A0A077YX22_TRITR Loading...

ribonucleoside-diphosphate reductase

AlphaFold DB , UniProt , Accession A0A077YX22, Species TRITR (Trichuris trichiura, Whipworm), Gene n/a, Length 366 aa.

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(Predicted Aligned Error values between residue pairs)

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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	L	36.6	Very low	31.6	Very low	213 Å²	213	154.1 Å²	154.1	100%	1.115	84%	0.842	S	S	*	*				0	98.8	0	-82.3	154.9	0	0	0	107.3
2	L	30.7	Very low	31.6	Very low	173 Å²	173	151.7 Å²	151.7	91%	0.906	84%	0.839	S	S	*	*			trans	-77.8	127.9	170.5	-81.2	152.8	0	0	0	107.9
3	F	31.3	Very low	31.5	Very low	178 Å²	178	155.6 Å²	155.6	78%	0.781	84%	0.843	S	S	*	*			trans	-130.7	124.8	159.9	-89.8	-80.4	0	0	0	108.9
4	P	35.6	Very low	31.3	Very low	113 Å²	113	159.4 Å²	159.4	73%	0.734	85%	0.847	S	S	*	*			trans	-85.3	136.4	-175.2	32.5	-32.3	0	0	0	111.5	Q6	P4-Q6 PolarHBondContact O-N 3.44Å
5	F	31.9	Very low	31.2	Very low	215 Å²	215	165.3 Å²	165.3	94%	0.943	85%	0.853	S	S	*	*			trans	-74.3	112.3	170.3	-91.2	-91.2	0	0	0	109.5
6	Q	31.5	Very low	31	Very low	175 Å²	175	160.4 Å²	160.4	82%	0.818	84%	0.837	S	S	*	*			trans	-64.5	128.4	170.4	-76.9	176.3	-40.9	0	0	110.4	P4 V8	P4-Q6 PolarHBondContact O-N 3.44Å; Q6-V8 PolarHBondContact O-N 3.1Å
7	S	28.7	Very low	30.9	Very low	113 Å²	113	157.5 Å²	157.5	79%	0.79	83%	0.834	S	S	*	*			trans	-60.5	114.2	164.7	45.9	0	0	0	0	110.2	E9	S7-E9 PolarHBondContact O-N 3.35Å
8	V	31.3	Very low	31	Very low	131 Å²	131	156.3 Å²	156.3	79%	0.794	83%	0.828	S	S	*	*			trans	-87.9	104.4	171.2	178.6	0	0	0	0	108	Q6 A10	Q6-V8 PolarHBondContact O-N 3.1Å; V8-A10 PolarHBondContact O-N 2.9Å; V8-A10 VanDerWaalsContact O-N 3.11Å
9	E	27.3	Very low	31	Very low	184 Å²	184	157.8 Å²	157.8	86%	0.86	83%	0.83	S	S	*	*			trans	-64.8	101.6	166.1	-73.6	-179.9	155.4	0	0	109.5	S7 S11	S7-E9 PolarHBondContact O-N 3.35Å; E9-S11 PolarHBondContact O-N 3.42Å
10	A	32.4	Very low	31	Very low	95 Å²	95	160.7 Å²	160.7	79%	0.785	83%	0.831	S	S	*	*			trans	-83	93.6	170.6	0	0	0	0	0	109.7	V8	V8-A10 PolarHBondContact O-N 2.9Å; V8-A10 VanDerWaalsContact O-N 3.11Å
11	S	29.9	Very low	31	Very low	105 Å²	105	158.7 Å²	158.7	73%	0.734	82%	0.821	S	S	*	*			trans	-64	140.4	165.1	-90.3	0	0	0	0	111	E9 K13	E9-S11 PolarHBondContact O-N 3.42Å; S11-K13 PolarHBondContact O-N 2.98Å; S11-K13 VanDerWaalsContact O-N 3.13Å
12	P	31.4	Very low	31	Very low	125 Å²	125	150.3 Å²	150.3	81%	0.812	79%	0.787	S	S	*	*			trans	-76.8	106.9	-167.7	30	-32.9	0	0	0	110.7	K14	P12-K14 PolarHBondContact O-N 3.4Å
13	K	31	Very low	31.5	Very low	203 Å²	203	148 Å²	148	88%	0.883	78%	0.775	S	S	*	*			trans	-67.6	112.7	164.5	-79.4	-176.3	177	177.7	0	108.6	S11 R15	S11-K13 PolarHBondContact O-N 2.98Å; S11-K13 VanDerWaalsContact O-N 3.13Å; K13-R15 PolarHBondContact O-N 2.79Å
14	K	28.4	Very low	32	Very low	209 Å²	209	143.1 Å²	143.1	91%	0.909	76%	0.763	S	S	*	*			trans	-46.4	109.8	165.6	-77.1	177.4	174.2	178.4	0	109	P12 S16	P12-K14 PolarHBondContact O-N 3.4Å; K14-S16 PolarHBondContact O-N 2.98Å
15	R	29.3	Very low	32.7	Very low	248 Å²	248	141.8 Å²	141.8	94%	0.936	75%	0.753	S	S	*	*			trans	-72.3	118.8	175.6	-143.6	174	-171.9	-179.7	1.5	107.3	K13 S17	K13-R15 PolarHBondContact O-N 2.79Å; R15-S17 PolarHBondContact O-N 2.92Å
16	S	28.8	Very low	33.5	Very low	86 Å²	86	134.2 Å²	134.2	60%	0.601	72%	0.724	S	S	*	*			trans	-49.9	131.2	167.9	175.3	0	0	0	0	109	K14 D18	K14-S16 PolarHBondContact O-N 2.98Å; S16-D18 PolarHBondContact O-N 3.41Å; S16-D18 PolarHBondContact OG-OD1 3.49Å
17	S	29.5	Very low	34.3	Very low	112 Å²	112	130.9 Å²	130.9	78%	0.783	71%	0.709	S	S	*	*			trans	-70.4	78.5	171.4	53.5	0	0	0	0	109.1	R15 Q19	R15-S17 PolarHBondContact O-N 2.92Å; S17-Q19 PolarHBondContact O-N 2.93Å
18	D	32.6	Very low	35.5	Very low	136 Å²	136	128.3 Å²	128.3	73%	0.727	69%	0.691	S	S	*	*			trans	-71.7	111.5	163.3	-68.9	-14.5	0	0	0	106.5	S16 Y20	S16-D18 PolarHBondContact O-N 3.41Å; S16-D18 PolarHBondContact OG-OD1 3.49Å; D18-Y20 PolarHBondContact O-N 2.74Å
19	Q	31.2	Very low	36.5	Very low	184 Å²	184	122.8 Å²	122.8	86%	0.86	66%	0.659	S	S	*	*			trans	-54.3	101.6	173.1	-75	175	-25.6	0	0	108.5	S17 N21	S17-Q19 PolarHBondContact O-N 2.93Å; Q19-N21 PolarHBondContact O-N 2.95Å; Q19-N21 VanDerWaalsContact O-N 3.1Å
20	Y	30.7	Very low	37.7	Very low	215 Å²	215	119.2 Å²	119.2	84%	0.843	64%	0.642	S	S	*	*			trans	-69.6	105.2	171.2	-141.5	-94.1	0	0	0	107	D18 G22	D18-Y20 PolarHBondContact O-N 2.74Å; Y20-G22 VanDerWaalsContact C-N 3.27Å; Y20-G22 PolarHBondContact O-N 2.99Å
21	N	31	Very low	38.4	Very low	119 Å²	119	120.4 Å²	120.4	64%	0.636	63%	0.63	S	S	*	*			trans	-69.9	84.5	176.2	-114.4	0.7	0	0	0	109.2	Q19 D23 S24	Q19-N21 PolarHBondContact O-N 2.95Å; Q19-N21 VanDerWaalsContact O-N 3.1Å; N21-D23 PolarHBondContact O-N 3.44Å; N21-S24 PolarHBondContact O-OG 2.97Å
22	G	36.5	Very low	39.5	Very low	38 Å²	38	120 Å²	120	39%	0.392	62%	0.618	S	S	.	*	H	α-helix	trans	-59.7	-21.4	178.4	0	0	0	0	0	114.1	Y20 S24 V25 T26	Y20-G22 VanDerWaalsContact C-N 3.27Å; Y20-G22 PolarHBondContact O-N 2.99Å; G22-S24 VanDerWaalsContact C-N 3.34Å; G22-S24 PolarHBondContact O-N 3.33Å; G22-V25 PolarHBondContact O-N 3.27Å; G22-T26 PolarHBondContact O-N 3.28Å; G22-T26 PolarHBondContact O-OG1 2.79Å
23	D	42.3	Very low	40.4	Very low	123 Å²	123	114.8 Å²	114.8	66%	0.658	59%	0.586	S	S	*	*	H	α-helix	trans	-68.8	-28.5	-175.6	-63.6	-20.6	0	0	0	113.6	N21 T26 E27	N21-D23 PolarHBondContact O-N 3.44Å; D23-T26 WeakPolarHBondContact CA-OG1 3.47Å; D23-T26 PolarHBondContact O-OG1 3.44Å; D23-E27 WeakPolarHBondContact O-CB 3.41Å; D23-E27 PolarHBondContact O-N 3.08Å
24	S	41.6	Very low	41.2	Very low	76 Å²	76	109.3 Å²	109.3	53%	0.531	57%	0.573	S	S	.	*	H	α-helix	trans	-76.5	-33.8	-178.9	65.7	0	0	0	0	113.1	N21 G22 S28	N21-S24 PolarHBondContact O-OG 2.97Å; G22-S24 VanDerWaalsContact C-N 3.34Å; G22-S24 PolarHBondContact O-N 3.33Å; S24-S28 PolarHBondContact O-N 3.42Å; S24-S28 PolarHBondContact O-OG 3.3Å
25	V	49.5	Very low	42	Very low	86 Å²	86	108.4 Å²	108.4	52%	0.521	57%	0.569	S	S	.	*	H	α-helix	trans	-74.6	-41.5	178.5	-178.7	0	0	0	0	109.8	G22 S28 A29	G22-V25 PolarHBondContact O-N 3.27Å; V25-S28 PolarHBondContact O-N 2.91Å; V25-S28 PolarHBondContact O-OG 2.86Å; V25-A29 VanDerWaalsContact O-CB 3.32Å; V25-A29 WeakPolarHBondContact O-CB 3.36Å; V25-A29 PolarHBondContact O-N 3.08Å
26	T	49.5	Very low	42.9	Very low	55 Å²	55	102.8 Å²	102.8	34%	0.337	55%	0.554	S	S	.	*	H	α-helix	trans	-62.6	-45.4	176.6	47.6	0	0	0	0	111.8	G22 D23 S28 A29 E30	G22-T26 PolarHBondContact O-N 3.28Å; G22-T26 PolarHBondContact O-OG1 2.79Å; D23-T26 WeakPolarHBondContact CA-OG1 3.47Å; D23-T26 PolarHBondContact O-OG1 3.44Å; T26-S28 VanDerWaalsContact C-N 3.31Å; T26-S28 PolarHBondContact O-N 2.98Å; T26-A29 PolarHBondContact O-N 3.04Å; T26-E30 WeakPolarHBondContact O-CB 3.42Å; T26-E30 VanDerWaalsContact O-CG 3.3Å; T26-E30 WeakPolarHBondContact O-CG 3.38Å; T26-E30 PolarHBondContact O-N 2.97Å
27	E	48.4	Very low	44	Very low	106 Å²	106	100.8 Å²	100.8	50%	0.495	54%	0.535	S	S	.	.	H	α-helix	trans	-65.4	-35.6	-179.4	-150.8	-168.3	160.1	0	0	112.1	D23 K31	D23-E27 WeakPolarHBondContact O-CB 3.41Å; D23-E27 PolarHBondContact O-N 3.08Å; E27-K31 WeakPolarHBondContact O-CB 3.38Å; E27-K31 VanDerWaalsContact O-CG 3.32Å; E27-K31 WeakPolarHBondContact O-CG 3.42Å; E27-K31 PolarHBondContact O-N 3.18Å; E27-K31 VanDerWaalsContact O-N 3.1Å; E27-K31 IonicContact OE1-NZ 3.76Å; E27-K31 PolarHBondContact OE1-NZ 3.43Å
28	S	53.2	Low	45	Very low	59 Å²	59	104.6 Å²	104.6	41%	0.413	54%	0.541	S	S	.	.	H	α-helix	trans	-69.8	-42.1	174.1	72.2	0	0	0	0	112.5	S24 V25 T26 K31 I32	S24-S28 PolarHBondContact O-N 3.42Å; S24-S28 PolarHBondContact O-OG 3.3Å; V25-S28 PolarHBondContact O-N 2.91Å; V25-S28 PolarHBondContact O-OG 2.86Å; T26-S28 VanDerWaalsContact C-N 3.31Å; T26-S28 PolarHBondContact O-N 2.98Å; S28-K31 PolarHBondContact O-N 3Å; S28-I32 WeakPolarHBondContact O-CD1 3.31Å; S28-I32 VanDerWaalsContact O-CG1 3.26Å; S28-I32 WeakPolarHBondContact O-CG1 3.28Å; S28-I32 PolarHBondContact O-N 2.74Å
29	A	52.6	Low	45.8	Very low	15 Å²	15	100.4 Å²	100.4	12%	0.124	52%	0.52	C	S	.	.	H	α-helix	trans	-67.1	-38.4	177.9	0	0	0	0	0	112.1	V25 T26 I32 A33 P53 F56	V25-A29 VanDerWaalsContact O-CB 3.32Å; V25-A29 WeakPolarHBondContact O-CB 3.36Å; V25-A29 PolarHBondContact O-N 3.08Å; T26-A29 PolarHBondContact O-N 3.04Å; A29-I32 PolarHBondContact O-N 3.43Å; A29-A33 VanDerWaalsContact O-CB 3.25Å; A29-A33 WeakPolarHBondContact O-CB 3.47Å; A29-A33 PolarHBondContact O-N 2.94Å; A29-P53 HydrophobicContact CB-CB 4.49Å; A29-F56 HydrophobicContact CB-CE2 4.5Å
30	E	51.3	Low	47	Very low	109 Å²	109	95.3 Å²	95.3	51%	0.509	50%	0.502	S	S	.	.	H	α-helix	trans	-66.9	-42	174.9	-74.8	175.3	-177.2	0	0	112	T26 I32 A33 S34	T26-E30 WeakPolarHBondContact O-CB 3.42Å; T26-E30 VanDerWaalsContact O-CG 3.3Å; T26-E30 WeakPolarHBondContact O-CG 3.38Å; T26-E30 PolarHBondContact O-N 2.97Å; E30-I32 VanDerWaalsContact C-N 3.32Å; E30-I32 PolarHBondContact O-N 3.48Å; E30-A33 PolarHBondContact O-N 3Å; E30-S34 WeakPolarHBondContact O-CB 3.48Å; E30-S34 PolarHBondContact O-N 3.18Å; E30-S34 PolarHBondContact O-OG 2.92Å
31	K	47.7	Very low	48.2	Very low	120 Å²	120	92.3 Å²	92.3	52%	0.522	50%	0.5	S	S	.	.	H	α-helix	trans	-66.1	-30.9	175.7	-78.6	174.5	-173	159.9	0	113.2	E27 S28 S34	E27-K31 WeakPolarHBondContact O-CB 3.38Å; E27-K31 VanDerWaalsContact O-CG 3.32Å; E27-K31 WeakPolarHBondContact O-CG 3.42Å; E27-K31 PolarHBondContact O-N 3.18Å; E27-K31 VanDerWaalsContact O-N 3.1Å; E27-K31 IonicContact OE1-NZ 3.76Å; E27-K31 PolarHBondContact OE1-NZ 3.43Å; S28-K31 PolarHBondContact O-N 3Å; K31-S34 PolarHBondContact O-OG 3.19Å
32	I	52.6	Low	49.5	Very low	95 Å²	95	88.6 Å²	88.6	49%	0.487	49%	0.49	S	S	.	.	H	α-helix	trans	-76.9	-47.2	174.4	-66.6	165.4	0	0	0	110.1	S28 A29 E30 S34 K35	S28-I32 WeakPolarHBondContact O-CD1 3.31Å; S28-I32 VanDerWaalsContact O-CG1 3.26Å; S28-I32 WeakPolarHBondContact O-CG1 3.28Å; S28-I32 PolarHBondContact O-N 2.74Å; A29-I32 PolarHBondContact O-N 3.43Å; E30-I32 VanDerWaalsContact C-N 3.32Å; E30-I32 PolarHBondContact O-N 3.48Å; I32-S34 VanDerWaalsContact C-N 3.29Å; I32-S34 PolarHBondContact O-N 3.25Å; I32-K35 PolarHBondContact O-N 3.44Å; I32-K35 VanDerWaalsContact O-N 3.14Å
33	A	51.2	Low	50.9	Low	17 Å²	17	88.1 Å²	88.1	14%	0.14	48%	0.479	C	S	.	.	H	α-helix	trans	-60.6	-35.3	-179.3	0	0	0	0	0	113.3	A29 E30	A29-A33 VanDerWaalsContact O-CB 3.25Å; A29-A33 WeakPolarHBondContact O-CB 3.47Å; A29-A33 PolarHBondContact O-N 2.94Å; E30-A33 PolarHBondContact O-N 3Å
34	S	46.6	Very low	52.4	Low	87 Å²	87	85.9 Å²	85.9	61%	0.608	47%	0.467	S	S	*	.	T	Hydrogen-bonded Turn	trans	-75.3	-20.4	178.6	49.5	0	0	0	0	114.5	E30 K31 I32	E30-S34 WeakPolarHBondContact O-CB 3.48Å; E30-S34 PolarHBondContact O-N 3.18Å; E30-S34 PolarHBondContact O-OG 2.92Å; K31-S34 PolarHBondContact O-OG 3.19Å; I32-S34 VanDerWaalsContact C-N 3.29Å; I32-S34 PolarHBondContact O-N 3.25Å
35	K	45.5	Very low	54.5	Low	190 Å²	190	85.3 Å²	85.3	83%	0.826	46%	0.457	S	S	*	.	T	Hydrogen-bonded Turn	trans	-87.6	-22	-179.4	-88.1	-175.9	175	-179	0	114.3	I32	I32-K35 PolarHBondContact O-N 3.44Å; I32-K35 VanDerWaalsContact O-N 3.14Å
36	E	49.4	Very low	56.5	Low	131 Å²	131	81.7 Å²	81.7	61%	0.612	44%	0.435	S	S	*	.	S	Bend	trans	-102.8	-3.2	-170.4	-69.4	-177.6	169.5	0	0	114.4	R127	E36-R127 PolarHBondContact O-NH2 3.37Å
37	M	51.2	Low	58.5	Low	43 Å²	43	81.6 Å²	81.6	21%	0.212	44%	0.435	C	S	.	.			trans	-125.7	112.6	-171.4	-137.4	168.4	155.2	0	0	109.9	T39	M37-T39 HydrophobicContact CB-CG2 4.07Å; M37-T39 HydrophobicContact CE-CG2 3.97Å; M37-T39 HydrophobicContact CG-CG2 3.89Å; M37-T39 PolarHBondContact O-N 2.9Å; M37-T39 HydrophobicContact SD-CG2 3.9Å
38	E	50.3	Low	60.6	Low	192 Å²	192	76.6 Å²	76.6	90%	0.897	41%	0.412	S	S	*	.			trans	-68.4	65.8	158.4	-73	-177.6	164.3	0	0	108	T40	E38-T40 PolarHBondContact O-N 2.88Å
39	T	49.7	Very low	62.5	Low	48 Å²	48	74 Å²	74	29%	0.294	39%	0.393	S	S	.	.			trans	-65	123.4	173.9	31.7	0	0	0	0	108.4	M37 L44	M37-T39 HydrophobicContact CB-CG2 4.07Å; M37-T39 HydrophobicContact CE-CG2 3.97Å; M37-T39 HydrophobicContact CG-CG2 3.89Å; M37-T39 PolarHBondContact O-N 2.9Å; M37-T39 HydrophobicContact SD-CG2 3.9Å; T39-L44 HydrophobicContact CG2-CD2 4.4Å
40	T	56	Low	64.3	Low	78 Å²	78	79.4 Å²	79.4	48%	0.479	41%	0.411	S	S	.	.			trans	-71.3	154.2	169.1	71.6	0	0	0	0	108.9	E38 G42 D43	E38-T40 PolarHBondContact O-N 2.88Å; T40-G42 PolarHBondContact O-N 3.36Å; T40-D43 WeakPolarHBondContact CB-OD2 3.32Å; T40-D43 PolarHBondContact N-OD2 3.05Å; T40-D43 PolarHBondContact O-N 2.89Å; T40-D43 PolarHBondContact OG1-OD1 3.34Å; T40-D43 PolarHBondContact OG1-OD2 2.91Å
41	N	55.8	Low	66.1	Low	151 Å²	151	76.4 Å²	76.4	81%	0.807	40%	0.4	S	S	*	.	T	Hydrogen-bonded Turn	trans	-56	-24.7	176.3	-80.3	-17.2	0	0	0	113
42	G	59.4	Low	67.8	Low	42 Å²	42	72 Å²	72	43%	0.433	38%	0.382	S	S	.	.	T	Hydrogen-bonded Turn	trans	-71.5	-35.2	176.8	0	0	0	0	0	113.4	T40 L44 D45	T40-G42 PolarHBondContact O-N 3.36Å; G42-L44 VanDerWaalsContact C-N 3.27Å; G42-L44 PolarHBondContact O-N 3.44Å; G42-D45 PolarHBondContact O-N 3.41Å
43	D	65.9	Low	69.4	Low	28 Å²	28	69.6 Å²	69.6	15%	0.15	37%	0.373	C	S	.	.	T	Hydrogen-bonded Turn	trans	-68.4	-27.9	-175.5	-55.7	-38.3	0	0	0	112.2	T40 D45 E46 L49	T40-D43 WeakPolarHBondContact CB-OD2 3.32Å; T40-D43 PolarHBondContact N-OD2 3.05Å; T40-D43 PolarHBondContact O-N 2.89Å; T40-D43 PolarHBondContact OG1-OD1 3.34Å; T40-D43 PolarHBondContact OG1-OD2 2.91Å; D43-D45 VanDerWaalsContact C-N 3.32Å; D43-D45 PolarHBondContact O-N 3.42Å; D43-E46 PolarHBondContact O-N 3.02Å; D43-L49 HydrophobicContact CB-CB 4.27Å; D43-L49 HydrophobicContact CB-CD1 4.31Å
44	L	73	Confident	71	Confident	76 Å²	76	76 Å²	76	40%	0.398	40%	0.398	S	S	.	.	T	Hydrogen-bonded Turn	trans	-72.3	-24.7	179.8	-63.8	177.4	0	0	0	113.5	T39 G42 R50 P51	T39-L44 HydrophobicContact CG2-CD2 4.4Å; G42-L44 VanDerWaalsContact C-N 3.27Å; G42-L44 PolarHBondContact O-N 3.44Å; L44-R50 PolarHBondContact O-NE 3.43Å; L44-P51 HydrophobicContact CD2-CG 4.32Å
45	D	86.4	Confident	72.7	Confident	63 Å²	63	74.1 Å²	74.1	34%	0.337	38%	0.377	S	S	.	.	T	Hydrogen-bonded Turn	trans	-84	-18.3	177.5	-164.8	37.4	0	0	0	112.7	G42 D43 P47 K257 H258	G42-D45 PolarHBondContact O-N 3.41Å; D43-D45 VanDerWaalsContact C-N 3.32Å; D43-D45 PolarHBondContact O-N 3.42Å; D45-P47 WeakPolarHBondContact O-CD 3.27Å; D45-K257 IonicContact OD1-NZ 2.73Å; D45-K257 PolarHBondContact OD1-NZ 2.85Å; D45-K257 IonicContact OD2-NZ 3.69Å; D45-K257 PolarHBondContact OD2-NZ 3.1Å; D45-H258 IonicContact OD2-CD2 3.78Å; D45-H258 IonicContact OD2-CE1 3.58Å; D45-H258 IonicContact OD2-NE2 3.77Å; D45-H258 PolarHBondContact OD2-NE2 2.95Å
46	E	91.3	Very high	74.7	Confident	10 Å²	10	72.1 Å²	72.1	5%	0.047	37%	0.369	C	S	.	.			trans	-82.4	117.9	175.8	-71.7	-62.1	164.6	0	0	111.2	D43 L48 L49 R50 K257 H258	D43-E46 PolarHBondContact O-N 3.02Å; E46-L48 PolarHBondContact O-N 3.43Å; E46-L49 HydrophobicContact CB-CB 4.12Å; E46-L49 HydrophobicContact CB-CD1 4.01Å; E46-L49 HydrophobicContact CB-CG 3.98Å; E46-L49 HydrophobicContact CG-CD1 4.29Å; E46-L49 PolarHBondContact O-N 2.77Å; E46-L49 VanDerWaalsContact O-N 3.08Å; E46-R50 PolarHBondContact O-N 3.19Å; E46-R50 VanDerWaalsContact O-N 3.07Å; E46-K257 WeakPolarHBondContact OE2-CB 2.83Å; E46-K257 PolarHBondContact OE2-N 2.7Å; E46-H258 WeakPolarHBondContact OE1-CA 3.01Å; E46-H258 VanDerWaalsContact OE1-CB 3.24Å; E46-H258 WeakPolarHBondContact OE1-CB 3.26Å; E46-H258 IonicContact OE1-CD2 2.85Å; E46-H258 PolarHBondContact OE1-CD2 3.08Å; E46-H258 IonicContact OE1-CG 2.68Å; E46-H258 PolarHBondContact OE1-N 3.04Å
47	P	91.2	Very high	76.6	Confident	54 Å²	54	70 Å²	70	35%	0.351	37%	0.365	S	S	.	.	T	Hydrogen-bonded Turn	trans	-56.4	-34.9	179.5	-26	35.3	0	0	0	113.4	D45 L49	D45-P47 WeakPolarHBondContact O-CD 3.27Å; P47-L49 VanDerWaalsContact C-N 3.29Å; P47-L49 PolarHBondContact O-N 2.98Å
48	L	92.4	Very high	78.3	Confident	0 Å²	0	71 Å²	71	0%	0	37%	0.37	C	S	.	.	T	Hydrogen-bonded Turn	trans	-68.4	-26.4	-179.2	-63.7	-172.9	0	0	0	113.7	E46 Y63 I66 I129 Q130 V131 L252 H255 L256	E46-L48 PolarHBondContact O-N 3.43Å; L48-Y63 HydrophobicContact CD2-CE1 4.39Å; L48-I66 HydrophobicContact CD2-CD1 4.43Å; L48-I129 HydrophobicContact CB-CD1 3.77Å; L48-I129 HydrophobicContact CD1-CD1 4.4Å; L48-Q130 PolarHBondContact O-N 3.06Å; L48-V131 HydrophobicContact CD2-CG2 3.69Å; L48-L252 HydrophobicContact CD1-CD2 4.32Å; L48-H255 HydrophobicContact CD1-CB 3.85Å; L48-H255 HydrophobicContact CD2-CB 4.21Å; L48-H255 HydrophobicContact CG-CB 4.32Å; L48-L256 HydrophobicContact CD1-CD2 4.03Å
49	L	93.2	Very high	80.2	Confident	4 Å²	4	67.8 Å²	67.8	2%	0.021	36%	0.359	C	S	.	.	T	Hydrogen-bonded Turn	trans	-109.3	-10.2	-172	-52.5	-179	0	0	0	112.9	D43 E46 P47 E128 I129 Q130 F197	D43-L49 HydrophobicContact CB-CB 4.27Å; D43-L49 HydrophobicContact CB-CD1 4.31Å; E46-L49 HydrophobicContact CB-CB 4.12Å; E46-L49 HydrophobicContact CB-CD1 4.01Å; E46-L49 HydrophobicContact CB-CG 3.98Å; E46-L49 HydrophobicContact CG-CD1 4.29Å; E46-L49 PolarHBondContact O-N 2.77Å; E46-L49 VanDerWaalsContact O-N 3.08Å; P47-L49 VanDerWaalsContact C-N 3.29Å; P47-L49 PolarHBondContact O-N 2.98Å; L49-E128 HydrophobicContact CD2-CB 4.34Å; L49-I129 HydrophobicContact CD2-CD1 4.31Å; L49-Q130 WeakPolarHBondContact O-CG 3.34Å; L49-F197 HydrophobicContact CD1-CB 3.68Å; L49-F197 HydrophobicContact CD1-CD1 4.25Å; L49-F197 HydrophobicContact CD1-CD2 4.35Å; L49-F197 HydrophobicContact CD1-CG 3.86Å; L49-F197 HydrophobicContact CD2-CD1 4.25Å; L49-F197 HydrophobicContact CD2-CD2 3.81Å; L49-F197 HydrophobicContact CD2-CE1 4.34Å; L49-F197 HydrophobicContact CD2-CE2 3.91Å; L49-F197 HydrophobicContact CD2-CG 4Å; L49-F197 HydrophobicContact CD2-CZ 4.19Å
50	R	89.9	Confident	82.2	Confident	130 Å²	130	70.9 Å²	70.9	49%	0.491	38%	0.38	S	S	.	.	S	Bend	trans	-63.3	130	-179.5	-174.7	-179.7	-61	153.2	6.2	111.1	L44 E46 N52 Q130	L44-R50 PolarHBondContact O-NE 3.43Å; E46-R50 PolarHBondContact O-N 3.19Å; E46-R50 VanDerWaalsContact O-N 3.07Å; R50-N52 PolarHBondContact O-N 3.25Å; R50-N52 VanDerWaalsContact O-N 3.1Å; R50-Q130 WeakPolarHBondContact O-CB 3.33Å; R50-Q130 VanDerWaalsContact O-CG 3.23Å; R50-Q130 WeakPolarHBondContact O-CG 3.39Å
51	P	88.6	Confident	83.9	Confident	45 Å²	45	70 Å²	70	29%	0.292	37%	0.372	S	S	.	.			trans	-48.9	120.4	175.6	-29.7	35.6	0	0	0	112.2	L44	L44-P51 HydrophobicContact CD2-CG 4.32Å
52	N	85	Confident	85.6	Confident	27 Å²	27	68.3 Å²	68.3	14%	0.144	36%	0.359	C	S	.	.			trans	-113.1	102.9	-176.7	176.6	11.1	0	0	0	110	R50 K54 R55 Q130	R50-N52 PolarHBondContact O-N 3.25Å; R50-N52 VanDerWaalsContact O-N 3.1Å; N52-K54 PolarHBondContact O-N 3.13Å; N52-K54 WeakPolarHBondContact OD1-CA 3.34Å; N52-K54 WeakPolarHBondContact OD1-CB 3.47Å; N52-K54 PolarHBondContact OD1-N 2.98Å; N52-R55 HydrophobicContact CB-CB 4.22Å; N52-R55 VanDerWaalsContact O-CB 3.27Å; N52-R55 WeakPolarHBondContact O-CB 3.46Å; N52-R55 VanDerWaalsContact O-CD 3.28Å; N52-R55 WeakPolarHBondContact O-CD 3.36Å; N52-R55 WeakPolarHBondContact O-CG 3.27Å; N52-R55 PolarHBondContact O-N 3Å; N52-R55 VanDerWaalsContact O-N 3.14Å; N52-R55 PolarHBondContact OD1-N 3.06Å; N52-Q130 HydrophobicContact CB-CB 4.1Å; N52-Q130 PolarHBondContact ND2-O 3.5Å
53	P	85.3	Confident	87.3	Confident	45 Å²	45	68.4 Å²	68.4	29%	0.292	35%	0.347	S	S	.	.	T	Hydrogen-bonded Turn	trans	-66.9	-18.1	177.9	27.2	-33.9	0	0	0	112.8	A29 R55 F56	A29-P53 HydrophobicContact CB-CB 4.49Å; P53-R55 VanDerWaalsContact C-N 3.32Å; P53-F56 WeakPolarHBondContact O-CD2 3.47Å
54	K	84.8	Confident	88.8	Confident	151 Å²	151	71.2 Å²	71.2	66%	0.657	37%	0.367	S	S	*	.	T	Hydrogen-bonded Turn	trans	-88	3.2	176.8	-59.1	-178.8	-178.6	177.5	0	113	N52 F56 V57	N52-K54 PolarHBondContact O-N 3.13Å; N52-K54 WeakPolarHBondContact OD1-CA 3.34Å; N52-K54 WeakPolarHBondContact OD1-CB 3.47Å; N52-K54 PolarHBondContact OD1-N 2.98Å; K54-F56 PolarHBondContact O-N 3.47Å; K54-V57 HydrophobicContact CB-CG2 4.45Å; K54-V57 VanDerWaalsContact O-CG2 3.28Å; K54-V57 WeakPolarHBondContact O-CG2 3.39Å; K54-V57 PolarHBondContact O-N 2.99Å
55	R	83.3	Confident	89.8	Confident	49 Å²	49	70.3 Å²	70.3	19%	0.185	36%	0.362	C	S	.	.	T	Hydrogen-bonded Turn	trans	-60.1	-13.5	-180	71.8	-169.9	173.9	-132.8	-5.8	114.9	N52 P53 V57 T132	N52-R55 HydrophobicContact CB-CB 4.22Å; N52-R55 VanDerWaalsContact O-CB 3.27Å; N52-R55 WeakPolarHBondContact O-CB 3.46Å; N52-R55 VanDerWaalsContact O-CD 3.28Å; N52-R55 WeakPolarHBondContact O-CD 3.36Å; N52-R55 WeakPolarHBondContact O-CG 3.27Å; N52-R55 PolarHBondContact O-N 3Å; N52-R55 VanDerWaalsContact O-N 3.14Å; N52-R55 PolarHBondContact OD1-N 3.06Å; P53-R55 VanDerWaalsContact C-N 3.32Å; R55-V57 VanDerWaalsContact C-N 3.31Å; R55-T132 WeakPolarHBondContact CA-OG1 3.4Å
56	F	86.6	Confident	90.3	Very high	147 Å²	147	67.3 Å²	67.3	65%	0.645	35%	0.346	S	S	*	.	T	Hydrogen-bonded Turn	trans	-81.8	-7.6	177.9	-54.1	-72	0	0	0	113.7	A29 P53 K54	A29-F56 HydrophobicContact CB-CE2 4.5Å; P53-F56 WeakPolarHBondContact O-CD2 3.47Å; K54-F56 PolarHBondContact O-N 3.47Å
57	V	88.6	Confident	90.6	Very high	88 Å²	88	69.4 Å²	69.4	53%	0.533	35%	0.354	S	S	.	.			trans	-122.8	137.1	174.1	-65.4	0	0	0	0	109.6	K54 R55	K54-V57 HydrophobicContact CB-CG2 4.45Å; K54-V57 VanDerWaalsContact O-CG2 3.28Å; K54-V57 WeakPolarHBondContact O-CG2 3.39Å; K54-V57 PolarHBondContact O-N 2.99Å; R55-V57 VanDerWaalsContact C-N 3.31Å
58	L	87.5	Confident	90.9	Very high	62 Å²	62	68.9 Å²	68.9	33%	0.325	35%	0.351	S	S	.	.			trans	-76.9	-38.6	-178	178	62	0	0	0	112.6	L61 W67 T132	L58-L61 HydrophobicContact CD1-CD2 3.87Å; L58-L61 HydrophobicContact CG-CD2 4.1Å; L58-W67 HydrophobicContact CD1-CE3 4.03Å; L58-W67 HydrophobicContact CD1-CH2 4Å; L58-W67 HydrophobicContact CD1-CZ3 3.52Å; L58-W67 HydrophobicContact CD2-CH2 3.44Å; L58-W67 VanDerWaalsContact CD2-CH2 3.44Å; L58-W67 HydrophobicContact CD2-CZ2 4.03Å; L58-W67 HydrophobicContact CD2-CZ3 3.9Å; L58-W67 HydrophobicContact CG-CH2 4.31Å; L58-W67 HydrophobicContact CG-CZ3 4.31Å; L58-T132 HydrophobicContact CD1-CG2 4.05Å
59	L	89.8	Confident	91	Very high	126 Å²	126	70.8 Å²	70.8	66%	0.66	36%	0.359	S	S	*	.	P	Polyproline II helix	trans	-98.8	147	-175.9	-63.2	178.6	0	0	0	111.7	L61	L59-L61 HydrophobicContact CD2-CD2 4.26Å; L59-L61 HydrophobicContact CD2-CG 4Å
60	P	91.9	Very high	91.1	Very high	112 Å²	112	72.7 Å²	72.7	73%	0.727	37%	0.366	S	S	*	.	S	Bend	cis	-75.1	149	-4.9	32	-35.2	0	0	0	112.6
61	L	91.7	Very high	91.4	Very high	60 Å²	60	68.4 Å²	68.4	31%	0.314	35%	0.351	S	S	.	.	P	Polyproline II helix	trans	-65.5	132.6	172.8	-59	177.4	0	0	0	110	L58 L59 W67 E133	L58-L61 HydrophobicContact CD1-CD2 3.87Å; L58-L61 HydrophobicContact CG-CD2 4.1Å; L59-L61 HydrophobicContact CD2-CD2 4.26Å; L59-L61 HydrophobicContact CD2-CG 4Å; L61-W67 HydrophobicContact CD1-CB 4.21Å; L61-W67 HydrophobicContact CD1-CD2 4.24Å; L61-W67 HydrophobicContact CD1-CG 3.73Å; L61-W67 HydrophobicContact CD2-CD2 3.96Å; L61-W67 HydrophobicContact CD2-CE3 4.16Å; L61-W67 HydrophobicContact CD2-CG 4.12Å; L61-E133 WeakPolarHBondContact CA-OE1 3.5Å; L61-E133 HydrophobicContact CD2-CG 3.84Å
62	Q	92.3	Very high	91.6	Very high	116 Å²	116	70.1 Å²	70.1	54%	0.542	35%	0.354	S	S	.	.	S	Bend	trans	-98	-33.1	175.8	-67.4	177.5	69.2	0	0	111.7	E133	Q62-E133 PolarHBondContact N-OE1 3.18Å
63	Y	95.3	Very high	92	Very high	43 Å²	43	69 Å²	69	17%	0.169	35%	0.348	C	S	.	.			trans	-126.2	84.1	-176.9	-64.3	-90.4	0	0	0	110.8	L48 D65 I66 W67 V131 E133 H255	L48-Y63 HydrophobicContact CD2-CE1 4.39Å; Y63-D65 PolarHBondContact O-N 3.47Å; Y63-I66 HydrophobicContact CD1-CD1 3.95Å; Y63-I66 HydrophobicContact CD2-CD1 4.45Å; Y63-I66 HydrophobicContact CG-CD1 3.78Å; Y63-I66 HydrophobicContact CG-CG1 4.41Å; Y63-I66 PolarHBondContact O-N 3.1Å; Y63-W67 PolarHBondContact O-N 3.33Å; Y63-V131 HydrophobicContact CD2-CG1 3.59Å; Y63-V131 HydrophobicContact CD2-CG2 4.18Å; Y63-V131 HydrophobicContact CE2-CG1 4.08Å; Y63-V131 HydrophobicContact CE2-CG2 3.79Å; Y63-V131 HydrophobicContact CG-CG1 4.39Å; Y63-E133 PolarHBondContact N-OE1 3.1Å; Y63-H255 AromaticContact CD1-CE1 3.71Å; Y63-H255 AromaticContact CD1-ND1 3.83Å; Y63-H255 AromaticContact CE1-ND1 3.68Å
64	P	95.7	Very high	92.3	Very high	88 Å²	88	69.4 Å²	69.4	57%	0.571	35%	0.346	S	S	*	.	H	α-helix	trans	-61.4	-30.3	-177.7	-24.7	35	0	0	0	114.2	S68	P64-S68 WeakPolarHBondContact O-CB 3.28Å; P64-S68 PolarHBondContact O-N 2.65Å
65	D	95.8	Very high	92.6	Very high	57 Å²	57	62.4 Å²	62.4	31%	0.305	32%	0.317	S	S	.	.	H	α-helix	trans	-70.1	-46.2	175.8	57.5	-19	0	0	0	112	Y63 W67 S68 Y69 H255	Y63-D65 PolarHBondContact O-N 3.47Å; D65-W67 VanDerWaalsContact C-N 3.29Å; D65-W67 PolarHBondContact O-N 3.48Å; D65-S68 WeakPolarHBondContact O-CB 3.43Å; D65-S68 PolarHBondContact O-N 2.97Å; D65-S68 VanDerWaalsContact O-N 3.1Å; D65-S68 PolarHBondContact O-OG 3.35Å; D65-Y69 PolarHBondContact O-N 3.43Å; D65-H255 IonicContact OD1-CE1 2.74Å; D65-H255 IonicContact OD1-NE2 2.79Å; D65-H255 IonicContact OD2-CD2 2.84Å; D65-H255 IonicContact OD2-CE1 3.41Å; D65-H255 PolarHBondContact OD2-CE1 3.28Å; D65-H255 VanDerWaalsContact OD2-CE1 3.31Å; D65-H255 IonicContact OD2-NE2 3.33Å; D65-H255 PolarHBondContact OD2-NE2 3.02Å
66	I	97	Very high	92.9	Very high	0 Å²	0	60.9 Å²	60.9	0%	0	31%	0.313	C	S	.	.	H	α-helix	trans	-58.4	-44.2	171.4	-64	-177.8	0	0	0	110	L48 Y63 S68 Y69 Y70 V131 E133 A134 F248 L251 L252	L48-I66 HydrophobicContact CD2-CD1 4.43Å; Y63-I66 HydrophobicContact CD1-CD1 3.95Å; Y63-I66 HydrophobicContact CD2-CD1 4.45Å; Y63-I66 HydrophobicContact CG-CD1 3.78Å; Y63-I66 HydrophobicContact CG-CG1 4.41Å; Y63-I66 PolarHBondContact O-N 3.1Å; I66-S68 VanDerWaalsContact C-N 3.29Å; I66-S68 PolarHBondContact O-N 3.49Å; I66-Y69 WeakPolarHBondContact O-CB 3.21Å; I66-Y69 PolarHBondContact O-N 2.93Å; I66-Y70 PolarHBondContact O-N 3.49Å; I66-V131 HydrophobicContact CD1-CG1 4.44Å; I66-E133 HydrophobicContact CB-CB 4.25Å; I66-E133 HydrophobicContact CG2-CB 3.69Å; I66-A134 HydrophobicContact CG2-CB 3.87Å; I66-F248 HydrophobicContact CG2-CE2 3.94Å; I66-F248 HydrophobicContact CG2-CZ 4.23Å; I66-L251 HydrophobicContact CG1-CD2 3.99Å; I66-L252 HydrophobicContact CD1-CD2 3.96Å
67	W	96.7	Very high	93.2	Very high	54 Å²	54	56.8 Å²	56.8	21%	0.205	30%	0.295	C	S	.	.	H	α-helix	trans	-60.7	-38.3	175.5	-174.8	-109.8	0	0	0	112.7	L58 L61 Y63 D65 Y69 Y70 K71 E133 C136	L58-W67 HydrophobicContact CD1-CE3 4.03Å; L58-W67 HydrophobicContact CD1-CH2 4Å; L58-W67 HydrophobicContact CD1-CZ3 3.52Å; L58-W67 HydrophobicContact CD2-CH2 3.44Å; L58-W67 VanDerWaalsContact CD2-CH2 3.44Å; L58-W67 HydrophobicContact CD2-CZ2 4.03Å; L58-W67 HydrophobicContact CD2-CZ3 3.9Å; L58-W67 HydrophobicContact CG-CH2 4.31Å; L58-W67 HydrophobicContact CG-CZ3 4.31Å; L61-W67 HydrophobicContact CD1-CB 4.21Å; L61-W67 HydrophobicContact CD1-CD2 4.24Å; L61-W67 HydrophobicContact CD1-CG 3.73Å; L61-W67 HydrophobicContact CD2-CD2 3.96Å; L61-W67 HydrophobicContact CD2-CE3 4.16Å; L61-W67 HydrophobicContact CD2-CG 4.12Å; Y63-W67 PolarHBondContact O-N 3.33Å; D65-W67 VanDerWaalsContact C-N 3.29Å; D65-W67 PolarHBondContact O-N 3.48Å; W67-Y69 VanDerWaalsContact C-N 3.28Å; W67-Y69 PolarHBondContact O-N 3.26Å; W67-Y70 HydrophobicContact CD2-CD1 4.03Å; W67-Y70 AromaticContact CE3-CD1 3.65Å; W67-Y70 HydrophobicContact CE3-CD1 3.65Å; W67-Y70 HydrophobicContact CE3-CE1 4.4Å; W67-Y70 HydrophobicContact CE3-CG 4.24Å; W67-Y70 AromaticContact CH2-CD1 3.4Å; W67-Y70 HydrophobicContact CH2-CD1 3.4Å; W67-Y70 AromaticContact CH2-CE1 3.28Å; W67-Y70 HydrophobicContact CH2-CE1 3.28Å; W67-Y70 HydrophobicContact CH2-CG 4.48Å; W67-Y70 AromaticContact CZ2-CD1 3.8Å; W67-Y70 HydrophobicContact CZ2-CD1 3.8Å; W67-Y70 AromaticContact CZ2-CE1 3.77Å; W67-Y70 HydrophobicContact CZ2-CE1 3.77Å; W67-Y70 AromaticContact CZ3-CD1 3.32Å; W67-Y70 HydrophobicContact CZ3-CD1 3.32Å; W67-Y70 AromaticContact CZ3-CE1 3.66Å; W67-Y70 HydrophobicContact CZ3-CE1 3.66Å; W67-Y70 HydrophobicContact CZ3-CG 4.04Å; W67-Y70 WeakPolarHBondContact O-CB 3.4Å; W67-Y70 PolarHBondContact O-N 3.48Å; W67-Y70 VanDerWaalsContact O-N 3.14Å; W67-K71 HydrophobicContact CZ2-CD 4.04Å; W67-K71 PolarHBondContact O-N 3Å; W67-E133 HydrophobicContact CB-CB 4.4Å; W67-E133 HydrophobicContact CB-CG 4.15Å; W67-E133 HydrophobicContact CE3-CB 4.19Å; W67-E133 HydrophobicContact CE3-CG 4.02Å; W67-C136 HydrophobicContact CZ3-CB 4Å
68	S	96.4	Very high	93.5	Very high	43 Å²	43	52.8 Å²	52.8	30%	0.301	27%	0.271	S	S	.	.	H	α-helix	trans	-62.3	-35.4	177.5	81.4	0	0	0	0	112.3	P64 D65 I66 K71 K72	P64-S68 WeakPolarHBondContact O-CB 3.28Å; P64-S68 PolarHBondContact O-N 2.65Å; D65-S68 WeakPolarHBondContact O-CB 3.43Å; D65-S68 PolarHBondContact O-N 2.97Å; D65-S68 VanDerWaalsContact O-N 3.1Å; D65-S68 PolarHBondContact O-OG 3.35Å; I66-S68 VanDerWaalsContact C-N 3.29Å; I66-S68 PolarHBondContact O-N 3.49Å; S68-K71 PolarHBondContact O-N 3.3Å; S68-K72 WeakPolarHBondContact O-CG 3.43Å; S68-K72 PolarHBondContact O-N 2.93Å
69	Y	95.5	Very high	93.9	Very high	39 Å²	39	51.9 Å²	51.9	15%	0.153	27%	0.268	C	S	.	.	H	α-helix	trans	-66.7	-40.5	173.3	-89.9	-103.2	0	0	0	111.9	D65 I66 W67 K71 K72 A73 F137 L244 D247 F248 L251	D65-Y69 PolarHBondContact O-N 3.43Å; I66-Y69 WeakPolarHBondContact O-CB 3.21Å; I66-Y69 PolarHBondContact O-N 2.93Å; W67-Y69 VanDerWaalsContact C-N 3.28Å; W67-Y69 PolarHBondContact O-N 3.26Å; Y69-K71 VanDerWaalsContact C-N 3.28Å; Y69-K71 PolarHBondContact O-N 2.68Å; Y69-K72 WeakPolarHBondContact O-CB 3.25Å; Y69-K72 PolarHBondContact O-N 3.29Å; Y69-K72 VanDerWaalsContact O-N 3.15Å; Y69-A73 PolarHBondContact O-N 2.94Å; Y69-F137 HydrophobicContact CD1-CE2 4.42Å; Y69-L244 HydrophobicContact CD1-CD1 3.61Å; Y69-L244 HydrophobicContact CE1-CD1 3.89Å; Y69-D247 HydrophobicContact CE1-CB 3.87Å; Y69-F248 HydrophobicContact CD1-CB 4.01Å; Y69-F248 HydrophobicContact CD1-CD2 4.04Å; Y69-F248 HydrophobicContact CE1-CB 4.45Å; Y69-F248 HydrophobicContact CG-CD2 4.01Å; Y69-L251 HydrophobicContact CD2-CD2 3.5Å; Y69-L251 VanDerWaalsContact CD2-CD2 3.5Å; Y69-L251 HydrophobicContact CE2-CD2 3.7Å; Y69-L251 HydrophobicContact CE2-CG 4.49Å; Y69-L251 HydrophobicContact CG-CD2 4.07Å
70	Y	95.9	Very high	94.2	Very high	45 Å²	45	46.2 Å²	46.2	18%	0.176	24%	0.238	C	C	.	.	H	α-helix	trans	-58.7	-42.8	172.3	163.5	-99.3	0	0	0	111.2	I66 W67 K72 A73 E74 C136 F140	I66-Y70 PolarHBondContact O-N 3.49Å; W67-Y70 HydrophobicContact CD2-CD1 4.03Å; W67-Y70 AromaticContact CE3-CD1 3.65Å; W67-Y70 HydrophobicContact CE3-CD1 3.65Å; W67-Y70 HydrophobicContact CE3-CE1 4.4Å; W67-Y70 HydrophobicContact CE3-CG 4.24Å; W67-Y70 AromaticContact CH2-CD1 3.4Å; W67-Y70 HydrophobicContact CH2-CD1 3.4Å; W67-Y70 AromaticContact CH2-CE1 3.28Å; W67-Y70 HydrophobicContact CH2-CE1 3.28Å; W67-Y70 HydrophobicContact CH2-CG 4.48Å; W67-Y70 AromaticContact CZ2-CD1 3.8Å; W67-Y70 HydrophobicContact CZ2-CD1 3.8Å; W67-Y70 AromaticContact CZ2-CE1 3.77Å; W67-Y70 HydrophobicContact CZ2-CE1 3.77Å; W67-Y70 AromaticContact CZ3-CD1 3.32Å; W67-Y70 HydrophobicContact CZ3-CD1 3.32Å; W67-Y70 AromaticContact CZ3-CE1 3.66Å; W67-Y70 HydrophobicContact CZ3-CE1 3.66Å; W67-Y70 HydrophobicContact CZ3-CG 4.04Å; W67-Y70 WeakPolarHBondContact O-CB 3.4Å; W67-Y70 PolarHBondContact O-N 3.48Å; W67-Y70 VanDerWaalsContact O-N 3.14Å; Y70-K72 PolarHBondContact O-N 2.98Å; Y70-A73 PolarHBondContact O-N 3.19Å; Y70-E74 WeakPolarHBondContact CE1-OE2 3.15Å; Y70-E74 PolarHBondContact O-N 3.46Å; Y70-E74 PolarHBondContact OH-OE2 3.12Å; Y70-C136 HydrophobicContact CD1-CB 4.44Å; Y70-C136 HydrophobicContact CD2-CB 3.64Å; Y70-C136 WeakPolarHBondContact CD2-O 3.36Å; Y70-C136 HydrophobicContact CE2-CB 3.89Å; Y70-C136 HydrophobicContact CG-CB 3.93Å; Y70-F140 HydrophobicContact CE2-CB 4.42Å
71	K	95.9	Very high	94.4	Very high	40 Å²	40	47.7 Å²	47.7	17%	0.174	24%	0.236	C	C	.	.	H	α-helix	trans	-66.4	-34	175.5	-63.5	-53.5	-56.7	176	0	113.2	W67 S68 Y69 E74 A75 V350	W67-K71 HydrophobicContact CZ2-CD 4.04Å; W67-K71 PolarHBondContact O-N 3Å; S68-K71 PolarHBondContact O-N 3.3Å; Y69-K71 VanDerWaalsContact C-N 3.28Å; Y69-K71 PolarHBondContact O-N 2.68Å; K71-E74 IonicContact NZ-OE1 2.7Å; K71-E74 PolarHBondContact NZ-OE1 3.14Å; K71-E74 IonicContact NZ-OE2 3.31Å; K71-E74 PolarHBondContact NZ-OE2 3.36Å; K71-A75 WeakPolarHBondContact O-CB 3.29Å; K71-A75 PolarHBondContact O-N 2.75Å; K71-V350 HydrophobicContact CB-CG1 4.49Å; K71-V350 VanDerWaalsContact CE-CG1 3.44Å; K71-V350 WeakPolarHBondContact CE-O 3.49Å; K71-V350 WeakPolarHBondContact O-CG1 3.42Å
72	K	93.2	Very high	94.4	Very high	80 Å²	80	48.2 Å²	48.2	35%	0.348	24%	0.236	S	C	.	.	H	α-helix	trans	-60.8	-47.9	171.6	-73.3	174.8	-176.8	178.5	0	111	S68 Y69 Y70 A75 S76 L244 M351	S68-K72 WeakPolarHBondContact O-CG 3.43Å; S68-K72 PolarHBondContact O-N 2.93Å; Y69-K72 WeakPolarHBondContact O-CB 3.25Å; Y69-K72 PolarHBondContact O-N 3.29Å; Y69-K72 VanDerWaalsContact O-N 3.15Å; Y70-K72 PolarHBondContact O-N 2.98Å; K72-A75 WeakPolarHBondContact O-CB 3.41Å; K72-A75 PolarHBondContact O-N 3.11Å; K72-S76 PolarHBondContact O-N 3.19Å; K72-S76 VanDerWaalsContact O-N 3.12Å; K72-S76 PolarHBondContact O-OG 3.49Å; K72-L244 HydrophobicContact CB-CD1 4.06Å; K72-L244 HydrophobicContact CB-CD2 4.22Å; K72-L244 HydrophobicContact CD-CD1 4.07Å; K72-M351 HydrophobicContact CB-CE 4.29Å; K72-M351 HydrophobicContact CG-CE 3.36Å
73	A	92.2	Very high	94.4	Very high	3 Å²	3	43.4 Å²	43.4	3%	0.025	22%	0.215	C	C	.	.	H	α-helix	trans	-61.4	-47	178.1	0	0	0	0	0	111.1	Y69 Y70 A75 S76 F77 F137 F140 L244	Y69-A73 PolarHBondContact O-N 2.94Å; Y70-A73 PolarHBondContact O-N 3.19Å; A73-A75 PolarHBondContact O-N 3.3Å; A73-S76 PolarHBondContact O-N 2.71Å; A73-S76 VanDerWaalsContact O-N 3.08Å; A73-S76 PolarHBondContact O-OG 3.28Å; A73-F77 PolarHBondContact O-N 3.16Å; A73-F137 HydrophobicContact CB-CD2 4.34Å; A73-F137 HydrophobicContact CB-CE2 4Å; A73-F140 HydrophobicContact CB-CD1 3.53Å; A73-F140 HydrophobicContact CB-CE1 3.85Å; A73-F140 HydrophobicContact CB-CG 4.19Å; A73-F140 WeakPolarHBondContact O-CE1 3.19Å; A73-F140 WeakPolarHBondContact O-CZ 3.19Å; A73-L244 HydrophobicContact CB-CD2 3.78Å
74	E	92.3	Very high	94.3	Very high	54 Å²	54	46.1 Å²	46.1	25%	0.252	23%	0.232	S	C	.	.	H	α-helix	trans	-58.2	-37.6	175.9	-167.8	-172.1	129.1	0	0	112.5	Y70 K71 S76 F140 V350	Y70-E74 WeakPolarHBondContact CE1-OE2 3.15Å; Y70-E74 PolarHBondContact O-N 3.46Å; Y70-E74 PolarHBondContact OH-OE2 3.12Å; K71-E74 IonicContact NZ-OE1 2.7Å; K71-E74 PolarHBondContact NZ-OE1 3.14Å; K71-E74 IonicContact NZ-OE2 3.31Å; K71-E74 PolarHBondContact NZ-OE2 3.36Å; E74-S76 VanDerWaalsContact C-N 3.31Å; E74-S76 PolarHBondContact O-N 2.98Å; E74-F140 HydrophobicContact CB-CE2 4.32Å; E74-F140 HydrophobicContact CG-CE2 4.46Å; E74-V350 HydrophobicContact CB-CG1 4.16Å; E74-V350 HydrophobicContact CG-CG1 4.31Å
75	A	90.3	Very high	94.2	Very high	5 Å²	5	43 Å²	43	4%	0.041	21%	0.211	C	C	.	.	H	α-helix	trans	-70.3	-28.3	179.7	0	0	0	0	0	112.9	K71 K72 A73 Q346 K347 V350	K71-A75 WeakPolarHBondContact O-CB 3.29Å; K71-A75 PolarHBondContact O-N 2.75Å; K72-A75 WeakPolarHBondContact O-CB 3.41Å; K72-A75 PolarHBondContact O-N 3.11Å; A73-A75 PolarHBondContact O-N 3.3Å; A75-Q346 HydrophobicContact CB-CG 3.95Å; A75-K347 PolarHBondContact O-N 2.91Å; A75-V350 HydrophobicContact CB-CB 4.05Å; A75-V350 HydrophobicContact CB-CG1 3.81Å
76	S	90.1	Very high	94.1	Very high	16 Å²	16	44.3 Å²	44.3	11%	0.112	22%	0.224	C	C	.	.	H	α-helix	trans	-92.9	1.4	-177.7	67.4	0	0	0	0	114.4	K72 A73 E74 W78 R240	K72-S76 PolarHBondContact O-N 3.19Å; K72-S76 VanDerWaalsContact O-N 3.12Å; K72-S76 PolarHBondContact O-OG 3.49Å; A73-S76 PolarHBondContact O-N 2.71Å; A73-S76 VanDerWaalsContact O-N 3.08Å; A73-S76 PolarHBondContact O-OG 3.28Å; E74-S76 VanDerWaalsContact C-N 3.31Å; E74-S76 PolarHBondContact O-N 2.98Å; S76-W78 PolarHBondContact O-N 3.03Å; S76-R240 PolarHBondContact O-NH2 3.1Å
77	F	92.8	Very high	93.8	Very high	62 Å²	62	51.8 Å²	51.8	27%	0.272	25%	0.253	S	S	.	.			trans	-49.8	133.8	179.6	-169.1	-101.3	0	0	0	113.4	A73 T79 F140 I144 I147	A73-F77 PolarHBondContact O-N 3.16Å; F77-T79 HydrophobicContact CE1-CG2 3.64Å; F77-T79 HydrophobicContact CZ-CG2 3.99Å; F77-F140 HydrophobicContact CB-CE2 4.46Å; F77-F140 HydrophobicContact CB-CZ 3.73Å; F77-F140 HydrophobicContact CD2-CE1 4.26Å; F77-F140 AromaticContact CD2-CE2 3.87Å; F77-F140 HydrophobicContact CD2-CE2 3.87Å; F77-F140 AromaticContact CD2-CZ 3.44Å; F77-F140 HydrophobicContact CD2-CZ 3.44Å; F77-F140 VanDerWaalsContact CD2-CZ 3.44Å; F77-F140 HydrophobicContact CE2-CZ 4.5Å; F77-F140 HydrophobicContact CG-CZ 4.02Å; F77-I144 HydrophobicContact CD2-CD1 4.07Å; F77-I144 HydrophobicContact CE2-CD1 4.48Å; F77-I147 HydrophobicContact CE2-CD1 3.82Å; F77-I147 HydrophobicContact CZ-CD1 4.13Å
78	W	95.3	Very high	93.8	Very high	4 Å²	4	49.2 Å²	49.2	2%	0.015	24%	0.243	C	C	.	.			trans	-141.9	170.8	174	63.8	-77.9	0	0	0	110.4	S76 E82 V83 I147 H148 M151 L237 I238 D241	S76-W78 PolarHBondContact O-N 3.03Å; W78-E82 WeakPolarHBondContact CA-OE1 3.2Å; W78-V83 HydrophobicContact CE3-CG2 4.4Å; W78-V83 HydrophobicContact CZ3-CG2 4Å; W78-I147 HydrophobicContact CD2-CG2 4.16Å; W78-I147 HydrophobicContact CE3-CG2 4.07Å; W78-I147 HydrophobicContact CH2-CG2 3.67Å; W78-I147 HydrophobicContact CZ2-CG2 3.77Å; W78-I147 HydrophobicContact CZ3-CG2 3.83Å; W78-I147 WeakPolarHBondContact O-CD1 3.24Å; W78-H148 AromaticContact CZ2-CD2 3.76Å; W78-M151 HydrophobicContact CH2-CB 4.09Å; W78-M151 HydrophobicContact CH2-CG 4.04Å; W78-M151 HydrophobicContact CH2-SD 4.43Å; W78-M151 HydrophobicContact CZ3-CG 4.38Å; W78-M151 HydrophobicContact CZ3-SD 4.18Å; W78-L237 HydrophobicContact CB-CD1 4.37Å; W78-L237 HydrophobicContact CD2-CB 4Å; W78-L237 HydrophobicContact CD2-CD1 3.65Å; W78-L237 HydrophobicContact CD2-CG 4.38Å; W78-L237 HydrophobicContact CE3-CD1 3.58Å; W78-L237 HydrophobicContact CG-CB 4.33Å; W78-L237 HydrophobicContact CG-CD1 4.01Å; W78-L237 HydrophobicContact CZ2-CB 4Å; W78-L237 HydrophobicContact CZ3-CD1 4.13Å; W78-I238 HydrophobicContact CH2-CD1 4.33Å; W78-I238 HydrophobicContact CH2-CG1 3.98Å; W78-I238 HydrophobicContact CZ2-CD1 4.43Å; W78-I238 HydrophobicContact CZ2-CG1 3.62Å; W78-D241 PolarHBondContact NE1-OD2 2.73Å
79	T	96.3	Very high	93.8	Very high	43 Å²	43	49.5 Å²	49.5	26%	0.264	24%	0.24	S	C	.	.			trans	-131.9	154.5	178.1	52.9	0	0	0	0	111.1	F77 E81 E82	F77-T79 HydrophobicContact CE1-CG2 3.64Å; F77-T79 HydrophobicContact CZ-CG2 3.99Å; T79-E81 PolarHBondContact O-N 2.9Å; T79-E82 PolarHBondContact N-OE1 3.07Å; T79-E82 WeakPolarHBondContact O-CB 3.44Å; T79-E82 PolarHBondContact O-N 2.94Å; T79-E82 PolarHBondContact OG1-OE1 3.07Å
80	V	96.1	Very high	93.7	Very high	6 Å²	6	51.8 Å²	51.8	4%	0.036	26%	0.258	C	S	.	.	G	3₁₀ helix	trans	-57.4	-34.4	-178.1	177.8	0	0	0	0	111.8	E82 V83 I147 E150 M151 L154	V80-E82 PolarHBondContact O-N 3.18Å; V80-E82 VanDerWaalsContact O-N 3.11Å; V80-V83 PolarHBondContact O-N 2.66Å; V80-I147 HydrophobicContact CG2-CG2 3.99Å; V80-E150 HydrophobicContact CG2-CB 4Å; V80-E150 HydrophobicContact CG2-CG 3.85Å; V80-M151 HydrophobicContact CB-SD 4.48Å; V80-M151 HydrophobicContact CG1-CE 4.08Å; V80-M151 HydrophobicContact CG1-SD 3.85Å; V80-M151 HydrophobicContact CG2-CB 4.12Å; V80-M151 HydrophobicContact CG2-SD 4.48Å; V80-L154 HydrophobicContact CG1-CD2 3.48Å; V80-L154 VanDerWaalsContact CG1-CD2 3.48Å
81	E	95.4	Very high	93.7	Very high	144 Å²	144	50.5 Å²	50.5	67%	0.673	25%	0.254	S	S	*	.	G	3₁₀ helix	trans	-64.3	-14.1	177.9	-66.9	78.8	-173.2	0	0	114.3	T79 V83	T79-E81 PolarHBondContact O-N 2.9Å; E81-V83 VanDerWaalsContact C-N 3.28Å
82	E	91.7	Very high	93.7	Very high	70 Å²	70	49 Å²	49	33%	0.327	25%	0.248	S	C	.	.	G	3₁₀ helix	trans	-76.3	-19.2	175.3	-65.8	175.2	-124.2	0	0	112.6	W78 T79 V80	W78-E82 WeakPolarHBondContact CA-OE1 3.2Å; T79-E82 PolarHBondContact N-OE1 3.07Å; T79-E82 WeakPolarHBondContact O-CB 3.44Å; T79-E82 PolarHBondContact O-N 2.94Å; T79-E82 PolarHBondContact OG1-OE1 3.07Å; V80-E82 PolarHBondContact O-N 3.18Å; V80-E82 VanDerWaalsContact O-N 3.11Å
83	V	92.8	Very high	93.8	Very high	15 Å²	15	50 Å²	50	9%	0.091	25%	0.254	C	S	.	.	S	Bend	trans	-89.7	122.4	-177.7	-176.3	0	0	0	0	110.8	W78 V80 E81 L85 M151 G230 F233 L237	W78-V83 HydrophobicContact CE3-CG2 4.4Å; W78-V83 HydrophobicContact CZ3-CG2 4Å; V80-V83 PolarHBondContact O-N 2.66Å; E81-V83 VanDerWaalsContact C-N 3.28Å; V83-L85 HydrophobicContact CG1-CD2 3.83Å; V83-M151 HydrophobicContact CB-CE 4.41Å; V83-M151 HydrophobicContact CB-SD 3.91Å; V83-M151 HydrophobicContact CG1-CE 4.25Å; V83-M151 HydrophobicContact CG1-SD 4.12Å; V83-M151 HydrophobicContact CG2-SD 3.71Å; V83-G230 WeakPolarHBondContact CG1-O 3.3Å; V83-F233 HydrophobicContact CB-CD1 4.48Å; V83-F233 HydrophobicContact CG1-CD1 4.36Å; V83-F233 HydrophobicContact CG2-CD1 4.08Å; V83-F233 HydrophobicContact CG2-CE1 4.32Å; V83-L237 HydrophobicContact CG2-CD1 4.28Å
84	D	93.3	Very high	94	Very high	100 Å²	100	56.8 Å²	56.8	54%	0.535	28%	0.283	S	S	.	.			trans	-94.1	108.7	177.5	179.3	12.6	0	0	0	111.5	S86 G230	D84-S86 VanDerWaalsContact CG-OG 3.28Å; D84-S86 WeakPolarHBondContact OD1-CB 3.46Å; D84-S86 PolarHBondContact OD1-N 2.76Å; D84-S86 PolarHBondContact OD1-OG 3.23Å; D84-S86 PolarHBondContact OD2-OG 3.49Å; D84-G230 WeakPolarHBondContact O-CA 3.31Å
85	L	94.2	Very high	94.1	Very high	23 Å²	23	54.8 Å²	54.8	12%	0.12	27%	0.274	C	S	.	.			trans	-91.4	0	178	-56.5	-177	0	0	0	113.7	V83 R87 D88 M151 L154 L155 T158	V83-L85 HydrophobicContact CG1-CD2 3.83Å; L85-R87 PolarHBondContact O-N 2.86Å; L85-D88 PolarHBondContact O-N 3.09Å; L85-D88 VanDerWaalsContact O-N 3.09Å; L85-M151 HydrophobicContact CD1-CE 4.14Å; L85-M151 HydrophobicContact CD2-CE 4.25Å; L85-L154 HydrophobicContact CD1-CD2 3.89Å; L85-L154 HydrophobicContact CD1-CG 3.81Å; L85-L155 HydrophobicContact CD1-CD2 4.37Å; L85-L155 HydrophobicContact CD2-CD2 3.67Å; L85-T158 HydrophobicContact CD1-CG2 4.44Å
86	S	92	Very high	94.4	Very high	85 Å²	85	58.2 Å²	58.2	59%	0.594	29%	0.291	S	S	*	.	T	Hydrogen-bonded Turn	trans	-59.7	-27.8	-169.4	63.5	0	0	0	0	114.4	D84	D84-S86 VanDerWaalsContact CG-OG 3.28Å; D84-S86 WeakPolarHBondContact OD1-CB 3.46Å; D84-S86 PolarHBondContact OD1-N 2.76Å; D84-S86 PolarHBondContact OD1-OG 3.23Å; D84-S86 PolarHBondContact OD2-OG 3.49Å
87	R	92.1	Very high	94.6	Very high	157 Å²	157	61.1 Å²	61.1	59%	0.592	32%	0.316	S	S	*	.	T	Hydrogen-bonded Turn	trans	-92.5	-20.1	-178.3	-66.6	-179.8	60.3	-173.5	-5.5	113.4	L85 M89 T90 P229	L85-R87 PolarHBondContact O-N 2.86Å; R87-M89 PolarHBondContact O-N 2.83Å; R87-T90 PolarHBondContact O-N 3.43Å; R87-P229 HydrophobicContact CB-CG 3.81Å
88	D	96.3	Very high	94.8	Very high	0 Å²	0	62.5 Å²	62.5	0%	0	33%	0.326	C	S	.	.	H	α-helix	trans	-67.8	-39.6	-168.6	-73.7	10.1	0	0	0	111.9	L85 T90 D91 W92 Y159 M228 P229 G230 L231	L85-D88 PolarHBondContact O-N 3.09Å; L85-D88 VanDerWaalsContact O-N 3.09Å; D88-T90 PolarHBondContact O-N 2.91Å; D88-D91 CarbonylContact O-C 3.59Å; D88-D91 PolarHBondContact O-N 3.34Å; D88-W92 WeakPolarHBondContact O-CB 3.5Å; D88-W92 PolarHBondContact O-N 3.24Å; D88-Y159 HydrophobicContact CB-CE1 3.6Å; D88-Y159 PolarHBondContact OD2-OH 2.86Å; D88-M228 HydrophobicContact CB-CB 4.34Å; D88-M228 HydrophobicContact CB-CG 4.36Å; D88-M228 VanDerWaalsContact OD1-CA 3.27Å; D88-M228 WeakPolarHBondContact OD1-CA 3.48Å; D88-P229 WeakPolarHBondContact OD1-CD 3.33Å; D88-P229 WeakPolarHBondContact OD1-CG 3.23Å; D88-G230 PolarHBondContact OD1-N 3.43Å; D88-G230 WeakPolarHBondContact OD2-CA 3.34Å; D88-G230 PolarHBondContact OD2-N 2.61Å; D88-L231 PolarHBondContact OD2-N 3.26Å
89	M	95.3	Very high	94.8	Very high	48 Å²	48	63 Å²	63	24%	0.236	33%	0.329	C	S	.	.	H	α-helix	trans	-58.8	-34.1	178.7	-73.3	-53.4	-63.2	0	0	113	R87 D91 E93 T158 Y159	R87-M89 PolarHBondContact O-N 2.83Å; M89-D91 VanDerWaalsContact C-N 3.28Å; M89-D91 PolarHBondContact O-N 3.04Å; M89-E93 WeakPolarHBondContact O-CG 3.36Å; M89-E93 PolarHBondContact O-N 2.8Å; M89-E93 VanDerWaalsContact O-N 3.13Å; M89-T158 HydrophobicContact CG-CG2 4Å; M89-T158 HydrophobicContact SD-CG2 3.87Å; M89-Y159 HydrophobicContact SD-CD1 3.8Å
90	T	94.6	Very high	94.8	Very high	87 Å²	87	63.3 Å²	63.3	53%	0.534	33%	0.326	S	S	.	.	H	α-helix	trans	-68	-32.8	178	-60	0	0	0	0	111.7	R87 D88 K94	R87-T90 PolarHBondContact O-N 3.43Å; D88-T90 PolarHBondContact O-N 2.91Å; T90-K94 WeakPolarHBondContact O-CE 3.37Å; T90-K94 WeakPolarHBondContact O-CG 3.3Å
91	D	96.1	Very high	94.7	Very high	19 Å²	19	66.4 Å²	66.4	10%	0.102	34%	0.341	C	S	.	.	H	α-helix	trans	-84.4	-39.1	177.8	-68.5	-22.3	0	0	0	111.3	D88 M89 E93 K94 L95 L227 M228	D88-D91 CarbonylContact O-C 3.59Å; D88-D91 PolarHBondContact O-N 3.34Å; M89-D91 VanDerWaalsContact C-N 3.28Å; M89-D91 PolarHBondContact O-N 3.04Å; D91-E93 VanDerWaalsContact C-N 3.27Å; D91-E93 PolarHBondContact O-N 3.47Å; D91-K94 WeakPolarHBondContact O-CB 3.33Å; D91-K94 PolarHBondContact O-N 2.93Å; D91-K94 IonicContact OD1-NZ 2.95Å; D91-K94 PolarHBondContact OD1-NZ 3.25Å; D91-L95 WeakPolarHBondContact O-CG 3.47Å; D91-L95 PolarHBondContact O-N 3.13Å; D91-L227 HydrophobicContact CB-CD2 4.26Å; D91-M228 HydrophobicContact CB-CG 4.21Å; D91-M228 PolarHBondContact OD2-N 3.17Å
92	W	96.3	Very high	94.7	Very high	9 Å²	9	59.6 Å²	59.6	3%	0.034	31%	0.309	C	S	.	.	H	α-helix	trans	-49.1	-49	172	-179.3	-107.8	0	0	0	111.1	D88 K94 L95 K100 I103 S104 Y159 I160 M228	D88-W92 WeakPolarHBondContact O-CB 3.5Å; D88-W92 PolarHBondContact O-N 3.24Å; W92-K94 PolarHBondContact O-N 3.44Å; W92-L95 HydrophobicContact CE3-CD1 3.85Å; W92-L95 HydrophobicContact CZ3-CD1 4.3Å; W92-L95 WeakPolarHBondContact O-CB 3.38Å; W92-L95 PolarHBondContact O-N 2.95Å; W92-L95 VanDerWaalsContact O-N 3.08Å; W92-K100 HydrophobicContact CD2-CG 4.32Å; W92-K100 HydrophobicContact CH2-CB 3.93Å; W92-K100 HydrophobicContact CH2-CG 4.11Å; W92-K100 HydrophobicContact CZ2-CB 3.94Å; W92-K100 HydrophobicContact CZ2-CD 4.2Å; W92-K100 HydrophobicContact CZ2-CG 3.91Å; W92-K100 HydrophobicContact CZ3-CG 4.4Å; W92-K100 WeakPolarHBondContact O-CE 3.34Å; W92-I103 HydrophobicContact CH2-CB 4.47Å; W92-I103 HydrophobicContact CZ3-CB 3.95Å; W92-I103 HydrophobicContact CZ3-CD1 4.13Å; W92-I103 HydrophobicContact CZ3-CG2 3.82Å; W92-S104 WeakPolarHBondContact CH2-OG 3.24Å; W92-Y159 HydrophobicContact CD2-CG 4.2Å; W92-Y159 HydrophobicContact CE3-CD2 4.32Å; W92-Y159 HydrophobicContact CE3-CG 4.11Å; W92-Y159 HydrophobicContact CZ3-CD2 4.29Å; W92-Y159 HydrophobicContact CZ3-CG 4.39Å; W92-Y159 PolarHBondContact NE1-O 3Å; W92-I160 HydrophobicContact CH2-CD1 4.13Å; W92-I160 HydrophobicContact CZ2-CD1 3.73Å; W92-M228 HydrophobicContact CE3-SD 3.98Å
93	E	95	Very high	94.9	Very high	101 Å²	101	56.5 Å²	56.5	47%	0.472	29%	0.294	S	S	.	.	T	Hydrogen-bonded Turn	trans	-66.7	-19.1	-179	-67	-53.3	160.7	0	0	115.2	M89 D91 K100	M89-E93 WeakPolarHBondContact O-CG 3.36Å; M89-E93 PolarHBondContact O-N 2.8Å; M89-E93 VanDerWaalsContact O-N 3.13Å; D91-E93 VanDerWaalsContact C-N 3.27Å; D91-E93 PolarHBondContact O-N 3.47Å; E93-K100 IonicContact OE2-NZ 3.64Å; E93-K100 PolarHBondContact OE2-NZ 2.97Å
94	K	95	Very high	95	Very high	145 Å²	145	55.9 Å²	55.9	63%	0.63	29%	0.291	S	S	*	.	T	Hydrogen-bonded Turn	trans	-87.4	-16.2	175.9	-60.6	169	-163	152.4	0	112.7	T90 D91 W92	T90-K94 WeakPolarHBondContact O-CE 3.37Å; T90-K94 WeakPolarHBondContact O-CG 3.3Å; D91-K94 WeakPolarHBondContact O-CB 3.33Å; D91-K94 PolarHBondContact O-N 2.93Å; D91-K94 IonicContact OD1-NZ 2.95Å; D91-K94 PolarHBondContact OD1-NZ 3.25Å; W92-K94 PolarHBondContact O-N 3.44Å
95	L	95.6	Very high	95	Very high	12 Å²	12	53.4 Å²	53.4	6%	0.063	27%	0.274	C	S	.	.	S	Bend	trans	-65.9	145	178.4	-63.3	-179.2	0	0	0	110.6	D91 W92 E99 K100 I103 L227 M228	D91-L95 WeakPolarHBondContact O-CG 3.47Å; D91-L95 PolarHBondContact O-N 3.13Å; W92-L95 HydrophobicContact CE3-CD1 3.85Å; W92-L95 HydrophobicContact CZ3-CD1 4.3Å; W92-L95 WeakPolarHBondContact O-CB 3.38Å; W92-L95 PolarHBondContact O-N 2.95Å; W92-L95 VanDerWaalsContact O-N 3.08Å; L95-E99 WeakPolarHBondContact CA-OE2 3.44Å; L95-E99 HydrophobicContact CB-CB 4.01Å; L95-E99 HydrophobicContact CD1-CB 4.44Å; L95-E99 HydrophobicContact CD2-CB 4.3Å; L95-E99 HydrophobicContact CG-CB 4.48Å; L95-K100 HydrophobicContact CB-CG 3.83Å; L95-I103 HydrophobicContact CD1-CD1 3.52Å; L95-L227 HydrophobicContact CD2-CD1 3.97Å; L95-M228 HydrophobicContact CD1-CE 3.91Å; L95-M228 HydrophobicContact CD1-SD 3.83Å
96	N	95.6	Very high	95	Very high	76 Å²	76	52.3 Å²	52.3	41%	0.406	27%	0.269	S	S	.	.			trans	-75.9	167.7	173.4	73	61.9	0	0	0	111.2	N98 E99 K100	N96-N98 VanDerWaalsContact C-N 3.27Å; N96-N98 PolarHBondContact O-N 2.96Å; N96-N98 WeakPolarHBondContact OD1-CA 3.43Å; N96-N98 VanDerWaalsContact OD1-CB 3.28Å; N96-N98 WeakPolarHBondContact OD1-CB 3.4Å; N96-N98 PolarHBondContact OD1-N 3.25Å; N96-E99 PolarHBondContact N-OE2 3.29Å; N96-E99 WeakPolarHBondContact ND2-CG 3.37Å; N96-E99 PolarHBondContact ND2-OE2 3.06Å; N96-E99 PolarHBondContact O-N 2.72Å; N96-E99 PolarHBondContact OD1-N 3.48Å; N96-K100 PolarHBondContact O-N 2.93Å
97	A	95.5	Very high	95.1	Very high	78 Å²	78	48.3 Å²	48.3	65%	0.645	24%	0.241	S	C	*	.	H	α-helix	trans	-59.4	-34.6	-176.8	0	0	0	0	0	113.7	H101	A97-H101 WeakPolarHBondContact O-CB 3.43Å; A97-H101 PolarHBondContact O-N 3.36Å
98	N	96	Very high	95.1	Very high	90 Å²	90	40.9 Å²	40.9	48%	0.481	21%	0.213	S	C	.	.	H	α-helix	trans	-69.7	-40.2	178.8	-65.8	-17.3	0	0	0	111.4	N96 H101 F102 L288	N96-N98 VanDerWaalsContact C-N 3.27Å; N96-N98 PolarHBondContact O-N 2.96Å; N96-N98 WeakPolarHBondContact OD1-CA 3.43Å; N96-N98 VanDerWaalsContact OD1-CB 3.28Å; N96-N98 WeakPolarHBondContact OD1-CB 3.4Å; N96-N98 PolarHBondContact OD1-N 3.25Å; N98-H101 PolarHBondContact O-N 3.12Å; N98-F102 WeakPolarHBondContact O-CB 3.47Å; N98-F102 PolarHBondContact O-N 3.46Å; N98-L288 HydrophobicContact CB-CB 4.12Å; N98-L288 HydrophobicContact CB-CD2 3.84Å
99	E	96.2	Very high	94.8	Very high	15 Å²	15	40.9 Å²	40.9	7%	0.07	21%	0.213	C	C	.	.	H	α-helix	trans	-66.5	-47.4	176.9	-68.4	171.1	140.7	0	0	111.2	L95 N96 H101 F102 I103 R225 I289	L95-E99 WeakPolarHBondContact CA-OE2 3.44Å; L95-E99 HydrophobicContact CB-CB 4.01Å; L95-E99 HydrophobicContact CD1-CB 4.44Å; L95-E99 HydrophobicContact CD2-CB 4.3Å; L95-E99 HydrophobicContact CG-CB 4.48Å; N96-E99 PolarHBondContact N-OE2 3.29Å; N96-E99 WeakPolarHBondContact ND2-CG 3.37Å; N96-E99 PolarHBondContact ND2-OE2 3.06Å; N96-E99 PolarHBondContact O-N 2.72Å; N96-E99 PolarHBondContact OD1-N 3.48Å; E99-H101 VanDerWaalsContact C-N 3.32Å; E99-H101 PolarHBondContact O-N 3.11Å; E99-F102 PolarHBondContact O-N 3.45Å; E99-I103 WeakPolarHBondContact O-CD1 3.29Å; E99-I103 WeakPolarHBondContact O-CG1 3.28Å; E99-I103 PolarHBondContact O-N 2.76Å; E99-R225 IonicContact OE1-CZ 2.68Å; E99-R225 IonicContact OE1-NH1 2.95Å; E99-R225 PolarHBondContact OE1-NH1 2.91Å; E99-R225 IonicContact OE1-NH2 3Å; E99-R225 PolarHBondContact OE1-NH2 2.91Å; E99-I289 HydrophobicContact CG-CG2 4.28Å
100	K	96.2	Very high	94.7	Very high	49 Å²	49	38.6 Å²	38.6	21%	0.213	20%	0.201	C	C	.	.	H	α-helix	trans	-57.7	-45.7	175	-70.7	-173.5	172.7	-171	0	111	W92 E93 L95 N96 I103 S104	W92-K100 HydrophobicContact CD2-CG 4.32Å; W92-K100 HydrophobicContact CH2-CB 3.93Å; W92-K100 HydrophobicContact CH2-CG 4.11Å; W92-K100 HydrophobicContact CZ2-CB 3.94Å; W92-K100 HydrophobicContact CZ2-CD 4.2Å; W92-K100 HydrophobicContact CZ2-CG 3.91Å; W92-K100 HydrophobicContact CZ3-CG 4.4Å; W92-K100 WeakPolarHBondContact O-CE 3.34Å; E93-K100 IonicContact OE2-NZ 3.64Å; E93-K100 PolarHBondContact OE2-NZ 2.97Å; L95-K100 HydrophobicContact CB-CG 3.83Å; N96-K100 PolarHBondContact O-N 2.93Å; K100-I103 PolarHBondContact O-N 3.19Å; K100-S104 WeakPolarHBondContact O-CB 3.48Å; K100-S104 PolarHBondContact O-N 3.03Å; K100-S104 PolarHBondContact O-OG 2.98Å
101	H	93.7	Very high	94.5	Very high	72 Å²	72	35.5 Å²	35.5	33%	0.333	18%	0.184	S	C	.	.	H	α-helix	trans	-59.8	-49.2	177.5	177.4	67.6	0	0	0	112	A97 N98 E99 I103 S104 Y105	A97-H101 WeakPolarHBondContact O-CB 3.43Å; A97-H101 PolarHBondContact O-N 3.36Å; N98-H101 PolarHBondContact O-N 3.12Å; E99-H101 VanDerWaalsContact C-N 3.32Å; E99-H101 PolarHBondContact O-N 3.11Å; H101-I103 PolarHBondContact O-N 2.8Å; H101-S104 PolarHBondContact O-N 3.44Å; H101-Y105 AromaticContact CE1-CD2 3.69Å; H101-Y105 AromaticContact CE1-CE1 3.79Å; H101-Y105 AromaticContact CE1-CE2 3.36Å; H101-Y105 WeakPolarHBondContact CE1-CE2 3.46Å; H101-Y105 AromaticContact CE1-CZ 3.42Å; H101-Y105 VanDerWaalsContact CE1-CZ 3.42Å; H101-Y105 AromaticContact ND1-CD2 3.7Å; H101-Y105 AromaticContact ND1-CE2 3.47Å; H101-Y105 WeakPolarHBondContact ND1-CE2 3.33Å; H101-Y105 WeakPolarHBondContact O-CD2 3.09Å; H101-Y105 PolarHBondContact O-N 2.99Å; H101-Y105 VanDerWaalsContact O-N 3.1Å
102	F	95.3	Very high	94.1	Very high	1 Å²	1	35.3 Å²	35.3	0%	0.004	19%	0.185	C	C	.	.	H	α-helix	trans	-57.9	-50.8	179.1	-178.1	-85.9	0	0	0	111.9	N98 E99 S104 Y105 V106 L284 V286 L288 I289	N98-F102 WeakPolarHBondContact O-CB 3.47Å; N98-F102 PolarHBondContact O-N 3.46Å; E99-F102 PolarHBondContact O-N 3.45Å; F102-S104 PolarHBondContact O-N 3.16Å; F102-Y105 PolarHBondContact O-N 3.27Å; F102-V106 HydrophobicContact CD1-CG2 4.08Å; F102-V106 HydrophobicContact CE1-CG2 3.58Å; F102-V106 HydrophobicContact CE2-CG2 4.44Å; F102-V106 HydrophobicContact CZ-CG2 3.78Å; F102-V106 WeakPolarHBondContact O-CG2 3.17Å; F102-V106 PolarHBondContact O-N 3.5Å; F102-L284 HydrophobicContact CD2-CD1 4.25Å; F102-L284 HydrophobicContact CD2-CD2 4.2Å; F102-L284 HydrophobicContact CD2-CG 3.74Å; F102-L284 HydrophobicContact CE2-CD2 4.23Å; F102-L284 HydrophobicContact CE2-CG 3.95Å; F102-V286 HydrophobicContact CE2-CB 4.35Å; F102-V286 HydrophobicContact CE2-CG1 3.85Å; F102-V286 HydrophobicContact CZ-CG1 3.91Å; F102-L288 HydrophobicContact CB-CB 4.17Å; F102-L288 HydrophobicContact CB-CD1 4.41Å; F102-L288 HydrophobicContact CD2-CB 4.35Å; F102-L288 HydrophobicContact CD2-CD1 4.38Å; F102-I289 HydrophobicContact CB-CG2 3.81Å; F102-I289 HydrophobicContact CD1-CD1 4.05Å; F102-I289 HydrophobicContact CD1-CG1 4.35Å; F102-I289 HydrophobicContact CD1-CG2 3.52Å; F102-I289 HydrophobicContact CE1-CD1 3.66Å; F102-I289 HydrophobicContact CE1-CG1 4.32Å; F102-I289 HydrophobicContact CE1-CG2 4.27Å; F102-I289 HydrophobicContact CG-CG2 3.68Å; F102-I289 HydrophobicContact CZ-CD1 4.06Å
103	I	95.9	Very high	93.8	Very high	4 Å²	4	35.3 Å²	35.3	2%	0.021	19%	0.187	C	C	.	.	H	α-helix	trans	-64.8	-44.2	-177.6	-64.5	157.1	0	0	0	110.9	W92 L95 E99 K100 H101 Y105 V106 L107 L222 M228 L231	W92-I103 HydrophobicContact CH2-CB 4.47Å; W92-I103 HydrophobicContact CZ3-CB 3.95Å; W92-I103 HydrophobicContact CZ3-CD1 4.13Å; W92-I103 HydrophobicContact CZ3-CG2 3.82Å; L95-I103 HydrophobicContact CD1-CD1 3.52Å; E99-I103 WeakPolarHBondContact O-CD1 3.29Å; E99-I103 WeakPolarHBondContact O-CG1 3.28Å; E99-I103 PolarHBondContact O-N 2.76Å; K100-I103 PolarHBondContact O-N 3.19Å; H101-I103 PolarHBondContact O-N 2.8Å; I103-Y105 VanDerWaalsContact C-N 3.28Å; I103-Y105 PolarHBondContact O-N 3.38Å; I103-V106 PolarHBondContact O-N 3.31Å; I103-L107 HydrophobicContact CG2-CD1 3.93Å; I103-L107 HydrophobicContact CG2-CG 4.26Å; I103-L107 VanDerWaalsContact O-CG 3.3Å; I103-L107 WeakPolarHBondContact O-CG 3.32Å; I103-L107 PolarHBondContact O-N 2.9Å; I103-L222 HydrophobicContact CD1-CD1 3.73Å; I103-L222 HydrophobicContact CG1-CD1 3.71Å; I103-M228 HydrophobicContact CD1-CE 3.48Å; I103-M228 VanDerWaalsContact CD1-CE 3.48Å; I103-M228 HydrophobicContact CD1-SD 4.08Å; I103-L231 HydrophobicContact CG2-CD2 3.9Å
104	S	94.4	Very high	93.6	Very high	2 Å²	2	30.5 Å²	30.5	1%	0.014	17%	0.165	C	C	.	.	H	α-helix	trans	-57.1	-43.8	178.9	-54.5	0	0	0	0	111.6	W92 K100 H101 F102 L107 A108 I160	W92-S104 WeakPolarHBondContact CH2-OG 3.24Å; K100-S104 WeakPolarHBondContact O-CB 3.48Å; K100-S104 PolarHBondContact O-N 3.03Å; K100-S104 PolarHBondContact O-OG 2.98Å; H101-S104 PolarHBondContact O-N 3.44Å; F102-S104 PolarHBondContact O-N 3.16Å; S104-L107 PolarHBondContact O-N 3.11Å; S104-A108 WeakPolarHBondContact O-CB 3.2Å; S104-A108 PolarHBondContact O-N 3.46Å; S104-I160 VanDerWaalsContact OG-CD1 3.27Å; S104-I160 WeakPolarHBondContact OG-CD1 3.26Å
105	Y	93	Very high	93.5	Very high	48 Å²	48	25 Å²	25	19%	0.188	15%	0.149	C	C	.	.	H	α-helix	trans	-74.6	-33.5	-178.3	-85.3	-126.9	0	0	0	112.5	H101 F102 I103 F109 L169 I176 L284	H101-Y105 AromaticContact CE1-CD2 3.69Å; H101-Y105 AromaticContact CE1-CE1 3.79Å; H101-Y105 AromaticContact CE1-CE2 3.36Å; H101-Y105 WeakPolarHBondContact CE1-CE2 3.46Å; H101-Y105 AromaticContact CE1-CZ 3.42Å; H101-Y105 VanDerWaalsContact CE1-CZ 3.42Å; H101-Y105 AromaticContact ND1-CD2 3.7Å; H101-Y105 AromaticContact ND1-CE2 3.47Å; H101-Y105 WeakPolarHBondContact ND1-CE2 3.33Å; H101-Y105 WeakPolarHBondContact O-CD2 3.09Å; H101-Y105 PolarHBondContact O-N 2.99Å; H101-Y105 VanDerWaalsContact O-N 3.1Å; F102-Y105 PolarHBondContact O-N 3.27Å; I103-Y105 VanDerWaalsContact C-N 3.28Å; I103-Y105 PolarHBondContact O-N 3.38Å; Y105-F109 WeakPolarHBondContact O-CB 3.46Å; Y105-F109 PolarHBondContact O-N 3.09Å; Y105-L169 HydrophobicContact CD2-CD2 3.93Å; Y105-L169 HydrophobicContact CE2-CD2 3.99Å; Y105-I176 HydrophobicContact CD1-CD1 3.72Å; Y105-I176 HydrophobicContact CD1-CG1 4.29Å; Y105-I176 HydrophobicContact CD1-CG2 3.86Å; Y105-I176 HydrophobicContact CD2-CD1 4.48Å; Y105-I176 HydrophobicContact CE1-CB 4.45Å; Y105-I176 HydrophobicContact CE1-CD1 3.61Å; Y105-I176 HydrophobicContact CE1-CG1 3.79Å; Y105-I176 HydrophobicContact CE1-CG2 3.78Å; Y105-I176 HydrophobicContact CE2-CD1 4.39Å; Y105-I176 HydrophobicContact CG-CD1 4.16Å; Y105-L284 HydrophobicContact CD1-CD1 4.26Å; Y105-L284 HydrophobicContact CG-CD1 4.18Å
106	V	94	Very high	93.3	Very high	1 Å²	1	25.2 Å²	25.2	1%	0.006	15%	0.15	C	C	.	.	H	α-helix	trans	-64.3	-45	171.2	166.8	0	0	0	0	111.1	F102 I103 A108 F109 F110 I219 L284	F102-V106 HydrophobicContact CD1-CG2 4.08Å; F102-V106 HydrophobicContact CE1-CG2 3.58Å; F102-V106 HydrophobicContact CE2-CG2 4.44Å; F102-V106 HydrophobicContact CZ-CG2 3.78Å; F102-V106 WeakPolarHBondContact O-CG2 3.17Å; F102-V106 PolarHBondContact O-N 3.5Å; I103-V106 PolarHBondContact O-N 3.31Å; V106-A108 VanDerWaalsContact C-N 3.33Å; V106-A108 PolarHBondContact O-N 3.5Å; V106-F109 WeakPolarHBondContact O-CB 3.23Å; V106-F109 PolarHBondContact O-N 2.63Å; V106-F110 HydrophobicContact CG1-CD2 3.81Å; V106-F110 HydrophobicContact CG1-CE2 3.46Å; V106-F110 VanDerWaalsContact CG1-CE2 3.46Å; V106-F110 HydrophobicContact CG1-CZ 3.91Å; V106-F110 WeakPolarHBondContact O-CD2 3.43Å; V106-F110 WeakPolarHBondContact O-CG 3.12Å; V106-F110 PolarHBondContact O-N 3.08Å; V106-I219 HydrophobicContact CG1-CD1 4.02Å; V106-L284 HydrophobicContact CG2-CD2 3.72Å
107	L	94.7	Very high	93.3	Very high	1 Å²	1	21.8 Å²	21.8	1%	0.005	13%	0.132	C	C	.	.	H	α-helix	trans	-62.8	-42.2	177.3	-67.9	173.7	0	0	0	111.7	I103 S104 F109 F110 A111 Y152 L155 I156 Y159 L231	I103-L107 HydrophobicContact CG2-CD1 3.93Å; I103-L107 HydrophobicContact CG2-CG 4.26Å; I103-L107 VanDerWaalsContact O-CG 3.3Å; I103-L107 WeakPolarHBondContact O-CG 3.32Å; I103-L107 PolarHBondContact O-N 2.9Å; S104-L107 PolarHBondContact O-N 3.11Å; L107-F109 VanDerWaalsContact C-N 3.32Å; L107-F109 PolarHBondContact O-N 3.03Å; L107-F110 PolarHBondContact O-N 3.33Å; L107-A111 WeakPolarHBondContact O-CB 3.47Å; L107-A111 PolarHBondContact O-N 2.82Å; L107-Y152 HydrophobicContact CD2-CD1 3.76Å; L107-Y152 HydrophobicContact CD2-CE1 4.17Å; L107-L155 HydrophobicContact CD1-CB 4.07Å; L107-L155 HydrophobicContact CD2-CB 4.12Å; L107-L155 HydrophobicContact CD2-CD1 3.87Å; L107-I156 HydrophobicContact CB-CD1 4.14Å; L107-I156 HydrophobicContact CB-CG1 3.74Å; L107-I156 HydrophobicContact CD1-CG1 4.37Å; L107-Y159 HydrophobicContact CD1-CD2 3.77Å; L107-Y159 HydrophobicContact CD1-CE2 4Å; L107-L231 HydrophobicContact CD2-CD1 3.82Å
108	A	91.7	Very high	93.2	Very high	1 Å²	1	20.4 Å²	20.4	1%	0.008	11%	0.111	C	C	.	.	H	α-helix	trans	-63.8	-38.1	176.3	0	0	0	0	0	112.4	S104 V106 A112 L169 A172 I176	S104-A108 WeakPolarHBondContact O-CB 3.2Å; S104-A108 PolarHBondContact O-N 3.46Å; V106-A108 VanDerWaalsContact C-N 3.33Å; V106-A108 PolarHBondContact O-N 3.5Å; A108-A112 WeakPolarHBondContact O-CB 3.42Å; A108-A112 PolarHBondContact O-N 2.58Å; A108-L169 HydrophobicContact CB-CB 3.91Å; A108-L169 HydrophobicContact CB-CD2 3.81Å; A108-L169 HydrophobicContact CB-CG 4.43Å; A108-A172 HydrophobicContact CB-CB 3.94Å; A108-I176 HydrophobicContact CB-CD1 4.38Å
109	F	91.1	Very high	93.1	Very high	0 Å²	0	20.2 Å²	20.2	0%	0	11%	0.108	C	C	.	.	H	α-helix	trans	-60.9	-48.8	172	164.2	-108.4	0	0	0	111.8	Y105 V106 L107 A112 S113 V179 K182 F211 F212 F279	Y105-F109 WeakPolarHBondContact O-CB 3.46Å; Y105-F109 PolarHBondContact O-N 3.09Å; V106-F109 WeakPolarHBondContact O-CB 3.23Å; V106-F109 PolarHBondContact O-N 2.63Å; L107-F109 VanDerWaalsContact C-N 3.32Å; L107-F109 PolarHBondContact O-N 3.03Å; F109-A112 PolarHBondContact O-N 3.19Å; F109-S113 WeakPolarHBondContact CD2-OG 3.1Å; F109-S113 WeakPolarHBondContact CE2-OG 3.49Å; F109-S113 VanDerWaalsContact O-CB 3.32Å; F109-S113 WeakPolarHBondContact O-CB 3.27Å; F109-S113 PolarHBondContact O-N 2.87Å; F109-S113 PolarHBondContact O-OG 3.3Å; F109-V179 HydrophobicContact CB-CG2 3.91Å; F109-V179 HydrophobicContact CD2-CG1 4.3Å; F109-V179 HydrophobicContact CD2-CG2 4.33Å; F109-K182 HydrophobicContact CD2-CD 3.93Å; F109-K182 HydrophobicContact CE2-CB 4.08Å; F109-K182 HydrophobicContact CE2-CD 3.2Å; F109-K182 HydrophobicContact CE2-CG 4.3Å; F109-K182 HydrophobicContact CZ-CD 3.65Å; F109-F211 HydrophobicContact CZ-CB 4.46Å; F109-F212 HydrophobicContact CE1-CD1 4.29Å; F109-F279 HydrophobicContact CB-CZ 4.15Å; F109-F279 HydrophobicContact CD1-CZ 4.43Å; F109-F279 HydrophobicContact CD2-CZ 4.39Å; F109-F279 HydrophobicContact CG-CZ 4.04Å
110	F	92.4	Very high	93	Very high	0 Å²	0	20.1 Å²	20.1	0%	0	11%	0.108	C	C	.	.	H	α-helix	trans	-63.2	-51.2	-179.7	-69.2	-33.8	0	0	0	112.5	V106 L107 A112 S113 D114 Y152 F212 F216 I219	V106-F110 HydrophobicContact CG1-CD2 3.81Å; V106-F110 HydrophobicContact CG1-CE2 3.46Å; V106-F110 VanDerWaalsContact CG1-CE2 3.46Å; V106-F110 HydrophobicContact CG1-CZ 3.91Å; V106-F110 WeakPolarHBondContact O-CD2 3.43Å; V106-F110 WeakPolarHBondContact O-CG 3.12Å; V106-F110 PolarHBondContact O-N 3.08Å; L107-F110 PolarHBondContact O-N 3.33Å; F110-A112 PolarHBondContact O-N 3.07Å; F110-A112 VanDerWaalsContact O-N 3.13Å; F110-S113 PolarHBondContact O-N 3.16Å; F110-D114 PolarHBondContact O-N 3.41Å; F110-Y152 HydrophobicContact CB-CD1 3.92Å; F110-Y152 HydrophobicContact CB-CD2 3.7Å; F110-Y152 HydrophobicContact CB-CE1 3.76Å; F110-Y152 HydrophobicContact CB-CE2 3.53Å; F110-Y152 HydrophobicContact CB-CG 3.9Å; F110-Y152 HydrophobicContact CD2-CD1 4.03Å; F110-Y152 AromaticContact CD2-CE1 3.26Å; F110-Y152 HydrophobicContact CD2-CE1 3.26Å; F110-Y152 HydrophobicContact CD2-CE2 4.29Å; F110-Y152 AromaticContact CD2-CZ 3.4Å; F110-Y152 VanDerWaalsContact CD2-CZ 3.4Å; F110-Y152 WeakPolarHBondContact CD2-OH 3.26Å; F110-Y152 HydrophobicContact CE2-CE1 4.02Å; F110-Y152 HydrophobicContact CG-CD1 4.47Å; F110-Y152 AromaticContact CG-CE1 3.88Å; F110-Y152 HydrophobicContact CG-CE1 3.88Å; F110-Y152 HydrophobicContact CG-CE2 4.11Å; F110-Y152 AromaticContact CG-CZ 3.64Å; F110-F212 AromaticContact CD1-CD1 3.47Å; F110-F212 HydrophobicContact CD1-CD1 3.47Å; F110-F212 VanDerWaalsContact CD1-CD1 3.47Å; F110-F212 AromaticContact CD1-CE1 3.82Å; F110-F212 HydrophobicContact CD1-CE1 3.82Å; F110-F212 HydrophobicContact CE1-CB 4.37Å; F110-F212 AromaticContact CE1-CD1 3.53Å; F110-F212 HydrophobicContact CE1-CD1 3.53Å; F110-F212 HydrophobicContact CE1-CE1 4.34Å; F110-F212 HydrophobicContact CE1-CG 4.43Å; F110-F216 HydrophobicContact CE1-CD1 4.29Å; F110-F216 HydrophobicContact CE1-CE1 4.08Å; F110-F216 HydrophobicContact CE2-CD1 4.16Å; F110-F216 HydrophobicContact CE2-CE1 4.15Å; F110-F216 AromaticContact CZ-CD1 3.54Å; F110-F216 HydrophobicContact CZ-CD1 3.54Å; F110-F216 AromaticContact CZ-CE1 3.64Å; F110-F216 HydrophobicContact CZ-CE1 3.64Å; F110-F216 HydrophobicContact CZ-CG 4.42Å; F110-I219 HydrophobicContact CE2-CD1 3.64Å; F110-I219 HydrophobicContact CZ-CD1 4.45Å
111	A	90.4	Very high	93	Very high	21 Å²	21	17.8 Å²	17.8	17%	0.174	10%	0.097	C	C	.	.	H	α-helix	trans	-55.1	-37.1	179.1	0	0	0	0	0	112.8	L107 I156	L107-A111 WeakPolarHBondContact O-CB 3.47Å; L107-A111 PolarHBondContact O-N 2.82Å; A111-I156 HydrophobicContact CB-CD1 4.16Å
112	A	88.7	Confident	93	Very high	15 Å²	15	17.4 Å²	17.4	12%	0.124	10%	0.1	C	C	.	.	H	α-helix	trans	-73.8	-37.6	175.4	0	0	0	0	0	113.3	A108 F109 F110 I116 I173 V179	A108-A112 WeakPolarHBondContact O-CB 3.42Å; A108-A112 PolarHBondContact O-N 2.58Å; F109-A112 PolarHBondContact O-N 3.19Å; F110-A112 PolarHBondContact O-N 3.07Å; F110-A112 VanDerWaalsContact O-N 3.13Å; A112-I116 WeakPolarHBondContact O-CG1 3.38Å; A112-I116 PolarHBondContact O-N 3.11Å; A112-I173 HydrophobicContact CB-CD1 3.97Å; A112-I173 HydrophobicContact CB-CG1 3.63Å; A112-V179 HydrophobicContact CB-CG1 4.3Å
113	S	90	Very high	92.7	Very high	10 Å²	10	22.7 Å²	22.7	7%	0.07	13%	0.125	C	C	.	.	H	α-helix	trans	-77.4	-40.2	-172.4	-58.7	0	0	0	0	112.3	F109 F110 G115 I116 V117	F109-S113 WeakPolarHBondContact CD2-OG 3.1Å; F109-S113 WeakPolarHBondContact CE2-OG 3.49Å; F109-S113 VanDerWaalsContact O-CB 3.32Å; F109-S113 WeakPolarHBondContact O-CB 3.27Å; F109-S113 PolarHBondContact O-N 2.87Å; F109-S113 PolarHBondContact O-OG 3.3Å; F110-S113 PolarHBondContact O-N 3.16Å; S113-G115 VanDerWaalsContact C-N 3.26Å; S113-G115 PolarHBondContact O-N 3.36Å; S113-I116 WeakPolarHBondContact O-CA 3.39Å; S113-I116 WeakPolarHBondContact O-CB 3.32Å; S113-I116 PolarHBondContact O-N 3.41Å; S113-V117 PolarHBondContact O-N 3.26Å
114	D	91.4	Very high	92.5	Very high	0 Å²	0	24.7 Å²	24.7	0%	0	13%	0.132	C	C	.	.	H	α-helix	trans	-63.9	-35.9	177.3	-61	-12.2	0	0	0	111.1	F110 I116 V117 F118 H148 Y152 F212	F110-D114 PolarHBondContact O-N 3.41Å; D114-I116 VanDerWaalsContact C-N 3.27Å; D114-I116 PolarHBondContact O-N 2.92Å; D114-V117 PolarHBondContact O-N 3.37Å; D114-F118 WeakPolarHBondContact O-CB 3Å; D114-F118 PolarHBondContact O-N 2.91Å; D114-H148 WeakPolarHBondContact OD2-CB 3.39Å; D114-Y152 WeakPolarHBondContact OD2-CD2 3.48Å; D114-Y152 WeakPolarHBondContact OD2-CE2 3.34Å; D114-F212 VanDerWaalsContact OD1-CE1 3.22Å; D114-F212 WeakPolarHBondContact OD1-CE1 3.5Å; D114-F212 VanDerWaalsContact OD1-CZ 3.23Å; D114-F212 WeakPolarHBondContact OD1-CZ 3.43Å
115	G	91.6	Very high	92.4	Very high	30 Å²	30	24.6 Å²	24.6	31%	0.309	13%	0.131	S	C	.	.	H	α-helix	trans	-59.8	-36.8	171.8	0	0	0	0	0	112.8	S113 E119	S113-G115 VanDerWaalsContact C-N 3.26Å; S113-G115 PolarHBondContact O-N 3.36Å; G115-E119 WeakPolarHBondContact O-CG 3.38Å; G115-E119 PolarHBondContact O-N 3.17Å; G115-E119 VanDerWaalsContact O-N 3.14Å
116	I	92.3	Very high	92.4	Very high	16 Å²	16	23.5 Å²	23.5	8%	0.082	13%	0.131	C	C	.	.	H	α-helix	trans	-70.6	-41.6	176.3	-65.6	167.1	0	0	0	110.9	A112 S113 D114 E119 N120 I173 A183 A186 L187 I190	A112-I116 WeakPolarHBondContact O-CG1 3.38Å; A112-I116 PolarHBondContact O-N 3.11Å; S113-I116 WeakPolarHBondContact O-CA 3.39Å; S113-I116 WeakPolarHBondContact O-CB 3.32Å; S113-I116 PolarHBondContact O-N 3.41Å; D114-I116 VanDerWaalsContact C-N 3.27Å; D114-I116 PolarHBondContact O-N 2.92Å; I116-E119 PolarHBondContact O-N 2.92Å; I116-N120 WeakPolarHBondContact O-CB 3.26Å; I116-N120 PolarHBondContact O-N 3.26Å; I116-N120 VanDerWaalsContact O-N 3.1Å; I116-I173 HydrophobicContact CD1-CD1 4Å; I116-I173 HydrophobicContact CG1-CD1 4.42Å; I116-A183 HydrophobicContact CD1-CB 3.61Å; I116-A186 HydrophobicContact CG2-CB 3.81Å; I116-L187 HydrophobicContact CD1-CG 4.42Å; I116-L187 HydrophobicContact CG1-CD2 4.42Å; I116-L187 HydrophobicContact CG2-CD2 4.24Å; I116-L187 HydrophobicContact CG2-CG 4.44Å; I116-I190 HydrophobicContact CG2-CD1 3.31Å; I116-I190 WeakPolarHBondContact O-CD1 3.46Å
117	V	94.1	Very high	92.2	Very high	4 Å²	4	30.3 Å²	30.3	2%	0.024	16%	0.156	C	C	.	.	H	α-helix	trans	-60.4	-48.3	175.1	169.3	0	0	0	0	110.4	S113 D114 E119 N120 L121 E145 F204 V207 E208 F212	S113-V117 PolarHBondContact O-N 3.26Å; D114-V117 PolarHBondContact O-N 3.37Å; V117-E119 PolarHBondContact O-N 3.1Å; V117-N120 WeakPolarHBondContact O-CB 3.43Å; V117-N120 PolarHBondContact O-N 2.89Å; V117-L121 HydrophobicContact CG1-CD1 4.02Å; V117-L121 HydrophobicContact CG1-CG 4.46Å; V117-L121 WeakPolarHBondContact O-CG 3.22Å; V117-L121 PolarHBondContact O-N 2.94Å; V117-E145 HydrophobicContact CG1-CG 4.18Å; V117-F204 HydrophobicContact CG1-CE2 3.89Å; V117-F204 HydrophobicContact CG1-CZ 4.01Å; V117-V207 HydrophobicContact CG2-CG1 3.88Å; V117-E208 WeakPolarHBondContact CG1-OE1 3.44Å; V117-F212 HydrophobicContact CG2-CE2 4.37Å; V117-F212 HydrophobicContact CG2-CZ 4.42Å
118	F	94.9	Very high	92	Very high	48 Å²	48	31.6 Å²	31.6	21%	0.211	16%	0.162	C	C	.	.	H	α-helix	trans	-53.2	-53.2	176	170.6	-89.2	0	0	0	112.2	D114 N120 L121 V122 I142 E145	D114-F118 WeakPolarHBondContact O-CB 3Å; D114-F118 PolarHBondContact O-N 2.91Å; F118-N120 VanDerWaalsContact C-N 3.29Å; F118-N120 PolarHBondContact O-N 3.44Å; F118-L121 PolarHBondContact O-N 3.22Å; F118-V122 HydrophobicContact CD2-CG2 4.49Å; F118-V122 HydrophobicContact CE1-CG2 4.16Å; F118-V122 HydrophobicContact CE2-CG2 4.11Å; F118-V122 HydrophobicContact CZ-CG2 3.92Å; F118-V122 WeakPolarHBondContact O-CG2 3.17Å; F118-V122 PolarHBondContact O-N 2.99Å; F118-I142 HydrophobicContact CD2-CG2 3.94Å; F118-I142 HydrophobicContact CE2-CG2 3.55Å; F118-E145 HydrophobicContact CB-CB 4.29Å
119	E	93.5	Very high	92.1	Very high	86 Å²	86	31.6 Å²	31.6	40%	0.402	16%	0.162	S	C	.	.	H	α-helix	trans	-61.3	-39.5	-179.7	-72.4	-61.4	159.6	0	0	111.4	G115 I116 V117 L121 V122 E123	G115-E119 WeakPolarHBondContact O-CG 3.38Å; G115-E119 PolarHBondContact O-N 3.17Å; G115-E119 VanDerWaalsContact O-N 3.14Å; I116-E119 PolarHBondContact O-N 2.92Å; V117-E119 PolarHBondContact O-N 3.1Å; E119-L121 PolarHBondContact O-N 2.94Å; E119-V122 PolarHBondContact O-N 2.95Å; E119-E123 VanDerWaalsContact O-CB 3.3Å; E119-E123 WeakPolarHBondContact O-CB 3.28Å; E119-E123 WeakPolarHBondContact O-CG 3.39Å; E119-E123 PolarHBondContact O-N 3.24Å
120	N	93.9	Very high	92.2	Very high	13 Å²	13	31.8 Å²	31.8	7%	0.07	16%	0.163	C	C	.	.	H	α-helix	trans	-62	-43.4	176.3	-162.9	9.4	0	0	0	112.6	I116 V117 F118 R124 F125 I190	I116-N120 WeakPolarHBondContact O-CB 3.26Å; I116-N120 PolarHBondContact O-N 3.26Å; I116-N120 VanDerWaalsContact O-N 3.1Å; V117-N120 WeakPolarHBondContact O-CB 3.43Å; V117-N120 PolarHBondContact O-N 2.89Å; F118-N120 VanDerWaalsContact C-N 3.29Å; F118-N120 PolarHBondContact O-N 3.44Å; N120-R124 WeakPolarHBondContact O-CA 3.48Å; N120-R124 VanDerWaalsContact O-CB 3.31Å; N120-R124 WeakPolarHBondContact O-CB 3.11Å; N120-R124 PolarHBondContact O-N 3.5Å; N120-F125 WeakPolarHBondContact ND2-CE2 3.28Å; N120-F125 PolarHBondContact O-N 2.93Å; N120-I190 HydrophobicContact CB-CD1 3.78Å; N120-I190 HydrophobicContact CB-CG1 3.67Å; N120-I190 VanDerWaalsContact CG-CG1 3.45Å
121	L	95.5	Very high	92.3	Very high	0 Å²	0	32 Å²	32	0%	0	16%	0.164	C	C	.	.	I	π-helix	trans	-63.1	-43.8	178.7	-72.7	170.4	0	0	0	111.5	V117 F118 E119 F125 S126 Y138 Q141 I142 E145 F204	V117-L121 HydrophobicContact CG1-CD1 4.02Å; V117-L121 HydrophobicContact CG1-CG 4.46Å; V117-L121 WeakPolarHBondContact O-CG 3.22Å; V117-L121 PolarHBondContact O-N 2.94Å; F118-L121 PolarHBondContact O-N 3.22Å; E119-L121 PolarHBondContact O-N 2.94Å; L121-F125 HydrophobicContact CD2-CB 4.37Å; L121-F125 HydrophobicContact CD2-CD2 4.46Å; L121-S126 WeakPolarHBondContact O-CB 3.42Å; L121-S126 PolarHBondContact O-N 3.1Å; L121-S126 PolarHBondContact O-OG 3Å; L121-Y138 HydrophobicContact CD2-CD1 3.63Å; L121-Y138 HydrophobicContact CD2-CE1 3.72Å; L121-Y138 HydrophobicContact CD2-CG 4.39Å; L121-Q141 HydrophobicContact CD1-CB 4.48Å; L121-Q141 HydrophobicContact CD1-CG 3.65Å; L121-I142 HydrophobicContact CB-CD1 4.15Å; L121-I142 HydrophobicContact CB-CG1 3.8Å; L121-I142 HydrophobicContact CD1-CG1 4.09Å; L121-E145 HydrophobicContact CD1-CG 3.95Å; L121-F204 HydrophobicContact CD1-CZ 4.44Å; L121-F204 HydrophobicContact CD2-CE1 4.3Å; L121-F204 HydrophobicContact CD2-CE2 4.17Å; L121-F204 HydrophobicContact CD2-CZ 3.62Å; L121-F204 HydrophobicContact CG-CE2 4.26Å; L121-F204 HydrophobicContact CG-CZ 4.02Å
122	V	93.7	Very high	92.5	Very high	64 Å²	64	31.7 Å²	31.7	39%	0.388	16%	0.16	S	C	.	.	I	π-helix	trans	-73.1	-51.3	-178.1	175.6	0	0	0	0	111.3	F118 E119 I142	F118-V122 HydrophobicContact CD2-CG2 4.49Å; F118-V122 HydrophobicContact CE1-CG2 4.16Å; F118-V122 HydrophobicContact CE2-CG2 4.11Å; F118-V122 HydrophobicContact CZ-CG2 3.92Å; F118-V122 WeakPolarHBondContact O-CG2 3.17Å; F118-V122 PolarHBondContact O-N 2.99Å; E119-V122 PolarHBondContact O-N 2.95Å; V122-I142 HydrophobicContact CG2-CD1 3.87Å; V122-I142 HydrophobicContact CG2-CG1 4.23Å; V122-I142 HydrophobicContact CG2-CG2 4.27Å
123	E	90.4	Very high	92.8	Very high	112 Å²	112	31 Å²	31	52%	0.523	16%	0.155	S	C	.	.	I	π-helix	trans	-76.6	-33.5	-172.7	-66	-162.7	151.7	0	0	113.4	E119	E119-E123 VanDerWaalsContact O-CB 3.3Å; E119-E123 WeakPolarHBondContact O-CB 3.28Å; E119-E123 WeakPolarHBondContact O-CG 3.39Å; E119-E123 PolarHBondContact O-N 3.24Å
124	R	90.5	Very high	93.1	Very high	47 Å²	47	30.6 Å²	30.6	18%	0.177	15%	0.151	C	C	.	.	I	π-helix	trans	-113.2	-74.6	-171.5	-49	-69	-80.2	118.5	4.6	111.3	N120 S126 R127 E128 I190 D192	N120-R124 WeakPolarHBondContact O-CA 3.48Å; N120-R124 VanDerWaalsContact O-CB 3.31Å; N120-R124 WeakPolarHBondContact O-CB 3.11Å; N120-R124 PolarHBondContact O-N 3.5Å; R124-S126 PolarHBondContact O-N 3.22Å; R124-R127 PolarHBondContact O-N 3.35Å; R124-E128 IonicContact CZ-OE1 2.98Å; R124-E128 IonicContact NH1-OE1 3.54Å; R124-E128 PolarHBondContact NH1-OE1 3.45Å; R124-E128 IonicContact NH2-OE1 3.73Å; R124-E128 WeakPolarHBondContact O-CB 2.89Å; R124-E128 VanDerWaalsContact O-CG 3.3Å; R124-E128 WeakPolarHBondContact O-CG 3.46Å; R124-E128 PolarHBondContact O-N 3.14Å; R124-I190 HydrophobicContact CG-CG2 4.43Å; R124-I190 PolarHBondContact NE-O 3.42Å; R124-D192 PolarHBondContact NH2-O 2.96Å; R124-D192 VanDerWaalsContact NH2-O 3.16Å
125	F	93.8	Very high	93.2	Very high	0 Å²	0	34.4 Å²	34.4	0%	0	17%	0.166	C	C	.	.	I	π-helix	trans	-62.7	-47.8	-165.3	-74.1	-76.3	0	0	0	113.5	N120 L121 R127 E128 I129 Y138 F197 R200 L201 F204	N120-F125 WeakPolarHBondContact ND2-CE2 3.28Å; N120-F125 PolarHBondContact O-N 2.93Å; L121-F125 HydrophobicContact CD2-CB 4.37Å; L121-F125 HydrophobicContact CD2-CD2 4.46Å; F125-R127 PolarHBondContact O-N 2.99Å; F125-E128 PolarHBondContact O-N 2.82Å; F125-I129 WeakPolarHBondContact O-CB 3.3Å; F125-I129 WeakPolarHBondContact O-CG2 3.41Å; F125-I129 PolarHBondContact O-N 3.29Å; F125-Y138 HydrophobicContact CB-CD2 4.41Å; F125-Y138 HydrophobicContact CB-CE2 3.8Å; F125-F197 HydrophobicContact CD1-CD2 4.29Å; F125-F197 AromaticContact CD1-CE2 3.48Å; F125-F197 HydrophobicContact CD1-CE2 3.48Å; F125-F197 VanDerWaalsContact CD1-CE2 3.48Å; F125-F197 AromaticContact CD1-CZ 3.92Å; F125-F197 HydrophobicContact CD1-CZ 3.92Å; F125-F197 HydrophobicContact CE1-CD2 4.33Å; F125-F197 AromaticContact CE1-CE2 3.82Å; F125-F197 HydrophobicContact CE1-CE2 3.82Å; F125-F197 HydrophobicContact CE1-CZ 4.14Å; F125-R200 HydrophobicContact CZ-CB 4.38Å; F125-L201 HydrophobicContact CE1-CB 4.26Å; F125-L201 HydrophobicContact CE1-CD1 3.93Å; F125-F204 HydrophobicContact CD2-CD2 4.32Å; F125-F204 HydrophobicContact CE2-CB 3.9Å; F125-F204 HydrophobicContact CE2-CD1 4.42Å; F125-F204 AromaticContact CE2-CD2 3.61Å; F125-F204 HydrophobicContact CE2-CD2 3.61Å; F125-F204 HydrophobicContact CE2-CE2 4.23Å; F125-F204 AromaticContact CE2-CG 3.72Å; F125-F204 HydrophobicContact CE2-CG 3.72Å; F125-F204 HydrophobicContact CZ-CB 3.69Å; F125-F204 HydrophobicContact CZ-CD2 4.28Å; F125-F204 AromaticContact CZ-CG 3.93Å; F125-F204 HydrophobicContact CZ-CG 3.93Å
126	S	92.3	Very high	93.4	Very high	24 Å²	24	34.9 Å²	34.9	17%	0.168	16%	0.164	C	C	.	.	H	α-helix	trans	-65.6	-27.9	-179.9	-63.9	0	0	0	0	113	L121 R124 R135	L121-S126 WeakPolarHBondContact O-CB 3.42Å; L121-S126 PolarHBondContact O-N 3.1Å; L121-S126 PolarHBondContact O-OG 3Å; R124-S126 PolarHBondContact O-N 3.22Å; S126-R135 VanDerWaalsContact O-CZ 3.3Å; S126-R135 PolarHBondContact O-NH2 2.93Å; S126-R135 VanDerWaalsContact O-NH2 3.1Å
127	R	88.7	Confident	93.7	Very high	145 Å²	145	34.1 Å²	34.1	55%	0.547	16%	0.16	S	C	.	.	H	α-helix	trans	-77	-42.4	176.2	-175.8	175.9	176.5	168.7	-1.2	111.5	E36 R124 F125 Q130 R135	E36-R127 PolarHBondContact O-NH2 3.37Å; R124-R127 PolarHBondContact O-N 3.35Å; F125-R127 PolarHBondContact O-N 2.99Å; R127-Q130 PolarHBondContact O-NE2 3.32Å; R127-R135 PolarHBondContact O-NH2 3.15Å
128	E	92	Very high	93.8	Very high	28 Å²	28	34 Å²	34	13%	0.131	16%	0.159	C	C	.	.	H	α-helix	trans	-75.4	-46.7	-174.6	-70.6	173	164.1	0	0	112.3	L49 R124 F125 Q130 F197 R200	L49-E128 HydrophobicContact CD2-CB 4.34Å; R124-E128 IonicContact CZ-OE1 2.98Å; R124-E128 IonicContact NH1-OE1 3.54Å; R124-E128 PolarHBondContact NH1-OE1 3.45Å; R124-E128 IonicContact NH2-OE1 3.73Å; R124-E128 WeakPolarHBondContact O-CB 2.89Å; R124-E128 VanDerWaalsContact O-CG 3.3Å; R124-E128 WeakPolarHBondContact O-CG 3.46Å; R124-E128 PolarHBondContact O-N 3.14Å; F125-E128 PolarHBondContact O-N 2.82Å; E128-Q130 WeakPolarHBondContact O-CG 3.29Å; E128-Q130 PolarHBondContact O-N 2.91Å; E128-Q130 PolarHBondContact O-NE2 3Å; E128-Q130 VanDerWaalsContact O-NE2 3.08Å; E128-F197 HydrophobicContact CB-CD2 4.32Å; E128-F197 HydrophobicContact CB-CE2 4.46Å; E128-F197 WeakPolarHBondContact OE2-CD2 3.44Å; E128-R200 IonicContact OE1-CZ 2.69Å; E128-R200 IonicContact OE1-NH1 3.19Å; E128-R200 IonicContact OE1-NH2 2.73Å; E128-R200 PolarHBondContact OE1-NH2 2.99Å; E128-R200 IonicContact OE2-CZ 3.55Å; E128-R200 VanDerWaalsContact OE2-CZ 3.24Å; E128-R200 IonicContact OE2-NH1 2.99Å; E128-R200 PolarHBondContact OE2-NH1 3.4Å; E128-R200 IonicContact OE2-NH2 2.62Å; E128-R200 PolarHBondContact OE2-NH2 2.92Å
129	I	93.6	Very high	93.9	Very high	0 Å²	0	33.9 Å²	33.9	0%	0	17%	0.171	C	C	.	.			trans	-63	133.6	179.7	-158.1	75	0	0	0	110.4	L48 L49 F125 A134 R135 Y138 F197	L48-I129 HydrophobicContact CB-CD1 3.77Å; L48-I129 HydrophobicContact CD1-CD1 4.4Å; L49-I129 HydrophobicContact CD2-CD1 4.31Å; F125-I129 WeakPolarHBondContact O-CB 3.3Å; F125-I129 WeakPolarHBondContact O-CG2 3.41Å; F125-I129 PolarHBondContact O-N 3.29Å; I129-A134 HydrophobicContact CD1-CB 4.43Å; I129-A134 HydrophobicContact CG1-CB 3.73Å; I129-R135 HydrophobicContact CG2-CG 3.67Å; I129-R135 VanDerWaalsContact O-CZ 3.24Å; I129-R135 PolarHBondContact O-NE 3.31Å; I129-R135 PolarHBondContact O-NH2 2.73Å; I129-Y138 HydrophobicContact CB-CE2 4.23Å; I129-Y138 HydrophobicContact CG2-CD2 3.82Å; I129-Y138 HydrophobicContact CG2-CE2 3.87Å; I129-F197 HydrophobicContact CD1-CZ 4.27Å
130	Q	93.3	Very high	94	Very high	4 Å²	4	31.2 Å²	31.2	2%	0.019	16%	0.159	C	C	.	.			trans	-113.6	-7	-177.7	-61.1	-59.5	-57.4	0	0	113.2	L48 L49 R50 N52 R127 E128	L48-Q130 PolarHBondContact O-N 3.06Å; L49-Q130 WeakPolarHBondContact O-CG 3.34Å; R50-Q130 WeakPolarHBondContact O-CB 3.33Å; R50-Q130 VanDerWaalsContact O-CG 3.23Å; R50-Q130 WeakPolarHBondContact O-CG 3.39Å; N52-Q130 HydrophobicContact CB-CB 4.1Å; N52-Q130 PolarHBondContact ND2-O 3.5Å; R127-Q130 PolarHBondContact O-NE2 3.32Å; E128-Q130 WeakPolarHBondContact O-CG 3.29Å; E128-Q130 PolarHBondContact O-N 2.91Å; E128-Q130 PolarHBondContact O-NE2 3Å; E128-Q130 VanDerWaalsContact O-NE2 3.08Å
131	V	93.7	Very high	94.2	Very high	6 Å²	6	30.7 Å²	30.7	4%	0.036	16%	0.155	C	C	.	.			trans	-74.7	124.5	174.2	176.1	0	0	0	0	109.6	L48 Y63 I66 E133 A134 R135	L48-V131 HydrophobicContact CD2-CG2 3.69Å; Y63-V131 HydrophobicContact CD2-CG1 3.59Å; Y63-V131 HydrophobicContact CD2-CG2 4.18Å; Y63-V131 HydrophobicContact CE2-CG1 4.08Å; Y63-V131 HydrophobicContact CE2-CG2 3.79Å; Y63-V131 HydrophobicContact CG-CG1 4.39Å; I66-V131 HydrophobicContact CD1-CG1 4.44Å; V131-E133 VanDerWaalsContact C-N 3.34Å; V131-E133 HydrophobicContact CG1-CB 4.26Å; V131-E133 VanDerWaalsContact CG1-OE2 3.23Å; V131-E133 WeakPolarHBondContact CG1-OE2 3.47Å; V131-E133 PolarHBondContact O-N 3.2Å; V131-A134 HydrophobicContact CB-CB 4.19Å; V131-A134 HydrophobicContact CG1-CB 4.29Å; V131-A134 PolarHBondContact O-N 2.85Å; V131-R135 WeakPolarHBondContact O-CG 3.38Å; V131-R135 PolarHBondContact O-N 3.44Å; V131-R135 VanDerWaalsContact O-N 3.09Å
132	T	94	Very high	94.3	Very high	14 Å²	14	32.1 Å²	32.1	9%	0.086	16%	0.163	C	C	.	.	H	α-helix	trans	-62.7	-42.2	-174.6	-49.1	0	0	0	0	111.5	R55 L58 A134 R135 C136	R55-T132 WeakPolarHBondContact CA-OG1 3.4Å; L58-T132 HydrophobicContact CD1-CG2 4.05Å; T132-A134 VanDerWaalsContact C-N 3.35Å; T132-A134 PolarHBondContact O-N 3.18Å; T132-R135 WeakPolarHBondContact O-CB 3.15Å; T132-R135 PolarHBondContact O-N 3.27Å; T132-C136 PolarHBondContact O-N 3.11Å; T132-C136 PolarHBondContact O-SG 3.12Å; T132-C136 VanDerWaalsContact O-SG 3.39Å
133	E	95.6	Very high	94.4	Very high	1 Å²	1	31 Å²	31	1%	0.005	16%	0.16	C	C	.	.	H	α-helix	trans	-62.8	-41	-179.2	-59.4	93.6	137.1	0	0	111.8	L61 Q62 Y63 I66 W67 V131 C136 F137	L61-E133 WeakPolarHBondContact CA-OE1 3.5Å; L61-E133 HydrophobicContact CD2-CG 3.84Å; Q62-E133 PolarHBondContact N-OE1 3.18Å; Y63-E133 PolarHBondContact N-OE1 3.1Å; I66-E133 HydrophobicContact CB-CB 4.25Å; I66-E133 HydrophobicContact CG2-CB 3.69Å; W67-E133 HydrophobicContact CB-CB 4.4Å; W67-E133 HydrophobicContact CB-CG 4.15Å; W67-E133 HydrophobicContact CE3-CB 4.19Å; W67-E133 HydrophobicContact CE3-CG 4.02Å; V131-E133 VanDerWaalsContact C-N 3.34Å; V131-E133 HydrophobicContact CG1-CB 4.26Å; V131-E133 VanDerWaalsContact CG1-OE2 3.23Å; V131-E133 WeakPolarHBondContact CG1-OE2 3.47Å; V131-E133 PolarHBondContact O-N 3.2Å; E133-C136 WeakPolarHBondContact O-CB 3.33Å; E133-C136 PolarHBondContact O-N 3.27Å; E133-F137 PolarHBondContact O-N 3.21Å; E133-F137 VanDerWaalsContact O-N 3.09Å
134	A	96.3	Very high	94.7	Very high	0 Å²	0	25.8 Å²	25.8	0%	0	14%	0.136	C	C	.	.	H	α-helix	trans	-69.6	-35.6	176.3	0	0	0	0	0	111.8	I66 I129 V131 T132 C136 F137 Y138 F248 L252	I66-A134 HydrophobicContact CG2-CB 3.87Å; I129-A134 HydrophobicContact CD1-CB 4.43Å; I129-A134 HydrophobicContact CG1-CB 3.73Å; V131-A134 HydrophobicContact CB-CB 4.19Å; V131-A134 HydrophobicContact CG1-CB 4.29Å; V131-A134 PolarHBondContact O-N 2.85Å; T132-A134 VanDerWaalsContact C-N 3.35Å; T132-A134 PolarHBondContact O-N 3.18Å; A134-C136 VanDerWaalsContact C-N 3.31Å; A134-C136 PolarHBondContact O-N 3.38Å; A134-F137 WeakPolarHBondContact O-CB 3.41Å; A134-F137 PolarHBondContact O-N 3.5Å; A134-Y138 PolarHBondContact O-N 3.01Å; A134-F248 HydrophobicContact CB-CZ 4.05Å; A134-L252 HydrophobicContact CB-CD2 4.16Å
135	R	94.6	Very high	95.1	Very high	80 Å²	80	23.6 Å²	23.6	30%	0.302	13%	0.128	S	C	.	.	H	α-helix	trans	-63.8	-36.4	171.4	-70.6	179.7	166.6	-117.9	-9.5	112.3	S126 R127 I129 V131 T132 Y138 G139	S126-R135 VanDerWaalsContact O-CZ 3.3Å; S126-R135 PolarHBondContact O-NH2 2.93Å; S126-R135 VanDerWaalsContact O-NH2 3.1Å; R127-R135 PolarHBondContact O-NH2 3.15Å; I129-R135 HydrophobicContact CG2-CG 3.67Å; I129-R135 VanDerWaalsContact O-CZ 3.24Å; I129-R135 PolarHBondContact O-NE 3.31Å; I129-R135 PolarHBondContact O-NH2 2.73Å; V131-R135 WeakPolarHBondContact O-CG 3.38Å; V131-R135 PolarHBondContact O-N 3.44Å; V131-R135 VanDerWaalsContact O-N 3.09Å; T132-R135 WeakPolarHBondContact O-CB 3.15Å; T132-R135 PolarHBondContact O-N 3.27Å; R135-Y138 PolarHBondContact O-N 3Å; R135-G139 PolarHBondContact O-N 3.29Å
136	C	95.7	Very high	95.2	Very high	40 Å²	40	27.3 Å²	27.3	27%	0.27	15%	0.148	S	C	.	.	H	α-helix	trans	-62.9	-44.2	173.2	-69.3	0	0	0	0	111.1	W67 Y70 T132 E133 A134 G139 F140	W67-C136 HydrophobicContact CZ3-CB 4Å; Y70-C136 HydrophobicContact CD1-CB 4.44Å; Y70-C136 HydrophobicContact CD2-CB 3.64Å; Y70-C136 WeakPolarHBondContact CD2-O 3.36Å; Y70-C136 HydrophobicContact CE2-CB 3.89Å; Y70-C136 HydrophobicContact CG-CB 3.93Å; T132-C136 PolarHBondContact O-N 3.11Å; T132-C136 PolarHBondContact O-SG 3.12Å; T132-C136 VanDerWaalsContact O-SG 3.39Å; E133-C136 WeakPolarHBondContact O-CB 3.33Å; E133-C136 PolarHBondContact O-N 3.27Å; A134-C136 VanDerWaalsContact C-N 3.31Å; A134-C136 PolarHBondContact O-N 3.38Å; C136-G139 PolarHBondContact O-N 3.4Å; C136-F140 PolarHBondContact O-N 3.01Å
137	F	97.1	Very high	95.4	Very high	1 Å²	1	27 Å²	27	0%	0.004	14%	0.144	C	C	.	.	H	α-helix	trans	-59	-53.4	173.6	-172.8	-82.3	0	0	0	111.4	Y69 A73 E133 A134 G139 F140 Q141 L244 F248	Y69-F137 HydrophobicContact CD1-CE2 4.42Å; A73-F137 HydrophobicContact CB-CD2 4.34Å; A73-F137 HydrophobicContact CB-CE2 4Å; E133-F137 PolarHBondContact O-N 3.21Å; E133-F137 VanDerWaalsContact O-N 3.09Å; A134-F137 WeakPolarHBondContact O-CB 3.41Å; A134-F137 PolarHBondContact O-N 3.5Å; F137-G139 VanDerWaalsContact C-N 3.29Å; F137-G139 PolarHBondContact O-N 3.22Å; F137-F140 CarbonylContact O-C 3.43Å; F137-F140 WeakPolarHBondContact O-CA 3.11Å; F137-F140 WeakPolarHBondContact O-CB 3.06Å; F137-F140 PolarHBondContact O-N 3.28Å; F137-Q141 HydrophobicContact CD1-CB 4.35Å; F137-Q141 HydrophobicContact CE1-CB 4.15Å; F137-Q141 PolarHBondContact O-N 2.6Å; F137-L244 HydrophobicContact CE2-CD2 4.26Å; F137-L244 HydrophobicContact CE2-CG 4.15Å; F137-L244 HydrophobicContact CZ-CD2 4.47Å; F137-L244 HydrophobicContact CZ-CG 4.12Å; F137-F248 HydrophobicContact CB-CE1 3.98Å; F137-F248 HydrophobicContact CB-CE2 3.86Å; F137-F248 HydrophobicContact CB-CZ 3.57Å; F137-F248 HydrophobicContact CD1-CB 4.34Å; F137-F248 AromaticContact CD1-CD1 3.21Å; F137-F248 HydrophobicContact CD1-CD1 3.21Å; F137-F248 HydrophobicContact CD1-CD2 4Å; F137-F248 AromaticContact CD1-CE1 3.28Å; F137-F248 HydrophobicContact CD1-CE1 3.28Å; F137-F248 HydrophobicContact CD1-CE2 4.07Å; F137-F248 AromaticContact CD1-CG 3.58Å; F137-F248 HydrophobicContact CD1-CG 3.58Å; F137-F248 AromaticContact CD1-CZ 3.74Å; F137-F248 HydrophobicContact CD1-CZ 3.74Å; F137-F248 HydrophobicContact CD2-CD1 4.48Å; F137-F248 AromaticContact CD2-CD2 3.8Å; F137-F248 HydrophobicContact CD2-CD2 3.8Å; F137-F248 AromaticContact CD2-CE2 3.95Å; F137-F248 HydrophobicContact CD2-CE2 3.95Å; F137-F248 HydrophobicContact CD2-CG 4.07Å; F137-F248 HydrophobicContact CD2-CZ 4.36Å; F137-F248 HydrophobicContact CE1-CB 3.67Å; F137-F248 AromaticContact CE1-CD1 3.29Å; F137-F248 HydrophobicContact CE1-CD1 3.29Å; F137-F248 HydrophobicContact CE1-CD2 4.15Å; F137-F248 AromaticContact CE1-CE1 3.91Å; F137-F248 HydrophobicContact CE1-CE1 3.91Å; F137-F248 AromaticContact CE1-CG 3.42Å; F137-F248 HydrophobicContact CE1-CG 3.42Å; F137-F248 VanDerWaalsContact CE1-CG 3.42Å; F137-F248 HydrophobicContact CE2-CB 4.06Å; F137-F248 AromaticContact CE2-CD2 3.96Å; F137-F248 HydrophobicContact CE2-CD2 3.96Å; F137-F248 AromaticContact CE2-CG 3.94Å; F137-F248 HydrophobicContact CE2-CG 3.94Å; F137-F248 AromaticContact CG-CD1 3.86Å; F137-F248 HydrophobicContact CG-CD1 3.86Å; F137-F248 AromaticContact CG-CD2 3.82Å; F137-F248 HydrophobicContact CG-CD2 3.82Å; F137-F248 AromaticContact CG-CE1 3.71Å; F137-F248 HydrophobicContact CG-CE1 3.71Å; F137-F248 AromaticContact CG-CE2 3.67Å; F137-F248 HydrophobicContact CG-CE2 3.67Å; F137-F248 AromaticContact CG-CG 3.91Å; F137-F248 HydrophobicContact CG-CG 3.91Å; F137-F248 AromaticContact CG-CZ 3.62Å; F137-F248 HydrophobicContact CG-CZ 3.62Å; F137-F248 HydrophobicContact CZ-CB 3.51Å; F137-F248 AromaticContact CZ-CD1 4Å; F137-F248 HydrophobicContact CZ-CD1 4Å; F137-F248 HydrophobicContact CZ-CD2 4.12Å; F137-F248 AromaticContact CZ-CG 3.61Å; F137-F248 HydrophobicContact CZ-CG 3.61Å
138	Y	97.2	Very high	95.8	Very high	1 Å²	1	20.1 Å²	20.1	0%	0.004	12%	0.118	C	C	.	.	H	α-helix	trans	-61.7	-35.8	179.8	-72.7	-37.2	0	0	0	113.3	L121 F125 I129 A134 R135 F140 Q141 I142 F248 L252	L121-Y138 HydrophobicContact CD2-CD1 3.63Å; L121-Y138 HydrophobicContact CD2-CE1 3.72Å; L121-Y138 HydrophobicContact CD2-CG 4.39Å; F125-Y138 HydrophobicContact CB-CD2 4.41Å; F125-Y138 HydrophobicContact CB-CE2 3.8Å; I129-Y138 HydrophobicContact CB-CE2 4.23Å; I129-Y138 HydrophobicContact CG2-CD2 3.82Å; I129-Y138 HydrophobicContact CG2-CE2 3.87Å; A134-Y138 PolarHBondContact O-N 3.01Å; R135-Y138 PolarHBondContact O-N 3Å; Y138-F140 PolarHBondContact O-N 3.16Å; Y138-Q141 PolarHBondContact O-N 3.04Å; Y138-I142 VanDerWaalsContact O-CB 3.31Å; Y138-I142 WeakPolarHBondContact O-CB 3.4Å; Y138-I142 WeakPolarHBondContact O-CD1 3.43Å; Y138-I142 WeakPolarHBondContact O-CG1 3.45Å; Y138-I142 PolarHBondContact O-N 2.93Å; Y138-F248 HydrophobicContact CD1-CE1 4.12Å; Y138-F248 HydrophobicContact CE1-CD1 4.12Å; Y138-F248 AromaticContact CE1-CE1 3.74Å; Y138-F248 HydrophobicContact CE1-CE1 3.74Å; Y138-L252 HydrophobicContact CE2-CD1 4.33Å; Y138-L252 WeakPolarHBondContact OH-CD1 3.42Å
139	G	96.1	Very high	95.9	Very high	45 Å²	45	20.1 Å²	20.1	46%	0.464	12%	0.121	S	C	.	.	H	α-helix	trans	-60.4	-34.9	173.6	0	0	0	0	0	112.6	R135 C136 F137 A143	R135-G139 PolarHBondContact O-N 3.29Å; C136-G139 PolarHBondContact O-N 3.4Å; F137-G139 VanDerWaalsContact C-N 3.29Å; F137-G139 PolarHBondContact O-N 3.22Å; G139-A143 PolarHBondContact O-N 2.78Å
140	F	96.5	Very high	96.1	Very high	31 Å²	31	24.9 Å²	24.9	14%	0.136	14%	0.143	C	C	.	.	H	α-helix	trans	-78.2	-44	175.6	-163.3	-83.4	0	0	0	112.3	Y70 A73 E74 F77 C136 F137 Y138 I142 A143 I144	Y70-F140 HydrophobicContact CE2-CB 4.42Å; A73-F140 HydrophobicContact CB-CD1 3.53Å; A73-F140 HydrophobicContact CB-CE1 3.85Å; A73-F140 HydrophobicContact CB-CG 4.19Å; A73-F140 WeakPolarHBondContact O-CE1 3.19Å; A73-F140 WeakPolarHBondContact O-CZ 3.19Å; E74-F140 HydrophobicContact CB-CE2 4.32Å; E74-F140 HydrophobicContact CG-CE2 4.46Å; F77-F140 HydrophobicContact CB-CE2 4.46Å; F77-F140 HydrophobicContact CB-CZ 3.73Å; F77-F140 HydrophobicContact CD2-CE1 4.26Å; F77-F140 AromaticContact CD2-CE2 3.87Å; F77-F140 HydrophobicContact CD2-CE2 3.87Å; F77-F140 AromaticContact CD2-CZ 3.44Å; F77-F140 HydrophobicContact CD2-CZ 3.44Å; F77-F140 VanDerWaalsContact CD2-CZ 3.44Å; F77-F140 HydrophobicContact CE2-CZ 4.5Å; F77-F140 HydrophobicContact CG-CZ 4.02Å; C136-F140 PolarHBondContact O-N 3.01Å; F137-F140 CarbonylContact O-C 3.43Å; F137-F140 WeakPolarHBondContact O-CA 3.11Å; F137-F140 WeakPolarHBondContact O-CB 3.06Å; F137-F140 PolarHBondContact O-N 3.28Å; Y138-F140 PolarHBondContact O-N 3.16Å; F140-I142 VanDerWaalsContact C-N 3.32Å; F140-I142 PolarHBondContact O-N 3.35Å; F140-A143 WeakPolarHBondContact O-CB 3.5Å; F140-A143 PolarHBondContact O-N 3.01Å; F140-I144 HydrophobicContact CD1-CG1 3.72Å; F140-I144 HydrophobicContact CE1-CD1 3.86Å; F140-I144 HydrophobicContact CE1-CG1 3.47Å; F140-I144 VanDerWaalsContact CE1-CG1 3.47Å; F140-I144 HydrophobicContact CZ-CD1 4.45Å; F140-I144 HydrophobicContact CZ-CG1 4.39Å; F140-I144 WeakPolarHBondContact O-CG1 3.47Å; F140-I144 PolarHBondContact O-N 3.42Å
141	Q	97.4	Very high	96.2	Very high	1 Å²	1	24.7 Å²	24.7	1%	0.005	14%	0.142	C	C	.	.	H	α-helix	trans	-54.4	-49.9	173.7	178.8	171.1	4.4	0	0	110.4	L121 F137 Y138 A143 I144 E145 E208 H245	L121-Q141 HydrophobicContact CD1-CB 4.48Å; L121-Q141 HydrophobicContact CD1-CG 3.65Å; F137-Q141 HydrophobicContact CD1-CB 4.35Å; F137-Q141 HydrophobicContact CE1-CB 4.15Å; F137-Q141 PolarHBondContact O-N 2.6Å; Y138-Q141 PolarHBondContact O-N 3.04Å; Q141-A143 PolarHBondContact O-N 3.38Å; Q141-I144 CarbonylContact O-C 3.54Å; Q141-I144 WeakPolarHBondContact O-CA 3.43Å; Q141-I144 WeakPolarHBondContact O-CB 3.41Å; Q141-I144 PolarHBondContact O-N 3.44Å; Q141-E145 HydrophobicContact CG-CG 4.24Å; Q141-E145 WeakPolarHBondContact CG-OE1 3.23Å; Q141-E145 PolarHBondContact NE2-OE1 3.24Å; Q141-E145 VanDerWaalsContact NE2-OE1 3.1Å; Q141-E145 WeakPolarHBondContact O-CG 3.34Å; Q141-E145 PolarHBondContact O-N 2.95Å; Q141-E208 PolarHBondContact NE2-OE1 3.44Å; Q141-H245 VanDerWaalsContact NE2-CG 3.32Å; Q141-H245 PolarHBondContact NE2-ND1 3.19Å
142	I	97.7	Very high	96.4	Very high	30 Å²	30	24.4 Å²	24.4	15%	0.154	14%	0.141	C	C	.	.	H	α-helix	trans	-54.8	-39	176	-72.1	164.3	0	0	0	112.1	F118 L121 V122 Y138 F140 N146	F118-I142 HydrophobicContact CD2-CG2 3.94Å; F118-I142 HydrophobicContact CE2-CG2 3.55Å; L121-I142 HydrophobicContact CB-CD1 4.15Å; L121-I142 HydrophobicContact CB-CG1 3.8Å; L121-I142 HydrophobicContact CD1-CG1 4.09Å; V122-I142 HydrophobicContact CG2-CD1 3.87Å; V122-I142 HydrophobicContact CG2-CG1 4.23Å; V122-I142 HydrophobicContact CG2-CG2 4.27Å; Y138-I142 VanDerWaalsContact O-CB 3.31Å; Y138-I142 WeakPolarHBondContact O-CB 3.4Å; Y138-I142 WeakPolarHBondContact O-CD1 3.43Å; Y138-I142 WeakPolarHBondContact O-CG1 3.45Å; Y138-I142 PolarHBondContact O-N 2.93Å; F140-I142 VanDerWaalsContact C-N 3.32Å; F140-I142 PolarHBondContact O-N 3.35Å; I142-N146 PolarHBondContact O-N 3.38Å; I142-N146 PolarHBondContact O-ND2 3.28Å
143	A	97.1	Very high	96.3	Very high	41 Å²	41	26 Å²	26	34%	0.339	15%	0.152	S	C	.	.	H	α-helix	trans	-67.6	-38.5	176.4	0	0	0	0	0	111.7	G139 F140 Q141 N146 I147	G139-A143 PolarHBondContact O-N 2.78Å; F140-A143 WeakPolarHBondContact O-CB 3.5Å; F140-A143 PolarHBondContact O-N 3.01Å; Q141-A143 PolarHBondContact O-N 3.38Å; A143-N146 WeakPolarHBondContact O-CB 3.22Å; A143-N146 PolarHBondContact O-N 3.3Å; A143-I147 PolarHBondContact O-N 3.12Å
144	I	96.6	Very high	96.3	Very high	3 Å²	3	29.1 Å²	29.1	2%	0.015	17%	0.169	C	C	.	.	H	α-helix	trans	-70.7	-39.9	177.9	-69.4	-72.8	0	0	0	111.7	F77 F140 Q141 N146 I147 H148 D241	F77-I144 HydrophobicContact CD2-CD1 4.07Å; F77-I144 HydrophobicContact CE2-CD1 4.48Å; F140-I144 HydrophobicContact CD1-CG1 3.72Å; F140-I144 HydrophobicContact CE1-CD1 3.86Å; F140-I144 HydrophobicContact CE1-CG1 3.47Å; F140-I144 VanDerWaalsContact CE1-CG1 3.47Å; F140-I144 HydrophobicContact CZ-CD1 4.45Å; F140-I144 HydrophobicContact CZ-CG1 4.39Å; F140-I144 WeakPolarHBondContact O-CG1 3.47Å; F140-I144 PolarHBondContact O-N 3.42Å; Q141-I144 CarbonylContact O-C 3.54Å; Q141-I144 WeakPolarHBondContact O-CA 3.43Å; Q141-I144 WeakPolarHBondContact O-CB 3.41Å; Q141-I144 PolarHBondContact O-N 3.44Å; I144-N146 PolarHBondContact O-N 2.95Å; I144-I147 HydrophobicContact CD1-CD1 4.02Å; I144-I147 CarbonylContact O-C 3.56Å; I144-I147 WeakPolarHBondContact O-CA 3.36Å; I144-I147 WeakPolarHBondContact O-CB 3.42Å; I144-I147 PolarHBondContact O-N 2.92Å; I144-H148 VanDerWaalsContact CG2-CE1 3.46Å; I144-H148 WeakPolarHBondContact CG2-CE1 3.48Å; I144-H148 WeakPolarHBondContact CG2-NE2 3.49Å; I144-H148 PolarHBondContact O-CD2 3.16Å; I144-H148 PolarHBondContact O-N 3.48Å; I144-D241 HydrophobicContact CG2-CB 4.02Å
145	E	97.1	Very high	96.3	Very high	0 Å²	0	29.1 Å²	29.1	0%	0	17%	0.169	C	C	.	.	H	α-helix	trans	-58.6	-34.6	173.9	-60.2	-50.5	159.4	0	0	112.5	V117 F118 L121 Q141 H148 S149 H245	V117-E145 HydrophobicContact CG1-CG 4.18Å; F118-E145 HydrophobicContact CB-CB 4.29Å; L121-E145 HydrophobicContact CD1-CG 3.95Å; Q141-E145 HydrophobicContact CG-CG 4.24Å; Q141-E145 WeakPolarHBondContact CG-OE1 3.23Å; Q141-E145 PolarHBondContact NE2-OE1 3.24Å; Q141-E145 VanDerWaalsContact NE2-OE1 3.1Å; Q141-E145 WeakPolarHBondContact O-CG 3.34Å; Q141-E145 PolarHBondContact O-N 2.95Å; E145-H148 PolarHBondContact O-N 2.89Å; E145-H148 IonicContact OE2-ND1 3.79Å; E145-S149 WeakPolarHBondContact O-CB 3.47Å; E145-S149 PolarHBondContact O-N 3.03Å; E145-S149 PolarHBondContact O-OG 3.1Å; E145-H245 IonicContact OE1-CE1 2.95Å; E145-H245 PolarHBondContact OE1-CE1 3.1Å; E145-H245 IonicContact OE1-ND1 3.16Å; E145-H245 PolarHBondContact OE1-ND1 2.97Å
146	N	96.5	Very high	96.3	Very high	79 Å²	79	25.3 Å²	25.3	42%	0.422	15%	0.154	S	C	.	.	H	α-helix	trans	-66.7	-40.1	173.6	-73.6	-59.8	0	0	0	111.7	I142 A143 I144 H148 S149 E150	I142-N146 PolarHBondContact O-N 3.38Å; I142-N146 PolarHBondContact O-ND2 3.28Å; A143-N146 WeakPolarHBondContact O-CB 3.22Å; A143-N146 PolarHBondContact O-N 3.3Å; I144-N146 PolarHBondContact O-N 2.95Å; N146-H148 VanDerWaalsContact C-N 3.34Å; N146-S149 PolarHBondContact O-N 3.29Å; N146-E150 WeakPolarHBondContact O-CB 3.45Å; N146-E150 PolarHBondContact O-N 2.94Å
147	I	97.5	Very high	96.1	Very high	18 Å²	18	27.4 Å²	27.4	9%	0.092	16%	0.163	C	C	.	.	H	α-helix	trans	-65.5	-40.4	176.1	-68.4	159.7	0	0	0	110	F77 W78 V80 A143 I144 E150 M151	F77-I147 HydrophobicContact CE2-CD1 3.82Å; F77-I147 HydrophobicContact CZ-CD1 4.13Å; W78-I147 HydrophobicContact CD2-CG2 4.16Å; W78-I147 HydrophobicContact CE3-CG2 4.07Å; W78-I147 HydrophobicContact CH2-CG2 3.67Å; W78-I147 HydrophobicContact CZ2-CG2 3.77Å; W78-I147 HydrophobicContact CZ3-CG2 3.83Å; W78-I147 WeakPolarHBondContact O-CD1 3.24Å; V80-I147 HydrophobicContact CG2-CG2 3.99Å; A143-I147 PolarHBondContact O-N 3.12Å; I144-I147 HydrophobicContact CD1-CD1 4.02Å; I144-I147 CarbonylContact O-C 3.56Å; I144-I147 WeakPolarHBondContact O-CA 3.36Å; I144-I147 WeakPolarHBondContact O-CB 3.42Å; I144-I147 PolarHBondContact O-N 2.92Å; I147-E150 PolarHBondContact O-N 2.99Å; I147-M151 VanDerWaalsContact O-CB 3.29Å; I147-M151 WeakPolarHBondContact O-CB 3.26Å; I147-M151 PolarHBondContact O-N 2.94Å
148	H	96.8	Very high	96	Very high	0 Å²	0	29.3 Å²	29.3	0%	0	17%	0.174	C	C	.	.	H	α-helix	trans	-59.5	-51.4	174.1	-61.8	-178.6	0	0	0	110.7	W78 D114 I144 E145 N146 E150 M151 Y152 D241 E242	W78-H148 AromaticContact CZ2-CD2 3.76Å; D114-H148 WeakPolarHBondContact OD2-CB 3.39Å; I144-H148 VanDerWaalsContact CG2-CE1 3.46Å; I144-H148 WeakPolarHBondContact CG2-CE1 3.48Å; I144-H148 WeakPolarHBondContact CG2-NE2 3.49Å; I144-H148 PolarHBondContact O-CD2 3.16Å; I144-H148 PolarHBondContact O-N 3.48Å; E145-H148 PolarHBondContact O-N 2.89Å; E145-H148 IonicContact OE2-ND1 3.79Å; N146-H148 VanDerWaalsContact C-N 3.34Å; H148-E150 VanDerWaalsContact C-N 3.33Å; H148-E150 PolarHBondContact O-N 2.88Å; H148-M151 WeakPolarHBondContact O-CB 3.43Å; H148-M151 PolarHBondContact O-N 3.38Å; H148-M151 VanDerWaalsContact O-N 3.16Å; H148-Y152 HydrophobicContact CB-CD2 4.47Å; H148-Y152 HydrophobicContact CB-CE2 4.28Å; H148-Y152 WeakPolarHBondContact O-CD2 3.3Å; H148-Y152 PolarHBondContact O-N 3.21Å; H148-D241 IonicContact NE2-OD2 2.58Å; H148-E242 IonicContact CE1-OE1 2.6Å; H148-E242 PolarHBondContact CE1-OE1 3.41Å; H148-E242 IonicContact ND1-OE1 3.19Å; H148-E242 PolarHBondContact ND1-OE1 3.42Å
149	S	94.7	Very high	95.9	Very high	27 Å²	27	29.4 Å²	29.4	19%	0.189	18%	0.175	C	C	.	.	H	α-helix	trans	-58.4	-42.3	178.2	-63.5	0	0	0	0	112.7	E145 N146 S153	E145-S149 WeakPolarHBondContact O-CB 3.47Å; E145-S149 PolarHBondContact O-N 3.03Å; E145-S149 PolarHBondContact O-OG 3.1Å; N146-S149 PolarHBondContact O-N 3.29Å; S149-S153 WeakPolarHBondContact O-CB 3.48Å; S149-S153 PolarHBondContact O-N 2.81Å; S149-S153 PolarHBondContact O-OG 2.84Å
150	E	95.8	Very high	95.8	Very high	100 Å²	100	27.5 Å²	27.5	47%	0.467	15%	0.154	S	C	.	.	H	α-helix	trans	-64.5	-46.9	175.3	-176.1	179.6	-169.2	0	0	111.4	V80 N146 I147 H148 Y152 S153 L154	V80-E150 HydrophobicContact CG2-CB 4Å; V80-E150 HydrophobicContact CG2-CG 3.85Å; N146-E150 WeakPolarHBondContact O-CB 3.45Å; N146-E150 PolarHBondContact O-N 2.94Å; I147-E150 PolarHBondContact O-N 2.99Å; H148-E150 VanDerWaalsContact C-N 3.33Å; H148-E150 PolarHBondContact O-N 2.88Å; E150-Y152 PolarHBondContact O-N 2.84Å; E150-S153 PolarHBondContact O-N 3.45Å; E150-L154 WeakPolarHBondContact O-CB 3.41Å; E150-L154 PolarHBondContact O-N 3.33Å
151	M	97.2	Very high	95.4	Very high	0 Å²	0	32.9 Å²	32.9	0%	0	18%	0.18	C	C	.	.	H	α-helix	trans	-60	-48.2	179.3	-173.2	71	-99.1	0	0	111.2	W78 V80 V83 L85 I147 H148 S153 L154 L155 I238	W78-M151 HydrophobicContact CH2-CB 4.09Å; W78-M151 HydrophobicContact CH2-CG 4.04Å; W78-M151 HydrophobicContact CH2-SD 4.43Å; W78-M151 HydrophobicContact CZ3-CG 4.38Å; W78-M151 HydrophobicContact CZ3-SD 4.18Å; V80-M151 HydrophobicContact CB-SD 4.48Å; V80-M151 HydrophobicContact CG1-CE 4.08Å; V80-M151 HydrophobicContact CG1-SD 3.85Å; V80-M151 HydrophobicContact CG2-CB 4.12Å; V80-M151 HydrophobicContact CG2-SD 4.48Å; V83-M151 HydrophobicContact CB-CE 4.41Å; V83-M151 HydrophobicContact CB-SD 3.91Å; V83-M151 HydrophobicContact CG1-CE 4.25Å; V83-M151 HydrophobicContact CG1-SD 4.12Å; V83-M151 HydrophobicContact CG2-SD 3.71Å; L85-M151 HydrophobicContact CD1-CE 4.14Å; L85-M151 HydrophobicContact CD2-CE 4.25Å; I147-M151 VanDerWaalsContact O-CB 3.29Å; I147-M151 WeakPolarHBondContact O-CB 3.26Å; I147-M151 PolarHBondContact O-N 2.94Å; H148-M151 WeakPolarHBondContact O-CB 3.43Å; H148-M151 PolarHBondContact O-N 3.38Å; H148-M151 VanDerWaalsContact O-N 3.16Å; M151-S153 VanDerWaalsContact C-N 3.31Å; M151-S153 PolarHBondContact O-N 3.22Å; M151-L154 HydrophobicContact CE-CB 4.27Å; M151-L154 HydrophobicContact CE-CD2 3.97Å; M151-L154 HydrophobicContact CE-CG 4.38Å; M151-L154 PolarHBondContact O-N 3.22Å; M151-L155 HydrophobicContact CE-CD1 4.28Å; M151-L155 HydrophobicContact CE-CD2 4.07Å; M151-L155 HydrophobicContact CE-CG 3.78Å; M151-L155 HydrophobicContact CG-CD1 4.17Å; M151-L155 VanDerWaalsContact O-CG 3.23Å; M151-L155 WeakPolarHBondContact O-CG 3.38Å; M151-L155 PolarHBondContact O-N 2.85Å; M151-I238 HydrophobicContact CB-CD1 4.48Å; M151-I238 HydrophobicContact CG-CD1 4.27Å
152	Y	96.3	Very high	95.2	Very high	1 Å²	1	37 Å²	37	0%	0.004	20%	0.201	C	C	.	.	H	α-helix	trans	-63.2	-38.4	177.1	-69.8	-54.3	0	0	0	112.5	L107 F110 D114 H148 E150 L155 I156 I238	L107-Y152 HydrophobicContact CD2-CD1 3.76Å; L107-Y152 HydrophobicContact CD2-CE1 4.17Å; F110-Y152 HydrophobicContact CB-CD1 3.92Å; F110-Y152 HydrophobicContact CB-CD2 3.7Å; F110-Y152 HydrophobicContact CB-CE1 3.76Å; F110-Y152 HydrophobicContact CB-CE2 3.53Å; F110-Y152 HydrophobicContact CB-CG 3.9Å; F110-Y152 HydrophobicContact CD2-CD1 4.03Å; F110-Y152 AromaticContact CD2-CE1 3.26Å; F110-Y152 HydrophobicContact CD2-CE1 3.26Å; F110-Y152 HydrophobicContact CD2-CE2 4.29Å; F110-Y152 AromaticContact CD2-CZ 3.4Å; F110-Y152 VanDerWaalsContact CD2-CZ 3.4Å; F110-Y152 WeakPolarHBondContact CD2-OH 3.26Å; F110-Y152 HydrophobicContact CE2-CE1 4.02Å; F110-Y152 HydrophobicContact CG-CD1 4.47Å; F110-Y152 AromaticContact CG-CE1 3.88Å; F110-Y152 HydrophobicContact CG-CE1 3.88Å; F110-Y152 HydrophobicContact CG-CE2 4.11Å; F110-Y152 AromaticContact CG-CZ 3.64Å; D114-Y152 WeakPolarHBondContact OD2-CD2 3.48Å; D114-Y152 WeakPolarHBondContact OD2-CE2 3.34Å; H148-Y152 HydrophobicContact CB-CD2 4.47Å; H148-Y152 HydrophobicContact CB-CE2 4.28Å; H148-Y152 WeakPolarHBondContact O-CD2 3.3Å; H148-Y152 PolarHBondContact O-N 3.21Å; E150-Y152 PolarHBondContact O-N 2.84Å; Y152-L155 HydrophobicContact CD1-CD1 4Å; Y152-L155 HydrophobicContact CE1-CD1 4.48Å; Y152-L155 PolarHBondContact O-N 2.95Å; Y152-I156 VanDerWaalsContact O-CG1 3.31Å; Y152-I156 WeakPolarHBondContact O-CG1 3.49Å; Y152-I156 PolarHBondContact O-N 3.21Å; Y152-I238 HydrophobicContact CE1-CD1 3.98Å; Y152-I238 HydrophobicContact CE2-CD1 3.79Å; Y152-I238 HydrophobicContact CE2-CG2 4.36Å; Y152-I238 VanDerWaalsContact CZ-CD1 3.49Å; Y152-I238 WeakPolarHBondContact OH-CG2 3.5Å
153	S	93.3	Very high	94.8	Very high	46 Å²	46	42.3 Å²	42.3	32%	0.322	23%	0.226	S	C	.	.	H	α-helix	trans	-63.5	-42.2	175.1	-60.8	0	0	0	0	112.2	S149 E150 M151 I156 D157	S149-S153 WeakPolarHBondContact O-CB 3.48Å; S149-S153 PolarHBondContact O-N 2.81Å; S149-S153 PolarHBondContact O-OG 2.84Å; E150-S153 PolarHBondContact O-N 3.45Å; M151-S153 VanDerWaalsContact C-N 3.31Å; M151-S153 PolarHBondContact O-N 3.22Å; S153-I156 PolarHBondContact O-N 2.98Å; S153-D157 WeakPolarHBondContact O-CB 3.43Å; S153-D157 PolarHBondContact O-N 3.42Å
154	L	94.7	Very high	94.5	Very high	68 Å²	68	43.7 Å²	43.7	36%	0.356	24%	0.237	S	C	.	.	H	α-helix	trans	-65.6	-39.6	176.1	-178.8	63.5	0	0	0	112	V80 L85 E150 M151 D157 T158	V80-L154 HydrophobicContact CG1-CD2 3.48Å; V80-L154 VanDerWaalsContact CG1-CD2 3.48Å; L85-L154 HydrophobicContact CD1-CD2 3.89Å; L85-L154 HydrophobicContact CD1-CG 3.81Å; E150-L154 WeakPolarHBondContact O-CB 3.41Å; E150-L154 PolarHBondContact O-N 3.33Å; M151-L154 HydrophobicContact CE-CB 4.27Å; M151-L154 HydrophobicContact CE-CD2 3.97Å; M151-L154 HydrophobicContact CE-CG 4.38Å; M151-L154 PolarHBondContact O-N 3.22Å; L154-D157 PolarHBondContact O-N 3.16Å; L154-T158 VanDerWaalsContact O-CB 3.25Å; L154-T158 WeakPolarHBondContact O-CB 3.31Å; L154-T158 PolarHBondContact O-N 3.06Å; L154-T158 PolarHBondContact O-OG1 2.61Å
155	L	96.5	Very high	94.2	Very high	0 Å²	0	47.5 Å²	47.5	0%	0	26%	0.255	C	S	.	.	H	α-helix	trans	-61.7	-47.7	175.3	-69.6	164.6	0	0	0	111	L85 L107 M151 Y152 T158 Y159 L231	L85-L155 HydrophobicContact CD1-CD2 4.37Å; L85-L155 HydrophobicContact CD2-CD2 3.67Å; L107-L155 HydrophobicContact CD1-CB 4.07Å; L107-L155 HydrophobicContact CD2-CB 4.12Å; L107-L155 HydrophobicContact CD2-CD1 3.87Å; M151-L155 HydrophobicContact CE-CD1 4.28Å; M151-L155 HydrophobicContact CE-CD2 4.07Å; M151-L155 HydrophobicContact CE-CG 3.78Å; M151-L155 HydrophobicContact CG-CD1 4.17Å; M151-L155 VanDerWaalsContact O-CG 3.23Å; M151-L155 WeakPolarHBondContact O-CG 3.38Å; M151-L155 PolarHBondContact O-N 2.85Å; Y152-L155 HydrophobicContact CD1-CD1 4Å; Y152-L155 HydrophobicContact CE1-CD1 4.48Å; Y152-L155 PolarHBondContact O-N 2.95Å; L155-T158 PolarHBondContact O-N 3.36Å; L155-Y159 HydrophobicContact CB-CD2 4.46Å; L155-Y159 HydrophobicContact CB-CE2 3.99Å; L155-Y159 HydrophobicContact CD2-CE2 3.79Å; L155-Y159 WeakPolarHBondContact CD2-OH 3.4Å; L155-Y159 HydrophobicContact CG-CE2 4.49Å; L155-Y159 WeakPolarHBondContact O-CD2 3.38Å; L155-Y159 VanDerWaalsContact O-CG 3.23Å; L155-Y159 PolarHBondContact O-N 3.3Å; L155-L231 HydrophobicContact CD1-CD1 3.82Å; L155-L231 HydrophobicContact CD2-CB 4.37Å; L155-L231 HydrophobicContact CD2-CD1 4.23Å
156	I	94.3	Very high	93.9	Very high	0 Å²	0	50.4 Å²	50.4	0%	0	27%	0.266	C	S	.	.	H	α-helix	trans	-61.1	-48.2	176.5	-67.2	168.6	0	0	0	110.5	L107 A111 Y152 S153 T158 Y159 I160 R166 L169 F170	L107-I156 HydrophobicContact CB-CD1 4.14Å; L107-I156 HydrophobicContact CB-CG1 3.74Å; L107-I156 HydrophobicContact CD1-CG1 4.37Å; A111-I156 HydrophobicContact CB-CD1 4.16Å; Y152-I156 VanDerWaalsContact O-CG1 3.31Å; Y152-I156 WeakPolarHBondContact O-CG1 3.49Å; Y152-I156 PolarHBondContact O-N 3.21Å; S153-I156 PolarHBondContact O-N 2.98Å; I156-T158 VanDerWaalsContact C-N 3.27Å; I156-T158 PolarHBondContact O-N 3.44Å; I156-Y159 PolarHBondContact O-N 3.23Å; I156-I160 HydrophobicContact CG2-CG1 4.16Å; I156-I160 VanDerWaalsContact O-CB 3.29Å; I156-I160 WeakPolarHBondContact O-CB 3.36Å; I156-I160 WeakPolarHBondContact O-CG1 3.31Å; I156-I160 PolarHBondContact O-N 3.38Å; I156-R166 HydrophobicContact CG2-CG 4.05Å; I156-L169 HydrophobicContact CG2-CD1 4.42Å; I156-F170 HydrophobicContact CB-CE1 4.21Å; I156-F170 HydrophobicContact CB-CZ 4.07Å; I156-F170 HydrophobicContact CD1-CD1 4.26Å; I156-F170 HydrophobicContact CD1-CE1 3.9Å; I156-F170 HydrophobicContact CG2-CE1 4.14Å; I156-F170 HydrophobicContact CG2-CE2 4.18Å; I156-F170 HydrophobicContact CG2-CZ 3.83Å
157	D	92.6	Very high	93.5	Very high	84 Å²	84	52.8 Å²	52.8	45%	0.449	27%	0.274	S	S	.	.	H	α-helix	trans	-64	-33	-179.6	-168.2	62	0	0	0	112.6	S153 L154 R166	S153-D157 WeakPolarHBondContact O-CB 3.43Å; S153-D157 PolarHBondContact O-N 3.42Å; L154-D157 PolarHBondContact O-N 3.16Å; D157-R166 WeakPolarHBondContact OD1-CD 3.39Å; D157-R166 IonicContact OD1-CZ 3.39Å; D157-R166 IonicContact OD1-NE 3.63Å; D157-R166 IonicContact OD1-NH1 2.74Å; D157-R166 PolarHBondContact OD1-NH1 2.98Å
158	T	93.7	Very high	93.1	Very high	40 Å²	40	55.1 Å²	55.1	25%	0.245	29%	0.285	C	S	.	.	H	α-helix	trans	-70.7	-47.6	177.3	-60	0	0	0	0	111.7	L85 M89 L154 L155 I156	L85-T158 HydrophobicContact CD1-CG2 4.44Å; M89-T158 HydrophobicContact CG-CG2 4Å; M89-T158 HydrophobicContact SD-CG2 3.87Å; L154-T158 VanDerWaalsContact O-CB 3.25Å; L154-T158 WeakPolarHBondContact O-CB 3.31Å; L154-T158 PolarHBondContact O-N 3.06Å; L154-T158 PolarHBondContact O-OG1 2.61Å; L155-T158 PolarHBondContact O-N 3.36Å; I156-T158 VanDerWaalsContact C-N 3.27Å; I156-T158 PolarHBondContact O-N 3.44Å
159	Y	95.2	Very high	92.7	Very high	3 Å²	3	55.2 Å²	55.2	1%	0.012	29%	0.285	C	S	.	.	H	α-helix	trans	-85	-33.1	-171.5	-56.1	-28.6	0	0	0	113.8	D88 M89 W92 L107 L155 I156 Q161 L231	D88-Y159 HydrophobicContact CB-CE1 3.6Å; D88-Y159 PolarHBondContact OD2-OH 2.86Å; M89-Y159 HydrophobicContact SD-CD1 3.8Å; W92-Y159 HydrophobicContact CD2-CG 4.2Å; W92-Y159 HydrophobicContact CE3-CD2 4.32Å; W92-Y159 HydrophobicContact CE3-CG 4.11Å; W92-Y159 HydrophobicContact CZ3-CD2 4.29Å; W92-Y159 HydrophobicContact CZ3-CG 4.39Å; W92-Y159 PolarHBondContact NE1-O 3Å; L107-Y159 HydrophobicContact CD1-CD2 3.77Å; L107-Y159 HydrophobicContact CD1-CE2 4Å; L155-Y159 HydrophobicContact CB-CD2 4.46Å; L155-Y159 HydrophobicContact CB-CE2 3.99Å; L155-Y159 HydrophobicContact CD2-CE2 3.79Å; L155-Y159 WeakPolarHBondContact CD2-OH 3.4Å; L155-Y159 HydrophobicContact CG-CE2 4.49Å; L155-Y159 WeakPolarHBondContact O-CD2 3.38Å; L155-Y159 VanDerWaalsContact O-CG 3.23Å; L155-Y159 PolarHBondContact O-N 3.3Å; I156-Y159 PolarHBondContact O-N 3.23Å; Y159-Q161 PolarHBondContact O-N 3.46Å; Y159-L231 WeakPolarHBondContact OH-CB 3.42Å
160	I	93.6	Very high	92.4	Very high	5 Å²	5	58 Å²	58	3%	0.026	29%	0.294	C	S	.	.			trans	-100.6	93.7	-172.1	-46.8	-58.8	0	0	0	109.5	W92 S104 I156 D162 E165 R166 L169	W92-I160 HydrophobicContact CH2-CD1 4.13Å; W92-I160 HydrophobicContact CZ2-CD1 3.73Å; S104-I160 VanDerWaalsContact OG-CD1 3.27Å; S104-I160 WeakPolarHBondContact OG-CD1 3.26Å; I156-I160 HydrophobicContact CG2-CG1 4.16Å; I156-I160 VanDerWaalsContact O-CB 3.29Å; I156-I160 WeakPolarHBondContact O-CB 3.36Å; I156-I160 WeakPolarHBondContact O-CG1 3.31Å; I156-I160 PolarHBondContact O-N 3.38Å; I160-D162 VanDerWaalsContact C-N 3.35Å; I160-E165 HydrophobicContact CG2-CB 3.81Å; I160-E165 HydrophobicContact CG2-CG 3.75Å; I160-R166 HydrophobicContact CB-CB 4.5Å; I160-R166 HydrophobicContact CG2-CB 4.14Å; I160-L169 HydrophobicContact CB-CD1 4.46Å; I160-L169 HydrophobicContact CD1-CD1 4.11Å; I160-L169 HydrophobicContact CG1-CD1 3.72Å; I160-L169 HydrophobicContact CG2-CD1 4.16Å
161	Q	89.5	Confident	92	Very high	145 Å²	145	56 Å²	56	68%	0.678	29%	0.286	S	S	*	.			trans	-73.7	-26.2	-178.5	-64	179	12.7	0	0	113.1	Y159 E163	Y159-Q161 PolarHBondContact O-N 3.46Å; Q161-E163 PolarHBondContact O-N 3.18Å
162	D	91.7	Very high	91.3	Very high	86 Å²	86	56 Å²	56	46%	0.46	29%	0.286	S	S	.	.			trans	-76.8	120	177.9	-174.7	89.1	0	0	0	110.6	I160 A164 E165 R166	I160-D162 VanDerWaalsContact C-N 3.35Å; D162-A164 VanDerWaalsContact C-N 3.31Å; D162-A164 PolarHBondContact O-N 3.19Å; D162-A164 WeakPolarHBondContact OD2-CA 3.42Å; D162-A164 WeakPolarHBondContact OD2-CB 3.32Å; D162-A164 PolarHBondContact OD2-N 3.35Å; D162-E165 HydrophobicContact CB-CB 3.94Å; D162-E165 PolarHBondContact O-N 3.2Å; D162-E165 PolarHBondContact OD2-N 3.19Å; D162-R166 WeakPolarHBondContact O-CB 3.39Å; D162-R166 PolarHBondContact O-N 3.04Å
163	E	89.6	Confident	90.4	Very high	143 Å²	143	58.5 Å²	58.5	67%	0.668	30%	0.299	S	S	*	.	H	α-helix	trans	-64.9	-34.5	-176.3	-178.5	173.7	-162.6	0	0	112.7	Q161 H167	Q161-E163 PolarHBondContact O-N 3.18Å; E163-H167 WeakPolarHBondContact O-CB 3.13Å; E163-H167 PolarHBondContact O-N 2.96Å
164	A	90.4	Very high	89.9	Confident	70 Å²	70	63.8 Å²	63.8	58%	0.579	32%	0.319	S	S	*	.	H	α-helix	trans	-73.7	-40.2	-180	0	0	0	0	0	111.2	D162 H167 H168	D162-A164 VanDerWaalsContact C-N 3.31Å; D162-A164 PolarHBondContact O-N 3.19Å; D162-A164 WeakPolarHBondContact OD2-CA 3.42Å; D162-A164 WeakPolarHBondContact OD2-CB 3.32Å; D162-A164 PolarHBondContact OD2-N 3.35Å; A164-H167 PolarHBondContact O-N 3.18Å; A164-H168 WeakPolarHBondContact O-CB 3.5Å; A164-H168 PolarHBondContact O-N 3.1Å
165	E	90.5	Very high	89.3	Confident	83 Å²	83	62.9 Å²	62.9	39%	0.388	32%	0.316	S	S	.	.	H	α-helix	trans	-63.3	-44.5	172.6	-171.6	172.1	-162.6	0	0	110.9	I160 D162 H167 H168 L169	I160-E165 HydrophobicContact CG2-CB 3.81Å; I160-E165 HydrophobicContact CG2-CG 3.75Å; D162-E165 HydrophobicContact CB-CB 3.94Å; D162-E165 PolarHBondContact O-N 3.2Å; D162-E165 PolarHBondContact OD2-N 3.19Å; E165-H167 PolarHBondContact O-N 3.22Å; E165-H168 WeakPolarHBondContact O-CA 3.41Å; E165-H168 WeakPolarHBondContact O-CB 3.35Å; E165-H168 PolarHBondContact O-N 3.23Å; E165-H168 VanDerWaalsContact O-N 3.08Å; E165-L169 HydrophobicContact CG-CD1 4.21Å; E165-L169 VanDerWaalsContact O-CG 3.31Å; E165-L169 WeakPolarHBondContact O-CG 3.41Å; E165-L169 PolarHBondContact O-N 2.85Å
166	R	90.9	Very high	88.6	Confident	60 Å²	60	63 Å²	63	23%	0.226	32%	0.317	C	S	.	.	H	α-helix	trans	-58.7	-46.2	175	-177.5	175.1	66.4	-151.1	-0.3	112.1	I156 D157 I160 D162 H168 L169 F170	I156-R166 HydrophobicContact CG2-CG 4.05Å; D157-R166 WeakPolarHBondContact OD1-CD 3.39Å; D157-R166 IonicContact OD1-CZ 3.39Å; D157-R166 IonicContact OD1-NE 3.63Å; D157-R166 IonicContact OD1-NH1 2.74Å; D157-R166 PolarHBondContact OD1-NH1 2.98Å; I160-R166 HydrophobicContact CB-CB 4.5Å; I160-R166 HydrophobicContact CG2-CB 4.14Å; D162-R166 WeakPolarHBondContact O-CB 3.39Å; D162-R166 PolarHBondContact O-N 3.04Å; R166-H168 VanDerWaalsContact C-N 3.3Å; R166-H168 PolarHBondContact O-N 3.35Å; R166-L169 PolarHBondContact O-N 2.97Å; R166-F170 HydrophobicContact CG-CD2 3.64Å; R166-F170 HydrophobicContact CG-CE2 3.3Å; R166-F170 HydrophobicContact CG-CZ 4.28Å; R166-F170 VanDerWaalsContact O-CD2 3.28Å; R166-F170 WeakPolarHBondContact O-CD2 3.42Å; R166-F170 PolarHBondContact O-N 2.85Å
167	H	89.6	Confident	88.1	Confident	129 Å²	129	68.2 Å²	68.2	60%	0.597	35%	0.351	S	S	*	.	H	α-helix	trans	-63	-37.2	174.8	-175	-82.4	0	0	0	112	E163 A164 E165 N171	E163-H167 WeakPolarHBondContact O-CB 3.13Å; E163-H167 PolarHBondContact O-N 2.96Å; A164-H167 PolarHBondContact O-N 3.18Å; E165-H167 PolarHBondContact O-N 3.22Å; H167-N171 PolarHBondContact CE1-ND2 2.68Å; H167-N171 PolarHBondContact ND1-ND2 3.48Å; H167-N171 PolarHBondContact NE2-ND2 3.16Å; H167-N171 PolarHBondContact O-N 2.71Å; H167-N171 PolarHBondContact O-ND2 2.84Å
168	H	88.4	Confident	87.6	Confident	68 Å²	68	65.3 Å²	65.3	32%	0.315	34%	0.337	S	S	.	.	H	α-helix	trans	-61.9	-42.9	175.1	179.9	82.4	0	0	0	112	A164 E165 R166 N171 T175	A164-H168 WeakPolarHBondContact O-CB 3.5Å; A164-H168 PolarHBondContact O-N 3.1Å; E165-H168 WeakPolarHBondContact O-CA 3.41Å; E165-H168 WeakPolarHBondContact O-CB 3.35Å; E165-H168 PolarHBondContact O-N 3.23Å; E165-H168 VanDerWaalsContact O-N 3.08Å; R166-H168 VanDerWaalsContact C-N 3.3Å; R166-H168 PolarHBondContact O-N 3.35Å; H168-N171 PolarHBondContact O-N 3.36Å; H168-T175 VanDerWaalsContact CE1-CB 3.47Å; H168-T175 WeakPolarHBondContact CE1-CB 3.46Å; H168-T175 PolarHBondContact O-OG1 3.1Å
169	L	88.6	Confident	87.2	Confident	1 Å²	1	63.4 Å²	63.4	1%	0.005	33%	0.325	C	S	.	.	H	α-helix	trans	-70.9	-41.6	180	-66.2	170.8	0	0	0	112.4	Y105 A108 I156 I160 E165 R166 N171 A172 I176	Y105-L169 HydrophobicContact CD2-CD2 3.93Å; Y105-L169 HydrophobicContact CE2-CD2 3.99Å; A108-L169 HydrophobicContact CB-CB 3.91Å; A108-L169 HydrophobicContact CB-CD2 3.81Å; A108-L169 HydrophobicContact CB-CG 4.43Å; I156-L169 HydrophobicContact CG2-CD1 4.42Å; I160-L169 HydrophobicContact CB-CD1 4.46Å; I160-L169 HydrophobicContact CD1-CD1 4.11Å; I160-L169 HydrophobicContact CG1-CD1 3.72Å; I160-L169 HydrophobicContact CG2-CD1 4.16Å; E165-L169 HydrophobicContact CG-CD1 4.21Å; E165-L169 VanDerWaalsContact O-CG 3.31Å; E165-L169 WeakPolarHBondContact O-CG 3.41Å; E165-L169 PolarHBondContact O-N 2.85Å; R166-L169 PolarHBondContact O-N 2.97Å; L169-N171 PolarHBondContact O-N 3.19Å; L169-A172 VanDerWaalsContact O-CB 3.23Å; L169-A172 WeakPolarHBondContact O-CB 3.33Å; L169-A172 PolarHBondContact O-N 3.19Å; L169-I176 HydrophobicContact CD2-CD1 4.26Å
170	F	87.3	Confident	87	Confident	87 Å²	87	67.8 Å²	67.8	38%	0.382	34%	0.344	S	S	.	.	H	α-helix	trans	-64.5	-21.4	176.1	-75.8	-51.3	0	0	0	113.7	I156 R166	I156-F170 HydrophobicContact CB-CE1 4.21Å; I156-F170 HydrophobicContact CB-CZ 4.07Å; I156-F170 HydrophobicContact CD1-CD1 4.26Å; I156-F170 HydrophobicContact CD1-CE1 3.9Å; I156-F170 HydrophobicContact CG2-CE1 4.14Å; I156-F170 HydrophobicContact CG2-CE2 4.18Å; I156-F170 HydrophobicContact CG2-CZ 3.83Å; R166-F170 HydrophobicContact CG-CD2 3.64Å; R166-F170 HydrophobicContact CG-CE2 3.3Å; R166-F170 HydrophobicContact CG-CZ 4.28Å; R166-F170 VanDerWaalsContact O-CD2 3.28Å; R166-F170 WeakPolarHBondContact O-CD2 3.42Å; R166-F170 PolarHBondContact O-N 2.85Å
171	N	87.4	Confident	86.8	Confident	57 Å²	57	71.5 Å²	71.5	31%	0.305	36%	0.36	S	S	.	.	T	Hydrogen-bonded Turn	trans	-100.1	25.9	174.6	-65.4	-75.3	0	0	0	112.7	H167 H168 L169 I173 E174 T175	H167-N171 PolarHBondContact CE1-ND2 2.68Å; H167-N171 PolarHBondContact ND1-ND2 3.48Å; H167-N171 PolarHBondContact NE2-ND2 3.16Å; H167-N171 PolarHBondContact O-N 2.71Å; H167-N171 PolarHBondContact O-ND2 2.84Å; H168-N171 PolarHBondContact O-N 3.36Å; L169-N171 PolarHBondContact O-N 3.19Å; N171-I173 PolarHBondContact O-N 3.12Å; N171-E174 PolarHBondContact O-N 3.24Å; N171-T175 VanDerWaalsContact C-OG1 3.31Å; N171-T175 HydrophobicContact CB-CG2 3.85Å; N171-T175 WeakPolarHBondContact O-CG2 3.39Å; N171-T175 PolarHBondContact O-N 2.93Å; N171-T175 PolarHBondContact O-OG1 3.41Å
172	A	82.2	Confident	86.8	Confident	0 Å²	0	64.8 Å²	64.8	0%	0	33%	0.329	C	S	.	.	H	α-helix	trans	-50.1	-34.5	-173.1	0	0	0	0	0	115.3	A108 L169 E174 T175 I176 V179	A108-A172 HydrophobicContact CB-CB 3.94Å; L169-A172 VanDerWaalsContact O-CB 3.23Å; L169-A172 WeakPolarHBondContact O-CB 3.33Å; L169-A172 PolarHBondContact O-N 3.19Å; A172-E174 PolarHBondContact O-N 3.21Å; A172-T175 VanDerWaalsContact CA-OG1 3.27Å; A172-T175 WeakPolarHBondContact CA-OG1 3.19Å; A172-T175 PolarHBondContact N-OG1 3.05Å; A172-T175 PolarHBondContact O-N 2.99Å; A172-I176 HydrophobicContact CB-CB 4.49Å; A172-I176 HydrophobicContact CB-CD1 3.85Å; A172-I176 HydrophobicContact CB-CG1 4.39Å; A172-I176 WeakPolarHBondContact O-CA 3Å; A172-I176 WeakPolarHBondContact O-CB 3.42Å; A172-I176 PolarHBondContact O-N 2.93Å; A172-V179 HydrophobicContact CB-CB 4.33Å; A172-V179 HydrophobicContact CB-CG1 3.98Å; A172-V179 HydrophobicContact CB-CG2 4.32Å
173	I	78.9	Confident	86.8	Confident	53 Å²	53	60.7 Å²	60.7	27%	0.272	31%	0.307	S	S	.	.	H	α-helix	trans	-58.3	-37.1	176.8	-59.4	176.5	0	0	0	111.2	A112 I116 N171 K180 A183	A112-I173 HydrophobicContact CB-CD1 3.97Å; A112-I173 HydrophobicContact CB-CG1 3.63Å; I116-I173 HydrophobicContact CD1-CD1 4Å; I116-I173 HydrophobicContact CG1-CD1 4.42Å; N171-I173 PolarHBondContact O-N 3.12Å; I173-K180 VanDerWaalsContact O-CB 3.24Å; I173-K180 WeakPolarHBondContact O-CB 3.41Å; I173-K180 WeakPolarHBondContact O-CG 3.27Å; I173-A183 HydrophobicContact CG1-CB 4.19Å; I173-A183 HydrophobicContact CG2-CB 3.95Å
174	E	83.1	Confident	87	Confident	158 Å²	158	57.4 Å²	57.4	74%	0.738	29%	0.294	S	S	*	.	H	α-helix	trans	-92.8	-33.8	-179.4	-60.8	-172.1	173.1	0	0	112.3	N171 A172	N171-E174 PolarHBondContact O-N 3.24Å; A172-E174 PolarHBondContact O-N 3.21Å
175	T	80.5	Confident	87.2	Confident	48 Å²	48	54.2 Å²	54.2	29%	0.294	27%	0.267	S	S	.	.	H	α-helix	trans	-94.6	-26.2	-168.7	60	0	0	0	0	113.9	H168 N171 A172	H168-T175 VanDerWaalsContact CE1-CB 3.47Å; H168-T175 WeakPolarHBondContact CE1-CB 3.46Å; H168-T175 PolarHBondContact O-OG1 3.1Å; N171-T175 VanDerWaalsContact C-OG1 3.31Å; N171-T175 HydrophobicContact CB-CG2 3.85Å; N171-T175 WeakPolarHBondContact O-CG2 3.39Å; N171-T175 PolarHBondContact O-N 2.93Å; N171-T175 PolarHBondContact O-OG1 3.41Å; A172-T175 VanDerWaalsContact CA-OG1 3.27Å; A172-T175 WeakPolarHBondContact CA-OG1 3.19Å; A172-T175 PolarHBondContact N-OG1 3.05Å; A172-T175 PolarHBondContact O-N 2.99Å
176	I	82.6	Confident	87.3	Confident	4 Å²	4	50.7 Å²	50.7	2%	0.021	25%	0.252	C	S	.	.			trans	-116	106.4	-174.3	-59.9	172	0	0	0	109.5	Y105 A108 L169 A172 C178 V179 K180	Y105-I176 HydrophobicContact CD1-CD1 3.72Å; Y105-I176 HydrophobicContact CD1-CG1 4.29Å; Y105-I176 HydrophobicContact CD1-CG2 3.86Å; Y105-I176 HydrophobicContact CD2-CD1 4.48Å; Y105-I176 HydrophobicContact CE1-CB 4.45Å; Y105-I176 HydrophobicContact CE1-CD1 3.61Å; Y105-I176 HydrophobicContact CE1-CG1 3.79Å; Y105-I176 HydrophobicContact CE1-CG2 3.78Å; Y105-I176 HydrophobicContact CE2-CD1 4.39Å; Y105-I176 HydrophobicContact CG-CD1 4.16Å; A108-I176 HydrophobicContact CB-CD1 4.38Å; L169-I176 HydrophobicContact CD2-CD1 4.26Å; A172-I176 HydrophobicContact CB-CB 4.49Å; A172-I176 HydrophobicContact CB-CD1 3.85Å; A172-I176 HydrophobicContact CB-CG1 4.39Å; A172-I176 WeakPolarHBondContact O-CA 3Å; A172-I176 WeakPolarHBondContact O-CB 3.42Å; A172-I176 PolarHBondContact O-N 2.93Å; I176-C178 VanDerWaalsContact C-N 3.25Å; I176-C178 WeakPolarHBondContact CG2-SG 3.5Å; I176-C178 PolarHBondContact O-N 2.7Å; I176-C178 VanDerWaalsContact O-N 3.12Å; I176-V179 HydrophobicContact CB-CB 4.2Å; I176-V179 HydrophobicContact CB-CG2 4.06Å; I176-V179 HydrophobicContact CG2-CB 4.23Å; I176-V179 HydrophobicContact CG2-CG2 3.77Å; I176-V179 PolarHBondContact O-N 3.01Å; I176-V179 VanDerWaalsContact O-N 3.14Å; I176-K180 PolarHBondContact O-N 2.75Å
177	P	84.3	Confident	87.3	Confident	108 Å²	108	51.2 Å²	51.2	70%	0.701	26%	0.259	S	S	*	.	H	α-helix	trans	-56.5	-33.2	-174.6	-29	35.6	0	0	0	115.3	K180 K181	P177-K180 WeakPolarHBondContact O-CB 3.4Å; P177-K180 PolarHBondContact O-N 2.53Å; P177-K181 PolarHBondContact O-N 3.08Å; P177-K181 VanDerWaalsContact O-N 3.16Å
178	C	81.9	Confident	87.6	Confident	23 Å²	23	51.5 Å²	51.5	16%	0.155	26%	0.255	C	S	.	.	H	α-helix	trans	-73.5	-36.8	-179.2	65.4	0	0	0	0	112.8	I176 F279 A283	I176-C178 VanDerWaalsContact C-N 3.25Å; I176-C178 WeakPolarHBondContact CG2-SG 3.5Å; I176-C178 PolarHBondContact O-N 2.7Å; I176-C178 VanDerWaalsContact O-N 3.12Å; C178-F279 HydrophobicContact CB-CD2 3.91Å; C178-F279 HydrophobicContact CB-CE2 4.12Å; C178-A283 HydrophobicContact CB-CB 3.26Å
179	V	85.6	Confident	87.7	Confident	1 Å²	1	49.3 Å²	49.3	1%	0.006	24%	0.244	C	C	.	.	H	α-helix	trans	-66.3	-43.6	171.3	176	0	0	0	0	109.7	F109 A112 A172 I176 K181 K182 A183 F279	F109-V179 HydrophobicContact CB-CG2 3.91Å; F109-V179 HydrophobicContact CD2-CG1 4.3Å; F109-V179 HydrophobicContact CD2-CG2 4.33Å; A112-V179 HydrophobicContact CB-CG1 4.3Å; A172-V179 HydrophobicContact CB-CB 4.33Å; A172-V179 HydrophobicContact CB-CG1 3.98Å; A172-V179 HydrophobicContact CB-CG2 4.32Å; I176-V179 HydrophobicContact CB-CB 4.2Å; I176-V179 HydrophobicContact CB-CG2 4.06Å; I176-V179 HydrophobicContact CG2-CB 4.23Å; I176-V179 HydrophobicContact CG2-CG2 3.77Å; I176-V179 PolarHBondContact O-N 3.01Å; I176-V179 VanDerWaalsContact O-N 3.14Å; V179-K181 VanDerWaalsContact C-N 3.3Å; V179-K181 PolarHBondContact O-N 3.36Å; V179-K182 PolarHBondContact O-N 3.04Å; V179-K182 VanDerWaalsContact O-N 3.16Å; V179-A183 WeakPolarHBondContact O-CB 3.31Å; V179-A183 PolarHBondContact O-N 3.4Å; V179-F279 HydrophobicContact CG2-CE2 4.35Å
180	K	89.9	Confident	87.7	Confident	95 Å²	95	50 Å²	50	41%	0.413	25%	0.248	S	C	.	.	H	α-helix	trans	-53.4	-44.3	176.8	-172.6	169.5	-178.6	165.2	0	113	I173 I176 P177 K182 A183 D184	I173-K180 VanDerWaalsContact O-CB 3.24Å; I173-K180 WeakPolarHBondContact O-CB 3.41Å; I173-K180 WeakPolarHBondContact O-CG 3.27Å; I176-K180 PolarHBondContact O-N 2.75Å; P177-K180 WeakPolarHBondContact O-CB 3.4Å; P177-K180 PolarHBondContact O-N 2.53Å; K180-K182 PolarHBondContact O-N 2.87Å; K180-A183 PolarHBondContact O-N 3.37Å; K180-D184 VanDerWaalsContact O-CB 3.28Å; K180-D184 WeakPolarHBondContact O-CB 3.38Å; K180-D184 PolarHBondContact O-N 2.9Å
181	K	90	Very high	87.7	Confident	83 Å²	83	49.5 Å²	49.5	36%	0.361	26%	0.259	S	S	.	.	H	α-helix	trans	-61.7	-41.6	-179.8	-177.4	171.2	172.4	173	0	112.7	P177 V179 W185 E278	P177-K181 PolarHBondContact O-N 3.08Å; P177-K181 VanDerWaalsContact O-N 3.16Å; V179-K181 VanDerWaalsContact C-N 3.3Å; V179-K181 PolarHBondContact O-N 3.36Å; K181-W185 PolarHBondContact O-N 3.19Å; K181-W185 VanDerWaalsContact O-N 3.11Å; K181-E278 IonicContact NZ-OE1 3.76Å; K181-E278 PolarHBondContact NZ-OE1 3.14Å; K181-E278 IonicContact NZ-OE2 3.53Å; K181-E278 PolarHBondContact NZ-OE2 2.84Å
182	K	90.5	Very high	87.7	Confident	3 Å²	3	49 Å²	49	1%	0.013	26%	0.256	C	S	.	.	H	α-helix	trans	-67.5	-46.3	174.6	-74.7	-175.7	170.3	-173.9	0	111.5	F109 V179 K180 D184 W185 A186 F211 I275 E276 F279	F109-K182 HydrophobicContact CD2-CD 3.93Å; F109-K182 HydrophobicContact CE2-CB 4.08Å; F109-K182 HydrophobicContact CE2-CD 3.2Å; F109-K182 HydrophobicContact CE2-CG 4.3Å; F109-K182 HydrophobicContact CZ-CD 3.65Å; V179-K182 PolarHBondContact O-N 3.04Å; V179-K182 VanDerWaalsContact O-N 3.16Å; K180-K182 PolarHBondContact O-N 2.87Å; K182-D184 PolarHBondContact O-N 3.27Å; K182-W185 WeakPolarHBondContact O-CB 3.3Å; K182-W185 PolarHBondContact O-N 2.94Å; K182-W185 VanDerWaalsContact O-N 3.12Å; K182-A186 PolarHBondContact O-N 3.2Å; K182-F211 HydrophobicContact CB-CE2 4.49Å; K182-F211 PolarHBondContact NZ-O 2.85Å; K182-I275 HydrophobicContact CG-CG2 3.62Å; K182-E276 WeakPolarHBondContact CE-OE2 3.46Å; K182-E276 VanDerWaalsContact NZ-CD 3.27Å; K182-E276 IonicContact NZ-OE1 2.71Å; K182-E276 PolarHBondContact NZ-OE1 3.13Å; K182-E276 IonicContact NZ-OE2 3.24Å; K182-E276 PolarHBondContact NZ-OE2 3.27Å; K182-F279 HydrophobicContact CD-CD2 4.11Å; K182-F279 HydrophobicContact CD-CE2 4.46Å; K182-F279 HydrophobicContact CD-CG 4.25Å
183	A	91.2	Very high	87.7	Confident	1 Å²	1	57.6 Å²	57.6	1%	0.008	29%	0.294	C	S	.	.	H	α-helix	trans	-59	-46.6	177.2	0	0	0	0	0	111.4	I116 I173 V179 K180 W185 A186 L187	I116-A183 HydrophobicContact CD1-CB 3.61Å; I173-A183 HydrophobicContact CG1-CB 4.19Å; I173-A183 HydrophobicContact CG2-CB 3.95Å; V179-A183 WeakPolarHBondContact O-CB 3.31Å; V179-A183 PolarHBondContact O-N 3.4Å; K180-A183 PolarHBondContact O-N 3.37Å; A183-W185 VanDerWaalsContact C-N 3.29Å; A183-W185 PolarHBondContact O-N 3.29Å; A183-A186 PolarHBondContact O-N 3.02Å; A183-L187 VanDerWaalsContact O-CB 3.28Å; A183-L187 WeakPolarHBondContact O-CB 3.2Å; A183-L187 WeakPolarHBondContact O-CG 3.48Å; A183-L187 PolarHBondContact O-N 3.35Å
184	D	93	Very high	88.1	Confident	74 Å²	74	64.5 Å²	64.5	40%	0.396	32%	0.322	S	S	.	.	H	α-helix	trans	-59.3	-40.2	175.5	-74.3	-17.1	0	0	0	110.9	K180 K182 R188	K180-D184 VanDerWaalsContact O-CB 3.28Å; K180-D184 WeakPolarHBondContact O-CB 3.38Å; K180-D184 PolarHBondContact O-N 2.9Å; K182-D184 PolarHBondContact O-N 3.27Å; D184-R188 WeakPolarHBondContact O-CG 3.37Å; D184-R188 PolarHBondContact O-N 2.95Å
185	W	94.4	Very high	88.3	Confident	2 Å²	2	57.7 Å²	57.7	1%	0.008	29%	0.292	C	S	.	.	H	α-helix	trans	-60.5	-48.6	175.3	-172.1	100.9	0	0	0	111.8	K181 K182 A183 W189 A203 A206 V207 F211 I268 E271 A272 I275	K181-W185 PolarHBondContact O-N 3.19Å; K181-W185 VanDerWaalsContact O-N 3.11Å; K182-W185 WeakPolarHBondContact O-CB 3.3Å; K182-W185 PolarHBondContact O-N 2.94Å; K182-W185 VanDerWaalsContact O-N 3.12Å; A183-W185 VanDerWaalsContact C-N 3.29Å; A183-W185 PolarHBondContact O-N 3.29Å; W185-W189 AromaticContact CD2-CD1 3.92Å; W185-W189 AromaticContact CD2-NE1 3.74Å; W185-W189 AromaticContact CE2-NE1 3.37Å; W185-W189 AromaticContact CE3-CD1 3.66Å; W185-W189 AromaticContact CE3-NE1 3.85Å; W185-W189 AromaticContact CH2-CD1 3.76Å; W185-W189 AromaticContact CH2-NE1 3.37Å; W185-W189 AromaticContact CZ2-CD1 3.99Å; W185-W189 AromaticContact CZ2-NE1 3.2Å; W185-W189 AromaticContact CZ3-CD1 3.56Å; W185-W189 AromaticContact CZ3-NE1 3.66Å; W185-A203 HydrophobicContact CH2-CB 3.78Å; W185-A203 HydrophobicContact CZ3-CB 4.3Å; W185-A206 HydrophobicContact CH2-CB 4.19Å; W185-V207 HydrophobicContact CE3-CG2 4.22Å; W185-V207 HydrophobicContact CZ3-CG2 3.62Å; W185-F211 HydrophobicContact CB-CE2 4.35Å; W185-F211 HydrophobicContact CB-CZ 4.29Å; W185-F211 AromaticContact CD2-CE2 3.93Å; W185-F211 HydrophobicContact CD2-CE2 3.93Å; W185-F211 AromaticContact CD2-CZ 3.72Å; W185-F211 HydrophobicContact CD2-CZ 3.72Å; W185-F211 HydrophobicContact CE3-CD2 4.5Å; W185-F211 AromaticContact CE3-CE2 3.42Å; W185-F211 HydrophobicContact CE3-CE2 3.42Å; W185-F211 VanDerWaalsContact CE3-CE2 3.42Å; W185-F211 AromaticContact CE3-CZ 3.65Å; W185-F211 HydrophobicContact CE3-CZ 3.65Å; W185-F211 HydrophobicContact CG-CE2 4.34Å; W185-F211 HydrophobicContact CG-CZ 4.01Å; W185-F211 AromaticContact CZ3-CE2 3.99Å; W185-F211 HydrophobicContact CZ3-CE2 3.99Å; W185-F211 HydrophobicContact CZ3-CZ 4.2Å; W185-I268 HydrophobicContact CH2-CG2 4.1Å; W185-I268 HydrophobicContact CZ2-CG2 3.93Å; W185-E271 VanDerWaalsContact CD1-CD 3.49Å; W185-E271 PolarHBondContact NE1-OE1 3.44Å; W185-E271 PolarHBondContact NE1-OE2 2.91Å; W185-A272 HydrophobicContact CZ2-CB 4.4Å; W185-I275 HydrophobicContact CB-CD1 4.05Å; W185-I275 HydrophobicContact CG-CD1 3.78Å
186	A	92.8	Very high	88.8	Confident	10 Å²	10	57.3 Å²	57.3	8%	0.083	29%	0.29	C	S	.	.	H	α-helix	trans	-67.6	-45.7	-179.8	0	0	0	0	0	112.4	I116 K182 A183 R188 W189 I190 V207	I116-A186 HydrophobicContact CG2-CB 3.81Å; K182-A186 PolarHBondContact O-N 3.2Å; A183-A186 PolarHBondContact O-N 3.02Å; A186-R188 VanDerWaalsContact C-N 3.26Å; A186-R188 PolarHBondContact O-N 3.09Å; A186-W189 WeakPolarHBondContact O-CB 3.41Å; A186-W189 PolarHBondContact O-N 3.46Å; A186-I190 PolarHBondContact O-N 3.11Å; A186-V207 HydrophobicContact CB-CG2 4.31Å
187	L	92.3	Very high	89.3	Confident	71 Å²	71	57.3 Å²	57.3	37%	0.372	29%	0.29	S	S	.	.	H	α-helix	trans	-60.4	-33.8	178.2	-72.8	170.1	0	0	0	112.5	I116 A183 W189 I190 A191	I116-L187 HydrophobicContact CD1-CG 4.42Å; I116-L187 HydrophobicContact CG1-CD2 4.42Å; I116-L187 HydrophobicContact CG2-CD2 4.24Å; I116-L187 HydrophobicContact CG2-CG 4.44Å; A183-L187 VanDerWaalsContact O-CB 3.28Å; A183-L187 WeakPolarHBondContact O-CB 3.2Å; A183-L187 WeakPolarHBondContact O-CG 3.48Å; A183-L187 PolarHBondContact O-N 3.35Å; L187-W189 VanDerWaalsContact C-N 3.29Å; L187-W189 PolarHBondContact O-N 3.36Å; L187-I190 HydrophobicContact CD2-CD1 4.25Å; L187-I190 PolarHBondContact O-N 3.05Å; L187-A191 WeakPolarHBondContact O-CB 3.36Å; L187-A191 PolarHBondContact O-N 3.43Å
188	R	93.9	Very high	89.8	Confident	135 Å²	135	56.3 Å²	56.3	51%	0.509	27%	0.272	S	S	.	.	H	α-helix	trans	-57.8	-42.1	173	-77.1	176.8	-40.4	177.4	15.9	111.6	D184 A186 D192 E271	D184-R188 WeakPolarHBondContact O-CG 3.37Å; D184-R188 PolarHBondContact O-N 2.95Å; A186-R188 VanDerWaalsContact C-N 3.26Å; A186-R188 PolarHBondContact O-N 3.09Å; R188-D192 VanDerWaalsContact O-CB 3.26Å; R188-D192 WeakPolarHBondContact O-CB 3.48Å; R188-D192 PolarHBondContact O-N 2.73Å; R188-E271 IonicContact CZ-OE1 2.73Å; R188-E271 IonicContact NH1-OE1 2.71Å; R188-E271 IonicContact NH2-OE1 3.88Å; R188-E271 PolarHBondContact NH2-OE1 3.11Å; R188-E271 IonicContact NH2-OE2 3.15Å
189	W	91.8	Very high	90.4	Very high	22 Å²	22	56 Å²	56	8%	0.083	27%	0.269	C	S	.	.	H	α-helix	trans	-72.3	-32.1	179.7	-69.6	109	0	0	0	113.3	W185 A186 L187 D199 R200 A203 I268	W185-W189 AromaticContact CD2-CD1 3.92Å; W185-W189 AromaticContact CD2-NE1 3.74Å; W185-W189 AromaticContact CE2-NE1 3.37Å; W185-W189 AromaticContact CE3-CD1 3.66Å; W185-W189 AromaticContact CE3-NE1 3.85Å; W185-W189 AromaticContact CH2-CD1 3.76Å; W185-W189 AromaticContact CH2-NE1 3.37Å; W185-W189 AromaticContact CZ2-CD1 3.99Å; W185-W189 AromaticContact CZ2-NE1 3.2Å; W185-W189 AromaticContact CZ3-CD1 3.56Å; W185-W189 AromaticContact CZ3-NE1 3.66Å; A186-W189 WeakPolarHBondContact O-CB 3.41Å; A186-W189 PolarHBondContact O-N 3.46Å; L187-W189 VanDerWaalsContact C-N 3.29Å; L187-W189 PolarHBondContact O-N 3.36Å; W189-D199 HydrophobicContact CZ3-CB 4.16Å; W189-R200 HydrophobicContact CE3-CG 4.05Å; W189-R200 WeakPolarHBondContact O-CD 3.41Å; W189-A203 HydrophobicContact CB-CB 4.35Å; W189-A203 HydrophobicContact CD2-CB 3.39Å; W189-A203 VanDerWaalsContact CE2-CB 3.41Å; W189-A203 HydrophobicContact CE3-CB 3.92Å; W189-A203 HydrophobicContact CG-CB 3.6Å; W189-A203 HydrophobicContact CH2-CB 4.37Å; W189-A203 HydrophobicContact CZ2-CB 3.94Å; W189-A203 HydrophobicContact CZ3-CB 4.37Å; W189-I268 HydrophobicContact CH2-CD1 3.68Å; W189-I268 HydrophobicContact CH2-CG1 3.86Å; W189-I268 HydrophobicContact CZ2-CD1 4.06Å; W189-I268 HydrophobicContact CZ2-CG1 3.81Å; W189-I268 HydrophobicContact CZ2-CG2 4.3Å
190	I	87.5	Confident	90.9	Very high	16 Å²	16	56.3 Å²	56.3	8%	0.082	27%	0.27	C	S	.	.	H	α-helix	trans	-67.2	-51	175	-62.9	168.8	0	0	0	110.2	I116 N120 R124 A186 L187 D192	I116-I190 HydrophobicContact CG2-CD1 3.31Å; I116-I190 WeakPolarHBondContact O-CD1 3.46Å; N120-I190 HydrophobicContact CB-CD1 3.78Å; N120-I190 HydrophobicContact CB-CG1 3.67Å; N120-I190 VanDerWaalsContact CG-CG1 3.45Å; R124-I190 HydrophobicContact CG-CG2 4.43Å; R124-I190 PolarHBondContact NE-O 3.42Å; A186-I190 PolarHBondContact O-N 3.11Å; L187-I190 HydrophobicContact CD2-CD1 4.25Å; L187-I190 PolarHBondContact O-N 3.05Å; I190-D192 VanDerWaalsContact C-N 3.25Å; I190-D192 PolarHBondContact O-N 2.87Å
191	A	88.1	Confident	91.2	Very high	76 Å²	76	51.8 Å²	51.8	63%	0.628	25%	0.251	S	S	*	.	H	α-helix	trans	-73.4	-14.7	-177.6	0	0	0	0	0	113.6	L187 K193	L187-A191 WeakPolarHBondContact O-CB 3.36Å; L187-A191 PolarHBondContact O-N 3.43Å; A191-K193 PolarHBondContact O-N 2.93Å; A191-K193 VanDerWaalsContact O-N 3.16Å
192	D	86.9	Confident	91.5	Very high	45 Å²	45	47.9 Å²	47.9	24%	0.241	23%	0.233	C	C	.	.			trans	-71.9	109	-179.5	-166.5	-7.6	0	0	0	111.8	R124 R188 I190 K194 S195	R124-D192 PolarHBondContact NH2-O 2.96Å; R124-D192 VanDerWaalsContact NH2-O 3.16Å; R188-D192 VanDerWaalsContact O-CB 3.26Å; R188-D192 WeakPolarHBondContact O-CB 3.48Å; R188-D192 PolarHBondContact O-N 2.73Å; I190-D192 VanDerWaalsContact C-N 3.25Å; I190-D192 PolarHBondContact O-N 2.87Å; D192-K194 WeakPolarHBondContact OD1-CA 3.2Å; D192-K194 WeakPolarHBondContact OD1-CB 3.39Å; D192-K194 PolarHBondContact OD1-N 3.37Å; D192-S195 PolarHBondContact OD1-N 2.92Å; D192-S195 VanDerWaalsContact OD1-N 3.08Å; D192-S195 WeakPolarHBondContact OD2-CB 3.42Å; D192-S195 PolarHBondContact OD2-OG 2.98Å
193	K	82.5	Confident	91.8	Very high	182 Å²	182	47.8 Å²	47.8	79%	0.791	23%	0.233	S	C	*	.	S	Bend	trans	-87.2	-10.5	174.9	-61.7	-173.2	178	-173.6	0	113.5	A191	A191-K193 PolarHBondContact O-N 2.93Å; A191-K193 VanDerWaalsContact O-N 3.16Å
194	K	86.8	Confident	92	Very high	197 Å²	197	48 Å²	48	86%	0.857	23%	0.234	S	C	*	.	S	Bend	trans	-96.6	-35.6	-176.1	-62.5	-179	-179.2	176.6	0	112	D192	D192-K194 WeakPolarHBondContact OD1-CA 3.2Å; D192-K194 WeakPolarHBondContact OD1-CB 3.39Å; D192-K194 PolarHBondContact OD1-N 3.37Å
195	S	88.8	Confident	92.1	Very high	16 Å²	16	44.5 Å²	44.5	11%	0.112	22%	0.215	C	C	.	.	S	Bend	trans	-68	131.2	-179.4	-75.1	0	0	0	0	111.4	D192 R200	D192-S195 PolarHBondContact OD1-N 2.92Å; D192-S195 VanDerWaalsContact OD1-N 3.08Å; D192-S195 WeakPolarHBondContact OD2-CB 3.42Å; D192-S195 PolarHBondContact OD2-OG 2.98Å; S195-R200 PolarHBondContact O-NE 3.35Å
196	P	91.3	Very high	92.2	Very high	39 Å²	39	44.4 Å²	44.4	25%	0.253	22%	0.215	S	C	.	.			trans	-66.3	158.9	179.5	31	-36.8	0	0	0	110.6	R198 D199 R200	P196-R198 HydrophobicContact CB-CG 4.08Å; P196-R198 HydrophobicContact CG-CG 3.83Å; P196-R198 PolarHBondContact O-N 3.04Å; P196-R198 VanDerWaalsContact O-N 3.17Å; P196-D199 HydrophobicContact CG-CB 4.11Å; P196-D199 WeakPolarHBondContact CG-OD1 3.23Å; P196-D199 PolarHBondContact O-N 3.41Å; P196-D199 VanDerWaalsContact O-N 3.08Å; P196-R200 PolarHBondContact O-N 3.42Å
197	F	93	Very high	92.3	Very high	5 Å²	5	44.5 Å²	44.5	2%	0.022	22%	0.215	C	C	.	.	H	α-helix	trans	-47.7	-44.9	177.9	179.4	-91.8	0	0	0	113.4	L49 F125 E128 I129 D199 R200 L201 L256	L49-F197 HydrophobicContact CD1-CB 3.68Å; L49-F197 HydrophobicContact CD1-CD1 4.25Å; L49-F197 HydrophobicContact CD1-CD2 4.35Å; L49-F197 HydrophobicContact CD1-CG 3.86Å; L49-F197 HydrophobicContact CD2-CD1 4.25Å; L49-F197 HydrophobicContact CD2-CD2 3.81Å; L49-F197 HydrophobicContact CD2-CE1 4.34Å; L49-F197 HydrophobicContact CD2-CE2 3.91Å; L49-F197 HydrophobicContact CD2-CG 4Å; L49-F197 HydrophobicContact CD2-CZ 4.19Å; F125-F197 HydrophobicContact CD1-CD2 4.29Å; F125-F197 AromaticContact CD1-CE2 3.48Å; F125-F197 HydrophobicContact CD1-CE2 3.48Å; F125-F197 VanDerWaalsContact CD1-CE2 3.48Å; F125-F197 AromaticContact CD1-CZ 3.92Å; F125-F197 HydrophobicContact CD1-CZ 3.92Å; F125-F197 HydrophobicContact CE1-CD2 4.33Å; F125-F197 AromaticContact CE1-CE2 3.82Å; F125-F197 HydrophobicContact CE1-CE2 3.82Å; F125-F197 HydrophobicContact CE1-CZ 4.14Å; E128-F197 HydrophobicContact CB-CD2 4.32Å; E128-F197 HydrophobicContact CB-CE2 4.46Å; E128-F197 WeakPolarHBondContact OE2-CD2 3.44Å; I129-F197 HydrophobicContact CD1-CZ 4.27Å; F197-D199 PolarHBondContact O-N 3.19Å; F197-R200 PolarHBondContact O-N 2.79Å; F197-L201 HydrophobicContact CE1-CB 4.36Å; F197-L201 HydrophobicContact CE1-CD2 3.91Å; F197-L201 WeakPolarHBondContact O-CB 3.13Å; F197-L201 PolarHBondContact O-N 3.33Å; F197-L256 HydrophobicContact CD1-CD1 4.48Å; F197-L256 HydrophobicContact CD1-CD2 3.94Å; F197-L256 HydrophobicContact CE1-CD2 4.1Å
198	R	94.1	Very high	92.2	Very high	86 Å²	86	41.3 Å²	41.3	33%	0.325	20%	0.198	S	C	.	.	H	α-helix	trans	-58.6	-38.8	180	67.1	-175.4	176	-115	-2.3	114.5	P196 V202 L256 H258 T260	P196-R198 HydrophobicContact CB-CG 4.08Å; P196-R198 HydrophobicContact CG-CG 3.83Å; P196-R198 PolarHBondContact O-N 3.04Å; P196-R198 VanDerWaalsContact O-N 3.17Å; R198-V202 WeakPolarHBondContact O-CG2 3.45Å; R198-V202 PolarHBondContact O-N 3.37Å; R198-L256 HydrophobicContact CB-CD1 3.63Å; R198-H258 WeakPolarHBondContact CD-O 3.44Å; R198-T260 VanDerWaalsContact C-OG1 3.23Å; R198-T260 WeakPolarHBondContact CB-OG1 3.44Å; R198-T260 VanDerWaalsContact CG-OG1 3.27Å; R198-T260 WeakPolarHBondContact CG-OG1 3.43Å; R198-T260 PolarHBondContact O-OG1 3.27Å; R198-T260 VanDerWaalsContact O-OG1 3.13Å
199	D	95.3	Very high	92	Very high	16 Å²	16	35.2 Å²	35.2	9%	0.086	18%	0.177	C	C	.	.	H	α-helix	trans	-73.5	-42.7	180	-78	38.3	0	0	0	109.1	W189 P196 F197 L201 V202 A203 T260 R264	W189-D199 HydrophobicContact CZ3-CB 4.16Å; P196-D199 HydrophobicContact CG-CB 4.11Å; P196-D199 WeakPolarHBondContact CG-OD1 3.23Å; P196-D199 PolarHBondContact O-N 3.41Å; P196-D199 VanDerWaalsContact O-N 3.08Å; F197-D199 PolarHBondContact O-N 3.19Å; D199-L201 VanDerWaalsContact C-N 3.34Å; D199-L201 PolarHBondContact O-N 2.86Å; D199-V202 PolarHBondContact O-N 3.41Å; D199-A203 PolarHBondContact O-N 3.14Å; D199-T260 WeakPolarHBondContact OD1-CG2 3.19Å; D199-T260 PolarHBondContact OD1-OG1 2.71Å; D199-R264 IonicContact OD2-CZ 2.61Å; D199-R264 IonicContact OD2-NE 3.2Å; D199-R264 PolarHBondContact OD2-NE 3.1Å; D199-R264 IonicContact OD2-NH2 3.3Å
200	R	95.1	Very high	92.1	Very high	8 Å²	8	34.2 Å²	34.2	3%	0.03	17%	0.173	C	C	.	.	H	α-helix	trans	-65.3	-35.8	176.5	-72.5	-176	-67.8	106.3	-4.9	112.5	F125 E128 W189 S195 P196 F197 A203 F204	F125-R200 HydrophobicContact CZ-CB 4.38Å; E128-R200 IonicContact OE1-CZ 2.69Å; E128-R200 IonicContact OE1-NH1 3.19Å; E128-R200 IonicContact OE1-NH2 2.73Å; E128-R200 PolarHBondContact OE1-NH2 2.99Å; E128-R200 IonicContact OE2-CZ 3.55Å; E128-R200 VanDerWaalsContact OE2-CZ 3.24Å; E128-R200 IonicContact OE2-NH1 2.99Å; E128-R200 PolarHBondContact OE2-NH1 3.4Å; E128-R200 IonicContact OE2-NH2 2.62Å; E128-R200 PolarHBondContact OE2-NH2 2.92Å; W189-R200 HydrophobicContact CE3-CG 4.05Å; W189-R200 WeakPolarHBondContact O-CD 3.41Å; S195-R200 PolarHBondContact O-NE 3.35Å; P196-R200 PolarHBondContact O-N 3.42Å; F197-R200 PolarHBondContact O-N 2.79Å; R200-A203 PolarHBondContact O-N 3.41Å; R200-F204 VanDerWaalsContact O-CB 3.3Å; R200-F204 WeakPolarHBondContact O-CB 3.16Å; R200-F204 PolarHBondContact O-N 3.15Å
201	L	96.1	Very high	92.4	Very high	1 Å²	1	33.6 Å²	33.6	1%	0.005	17%	0.17	C	C	.	.	H	α-helix	trans	-65	-40.8	176.5	-176.1	65.8	0	0	0	111.5	F125 F197 D199 F204 A205 A249 L252 F253 L256	F125-L201 HydrophobicContact CE1-CB 4.26Å; F125-L201 HydrophobicContact CE1-CD1 3.93Å; F197-L201 HydrophobicContact CE1-CB 4.36Å; F197-L201 HydrophobicContact CE1-CD2 3.91Å; F197-L201 WeakPolarHBondContact O-CB 3.13Å; F197-L201 PolarHBondContact O-N 3.33Å; D199-L201 VanDerWaalsContact C-N 3.34Å; D199-L201 PolarHBondContact O-N 2.86Å; L201-F204 WeakPolarHBondContact O-CB 3.38Å; L201-F204 PolarHBondContact O-N 3.32Å; L201-A205 PolarHBondContact O-N 3.19Å; L201-A249 HydrophobicContact CD1-CB 3.96Å; L201-L252 HydrophobicContact CD2-CB 3.88Å; L201-F253 HydrophobicContact CD2-CB 3.88Å; L201-L256 HydrophobicContact CD2-CD1 4.07Å
202	V	97.1	Very high	92.5	Very high	0 Å²	0	30 Å²	30	0%	0	14%	0.141	C	C	.	.	H	α-helix	trans	-64.6	-43.9	174.1	171.5	0	0	0	0	110.8	R198 D199 F204 A205 A206 F253 I265 I268 L311	R198-V202 WeakPolarHBondContact O-CG2 3.45Å; R198-V202 PolarHBondContact O-N 3.37Å; D199-V202 PolarHBondContact O-N 3.41Å; V202-F204 VanDerWaalsContact C-N 3.31Å; V202-F204 PolarHBondContact O-N 3.03Å; V202-A205 PolarHBondContact O-N 3.3Å; V202-A206 PolarHBondContact O-N 2.82Å; V202-F253 HydrophobicContact CG2-CD2 3.81Å; V202-F253 HydrophobicContact CG2-CE2 3.63Å; V202-F253 HydrophobicContact CG2-CZ 4.43Å; V202-I265 HydrophobicContact CG1-CB 4.42Å; V202-I265 HydrophobicContact CG1-CG1 4.28Å; V202-I265 HydrophobicContact CG1-CG2 4.04Å; V202-I265 HydrophobicContact CG2-CG1 4.11Å; V202-I268 HydrophobicContact CB-CD1 4.33Å; V202-I268 HydrophobicContact CG1-CB 4.3Å; V202-I268 HydrophobicContact CG1-CD1 4.05Å; V202-I268 HydrophobicContact CG1-CG2 4.15Å; V202-L311 HydrophobicContact CG1-CD1 4.04Å; V202-L311 HydrophobicContact CG2-CD1 4.44Å; V202-L311 HydrophobicContact CG2-CD2 4.42Å
203	A	96.6	Very high	92.7	Very high	1 Å²	1	28.3 Å²	28.3	1%	0.008	13%	0.132	C	C	.	.	H	α-helix	trans	-62.2	-40.4	175.4	0	0	0	0	0	112.1	W185 W189 D199 R200 A206 V207 I268	W185-A203 HydrophobicContact CH2-CB 3.78Å; W185-A203 HydrophobicContact CZ3-CB 4.3Å; W189-A203 HydrophobicContact CB-CB 4.35Å; W189-A203 HydrophobicContact CD2-CB 3.39Å; W189-A203 VanDerWaalsContact CE2-CB 3.41Å; W189-A203 HydrophobicContact CE3-CB 3.92Å; W189-A203 HydrophobicContact CG-CB 3.6Å; W189-A203 HydrophobicContact CH2-CB 4.37Å; W189-A203 HydrophobicContact CZ2-CB 3.94Å; W189-A203 HydrophobicContact CZ3-CB 4.37Å; D199-A203 PolarHBondContact O-N 3.14Å; R200-A203 PolarHBondContact O-N 3.41Å; A203-A206 WeakPolarHBondContact O-CB 3.47Å; A203-A206 PolarHBondContact O-N 3.39Å; A203-V207 WeakPolarHBondContact O-CG2 3.39Å; A203-V207 PolarHBondContact O-N 3.23Å; A203-I268 HydrophobicContact CB-CG2 4.07Å
204	F	95.7	Very high	93.1	Very high	5 Å²	5	19.7 Å²	19.7	2%	0.022	9%	0.094	C	C	.	.	H	α-helix	trans	-61.6	-47.6	175.1	-174.9	-101.5	0	0	0	111.6	V117 L121 F125 R200 L201 V202 A206 V207 E208 A249	V117-F204 HydrophobicContact CG1-CE2 3.89Å; V117-F204 HydrophobicContact CG1-CZ 4.01Å; L121-F204 HydrophobicContact CD1-CZ 4.44Å; L121-F204 HydrophobicContact CD2-CE1 4.3Å; L121-F204 HydrophobicContact CD2-CE2 4.17Å; L121-F204 HydrophobicContact CD2-CZ 3.62Å; L121-F204 HydrophobicContact CG-CE2 4.26Å; L121-F204 HydrophobicContact CG-CZ 4.02Å; F125-F204 HydrophobicContact CD2-CD2 4.32Å; F125-F204 HydrophobicContact CE2-CB 3.9Å; F125-F204 HydrophobicContact CE2-CD1 4.42Å; F125-F204 AromaticContact CE2-CD2 3.61Å; F125-F204 HydrophobicContact CE2-CD2 3.61Å; F125-F204 HydrophobicContact CE2-CE2 4.23Å; F125-F204 AromaticContact CE2-CG 3.72Å; F125-F204 HydrophobicContact CE2-CG 3.72Å; F125-F204 HydrophobicContact CZ-CB 3.69Å; F125-F204 HydrophobicContact CZ-CD2 4.28Å; F125-F204 AromaticContact CZ-CG 3.93Å; F125-F204 HydrophobicContact CZ-CG 3.93Å; R200-F204 VanDerWaalsContact O-CB 3.3Å; R200-F204 WeakPolarHBondContact O-CB 3.16Å; R200-F204 PolarHBondContact O-N 3.15Å; L201-F204 WeakPolarHBondContact O-CB 3.38Å; L201-F204 PolarHBondContact O-N 3.32Å; V202-F204 VanDerWaalsContact C-N 3.31Å; V202-F204 PolarHBondContact O-N 3.03Å; F204-A206 PolarHBondContact O-N 2.77Å; F204-V207 WeakPolarHBondContact O-CB 3.41Å; F204-V207 PolarHBondContact O-N 2.86Å; F204-E208 HydrophobicContact CD1-CG 4.26Å; F204-E208 HydrophobicContact CE1-CG 3.9Å; F204-E208 HydrophobicContact CZ-CG 4.11Å; F204-E208 WeakPolarHBondContact CZ-OE1 3.19Å; F204-E208 PolarHBondContact O-N 3.06Å; F204-E208 VanDerWaalsContact O-N 3.1Å; F204-A249 HydrophobicContact CD1-CB 4.26Å
205	A	95.2	Very high	93.4	Very high	1 Å²	1	10.3 Å²	10.3	1%	0.008	5%	0.054	C	C	.	.	H	α-helix	trans	-59.1	-32.3	174.4	0	0	0	0	0	112.6	L201 V202 G209 A249 L307	L201-A205 PolarHBondContact O-N 3.19Å; V202-A205 PolarHBondContact O-N 3.3Å; A205-G209 WeakPolarHBondContact O-CA 3.49Å; A205-G209 PolarHBondContact O-N 3.48Å; A205-A249 HydrophobicContact CB-CB 3.84Å; A205-L307 HydrophobicContact CB-CD1 4.1Å; A205-L307 HydrophobicContact CB-CD2 4.47Å
206	A	95.8	Very high	93.7	Very high	0 Å²	0	10 Å²	10	0%	0	5%	0.051	C	C	.	.	H	α-helix	trans	-71.3	-33.2	174.2	0	0	0	0	0	112.9	W185 V202 A203 F204 I210 F211 I269 A272 L307	W185-A206 HydrophobicContact CH2-CB 4.19Å; V202-A206 PolarHBondContact O-N 2.82Å; A203-A206 WeakPolarHBondContact O-CB 3.47Å; A203-A206 PolarHBondContact O-N 3.39Å; F204-A206 PolarHBondContact O-N 2.77Å; A206-I210 HydrophobicContact CB-CD1 4.34Å; A206-I210 WeakPolarHBondContact O-CA 3.39Å; A206-I210 VanDerWaalsContact O-CB 3.25Å; A206-I210 WeakPolarHBondContact O-CB 3.25Å; A206-I210 PolarHBondContact O-N 3.43Å; A206-F211 PolarHBondContact O-N 3.21Å; A206-I269 HydrophobicContact CB-CD1 3.92Å; A206-A272 HydrophobicContact CB-CB 4.06Å; A206-L307 HydrophobicContact CB-CD2 4.47Å
207	V	94.6	Very high	93.8	Very high	13 Å²	13	8.2 Å²	8.2	8%	0.079	4%	0.039	C	C	.	.	I	π-helix	trans	-62.3	-60.4	171.6	-180	0	0	0	0	109.3	V117 W185 A186 A203 F204 G209 F211 F212	V117-V207 HydrophobicContact CG2-CG1 3.88Å; W185-V207 HydrophobicContact CE3-CG2 4.22Å; W185-V207 HydrophobicContact CZ3-CG2 3.62Å; A186-V207 HydrophobicContact CB-CG2 4.31Å; A203-V207 WeakPolarHBondContact O-CG2 3.39Å; A203-V207 PolarHBondContact O-N 3.23Å; F204-V207 WeakPolarHBondContact O-CB 3.41Å; F204-V207 PolarHBondContact O-N 2.86Å; V207-G209 VanDerWaalsContact C-N 3.34Å; V207-G209 PolarHBondContact O-N 2.99Å; V207-F211 HydrophobicContact CB-CD2 4.46Å; V207-F211 HydrophobicContact CG1-CD2 4.34Å; V207-F211 HydrophobicContact CG2-CD2 4.19Å; V207-F211 HydrophobicContact CG2-CE2 4.45Å; V207-F211 WeakPolarHBondContact O-CB 3.49Å; V207-F211 PolarHBondContact O-N 2.82Å; V207-F212 HydrophobicContact CG1-CE2 3.86Å; V207-F212 WeakPolarHBondContact O-CD2 3.35Å
208	E	91	Very high	93.9	Very high	4 Å²	4	8 Å²	8	2%	0.019	4%	0.037	C	C	.	.	I	π-helix	trans	-60.7	-43.1	-176.7	-51.4	-64.9	-151.2	0	0	111.9	V117 Q141 F204 F212 H245 C246	V117-E208 WeakPolarHBondContact CG1-OE1 3.44Å; Q141-E208 PolarHBondContact NE2-OE1 3.44Å; F204-E208 HydrophobicContact CD1-CG 4.26Å; F204-E208 HydrophobicContact CE1-CG 3.9Å; F204-E208 HydrophobicContact CZ-CG 4.11Å; F204-E208 WeakPolarHBondContact CZ-OE1 3.19Å; F204-E208 PolarHBondContact O-N 3.06Å; F204-E208 VanDerWaalsContact O-N 3.1Å; E208-F212 WeakPolarHBondContact OE2-CE2 3.42Å; E208-H245 HydrophobicContact CG-CB 4.23Å; E208-C246 HydrophobicContact CB-CB 4.05Å
209	G	89.6	Confident	93.9	Very high	7 Å²	7	4 Å²	4	7%	0.072	2%	0.023	C	C	.	.	I	π-helix	trans	-86.2	-35.3	-171.4	0	0	0	0	0	115.3	A205 V207 S213 V303	A205-G209 WeakPolarHBondContact O-CA 3.49Å; A205-G209 PolarHBondContact O-N 3.48Å; V207-G209 VanDerWaalsContact C-N 3.34Å; V207-G209 PolarHBondContact O-N 2.99Å; G209-S213 WeakPolarHBondContact O-CB 3.36Å; G209-V303 WeakPolarHBondContact O-CG1 3.49Å
210	I	93.8	Very high	93.8	Very high	0 Å²	0	3.6 Å²	3.6	0%	0	2%	0.02	C	C	.	.	I	π-helix	trans	-108.3	-51.9	-172.6	-59.1	174.4	0	0	0	110.8	A206 F212 S213 I269 A272 V273 E276 I300 A304 L307	A206-I210 HydrophobicContact CB-CD1 4.34Å; A206-I210 WeakPolarHBondContact O-CA 3.39Å; A206-I210 VanDerWaalsContact O-CB 3.25Å; A206-I210 WeakPolarHBondContact O-CB 3.25Å; A206-I210 PolarHBondContact O-N 3.43Å; I210-F212 VanDerWaalsContact C-N 3.26Å; I210-F212 PolarHBondContact O-N 3.01Å; I210-S213 PolarHBondContact O-N 3.05Å; I210-S213 VanDerWaalsContact O-N 3.12Å; I210-S213 PolarHBondContact O-OG 3.49Å; I210-I269 HydrophobicContact CD1-CD1 3.99Å; I210-I269 HydrophobicContact CD1-CG2 3.94Å; I210-A272 HydrophobicContact CD1-CB 4.33Å; I210-V273 HydrophobicContact CD1-CG2 4.32Å; I210-V273 HydrophobicContact CG2-CG2 4.5Å; I210-E276 HydrophobicContact CG2-CB 4.21Å; I210-E276 HydrophobicContact CG2-CG 4.42Å; I210-I300 HydrophobicContact CG2-CG2 4.08Å; I210-A304 HydrophobicContact CD1-CB 4.04Å; I210-L307 HydrophobicContact CD1-CD2 3.96Å; I210-L307 HydrophobicContact CG1-CD2 4.06Å
211	F	92.7	Very high	93.7	Very high	4 Å²	4	6.2 Å²	6.2	2%	0.018	3%	0.03	C	C	.	.	I	π-helix	trans	-64.3	-28.2	-172.2	-76.6	-5.4	0	0	0	114.5	F109 K182 W185 A206 V207 A272 I275 E276	F109-F211 HydrophobicContact CZ-CB 4.46Å; K182-F211 HydrophobicContact CB-CE2 4.49Å; K182-F211 PolarHBondContact NZ-O 2.85Å; W185-F211 HydrophobicContact CB-CE2 4.35Å; W185-F211 HydrophobicContact CB-CZ 4.29Å; W185-F211 AromaticContact CD2-CE2 3.93Å; W185-F211 HydrophobicContact CD2-CE2 3.93Å; W185-F211 AromaticContact CD2-CZ 3.72Å; W185-F211 HydrophobicContact CD2-CZ 3.72Å; W185-F211 HydrophobicContact CE3-CD2 4.5Å; W185-F211 AromaticContact CE3-CE2 3.42Å; W185-F211 HydrophobicContact CE3-CE2 3.42Å; W185-F211 VanDerWaalsContact CE3-CE2 3.42Å; W185-F211 AromaticContact CE3-CZ 3.65Å; W185-F211 HydrophobicContact CE3-CZ 3.65Å; W185-F211 HydrophobicContact CG-CE2 4.34Å; W185-F211 HydrophobicContact CG-CZ 4.01Å; W185-F211 AromaticContact CZ3-CE2 3.99Å; W185-F211 HydrophobicContact CZ3-CE2 3.99Å; W185-F211 HydrophobicContact CZ3-CZ 4.2Å; A206-F211 PolarHBondContact O-N 3.21Å; V207-F211 HydrophobicContact CB-CD2 4.46Å; V207-F211 HydrophobicContact CG1-CD2 4.34Å; V207-F211 HydrophobicContact CG2-CD2 4.19Å; V207-F211 HydrophobicContact CG2-CE2 4.45Å; V207-F211 WeakPolarHBondContact O-CB 3.49Å; V207-F211 PolarHBondContact O-N 2.82Å; F211-A272 HydrophobicContact CD1-CB 4.37Å; F211-A272 HydrophobicContact CE1-CB 3.74Å; F211-A272 WeakPolarHBondContact CE1-O 3.4Å; F211-A272 HydrophobicContact CZ-CB 4.34Å; F211-I275 HydrophobicContact CE1-CB 4.18Å; F211-I275 HydrophobicContact CE1-CG2 4.1Å; F211-I275 HydrophobicContact CZ-CB 4.44Å; F211-I275 HydrophobicContact CZ-CD1 4.35Å; F211-I275 HydrophobicContact CZ-CG2 4.17Å; F211-E276 WeakPolarHBondContact CA-OE2 3.38Å
212	F	90	Very high	93.6	Very high	1 Å²	1	6.2 Å²	6.2	0%	0.004	3%	0.03	C	C	.	.	T	Hydrogen-bonded Turn	trans	-88.2	-26.9	175.2	-64.5	-80.2	0	0	0	113.3	F109 F110 D114 V117 V207 E208 I210 G214 S215 F216	F109-F212 HydrophobicContact CE1-CD1 4.29Å; F110-F212 AromaticContact CD1-CD1 3.47Å; F110-F212 HydrophobicContact CD1-CD1 3.47Å; F110-F212 VanDerWaalsContact CD1-CD1 3.47Å; F110-F212 AromaticContact CD1-CE1 3.82Å; F110-F212 HydrophobicContact CD1-CE1 3.82Å; F110-F212 HydrophobicContact CE1-CB 4.37Å; F110-F212 AromaticContact CE1-CD1 3.53Å; F110-F212 HydrophobicContact CE1-CD1 3.53Å; F110-F212 HydrophobicContact CE1-CE1 4.34Å; F110-F212 HydrophobicContact CE1-CG 4.43Å; D114-F212 VanDerWaalsContact OD1-CE1 3.22Å; D114-F212 WeakPolarHBondContact OD1-CE1 3.5Å; D114-F212 VanDerWaalsContact OD1-CZ 3.23Å; D114-F212 WeakPolarHBondContact OD1-CZ 3.43Å; V117-F212 HydrophobicContact CG2-CE2 4.37Å; V117-F212 HydrophobicContact CG2-CZ 4.42Å; V207-F212 HydrophobicContact CG1-CE2 3.86Å; V207-F212 WeakPolarHBondContact O-CD2 3.35Å; E208-F212 WeakPolarHBondContact OE2-CE2 3.42Å; I210-F212 VanDerWaalsContact C-N 3.26Å; I210-F212 PolarHBondContact O-N 3.01Å; F212-G214 PolarHBondContact O-N 3.38Å; F212-S215 PolarHBondContact O-N 3.34Å; F212-S215 VanDerWaalsContact O-N 3.15Å; F212-F216 HydrophobicContact CB-CD2 3.9Å; F212-F216 HydrophobicContact CB-CE2 3.38Å; F212-F216 HydrophobicContact CB-CZ 3.75Å; F212-F216 HydrophobicContact CD1-CZ 4.32Å; F212-F216 HydrophobicContact CG-CE2 4.3Å; F212-F216 HydrophobicContact CG-CZ 4.28Å; F212-F216 WeakPolarHBondContact O-CD2 3.32Å; F212-F216 WeakPolarHBondContact O-CG 3.14Å; F212-F216 PolarHBondContact O-N 3.01Å
213	S	91.2	Very high	93.4	Very high	9 Å²	9	8.4 Å²	8.4	6%	0.063	4%	0.04	C	C	.	.	H	α-helix	trans	-56.5	-48	-167.2	65.8	0	0	0	0	114.9	G209 I210 S215 F216 A217 I300	G209-S213 WeakPolarHBondContact O-CB 3.36Å; I210-S213 PolarHBondContact O-N 3.05Å; I210-S213 VanDerWaalsContact O-N 3.12Å; I210-S213 PolarHBondContact O-OG 3.49Å; S213-S215 VanDerWaalsContact C-N 3.34Å; S213-S215 PolarHBondContact O-N 3.47Å; S213-F216 PolarHBondContact O-N 2.94Å; S213-A217 WeakPolarHBondContact O-CB 3.23Å; S213-A217 PolarHBondContact O-N 2.71Å; S213-I300 WeakPolarHBondContact OG-CD1 3.15Å
214	G	92.1	Very high	93.1	Very high	0 Å²	0	13.6 Å²	13.6	0%	0	6%	0.062	C	C	.	.	H	α-helix	trans	-73.6	-28.7	-177.6	0	0	0	0	0	113.3	F212 S218 L280	F212-G214 PolarHBondContact O-N 3.38Å; G214-S218 WeakPolarHBondContact O-CB 3.39Å; G214-S218 PolarHBondContact O-N 3.15Å; G214-S218 PolarHBondContact O-OG 2.86Å; G214-L280 VanDerWaalsContact CA-CD1 3.47Å
215	S	93.4	Very high	92.9	Very high	0 Å²	0	18.2 Å²	18.2	0%	0	8%	0.079	C	C	.	.	H	α-helix	trans	-69.9	-42	172.2	-62.8	0	0	0	0	111.1	F212 S213 S218 I219	F212-S215 PolarHBondContact O-N 3.34Å; F212-S215 VanDerWaalsContact O-N 3.15Å; S213-S215 VanDerWaalsContact C-N 3.34Å; S213-S215 PolarHBondContact O-N 3.47Å; S215-S218 WeakPolarHBondContact O-CB 3.25Å; S215-S218 PolarHBondContact O-N 3.22Å; S215-I219 PolarHBondContact O-N 2.82Å; S215-I219 VanDerWaalsContact O-N 3.12Å
216	F	93.9	Very high	92.8	Very high	11 Å²	11	20.9 Å²	20.9	5%	0.048	11%	0.107	C	C	.	.	H	α-helix	trans	-60.5	-46.7	171.4	-67.3	-34.3	0	0	0	112.2	F110 F212 S213 S218 I219 F220 N235 I238 E242	F110-F216 HydrophobicContact CE1-CD1 4.29Å; F110-F216 HydrophobicContact CE1-CE1 4.08Å; F110-F216 HydrophobicContact CE2-CD1 4.16Å; F110-F216 HydrophobicContact CE2-CE1 4.15Å; F110-F216 AromaticContact CZ-CD1 3.54Å; F110-F216 HydrophobicContact CZ-CD1 3.54Å; F110-F216 AromaticContact CZ-CE1 3.64Å; F110-F216 HydrophobicContact CZ-CE1 3.64Å; F110-F216 HydrophobicContact CZ-CG 4.42Å; F212-F216 HydrophobicContact CB-CD2 3.9Å; F212-F216 HydrophobicContact CB-CE2 3.38Å; F212-F216 HydrophobicContact CB-CZ 3.75Å; F212-F216 HydrophobicContact CD1-CZ 4.32Å; F212-F216 HydrophobicContact CG-CE2 4.3Å; F212-F216 HydrophobicContact CG-CZ 4.28Å; F212-F216 WeakPolarHBondContact O-CD2 3.32Å; F212-F216 WeakPolarHBondContact O-CG 3.14Å; F212-F216 PolarHBondContact O-N 3.01Å; S213-F216 PolarHBondContact O-N 2.94Å; F216-S218 PolarHBondContact O-N 3.43Å; F216-I219 PolarHBondContact O-N 2.95Å; F216-I219 VanDerWaalsContact O-N 3.11Å; F216-F220 HydrophobicContact CB-CD2 4.46Å; F216-F220 HydrophobicContact CB-CE2 4.34Å; F216-F220 WeakPolarHBondContact O-CD2 3.38Å; F216-F220 PolarHBondContact O-N 3.39Å; F216-N235 VanDerWaalsContact CD1-OD1 3.24Å; F216-N235 WeakPolarHBondContact CD1-OD1 3.36Å; F216-N235 PolarHBondContact O-ND2 3.46Å; F216-I238 HydrophobicContact CE1-CG2 3.98Å; F216-I238 HydrophobicContact CZ-CG2 3.86Å; F216-E242 HydrophobicContact CE2-CB 3.91Å; F216-E242 HydrophobicContact CE2-CG 3.65Å; F216-E242 HydrophobicContact CZ-CB 4.3Å; F216-E242 HydrophobicContact CZ-CG 3.54Å
217	A	93.9	Very high	92.7	Very high	0 Å²	0	22.1 Å²	22.1	0%	0	11%	0.113	C	C	.	.	H	α-helix	trans	-58.6	-35.8	176.5	0	0	0	0	0	112.2	S213 F220 W221 M296 Y299 M326	S213-A217 WeakPolarHBondContact O-CB 3.23Å; S213-A217 PolarHBondContact O-N 2.71Å; A217-F220 PolarHBondContact O-N 3.43Å; A217-W221 PolarHBondContact O-N 3.13Å; A217-M296 HydrophobicContact CB-CE 4.16Å; A217-Y299 HydrophobicContact CB-CD1 4.02Å; A217-Y299 HydrophobicContact CB-CE1 3.59Å; A217-M326 HydrophobicContact CB-CE 4.24Å; A217-M326 HydrophobicContact CB-SD 4.02Å
218	S	94.5	Very high	92.8	Very high	0 Å²	0	21.5 Å²	21.5	0%	0	11%	0.11	C	C	.	.	H	α-helix	trans	-68	-35.2	176.7	-58.8	0	0	0	0	113.1	G214 S215 F216 W221 I289 M296	G214-S218 WeakPolarHBondContact O-CB 3.39Å; G214-S218 PolarHBondContact O-N 3.15Å; G214-S218 PolarHBondContact O-OG 2.86Å; S215-S218 WeakPolarHBondContact O-CB 3.25Å; S215-S218 PolarHBondContact O-N 3.22Å; F216-S218 PolarHBondContact O-N 3.43Å; S218-W221 WeakPolarHBondContact O-CB 3.31Å; S218-I289 WeakPolarHBondContact O-CD1 3.39Å; S218-M296 WeakPolarHBondContact OG-CE 3.39Å
219	I	94.6	Very high	93	Very high	4 Å²	4	23.4 Å²	23.4	2%	0.021	12%	0.122	C	C	.	.	H	α-helix	trans	-75	-37.1	173.8	-67.8	166.6	0	0	0	111.1	V106 F110 S215 F216 W221 L222 K223 L231 T232 N235	V106-I219 HydrophobicContact CG1-CD1 4.02Å; F110-I219 HydrophobicContact CE2-CD1 3.64Å; F110-I219 HydrophobicContact CZ-CD1 4.45Å; S215-I219 PolarHBondContact O-N 2.82Å; S215-I219 VanDerWaalsContact O-N 3.12Å; F216-I219 PolarHBondContact O-N 2.95Å; F216-I219 VanDerWaalsContact O-N 3.11Å; I219-W221 PolarHBondContact O-N 2.92Å; I219-L222 WeakPolarHBondContact O-CA 3.42Å; I219-L222 VanDerWaalsContact O-CB 3.26Å; I219-L222 WeakPolarHBondContact O-CB 3.36Å; I219-L222 PolarHBondContact O-N 2.84Å; I219-K223 PolarHBondContact O-N 3.28Å; I219-L231 HydrophobicContact CD1-CD1 4.25Å; I219-L231 HydrophobicContact CG2-CD1 4.49Å; I219-L231 HydrophobicContact CG2-CD2 4.34Å; I219-L231 HydrophobicContact CG2-CG 3.94Å; I219-T232 HydrophobicContact CG2-CG2 4.24Å; I219-N235 HydrophobicContact CB-CB 4.34Å; I219-N235 VanDerWaalsContact CD1-OD1 3.26Å; I219-N235 WeakPolarHBondContact CD1-OD1 3.48Å; I219-N235 HydrophobicContact CG2-CB 3.57Å; I219-N235 VanDerWaalsContact CG2-CG 3.45Å
220	F	93.8	Very high	93.2	Very high	6 Å²	6	23.1 Å²	23.1	3%	0.026	12%	0.119	C	C	.	.	H	α-helix	trans	-62.1	-29.7	172.9	-75.9	-50.9	0	0	0	113.6	F216 A217 L222 K223 K224 N235 E236 S239 F325 M326 I329	F216-F220 HydrophobicContact CB-CD2 4.46Å; F216-F220 HydrophobicContact CB-CE2 4.34Å; F216-F220 WeakPolarHBondContact O-CD2 3.38Å; F216-F220 PolarHBondContact O-N 3.39Å; A217-F220 PolarHBondContact O-N 3.43Å; F220-L222 VanDerWaalsContact C-N 3.28Å; F220-L222 PolarHBondContact O-N 3.03Å; F220-K223 HydrophobicContact CD1-CD 4.24Å; F220-K223 VanDerWaalsContact O-CB 3.3Å; F220-K223 WeakPolarHBondContact O-CB 3.31Å; F220-K223 PolarHBondContact O-N 3.24Å; F220-K224 PolarHBondContact O-N 3.35Å; F220-N235 WeakPolarHBondContact CE2-ND2 3.4Å; F220-N235 WeakPolarHBondContact CZ-ND2 3.42Å; F220-E236 HydrophobicContact CE1-CG 3.59Å; F220-E236 HydrophobicContact CZ-CG 4.2Å; F220-S239 WeakPolarHBondContact CZ-OG 3.41Å; F220-F325 HydrophobicContact CB-CD2 4.01Å; F220-F325 HydrophobicContact CB-CE2 3.87Å; F220-M326 HydrophobicContact CB-SD 4Å; F220-M326 HydrophobicContact CD2-CE 3.73Å; F220-M326 HydrophobicContact CD2-SD 3.6Å; F220-M326 VanDerWaalsContact CD2-SD 3.6Å; F220-M326 HydrophobicContact CE2-CE 4.07Å; F220-M326 HydrophobicContact CE2-SD 4.43Å; F220-M326 HydrophobicContact CG-SD 4.13Å; F220-I329 HydrophobicContact CB-CD1 3.66Å; F220-I329 HydrophobicContact CD1-CD1 3.16Å; F220-I329 HydrophobicContact CD1-CG1 3.96Å; F220-I329 HydrophobicContact CD2-CD1 3.66Å; F220-I329 HydrophobicContact CE1-CD1 3.56Å; F220-I329 HydrophobicContact CE1-CG1 4.05Å; F220-I329 HydrophobicContact CE1-CG2 3.77Å; F220-I329 HydrophobicContact CE2-CD1 4.01Å; F220-I329 HydrophobicContact CG-CD1 3.21Å; F220-I329 HydrophobicContact CG-CG1 4.43Å; F220-I329 HydrophobicContact CZ-CD1 3.96Å; F220-I329 HydrophobicContact CZ-CG2 3.83Å
221	W	93.5	Very high	93.4	Very high	64 Å²	64	23.1 Å²	23.1	24%	0.242	12%	0.119	C	C	.	.	H	α-helix	trans	-60.7	-37.7	168.3	177.6	-108.1	0	0	0	112.8	A217 S218 I219 K223 K224 R225 I289 M291 F325	A217-W221 PolarHBondContact O-N 3.13Å; S218-W221 WeakPolarHBondContact O-CB 3.31Å; I219-W221 PolarHBondContact O-N 2.92Å; W221-K223 VanDerWaalsContact C-N 3.35Å; W221-K224 HydrophobicContact CE3-CD 4.33Å; W221-K224 HydrophobicContact CZ3-CD 4.17Å; W221-K224 PolarHBondContact O-N 3.26Å; W221-R225 WeakPolarHBondContact O-CG 3.47Å; W221-R225 PolarHBondContact O-N 3.28Å; W221-I289 PolarHBondContact NE1-O 3.43Å; W221-M291 HydrophobicContact CB-CE 4.1Å; W221-M291 HydrophobicContact CB-CG 4.01Å; W221-M291 HydrophobicContact CB-SD 3.48Å; W221-M291 WeakPolarHBondContact CB-SD 3.47Å; W221-M291 VanDerWaalsContact CD1-CG 3.48Å; W221-M291 HydrophobicContact CD2-CG 3.69Å; W221-M291 HydrophobicContact CD2-SD 4.31Å; W221-M291 HydrophobicContact CE3-CG 4.42Å; W221-M291 HydrophobicContact CG-CE 4.41Å; W221-M291 HydrophobicContact CG-CG 3.46Å; W221-M291 VanDerWaalsContact CG-CG 3.46Å; W221-M291 HydrophobicContact CG-SD 3.66Å; W221-F325 HydrophobicContact CB-CZ 4.39Å; W221-F325 HydrophobicContact CE3-CD1 4.44Å; W221-F325 AromaticContact CE3-CE1 3.76Å; W221-F325 HydrophobicContact CE3-CE1 3.76Å; W221-F325 HydrophobicContact CE3-CZ 4.14Å; W221-F325 HydrophobicContact CZ3-CE1 4.22Å
222	L	92.4	Very high	93.5	Very high	0 Å²	0	23.4 Å²	23.4	0%	0	12%	0.122	C	C	.	.	H	α-helix	trans	-67.8	-36.3	174.3	-54.8	170.4	0	0	0	111.3	I103 I219 F220 K224 R225 G226 L227 M228 L231 I289	I103-L222 HydrophobicContact CD1-CD1 3.73Å; I103-L222 HydrophobicContact CG1-CD1 3.71Å; I219-L222 WeakPolarHBondContact O-CA 3.42Å; I219-L222 VanDerWaalsContact O-CB 3.26Å; I219-L222 WeakPolarHBondContact O-CB 3.36Å; I219-L222 PolarHBondContact O-N 2.84Å; F220-L222 VanDerWaalsContact C-N 3.28Å; F220-L222 PolarHBondContact O-N 3.03Å; L222-K224 PolarHBondContact O-N 3.26Å; L222-R225 CarbonylContact O-C 3.48Å; L222-R225 WeakPolarHBondContact O-CA 3.14Å; L222-R225 WeakPolarHBondContact O-CB 3.45Å; L222-R225 PolarHBondContact O-N 3.21Å; L222-R225 VanDerWaalsContact O-N 3.1Å; L222-G226 PolarHBondContact O-N 3.31Å; L222-L227 PolarHBondContact O-N 3.22Å; L222-L227 VanDerWaalsContact O-N 3.17Å; L222-M228 HydrophobicContact CB-CE 4.3Å; L222-M228 HydrophobicContact CD1-CE 3.66Å; L222-M228 HydrophobicContact CG-CE 4.38Å; L222-L231 HydrophobicContact CD1-CD2 4.47Å; L222-I289 HydrophobicContact CD2-CG2 4.49Å
223	K	92.6	Very high	93.7	Very high	46 Å²	46	25.5 Å²	25.5	20%	0.2	13%	0.131	C	C	.	.	H	α-helix	trans	-58.2	-46.4	170.9	-172.9	-174.3	168.2	-177.3	0	111.7	I219 F220 W221 R225 G226 T232 E236 E332	I219-K223 PolarHBondContact O-N 3.28Å; F220-K223 HydrophobicContact CD1-CD 4.24Å; F220-K223 VanDerWaalsContact O-CB 3.3Å; F220-K223 WeakPolarHBondContact O-CB 3.31Å; F220-K223 PolarHBondContact O-N 3.24Å; W221-K223 VanDerWaalsContact C-N 3.35Å; K223-R225 PolarHBondContact O-N 2.8Å; K223-G226 WeakPolarHBondContact O-CA 3.39Å; K223-G226 PolarHBondContact O-N 3.49Å; K223-T232 HydrophobicContact CB-CG2 3.64Å; K223-T232 HydrophobicContact CG-CG2 4.36Å; K223-E236 WeakPolarHBondContact CD-OE1 3.3Å; K223-E236 WeakPolarHBondContact CE-OE1 3.39Å; K223-E236 IonicContact NZ-OE1 2.86Å; K223-E236 PolarHBondContact NZ-OE1 2.95Å; K223-E236 IonicContact NZ-OE2 2.78Å; K223-E332 IonicContact NZ-OE2 3.91Å; K223-E332 PolarHBondContact NZ-OE2 2.81Å
224	K	90.8	Very high	93.9	Very high	111 Å²	111	25.1 Å²	25.1	48%	0.483	13%	0.128	S	C	.	.	H	α-helix	trans	-58.9	-29.1	176.7	-168.4	173.1	-170.5	168.1	0	112.3	F220 W221 L222 G226 D324 F325	F220-K224 PolarHBondContact O-N 3.35Å; W221-K224 HydrophobicContact CE3-CD 4.33Å; W221-K224 HydrophobicContact CZ3-CD 4.17Å; W221-K224 PolarHBondContact O-N 3.26Å; L222-K224 PolarHBondContact O-N 3.26Å; K224-G226 VanDerWaalsContact C-N 3.33Å; K224-D324 IonicContact NZ-OD1 3.57Å; K224-D324 PolarHBondContact NZ-OD1 3.37Å; K224-D324 IonicContact NZ-OD2 2.84Å; K224-D324 PolarHBondContact NZ-OD2 3.36Å; K224-F325 HydrophobicContact CD-CB 4.1Å; K224-F325 HydrophobicContact CD-CD1 3.9Å; K224-F325 HydrophobicContact CD-CG 4.19Å
225	R	92.4	Very high	94	Very high	101 Å²	101	25.2 Å²	25.2	38%	0.381	13%	0.129	S	C	.	.	T	Hydrogen-bonded Turn	trans	-84	-4.8	175.1	-65.2	171.9	57.9	-170.1	-4.2	113.8	E99 W221 L222 K223 L227 I289	E99-R225 IonicContact OE1-CZ 2.68Å; E99-R225 IonicContact OE1-NH1 2.95Å; E99-R225 PolarHBondContact OE1-NH1 2.91Å; E99-R225 IonicContact OE1-NH2 3Å; E99-R225 PolarHBondContact OE1-NH2 2.91Å; W221-R225 WeakPolarHBondContact O-CG 3.47Å; W221-R225 PolarHBondContact O-N 3.28Å; L222-R225 CarbonylContact O-C 3.48Å; L222-R225 WeakPolarHBondContact O-CA 3.14Å; L222-R225 WeakPolarHBondContact O-CB 3.45Å; L222-R225 PolarHBondContact O-N 3.21Å; L222-R225 VanDerWaalsContact O-N 3.1Å; K223-R225 PolarHBondContact O-N 2.8Å; R225-L227 HydrophobicContact CB-CD1 3.83Å; R225-L227 HydrophobicContact CB-CG 4.08Å; R225-I289 PolarHBondContact NH1-O 3.44Å
226	G	92	Very high	94	Very high	57 Å²	57	27.2 Å²	27.2	59%	0.588	14%	0.138	S	C	*	.	T	Hydrogen-bonded Turn	trans	71.2	31.2	179.4	0	0	0	0	0	113.8	L222 K223 K224	L222-G226 PolarHBondContact O-N 3.31Å; K223-G226 WeakPolarHBondContact O-CA 3.39Å; K223-G226 PolarHBondContact O-N 3.49Å; K224-G226 VanDerWaalsContact C-N 3.33Å
227	L	94.3	Very high	94	Very high	26 Å²	26	27 Å²	27	14%	0.136	14%	0.137	C	C	.	.			trans	-107.7	145.9	-175.9	-62.9	168.3	0	0	0	111.1	D91 L95 L222 R225 T232	D91-L227 HydrophobicContact CB-CD2 4.26Å; L95-L227 HydrophobicContact CD2-CD1 3.97Å; L222-L227 PolarHBondContact O-N 3.22Å; L222-L227 VanDerWaalsContact O-N 3.17Å; R225-L227 HydrophobicContact CB-CD1 3.83Å; R225-L227 HydrophobicContact CB-CG 4.08Å; L227-T232 WeakPolarHBondContact O-CG2 3.43Å
228	M	95.7	Very high	94.1	Very high	0 Å²	0	27 Å²	27	0%	0	14%	0.137	C	C	.	.			trans	49.2	64.9	171.9	-61.4	169.5	-64.2	0	0	112.8	D88 D91 W92 L95 I103 L222 G230 L231 T232	D88-M228 HydrophobicContact CB-CB 4.34Å; D88-M228 HydrophobicContact CB-CG 4.36Å; D88-M228 VanDerWaalsContact OD1-CA 3.27Å; D88-M228 WeakPolarHBondContact OD1-CA 3.48Å; D91-M228 HydrophobicContact CB-CG 4.21Å; D91-M228 PolarHBondContact OD2-N 3.17Å; W92-M228 HydrophobicContact CE3-SD 3.98Å; L95-M228 HydrophobicContact CD1-CE 3.91Å; L95-M228 HydrophobicContact CD1-SD 3.83Å; I103-M228 HydrophobicContact CD1-CE 3.48Å; I103-M228 VanDerWaalsContact CD1-CE 3.48Å; I103-M228 HydrophobicContact CD1-SD 4.08Å; L222-M228 HydrophobicContact CB-CE 4.3Å; L222-M228 HydrophobicContact CD1-CE 3.66Å; L222-M228 HydrophobicContact CG-CE 4.38Å; M228-G230 PolarHBondContact O-N 3.03Å; M228-L231 HydrophobicContact CB-CB 3.93Å; M228-L231 HydrophobicContact CB-CD2 4.48Å; M228-L231 HydrophobicContact CE-CD2 3.97Å; M228-L231 PolarHBondContact O-N 3.09Å; M228-L231 HydrophobicContact SD-CD2 4.11Å; M228-T232 WeakPolarHBondContact O-CG2 3.3Å; M228-T232 PolarHBondContact O-N 3.47Å; M228-T232 PolarHBondContact O-OG1 3.42Å
229	P	95.3	Very high	94	Very high	44 Å²	44	28.2 Å²	28.2	29%	0.286	15%	0.146	S	C	.	.	H	α-helix	trans	-53.9	-34.2	-178.3	23	-35.2	0	0	0	113.8	R87 D88 T232 F233	R87-P229 HydrophobicContact CB-CG 3.81Å; D88-P229 WeakPolarHBondContact OD1-CD 3.33Å; D88-P229 WeakPolarHBondContact OD1-CG 3.23Å; P229-T232 WeakPolarHBondContact CA-OG1 3.08Å; P229-T232 PolarHBondContact O-OG1 3.47Å; P229-T232 VanDerWaalsContact O-OG1 3.1Å; P229-F233 WeakPolarHBondContact O-CB 3.48Å; P229-F233 PolarHBondContact O-N 3.34Å
230	G	95.4	Very high	93.8	Very high	1 Å²	1	31.5 Å²	31.5	1%	0.01	16%	0.158	C	C	.	.	H	α-helix	trans	-63.5	-55.4	176.4	0	0	0	0	0	112.3	V83 D84 D88 M228 T232 F233 S234	V83-G230 WeakPolarHBondContact CG1-O 3.3Å; D84-G230 WeakPolarHBondContact O-CA 3.31Å; D88-G230 PolarHBondContact OD1-N 3.43Å; D88-G230 WeakPolarHBondContact OD2-CA 3.34Å; D88-G230 PolarHBondContact OD2-N 2.61Å; M228-G230 PolarHBondContact O-N 3.03Å; G230-T232 VanDerWaalsContact C-N 3.31Å; G230-T232 PolarHBondContact O-N 3.03Å; G230-F233 PolarHBondContact O-N 3.28Å; G230-S234 PolarHBondContact O-N 3.35Å; G230-S234 PolarHBondContact O-OG 3.45Å
231	L	96.4	Very high	93.9	Very high	0 Å²	0	31.3 Å²	31.3	0%	0	16%	0.157	C	C	.	.	H	α-helix	trans	-54.2	-46.7	174.4	176	59.9	0	0	0	112.2	D88 I103 L107 L155 Y159 I219 L222 M228 F233 S234 N235	D88-L231 PolarHBondContact OD2-N 3.26Å; I103-L231 HydrophobicContact CG2-CD2 3.9Å; L107-L231 HydrophobicContact CD2-CD1 3.82Å; L155-L231 HydrophobicContact CD1-CD1 3.82Å; L155-L231 HydrophobicContact CD2-CB 4.37Å; L155-L231 HydrophobicContact CD2-CD1 4.23Å; Y159-L231 WeakPolarHBondContact OH-CB 3.42Å; I219-L231 HydrophobicContact CD1-CD1 4.25Å; I219-L231 HydrophobicContact CG2-CD1 4.49Å; I219-L231 HydrophobicContact CG2-CD2 4.34Å; I219-L231 HydrophobicContact CG2-CG 3.94Å; L222-L231 HydrophobicContact CD1-CD2 4.47Å; M228-L231 HydrophobicContact CB-CB 3.93Å; M228-L231 HydrophobicContact CB-CD2 4.48Å; M228-L231 HydrophobicContact CE-CD2 3.97Å; M228-L231 PolarHBondContact O-N 3.09Å; M228-L231 HydrophobicContact SD-CD2 4.11Å; L231-F233 VanDerWaalsContact C-N 3.34Å; L231-S234 PolarHBondContact O-OG 2.95Å; L231-N235 WeakPolarHBondContact O-CB 3.03Å; L231-N235 PolarHBondContact O-N 3.08Å
232	T	94.7	Very high	93.9	Very high	11 Å²	11	28.4 Å²	28.4	7%	0.067	15%	0.146	C	C	.	.	H	α-helix	trans	-70.1	-34.8	-176.4	59.7	0	0	0	0	112	I219 K223 L227 M228 P229 G230 N235 E236	I219-T232 HydrophobicContact CG2-CG2 4.24Å; K223-T232 HydrophobicContact CB-CG2 3.64Å; K223-T232 HydrophobicContact CG-CG2 4.36Å; L227-T232 WeakPolarHBondContact O-CG2 3.43Å; M228-T232 WeakPolarHBondContact O-CG2 3.3Å; M228-T232 PolarHBondContact O-N 3.47Å; M228-T232 PolarHBondContact O-OG1 3.42Å; P229-T232 WeakPolarHBondContact CA-OG1 3.08Å; P229-T232 PolarHBondContact O-OG1 3.47Å; P229-T232 VanDerWaalsContact O-OG1 3.1Å; G230-T232 VanDerWaalsContact C-N 3.31Å; G230-T232 PolarHBondContact O-N 3.03Å; T232-N235 WeakPolarHBondContact O-CB 3.34Å; T232-N235 PolarHBondContact O-N 2.87Å; T232-E236 WeakPolarHBondContact O-CG 3.3Å; T232-E236 PolarHBondContact O-N 3.36Å
233	F	94.8	Very high	93.8	Very high	45 Å²	45	29.6 Å²	29.6	20%	0.197	16%	0.158	C	C	.	.	H	α-helix	trans	-70.4	-45	175.7	-178.7	-112.2	0	0	0	111.8	V83 P229 G230 L231 N235 E236 L237	V83-F233 HydrophobicContact CB-CD1 4.48Å; V83-F233 HydrophobicContact CG1-CD1 4.36Å; V83-F233 HydrophobicContact CG2-CD1 4.08Å; V83-F233 HydrophobicContact CG2-CE1 4.32Å; P229-F233 WeakPolarHBondContact O-CB 3.48Å; P229-F233 PolarHBondContact O-N 3.34Å; G230-F233 PolarHBondContact O-N 3.28Å; L231-F233 VanDerWaalsContact C-N 3.34Å; F233-N235 PolarHBondContact O-N 3.25Å; F233-E236 WeakPolarHBondContact O-CB 3.48Å; F233-E236 PolarHBondContact O-N 3.04Å; F233-E236 VanDerWaalsContact O-N 3.16Å; F233-L237 HydrophobicContact CD1-CD1 4.27Å; F233-L237 HydrophobicContact CE1-CD1 3.82Å; F233-L237 HydrophobicContact CZ-CD1 4.11Å; F233-L237 HydrophobicContact CZ-CD2 4.49Å; F233-L237 PolarHBondContact O-N 3.29Å
234	S	95.5	Very high	93.8	Very high	1 Å²	1	28.4 Å²	28.4	1%	0.007	15%	0.154	C	C	.	.	H	α-helix	trans	-60.8	-37.9	173.2	59.7	0	0	0	0	111.5	G230 L231 E236 L237 I238	G230-S234 PolarHBondContact O-N 3.35Å; G230-S234 PolarHBondContact O-OG 3.45Å; L231-S234 PolarHBondContact O-OG 2.95Å; S234-E236 VanDerWaalsContact C-N 3.32Å; S234-E236 PolarHBondContact O-N 3.24Å; S234-L237 PolarHBondContact O-N 3.38Å; S234-I238 VanDerWaalsContact O-CG1 3.27Å; S234-I238 WeakPolarHBondContact O-CG1 3.41Å; S234-I238 PolarHBondContact O-N 3.2Å
235	N	94.7	Very high	94	Very high	2 Å²	2	23.3 Å²	23.3	1%	0.011	13%	0.132	C	C	.	.	H	α-helix	trans	-63.5	-34.7	176	-171.4	84.2	0	0	0	113	F216 I219 F220 L231 T232 F233 S239	F216-N235 VanDerWaalsContact CD1-OD1 3.24Å; F216-N235 WeakPolarHBondContact CD1-OD1 3.36Å; F216-N235 PolarHBondContact O-ND2 3.46Å; I219-N235 HydrophobicContact CB-CB 4.34Å; I219-N235 VanDerWaalsContact CD1-OD1 3.26Å; I219-N235 WeakPolarHBondContact CD1-OD1 3.48Å; I219-N235 HydrophobicContact CG2-CB 3.57Å; I219-N235 VanDerWaalsContact CG2-CG 3.45Å; F220-N235 WeakPolarHBondContact CE2-ND2 3.4Å; F220-N235 WeakPolarHBondContact CZ-ND2 3.42Å; L231-N235 WeakPolarHBondContact O-CB 3.03Å; L231-N235 PolarHBondContact O-N 3.08Å; T232-N235 WeakPolarHBondContact O-CB 3.34Å; T232-N235 PolarHBondContact O-N 2.87Å; F233-N235 PolarHBondContact O-N 3.25Å; N235-S239 WeakPolarHBondContact O-CB 3.49Å; N235-S239 PolarHBondContact O-N 3.5Å; N235-S239 PolarHBondContact O-OG 3.3Å
236	E	93	Very high	94.1	Very high	41 Å²	41	18.6 Å²	18.6	19%	0.192	12%	0.115	C	C	.	.	H	α-helix	trans	-62.1	-45.4	172	-73.6	168.8	-154.2	0	0	112	F220 K223 T232 F233 S234 S239 R240 I329	F220-E236 HydrophobicContact CE1-CG 3.59Å; F220-E236 HydrophobicContact CZ-CG 4.2Å; K223-E236 WeakPolarHBondContact CD-OE1 3.3Å; K223-E236 WeakPolarHBondContact CE-OE1 3.39Å; K223-E236 IonicContact NZ-OE1 2.86Å; K223-E236 PolarHBondContact NZ-OE1 2.95Å; K223-E236 IonicContact NZ-OE2 2.78Å; T232-E236 WeakPolarHBondContact O-CG 3.3Å; T232-E236 PolarHBondContact O-N 3.36Å; F233-E236 WeakPolarHBondContact O-CB 3.48Å; F233-E236 PolarHBondContact O-N 3.04Å; F233-E236 VanDerWaalsContact O-N 3.16Å; S234-E236 VanDerWaalsContact C-N 3.32Å; S234-E236 PolarHBondContact O-N 3.24Å; E236-S239 PolarHBondContact O-OG 3.09Å; E236-R240 WeakPolarHBondContact O-CB 3.28Å; E236-R240 PolarHBondContact O-N 2.86Å; E236-I329 HydrophobicContact CG-CG2 4.44Å
237	L	94.5	Very high	94.2	Very high	7 Å²	7	18.2 Å²	18.2	4%	0.037	10%	0.099	C	C	.	.	H	α-helix	trans	-65.2	-50.2	-179.4	-61.2	174.6	0	0	0	111	W78 V83 F233 S234 R240 D241	W78-L237 HydrophobicContact CB-CD1 4.37Å; W78-L237 HydrophobicContact CD2-CB 4Å; W78-L237 HydrophobicContact CD2-CD1 3.65Å; W78-L237 HydrophobicContact CD2-CG 4.38Å; W78-L237 HydrophobicContact CE3-CD1 3.58Å; W78-L237 HydrophobicContact CG-CB 4.33Å; W78-L237 HydrophobicContact CG-CD1 4.01Å; W78-L237 HydrophobicContact CZ2-CB 4Å; W78-L237 HydrophobicContact CZ3-CD1 4.13Å; V83-L237 HydrophobicContact CG2-CD1 4.28Å; F233-L237 HydrophobicContact CD1-CD1 4.27Å; F233-L237 HydrophobicContact CE1-CD1 3.82Å; F233-L237 HydrophobicContact CZ-CD1 4.11Å; F233-L237 HydrophobicContact CZ-CD2 4.49Å; F233-L237 PolarHBondContact O-N 3.29Å; S234-L237 PolarHBondContact O-N 3.38Å; L237-R240 WeakPolarHBondContact O-CB 3.35Å; L237-R240 PolarHBondContact O-N 2.97Å; L237-D241 VanDerWaalsContact O-CG 3.25Å; L237-D241 PolarHBondContact O-N 2.84Å; L237-D241 VanDerWaalsContact O-N 3.14Å
238	I	94.6	Very high	94.3	Very high	0 Å²	0	17 Å²	17	0%	0	9%	0.093	C	C	.	.	H	α-helix	trans	-65.4	-48.2	-177.8	-62.6	168	0	0	0	110.9	W78 M151 Y152 F216 S234 R240 D241 E242	W78-I238 HydrophobicContact CH2-CD1 4.33Å; W78-I238 HydrophobicContact CH2-CG1 3.98Å; W78-I238 HydrophobicContact CZ2-CD1 4.43Å; W78-I238 HydrophobicContact CZ2-CG1 3.62Å; M151-I238 HydrophobicContact CB-CD1 4.48Å; M151-I238 HydrophobicContact CG-CD1 4.27Å; Y152-I238 HydrophobicContact CE1-CD1 3.98Å; Y152-I238 HydrophobicContact CE2-CD1 3.79Å; Y152-I238 HydrophobicContact CE2-CG2 4.36Å; Y152-I238 VanDerWaalsContact CZ-CD1 3.49Å; Y152-I238 WeakPolarHBondContact OH-CG2 3.5Å; F216-I238 HydrophobicContact CE1-CG2 3.98Å; F216-I238 HydrophobicContact CZ-CG2 3.86Å; S234-I238 VanDerWaalsContact O-CG1 3.27Å; S234-I238 WeakPolarHBondContact O-CG1 3.41Å; S234-I238 PolarHBondContact O-N 3.2Å; I238-R240 PolarHBondContact O-N 2.96Å; I238-D241 CarbonylContact O-C 3.53Å; I238-D241 WeakPolarHBondContact O-CA 3.38Å; I238-D241 PolarHBondContact O-N 2.81Å; I238-E242 HydrophobicContact CG2-CG 4.23Å; I238-E242 WeakPolarHBondContact O-CG 3.41Å; I238-E242 PolarHBondContact O-N 3Å
239	S	92.6	Very high	94.3	Very high	25 Å²	25	17 Å²	17	18%	0.175	9%	0.093	C	C	.	.	H	α-helix	trans	-63.5	-29.3	-179.2	61.8	0	0	0	0	113.7	F220 N235 E236 G243	F220-S239 WeakPolarHBondContact CZ-OG 3.41Å; N235-S239 WeakPolarHBondContact O-CB 3.49Å; N235-S239 PolarHBondContact O-N 3.5Å; N235-S239 PolarHBondContact O-OG 3.3Å; E236-S239 PolarHBondContact O-OG 3.09Å; S239-G243 PolarHBondContact O-N 2.73Å
240	R	92	Very high	94.3	Very high	74 Å²	74	15.2 Å²	15.2	28%	0.279	8%	0.081	S	C	.	.	H	α-helix	trans	-67	-44.1	170.9	177	-160.4	66.5	-162.1	-4	111	S76 E236 L237 I238 G243 L244 G343	S76-R240 PolarHBondContact O-NH2 3.1Å; E236-R240 WeakPolarHBondContact O-CB 3.28Å; E236-R240 PolarHBondContact O-N 2.86Å; L237-R240 WeakPolarHBondContact O-CB 3.35Å; L237-R240 PolarHBondContact O-N 2.97Å; I238-R240 PolarHBondContact O-N 2.96Å; R240-G243 PolarHBondContact O-N 3.48Å; R240-L244 PolarHBondContact O-N 2.64Å; R240-G343 PolarHBondContact NH1-O 3.26Å; R240-G343 VanDerWaalsContact NH1-O 3.15Å
241	D	94.2	Very high	94.4	Very high	2 Å²	2	16.2 Å²	16.2	1%	0.011	9%	0.086	C	C	.	.	H	α-helix	trans	-66.1	-42.7	179.6	-62.9	-17.5	0	0	0	110.3	W78 I144 H148 L237 I238 G243 L244 H245	W78-D241 PolarHBondContact NE1-OD2 2.73Å; I144-D241 HydrophobicContact CG2-CB 4.02Å; H148-D241 IonicContact NE2-OD2 2.58Å; L237-D241 VanDerWaalsContact O-CG 3.25Å; L237-D241 PolarHBondContact O-N 2.84Å; L237-D241 VanDerWaalsContact O-N 3.14Å; I238-D241 CarbonylContact O-C 3.53Å; I238-D241 WeakPolarHBondContact O-CA 3.38Å; I238-D241 PolarHBondContact O-N 2.81Å; D241-G243 VanDerWaalsContact C-N 3.33Å; D241-G243 PolarHBondContact O-N 3.34Å; D241-L244 CarbonylContact O-C 3.56Å; D241-L244 WeakPolarHBondContact O-CA 3.35Å; D241-L244 WeakPolarHBondContact O-CB 3.3Å; D241-L244 PolarHBondContact O-N 3.47Å; D241-H245 PolarHBondContact O-CD2 3.02Å; D241-H245 PolarHBondContact O-N 2.72Å; D241-H245 PolarHBondContact O-ND1 3.31Å
242	E	93.5	Very high	94.4	Very high	2 Å²	2	16.2 Å²	16.2	1%	0.009	9%	0.086	C	C	.	.	H	α-helix	trans	-64.1	-35.5	173.5	-58.6	-41.3	152.4	0	0	113.7	H148 F216 I238 L244 H245 C246	H148-E242 IonicContact CE1-OE1 2.6Å; H148-E242 PolarHBondContact CE1-OE1 3.41Å; H148-E242 IonicContact ND1-OE1 3.19Å; H148-E242 PolarHBondContact ND1-OE1 3.42Å; F216-E242 HydrophobicContact CE2-CB 3.91Å; F216-E242 HydrophobicContact CE2-CG 3.65Å; F216-E242 HydrophobicContact CZ-CB 4.3Å; F216-E242 HydrophobicContact CZ-CG 3.54Å; I238-E242 HydrophobicContact CG2-CG 4.23Å; I238-E242 WeakPolarHBondContact O-CG 3.41Å; I238-E242 PolarHBondContact O-N 3Å; E242-L244 VanDerWaalsContact C-N 3.29Å; E242-L244 PolarHBondContact O-N 3.5Å; E242-H245 PolarHBondContact O-N 3.24Å; E242-H245 IonicContact OE2-CE1 2.72Å; E242-H245 IonicContact OE2-CG 2.86Å; E242-H245 IonicContact OE2-ND1 3.52Å; E242-H245 PolarHBondContact OE2-ND1 3.05Å; E242-C246 VanDerWaalsContact O-CB 3.3Å; E242-C246 WeakPolarHBondContact O-CB 3.49Å; E242-C246 PolarHBondContact O-N 3.08Å
243	G	91.5	Very high	94.5	Very high	25 Å²	25	15.8 Å²	15.8	26%	0.258	8%	0.084	S	C	.	.	H	α-helix	trans	-57.3	-45.5	170	0	0	0	0	0	111.3	S239 R240 D241 D247	S239-G243 PolarHBondContact O-N 2.73Å; R240-G243 PolarHBondContact O-N 3.48Å; D241-G243 VanDerWaalsContact C-N 3.33Å; D241-G243 PolarHBondContact O-N 3.34Å; G243-D247 WeakPolarHBondContact O-CB 3.49Å; G243-D247 PolarHBondContact O-N 3.09Å
244	L	92.6	Very high	94.5	Very high	21 Å²	21	16.5 Å²	16.5	11%	0.11	9%	0.094	C	C	.	.	H	α-helix	trans	-67.3	-38.9	177.7	-175.6	65.8	0	0	0	112.5	Y69 K72 A73 F137 R240 D241 E242 F248	Y69-L244 HydrophobicContact CD1-CD1 3.61Å; Y69-L244 HydrophobicContact CE1-CD1 3.89Å; K72-L244 HydrophobicContact CB-CD1 4.06Å; K72-L244 HydrophobicContact CB-CD2 4.22Å; K72-L244 HydrophobicContact CD-CD1 4.07Å; A73-L244 HydrophobicContact CB-CD2 3.78Å; F137-L244 HydrophobicContact CE2-CD2 4.26Å; F137-L244 HydrophobicContact CE2-CG 4.15Å; F137-L244 HydrophobicContact CZ-CD2 4.47Å; F137-L244 HydrophobicContact CZ-CG 4.12Å; R240-L244 PolarHBondContact O-N 2.64Å; D241-L244 CarbonylContact O-C 3.56Å; D241-L244 WeakPolarHBondContact O-CA 3.35Å; D241-L244 WeakPolarHBondContact O-CB 3.3Å; D241-L244 PolarHBondContact O-N 3.47Å; E242-L244 VanDerWaalsContact C-N 3.29Å; E242-L244 PolarHBondContact O-N 3.5Å; L244-F248 VanDerWaalsContact O-CB 3.27Å; L244-F248 WeakPolarHBondContact O-CB 3.23Å; L244-F248 PolarHBondContact O-N 2.94Å
245	H	94.9	Very high	94.6	Very high	5 Å²	5	19 Å²	19	2%	0.023	11%	0.105	C	C	.	.	H	α-helix	trans	-63.2	-46.2	176.5	-59.6	163.2	0	0	0	111.4	Q141 E145 E208 D241 E242 F248 A249	Q141-H245 VanDerWaalsContact NE2-CG 3.32Å; Q141-H245 PolarHBondContact NE2-ND1 3.19Å; E145-H245 IonicContact OE1-CE1 2.95Å; E145-H245 PolarHBondContact OE1-CE1 3.1Å; E145-H245 IonicContact OE1-ND1 3.16Å; E145-H245 PolarHBondContact OE1-ND1 2.97Å; E208-H245 HydrophobicContact CG-CB 4.23Å; D241-H245 PolarHBondContact O-CD2 3.02Å; D241-H245 PolarHBondContact O-N 2.72Å; D241-H245 PolarHBondContact O-ND1 3.31Å; E242-H245 PolarHBondContact O-N 3.24Å; E242-H245 IonicContact OE2-CE1 2.72Å; E242-H245 IonicContact OE2-CG 2.86Å; E242-H245 IonicContact OE2-ND1 3.52Å; E242-H245 PolarHBondContact OE2-ND1 3.05Å; H245-F248 PolarHBondContact O-N 2.89Å; H245-A249 PolarHBondContact O-N 2.78Å
246	C	94.7	Very high	94.6	Very high	2 Å²	2	19.2 Å²	19.2	1%	0.014	11%	0.107	C	C	.	.	H	α-helix	trans	-61.9	-49.2	175.8	-176.7	0	0	0	0	111.7	E208 E242 F248 A249 C250	E208-C246 HydrophobicContact CB-CB 4.05Å; E242-C246 VanDerWaalsContact O-CB 3.3Å; E242-C246 WeakPolarHBondContact O-CB 3.49Å; E242-C246 PolarHBondContact O-N 3.08Å; C246-F248 VanDerWaalsContact C-N 3.26Å; C246-F248 PolarHBondContact O-N 3.44Å; C246-A249 WeakPolarHBondContact O-CB 3.22Å; C246-A249 PolarHBondContact O-N 2.87Å; C246-A249 VanDerWaalsContact O-N 3.1Å; C246-C250 PolarHBondContact O-N 3.12Å; C246-C250 PolarHBondContact O-SG 3.26Å
247	D	93.9	Very high	94.6	Very high	48 Å²	48	23 Å²	23	26%	0.257	12%	0.122	S	C	.	.	H	α-helix	trans	-61.5	-36.1	177.9	-71.2	-6.2	0	0	0	111.5	Y69 G243 C250 L251 R306	Y69-D247 HydrophobicContact CE1-CB 3.87Å; G243-D247 WeakPolarHBondContact O-CB 3.49Å; G243-D247 PolarHBondContact O-N 3.09Å; D247-C250 PolarHBondContact O-N 3.38Å; D247-L251 PolarHBondContact O-N 3.43Å; D247-R306 IonicContact OD1-NH1 3.98Å
248	F	96	Very high	94.5	Very high	1 Å²	1	26.4 Å²	26.4	0%	0.004	14%	0.138	C	C	.	.	H	α-helix	trans	-66.4	-40.1	174.4	-176.9	-107.5	0	0	0	112.5	I66 Y69 A134 F137 Y138 L244 H245 C246 C250 L251 L252	I66-F248 HydrophobicContact CG2-CE2 3.94Å; I66-F248 HydrophobicContact CG2-CZ 4.23Å; Y69-F248 HydrophobicContact CD1-CB 4.01Å; Y69-F248 HydrophobicContact CD1-CD2 4.04Å; Y69-F248 HydrophobicContact CE1-CB 4.45Å; Y69-F248 HydrophobicContact CG-CD2 4.01Å; A134-F248 HydrophobicContact CB-CZ 4.05Å; F137-F248 HydrophobicContact CB-CE1 3.98Å; F137-F248 HydrophobicContact CB-CE2 3.86Å; F137-F248 HydrophobicContact CB-CZ 3.57Å; F137-F248 HydrophobicContact CD1-CB 4.34Å; F137-F248 AromaticContact CD1-CD1 3.21Å; F137-F248 HydrophobicContact CD1-CD1 3.21Å; F137-F248 HydrophobicContact CD1-CD2 4Å; F137-F248 AromaticContact CD1-CE1 3.28Å; F137-F248 HydrophobicContact CD1-CE1 3.28Å; F137-F248 HydrophobicContact CD1-CE2 4.07Å; F137-F248 AromaticContact CD1-CG 3.58Å; F137-F248 HydrophobicContact CD1-CG 3.58Å; F137-F248 AromaticContact CD1-CZ 3.74Å; F137-F248 HydrophobicContact CD1-CZ 3.74Å; F137-F248 HydrophobicContact CD2-CD1 4.48Å; F137-F248 AromaticContact CD2-CD2 3.8Å; F137-F248 HydrophobicContact CD2-CD2 3.8Å; F137-F248 AromaticContact CD2-CE2 3.95Å; F137-F248 HydrophobicContact CD2-CE2 3.95Å; F137-F248 HydrophobicContact CD2-CG 4.07Å; F137-F248 HydrophobicContact CD2-CZ 4.36Å; F137-F248 HydrophobicContact CE1-CB 3.67Å; F137-F248 AromaticContact CE1-CD1 3.29Å; F137-F248 HydrophobicContact CE1-CD1 3.29Å; F137-F248 HydrophobicContact CE1-CD2 4.15Å; F137-F248 AromaticContact CE1-CE1 3.91Å; F137-F248 HydrophobicContact CE1-CE1 3.91Å; F137-F248 AromaticContact CE1-CG 3.42Å; F137-F248 HydrophobicContact CE1-CG 3.42Å; F137-F248 VanDerWaalsContact CE1-CG 3.42Å; F137-F248 HydrophobicContact CE2-CB 4.06Å; F137-F248 AromaticContact CE2-CD2 3.96Å; F137-F248 HydrophobicContact CE2-CD2 3.96Å; F137-F248 AromaticContact CE2-CG 3.94Å; F137-F248 HydrophobicContact CE2-CG 3.94Å; F137-F248 AromaticContact CG-CD1 3.86Å; F137-F248 HydrophobicContact CG-CD1 3.86Å; F137-F248 AromaticContact CG-CD2 3.82Å; F137-F248 HydrophobicContact CG-CD2 3.82Å; F137-F248 AromaticContact CG-CE1 3.71Å; F137-F248 HydrophobicContact CG-CE1 3.71Å; F137-F248 AromaticContact CG-CE2 3.67Å; F137-F248 HydrophobicContact CG-CE2 3.67Å; F137-F248 AromaticContact CG-CG 3.91Å; F137-F248 HydrophobicContact CG-CG 3.91Å; F137-F248 AromaticContact CG-CZ 3.62Å; F137-F248 HydrophobicContact CG-CZ 3.62Å; F137-F248 HydrophobicContact CZ-CB 3.51Å; F137-F248 AromaticContact CZ-CD1 4Å; F137-F248 HydrophobicContact CZ-CD1 4Å; F137-F248 HydrophobicContact CZ-CD2 4.12Å; F137-F248 AromaticContact CZ-CG 3.61Å; F137-F248 HydrophobicContact CZ-CG 3.61Å; Y138-F248 HydrophobicContact CD1-CE1 4.12Å; Y138-F248 HydrophobicContact CE1-CD1 4.12Å; Y138-F248 AromaticContact CE1-CE1 3.74Å; Y138-F248 HydrophobicContact CE1-CE1 3.74Å; L244-F248 VanDerWaalsContact O-CB 3.27Å; L244-F248 WeakPolarHBondContact O-CB 3.23Å; L244-F248 PolarHBondContact O-N 2.94Å; H245-F248 PolarHBondContact O-N 2.89Å; C246-F248 VanDerWaalsContact C-N 3.26Å; C246-F248 PolarHBondContact O-N 3.44Å; F248-C250 VanDerWaalsContact C-N 3.31Å; F248-C250 PolarHBondContact O-N 3.46Å; F248-L251 HydrophobicContact CD2-CD2 4.33Å; F248-L251 WeakPolarHBondContact O-CB 3.48Å; F248-L251 PolarHBondContact O-N 3.05Å; F248-L252 HydrophobicContact CD1-CD1 4.01Å; F248-L252 HydrophobicContact CD1-CG 4.3Å; F248-L252 HydrophobicContact CE1-CD1 3.44Å; F248-L252 VanDerWaalsContact CE1-CD1 3.44Å; F248-L252 HydrophobicContact CE1-CD2 4.37Å; F248-L252 HydrophobicContact CE1-CG 3.86Å; F248-L252 HydrophobicContact CE2-CD2 4.44Å; F248-L252 HydrophobicContact CE2-CG 4.39Å; F248-L252 HydrophobicContact CZ-CD1 3.89Å; F248-L252 HydrophobicContact CZ-CD2 3.96Å; F248-L252 HydrophobicContact CZ-CG 3.9Å; F248-L252 WeakPolarHBondContact O-CG 3.25Å; F248-L252 PolarHBondContact O-N 3.45Å
249	A	96.4	Very high	94.5	Very high	1 Å²	1	30.6 Å²	30.6	1%	0.008	16%	0.156	C	C	.	.	H	α-helix	trans	-61.2	-41.2	173.8	0	0	0	0	0	111.5	L201 F204 A205 H245 C246 L252 F253	L201-A249 HydrophobicContact CD1-CB 3.96Å; F204-A249 HydrophobicContact CD1-CB 4.26Å; A205-A249 HydrophobicContact CB-CB 3.84Å; H245-A249 PolarHBondContact O-N 2.78Å; C246-A249 WeakPolarHBondContact O-CB 3.22Å; C246-A249 PolarHBondContact O-N 2.87Å; C246-A249 VanDerWaalsContact O-N 3.1Å; A249-L252 PolarHBondContact O-N 3.26Å; A249-F253 WeakPolarHBondContact O-CB 3.18Å; A249-F253 PolarHBondContact O-N 3.31Å
250	C	95.8	Very high	94.5	Very high	5 Å²	5	29.8 Å²	29.8	3%	0.034	15%	0.15	C	C	.	.	H	α-helix	trans	-63.7	-41.8	173	-65.4	0	0	0	0	112.3	C246 D247 F248 L252 F253 S254 L307 E310	C246-C250 PolarHBondContact O-N 3.12Å; C246-C250 PolarHBondContact O-SG 3.26Å; D247-C250 PolarHBondContact O-N 3.38Å; F248-C250 VanDerWaalsContact C-N 3.31Å; F248-C250 PolarHBondContact O-N 3.46Å; C250-L252 PolarHBondContact O-N 3.3Å; C250-F253 WeakPolarHBondContact O-CB 3.46Å; C250-F253 PolarHBondContact O-N 3.46Å; C250-S254 PolarHBondContact O-N 3.14Å; C250-L307 VanDerWaalsContact SG-CD1 3.51Å; C250-E310 HydrophobicContact CB-CB 4.08Å
251	L	96	Very high	94.7	Very high	23 Å²	23	29.6 Å²	29.6	12%	0.12	16%	0.16	C	C	.	.	H	α-helix	trans	-59.1	-49.5	174.3	178.9	70.5	0	0	0	111.2	I66 Y69 D247 F248 F253 S254 H255	I66-L251 HydrophobicContact CG1-CD2 3.99Å; Y69-L251 HydrophobicContact CD2-CD2 3.5Å; Y69-L251 VanDerWaalsContact CD2-CD2 3.5Å; Y69-L251 HydrophobicContact CE2-CD2 3.7Å; Y69-L251 HydrophobicContact CE2-CG 4.49Å; Y69-L251 HydrophobicContact CG-CD2 4.07Å; D247-L251 PolarHBondContact O-N 3.43Å; F248-L251 HydrophobicContact CD2-CD2 4.33Å; F248-L251 WeakPolarHBondContact O-CB 3.48Å; F248-L251 PolarHBondContact O-N 3.05Å; L251-F253 VanDerWaalsContact C-N 3.25Å; L251-F253 PolarHBondContact O-N 3.49Å; L251-S254 WeakPolarHBondContact O-CB 3.49Å; L251-S254 PolarHBondContact O-N 2.91Å; L251-S254 VanDerWaalsContact O-N 3.11Å; L251-S254 PolarHBondContact O-OG 2.98Å; L251-H255 PolarHBondContact O-CD2 3.09Å; L251-H255 PolarHBondContact O-N 3.19Å
252	L	96.9	Very high	94.8	Very high	0 Å²	0	34.2 Å²	34.2	0%	0	18%	0.18	C	C	.	.	H	α-helix	trans	-59.8	-39.7	176.8	-72.1	-177.1	0	0	0	111.4	L48 I66 A134 Y138 L201 F248 A249 C250 S254 H255 L256	L48-L252 HydrophobicContact CD1-CD2 4.32Å; I66-L252 HydrophobicContact CD1-CD2 3.96Å; A134-L252 HydrophobicContact CB-CD2 4.16Å; Y138-L252 HydrophobicContact CE2-CD1 4.33Å; Y138-L252 WeakPolarHBondContact OH-CD1 3.42Å; L201-L252 HydrophobicContact CD2-CB 3.88Å; F248-L252 HydrophobicContact CD1-CD1 4.01Å; F248-L252 HydrophobicContact CD1-CG 4.3Å; F248-L252 HydrophobicContact CE1-CD1 3.44Å; F248-L252 VanDerWaalsContact CE1-CD1 3.44Å; F248-L252 HydrophobicContact CE1-CD2 4.37Å; F248-L252 HydrophobicContact CE1-CG 3.86Å; F248-L252 HydrophobicContact CE2-CD2 4.44Å; F248-L252 HydrophobicContact CE2-CG 4.39Å; F248-L252 HydrophobicContact CZ-CD1 3.89Å; F248-L252 HydrophobicContact CZ-CD2 3.96Å; F248-L252 HydrophobicContact CZ-CG 3.9Å; F248-L252 WeakPolarHBondContact O-CG 3.25Å; F248-L252 PolarHBondContact O-N 3.45Å; A249-L252 PolarHBondContact O-N 3.26Å; C250-L252 PolarHBondContact O-N 3.3Å; L252-S254 VanDerWaalsContact C-N 3.29Å; L252-S254 PolarHBondContact O-N 2.97Å; L252-H255 PolarHBondContact O-N 3.38Å; L252-H255 VanDerWaalsContact O-N 3.16Å; L252-L256 PolarHBondContact O-N 3.29Å
253	F	96.6	Very high	94.9	Very high	2 Å²	2	40.1 Å²	40.1	1%	0.009	21%	0.212	C	C	.	.	H	α-helix	trans	-60.9	-39.1	175.8	-176.8	-95.6	0	0	0	111.9	L201 V202 A249 C250 L251 H255 L256 K259 I265 L311	L201-F253 HydrophobicContact CD2-CB 3.88Å; V202-F253 HydrophobicContact CG2-CD2 3.81Å; V202-F253 HydrophobicContact CG2-CE2 3.63Å; V202-F253 HydrophobicContact CG2-CZ 4.43Å; A249-F253 WeakPolarHBondContact O-CB 3.18Å; A249-F253 PolarHBondContact O-N 3.31Å; C250-F253 WeakPolarHBondContact O-CB 3.46Å; C250-F253 PolarHBondContact O-N 3.46Å; L251-F253 VanDerWaalsContact C-N 3.25Å; L251-F253 PolarHBondContact O-N 3.49Å; F253-H255 VanDerWaalsContact C-N 3.25Å; F253-H255 PolarHBondContact O-N 3.46Å; F253-L256 HydrophobicContact CD2-CD1 3.86Å; F253-L256 HydrophobicContact CE2-CD1 4.43Å; F253-L256 WeakPolarHBondContact O-CB 3.1Å; F253-L256 PolarHBondContact O-N 3.27Å; F253-K259 HydrophobicContact CE1-CB 4.41Å; F253-K259 HydrophobicContact CE1-CD 3.99Å; F253-K259 HydrophobicContact CE1-CG 4.23Å; F253-K259 HydrophobicContact CZ-CB 3.88Å; F253-K259 HydrophobicContact CZ-CD 4.33Å; F253-K259 HydrophobicContact CZ-CG 4.13Å; F253-I265 HydrophobicContact CE1-CD1 4.32Å; F253-I265 HydrophobicContact CE2-CD1 4.4Å; F253-I265 HydrophobicContact CZ-CD1 3.68Å; F253-L311 HydrophobicContact CB-CD2 4.01Å; F253-L311 HydrophobicContact CD1-CD2 3.68Å; F253-L311 HydrophobicContact CD2-CD2 4.29Å; F253-L311 HydrophobicContact CE1-CB 4.4Å; F253-L311 HydrophobicContact CE1-CD2 4.24Å; F253-L311 HydrophobicContact CG-CD2 3.72Å
254	S	96	Very high	95.1	Very high	59 Å²	59	42.2 Å²	42.2	41%	0.413	21%	0.212	S	C	.	.	H	α-helix	trans	-63.6	-30.2	177	83.1	0	0	0	0	113.2	C250 L251 L252	C250-S254 PolarHBondContact O-N 3.14Å; L251-S254 WeakPolarHBondContact O-CB 3.49Å; L251-S254 PolarHBondContact O-N 2.91Å; L251-S254 VanDerWaalsContact O-N 3.11Å; L251-S254 PolarHBondContact O-OG 2.98Å; L252-S254 VanDerWaalsContact C-N 3.29Å; L252-S254 PolarHBondContact O-N 2.97Å
255	H	95.8	Very high	95.4	Very high	53 Å²	53	41.3 Å²	41.3	25%	0.245	21%	0.207	C	C	.	.	T	Hydrogen-bonded Turn	trans	-82.8	-8.7	177.2	-81.9	-70.2	0	0	0	114.3	L48 Y63 D65 L251 L252 F253	L48-H255 HydrophobicContact CD1-CB 3.85Å; L48-H255 HydrophobicContact CD2-CB 4.21Å; L48-H255 HydrophobicContact CG-CB 4.32Å; Y63-H255 AromaticContact CD1-CE1 3.71Å; Y63-H255 AromaticContact CD1-ND1 3.83Å; Y63-H255 AromaticContact CE1-ND1 3.68Å; D65-H255 IonicContact OD1-CE1 2.74Å; D65-H255 IonicContact OD1-NE2 2.79Å; D65-H255 IonicContact OD2-CD2 2.84Å; D65-H255 IonicContact OD2-CE1 3.41Å; D65-H255 PolarHBondContact OD2-CE1 3.28Å; D65-H255 VanDerWaalsContact OD2-CE1 3.31Å; D65-H255 IonicContact OD2-NE2 3.33Å; D65-H255 PolarHBondContact OD2-NE2 3.02Å; L251-H255 PolarHBondContact O-CD2 3.09Å; L251-H255 PolarHBondContact O-N 3.19Å; L252-H255 PolarHBondContact O-N 3.38Å; L252-H255 VanDerWaalsContact O-N 3.16Å; F253-H255 VanDerWaalsContact C-N 3.25Å; F253-H255 PolarHBondContact O-N 3.46Å
256	L	94.9	Very high	95.5	Very high	8 Å²	8	44.1 Å²	44.1	4%	0.042	22%	0.22	C	C	.	.			trans	-69.2	135.4	176.8	-67.6	173.3	0	0	0	111	L48 F197 R198 L201 L252 F253	L48-L256 HydrophobicContact CD1-CD2 4.03Å; F197-L256 HydrophobicContact CD1-CD1 4.48Å; F197-L256 HydrophobicContact CD1-CD2 3.94Å; F197-L256 HydrophobicContact CE1-CD2 4.1Å; R198-L256 HydrophobicContact CB-CD1 3.63Å; L201-L256 HydrophobicContact CD2-CD1 4.07Å; L252-L256 PolarHBondContact O-N 3.29Å; F253-L256 HydrophobicContact CD2-CD1 3.86Å; F253-L256 HydrophobicContact CE2-CD1 4.43Å; F253-L256 WeakPolarHBondContact O-CB 3.1Å; F253-L256 PolarHBondContact O-N 3.27Å
257	K	93.5	Very high	95.6	Very high	120 Å²	120	49.2 Å²	49.2	52%	0.522	24%	0.244	S	C	.	.	S	Bend	trans	-73.4	-46.1	176	-174.5	-173.8	177.4	-166.4	0	110.8	D45 E46	D45-K257 IonicContact OD1-NZ 2.73Å; D45-K257 PolarHBondContact OD1-NZ 2.85Å; D45-K257 IonicContact OD2-NZ 3.69Å; D45-K257 PolarHBondContact OD2-NZ 3.1Å; E46-K257 WeakPolarHBondContact OE2-CB 2.83Å; E46-K257 PolarHBondContact OE2-N 2.7Å
258	H	92.6	Very high	95.8	Very high	78 Å²	78	47 Å²	47	36%	0.361	23%	0.232	S	C	.	.	S	Bend	trans	-103.9	92.5	176.8	-57.9	-70.9	0	0	0	109.7	D45 E46 R198	D45-H258 IonicContact OD2-CD2 3.78Å; D45-H258 IonicContact OD2-CE1 3.58Å; D45-H258 IonicContact OD2-NE2 3.77Å; D45-H258 PolarHBondContact OD2-NE2 2.95Å; E46-H258 WeakPolarHBondContact OE1-CA 3.01Å; E46-H258 VanDerWaalsContact OE1-CB 3.24Å; E46-H258 WeakPolarHBondContact OE1-CB 3.26Å; E46-H258 IonicContact OE1-CD2 2.85Å; E46-H258 PolarHBondContact OE1-CD2 3.08Å; E46-H258 IonicContact OE1-CG 2.68Å; E46-H258 PolarHBondContact OE1-N 3.04Å; R198-H258 WeakPolarHBondContact CD-O 3.44Å
259	K	93.6	Very high	95.8	Very high	89 Å²	89	47 Å²	47	39%	0.387	23%	0.232	S	C	.	.	P	Polyproline II helix	trans	-69.5	151.4	177.1	-66.8	-174.4	175.9	-178.1	0	112	F253 D312	F253-K259 HydrophobicContact CE1-CB 4.41Å; F253-K259 HydrophobicContact CE1-CD 3.99Å; F253-K259 HydrophobicContact CE1-CG 4.23Å; F253-K259 HydrophobicContact CZ-CB 3.88Å; F253-K259 HydrophobicContact CZ-CD 4.33Å; F253-K259 HydrophobicContact CZ-CG 4.13Å; K259-D312 IonicContact NZ-OD2 3.91Å; K259-D312 PolarHBondContact NZ-OD2 3.19Å
260	T	93.6	Very high	95.9	Very high	8 Å²	8	51.6 Å²	51.6	5%	0.049	25%	0.249	C	C	.	.	P	Polyproline II helix	trans	-61.7	143.1	170	-52.4	0	0	0	0	109.1	R198 D199 R264 I265	R198-T260 VanDerWaalsContact C-OG1 3.23Å; R198-T260 WeakPolarHBondContact CB-OG1 3.44Å; R198-T260 VanDerWaalsContact CG-OG1 3.27Å; R198-T260 WeakPolarHBondContact CG-OG1 3.43Å; R198-T260 PolarHBondContact O-OG1 3.27Å; R198-T260 VanDerWaalsContact O-OG1 3.13Å; D199-T260 WeakPolarHBondContact OD1-CG2 3.19Å; D199-T260 PolarHBondContact OD1-OG1 2.71Å; T260-R264 HydrophobicContact CG2-CB 3.7Å; T260-R264 HydrophobicContact CG2-CG 3.5Å; T260-I265 HydrophobicContact CG2-CG1 3.79Å
261	S	95.3	Very high	96	Very high	69 Å²	69	54.7 Å²	54.7	48%	0.483	26%	0.263	S	S	.	.	P	Polyproline II helix	trans	-64.7	146.6	177.4	59.2	0	0	0	0	110.7	D263 R264 I265	S261-D263 VanDerWaalsContact C-N 3.26Å; S261-D263 PolarHBondContact O-N 3.33Å; S261-R264 WeakPolarHBondContact O-CB 3.5Å; S261-R264 PolarHBondContact O-N 2.9Å; S261-R264 VanDerWaalsContact OG-CB 3.23Å; S261-R264 WeakPolarHBondContact OG-CB 3.42Å; S261-R264 PolarHBondContact OG-N 2.82Å; S261-I265 WeakPolarHBondContact O-CG1 3.33Å; S261-I265 PolarHBondContact O-N 2.97Å
262	K	96	Very high	96	Very high	100 Å²	100	53.6 Å²	53.6	44%	0.435	26%	0.257	S	S	.	.	H	α-helix	trans	-53.2	-44.6	177.9	-66.2	-162.5	177.7	-158.8	0	111.9	R264 I265 E266 D312 D314	K262-R264 VanDerWaalsContact C-N 3.26Å; K262-R264 PolarHBondContact O-N 3.45Å; K262-I265 PolarHBondContact O-N 2.91Å; K262-E266 WeakPolarHBondContact O-CB 3.41Å; K262-E266 PolarHBondContact O-N 3.23Å; K262-D312 VanDerWaalsContact CE-O 3.25Å; K262-D312 WeakPolarHBondContact CE-O 3.38Å; K262-D312 PolarHBondContact NZ-O 3.27Å; K262-D314 IonicContact NZ-OD2 2.7Å; K262-D314 PolarHBondContact NZ-OD2 2.96Å
263	D	96.8	Very high	96	Very high	126 Å²	126	53.7 Å²	53.7	67%	0.674	26%	0.258	S	S	*	.	H	α-helix	trans	-58.5	-37.5	177.3	-57.8	-16.9	0	0	0	112.7	S261 Q267	S261-D263 VanDerWaalsContact C-N 3.26Å; S261-D263 PolarHBondContact O-N 3.33Å; D263-Q267 WeakPolarHBondContact O-CB 3.46Å; D263-Q267 PolarHBondContact O-N 3.32Å
264	R	96.2	Very high	96	Very high	68 Å²	68	56.1 Å²	56.1	26%	0.257	28%	0.278	S	S	.	.	H	α-helix	trans	-75.3	-39.2	179.9	179	61.5	167.9	167.6	5.4	111.2	D199 T260 S261 K262 Q267 I268	D199-R264 IonicContact OD2-CZ 2.61Å; D199-R264 IonicContact OD2-NE 3.2Å; D199-R264 PolarHBondContact OD2-NE 3.1Å; D199-R264 IonicContact OD2-NH2 3.3Å; T260-R264 HydrophobicContact CG2-CB 3.7Å; T260-R264 HydrophobicContact CG2-CG 3.5Å; S261-R264 WeakPolarHBondContact O-CB 3.5Å; S261-R264 PolarHBondContact O-N 2.9Å; S261-R264 VanDerWaalsContact OG-CB 3.23Å; S261-R264 WeakPolarHBondContact OG-CB 3.42Å; S261-R264 PolarHBondContact OG-N 2.82Å; K262-R264 VanDerWaalsContact C-N 3.26Å; K262-R264 PolarHBondContact O-N 3.45Å; R264-Q267 PolarHBondContact O-N 3.33Å; R264-I268 HydrophobicContact CG-CD1 4.31Å; R264-I268 VanDerWaalsContact O-CG1 3.28Å; R264-I268 WeakPolarHBondContact O-CG1 3.27Å; R264-I268 PolarHBondContact O-N 3.02Å; R264-I268 VanDerWaalsContact O-N 3.11Å
265	I	97.5	Very high	96	Very high	2 Å²	2	54 Å²	54	1%	0.01	26%	0.262	C	S	.	.	H	α-helix	trans	-60.3	-52.1	172.5	-63.9	165.6	0	0	0	109.4	V202 F253 T260 S261 K262 Q267 I268 I269 L308 L311 C313	V202-I265 HydrophobicContact CG1-CB 4.42Å; V202-I265 HydrophobicContact CG1-CG1 4.28Å; V202-I265 HydrophobicContact CG1-CG2 4.04Å; V202-I265 HydrophobicContact CG2-CG1 4.11Å; F253-I265 HydrophobicContact CE1-CD1 4.32Å; F253-I265 HydrophobicContact CE2-CD1 4.4Å; F253-I265 HydrophobicContact CZ-CD1 3.68Å; T260-I265 HydrophobicContact CG2-CG1 3.79Å; S261-I265 WeakPolarHBondContact O-CG1 3.33Å; S261-I265 PolarHBondContact O-N 2.97Å; K262-I265 PolarHBondContact O-N 2.91Å; I265-Q267 VanDerWaalsContact C-N 3.28Å; I265-Q267 PolarHBondContact O-N 2.96Å; I265-I268 PolarHBondContact O-N 3.04Å; I265-I268 VanDerWaalsContact O-N 3.09Å; I265-I269 HydrophobicContact CG2-CG1 4.16Å; I265-I269 WeakPolarHBondContact O-CG1 3.15Å; I265-I269 PolarHBondContact O-N 3.36Å; I265-L308 HydrophobicContact CG2-CD2 4.05Å; I265-L311 HydrophobicContact CG2-CB 4.3Å; I265-L311 HydrophobicContact CG2-CD1 3.94Å; I265-C313 VanDerWaalsContact CD1-SG 3.56Å
266	E	97.2	Very high	95.9	Very high	64 Å²	64	51.5 Å²	51.5	30%	0.299	25%	0.251	S	S	.	.	H	α-helix	trans	-53.6	-44.9	176.4	166.3	165.2	-177.4	0	0	111.7	K262 I268 I269 R270 I316	K262-E266 WeakPolarHBondContact O-CB 3.41Å; K262-E266 PolarHBondContact O-N 3.23Å; E266-I268 PolarHBondContact O-N 3.03Å; E266-I269 PolarHBondContact O-N 3.17Å; E266-R270 HydrophobicContact CG-CG 4.23Å; E266-R270 VanDerWaalsContact O-CB 3.31Å; E266-R270 WeakPolarHBondContact O-CB 3.42Å; E266-R270 VanDerWaalsContact O-CG 3.25Å; E266-R270 WeakPolarHBondContact O-CG 3.5Å; E266-R270 PolarHBondContact O-N 2.93Å; E266-R270 IonicContact OE1-CZ 3.19Å; E266-R270 IonicContact OE1-NE 3.93Å; E266-R270 PolarHBondContact OE1-NE 3.13Å; E266-R270 IonicContact OE1-NH2 3.59Å; E266-R270 PolarHBondContact OE1-NH2 3.46Å; E266-I316 HydrophobicContact CB-CD1 3.91Å; E266-I316 VanDerWaalsContact CD-CD1 3.43Å; E266-I316 HydrophobicContact CG-CD1 3.4Å
267	Q	97	Very high	95.9	Very high	109 Å²	109	53 Å²	53	51%	0.509	26%	0.257	S	S	.	.	H	α-helix	trans	-58.2	-47.7	176.8	-175.6	-173.4	11.9	0	0	112.3	D263 R264 I265 E271	D263-Q267 WeakPolarHBondContact O-CB 3.46Å; D263-Q267 PolarHBondContact O-N 3.32Å; R264-Q267 PolarHBondContact O-N 3.33Å; I265-Q267 VanDerWaalsContact C-N 3.28Å; I265-Q267 PolarHBondContact O-N 2.96Å; Q267-E271 PolarHBondContact O-N 3.43Å; Q267-E271 VanDerWaalsContact O-N 3.11Å
268	I	97.2	Very high	96	Very high	2 Å²	2	50.6 Å²	50.6	1%	0.01	25%	0.248	C	C	.	.	H	α-helix	trans	-63.8	-47.5	-179.1	-65.3	167.9	0	0	0	110.1	W185 W189 V202 A203 R264 I265 E266 E271 A272	W185-I268 HydrophobicContact CH2-CG2 4.1Å; W185-I268 HydrophobicContact CZ2-CG2 3.93Å; W189-I268 HydrophobicContact CH2-CD1 3.68Å; W189-I268 HydrophobicContact CH2-CG1 3.86Å; W189-I268 HydrophobicContact CZ2-CD1 4.06Å; W189-I268 HydrophobicContact CZ2-CG1 3.81Å; W189-I268 HydrophobicContact CZ2-CG2 4.3Å; V202-I268 HydrophobicContact CB-CD1 4.33Å; V202-I268 HydrophobicContact CG1-CB 4.3Å; V202-I268 HydrophobicContact CG1-CD1 4.05Å; V202-I268 HydrophobicContact CG1-CG2 4.15Å; A203-I268 HydrophobicContact CB-CG2 4.07Å; R264-I268 HydrophobicContact CG-CD1 4.31Å; R264-I268 VanDerWaalsContact O-CG1 3.28Å; R264-I268 WeakPolarHBondContact O-CG1 3.27Å; R264-I268 PolarHBondContact O-N 3.02Å; R264-I268 VanDerWaalsContact O-N 3.11Å; I265-I268 PolarHBondContact O-N 3.04Å; I265-I268 VanDerWaalsContact O-N 3.09Å; E266-I268 PolarHBondContact O-N 3.03Å; I268-E271 PolarHBondContact O-N 2.92Å; I268-A272 PolarHBondContact O-N 2.73Å
269	I	97.7	Very high	96	Very high	0 Å²	0	47.2 Å²	47.2	0%	0	23%	0.232	C	C	.	.	H	α-helix	trans	-64.7	-44.2	-179	-63.3	-55.2	0	0	0	111.3	A206 I210 I265 E266 E271 A272 V273 A304 L307 L308	A206-I269 HydrophobicContact CB-CD1 3.92Å; I210-I269 HydrophobicContact CD1-CD1 3.99Å; I210-I269 HydrophobicContact CD1-CG2 3.94Å; I265-I269 HydrophobicContact CG2-CG1 4.16Å; I265-I269 WeakPolarHBondContact O-CG1 3.15Å; I265-I269 PolarHBondContact O-N 3.36Å; E266-I269 PolarHBondContact O-N 3.17Å; I269-E271 VanDerWaalsContact C-N 3.33Å; I269-E271 PolarHBondContact O-N 3.18Å; I269-A272 PolarHBondContact O-N 3.28Å; I269-V273 HydrophobicContact CG2-CG2 4.28Å; I269-V273 WeakPolarHBondContact O-CG2 3.42Å; I269-V273 PolarHBondContact O-N 3.32Å; I269-A304 HydrophobicContact CG2-CB 3.93Å; I269-L307 HydrophobicContact CD1-CD2 3.68Å; I269-L307 HydrophobicContact CD1-CG 4.17Å; I269-L308 HydrophobicContact CB-CD2 4.14Å; I269-L308 HydrophobicContact CG1-CD2 3.87Å; I269-L308 HydrophobicContact CG1-CG 4.37Å; I269-L308 HydrophobicContact CG2-CD1 4.18Å; I269-L308 HydrophobicContact CG2-CD2 4.22Å; I269-L308 HydrophobicContact CG2-CG 4.07Å
270	R	97.8	Very high	95.9	Very high	99 Å²	99	43 Å²	43	37%	0.374	21%	0.214	S	C	.	.	H	α-helix	trans	-62.2	-39.5	177.3	-75.1	-176.6	-178.6	-73.4	6.7	112.7	E266 A272 A274 I316	E266-R270 HydrophobicContact CG-CG 4.23Å; E266-R270 VanDerWaalsContact O-CB 3.31Å; E266-R270 WeakPolarHBondContact O-CB 3.42Å; E266-R270 VanDerWaalsContact O-CG 3.25Å; E266-R270 WeakPolarHBondContact O-CG 3.5Å; E266-R270 PolarHBondContact O-N 2.93Å; E266-R270 IonicContact OE1-CZ 3.19Å; E266-R270 IonicContact OE1-NE 3.93Å; E266-R270 PolarHBondContact OE1-NE 3.13Å; E266-R270 IonicContact OE1-NH2 3.59Å; E266-R270 PolarHBondContact OE1-NH2 3.46Å; R270-A272 VanDerWaalsContact C-N 3.35Å; R270-A274 WeakPolarHBondContact O-CB 2.97Å; R270-A274 PolarHBondContact O-N 3.43Å; R270-I316 VanDerWaalsContact NH1-CG2 3.25Å
271	E	97.1	Very high	95.8	Very high	70 Å²	70	44.4 Å²	44.4	33%	0.327	22%	0.222	S	C	.	.	H	α-helix	trans	-63.1	-44.6	175.2	-168.1	-175.7	-176.6	0	0	110.5	W185 R188 Q267 I268 I269 A274 I275	W185-E271 VanDerWaalsContact CD1-CD 3.49Å; W185-E271 PolarHBondContact NE1-OE1 3.44Å; W185-E271 PolarHBondContact NE1-OE2 2.91Å; R188-E271 IonicContact CZ-OE1 2.73Å; R188-E271 IonicContact NH1-OE1 2.71Å; R188-E271 IonicContact NH2-OE1 3.88Å; R188-E271 PolarHBondContact NH2-OE1 3.11Å; R188-E271 IonicContact NH2-OE2 3.15Å; Q267-E271 PolarHBondContact O-N 3.43Å; Q267-E271 VanDerWaalsContact O-N 3.11Å; I268-E271 PolarHBondContact O-N 2.92Å; I269-E271 VanDerWaalsContact C-N 3.33Å; I269-E271 PolarHBondContact O-N 3.18Å; E271-A274 PolarHBondContact O-N 3.04Å; E271-I275 HydrophobicContact CG-CD1 4.11Å; E271-I275 VanDerWaalsContact O-CG1 3.31Å; E271-I275 WeakPolarHBondContact O-CG1 3.27Å; E271-I275 PolarHBondContact O-N 3.25Å; E271-I275 VanDerWaalsContact O-N 3.12Å
272	A	96.5	Very high	95.5	Very high	0 Å²	0	48.1 Å²	48.1	0%	0	23%	0.232	C	C	.	.	H	α-helix	trans	-62.3	-46	177.4	0	0	0	0	0	112.3	W185 A206 I210 F211 I268 I269 R270 A274 I275 E276	W185-A272 HydrophobicContact CZ2-CB 4.4Å; A206-A272 HydrophobicContact CB-CB 4.06Å; I210-A272 HydrophobicContact CD1-CB 4.33Å; F211-A272 HydrophobicContact CD1-CB 4.37Å; F211-A272 HydrophobicContact CE1-CB 3.74Å; F211-A272 WeakPolarHBondContact CE1-O 3.4Å; F211-A272 HydrophobicContact CZ-CB 4.34Å; I268-A272 PolarHBondContact O-N 2.73Å; I269-A272 PolarHBondContact O-N 3.28Å; R270-A272 VanDerWaalsContact C-N 3.35Å; A272-A274 PolarHBondContact O-N 3.43Å; A272-I275 PolarHBondContact O-N 3.08Å; A272-E276 WeakPolarHBondContact O-CB 3.46Å; A272-E276 PolarHBondContact O-N 2.84Å
273	V	97.2	Very high	95	Very high	1 Å²	1	45.4 Å²	45.4	1%	0.006	23%	0.229	C	C	.	.	H	α-helix	trans	-58.7	-46.6	176.7	169.8	0	0	0	0	111.6	I210 I269 I275 E276 Q277 I300 E301 A304 Y317	I210-V273 HydrophobicContact CD1-CG2 4.32Å; I210-V273 HydrophobicContact CG2-CG2 4.5Å; I269-V273 HydrophobicContact CG2-CG2 4.28Å; I269-V273 WeakPolarHBondContact O-CG2 3.42Å; I269-V273 PolarHBondContact O-N 3.32Å; V273-I275 VanDerWaalsContact C-N 3.32Å; V273-I275 PolarHBondContact O-N 3.45Å; V273-E276 PolarHBondContact O-N 3.42Å; V273-Q277 HydrophobicContact CG1-CG 4.19Å; V273-Q277 WeakPolarHBondContact O-CB 3.39Å; V273-Q277 VanDerWaalsContact O-CG 3.31Å; V273-Q277 WeakPolarHBondContact O-CG 3.46Å; V273-Q277 PolarHBondContact O-N 3.27Å; V273-I300 HydrophobicContact CB-CG2 4.41Å; V273-I300 HydrophobicContact CG1-CG2 4.05Å; V273-I300 HydrophobicContact CG2-CG2 4.27Å; V273-E301 HydrophobicContact CG1-CG 4.44Å; V273-A304 HydrophobicContact CG2-CB 3.33Å; V273-Y317 HydrophobicContact CG1-CE1 4.49Å; V273-Y317 HydrophobicContact CG2-CE2 4.26Å
274	A	96.5	Very high	94.7	Very high	53 Å²	53	39.5 Å²	39.5	44%	0.438	20%	0.197	S	C	.	.	H	α-helix	trans	-62	-41.5	-179.4	0	0	0	0	0	112	R270 E271 A272 E278	R270-A274 WeakPolarHBondContact O-CB 2.97Å; R270-A274 PolarHBondContact O-N 3.43Å; E271-A274 PolarHBondContact O-N 3.04Å; A272-A274 PolarHBondContact O-N 3.43Å; A274-E278 WeakPolarHBondContact O-CB 3.33Å; A274-E278 PolarHBondContact O-N 2.86Å; A274-E278 VanDerWaalsContact O-N 3.09Å
275	I	95.2	Very high	94.5	Very high	16 Å²	16	37.4 Å²	37.4	8%	0.082	19%	0.193	C	C	.	.	H	α-helix	trans	-64.9	-42.9	176.6	-68.1	168.2	0	0	0	110.8	K182 W185 F211 E271 A272 V273 E278 F279	K182-I275 HydrophobicContact CG-CG2 3.62Å; W185-I275 HydrophobicContact CB-CD1 4.05Å; W185-I275 HydrophobicContact CG-CD1 3.78Å; F211-I275 HydrophobicContact CE1-CB 4.18Å; F211-I275 HydrophobicContact CE1-CG2 4.1Å; F211-I275 HydrophobicContact CZ-CB 4.44Å; F211-I275 HydrophobicContact CZ-CD1 4.35Å; F211-I275 HydrophobicContact CZ-CG2 4.17Å; E271-I275 HydrophobicContact CG-CD1 4.11Å; E271-I275 VanDerWaalsContact O-CG1 3.31Å; E271-I275 WeakPolarHBondContact O-CG1 3.27Å; E271-I275 PolarHBondContact O-N 3.25Å; E271-I275 VanDerWaalsContact O-N 3.12Å; A272-I275 PolarHBondContact O-N 3.08Å; V273-I275 VanDerWaalsContact C-N 3.32Å; V273-I275 PolarHBondContact O-N 3.45Å; I275-E278 PolarHBondContact O-N 3.3Å; I275-F279 WeakPolarHBondContact O-CB 3.29Å; I275-F279 PolarHBondContact O-N 3.36Å
276	E	95.2	Very high	94.3	Very high	0 Å²	0	37.3 Å²	37.3	0%	0	19%	0.192	C	C	.	.	H	α-helix	trans	-67.6	-42.5	-179.1	-170.5	58.9	-151.2	0	0	112.4	K182 I210 F211 A272 V273 F279 L280 I300	K182-E276 WeakPolarHBondContact CE-OE2 3.46Å; K182-E276 VanDerWaalsContact NZ-CD 3.27Å; K182-E276 IonicContact NZ-OE1 2.71Å; K182-E276 PolarHBondContact NZ-OE1 3.13Å; K182-E276 IonicContact NZ-OE2 3.24Å; K182-E276 PolarHBondContact NZ-OE2 3.27Å; I210-E276 HydrophobicContact CG2-CB 4.21Å; I210-E276 HydrophobicContact CG2-CG 4.42Å; F211-E276 WeakPolarHBondContact CA-OE2 3.38Å; A272-E276 WeakPolarHBondContact O-CB 3.46Å; A272-E276 PolarHBondContact O-N 2.84Å; V273-E276 PolarHBondContact O-N 3.42Å; E276-F279 WeakPolarHBondContact O-CB 3.48Å; E276-F279 PolarHBondContact O-N 2.98Å; E276-L280 HydrophobicContact CG-CD1 4.35Å; E276-L280 PolarHBondContact O-N 2.99Å; E276-L280 VanDerWaalsContact O-N 3.08Å; E276-L280 WeakPolarHBondContact OE1-CD1 3.34Å; E276-I300 HydrophobicContact CB-CG2 4.03Å; E276-I300 HydrophobicContact CG-CD1 3.59Å; E276-I300 HydrophobicContact CG-CG1 3.87Å; E276-I300 HydrophobicContact CG-CG2 4.03Å
277	Q	95.4	Very high	94.1	Very high	39 Å²	39	38.7 Å²	38.7	18%	0.182	20%	0.201	C	C	.	.	H	α-helix	trans	-61.3	-47.6	175.8	-73.2	-178.2	-20	0	0	110.9	V273 F279 L280 T281 C297 I300 E301	V273-Q277 HydrophobicContact CG1-CG 4.19Å; V273-Q277 WeakPolarHBondContact O-CB 3.39Å; V273-Q277 VanDerWaalsContact O-CG 3.31Å; V273-Q277 WeakPolarHBondContact O-CG 3.46Å; V273-Q277 PolarHBondContact O-N 3.27Å; Q277-F279 VanDerWaalsContact C-N 3.29Å; Q277-F279 PolarHBondContact O-N 3.39Å; Q277-L280 PolarHBondContact O-N 2.69Å; Q277-T281 WeakPolarHBondContact O-CB 3.37Å; Q277-T281 VanDerWaalsContact O-CG2 3.3Å; Q277-T281 WeakPolarHBondContact O-CG2 3.29Å; Q277-T281 PolarHBondContact O-N 2.98Å; Q277-T281 PolarHBondContact O-OG1 3.18Å; Q277-C297 HydrophobicContact CG-CB 4.12Å; Q277-C297 PolarHBondContact NE2-O 3.36Å; Q277-I300 HydrophobicContact CG-CB 4.36Å; Q277-I300 HydrophobicContact CG-CG2 4.3Å; Q277-E301 PolarHBondContact NE2-OE1 2.97Å; Q277-E301 VanDerWaalsContact NE2-OE1 3.1Å
278	E	94	Very high	93.9	Very high	70 Å²	70	35.2 Å²	35.2	33%	0.327	19%	0.186	S	C	.	.	H	α-helix	trans	-59.2	-41.3	176.1	-175.7	-175.6	139.1	0	0	111.8	K181 A274 I275 L280 T281 E282 A283	K181-E278 IonicContact NZ-OE1 3.76Å; K181-E278 PolarHBondContact NZ-OE1 3.14Å; K181-E278 IonicContact NZ-OE2 3.53Å; K181-E278 PolarHBondContact NZ-OE2 2.84Å; A274-E278 WeakPolarHBondContact O-CB 3.33Å; A274-E278 PolarHBondContact O-N 2.86Å; A274-E278 VanDerWaalsContact O-N 3.09Å; I275-E278 PolarHBondContact O-N 3.3Å; E278-L280 PolarHBondContact O-N 3.31Å; E278-T281 PolarHBondContact O-N 3.31Å; E278-E282 HydrophobicContact CG-CB 4.39Å; E278-E282 WeakPolarHBondContact O-CB 3.47Å; E278-E282 PolarHBondContact O-N 2.73Å; E278-A283 PolarHBondContact O-N 3.1Å; E278-A283 VanDerWaalsContact O-N 3.07Å
279	F	92.9	Very high	93.7	Very high	6 Å²	6	35.2 Å²	35.2	3%	0.026	19%	0.186	C	C	.	.	I	π-helix	trans	-58.8	-47.3	177.7	-177.5	-99.5	0	0	0	112	F109 C178 V179 K182 I275 E276 Q277 L284	F109-F279 HydrophobicContact CB-CZ 4.15Å; F109-F279 HydrophobicContact CD1-CZ 4.43Å; F109-F279 HydrophobicContact CD2-CZ 4.39Å; F109-F279 HydrophobicContact CG-CZ 4.04Å; C178-F279 HydrophobicContact CB-CD2 3.91Å; C178-F279 HydrophobicContact CB-CE2 4.12Å; V179-F279 HydrophobicContact CG2-CE2 4.35Å; K182-F279 HydrophobicContact CD-CD2 4.11Å; K182-F279 HydrophobicContact CD-CE2 4.46Å; K182-F279 HydrophobicContact CD-CG 4.25Å; I275-F279 WeakPolarHBondContact O-CB 3.29Å; I275-F279 PolarHBondContact O-N 3.36Å; E276-F279 WeakPolarHBondContact O-CB 3.48Å; E276-F279 PolarHBondContact O-N 2.98Å; Q277-F279 VanDerWaalsContact C-N 3.29Å; Q277-F279 PolarHBondContact O-N 3.39Å; F279-L284 HydrophobicContact CE1-CD2 4.28Å; F279-L284 HydrophobicContact CZ-CB 4.39Å; F279-L284 HydrophobicContact CZ-CD2 4.03Å; F279-L284 CarbonylContact O-C 3.58Å; F279-L284 WeakPolarHBondContact O-CA 3.36Å; F279-L284 PolarHBondContact O-N 3.42Å
280	L	92.8	Very high	93.4	Very high	0 Å²	0	38 Å²	38	0%	0	21%	0.214	C	C	.	.	I	π-helix	trans	-89.4	-4.2	-174.4	-65.9	173.8	0	0	0	115	G214 E276 Q277 E278 P285 V286 M296 I300	G214-L280 VanDerWaalsContact CA-CD1 3.47Å; E276-L280 HydrophobicContact CG-CD1 4.35Å; E276-L280 PolarHBondContact O-N 2.99Å; E276-L280 VanDerWaalsContact O-N 3.08Å; E276-L280 WeakPolarHBondContact OE1-CD1 3.34Å; Q277-L280 PolarHBondContact O-N 2.69Å; E278-L280 PolarHBondContact O-N 3.31Å; L280-P285 WeakPolarHBondContact O-CA 3.46Å; L280-V286 HydrophobicContact CB-CG1 3.89Å; L280-V286 HydrophobicContact CD2-CG1 3.74Å; L280-V286 HydrophobicContact CG-CG1 4.28Å; L280-V286 PolarHBondContact O-N 3.23Å; L280-M296 HydrophobicContact CB-CG 3.94Å; L280-M296 HydrophobicContact CD1-CG 3.64Å; L280-M296 HydrophobicContact CD1-SD 3.86Å; L280-M296 HydrophobicContact CG-CG 4.4Å; L280-I300 HydrophobicContact CD1-CD1 4.27Å
281	T	91	Very high	93.2	Very high	38 Å²	38	33.8 Å²	33.8	23%	0.233	20%	0.199	C	C	.	.	I	π-helix	trans	-117.3	-34.3	-178.9	61.5	0	0	0	0	114.2	Q277 E278 P285 C293 C297	Q277-T281 WeakPolarHBondContact O-CB 3.37Å; Q277-T281 VanDerWaalsContact O-CG2 3.3Å; Q277-T281 WeakPolarHBondContact O-CG2 3.29Å; Q277-T281 PolarHBondContact O-N 2.98Å; Q277-T281 PolarHBondContact O-OG1 3.18Å; E278-T281 PolarHBondContact O-N 3.31Å; T281-P285 WeakPolarHBondContact O-CG 3.35Å; T281-C293 HydrophobicContact CG2-CB 3.75Å; T281-C297 WeakPolarHBondContact CG2-SG 3.35Å
282	E	88.6	Confident	93.1	Very high	147 Å²	147	34.4 Å²	34.4	69%	0.687	21%	0.205	S	C	*	.	I	π-helix	trans	-112	-50.3	-177	-60.7	-175	-153.9	0	0	111.1	E278	E278-E282 HydrophobicContact CG-CB 4.39Å; E278-E282 WeakPolarHBondContact O-CB 3.47Å; E278-E282 PolarHBondContact O-N 2.73Å
283	A	86	Confident	93	Very high	44 Å²	44	35.7 Å²	35.7	36%	0.364	21%	0.214	S	C	.	.	I	π-helix	trans	-83.3	-41.7	-166.2	0	0	0	0	0	113.3	C178 E278	C178-A283 HydrophobicContact CB-CB 3.26Å; E278-A283 PolarHBondContact O-N 3.1Å; E278-A283 VanDerWaalsContact O-N 3.07Å
284	L	89.8	Confident	92.9	Very high	1 Å²	1	40.9 Å²	40.9	1%	0.005	25%	0.245	C	C	.	.	S	Bend	trans	-137.8	76.6	172.1	-170	65.9	0	0	0	108.8	F102 Y105 V106 F279 V286 L288	F102-L284 HydrophobicContact CD2-CD1 4.25Å; F102-L284 HydrophobicContact CD2-CD2 4.2Å; F102-L284 HydrophobicContact CD2-CG 3.74Å; F102-L284 HydrophobicContact CE2-CD2 4.23Å; F102-L284 HydrophobicContact CE2-CG 3.95Å; Y105-L284 HydrophobicContact CD1-CD1 4.26Å; Y105-L284 HydrophobicContact CG-CD1 4.18Å; V106-L284 HydrophobicContact CG2-CD2 3.72Å; F279-L284 HydrophobicContact CE1-CD2 4.28Å; F279-L284 HydrophobicContact CZ-CB 4.39Å; F279-L284 HydrophobicContact CZ-CD2 4.03Å; F279-L284 CarbonylContact O-C 3.58Å; F279-L284 WeakPolarHBondContact O-CA 3.36Å; F279-L284 PolarHBondContact O-N 3.42Å; L284-V286 PolarHBondContact O-N 2.84Å; L284-L288 HydrophobicContact CD1-CD1 4.49Å
285	P	92.4	Very high	92.9	Very high	25 Å²	25	41.4 Å²	41.4	16%	0.162	24%	0.24	C	C	.	.			trans	-63.8	129.5	-169.6	-24.7	36.2	0	0	0	113.1	L280 T281 N287 L288	L280-P285 WeakPolarHBondContact O-CA 3.46Å; T281-P285 WeakPolarHBondContact O-CG 3.35Å; P285-N287 VanDerWaalsContact CB-OD1 3.28Å; P285-N287 WeakPolarHBondContact CB-OD1 3.34Å; P285-N287 PolarHBondContact O-N 3.14Å; P285-N287 VanDerWaalsContact O-N 3.1Å; P285-L288 WeakPolarHBondContact O-CB 3.36Å; P285-L288 WeakPolarHBondContact O-CD1 3.47Å; P285-L288 WeakPolarHBondContact O-CG 3.32Å; P285-L288 PolarHBondContact O-N 2.94Å; P285-L288 VanDerWaalsContact O-N 3.11Å
286	V	92.3	Very high	92.9	Very high	0 Å²	0	40.7 Å²	40.7	0%	0	24%	0.236	C	C	.	.	G	3₁₀ helix	trans	-67.4	-11.9	177.8	-61.7	0	0	0	0	113.6	F102 L280 L284 L288 I289 M291 C293 M296	F102-V286 HydrophobicContact CE2-CB 4.35Å; F102-V286 HydrophobicContact CE2-CG1 3.85Å; F102-V286 HydrophobicContact CZ-CG1 3.91Å; L280-V286 HydrophobicContact CB-CG1 3.89Å; L280-V286 HydrophobicContact CD2-CG1 3.74Å; L280-V286 HydrophobicContact CG-CG1 4.28Å; L280-V286 PolarHBondContact O-N 3.23Å; L284-V286 PolarHBondContact O-N 2.84Å; V286-L288 PolarHBondContact O-N 3.49Å; V286-I289 WeakPolarHBondContact O-CG1 3.32Å; V286-I289 PolarHBondContact O-N 3.19Å; V286-M291 HydrophobicContact CB-CB 3.93Å; V286-M291 HydrophobicContact CG2-CB 3.91Å; V286-M291 PolarHBondContact O-N 3.37Å; V286-M291 VanDerWaalsContact O-N 3.11Å; V286-C293 HydrophobicContact CG2-CB 4.47Å; V286-M296 HydrophobicContact CG1-CE 3.98Å; V286-M296 HydrophobicContact CG1-CG 4.23Å; V286-M296 HydrophobicContact CG2-CB 3.92Å; V286-M296 HydrophobicContact CG2-CG 4.3Å
287	N	93.7	Very high	93	Very high	92 Å²	92	41.9 Å²	41.9	49%	0.492	24%	0.244	S	C	.	.	G	3₁₀ helix	trans	-60.9	-21.9	171.3	68.7	14.4	0	0	0	112.7	P285 I289 G290 M291	P285-N287 VanDerWaalsContact CB-OD1 3.28Å; P285-N287 WeakPolarHBondContact CB-OD1 3.34Å; P285-N287 PolarHBondContact O-N 3.14Å; P285-N287 VanDerWaalsContact O-N 3.1Å; N287-I289 PolarHBondContact O-N 3.09Å; N287-G290 PolarHBondContact O-N 3.27Å; N287-M291 VanDerWaalsContact CA-O 3.29Å; N287-M291 WeakPolarHBondContact CA-O 3.36Å; N287-M291 PolarHBondContact N-O 3.22Å
288	L	92.6	Very high	93.1	Very high	36 Å²	36	42.9 Å²	42.9	19%	0.188	25%	0.249	C	C	.	.	G	3₁₀ helix	trans	-63.2	-28.7	177.8	-65.2	174.6	0	0	0	112	N98 F102 L284 P285 V286	N98-L288 HydrophobicContact CB-CB 4.12Å; N98-L288 HydrophobicContact CB-CD2 3.84Å; F102-L288 HydrophobicContact CB-CB 4.17Å; F102-L288 HydrophobicContact CB-CD1 4.41Å; F102-L288 HydrophobicContact CD2-CB 4.35Å; F102-L288 HydrophobicContact CD2-CD1 4.38Å; L284-L288 HydrophobicContact CD1-CD1 4.49Å; P285-L288 WeakPolarHBondContact O-CB 3.36Å; P285-L288 WeakPolarHBondContact O-CD1 3.47Å; P285-L288 WeakPolarHBondContact O-CG 3.32Å; P285-L288 PolarHBondContact O-N 2.94Å; P285-L288 VanDerWaalsContact O-N 3.11Å; V286-L288 PolarHBondContact O-N 3.49Å
289	I	93	Very high	93.2	Very high	3 Å²	3	40.5 Å²	40.5	2%	0.015	24%	0.237	C	C	.	.	G	3₁₀ helix	trans	-103.8	8.9	175.3	59.9	167	0	0	0	113	E99 F102 S218 W221 L222 R225 V286 N287 M291	E99-I289 HydrophobicContact CG-CG2 4.28Å; F102-I289 HydrophobicContact CB-CG2 3.81Å; F102-I289 HydrophobicContact CD1-CD1 4.05Å; F102-I289 HydrophobicContact CD1-CG1 4.35Å; F102-I289 HydrophobicContact CD1-CG2 3.52Å; F102-I289 HydrophobicContact CE1-CD1 3.66Å; F102-I289 HydrophobicContact CE1-CG1 4.32Å; F102-I289 HydrophobicContact CE1-CG2 4.27Å; F102-I289 HydrophobicContact CG-CG2 3.68Å; F102-I289 HydrophobicContact CZ-CD1 4.06Å; S218-I289 WeakPolarHBondContact O-CD1 3.39Å; W221-I289 PolarHBondContact NE1-O 3.43Å; L222-I289 HydrophobicContact CD2-CG2 4.49Å; R225-I289 PolarHBondContact NH1-O 3.44Å; V286-I289 WeakPolarHBondContact O-CG1 3.32Å; V286-I289 PolarHBondContact O-N 3.19Å; N287-I289 PolarHBondContact O-N 3.09Å; I289-M291 HydrophobicContact CD1-CG 4.06Å; I289-M291 HydrophobicContact CD1-SD 3.73Å; I289-M291 HydrophobicContact CG1-CG 4.11Å; I289-M291 HydrophobicContact CG1-SD 4.39Å
290	G	92.4	Very high	93.3	Very high	57 Å²	57	40.2 Å²	40.2	59%	0.588	24%	0.236	S	C	*	.	T	Hydrogen-bonded Turn	trans	84.4	12.4	178	0	0	0	0	0	115.4	N287	N287-G290 PolarHBondContact O-N 3.27Å
291	M	93.7	Very high	93.5	Very high	11 Å²	11	42.6 Å²	42.6	5%	0.054	25%	0.247	C	C	.	.			trans	-85.4	156.8	172.8	-65.4	-176.3	79.3	0	0	111.7	W221 V286 N287 I289 M296 F323 F325	W221-M291 HydrophobicContact CB-CE 4.1Å; W221-M291 HydrophobicContact CB-CG 4.01Å; W221-M291 HydrophobicContact CB-SD 3.48Å; W221-M291 WeakPolarHBondContact CB-SD 3.47Å; W221-M291 VanDerWaalsContact CD1-CG 3.48Å; W221-M291 HydrophobicContact CD2-CG 3.69Å; W221-M291 HydrophobicContact CD2-SD 4.31Å; W221-M291 HydrophobicContact CE3-CG 4.42Å; W221-M291 HydrophobicContact CG-CE 4.41Å; W221-M291 HydrophobicContact CG-CG 3.46Å; W221-M291 VanDerWaalsContact CG-CG 3.46Å; W221-M291 HydrophobicContact CG-SD 3.66Å; V286-M291 HydrophobicContact CB-CB 3.93Å; V286-M291 HydrophobicContact CG2-CB 3.91Å; V286-M291 PolarHBondContact O-N 3.37Å; V286-M291 VanDerWaalsContact O-N 3.11Å; N287-M291 VanDerWaalsContact CA-O 3.29Å; N287-M291 WeakPolarHBondContact CA-O 3.36Å; N287-M291 PolarHBondContact N-O 3.22Å; I289-M291 HydrophobicContact CD1-CG 4.06Å; I289-M291 HydrophobicContact CD1-SD 3.73Å; I289-M291 HydrophobicContact CG1-CG 4.11Å; I289-M291 HydrophobicContact CG1-SD 4.39Å; M291-M296 HydrophobicContact CE-CE 3.53Å; M291-M296 HydrophobicContact SD-CE 3.98Å; M291-F323 HydrophobicContact CE-CD1 4.36Å; M291-F323 HydrophobicContact CE-CD2 4.49Å; M291-F323 HydrophobicContact CE-CE1 3.78Å; M291-F323 HydrophobicContact CE-CE2 3.92Å; M291-F323 HydrophobicContact CE-CZ 3.54Å; M291-F325 HydrophobicContact CE-CZ 4.03Å
292	N	94.4	Very high	93.8	Very high	83 Å²	83	44.5 Å²	44.5	44%	0.444	25%	0.251	S	S	.	.			trans	-88.6	119.8	177.6	-174.9	-55.6	0	0	0	110.6	V294 L295 M296	N292-V294 VanDerWaalsContact C-N 3.3Å; N292-V294 PolarHBondContact O-N 3.2Å; N292-V294 WeakPolarHBondContact OD1-CA 3.25Å; N292-V294 VanDerWaalsContact OD1-CB 3.26Å; N292-V294 WeakPolarHBondContact OD1-CB 3.28Å; N292-V294 PolarHBondContact OD1-N 3.49Å; N292-L295 HydrophobicContact CB-CB 4.09Å; N292-L295 HydrophobicContact CB-CD1 3.94Å; N292-L295 HydrophobicContact CB-CG 3.9Å; N292-L295 PolarHBondContact O-N 3.15Å; N292-L295 PolarHBondContact OD1-N 2.9Å; N292-L295 VanDerWaalsContact OD1-N 3.16Å; N292-M296 PolarHBondContact O-N 3.4Å
293	C	94.3	Very high	94.1	Very high	28 Å²	28	37.8 Å²	37.8	19%	0.189	22%	0.22	C	C	.	.	H	α-helix	trans	-58.6	-36.8	179.3	-64	0	0	0	0	113.5	T281 V286 M296 C297	T281-C293 HydrophobicContact CG2-CB 3.75Å; V286-C293 HydrophobicContact CG2-CB 4.47Å; C293-M296 PolarHBondContact O-N 3.28Å; C293-C297 PolarHBondContact O-N 2.77Å; C293-C297 PolarHBondContact O-SG 3.14Å
294	V	95.4	Very high	94.6	Very high	109 Å²	109	35.7 Å²	35.7	66%	0.661	20%	0.202	S	C	*	.	H	α-helix	trans	-67.2	-42.9	178.2	-178.6	0	0	0	0	110.6	N292 M296 C297 Q298	N292-V294 VanDerWaalsContact C-N 3.3Å; N292-V294 PolarHBondContact O-N 3.2Å; N292-V294 WeakPolarHBondContact OD1-CA 3.25Å; N292-V294 VanDerWaalsContact OD1-CB 3.26Å; N292-V294 WeakPolarHBondContact OD1-CB 3.28Å; N292-V294 PolarHBondContact OD1-N 3.49Å; V294-M296 VanDerWaalsContact C-N 3.29Å; V294-M296 PolarHBondContact O-N 2.98Å; V294-C297 PolarHBondContact O-N 3.1Å; V294-Q298 PolarHBondContact O-N 2.84Å
295	L	95.8	Very high	94.9	Very high	64 Å²	64	35.8 Å²	35.8	34%	0.335	20%	0.203	S	C	.	.	H	α-helix	trans	-66.1	-34.7	174.4	-61.6	-176.7	0	0	0	111.3	N292 Q298 Y299 P322 F323	N292-L295 HydrophobicContact CB-CB 4.09Å; N292-L295 HydrophobicContact CB-CD1 3.94Å; N292-L295 HydrophobicContact CB-CG 3.9Å; N292-L295 PolarHBondContact O-N 3.15Å; N292-L295 PolarHBondContact OD1-N 2.9Å; N292-L295 VanDerWaalsContact OD1-N 3.16Å; L295-Q298 PolarHBondContact O-N 3.43Å; L295-Y299 PolarHBondContact O-N 3.41Å; L295-P322 HydrophobicContact CB-CB 4.12Å; L295-P322 HydrophobicContact CB-CG 4.26Å; L295-P322 HydrophobicContact CD2-CB 3.99Å; L295-P322 HydrophobicContact CG-CB 4.49Å; L295-P322 WeakPolarHBondContact O-CG 3.25Å; L295-F323 HydrophobicContact CB-CE1 3.89Å; L295-F323 HydrophobicContact CB-CZ 3.96Å
296	M	95.8	Very high	95	Very high	1 Å²	1	39 Å²	39	1%	0.005	21%	0.211	C	C	.	.	H	α-helix	trans	-63.4	-44.7	173.6	-174	57.1	77.1	0	0	111.4	A217 S218 L280 V286 M291 N292 C293 V294 Q298 Y299 I300 F323	A217-M296 HydrophobicContact CB-CE 4.16Å; S218-M296 WeakPolarHBondContact OG-CE 3.39Å; L280-M296 HydrophobicContact CB-CG 3.94Å; L280-M296 HydrophobicContact CD1-CG 3.64Å; L280-M296 HydrophobicContact CD1-SD 3.86Å; L280-M296 HydrophobicContact CG-CG 4.4Å; V286-M296 HydrophobicContact CG1-CE 3.98Å; V286-M296 HydrophobicContact CG1-CG 4.23Å; V286-M296 HydrophobicContact CG2-CB 3.92Å; V286-M296 HydrophobicContact CG2-CG 4.3Å; M291-M296 HydrophobicContact CE-CE 3.53Å; M291-M296 HydrophobicContact SD-CE 3.98Å; N292-M296 PolarHBondContact O-N 3.4Å; C293-M296 PolarHBondContact O-N 3.28Å; V294-M296 VanDerWaalsContact C-N 3.29Å; V294-M296 PolarHBondContact O-N 2.98Å; M296-Q298 VanDerWaalsContact C-N 3.32Å; M296-Q298 PolarHBondContact O-N 3.38Å; M296-Y299 WeakPolarHBondContact O-CB 3.11Å; M296-Y299 PolarHBondContact O-N 3.21Å; M296-Y299 VanDerWaalsContact O-N 3.1Å; M296-Y299 HydrophobicContact SD-CD1 4.01Å; M296-I300 WeakPolarHBondContact O-CG1 3.4Å; M296-I300 PolarHBondContact O-N 3.2Å; M296-I300 HydrophobicContact SD-CD1 4.46Å; M296-F323 HydrophobicContact CB-CZ 4.48Å; M296-F323 HydrophobicContact CE-CE2 4Å; M296-F323 HydrophobicContact CE-CZ 4.26Å; M296-F323 HydrophobicContact SD-CE2 4Å
297	C	96.7	Very high	95	Very high	25 Å²	25	39.1 Å²	39.1	17%	0.169	21%	0.212	C	C	.	.	H	α-helix	trans	-57.6	-44.7	174.3	-70	0	0	0	0	112.5	Q277 T281 C293 V294 Y299 I300 E301	Q277-C297 HydrophobicContact CG-CB 4.12Å; Q277-C297 PolarHBondContact NE2-O 3.36Å; T281-C297 WeakPolarHBondContact CG2-SG 3.35Å; C293-C297 PolarHBondContact O-N 2.77Å; C293-C297 PolarHBondContact O-SG 3.14Å; V294-C297 PolarHBondContact O-N 3.1Å; C297-Y299 VanDerWaalsContact C-N 3.3Å; C297-Y299 PolarHBondContact O-N 3.33Å; C297-I300 PolarHBondContact O-N 3.49Å; C297-E301 WeakPolarHBondContact O-CG 3.27Å; C297-E301 PolarHBondContact O-N 3.27Å
298	Q	97	Very high	95.2	Very high	61 Å²	61	34.8 Å²	34.8	29%	0.285	19%	0.189	S	C	.	.	H	α-helix	trans	-61	-38.9	175.8	180	-176.5	-15.4	0	0	111.8	V294 L295 M296 E301 Y302 A319 E320 P322	V294-Q298 PolarHBondContact O-N 2.84Å; L295-Q298 PolarHBondContact O-N 3.43Å; M296-Q298 VanDerWaalsContact C-N 3.32Å; M296-Q298 PolarHBondContact O-N 3.38Å; Q298-E301 PolarHBondContact O-N 2.65Å; Q298-Y302 PolarHBondContact O-N 3.07Å; Q298-A319 HydrophobicContact CG-CB 4.13Å; Q298-E320 WeakPolarHBondContact CG-O 3.48Å; Q298-E320 PolarHBondContact NE2-O 3.49Å; Q298-P322 HydrophobicContact CB-CG 4.24Å; Q298-P322 HydrophobicContact CG-CG 4.22Å
299	Y	95.7	Very high	95.3	Very high	19 Å²	19	36.3 Å²	36.3	8%	0.075	20%	0.2	C	C	.	.	H	α-helix	trans	-64.3	-44	175.6	176.1	-107	0	0	0	112.2	A217 L295 M296 C297 E301 Y302 V303 N321 F323 M326	A217-Y299 HydrophobicContact CB-CD1 4.02Å; A217-Y299 HydrophobicContact CB-CE1 3.59Å; L295-Y299 PolarHBondContact O-N 3.41Å; M296-Y299 WeakPolarHBondContact O-CB 3.11Å; M296-Y299 PolarHBondContact O-N 3.21Å; M296-Y299 VanDerWaalsContact O-N 3.1Å; M296-Y299 HydrophobicContact SD-CD1 4.01Å; C297-Y299 VanDerWaalsContact C-N 3.3Å; C297-Y299 PolarHBondContact O-N 3.33Å; Y299-E301 VanDerWaalsContact C-N 3.29Å; Y299-E301 PolarHBondContact O-N 3.11Å; Y299-Y302 HydrophobicContact CD2-CD1 4.29Å; Y299-Y302 HydrophobicContact CE2-CD1 4.3Å; Y299-Y302 WeakPolarHBondContact O-CB 3.46Å; Y299-Y302 PolarHBondContact O-N 3.08Å; Y299-V303 HydrophobicContact CD1-CG2 4.42Å; Y299-V303 HydrophobicContact CD2-CG2 4.38Å; Y299-V303 HydrophobicContact CE1-CG2 3.89Å; Y299-V303 HydrophobicContact CE2-CG2 3.86Å; Y299-V303 WeakPolarHBondContact O-CG2 3.2Å; Y299-V303 PolarHBondContact O-N 3.17Å; Y299-N321 WeakPolarHBondContact CD2-OD1 3.41Å; Y299-F323 VanDerWaalsContact CB-CE2 3.45Å; Y299-F323 HydrophobicContact CD1-CD2 4.19Å; Y299-F323 HydrophobicContact CD1-CE2 4.17Å; Y299-F323 AromaticContact CD2-CD2 3.76Å; Y299-F323 HydrophobicContact CD2-CD2 3.76Å; Y299-F323 HydrophobicContact CD2-CE2 4.37Å; Y299-F323 HydrophobicContact CE2-CD2 4.5Å; Y299-F323 AromaticContact CG-CD2 3.59Å; Y299-F323 HydrophobicContact CG-CD2 3.59Å; Y299-F323 AromaticContact CG-CE2 3.74Å; Y299-F323 HydrophobicContact CG-CE2 3.74Å; Y299-M326 HydrophobicContact CE2-CB 4.45Å; Y299-M326 HydrophobicContact CE2-CG 4.03Å; Y299-M326 WeakPolarHBondContact OH-CE 3.28Å
300	I	96	Very high	95.3	Very high	0 Å²	0	41 Å²	41	0%	0	22%	0.222	C	C	.	.	H	α-helix	trans	-60.1	-41.6	175.3	-61.2	-49.6	0	0	0	111	I210 S213 V273 E276 Q277 L280 M296 C297 V303 A304	I210-I300 HydrophobicContact CG2-CG2 4.08Å; S213-I300 WeakPolarHBondContact OG-CD1 3.15Å; V273-I300 HydrophobicContact CB-CG2 4.41Å; V273-I300 HydrophobicContact CG1-CG2 4.05Å; V273-I300 HydrophobicContact CG2-CG2 4.27Å; E276-I300 HydrophobicContact CB-CG2 4.03Å; E276-I300 HydrophobicContact CG-CD1 3.59Å; E276-I300 HydrophobicContact CG-CG1 3.87Å; E276-I300 HydrophobicContact CG-CG2 4.03Å; Q277-I300 HydrophobicContact CG-CB 4.36Å; Q277-I300 HydrophobicContact CG-CG2 4.3Å; L280-I300 HydrophobicContact CD1-CD1 4.27Å; M296-I300 WeakPolarHBondContact O-CG1 3.4Å; M296-I300 PolarHBondContact O-N 3.2Å; M296-I300 HydrophobicContact SD-CD1 4.46Å; C297-I300 PolarHBondContact O-N 3.49Å; I300-V303 PolarHBondContact O-N 3.41Å; I300-A304 WeakPolarHBondContact O-CB 3.4Å; I300-A304 PolarHBondContact O-N 3.36Å
301	E	97.8	Very high	95.4	Very high	50 Å²	50	38.4 Å²	38.4	23%	0.234	19%	0.194	C	C	.	.	H	α-helix	trans	-63.1	-41.3	175.7	-72.4	174.9	177.8	0	0	112.4	V273 Q277 C297 Q298 Y299 A304 D305 Y317 A319	V273-E301 HydrophobicContact CG1-CG 4.44Å; Q277-E301 PolarHBondContact NE2-OE1 2.97Å; Q277-E301 VanDerWaalsContact NE2-OE1 3.1Å; C297-E301 WeakPolarHBondContact O-CG 3.27Å; C297-E301 PolarHBondContact O-N 3.27Å; Q298-E301 PolarHBondContact O-N 2.65Å; Y299-E301 VanDerWaalsContact C-N 3.29Å; Y299-E301 PolarHBondContact O-N 3.11Å; E301-A304 PolarHBondContact O-N 3.4Å; E301-D305 PolarHBondContact O-N 2.86Å; E301-Y317 HydrophobicContact CB-CD1 4.05Å; E301-Y317 HydrophobicContact CB-CD2 4.2Å; E301-Y317 HydrophobicContact CB-CG 3.73Å; E301-Y317 HydrophobicContact CG-CD1 3.49Å; E301-Y317 VanDerWaalsContact CG-CD1 3.49Å; E301-Y317 HydrophobicContact CG-CD2 4.29Å; E301-Y317 HydrophobicContact CG-CE1 3.89Å; E301-Y317 HydrophobicContact CG-CG 3.71Å; E301-A319 HydrophobicContact CB-CB 3.68Å
302	Y	96	Very high	95.5	Very high	79 Å²	79	42.1 Å²	42.1	31%	0.31	21%	0.214	S	C	.	.	H	α-helix	trans	-60.9	-45.5	174.5	163.9	-97.9	0	0	0	111.8	Q298 Y299 D305 R306 A319 N321	Q298-Y302 PolarHBondContact O-N 3.07Å; Y299-Y302 HydrophobicContact CD2-CD1 4.29Å; Y299-Y302 HydrophobicContact CE2-CD1 4.3Å; Y299-Y302 WeakPolarHBondContact O-CB 3.46Å; Y299-Y302 PolarHBondContact O-N 3.08Å; Y302-D305 PolarHBondContact O-N 3.34Å; Y302-R306 PolarHBondContact O-N 3.37Å; Y302-R306 VanDerWaalsContact O-N 3.09Å; Y302-A319 WeakPolarHBondContact CD2-O 3.41Å; Y302-N321 HydrophobicContact CD1-CB 3.93Å; Y302-N321 HydrophobicContact CD2-CB 4.11Å; Y302-N321 HydrophobicContact CE1-CB 3.84Å; Y302-N321 HydrophobicContact CE2-CB 4.01Å; Y302-N321 HydrophobicContact CG-CB 4.07Å
303	V	94.6	Very high	95.5	Very high	6 Å²	6	38.8 Å²	38.8	4%	0.036	20%	0.197	C	C	.	.	H	α-helix	trans	-64.9	-40.9	177.5	173.7	0	0	0	0	111.1	G209 Y299 I300 R306 L307	G209-V303 WeakPolarHBondContact O-CG1 3.49Å; Y299-V303 HydrophobicContact CD1-CG2 4.42Å; Y299-V303 HydrophobicContact CD2-CG2 4.38Å; Y299-V303 HydrophobicContact CE1-CG2 3.89Å; Y299-V303 HydrophobicContact CE2-CG2 3.86Å; Y299-V303 WeakPolarHBondContact O-CG2 3.2Å; Y299-V303 PolarHBondContact O-N 3.17Å; I300-V303 PolarHBondContact O-N 3.41Å; V303-R306 WeakPolarHBondContact O-CB 3.23Å; V303-R306 PolarHBondContact O-N 2.88Å; V303-L307 PolarHBondContact O-N 3.36Å
304	A	96.2	Very high	95.6	Very high	0 Å²	0	43 Å²	43	0%	0	22%	0.218	C	C	.	.	H	α-helix	trans	-63.4	-42.3	177.3	0	0	0	0	0	112.4	I210 I269 V273 I300 E301 R306 L307 L308 Y317	I210-A304 HydrophobicContact CD1-CB 4.04Å; I269-A304 HydrophobicContact CG2-CB 3.93Å; V273-A304 HydrophobicContact CG2-CB 3.33Å; I300-A304 WeakPolarHBondContact O-CB 3.4Å; I300-A304 PolarHBondContact O-N 3.36Å; E301-A304 PolarHBondContact O-N 3.4Å; A304-R306 VanDerWaalsContact C-N 3.32Å; A304-R306 PolarHBondContact O-N 3.46Å; A304-L307 PolarHBondContact O-N 3.28Å; A304-L308 VanDerWaalsContact O-CG 3.3Å; A304-L308 WeakPolarHBondContact O-CG 3.47Å; A304-L308 PolarHBondContact O-N 3.32Å; A304-Y317 HydrophobicContact CB-CD2 4.45Å; A304-Y317 HydrophobicContact CB-CE2 4.24Å
305	D	96.7	Very high	95.7	Very high	3 Å²	3	43.2 Å²	43.2	2%	0.016	21%	0.21	C	C	.	.	H	α-helix	trans	-63.3	-37	174.3	-86.2	-11.1	0	0	0	112.6	E301 Y302 L308 V309 K315 I316 Y317 N318 A319	E301-D305 PolarHBondContact O-N 2.86Å; Y302-D305 PolarHBondContact O-N 3.34Å; D305-L308 PolarHBondContact O-N 3.19Å; D305-V309 WeakPolarHBondContact O-CG2 3.02Å; D305-V309 PolarHBondContact O-N 3.2Å; D305-V309 VanDerWaalsContact O-N 3.08Å; D305-K315 HydrophobicContact CB-CB 4.35Å; D305-K315 HydrophobicContact CB-CD 4.24Å; D305-K315 HydrophobicContact CB-CG 4.06Å; D305-I316 PolarHBondContact OD1-N 3.17Å; D305-Y317 PolarHBondContact OD1-N 3.16Å; D305-Y317 PolarHBondContact OD2-N 3.42Å; D305-N318 VanDerWaalsContact OD2-CA 3.25Å; D305-N318 WeakPolarHBondContact OD2-CA 3.24Å; D305-N318 PolarHBondContact OD2-N 3.31Å; D305-A319 PolarHBondContact OD2-N 2.92Å
306	R	94.1	Very high	95.7	Very high	91 Å²	91	42 Å²	42	34%	0.343	20%	0.203	S	C	.	.	H	α-helix	trans	-60	-49.2	173	-174.2	-175.4	71.4	98.5	-3.3	110.4	D247 Y302 V303 A304 L308 V309 E310	D247-R306 IonicContact OD1-NH1 3.98Å; Y302-R306 PolarHBondContact O-N 3.37Å; Y302-R306 VanDerWaalsContact O-N 3.09Å; V303-R306 WeakPolarHBondContact O-CB 3.23Å; V303-R306 PolarHBondContact O-N 2.88Å; A304-R306 VanDerWaalsContact C-N 3.32Å; A304-R306 PolarHBondContact O-N 3.46Å; R306-L308 VanDerWaalsContact C-N 3.34Å; R306-L308 PolarHBondContact O-N 2.81Å; R306-V309 PolarHBondContact O-N 3.49Å; R306-E310 PolarHBondContact O-N 2.91Å; R306-E310 VanDerWaalsContact O-N 3.13Å
307	L	93.8	Very high	95.7	Very high	3 Å²	3	44.6 Å²	44.6	2%	0.016	21%	0.214	C	C	.	.	H	α-helix	trans	-63.1	-39.3	178.7	-179.7	55.2	0	0	0	112.1	A205 A206 I210 C250 I269 V303 A304 V309 E310 L311	A205-L307 HydrophobicContact CB-CD1 4.1Å; A205-L307 HydrophobicContact CB-CD2 4.47Å; A206-L307 HydrophobicContact CB-CD2 4.47Å; I210-L307 HydrophobicContact CD1-CD2 3.96Å; I210-L307 HydrophobicContact CG1-CD2 4.06Å; C250-L307 VanDerWaalsContact SG-CD1 3.51Å; I269-L307 HydrophobicContact CD1-CD2 3.68Å; I269-L307 HydrophobicContact CD1-CG 4.17Å; V303-L307 PolarHBondContact O-N 3.36Å; A304-L307 PolarHBondContact O-N 3.28Å; L307-V309 VanDerWaalsContact C-N 3.33Å; L307-V309 PolarHBondContact O-N 3.34Å; L307-E310 PolarHBondContact O-N 3.19Å; L307-L311 HydrophobicContact CD1-CD1 3.92Å; L307-L311 HydrophobicContact CD1-CG 4.1Å; L307-L311 HydrophobicContact CG-CD1 3.94Å; L307-L311 WeakPolarHBondContact O-CB 3.38Å; L307-L311 VanDerWaalsContact O-CG 3.29Å; L307-L311 WeakPolarHBondContact O-CG 3.39Å; L307-L311 PolarHBondContact O-N 3.32Å
308	L	96.7	Very high	95.7	Very high	1 Å²	1	48.9 Å²	48.9	1%	0.005	24%	0.235	C	C	.	.	H	α-helix	trans	-59.1	-43.7	175.1	-75.4	163.9	0	0	0	111.9	I265 I269 A304 D305 R306 L311 D312 C313 I316	I265-L308 HydrophobicContact CG2-CD2 4.05Å; I269-L308 HydrophobicContact CB-CD2 4.14Å; I269-L308 HydrophobicContact CG1-CD2 3.87Å; I269-L308 HydrophobicContact CG1-CG 4.37Å; I269-L308 HydrophobicContact CG2-CD1 4.18Å; I269-L308 HydrophobicContact CG2-CD2 4.22Å; I269-L308 HydrophobicContact CG2-CG 4.07Å; A304-L308 VanDerWaalsContact O-CG 3.3Å; A304-L308 WeakPolarHBondContact O-CG 3.47Å; A304-L308 PolarHBondContact O-N 3.32Å; D305-L308 PolarHBondContact O-N 3.19Å; R306-L308 VanDerWaalsContact C-N 3.34Å; R306-L308 PolarHBondContact O-N 2.81Å; L308-L311 CarbonylContact O-C 3.59Å; L308-L311 PolarHBondContact O-N 2.99Å; L308-D312 PolarHBondContact O-N 2.62Å; L308-C313 HydrophobicContact CB-CB 4.16Å; L308-C313 HydrophobicContact CD2-CB 3.95Å; L308-C313 WeakPolarHBondContact O-CA 3.5Å; L308-C313 VanDerWaalsContact O-CB 3.29Å; L308-C313 WeakPolarHBondContact O-CB 3.42Å; L308-C313 PolarHBondContact O-N 3.09Å; L308-I316 HydrophobicContact CD1-CB 4Å; L308-I316 HydrophobicContact CD1-CD1 3.61Å; L308-I316 HydrophobicContact CD1-CG1 3.81Å; L308-I316 HydrophobicContact CD2-CD1 4.3Å
309	V	94.8	Very high	95.5	Very high	69 Å²	69	46.7 Å²	46.7	42%	0.418	23%	0.227	S	C	.	.	H	α-helix	trans	-64	-43.5	178.2	171	0	0	0	0	111.6	D305 R306 L307 L311 D312 K315	D305-V309 WeakPolarHBondContact O-CG2 3.02Å; D305-V309 PolarHBondContact O-N 3.2Å; D305-V309 VanDerWaalsContact O-N 3.08Å; R306-V309 PolarHBondContact O-N 3.49Å; L307-V309 VanDerWaalsContact C-N 3.33Å; L307-V309 PolarHBondContact O-N 3.34Å; V309-L311 PolarHBondContact O-N 3.31Å; V309-D312 PolarHBondContact O-N 3.33Å; V309-D312 VanDerWaalsContact O-N 3.09Å; V309-K315 HydrophobicContact CG2-CD 4.42Å; V309-K315 HydrophobicContact CG2-CG 3.67Å
310	E	93.3	Very high	95.4	Very high	101 Å²	101	53.1 Å²	53.1	47%	0.472	26%	0.258	S	S	.	.	H	α-helix	trans	-63.9	-24.9	175.9	-66.4	-61.4	149.6	0	0	112.7	C250 R306 L307 D312	C250-E310 HydrophobicContact CB-CB 4.08Å; R306-E310 PolarHBondContact O-N 2.91Å; R306-E310 VanDerWaalsContact O-N 3.13Å; L307-E310 PolarHBondContact O-N 3.19Å; E310-D312 VanDerWaalsContact C-N 3.32Å
311	L	94.9	Very high	95.3	Very high	2 Å²	2	54.6 Å²	54.6	1%	0.01	27%	0.266	C	S	.	.	T	Hydrogen-bonded Turn	trans	-92.5	21.6	174.6	-64.1	173.1	0	0	0	113.3	V202 F253 I265 L307 L308 V309 C313	V202-L311 HydrophobicContact CG1-CD1 4.04Å; V202-L311 HydrophobicContact CG2-CD1 4.44Å; V202-L311 HydrophobicContact CG2-CD2 4.42Å; F253-L311 HydrophobicContact CB-CD2 4.01Å; F253-L311 HydrophobicContact CD1-CD2 3.68Å; F253-L311 HydrophobicContact CD2-CD2 4.29Å; F253-L311 HydrophobicContact CE1-CB 4.4Å; F253-L311 HydrophobicContact CE1-CD2 4.24Å; F253-L311 HydrophobicContact CG-CD2 3.72Å; I265-L311 HydrophobicContact CG2-CB 4.3Å; I265-L311 HydrophobicContact CG2-CD1 3.94Å; L307-L311 HydrophobicContact CD1-CD1 3.92Å; L307-L311 HydrophobicContact CD1-CG 4.1Å; L307-L311 HydrophobicContact CG-CD1 3.94Å; L307-L311 WeakPolarHBondContact O-CB 3.38Å; L307-L311 VanDerWaalsContact O-CG 3.29Å; L307-L311 WeakPolarHBondContact O-CG 3.39Å; L307-L311 PolarHBondContact O-N 3.32Å; L308-L311 CarbonylContact O-C 3.59Å; L308-L311 PolarHBondContact O-N 2.99Å; V309-L311 PolarHBondContact O-N 3.31Å; L311-C313 PolarHBondContact O-N 3.28Å; L311-C313 PolarHBondContact O-SG 3.19Å
312	D	94.4	Very high	95.1	Very high	90 Å²	90	53.8 Å²	53.8	48%	0.481	27%	0.265	S	S	.	.	T	Hydrogen-bonded Turn	trans	57.7	25.9	-179.4	-63.1	-52.8	0	0	0	114.8	K259 K262 L308 V309 E310	K259-D312 IonicContact NZ-OD2 3.91Å; K259-D312 PolarHBondContact NZ-OD2 3.19Å; K262-D312 VanDerWaalsContact CE-O 3.25Å; K262-D312 WeakPolarHBondContact CE-O 3.38Å; K262-D312 PolarHBondContact NZ-O 3.27Å; L308-D312 PolarHBondContact O-N 2.62Å; V309-D312 PolarHBondContact O-N 3.33Å; V309-D312 VanDerWaalsContact O-N 3.09Å; E310-D312 VanDerWaalsContact C-N 3.32Å
313	C	95.3	Very high	94.8	Very high	12 Å²	12	50.6 Å²	50.6	8%	0.081	25%	0.253	C	S	.	.	P	Polyproline II helix	trans	-103.3	157.5	176.5	-65.2	0	0	0	0	111.8	I265 L308 L311	I265-C313 VanDerWaalsContact CD1-SG 3.56Å; L308-C313 HydrophobicContact CB-CB 4.16Å; L308-C313 HydrophobicContact CD2-CB 3.95Å; L308-C313 WeakPolarHBondContact O-CA 3.5Å; L308-C313 VanDerWaalsContact O-CB 3.29Å; L308-C313 WeakPolarHBondContact O-CB 3.42Å; L308-C313 PolarHBondContact O-N 3.09Å; L311-C313 PolarHBondContact O-N 3.28Å; L311-C313 PolarHBondContact O-SG 3.19Å
314	D	96.3	Very high	94.4	Very high	117 Å²	117	54.2 Å²	54.2	63%	0.626	27%	0.272	S	S	*	.	P	Polyproline II helix	trans	-78.2	148.7	175.7	-60	-68.4	0	0	0	109.6	K262	K262-D314 IonicContact NZ-OD2 2.7Å; K262-D314 PolarHBondContact NZ-OD2 2.96Å
315	K	96.8	Very high	93.8	Very high	114 Å²	114	54.8 Å²	54.8	50%	0.496	27%	0.274	S	S	.	.	P	Polyproline II helix	trans	-62	142.3	174.9	-65.9	-172.5	-179.4	-172.6	0	110.6	D305 V309	D305-K315 HydrophobicContact CB-CB 4.35Å; D305-K315 HydrophobicContact CB-CD 4.24Å; D305-K315 HydrophobicContact CB-CG 4.06Å; V309-K315 HydrophobicContact CG2-CD 4.42Å; V309-K315 HydrophobicContact CG2-CG 3.67Å
316	I	96	Very high	93	Very high	37 Å²	37	56.1 Å²	56.1	19%	0.19	28%	0.281	C	S	.	.	S	Bend	trans	-107	-45.5	-176	-74.4	177.1	0	0	0	111.1	E266 R270 D305 L308	E266-I316 HydrophobicContact CB-CD1 3.91Å; E266-I316 VanDerWaalsContact CD-CD1 3.43Å; E266-I316 HydrophobicContact CG-CD1 3.4Å; R270-I316 VanDerWaalsContact NH1-CG2 3.25Å; D305-I316 PolarHBondContact OD1-N 3.17Å; L308-I316 HydrophobicContact CD1-CB 4Å; L308-I316 HydrophobicContact CD1-CD1 3.61Å; L308-I316 HydrophobicContact CD1-CG1 3.81Å; L308-I316 HydrophobicContact CD2-CD1 4.3Å
317	Y	96.1	Very high	91.8	Very high	57 Å²	57	57.3 Å²	57.3	22%	0.224	29%	0.29	C	S	.	.	S	Bend	trans	-91.8	-30.5	-171.2	-60.9	-82.5	0	0	0	111.7	V273 E301 A304 D305 A319	V273-Y317 HydrophobicContact CG1-CE1 4.49Å; V273-Y317 HydrophobicContact CG2-CE2 4.26Å; E301-Y317 HydrophobicContact CB-CD1 4.05Å; E301-Y317 HydrophobicContact CB-CD2 4.2Å; E301-Y317 HydrophobicContact CB-CG 3.73Å; E301-Y317 HydrophobicContact CG-CD1 3.49Å; E301-Y317 VanDerWaalsContact CG-CD1 3.49Å; E301-Y317 HydrophobicContact CG-CD2 4.29Å; E301-Y317 HydrophobicContact CG-CE1 3.89Å; E301-Y317 HydrophobicContact CG-CG 3.71Å; A304-Y317 HydrophobicContact CB-CD2 4.45Å; A304-Y317 HydrophobicContact CB-CE2 4.24Å; D305-Y317 PolarHBondContact OD1-N 3.16Å; D305-Y317 PolarHBondContact OD2-N 3.42Å; Y317-A319 PolarHBondContact O-N 3.4Å
318	N	96.2	Very high	89.8	Confident	114 Å²	114	61.4 Å²	61.4	61%	0.61	31%	0.311	S	S	*	.			trans	50.9	37.1	-171.3	-60.1	-82.5	0	0	0	112.1	D305	D305-N318 VanDerWaalsContact OD2-CA 3.25Å; D305-N318 WeakPolarHBondContact OD2-CA 3.24Å; D305-N318 PolarHBondContact OD2-N 3.31Å
319	A	94.4	Very high	87.8	Confident	16 Å²	16	62.8 Å²	62.8	13%	0.132	32%	0.317	C	S	.	.			trans	-78.7	144	179.9	0	0	0	0	0	111	Q298 E301 Y302 D305 Y317	Q298-A319 HydrophobicContact CG-CB 4.13Å; E301-A319 HydrophobicContact CB-CB 3.68Å; Y302-A319 WeakPolarHBondContact CD2-O 3.41Å; D305-A319 PolarHBondContact OD2-N 2.92Å; Y317-A319 PolarHBondContact O-N 3.4Å
320	E	93.7	Very high	85.3	Confident	153 Å²	153	63.9 Å²	63.9	72%	0.715	33%	0.328	S	S	*	.			trans	-93.4	152	171.3	-64.1	-177.1	163	0	0	110.2	Q298 P322	Q298-E320 WeakPolarHBondContact CG-O 3.48Å; Q298-E320 PolarHBondContact NE2-O 3.49Å; E320-P322 VanDerWaalsContact O-CD 3.23Å; E320-P322 WeakPolarHBondContact O-CD 3.46Å
321	N	93.2	Very high	82.2	Confident	31 Å²	31	64.5 Å²	64.5	17%	0.166	33%	0.334	C	S	.	.			trans	-65.8	115.9	175	177.4	19	0	0	0	110.5	Y299 Y302 F323	Y299-N321 WeakPolarHBondContact CD2-OD1 3.41Å; Y302-N321 HydrophobicContact CD1-CB 3.93Å; Y302-N321 HydrophobicContact CD2-CB 4.11Å; Y302-N321 HydrophobicContact CE1-CB 3.84Å; Y302-N321 HydrophobicContact CE2-CB 4.01Å; Y302-N321 HydrophobicContact CG-CB 4.07Å; N321-F323 VanDerWaalsContact C-N 3.33Å; N321-F323 PolarHBondContact ND2-O 3.06Å; N321-F323 VanDerWaalsContact ND2-O 3.09Å; N321-F323 PolarHBondContact OD1-N 2.95Å; N321-F323 PolarHBondContact OD1-O 3.46Å
322	P	93.3	Very high	79.3	Confident	33 Å²	33	69.6 Å²	69.6	21%	0.214	36%	0.358	C	S	.	.			trans	-84.4	-7.7	-179.7	32.8	-30.4	0	0	0	113.4	L295 Q298 E320	L295-P322 HydrophobicContact CB-CB 4.12Å; L295-P322 HydrophobicContact CB-CG 4.26Å; L295-P322 HydrophobicContact CD2-CB 3.99Å; L295-P322 HydrophobicContact CG-CB 4.49Å; L295-P322 WeakPolarHBondContact O-CG 3.25Å; Q298-P322 HydrophobicContact CB-CG 4.24Å; Q298-P322 HydrophobicContact CG-CG 4.22Å; E320-P322 VanDerWaalsContact O-CD 3.23Å; E320-P322 WeakPolarHBondContact O-CD 3.46Å
323	F	90.8	Very high	76.4	Confident	12 Å²	12	65.8 Å²	65.8	5%	0.053	34%	0.34	C	S	.	.			trans	-112.8	95.8	-173.4	-60.6	-43.9	0	0	0	111.3	M291 L295 M296 Y299 N321 F325 M326	M291-F323 HydrophobicContact CE-CD1 4.36Å; M291-F323 HydrophobicContact CE-CD2 4.49Å; M291-F323 HydrophobicContact CE-CE1 3.78Å; M291-F323 HydrophobicContact CE-CE2 3.92Å; M291-F323 HydrophobicContact CE-CZ 3.54Å; L295-F323 HydrophobicContact CB-CE1 3.89Å; L295-F323 HydrophobicContact CB-CZ 3.96Å; M296-F323 HydrophobicContact CB-CZ 4.48Å; M296-F323 HydrophobicContact CE-CE2 4Å; M296-F323 HydrophobicContact CE-CZ 4.26Å; M296-F323 HydrophobicContact SD-CE2 4Å; Y299-F323 VanDerWaalsContact CB-CE2 3.45Å; Y299-F323 HydrophobicContact CD1-CD2 4.19Å; Y299-F323 HydrophobicContact CD1-CE2 4.17Å; Y299-F323 AromaticContact CD2-CD2 3.76Å; Y299-F323 HydrophobicContact CD2-CD2 3.76Å; Y299-F323 HydrophobicContact CD2-CE2 4.37Å; Y299-F323 HydrophobicContact CE2-CD2 4.5Å; Y299-F323 AromaticContact CG-CD2 3.59Å; Y299-F323 HydrophobicContact CG-CD2 3.59Å; Y299-F323 AromaticContact CG-CE2 3.74Å; Y299-F323 HydrophobicContact CG-CE2 3.74Å; N321-F323 VanDerWaalsContact C-N 3.33Å; N321-F323 PolarHBondContact ND2-O 3.06Å; N321-F323 VanDerWaalsContact ND2-O 3.09Å; N321-F323 PolarHBondContact OD1-N 2.95Å; N321-F323 PolarHBondContact OD1-O 3.46Å; F323-F325 HydrophobicContact CB-CD1 4.07Å; F323-F325 HydrophobicContact CB-CE1 3.59Å; F323-F325 HydrophobicContact CB-CE2 4.23Å; F323-F325 HydrophobicContact CB-CZ 3.68Å; F323-F325 AromaticContact CD1-CE1 3.68Å; F323-F325 HydrophobicContact CD1-CE1 3.68Å; F323-F325 AromaticContact CD1-CZ 3.93Å; F323-F325 HydrophobicContact CD1-CZ 3.93Å; F323-F325 HydrophobicContact CD2-CZ 4.31Å; F323-F325 AromaticContact CG-CE1 3.79Å; F323-F325 HydrophobicContact CG-CE1 3.79Å; F323-F325 AromaticContact CG-CZ 3.71Å; F323-F325 HydrophobicContact CG-CZ 3.71Å; F323-F325 PolarHBondContact O-N 2.69Å; F323-M326 HydrophobicContact CB-CB 4.38Å; F323-M326 HydrophobicContact CB-CG 3.76Å; F323-M326 WeakPolarHBondContact O-CB 3.32Å; F323-M326 PolarHBondContact O-N 3.01Å
324	D	86.4	Confident	73.2	Confident	82 Å²	82	72.6 Å²	72.6	44%	0.439	37%	0.369	S	S	.	.	H	α-helix	trans	-51.4	-38.9	176.4	62.7	-14.7	0	0	0	113.5	K224 M326 E327 M328	K224-D324 IonicContact NZ-OD1 3.57Å; K224-D324 PolarHBondContact NZ-OD1 3.37Å; K224-D324 IonicContact NZ-OD2 2.84Å; K224-D324 PolarHBondContact NZ-OD2 3.36Å; D324-M326 PolarHBondContact O-N 3.1Å; D324-E327 PolarHBondContact O-N 2.91Å; D324-E327 VanDerWaalsContact O-N 3.13Å; D324-M328 HydrophobicContact CB-CE 4.47Å; D324-M328 PolarHBondContact O-N 3.42Å
325	F	83.2	Confident	69.8	Low	12 Å²	12	69.6 Å²	69.6	5%	0.053	35%	0.354	C	S	.	.	H	α-helix	trans	-66.1	-23.9	-179.1	61.2	-94.6	0	0	0	113.1	F220 W221 K224 M291 F323 E327 M328 I329	F220-F325 HydrophobicContact CB-CD2 4.01Å; F220-F325 HydrophobicContact CB-CE2 3.87Å; W221-F325 HydrophobicContact CB-CZ 4.39Å; W221-F325 HydrophobicContact CE3-CD1 4.44Å; W221-F325 AromaticContact CE3-CE1 3.76Å; W221-F325 HydrophobicContact CE3-CE1 3.76Å; W221-F325 HydrophobicContact CE3-CZ 4.14Å; W221-F325 HydrophobicContact CZ3-CE1 4.22Å; K224-F325 HydrophobicContact CD-CB 4.1Å; K224-F325 HydrophobicContact CD-CD1 3.9Å; K224-F325 HydrophobicContact CD-CG 4.19Å; M291-F325 HydrophobicContact CE-CZ 4.03Å; F323-F325 HydrophobicContact CB-CD1 4.07Å; F323-F325 HydrophobicContact CB-CE1 3.59Å; F323-F325 HydrophobicContact CB-CE2 4.23Å; F323-F325 HydrophobicContact CB-CZ 3.68Å; F323-F325 AromaticContact CD1-CE1 3.68Å; F323-F325 HydrophobicContact CD1-CE1 3.68Å; F323-F325 AromaticContact CD1-CZ 3.93Å; F323-F325 HydrophobicContact CD1-CZ 3.93Å; F323-F325 HydrophobicContact CD2-CZ 4.31Å; F323-F325 AromaticContact CG-CE1 3.79Å; F323-F325 HydrophobicContact CG-CE1 3.79Å; F323-F325 AromaticContact CG-CZ 3.71Å; F323-F325 HydrophobicContact CG-CZ 3.71Å; F323-F325 PolarHBondContact O-N 2.69Å; F325-E327 VanDerWaalsContact C-N 3.26Å; F325-E327 PolarHBondContact O-N 3.38Å; F325-M328 PolarHBondContact O-N 2.97Å; F325-I329 HydrophobicContact CD2-CD1 4.41Å; F325-I329 VanDerWaalsContact O-CD1 3.23Å; F325-I329 WeakPolarHBondContact O-CD1 3.4Å; F325-I329 VanDerWaalsContact O-CG1 3.3Å; F325-I329 WeakPolarHBondContact O-CG1 3.37Å; F325-I329 PolarHBondContact O-N 3.29Å
326	M	79	Confident	66.4	Low	31 Å²	31	70.4 Å²	70.4	15%	0.153	36%	0.364	C	S	.	.	H	α-helix	trans	-67.7	-27.9	175	-67.2	-56.1	-70.7	0	0	112.2	A217 F220 Y299 F323 D324 I329	A217-M326 HydrophobicContact CB-CE 4.24Å; A217-M326 HydrophobicContact CB-SD 4.02Å; F220-M326 HydrophobicContact CB-SD 4Å; F220-M326 HydrophobicContact CD2-CE 3.73Å; F220-M326 HydrophobicContact CD2-SD 3.6Å; F220-M326 VanDerWaalsContact CD2-SD 3.6Å; F220-M326 HydrophobicContact CE2-CE 4.07Å; F220-M326 HydrophobicContact CE2-SD 4.43Å; F220-M326 HydrophobicContact CG-SD 4.13Å; Y299-M326 HydrophobicContact CE2-CB 4.45Å; Y299-M326 HydrophobicContact CE2-CG 4.03Å; Y299-M326 WeakPolarHBondContact OH-CE 3.28Å; F323-M326 HydrophobicContact CB-CB 4.38Å; F323-M326 HydrophobicContact CB-CG 3.76Å; F323-M326 WeakPolarHBondContact O-CB 3.32Å; F323-M326 PolarHBondContact O-N 3.01Å; D324-M326 PolarHBondContact O-N 3.1Å; M326-I329 HydrophobicContact SD-CD1 4.1Å
327	E	68.7	Low	63.2	Low	116 Å²	116	75.9 Å²	75.9	54%	0.542	39%	0.387	S	S	.	.	H	α-helix	trans	-79.5	-33.8	173.8	-60	-177.4	176.9	0	0	111.8	D324 F325 I329	D324-E327 PolarHBondContact O-N 2.91Å; D324-E327 VanDerWaalsContact O-N 3.13Å; F325-E327 VanDerWaalsContact C-N 3.26Å; F325-E327 PolarHBondContact O-N 3.38Å; E327-I329 VanDerWaalsContact C-N 3.34Å; E327-I329 PolarHBondContact O-N 2.7Å
328	M	51.6	Low	60.1	Low	90 Å²	90	82.2 Å²	82.2	44%	0.443	42%	0.416	S	S	.	.	H	α-helix	trans	-69.4	-29.2	-178.5	-64.2	-178.9	-174.4	0	0	112.8	D324 F325 S330 L331 E332	D324-M328 HydrophobicContact CB-CE 4.47Å; D324-M328 PolarHBondContact O-N 3.42Å; F325-M328 PolarHBondContact O-N 2.97Å; M328-S330 VanDerWaalsContact C-N 3.33Å; M328-S330 PolarHBondContact O-N 3.29Å; M328-L331 CarbonylContact O-C 3.52Å; M328-L331 WeakPolarHBondContact O-CA 3.18Å; M328-L331 WeakPolarHBondContact O-CB 3.3Å; M328-L331 PolarHBondContact O-N 2.63Å; M328-E332 WeakPolarHBondContact O-CG 3.43Å; M328-E332 PolarHBondContact O-N 3.29Å
329	I	54.8	Low	57.2	Low	29 Å²	29	84.9 Å²	84.9	15%	0.149	43%	0.425	C	S	.	.	H	α-helix	trans	-64.6	-38.3	-178.7	-69.8	151.5	0	0	0	111.7	F220 E236 F325 M326 E327 L331 E332	F220-I329 HydrophobicContact CB-CD1 3.66Å; F220-I329 HydrophobicContact CD1-CD1 3.16Å; F220-I329 HydrophobicContact CD1-CG1 3.96Å; F220-I329 HydrophobicContact CD2-CD1 3.66Å; F220-I329 HydrophobicContact CE1-CD1 3.56Å; F220-I329 HydrophobicContact CE1-CG1 4.05Å; F220-I329 HydrophobicContact CE1-CG2 3.77Å; F220-I329 HydrophobicContact CE2-CD1 4.01Å; F220-I329 HydrophobicContact CG-CD1 3.21Å; F220-I329 HydrophobicContact CG-CG1 4.43Å; F220-I329 HydrophobicContact CZ-CD1 3.96Å; F220-I329 HydrophobicContact CZ-CG2 3.83Å; E236-I329 HydrophobicContact CG-CG2 4.44Å; F325-I329 HydrophobicContact CD2-CD1 4.41Å; F325-I329 VanDerWaalsContact O-CD1 3.23Å; F325-I329 WeakPolarHBondContact O-CD1 3.4Å; F325-I329 VanDerWaalsContact O-CG1 3.3Å; F325-I329 WeakPolarHBondContact O-CG1 3.37Å; F325-I329 PolarHBondContact O-N 3.29Å; M326-I329 HydrophobicContact SD-CD1 4.1Å; E327-I329 VanDerWaalsContact C-N 3.34Å; E327-I329 PolarHBondContact O-N 2.7Å; I329-L331 PolarHBondContact O-N 3.31Å; I329-L331 VanDerWaalsContact O-N 3.15Å; I329-E332 PolarHBondContact O-N 2.7Å
330	S	43.2	Very low	54.4	Low	93 Å²	93	93.1 Å²	93.1	65%	0.65	45%	0.452	S	S	*	.	H	α-helix	trans	-64.1	-15	172	-55	0	0	0	0	113.5	M328	M328-S330 VanDerWaalsContact C-N 3.33Å; M328-S330 PolarHBondContact O-N 3.29Å
331	L	29	Very low	51.9	Low	114 Å²	114	93.2 Å²	93.2	60%	0.597	45%	0.45	S	S	*	.	H	α-helix	trans	-103.9	-35.3	-179.2	-79	153.5	0	0	0	112.8	M328 I329 G333 K334	M328-L331 CarbonylContact O-C 3.52Å; M328-L331 WeakPolarHBondContact O-CA 3.18Å; M328-L331 WeakPolarHBondContact O-CB 3.3Å; M328-L331 PolarHBondContact O-N 2.63Å; I329-L331 PolarHBondContact O-N 3.31Å; I329-L331 VanDerWaalsContact O-N 3.15Å; L331-G333 VanDerWaalsContact C-N 3.3Å; L331-G333 PolarHBondContact O-N 2.74Å; L331-K334 PolarHBondContact O-N 3.2Å
332	E	32.3	Very low	49.1	Very low	108 Å²	108	92.9 Å²	92.9	51%	0.505	45%	0.449	S	S	.	.	H	α-helix	trans	-72.8	-18.2	-178.2	-76.8	-176.6	174.9	0	0	113.6	K223 M328 I329 K334	K223-E332 IonicContact NZ-OE2 3.91Å; K223-E332 PolarHBondContact NZ-OE2 2.81Å; M328-E332 WeakPolarHBondContact O-CG 3.43Å; M328-E332 PolarHBondContact O-N 3.29Å; I329-E332 PolarHBondContact O-N 2.7Å; E332-K334 PolarHBondContact O-N 2.79Å
333	G	34.3	Very low	46.7	Very low	11 Å²	11	92 Å²	92	11%	0.113	45%	0.447	C	S	.	.	T	Hydrogen-bonded Turn	trans	-57.1	-15.3	171.4	0	0	0	0	0	114.3	L331 T335	L331-G333 VanDerWaalsContact C-N 3.3Å; L331-G333 PolarHBondContact O-N 2.74Å; G333-T335 PolarHBondContact O-N 3.32Å; G333-T335 VanDerWaalsContact O-N 3.09Å
334	K	28	Very low	44.2	Very low	155 Å²	155	96.2 Å²	96.2	67%	0.674	47%	0.467	S	S	*	.			trans	-80.9	39.1	175.7	-61.3	-173.5	179.7	178.8	0	114.2	L331 E332 N336	L331-K334 PolarHBondContact O-N 3.2Å; E332-K334 PolarHBondContact O-N 2.79Å; K334-N336 PolarHBondContact O-N 3.1Å
335	T	25.4	Very low	42.2	Very low	53 Å²	53	98.3 Å²	98.3	33%	0.325	47%	0.469	S	S	.	.			trans	-69.1	126.6	169.2	45.1	0	0	0	0	110.3	G333 F337 V342	G333-T335 PolarHBondContact O-N 3.32Å; G333-T335 VanDerWaalsContact O-N 3.09Å; T335-F337 PolarHBondContact O-N 3.14Å; T335-V342 WeakPolarHBondContact O-CG2 3.41Å
336	N	26.2	Very low	40.4	Very low	131 Å²	131	103.7 Å²	103.7	70%	0.701	50%	0.495	S	S	*	.			trans	-54.6	135.6	177.6	-77.7	-42.3	0	0	0	111.1	K334 F338 E339	K334-N336 PolarHBondContact O-N 3.1Å; N336-F338 PolarHBondContact O-N 2.88Å; N336-E339 PolarHBondContact O-N 3.39Å
337	F	28.3	Very low	39	Very low	153 Å²	153	106.6 Å²	106.6	67%	0.671	51%	0.506	S	S	*	.	T	Hydrogen-bonded Turn	trans	-38.7	-20.3	-179.3	-177.2	-96.3	0	0	0	117.2	T335	T335-F337 PolarHBondContact O-N 3.14Å
338	F	31	Very low	38	Very low	190 Å²	190	107.7 Å²	107.7	83%	0.833	53%	0.525	S	S	*	.	T	Hydrogen-bonded Turn	trans	-100.4	-10.6	-176	-73	-79.1	0	0	0	116.1	N336	N336-F338 PolarHBondContact O-N 2.88Å
339	E	34.3	Very low	38.2	Very low	169 Å²	169	105.8 Å²	105.8	79%	0.79	53%	0.529	S	S	*	.	T	Hydrogen-bonded Turn	trans	-109.8	-20.1	-171.9	-70.4	-173.4	172.4	0	0	115.2	N336	N336-E339 PolarHBondContact O-N 3.39Å
340	R	35.7	Very low	38.1	Very low	190 Å²	190	105.5 Å²	105.5	72%	0.717	53%	0.528	S	S	*	.	S	Bend	trans	-150.8	159.4	173.9	-68.5	-170.1	-179.6	-179.8	1.2	110.6	V342	R340-V342 WeakPolarHBondContact O-CG2 3.23Å; R340-V342 PolarHBondContact O-N 3.45Å
341	K	41.8	Very low	38.5	Very low	154 Å²	154	105.2 Å²	105.2	67%	0.67	52%	0.518	S	S	*	.			trans	-61.6	104.2	159.9	-75.5	-173.2	-179	-179.9	0	106.2	G343	K341-G343 PolarHBondContact O-N 3.17Å
342	V	33.7	Very low	39.3	Very low	24 Å²	24	101.2 Å²	101.2	15%	0.145	50%	0.504	C	S	.	.			trans	-66.7	123.2	-173	-174.5	0	0	0	0	108.4	T335 R340 E344 Y345	T335-V342 WeakPolarHBondContact O-CG2 3.41Å; R340-V342 WeakPolarHBondContact O-CG2 3.23Å; R340-V342 PolarHBondContact O-N 3.45Å; V342-E344 HydrophobicContact CG1-CB 4.35Å; V342-E344 PolarHBondContact O-N 3.48Å; V342-Y345 VanDerWaalsContact O-CD2 3.22Å; V342-Y345 WeakPolarHBondContact O-CD2 3.41Å
343	G	43.5	Very low	40	Very low	16 Å²	16	101.6 Å²	101.6	17%	0.165	51%	0.509	C	S	.	.	S	Bend	trans	-68.7	-17.2	178.6	0	0	0	0	0	114	R240 K341 Y345	R240-G343 PolarHBondContact NH1-O 3.26Å; R240-G343 VanDerWaalsContact NH1-O 3.15Å; K341-G343 PolarHBondContact O-N 3.17Å; G343-Y345 PolarHBondContact O-N 3.11Å
344	E	38.4	Very low	40.8	Very low	99 Å²	99	111 Å²	111	46%	0.463	54%	0.543	S	S	.	.			trans	-94.9	70	168.3	-67.2	-176.2	-177.5	0	0	110.5	V342 Q346	V342-E344 HydrophobicContact CG1-CB 4.35Å; V342-E344 PolarHBondContact O-N 3.48Å; E344-Q346 PolarHBondContact O-N 3.32Å
345	Y	43.1	Very low	41.9	Very low	126 Å²	126	111.1 Å²	111.1	49%	0.494	55%	0.551	S	S	.	*			trans	-73.8	104.4	155.6	-93.3	-86.9	0	0	0	107.7	V342 G343	V342-Y345 VanDerWaalsContact O-CD2 3.22Å; V342-Y345 WeakPolarHBondContact O-CD2 3.41Å; G343-Y345 PolarHBondContact O-N 3.11Å
346	Q	45.4	Very low	43.1	Very low	126 Å²	126	116.1 Å²	116.1	59%	0.589	57%	0.571	S	S	*	*			trans	-86.2	107	149.5	-166.3	-177.1	-63.4	0	0	106.1	A75 E344 C348	A75-Q346 HydrophobicContact CB-CG 3.95Å; E344-Q346 PolarHBondContact O-N 3.32Å; Q346-C348 PolarHBondContact O-N 2.89Å; Q346-C348 VanDerWaalsContact O-N 3.14Å
347	K	50.5	Low	44.3	Very low	91 Å²	91	112.8 Å²	112.8	40%	0.396	56%	0.558	S	S	.	*			trans	-53.8	124.6	178.3	-76.7	-179.6	-178.7	172.6	0	110	A75 G349 V350	A75-K347 PolarHBondContact O-N 2.91Å; K347-G349 PolarHBondContact O-N 3.38Å; K347-V350 HydrophobicContact CB-CG2 3.77Å; K347-V350 WeakPolarHBondContact O-CG2 3.37Å; K347-V350 PolarHBondContact O-N 3.22Å
348	C	48.8	Very low	45.2	Very low	139 Å²	139	112.5 Å²	112.5	94%	0.939	56%	0.558	S	S	*	*	T	Hydrogen-bonded Turn	trans	-54.9	129.6	-176.6	-171	0	0	0	0	110.4	Q346	Q346-C348 PolarHBondContact O-N 2.89Å; Q346-C348 VanDerWaalsContact O-N 3.14Å
349	G	55.1	Low	46.3	Very low	50 Å²	50	108.9 Å²	108.9	52%	0.515	55%	0.551	S	S	.	*	T	Hydrogen-bonded Turn	trans	92.7	-14.1	176.4	0	0	0	0	0	116.6	K347 M351 G352	K347-G349 PolarHBondContact O-N 3.38Å; G349-M351 VanDerWaalsContact C-N 3.3Å; G349-M351 PolarHBondContact O-N 2.87Å; G349-G352 PolarHBondContact O-N 2.98Å
350	V	51.6	Low	47.8	Very low	24 Å²	24	109.1 Å²	109.1	15%	0.145	55%	0.55	C	S	.	*	T	Hydrogen-bonded Turn	trans	-67.6	-29.7	-176.3	-178.9	0	0	0	0	112.9	K71 E74 A75 K347	K71-V350 HydrophobicContact CB-CG1 4.49Å; K71-V350 VanDerWaalsContact CE-CG1 3.44Å; K71-V350 WeakPolarHBondContact CE-O 3.49Å; K71-V350 WeakPolarHBondContact O-CG1 3.42Å; E74-V350 HydrophobicContact CB-CG1 4.16Å; E74-V350 HydrophobicContact CG-CG1 4.31Å; A75-V350 HydrophobicContact CB-CB 4.05Å; A75-V350 HydrophobicContact CB-CG1 3.81Å; K347-V350 HydrophobicContact CB-CG2 3.77Å; K347-V350 WeakPolarHBondContact O-CG2 3.37Å; K347-V350 PolarHBondContact O-N 3.22Å
351	M	51.8	Low	49.2	Very low	86 Å²	86	103.6 Å²	103.6	42%	0.424	54%	0.538	S	S	.	.	T	Hydrogen-bonded Turn	trans	-99.3	3.5	176.1	-70.5	-69.2	-153.7	0	0	114	K72 G349 N353	K72-M351 HydrophobicContact CB-CE 4.29Å; K72-M351 HydrophobicContact CG-CE 3.36Å; G349-M351 VanDerWaalsContact C-N 3.3Å; G349-M351 PolarHBondContact O-N 2.87Å; M351-N353 PolarHBondContact O-N 3.26Å
352	G	46.2	Very low	50.6	Low	30 Å²	30	103 Å²	103	31%	0.309	54%	0.541	S	S	.	.			trans	-69.1	130.2	-179	0	0	0	0	0	111.2	G349 Y354	G349-G352 PolarHBondContact O-N 2.98Å; G352-Y354 PolarHBondContact O-N 3.17Å; G352-Y354 VanDerWaalsContact O-N 3.14Å
353	N	46.6	Very low	52.1	Low	116 Å²	116	108.9 Å²	108.9	62%	0.62	57%	0.572	S	S	*	*			trans	-61.2	118.4	164.3	-88.7	-15.7	0	0	0	108.1	M351 N355 E356 S357	M351-N353 PolarHBondContact O-N 3.26Å; N353-N355 PolarHBondContact O-N 3.13Å; N353-E356 PolarHBondContact O-N 3.02Å; N353-S357 PolarHBondContact O-N 3.36Å; N353-S357 PolarHBondContact O-OG 3.17Å
354	Y	51.3	Low	53	Low	209 Å²	209	115.5 Å²	115.5	82%	0.82	60%	0.598	S	S	*	*	T	Hydrogen-bonded Turn	trans	-54.7	-22.5	-178.5	-120.8	-92.6	0	0	0	113.1	G352	G352-Y354 PolarHBondContact O-N 3.17Å; G352-Y354 VanDerWaalsContact O-N 3.14Å
355	N	50.7	Low	53.7	Low	158 Å²	158	118.8 Å²	118.8	85%	0.845	62%	0.619	S	S	*	*	T	Hydrogen-bonded Turn	trans	-93.3	-13.5	-175.5	-73.7	-9.7	0	0	0	115.4	N353	N353-N355 PolarHBondContact O-N 3.13Å
356	E	51.3	Low	54.3	Low	157 Å²	157	126.3 Å²	126.3	73%	0.734	66%	0.655	S	S	*	*	T	Hydrogen-bonded Turn	trans	-124.9	-23.4	-175.3	-71.7	-177.9	168.1	0	0	114.1	N353	N353-E356 PolarHBondContact O-N 3.02Å
357	S	50.4	Low	54.7	Low	62 Å²	62	126.3 Å²	126.3	43%	0.434	66%	0.658	S	S	.	*	T	Hydrogen-bonded Turn	trans	-92.1	1.3	-168	56.8	0	0	0	0	116.1	N353	N353-S357 PolarHBondContact O-N 3.36Å; N353-S357 PolarHBondContact O-OG 3.17Å
358	H	49	Very low	55	Low	146 Å²	146	128.2 Å²	128.2	68%	0.676	67%	0.672	S	S	*	*	T	Hydrogen-bonded Turn	trans	-123.8	39.5	179	-65.6	-47.1	0	0	0	113.2	F360	H358-F360 PolarHBondContact O-N 3.42Å
359	V	54	Low	55.3	Low	114 Å²	114	127.6 Å²	127.6	69%	0.691	66%	0.657	S	S	*	*			trans	-86.3	100.2	166.7	-174.6	0	0	0	0	108.3	T361	V359-T361 PolarHBondContact O-N 3.43Å
360	F	64	Low	55.3	Low	174 Å²	174	132.1 Å²	132.1	76%	0.763	67%	0.666	S	S	*	*			trans	-69.1	109	165.7	179.9	-97.4	0	0	0	108.3	H358 L362	H358-F360 PolarHBondContact O-N 3.42Å; F360-L362 HydrophobicContact CD1-CG 4.47Å; F360-L362 HydrophobicContact CE1-CD1 3.85Å; F360-L362 HydrophobicContact CE1-CD2 3.94Å; F360-L362 HydrophobicContact CE1-CG 3.64Å; F360-L362 HydrophobicContact CZ-CD1 4.34Å; F360-L362 HydrophobicContact CZ-CD2 3.7Å; F360-L362 HydrophobicContact CZ-CG 3.96Å
361	T	65.2	Low	55.6	Low	74 Å²	74	138.9 Å²	138.9	45%	0.454	70%	0.698	S	S	.	*			trans	-116.9	139.5	173.5	-174.4	0	0	0	0	110.1	V359 D363 E364	V359-T361 PolarHBondContact O-N 3.43Å; T361-D363 PolarHBondContact OG1-N 3.22Å; T361-E364 HydrophobicContact CG2-CG 4.09Å
362	L	71.5	Confident	55.8	Low	141 Å²	141	142.4 Å²	142.4	74%	0.738	72%	0.716	S	S	*	*	S	Bend	trans	-105.2	-2.2	176.9	-73	171.7	0	0	0	112.4	F360	F360-L362 HydrophobicContact CD1-CG 4.47Å; F360-L362 HydrophobicContact CE1-CD1 3.85Å; F360-L362 HydrophobicContact CE1-CD2 3.94Å; F360-L362 HydrophobicContact CE1-CG 3.64Å; F360-L362 HydrophobicContact CZ-CD1 4.34Å; F360-L362 HydrophobicContact CZ-CD2 3.7Å; F360-L362 HydrophobicContact CZ-CG 3.96Å
363	D	65	Low	56.5	Low	149 Å²	149	150.4 Å²	150.4	80%	0.797	75%	0.745	S	S	*	*			trans	-101.7	27.2	-172.3	-66.2	-32.3	0	0	0	113	T361	T361-D363 PolarHBondContact OG1-N 3.22Å
364	E	62.1	Low	57.2	Low	154 Å²	154	153.1 Å²	153.1	72%	0.72	76%	0.755	S	S	*	*			trans	-83.1	124.1	168.3	-70.3	-154.8	166	0	0	110.6	T361 F366	T361-E364 HydrophobicContact CG2-CG 4.09Å; E364-F366 PolarHBondContact O-N 3.32Å
365	D	54.2	Low	57.7	Low	169 Å²	169	148.4 Å²	148.4	90%	0.904	75%	0.75	S	S	*	*			trans	-69	115.9	169.7	-79	-29.8	0	0	0	108.7
366	F	55.4	Low	58.4	Low	283 Å²	283	147.5 Å²	147.5	100%	1.241	74%	0.741	S	S	*	*			trans	-59.3	0	-178.5	-93.7	-88.6	0	0	0	114.8	E364	E364-F366 PolarHBondContact O-N 3.32Å

Retrieved 366 of 366 residues in 99.9 ms (Link to these results)

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