarHBondContact O-N 3.46Å
406	M	74.5	Confident	70.2	Confident	126 Å²	126	125 Å²	125	62%	0.621	64%	0.644	S	S	*	*	H	α-helix	trans	-67.7	-37.4	174.9	-72.5	-178.6	68.3	0	0	111.8	V402 L403 A408 Q409	V402-M406 HydrophobicContact CG1-CG 4.36Å; V402-M406 HydrophobicContact CG1-SD 4.07Å; V402-M406 WeakPolarHBondContact O-CG 3.28Å; V402-M406 PolarHBondContact O-N 2.74Å; L403-M406 PolarHBondContact O-N 3.36Å; M406-A408 PolarHBondContact O-N 3.19Å; M406-Q409 PolarHBondContact O-N 2.83Å
407	Q	67.8	Low	67.6	Low	160 Å²	160	125.3 Å²	125.3	75%	0.748	66%	0.658	S	S	*	*	H	α-helix	trans	-70.6	-20.2	172.5	-74.5	-178.6	-26.6	0	0	113.3	L403 F404	L403-Q407 PolarHBondContact O-N 3.06Å; F404-Q407 PolarHBondContact O-N 2.93Å
408	A	62	Low	65.1	Low	77 Å²	77	130.2 Å²	130.2	64%	0.636	68%	0.682	S	S	*	*	T	Hydrogen-bonded Turn	trans	-88.6	1.4	178.3	0	0	0	0	0	114.4	F404 R405 M406 P410	F404-A408 WeakPolarHBondContact O-CB 3.38Å; F404-A408 PolarHBondContact O-N 2.94Å; F404-A408 VanDerWaalsContact O-N 3.12Å; R405-A408 PolarHBondContact O-N 2.89Å; M406-A408 PolarHBondContact O-N 3.19Å; A408-P410 WeakPolarHBondContact O-CD 3.15Å
409	Q	57.8	Low	62.3	Low	155 Å²	155	128.4 Å²	128.4	72%	0.724	69%	0.691	S	S	*	*	S	Bend	trans	-75.1	122.3	171.2	-81.5	-171.8	-26.5	0	0	110.4	R405 M406	R405-Q409 PolarHBondContact O-N 3.46Å; M406-Q409 PolarHBondContact O-N 2.83Å
410	P	55	Low	59.6	Low	110 Å²	110	132.5 Å²	132.5	71%	0.714	71%	0.707	S	S	*	*			trans	-72	149.3	177.2	28.6	-31.7	0	0	0	111	A408 G412	A408-P410 WeakPolarHBondContact O-CD 3.15Å; P410-G412 PolarHBondContact O-N 3.19Å
411	P	52.3	Low	57.2	Low	136 Å²	136	135 Å²	135	88%	0.883	72%	0.721	S	S	*	*			trans	-69.4	106.6	-176.9	27.7	-31.6	0	0	0	110.3
412	G	45.4	Very low	54.8	Low	71 Å²	71	140 Å²	140	73%	0.732	74%	0.738	S	S	*	*			trans	-103	104.3	-178.8	0	0	0	0	0	113.3	P410	P410-G412 PolarHBondContact O-N 3.19Å
413	Y	41.4	Very low	52.5	Low	223 Å²	223	141.4 Å²	141.4	88%	0.875	76%	0.757	S	S	*	*			trans	43.4	113.1	150.2	-86.2	-95	0	0	0	121.5
414	R	46.7	Very low	50.3	Low	240 Å²	240	145.7 Å²	145.7	91%	0.906	78%	0.775	S	S	*	*			trans	-66	140	157.7	-83.2	175.8	164.4	155.9	-4.9	111.1
415	H	40.5	Very low	48.7	Very low	190 Å²	190	144.2 Å²	144.2	88%	0.88	78%	0.78	S	S	*	*			trans	-124.3	131.3	156.7	-116.7	-75.4	0	0	0	110
416	V	43.4	Very low	46.8	Very low	124 Å²	124	141.4 Å²	141.4	75%	0.752	78%	0.779	S	S	*	*			trans	-96.9	136.5	173.2	171.1	0	0	0	0	108.1
417	A	38.1	Very low	45.4	Very low	88 Å²	88	140.3 Å²	140.3	73%	0.727	78%	0.784	S	S	*	*			trans	173.3	116	134.7	0	0	0	0	0	112.4
418	D	40.4	Very low	44.6	Very low	166 Å²	166	138.7 Å²	138.7	89%	0.888	79%	0.787	S	S	*	*			trans	21.6	140.6	141.5	-57.7	-28.4	0	0	0	123.8
419	G	35	Very low	43.8	Very low	72 Å²	72	142.8 Å²	142.8	74%	0.742	80%	0.798	S	S	*	*			trans	164.3	88	155.7	0	0	0	0	0	116.9
420	E	35.8	Very low	44	Very low	191 Å²	191	140.6 Å²	140.6	89%	0.893	80%	0.797	S	S	*	*			trans	65.4	114.2	144.7	-67.3	-179.6	145.2	0	0	124.1
421	D	40.9	Very low	43.4	Very low	136 Å²	136	141.2 Å²	141.2	73%	0.727	80%	0.804	S	S	*	*			trans	31.7	121	132.3	-77.9	-16.9	0	0	0	122.6
422	H	38.3	Very low	43.1	Very low	177 Å²	177	139.5 Å²	139.5	82%	0.819	80%	0.801	S	S	*	*				176.9	136	98.7	-91	-54.5	0	0	0	114.1
423	A	38	Very low	43.2	Very low	98 Å²	98	145.4 Å²	145.4	81%	0.81	83%	0.831	S	S	*	*			trans	67.3	107.5	144.6	0	0	0	0	0	121.8
424	Q	41.9	Very low	43.3	Very low	175 Å²	175	141.5 Å²	141.5	82%	0.818	83%	0.829	S	S	*	*			trans	-62.5	161.9	151.1	-104.6	-177.1	-3.7	0	0	111.8
425	P	49.9	Very low	43.2	Very low	109 Å²	109	136.3 Å²	136.3	71%	0.708	83%	0.825	S	S	*	*				-152	154.5	61	34.2	-10.3	0	0	0	120.5
426	L	38.6	Very low	43.3	Very low	146 Å²	146	133.3 Å²	133.3	76%	0.764	82%	0.822	S	S	*	*			trans	59.9	108.8	135.9	-75	139.2	0	0	0	121.9
427	S	44.1	Very low	43.3	Very low	103 Å²	103	133.9 Å²	133.9	72%	0.72	83%	0.826	S	S	*	*				-5.9	158.4	129.2	10.6	0	0	0	0	118.8
428	P	51.6	Low	43.6	Very low	126 Å²	126	136.8 Å²	136.8	82%	0.818	83%	0.832	S	S	*	*				-148.1	156.3	50.2	40.1	-18.7	0	0	0	119.2
429	L	44.3	Very low	43.8	Very low	162 Å²	162	134.8 Å²	134.8	85%	0.848	83%	0.828	S	S	*	*			trans	-60.6	-173.4	151.2	-80.4	151.7	0	0	0	111
430	P	61.8	Low	44.5	Very low	110 Å²	110	139.3 Å²	139.3	71%	0.714	83%	0.834	S	S	*	*				-131.4	-179.7	-51.5	35.5	-19.2	0	0	0	110.1
431	S	42.3	Very low	45.1	Very low	123 Å²	123	135.3 Å²	135.3	86%	0.86	83%	0.83	S	S	*	*			trans	-162.4	134.3	138.3	37.1	0	0	0	0	111.5
432	A	47.2	Very low	45.5	Very low	99 Å²	99	135.3 Å²	135.3	82%	0.818	84%	0.839	S	S	*	*			trans	-88.9	149	170.3	0	0	0	0	0	110
433	S	48.1	Very low	46.2	Very low	195 Å²	195	131.5 Å²	131.5	100%	1.364	84%	0.84	S	S	*	*			trans	-166.2	0	141.4	56.3	0	0	0	0	108.6

Retrieved 433 of 433 residues in 82.8 ms (Link to these results)

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