A0A3Q0KER4_SCHMA Loading...

Putative cyclin l

AlphaFold DB , UniProt , Accession A0A3Q0KER4, Species SCHMA (Schistosoma mansoni, Blood fluke), Gene n/a, Length 639 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	M	37.9	Very low	38	Very low	252 Å²	252	148 Å²	148	100%	1.241	87%	0.865	S	S	*	*				0	149.3	0	-74.2	173.8	168.1	0	0	108.1
2	A	34.1	Very low	38	Very low	103 Å²	103	149.7 Å²	149.7	85%	0.851	86%	0.858	S	S	*	*			trans	-107.6	150.4	-165.7	0	0	0	0	0	113.3
3	A	40.6	Very low	38.4	Very low	98 Å²	98	146.9 Å²	146.9	81%	0.81	85%	0.849	S	S	*	*			trans	-160.4	61.8	166.6	0	0	0	0	0	110.8	S5	A3-S5 PolarHBondContact O-N 3.03Å; A3-S5 VanDerWaalsContact O-N 3.16Å
4	E	37	Very low	39	Very low	198 Å²	198	146.7 Å²	146.7	93%	0.925	84%	0.843	S	S	*	*			trans	-71.8	104.3	169.9	-71.4	-171.8	135	0	0	110.1	G6	E4-G6 VanDerWaalsContact C-N 3.28Å; E4-G6 PolarHBondContact O-N 3.36Å
5	S	44.1	Very low	40.1	Very low	122 Å²	122	141.6 Å²	141.6	85%	0.853	82%	0.82	S	S	*	*			trans	-79.5	71.2	178.7	42.4	0	0	0	0	111.8	A3 S7	A3-S5 PolarHBondContact O-N 3.03Å; A3-S5 VanDerWaalsContact O-N 3.16Å; S5-S7 PolarHBondContact O-N 2.89Å
6	G	38.9	Very low	41.1	Very low	70 Å²	70	137.3 Å²	137.3	72%	0.722	80%	0.796	S	S	*	*			trans	-52.8	118.3	-178.2	0	0	0	0	0	114	E4 R8	E4-G6 VanDerWaalsContact C-N 3.28Å; E4-G6 PolarHBondContact O-N 3.36Å; G6-R8 PolarHBondContact O-N 3.45Å; G6-R8 VanDerWaalsContact O-N 3.08Å
7	S	39	Very low	42.1	Very low	121 Å²	121	140.8 Å²	140.8	85%	0.846	79%	0.793	S	S	*	*			trans	-73.7	96.9	-175.3	49.6	0	0	0	0	112.6	S5 S9	S5-S7 PolarHBondContact O-N 2.89Å; S7-S9 VanDerWaalsContact C-N 3.35Å; S7-S9 PolarHBondContact O-N 3.04Å
8	R	36.9	Very low	43.4	Very low	241 Å²	241	141.1 Å²	141.1	91%	0.909	79%	0.787	S	S	*	*			trans	-69.4	90.2	167.5	-86.7	-173.7	169.1	176.2	-1.9	110.8	G6 V10	G6-R8 PolarHBondContact O-N 3.45Å; G6-R8 VanDerWaalsContact O-N 3.08Å; R8-V10 PolarHBondContact O-N 3Å; R8-V10 VanDerWaalsContact O-N 3.1Å
9	S	35.3	Very low	44.7	Very low	111 Å²	111	142.3 Å²	142.3	78%	0.776	78%	0.779	S	S	*	*			trans	-61.9	109.3	164.4	-175.6	0	0	0	0	109.5	S7 K11	S7-S9 VanDerWaalsContact C-N 3.35Å; S7-S9 PolarHBondContact O-N 3.04Å; S9-K11 PolarHBondContact O-N 2.78Å; S9-K11 VanDerWaalsContact O-N 3.1Å
10	V	37	Very low	46.2	Very low	128 Å²	128	140.9 Å²	140.9	78%	0.776	78%	0.779	S	S	*	*			trans	-75.6	96.9	173	179.7	0	0	0	0	107.5	R8 Q12	R8-V10 PolarHBondContact O-N 3Å; R8-V10 VanDerWaalsContact O-N 3.1Å; V10-Q12 PolarHBondContact O-N 3.41Å; V10-Q12 VanDerWaalsContact O-N 3.11Å
11	K	37.5	Very low	47.6	Very low	184 Å²	184	137.3 Å²	137.3	80%	0.8	78%	0.775	S	S	*	*	P	Polyproline II helix	trans	-55.1	118.1	165.4	-74.2	-168.3	173.2	-167.7	0	108.3	S9	S9-K11 PolarHBondContact O-N 2.78Å; S9-K11 VanDerWaalsContact O-N 3.1Å
12	Q	37.8	Very low	49.2	Very low	168 Å²	168	129.4 Å²	129.4	79%	0.785	74%	0.741	S	S	*	*	P	Polyproline II helix	trans	-62	145.8	164.3	-67.4	-168.6	-1.3	0	0	108.5	V10 D14	V10-Q12 PolarHBondContact O-N 3.41Å; V10-Q12 VanDerWaalsContact O-N 3.11Å; Q12-D14 PolarHBondContact O-N 2.86Å
13	P	42.9	Very low	51	Low	114 Å²	114	127.9 Å²	127.9	74%	0.74	72%	0.718	S	S	*	*	P	Polyproline II helix	trans	-67	128.4	177.9	27.4	-33.5	0	0	0	110	S15	P13-S15 PolarHBondContact O-N 3.3Å
14	D	47.2	Very low	52.4	Low	144 Å²	144	128 Å²	128	77%	0.77	70%	0.704	S	S	*	*			trans	-64	84.1	172.9	-67.6	-51	0	0	0	109.9	Q12 T16	Q12-D14 PolarHBondContact O-N 2.86Å; D14-T16 PolarHBondContact O-N 3.17Å
15	S	55.4	Low	54.3	Low	70 Å²	70	121.7 Å²	121.7	49%	0.49	68%	0.68	S	S	.	*			trans	-79.3	1.1	179.8	57.7	0	0	0	0	113.2	P13 W17	P13-S15 PolarHBondContact O-N 3.3Å; S15-W17 PolarHBondContact O-N 3.34Å
16	T	56.5	Low	55.9	Low	73 Å²	73	121.8 Å²	121.8	45%	0.448	67%	0.669	S	S	.	*			trans	-84.9	83.6	179.3	49.2	0	0	0	0	111.2	D14 E18 N23	D14-T16 PolarHBondContact O-N 3.17Å; T16-E18 PolarHBondContact O-N 2.82Å; T16-N23 WeakPolarHBondContact CB-ND2 3.49Å; T16-N23 VanDerWaalsContact CG2-ND2 3.34Å; T16-N23 WeakPolarHBondContact CG2-ND2 3.44Å
17	W	58.3	Low	57.9	Low	197 Å²	197	122.2 Å²	122.2	75%	0.746	65%	0.652	S	S	*	*	E	Extended strand (participates in β ladder)	trans	-75.5	100.8	170.6	-68.5	77.4	0	0	0	109.4	S15 L24	S15-W17 PolarHBondContact O-N 3.34Å; W17-L24 HydrophobicContact CB-CB 4.38Å; W17-L24 WeakPolarHBondContact O-CB 3.34Å; W17-L24 PolarHBondContact O-N 3.18Å
18	E	65.6	Low	59.9	Low	145 Å²	145	116.8 Å²	116.8	68%	0.678	61%	0.614	S	S	*	*	E	Extended strand (participates in β ladder)	trans	-80.3	119.4	171.3	-64.5	-157.5	154.3	0	0	111	T16 V22	T16-E18 PolarHBondContact O-N 2.82Å; E18-V22 WeakPolarHBondContact CA-O 3.33Å
19	Y	66.6	Low	62.2	Low	164 Å²	164	109 Å²	109	64%	0.643	59%	0.589	S	S	*	*	E	Extended strand (participates in β ladder)	trans	-120	111.7	173.8	-176.4	-96.3	0	0	0	109.4	G21 V22	Y19-G21 PolarHBondContact O-N 3.31Å; Y19-V22 PolarHBondContact N-O 3.15Å; Y19-V22 WeakPolarHBondContact O-CB 3.46Å; Y19-V22 PolarHBondContact O-N 3.47Å
20	C	74.8	Confident	64.8	Low	114 Å²	114	106.2 Å²	106.2	77%	0.77	57%	0.565	S	S	*	*	T	Hydrogen-bonded Turn	trans	52.5	38.3	-177.1	-59.6	0	0	0	0	113.8	V22	C20-V22 VanDerWaalsContact C-N 3.29Å; C20-V22 PolarHBondContact O-N 3.14Å
21	G	75.6	Confident	67.3	Low	67 Å²	67	101.1 Å²	101.1	69%	0.691	53%	0.533	S	S	*	.	T	Hydrogen-bonded Turn	trans	77.8	6.8	-176	0	0	0	0	0	114.9	Y19	Y19-G21 PolarHBondContact O-N 3.31Å
22	V	71.2	Confident	69.7	Low	86 Å²	86	95.7 Å²	95.7	52%	0.521	52%	0.517	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-100.1	114.5	171.9	-174.5	0	0	0	0	109.1	E18 Y19 C20 L24	E18-V22 WeakPolarHBondContact CA-O 3.33Å; Y19-V22 PolarHBondContact N-O 3.15Å; Y19-V22 WeakPolarHBondContact O-CB 3.46Å; Y19-V22 PolarHBondContact O-N 3.47Å; C20-V22 VanDerWaalsContact C-N 3.29Å; C20-V22 PolarHBondContact O-N 3.14Å; V22-L24 HydrophobicContact CG1-CD2 4.08Å; V22-L24 PolarHBondContact O-N 3.44Å
23	N	72.8	Confident	72.1	Confident	71 Å²	71	95.6 Å²	95.6	38%	0.38	52%	0.517	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-74.9	110.4	173.6	-171.4	-46.6	0	0	0	110	T16 T25	T16-N23 WeakPolarHBondContact CB-ND2 3.49Å; T16-N23 VanDerWaalsContact CG2-ND2 3.34Å; T16-N23 WeakPolarHBondContact CG2-ND2 3.44Å; N23-T25 PolarHBondContact O-N 3.05Å
24	L	70.3	Confident	74.2	Confident	99 Å²	99	98.1 Å²	98.1	52%	0.518	52%	0.519	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-87.6	86.9	-177.1	-63.5	177.6	0	0	0	111.1	W17 V22	W17-L24 HydrophobicContact CB-CB 4.38Å; W17-L24 WeakPolarHBondContact O-CB 3.34Å; W17-L24 PolarHBondContact O-N 3.18Å; V22-L24 HydrophobicContact CG1-CD2 4.08Å; V22-L24 PolarHBondContact O-N 3.44Å
25	T	76.2	Confident	76.1	Confident	67 Å²	67	99.4 Å²	99.4	41%	0.411	51%	0.513	S	S	.	.			trans	-94	142.7	177.4	-172.6	0	0	0	0	113.5	N23 H27	N23-T25 PolarHBondContact O-N 3.05Å; T25-H27 VanDerWaalsContact C-N 3.3Å; T25-H27 WeakPolarHBondContact OG1-CB 3.45Å; T25-H27 PolarHBondContact OG1-CD2 2.76Å; T25-H27 PolarHBondContact OG1-N 3.41Å; T25-H27 VanDerWaalsContact OG1-N 3.13Å
26	I	78	Confident	77.7	Confident	123 Å²	123	97.6 Å²	97.6	63%	0.631	50%	0.497	S	S	*	.	S	Bend	trans	-85.1	-0.4	168.9	64.3	168.8	0	0	0	113	K171	I26-K171 WeakPolarHBondContact O-CE 3.46Å; I26-K171 PolarHBondContact O-NZ 2.76Å
27	H	80.8	Confident	79.2	Confident	80 Å²	80	101 Å²	101	37%	0.37	51%	0.506	S	S	.	.	S	Bend	trans	-87.5	168.8	-177.7	-66.9	-101	0	0	0	111.6	T25 I29 L213	T25-H27 VanDerWaalsContact C-N 3.3Å; T25-H27 WeakPolarHBondContact OG1-CB 3.45Å; T25-H27 PolarHBondContact OG1-CD2 2.76Å; T25-H27 PolarHBondContact OG1-N 3.41Å; T25-H27 VanDerWaalsContact OG1-N 3.13Å; H27-I29 PolarHBondContact O-N 3.26Å; H27-L213 HydrophobicContact CB-CD2 4.48Å
28	N	81.2	Confident	80.9	Confident	7 Å²	7	94.8 Å²	94.8	4%	0.037	49%	0.491	C	S	.	.	P	Polyproline II helix	trans	-66.5	127.5	169.9	-83	-4	0	0	0	109	I30 K171 L213 P214	N28-I30 PolarHBondContact O-N 2.98Å; N28-I30 VanDerWaalsContact O-N 3.13Å; N28-K171 PolarHBondContact ND2-O 3.15Å; N28-K171 PolarHBondContact OD1-N 3.48Å; N28-L213 HydrophobicContact CB-CD2 4.34Å; N28-P214 VanDerWaalsContact ND2-CG 3.3Å; N28-P214 WeakPolarHBondContact ND2-CG 3.49Å
29	I	85.4	Confident	82.3	Confident	76 Å²	76	88 Å²	88	39%	0.39	46%	0.46	S	S	.	.	P	Polyproline II helix	trans	-61.9	118.2	167.6	-59.7	-179	0	0	0	108.4	H27 R85 C167	H27-I29 PolarHBondContact O-N 3.26Å; I29-R85 PolarHBondContact O-NE 3.38Å; I29-R85 PolarHBondContact O-NH2 3.31Å; I29-C167 HydrophobicContact CD1-CB 3.45Å; I29-C167 VanDerWaalsContact CD1-CB 3.45Å
30	I	90.7	Very high	83.7	Confident	54 Å²	54	81.9 Å²	81.9	28%	0.277	44%	0.44	S	S	.	.	P	Polyproline II helix	trans	-92.5	147.3	168.2	-58.3	-50	0	0	0	108	N28 V210 R211 Y212 L213	N28-I30 PolarHBondContact O-N 2.98Å; N28-I30 VanDerWaalsContact O-N 3.13Å; I30-V210 WeakPolarHBondContact CG2-O 3.29Å; I30-R211 VanDerWaalsContact CG2-O 3.28Å; I30-R211 WeakPolarHBondContact CG2-O 3.49Å; I30-Y212 VanDerWaalsContact CD1-C 3.48Å; I30-Y212 WeakPolarHBondContact CD1-O 3.39Å; I30-L213 HydrophobicContact CD1-CD2 4.09Å; I30-L213 HydrophobicContact CD1-CG 4.46Å; I30-L213 HydrophobicContact CG1-CD2 3.95Å; I30-L213 HydrophobicContact CG1-CG 4.29Å
31	I	89.2	Confident	84.7	Confident	20 Å²	20	76.5 Å²	76.5	10%	0.103	40%	0.403	C	S	.	.	P	Polyproline II helix	trans	-90.9	123.4	178.3	-63.6	-176.2	0	0	0	108.1	R35 L36 Y88 V210	I31-R35 HydrophobicContact CG2-CB 3.7Å; I31-L36 HydrophobicContact CB-CD2 4.05Å; I31-L36 HydrophobicContact CG2-CD2 3.87Å; I31-L36 HydrophobicContact CG2-CG 4.45Å; I31-Y88 HydrophobicContact CD1-CD2 4.17Å; I31-Y88 HydrophobicContact CD1-CG 3.87Å; I31-V210 HydrophobicContact CD1-CB 3.79Å; I31-V210 HydrophobicContact CD1-CG1 4.12Å; I31-V210 HydrophobicContact CD1-CG2 4.12Å; I31-V210 HydrophobicContact CG1-CB 4.02Å; I31-V210 PolarHBondContact N-O 3.14Å
32	P	87.4	Confident	85.6	Confident	70 Å²	70	75 Å²	75	46%	0.455	38%	0.379	S	S	.	.	P	Polyproline II helix	trans	-55.7	145.8	176.6	-25.9	34.5	0	0	0	112	E34 R35	P32-E34 VanDerWaalsContact C-N 3.26Å; P32-E34 PolarHBondContact O-N 2.95Å; P32-R35 WeakPolarHBondContact O-CA 3.32Å; P32-R35 WeakPolarHBondContact O-CB 3.49Å; P32-R35 PolarHBondContact O-N 3.1Å
33	E	87.1	Confident	86.7	Confident	167 Å²	167	76.7 Å²	76.7	78%	0.78	38%	0.384	S	S	*	.	G	3₁₀ helix	trans	-59.7	-36.2	-171.1	-58.5	-169.9	152.9	0	0	113	R35 L36	E33-R35 PolarHBondContact O-N 2.61Å; E33-L36 HydrophobicContact CB-CD1 4.36Å; E33-L36 HydrophobicContact CG-CD1 4.3Å; E33-L36 WeakPolarHBondContact O-CB 3.47Å; E33-L36 PolarHBondContact O-N 3.01Å
34	E	87.9	Confident	87.8	Confident	167 Å²	167	74.3 Å²	74.3	78%	0.78	37%	0.371	S	S	*	.	G	3₁₀ helix	trans	-50.9	-23.5	170.3	-59.1	171.9	-171.1	0	0	114.7	P32	P32-E34 VanDerWaalsContact C-N 3.26Å; P32-E34 PolarHBondContact O-N 2.95Å
35	R	86.9	Confident	88.9	Confident	171 Å²	171	78.1 Å²	78.1	65%	0.645	38%	0.383	S	S	*	.	G	3₁₀ helix	trans	-105.9	-2.3	-179.6	-61.1	-173.6	-176.4	-175.7	2.8	113.3	I31 P32 E33	I31-R35 HydrophobicContact CG2-CB 3.7Å; P32-R35 WeakPolarHBondContact O-CA 3.32Å; P32-R35 WeakPolarHBondContact O-CB 3.49Å; P32-R35 PolarHBondContact O-N 3.1Å; E33-R35 PolarHBondContact O-N 2.61Å
36	L	88.9	Confident	89.8	Confident	32 Å²	32	75.3 Å²	75.3	17%	0.168	37%	0.366	C	S	.	.	T	Hydrogen-bonded Turn	trans	-80.1	-32	171	-58.5	174.8	0	0	0	111	I31 E33 T39 Y88 V210 R211	I31-L36 HydrophobicContact CB-CD2 4.05Å; I31-L36 HydrophobicContact CG2-CD2 3.87Å; I31-L36 HydrophobicContact CG2-CG 4.45Å; E33-L36 HydrophobicContact CB-CD1 4.36Å; E33-L36 HydrophobicContact CG-CD1 4.3Å; E33-L36 WeakPolarHBondContact O-CB 3.47Å; E33-L36 PolarHBondContact O-N 3.01Å; L36-T39 WeakPolarHBondContact O-CG2 3.39Å; L36-Y88 HydrophobicContact CD2-CD1 4.19Å; L36-Y88 HydrophobicContact CD2-CE1 3.95Å; L36-V210 HydrophobicContact CD2-CG2 4.5Å; L36-R211 HydrophobicContact CD1-CG 3.74Å; L36-R211 HydrophobicContact CD2-CG 3.97Å
37	F	89.3	Confident	90.6	Very high	145 Å²	145	75.3 Å²	75.3	64%	0.636	36%	0.363	S	S	*	.	S	Bend	trans	-149.3	129.7	177.7	-179.7	-97.1	0	0	0	111.6
38	P	92.8	Very high	91.3	Very high	66 Å²	66	77.2 Å²	77.2	43%	0.429	37%	0.368	S	S	.	.	S	Bend	cis	-77.1	139.4	-4.1	31.7	-34.6	0	0	0	112.2	Q42 L43	P38-Q42 HydrophobicContact CB-CB 4.45Å; P38-L43 HydrophobicContact CB-CD2 4.29Å; P38-L43 HydrophobicContact CB-CG 4.47Å; P38-L43 HydrophobicContact CG-CD2 4.04Å; P38-L43 HydrophobicContact CG-CG 4.46Å
39	T	95.1	Very high	91.9	Very high	3 Å²	3	80.8 Å²	80.8	2%	0.018	38%	0.384	C	S	.	.			trans	-69.7	159.1	175.4	76.5	0	0	0	0	111.6	L36 S41 Q42 L43 E51 Y88	L36-T39 WeakPolarHBondContact O-CG2 3.39Å; T39-S41 PolarHBondContact O-N 2.96Å; T39-S41 VanDerWaalsContact O-N 3.13Å; T39-S41 PolarHBondContact OG1-N 3.29Å; T39-Q42 PolarHBondContact O-N 3.43Å; T39-Q42 VanDerWaalsContact O-N 3.12Å; T39-Q42 WeakPolarHBondContact OG1-CG 3.5Å; T39-Q42 PolarHBondContact OG1-N 3.13Å; T39-L43 WeakPolarHBondContact O-CG 3.37Å; T39-L43 PolarHBondContact O-N 3.13Å; T39-E51 WeakPolarHBondContact CB-OE2 3.47Å; T39-E51 WeakPolarHBondContact CG2-OE2 3.49Å; T39-E51 PolarHBondContact OG1-OE1 3.47Å; T39-E51 PolarHBondContact OG1-OE2 2.99Å; T39-Y88 HydrophobicContact CG2-CD1 4.43Å; T39-Y88 HydrophobicContact CG2-CE1 4.23Å
40	P	95.8	Very high	92.4	Very high	35 Å²	35	77.8 Å²	77.8	23%	0.227	37%	0.37	C	S	.	.	H	α-helix	trans	-57.5	-24.1	169.3	-27.7	37.6	0	0	0	114.4	D44 Y88 S91	P40-D44 PolarHBondContact O-N 3.06Å; P40-Y88 WeakPolarHBondContact CD-O 3.48Å; P40-Y88 VanDerWaalsContact CG-O 3.29Å; P40-Y88 WeakPolarHBondContact CG-O 3.29Å; P40-S91 WeakPolarHBondContact O-CB 3.47Å
41	S	95.9	Very high	92.7	Very high	0 Å²	0	75.4 Å²	75.4	0%	0	36%	0.357	C	S	.	.	H	α-helix	trans	-77	-40.7	175.5	-46.8	0	0	0	0	111.4	T39 L43 D44 K45 M46 E51 F92	T39-S41 PolarHBondContact O-N 2.96Å; T39-S41 VanDerWaalsContact O-N 3.13Å; T39-S41 PolarHBondContact OG1-N 3.29Å; S41-L43 VanDerWaalsContact C-N 3.33Å; S41-D44 CarbonylContact O-C 3.58Å; S41-D44 WeakPolarHBondContact O-CA 3.41Å; S41-D44 WeakPolarHBondContact O-CB 3.49Å; S41-D44 PolarHBondContact O-N 3.11Å; S41-K45 PolarHBondContact O-N 3.48Å; S41-M46 WeakPolarHBondContact O-CB 3.47Å; S41-M46 PolarHBondContact O-N 2.96Å; S41-E51 VanDerWaalsContact CB-CD 3.44Å; S41-E51 VanDerWaalsContact CB-OE1 3.26Å; S41-E51 WeakPolarHBondContact CB-OE1 3.46Å; S41-E51 PolarHBondContact OG-OE1 2.98Å; S41-F92 WeakPolarHBondContact OG-CD2 3.49Å; S41-F92 PolarHBondContact OG-N 2.98Å
42	Q	95.4	Very high	93	Very high	37 Å²	37	76.2 Å²	76.2	17%	0.173	36%	0.362	C	S	.	.	H	α-helix	trans	-64	-37.9	174.2	-70.8	173.2	-45.9	0	0	111.7	P38 T39 D44 K45	P38-Q42 HydrophobicContact CB-CB 4.45Å; T39-Q42 PolarHBondContact O-N 3.43Å; T39-Q42 VanDerWaalsContact O-N 3.12Å; T39-Q42 WeakPolarHBondContact OG1-CG 3.5Å; T39-Q42 PolarHBondContact OG1-N 3.13Å; Q42-D44 PolarHBondContact O-N 2.94Å; Q42-K45 WeakPolarHBondContact O-CA 3.48Å; Q42-K45 PolarHBondContact O-N 3.39Å
43	L	94.6	Very high	93.5	Very high	121 Å²	121	74.2 Å²	74.2	63%	0.634	35%	0.347	S	S	*	.	H	α-helix	trans	-62.4	-27.1	171	-65.5	176.5	0	0	0	112.9	P38 T39 S41 K45	P38-L43 HydrophobicContact CB-CD2 4.29Å; P38-L43 HydrophobicContact CB-CG 4.47Å; P38-L43 HydrophobicContact CG-CD2 4.04Å; P38-L43 HydrophobicContact CG-CG 4.46Å; T39-L43 WeakPolarHBondContact O-CG 3.37Å; T39-L43 PolarHBondContact O-N 3.13Å; S41-L43 VanDerWaalsContact C-N 3.33Å; L43-K45 PolarHBondContact O-N 3.46Å
44	D	94.7	Very high	93.9	Very high	20 Å²	20	66.3 Å²	66.3	11%	0.107	31%	0.31	C	S	.	.	T	Hydrogen-bonded Turn	trans	-87.4	18.4	169.6	-81.9	-16.6	0	0	0	113.4	P40 S41 Q42 M46 S91 V93 R94 Q282	P40-D44 PolarHBondContact O-N 3.06Å; S41-D44 CarbonylContact O-C 3.58Å; S41-D44 WeakPolarHBondContact O-CA 3.41Å; S41-D44 WeakPolarHBondContact O-CB 3.49Å; S41-D44 PolarHBondContact O-N 3.11Å; Q42-D44 PolarHBondContact O-N 2.94Å; D44-M46 VanDerWaalsContact C-N 3.33Å; D44-M46 PolarHBondContact O-N 2.91Å; D44-S91 WeakPolarHBondContact OD2-CB 3.26Å; D44-S91 PolarHBondContact OD2-OG 3.3Å; D44-V93 HydrophobicContact CB-CB 4.02Å; D44-V93 HydrophobicContact CB-CG2 3.74Å; D44-R94 IonicContact OD1-CZ 3.69Å; D44-R94 IonicContact OD1-NE 2.77Å; D44-R94 PolarHBondContact OD1-NE 3.38Å; D44-R94 IonicContact OD1-NH2 3.76Å; D44-R94 PolarHBondContact OD1-NH2 3.14Å; D44-R94 WeakPolarHBondContact OD2-CD 3.49Å; D44-R94 VanDerWaalsContact OD2-CG 3.31Å; D44-R94 WeakPolarHBondContact OD2-CG 3.32Å; D44-R94 IonicContact OD2-CZ 2.62Å; D44-R94 IonicContact OD2-NE 2.68Å; D44-R94 PolarHBondContact OD2-NE 3.11Å; D44-R94 IonicContact OD2-NH2 3.35Å; D44-Q282 PolarHBondContact OD1-NE2 2.98Å; D44-Q282 PolarHBondContact OD2-NE2 2.87Å
45	K	94.2	Very high	94.4	Very high	180 Å²	180	58.8 Å²	58.8	78%	0.783	28%	0.275	S	S	*	.	T	Hydrogen-bonded Turn	trans	65.2	25.9	178.5	-49.9	-175.4	-179.7	-173.5	0	115.2	S41 Q42 L43	S41-K45 PolarHBondContact O-N 3.48Å; Q42-K45 WeakPolarHBondContact O-CA 3.48Å; Q42-K45 PolarHBondContact O-N 3.39Å; L43-K45 PolarHBondContact O-N 3.46Å
46	M	95	Very high	94.9	Very high	7 Å²	7	51.6 Å²	51.6	3%	0.034	25%	0.248	C	C	.	.			trans	-76	135.7	167.8	-170.3	167.8	-71.3	0	0	111.1	S41 D44 T50 E51 L54 F92 V93 L275 L278	S41-M46 WeakPolarHBondContact O-CB 3.47Å; S41-M46 PolarHBondContact O-N 2.96Å; D44-M46 VanDerWaalsContact C-N 3.33Å; D44-M46 PolarHBondContact O-N 2.91Å; M46-T50 HydrophobicContact CG-CG2 3.91Å; M46-T50 HydrophobicContact SD-CG2 4.21Å; M46-E51 HydrophobicContact CG-CB 4.23Å; M46-E51 HydrophobicContact SD-CB 3.82Å; M46-E51 HydrophobicContact SD-CG 4.49Å; M46-L54 HydrophobicContact CE-CD1 3.77Å; M46-L54 HydrophobicContact SD-CD1 3.72Å; M46-F92 HydrophobicContact CE-CB 3.65Å; M46-F92 HydrophobicContact SD-CB 4.02Å; M46-F92 HydrophobicContact SD-CD2 4.38Å; M46-V93 HydrophobicContact CE-CG2 3.73Å; M46-L275 HydrophobicContact CE-CD2 3.49Å; M46-L275 VanDerWaalsContact CE-CD2 3.49Å; M46-L278 HydrophobicContact CB-CD1 4.17Å; M46-L278 HydrophobicContact CE-CD1 3.93Å; M46-L278 HydrophobicContact CG-CD1 4.27Å
47	E	95.4	Very high	95.2	Very high	123 Å²	123	50.8 Å²	50.8	58%	0.575	24%	0.244	S	C	*	.			trans	-65.7	139.8	169.3	177.8	-168.2	-135.9	0	0	110.8	E49 T50 E51	E47-E49 VanDerWaalsContact C-N 3.34Å; E47-E49 HydrophobicContact CG-CB 4.44Å; E47-E49 PolarHBondContact O-N 3.01Å; E47-T50 WeakPolarHBondContact O-CB 3.45Å; E47-T50 PolarHBondContact O-N 3.13Å; E47-T50 PolarHBondContact OE2-OG1 3.12Å; E47-E51 PolarHBondContact O-N 3.5Å
48	Y	94.3	Very high	95.6	Very high	120 Å²	120	43.9 Å²	43.9	47%	0.471	21%	0.214	S	C	.	.	H	α-helix	trans	-54.3	-45.1	-179.5	-179.2	-118.4	0	0	0	113.5	E51 I52	Y48-E51 WeakPolarHBondContact O-CB 3.36Å; Y48-E51 PolarHBondContact O-N 3.44Å; Y48-I52 HydrophobicContact CD1-CD1 3.91Å; Y48-I52 HydrophobicContact CD2-CD1 4.49Å; Y48-I52 HydrophobicContact CE1-CD1 3.53Å; Y48-I52 HydrophobicContact CE2-CD1 4.15Å; Y48-I52 HydrophobicContact CG-CD1 4.39Å; Y48-I52 WeakPolarHBondContact O-CG1 3.43Å; Y48-I52 PolarHBondContact O-N 2.93Å
49	E	94.7	Very high	95.9	Very high	82 Å²	82	40.8 Å²	40.8	38%	0.383	19%	0.194	S	C	.	.	H	α-helix	trans	-67.7	-39.7	179.4	-62.8	-58.1	150.1	0	0	112.3	E47 E51 I52 D53 R263	E47-E49 VanDerWaalsContact C-N 3.34Å; E47-E49 HydrophobicContact CG-CB 4.44Å; E47-E49 PolarHBondContact O-N 3.01Å; E49-E51 VanDerWaalsContact C-N 3.27Å; E49-E51 PolarHBondContact O-N 3.32Å; E49-I52 PolarHBondContact O-N 3.17Å; E49-D53 WeakPolarHBondContact O-CB 3.06Å; E49-D53 PolarHBondContact O-N 2.97Å; E49-R263 PolarHBondContact O-NH2 3.24Å; E49-R263 IonicContact OE2-CZ 3.73Å; E49-R263 IonicContact OE2-NH1 3.27Å; E49-R263 PolarHBondContact OE2-NH1 3.14Å; E49-R263 IonicContact OE2-NH2 3.5Å; E49-R263 PolarHBondContact OE2-NH2 3.16Å
50	T	95.8	Very high	95.9	Very high	14 Å²	14	44.3 Å²	44.3	9%	0.086	21%	0.21	C	C	.	.	H	α-helix	trans	-60.8	-35.6	171.9	-71.2	0	0	0	0	111.7	M46 E47 L54 L271 V274	M46-T50 HydrophobicContact CG-CG2 3.91Å; M46-T50 HydrophobicContact SD-CG2 4.21Å; E47-T50 WeakPolarHBondContact O-CB 3.45Å; E47-T50 PolarHBondContact O-N 3.13Å; E47-T50 PolarHBondContact OE2-OG1 3.12Å; T50-L54 HydrophobicContact CG2-CD1 4.46Å; T50-L54 WeakPolarHBondContact O-CG 3.38Å; T50-L54 PolarHBondContact O-N 3.34Å; T50-L271 HydrophobicContact CG2-CD1 4.02Å; T50-V274 HydrophobicContact CG2-CG1 4.04Å
51	E	96.3	Very high	96	Very high	3 Å²	3	43.2 Å²	43.2	1%	0.014	20%	0.202	C	C	.	.	H	α-helix	trans	-70.1	-44	174.4	176.7	163.3	-149.8	0	0	112.7	T39 S41 M46 E47 Y48 E49 D53 L54 R55 F92	T39-E51 WeakPolarHBondContact CB-OE2 3.47Å; T39-E51 WeakPolarHBondContact CG2-OE2 3.49Å; T39-E51 PolarHBondContact OG1-OE1 3.47Å; T39-E51 PolarHBondContact OG1-OE2 2.99Å; S41-E51 VanDerWaalsContact CB-CD 3.44Å; S41-E51 VanDerWaalsContact CB-OE1 3.26Å; S41-E51 WeakPolarHBondContact CB-OE1 3.46Å; S41-E51 PolarHBondContact OG-OE1 2.98Å; M46-E51 HydrophobicContact CG-CB 4.23Å; M46-E51 HydrophobicContact SD-CB 3.82Å; M46-E51 HydrophobicContact SD-CG 4.49Å; E47-E51 PolarHBondContact O-N 3.5Å; Y48-E51 WeakPolarHBondContact O-CB 3.36Å; Y48-E51 PolarHBondContact O-N 3.44Å; E49-E51 VanDerWaalsContact C-N 3.27Å; E49-E51 PolarHBondContact O-N 3.32Å; E51-D53 VanDerWaalsContact C-N 3.27Å; E51-D53 PolarHBondContact O-N 2.85Å; E51-L54 PolarHBondContact O-N 3.02Å; E51-R55 WeakPolarHBondContact O-CG 3.48Å; E51-R55 PolarHBondContact O-N 2.97Å; E51-R55 IonicContact OE1-CZ 3.18Å; E51-R55 IonicContact OE1-NE 2.63Å; E51-R55 IonicContact OE1-NH2 3.03Å; E51-R55 PolarHBondContact OE1-NH2 2.92Å; E51-F92 HydrophobicContact CG-CD2 3.96Å; E51-F92 HydrophobicContact CG-CE2 3.92Å
52	I	95.9	Very high	96.1	Very high	38 Å²	38	43.2 Å²	43.2	20%	0.195	20%	0.202	C	C	.	.	H	α-helix	trans	-59.1	-42.6	175.6	-67.1	166.4	0	0	0	110.4	Y48 E49 L54 R55 I56 R263	Y48-I52 HydrophobicContact CD1-CD1 3.91Å; Y48-I52 HydrophobicContact CD2-CD1 4.49Å; Y48-I52 HydrophobicContact CE1-CD1 3.53Å; Y48-I52 HydrophobicContact CE2-CD1 4.15Å; Y48-I52 HydrophobicContact CG-CD1 4.39Å; Y48-I52 WeakPolarHBondContact O-CG1 3.43Å; Y48-I52 PolarHBondContact O-N 2.93Å; E49-I52 PolarHBondContact O-N 3.17Å; I52-L54 VanDerWaalsContact C-N 3.31Å; I52-L54 PolarHBondContact O-N 3.48Å; I52-R55 WeakPolarHBondContact O-CB 3.35Å; I52-R55 PolarHBondContact O-N 3.31Å; I52-R55 VanDerWaalsContact O-N 3.16Å; I52-I56 HydrophobicContact CG2-CD1 3.71Å; I52-I56 HydrophobicContact CG2-CG1 4.34Å; I52-I56 WeakPolarHBondContact O-CG1 3.44Å; I52-I56 PolarHBondContact O-N 3.35Å; I52-R263 VanDerWaalsContact CG2-CZ 3.49Å
53	D	96.6	Very high	96.2	Very high	28 Å²	28	43.7 Å²	43.7	15%	0.15	20%	0.204	C	C	.	.	H	α-helix	trans	-59.9	-39.9	177	-77.4	-1.4	0	0	0	112.3	E49 E51 L57 R263 V266 L271	E49-D53 WeakPolarHBondContact O-CB 3.06Å; E49-D53 PolarHBondContact O-N 2.97Å; E51-D53 VanDerWaalsContact C-N 3.27Å; E51-D53 PolarHBondContact O-N 2.85Å; D53-L57 WeakPolarHBondContact O-CB 3.31Å; D53-L57 PolarHBondContact O-N 3.49Å; D53-R263 IonicContact OD1-CZ 3.46Å; D53-R263 IonicContact OD1-NE 3.02Å; D53-R263 PolarHBondContact OD1-NE 2.94Å; D53-R263 IonicContact OD1-NH2 2.74Å; D53-R263 PolarHBondContact OD1-NH2 3.38Å; D53-V266 HydrophobicContact CB-CG1 4Å; D53-V266 HydrophobicContact CB-CG2 3.81Å; D53-V266 WeakPolarHBondContact OD1-CG2 3.45Å; D53-V266 WeakPolarHBondContact OD2-CG1 3.38Å; D53-V266 WeakPolarHBondContact OD2-CG2 3.45Å; D53-L271 HydrophobicContact CB-CD1 3.75Å; D53-L271 HydrophobicContact CB-CD2 4.16Å
54	L	97.1	Very high	96.3	Very high	1 Å²	1	40.6 Å²	40.6	1%	0.005	19%	0.189	C	C	.	.	H	α-helix	trans	-70.8	-30.9	175.3	-75.1	167.6	0	0	0	113.7	M46 T50 E51 I52 G58 Y83 F92 Y97 L271 L275	M46-L54 HydrophobicContact CE-CD1 3.77Å; M46-L54 HydrophobicContact SD-CD1 3.72Å; T50-L54 HydrophobicContact CG2-CD1 4.46Å; T50-L54 WeakPolarHBondContact O-CG 3.38Å; T50-L54 PolarHBondContact O-N 3.34Å; E51-L54 PolarHBondContact O-N 3.02Å; I52-L54 VanDerWaalsContact C-N 3.31Å; I52-L54 PolarHBondContact O-N 3.48Å; L54-G58 PolarHBondContact O-N 2.8Å; L54-G58 VanDerWaalsContact O-N 3.13Å; L54-Y83 PolarHBondContact O-OH 2.85Å; L54-F92 HydrophobicContact CB-CD1 4.11Å; L54-F92 HydrophobicContact CB-CD2 4.25Å; L54-F92 HydrophobicContact CB-CE1 3.98Å; L54-F92 HydrophobicContact CB-CE2 4.12Å; L54-F92 HydrophobicContact CB-CG 4.26Å; L54-F92 HydrophobicContact CB-CZ 3.98Å; L54-F92 HydrophobicContact CD1-CB 4.01Å; L54-F92 HydrophobicContact CD1-CD1 4.32Å; L54-F92 HydrophobicContact CD1-CD2 4.4Å; L54-F92 HydrophobicContact CD1-CG 4.01Å; L54-Y97 HydrophobicContact CD2-CD1 4.18Å; L54-Y97 HydrophobicContact CD2-CG 4.21Å; L54-L271 HydrophobicContact CD2-CD2 3.48Å; L54-L271 VanDerWaalsContact CD2-CD2 3.48Å; L54-L271 HydrophobicContact CD2-CG 3.81Å; L54-L271 HydrophobicContact CG-CD1 4.25Å; L54-L271 HydrophobicContact CG-CD2 3.77Å; L54-L271 HydrophobicContact CG-CG 3.97Å; L54-L275 HydrophobicContact CD1-CD1 3.98Å; L54-L275 HydrophobicContact CD1-CD2 3.81Å; L54-L275 HydrophobicContact CD1-CG 3.89Å; L54-L275 HydrophobicContact CD2-CD1 3.55Å; L54-L275 HydrophobicContact CD2-CG 4.25Å; L54-L275 HydrophobicContact CG-CD1 4.44Å
55	R	97.2	Very high	96.5	Very high	9 Å²	9	39.6 Å²	39.6	3%	0.034	18%	0.183	C	C	.	.	H	α-helix	trans	-67.3	-51.3	172.9	-70.8	174.8	-176.4	-78.5	-2	110.8	E51 I52 G58 C59 Q84 F87 F92	E51-R55 WeakPolarHBondContact O-CG 3.48Å; E51-R55 PolarHBondContact O-N 2.97Å; E51-R55 IonicContact OE1-CZ 3.18Å; E51-R55 IonicContact OE1-NE 2.63Å; E51-R55 IonicContact OE1-NH2 3.03Å; E51-R55 PolarHBondContact OE1-NH2 2.92Å; I52-R55 WeakPolarHBondContact O-CB 3.35Å; I52-R55 PolarHBondContact O-N 3.31Å; I52-R55 VanDerWaalsContact O-N 3.16Å; R55-G58 PolarHBondContact O-N 3.34Å; R55-C59 PolarHBondContact O-N 3.14Å; R55-C59 VanDerWaalsContact O-N 3.09Å; R55-C59 PolarHBondContact O-SG 2.94Å; R55-Q84 PolarHBondContact NH1-O 3.18Å; R55-F87 VanDerWaalsContact NH2-C 3.26Å; R55-F87 PolarHBondContact NH2-O 2.78Å; R55-F92 HydrophobicContact CG-CE2 3.74Å; R55-F92 HydrophobicContact CG-CZ 3.81Å
56	I	97.1	Very high	96.7	Very high	19 Å²	19	31 Å²	31	10%	0.097	15%	0.146	C	C	.	.	H	α-helix	trans	-60.1	-51.7	177.9	-66.3	167.3	0	0	0	110.5	I52 G58 C59 E60 L260	I52-I56 HydrophobicContact CG2-CD1 3.71Å; I52-I56 HydrophobicContact CG2-CG1 4.34Å; I52-I56 WeakPolarHBondContact O-CG1 3.44Å; I52-I56 PolarHBondContact O-N 3.35Å; I56-G58 VanDerWaalsContact C-N 3.29Å; I56-G58 PolarHBondContact O-N 2.62Å; I56-C59 PolarHBondContact O-N 3.49Å; I56-C59 VanDerWaalsContact O-N 3.11Å; I56-E60 HydrophobicContact CG2-CG 4.37Å; I56-E60 WeakPolarHBondContact O-CG 3.34Å; I56-E60 PolarHBondContact O-N 3.16Å; I56-L260 HydrophobicContact CD1-CD1 3.66Å; I56-L260 HydrophobicContact CG1-CD1 4.04Å
57	L	96.6	Very high	96.8	Very high	16 Å²	16	34.3 Å²	34.3	8%	0.084	17%	0.166	C	C	.	.	H	α-helix	trans	-56.7	-41.8	179.9	174.8	62.9	0	0	0	112.4	D53 E60 L61 Y97 V268 L271	D53-L57 WeakPolarHBondContact O-CB 3.31Å; D53-L57 PolarHBondContact O-N 3.49Å; L57-E60 PolarHBondContact O-N 3.12Å; L57-L61 HydrophobicContact CD1-CG 4.45Å; L57-L61 WeakPolarHBondContact O-CG 3.45Å; L57-L61 PolarHBondContact O-N 2.99Å; L57-Y97 HydrophobicContact CD2-CD2 4.35Å; L57-Y97 HydrophobicContact CD2-CE2 3.52Å; L57-Y97 HydrophobicContact CG-CE2 3.82Å; L57-V268 HydrophobicContact CD1-CG1 4.48Å; L57-V268 HydrophobicContact CD1-CG2 3.71Å; L57-V268 HydrophobicContact CD2-CB 4.37Å; L57-V268 HydrophobicContact CD2-CG1 3.54Å; L57-V268 HydrophobicContact CD2-CG2 3.95Å; L57-V268 HydrophobicContact CG-CG2 4.49Å; L57-L271 HydrophobicContact CD2-CD2 3.71Å
58	G	97.7	Very high	96.9	Very high	0 Å²	0	32.2 Å²	32.2	0%	0	16%	0.159	C	C	.	.	H	α-helix	trans	-61.8	-46.4	175.2	0	0	0	0	0	113.1	L54 R55 I56 E60 L61 I62 Y83	L54-G58 PolarHBondContact O-N 2.8Å; L54-G58 VanDerWaalsContact O-N 3.13Å; R55-G58 PolarHBondContact O-N 3.34Å; I56-G58 VanDerWaalsContact C-N 3.29Å; I56-G58 PolarHBondContact O-N 2.62Å; G58-E60 VanDerWaalsContact C-N 3.3Å; G58-E60 PolarHBondContact O-N 3Å; G58-L61 PolarHBondContact O-N 3.37Å; G58-I62 VanDerWaalsContact O-CG1 3.29Å; G58-I62 WeakPolarHBondContact O-CG1 3.46Å; G58-I62 PolarHBondContact O-N 3.44Å; G58-Y83 VanDerWaalsContact CA-OH 3.32Å; G58-Y83 WeakPolarHBondContact CA-OH 3.38Å
59	C	97.8	Very high	97.1	Very high	0 Å²	0	27.1 Å²	27.1	0%	0	14%	0.14	C	C	.	.	H	α-helix	trans	-64.5	-33.3	176.5	-68.5	0	0	0	0	112.6	R55 I56 I62 Q63 Q80 L204 R205	R55-C59 PolarHBondContact O-N 3.14Å; R55-C59 VanDerWaalsContact O-N 3.09Å; R55-C59 PolarHBondContact O-SG 2.94Å; I56-C59 PolarHBondContact O-N 3.49Å; I56-C59 VanDerWaalsContact O-N 3.11Å; C59-I62 PolarHBondContact O-N 3.2Å; C59-Q63 PolarHBondContact O-N 3.47Å; C59-Q80 HydrophobicContact CB-CG 3.96Å; C59-Q80 PolarHBondContact O-NE2 2.63Å; C59-L204 PolarHBondContact SG-O 3.31Å; C59-L204 VanDerWaalsContact SG-O 3.37Å; C59-R205 HydrophobicContact CB-CB 4.2Å; C59-R205 HydrophobicContact CB-CG 4.02Å
60	E	96.3	Very high	97.2	Very high	78 Å²	78	32.1 Å²	32.1	36%	0.364	16%	0.155	S	C	.	.	H	α-helix	trans	-67.9	-44.7	173	-69.5	-168.9	158.1	0	0	112.4	I56 L57 G58 I62 Q63 D64 R205	I56-E60 HydrophobicContact CG2-CG 4.37Å; I56-E60 WeakPolarHBondContact O-CG 3.34Å; I56-E60 PolarHBondContact O-N 3.16Å; L57-E60 PolarHBondContact O-N 3.12Å; G58-E60 VanDerWaalsContact C-N 3.3Å; G58-E60 PolarHBondContact O-N 3Å; E60-I62 VanDerWaalsContact C-N 3.28Å; E60-I62 PolarHBondContact O-N 3.24Å; E60-Q63 PolarHBondContact O-N 2.68Å; E60-D64 PolarHBondContact O-N 2.77Å; E60-R205 IonicContact OE1-CZ 2.76Å; E60-R205 IonicContact OE1-NH1 2.85Å; E60-R205 PolarHBondContact OE1-NH1 3.3Å
61	L	97.6	Very high	97.3	Very high	12 Å²	12	32.1 Å²	32.1	6%	0.063	15%	0.154	C	C	.	.	H	α-helix	trans	-59.8	-39.1	173.4	-71.6	-179.1	0	0	0	111.8	L57 G58 S65 Y97 E98 F125 I128	L57-L61 HydrophobicContact CD1-CG 4.45Å; L57-L61 WeakPolarHBondContact O-CG 3.45Å; L57-L61 PolarHBondContact O-N 2.99Å; G58-L61 PolarHBondContact O-N 3.37Å; L61-S65 WeakPolarHBondContact O-CB 3.5Å; L61-S65 PolarHBondContact O-N 2.95Å; L61-S65 PolarHBondContact O-OG 3.31Å; L61-Y97 HydrophobicContact CD1-CD2 4.33Å; L61-Y97 HydrophobicContact CD1-CE2 3.61Å; L61-E98 HydrophobicContact CD1-CG 4.29Å; L61-F125 HydrophobicContact CB-CE1 3.94Å; L61-F125 HydrophobicContact CB-CZ 4.35Å; L61-F125 HydrophobicContact CD1-CE1 4.2Å; L61-I128 HydrophobicContact CD2-CG2 3.62Å
62	I	98.4	Very high	97.3	Very high	0 Å²	0	33.8 Å²	33.8	0%	0	17%	0.166	C	C	.	.	H	α-helix	trans	-65.1	-41	175.5	-69	167.3	0	0	0	111.3	G58 C59 E60 S65 G66 A79 Q80 Y83 A101 C104 I105	G58-I62 VanDerWaalsContact O-CG1 3.29Å; G58-I62 WeakPolarHBondContact O-CG1 3.46Å; G58-I62 PolarHBondContact O-N 3.44Å; C59-I62 PolarHBondContact O-N 3.2Å; E60-I62 VanDerWaalsContact C-N 3.28Å; E60-I62 PolarHBondContact O-N 3.24Å; I62-S65 PolarHBondContact O-OG 3.38Å; I62-G66 PolarHBondContact O-N 3.44Å; I62-A79 HydrophobicContact CG2-CB 3.46Å; I62-A79 VanDerWaalsContact CG2-CB 3.46Å; I62-Q80 HydrophobicContact CB-CG 4.1Å; I62-Q80 HydrophobicContact CD1-CG 4.44Å; I62-Q80 HydrophobicContact CG2-CG 3.78Å; I62-Y83 HydrophobicContact CD1-CD1 4.49Å; I62-Y83 HydrophobicContact CD1-CD2 3.95Å; I62-Y83 HydrophobicContact CD1-CG 3.8Å; I62-A101 HydrophobicContact CD1-CB 4.37Å; I62-A101 HydrophobicContact CG1-CB 3.99Å; I62-C104 HydrophobicContact CD1-CB 4.38Å; I62-I105 HydrophobicContact CG2-CB 4.48Å; I62-I105 HydrophobicContact CG2-CD1 4.17Å
63	Q	97.2	Very high	97.2	Very high	46 Å²	46	33.6 Å²	33.6	22%	0.215	16%	0.164	C	C	.	.	H	α-helix	trans	-69.3	-52.8	179	-172.5	69	29	0	0	112.4	C59 E60 S65 G66 V67 Q73	C59-Q63 PolarHBondContact O-N 3.47Å; E60-Q63 PolarHBondContact O-N 2.68Å; Q63-S65 VanDerWaalsContact C-N 3.3Å; Q63-S65 PolarHBondContact O-N 3.47Å; Q63-G66 PolarHBondContact O-N 3.05Å; Q63-V67 WeakPolarHBondContact O-CG2 3.34Å; Q63-V67 PolarHBondContact O-N 3.4Å; Q63-Q73 VanDerWaalsContact OE1-NE2 3.15Å
64	D	97.4	Very high	97.2	Very high	56 Å²	56	34.6 Å²	34.6	30%	0.299	17%	0.171	S	C	.	.	H	α-helix	trans	-67.2	-32.3	-179.1	-88.9	-27.3	0	0	0	111	E60 L68 I128 R506	E60-D64 PolarHBondContact O-N 2.77Å; D64-L68 WeakPolarHBondContact O-CG 3.43Å; D64-L68 PolarHBondContact O-N 3.18Å; D64-L68 VanDerWaalsContact O-N 3.14Å; D64-I128 HydrophobicContact CB-CD1 4.41Å; D64-R506 IonicContact OD1-CZ 3.15Å; D64-R506 IonicContact OD1-NH1 2.85Å; D64-R506 PolarHBondContact OD1-NH1 2.57Å; D64-R506 IonicContact OD1-NH2 3.18Å; D64-R506 PolarHBondContact OD1-NH2 3.46Å; D64-R506 IonicContact OD2-NH1 2.94Å; D64-R506 PolarHBondContact OD2-NH1 3Å
65	S	98.2	Very high	97.2	Very high	0 Å²	0	34.5 Å²	34.5	0%	0	17%	0.17	C	C	.	.	H	α-helix	trans	-70.1	-41.1	172.9	64.9	0	0	0	0	113.2	L61 I62 Q63 V67 L68 L69 F125	L61-S65 WeakPolarHBondContact O-CB 3.5Å; L61-S65 PolarHBondContact O-N 2.95Å; L61-S65 PolarHBondContact O-OG 3.31Å; I62-S65 PolarHBondContact O-OG 3.38Å; Q63-S65 VanDerWaalsContact C-N 3.3Å; Q63-S65 PolarHBondContact O-N 3.47Å; S65-V67 VanDerWaalsContact C-N 3.33Å; S65-V67 PolarHBondContact O-N 3.02Å; S65-L68 PolarHBondContact O-N 2.89Å; S65-L69 WeakPolarHBondContact O-CB 3.39Å; S65-L69 VanDerWaalsContact O-CG 3.25Å; S65-L69 WeakPolarHBondContact O-CG 3.46Å; S65-L69 PolarHBondContact O-N 3.5Å; S65-F125 VanDerWaalsContact CB-CE2 3.4Å; S65-F125 VanDerWaalsContact OG-CE2 3.31Å; S65-F125 WeakPolarHBondContact OG-CE2 3.43Å
66	G	98	Very high	97.2	Very high	0 Å²	0	34.5 Å²	34.5	0%	0	17%	0.171	C	C	.	.	H	α-helix	trans	-63.2	-37.4	175.8	0	0	0	0	0	113	I62 Q63 L69 R70 L71 M76	I62-G66 PolarHBondContact O-N 3.44Å; Q63-G66 PolarHBondContact O-N 3.05Å; G66-L69 CarbonylContact O-C 3.57Å; G66-L69 PolarHBondContact O-N 2.93Å; G66-R70 PolarHBondContact O-N 2.95Å; G66-L71 PolarHBondContact O-N 3.38Å; G66-M76 VanDerWaalsContact CA-SD 3.54Å
67	V	97.5	Very high	97.1	Very high	76 Å²	76	33.6 Å²	33.6	46%	0.461	17%	0.166	S	C	.	.	H	α-helix	trans	-62.6	-46.2	172.2	170	0	0	0	0	111.3	Q63 S65 R70 M76	Q63-V67 WeakPolarHBondContact O-CG2 3.34Å; Q63-V67 PolarHBondContact O-N 3.4Å; S65-V67 VanDerWaalsContact C-N 3.33Å; S65-V67 PolarHBondContact O-N 3.02Å; V67-R70 PolarHBondContact O-N 2.97Å; V67-R70 VanDerWaalsContact O-N 3.07Å; V67-M76 HydrophobicContact CG2-CE 4.33Å; V67-M76 HydrophobicContact CG2-SD 4.06Å; V67-M76 PolarHBondContact N-SD 2.97Å
68	L	97.5	Very high	97.2	Very high	78 Å²	78	32.9 Å²	32.9	41%	0.408	16%	0.162	S	C	.	.	H	α-helix	trans	-66.7	-35.9	178	-72.2	169.4	0	0	0	112.7	D64 S65 R70 V124 I128	D64-L68 WeakPolarHBondContact O-CG 3.43Å; D64-L68 PolarHBondContact O-N 3.18Å; D64-L68 VanDerWaalsContact O-N 3.14Å; S65-L68 PolarHBondContact O-N 2.89Å; L68-R70 PolarHBondContact O-N 3.12Å; L68-V124 HydrophobicContact CB-CG1 3.73Å; L68-V124 HydrophobicContact CB-CG2 4Å; L68-V124 HydrophobicContact CD1-CG1 3.92Å; L68-V124 HydrophobicContact CG-CG1 4.49Å; L68-I128 HydrophobicContact CD1-CD1 4.07Å; L68-I128 HydrophobicContact CD1-CG1 3.74Å
69	L	97.9	Very high	97.2	Very high	14 Å²	14	32.9 Å²	32.9	7%	0.073	16%	0.162	C	C	.	.	T	Hydrogen-bonded Turn	trans	-75.1	-5	171.9	-68.1	168.5	0	0	0	113.4	S65 G66 L71 I105 R116 D120 V121 V124	S65-L69 WeakPolarHBondContact O-CB 3.39Å; S65-L69 VanDerWaalsContact O-CG 3.25Å; S65-L69 WeakPolarHBondContact O-CG 3.46Å; S65-L69 PolarHBondContact O-N 3.5Å; G66-L69 CarbonylContact O-C 3.57Å; G66-L69 PolarHBondContact O-N 2.93Å; L69-L71 VanDerWaalsContact C-N 3.31Å; L69-L71 HydrophobicContact CB-CD1 3.98Å; L69-L71 HydrophobicContact CB-CG 3.99Å; L69-L71 HydrophobicContact CD1-CD1 4.03Å; L69-L71 PolarHBondContact O-N 3.22Å; L69-I105 HydrophobicContact CD1-CG1 4.32Å; L69-R116 HydrophobicContact CB-CG 4.46Å; L69-R116 HydrophobicContact CD2-CG 4.35Å; L69-R116 PolarHBondContact O-NE 2.79Å; L69-R116 PolarHBondContact O-NH2 3.17Å; L69-R116 VanDerWaalsContact O-NH2 3.08Å; L69-D120 HydrophobicContact CD2-CB 3.92Å; L69-V121 HydrophobicContact CD1-CG2 4.04Å; L69-V121 HydrophobicContact CD2-CG2 4.49Å; L69-V124 HydrophobicContact CD2-CB 4.43Å; L69-V124 HydrophobicContact CD2-CG2 3.88Å; L69-V124 HydrophobicContact CG-CB 4.43Å; L69-V124 HydrophobicContact CG-CG1 4.4Å; L69-V124 HydrophobicContact CG-CG2 4.1Å
70	R	97.4	Very high	97.2	Very high	186 Å²	186	33 Å²	33	70%	0.702	16%	0.163	S	C	*	.	T	Hydrogen-bonded Turn	trans	52.4	45.9	-175.1	-52.5	-177.9	-175.2	-177.8	1.9	112.6	G66 V67 L68 R116	G66-R70 PolarHBondContact O-N 2.95Å; V67-R70 PolarHBondContact O-N 2.97Å; V67-R70 VanDerWaalsContact O-N 3.07Å; L68-R70 PolarHBondContact O-N 3.12Å; R70-R116 PolarHBondContact O-NH2 2.93Å
71	L	97.6	Very high	97.2	Very high	14 Å²	14	29.4 Å²	29.4	7%	0.073	15%	0.146	C	C	.	.			trans	-83.8	153.3	175.6	-73.8	169.7	0	0	0	111	G66 L69 A75 I105 A109 S114 R116	G66-L71 PolarHBondContact O-N 3.38Å; L69-L71 VanDerWaalsContact C-N 3.31Å; L69-L71 HydrophobicContact CB-CD1 3.98Å; L69-L71 HydrophobicContact CB-CG 3.99Å; L69-L71 HydrophobicContact CD1-CD1 4.03Å; L69-L71 PolarHBondContact O-N 3.22Å; L71-A75 HydrophobicContact CB-CB 4.3Å; L71-I105 HydrophobicContact CD1-CD1 3.55Å; L71-I105 HydrophobicContact CD1-CG1 3.66Å; L71-A109 HydrophobicContact CD1-CB 4.05Å; L71-A109 HydrophobicContact CD2-CB 3.77Å; L71-S114 VanDerWaalsContact CD2-O 3.24Å; L71-S114 WeakPolarHBondContact CD2-O 3.39Å; L71-R116 HydrophobicContact CD2-CG 4.06Å; L71-R116 HydrophobicContact CG-CG 4.46Å
72	P	96.6	Very high	97.2	Very high	39 Å²	39	28.8 Å²	28.8	25%	0.253	14%	0.143	S	C	.	.			trans	-66.9	155.6	173.7	29.2	-34.3	0	0	0	111	V74 A75 M76 Y592	P72-V74 PolarHBondContact O-N 3.29Å; P72-A75 HydrophobicContact CG-CB 3.9Å; P72-A75 PolarHBondContact O-N 2.92Å; P72-M76 PolarHBondContact O-N 3.22Å; P72-Y592 HydrophobicContact CB-CE1 4.33Å
73	Q	94.3	Very high	97.1	Very high	34 Å²	34	28.8 Å²	28.8	16%	0.159	14%	0.143	C	C	.	.	H	α-helix	trans	-63.3	-27.9	-179.4	-173.5	61.7	56.7	0	0	112.3	Q63 A75 M76 A77 Y592	Q63-Q73 VanDerWaalsContact OE1-NE2 3.15Å; Q73-A75 PolarHBondContact O-N 3.38Å; Q73-M76 HydrophobicContact CB-CE 4.36Å; Q73-M76 PolarHBondContact O-N 3.41Å; Q73-A77 WeakPolarHBondContact O-CB 3.22Å; Q73-A77 PolarHBondContact O-N 3.42Å; Q73-Y592 HydrophobicContact CB-CE1 4.25Å; Q73-Y592 PolarHBondContact N-OH 3.32Å
74	V	95.3	Very high	97.1	Very high	48 Å²	48	26.8 Å²	26.8	29%	0.291	13%	0.134	S	C	.	.	H	α-helix	trans	-58.9	-45.2	171.8	-159.2	0	0	0	0	111.1	P72 M76 A77 T78 E112 Y592	P72-V74 PolarHBondContact O-N 3.29Å; V74-M76 PolarHBondContact O-N 3.3Å; V74-A77 PolarHBondContact O-N 3.11Å; V74-T78 WeakPolarHBondContact O-CB 3Å; V74-T78 PolarHBondContact O-N 2.96Å; V74-T78 PolarHBondContact O-OG1 2.91Å; V74-T78 VanDerWaalsContact O-OG1 3.11Å; V74-E112 HydrophobicContact CB-CG 4.5Å; V74-E112 HydrophobicContact CG1-CG 4.4Å; V74-E112 WeakPolarHBondContact CG1-OE2 3.42Å; V74-Y592 WeakPolarHBondContact CG2-OH 3.4Å; V74-Y592 PolarHBondContact N-OH 3.17Å
75	A	96.9	Very high	97	Very high	0 Å²	0	24.6 Å²	24.6	0%	0	12%	0.121	C	C	.	.	H	α-helix	trans	-67.3	-34.9	179.2	0	0	0	0	0	113.1	L71 P72 Q73 A79 A108 E112	L71-A75 HydrophobicContact CB-CB 4.3Å; P72-A75 HydrophobicContact CG-CB 3.9Å; P72-A75 PolarHBondContact O-N 2.92Å; Q73-A75 PolarHBondContact O-N 3.38Å; A75-A79 VanDerWaalsContact O-CB 3.25Å; A75-A79 WeakPolarHBondContact O-CB 3.33Å; A75-A79 PolarHBondContact O-N 3.36Å; A75-A108 VanDerWaalsContact O-CB 3.29Å; A75-A108 WeakPolarHBondContact O-CB 3.43Å; A75-E112 HydrophobicContact CB-CB 3.98Å; A75-E112 HydrophobicContact CB-CG 3.86Å
76	M	97.2	Very high	96.9	Very high	8 Å²	8	24.7 Å²	24.7	4%	0.039	12%	0.122	C	C	.	.	H	α-helix	trans	-67.9	-43.3	173.7	-67.6	-174.1	-75.8	0	0	111.4	G66 V67 P72 Q73 V74 A79 Q80 I105	G66-M76 VanDerWaalsContact CA-SD 3.54Å; V67-M76 HydrophobicContact CG2-CE 4.33Å; V67-M76 HydrophobicContact CG2-SD 4.06Å; V67-M76 PolarHBondContact N-SD 2.97Å; P72-M76 PolarHBondContact O-N 3.22Å; Q73-M76 HydrophobicContact CB-CE 4.36Å; Q73-M76 PolarHBondContact O-N 3.41Å; V74-M76 PolarHBondContact O-N 3.3Å; M76-A79 PolarHBondContact O-N 2.85Å; M76-Q80 WeakPolarHBondContact O-CG 3.42Å; M76-Q80 PolarHBondContact O-N 2.95Å; M76-Q80 PolarHBondContact O-OE1 3.1Å; M76-I105 HydrophobicContact CG-CD1 4.35Å
77	A	96.7	Very high	96.9	Very high	0 Å²	0	24.7 Å²	24.7	0%	0	12%	0.122	C	C	.	.	H	α-helix	trans	-65.1	-47.6	176	0	0	0	0	0	112.1	Q73 V74 A79 Q80 V81 H172 L204	Q73-A77 WeakPolarHBondContact O-CB 3.22Å; Q73-A77 PolarHBondContact O-N 3.42Å; V74-A77 PolarHBondContact O-N 3.11Å; A77-A79 VanDerWaalsContact C-N 3.3Å; A77-A79 PolarHBondContact O-N 3.25Å; A77-Q80 PolarHBondContact O-N 3.03Å; A77-Q80 VanDerWaalsContact O-N 3.13Å; A77-V81 WeakPolarHBondContact O-CG2 3Å; A77-V81 PolarHBondContact O-N 3.37Å; A77-H172 VanDerWaalsContact C-CE1 3.42Å; A77-H172 VanDerWaalsContact CB-CE1 3.47Å; A77-H172 WeakPolarHBondContact CB-CE1 3.48Å; A77-L204 HydrophobicContact CB-CD1 3.71Å; A77-L204 HydrophobicContact CB-CD2 3.85Å; A77-L204 HydrophobicContact CB-CG 4.48Å
78	T	96.8	Very high	96.8	Very high	1 Å²	1	22.1 Å²	22.1	1%	0.006	10%	0.104	C	C	.	.	H	α-helix	trans	-57.2	-43.4	175	-65.5	0	0	0	0	110.7	V74 Q80 V81 L82 A108 L111 E112 H172	V74-T78 WeakPolarHBondContact O-CB 3Å; V74-T78 PolarHBondContact O-N 2.96Å; V74-T78 PolarHBondContact O-OG1 2.91Å; V74-T78 VanDerWaalsContact O-OG1 3.11Å; T78-Q80 PolarHBondContact O-N 2.89Å; T78-V81 PolarHBondContact O-N 3.32Å; T78-L82 HydrophobicContact CG2-CD1 3.97Å; T78-L82 HydrophobicContact CG2-CG 4.4Å; T78-L82 WeakPolarHBondContact O-CB 3.43Å; T78-L82 WeakPolarHBondContact O-CG 3.49Å; T78-L82 PolarHBondContact O-N 3.45Å; T78-A108 HydrophobicContact CG2-CB 3.94Å; T78-L111 HydrophobicContact CG2-CD1 4.38Å; T78-E112 WeakPolarHBondContact CB-OE1 3.42Å; T78-E112 PolarHBondContact OG1-OE1 3.31Å; T78-H172 PolarHBondContact N-CE1 2.72Å; T78-H172 PolarHBondContact N-NE2 2.78Å; T78-H172 PolarHBondContact OG1-NE2 3.03Å
79	A	98	Very high	96.7	Very high	0 Å²	0	20.5 Å²	20.5	0%	0	10%	0.099	C	C	.	.	H	α-helix	trans	-61.8	-41.1	175.2	0	0	0	0	0	113.4	I62 A75 M76 A77 Y83 C104 I105 A108	I62-A79 HydrophobicContact CG2-CB 3.46Å; I62-A79 VanDerWaalsContact CG2-CB 3.46Å; A75-A79 VanDerWaalsContact O-CB 3.25Å; A75-A79 WeakPolarHBondContact O-CB 3.33Å; A75-A79 PolarHBondContact O-N 3.36Å; M76-A79 PolarHBondContact O-N 2.85Å; A77-A79 VanDerWaalsContact C-N 3.3Å; A77-A79 PolarHBondContact O-N 3.25Å; A79-Y83 VanDerWaalsContact O-CB 3.31Å; A79-Y83 WeakPolarHBondContact O-CB 3.5Å; A79-Y83 PolarHBondContact O-N 2.89Å; A79-C104 HydrophobicContact CB-CB 4.38Å; A79-C104 WeakPolarHBondContact O-CB 3.45Å; A79-I105 HydrophobicContact CB-CB 4.22Å; A79-I105 HydrophobicContact CB-CD1 3.78Å; A79-A108 HydrophobicContact CB-CB 3.71Å
80	Q	97.8	Very high	96.6	Very high	3 Å²	3	23 Å²	23	1%	0.014	11%	0.109	C	C	.	.	H	α-helix	trans	-65.9	-42.5	177.1	-73.8	160.1	-27.7	0	0	111.9	C59 I62 M76 A77 T78 Y83 Q84 L204	C59-Q80 HydrophobicContact CB-CG 3.96Å; C59-Q80 PolarHBondContact O-NE2 2.63Å; I62-Q80 HydrophobicContact CB-CG 4.1Å; I62-Q80 HydrophobicContact CD1-CG 4.44Å; I62-Q80 HydrophobicContact CG2-CG 3.78Å; M76-Q80 WeakPolarHBondContact O-CG 3.42Å; M76-Q80 PolarHBondContact O-N 2.95Å; M76-Q80 PolarHBondContact O-OE1 3.1Å; A77-Q80 PolarHBondContact O-N 3.03Å; A77-Q80 VanDerWaalsContact O-N 3.13Å; T78-Q80 PolarHBondContact O-N 2.89Å; Q80-Y83 PolarHBondContact O-N 3.26Å; Q80-Q84 WeakPolarHBondContact O-CG 3.16Å; Q80-Q84 PolarHBondContact O-N 3.2Å; Q80-L204 HydrophobicContact CB-CB 4.38Å; Q80-L204 VanDerWaalsContact OE1-CB 3.29Å
81	V	96.5	Very high	96.6	Very high	2 Å²	2	14.2 Å²	14.2	1%	0.012	8%	0.076	C	C	.	.	H	α-helix	trans	-63.4	-44.4	175.5	176.8	0	0	0	0	111.6	A77 T78 Y83 Q84 R85 A170 L204 F209	A77-V81 WeakPolarHBondContact O-CG2 3Å; A77-V81 PolarHBondContact O-N 3.37Å; T78-V81 PolarHBondContact O-N 3.32Å; V81-Y83 VanDerWaalsContact C-N 3.34Å; V81-Y83 PolarHBondContact O-N 3Å; V81-Q84 PolarHBondContact O-N 2.93Å; V81-R85 HydrophobicContact CG1-CG 4.47Å; V81-R85 WeakPolarHBondContact O-CB 3.29Å; V81-R85 WeakPolarHBondContact O-CG 3.37Å; V81-R85 PolarHBondContact O-N 3.39Å; V81-A170 HydrophobicContact CB-CB 4.31Å; V81-A170 HydrophobicContact CG1-CB 4.08Å; V81-L204 HydrophobicContact CG2-CD2 4.3Å; V81-F209 HydrophobicContact CG2-CB 4Å; V81-F209 HydrophobicContact CG2-CD1 3.63Å; V81-F209 HydrophobicContact CG2-CE1 4.4Å; V81-F209 HydrophobicContact CG2-CG 4.04Å
82	L	97.2	Very high	96.6	Very high	0 Å²	0	13.5 Å²	13.5	0%	0	7%	0.073	C	C	.	.	H	α-helix	trans	-62.1	-41.2	176.3	-68.7	171.4	0	0	0	112	T78 F86 C104 L107 A108 L111 L164 V168	T78-L82 HydrophobicContact CG2-CD1 3.97Å; T78-L82 HydrophobicContact CG2-CG 4.4Å; T78-L82 WeakPolarHBondContact O-CB 3.43Å; T78-L82 WeakPolarHBondContact O-CG 3.49Å; T78-L82 PolarHBondContact O-N 3.45Å; L82-F86 WeakPolarHBondContact O-CB 3.45Å; L82-F86 PolarHBondContact O-N 3.41Å; L82-C104 HydrophobicContact CB-CB 4.47Å; L82-L107 HydrophobicContact CD1-CD2 4.21Å; L82-L107 HydrophobicContact CD1-CG 4.33Å; L82-A108 HydrophobicContact CD1-CB 4.47Å; L82-L111 HydrophobicContact CD1-CD1 3.98Å; L82-L164 HydrophobicContact CB-CD1 4.47Å; L82-L164 HydrophobicContact CD2-CD1 3.55Å; L82-V168 HydrophobicContact CD2-CB 3.83Å; L82-V168 HydrophobicContact CD2-CG1 3.92Å
83	Y	97.9	Very high	96.5	Very high	0 Å²	0	11.8 Å²	11.8	0%	0	6%	0.061	C	C	.	.	H	α-helix	trans	-63.5	-48.7	177.1	179.2	-90.7	0	0	0	111.7	L54 G58 I62 A79 Q80 V81 F86 F87 F92 A101	L54-Y83 PolarHBondContact O-OH 2.85Å; G58-Y83 VanDerWaalsContact CA-OH 3.32Å; G58-Y83 WeakPolarHBondContact CA-OH 3.38Å; I62-Y83 HydrophobicContact CD1-CD1 4.49Å; I62-Y83 HydrophobicContact CD1-CD2 3.95Å; I62-Y83 HydrophobicContact CD1-CG 3.8Å; A79-Y83 VanDerWaalsContact O-CB 3.31Å; A79-Y83 WeakPolarHBondContact O-CB 3.5Å; A79-Y83 PolarHBondContact O-N 2.89Å; Q80-Y83 PolarHBondContact O-N 3.26Å; V81-Y83 VanDerWaalsContact C-N 3.34Å; V81-Y83 PolarHBondContact O-N 3Å; Y83-F86 PolarHBondContact O-N 2.96Å; Y83-F87 HydrophobicContact CD1-CD2 4.24Å; Y83-F87 HydrophobicContact CD2-CD2 4Å; Y83-F87 AromaticContact CD2-CE2 3.79Å; Y83-F87 HydrophobicContact CD2-CE2 3.79Å; Y83-F87 HydrophobicContact CE1-CD2 4.03Å; Y83-F87 HydrophobicContact CE1-CE2 4.42Å; Y83-F87 AromaticContact CE2-CD2 3.8Å; Y83-F87 HydrophobicContact CE2-CD2 3.8Å; Y83-F87 AromaticContact CE2-CE2 3.38Å; Y83-F87 HydrophobicContact CE2-CE2 3.38Å; Y83-F87 HydrophobicContact CE2-CZ 4.46Å; Y83-F87 HydrophobicContact CG-CD2 4.22Å; Y83-F87 HydrophobicContact CG-CE2 4.46Å; Y83-F87 AromaticContact CZ-CD2 3.79Å; Y83-F87 AromaticContact CZ-CE2 3.73Å; Y83-F87 WeakPolarHBondContact O-CD2 3.49Å; Y83-F87 PolarHBondContact O-N 3.47Å; Y83-F87 VanDerWaalsContact O-N 3.09Å; Y83-F92 HydrophobicContact CE1-CZ 4.37Å; Y83-F92 WeakPolarHBondContact OH-CE1 3.18Å; Y83-A101 HydrophobicContact CD2-CB 4.36Å; Y83-A101 HydrophobicContact CE2-CB 4.08Å
84	Q	96.5	Very high	96.5	Very high	4 Å²	4	17.5 Å²	17.5	2%	0.019	8%	0.082	C	C	.	.	H	α-helix	trans	-61	-49.7	177.2	-73.3	-73.4	31.3	0	0	111.8	R55 Q80 V81 F86 F87 Y88 T206 V210	R55-Q84 PolarHBondContact NH1-O 3.18Å; Q80-Q84 WeakPolarHBondContact O-CG 3.16Å; Q80-Q84 PolarHBondContact O-N 3.2Å; V81-Q84 PolarHBondContact O-N 2.93Å; Q84-F86 VanDerWaalsContact C-N 3.32Å; Q84-F86 PolarHBondContact O-N 3.11Å; Q84-F87 PolarHBondContact O-N 2.76Å; Q84-Y88 WeakPolarHBondContact O-CD2 3.15Å; Q84-Y88 PolarHBondContact O-N 3.13Å; Q84-T206 PolarHBondContact NE2-O 3.35Å; Q84-V210 HydrophobicContact CB-CG1 4.08Å
85	R	95.7	Very high	96.6	Very high	9 Å²	9	16.2 Å²	16.2	3%	0.034	7%	0.072	C	C	.	.	H	α-helix	trans	-55.4	-46.7	177.1	-75.1	-178	171.8	154.3	3.9	111.5	I29 V81 F87 Y88 S89 L164 H169 V210	I29-R85 PolarHBondContact O-NE 3.38Å; I29-R85 PolarHBondContact O-NH2 3.31Å; V81-R85 HydrophobicContact CG1-CG 4.47Å; V81-R85 WeakPolarHBondContact O-CB 3.29Å; V81-R85 WeakPolarHBondContact O-CG 3.37Å; V81-R85 PolarHBondContact O-N 3.39Å; R85-F87 PolarHBondContact O-N 3.37Å; R85-Y88 PolarHBondContact O-N 3.26Å; R85-S89 PolarHBondContact O-N 2.77Å; R85-S89 PolarHBondContact O-OG 3.12Å; R85-L164 HydrophobicContact CB-CD1 4.45Å; R85-L164 HydrophobicContact CB-CD2 3.63Å; R85-H169 PolarHBondContact NH1-O 2.65Å; R85-V210 HydrophobicContact CG-CG1 3.64Å
86	F	96.7	Very high	96.5	Very high	2 Å²	2	18.7 Å²	18.7	1%	0.009	8%	0.083	C	C	.	.	H	α-helix	trans	-59.4	-45.4	178.4	178.8	-94.8	0	0	0	112.4	L82 Y83 Q84 Y88 S89 K90 H95 Y100 V160 E163	L82-F86 WeakPolarHBondContact O-CB 3.45Å; L82-F86 PolarHBondContact O-N 3.41Å; Y83-F86 PolarHBondContact O-N 2.96Å; Q84-F86 VanDerWaalsContact C-N 3.32Å; Q84-F86 PolarHBondContact O-N 3.11Å; F86-Y88 PolarHBondContact O-N 3.4Å; F86-S89 CarbonylContact O-C 2.92Å; F86-S89 PolarHBondContact O-N 2.99Å; F86-K90 HydrophobicContact CD1-CB 4.46Å; F86-K90 HydrophobicContact CE1-CB 3.8Å; F86-K90 HydrophobicContact CE1-CG 4.47Å; F86-K90 HydrophobicContact CE2-CB 4.14Å; F86-K90 HydrophobicContact CE2-CG 3.92Å; F86-K90 HydrophobicContact CZ-CB 3.61Å; F86-K90 HydrophobicContact CZ-CG 3.79Å; F86-K90 PolarHBondContact O-N 2.55Å; F86-H95 HydrophobicContact CE1-CB 4.2Å; F86-Y100 AromaticContact CD1-CD1 3.59Å; F86-Y100 HydrophobicContact CD1-CD1 3.59Å; F86-Y100 AromaticContact CD1-CE1 3.91Å; F86-Y100 HydrophobicContact CD1-CE1 3.91Å; F86-Y100 HydrophobicContact CD1-CG 4.27Å; F86-Y100 HydrophobicContact CD2-CD1 4.47Å; F86-Y100 HydrophobicContact CD2-CE1 4.27Å; F86-Y100 AromaticContact CE1-CD1 3.38Å; F86-Y100 HydrophobicContact CE1-CD1 3.38Å; F86-Y100 HydrophobicContact CE1-CD2 4.49Å; F86-Y100 AromaticContact CE1-CE1 3.29Å; F86-Y100 HydrophobicContact CE1-CE1 3.29Å; F86-Y100 HydrophobicContact CE1-CE2 4.42Å; F86-Y100 HydrophobicContact CE1-CG 4.01Å; F86-Y100 AromaticContact CE1-CZ 3.84Å; F86-Y100 HydrophobicContact CE2-CD1 4.3Å; F86-Y100 AromaticContact CE2-CE1 3.69Å; F86-Y100 HydrophobicContact CE2-CE1 3.69Å; F86-Y100 HydrophobicContact CG-CD1 4.15Å; F86-Y100 HydrophobicContact CG-CE1 4.37Å; F86-Y100 AromaticContact CZ-CD1 3.77Å; F86-Y100 HydrophobicContact CZ-CD1 3.77Å; F86-Y100 AromaticContact CZ-CE1 3.16Å; F86-Y100 HydrophobicContact CZ-CE1 3.16Å; F86-Y100 AromaticContact CZ-CZ 3.65Å; F86-V160 HydrophobicContact CB-CG2 4.48Å; F86-V160 HydrophobicContact CD2-CB 4.45Å; F86-V160 HydrophobicContact CD2-CG2 3.97Å; F86-V160 HydrophobicContact CE2-CG2 4.48Å; F86-V160 HydrophobicContact CG-CG2 4.13Å; F86-E163 HydrophobicContact CD2-CB 3.88Å; F86-E163 HydrophobicContact CD2-CG 3.93Å; F86-E163 HydrophobicContact CE2-CB 3.9Å; F86-E163 HydrophobicContact CE2-CG 3.98Å
87	F	97	Very high	96.5	Very high	0 Å²	0	18.3 Å²	18.3	0%	0	8%	0.081	C	C	.	.	H	α-helix	trans	-78.2	-13.2	-177.3	-78.7	-70.6	0	0	0	114.7	R55 Y83 Q84 R85 K90 F92 H95 Y100	R55-F87 VanDerWaalsContact NH2-C 3.26Å; R55-F87 PolarHBondContact NH2-O 2.78Å; Y83-F87 HydrophobicContact CD1-CD2 4.24Å; Y83-F87 HydrophobicContact CD2-CD2 4Å; Y83-F87 AromaticContact CD2-CE2 3.79Å; Y83-F87 HydrophobicContact CD2-CE2 3.79Å; Y83-F87 HydrophobicContact CE1-CD2 4.03Å; Y83-F87 HydrophobicContact CE1-CE2 4.42Å; Y83-F87 AromaticContact CE2-CD2 3.8Å; Y83-F87 HydrophobicContact CE2-CD2 3.8Å; Y83-F87 AromaticContact CE2-CE2 3.38Å; Y83-F87 HydrophobicContact CE2-CE2 3.38Å; Y83-F87 HydrophobicContact CE2-CZ 4.46Å; Y83-F87 HydrophobicContact CG-CD2 4.22Å; Y83-F87 HydrophobicContact CG-CE2 4.46Å; Y83-F87 AromaticContact CZ-CD2 3.79Å; Y83-F87 AromaticContact CZ-CE2 3.73Å; Y83-F87 WeakPolarHBondContact O-CD2 3.49Å; Y83-F87 PolarHBondContact O-N 3.47Å; Y83-F87 VanDerWaalsContact O-N 3.09Å; Q84-F87 PolarHBondContact O-N 2.76Å; R85-F87 PolarHBondContact O-N 3.37Å; F87-K90 WeakPolarHBondContact CA-O 3.28Å; F87-K90 VanDerWaalsContact CD1-O 3.28Å; F87-K90 WeakPolarHBondContact CD1-O 3.43Å; F87-F92 HydrophobicContact CB-CD2 4.46Å; F87-F92 HydrophobicContact CB-CE1 4.18Å; F87-F92 HydrophobicContact CB-CE2 3.75Å; F87-F92 HydrophobicContact CB-CZ 3.59Å; F87-F92 HydrophobicContact CD1-CB 4.49Å; F87-F92 AromaticContact CD1-CD1 3.37Å; F87-F92 HydrophobicContact CD1-CD1 3.37Å; F87-F92 AromaticContact CD1-CD2 3.91Å; F87-F92 HydrophobicContact CD1-CD2 3.91Å; F87-F92 AromaticContact CD1-CE1 3.34Å; F87-F92 HydrophobicContact CD1-CE1 3.34Å; F87-F92 AromaticContact CD1-CE2 3.88Å; F87-F92 HydrophobicContact CD1-CE2 3.88Å; F87-F92 AromaticContact CD1-CG 3.66Å; F87-F92 HydrophobicContact CD1-CG 3.66Å; F87-F92 AromaticContact CD1-CZ 3.61Å; F87-F92 HydrophobicContact CD1-CZ 3.61Å; F87-F92 HydrophobicContact CD2-CD1 4.38Å; F87-F92 AromaticContact CD2-CE1 3.58Å; F87-F92 HydrophobicContact CD2-CE1 3.58Å; F87-F92 AromaticContact CD2-CZ 3.74Å; F87-F92 HydrophobicContact CD2-CZ 3.74Å; F87-F92 HydrophobicContact CE1-CB 4.48Å; F87-F92 AromaticContact CE1-CD1 3.29Å; F87-F92 HydrophobicContact CE1-CD1 3.29Å; F87-F92 AromaticContact CE1-CE1 3.5Å; F87-F92 HydrophobicContact CE1-CE1 3.5Å; F87-F92 AromaticContact CE1-CG 3.89Å; F87-F92 HydrophobicContact CE1-CG 3.89Å; F87-F92 HydrophobicContact CE1-CZ 4.25Å; F87-F92 HydrophobicContact CE2-CD1 4.32Å; F87-F92 AromaticContact CE2-CE1 3.73Å; F87-F92 HydrophobicContact CE2-CE1 3.73Å; F87-F92 HydrophobicContact CE2-CZ 4.36Å; F87-F92 AromaticContact CG-CD1 3.96Å; F87-F92 HydrophobicContact CG-CD1 3.96Å; F87-F92 HydrophobicContact CG-CD2 4.35Å; F87-F92 AromaticContact CG-CE1 3.4Å; F87-F92 HydrophobicContact CG-CE1 3.4Å; F87-F92 VanDerWaalsContact CG-CE1 3.4Å; F87-F92 AromaticContact CG-CE2 3.85Å; F87-F92 HydrophobicContact CG-CE2 3.85Å; F87-F92 HydrophobicContact CG-CG 4.4Å; F87-F92 AromaticContact CG-CZ 3.34Å; F87-F92 HydrophobicContact CG-CZ 3.34Å; F87-F92 AromaticContact CZ-CD1 3.81Å; F87-F92 HydrophobicContact CZ-CD1 3.81Å; F87-F92 AromaticContact CZ-CE1 3.7Å; F87-F92 HydrophobicContact CZ-CE1 3.7Å; F87-H95 HydrophobicContact CE1-CB 3.96Å; F87-H95 HydrophobicContact CZ-CB 4.34Å; F87-Y100 HydrophobicContact CE2-CG 4.16Å; F87-Y100 HydrophobicContact CZ-CD2 4.19Å; F87-Y100 AromaticContact CZ-CG 3.9Å; F87-Y100 HydrophobicContact CZ-CG 3.9Å
88	Y	95.7	Very high	96.6	Very high	23 Å²	23	19.1 Å²	19.1	9%	0.09	9%	0.085	C	C	.	.	H	α-helix	trans	-75.5	-27.1	161.5	-84.5	-79	0	0	0	112.3	I31 L36 T39 P40 Q84 R85 F86 D207 V210	I31-Y88 HydrophobicContact CD1-CD2 4.17Å; I31-Y88 HydrophobicContact CD1-CG 3.87Å; L36-Y88 HydrophobicContact CD2-CD1 4.19Å; L36-Y88 HydrophobicContact CD2-CE1 3.95Å; T39-Y88 HydrophobicContact CG2-CD1 4.43Å; T39-Y88 HydrophobicContact CG2-CE1 4.23Å; P40-Y88 WeakPolarHBondContact CD-O 3.48Å; P40-Y88 VanDerWaalsContact CG-O 3.29Å; P40-Y88 WeakPolarHBondContact CG-O 3.29Å; Q84-Y88 WeakPolarHBondContact O-CD2 3.15Å; Q84-Y88 PolarHBondContact O-N 3.13Å; R85-Y88 PolarHBondContact O-N 3.26Å; F86-Y88 PolarHBondContact O-N 3.4Å; Y88-D207 HydrophobicContact CE2-CB 3.98Å; Y88-D207 WeakPolarHBondContact OH-CB 3.44Å; Y88-D207 PolarHBondContact OH-OD2 3.28Å; Y88-V210 HydrophobicContact CD2-CG2 3.67Å; Y88-V210 HydrophobicContact CE2-CG2 3.55Å; Y88-V210 HydrophobicContact CG-CG2 4.49Å
89	S	94.6	Very high	96.6	Very high	43 Å²	43	21 Å²	21	30%	0.301	9%	0.094	S	C	.	.	H	α-helix	trans	-89	-17.7	176.2	-48.3	0	0	0	0	114.3	R85 F86 E163	R85-S89 PolarHBondContact O-N 2.77Å; R85-S89 PolarHBondContact O-OG 3.12Å; F86-S89 CarbonylContact O-C 2.92Å; F86-S89 PolarHBondContact O-N 2.99Å; S89-E163 WeakPolarHBondContact CB-OE1 3.42Å
90	K	96.2	Very high	96.6	Very high	66 Å²	66	21.4 Å²	21.4	29%	0.287	10%	0.095	S	C	.	.	S	Bend	trans	-146.8	138.1	-175.1	-71.2	-65.8	166.1	-71.2	0	114.2	F86 F87 E163	F86-K90 HydrophobicContact CD1-CB 4.46Å; F86-K90 HydrophobicContact CE1-CB 3.8Å; F86-K90 HydrophobicContact CE1-CG 4.47Å; F86-K90 HydrophobicContact CE2-CB 4.14Å; F86-K90 HydrophobicContact CE2-CG 3.92Å; F86-K90 HydrophobicContact CZ-CB 3.61Å; F86-K90 HydrophobicContact CZ-CG 3.79Å; F86-K90 PolarHBondContact O-N 2.55Å; F87-K90 WeakPolarHBondContact CA-O 3.28Å; F87-K90 VanDerWaalsContact CD1-O 3.28Å; F87-K90 WeakPolarHBondContact CD1-O 3.43Å; K90-E163 WeakPolarHBondContact CE-OE2 3.44Å; K90-E163 HydrophobicContact CG-CG 4.04Å; K90-E163 IonicContact NZ-OE1 3.73Å; K90-E163 PolarHBondContact NZ-OE1 3Å; K90-E163 IonicContact NZ-OE2 3.19Å; K90-E163 PolarHBondContact NZ-OE2 3.3Å
91	S	96.9	Very high	96.7	Very high	2 Å²	2	21.2 Å²	21.2	1%	0.014	9%	0.094	C	C	.	.			trans	-61.1	136.1	-179.1	168.5	0	0	0	0	114.8	P40 D44 V93 R94 H95	P40-S91 WeakPolarHBondContact O-CB 3.47Å; D44-S91 WeakPolarHBondContact OD2-CB 3.26Å; D44-S91 PolarHBondContact OD2-OG 3.3Å; S91-V93 VanDerWaalsContact C-N 3.29Å; S91-V93 PolarHBondContact O-N 3.34Å; S91-V93 WeakPolarHBondContact OG-CB 3.38Å; S91-V93 PolarHBondContact OG-N 3.03Å; S91-R94 PolarHBondContact O-N 3Å; S91-R94 PolarHBondContact OG-N 3.4Å; S91-H95 WeakPolarHBondContact O-CB 3.45Å; S91-H95 PolarHBondContact O-N 3Å; S91-H95 VanDerWaalsContact O-N 3.11Å; S91-H95 PolarHBondContact O-ND1 2.87Å
92	F	97.4	Very high	96.8	Very high	0 Å²	0	21.2 Å²	21.2	0%	0	9%	0.094	C	C	.	.	T	Hydrogen-bonded Turn	trans	-63.2	-27.2	166.4	-79.5	-69.3	0	0	0	114.1	S41 M46 E51 L54 R55 Y83 F87 L275 R279	S41-F92 WeakPolarHBondContact OG-CD2 3.49Å; S41-F92 PolarHBondContact OG-N 2.98Å; M46-F92 HydrophobicContact CE-CB 3.65Å; M46-F92 HydrophobicContact SD-CB 4.02Å; M46-F92 HydrophobicContact SD-CD2 4.38Å; E51-F92 HydrophobicContact CG-CD2 3.96Å; E51-F92 HydrophobicContact CG-CE2 3.92Å; L54-F92 HydrophobicContact CB-CD1 4.11Å; L54-F92 HydrophobicContact CB-CD2 4.25Å; L54-F92 HydrophobicContact CB-CE1 3.98Å; L54-F92 HydrophobicContact CB-CE2 4.12Å; L54-F92 HydrophobicContact CB-CG 4.26Å; L54-F92 HydrophobicContact CB-CZ 3.98Å; L54-F92 HydrophobicContact CD1-CB 4.01Å; L54-F92 HydrophobicContact CD1-CD1 4.32Å; L54-F92 HydrophobicContact CD1-CD2 4.4Å; L54-F92 HydrophobicContact CD1-CG 4.01Å; R55-F92 HydrophobicContact CG-CE2 3.74Å; R55-F92 HydrophobicContact CG-CZ 3.81Å; Y83-F92 HydrophobicContact CE1-CZ 4.37Å; Y83-F92 WeakPolarHBondContact OH-CE1 3.18Å; F87-F92 HydrophobicContact CB-CD2 4.46Å; F87-F92 HydrophobicContact CB-CE1 4.18Å; F87-F92 HydrophobicContact CB-CE2 3.75Å; F87-F92 HydrophobicContact CB-CZ 3.59Å; F87-F92 HydrophobicContact CD1-CB 4.49Å; F87-F92 AromaticContact CD1-CD1 3.37Å; F87-F92 HydrophobicContact CD1-CD1 3.37Å; F87-F92 AromaticContact CD1-CD2 3.91Å; F87-F92 HydrophobicContact CD1-CD2 3.91Å; F87-F92 AromaticContact CD1-CE1 3.34Å; F87-F92 HydrophobicContact CD1-CE1 3.34Å; F87-F92 AromaticContact CD1-CE2 3.88Å; F87-F92 HydrophobicContact CD1-CE2 3.88Å; F87-F92 AromaticContact CD1-CG 3.66Å; F87-F92 HydrophobicContact CD1-CG 3.66Å; F87-F92 AromaticContact CD1-CZ 3.61Å; F87-F92 HydrophobicContact CD1-CZ 3.61Å; F87-F92 HydrophobicContact CD2-CD1 4.38Å; F87-F92 AromaticContact CD2-CE1 3.58Å; F87-F92 HydrophobicContact CD2-CE1 3.58Å; F87-F92 AromaticContact CD2-CZ 3.74Å; F87-F92 HydrophobicContact CD2-CZ 3.74Å; F87-F92 HydrophobicContact CE1-CB 4.48Å; F87-F92 AromaticContact CE1-CD1 3.29Å; F87-F92 HydrophobicContact CE1-CD1 3.29Å; F87-F92 AromaticContact CE1-CE1 3.5Å; F87-F92 HydrophobicContact CE1-CE1 3.5Å; F87-F92 AromaticContact CE1-CG 3.89Å; F87-F92 HydrophobicContact CE1-CG 3.89Å; F87-F92 HydrophobicContact CE1-CZ 4.25Å; F87-F92 HydrophobicContact CE2-CD1 4.32Å; F87-F92 AromaticContact CE2-CE1 3.73Å; F87-F92 HydrophobicContact CE2-CE1 3.73Å; F87-F92 HydrophobicContact CE2-CZ 4.36Å; F87-F92 AromaticContact CG-CD1 3.96Å; F87-F92 HydrophobicContact CG-CD1 3.96Å; F87-F92 HydrophobicContact CG-CD2 4.35Å; F87-F92 AromaticContact CG-CE1 3.4Å; F87-F92 HydrophobicContact CG-CE1 3.4Å; F87-F92 VanDerWaalsContact CG-CE1 3.4Å; F87-F92 AromaticContact CG-CE2 3.85Å; F87-F92 HydrophobicContact CG-CE2 3.85Å; F87-F92 HydrophobicContact CG-CG 4.4Å; F87-F92 AromaticContact CG-CZ 3.34Å; F87-F92 HydrophobicContact CG-CZ 3.34Å; F87-F92 AromaticContact CZ-CD1 3.81Å; F87-F92 HydrophobicContact CZ-CD1 3.81Å; F87-F92 AromaticContact CZ-CE1 3.7Å; F87-F92 HydrophobicContact CZ-CE1 3.7Å; F92-L275 HydrophobicContact CB-CD2 4.39Å; F92-R279 PolarHBondContact O-NH2 3.31Å
93	V	95.8	Very high	96.8	Very high	2 Å²	2	21.2 Å²	21.2	1%	0.012	10%	0.095	C	C	.	.	T	Hydrogen-bonded Turn	trans	-65.9	-50	175.3	-172.1	0	0	0	0	109	D44 M46 S91 H95 L278 R279 Q282	D44-V93 HydrophobicContact CB-CB 4.02Å; D44-V93 HydrophobicContact CB-CG2 3.74Å; M46-V93 HydrophobicContact CE-CG2 3.73Å; S91-V93 VanDerWaalsContact C-N 3.29Å; S91-V93 PolarHBondContact O-N 3.34Å; S91-V93 WeakPolarHBondContact OG-CB 3.38Å; S91-V93 PolarHBondContact OG-N 3.03Å; V93-H95 VanDerWaalsContact C-N 3.31Å; V93-H95 PolarHBondContact O-N 2.88Å; V93-L278 HydrophobicContact CG1-CB 3.98Å; V93-L278 HydrophobicContact CG2-CB 4.01Å; V93-L278 HydrophobicContact CG2-CD1 4.09Å; V93-R279 HydrophobicContact CG1-CG 3.78Å; V93-R279 WeakPolarHBondContact O-CD 3.3Å; V93-R279 VanDerWaalsContact O-CG 3.29Å; V93-R279 WeakPolarHBondContact O-CG 3.26Å; V93-R279 PolarHBondContact O-NE 2.95Å; V93-Q282 HydrophobicContact CG1-CB 4.34Å
94	R	94.7	Very high	96.9	Very high	155 Å²	155	21.2 Å²	21.2	59%	0.585	10%	0.095	S	C	*	.	T	Hydrogen-bonded Turn	trans	-72.2	-20.3	-179.4	-62.4	173	-157.3	-151.4	3.5	113.9	D44 S91	D44-R94 IonicContact OD1-CZ 3.69Å; D44-R94 IonicContact OD1-NE 2.77Å; D44-R94 PolarHBondContact OD1-NE 3.38Å; D44-R94 IonicContact OD1-NH2 3.76Å; D44-R94 PolarHBondContact OD1-NH2 3.14Å; D44-R94 WeakPolarHBondContact OD2-CD 3.49Å; D44-R94 VanDerWaalsContact OD2-CG 3.31Å; D44-R94 WeakPolarHBondContact OD2-CG 3.32Å; D44-R94 IonicContact OD2-CZ 2.62Å; D44-R94 IonicContact OD2-NE 2.68Å; D44-R94 PolarHBondContact OD2-NE 3.11Å; D44-R94 IonicContact OD2-NH2 3.35Å; S91-R94 PolarHBondContact O-N 3Å; S91-R94 PolarHBondContact OG-N 3.4Å
95	H	96.3	Very high	97	Very high	21 Å²	21	21.1 Å²	21.1	10%	0.097	9%	0.094	C	C	.	.	S	Bend	trans	-132.1	111.5	-172.4	-62.9	101.1	0	0	0	112.3	F86 F87 S91 V93 Y97 Y100 R159	F86-H95 HydrophobicContact CE1-CB 4.2Å; F87-H95 HydrophobicContact CE1-CB 3.96Å; F87-H95 HydrophobicContact CZ-CB 4.34Å; S91-H95 WeakPolarHBondContact O-CB 3.45Å; S91-H95 PolarHBondContact O-N 3Å; S91-H95 VanDerWaalsContact O-N 3.11Å; S91-H95 PolarHBondContact O-ND1 2.87Å; V93-H95 VanDerWaalsContact C-N 3.31Å; V93-H95 PolarHBondContact O-N 2.88Å; H95-Y97 PolarHBondContact O-N 3.15Å; H95-Y100 HydrophobicContact CB-CD2 4.08Å; H95-Y100 HydrophobicContact CB-CE2 3.67Å; H95-Y100 AromaticContact CD2-CE2 3.85Å; H95-Y100 AromaticContact CD2-CZ 3.71Å; H95-Y100 PolarHBondContact CD2-OH 2.9Å; H95-R159 PolarHBondContact CD2-NH1 3.15Å; H95-R159 PolarHBondContact NE2-NH1 3.3Å; H95-R159 VanDerWaalsContact NE2-NH1 3.1Å
96	F	95.7	Very high	97.1	Very high	51 Å²	51	22 Å²	22	22%	0.224	10%	0.098	C	C	.	.			trans	-67.3	115.7	-177.4	-175.7	-119.8	0	0	0	112.2	E98 H99	F96-E98 VanDerWaalsContact C-N 3.33Å; F96-E98 HydrophobicContact CD1-CB 3.96Å; F96-E98 HydrophobicContact CE1-CB 3.39Å; F96-E98 HydrophobicContact CE1-CG 4.48Å; F96-E98 HydrophobicContact CZ-CB 3.88Å; F96-E98 PolarHBondContact O-N 3.28Å; F96-H99 AromaticContact CD1-CD2 3.96Å; F96-H99 AromaticContact CD1-CE1 3.8Å; F96-H99 AromaticContact CD1-CG 3.96Å; F96-H99 AromaticContact CD1-ND1 3.87Å; F96-H99 AromaticContact CD1-NE2 3.87Å; F96-H99 PolarHBondContact O-N 3.18Å; F96-H99 VanDerWaalsContact O-N 3.16Å
97	Y	97.1	Very high	97.2	Very high	0 Å²	0	22.2 Å²	22.2	0%	0	10%	0.099	C	C	.	.	H	α-helix	trans	-51.5	-43.4	-168.8	81	-78.9	0	0	0	114.1	L54 L57 L61 H95 H99 Y100 A101 R132 E272 L275	L54-Y97 HydrophobicContact CD2-CD1 4.18Å; L54-Y97 HydrophobicContact CD2-CG 4.21Å; L57-Y97 HydrophobicContact CD2-CD2 4.35Å; L57-Y97 HydrophobicContact CD2-CE2 3.52Å; L57-Y97 HydrophobicContact CG-CE2 3.82Å; L61-Y97 HydrophobicContact CD1-CD2 4.33Å; L61-Y97 HydrophobicContact CD1-CE2 3.61Å; H95-Y97 PolarHBondContact O-N 3.15Å; Y97-H99 PolarHBondContact O-N 2.75Å; Y97-Y100 PolarHBondContact O-N 2.89Å; Y97-A101 PolarHBondContact O-N 3.26Å; Y97-R132 PolarHBondContact OH-NH1 3.18Å; Y97-E272 HydrophobicContact CE1-CG 4.11Å; Y97-E272 PolarHBondContact OH-OE1 2.96Å; Y97-L275 HydrophobicContact CD1-CD1 3.93Å; Y97-L275 HydrophobicContact CE1-CD1 4.37Å
98	E	97.2	Very high	97.2	Very high	17 Å²	17	22.2 Å²	22.2	8%	0.079	10%	0.099	C	C	.	.	H	α-helix	trans	-62	-40.1	-177.1	-153.5	-169.7	122.8	0	0	112.5	L61 F96 Y100 A101 M102 F125 R129	L61-E98 HydrophobicContact CD1-CG 4.29Å; F96-E98 VanDerWaalsContact C-N 3.33Å; F96-E98 HydrophobicContact CD1-CB 3.96Å; F96-E98 HydrophobicContact CE1-CB 3.39Å; F96-E98 HydrophobicContact CE1-CG 4.48Å; F96-E98 HydrophobicContact CZ-CB 3.88Å; F96-E98 PolarHBondContact O-N 3.28Å; E98-Y100 VanDerWaalsContact C-N 3.27Å; E98-Y100 PolarHBondContact O-N 3.22Å; E98-A101 PolarHBondContact O-N 2.84Å; E98-M102 HydrophobicContact CB-CE 4.46Å; E98-M102 HydrophobicContact CG-CE 3.78Å; E98-M102 WeakPolarHBondContact O-CG 3.44Å; E98-M102 PolarHBondContact O-N 3.16Å; E98-M102 WeakPolarHBondContact OE1-CE 3.49Å; E98-F125 HydrophobicContact CG-CD1 3.86Å; E98-F125 HydrophobicContact CG-CE1 4.3Å; E98-R129 IonicContact OE2-CZ 3.78Å; E98-R129 IonicContact OE2-NH1 2.75Å; E98-R129 PolarHBondContact OE2-NH1 3.24Å
99	H	97.8	Very high	97.3	Very high	41 Å²	41	21.1 Å²	21.1	19%	0.19	10%	0.095	C	C	.	.	H	α-helix	trans	-63.8	-33.9	176.1	-62.1	158	0	0	0	112.1	F96 Y97 A103 L149 A156	F96-H99 AromaticContact CD1-CD2 3.96Å; F96-H99 AromaticContact CD1-CE1 3.8Å; F96-H99 AromaticContact CD1-CG 3.96Å; F96-H99 AromaticContact CD1-ND1 3.87Å; F96-H99 AromaticContact CD1-NE2 3.87Å; F96-H99 PolarHBondContact O-N 3.18Å; F96-H99 VanDerWaalsContact O-N 3.16Å; Y97-H99 PolarHBondContact O-N 2.75Å; H99-A103 WeakPolarHBondContact O-CB 3.49Å; H99-A103 PolarHBondContact O-N 2.96Å; H99-L149 VanDerWaalsContact CD2-CD1 3.46Å; H99-L149 WeakPolarHBondContact CD2-CD1 3.42Å; H99-L149 WeakPolarHBondContact NE2-CD1 3.48Å; H99-A156 HydrophobicContact CB-CB 4.46Å
100	Y	98.4	Very high	97.4	Very high	8 Å²	8	23 Å²	23	3%	0.031	10%	0.098	C	C	.	.	H	α-helix	trans	-80.9	-33.4	179.7	-79.5	-92.8	0	0	0	112.2	F86 F87 H95 Y97 E98 A103 C104 A156 R159 V160	F86-Y100 AromaticContact CD1-CD1 3.59Å; F86-Y100 HydrophobicContact CD1-CD1 3.59Å; F86-Y100 AromaticContact CD1-CE1 3.91Å; F86-Y100 HydrophobicContact CD1-CE1 3.91Å; F86-Y100 HydrophobicContact CD1-CG 4.27Å; F86-Y100 HydrophobicContact CD2-CD1 4.47Å; F86-Y100 HydrophobicContact CD2-CE1 4.27Å; F86-Y100 AromaticContact CE1-CD1 3.38Å; F86-Y100 HydrophobicContact CE1-CD1 3.38Å; F86-Y100 HydrophobicContact CE1-CD2 4.49Å; F86-Y100 AromaticContact CE1-CE1 3.29Å; F86-Y100 HydrophobicContact CE1-CE1 3.29Å; F86-Y100 HydrophobicContact CE1-CE2 4.42Å; F86-Y100 HydrophobicContact CE1-CG 4.01Å; F86-Y100 AromaticContact CE1-CZ 3.84Å; F86-Y100 HydrophobicContact CE2-CD1 4.3Å; F86-Y100 AromaticContact CE2-CE1 3.69Å; F86-Y100 HydrophobicContact CE2-CE1 3.69Å; F86-Y100 HydrophobicContact CG-CD1 4.15Å; F86-Y100 HydrophobicContact CG-CE1 4.37Å; F86-Y100 AromaticContact CZ-CD1 3.77Å; F86-Y100 HydrophobicContact CZ-CD1 3.77Å; F86-Y100 AromaticContact CZ-CE1 3.16Å; F86-Y100 HydrophobicContact CZ-CE1 3.16Å; F86-Y100 AromaticContact CZ-CZ 3.65Å; F87-Y100 HydrophobicContact CE2-CG 4.16Å; F87-Y100 HydrophobicContact CZ-CD2 4.19Å; F87-Y100 AromaticContact CZ-CG 3.9Å; F87-Y100 HydrophobicContact CZ-CG 3.9Å; H95-Y100 HydrophobicContact CB-CD2 4.08Å; H95-Y100 HydrophobicContact CB-CE2 3.67Å; H95-Y100 AromaticContact CD2-CE2 3.85Å; H95-Y100 AromaticContact CD2-CZ 3.71Å; H95-Y100 PolarHBondContact CD2-OH 2.9Å; Y97-Y100 PolarHBondContact O-N 2.89Å; E98-Y100 VanDerWaalsContact C-N 3.27Å; E98-Y100 PolarHBondContact O-N 3.22Å; Y100-A103 PolarHBondContact O-N 3.42Å; Y100-C104 WeakPolarHBondContact O-CB 3.34Å; Y100-C104 PolarHBondContact O-N 3.46Å; Y100-C104 PolarHBondContact O-SG 3.37Å; Y100-A156 HydrophobicContact CD1-CB 4.15Å; Y100-A156 HydrophobicContact CD2-CB 4.12Å; Y100-A156 HydrophobicContact CE1-CB 3.89Å; Y100-A156 HydrophobicContact CE2-CB 3.86Å; Y100-A156 HydrophobicContact CG-CB 4.26Å; Y100-R159 HydrophobicContact CE1-CB 4.32Å; Y100-R159 WeakPolarHBondContact OH-CD 3.47Å; Y100-V160 HydrophobicContact CD1-CG2 3.6Å; Y100-V160 HydrophobicContact CE1-CG2 3.83Å
101	A	98.5	Very high	97.4	Very high	0 Å²	0	22.9 Å²	22.9	0%	0	10%	0.1	C	C	.	.	H	α-helix	trans	-60.8	-47.8	168.2	0	0	0	0	0	111.1	I62 Y83 Y97 E98 A103 C104 I105 F125	I62-A101 HydrophobicContact CD1-CB 4.37Å; I62-A101 HydrophobicContact CG1-CB 3.99Å; Y83-A101 HydrophobicContact CD2-CB 4.36Å; Y83-A101 HydrophobicContact CE2-CB 4.08Å; Y97-A101 PolarHBondContact O-N 3.26Å; E98-A101 PolarHBondContact O-N 2.84Å; A101-A103 VanDerWaalsContact C-N 3.35Å; A101-A103 PolarHBondContact O-N 3.35Å; A101-C104 PolarHBondContact O-N 3.14Å; A101-I105 WeakPolarHBondContact O-CG2 3.46Å; A101-I105 PolarHBondContact O-N 2.98Å; A101-I105 VanDerWaalsContact O-N 3.13Å; A101-F125 HydrophobicContact CB-CE1 3.74Å; A101-F125 HydrophobicContact CB-CZ 3.86Å
102	M	98.7	Very high	97.4	Very high	1 Å²	1	25.8 Å²	25.8	1%	0.005	11%	0.113	C	C	.	.	H	α-helix	trans	-57.5	-44.8	172.7	-71.6	-175.6	-134.4	0	0	112.3	E98 I105 F106 V121 I122 F125 L149 V153	E98-M102 HydrophobicContact CB-CE 4.46Å; E98-M102 HydrophobicContact CG-CE 3.78Å; E98-M102 WeakPolarHBondContact O-CG 3.44Å; E98-M102 PolarHBondContact O-N 3.16Å; E98-M102 WeakPolarHBondContact OE1-CE 3.49Å; M102-I105 WeakPolarHBondContact O-CG2 3.24Å; M102-F106 VanDerWaalsContact O-CB 3.23Å; M102-F106 WeakPolarHBondContact O-CB 3.49Å; M102-F106 PolarHBondContact O-N 3.3Å; M102-V121 HydrophobicContact CB-CG1 4.11Å; M102-V121 HydrophobicContact CG-CG1 4.23Å; M102-I122 HydrophobicContact SD-CG1 4.25Å; M102-F125 HydrophobicContact CB-CE2 4.46Å; M102-F125 HydrophobicContact CB-CZ 4.49Å; M102-F125 HydrophobicContact CE-CB 3.84Å; M102-F125 HydrophobicContact CE-CD1 3.9Å; M102-F125 HydrophobicContact CE-CG 4Å; M102-F125 HydrophobicContact CG-CB 4.14Å; M102-F125 HydrophobicContact CG-CD1 3.57Å; M102-F125 HydrophobicContact CG-CD2 3.6Å; M102-F125 HydrophobicContact CG-CE1 3.77Å; M102-F125 HydrophobicContact CG-CE2 3.79Å; M102-F125 HydrophobicContact CG-CG 3.48Å; M102-F125 VanDerWaalsContact CG-CG 3.48Å; M102-F125 HydrophobicContact CG-CZ 3.88Å; M102-F125 HydrophobicContact SD-CB 4.18Å; M102-F125 HydrophobicContact SD-CD1 4.45Å; M102-F125 HydrophobicContact SD-CG 4.17Å; M102-L149 HydrophobicContact CE-CD1 4.17Å; M102-L149 HydrophobicContact SD-CD1 4.36Å; M102-V153 HydrophobicContact CB-CG1 4.09Å; M102-V153 HydrophobicContact CB-CG2 3.87Å; M102-V153 HydrophobicContact CG-CG2 4.44Å; M102-V153 HydrophobicContact SD-CG2 3.69Å
103	A	98.6	Very high	97.3	Very high	1 Å²	1	34 Å²	34	1%	0.008	15%	0.152	C	C	.	.	H	α-helix	trans	-66.8	-40.1	179.8	0	0	0	0	0	112.8	H99 Y100 A101 F106 L107 V153 A156 E157	H99-A103 WeakPolarHBondContact O-CB 3.49Å; H99-A103 PolarHBondContact O-N 2.96Å; Y100-A103 PolarHBondContact O-N 3.42Å; A101-A103 VanDerWaalsContact C-N 3.35Å; A101-A103 PolarHBondContact O-N 3.35Å; A103-F106 PolarHBondContact O-N 3.01Å; A103-L107 WeakPolarHBondContact O-CB 3.35Å; A103-L107 PolarHBondContact O-N 3.03Å; A103-V153 HydrophobicContact CB-CG1 4.41Å; A103-A156 HydrophobicContact CB-CB 3.8Å; A103-E157 HydrophobicContact CB-CB 4.2Å
104	C	98.5	Very high	97.3	Very high	0 Å²	0	34.8 Å²	34.8	0%	0	16%	0.158	C	C	.	.	H	α-helix	trans	-69	-40.9	-179.5	-67	0	0	0	0	112	I62 A79 L82 Y100 A101 L107 A108	I62-C104 HydrophobicContact CD1-CB 4.38Å; A79-C104 HydrophobicContact CB-CB 4.38Å; A79-C104 WeakPolarHBondContact O-CB 3.45Å; L82-C104 HydrophobicContact CB-CB 4.47Å; Y100-C104 WeakPolarHBondContact O-CB 3.34Å; Y100-C104 PolarHBondContact O-N 3.46Å; Y100-C104 PolarHBondContact O-SG 3.37Å; A101-C104 PolarHBondContact O-N 3.14Å; C104-L107 PolarHBondContact O-N 3.2Å; C104-A108 VanDerWaalsContact O-CB 3.29Å; C104-A108 WeakPolarHBondContact O-CB 3.34Å; C104-A108 PolarHBondContact O-N 3.37Å
105	I	98.4	Very high	97.4	Very high	1 Å²	1	31.3 Å²	31.3	1%	0.005	16%	0.155	C	C	.	.	H	α-helix	trans	-72	-34.2	175.7	-165	58	0	0	0	112.5	I62 L69 L71 M76 A79 A101 M102 A109 V121 F125	I62-I105 HydrophobicContact CG2-CB 4.48Å; I62-I105 HydrophobicContact CG2-CD1 4.17Å; L69-I105 HydrophobicContact CD1-CG1 4.32Å; L71-I105 HydrophobicContact CD1-CD1 3.55Å; L71-I105 HydrophobicContact CD1-CG1 3.66Å; M76-I105 HydrophobicContact CG-CD1 4.35Å; A79-I105 HydrophobicContact CB-CB 4.22Å; A79-I105 HydrophobicContact CB-CD1 3.78Å; A101-I105 WeakPolarHBondContact O-CG2 3.46Å; A101-I105 PolarHBondContact O-N 2.98Å; A101-I105 VanDerWaalsContact O-N 3.13Å; M102-I105 WeakPolarHBondContact O-CG2 3.24Å; I105-A109 VanDerWaalsContact O-CB 3.22Å; I105-A109 WeakPolarHBondContact O-CB 3.46Å; I105-A109 PolarHBondContact O-N 2.91Å; I105-V121 HydrophobicContact CG2-CG1 3.96Å; I105-F125 HydrophobicContact CG2-CE2 4.03Å; I105-F125 HydrophobicContact CG2-CZ 4.49Å
106	F	98.4	Very high	97.4	Very high	28 Å²	28	33.8 Å²	33.8	12%	0.123	16%	0.164	C	C	.	.	H	α-helix	trans	-66.5	-38.7	172.7	178.2	-111.8	0	0	0	112.4	M102 A103 R116 I118 V121 E157	M102-F106 VanDerWaalsContact O-CB 3.23Å; M102-F106 WeakPolarHBondContact O-CB 3.49Å; M102-F106 PolarHBondContact O-N 3.3Å; A103-F106 PolarHBondContact O-N 3.01Å; F106-R116 WeakPolarHBondContact CE2-O 3.49Å; F106-I118 HydrophobicContact CD2-CB 4.43Å; F106-I118 HydrophobicContact CE2-CB 4.02Å; F106-I118 HydrophobicContact CZ-CB 4.3Å; F106-V121 HydrophobicContact CB-CG2 4.36Å; F106-V121 HydrophobicContact CD2-CG2 4.25Å; F106-E157 WeakPolarHBondContact CD1-OE1 3.17Å; F106-E157 WeakPolarHBondContact CE1-OE1 3.39Å
107	L	98.1	Very high	97.5	Very high	6 Å²	6	39.9 Å²	39.9	3%	0.031	19%	0.185	C	C	.	.	H	α-helix	trans	-69.6	-51.7	175.4	177.6	55.6	0	0	0	111.4	L82 A103 C104 A109 K110 L111 V160 L161 V168	L82-L107 HydrophobicContact CD1-CD2 4.21Å; L82-L107 HydrophobicContact CD1-CG 4.33Å; A103-L107 WeakPolarHBondContact O-CB 3.35Å; A103-L107 PolarHBondContact O-N 3.03Å; C104-L107 PolarHBondContact O-N 3.2Å; L107-A109 VanDerWaalsContact C-N 3.29Å; L107-A109 PolarHBondContact O-N 3.17Å; L107-K110 WeakPolarHBondContact O-CA 3.4Å; L107-K110 WeakPolarHBondContact O-CB 3.43Å; L107-K110 PolarHBondContact O-N 3.22Å; L107-L111 HydrophobicContact CD1-CD1 4.27Å; L107-L111 HydrophobicContact CD1-CG 4.25Å; L107-L111 HydrophobicContact CG-CD1 4.03Å; L107-L111 HydrophobicContact CG-CG 4.45Å; L107-L111 WeakPolarHBondContact O-CG 3.4Å; L107-L111 PolarHBondContact O-N 3.09Å; L107-L111 VanDerWaalsContact O-N 3.09Å; L107-V160 HydrophobicContact CD2-CG1 4.08Å; L107-L161 HydrophobicContact CD1-CD1 4.41Å; L107-L161 HydrophobicContact CD1-CD2 4.05Å; L107-L161 HydrophobicContact CD1-CG 4.39Å; L107-L161 HydrophobicContact CD2-CD2 3.88Å; L107-L161 HydrophobicContact CD2-CG 4Å; L107-V168 HydrophobicContact CD2-CG1 4.46Å
108	A	98	Very high	97.4	Very high	0 Å²	0	41 Å²	41	0%	0	19%	0.191	C	C	.	.	H	α-helix	trans	-61.4	-35.5	180	0	0	0	0	0	112.9	A75 T78 A79 L82 C104 K110 L111 E112	A75-A108 VanDerWaalsContact O-CB 3.29Å; A75-A108 WeakPolarHBondContact O-CB 3.43Å; T78-A108 HydrophobicContact CG2-CB 3.94Å; A79-A108 HydrophobicContact CB-CB 3.71Å; L82-A108 HydrophobicContact CD1-CB 4.47Å; C104-A108 VanDerWaalsContact O-CB 3.29Å; C104-A108 WeakPolarHBondContact O-CB 3.34Å; C104-A108 PolarHBondContact O-N 3.37Å; A108-K110 PolarHBondContact O-N 3.41Å; A108-L111 PolarHBondContact O-N 3.49Å; A108-L111 VanDerWaalsContact O-N 3.1Å; A108-E112 PolarHBondContact O-N 3.28Å
109	A	97.9	Very high	97.4	Very high	1 Å²	1	45 Å²	45	1%	0.008	21%	0.206	C	C	.	.	H	α-helix	trans	-58.9	-29.6	172.2	0	0	0	0	0	113	L71 I105 L107 S114 P115	L71-A109 HydrophobicContact CD1-CB 4.05Å; L71-A109 HydrophobicContact CD2-CB 3.77Å; I105-A109 VanDerWaalsContact O-CB 3.22Å; I105-A109 WeakPolarHBondContact O-CB 3.46Å; I105-A109 PolarHBondContact O-N 2.91Å; L107-A109 VanDerWaalsContact C-N 3.29Å; L107-A109 PolarHBondContact O-N 3.17Å; A109-S114 CarbonylContact O-C 3.35Å; A109-S114 WeakPolarHBondContact O-CA 3.48Å; A109-S114 PolarHBondContact O-N 3.16Å; A109-P115 WeakPolarHBondContact O-CA 3.49Å
110	K	97.2	Very high	97.4	Very high	81 Å²	81	45.2 Å²	45.2	35%	0.352	21%	0.208	S	C	.	.	H	α-helix	trans	-80.7	-36.1	172.6	-66.5	-179.3	-68	178.3	0	112.6	L107 A108 P115 E157	L107-K110 WeakPolarHBondContact O-CA 3.4Å; L107-K110 WeakPolarHBondContact O-CB 3.43Å; L107-K110 PolarHBondContact O-N 3.22Å; A108-K110 PolarHBondContact O-N 3.41Å; K110-P115 HydrophobicContact CG-CB 4.26Å; K110-E157 WeakPolarHBondContact CE-OE1 3.34Å; K110-E157 VanDerWaalsContact NZ-CD 3.32Å; K110-E157 IonicContact NZ-OE1 2.74Å; K110-E157 PolarHBondContact NZ-OE1 2.99Å; K110-E157 IonicContact NZ-OE2 3.55Å; K110-E157 PolarHBondContact NZ-OE2 3.15Å
111	L	96.3	Very high	97.3	Very high	64 Å²	64	44.9 Å²	44.9	34%	0.335	21%	0.206	S	C	.	.	H	α-helix	trans	-70.4	-33.8	-179.2	-62.5	173.2	0	0	0	112.9	T78 L82 L107 A108 E113 V168	T78-L111 HydrophobicContact CG2-CD1 4.38Å; L82-L111 HydrophobicContact CD1-CD1 3.98Å; L107-L111 HydrophobicContact CD1-CD1 4.27Å; L107-L111 HydrophobicContact CD1-CG 4.25Å; L107-L111 HydrophobicContact CG-CD1 4.03Å; L107-L111 HydrophobicContact CG-CG 4.45Å; L107-L111 WeakPolarHBondContact O-CG 3.4Å; L107-L111 PolarHBondContact O-N 3.09Å; L107-L111 VanDerWaalsContact O-N 3.09Å; A108-L111 PolarHBondContact O-N 3.49Å; A108-L111 VanDerWaalsContact O-N 3.1Å; L111-E113 VanDerWaalsContact C-N 3.33Å; L111-V168 HydrophobicContact CD1-CB 3.7Å; L111-V168 HydrophobicContact CD1-CG1 4.48Å; L111-V168 HydrophobicContact CD1-CG2 3.64Å; L111-V168 HydrophobicContact CD2-CG2 3.67Å; L111-V168 HydrophobicContact CG-CG2 4.32Å
112	E	95.7	Very high	97.3	Very high	63 Å²	63	45 Å²	45	29%	0.294	21%	0.207	S	C	.	.	T	Hydrogen-bonded Turn	trans	-97.7	35.3	177.4	-51.8	-65.1	163.5	0	0	111.9	V74 A75 T78 A108 S114	V74-E112 HydrophobicContact CB-CG 4.5Å; V74-E112 HydrophobicContact CG1-CG 4.4Å; V74-E112 WeakPolarHBondContact CG1-OE2 3.42Å; A75-E112 HydrophobicContact CB-CB 3.98Å; A75-E112 HydrophobicContact CB-CG 3.86Å; T78-E112 WeakPolarHBondContact CB-OE1 3.42Å; T78-E112 PolarHBondContact OG1-OE1 3.31Å; A108-E112 PolarHBondContact O-N 3.28Å; E112-S114 WeakPolarHBondContact O-CB 3.47Å; E112-S114 PolarHBondContact O-N 3Å; E112-S114 PolarHBondContact O-OG 3.09Å
113	E	95.4	Very high	97.2	Very high	172 Å²	172	47.7 Å²	47.7	80%	0.804	22%	0.221	S	C	*	.	T	Hydrogen-bonded Turn	trans	43.5	35.1	174.7	-64.1	-58.2	150.9	0	0	115.6	L111 P115	L111-E113 VanDerWaalsContact C-N 3.33Å; E113-P115 VanDerWaalsContact C-CD 3.44Å
114	S	95.6	Very high	97.1	Very high	20 Å²	20	48.6 Å²	48.6	14%	0.14	23%	0.227	C	C	.	.			trans	-135	50.1	-175.4	47.7	0	0	0	0	112.5	L71 A109 E112 R116	L71-S114 VanDerWaalsContact CD2-O 3.24Å; L71-S114 WeakPolarHBondContact CD2-O 3.39Å; A109-S114 CarbonylContact O-C 3.35Å; A109-S114 WeakPolarHBondContact O-CA 3.48Å; A109-S114 PolarHBondContact O-N 3.16Å; E112-S114 WeakPolarHBondContact O-CB 3.47Å; E112-S114 PolarHBondContact O-N 3Å; E112-S114 PolarHBondContact O-OG 3.09Å; S114-R116 PolarHBondContact O-NH1 2.88Å
115	P	96.7	Very high	97	Very high	82 Å²	82	48.7 Å²	48.7	53%	0.532	23%	0.228	S	C	.	.			trans	-60.8	157.8	-168.3	24.4	-35.6	0	0	0	114.2	A109 K110 E113	A109-P115 WeakPolarHBondContact O-CA 3.49Å; K110-P115 HydrophobicContact CG-CB 4.26Å; E113-P115 VanDerWaalsContact C-CD 3.44Å
116	R	97.3	Very high	96.9	Very high	73 Å²	73	51.7 Å²	51.7	28%	0.275	24%	0.241	S	C	.	.			trans	-133.1	155.5	176.6	-64.4	-64.9	-179.7	-86.6	-2.9	110	L69 R70 L71 F106 S114 V121	L69-R116 HydrophobicContact CB-CG 4.46Å; L69-R116 HydrophobicContact CD2-CG 4.35Å; L69-R116 PolarHBondContact O-NE 2.79Å; L69-R116 PolarHBondContact O-NH2 3.17Å; L69-R116 VanDerWaalsContact O-NH2 3.08Å; R70-R116 PolarHBondContact O-NH2 2.93Å; L71-R116 HydrophobicContact CD2-CG 4.06Å; L71-R116 HydrophobicContact CG-CG 4.46Å; F106-R116 WeakPolarHBondContact CE2-O 3.49Å; S114-R116 PolarHBondContact O-NH1 2.88Å; R116-V121 HydrophobicContact CB-CG2 4.46Å
117	R	96.9	Very high	96.7	Very high	178 Å²	178	51.7 Å²	51.7	67%	0.672	24%	0.241	S	C	*	.			trans	-75.4	142	174.3	-56.9	175.3	168.2	-174.4	-6	108.4	R119 D120 V121	R117-R119 PolarHBondContact O-N 3.32Å; R117-R119 VanDerWaalsContact O-N 3.14Å; R117-D120 VanDerWaalsContact CB-OD2 3.28Å; R117-D120 WeakPolarHBondContact CB-OD2 3.46Å; R117-D120 PolarHBondContact N-OD2 2.99Å; R117-D120 WeakPolarHBondContact O-CA 3.41Å; R117-D120 VanDerWaalsContact O-CB 3.32Å; R117-D120 WeakPolarHBondContact O-CB 3.49Å; R117-D120 PolarHBondContact O-N 3.02Å; R117-V121 PolarHBondContact O-N 2.88Å
118	I	96.8	Very high	96.6	Very high	25 Å²	25	52.5 Å²	52.5	13%	0.128	25%	0.246	C	C	.	.	H	α-helix	trans	-58.3	-29.4	178.3	-167.7	168.5	0	0	0	112.9	F106 V121 I122 K150 V153 I154	F106-I118 HydrophobicContact CD2-CB 4.43Å; F106-I118 HydrophobicContact CE2-CB 4.02Å; F106-I118 HydrophobicContact CZ-CB 4.3Å; I118-V121 PolarHBondContact O-N 3.35Å; I118-I122 HydrophobicContact CG1-CD1 4.18Å; I118-I122 WeakPolarHBondContact O-CG1 3.39Å; I118-I122 PolarHBondContact O-N 2.86Å; I118-K150 HydrophobicContact CD1-CG 4.11Å; I118-K150 HydrophobicContact CG2-CG 4.26Å; I118-V153 HydrophobicContact CD1-CB 4.12Å; I118-V153 HydrophobicContact CD1-CG1 3.89Å; I118-V153 HydrophobicContact CG1-CG1 4.31Å; I118-I154 HydrophobicContact CD1-CD1 3.97Å; I118-I154 HydrophobicContact CD1-CG1 3.53Å
119	R	96.4	Very high	96.4	Very high	101 Å²	101	56.4 Å²	56.4	38%	0.381	26%	0.26	S	S	.	.	H	α-helix	trans	-60.3	-42.6	170.8	-174.8	-174.3	-69.6	161.6	-1	111.9	R117 V121 I122 N123	R117-R119 PolarHBondContact O-N 3.32Å; R117-R119 VanDerWaalsContact O-N 3.14Å; R119-V121 VanDerWaalsContact C-N 3.32Å; R119-V121 PolarHBondContact O-N 2.84Å; R119-I122 PolarHBondContact O-N 3.26Å; R119-N123 WeakPolarHBondContact O-CB 3.34Å; R119-N123 PolarHBondContact O-N 3.3Å; R119-N123 PolarHBondContact O-OD1 3.46Å
120	D	97	Very high	96.1	Very high	44 Å²	44	57.2 Å²	57.2	24%	0.235	26%	0.264	C	S	.	.	H	α-helix	trans	-63.9	-41.5	-179.2	-48.6	-28.2	0	0	0	110.2	L69 R117 N123 V124	L69-D120 HydrophobicContact CD2-CB 3.92Å; R117-D120 VanDerWaalsContact CB-OD2 3.28Å; R117-D120 WeakPolarHBondContact CB-OD2 3.46Å; R117-D120 PolarHBondContact N-OD2 2.99Å; R117-D120 WeakPolarHBondContact O-CA 3.41Å; R117-D120 VanDerWaalsContact O-CB 3.32Å; R117-D120 WeakPolarHBondContact O-CB 3.49Å; R117-D120 PolarHBondContact O-N 3.02Å; D120-N123 PolarHBondContact O-N 3.43Å; D120-V124 WeakPolarHBondContact O-CB 3.47Å; D120-V124 WeakPolarHBondContact O-CG2 3.49Å; D120-V124 PolarHBondContact O-N 3.2Å
121	V	97.9	Very high	95.9	Very high	1 Å²	1	57.3 Å²	57.3	1%	0.006	27%	0.271	C	S	.	.	H	α-helix	trans	-62.4	-49.9	176.1	-176.5	0	0	0	0	111.1	L69 M102 I105 F106 R116 R117 I118 R119 N123 V124 F125	L69-V121 HydrophobicContact CD1-CG2 4.04Å; L69-V121 HydrophobicContact CD2-CG2 4.49Å; M102-V121 HydrophobicContact CB-CG1 4.11Å; M102-V121 HydrophobicContact CG-CG1 4.23Å; I105-V121 HydrophobicContact CG2-CG1 3.96Å; F106-V121 HydrophobicContact CB-CG2 4.36Å; F106-V121 HydrophobicContact CD2-CG2 4.25Å; R116-V121 HydrophobicContact CB-CG2 4.46Å; R117-V121 PolarHBondContact O-N 2.88Å; I118-V121 PolarHBondContact O-N 3.35Å; R119-V121 VanDerWaalsContact C-N 3.32Å; R119-V121 PolarHBondContact O-N 2.84Å; V121-N123 PolarHBondContact O-N 3.07Å; V121-V124 PolarHBondContact O-N 3.31Å; V121-F125 HydrophobicContact CG1-CD2 4.09Å; V121-F125 HydrophobicContact CG1-CE2 4.15Å; V121-F125 WeakPolarHBondContact O-CD2 3.47Å; V121-F125 PolarHBondContact O-N 2.85Å
122	I	97.6	Very high	95.6	Very high	4 Å²	4	57.7 Å²	57.7	2%	0.021	27%	0.268	C	S	.	.	H	α-helix	trans	-61.4	-44.4	178.8	-68.6	166.6	0	0	0	111.1	M102 I118 R119 V124 F125 H126 V140 Y146 L149 K150	M102-I122 HydrophobicContact SD-CG1 4.25Å; I118-I122 HydrophobicContact CG1-CD1 4.18Å; I118-I122 WeakPolarHBondContact O-CG1 3.39Å; I118-I122 PolarHBondContact O-N 2.86Å; R119-I122 PolarHBondContact O-N 3.26Å; I122-V124 VanDerWaalsContact C-N 3.3Å; I122-V124 PolarHBondContact O-N 3.09Å; I122-F125 PolarHBondContact O-N 3.05Å; I122-H126 WeakPolarHBondContact O-CB 3.5Å; I122-H126 PolarHBondContact O-N 3.34Å; I122-V140 HydrophobicContact CG2-CG1 4.49Å; I122-Y146 HydrophobicContact CB-CE2 4.39Å; I122-Y146 HydrophobicContact CD1-CD2 4.47Å; I122-Y146 HydrophobicContact CD1-CE2 3.96Å; I122-Y146 HydrophobicContact CG2-CD2 4Å; I122-Y146 HydrophobicContact CG2-CE2 4.01Å; I122-L149 HydrophobicContact CD1-CG 4.48Å; I122-L149 HydrophobicContact CG2-CD2 3.79Å; I122-K150 HydrophobicContact CD1-CB 3.99Å
123	N	96.4	Very high	95.3	Very high	56 Å²	56	57.6 Å²	57.6	30%	0.299	27%	0.269	S	S	.	.	H	α-helix	trans	-60.3	-39.2	177.2	-71.8	0.9	0	0	0	112.2	R119 D120 V121 H127 V140	R119-N123 WeakPolarHBondContact O-CB 3.34Å; R119-N123 PolarHBondContact O-N 3.3Å; R119-N123 PolarHBondContact O-OD1 3.46Å; D120-N123 PolarHBondContact O-N 3.43Å; V121-N123 PolarHBondContact O-N 3.07Å; N123-H127 WeakPolarHBondContact O-CB 3.39Å; N123-H127 PolarHBondContact O-N 2.74Å; N123-V140 WeakPolarHBondContact OD1-CG2 3.48Å
124	V	96.9	Very high	94.9	Very high	20 Å²	20	58.9 Å²	58.9	12%	0.121	27%	0.272	C	S	.	.	H	α-helix	trans	-69.3	-44.3	177.6	162.9	0	0	0	0	111.8	L68 L69 D120 V121 I122 H127 I128	L68-V124 HydrophobicContact CB-CG1 3.73Å; L68-V124 HydrophobicContact CB-CG2 4Å; L68-V124 HydrophobicContact CD1-CG1 3.92Å; L68-V124 HydrophobicContact CG-CG1 4.49Å; L69-V124 HydrophobicContact CD2-CB 4.43Å; L69-V124 HydrophobicContact CD2-CG2 3.88Å; L69-V124 HydrophobicContact CG-CB 4.43Å; L69-V124 HydrophobicContact CG-CG1 4.4Å; L69-V124 HydrophobicContact CG-CG2 4.1Å; D120-V124 WeakPolarHBondContact O-CB 3.47Å; D120-V124 WeakPolarHBondContact O-CG2 3.49Å; D120-V124 PolarHBondContact O-N 3.2Å; V121-V124 PolarHBondContact O-N 3.31Å; I122-V124 VanDerWaalsContact C-N 3.3Å; I122-V124 PolarHBondContact O-N 3.09Å; V124-H127 PolarHBondContact O-N 3.17Å; V124-I128 HydrophobicContact CG1-CD1 3.89Å; V124-I128 VanDerWaalsContact O-CG1 3.31Å; V124-I128 WeakPolarHBondContact O-CG1 3.43Å; V124-I128 PolarHBondContact O-N 3.47Å
125	F	97.2	Very high	94.6	Very high	3 Å²	3	63.6 Å²	63.6	1%	0.013	29%	0.291	C	S	.	.	H	α-helix	trans	-64.6	-41.2	176.1	-88.7	-107.4	0	0	0	112.2	L61 S65 E98 A101 M102 I105 V121 I122 H127 I128 R129	L61-F125 HydrophobicContact CB-CE1 3.94Å; L61-F125 HydrophobicContact CB-CZ 4.35Å; L61-F125 HydrophobicContact CD1-CE1 4.2Å; S65-F125 VanDerWaalsContact CB-CE2 3.4Å; S65-F125 VanDerWaalsContact OG-CE2 3.31Å; S65-F125 WeakPolarHBondContact OG-CE2 3.43Å; E98-F125 HydrophobicContact CG-CD1 3.86Å; E98-F125 HydrophobicContact CG-CE1 4.3Å; A101-F125 HydrophobicContact CB-CE1 3.74Å; A101-F125 HydrophobicContact CB-CZ 3.86Å; M102-F125 HydrophobicContact CB-CE2 4.46Å; M102-F125 HydrophobicContact CB-CZ 4.49Å; M102-F125 HydrophobicContact CE-CB 3.84Å; M102-F125 HydrophobicContact CE-CD1 3.9Å; M102-F125 HydrophobicContact CE-CG 4Å; M102-F125 HydrophobicContact CG-CB 4.14Å; M102-F125 HydrophobicContact CG-CD1 3.57Å; M102-F125 HydrophobicContact CG-CD2 3.6Å; M102-F125 HydrophobicContact CG-CE1 3.77Å; M102-F125 HydrophobicContact CG-CE2 3.79Å; M102-F125 HydrophobicContact CG-CG 3.48Å; M102-F125 VanDerWaalsContact CG-CG 3.48Å; M102-F125 HydrophobicContact CG-CZ 3.88Å; M102-F125 HydrophobicContact SD-CB 4.18Å; M102-F125 HydrophobicContact SD-CD1 4.45Å; M102-F125 HydrophobicContact SD-CG 4.17Å; I105-F125 HydrophobicContact CG2-CE2 4.03Å; I105-F125 HydrophobicContact CG2-CZ 4.49Å; V121-F125 HydrophobicContact CG1-CD2 4.09Å; V121-F125 HydrophobicContact CG1-CE2 4.15Å; V121-F125 WeakPolarHBondContact O-CD2 3.47Å; V121-F125 PolarHBondContact O-N 2.85Å; I122-F125 PolarHBondContact O-N 3.05Å; F125-H127 VanDerWaalsContact C-N 3.34Å; F125-H127 PolarHBondContact O-N 3.37Å; F125-I128 PolarHBondContact O-N 3.37Å; F125-R129 WeakPolarHBondContact O-CB 3.37Å; F125-R129 PolarHBondContact O-N 2.99Å
126	H	95.4	Very high	94.1	Very high	64 Å²	64	65.3 Å²	65.3	30%	0.296	30%	0.3	S	S	.	.	H	α-helix	trans	-57.5	-45.9	172.3	-176.3	-106.5	0	0	0	111.7	I122 R129 Q130 T138 V140	I122-H126 WeakPolarHBondContact O-CB 3.5Å; I122-H126 PolarHBondContact O-N 3.34Å; H126-R129 PolarHBondContact O-N 3.19Å; H126-Q130 VanDerWaalsContact CE1-CD 3.49Å; H126-Q130 PolarHBondContact CE1-NE2 3.16Å; H126-Q130 WeakPolarHBondContact O-CG 3.22Å; H126-Q130 PolarHBondContact O-N 3.18Å; H126-T138 PolarHBondContact CE1-O 2.84Å; H126-T138 PolarHBondContact ND1-O 3.2Å; H126-V140 HydrophobicContact CB-CG2 3.56Å; H126-V140 VanDerWaalsContact CG-CG2 3.48Å; H126-V140 WeakPolarHBondContact ND1-CG2 3.49Å
127	H	95.2	Very high	93.6	Very high	27 Å²	27	64.5 Å²	64.5	13%	0.125	30%	0.304	C	S	.	.	H	α-helix	trans	-61.6	-46.1	176.2	179.8	63.6	0	0	0	112.6	N123 V124 F125 R129 Q130 V131	N123-H127 WeakPolarHBondContact O-CB 3.39Å; N123-H127 PolarHBondContact O-N 2.74Å; V124-H127 PolarHBondContact O-N 3.17Å; F125-H127 VanDerWaalsContact C-N 3.34Å; F125-H127 PolarHBondContact O-N 3.37Å; H127-R129 VanDerWaalsContact C-N 3.32Å; H127-R129 PolarHBondContact O-N 2.97Å; H127-Q130 PolarHBondContact O-N 3.1Å; H127-V131 WeakPolarHBondContact O-CG2 3.22Å; H127-V131 PolarHBondContact O-N 2.98Å
128	I	95.4	Very high	93.2	Very high	23 Å²	23	59 Å²	59	12%	0.118	29%	0.29	C	S	.	.	H	α-helix	trans	-58.4	-45.8	176.6	-67.8	163	0	0	0	110.5	L61 D64 L68 V124 F125 Q130 V131 R132	L61-I128 HydrophobicContact CD2-CG2 3.62Å; D64-I128 HydrophobicContact CB-CD1 4.41Å; L68-I128 HydrophobicContact CD1-CD1 4.07Å; L68-I128 HydrophobicContact CD1-CG1 3.74Å; V124-I128 HydrophobicContact CG1-CD1 3.89Å; V124-I128 VanDerWaalsContact O-CG1 3.31Å; V124-I128 WeakPolarHBondContact O-CG1 3.43Å; V124-I128 PolarHBondContact O-N 3.47Å; F125-I128 PolarHBondContact O-N 3.37Å; I128-Q130 PolarHBondContact O-N 3.49Å; I128-V131 PolarHBondContact O-N 3.22Å; I128-R132 WeakPolarHBondContact O-CB 3.31Å; I128-R132 PolarHBondContact O-N 3.33Å
129	R	93.6	Very high	92.8	Very high	82 Å²	82	61.5 Å²	61.5	31%	0.309	31%	0.308	S	S	.	.	H	α-helix	trans	-61.9	-43.4	178.2	-168.5	170.4	-176.7	137.6	9.1	111.8	E98 F125 H126 H127 R132 D133 E272	E98-R129 IonicContact OE2-CZ 3.78Å; E98-R129 IonicContact OE2-NH1 2.75Å; E98-R129 PolarHBondContact OE2-NH1 3.24Å; F125-R129 WeakPolarHBondContact O-CB 3.37Å; F125-R129 PolarHBondContact O-N 2.99Å; H126-R129 PolarHBondContact O-N 3.19Å; H127-R129 VanDerWaalsContact C-N 3.32Å; H127-R129 PolarHBondContact O-N 2.97Å; R129-R132 PolarHBondContact O-N 3.4Å; R129-D133 VanDerWaalsContact O-CB 3.32Å; R129-D133 WeakPolarHBondContact O-CB 3.32Å; R129-D133 PolarHBondContact O-N 2.83Å; R129-E272 IonicContact CZ-OE2 3.54Å; R129-E272 IonicContact NH2-OE2 3.97Å; R129-E272 PolarHBondContact NH2-OE2 3.25Å
130	Q	92.6	Very high	92.3	Very high	19 Å²	19	57.9 Å²	57.9	9%	0.089	30%	0.297	C	S	.	.	H	α-helix	trans	-62.7	-43.3	175.8	-72.4	-179.4	-30.5	0	0	112.9	H126 H127 I128 D133 K134 K135 P137 T138	H126-Q130 VanDerWaalsContact CE1-CD 3.49Å; H126-Q130 PolarHBondContact CE1-NE2 3.16Å; H126-Q130 WeakPolarHBondContact O-CG 3.22Å; H126-Q130 PolarHBondContact O-N 3.18Å; H127-Q130 PolarHBondContact O-N 3.1Å; I128-Q130 PolarHBondContact O-N 3.49Å; Q130-D133 CarbonylContact O-C 3.2Å; Q130-D133 PolarHBondContact O-N 3.07Å; Q130-K134 PolarHBondContact O-N 2.95Å; Q130-K134 VanDerWaalsContact O-N 3.16Å; Q130-K135 HydrophobicContact CB-CB 4.36Å; Q130-K135 PolarHBondContact O-N 3.47Å; Q130-P137 VanDerWaalsContact OE1-CA 3.31Å; Q130-T138 PolarHBondContact NE2-OG1 2.82Å; Q130-T138 PolarHBondContact OE1-O 3.37Å
131	V	92.3	Very high	91.8	Very high	82 Å²	82	62.2 Å²	62.2	50%	0.497	32%	0.319	S	S	.	.	H	α-helix	trans	-65.5	-41.3	177.1	171.9	0	0	0	0	111.2	H127 I128 K134	H127-V131 WeakPolarHBondContact O-CG2 3.22Å; H127-V131 PolarHBondContact O-N 2.98Å; I128-V131 PolarHBondContact O-N 3.22Å; V131-K134 PolarHBondContact O-N 3.18Å; V131-K134 VanDerWaalsContact O-N 3.14Å
132	R	89	Confident	91.4	Very high	73 Å²	73	67.2 Å²	67.2	28%	0.275	35%	0.345	S	S	.	.	H	α-helix	trans	-59.9	-45.2	174.5	-171.7	-179.8	75.9	-178.7	14.2	111.7	Y97 I128 R129 K134 E272	Y97-R132 PolarHBondContact OH-NH1 3.18Å; I128-R132 WeakPolarHBondContact O-CB 3.31Å; I128-R132 PolarHBondContact O-N 3.33Å; R129-R132 PolarHBondContact O-N 3.4Å; R132-K134 PolarHBondContact O-N 3.45Å; R132-E272 IonicContact CZ-OE1 2.68Å; R132-E272 IonicContact NH1-OE1 3.31Å; R132-E272 IonicContact NH2-OE1 3.73Å; R132-E272 PolarHBondContact NH2-OE1 3.4Å; R132-E272 IonicContact NH2-OE2 3.52Å
133	D	89.1	Confident	91	Very high	60 Å²	60	70.1 Å²	70.1	32%	0.321	36%	0.361	S	S	.	.	T	Hydrogen-bonded Turn	trans	-74.9	0.8	177.9	-66.1	6.1	0	0	0	113.5	R129 Q130 K135	R129-D133 VanDerWaalsContact O-CB 3.32Å; R129-D133 WeakPolarHBondContact O-CB 3.32Å; R129-D133 PolarHBondContact O-N 2.83Å; Q130-D133 CarbonylContact O-C 3.2Å; Q130-D133 PolarHBondContact O-N 3.07Å; D133-K135 HydrophobicContact CB-CD 3.67Å; D133-K135 HydrophobicContact CB-CG 3.91Å; D133-K135 PolarHBondContact O-N 2.75Å; D133-K135 IonicContact OD2-NZ 3.33Å; D133-K135 PolarHBondContact OD2-NZ 3.36Å
134	K	88.9	Confident	90.9	Very high	199 Å²	199	73.4 Å²	73.4	87%	0.865	37%	0.374	S	S	*	.	T	Hydrogen-bonded Turn	trans	57.8	22.9	-174.7	-53.2	172.9	-173.5	167.5	0	114.4	Q130 V131 R132	Q130-K134 PolarHBondContact O-N 2.95Å; Q130-K134 VanDerWaalsContact O-N 3.16Å; V131-K134 PolarHBondContact O-N 3.18Å; V131-K134 VanDerWaalsContact O-N 3.14Å; R132-K134 PolarHBondContact O-N 3.45Å
135	K	88.5	Confident	90.7	Very high	120 Å²	120	76 Å²	76	52%	0.522	39%	0.393	S	S	.	.	P	Polyproline II helix	trans	-80.8	154.9	178.1	-67.9	166.6	-176.5	160.5	0	110.5	Q130 D133	Q130-K135 HydrophobicContact CB-CB 4.36Å; Q130-K135 PolarHBondContact O-N 3.47Å; D133-K135 HydrophobicContact CB-CD 3.67Å; D133-K135 HydrophobicContact CB-CG 3.91Å; D133-K135 PolarHBondContact O-N 2.75Å; D133-K135 IonicContact OD2-NZ 3.33Å; D133-K135 PolarHBondContact OD2-NZ 3.36Å
136	T	86	Confident	90.7	Very high	118 Å²	118	77 Å²	77	72%	0.724	40%	0.397	S	S	*	.	P	Polyproline II helix	trans	-63.4	131.3	167.8	39.3	0	0	0	0	109.6	T138	T136-T138 PolarHBondContact O-N 3.35Å
137	P	86.9	Confident	90.7	Very high	56 Å²	56	76 Å²	76	36%	0.364	40%	0.397	S	S	.	.	P	Polyproline II helix	trans	-64.3	124.2	178.2	-26.1	36.1	0	0	0	112.3	Q130	Q130-P137 VanDerWaalsContact OE1-CA 3.31Å
138	T	89	Confident	90.8	Very high	63 Å²	63	78.5 Å²	78.5	39%	0.387	41%	0.412	S	S	.	.			trans	-122.4	153	176.8	68.2	0	0	0	0	111	H126 Q130 T136 Y493	H126-T138 PolarHBondContact CE1-O 2.84Å; H126-T138 PolarHBondContact ND1-O 3.2Å; Q130-T138 PolarHBondContact NE2-OG1 2.82Å; Q130-T138 PolarHBondContact OE1-O 3.37Å; T136-T138 PolarHBondContact O-N 3.35Å; T138-Y493 PolarHBondContact O-OH 2.9Å
139	P	86.8	Confident	90.9	Very high	76 Å²	76	79.6 Å²	79.6	49%	0.494	42%	0.418	S	S	.	.	P	Polyproline II helix	trans	-61.7	146.3	173.7	25.9	-34.9	0	0	0	111.8	I141 Y493	P139-I141 PolarHBondContact O-N 3.37Å; P139-Y493 WeakPolarHBondContact CA-OH 3.42Å; P139-Y493 HydrophobicContact CB-CE2 4Å
140	V	86.7	Confident	91	Very high	26 Å²	26	79.6 Å²	79.6	16%	0.158	42%	0.42	C	S	.	.	P	Polyproline II helix	trans	-62.1	122.6	167.8	175.5	0	0	0	0	108.5	I122 N123 H126 Y146	I122-V140 HydrophobicContact CG2-CG1 4.49Å; N123-V140 WeakPolarHBondContact OD1-CG2 3.48Å; H126-V140 HydrophobicContact CB-CG2 3.56Å; H126-V140 VanDerWaalsContact CG-CG2 3.48Å; H126-V140 WeakPolarHBondContact ND1-CG2 3.49Å; V140-Y146 HydrophobicContact CG1-CD2 3.63Å; V140-Y146 HydrophobicContact CG1-CE2 4.35Å; V140-Y146 HydrophobicContact CG1-CG 4.31Å
141	I	86.3	Confident	91.3	Very high	134 Å²	134	82.4 Å²	82.4	69%	0.687	44%	0.435	S	S	*	.	P	Polyproline II helix	trans	-73.4	129.8	174.2	-54.3	178.4	0	0	0	107.7	P139 D143 Y146	P139-I141 PolarHBondContact O-N 3.37Å; I141-D143 HydrophobicContact CG2-CB 4.16Å; I141-D143 PolarHBondContact O-N 2.64Å; I141-Y146 WeakPolarHBondContact O-CB 3.41Å
142	L	89.4	Confident	91.5	Very high	107 Å²	107	82.6 Å²	82.6	56%	0.56	43%	0.431	S	S	*	.			trans	-87	60.2	-176.4	-61.5	-180	0	0	0	111.3	Y146	L142-Y146 HydrophobicContact CD2-CD1 3.82Å; L142-Y146 HydrophobicContact CD2-CD2 4.12Å; L142-Y146 HydrophobicContact CD2-CE1 3.77Å; L142-Y146 HydrophobicContact CD2-CE2 4.04Å; L142-Y146 HydrophobicContact CD2-CG 4Å
143	D	90.2	Very high	92	Very high	65 Å²	65	79.1 Å²	79.1	35%	0.348	42%	0.418	S	S	.	.	S	Bend	trans	-99.5	-165.7	-176	78.5	-36.2	0	0	0	112.9	I141 S145 Y146 S147	I141-D143 HydrophobicContact CG2-CB 4.16Å; I141-D143 PolarHBondContact O-N 2.64Å; D143-S145 VanDerWaalsContact C-N 3.33Å; D143-S145 VanDerWaalsContact CG-OG 3.24Å; D143-S145 WeakPolarHBondContact OD1-CA 3.39Å; D143-S145 WeakPolarHBondContact OD1-CB 3.38Å; D143-S145 PolarHBondContact OD1-N 3.49Å; D143-S145 VanDerWaalsContact OD1-N 3.07Å; D143-S145 PolarHBondContact OD1-OG 3.11Å; D143-S145 WeakPolarHBondContact OD2-CB 3.32Å; D143-S145 PolarHBondContact OD2-N 3.4Å; D143-S145 PolarHBondContact OD2-OG 3.44Å; D143-S145 VanDerWaalsContact OD2-OG 3.04Å; D143-Y146 PolarHBondContact OD1-N 2.94Å; D143-S147 PolarHBondContact O-N 3.37Å; D143-S147 VanDerWaalsContact O-N 3.15Å; D143-S147 PolarHBondContact O-OG 3.11Å
144	Q	93.9	Very high	92.4	Very high	125 Å²	125	78.7 Å²	78.7	58%	0.584	42%	0.415	S	S	*	.	H	α-helix	trans	-67.4	-31.3	172.6	-169.2	58.8	33.3	0	0	112.2	S147 N148	Q144-S147 PolarHBondContact O-N 3.13Å; Q144-N148 PolarHBondContact NE2-OD1 3.36Å; Q144-N148 WeakPolarHBondContact O-CB 3.28Å; Q144-N148 PolarHBondContact O-N 3.37Å; Q144-N148 PolarHBondContact O-ND2 3.48Å
145	S	93.1	Very high	92.8	Very high	75 Å²	75	74 Å²	74	52%	0.524	40%	0.395	S	S	.	.	H	α-helix	trans	-64.7	-43.8	175.8	86.1	0	0	0	0	111.9	D143 S147 N148 L149	D143-S145 VanDerWaalsContact C-N 3.33Å; D143-S145 VanDerWaalsContact CG-OG 3.24Å; D143-S145 WeakPolarHBondContact OD1-CA 3.39Å; D143-S145 WeakPolarHBondContact OD1-CB 3.38Å; D143-S145 PolarHBondContact OD1-N 3.49Å; D143-S145 VanDerWaalsContact OD1-N 3.07Å; D143-S145 PolarHBondContact OD1-OG 3.11Å; D143-S145 WeakPolarHBondContact OD2-CB 3.32Å; D143-S145 PolarHBondContact OD2-N 3.4Å; D143-S145 PolarHBondContact OD2-OG 3.44Å; D143-S145 VanDerWaalsContact OD2-OG 3.04Å; S145-S147 VanDerWaalsContact C-N 3.34Å; S145-S147 PolarHBondContact O-N 3.13Å; S145-N148 PolarHBondContact O-N 2.85Å; S145-L149 WeakPolarHBondContact O-CB 3.21Å; S145-L149 PolarHBondContact O-N 3.01Å
146	Y	95.7	Very high	93.3	Very high	22 Å²	22	68.4 Å²	68.4	9%	0.086	37%	0.371	C	S	.	.	H	α-helix	trans	-60	-43.5	172.1	167	-96.4	0	0	0	111.8	I122 V140 I141 L142 D143 L149 K150	I122-Y146 HydrophobicContact CB-CE2 4.39Å; I122-Y146 HydrophobicContact CD1-CD2 4.47Å; I122-Y146 HydrophobicContact CD1-CE2 3.96Å; I122-Y146 HydrophobicContact CG2-CD2 4Å; I122-Y146 HydrophobicContact CG2-CE2 4.01Å; V140-Y146 HydrophobicContact CG1-CD2 3.63Å; V140-Y146 HydrophobicContact CG1-CE2 4.35Å; V140-Y146 HydrophobicContact CG1-CG 4.31Å; I141-Y146 WeakPolarHBondContact O-CB 3.41Å; L142-Y146 HydrophobicContact CD2-CD1 3.82Å; L142-Y146 HydrophobicContact CD2-CD2 4.12Å; L142-Y146 HydrophobicContact CD2-CE1 3.77Å; L142-Y146 HydrophobicContact CD2-CE2 4.04Å; L142-Y146 HydrophobicContact CD2-CG 4Å; D143-Y146 PolarHBondContact OD1-N 2.94Å; Y146-L149 PolarHBondContact O-N 3.44Å; Y146-K150 WeakPolarHBondContact O-CB 3.43Å; Y146-K150 PolarHBondContact O-N 3.34Å
147	S	96.4	Very high	93.9	Very high	43 Å²	43	63.7 Å²	63.7	30%	0.301	34%	0.34	S	S	.	.	H	α-helix	trans	-64.6	-40.5	178.7	-60.7	0	0	0	0	111.9	D143 Q144 S145 N151	D143-S147 PolarHBondContact O-N 3.37Å; D143-S147 VanDerWaalsContact O-N 3.15Å; D143-S147 PolarHBondContact O-OG 3.11Å; Q144-S147 PolarHBondContact O-N 3.13Å; S145-S147 VanDerWaalsContact C-N 3.34Å; S145-S147 PolarHBondContact O-N 3.13Å; S147-N151 WeakPolarHBondContact O-CB 3.36Å; S147-N151 VanDerWaalsContact O-CG 3.28Å; S147-N151 PolarHBondContact O-N 3.15Å; S147-N151 VanDerWaalsContact O-N 3.09Å; S147-N151 PolarHBondContact O-ND2 2.67Å
148	N	96.9	Very high	94.4	Very high	81 Å²	81	68 Å²	68	43%	0.433	35%	0.349	S	S	.	.	H	α-helix	trans	-64.8	-47	173.5	-71.7	-13.1	0	0	0	111.5	Q144 S145 N151 Q152	Q144-N148 PolarHBondContact NE2-OD1 3.36Å; Q144-N148 WeakPolarHBondContact O-CB 3.28Å; Q144-N148 PolarHBondContact O-N 3.37Å; Q144-N148 PolarHBondContact O-ND2 3.48Å; S145-N148 PolarHBondContact O-N 2.85Å; N148-N151 CarbonylContact O-C 3.54Å; N148-N151 WeakPolarHBondContact O-CB 3.39Å; N148-N151 PolarHBondContact O-N 2.88Å; N148-N151 VanDerWaalsContact O-N 3.16Å; N148-Q152 WeakPolarHBondContact O-CG 3.45Å; N148-Q152 PolarHBondContact O-N 3.04Å
149	L	97	Very high	94.8	Very high	46 Å²	46	71 Å²	71	24%	0.241	35%	0.353	C	S	.	.	H	α-helix	trans	-60.1	-47.7	177.4	174.8	58.4	0	0	0	111.9	H99 M102 I122 S145 Y146 N151 Q152 V153	H99-L149 VanDerWaalsContact CD2-CD1 3.46Å; H99-L149 WeakPolarHBondContact CD2-CD1 3.42Å; H99-L149 WeakPolarHBondContact NE2-CD1 3.48Å; M102-L149 HydrophobicContact CE-CD1 4.17Å; M102-L149 HydrophobicContact SD-CD1 4.36Å; I122-L149 HydrophobicContact CD1-CG 4.48Å; I122-L149 HydrophobicContact CG2-CD2 3.79Å; S145-L149 WeakPolarHBondContact O-CB 3.21Å; S145-L149 PolarHBondContact O-N 3.01Å; Y146-L149 PolarHBondContact O-N 3.44Å; L149-N151 VanDerWaalsContact C-N 3.26Å; L149-N151 PolarHBondContact O-N 3.04Å; L149-Q152 PolarHBondContact O-N 2.87Å; L149-V153 HydrophobicContact CD1-CG2 4.3Å; L149-V153 PolarHBondContact O-N 3.24Å
150	K	97.5	Very high	95.4	Very high	81 Å²	81	67.4 Å²	67.4	35%	0.352	33%	0.33	S	S	.	.	H	α-helix	trans	-53	-45.5	173	-179.7	-163.4	171.6	-162.3	0	111.1	I118 I122 Y146 V153 I154	I118-K150 HydrophobicContact CD1-CG 4.11Å; I118-K150 HydrophobicContact CG2-CG 4.26Å; I122-K150 HydrophobicContact CD1-CB 3.99Å; Y146-K150 WeakPolarHBondContact O-CB 3.43Å; Y146-K150 PolarHBondContact O-N 3.34Å; K150-V153 PolarHBondContact O-N 2.88Å; K150-I154 HydrophobicContact CG-CD1 4.06Å; K150-I154 VanDerWaalsContact O-CG1 3.31Å; K150-I154 WeakPolarHBondContact O-CG1 3.35Å; K150-I154 PolarHBondContact O-N 3.04Å; K150-I154 VanDerWaalsContact O-N 3.09Å
151	N	97.7	Very high	95.9	Very high	78 Å²	78	67.7 Å²	67.7	42%	0.417	33%	0.331	S	S	.	.	H	α-helix	trans	-67.5	-32.9	177.3	-73.7	-22.7	0	0	0	112.9	S147 N148 L149 K155	S147-N151 WeakPolarHBondContact O-CB 3.36Å; S147-N151 VanDerWaalsContact O-CG 3.28Å; S147-N151 PolarHBondContact O-N 3.15Å; S147-N151 VanDerWaalsContact O-N 3.09Å; S147-N151 PolarHBondContact O-ND2 2.67Å; N148-N151 CarbonylContact O-C 3.54Å; N148-N151 WeakPolarHBondContact O-CB 3.39Å; N148-N151 PolarHBondContact O-N 2.88Å; N148-N151 VanDerWaalsContact O-N 3.16Å; L149-N151 VanDerWaalsContact C-N 3.26Å; L149-N151 PolarHBondContact O-N 3.04Å; N151-K155 WeakPolarHBondContact O-CB 3.31Å; N151-K155 VanDerWaalsContact O-CG 3.22Å; N151-K155 WeakPolarHBondContact O-CG 3.4Å; N151-K155 PolarHBondContact O-N 2.95Å
152	Q	97.7	Very high	96.4	Very high	87 Å²	87	69.6 Å²	69.6	41%	0.407	33%	0.334	S	S	.	.	H	α-helix	trans	-68.9	-41.2	173.2	-65.7	-63.2	3.6	0	0	112.3	N148 L149 I154 K155 A156	N148-Q152 WeakPolarHBondContact O-CG 3.45Å; N148-Q152 PolarHBondContact O-N 3.04Å; L149-Q152 PolarHBondContact O-N 2.87Å; Q152-I154 PolarHBondContact O-N 3.44Å; Q152-K155 CarbonylContact O-C 3.57Å; Q152-K155 PolarHBondContact O-N 3.48Å; Q152-K155 VanDerWaalsContact O-N 3.15Å; Q152-A156 WeakPolarHBondContact O-CB 3.13Å; Q152-A156 PolarHBondContact O-N 3.35Å
153	V	98.2	Very high	96.6	Very high	0 Å²	0	67.7 Å²	67.7	0%	0	32%	0.322	C	S	.	.	H	α-helix	trans	-63.1	-42.1	175.6	176.3	0	0	0	0	111.1	M102 A103 I118 L149 K150 K155 A156 E157	M102-V153 HydrophobicContact CB-CG1 4.09Å; M102-V153 HydrophobicContact CB-CG2 3.87Å; M102-V153 HydrophobicContact CG-CG2 4.44Å; M102-V153 HydrophobicContact SD-CG2 3.69Å; A103-V153 HydrophobicContact CB-CG1 4.41Å; I118-V153 HydrophobicContact CD1-CB 4.12Å; I118-V153 HydrophobicContact CD1-CG1 3.89Å; I118-V153 HydrophobicContact CG1-CG1 4.31Å; L149-V153 HydrophobicContact CD1-CG2 4.3Å; L149-V153 PolarHBondContact O-N 3.24Å; K150-V153 PolarHBondContact O-N 2.88Å; V153-K155 VanDerWaalsContact C-N 3.3Å; V153-K155 PolarHBondContact O-N 2.97Å; V153-A156 PolarHBondContact O-N 3.44Å; V153-E157 PolarHBondContact O-N 2.98Å
154	I	98	Very high	96.8	Very high	50 Å²	50	65.6 Å²	65.6	26%	0.256	31%	0.311	S	S	.	.	H	α-helix	trans	-68.3	-27.1	174.8	-62.2	166.1	0	0	0	112.2	I118 K150 Q152 R158	I118-I154 HydrophobicContact CD1-CD1 3.97Å; I118-I154 HydrophobicContact CD1-CG1 3.53Å; K150-I154 HydrophobicContact CG-CD1 4.06Å; K150-I154 VanDerWaalsContact O-CG1 3.31Å; K150-I154 WeakPolarHBondContact O-CG1 3.35Å; K150-I154 PolarHBondContact O-N 3.04Å; K150-I154 VanDerWaalsContact O-N 3.09Å; Q152-I154 PolarHBondContact O-N 3.44Å; I154-R158 PolarHBondContact O-NE 3.38Å
155	K	98	Very high	96.7	Very high	102 Å²	102	62 Å²	62	44%	0.443	31%	0.307	S	S	.	.	H	α-helix	trans	-75.4	-38.6	170.7	-76.2	170.5	-179.3	-178.4	0	111.5	N151 Q152 V153 R159	N151-K155 WeakPolarHBondContact O-CB 3.31Å; N151-K155 VanDerWaalsContact O-CG 3.22Å; N151-K155 WeakPolarHBondContact O-CG 3.4Å; N151-K155 PolarHBondContact O-N 2.95Å; Q152-K155 CarbonylContact O-C 3.57Å; Q152-K155 PolarHBondContact O-N 3.48Å; Q152-K155 VanDerWaalsContact O-N 3.15Å; V153-K155 VanDerWaalsContact C-N 3.3Å; V153-K155 PolarHBondContact O-N 2.97Å; K155-R159 WeakPolarHBondContact O-CG 3.14Å; K155-R159 PolarHBondContact O-N 3.07Å
156	A	98.4	Very high	96.6	Very high	2 Å²	2	65.4 Å²	65.4	2%	0.017	31%	0.313	C	S	.	.	H	α-helix	trans	-67.3	-45.9	177.8	0	0	0	0	0	111.9	H99 Y100 A103 Q152 V153 R158 R159 V160	H99-A156 HydrophobicContact CB-CB 4.46Å; Y100-A156 HydrophobicContact CD1-CB 4.15Å; Y100-A156 HydrophobicContact CD2-CB 4.12Å; Y100-A156 HydrophobicContact CE1-CB 3.89Å; Y100-A156 HydrophobicContact CE2-CB 3.86Å; Y100-A156 HydrophobicContact CG-CB 4.26Å; A103-A156 HydrophobicContact CB-CB 3.8Å; Q152-A156 WeakPolarHBondContact O-CB 3.13Å; Q152-A156 PolarHBondContact O-N 3.35Å; V153-A156 PolarHBondContact O-N 3.44Å; A156-R158 PolarHBondContact O-N 2.89Å; A156-R159 CarbonylContact O-C 3.49Å; A156-R159 WeakPolarHBondContact O-CA 3.32Å; A156-R159 WeakPolarHBondContact O-CB 3.46Å; A156-R159 PolarHBondContact O-N 3.37Å; A156-V160 WeakPolarHBondContact O-CG2 3.42Å; A156-V160 PolarHBondContact O-N 3.03Å
157	E	98.1	Very high	96.3	Very high	18 Å²	18	67.3 Å²	67.3	8%	0.084	33%	0.328	C	S	.	.	H	α-helix	trans	-53.7	-50.5	175.3	171.3	174.3	-114	0	0	112.2	A103 F106 K110 V153 R159 V160 L161	A103-E157 HydrophobicContact CB-CB 4.2Å; F106-E157 WeakPolarHBondContact CD1-OE1 3.17Å; F106-E157 WeakPolarHBondContact CE1-OE1 3.39Å; K110-E157 WeakPolarHBondContact CE-OE1 3.34Å; K110-E157 VanDerWaalsContact NZ-CD 3.32Å; K110-E157 IonicContact NZ-OE1 2.74Å; K110-E157 PolarHBondContact NZ-OE1 2.99Å; K110-E157 IonicContact NZ-OE2 3.55Å; K110-E157 PolarHBondContact NZ-OE2 3.15Å; V153-E157 PolarHBondContact O-N 2.98Å; E157-R159 PolarHBondContact O-N 3.37Å; E157-V160 PolarHBondContact O-N 3Å; E157-V160 VanDerWaalsContact O-N 3.17Å; E157-L161 HydrophobicContact CG-CD1 4.21Å; E157-L161 PolarHBondContact O-N 2.7Å
158	R	98	Very high	96.1	Very high	148 Å²	148	66.4 Å²	66.4	56%	0.558	32%	0.321	S	S	*	.	H	α-helix	trans	-64.4	-28	178.9	-72.1	-179.8	-70.4	165.9	-4.1	112.7	I154 A156 K162	I154-R158 PolarHBondContact O-NE 3.38Å; A156-R158 PolarHBondContact O-N 2.89Å; R158-K162 WeakPolarHBondContact O-CB 3.49Å; R158-K162 PolarHBondContact O-N 2.74Å; R158-K162 VanDerWaalsContact O-N 3.14Å
159	R	97.8	Very high	95.7	Very high	125 Å²	125	67.8 Å²	67.8	47%	0.472	33%	0.325	S	S	.	.	H	α-helix	trans	-73.9	-41.9	172.4	-73.8	172.9	179.9	-159.8	10.5	111.8	H95 Y100 K155 A156 E157 K162 E163	H95-R159 PolarHBondContact CD2-NH1 3.15Å; H95-R159 PolarHBondContact NE2-NH1 3.3Å; H95-R159 VanDerWaalsContact NE2-NH1 3.1Å; Y100-R159 HydrophobicContact CE1-CB 4.32Å; Y100-R159 WeakPolarHBondContact OH-CD 3.47Å; K155-R159 WeakPolarHBondContact O-CG 3.14Å; K155-R159 PolarHBondContact O-N 3.07Å; A156-R159 CarbonylContact O-C 3.49Å; A156-R159 WeakPolarHBondContact O-CA 3.32Å; A156-R159 WeakPolarHBondContact O-CB 3.46Å; A156-R159 PolarHBondContact O-N 3.37Å; E157-R159 PolarHBondContact O-N 3.37Å; R159-K162 PolarHBondContact O-N 3.27Å; R159-E163 WeakPolarHBondContact O-CB 3.42Å; R159-E163 PolarHBondContact O-N 3.43Å
160	V	98.1	Very high	95.1	Very high	0 Å²	0	66.1 Å²	66.1	0%	0	32%	0.317	C	S	.	.	H	α-helix	trans	-58.5	-48.8	173.7	174.9	0	0	0	0	110.6	F86 Y100 L107 A156 E157 K162 E163 L164	F86-V160 HydrophobicContact CB-CG2 4.48Å; F86-V160 HydrophobicContact CD2-CB 4.45Å; F86-V160 HydrophobicContact CD2-CG2 3.97Å; F86-V160 HydrophobicContact CE2-CG2 4.48Å; F86-V160 HydrophobicContact CG-CG2 4.13Å; Y100-V160 HydrophobicContact CD1-CG2 3.6Å; Y100-V160 HydrophobicContact CE1-CG2 3.83Å; L107-V160 HydrophobicContact CD2-CG1 4.08Å; A156-V160 WeakPolarHBondContact O-CG2 3.42Å; A156-V160 PolarHBondContact O-N 3.03Å; E157-V160 PolarHBondContact O-N 3Å; E157-V160 VanDerWaalsContact O-N 3.17Å; V160-K162 PolarHBondContact O-N 3.04Å; V160-E163 PolarHBondContact O-N 2.82Å; V160-L164 HydrophobicContact CG1-CD1 3.77Å; V160-L164 HydrophobicContact CG1-CG 4.37Å; V160-L164 WeakPolarHBondContact O-CB 3.18Å; V160-L164 WeakPolarHBondContact O-CG 3.4Å; V160-L164 PolarHBondContact O-N 3.13Å
161	L	97.4	Very high	94.8	Very high	33 Å²	33	65.9 Å²	65.9	17%	0.173	32%	0.316	C	S	.	.	H	α-helix	trans	-59.9	-45.3	177.9	-74.8	169.6	0	0	0	112.9	L107 E157 G165 F166 V168	L107-L161 HydrophobicContact CD1-CD1 4.41Å; L107-L161 HydrophobicContact CD1-CD2 4.05Å; L107-L161 HydrophobicContact CD1-CG 4.39Å; L107-L161 HydrophobicContact CD2-CD2 3.88Å; L107-L161 HydrophobicContact CD2-CG 4Å; E157-L161 HydrophobicContact CG-CD1 4.21Å; E157-L161 PolarHBondContact O-N 2.7Å; L161-G165 PolarHBondContact O-N 2.98Å; L161-F166 HydrophobicContact CB-CD1 4.23Å; L161-F166 HydrophobicContact CB-CE1 3.97Å; L161-F166 HydrophobicContact CB-CZ 4.4Å; L161-F166 HydrophobicContact CD1-CE1 4.42Å; L161-F166 HydrophobicContact CD2-CD1 3.96Å; L161-F166 HydrophobicContact CD2-CE1 4.29Å; L161-F166 HydrophobicContact CG-CE1 4.47Å; L161-F166 PolarHBondContact O-N 3.22Å; L161-V168 HydrophobicContact CD2-CG1 3.86Å
162	K	96.2	Very high	94.6	Very high	174 Å²	174	63.6 Å²	63.6	76%	0.757	30%	0.303	S	S	*	.	H	α-helix	trans	-65.2	-44.8	177.4	-178.2	179	177	-178.3	0	112	R158 R159 V160 G165	R158-K162 WeakPolarHBondContact O-CB 3.49Å; R158-K162 PolarHBondContact O-N 2.74Å; R158-K162 VanDerWaalsContact O-N 3.14Å; R159-K162 PolarHBondContact O-N 3.27Å; V160-K162 PolarHBondContact O-N 3.04Å; K162-G165 PolarHBondContact O-N 3.4Å
163	E	94.9	Very high	94.4	Very high	67 Å²	67	59.4 Å²	59.4	31%	0.313	28%	0.283	S	S	.	.	H	α-helix	trans	-67.8	-39.5	-174.6	-169.9	62.6	-148.1	0	0	112.1	F86 S89 K90 R159 V160 G165	F86-E163 HydrophobicContact CD2-CB 3.88Å; F86-E163 HydrophobicContact CD2-CG 3.93Å; F86-E163 HydrophobicContact CE2-CB 3.9Å; F86-E163 HydrophobicContact CE2-CG 3.98Å; S89-E163 WeakPolarHBondContact CB-OE1 3.42Å; K90-E163 WeakPolarHBondContact CE-OE2 3.44Å; K90-E163 HydrophobicContact CG-CG 4.04Å; K90-E163 IonicContact NZ-OE1 3.73Å; K90-E163 PolarHBondContact NZ-OE1 3Å; K90-E163 IonicContact NZ-OE2 3.19Å; K90-E163 PolarHBondContact NZ-OE2 3.3Å; R159-E163 WeakPolarHBondContact O-CB 3.42Å; R159-E163 PolarHBondContact O-N 3.43Å; V160-E163 PolarHBondContact O-N 2.82Å; E163-G165 PolarHBondContact O-N 3.39Å
164	L	93.3	Very high	94.2	Very high	21 Å²	21	60.5 Å²	60.5	11%	0.11	29%	0.288	C	S	.	.	T	Hydrogen-bonded Turn	trans	-82.5	7.6	177.1	-58.2	-177.9	0	0	0	113.1	L82 R85 V160 F166 C167	L82-L164 HydrophobicContact CB-CD1 4.47Å; L82-L164 HydrophobicContact CD2-CD1 3.55Å; R85-L164 HydrophobicContact CB-CD1 4.45Å; R85-L164 HydrophobicContact CB-CD2 3.63Å; V160-L164 HydrophobicContact CG1-CD1 3.77Å; V160-L164 HydrophobicContact CG1-CG 4.37Å; V160-L164 WeakPolarHBondContact O-CB 3.18Å; V160-L164 WeakPolarHBondContact O-CG 3.4Å; V160-L164 PolarHBondContact O-N 3.13Å; L164-F166 PolarHBondContact O-N 3.16Å; L164-F166 VanDerWaalsContact O-N 3.16Å; L164-C167 WeakPolarHBondContact O-CA 3.4Å; L164-C167 VanDerWaalsContact O-CB 3.24Å; L164-C167 WeakPolarHBondContact O-CB 3.5Å; L164-C167 PolarHBondContact O-N 2.94Å
165	G	91.4	Very high	94	Very high	48 Å²	48	65.3 Å²	65.3	50%	0.495	31%	0.307	S	S	.	.	T	Hydrogen-bonded Turn	trans	59.3	26.5	-179.4	0	0	0	0	0	114.2	L161 K162 E163 C167	L161-G165 PolarHBondContact O-N 2.98Å; K162-G165 PolarHBondContact O-N 3.4Å; E163-G165 PolarHBondContact O-N 3.39Å; G165-C167 PolarHBondContact O-N 3.18Å
166	F	91.8	Very high	93.9	Very high	148 Å²	148	62.3 Å²	62.3	65%	0.649	30%	0.296	S	S	*	.	T	Hydrogen-bonded Turn	trans	60.8	8	-166.4	-59.8	-96.8	0	0	0	115.8	L161 L164 V168	L161-F166 HydrophobicContact CB-CD1 4.23Å; L161-F166 HydrophobicContact CB-CE1 3.97Å; L161-F166 HydrophobicContact CB-CZ 4.4Å; L161-F166 HydrophobicContact CD1-CE1 4.42Å; L161-F166 HydrophobicContact CD2-CD1 3.96Å; L161-F166 HydrophobicContact CD2-CE1 4.29Å; L161-F166 HydrophobicContact CG-CE1 4.47Å; L161-F166 PolarHBondContact O-N 3.22Å; L164-F166 PolarHBondContact O-N 3.16Å; L164-F166 VanDerWaalsContact O-N 3.16Å; F166-V168 PolarHBondContact O-N 2.93Å
167	C	90.5	Very high	93.8	Very high	61 Å²	61	62.2 Å²	62.2	41%	0.412	30%	0.295	S	S	.	.			trans	-75.9	62.3	174.9	-59.7	0	0	0	0	112.1	I29 L164 G165 H169	I29-C167 HydrophobicContact CD1-CB 3.45Å; I29-C167 VanDerWaalsContact CD1-CB 3.45Å; L164-C167 WeakPolarHBondContact O-CA 3.4Å; L164-C167 VanDerWaalsContact O-CB 3.24Å; L164-C167 WeakPolarHBondContact O-CB 3.5Å; L164-C167 PolarHBondContact O-N 2.94Å; G165-C167 PolarHBondContact O-N 3.18Å; C167-H169 VanDerWaalsContact C-N 3.33Å; C167-H169 PolarHBondContact O-N 3.4Å
168	V	91.4	Very high	93.6	Very high	25 Å²	25	63.9 Å²	63.9	15%	0.152	30%	0.304	C	S	.	.			trans	-87.5	4.4	-175	-61.5	0	0	0	0	114.3	L82 L107 L111 L161 F166	L82-V168 HydrophobicContact CD2-CB 3.83Å; L82-V168 HydrophobicContact CD2-CG1 3.92Å; L107-V168 HydrophobicContact CD2-CG1 4.46Å; L111-V168 HydrophobicContact CD1-CB 3.7Å; L111-V168 HydrophobicContact CD1-CG1 4.48Å; L111-V168 HydrophobicContact CD1-CG2 3.64Å; L111-V168 HydrophobicContact CD2-CG2 3.67Å; L111-V168 HydrophobicContact CG-CG2 4.32Å; L161-V168 HydrophobicContact CD2-CG1 3.86Å; F166-V168 PolarHBondContact O-N 2.93Å
169	H	87.3	Confident	93.5	Very high	110 Å²	110	59.1 Å²	59.1	51%	0.509	29%	0.293	S	S	.	.			trans	-70.1	136.1	177.1	-173.6	58.2	0	0	0	111.6	R85 C167 K171	R85-H169 PolarHBondContact NH1-O 2.65Å; C167-H169 VanDerWaalsContact C-N 3.33Å; C167-H169 PolarHBondContact O-N 3.4Å; H169-K171 WeakPolarHBondContact NE2-CG 3.49Å
170	A	86.2	Confident	93.4	Very high	10 Å²	10	54.2 Å²	54.2	8%	0.083	28%	0.275	C	S	.	.			trans	-139.2	109	173.8	0	0	0	0	0	109.7	V81 H172	V81-A170 HydrophobicContact CB-CB 4.31Å; V81-A170 HydrophobicContact CG1-CB 4.08Å; A170-H172 PolarHBondContact O-CD2 2.85Å; A170-H172 PolarHBondContact O-NE2 2.69Å
171	K	91.3	Very high	93.3	Very high	77 Å²	77	54.2 Å²	54.2	34%	0.335	28%	0.275	S	S	.	.			trans	-74.1	131.3	163.5	-68.1	175.3	172.3	169.8	0	108.2	I26 N28 H169 P214	I26-K171 WeakPolarHBondContact O-CE 3.46Å; I26-K171 PolarHBondContact O-NZ 2.76Å; N28-K171 PolarHBondContact ND2-O 3.15Å; N28-K171 PolarHBondContact OD1-N 3.48Å; H169-K171 WeakPolarHBondContact NE2-CG 3.49Å; K171-P214 HydrophobicContact CB-CG 4.03Å; K171-P214 WeakPolarHBondContact O-CG 3.41Å
172	H	91.8	Very high	93.2	Very high	29 Å²	29	56.7 Å²	56.7	13%	0.134	29%	0.286	C	S	.	.			trans	-109.4	140.5	-178.1	-63.7	-69.3	0	0	0	112.2	A77 T78 A170 H174	A77-H172 VanDerWaalsContact C-CE1 3.42Å; A77-H172 VanDerWaalsContact CB-CE1 3.47Å; A77-H172 WeakPolarHBondContact CB-CE1 3.48Å; T78-H172 PolarHBondContact N-CE1 2.72Å; T78-H172 PolarHBondContact N-NE2 2.78Å; T78-H172 PolarHBondContact OG1-NE2 3.03Å; A170-H172 PolarHBondContact O-CD2 2.85Å; A170-H172 PolarHBondContact O-NE2 2.69Å; H172-H174 WeakPolarHBondContact CB-ND1 3.41Å; H172-H174 PolarHBondContact O-N 3.32Å
173	P	94.1	Very high	93.1	Very high	0 Å²	0	51 Å²	51	0%	0	27%	0.271	C	S	.	.	T	Hydrogen-bonded Turn	trans	-70.2	-8.7	-175.3	29.8	-37.6	0	0	0	114.3	K175 L176 V177 M200 F209 P214 I217 A218	P173-K175 VanDerWaalsContact C-N 3.26Å; P173-K175 PolarHBondContact O-N 2.98Å; P173-K175 VanDerWaalsContact O-N 3.12Å; P173-L176 WeakPolarHBondContact O-CA 3.19Å; P173-L176 WeakPolarHBondContact O-CB 3.42Å; P173-L176 PolarHBondContact O-N 3.35Å; P173-V177 PolarHBondContact O-N 3.4Å; P173-M200 HydrophobicContact CB-CG 4.19Å; P173-M200 HydrophobicContact CG-CG 3.55Å; P173-M200 HydrophobicContact CG-SD 4.12Å; P173-F209 VanDerWaalsContact CD-CE1 3.49Å; P173-F209 HydrophobicContact CG-CE1 3.97Å; P173-F209 HydrophobicContact CG-CZ 3.78Å; P173-P214 HydrophobicContact CB-CB 4.23Å; P173-P214 WeakPolarHBondContact CB-O 3.41Å; P173-I217 HydrophobicContact CB-CB 4.33Å; P173-I217 HydrophobicContact CB-CG2 4.18Å; P173-I217 HydrophobicContact CG-CB 4.34Å; P173-I217 HydrophobicContact CG-CG2 3.79Å; P173-A218 HydrophobicContact CB-CB 4.2Å
174	H	93.9	Very high	93	Very high	22 Å²	22	48.7 Å²	48.7	10%	0.102	26%	0.261	C	S	.	.	H	α-helix	trans	-45.4	-45.7	-178.8	-62.1	67.7	0	0	0	113.5	H172 W197 M200 N201	H172-H174 WeakPolarHBondContact CB-ND1 3.41Å; H172-H174 PolarHBondContact O-N 3.32Å; H174-W197 HydrophobicContact CB-CH2 3.8Å; H174-W197 HydrophobicContact CB-CZ3 3.87Å; H174-W197 AromaticContact CD2-CH2 3.87Å; H174-W197 AromaticContact CD2-CZ2 3.71Å; H174-W197 VanDerWaalsContact O-CZ3 3.28Å; H174-W197 WeakPolarHBondContact O-CZ3 3.2Å; H174-M200 HydrophobicContact CB-CE 4.13Å; H174-M200 HydrophobicContact CB-SD 4.42Å; H174-M200 WeakPolarHBondContact CD2-CE 3.45Å; H174-M200 VanDerWaalsContact CD2-SD 3.57Å; H174-M200 PolarHBondContact CE1-SD 3.33Å; H174-M200 VanDerWaalsContact CG-SD 3.6Å; H174-M200 PolarHBondContact ND1-SD 3.34Å; H174-M200 PolarHBondContact NE2-SD 3.07Å; H174-M200 VanDerWaalsContact NE2-SD 3.37Å; H174-N201 PolarHBondContact NE2-OD1 2.74Å
175	K	94.2	Very high	93	Very high	151 Å²	151	54.7 Å²	54.7	66%	0.657	29%	0.293	S	S	*	.	H	α-helix	trans	-72.3	-39.6	178.8	-171.5	-176.1	175.7	-169.7	0	112.1	P173 V177 I178 C179	P173-K175 VanDerWaalsContact C-N 3.26Å; P173-K175 PolarHBondContact O-N 2.98Å; P173-K175 VanDerWaalsContact O-N 3.12Å; K175-V177 VanDerWaalsContact C-N 3.35Å; K175-V177 PolarHBondContact O-N 2.87Å; K175-I178 PolarHBondContact O-N 3.45Å; K175-I178 VanDerWaalsContact O-N 3.16Å; K175-C179 PolarHBondContact O-N 2.92Å; K175-C179 PolarHBondContact O-SG 3.09Å
176	L	95.7	Very high	93	Very high	39 Å²	39	54.6 Å²	54.6	20%	0.204	28%	0.279	C	S	.	.	H	α-helix	trans	-64.4	-39	-178.9	-60.6	178	0	0	0	111.4	P173 I178 C179 Y180 P214 E215 A218	P173-L176 WeakPolarHBondContact O-CA 3.19Å; P173-L176 WeakPolarHBondContact O-CB 3.42Å; P173-L176 PolarHBondContact O-N 3.35Å; L176-I178 PolarHBondContact O-N 3.12Å; L176-C179 PolarHBondContact O-N 3.37Å; L176-Y180 HydrophobicContact CB-CE1 4.4Å; L176-Y180 HydrophobicContact CB-CE2 4.23Å; L176-Y180 HydrophobicContact CD2-CE1 4.28Å; L176-Y180 WeakPolarHBondContact O-CB 3.3Å; L176-Y180 PolarHBondContact O-N 3.1Å; L176-P214 HydrophobicContact CD1-CB 3.74Å; L176-E215 HydrophobicContact CD1-CB 4.45Å; L176-E215 HydrophobicContact CD1-CG 3.96Å; L176-A218 HydrophobicContact CB-CB 3.74Å
177	V	95.4	Very high	92.9	Very high	0 Å²	0	52.3 Å²	52.3	0%	0	27%	0.271	C	S	.	.	H	α-helix	trans	-55.6	-38.1	174	173.4	0	0	0	0	111.9	P173 K175 L181 A196 M200 A218 I222	P173-V177 PolarHBondContact O-N 3.4Å; K175-V177 VanDerWaalsContact C-N 3.35Å; K175-V177 PolarHBondContact O-N 2.87Å; V177-L181 HydrophobicContact CG1-CD1 4.24Å; V177-L181 WeakPolarHBondContact O-CB 3.48Å; V177-L181 WeakPolarHBondContact O-CD1 3.38Å; V177-L181 VanDerWaalsContact O-CG 3.28Å; V177-L181 WeakPolarHBondContact O-CG 3.23Å; V177-L181 PolarHBondContact O-N 2.88Å; V177-A196 HydrophobicContact CG1-CB 3.79Å; V177-M200 HydrophobicContact CG2-CB 4.31Å; V177-M200 HydrophobicContact CG2-CG 4.19Å; V177-A218 HydrophobicContact CG2-CB 3.84Å; V177-I222 HydrophobicContact CG1-CG1 4.28Å
178	I	94.9	Very high	92.9	Very high	54 Å²	54	54.7 Å²	54.7	28%	0.277	28%	0.283	S	S	.	.	H	α-helix	trans	-73.6	-51.4	175.7	-53.6	-56	0	0	0	110.8	K175 L176 Y180 L181 Q182 V193 W197	K175-I178 PolarHBondContact O-N 3.45Å; K175-I178 VanDerWaalsContact O-N 3.16Å; L176-I178 PolarHBondContact O-N 3.12Å; I178-Y180 VanDerWaalsContact C-N 3.29Å; I178-Y180 PolarHBondContact O-N 2.72Å; I178-L181 PolarHBondContact O-N 3.32Å; I178-Q182 HydrophobicContact CG2-CG 4.48Å; I178-Q182 WeakPolarHBondContact O-CG 3.25Å; I178-Q182 PolarHBondContact O-N 3.14Å; I178-V193 HydrophobicContact CD1-CG1 3.69Å; I178-W197 HydrophobicContact CD1-CE3 4.1Å; I178-W197 HydrophobicContact CD1-CZ3 4.2Å; I178-W197 HydrophobicContact CG1-CE3 4.46Å; I178-W197 HydrophobicContact CG1-CZ3 4.13Å
179	C	95.5	Very high	93.1	Very high	48 Å²	48	55.8 Å²	55.8	32%	0.324	29%	0.289	S	S	.	.	H	α-helix	trans	-62.7	-32.7	-177	-64.9	0	0	0	0	113.3	K175 L176 Q182 A183	K175-C179 PolarHBondContact O-N 2.92Å; K175-C179 PolarHBondContact O-SG 3.09Å; L176-C179 PolarHBondContact O-N 3.37Å; C179-Q182 WeakPolarHBondContact O-CB 3.29Å; C179-Q182 PolarHBondContact O-N 2.94Å; C179-A183 PolarHBondContact O-N 3.1Å
180	Y	96.7	Very high	93.4	Very high	21 Å²	21	58.8 Å²	58.8	8%	0.082	30%	0.3	C	S	.	.	H	α-helix	trans	-74.8	-40.6	175.8	-64.4	-5.5	0	0	0	111.3	L176 I178 Q182 A183 L184 E215 A218 I222 F243	L176-Y180 HydrophobicContact CB-CE1 4.4Å; L176-Y180 HydrophobicContact CB-CE2 4.23Å; L176-Y180 HydrophobicContact CD2-CE1 4.28Å; L176-Y180 WeakPolarHBondContact O-CB 3.3Å; L176-Y180 PolarHBondContact O-N 3.1Å; I178-Y180 VanDerWaalsContact C-N 3.29Å; I178-Y180 PolarHBondContact O-N 2.72Å; Y180-Q182 PolarHBondContact O-N 2.85Å; Y180-A183 PolarHBondContact O-N 2.94Å; Y180-L184 WeakPolarHBondContact O-CG 3.21Å; Y180-L184 PolarHBondContact O-N 3.24Å; Y180-L184 VanDerWaalsContact O-N 3.09Å; Y180-E215 WeakPolarHBondContact OH-CB 3.36Å; Y180-E215 WeakPolarHBondContact OH-CG 3.35Å; Y180-A218 HydrophobicContact CD2-CB 3.85Å; Y180-A218 HydrophobicContact CE2-CB 3.78Å; Y180-I222 HydrophobicContact CD2-CD1 4.33Å; Y180-F243 AromaticContact CD1-CD1 3.68Å; Y180-F243 HydrophobicContact CD1-CD1 3.68Å; Y180-F243 HydrophobicContact CD1-CD2 4.13Å; Y180-F243 AromaticContact CD1-CE1 3.44Å; Y180-F243 HydrophobicContact CD1-CE1 3.44Å; Y180-F243 VanDerWaalsContact CD1-CE1 3.44Å; Y180-F243 AromaticContact CD1-CE2 3.91Å; Y180-F243 HydrophobicContact CD1-CE2 3.91Å; Y180-F243 HydrophobicContact CD1-CG 4.03Å; Y180-F243 AromaticContact CD1-CZ 3.57Å; Y180-F243 HydrophobicContact CD1-CZ 3.57Å; Y180-F243 AromaticContact CD2-CD2 3.81Å; Y180-F243 HydrophobicContact CD2-CD2 3.81Å; Y180-F243 AromaticContact CD2-CE2 3.98Å; Y180-F243 HydrophobicContact CD2-CE2 3.98Å; Y180-F243 HydrophobicContact CD2-CG 4.16Å; Y180-F243 HydrophobicContact CD2-CZ 4.48Å; Y180-F243 HydrophobicContact CE1-CB 4.39Å; Y180-F243 AromaticContact CE1-CD1 3.39Å; Y180-F243 HydrophobicContact CE1-CD1 3.39Å; Y180-F243 HydrophobicContact CE1-CD2 4.27Å; Y180-F243 AromaticContact CE1-CE1 3.65Å; Y180-F243 HydrophobicContact CE1-CE1 3.65Å; Y180-F243 HydrophobicContact CE1-CE2 4.46Å; Y180-F243 AromaticContact CE1-CG 3.75Å; Y180-F243 HydrophobicContact CE1-CG 3.75Å; Y180-F243 HydrophobicContact CE1-CZ 4.19Å; Y180-F243 HydrophobicContact CE2-CB 4.12Å; Y180-F243 HydrophobicContact CE2-CD1 4.39Å; Y180-F243 AromaticContact CE2-CD2 3.95Å; Y180-F243 HydrophobicContact CE2-CD2 3.95Å; Y180-F243 AromaticContact CE2-CG 3.87Å; Y180-F243 HydrophobicContact CE2-CG 3.87Å; Y180-F243 HydrophobicContact CG-CD1 4.3Å; Y180-F243 AromaticContact CG-CD2 3.91Å; Y180-F243 HydrophobicContact CG-CD2 3.91Å; Y180-F243 HydrophobicContact CG-CE1 4.08Å; Y180-F243 AromaticContact CG-CE2 3.64Å; Y180-F243 HydrophobicContact CG-CE2 3.64Å; Y180-F243 HydrophobicContact CG-CG 4.24Å; Y180-F243 AromaticContact CG-CZ 3.74Å; Y180-F243 HydrophobicContact CG-CZ 3.74Å; Y180-F243 AromaticContact CZ-CD1 3.78Å; Y180-F243 AromaticContact CZ-CG 3.65Å
181	L	95.6	Very high	93.9	Very high	0 Å²	0	63.9 Å²	63.9	0%	0	33%	0.326	C	S	.	.	H	α-helix	trans	-67.3	-22.5	172.3	-70.5	174	0	0	0	112.9	V177 I178 H186 E187 L192 V193 A196 I222	V177-L181 HydrophobicContact CG1-CD1 4.24Å; V177-L181 WeakPolarHBondContact O-CB 3.48Å; V177-L181 WeakPolarHBondContact O-CD1 3.38Å; V177-L181 VanDerWaalsContact O-CG 3.28Å; V177-L181 WeakPolarHBondContact O-CG 3.23Å; V177-L181 PolarHBondContact O-N 2.88Å; I178-L181 PolarHBondContact O-N 3.32Å; L181-H186 HydrophobicContact CD2-CB 4.12Å; L181-H186 CarbonylContact O-C 3.58Å; L181-H186 WeakPolarHBondContact O-CA 3.29Å; L181-H186 PolarHBondContact O-N 2.88Å; L181-E187 PolarHBondContact O-N 3.47Å; L181-L192 HydrophobicContact CD1-CG 4.43Å; L181-L192 HydrophobicContact CD2-CD2 3.72Å; L181-L192 HydrophobicContact CD2-CG 3.91Å; L181-V193 HydrophobicContact CD1-CB 4.2Å; L181-V193 HydrophobicContact CD1-CG2 3.75Å; L181-A196 HydrophobicContact CD1-CB 4.37Å; L181-I222 HydrophobicContact CD1-CG1 4.34Å; L181-I222 HydrophobicContact CD2-CD1 4.22Å; L181-I222 HydrophobicContact CD2-CG1 4.16Å; L181-I222 HydrophobicContact CD2-CG2 3.86Å; L181-I222 HydrophobicContact CG-CD1 3.89Å; L181-I222 HydrophobicContact CG-CG1 4.06Å
182	Q	94.7	Very high	94.2	Very high	86 Å²	86	60.2 Å²	60.2	40%	0.402	31%	0.31	S	S	.	.	H	α-helix	trans	-71.3	-47.6	167.7	-73.8	179.8	-47.1	0	0	111.8	I178 C179 Y180 L184 D185 E187	I178-Q182 HydrophobicContact CG2-CG 4.48Å; I178-Q182 WeakPolarHBondContact O-CG 3.25Å; I178-Q182 PolarHBondContact O-N 3.14Å; C179-Q182 WeakPolarHBondContact O-CB 3.29Å; C179-Q182 PolarHBondContact O-N 2.94Å; Y180-Q182 PolarHBondContact O-N 2.85Å; Q182-L184 PolarHBondContact O-N 3.4Å; Q182-L184 VanDerWaalsContact O-N 3.13Å; Q182-D185 PolarHBondContact O-N 3.16Å; Q182-D185 VanDerWaalsContact O-N 3.13Å; Q182-E187 HydrophobicContact CG-CB 3.7Å; Q182-E187 HydrophobicContact CG-CG 3.97Å; Q182-E187 WeakPolarHBondContact CG-OE2 3.45Å; Q182-E187 PolarHBondContact NE2-OE2 3.06Å
183	A	94.1	Very high	94.4	Very high	55 Å²	55	60.2 Å²	60.2	46%	0.455	31%	0.312	S	S	.	.	H	α-helix	trans	-67	-8.4	176.6	0	0	0	0	0	114.7	C179 Y180 F243	C179-A183 PolarHBondContact O-N 3.1Å; Y180-A183 PolarHBondContact O-N 2.94Å; A183-F243 HydrophobicContact CB-CE1 4.48Å; A183-F243 HydrophobicContact CB-CZ 4.06Å
184	L	93.7	Very high	94.6	Very high	18 Å²	18	64.5 Å²	64.5	9%	0.094	33%	0.332	C	S	.	.	T	Hydrogen-bonded Turn	trans	-110.4	15.9	175.7	-61	169.3	0	0	0	112.7	Y180 Q182 H186 W239	Y180-L184 WeakPolarHBondContact O-CG 3.21Å; Y180-L184 PolarHBondContact O-N 3.24Å; Y180-L184 VanDerWaalsContact O-N 3.09Å; Q182-L184 PolarHBondContact O-N 3.4Å; Q182-L184 VanDerWaalsContact O-N 3.13Å; L184-H186 VanDerWaalsContact O-CG 3.22Å; L184-H186 PolarHBondContact O-N 2.97Å; L184-H186 VanDerWaalsContact O-N 3.13Å; L184-H186 PolarHBondContact O-ND1 3.08Å; L184-H186 VanDerWaalsContact O-ND1 3.11Å; L184-W239 HydrophobicContact CD1-CD2 4.02Å; L184-W239 HydrophobicContact CD1-CE3 3.63Å; L184-W239 HydrophobicContact CD1-CZ3 3.93Å; L184-W239 HydrophobicContact CD2-CB 3.87Å; L184-W239 HydrophobicContact CD2-CD2 4.46Å; L184-W239 HydrophobicContact CD2-CE3 4.3Å; L184-W239 HydrophobicContact CD2-CG 4.33Å
185	D	92.7	Very high	94.7	Very high	146 Å²	146	64.5 Å²	64.5	78%	0.781	33%	0.334	S	S	*	.	T	Hydrogen-bonded Turn	trans	51.6	36.1	-179	-66.4	-47.9	0	0	0	114.1	Q182	Q182-D185 PolarHBondContact O-N 3.16Å; Q182-D185 VanDerWaalsContact O-N 3.13Å
186	H	91.2	Very high	94.9	Very high	46 Å²	46	57.3 Å²	57.3	21%	0.213	30%	0.303	C	S	.	.			trans	-124.4	3	-171.5	-79.6	4.5	0	0	0	114.5	L181 L184 T188 N189 L192 L233	L181-H186 HydrophobicContact CD2-CB 4.12Å; L181-H186 CarbonylContact O-C 3.58Å; L181-H186 WeakPolarHBondContact O-CA 3.29Å; L181-H186 PolarHBondContact O-N 2.88Å; L184-H186 VanDerWaalsContact O-CG 3.22Å; L184-H186 PolarHBondContact O-N 2.97Å; L184-H186 VanDerWaalsContact O-N 3.13Å; L184-H186 PolarHBondContact O-ND1 3.08Å; L184-H186 VanDerWaalsContact O-ND1 3.11Å; H186-T188 PolarHBondContact O-N 3.1Å; H186-N189 WeakPolarHBondContact O-CB 3.47Å; H186-N189 PolarHBondContact O-N 3.21Å; H186-L192 HydrophobicContact CB-CD2 4.08Å; H186-L233 WeakPolarHBondContact CD2-CD2 3.43Å; H186-L233 WeakPolarHBondContact NE2-CD2 3.44Å
187	E	89.4	Confident	94.9	Very high	100 Å²	100	59.4 Å²	59.4	47%	0.467	31%	0.308	S	S	.	.	T	Hydrogen-bonded Turn	trans	-58.3	-29.4	176.1	56.3	145.6	-139.6	0	0	113.9	L181 Q182 N189	L181-E187 PolarHBondContact O-N 3.47Å; Q182-E187 HydrophobicContact CG-CB 3.7Å; Q182-E187 HydrophobicContact CG-CG 3.97Å; Q182-E187 WeakPolarHBondContact CG-OE2 3.45Å; Q182-E187 PolarHBondContact NE2-OE2 3.06Å; E187-N189 PolarHBondContact O-N 2.91Å
188	T	91.5	Very high	95	Very high	111 Å²	111	63.1 Å²	63.1	68%	0.681	33%	0.328	S	S	*	.	T	Hydrogen-bonded Turn	trans	-68.6	-23.6	176.4	60.6	0	0	0	0	112.4	H186 K190	H186-T188 PolarHBondContact O-N 3.1Å; T188-K190 VanDerWaalsContact C-N 3.33Å; T188-K190 PolarHBondContact O-N 2.97Å
189	N	94.5	Very high	95.1	Very high	49 Å²	49	61.3 Å²	61.3	26%	0.262	32%	0.317	S	S	.	.			trans	-81.1	78.4	-179.8	-169.5	-19.4	0	0	0	111.1	H186 E187 N191 L192 V193 I231	H186-N189 WeakPolarHBondContact O-CB 3.47Å; H186-N189 PolarHBondContact O-N 3.21Å; E187-N189 PolarHBondContact O-N 2.91Å; N189-N191 PolarHBondContact O-N 2.81Å; N189-N191 PolarHBondContact OD1-N 3.37Å; N189-L192 HydrophobicContact CB-CB 4.1Å; N189-L192 PolarHBondContact O-N 2.88Å; N189-L192 PolarHBondContact OD1-N 3.39Å; N189-V193 WeakPolarHBondContact O-CG2 3.33Å; N189-V193 PolarHBondContact O-N 3.13Å; N189-I231 VanDerWaalsContact ND2-CD1 3.31Å; N189-I231 WeakPolarHBondContact ND2-CD1 3.37Å
190	K	95	Very high	95.2	Very high	172 Å²	172	59 Å²	59	75%	0.748	30%	0.302	S	S	*	.	H	α-helix	trans	-50.1	-31.2	178.9	-63.7	176.4	-176.4	175.3	0	113.8	T188 Q194	T188-K190 VanDerWaalsContact C-N 3.33Å; T188-K190 PolarHBondContact O-N 2.97Å; K190-Q194 WeakPolarHBondContact O-CB 3.33Å; K190-Q194 PolarHBondContact O-N 3.23Å
191	N	96.4	Very high	95.1	Very high	118 Å²	118	59.3 Å²	59.3	63%	0.631	31%	0.305	S	S	*	.	H	α-helix	trans	-71.3	-42.6	177.3	-69.8	-29.5	0	0	0	111.9	N189 T195 L229	N189-N191 PolarHBondContact O-N 2.81Å; N189-N191 PolarHBondContact OD1-N 3.37Å; N191-T195 WeakPolarHBondContact O-CB 3.39Å; N191-T195 PolarHBondContact O-N 3Å; N191-T195 PolarHBondContact O-OG1 3.4Å; N191-L229 HydrophobicContact CB-CD1 4.44Å
192	L	97	Very high	95.2	Very high	0 Å²	0	61.2 Å²	61.2	0%	0	32%	0.315	C	S	.	.	H	α-helix	trans	-66.4	-49.8	174.9	178.4	56	0	0	0	110.9	L181 H186 N189 Q194 T195 A196 A225 L229 I231	L181-L192 HydrophobicContact CD1-CG 4.43Å; L181-L192 HydrophobicContact CD2-CD2 3.72Å; L181-L192 HydrophobicContact CD2-CG 3.91Å; H186-L192 HydrophobicContact CB-CD2 4.08Å; N189-L192 HydrophobicContact CB-CB 4.1Å; N189-L192 PolarHBondContact O-N 2.88Å; N189-L192 PolarHBondContact OD1-N 3.39Å; L192-Q194 PolarHBondContact O-N 3.46Å; L192-T195 PolarHBondContact O-N 3.05Å; L192-T195 VanDerWaalsContact O-N 3.15Å; L192-A196 WeakPolarHBondContact O-CB 3.48Å; L192-A196 PolarHBondContact O-N 3.5Å; L192-A225 HydrophobicContact CD1-CB 3.6Å; L192-L229 HydrophobicContact CB-CD1 4.02Å; L192-L229 HydrophobicContact CD1-CD1 4.18Å; L192-I231 HydrophobicContact CB-CD1 3.88Å; L192-I231 HydrophobicContact CD1-CD1 4.25Å; L192-I231 HydrophobicContact CD2-CD1 3.92Å; L192-I231 HydrophobicContact CD2-CG2 4.44Å; L192-I231 HydrophobicContact CG-CD1 4.23Å
193	V	96.7	Very high	95.2	Very high	29 Å²	29	57.1 Å²	57.1	18%	0.176	30%	0.296	C	S	.	.	H	α-helix	trans	-54.4	-51.7	176.8	177.2	0	0	0	0	111.2	I178 L181 N189 T195 W197	I178-V193 HydrophobicContact CD1-CG1 3.69Å; L181-V193 HydrophobicContact CD1-CB 4.2Å; L181-V193 HydrophobicContact CD1-CG2 3.75Å; N189-V193 WeakPolarHBondContact O-CG2 3.33Å; N189-V193 PolarHBondContact O-N 3.13Å; V193-T195 VanDerWaalsContact C-N 3.33Å; V193-T195 PolarHBondContact O-N 2.99Å; V193-W197 WeakPolarHBondContact O-CB 3.29Å; V193-W197 PolarHBondContact O-N 3.46Å
194	Q	96.7	Very high	95.3	Very high	89 Å²	89	54.6 Å²	54.6	42%	0.416	28%	0.275	S	S	.	.	H	α-helix	trans	-66.3	-34.1	179.8	-171.9	65.1	74.5	0	0	112.5	K190 L192 N198	K190-Q194 WeakPolarHBondContact O-CB 3.33Å; K190-Q194 PolarHBondContact O-N 3.23Å; L192-Q194 PolarHBondContact O-N 3.46Å; Q194-N198 PolarHBondContact NE2-OD1 3.13Å; Q194-N198 WeakPolarHBondContact O-CB 3.48Å; Q194-N198 PolarHBondContact O-N 3.26Å; Q194-N198 PolarHBondContact O-ND2 3.46Å; Q194-N198 PolarHBondContact O-OD1 2.9Å
195	T	97.5	Very high	95.4	Very high	23 Å²	23	57 Å²	57	14%	0.141	28%	0.283	C	S	.	.	H	α-helix	trans	-71.4	-45.7	179.3	-60.3	0	0	0	0	111.4	N191 L192 V193 W197 N198 Y199 A225 K228	N191-T195 WeakPolarHBondContact O-CB 3.39Å; N191-T195 PolarHBondContact O-N 3Å; N191-T195 PolarHBondContact O-OG1 3.4Å; L192-T195 PolarHBondContact O-N 3.05Å; L192-T195 VanDerWaalsContact O-N 3.15Å; V193-T195 VanDerWaalsContact C-N 3.33Å; V193-T195 PolarHBondContact O-N 2.99Å; T195-W197 VanDerWaalsContact C-N 3.35Å; T195-N198 PolarHBondContact O-N 3.31Å; T195-Y199 HydrophobicContact CG2-CD2 3.9Å; T195-Y199 HydrophobicContact CG2-CE2 3.53Å; T195-Y199 VanDerWaalsContact O-CD2 3.27Å; T195-Y199 WeakPolarHBondContact O-CD2 3.31Å; T195-Y199 PolarHBondContact O-N 3.03Å; T195-A225 HydrophobicContact CG2-CB 3.71Å; T195-K228 HydrophobicContact CG2-CD 4.29Å
196	A	98	Very high	95.5	Very high	0 Å²	0	50.7 Å²	50.7	0%	0	25%	0.25	C	C	.	.	H	α-helix	trans	-62.8	-41.3	174.6	0	0	0	0	0	111.6	V177 L181 L192 Y199 M200 I222 A225	V177-A196 HydrophobicContact CG1-CB 3.79Å; L181-A196 HydrophobicContact CD1-CB 4.37Å; L192-A196 WeakPolarHBondContact O-CB 3.48Å; L192-A196 PolarHBondContact O-N 3.5Å; A196-Y199 PolarHBondContact O-N 3.37Å; A196-M200 WeakPolarHBondContact O-CB 3.35Å; A196-M200 PolarHBondContact O-N 3.45Å; A196-I222 HydrophobicContact CB-CG1 3.96Å; A196-A225 HydrophobicContact CB-CB 3.86Å
197	W	96.6	Very high	95.7	Very high	82 Å²	82	49.8 Å²	49.8	31%	0.311	25%	0.246	S	C	.	.	H	α-helix	trans	-63.1	-40.4	174.3	-173.1	-83	0	0	0	112.3	H174 I178 V193 T195 M200 N201	H174-W197 HydrophobicContact CB-CH2 3.8Å; H174-W197 HydrophobicContact CB-CZ3 3.87Å; H174-W197 AromaticContact CD2-CH2 3.87Å; H174-W197 AromaticContact CD2-CZ2 3.71Å; H174-W197 VanDerWaalsContact O-CZ3 3.28Å; H174-W197 WeakPolarHBondContact O-CZ3 3.2Å; I178-W197 HydrophobicContact CD1-CE3 4.1Å; I178-W197 HydrophobicContact CD1-CZ3 4.2Å; I178-W197 HydrophobicContact CG1-CE3 4.46Å; I178-W197 HydrophobicContact CG1-CZ3 4.13Å; V193-W197 WeakPolarHBondContact O-CB 3.29Å; V193-W197 PolarHBondContact O-N 3.46Å; T195-W197 VanDerWaalsContact C-N 3.35Å; W197-M200 HydrophobicContact CB-CE 4.38Å; W197-M200 HydrophobicContact CD2-CE 3.64Å; W197-M200 HydrophobicContact CE3-CE 3.81Å; W197-M200 HydrophobicContact CG-CE 3.9Å; W197-M200 HydrophobicContact CZ3-CE 4.41Å; W197-M200 PolarHBondContact O-N 2.93Å; W197-N201 PolarHBondContact NE1-ND2 3.4Å; W197-N201 VanDerWaalsContact NE1-ND2 3.12Å; W197-N201 PolarHBondContact O-N 3.43Å; W197-N201 VanDerWaalsContact O-N 3.1Å; W197-N201 PolarHBondContact O-ND2 2.83Å
198	N	96.9	Very high	95.9	Very high	78 Å²	78	45 Å²	45	42%	0.417	22%	0.224	S	C	.	.	H	α-helix	trans	-64.6	-45.8	176	-70.7	-7.5	0	0	0	111.4	Q194 T195 M200 N201 D202	Q194-N198 PolarHBondContact NE2-OD1 3.13Å; Q194-N198 WeakPolarHBondContact O-CB 3.48Å; Q194-N198 PolarHBondContact O-N 3.26Å; Q194-N198 PolarHBondContact O-ND2 3.46Å; Q194-N198 PolarHBondContact O-OD1 2.9Å; T195-N198 PolarHBondContact O-N 3.31Å; N198-M200 VanDerWaalsContact C-N 3.31Å; N198-M200 PolarHBondContact O-N 3.3Å; N198-N201 PolarHBondContact O-N 2.84Å; N198-D202 PolarHBondContact O-N 2.95Å
199	Y	97.7	Very high	96.1	Very high	16 Å²	16	39.9 Å²	39.9	6%	0.063	19%	0.192	C	C	.	.	H	α-helix	trans	-57.9	-43.1	175.7	-78.6	-46.2	0	0	0	112.8	T195 A196 N201 D202 S203 L224 A225 K228 L257 Y261	T195-Y199 HydrophobicContact CG2-CD2 3.9Å; T195-Y199 HydrophobicContact CG2-CE2 3.53Å; T195-Y199 VanDerWaalsContact O-CD2 3.27Å; T195-Y199 WeakPolarHBondContact O-CD2 3.31Å; T195-Y199 PolarHBondContact O-N 3.03Å; A196-Y199 PolarHBondContact O-N 3.37Å; Y199-N201 VanDerWaalsContact C-N 3.35Å; Y199-N201 PolarHBondContact O-N 3.31Å; Y199-D202 PolarHBondContact O-N 2.92Å; Y199-S203 WeakPolarHBondContact O-CB 3.41Å; Y199-S203 PolarHBondContact O-N 2.91Å; Y199-S203 PolarHBondContact O-OG 3.09Å; Y199-L224 HydrophobicContact CD1-CD2 3.77Å; Y199-L224 HydrophobicContact CD2-CB 4.26Å; Y199-L224 HydrophobicContact CD2-CD2 4.17Å; Y199-L224 HydrophobicContact CD2-CG 4.12Å; Y199-L224 HydrophobicContact CE1-CD2 3.64Å; Y199-L224 HydrophobicContact CE1-CG 4.17Å; Y199-L224 HydrophobicContact CE2-CB 4.22Å; Y199-L224 HydrophobicContact CE2-CD2 4.04Å; Y199-L224 HydrophobicContact CE2-CG 3.72Å; Y199-L224 HydrophobicContact CG-CD2 4.06Å; Y199-A225 HydrophobicContact CD2-CB 4.06Å; Y199-A225 HydrophobicContact CE2-CB 4.25Å; Y199-K228 HydrophobicContact CE2-CD 4.23Å; Y199-K228 WeakPolarHBondContact OH-CD 3.39Å; Y199-K228 PolarHBondContact OH-NZ 3.08Å; Y199-L257 HydrophobicContact CD1-CD1 4.25Å; Y199-L257 HydrophobicContact CD1-CD2 4.46Å; Y199-L257 HydrophobicContact CG-CD1 4.32Å; Y199-Y261 AromaticContact CD1-CE2 3.58Å; Y199-Y261 HydrophobicContact CD1-CE2 3.58Å; Y199-Y261 AromaticContact CD1-CZ 3.86Å; Y199-Y261 VanDerWaalsContact CD1-OH 3.28Å; Y199-Y261 WeakPolarHBondContact CD1-OH 3.48Å; Y199-Y261 HydrophobicContact CE1-CD2 4.26Å; Y199-Y261 AromaticContact CE1-CE2 3.36Å; Y199-Y261 HydrophobicContact CE1-CE2 3.36Å; Y199-Y261 AromaticContact CE1-CZ 3.83Å
200	M	96.1	Very high	96.1	Very high	0 Å²	0	37.6 Å²	37.6	0%	0	18%	0.18	C	C	.	.	H	α-helix	trans	-68.1	-28.5	178.7	170.6	-79.7	-56.6	0	0	113.7	P173 H174 V177 A196 W197 N198 S203 C221	P173-M200 HydrophobicContact CB-CG 4.19Å; P173-M200 HydrophobicContact CG-CG 3.55Å; P173-M200 HydrophobicContact CG-SD 4.12Å; H174-M200 HydrophobicContact CB-CE 4.13Å; H174-M200 HydrophobicContact CB-SD 4.42Å; H174-M200 WeakPolarHBondContact CD2-CE 3.45Å; H174-M200 VanDerWaalsContact CD2-SD 3.57Å; H174-M200 PolarHBondContact CE1-SD 3.33Å; H174-M200 VanDerWaalsContact CG-SD 3.6Å; H174-M200 PolarHBondContact ND1-SD 3.34Å; H174-M200 PolarHBondContact NE2-SD 3.07Å; H174-M200 VanDerWaalsContact NE2-SD 3.37Å; V177-M200 HydrophobicContact CG2-CB 4.31Å; V177-M200 HydrophobicContact CG2-CG 4.19Å; A196-M200 WeakPolarHBondContact O-CB 3.35Å; A196-M200 PolarHBondContact O-N 3.45Å; W197-M200 HydrophobicContact CB-CE 4.38Å; W197-M200 HydrophobicContact CD2-CE 3.64Å; W197-M200 HydrophobicContact CE3-CE 3.81Å; W197-M200 HydrophobicContact CG-CE 3.9Å; W197-M200 HydrophobicContact CZ3-CE 4.41Å; W197-M200 PolarHBondContact O-N 2.93Å; N198-M200 VanDerWaalsContact C-N 3.31Å; N198-M200 PolarHBondContact O-N 3.3Å; M200-S203 PolarHBondContact O-OG 3.11Å; M200-C221 VanDerWaalsContact CA-SG 3.6Å; M200-C221 HydrophobicContact CB-CB 4.02Å
201	N	95.9	Very high	96	Very high	28 Å²	28	31.7 Å²	31.7	15%	0.15	15%	0.153	C	C	.	.	H	α-helix	trans	-81.5	-33.4	172.3	-71.2	-79.7	0	0	0	112.6	H174 W197 N198 Y199 L204	H174-N201 PolarHBondContact NE2-OD1 2.74Å; W197-N201 PolarHBondContact NE1-ND2 3.4Å; W197-N201 VanDerWaalsContact NE1-ND2 3.12Å; W197-N201 PolarHBondContact O-N 3.43Å; W197-N201 VanDerWaalsContact O-N 3.1Å; W197-N201 PolarHBondContact O-ND2 2.83Å; N198-N201 PolarHBondContact O-N 2.84Å; Y199-N201 VanDerWaalsContact C-N 3.35Å; Y199-N201 PolarHBondContact O-N 3.31Å; N201-L204 WeakPolarHBondContact O-CB 3.15Å
202	D	95.9	Very high	96	Very high	39 Å²	39	28.1 Å²	28.1	21%	0.209	13%	0.131	C	C	.	.	H	α-helix	trans	-70.3	-32.5	174.8	-82.3	-26	0	0	0	112	N198 Y199 L204 R205 L257 L260 Y261	N198-D202 PolarHBondContact O-N 2.95Å; Y199-D202 PolarHBondContact O-N 2.92Å; D202-L204 PolarHBondContact O-N 3.42Å; D202-R205 WeakPolarHBondContact O-CB 3.19Å; D202-R205 PolarHBondContact O-N 3.36Å; D202-R205 VanDerWaalsContact O-N 3.09Å; D202-R205 IonicContact OD1-CZ 3.69Å; D202-R205 IonicContact OD1-NE 3.94Å; D202-R205 IonicContact OD1-NH2 3.55Å; D202-R205 PolarHBondContact OD1-NH2 2.86Å; D202-L257 HydrophobicContact CB-CD2 4.38Å; D202-L260 HydrophobicContact CB-CD2 4.43Å; D202-L260 WeakPolarHBondContact O-CD2 3.41Å; D202-Y261 HydrophobicContact CB-CE1 4.45Å; D202-Y261 VanDerWaalsContact CB-OH 3.24Å; D202-Y261 WeakPolarHBondContact CB-OH 3.49Å; D202-Y261 WeakPolarHBondContact OD2-CE1 3.43Å; D202-Y261 PolarHBondContact OD2-OH 3.11Å
203	S	96.5	Very high	95.8	Very high	0 Å²	0	31.2 Å²	31.2	0%	0	15%	0.147	C	C	.	.	G	3₁₀ helix	trans	-66.3	-15.4	178.3	66	0	0	0	0	114.2	Y199 M200 R205 T206 I208	Y199-S203 WeakPolarHBondContact O-CB 3.41Å; Y199-S203 PolarHBondContact O-N 2.91Å; Y199-S203 PolarHBondContact O-OG 3.09Å; M200-S203 PolarHBondContact O-OG 3.11Å; S203-R205 PolarHBondContact O-N 3.37Å; S203-R205 VanDerWaalsContact O-N 3.15Å; S203-T206 WeakPolarHBondContact O-CA 3.45Å; S203-T206 WeakPolarHBondContact O-CB 3.31Å; S203-T206 PolarHBondContact O-N 2.95Å; S203-T206 PolarHBondContact O-OG1 3.49Å; S203-I208 VanDerWaalsContact CB-CD1 3.48Å
204	L	95.8	Very high	95.8	Very high	3 Å²	3	30 Å²	30	2%	0.016	14%	0.14	C	C	.	.	G	3₁₀ helix	trans	-61.7	-16.1	169.4	-71.1	160.5	0	0	0	113.5	C59 A77 Q80 V81 N201 D202 F209	C59-L204 PolarHBondContact SG-O 3.31Å; C59-L204 VanDerWaalsContact SG-O 3.37Å; A77-L204 HydrophobicContact CB-CD1 3.71Å; A77-L204 HydrophobicContact CB-CD2 3.85Å; A77-L204 HydrophobicContact CB-CG 4.48Å; Q80-L204 HydrophobicContact CB-CB 4.38Å; Q80-L204 VanDerWaalsContact OE1-CB 3.29Å; V81-L204 HydrophobicContact CG2-CD2 4.3Å; N201-L204 WeakPolarHBondContact O-CB 3.15Å; D202-L204 PolarHBondContact O-N 3.42Å; L204-F209 HydrophobicContact CB-CE2 4.39Å; L204-F209 HydrophobicContact CD2-CD1 4Å; L204-F209 HydrophobicContact CD2-CD2 3.95Å; L204-F209 HydrophobicContact CD2-CE1 3.57Å; L204-F209 HydrophobicContact CD2-CE2 3.54Å; L204-F209 HydrophobicContact CD2-CG 4.17Å; L204-F209 HydrophobicContact CD2-CZ 3.33Å; L204-F209 HydrophobicContact CG-CD2 4.43Å; L204-F209 HydrophobicContact CG-CE1 4.47Å; L204-F209 HydrophobicContact CG-CE2 3.73Å; L204-F209 HydrophobicContact CG-CZ 3.76Å
205	R	94.9	Very high	95.7	Very high	68 Å²	68	28.7 Å²	28.7	26%	0.257	13%	0.134	S	C	.	.	G	3₁₀ helix	trans	-84.1	-12.2	171.8	-54	-179	-140.5	-164.8	10.7	113	C59 E60 D202 S203 L260	C59-R205 HydrophobicContact CB-CB 4.2Å; C59-R205 HydrophobicContact CB-CG 4.02Å; E60-R205 IonicContact OE1-CZ 2.76Å; E60-R205 IonicContact OE1-NH1 2.85Å; E60-R205 PolarHBondContact OE1-NH1 3.3Å; D202-R205 WeakPolarHBondContact O-CB 3.19Å; D202-R205 PolarHBondContact O-N 3.36Å; D202-R205 VanDerWaalsContact O-N 3.09Å; D202-R205 IonicContact OD1-CZ 3.69Å; D202-R205 IonicContact OD1-NE 3.94Å; D202-R205 IonicContact OD1-NH2 3.55Å; D202-R205 PolarHBondContact OD1-NH2 2.86Å; S203-R205 PolarHBondContact O-N 3.37Å; S203-R205 VanDerWaalsContact O-N 3.15Å; R205-L260 HydrophobicContact CB-CD1 4.41Å; R205-L260 HydrophobicContact CB-CD2 4.36Å
206	T	95.4	Very high	95.7	Very high	14 Å²	14	28 Å²	28	9%	0.086	13%	0.13	C	C	.	.	S	Bend	trans	-95.2	-178.8	176.9	74.8	0	0	0	0	111.2	Q84 S203 I208 L260	Q84-T206 PolarHBondContact NE2-O 3.35Å; S203-T206 WeakPolarHBondContact O-CA 3.45Å; S203-T206 WeakPolarHBondContact O-CB 3.31Å; S203-T206 PolarHBondContact O-N 2.95Å; S203-T206 PolarHBondContact O-OG1 3.49Å; T206-I208 PolarHBondContact OG1-N 3.41Å; T206-L260 HydrophobicContact CG2-CB 4.04Å; T206-L260 HydrophobicContact CG2-CD2 3.83Å; T206-L260 HydrophobicContact CG2-CG 4.34Å
207	D	94.4	Very high	95.7	Very high	27 Å²	27	28 Å²	28	14%	0.144	13%	0.13	C	C	.	.	S	Bend	trans	-91.3	-2.7	178.2	67.3	-21.7	0	0	0	114	Y88 F209 V210 R211	Y88-D207 HydrophobicContact CE2-CB 3.98Å; Y88-D207 WeakPolarHBondContact OH-CB 3.44Å; Y88-D207 PolarHBondContact OH-OD2 3.28Å; D207-F209 PolarHBondContact O-N 3.49Å; D207-V210 HydrophobicContact CB-CG2 4.27Å; D207-V210 WeakPolarHBondContact O-CG2 3.32Å; D207-V210 PolarHBondContact O-N 3.48Å; D207-R211 PolarHBondContact O-N 3.49Å; D207-R211 IonicContact OD1-CZ 2.64Å; D207-R211 IonicContact OD1-NE 2.7Å; D207-R211 PolarHBondContact OD1-NE 3.49Å; D207-R211 IonicContact OD1-NH2 3.56Å; D207-R211 PolarHBondContact OD1-NH2 3.1Å; D207-R211 WeakPolarHBondContact OD2-CD 3.46Å; D207-R211 IonicContact OD2-CZ 3.37Å; D207-R211 IonicContact OD2-NE 3.75Å; D207-R211 PolarHBondContact OD2-NE 2.81Å; D207-R211 IonicContact OD2-NH2 3.85Å; D207-R211 PolarHBondContact OD2-NH2 3.08Å
208	I	95.3	Very high	95.8	Very high	0 Å²	0	24.1 Å²	24.1	0%	0	12%	0.116	C	C	.	.	H	α-helix	trans	-59.1	-28.2	-174	71.9	173.7	0	0	0	113.1	S203 T206 V210 R211 Y212 I217 I253 C256	S203-I208 VanDerWaalsContact CB-CD1 3.48Å; T206-I208 PolarHBondContact OG1-N 3.41Å; I208-V210 PolarHBondContact O-N 3.3Å; I208-R211 PolarHBondContact O-N 2.87Å; I208-R211 VanDerWaalsContact O-N 3.15Å; I208-Y212 HydrophobicContact CB-CD2 3.95Å; I208-Y212 HydrophobicContact CG2-CD2 4.26Å; I208-Y212 HydrophobicContact CG2-CE2 4.41Å; I208-Y212 PolarHBondContact O-N 2.7Å; I208-I217 HydrophobicContact CD1-CB 4.36Å; I208-I217 HydrophobicContact CD1-CD1 4.44Å; I208-I217 HydrophobicContact CD1-CG1 3.98Å; I208-I217 HydrophobicContact CD1-CG2 3.69Å; I208-I217 HydrophobicContact CG1-CD1 4.15Å; I208-I217 HydrophobicContact CG1-CG1 4.14Å; I208-I217 HydrophobicContact CG1-CG2 4.46Å; I208-I253 HydrophobicContact CB-CG1 4.45Å; I208-I253 HydrophobicContact CD1-CG1 4.48Å; I208-I253 HydrophobicContact CD1-CG2 3.7Å; I208-I253 HydrophobicContact CG2-CG1 4.26Å; I208-C256 HydrophobicContact CG2-CB 3.91Å
209	F	94.8	Very high	95.8	Very high	3 Å²	3	20.4 Å²	20.4	1%	0.013	10%	0.096	C	C	.	.	H	α-helix	trans	-69.4	-8.4	175.6	-80.6	-97.2	0	0	0	114.9	V81 P173 L204 D207 I217	V81-F209 HydrophobicContact CG2-CB 4Å; V81-F209 HydrophobicContact CG2-CD1 3.63Å; V81-F209 HydrophobicContact CG2-CE1 4.4Å; V81-F209 HydrophobicContact CG2-CG 4.04Å; P173-F209 VanDerWaalsContact CD-CE1 3.49Å; P173-F209 HydrophobicContact CG-CE1 3.97Å; P173-F209 HydrophobicContact CG-CZ 3.78Å; L204-F209 HydrophobicContact CB-CE2 4.39Å; L204-F209 HydrophobicContact CD2-CD1 4Å; L204-F209 HydrophobicContact CD2-CD2 3.95Å; L204-F209 HydrophobicContact CD2-CE1 3.57Å; L204-F209 HydrophobicContact CD2-CE2 3.54Å; L204-F209 HydrophobicContact CD2-CG 4.17Å; L204-F209 HydrophobicContact CD2-CZ 3.33Å; L204-F209 HydrophobicContact CG-CD2 4.43Å; L204-F209 HydrophobicContact CG-CE1 4.47Å; L204-F209 HydrophobicContact CG-CE2 3.73Å; L204-F209 HydrophobicContact CG-CZ 3.76Å; D207-F209 PolarHBondContact O-N 3.49Å; F209-I217 HydrophobicContact CD1-CD1 4.11Å; F209-I217 HydrophobicContact CD2-CD1 4.21Å; F209-I217 HydrophobicContact CE1-CD1 4.35Å; F209-I217 HydrophobicContact CE2-CD1 4.42Å; F209-I217 HydrophobicContact CE2-CG2 4.34Å; F209-I217 HydrophobicContact CG-CD1 4.05Å; F209-I217 HydrophobicContact CZ-CD1 4.49Å; F209-I217 HydrophobicContact CZ-CG2 4.35Å
210	V	93.6	Very high	95.8	Very high	0 Å²	0	19.6 Å²	19.6	0%	0	9%	0.093	C	C	.	.	H	α-helix	trans	-111.7	-9.6	168.8	-55.8	0	0	0	0	113.5	I30 I31 L36 Q84 R85 Y88 D207 I208	I30-V210 WeakPolarHBondContact CG2-O 3.29Å; I31-V210 HydrophobicContact CD1-CB 3.79Å; I31-V210 HydrophobicContact CD1-CG1 4.12Å; I31-V210 HydrophobicContact CD1-CG2 4.12Å; I31-V210 HydrophobicContact CG1-CB 4.02Å; I31-V210 PolarHBondContact N-O 3.14Å; L36-V210 HydrophobicContact CD2-CG2 4.5Å; Q84-V210 HydrophobicContact CB-CG1 4.08Å; R85-V210 HydrophobicContact CG-CG1 3.64Å; Y88-V210 HydrophobicContact CD2-CG2 3.67Å; Y88-V210 HydrophobicContact CE2-CG2 3.55Å; Y88-V210 HydrophobicContact CG-CG2 4.49Å; D207-V210 HydrophobicContact CB-CG2 4.27Å; D207-V210 WeakPolarHBondContact O-CG2 3.32Å; D207-V210 PolarHBondContact O-N 3.48Å; I208-V210 PolarHBondContact O-N 3.3Å
211	R	94.1	Very high	95.9	Very high	49 Å²	49	19.6 Å²	19.6	19%	0.185	9%	0.093	C	C	.	.	H	α-helix	trans	-101	-32.8	177.7	-67.7	-163.2	-77.3	138.8	-8.8	114.2	I30 L36 D207 I208	I30-R211 VanDerWaalsContact CG2-O 3.28Å; I30-R211 WeakPolarHBondContact CG2-O 3.49Å; L36-R211 HydrophobicContact CD1-CG 3.74Å; L36-R211 HydrophobicContact CD2-CG 3.97Å; D207-R211 PolarHBondContact O-N 3.49Å; D207-R211 IonicContact OD1-CZ 2.64Å; D207-R211 IonicContact OD1-NE 2.7Å; D207-R211 PolarHBondContact OD1-NE 3.49Å; D207-R211 IonicContact OD1-NH2 3.56Å; D207-R211 PolarHBondContact OD1-NH2 3.1Å; D207-R211 WeakPolarHBondContact OD2-CD 3.46Å; D207-R211 IonicContact OD2-CZ 3.37Å; D207-R211 IonicContact OD2-NE 3.75Å; D207-R211 PolarHBondContact OD2-NE 2.81Å; D207-R211 IonicContact OD2-NH2 3.85Å; D207-R211 PolarHBondContact OD2-NH2 3.08Å; I208-R211 PolarHBondContact O-N 2.87Å; I208-R211 VanDerWaalsContact O-N 3.15Å
212	Y	95.3	Very high	96	Very high	42 Å²	42	18.3 Å²	18.3	17%	0.165	9%	0.086	C	C	.	.	S	Bend	trans	-129.2	149.5	-171.1	-59.1	-79.4	0	0	0	112.4	I30 I208 E252 I253	I30-Y212 VanDerWaalsContact CD1-C 3.48Å; I30-Y212 WeakPolarHBondContact CD1-O 3.39Å; I208-Y212 HydrophobicContact CB-CD2 3.95Å; I208-Y212 HydrophobicContact CG2-CD2 4.26Å; I208-Y212 HydrophobicContact CG2-CE2 4.41Å; I208-Y212 PolarHBondContact O-N 2.7Å; Y212-E252 WeakPolarHBondContact OH-CB 3.22Å; Y212-I253 HydrophobicContact CD1-CD1 4.09Å; Y212-I253 HydrophobicContact CD2-CD1 3.79Å; Y212-I253 HydrophobicContact CD2-CG1 3.59Å; Y212-I253 HydrophobicContact CE2-CD1 4.33Å; Y212-I253 HydrophobicContact CE2-CG1 3.75Å; Y212-I253 HydrophobicContact CG-CD1 3.66Å; Y212-I253 HydrophobicContact CG-CG1 4Å
213	L	94.7	Very high	96.1	Very high	66 Å²	66	17.9 Å²	17.9	35%	0.346	8%	0.081	S	C	.	.			trans	-71.3	153.6	173.5	-68.8	173.7	0	0	0	111.3	H27 N28 I30 E215 A216 I217	H27-L213 HydrophobicContact CB-CD2 4.48Å; N28-L213 HydrophobicContact CB-CD2 4.34Å; I30-L213 HydrophobicContact CD1-CD2 4.09Å; I30-L213 HydrophobicContact CD1-CG 4.46Å; I30-L213 HydrophobicContact CG1-CD2 3.95Å; I30-L213 HydrophobicContact CG1-CG 4.29Å; L213-E215 WeakPolarHBondContact CB-OE2 3.41Å; L213-E215 PolarHBondContact O-N 3.19Å; L213-E215 VanDerWaalsContact O-N 3.1Å; L213-A216 PolarHBondContact O-N 2.92Å; L213-I217 PolarHBondContact O-N 2.93Å; L213-I217 VanDerWaalsContact O-N 3.1Å
214	P	95.5	Very high	96.1	Very high	3 Å²	3	18.6 Å²	18.6	2%	0.019	9%	0.085	C	C	.	.	H	α-helix	trans	-52	-33.4	-179.2	-30	37.6	0	0	0	114.9	N28 K171 P173 L176 I217 A218	N28-P214 VanDerWaalsContact ND2-CG 3.3Å; N28-P214 WeakPolarHBondContact ND2-CG 3.49Å; K171-P214 HydrophobicContact CB-CG 4.03Å; K171-P214 WeakPolarHBondContact O-CG 3.41Å; P173-P214 HydrophobicContact CB-CB 4.23Å; P173-P214 WeakPolarHBondContact CB-O 3.41Å; L176-P214 HydrophobicContact CD1-CB 3.74Å; P214-I217 PolarHBondContact O-N 3.38Å; P214-A218 WeakPolarHBondContact O-CB 3.21Å; P214-A218 PolarHBondContact O-N 2.76Å
215	E	95.7	Very high	96.2	Very high	61 Å²	61	18.5 Å²	18.5	29%	0.285	8%	0.084	S	C	.	.	H	α-helix	trans	-59.3	-52.3	177	-64.1	69.4	-157.9	0	0	110.4	L176 Y180 L213 I217 A218 C219 V245	L176-E215 HydrophobicContact CD1-CB 4.45Å; L176-E215 HydrophobicContact CD1-CG 3.96Å; Y180-E215 WeakPolarHBondContact OH-CB 3.36Å; Y180-E215 WeakPolarHBondContact OH-CG 3.35Å; L213-E215 WeakPolarHBondContact CB-OE2 3.41Å; L213-E215 PolarHBondContact O-N 3.19Å; L213-E215 VanDerWaalsContact O-N 3.1Å; E215-I217 PolarHBondContact O-N 2.75Å; E215-A218 PolarHBondContact O-N 3.49Å; E215-C219 PolarHBondContact O-N 3.12Å; E215-C219 VanDerWaalsContact O-N 3.08Å; E215-C219 PolarHBondContact O-SG 3.38Å; E215-V245 HydrophobicContact CB-CG2 4.47Å
216	A	97.2	Very high	96.4	Very high	9 Å²	9	15.4 Å²	15.4	7%	0.074	7%	0.074	C	C	.	.	H	α-helix	trans	-64.4	-39.4	175.6	0	0	0	0	0	112.8	L213 A218 C219 G220 V245 I253	L213-A216 PolarHBondContact O-N 2.92Å; A216-A218 PolarHBondContact O-N 2.88Å; A216-C219 PolarHBondContact O-N 2.63Å; A216-G220 PolarHBondContact O-N 2.94Å; A216-V245 HydrophobicContact CB-CG1 3.69Å; A216-V245 HydrophobicContact CB-CG2 4.16Å; A216-I253 HydrophobicContact CB-CD1 4.05Å; A216-I253 WeakPolarHBondContact O-CD1 3.39Å
217	I	97.6	Very high	96.4	Very high	0 Å²	0	17.6 Å²	17.6	0%	0	9%	0.088	C	C	.	.	H	α-helix	trans	-62.1	-43.3	176.9	-62.4	170.7	0	0	0	111.2	P173 I208 F209 L213 P214 E215 C221 I253	P173-I217 HydrophobicContact CB-CB 4.33Å; P173-I217 HydrophobicContact CB-CG2 4.18Å; P173-I217 HydrophobicContact CG-CB 4.34Å; P173-I217 HydrophobicContact CG-CG2 3.79Å; I208-I217 HydrophobicContact CD1-CB 4.36Å; I208-I217 HydrophobicContact CD1-CD1 4.44Å; I208-I217 HydrophobicContact CD1-CG1 3.98Å; I208-I217 HydrophobicContact CD1-CG2 3.69Å; I208-I217 HydrophobicContact CG1-CD1 4.15Å; I208-I217 HydrophobicContact CG1-CG1 4.14Å; I208-I217 HydrophobicContact CG1-CG2 4.46Å; F209-I217 HydrophobicContact CD1-CD1 4.11Å; F209-I217 HydrophobicContact CD2-CD1 4.21Å; F209-I217 HydrophobicContact CE1-CD1 4.35Å; F209-I217 HydrophobicContact CE2-CD1 4.42Å; F209-I217 HydrophobicContact CE2-CG2 4.34Å; F209-I217 HydrophobicContact CG-CD1 4.05Å; F209-I217 HydrophobicContact CZ-CD1 4.49Å; F209-I217 HydrophobicContact CZ-CG2 4.35Å; L213-I217 PolarHBondContact O-N 2.93Å; L213-I217 VanDerWaalsContact O-N 3.1Å; P214-I217 PolarHBondContact O-N 3.38Å; E215-I217 PolarHBondContact O-N 2.75Å; I217-C221 WeakPolarHBondContact O-CB 3.41Å; I217-C221 PolarHBondContact O-N 3.02Å; I217-C221 VanDerWaalsContact O-N 3.09Å; I217-C221 PolarHBondContact O-SG 2.85Å; I217-I253 HydrophobicContact CG1-CD1 4.33Å
218	A	97.7	Very high	96.5	Very high	0 Å²	0	22.3 Å²	22.3	0%	0	11%	0.108	C	C	.	.	H	α-helix	trans	-62.1	-43.6	175.1	0	0	0	0	0	111.3	P173 L176 V177 Y180 P214 E215 A216 C221 I222	P173-A218 HydrophobicContact CB-CB 4.2Å; L176-A218 HydrophobicContact CB-CB 3.74Å; V177-A218 HydrophobicContact CG2-CB 3.84Å; Y180-A218 HydrophobicContact CD2-CB 3.85Å; Y180-A218 HydrophobicContact CE2-CB 3.78Å; P214-A218 WeakPolarHBondContact O-CB 3.21Å; P214-A218 PolarHBondContact O-N 2.76Å; E215-A218 PolarHBondContact O-N 3.49Å; A216-A218 PolarHBondContact O-N 2.88Å; A218-C221 PolarHBondContact O-N 3.06Å; A218-I222 WeakPolarHBondContact O-CG1 3.28Å; A218-I222 PolarHBondContact O-N 2.83Å
219	C	97.8	Very high	96.6	Very high	0 Å²	0	25.2 Å²	25.2	0%	0	12%	0.123	C	C	.	.	H	α-helix	trans	-60.1	-51.2	177	-73.2	0	0	0	0	112.9	E215 A216 C221 I222 Y223 W239 W240 V245 V250	E215-C219 PolarHBondContact O-N 3.12Å; E215-C219 VanDerWaalsContact O-N 3.08Å; E215-C219 PolarHBondContact O-SG 3.38Å; A216-C219 PolarHBondContact O-N 2.63Å; C219-C221 VanDerWaalsContact C-N 3.33Å; C219-C221 PolarHBondContact O-N 3.33Å; C219-I222 PolarHBondContact O-N 3.43Å; C219-Y223 WeakPolarHBondContact O-CB 3.34Å; C219-Y223 PolarHBondContact O-N 2.88Å; C219-W239 HydrophobicContact CB-CH2 4.09Å; C219-W239 HydrophobicContact CB-CZ3 4.37Å; C219-W240 HydrophobicContact CB-CB 4.31Å; C219-V245 HydrophobicContact CB-CB 4.49Å; C219-V245 HydrophobicContact CB-CG1 4.25Å; C219-V245 HydrophobicContact CB-CG2 4.35Å; C219-V250 HydrophobicContact CB-CG2 3.95Å
220	G	98	Very high	96.6	Very high	0 Å²	0	32 Å²	32	0%	0	16%	0.159	C	C	.	.	H	α-helix	trans	-61.1	-37.1	178.1	0	0	0	0	0	113.9	A216 L224	A216-G220 PolarHBondContact O-N 2.94Å; G220-L224 WeakPolarHBondContact O-CB 3.44Å; G220-L224 PolarHBondContact O-N 3.38Å; G220-L224 VanDerWaalsContact O-N 3.07Å
221	C	98.1	Very high	96.7	Very high	0 Å²	0	33.6 Å²	33.6	0%	0	17%	0.168	C	C	.	.	H	α-helix	trans	-71.6	-36.3	177.8	-65.3	0	0	0	0	113	M200 I217 A218 C219 A225	M200-C221 VanDerWaalsContact CA-SG 3.6Å; M200-C221 HydrophobicContact CB-CB 4.02Å; I217-C221 WeakPolarHBondContact O-CB 3.41Å; I217-C221 PolarHBondContact O-N 3.02Å; I217-C221 VanDerWaalsContact O-N 3.09Å; I217-C221 PolarHBondContact O-SG 2.85Å; A218-C221 PolarHBondContact O-N 3.06Å; C219-C221 VanDerWaalsContact C-N 3.33Å; C219-C221 PolarHBondContact O-N 3.33Å; C221-A225 WeakPolarHBondContact O-CB 3.24Å; C221-A225 PolarHBondContact O-N 3.47Å
222	I	97.9	Very high	96.6	Very high	0 Å²	0	36.9 Å²	36.9	0%	0	20%	0.195	C	C	.	.	H	α-helix	trans	-68.4	-45.7	172.5	-71.2	165.5	0	0	0	110.3	V177 Y180 L181 A196 A218 C219 L224 A225 S226 L233 W239	V177-I222 HydrophobicContact CG1-CG1 4.28Å; Y180-I222 HydrophobicContact CD2-CD1 4.33Å; L181-I222 HydrophobicContact CD1-CG1 4.34Å; L181-I222 HydrophobicContact CD2-CD1 4.22Å; L181-I222 HydrophobicContact CD2-CG1 4.16Å; L181-I222 HydrophobicContact CD2-CG2 3.86Å; L181-I222 HydrophobicContact CG-CD1 3.89Å; L181-I222 HydrophobicContact CG-CG1 4.06Å; A196-I222 HydrophobicContact CB-CG1 3.96Å; A218-I222 WeakPolarHBondContact O-CG1 3.28Å; A218-I222 PolarHBondContact O-N 2.83Å; C219-I222 PolarHBondContact O-N 3.43Å; I222-L224 PolarHBondContact O-N 3.11Å; I222-A225 CarbonylContact O-C 3.51Å; I222-A225 WeakPolarHBondContact O-CA 3.22Å; I222-A225 WeakPolarHBondContact O-CB 3.32Å; I222-A225 PolarHBondContact O-N 3.37Å; I222-S226 PolarHBondContact O-N 2.92Å; I222-S226 PolarHBondContact O-OG 3.34Å; I222-L233 HydrophobicContact CG2-CD1 3.95Å; I222-W239 HydrophobicContact CB-CH2 3.73Å; I222-W239 HydrophobicContact CB-CZ2 4.19Å; I222-W239 HydrophobicContact CD1-CH2 4.37Å; I222-W239 HydrophobicContact CG2-CH2 3.52Å; I222-W239 HydrophobicContact CG2-CZ2 3.71Å; I222-W239 HydrophobicContact CG2-CZ3 4.36Å
223	Y	97.8	Very high	96.5	Very high	31 Å²	31	35.9 Å²	35.9	12%	0.122	19%	0.193	C	C	.	.	H	α-helix	trans	-56.2	-50.6	179.1	178.1	-120.7	0	0	0	112.2	C219 A225 S226 C227 W240 V250 H251 A254	C219-Y223 WeakPolarHBondContact O-CB 3.34Å; C219-Y223 PolarHBondContact O-N 2.88Å; Y223-A225 VanDerWaalsContact C-N 3.25Å; Y223-A225 PolarHBondContact O-N 2.79Å; Y223-S226 WeakPolarHBondContact CA-OG 3.49Å; Y223-S226 PolarHBondContact O-N 3.49Å; Y223-S226 PolarHBondContact O-OG 3.02Å; Y223-C227 PolarHBondContact O-N 3.38Å; Y223-C227 PolarHBondContact O-SG 3.11Å; Y223-C227 VanDerWaalsContact O-SG 3.36Å; Y223-W240 AromaticContact CD2-CZ3 3.88Å; Y223-W240 HydrophobicContact CD2-CZ3 3.88Å; Y223-W240 HydrophobicContact CE2-CH2 4.37Å; Y223-W240 AromaticContact CE2-CZ3 3.96Å; Y223-W240 HydrophobicContact CE2-CZ3 3.96Å; Y223-V250 HydrophobicContact CD1-CG1 3.46Å; Y223-V250 VanDerWaalsContact CD1-CG1 3.46Å; Y223-V250 HydrophobicContact CD2-CG1 4.3Å; Y223-V250 HydrophobicContact CE1-CG1 4.18Å; Y223-V250 HydrophobicContact CG-CG1 3.51Å; Y223-H251 AromaticContact CE1-CD2 3.77Å; Y223-H251 AromaticContact CE1-NE2 3.49Å; Y223-H251 WeakPolarHBondContact CE1-NE2 3.32Å; Y223-H251 AromaticContact CZ-CE1 3.93Å; Y223-H251 AromaticContact CZ-NE2 3.47Å; Y223-H251 PolarHBondContact OH-CE1 3.23Å; Y223-H251 PolarHBondContact OH-NE2 3.48Å; Y223-A254 HydrophobicContact CD1-CB 4.17Å
224	L	97.6	Very high	96.4	Very high	15 Å²	15	36.3 Å²	36.3	8%	0.079	20%	0.199	C	C	.	.	H	α-helix	trans	-61.9	-33.5	176.9	-174.1	61.8	0	0	0	112.2	Y199 G220 I222 K228 A254 L257 L258	Y199-L224 HydrophobicContact CD1-CD2 3.77Å; Y199-L224 HydrophobicContact CD2-CB 4.26Å; Y199-L224 HydrophobicContact CD2-CD2 4.17Å; Y199-L224 HydrophobicContact CD2-CG 4.12Å; Y199-L224 HydrophobicContact CE1-CD2 3.64Å; Y199-L224 HydrophobicContact CE1-CG 4.17Å; Y199-L224 HydrophobicContact CE2-CB 4.22Å; Y199-L224 HydrophobicContact CE2-CD2 4.04Å; Y199-L224 HydrophobicContact CE2-CG 3.72Å; Y199-L224 HydrophobicContact CG-CD2 4.06Å; G220-L224 WeakPolarHBondContact O-CB 3.44Å; G220-L224 PolarHBondContact O-N 3.38Å; G220-L224 VanDerWaalsContact O-N 3.07Å; I222-L224 PolarHBondContact O-N 3.11Å; L224-K228 WeakPolarHBondContact O-CB 3.47Å; L224-K228 PolarHBondContact O-N 3.45Å; L224-K228 VanDerWaalsContact O-N 3.11Å; L224-A254 HydrophobicContact CB-CB 4.2Å; L224-A254 HydrophobicContact CD1-CB 4.38Å; L224-L257 HydrophobicContact CD2-CB 3.67Å; L224-L257 HydrophobicContact CD2-CD1 3.89Å; L224-L257 HydrophobicContact CD2-CG 4.42Å; L224-L258 HydrophobicContact CD1-CD1 4.1Å; L224-L258 HydrophobicContact CD1-CD2 4.12Å; L224-L258 HydrophobicContact CD1-CG 4.02Å
225	A	98.1	Very high	96.2	Very high	0 Å²	0	43.4 Å²	43.4	0%	0	23%	0.226	C	C	.	.	H	α-helix	trans	-70.6	-43.3	174.9	0	0	0	0	0	113	L192 T195 A196 Y199 C221 I222 Y223 K228 L229	L192-A225 HydrophobicContact CD1-CB 3.6Å; T195-A225 HydrophobicContact CG2-CB 3.71Å; A196-A225 HydrophobicContact CB-CB 3.86Å; Y199-A225 HydrophobicContact CD2-CB 4.06Å; Y199-A225 HydrophobicContact CE2-CB 4.25Å; C221-A225 WeakPolarHBondContact O-CB 3.24Å; C221-A225 PolarHBondContact O-N 3.47Å; I222-A225 CarbonylContact O-C 3.51Å; I222-A225 WeakPolarHBondContact O-CA 3.22Å; I222-A225 WeakPolarHBondContact O-CB 3.32Å; I222-A225 PolarHBondContact O-N 3.37Å; Y223-A225 VanDerWaalsContact C-N 3.25Å; Y223-A225 PolarHBondContact O-N 2.79Å; A225-K228 PolarHBondContact O-N 3.07Å; A225-L229 WeakPolarHBondContact O-CB 3.42Å; A225-L229 WeakPolarHBondContact O-CG 3.39Å; A225-L229 PolarHBondContact O-N 3.28Å
226	S	97.2	Very high	95.8	Very high	4 Å²	4	49.2 Å²	49.2	3%	0.028	25%	0.253	C	S	.	.	H	α-helix	trans	-63.7	-43.8	175.8	47.6	0	0	0	0	111.9	I222 Y223 L229 N230 I231 L233	I222-S226 PolarHBondContact O-N 2.92Å; I222-S226 PolarHBondContact O-OG 3.34Å; Y223-S226 WeakPolarHBondContact CA-OG 3.49Å; Y223-S226 PolarHBondContact O-N 3.49Å; Y223-S226 PolarHBondContact O-OG 3.02Å; S226-L229 CarbonylContact O-C 3.56Å; S226-L229 PolarHBondContact O-N 3.03Å; S226-N230 PolarHBondContact O-N 3.44Å; S226-I231 WeakPolarHBondContact CB-O 3.34Å; S226-I231 PolarHBondContact O-N 3.29Å; S226-L233 VanDerWaalsContact OG-CD1 3.29Å; S226-L233 WeakPolarHBondContact OG-CD1 3.34Å
227	C	96.5	Very high	95.4	Very high	59 Å²	59	53.7 Å²	53.7	40%	0.399	28%	0.281	S	S	.	.	H	α-helix	trans	-61	-47.3	176.3	-70	0	0	0	0	111.7	Y223 L229 N230	Y223-C227 PolarHBondContact O-N 3.38Å; Y223-C227 PolarHBondContact O-SG 3.11Å; Y223-C227 VanDerWaalsContact O-SG 3.36Å; C227-L229 VanDerWaalsContact C-N 3.29Å; C227-L229 PolarHBondContact O-N 2.94Å; C227-N230 PolarHBondContact O-N 3.48Å
228	K	96.5	Very high	95.2	Very high	126 Å²	126	54.1 Å²	54.1	55%	0.548	29%	0.285	S	S	.	.	H	α-helix	trans	-61.8	-34.2	177.4	171.6	167.5	170.2	-177.7	0	113.8	T195 Y199 L224 A225	T195-K228 HydrophobicContact CG2-CD 4.29Å; Y199-K228 HydrophobicContact CE2-CD 4.23Å; Y199-K228 WeakPolarHBondContact OH-CD 3.39Å; Y199-K228 PolarHBondContact OH-NZ 3.08Å; L224-K228 WeakPolarHBondContact O-CB 3.47Å; L224-K228 PolarHBondContact O-N 3.45Å; L224-K228 VanDerWaalsContact O-N 3.11Å; A225-K228 PolarHBondContact O-N 3.07Å
229	L	96.7	Very high	95.1	Very high	61 Å²	61	54.6 Å²	54.6	32%	0.319	29%	0.286	S	S	.	.	H	α-helix	trans	-91	-2.7	-179.1	-64.4	174.8	0	0	0	113.1	N191 L192 A225 S226 C227 I231	N191-L229 HydrophobicContact CB-CD1 4.44Å; L192-L229 HydrophobicContact CB-CD1 4.02Å; L192-L229 HydrophobicContact CD1-CD1 4.18Å; A225-L229 WeakPolarHBondContact O-CB 3.42Å; A225-L229 WeakPolarHBondContact O-CG 3.39Å; A225-L229 PolarHBondContact O-N 3.28Å; S226-L229 CarbonylContact O-C 3.56Å; S226-L229 PolarHBondContact O-N 3.03Å; C227-L229 VanDerWaalsContact C-N 3.29Å; C227-L229 PolarHBondContact O-N 2.94Å; L229-I231 VanDerWaalsContact C-N 3.26Å; L229-I231 HydrophobicContact CB-CD1 3.63Å; L229-I231 HydrophobicContact CB-CG1 3.85Å; L229-I231 HydrophobicContact CD1-CD1 3.91Å; L229-I231 HydrophobicContact CG-CD1 4.44Å; L229-I231 PolarHBondContact O-N 3.47Å
230	N	95.6	Very high	95	Very high	145 Å²	145	54.9 Å²	54.9	78%	0.775	29%	0.287	S	S	*	.	T	Hydrogen-bonded Turn	trans	55.3	39.7	-173.3	-55	-89.7	0	0	0	112.6	S226 C227	S226-N230 PolarHBondContact O-N 3.44Å; C227-N230 PolarHBondContact O-N 3.48Å
231	I	95.2	Very high	94.8	Very high	34 Å²	34	60 Å²	60	17%	0.174	31%	0.311	C	S	.	.			trans	-93.5	119.4	175.6	-62.5	167	0	0	0	107.6	N189 L192 S226 L229 L233	N189-I231 VanDerWaalsContact ND2-CD1 3.31Å; N189-I231 WeakPolarHBondContact ND2-CD1 3.37Å; L192-I231 HydrophobicContact CB-CD1 3.88Å; L192-I231 HydrophobicContact CD1-CD1 4.25Å; L192-I231 HydrophobicContact CD2-CD1 3.92Å; L192-I231 HydrophobicContact CD2-CG2 4.44Å; L192-I231 HydrophobicContact CG-CD1 4.23Å; S226-I231 WeakPolarHBondContact CB-O 3.34Å; S226-I231 PolarHBondContact O-N 3.29Å; L229-I231 VanDerWaalsContact C-N 3.26Å; L229-I231 HydrophobicContact CB-CD1 3.63Å; L229-I231 HydrophobicContact CB-CG1 3.85Å; L229-I231 HydrophobicContact CD1-CD1 3.91Å; L229-I231 HydrophobicContact CG-CD1 4.44Å; L229-I231 PolarHBondContact O-N 3.47Å; I231-L233 HydrophobicContact CG2-CD2 4.24Å
232	P	92.9	Very high	94.6	Very high	118 Å²	118	66 Å²	66	77%	0.766	34%	0.341	S	S	*	.			trans	-71.7	131.9	173.5	29.9	-32.8	0	0	0	110.1
233	L	92.9	Very high	94.4	Very high	21 Å²	21	67.7 Å²	67.7	11%	0.11	35%	0.348	C	S	.	.			trans	-113.9	158	169.5	-58.9	-177.2	0	0	0	109.4	H186 I222 S226 I231 R235 W239	H186-L233 WeakPolarHBondContact CD2-CD2 3.43Å; H186-L233 WeakPolarHBondContact NE2-CD2 3.44Å; I222-L233 HydrophobicContact CG2-CD1 3.95Å; S226-L233 VanDerWaalsContact OG-CD1 3.29Å; S226-L233 WeakPolarHBondContact OG-CD1 3.34Å; I231-L233 HydrophobicContact CG2-CD2 4.24Å; L233-R235 PolarHBondContact O-N 3.49Å; L233-W239 VanDerWaalsContact CB-CD1 3.43Å; L233-W239 HydrophobicContact CB-CG 4.2Å; L233-W239 HydrophobicContact CD1-CD2 4.3Å; L233-W239 HydrophobicContact CD1-CZ2 3.83Å
234	P	92.5	Very high	94.2	Very high	75 Å²	75	71.9 Å²	71.9	49%	0.487	38%	0.382	S	S	.	.			trans	-57.5	132.2	-178.2	-24.5	33.6	0	0	0	113.3	W239	P234-W239 HydrophobicContact CB-CB 4.17Å; P234-W239 HydrophobicContact CG-CB 4.38Å; P234-W239 VanDerWaalsContact O-CD1 3.27Å; P234-W239 PolarHBondContact O-N 3.1Å
235	R	90.1	Very high	94.1	Very high	153 Å²	153	71.7 Å²	71.7	58%	0.577	38%	0.382	S	S	*	.	B	Isolated β-bridge	trans	-116.6	-14.5	-178.3	-76.9	-175.8	170.1	-168.4	-7.6	114.8	L233 P237 A238	L233-R235 PolarHBondContact O-N 3.49Å; R235-P237 CarbonylContact C-O 3.41Å; R235-P237 CarbonylContact O-C 3.58Å; R235-A238 PolarHBondContact O-N 3.34Å
236	H	88.2	Confident	94	Very high	183 Å²	183	74.2 Å²	74.2	85%	0.847	40%	0.399	S	S	*	.	T	Hydrogen-bonded Turn	trans	-138.4	97.5	179.8	-53.6	-59.2	0	0	0	109.9
237	P	88.3	Confident	93.9	Very high	102 Å²	102	79.1 Å²	79.1	66%	0.662	42%	0.422	S	S	*	.	T	Hydrogen-bonded Turn	cis	-61.2	161.8	-12.3	29.7	-36.2	0	0	0	112.1	R235 E241	R235-P237 CarbonylContact C-O 3.41Å; R235-P237 CarbonylContact O-C 3.58Å; P237-E241 VanDerWaalsContact CB-OE2 3.29Å; P237-E241 WeakPolarHBondContact CB-OE2 3.43Å
238	A	93.5	Very high	94	Very high	10 Å²	10	83.8 Å²	83.8	8%	0.083	44%	0.437	C	S	.	.	B	Isolated β-bridge	trans	-77.1	128.4	-178.3	0	0	0	0	0	110.1	R235 W240 E241	R235-A238 PolarHBondContact O-N 3.34Å; A238-W240 HydrophobicContact CB-CD2 4.13Å; A238-W240 HydrophobicContact CB-CH2 4.32Å; A238-W240 HydrophobicContact CB-CZ2 3.62Å; A238-W240 PolarHBondContact O-N 3.37Å; A238-E241 HydrophobicContact CB-CG 4.1Å; A238-E241 PolarHBondContact N-OE2 3.29Å; A238-E241 WeakPolarHBondContact O-CB 3.25Å; A238-E241 WeakPolarHBondContact O-CG 3.38Å; A238-E241 PolarHBondContact O-N 2.89Å
239	W	95.3	Very high	94	Very high	9 Å²	9	78.9 Å²	78.9	3%	0.034	42%	0.419	C	S	.	.	T	Hydrogen-bonded Turn	trans	-59.2	-23.6	-165.1	70.9	-93.9	0	0	0	115.1	L184 C219 I222 L233 P234 E241 M242 F243	L184-W239 HydrophobicContact CD1-CD2 4.02Å; L184-W239 HydrophobicContact CD1-CE3 3.63Å; L184-W239 HydrophobicContact CD1-CZ3 3.93Å; L184-W239 HydrophobicContact CD2-CB 3.87Å; L184-W239 HydrophobicContact CD2-CD2 4.46Å; L184-W239 HydrophobicContact CD2-CE3 4.3Å; L184-W239 HydrophobicContact CD2-CG 4.33Å; C219-W239 HydrophobicContact CB-CH2 4.09Å; C219-W239 HydrophobicContact CB-CZ3 4.37Å; I222-W239 HydrophobicContact CB-CH2 3.73Å; I222-W239 HydrophobicContact CB-CZ2 4.19Å; I222-W239 HydrophobicContact CD1-CH2 4.37Å; I222-W239 HydrophobicContact CG2-CH2 3.52Å; I222-W239 HydrophobicContact CG2-CZ2 3.71Å; I222-W239 HydrophobicContact CG2-CZ3 4.36Å; L233-W239 VanDerWaalsContact CB-CD1 3.43Å; L233-W239 HydrophobicContact CB-CG 4.2Å; L233-W239 HydrophobicContact CD1-CD2 4.3Å; L233-W239 HydrophobicContact CD1-CZ2 3.83Å; P234-W239 HydrophobicContact CB-CB 4.17Å; P234-W239 HydrophobicContact CG-CB 4.38Å; P234-W239 VanDerWaalsContact O-CD1 3.27Å; P234-W239 PolarHBondContact O-N 3.1Å; W239-E241 VanDerWaalsContact C-N 3.33Å; W239-M242 WeakPolarHBondContact O-CB 3.44Å; W239-F243 HydrophobicContact CE3-CD2 4.1Å; W239-F243 AromaticContact CE3-CE2 3.83Å; W239-F243 HydrophobicContact CE3-CE2 3.83Å; W239-F243 HydrophobicContact CZ3-CD2 4.02Å; W239-F243 AromaticContact CZ3-CE2 3.89Å; W239-F243 HydrophobicContact CZ3-CE2 3.89Å
240	W	95.9	Very high	94	Very high	7 Å²	7	76 Å²	76	3%	0.027	40%	0.404	C	S	.	.	T	Hydrogen-bonded Turn	trans	-73.7	-21.2	175.9	50.7	72.8	0	0	0	113.8	C219 Y223 A238 M242 F243 S244 V245 E247 V250	C219-W240 HydrophobicContact CB-CB 4.31Å; Y223-W240 AromaticContact CD2-CZ3 3.88Å; Y223-W240 HydrophobicContact CD2-CZ3 3.88Å; Y223-W240 HydrophobicContact CE2-CH2 4.37Å; Y223-W240 AromaticContact CE2-CZ3 3.96Å; Y223-W240 HydrophobicContact CE2-CZ3 3.96Å; A238-W240 HydrophobicContact CB-CD2 4.13Å; A238-W240 HydrophobicContact CB-CH2 4.32Å; A238-W240 HydrophobicContact CB-CZ2 3.62Å; A238-W240 PolarHBondContact O-N 3.37Å; W240-M242 VanDerWaalsContact C-N 3.26Å; W240-M242 PolarHBondContact O-N 2.91Å; W240-F243 PolarHBondContact O-N 3.03Å; W240-S244 PolarHBondContact O-N 2.93Å; W240-V245 HydrophobicContact CB-CB 4.42Å; W240-V245 PolarHBondContact O-N 3.15Å; W240-E247 HydrophobicContact CZ2-CB 4.04Å; W240-E247 HydrophobicContact CZ2-CG 3.74Å; W240-V250 HydrophobicContact CB-CG2 3.9Å; W240-V250 HydrophobicContact CD2-CG1 4.5Å; W240-V250 HydrophobicContact CD2-CG2 4.09Å; W240-V250 HydrophobicContact CE3-CG1 4.14Å; W240-V250 HydrophobicContact CE3-CG2 4.44Å; W240-V250 HydrophobicContact CG-CG2 3.85Å; W240-V250 HydrophobicContact CZ3-CG1 4.44Å
241	E	94.5	Very high	94.1	Very high	106 Å²	106	72 Å²	72	50%	0.495	38%	0.38	S	S	.	.	G	3₁₀ helix	trans	-64.5	-33	176	-60.8	169.1	160.5	0	0	110.9	P237 A238 W239 F243 S244	P237-E241 VanDerWaalsContact CB-OE2 3.29Å; P237-E241 WeakPolarHBondContact CB-OE2 3.43Å; A238-E241 HydrophobicContact CB-CG 4.1Å; A238-E241 PolarHBondContact N-OE2 3.29Å; A238-E241 WeakPolarHBondContact O-CB 3.25Å; A238-E241 WeakPolarHBondContact O-CG 3.38Å; A238-E241 PolarHBondContact O-N 2.89Å; W239-E241 VanDerWaalsContact C-N 3.33Å; E241-F243 PolarHBondContact O-N 3.1Å; E241-F243 VanDerWaalsContact O-N 3.11Å; E241-S244 PolarHBondContact O-N 3.33Å
242	M	92.8	Very high	94.2	Very high	128 Å²	128	73 Å²	73	63%	0.631	39%	0.385	S	S	*	.	G	3₁₀ helix	trans	-55.9	-27	172.1	-170.4	-174.2	-66.7	0	0	112.7	W239 W240	W239-M242 WeakPolarHBondContact O-CB 3.44Å; W240-M242 VanDerWaalsContact C-N 3.26Å; W240-M242 PolarHBondContact O-N 2.91Å
243	F	94	Very high	94.4	Very high	35 Å²	35	67.4 Å²	67.4	15%	0.154	35%	0.348	C	S	.	.	G	3₁₀ helix	trans	-103.6	12.6	179.1	-52.8	-54	0	0	0	113.1	Y180 A183 W239 W240 E241 V245	Y180-F243 AromaticContact CD1-CD1 3.68Å; Y180-F243 HydrophobicContact CD1-CD1 3.68Å; Y180-F243 HydrophobicContact CD1-CD2 4.13Å; Y180-F243 AromaticContact CD1-CE1 3.44Å; Y180-F243 HydrophobicContact CD1-CE1 3.44Å; Y180-F243 VanDerWaalsContact CD1-CE1 3.44Å; Y180-F243 AromaticContact CD1-CE2 3.91Å; Y180-F243 HydrophobicContact CD1-CE2 3.91Å; Y180-F243 HydrophobicContact CD1-CG 4.03Å; Y180-F243 AromaticContact CD1-CZ 3.57Å; Y180-F243 HydrophobicContact CD1-CZ 3.57Å; Y180-F243 AromaticContact CD2-CD2 3.81Å; Y180-F243 HydrophobicContact CD2-CD2 3.81Å; Y180-F243 AromaticContact CD2-CE2 3.98Å; Y180-F243 HydrophobicContact CD2-CE2 3.98Å; Y180-F243 HydrophobicContact CD2-CG 4.16Å; Y180-F243 HydrophobicContact CD2-CZ 4.48Å; Y180-F243 HydrophobicContact CE1-CB 4.39Å; Y180-F243 AromaticContact CE1-CD1 3.39Å; Y180-F243 HydrophobicContact CE1-CD1 3.39Å; Y180-F243 HydrophobicContact CE1-CD2 4.27Å; Y180-F243 AromaticContact CE1-CE1 3.65Å; Y180-F243 HydrophobicContact CE1-CE1 3.65Å; Y180-F243 HydrophobicContact CE1-CE2 4.46Å; Y180-F243 AromaticContact CE1-CG 3.75Å; Y180-F243 HydrophobicContact CE1-CG 3.75Å; Y180-F243 HydrophobicContact CE1-CZ 4.19Å; Y180-F243 HydrophobicContact CE2-CB 4.12Å; Y180-F243 HydrophobicContact CE2-CD1 4.39Å; Y180-F243 AromaticContact CE2-CD2 3.95Å; Y180-F243 HydrophobicContact CE2-CD2 3.95Å; Y180-F243 AromaticContact CE2-CG 3.87Å; Y180-F243 HydrophobicContact CE2-CG 3.87Å; Y180-F243 HydrophobicContact CG-CD1 4.3Å; Y180-F243 AromaticContact CG-CD2 3.91Å; Y180-F243 HydrophobicContact CG-CD2 3.91Å; Y180-F243 HydrophobicContact CG-CE1 4.08Å; Y180-F243 AromaticContact CG-CE2 3.64Å; Y180-F243 HydrophobicContact CG-CE2 3.64Å; Y180-F243 HydrophobicContact CG-CG 4.24Å; Y180-F243 AromaticContact CG-CZ 3.74Å; Y180-F243 HydrophobicContact CG-CZ 3.74Å; Y180-F243 AromaticContact CZ-CD1 3.78Å; Y180-F243 AromaticContact CZ-CG 3.65Å; A183-F243 HydrophobicContact CB-CE1 4.48Å; A183-F243 HydrophobicContact CB-CZ 4.06Å; W239-F243 HydrophobicContact CE3-CD2 4.1Å; W239-F243 AromaticContact CE3-CE2 3.83Å; W239-F243 HydrophobicContact CE3-CE2 3.83Å; W239-F243 HydrophobicContact CZ3-CD2 4.02Å; W239-F243 AromaticContact CZ3-CE2 3.89Å; W239-F243 HydrophobicContact CZ3-CE2 3.89Å; W240-F243 PolarHBondContact O-N 3.03Å; E241-F243 PolarHBondContact O-N 3.1Å; E241-F243 VanDerWaalsContact O-N 3.11Å; F243-V245 VanDerWaalsContact C-N 3.34Å; F243-V245 HydrophobicContact CB-CG2 4.32Å; F243-V245 PolarHBondContact O-N 3.18Å
244	S	93.6	Very high	94.6	Very high	118 Å²	118	66.8 Å²	66.8	83%	0.825	35%	0.346	S	S	*	.	T	Hydrogen-bonded Turn	trans	58.6	37.9	-179.3	-54.9	0	0	0	0	114.2	W240 E241	W240-S244 PolarHBondContact O-N 2.93Å; E241-S244 PolarHBondContact O-N 3.33Å
245	V	95.8	Very high	94.9	Very high	12 Å²	12	66.7 Å²	66.7	7%	0.073	34%	0.341	C	S	.	.			trans	-109.5	136.1	179	-178	0	0	0	0	110.4	E215 A216 C219 W240 F243 V250	E215-V245 HydrophobicContact CB-CG2 4.47Å; A216-V245 HydrophobicContact CB-CG1 3.69Å; A216-V245 HydrophobicContact CB-CG2 4.16Å; C219-V245 HydrophobicContact CB-CB 4.49Å; C219-V245 HydrophobicContact CB-CG1 4.25Å; C219-V245 HydrophobicContact CB-CG2 4.35Å; W240-V245 HydrophobicContact CB-CB 4.42Å; W240-V245 PolarHBondContact O-N 3.15Å; F243-V245 VanDerWaalsContact C-N 3.34Å; F243-V245 HydrophobicContact CB-CG2 4.32Å; F243-V245 PolarHBondContact O-N 3.18Å; V245-V250 HydrophobicContact CG1-CG2 3.73Å
246	S	96	Very high	95.2	Very high	53 Å²	53	60 Å²	60	37%	0.371	32%	0.317	S	S	.	.			trans	-75.2	146.9	175	69.8	0	0	0	0	112.6	E248 S249 V250	S246-E248 PolarHBondContact O-N 3.48Å; S246-S249 WeakPolarHBondContact O-CB 3.35Å; S246-S249 PolarHBondContact O-N 2.94Å; S246-S249 VanDerWaalsContact O-N 3.1Å; S246-S249 PolarHBondContact OG-N 3.45Å; S246-S249 PolarHBondContact OG-OG 2.8Å; S246-V250 PolarHBondContact O-N 2.66Å
247	E	96	Very high	95.6	Very high	106 Å²	106	51.3 Å²	51.3	50%	0.495	28%	0.277	S	S	.	.	H	α-helix	trans	-58	-35.9	176	178.3	165.8	-152	0	0	112.2	W240 S249 V250 H251	W240-E247 HydrophobicContact CZ2-CB 4.04Å; W240-E247 HydrophobicContact CZ2-CG 3.74Å; E247-S249 PolarHBondContact O-N 3.39Å; E247-V250 PolarHBondContact O-N 3.24Å; E247-H251 VanDerWaalsContact CG-ND1 3.32Å; E247-H251 WeakPolarHBondContact CG-ND1 3.21Å; E247-H251 PolarHBondContact O-N 2.99Å; E247-H251 PolarHBondContact O-ND1 3.41Å; E247-H251 IonicContact OE1-CE1 3.85Å; E247-H251 PolarHBondContact OE1-CE1 3.39Å; E247-H251 VanDerWaalsContact OE1-CE1 3.31Å; E247-H251 IonicContact OE1-ND1 3.66Å
248	E	96.7	Very high	96	Very high	157 Å²	157	50.5 Å²	50.5	73%	0.734	27%	0.267	S	S	*	.	H	α-helix	trans	-58.7	-45.5	174.8	-59.8	172.5	151.7	0	0	111.7	S246 V250 H251 E252	S246-E248 PolarHBondContact O-N 3.48Å; E248-V250 PolarHBondContact O-N 2.98Å; E248-H251 PolarHBondContact O-N 3.27Å; E248-E252 PolarHBondContact O-N 3.01Å
249	S	96.7	Very high	96.2	Very high	23 Å²	23	56.1 Å²	56.1	16%	0.161	29%	0.286	C	S	.	.	H	α-helix	trans	-63.1	-42.5	177.5	-60.6	0	0	0	0	111.4	S246 E247 H251 I253	S246-S249 WeakPolarHBondContact O-CB 3.35Å; S246-S249 PolarHBondContact O-N 2.94Å; S246-S249 VanDerWaalsContact O-N 3.1Å; S246-S249 PolarHBondContact OG-N 3.45Å; S246-S249 PolarHBondContact OG-OG 2.8Å; E247-S249 PolarHBondContact O-N 3.39Å; S249-H251 VanDerWaalsContact C-N 3.34Å; S249-H251 PolarHBondContact O-N 3.29Å; S249-I253 VanDerWaalsContact O-CB 3.31Å; S249-I253 WeakPolarHBondContact O-CB 3.11Å; S249-I253 VanDerWaalsContact O-CD1 3.28Å; S249-I253 WeakPolarHBondContact O-CD1 3.28Å; S249-I253 WeakPolarHBondContact O-CG1 3.42Å; S249-I253 PolarHBondContact O-N 3.37Å; S249-I253 VanDerWaalsContact O-N 3.08Å
250	V	97.5	Very high	96.2	Very high	0 Å²	0	57 Å²	57	0%	0	29%	0.291	C	S	.	.	H	α-helix	trans	-61.1	-43.6	176.9	175.1	0	0	0	0	110.9	C219 Y223 W240 V245 S246 E247 E248 A254	C219-V250 HydrophobicContact CB-CG2 3.95Å; Y223-V250 HydrophobicContact CD1-CG1 3.46Å; Y223-V250 VanDerWaalsContact CD1-CG1 3.46Å; Y223-V250 HydrophobicContact CD2-CG1 4.3Å; Y223-V250 HydrophobicContact CE1-CG1 4.18Å; Y223-V250 HydrophobicContact CG-CG1 3.51Å; W240-V250 HydrophobicContact CB-CG2 3.9Å; W240-V250 HydrophobicContact CD2-CG1 4.5Å; W240-V250 HydrophobicContact CD2-CG2 4.09Å; W240-V250 HydrophobicContact CE3-CG1 4.14Å; W240-V250 HydrophobicContact CE3-CG2 4.44Å; W240-V250 HydrophobicContact CG-CG2 3.85Å; W240-V250 HydrophobicContact CZ3-CG1 4.44Å; V245-V250 HydrophobicContact CG1-CG2 3.73Å; S246-V250 PolarHBondContact O-N 2.66Å; E247-V250 PolarHBondContact O-N 3.24Å; E248-V250 PolarHBondContact O-N 2.98Å; V250-A254 WeakPolarHBondContact O-CB 3.31Å; V250-A254 PolarHBondContact O-N 3.3Å
251	H	97.1	Very high	96.2	Very high	61 Å²	61	60 Å²	60	28%	0.282	30%	0.303	S	S	.	.	H	α-helix	trans	-71.4	-46.7	179.6	-78.2	92.6	0	0	0	113.3	Y223 E247 E248 S249 I253 A254 L255	Y223-H251 AromaticContact CE1-CD2 3.77Å; Y223-H251 AromaticContact CE1-NE2 3.49Å; Y223-H251 WeakPolarHBondContact CE1-NE2 3.32Å; Y223-H251 AromaticContact CZ-CE1 3.93Å; Y223-H251 AromaticContact CZ-NE2 3.47Å; Y223-H251 PolarHBondContact OH-CE1 3.23Å; Y223-H251 PolarHBondContact OH-NE2 3.48Å; E247-H251 VanDerWaalsContact CG-ND1 3.32Å; E247-H251 WeakPolarHBondContact CG-ND1 3.21Å; E247-H251 PolarHBondContact O-N 2.99Å; E247-H251 PolarHBondContact O-ND1 3.41Å; E247-H251 IonicContact OE1-CE1 3.85Å; E247-H251 PolarHBondContact OE1-CE1 3.39Å; E247-H251 VanDerWaalsContact OE1-CE1 3.31Å; E247-H251 IonicContact OE1-ND1 3.66Å; E248-H251 PolarHBondContact O-N 3.27Å; S249-H251 VanDerWaalsContact C-N 3.34Å; S249-H251 PolarHBondContact O-N 3.29Å; H251-I253 VanDerWaalsContact C-N 3.32Å; H251-I253 PolarHBondContact O-N 2.66Å; H251-A254 PolarHBondContact O-N 3.09Å; H251-L255 WeakPolarHBondContact O-CB 3.43Å; H251-L255 VanDerWaalsContact O-CG 3.32Å; H251-L255 WeakPolarHBondContact O-CG 3.42Å; H251-L255 PolarHBondContact O-N 2.94Å
252	E	97.1	Very high	96.3	Very high	57 Å²	57	58.6 Å²	58.6	27%	0.266	31%	0.31	S	S	.	.	H	α-helix	trans	-67.2	-31.8	179.4	-97	-62.9	123.9	0	0	112.8	Y212 E248 L255 C256 R259	Y212-E252 WeakPolarHBondContact OH-CB 3.22Å; E248-E252 PolarHBondContact O-N 3.01Å; E252-L255 PolarHBondContact O-N 3.11Å; E252-L255 WeakPolarHBondContact OE1-CD1 3.49Å; E252-C256 WeakPolarHBondContact O-CB 3.44Å; E252-C256 PolarHBondContact O-N 3.09Å; E252-R259 IonicContact OE1-CZ 2.98Å; E252-R259 IonicContact OE1-NH1 3.94Å; E252-R259 PolarHBondContact OE1-NH1 3.19Å; E252-R259 IonicContact OE1-NH2 2.7Å; E252-R259 PolarHBondContact OE1-NH2 3.02Å; E252-R259 IonicContact OE2-CZ 3.43Å; E252-R259 IonicContact OE2-NH1 3.65Å; E252-R259 PolarHBondContact OE2-NH1 2.97Å; E252-R259 IonicContact OE2-NH2 2.82Å
253	I	97.9	Very high	96.4	Very high	0 Å²	0	54.7 Å²	54.7	0%	0	29%	0.288	C	S	.	.	H	α-helix	trans	-66.4	-43.2	172	-70.1	167.1	0	0	0	111	I208 Y212 A216 I217 S249 H251 C256 L257	I208-I253 HydrophobicContact CB-CG1 4.45Å; I208-I253 HydrophobicContact CD1-CG1 4.48Å; I208-I253 HydrophobicContact CD1-CG2 3.7Å; I208-I253 HydrophobicContact CG2-CG1 4.26Å; Y212-I253 HydrophobicContact CD1-CD1 4.09Å; Y212-I253 HydrophobicContact CD2-CD1 3.79Å; Y212-I253 HydrophobicContact CD2-CG1 3.59Å; Y212-I253 HydrophobicContact CE2-CD1 4.33Å; Y212-I253 HydrophobicContact CE2-CG1 3.75Å; Y212-I253 HydrophobicContact CG-CD1 3.66Å; Y212-I253 HydrophobicContact CG-CG1 4Å; A216-I253 HydrophobicContact CB-CD1 4.05Å; A216-I253 WeakPolarHBondContact O-CD1 3.39Å; I217-I253 HydrophobicContact CG1-CD1 4.33Å; S249-I253 VanDerWaalsContact O-CB 3.31Å; S249-I253 WeakPolarHBondContact O-CB 3.11Å; S249-I253 VanDerWaalsContact O-CD1 3.28Å; S249-I253 WeakPolarHBondContact O-CD1 3.28Å; S249-I253 WeakPolarHBondContact O-CG1 3.42Å; S249-I253 PolarHBondContact O-N 3.37Å; S249-I253 VanDerWaalsContact O-N 3.08Å; H251-I253 VanDerWaalsContact C-N 3.32Å; H251-I253 PolarHBondContact O-N 2.66Å; I253-C256 PolarHBondContact O-N 3.15Å; I253-L257 PolarHBondContact O-N 2.92Å; I253-L257 VanDerWaalsContact O-N 3.11Å
254	A	97.8	Very high	96.4	Very high	7 Å²	7	58 Å²	58	6%	0.058	31%	0.313	C	S	.	.	H	α-helix	trans	-65	-42.1	175.4	0	0	0	0	0	112.1	Y223 L224 V250 H251 L257 L258	Y223-A254 HydrophobicContact CD1-CB 4.17Å; L224-A254 HydrophobicContact CB-CB 4.2Å; L224-A254 HydrophobicContact CD1-CB 4.38Å; V250-A254 WeakPolarHBondContact O-CB 3.31Å; V250-A254 PolarHBondContact O-N 3.3Å; H251-A254 PolarHBondContact O-N 3.09Å; A254-L257 PolarHBondContact O-N 2.9Å; A254-L258 WeakPolarHBondContact O-CG 3.37Å; A254-L258 PolarHBondContact O-N 2.95Å
255	L	97.5	Very high	96.1	Very high	73 Å²	73	61.7 Å²	61.7	38%	0.382	31%	0.314	S	S	.	.	H	α-helix	trans	-65.4	-40.3	175.2	-72.5	170.8	0	0	0	111.9	H251 E252 L257 L258 R259	H251-L255 WeakPolarHBondContact O-CB 3.43Å; H251-L255 VanDerWaalsContact O-CG 3.32Å; H251-L255 WeakPolarHBondContact O-CG 3.42Å; H251-L255 PolarHBondContact O-N 2.94Å; E252-L255 PolarHBondContact O-N 3.11Å; E252-L255 WeakPolarHBondContact OE1-CD1 3.49Å; L255-L257 VanDerWaalsContact C-N 3.34Å; L255-L257 PolarHBondContact O-N 3.33Å; L255-L258 PolarHBondContact O-N 2.96Å; L255-R259 WeakPolarHBondContact O-CB 3.34Å; L255-R259 WeakPolarHBondContact O-CG 3.43Å; L255-R259 PolarHBondContact O-N 3.49Å
256	C	96.7	Very high	95.8	Very high	13 Å²	13	63.6 Å²	63.6	9%	0.088	33%	0.326	C	S	.	.	H	α-helix	trans	-60	-43.7	175.2	-172	0	0	0	0	111.7	I208 E252 I253 R259 L260	I208-C256 HydrophobicContact CG2-CB 3.91Å; E252-C256 WeakPolarHBondContact O-CB 3.44Å; E252-C256 PolarHBondContact O-N 3.09Å; I253-C256 PolarHBondContact O-N 3.15Å; C256-R259 PolarHBondContact O-N 3.43Å; C256-L260 PolarHBondContact O-N 3.29Å
257	L	96.9	Very high	95.6	Very high	0 Å²	0	66 Å²	66	0%	0	34%	0.335	C	S	.	.	H	α-helix	trans	-63.1	-43.5	172.5	-89.6	169.3	0	0	0	112.5	Y199 D202 L224 I253 A254 L255 R259 L260 Y261	Y199-L257 HydrophobicContact CD1-CD1 4.25Å; Y199-L257 HydrophobicContact CD1-CD2 4.46Å; Y199-L257 HydrophobicContact CG-CD1 4.32Å; D202-L257 HydrophobicContact CB-CD2 4.38Å; L224-L257 HydrophobicContact CD2-CB 3.67Å; L224-L257 HydrophobicContact CD2-CD1 3.89Å; L224-L257 HydrophobicContact CD2-CG 4.42Å; I253-L257 PolarHBondContact O-N 2.92Å; I253-L257 VanDerWaalsContact O-N 3.11Å; A254-L257 PolarHBondContact O-N 2.9Å; L255-L257 VanDerWaalsContact C-N 3.34Å; L255-L257 PolarHBondContact O-N 3.33Å; L257-R259 PolarHBondContact O-N 3.34Å; L257-L260 HydrophobicContact CD2-CD2 4.39Å; L257-L260 WeakPolarHBondContact O-CB 3.48Å; L257-L260 PolarHBondContact O-N 3.18Å; L257-Y261 HydrophobicContact CB-CE2 4.34Å; L257-Y261 HydrophobicContact CD2-CE2 3.96Å; L257-Y261 WeakPolarHBondContact O-CD2 3.33Å; L257-Y261 PolarHBondContact O-N 3.27Å
258	L	97.1	Very high	95.5	Very high	86 Å²	86	61.9 Å²	61.9	45%	0.45	32%	0.317	S	S	.	.	H	α-helix	trans	-63.7	-39.4	176	-71.7	170.5	0	0	0	112.2	L224 A254 L255 Y261 A262	L224-L258 HydrophobicContact CD1-CD1 4.1Å; L224-L258 HydrophobicContact CD1-CD2 4.12Å; L224-L258 HydrophobicContact CD1-CG 4.02Å; A254-L258 WeakPolarHBondContact O-CG 3.37Å; A254-L258 PolarHBondContact O-N 2.95Å; L255-L258 PolarHBondContact O-N 2.96Å; L258-Y261 PolarHBondContact O-N 3.21Å; L258-A262 WeakPolarHBondContact O-CB 3.32Å; L258-A262 PolarHBondContact O-N 2.95Å
259	R	96.6	Very high	95.3	Very high	128 Å²	128	56.6 Å²	56.6	48%	0.483	30%	0.304	S	S	.	.	H	α-helix	trans	-60.7	-43.6	172.3	-69.6	166.3	-169.6	143.2	5.3	110.9	E252 L255 C256 L257 Y261 A262 R263	E252-R259 IonicContact OE1-CZ 2.98Å; E252-R259 IonicContact OE1-NH1 3.94Å; E252-R259 PolarHBondContact OE1-NH1 3.19Å; E252-R259 IonicContact OE1-NH2 2.7Å; E252-R259 PolarHBondContact OE1-NH2 3.02Å; E252-R259 IonicContact OE2-CZ 3.43Å; E252-R259 IonicContact OE2-NH1 3.65Å; E252-R259 PolarHBondContact OE2-NH1 2.97Å; E252-R259 IonicContact OE2-NH2 2.82Å; L255-R259 WeakPolarHBondContact O-CB 3.34Å; L255-R259 WeakPolarHBondContact O-CG 3.43Å; L255-R259 PolarHBondContact O-N 3.49Å; C256-R259 PolarHBondContact O-N 3.43Å; L257-R259 PolarHBondContact O-N 3.34Å; R259-Y261 PolarHBondContact O-N 2.89Å; R259-A262 PolarHBondContact O-N 3.31Å; R259-R263 PolarHBondContact O-N 2.91Å; R259-R263 VanDerWaalsContact O-N 3.12Å
260	L	96.2	Very high	95.2	Very high	26 Å²	26	62.8 Å²	62.8	14%	0.136	33%	0.328	C	S	.	.	H	α-helix	trans	-58.8	-45.6	173.5	176.4	69.3	0	0	0	112	I56 D202 R205 T206 C256 L257 R263	I56-L260 HydrophobicContact CD1-CD1 3.66Å; I56-L260 HydrophobicContact CG1-CD1 4.04Å; D202-L260 HydrophobicContact CB-CD2 4.43Å; D202-L260 WeakPolarHBondContact O-CD2 3.41Å; R205-L260 HydrophobicContact CB-CD1 4.41Å; R205-L260 HydrophobicContact CB-CD2 4.36Å; T206-L260 HydrophobicContact CG2-CB 4.04Å; T206-L260 HydrophobicContact CG2-CD2 3.83Å; T206-L260 HydrophobicContact CG2-CG 4.34Å; C256-L260 PolarHBondContact O-N 3.29Å; L257-L260 HydrophobicContact CD2-CD2 4.39Å; L257-L260 WeakPolarHBondContact O-CB 3.48Å; L257-L260 PolarHBondContact O-N 3.18Å; L260-R263 WeakPolarHBondContact O-CB 3.32Å; L260-R263 PolarHBondContact O-N 3.18Å
261	Y	95.5	Very high	95	Very high	71 Å²	71	63.1 Å²	63.1	28%	0.278	33%	0.33	S	S	.	.	H	α-helix	trans	-71.8	-34.4	178.9	-66.6	-60.3	0	0	0	113.2	Y199 D202 L257 L258 R259 R263 R509	Y199-Y261 AromaticContact CD1-CE2 3.58Å; Y199-Y261 HydrophobicContact CD1-CE2 3.58Å; Y199-Y261 AromaticContact CD1-CZ 3.86Å; Y199-Y261 VanDerWaalsContact CD1-OH 3.28Å; Y199-Y261 WeakPolarHBondContact CD1-OH 3.48Å; Y199-Y261 HydrophobicContact CE1-CD2 4.26Å; Y199-Y261 AromaticContact CE1-CE2 3.36Å; Y199-Y261 HydrophobicContact CE1-CE2 3.36Å; Y199-Y261 AromaticContact CE1-CZ 3.83Å; D202-Y261 HydrophobicContact CB-CE1 4.45Å; D202-Y261 VanDerWaalsContact CB-OH 3.24Å; D202-Y261 WeakPolarHBondContact CB-OH 3.49Å; D202-Y261 WeakPolarHBondContact OD2-CE1 3.43Å; D202-Y261 PolarHBondContact OD2-OH 3.11Å; L257-Y261 HydrophobicContact CB-CE2 4.34Å; L257-Y261 HydrophobicContact CD2-CE2 3.96Å; L257-Y261 WeakPolarHBondContact O-CD2 3.33Å; L257-Y261 PolarHBondContact O-N 3.27Å; L258-Y261 PolarHBondContact O-N 3.21Å; R259-Y261 PolarHBondContact O-N 2.89Å; Y261-R263 VanDerWaalsContact C-N 3.26Å; Y261-R263 PolarHBondContact O-N 2.68Å; Y261-R509 PolarHBondContact O-NH1 3.44Å; Y261-R509 PolarHBondContact O-NH2 2.85Å
262	A	96.2	Very high	94.8	Very high	77 Å²	77	62.1 Å²	62.1	64%	0.636	33%	0.325	S	S	*	.	H	α-helix	trans	-63.3	-33.7	175.2	0	0	0	0	0	112.1	L258 R259	L258-A262 WeakPolarHBondContact O-CB 3.32Å; L258-A262 PolarHBondContact O-N 2.95Å; R259-A262 PolarHBondContact O-N 3.31Å
263	R	94.7	Very high	94.7	Very high	45 Å²	45	62.2 Å²	62.2	17%	0.17	33%	0.332	C	S	.	.	S	Bend	trans	-53.1	136.6	-175.8	-152.2	172.1	-172	79.4	8.4	113	E49 I52 D53 R259 L260 Y261 R509	E49-R263 PolarHBondContact O-NH2 3.24Å; E49-R263 IonicContact OE2-CZ 3.73Å; E49-R263 IonicContact OE2-NH1 3.27Å; E49-R263 PolarHBondContact OE2-NH1 3.14Å; E49-R263 IonicContact OE2-NH2 3.5Å; E49-R263 PolarHBondContact OE2-NH2 3.16Å; I52-R263 VanDerWaalsContact CG2-CZ 3.49Å; D53-R263 IonicContact OD1-CZ 3.46Å; D53-R263 IonicContact OD1-NE 3.02Å; D53-R263 PolarHBondContact OD1-NE 2.94Å; D53-R263 IonicContact OD1-NH2 2.74Å; D53-R263 PolarHBondContact OD1-NH2 3.38Å; R259-R263 PolarHBondContact O-N 2.91Å; R259-R263 VanDerWaalsContact O-N 3.12Å; L260-R263 WeakPolarHBondContact O-CB 3.32Å; L260-R263 PolarHBondContact O-N 3.18Å; Y261-R263 VanDerWaalsContact C-N 3.26Å; Y261-R263 PolarHBondContact O-N 2.68Å; R263-R509 PolarHBondContact O-NH1 2.94Å
264	P	93.7	Very high	94.6	Very high	105 Å²	105	64 Å²	64	68%	0.682	34%	0.343	S	S	*	.	P	Polyproline II helix	trans	-69.7	168	172.6	30.6	-36.1	0	0	0	111.5
265	K	88.6	Confident	94.4	Very high	195 Å²	195	63.7 Å²	63.7	85%	0.848	34%	0.341	S	S	*	.	P	Polyproline II helix	trans	-77.6	127.3	171.8	-71	-171.5	175.6	-173.6	0	110.3
266	V	89.7	Confident	94.3	Very high	52 Å²	52	62.9 Å²	62.9	32%	0.315	34%	0.344	S	S	.	.	P	Polyproline II helix	trans	-72.9	136.8	178.4	-166.2	0	0	0	0	110.6	D53 L271	D53-V266 HydrophobicContact CB-CG1 4Å; D53-V266 HydrophobicContact CB-CG2 3.81Å; D53-V266 WeakPolarHBondContact OD1-CG2 3.45Å; D53-V266 WeakPolarHBondContact OD2-CG1 3.38Å; D53-V266 WeakPolarHBondContact OD2-CG2 3.45Å; V266-L271 HydrophobicContact CG1-CB 4.32Å; V266-L271 HydrophobicContact CG1-CD1 4.23Å; V266-L271 HydrophobicContact CG1-CD2 4.14Å; V266-L271 HydrophobicContact CG1-CG 4.48Å
267	D	92.1	Very high	94.2	Very high	105 Å²	105	68 Å²	68	56%	0.561	37%	0.367	S	S	*	.			trans	-81.8	114.6	160.5	171.9	34.9	0	0	0	109.8	G269 K270 L271	D267-G269 PolarHBondContact O-N 2.87Å; D267-G269 PolarHBondContact OD1-N 3.21Å; D267-K270 HydrophobicContact CB-CB 4.3Å; D267-K270 PolarHBondContact O-N 3.31Å; D267-K270 WeakPolarHBondContact OD2-CB 3.36Å; D267-K270 PolarHBondContact OD2-N 2.82Å; D267-L271 PolarHBondContact O-N 3.49Å; D267-L271 VanDerWaalsContact O-N 3.12Å
268	V	93	Very high	94.1	Very high	19 Å²	19	69.5 Å²	69.5	12%	0.115	38%	0.375	C	S	.	.	H	α-helix	trans	-69.7	-23.4	179.6	-169.7	0	0	0	0	112	L57 L271 E272	L57-V268 HydrophobicContact CD1-CG1 4.48Å; L57-V268 HydrophobicContact CD1-CG2 3.71Å; L57-V268 HydrophobicContact CD2-CB 4.37Å; L57-V268 HydrophobicContact CD2-CG1 3.54Å; L57-V268 HydrophobicContact CD2-CG2 3.95Å; L57-V268 HydrophobicContact CG-CG2 4.49Å; V268-L271 PolarHBondContact O-N 2.81Å; V268-E272 HydrophobicContact CG1-CG 4.07Å; V268-E272 WeakPolarHBondContact CG1-OE1 3.42Å; V268-E272 WeakPolarHBondContact O-CB 2.97Å; V268-E272 PolarHBondContact O-N 3.46Å
269	G	92.4	Very high	94	Very high	46 Å²	46	68.6 Å²	68.6	47%	0.474	37%	0.366	S	S	.	.	H	α-helix	trans	-62.5	-51.3	173.2	0	0	0	0	0	111.7	D267 L271 S273	D267-G269 PolarHBondContact O-N 2.87Å; D267-G269 PolarHBondContact OD1-N 3.21Å; G269-L271 VanDerWaalsContact C-N 3.34Å; G269-L271 PolarHBondContact O-N 2.8Å; G269-S273 WeakPolarHBondContact O-CB 3.37Å; G269-S273 PolarHBondContact O-N 2.95Å; G269-S273 VanDerWaalsContact O-N 3.07Å
270	K	93.8	Very high	94	Very high	153 Å²	153	68.9 Å²	68.9	67%	0.665	37%	0.37	S	S	*	.	H	α-helix	trans	-56.1	-45.8	170.8	-171.3	-172.9	177.8	-166.4	0	111.9	D267 S273 V274	D267-K270 HydrophobicContact CB-CB 4.3Å; D267-K270 PolarHBondContact O-N 3.31Å; D267-K270 WeakPolarHBondContact OD2-CB 3.36Å; D267-K270 PolarHBondContact OD2-N 2.82Å; K270-S273 WeakPolarHBondContact O-CB 3.39Å; K270-S273 PolarHBondContact O-N 3.49Å; K270-V274 WeakPolarHBondContact O-CG2 3.33Å; K270-V274 PolarHBondContact O-N 3Å
271	L	93.8	Very high	93.8	Very high	7 Å²	7	70.8 Å²	70.8	4%	0.037	39%	0.385	C	S	.	.	H	α-helix	trans	-66	-42.5	-176.3	-159.6	73.3	0	0	0	113	T50 D53 L54 L57 V266 D267 V268 G269 S273 L275	T50-L271 HydrophobicContact CG2-CD1 4.02Å; D53-L271 HydrophobicContact CB-CD1 3.75Å; D53-L271 HydrophobicContact CB-CD2 4.16Å; L54-L271 HydrophobicContact CD2-CD2 3.48Å; L54-L271 VanDerWaalsContact CD2-CD2 3.48Å; L54-L271 HydrophobicContact CD2-CG 3.81Å; L54-L271 HydrophobicContact CG-CD1 4.25Å; L54-L271 HydrophobicContact CG-CD2 3.77Å; L54-L271 HydrophobicContact CG-CG 3.97Å; L57-L271 HydrophobicContact CD2-CD2 3.71Å; V266-L271 HydrophobicContact CG1-CB 4.32Å; V266-L271 HydrophobicContact CG1-CD1 4.23Å; V266-L271 HydrophobicContact CG1-CD2 4.14Å; V266-L271 HydrophobicContact CG1-CG 4.48Å; D267-L271 PolarHBondContact O-N 3.49Å; D267-L271 VanDerWaalsContact O-N 3.12Å; V268-L271 PolarHBondContact O-N 2.81Å; G269-L271 VanDerWaalsContact C-N 3.34Å; G269-L271 PolarHBondContact O-N 2.8Å; L271-S273 VanDerWaalsContact C-N 3.31Å; L271-S273 PolarHBondContact O-N 3.2Å; L271-L275 WeakPolarHBondContact O-CB 3.5Å; L271-L275 PolarHBondContact O-N 2.86Å; L271-L275 VanDerWaalsContact O-N 3.1Å
272	E	94.3	Very high	93.6	Very high	39 Å²	39	70.1 Å²	70.1	18%	0.182	39%	0.385	C	S	.	.	H	α-helix	trans	-67	-31.5	173.8	-75.7	-178	-158.1	0	0	111.8	Y97 R129 R132 V268 A276	Y97-E272 HydrophobicContact CE1-CG 4.11Å; Y97-E272 PolarHBondContact OH-OE1 2.96Å; R129-E272 IonicContact CZ-OE2 3.54Å; R129-E272 IonicContact NH2-OE2 3.97Å; R129-E272 PolarHBondContact NH2-OE2 3.25Å; R132-E272 IonicContact CZ-OE1 2.68Å; R132-E272 IonicContact NH1-OE1 3.31Å; R132-E272 IonicContact NH2-OE1 3.73Å; R132-E272 PolarHBondContact NH2-OE1 3.4Å; R132-E272 IonicContact NH2-OE2 3.52Å; V268-E272 HydrophobicContact CG1-CG 4.07Å; V268-E272 WeakPolarHBondContact CG1-OE1 3.42Å; V268-E272 WeakPolarHBondContact O-CB 2.97Å; V268-E272 PolarHBondContact O-N 3.46Å; E272-A276 WeakPolarHBondContact O-CB 3.38Å; E272-A276 PolarHBondContact O-N 2.79Å
273	S	95	Very high	93.4	Very high	60 Å²	60	69.3 Å²	69.3	42%	0.42	38%	0.378	S	S	.	.	H	α-helix	trans	-67.1	-48.7	174.1	-172	0	0	0	0	112.7	G269 K270 L271 L275 A276 Q277	G269-S273 WeakPolarHBondContact O-CB 3.37Å; G269-S273 PolarHBondContact O-N 2.95Å; G269-S273 VanDerWaalsContact O-N 3.07Å; K270-S273 WeakPolarHBondContact O-CB 3.39Å; K270-S273 PolarHBondContact O-N 3.49Å; L271-S273 VanDerWaalsContact C-N 3.31Å; L271-S273 PolarHBondContact O-N 3.2Å; S273-L275 VanDerWaalsContact C-N 3.29Å; S273-L275 PolarHBondContact O-N 3.39Å; S273-A276 WeakPolarHBondContact O-CB 3.35Å; S273-A276 PolarHBondContact O-N 3.42Å; S273-Q277 WeakPolarHBondContact O-CG 3.4Å; S273-Q277 PolarHBondContact O-N 3.35Å
274	V	94.8	Very high	93.4	Very high	38 Å²	38	70.4 Å²	70.4	23%	0.23	39%	0.385	C	S	.	.	H	α-helix	trans	-59.5	-42	175.3	174.1	0	0	0	0	110.7	T50 K270 A276 Q277 L278	T50-V274 HydrophobicContact CG2-CG1 4.04Å; K270-V274 WeakPolarHBondContact O-CG2 3.33Å; K270-V274 PolarHBondContact O-N 3Å; V274-A276 VanDerWaalsContact C-N 3.32Å; V274-A276 PolarHBondContact O-N 2.99Å; V274-Q277 PolarHBondContact O-N 3.28Å; V274-L278 HydrophobicContact CG1-CD1 4.1Å; V274-L278 HydrophobicContact CG1-CG 4.49Å; V274-L278 WeakPolarHBondContact O-CG 3.49Å; V274-L278 PolarHBondContact O-N 3.45Å
275	L	94.1	Very high	93.3	Very high	0 Å²	0	67.5 Å²	67.5	0%	0	37%	0.37	C	S	.	.	H	α-helix	trans	-60.1	-36.9	172.9	-91.1	-174.8	0	0	0	113.8	M46 L54 F92 Y97 L271 S273 R279	M46-L275 HydrophobicContact CE-CD2 3.49Å; M46-L275 VanDerWaalsContact CE-CD2 3.49Å; L54-L275 HydrophobicContact CD1-CD1 3.98Å; L54-L275 HydrophobicContact CD1-CD2 3.81Å; L54-L275 HydrophobicContact CD1-CG 3.89Å; L54-L275 HydrophobicContact CD2-CD1 3.55Å; L54-L275 HydrophobicContact CD2-CG 4.25Å; L54-L275 HydrophobicContact CG-CD1 4.44Å; F92-L275 HydrophobicContact CB-CD2 4.39Å; Y97-L275 HydrophobicContact CD1-CD1 3.93Å; Y97-L275 HydrophobicContact CE1-CD1 4.37Å; L271-L275 WeakPolarHBondContact O-CB 3.5Å; L271-L275 PolarHBondContact O-N 2.86Å; L271-L275 VanDerWaalsContact O-N 3.1Å; S273-L275 VanDerWaalsContact C-N 3.29Å; S273-L275 PolarHBondContact O-N 3.39Å; L275-R279 VanDerWaalsContact O-CG 3.3Å; L275-R279 WeakPolarHBondContact O-CG 3.38Å; L275-R279 PolarHBondContact O-N 2.88Å
276	A	94.7	Very high	93.4	Very high	56 Å²	56	64.4 Å²	64.4	46%	0.463	36%	0.357	S	S	.	.	H	α-helix	trans	-71.1	-41.2	177.1	0	0	0	0	0	111.6	E272 S273 V274 R279 K280	E272-A276 WeakPolarHBondContact O-CB 3.38Å; E272-A276 PolarHBondContact O-N 2.79Å; S273-A276 WeakPolarHBondContact O-CB 3.35Å; S273-A276 PolarHBondContact O-N 3.42Å; V274-A276 VanDerWaalsContact C-N 3.32Å; V274-A276 PolarHBondContact O-N 2.99Å; A276-R279 PolarHBondContact O-N 3.08Å; A276-K280 PolarHBondContact O-N 3.36Å
277	Q	95.9	Very high	93.6	Very high	119 Å²	119	67.9 Å²	67.9	56%	0.556	37%	0.369	S	S	*	.	H	α-helix	trans	-60.7	-51	175.5	-69.1	172.5	-3.5	0	0	111.3	S273 V274 R279 K280 S281	S273-Q277 WeakPolarHBondContact O-CG 3.4Å; S273-Q277 PolarHBondContact O-N 3.35Å; V274-Q277 PolarHBondContact O-N 3.28Å; Q277-R279 VanDerWaalsContact C-N 3.3Å; Q277-R279 PolarHBondContact O-N 2.81Å; Q277-K280 WeakPolarHBondContact O-CB 3.37Å; Q277-K280 PolarHBondContact O-N 3.2Å; Q277-K280 VanDerWaalsContact O-N 3.12Å; Q277-S281 PolarHBondContact O-N 2.93Å; Q277-S281 PolarHBondContact O-OG 3.17Å
278	L	94.7	Very high	93.6	Very high	32 Å²	32	69.5 Å²	69.5	17%	0.168	37%	0.368	C	S	.	.	H	α-helix	trans	-58.7	-39.6	177.6	-71	171.8	0	0	0	112.4	M46 V93 V274 S281 Q282	M46-L278 HydrophobicContact CB-CD1 4.17Å; M46-L278 HydrophobicContact CE-CD1 3.93Å; M46-L278 HydrophobicContact CG-CD1 4.27Å; V93-L278 HydrophobicContact CG1-CB 3.98Å; V93-L278 HydrophobicContact CG2-CB 4.01Å; V93-L278 HydrophobicContact CG2-CD1 4.09Å; V274-L278 HydrophobicContact CG1-CD1 4.1Å; V274-L278 HydrophobicContact CG1-CG 4.49Å; V274-L278 WeakPolarHBondContact O-CG 3.49Å; V274-L278 PolarHBondContact O-N 3.45Å; L278-S281 PolarHBondContact O-N 2.82Å; L278-Q282 WeakPolarHBondContact O-CB 3.35Å; L278-Q282 PolarHBondContact O-N 3.46Å
279	R	94.9	Very high	93.6	Very high	68 Å²	68	73.1 Å²	73.1	26%	0.257	38%	0.383	S	S	.	.	H	α-helix	trans	-66.5	-39.9	175.3	-75.7	178.9	-168.8	113.7	13.9	112.8	F92 V93 L275 A276 Q277 Q282 A283	F92-R279 PolarHBondContact O-NH2 3.31Å; V93-R279 HydrophobicContact CG1-CG 3.78Å; V93-R279 WeakPolarHBondContact O-CD 3.3Å; V93-R279 VanDerWaalsContact O-CG 3.29Å; V93-R279 WeakPolarHBondContact O-CG 3.26Å; V93-R279 PolarHBondContact O-NE 2.95Å; L275-R279 VanDerWaalsContact O-CG 3.3Å; L275-R279 WeakPolarHBondContact O-CG 3.38Å; L275-R279 PolarHBondContact O-N 2.88Å; A276-R279 PolarHBondContact O-N 3.08Å; Q277-R279 VanDerWaalsContact C-N 3.3Å; Q277-R279 PolarHBondContact O-N 2.81Å; R279-Q282 PolarHBondContact O-N 3.23Å; R279-A283 PolarHBondContact O-N 3.47Å
280	K	94.9	Very high	93.5	Very high	134 Å²	134	74.3 Å²	74.3	58%	0.583	38%	0.379	S	S	*	.	H	α-helix	trans	-61.4	-50.2	174.8	-172.9	174.2	-174.4	-78.7	0	110.3	A276 Q277 Q282 A283 E284	A276-K280 PolarHBondContact O-N 3.36Å; Q277-K280 WeakPolarHBondContact O-CB 3.37Å; Q277-K280 PolarHBondContact O-N 3.2Å; Q277-K280 VanDerWaalsContact O-N 3.12Å; K280-Q282 VanDerWaalsContact C-N 3.31Å; K280-Q282 PolarHBondContact O-N 3.4Å; K280-A283 WeakPolarHBondContact O-CB 3.29Å; K280-A283 PolarHBondContact O-N 3.41Å; K280-A283 VanDerWaalsContact O-N 3.12Å; K280-E284 IonicContact NZ-OE1 2.76Å; K280-E284 PolarHBondContact NZ-OE1 3Å; K280-E284 VanDerWaalsContact O-CG 3.32Å; K280-E284 WeakPolarHBondContact O-CG 3.4Å; K280-E284 PolarHBondContact O-N 2.9Å
281	S	93.9	Very high	93.4	Very high	65 Å²	65	71.7 Å²	71.7	46%	0.455	37%	0.369	S	S	.	.	H	α-helix	trans	-62.7	-33.7	177.5	-58.1	0	0	0	0	113.6	Q277 L278 A285	Q277-S281 PolarHBondContact O-N 2.93Å; Q277-S281 PolarHBondContact O-OG 3.17Å; L278-S281 PolarHBondContact O-N 2.82Å; S281-A285 VanDerWaalsContact O-CB 3.26Å; S281-A285 WeakPolarHBondContact O-CB 3.38Å; S281-A285 PolarHBondContact O-N 3.12Å
282	Q	90.9	Very high	93.2	Very high	58 Å²	58	76.2 Å²	76.2	27%	0.271	39%	0.393	S	S	.	.	H	α-helix	trans	-69.5	-37.3	173.8	-175.1	173.9	72.9	0	0	112.2	D44 V93 L278 R279 K280 K286	D44-Q282 PolarHBondContact OD1-NE2 2.98Å; D44-Q282 PolarHBondContact OD2-NE2 2.87Å; V93-Q282 HydrophobicContact CG1-CB 4.34Å; L278-Q282 WeakPolarHBondContact O-CB 3.35Å; L278-Q282 PolarHBondContact O-N 3.46Å; R279-Q282 PolarHBondContact O-N 3.23Å; K280-Q282 VanDerWaalsContact C-N 3.31Å; K280-Q282 PolarHBondContact O-N 3.4Å; Q282-K286 WeakPolarHBondContact O-CB 3.33Å; Q282-K286 PolarHBondContact O-N 2.85Å; Q282-K286 VanDerWaalsContact O-N 3.13Å
283	A	92.1	Very high	92.9	Very high	59 Å²	59	79.6 Å²	79.6	49%	0.488	41%	0.407	S	S	.	.	H	α-helix	trans	-66.1	-49.8	173.6	0	0	0	0	0	111.4	R279 K280 A285 K286 E287	R279-A283 PolarHBondContact O-N 3.47Å; K280-A283 WeakPolarHBondContact O-CB 3.29Å; K280-A283 PolarHBondContact O-N 3.41Å; K280-A283 VanDerWaalsContact O-N 3.12Å; A283-A285 VanDerWaalsContact C-N 3.27Å; A283-A285 PolarHBondContact O-N 3.39Å; A283-K286 PolarHBondContact O-N 3.04Å; A283-K286 VanDerWaalsContact O-N 3.12Å; A283-E287 WeakPolarHBondContact O-CB 3.39Å; A283-E287 PolarHBondContact O-N 3.37Å
284	E	93.9	Very high	92.5	Very high	68 Å²	68	83.5 Å²	83.5	32%	0.318	42%	0.416	S	S	.	.	H	α-helix	trans	-61.1	-32.1	177.2	-68.6	166.1	164.1	0	0	113	K280 R288	K280-E284 IonicContact NZ-OE1 2.76Å; K280-E284 PolarHBondContact NZ-OE1 3Å; K280-E284 VanDerWaalsContact O-CG 3.32Å; K280-E284 WeakPolarHBondContact O-CG 3.4Å; K280-E284 PolarHBondContact O-N 2.9Å; E284-R288 WeakPolarHBondContact O-CG 3.39Å; E284-R288 PolarHBondContact O-N 2.98Å; E284-R288 PolarHBondContact O-NE 3.07Å
285	A	91.8	Very high	91.6	Very high	44 Å²	44	87.7 Å²	87.7	36%	0.364	43%	0.433	S	S	.	.	H	α-helix	trans	-69.7	-45.2	173.3	0	0	0	0	0	111.7	S281 A283 E287 R288 E289	S281-A285 VanDerWaalsContact O-CB 3.26Å; S281-A285 WeakPolarHBondContact O-CB 3.38Å; S281-A285 PolarHBondContact O-N 3.12Å; A283-A285 VanDerWaalsContact C-N 3.27Å; A283-A285 PolarHBondContact O-N 3.39Å; A285-E287 VanDerWaalsContact C-N 3.33Å; A285-E287 PolarHBondContact O-N 3.31Å; A285-R288 PolarHBondContact O-N 3.43Å; A285-E289 WeakPolarHBondContact O-CB 3.28Å; A285-E289 PolarHBondContact O-N 2.76Å
286	K	91.6	Very high	90.3	Very high	131 Å²	131	94.3 Å²	94.3	57%	0.57	46%	0.464	S	S	*	.	H	α-helix	trans	-65.9	-35.3	177.5	-172.1	-174.5	177	-167.6	0	112.2	Q282 A283 E289 N290	Q282-K286 WeakPolarHBondContact O-CB 3.33Å; Q282-K286 PolarHBondContact O-N 2.85Å; Q282-K286 VanDerWaalsContact O-N 3.13Å; A283-K286 PolarHBondContact O-N 3.04Å; A283-K286 VanDerWaalsContact O-N 3.12Å; K286-E289 PolarHBondContact O-N 2.98Å; K286-N290 PolarHBondContact O-N 3.5Å; K286-N290 PolarHBondContact O-ND2 2.84Å
287	E	92.8	Very high	88.9	Confident	125 Å²	125	96.8 Å²	96.8	58%	0.584	47%	0.474	S	S	*	.	H	α-helix	trans	-62	-53.6	176.3	-172.4	154.2	-134.9	0	0	111	A283 A285 E289 N290 E291	A283-E287 WeakPolarHBondContact O-CB 3.39Å; A283-E287 PolarHBondContact O-N 3.37Å; A285-E287 VanDerWaalsContact C-N 3.33Å; A285-E287 PolarHBondContact O-N 3.31Å; E287-E289 VanDerWaalsContact C-N 3.29Å; E287-E289 PolarHBondContact O-N 3.47Å; E287-N290 WeakPolarHBondContact O-CA 3.24Å; E287-N290 WeakPolarHBondContact O-CB 3.41Å; E287-N290 PolarHBondContact O-N 3.03Å; E287-E291 WeakPolarHBondContact O-CG 3.48Å; E287-E291 PolarHBondContact O-N 3.4Å
288	R	93.4	Very high	87.2	Confident	139 Å²	139	97 Å²	97	53%	0.525	48%	0.483	S	S	.	.	H	α-helix	trans	-58.7	-36.8	174.4	-72	175	-70	144.5	-7.4	113.4	E284 A285 N290 E291 L292	E284-R288 WeakPolarHBondContact O-CG 3.39Å; E284-R288 PolarHBondContact O-N 2.98Å; E284-R288 PolarHBondContact O-NE 3.07Å; A285-R288 PolarHBondContact O-N 3.43Å; R288-N290 VanDerWaalsContact C-N 3.32Å; R288-N290 PolarHBondContact O-N 3.14Å; R288-E291 PolarHBondContact O-N 2.87Å; R288-L292 WeakPolarHBondContact O-CB 3.48Å; R288-L292 WeakPolarHBondContact O-CG 3.21Å; R288-L292 PolarHBondContact O-N 3.12Å
289	E	91.4	Very high	85.6	Confident	94 Å²	94	100.6 Å²	100.6	44%	0.439	51%	0.506	S	S	.	.	H	α-helix	trans	-61.5	-39.9	173.6	-165.3	-161.4	142.7	0	0	111.9	A285 K286 E287 K293	A285-E289 WeakPolarHBondContact O-CB 3.28Å; A285-E289 PolarHBondContact O-N 2.76Å; K286-E289 PolarHBondContact O-N 2.98Å; E287-E289 VanDerWaalsContact C-N 3.29Å; E287-E289 PolarHBondContact O-N 3.47Å; E289-K293 WeakPolarHBondContact O-CB 3.33Å; E289-K293 WeakPolarHBondContact O-CD 3.49Å; E289-K293 VanDerWaalsContact O-CG 3.29Å; E289-K293 WeakPolarHBondContact O-CG 3.44Å; E289-K293 PolarHBondContact O-N 3.29Å; E289-K293 VanDerWaalsContact O-N 3.15Å; E289-K293 IonicContact OE1-NZ 2.61Å; E289-K293 PolarHBondContact OE1-NZ 3.37Å
290	N	91.5	Very high	83.4	Confident	72 Å²	72	102.4 Å²	102.4	39%	0.385	53%	0.525	S	S	.	.	H	α-helix	trans	-71.1	-34.9	175.6	-61.9	-39.4	0	0	0	112.2	K286 E287 R288 K293 K294	K286-N290 PolarHBondContact O-N 3.5Å; K286-N290 PolarHBondContact O-ND2 2.84Å; E287-N290 WeakPolarHBondContact O-CA 3.24Å; E287-N290 WeakPolarHBondContact O-CB 3.41Å; E287-N290 PolarHBondContact O-N 3.03Å; R288-N290 VanDerWaalsContact C-N 3.32Å; R288-N290 PolarHBondContact O-N 3.14Å; N290-K293 PolarHBondContact O-N 3.03Å; N290-K294 WeakPolarHBondContact O-CG 3.28Å; N290-K294 PolarHBondContact O-N 3.41Å
291	E	90.9	Very high	81.2	Confident	97 Å²	97	100.7 Å²	100.7	45%	0.453	53%	0.527	S	S	.	.	H	α-helix	trans	-65.8	-47	175.7	-67.9	176.4	138.8	0	0	111.8	E287 R288 K293 K294 Q295	E287-E291 WeakPolarHBondContact O-CG 3.48Å; E287-E291 PolarHBondContact O-N 3.4Å; R288-E291 PolarHBondContact O-N 2.87Å; E291-K293 VanDerWaalsContact C-N 3.29Å; E291-K293 PolarHBondContact O-N 2.89Å; E291-K294 WeakPolarHBondContact O-CB 3.28Å; E291-K294 PolarHBondContact O-N 3.45Å; E291-K294 VanDerWaalsContact O-N 3.14Å; E291-Q295 WeakPolarHBondContact O-CG 3.48Å; E291-Q295 PolarHBondContact O-N 3.2Å
292	L	89.7	Confident	79	Confident	103 Å²	103	103.5 Å²	103.5	54%	0.539	54%	0.544	S	S	.	.	H	α-helix	trans	-58.2	-41.7	174.4	-72.6	164.9	0	0	0	111.5	R288 Q295 Q296	R288-L292 WeakPolarHBondContact O-CB 3.48Å; R288-L292 WeakPolarHBondContact O-CG 3.21Å; R288-L292 PolarHBondContact O-N 3.12Å; L292-Q295 PolarHBondContact O-N 2.95Å; L292-Q296 PolarHBondContact O-N 3.1Å
293	K	88	Confident	77.1	Confident	110 Å²	110	105.9 Å²	105.9	48%	0.478	57%	0.568	S	S	.	*	H	α-helix	trans	-63.2	-41.4	175.1	-76.9	169.5	173.8	175	0	112.6	E289 N290 E291 Q296 T297	E289-K293 WeakPolarHBondContact O-CB 3.33Å; E289-K293 WeakPolarHBondContact O-CD 3.49Å; E289-K293 VanDerWaalsContact O-CG 3.29Å; E289-K293 WeakPolarHBondContact O-CG 3.44Å; E289-K293 PolarHBondContact O-N 3.29Å; E289-K293 VanDerWaalsContact O-N 3.15Å; E289-K293 IonicContact OE1-NZ 2.61Å; E289-K293 PolarHBondContact OE1-NZ 3.37Å; N290-K293 PolarHBondContact O-N 3.03Å; E291-K293 VanDerWaalsContact C-N 3.29Å; E291-K293 PolarHBondContact O-N 2.89Å; K293-Q296 PolarHBondContact O-N 3.39Å; K293-T297 PolarHBondContact O-N 2.97Å; K293-T297 VanDerWaalsContact O-N 3.14Å; K293-T297 PolarHBondContact O-OG1 3.02Å
294	K	86	Confident	75.1	Confident	142 Å²	142	109.3 Å²	109.3	62%	0.617	58%	0.583	S	S	*	*	H	α-helix	trans	-61.3	-43.4	173.7	-72.8	169.3	-179	178.1	0	111.8	N290 E291 T297 V298	N290-K294 WeakPolarHBondContact O-CG 3.28Å; N290-K294 PolarHBondContact O-N 3.41Å; E291-K294 WeakPolarHBondContact O-CB 3.28Å; E291-K294 PolarHBondContact O-N 3.45Å; E291-K294 VanDerWaalsContact O-N 3.14Å; K294-T297 WeakPolarHBondContact CA-OG1 3.47Å; K294-T297 PolarHBondContact O-N 3.34Å; K294-T297 PolarHBondContact O-OG1 3.33Å; K294-V298 WeakPolarHBondContact O-CG2 3.21Å; K294-V298 PolarHBondContact O-N 2.98Å
295	Q	75.9	Confident	72.9	Confident	126 Å²	126	117.4 Å²	117.4	59%	0.589	61%	0.61	S	S	*	*	H	α-helix	trans	-63.7	-42.1	179.3	-70	175.2	6.4	0	0	111.9	E291 L292 T297 V298 T299	E291-Q295 WeakPolarHBondContact O-CG 3.48Å; E291-Q295 PolarHBondContact O-N 3.2Å; L292-Q295 PolarHBondContact O-N 2.95Å; Q295-T297 PolarHBondContact O-N 2.97Å; Q295-V298 PolarHBondContact O-N 3.36Å; Q295-T299 PolarHBondContact O-N 2.99Å; Q295-T299 PolarHBondContact O-OG1 3.44Å
296	Q	67.6	Low	71.1	Confident	138 Å²	138	119.9 Å²	119.9	65%	0.645	63%	0.625	S	S	*	*	H	α-helix	trans	-62.2	-40.5	175.2	-73.6	-178.3	-10.1	0	0	112.4	L292 K293 V298 T299	L292-Q296 PolarHBondContact O-N 3.1Å; K293-Q296 PolarHBondContact O-N 3.39Å; Q296-V298 PolarHBondContact O-N 3.44Å; Q296-V298 VanDerWaalsContact O-N 3.15Å; Q296-T299 WeakPolarHBondContact CA-OG1 3.35Å; Q296-T299 PolarHBondContact O-N 3.07Å; Q296-T299 PolarHBondContact O-OG1 3.25Å
297	T	64.8	Low	68.8	Low	109 Å²	109	121.1 Å²	121.1	67%	0.669	64%	0.637	S	S	*	*	H	α-helix	trans	-66.9	-12.3	176.8	49.4	0	0	0	0	115	K293 K294 Q295	K293-T297 PolarHBondContact O-N 2.97Å; K293-T297 VanDerWaalsContact O-N 3.14Å; K293-T297 PolarHBondContact O-OG1 3.02Å; K294-T297 WeakPolarHBondContact CA-OG1 3.47Å; K294-T297 PolarHBondContact O-N 3.34Å; K294-T297 PolarHBondContact O-OG1 3.33Å; Q295-T297 PolarHBondContact O-N 2.97Å
298	V	61.5	Low	66.9	Low	123 Å²	123	123.5 Å²	123.5	75%	0.745	65%	0.648	S	S	*	*	H	α-helix	trans	-99.9	-15.1	176.6	176.9	0	0	0	0	112.2	K294 Q295 Q296	K294-V298 WeakPolarHBondContact O-CG2 3.21Å; K294-V298 PolarHBondContact O-N 2.98Å; Q295-V298 PolarHBondContact O-N 3.36Å; Q296-V298 PolarHBondContact O-N 3.44Å; Q296-V298 VanDerWaalsContact O-N 3.15Å
299	T	59.9	Low	64.5	Low	107 Å²	107	122.1 Å²	122.1	66%	0.656	66%	0.66	S	S	*	*	H	α-helix	trans	-103.7	-3.5	-173.4	35.8	0	0	0	0	115.6	Q295 Q296 P301	Q295-T299 PolarHBondContact O-N 2.99Å; Q295-T299 PolarHBondContact O-OG1 3.44Å; Q296-T299 WeakPolarHBondContact CA-OG1 3.35Å; Q296-T299 PolarHBondContact O-N 3.07Å; Q296-T299 PolarHBondContact O-OG1 3.25Å; T299-P301 WeakPolarHBondContact O-CD 3.29Å
300	T	48.2	Very low	62.4	Low	106 Å²	106	127.5 Å²	127.5	65%	0.65	68%	0.682	S	S	*	*	S	Bend	trans	-80.2	113.3	159.8	46.5	0	0	0	0	110.1
301	P	50.1	Low	60	Low	98 Å²	98	126.8 Å²	126.8	64%	0.636	69%	0.692	S	S	*	*			trans	-64.1	157.9	168.2	-12.7	28.7	0	0	0	109.7	T299 S303	T299-P301 WeakPolarHBondContact O-CD 3.29Å; P301-S303 VanDerWaalsContact C-N 3.26Å; P301-S303 PolarHBondContact O-N 2.62Å
302	P	47.8	Very low	57.9	Low	124 Å²	124	133 Å²	133	81%	0.805	71%	0.713	S	S	*	*			trans	-66.9	91.6	161.7	30	-32.5	0	0	0	108.2	T304	P302-T304 PolarHBondContact O-N 3.01Å
303	S	49.4	Very low	55.7	Low	109 Å²	109	135.3 Å²	135.3	76%	0.762	73%	0.726	S	S	*	*			trans	-52.5	117.5	170.1	-67.8	0	0	0	0	108.3	P301 R305	P301-S303 VanDerWaalsContact C-N 3.26Å; P301-S303 PolarHBondContact O-N 2.62Å; S303-R305 PolarHBondContact O-N 2.7Å
304	T	50.9	Low	53.7	Low	131 Å²	131	135.6 Å²	135.6	80%	0.804	74%	0.741	S	S	*	*			trans	-57.3	111.4	-179.3	32.9	0	0	0	0	109.1	P302 S306	P302-T304 PolarHBondContact O-N 3.01Å; T304-S306 VanDerWaalsContact C-N 3.25Å; T304-S306 PolarHBondContact O-N 3.4Å
305	R	48.1	Very low	51.7	Low	238 Å²	238	135 Å²	135	90%	0.898	75%	0.752	S	S	*	*			trans	-66.2	92.3	164.5	-86.7	-178.3	155.5	179.1	-7.9	107.5	S303 D307	S303-R305 PolarHBondContact O-N 2.7Å; R305-D307 PolarHBondContact O-N 3.17Å
306	S	53.1	Low	50	Low	95 Å²	95	136.2 Å²	136.2	66%	0.664	76%	0.758	S	S	*	*			trans	-67.5	120.9	161.7	37.6	0	0	0	0	108.3	T304 H308	T304-S306 VanDerWaalsContact C-N 3.25Å; T304-S306 PolarHBondContact O-N 3.4Å; S306-H308 PolarHBondContact O-N 3.45Å
307	D	43.3	Very low	48.9	Very low	157 Å²	157	137.7 Å²	137.7	84%	0.84	77%	0.77	S	S	*	*			trans	-69.8	100.1	177	-71.9	-55.8	0	0	0	110.3	R305	R305-D307 PolarHBondContact O-N 3.17Å
308	H	52.7	Low	47.9	Very low	176 Å²	176	138.1 Å²	138.1	82%	0.815	76%	0.764	S	S	*	*			trans	-115.2	100.6	162.2	-85.9	-65.2	0	0	0	110.9	S306 F310	S306-H308 PolarHBondContact O-N 3.45Å; H308-F310 PolarHBondContact O-N 3.21Å
309	S	44.9	Very low	46.9	Very low	109 Å²	109	140.6 Å²	140.6	76%	0.762	77%	0.772	S	S	*	*			trans	-57.9	120.2	169.9	151.8	0	0	0	0	111.5
310	F	46.6	Very low	46	Very low	208 Å²	208	139.9 Å²	139.9	91%	0.912	77%	0.772	S	S	*	*			trans	-141	114.7	141.2	-103.5	-80.4	0	0	0	108.3	H308	H308-F310 PolarHBondContact O-N 3.21Å
311	G	41.6	Very low	45.8	Very low	57 Å²	57	144.8 Å²	144.8	59%	0.588	78%	0.784	S	S	*	*			trans	-102.6	155.8	-175.9	0	0	0	0	0	113
312	Y	45.6	Very low	45.3	Very low	228 Å²	228	144.8 Å²	144.8	89%	0.894	79%	0.786	S	S	*	*			trans	-137.8	145.8	154.9	-92.7	-74.3	0	0	0	110.5
313	N	44.3	Very low	45	Very low	151 Å²	151	147.4 Å²	147.4	81%	0.807	79%	0.785	S	S	*	*			trans	-76.1	144.2	-160.2	-53	-45.9	0	0	0	114.1
314	S	46	Very low	44.6	Very low	115 Å²	115	147.6 Å²	147.6	80%	0.804	78%	0.777	S	S	*	*				-169.7	155.1	120.8	-84.6	0	0	0	0	112.6
315	P	42.9	Very low	44.4	Very low	130 Å²	130	148.4 Å²	148.4	84%	0.844	77%	0.772	S	S	*	*			trans	-94.2	170.5	-147.8	-11.6	31.5	0	0	0	117.5
316	Q	41.1	Very low	44	Very low	152 Å²	152	143.4 Å²	143.4	71%	0.71	76%	0.763	S	S	*	*			trans	-68.5	164	175.9	-60.8	155.5	-19.1	0	0	112.6	H318	Q316-H318 PolarHBondContact OE1-CD2 3.01Å; Q316-H318 PolarHBondContact OE1-NE2 3.16Å
317	N	43.6	Very low	43.5	Very low	168 Å²	168	147.8 Å²	147.8	90%	0.898	77%	0.77	S	S	*	*			trans	-131.4	122.7	144.1	-146.3	-7.9	0	0	0	109.2
318	H	44.9	Very low	43.5	Very low	119 Å²	119	145.4 Å²	145.4	55%	0.551	76%	0.763	S	S	*	*			trans	-98.6	151.4	-177	-73.9	-103.4	0	0	0	110.7	Q316	Q316-H318 PolarHBondContact OE1-CD2 3.01Å; Q316-H318 PolarHBondContact OE1-NE2 3.16Å
319	L	40.6	Very low	42.7	Very low	174 Å²	174	144.9 Å²	144.9	91%	0.911	77%	0.767	S	S	*	*				-159.6	151.3	110	-136.1	62.2	0	0	0	112.6
320	S	40.9	Very low	42.6	Very low	93 Å²	93	143.6 Å²	143.6	65%	0.65	77%	0.771	S	S	*	*			trans	-141	153.6	-174.3	62.6	0	0	0	0	112.5
321	K	42.8	Very low	42.1	Very low	209 Å²	209	141.2 Å²	141.2	91%	0.909	77%	0.767	S	S	*	*			trans	-176.2	108.2	167.7	-100.7	156.9	-175.6	179.4	0	106.6
322	S	41.4	Very low	42.1	Very low	97 Å²	97	145.3 Å²	145.3	68%	0.678	77%	0.773	S	S	*	*			cis	98.7	129.6	14.3	-158.3	0	0	0	0	115.5
323	K	41.7	Very low	41.8	Very low	180 Å²	180	142.2 Å²	142.2	78%	0.783	76%	0.764	S	S	*	*			trans	72.5	148.9	175.2	-57.7	-177	-179.2	178.5	0	116.2
324	N	39.7	Very low	41.2	Very low	113 Å²	113	140 Å²	140	60%	0.604	76%	0.761	S	S	*	*			cis	-158.3	132.9	-9.9	-114.6	13.1	0	0	0	109.7
325	Q	46	Very low	41	Very low	148 Å²	148	141.7 Å²	141.7	69%	0.692	77%	0.766	S	S	*	*				80.4	144.6	96.6	-74.4	-174	-7.4	0	0	119.1
326	N	40.1	Very low	40.7	Very low	132 Å²	132	142.8 Å²	142.8	71%	0.706	76%	0.764	S	S	*	*			trans	75.9	144.1	164	-57.5	-45.7	0	0	0	117.9
327	K	42.8	Very low	40.6	Very low	188 Å²	188	141.3 Å²	141.3	82%	0.817	77%	0.771	S	S	*	*			cis	-153.2	169	-9.9	-116.6	179.3	179.9	-176.8	0	110.1
328	P	44.4	Very low	40.3	Very low	106 Å²	106	143.5 Å²	143.5	69%	0.688	77%	0.772	S	S	*	*			trans	-114.8	-175.5	-158.6	44.5	-39.1	0	0	0	117.4
329	N	35.1	Very low	39.7	Very low	166 Å²	166	142.7 Å²	142.7	89%	0.888	79%	0.786	S	S	*	*			trans	88	115.9	157.8	-68.6	-1.3	0	0	0	120.5
330	G	43.8	Very low	39.3	Very low	82 Å²	82	142.9 Å²	142.9	85%	0.845	78%	0.783	S	S	*	*			trans	-147.9	150.1	156.1	0	0	0	0	0	108.3
331	N	35.9	Very low	39.3	Very low	157 Å²	157	144.1 Å²	144.1	84%	0.84	79%	0.788	S	S	*	*			trans	-138.3	140.6	-163.1	-174.8	11.4	0	0	0	112.1
332	M	41.1	Very low	39	Very low	143 Å²	143	142.8 Å²	142.8	70%	0.704	79%	0.785	S	S	*	*			trans	150.2	135.1	143.5	-84.4	-151.3	170.4	0	0	116.5
333	K	38.1	Very low	38.6	Very low	163 Å²	163	145 Å²	145	71%	0.709	79%	0.79	S	S	*	*			trans	64.3	91.7	136.9	-65.6	177	178.3	172.5	0	122.8
334	S	33.5	Very low	38.4	Very low	106 Å²	106	143.2 Å²	143.2	74%	0.741	79%	0.787	S	S	*	*				33.1	120.9	114	62.7	0	0	0	0	122.4
335	V	41.8	Very low	38.3	Very low	150 Å²	150	143 Å²	143	91%	0.909	79%	0.79	S	S	*	*			trans	-147.3	144	140.3	-178	0	0	0	0	108.8
336	D	35.6	Very low	37.9	Very low	152 Å²	152	141.4 Å²	141.4	81%	0.813	79%	0.791	S	S	*	*			trans	-75.2	148.1	179.5	-70.6	-75.3	0	0	0	115.3
337	S	39.7	Very low	38	Very low	122 Å²	122	141.5 Å²	141.5	85%	0.853	80%	0.795	S	S	*	*			trans	-162.7	127	154.8	-83.1	0	0	0	0	113.3
338	K	35.9	Very low	38	Very low	213 Å²	213	138.8 Å²	138.8	93%	0.926	78%	0.784	S	S	*	*			trans	-3.5	133.2	168.7	-70.9	176.3	172.6	177.8	0	119.8
339	A	32.9	Very low	38.1	Very low	102 Å²	102	137 Å²	137	84%	0.843	78%	0.778	S	S	*	*			trans	-91.5	145.7	164.3	0	0	0	0	0	113.2
340	E	33.3	Very low	39	Very low	179 Å²	179	134.5 Å²	134.5	84%	0.836	77%	0.771	S	S	*	*			trans	-111.7	153.3	161.5	-82.2	-83.1	142.2	0	0	108.3
341	P	40.9	Very low	39.6	Very low	119 Å²	119	138 Å²	138	77%	0.773	77%	0.77	S	S	*	*			trans	-80.5	142.2	-176	32.2	-34.6	0	0	0	113.5
342	E	36.2	Very low	41.3	Very low	181 Å²	181	132.7 Å²	132.7	85%	0.846	75%	0.746	S	S	*	*			trans	-74.7	134.1	-177.9	-60.1	-171.5	154.4	0	0	113.9
343	D	33	Very low	42.4	Very low	143 Å²	143	133.3 Å²	133.3	77%	0.765	75%	0.751	S	S	*	*			trans	-92	98.2	169.4	-172.5	17.2	0	0	0	110.3	T345	D343-T345 VanDerWaalsContact C-N 3.32Å; D343-T345 PolarHBondContact O-N 3.48Å; D343-T345 PolarHBondContact O-OG1 2.68Å
344	I	36.3	Very low	43.3	Very low	142 Å²	142	130.4 Å²	130.4	73%	0.728	74%	0.743	S	S	*	*			trans	-69.6	84.9	-174.6	-54.1	178.3	0	0	0	110.9	T346	I344-T346 HydrophobicContact CG2-CG2 4.49Å
345	T	38.4	Very low	44.7	Very low	109 Å²	109	126.9 Å²	126.9	67%	0.669	72%	0.72	S	S	*	*			trans	-89.9	110.2	162.3	30.4	0	0	0	0	109.5	D343 V347	D343-T345 VanDerWaalsContact C-N 3.32Å; D343-T345 PolarHBondContact O-N 3.48Å; D343-T345 PolarHBondContact O-OG1 2.68Å; T345-V347 PolarHBondContact O-N 3.47Å
346	T	38.2	Very low	46	Very low	115 Å²	115	122.8 Å²	122.8	71%	0.706	70%	0.698	S	S	*	*			trans	-68.5	95.2	179.1	38.6	0	0	0	0	111.5	I344 F348	I344-T346 HydrophobicContact CG2-CG2 4.49Å; T346-F348 PolarHBondContact O-N 3.33Å; T346-F348 VanDerWaalsContact O-N 3.11Å
347	V	41.6	Very low	47.5	Very low	133 Å²	133	118.4 Å²	118.4	81%	0.806	68%	0.683	S	S	*	*			trans	-66.2	105.8	171.3	-178.6	0	0	0	0	108.8	T345 A349	T345-V347 PolarHBondContact O-N 3.47Å; V347-A349 PolarHBondContact O-N 3.35Å
348	F	42.1	Very low	48.7	Very low	131 Å²	131	117 Å²	117	58%	0.575	67%	0.665	S	S	*	*			trans	-63.5	132	166.4	-76	-88.6	0	0	0	109.2	T346	T346-F348 PolarHBondContact O-N 3.33Å; T346-F348 VanDerWaalsContact O-N 3.11Å
349	A	47	Very low	50.5	Low	69 Å²	69	109.4 Å²	109.4	57%	0.57	64%	0.642	S	S	*	*			trans	-54.9	135	176.4	0	0	0	0	0	110.4	V347 N351 S352	V347-A349 PolarHBondContact O-N 3.35Å; A349-N351 PolarHBondContact O-N 3.07Å; A349-S352 PolarHBondContact O-N 3.36Å; A349-S352 VanDerWaalsContact O-N 3.1Å
350	P	53.6	Low	52.5	Low	113 Å²	113	109.3 Å²	109.3	73%	0.734	63%	0.627	S	S	*	*	T	Hydrogen-bonded Turn	trans	-63.6	-15	-165.8	22.8	-33.9	0	0	0	114.7
351	N	56.8	Low	54.2	Low	155 Å²	155	103.6 Å²	103.6	83%	0.829	61%	0.611	S	S	*	*	T	Hydrogen-bonded Turn	trans	-97.8	10.5	-177.6	-57.9	3.8	0	0	0	113.1	A349	A349-N351 PolarHBondContact O-N 3.07Å
352	S	72.1	Confident	55.8	Low	46 Å²	46	105 Å²	105	32%	0.322	61%	0.605	S	S	.	*			trans	-73.7	135.7	176.5	-176.9	0	0	0	0	112.1	A349 L354 A355 S356	A349-S352 PolarHBondContact O-N 3.36Å; A349-S352 VanDerWaalsContact O-N 3.1Å; S352-L354 PolarHBondContact O-N 3.33Å; S352-L354 VanDerWaalsContact O-N 3.13Å; S352-L354 PolarHBondContact OG-N 3.03Å; S352-A355 WeakPolarHBondContact O-CB 3.39Å; S352-A355 PolarHBondContact O-N 3.47Å; S352-S356 PolarHBondContact O-N 3.3Å; S352-S356 VanDerWaalsContact O-N 3.13Å
353	L	63.4	Low	57.6	Low	156 Å²	156	98.9 Å²	98.9	82%	0.817	59%	0.586	S	S	*	*	H	α-helix	trans	-48.5	-38.4	170	-97.2	164.7	0	0	0	112.7	S356 A357	L353-S356 PolarHBondContact O-N 3.09Å; L353-A357 WeakPolarHBondContact O-CB 3.48Å; L353-A357 PolarHBondContact O-N 3.2Å
354	L	56.6	Low	59.5	Low	103 Å²	103	96.3 Å²	96.3	54%	0.539	58%	0.575	S	S	.	*	H	α-helix	trans	-68	-38	179.4	-149.8	170.9	0	0	0	111.2	S352 A357 L358	S352-L354 PolarHBondContact O-N 3.33Å; S352-L354 VanDerWaalsContact O-N 3.13Å; S352-L354 PolarHBondContact OG-N 3.03Å; L354-A357 PolarHBondContact O-N 3.23Å; L354-L358 HydrophobicContact CD2-CD1 4.49Å; L354-L358 WeakPolarHBondContact O-CB 3.21Å; L354-L358 PolarHBondContact O-N 3.15Å
355	A	63	Low	60.6	Low	31 Å²	31	92.1 Å²	92.1	26%	0.256	56%	0.561	S	S	.	*	H	α-helix	trans	-66.1	-42.6	176.2	0	0	0	0	0	111.7	S352 L358 A359	S352-A355 WeakPolarHBondContact O-CB 3.39Å; S352-A355 PolarHBondContact O-N 3.47Å; A355-L358 PolarHBondContact O-N 2.87Å; A355-A359 WeakPolarHBondContact O-CB 3.34Å; A355-A359 PolarHBondContact O-N 3.27Å
356	S	68.8	Low	62.2	Low	64 Å²	64	89.7 Å²	89.7	45%	0.448	55%	0.552	S	S	.	*	H	α-helix	trans	-62.5	-46	174.8	-177.5	0	0	0	0	112	S352 L353 L358 A359 N360	S352-S356 PolarHBondContact O-N 3.3Å; S352-S356 VanDerWaalsContact O-N 3.13Å; L353-S356 PolarHBondContact O-N 3.09Å; S356-L358 VanDerWaalsContact C-N 3.31Å; S356-L358 PolarHBondContact O-N 3.2Å; S356-A359 WeakPolarHBondContact O-CB 3.46Å; S356-A359 PolarHBondContact O-N 2.82Å; S356-A359 VanDerWaalsContact O-N 3.17Å; S356-N360 PolarHBondContact O-N 3.29Å
357	A	68.4	Low	63.7	Low	60 Å²	60	88.3 Å²	88.3	50%	0.496	54%	0.544	S	S	.	.	H	α-helix	trans	-59.4	-40.2	175.6	0	0	0	0	0	112.6	L353 L354 N360 A361	L353-A357 WeakPolarHBondContact O-CB 3.48Å; L353-A357 PolarHBondContact O-N 3.2Å; L354-A357 PolarHBondContact O-N 3.23Å; A357-N360 PolarHBondContact O-N 3.27Å; A357-A361 WeakPolarHBondContact O-CB 3.27Å; A357-A361 PolarHBondContact O-N 3.07Å
358	L	65.3	Low	64.8	Low	93 Å²	93	87.3 Å²	87.3	49%	0.487	53%	0.533	S	S	.	.	H	α-helix	trans	-71.8	-31	177.9	-137.1	171.3	0	0	0	112.3	L354 A355 S356 K362	L354-L358 HydrophobicContact CD2-CD1 4.49Å; L354-L358 WeakPolarHBondContact O-CB 3.21Å; L354-L358 PolarHBondContact O-N 3.15Å; A355-L358 PolarHBondContact O-N 2.87Å; S356-L358 VanDerWaalsContact C-N 3.31Å; S356-L358 PolarHBondContact O-N 3.2Å; L358-K362 HydrophobicContact CD2-CD 4.4Å; L358-K362 HydrophobicContact CD2-CG 4.4Å; L358-K362 WeakPolarHBondContact O-CG 3.41Å; L358-K362 PolarHBondContact O-N 3.19Å
359	A	73.6	Confident	65.9	Low	53 Å²	53	86 Å²	86	44%	0.438	54%	0.536	S	S	.	.	H	α-helix	trans	-67.5	-48.2	171.5	0	0	0	0	0	111.4	A355 S356 A361 K362 A363	A355-A359 WeakPolarHBondContact O-CB 3.34Å; A355-A359 PolarHBondContact O-N 3.27Å; S356-A359 WeakPolarHBondContact O-CB 3.46Å; S356-A359 PolarHBondContact O-N 2.82Å; S356-A359 VanDerWaalsContact O-N 3.17Å; A359-A361 PolarHBondContact O-N 2.88Å; A359-K362 WeakPolarHBondContact O-CB 3.32Å; A359-K362 PolarHBondContact O-N 2.91Å; A359-K362 VanDerWaalsContact O-N 3.16Å; A359-A363 PolarHBondContact O-N 2.86Å
360	N	73.5	Confident	66.8	Low	100 Å²	100	85.9 Å²	85.9	54%	0.535	53%	0.534	S	S	.	.	H	α-helix	trans	-61.5	-43.3	177.9	-68.7	-5.7	0	0	0	111.6	S356 A357 K362 A363 V364	S356-N360 PolarHBondContact O-N 3.29Å; A357-N360 PolarHBondContact O-N 3.27Å; N360-K362 VanDerWaalsContact C-N 3.31Å; N360-K362 PolarHBondContact O-N 2.94Å; N360-A363 PolarHBondContact O-N 3.38Å; N360-A363 VanDerWaalsContact O-N 3.14Å; N360-V364 WeakPolarHBondContact O-CG2 3.36Å; N360-V364 PolarHBondContact O-N 3.36Å
361	A	69.4	Low	67.1	Low	60 Å²	60	84.2 Å²	84.2	50%	0.496	53%	0.526	S	S	.	.	H	α-helix	trans	-61	-36.9	175.4	0	0	0	0	0	113	A357 A359 A365	A357-A361 WeakPolarHBondContact O-CB 3.27Å; A357-A361 PolarHBondContact O-N 3.07Å; A359-A361 PolarHBondContact O-N 2.88Å; A361-A365 WeakPolarHBondContact O-CB 3.48Å; A361-A365 PolarHBondContact O-N 3.17Å
362	K	74.8	Confident	66.8	Low	147 Å²	147	86.1 Å²	86.1	64%	0.639	53%	0.526	S	S	*	.	H	α-helix	trans	-67.8	-40.9	172.5	-77.2	174	177.1	176.9	0	112.2	L358 A359 N360 A365 A366	L358-K362 HydrophobicContact CD2-CD 4.4Å; L358-K362 HydrophobicContact CD2-CG 4.4Å; L358-K362 WeakPolarHBondContact O-CG 3.41Å; L358-K362 PolarHBondContact O-N 3.19Å; A359-K362 WeakPolarHBondContact O-CB 3.32Å; A359-K362 PolarHBondContact O-N 2.91Å; A359-K362 VanDerWaalsContact O-N 3.16Å; N360-K362 VanDerWaalsContact C-N 3.31Å; N360-K362 PolarHBondContact O-N 2.94Å; K362-A365 PolarHBondContact O-N 2.8Å; K362-A366 WeakPolarHBondContact O-CB 3.39Å; K362-A366 PolarHBondContact O-N 3.06Å
363	A	74	Confident	65.7	Low	54 Å²	54	89 Å²	89	45%	0.446	55%	0.547	S	S	.	.	H	α-helix	trans	-62.1	-49.9	179.3	0	0	0	0	0	111.4	A359 N360 A365 A366 T367	A359-A363 PolarHBondContact O-N 2.86Å; N360-A363 PolarHBondContact O-N 3.38Å; N360-A363 VanDerWaalsContact O-N 3.14Å; A363-A365 VanDerWaalsContact C-N 3.33Å; A363-A365 PolarHBondContact O-N 2.83Å; A363-A366 WeakPolarHBondContact O-CB 2.98Å; A363-A366 PolarHBondContact O-N 3.08Å; A363-A366 VanDerWaalsContact O-N 3.11Å; A363-T367 PolarHBondContact O-N 3.3Å; A363-T367 PolarHBondContact O-OG1 2.95Å
364	V	73.3	Confident	64.8	Low	89 Å²	89	84.6 Å²	84.6	54%	0.539	54%	0.539	S	S	.	.	H	α-helix	trans	-58	-44.5	176.3	176.9	0	0	0	0	111.3	N360 A366 T367 I368	N360-V364 WeakPolarHBondContact O-CG2 3.36Å; N360-V364 PolarHBondContact O-N 3.36Å; V364-A366 VanDerWaalsContact C-N 3.33Å; V364-A366 PolarHBondContact O-N 2.78Å; V364-T367 PolarHBondContact O-N 3.36Å; V364-I368 HydrophobicContact CG1-CD1 3.88Å; V364-I368 WeakPolarHBondContact O-CG1 3.32Å; V364-I368 PolarHBondContact O-N 3.42Å
365	A	59.2	Low	63.7	Low	53 Å²	53	88.1 Å²	88.1	44%	0.438	56%	0.555	S	S	.	*	H	α-helix	trans	-63.1	-37	177	0	0	0	0	0	112.9	A361 K362 A363 T369	A361-A365 WeakPolarHBondContact O-CB 3.48Å; A361-A365 PolarHBondContact O-N 3.17Å; K362-A365 PolarHBondContact O-N 2.8Å; A363-A365 VanDerWaalsContact C-N 3.33Å; A363-A365 PolarHBondContact O-N 2.83Å; A365-T369 WeakPolarHBondContact O-CB 3.37Å; A365-T369 PolarHBondContact O-N 2.94Å; A365-T369 VanDerWaalsContact O-N 3.15Å; A365-T369 PolarHBondContact O-OG1 3.23Å
366	A	70.8	Confident	62.4	Low	58 Å²	58	94.5 Å²	94.5	48%	0.479	58%	0.583	S	S	.	*	H	α-helix	trans	-66.6	-45.1	174.6	0	0	0	0	0	111.4	K362 A363 V364 T369 A370	K362-A366 WeakPolarHBondContact O-CB 3.39Å; K362-A366 PolarHBondContact O-N 3.06Å; A363-A366 WeakPolarHBondContact O-CB 2.98Å; A363-A366 PolarHBondContact O-N 3.08Å; A363-A366 VanDerWaalsContact O-N 3.11Å; V364-A366 VanDerWaalsContact C-N 3.33Å; V364-A366 PolarHBondContact O-N 2.78Å; A366-T369 WeakPolarHBondContact O-CB 3.39Å; A366-T369 PolarHBondContact O-N 2.95Å; A366-A370 WeakPolarHBondContact O-CB 3.49Å; A366-A370 PolarHBondContact O-N 3.28Å
367	T	70.9	Confident	60.8	Low	87 Å²	87	97.4 Å²	97.4	53%	0.534	60%	0.598	S	S	.	*	H	α-helix	trans	-60.1	-47.6	176.7	-55.8	0	0	0	0	111.7	A363 V364 T369 A370 S371	A363-T367 PolarHBondContact O-N 3.3Å; A363-T367 PolarHBondContact O-OG1 2.95Å; V364-T367 PolarHBondContact O-N 3.36Å; T367-T369 PolarHBondContact O-N 3.21Å; T367-A370 PolarHBondContact O-N 3.46Å; T367-A370 VanDerWaalsContact O-N 3.14Å; T367-S371 PolarHBondContact O-N 3.34Å; T367-S371 PolarHBondContact O-OG 3.06Å; T367-S371 VanDerWaalsContact O-OG 3.11Å
368	I	64	Low	59.1	Low	111 Å²	111	101.4 Å²	101.4	57%	0.569	61%	0.611	S	S	*	*	H	α-helix	trans	-58.7	-37.8	176.6	-67.9	167.5	0	0	0	111.4	V364 K372	V364-I368 HydrophobicContact CG1-CD1 3.88Å; V364-I368 WeakPolarHBondContact O-CG1 3.32Å; V364-I368 PolarHBondContact O-N 3.42Å; I368-K372 PolarHBondContact O-N 3.37Å
369	T	64.9	Low	57.6	Low	105 Å²	105	105.9 Å²	105.9	64%	0.644	63%	0.63	S	S	*	*	H	α-helix	trans	-69.7	-41.4	177.4	-53.7	0	0	0	0	111.7	A365 A366 T367	A365-T369 WeakPolarHBondContact O-CB 3.37Å; A365-T369 PolarHBondContact O-N 2.94Å; A365-T369 VanDerWaalsContact O-N 3.15Å; A365-T369 PolarHBondContact O-OG1 3.23Å; A366-T369 WeakPolarHBondContact O-CB 3.39Å; A366-T369 PolarHBondContact O-N 2.95Å; T367-T369 PolarHBondContact O-N 3.21Å
370	A	66.4	Low	55.7	Low	65 Å²	65	110.7 Å²	110.7	54%	0.537	65%	0.647	S	S	.	*	H	α-helix	trans	-68.1	-46.5	178.9	0	0	0	0	0	112.3	A366 T367 K372 S373 G374	A366-A370 WeakPolarHBondContact O-CB 3.49Å; A366-A370 PolarHBondContact O-N 3.28Å; T367-A370 PolarHBondContact O-N 3.46Å; T367-A370 VanDerWaalsContact O-N 3.14Å; A370-K372 PolarHBondContact O-N 3.1Å; A370-S373 PolarHBondContact O-N 2.87Å; A370-G374 PolarHBondContact O-N 3.11Å
371	S	59.5	Low	53.9	Low	79 Å²	79	110.7 Å²	110.7	55%	0.552	66%	0.655	S	S	*	*	H	α-helix	trans	-57.3	-33.2	178.4	-61.8	0	0	0	0	112.4	T367 S373	T367-S371 PolarHBondContact O-N 3.34Å; T367-S371 PolarHBondContact O-OG 3.06Å; T367-S371 VanDerWaalsContact O-OG 3.11Å; S371-S373 PolarHBondContact O-N 3.1Å
372	K	50.9	Low	52.3	Low	194 Å²	194	117 Å²	117	84%	0.843	67%	0.671	S	S	*	*	T	Hydrogen-bonded Turn	trans	-78.6	-2.8	178.4	-137	173	-171.7	176.9	0	114.6	I368 A370	I368-K372 PolarHBondContact O-N 3.37Å; A370-K372 PolarHBondContact O-N 3.1Å
373	S	48	Very low	50.5	Low	108 Å²	108	117 Å²	117	76%	0.755	68%	0.683	S	S	*	*	T	Hydrogen-bonded Turn	trans	-113.2	-1.8	179.1	-169.8	0	0	0	0	113.7	A370 S371	A370-S373 PolarHBondContact O-N 2.87Å; S371-S373 PolarHBondContact O-N 3.1Å
374	G	44.6	Very low	48.4	Very low	63 Å²	63	117.5 Å²	117.5	65%	0.649	69%	0.694	S	S	*	*	S	Bend	trans	-108.2	-1.2	-166.2	0	0	0	0	0	117.4	A370	A370-G374 PolarHBondContact O-N 3.11Å
375	M	33.6	Very low	46.7	Very low	177 Å²	177	120.3 Å²	120.3	87%	0.872	71%	0.711	S	S	*	*			trans	-121.2	59.7	-170.8	-68	-171.1	71.9	0	0	114.2
376	I	37.2	Very low	45.3	Very low	164 Å²	164	124.7 Å²	124.7	84%	0.841	73%	0.727	S	S	*	*			trans	-144.7	85.9	161.8	-49.5	178.7	0	0	0	110.6
377	T	34.2	Very low	43.9	Very low	126 Å²	126	127.7 Å²	127.7	77%	0.773	74%	0.742	S	S	*	*			trans	-170.7	149.4	146.1	22.8	0	0	0	0	110.2
378	D	32.5	Very low	42.1	Very low	143 Å²	143	128.1 Å²	128.1	77%	0.765	75%	0.748	S	S	*	*			trans	51.1	105.2	153.7	-51.7	-21.9	0	0	0	120.2
379	E	33.3	Very low	40.9	Very low	188 Å²	188	129.7 Å²	129.7	88%	0.879	76%	0.763	S	S	*	*				-156.7	134.5	109.4	-95.2	-104.8	91	0	0	109.7
380	L	35.1	Very low	39.8	Very low	154 Å²	154	130.3 Å²	130.3	81%	0.806	77%	0.766	S	S	*	*			trans	-119.4	125.5	162.8	-85.7	88.3	0	0	0	108
381	S	34.7	Very low	38.8	Very low	99 Å²	99	132.1 Å²	132.1	69%	0.692	77%	0.773	S	S	*	*				155.6	161.6	111.1	64.2	0	0	0	0	114.8
382	K	37.4	Very low	37.8	Very low	192 Å²	192	137.8 Å²	137.8	84%	0.835	79%	0.79	S	S	*	*			trans	76.8	158.2	158	-66.3	171.6	-178.3	174.7	0	119.2
383	V	35.7	Very low	36.9	Very low	148 Å²	148	137.7 Å²	137.7	90%	0.897	79%	0.789	S	S	*	*			trans	67	116.3	173.7	-161.9	0	0	0	0	116.4
384	G	31.2	Very low	36.1	Very low	65 Å²	65	138.8 Å²	138.8	67%	0.67	80%	0.796	S	S	*	*			trans	-148	166.2	155.1	0	0	0	0	0	108.2
385	T	37.4	Very low	35.4	Very low	147 Å²	147	144.8 Å²	144.8	90%	0.902	81%	0.807	S	S	*	*			trans	-165.5	135.3	164.7	-73.9	0	0	0	0	108.2
386	D	29.7	Very low	35.7	Very low	145 Å²	145	141.1 Å²	141.1	78%	0.775	80%	0.796	S	S	*	*			trans	-90	161	174.3	-117.5	-38.2	0	0	0	109.5
387	P	41.3	Very low	35.7	Very low	122 Å²	122	138.2 Å²	138.2	79%	0.792	79%	0.791	S	S	*	*				-155.9	174.7	71.8	41.3	-20.1	0	0	0	119.1
388	S	31.5	Very low	36	Very low	95 Å²	95	141.1 Å²	141.1	66%	0.664	80%	0.795	S	S	*	*			trans	-73.2	157.8	179.3	77.7	0	0	0	0	116.4
389	V	39	Very low	36.1	Very low	145 Å²	145	141.8 Å²	141.8	88%	0.879	80%	0.799	S	S	*	*			trans	-133.8	148.2	150.9	-179	0	0	0	0	109.8
390	V	43.4	Very low	36.5	Very low	117 Å²	117	139.1 Å²	139.1	71%	0.709	80%	0.795	S	S	*	*			trans	-154.9	-172.9	-176.9	-122.1	0	0	0	0	107.4
391	P	45.3	Very low	36.7	Very low	104 Å²	104	137.3 Å²	137.3	68%	0.675	80%	0.795	S	S	*	*			cis	-123.6	-166.4	-40.5	38.6	-23.2	0	0	0	110.8
392	H	38.6	Very low	37	Very low	198 Å²	198	138.7 Å²	138.7	92%	0.917	80%	0.802	S	S	*	*			trans	-145.3	160.1	145.2	-107.2	-80.8	0	0	0	111
393	K	31.7	Very low	37.1	Very low	191 Å²	191	133.4 Å²	133.4	83%	0.83	80%	0.802	S	S	*	*			trans	-157.7	138.9	-157.6	178.9	-168.4	-178.4	-169.1	0	110.9
394	C	31.8	Very low	37.1	Very low	132 Å²	132	132.2 Å²	132.2	89%	0.892	80%	0.8	S	S	*	*			trans	-155.7	133.2	166.3	-98.3	0	0	0	0	113.5
395	E	29.2	Very low	37.5	Very low	188 Å²	188	134.7 Å²	134.7	88%	0.879	80%	0.804	S	S	*	*			trans	-168.8	163	167.7	-113	-168.8	-134.2	0	0	104.9
396	P	39.1	Very low	37.5	Very low	100 Å²	100	137.5 Å²	137.5	65%	0.649	80%	0.804	S	S	*	*			cis	-152.8	-158.9	43.3	42.4	-19.3	0	0	0	116.3
397	S	36.9	Very low	37.7	Very low	103 Å²	103	139.8 Å²	139.8	72%	0.72	81%	0.81	S	S	*	*			trans	75.3	152.7	147	71.4	0	0	0	0	119.1
398	E	40.6	Very low	37.5	Very low	187 Å²	187	142.4 Å²	142.4	87%	0.874	82%	0.816	S	S	*	*			cis	-132.1	-165.1	9.6	-75.4	-171.3	146.7	0	0	113.7
399	D	35.3	Very low	37.6	Very low	158 Å²	158	142 Å²	142	85%	0.845	82%	0.819	S	S	*	*			trans	-100.6	-175.6	-159.1	-88.8	-65.8	0	0	0	118.2
400	V	41.5	Very low	37.4	Very low	131 Å²	131	143.5 Å²	143.5	79%	0.794	82%	0.817	S	S	*	*			trans	105.7	92.2	150.7	-167.5	0	0	0	0	119.4
401	S	38.8	Very low	37.1	Very low	116 Å²	116	142.4 Å²	142.4	81%	0.811	81%	0.812	S	S	*	*				41.3	155.4	127.4	-71	0	0	0	0	125
402	P	42.2	Very low	36.8	Very low	129 Å²	129	143.1 Å²	143.1	84%	0.838	81%	0.81	S	S	*	*			trans	-111.4	167.4	-153.3	41.9	-34.5	0	0	0	117
403	G	38.2	Very low	36.9	Very low	80 Å²	80	140.7 Å²	140.7	83%	0.825	80%	0.799	S	S	*	*			trans	-139.3	157	165.1	0	0	0	0	0	111.5
404	S	36.6	Very low	37.2	Very low	123 Å²	123	137.4 Å²	137.4	86%	0.86	79%	0.789	S	S	*	*			trans	-124.7	-172.4	-168.2	76.3	0	0	0	0	112.6
405	P	38.9	Very low	37.6	Very low	117 Å²	117	138.6 Å²	138.6	76%	0.76	79%	0.787	S	S	*	*				-102.8	168.1	-119.7	40.1	-31.7	0	0	0	115.2
406	K	38.7	Very low	37.8	Very low	206 Å²	206	136.1 Å²	136.1	90%	0.896	78%	0.779	S	S	*	*			trans	-132.2	134.2	162.1	-74.5	-172.9	175.8	-179.6	0	111.4
407	Q	33.1	Very low	38	Very low	193 Å²	193	139.8 Å²	139.8	90%	0.902	79%	0.792	S	S	*	*			trans	-79.8	149.1	161.7	-67.7	172.1	-29	0	0	109.2
408	L	36.4	Very low	38	Very low	177 Å²	177	139.2 Å²	139.2	93%	0.927	79%	0.788	S	S	*	*			trans	-146.6	132	158.9	-107.2	162.9	0	0	0	107.2
409	A	33.7	Very low	37.9	Very low	88 Å²	88	136.9 Å²	136.9	73%	0.727	78%	0.781	S	S	*	*			trans	-123	151.1	173.7	0	0	0	0	0	108.3
410	E	35.4	Very low	38.2	Very low	176 Å²	176	135 Å²	135	82%	0.822	78%	0.776	S	S	*	*			trans	-159.4	154.6	155.3	-101.1	-63.4	98	0	0	107.3
411	P	37.6	Very low	38	Very low	93 Å²	93	133.2 Å²	133.2	60%	0.604	77%	0.769	S	S	*	*			trans	-110.6	-151.9	-166.5	43	-34.8	0	0	0	113.3
412	N	39.1	Very low	37.9	Very low	119 Å²	119	135.1 Å²	135.1	64%	0.636	77%	0.77	S	S	*	*			trans	94.5	142.4	175.1	-52	-63.7	0	0	0	115.5
413	Q	39.3	Very low	37.7	Very low	148 Å²	148	139.1 Å²	139.1	69%	0.692	77%	0.774	S	S	*	*			cis	-158.1	152.6	-11.8	-116.2	168	47.2	0	0	110.9
414	I	38.2	Very low	37.4	Very low	122 Å²	122	144 Å²	144	63%	0.626	77%	0.773	S	S	*	*			trans	40.4	119.1	143.2	-60	160.8	0	0	0	119
415	D	40.9	Very low	37.5	Very low	157 Å²	157	143.7 Å²	143.7	84%	0.84	77%	0.767	S	S	*	*				-154.1	156.3	110.8	-125.8	-29.6	0	0	0	113.2
416	N	34.5	Very low	37.2	Very low	135 Å²	135	144.3 Å²	144.3	72%	0.722	76%	0.764	S	S	*	*			trans	-114.7	153.7	-168.8	-64.5	-80.1	0	0	0	113.9
417	I	41.3	Very low	37.2	Very low	177 Å²	177	146.3 Å²	146.3	91%	0.908	77%	0.766	S	S	*	*			trans	-157.1	149.5	143.1	-101.4	148.6	0	0	0	108.2
418	S	37.9	Very low	37	Very low	91 Å²	91	143.2 Å²	143.2	64%	0.636	76%	0.761	S	S	*	*			trans	-116.9	-178.9	-156.7	49.7	0	0	0	0	115.5
419	D	39.2	Very low	37	Very low	138 Å²	138	140.6 Å²	140.6	74%	0.738	75%	0.752	S	S	*	*			trans	84.3	139.1	154.8	-55.1	-48.3	0	0	0	118.7
420	V	40	Very low	37.1	Very low	120 Å²	120	144.9 Å²	144.9	73%	0.727	76%	0.757	S	S	*	*			cis	-154.9	154.9	-2.9	104.4	0	0	0	0	113.9
421	S	38.9	Very low	36.8	Very low	93 Å²	93	144.1 Å²	144.1	65%	0.65	75%	0.753	S	S	*	*			trans	24.8	118.4	166	72.2	0	0	0	0	121.4
422	N	34.9	Very low	36.5	Very low	156 Å²	156	146.3 Å²	146.3	83%	0.834	76%	0.76	S	S	*	*				67.2	113.1	73.3	-83.4	-37.5	0	0	0	118.2
423	K	38.4	Very low	36.1	Very low	213 Å²	213	145.7 Å²	145.7	93%	0.926	77%	0.765	S	S	*	*				-168.7	142.3	110.1	-102.8	164.3	-175.7	174.5	0	114.6
424	K	32	Very low	35.7	Very low	183 Å²	183	147 Å²	147	80%	0.796	77%	0.771	S	S	*	*			trans	-115.9	-170.5	171.8	-111	-169.3	179.3	-163.9	0	107.5
425	P	39.7	Very low	35.4	Very low	115 Å²	115	147 Å²	147	75%	0.747	78%	0.782	S	S	*	*			cis	-137.7	-164.7	11.9	41.5	-19.9	0	0	0	116
426	D	31.6	Very low	35.1	Very low	130 Å²	130	149.5 Å²	149.5	70%	0.695	79%	0.785	S	S	*	*			trans	-64.1	162.2	-173.8	-50.7	-97.2	0	0	0	118.2
427	R	38.5	Very low	35	Very low	249 Å²	249	154.9 Å²	154.9	94%	0.94	80%	0.795	S	S	*	*			trans	-151.9	135.3	133.3	-114.3	178.4	-172.4	-173.4	2	112.3
428	T	29.9	Very low	34.6	Very low	127 Å²	127	158 Å²	158	78%	0.779	80%	0.795	S	S	*	*			trans	-92.1	159.9	171.1	38.6	0	0	0	0	111.4
429	V	36.3	Very low	34.3	Very low	122 Å²	122	159 Å²	159	74%	0.739	80%	0.8	S	S	*	*			trans	165.2	132	132	153	0	0	0	0	113.1
430	Q	35.7	Very low	34.1	Very low	178 Å²	178	160.5 Å²	160.5	83%	0.832	81%	0.806	S	S	*	*			trans	60.4	138.7	155.1	-76.5	165.7	-25.2	0	0	125.1
431	E	29.1	Very low	33.9	Very low	160 Å²	160	161.6 Å²	161.6	75%	0.748	81%	0.807	S	S	*	*			trans	-63	148.9	172.9	-54.7	144.6	125.6	0	0	112.6
432	N	30.2	Very low	33.5	Very low	140 Å²	140	168.4 Å²	168.4	75%	0.749	82%	0.818	S	S	*	*				-175.4	165.7	83.9	-102.6	-69.1	0	0	0	115.2
433	S	31.6	Very low	33.3	Very low	105 Å²	105	166.1 Å²	166.1	73%	0.734	81%	0.812	S	S	*	*			trans	68.4	130.6	151.9	49.7	0	0	0	0	123.4
434	E	31.6	Very low	33.1	Very low	177 Å²	177	159.7 Å²	159.7	83%	0.827	80%	0.799	S	S	*	*			trans	74.1	65.5	142.5	-62.4	-161.9	149.2	0	0	123.9
435	S	30.3	Very low	32.9	Very low	122 Å²	122	155.9 Å²	155.9	85%	0.853	80%	0.801	S	S	*	*				30.4	95.9	112.2	-60.3	0	0	0	0	120.9
436	K	35.1	Very low	32.6	Very low	208 Å²	208	161.2 Å²	161.2	90%	0.904	81%	0.808	S	S	*	*			trans	-134.2	67.4	155.3	-77.2	-176.6	-179.6	161	0	114.1
437	R	32.1	Very low	32.6	Very low	248 Å²	248	160 Å²	160	94%	0.936	81%	0.81	S	S	*	*	P	Polyproline II helix	trans	-79.2	123	166.4	-74.7	-172.8	174.7	-170	-1.1	110.7
438	R	33.5	Very low	32.3	Very low	242 Å²	242	155.9 Å²	155.9	91%	0.913	81%	0.806	S	S	*	*	P	Polyproline II helix	trans	-74.3	127.6	173	-66.4	-175.3	179.3	-168	0.3	110.5
439	P	31	Very low	32.5	Very low	114 Å²	114	157.3 Å²	157.3	74%	0.74	81%	0.807	S	S	*	*	P	Polyproline II helix	trans	-84.3	128.9	179.6	31.9	-33.2	0	0	0	112.2
440	I	36.3	Very low	32.2	Very low	168 Å²	168	157.1 Å²	157.1	86%	0.862	81%	0.809	S	S	*	*	P	Polyproline II helix	trans	-81.4	119.8	169.9	-63.7	178.9	0	0	0	109.2	R442	I440-R442 PolarHBondContact O-N 2.83Å
441	I	35.2	Very low	31.9	Very low	144 Å²	144	154.3 Å²	154.3	74%	0.738	81%	0.809	S	S	*	*			trans	-77.5	109.7	-168.4	-61.3	169.4	0	0	0	111.6
442	R	30.6	Very low	32.1	Very low	235 Å²	235	154.4 Å²	154.4	89%	0.887	82%	0.815	S	S	*	*			trans	-80.4	144	162.7	-66.1	179.9	176.4	175	-1.5	111	I440	I440-R442 PolarHBondContact O-N 2.83Å
443	P	31.5	Very low	32	Very low	109 Å²	109	154.7 Å²	154.7	71%	0.708	82%	0.816	S	S	*	*			trans	-100.2	113	151.9	-9.3	28.7	0	0	0	111.6
444	A	32.6	Very low	32.1	Very low	78 Å²	78	156.7 Å²	156.7	65%	0.645	82%	0.824	S	S	*	*			trans	32.1	97.8	155.1	0	0	0	0	0	119.6
445	A	29.4	Very low	32	Very low	103 Å²	103	156.8 Å²	156.8	85%	0.851	83%	0.825	S	S	*	*	P	Polyproline II helix	trans	-71.2	145.5	130.6	0	0	0	0	0	108.2
446	Y	31.9	Very low	32	Very low	227 Å²	227	156.7 Å²	156.7	89%	0.89	82%	0.824	S	S	*	*	P	Polyproline II helix	trans	-88.7	128.4	169.5	-96.7	-83.1	0	0	0	110.3
447	S	32.9	Very low	31.9	Very low	105 Å²	105	152.9 Å²	152.9	73%	0.734	81%	0.813	S	S	*	*	P	Polyproline II helix	trans	-87.3	160.2	-172.3	52.6	0	0	0	0	113.5
448	N	30.6	Very low	31.8	Very low	162 Å²	162	150.2 Å²	150.2	87%	0.866	81%	0.808	S	S	*	*			trans	-43.9	146.7	171.7	-50.3	-26.2	0	0	0	113.4
449	I	34.9	Very low	31.7	Very low	156 Å²	156	148.9 Å²	148.9	80%	0.8	80%	0.803	S	S	*	*			trans	-120.1	140.6	161.4	-65	178.4	0	0	0	106.7
450	P	30.5	Very low	31.8	Very low	118 Å²	118	154.9 Å²	154.9	77%	0.766	81%	0.811	S	S	*	*			trans	-75.9	156.2	-168.8	-13.6	29.9	0	0	0	113.7
451	S	28.2	Very low	31.4	Very low	119 Å²	119	158.1 Å²	158.1	83%	0.832	81%	0.813	S	S	*	*			trans	-62.1	138.8	164.7	-51	0	0	0	0	111.1
452	N	34.3	Very low	31.3	Very low	163 Å²	163	159.8 Å²	159.8	87%	0.872	82%	0.817	S	S	*	*			trans	-150.8	149.9	157.7	-117.6	-22.4	0	0	0	110.5
453	N	28.5	Very low	31.6	Very low	146 Å²	146	158.1 Å²	158.1	78%	0.781	82%	0.819	S	S	*	*			trans	-79.9	143.4	-168.9	-56.9	-38	0	0	0	112.6
454	T	33.3	Very low	31.7	Very low	146 Å²	146	161.7 Å²	161.7	90%	0.896	82%	0.818	S	S	*	*				-173	160.4	120.4	18.1	0	0	0	0	111.9
455	E	29	Very low	31.9	Very low	180 Å²	180	165.6 Å²	165.6	84%	0.841	82%	0.823	S	S	*	*			trans	-84.2	175.7	-169.4	-67.2	170.1	92.5	0	0	115
456	S	30.1	Very low	32.1	Very low	119 Å²	119	165.6 Å²	165.6	83%	0.832	80%	0.804	S	S	*	*			trans	72.7	152.2	164.2	77.3	0	0	0	0	116.8
457	D	33.6	Very low	32.2	Very low	128 Å²	128	164 Å²	164	68%	0.684	80%	0.797	S	S	*	*			cis	-139.6	157.7	9.7	-164.6	7.5	0	0	0	113.3
458	K	30.1	Very low	32.2	Very low	193 Å²	193	164.3 Å²	164.3	84%	0.839	80%	0.8	S	S	*	*			trans	-111.5	86.7	177.2	-74.4	179.1	-179.9	168.6	0	111.7
459	R	31.8	Very low	32.3	Very low	214 Å²	214	161.3 Å²	161.3	81%	0.808	79%	0.791	S	S	*	*			trans	-158.4	141.2	169	-95.6	119	-167	-114	3.3	109.1
460	R	32.2	Very low	32.3	Very low	239 Å²	239	163.7 Å²	163.7	90%	0.902	80%	0.796	S	S	*	*			cis	-138.3	148.4	3.4	-87.9	158.2	166.7	157.5	-7.2	110.2
461	R	29.3	Very low	32.4	Very low	237 Å²	237	166.8 Å²	166.8	89%	0.894	80%	0.797	S	S	*	*			trans	-132.6	110.7	152.2	-97.2	-168.7	177	-172.7	0.8	108.2
462	H	33.1	Very low	32.9	Very low	179 Å²	179	169.4 Å²	169.4	83%	0.829	80%	0.796	S	S	*	*			trans	-164.5	117.9	152.9	-87.5	-52	0	0	0	109.5
463	H	36.4	Very low	33	Very low	199 Å²	199	169.8 Å²	169.8	92%	0.921	79%	0.792	S	S	*	*				-134.7	147.2	119.2	-107.7	-78.6	0	0	0	108.6
464	R	32.4	Very low	33.1	Very low	184 Å²	184	172.6 Å²	172.6	69%	0.694	79%	0.793	S	S	*	*			trans	-113	159.3	-174	176.6	-169.5	-170.8	-168.8	8.5	107.2
465	H	37.1	Very low	33.1	Very low	160 Å²	160	172.4 Å²	172.4	74%	0.741	79%	0.787	S	S	*	*			trans	146.2	150.7	144.8	-90	-105.1	0	0	0	110.7
466	K	34.1	Very low	33.2	Very low	104 Å²	104	168.5 Å²	168.5	45%	0.452	78%	0.779	S	S	.	*			cis	-171.8	137.8	-41.7	-137.6	178.9	167.3	-157.5	0	108.1
467	Y	33.3	Very low	33.4	Very low	192 Å²	192	170 Å²	170	75%	0.753	78%	0.776	S	S	*	*			trans	63.1	164.9	171.4	-51.1	-66.9	0	0	0	116.1
468	S	33.9	Very low	33.2	Very low	113 Å²	113	168.6 Å²	168.6	79%	0.79	78%	0.776	S	S	*	*			cis	-140.6	169.6	-7.5	-153	0	0	0	0	112
469	S	31.5	Very low	33.1	Very low	98 Å²	98	164.5 Å²	164.5	69%	0.685	77%	0.772	S	S	*	*			trans	-94	148.9	175.4	-176.8	0	0	0	0	112.4
470	K	36.1	Very low	33.3	Very low	206 Å²	206	160.1 Å²	160.1	90%	0.896	78%	0.775	S	S	*	*			trans	-150.7	134.7	143.8	-114.6	175.4	-178.1	-177.9	0	110.6
471	K	32.4	Very low	33.2	Very low	183 Å²	183	154 Å²	154	80%	0.796	77%	0.768	S	S	*	*			trans	-95.5	154.5	167.9	-64.7	177.4	177.3	179.1	0	109.3
472	H	38.7	Very low	33.3	Very low	175 Å²	175	148 Å²	148	81%	0.81	76%	0.762	S	S	*	*			trans	169.1	147.8	146.8	-84.8	-64	0	0	0	105.1
473	H	36.6	Very low	33.2	Very low	171 Å²	171	144.8 Å²	144.8	79%	0.792	76%	0.76	S	S	*	*			cis	-165.1	-167.4	-22.5	-127.1	59.7	0	0	0	104.8
474	Y	30.3	Very low	32.9	Very low	205 Å²	205	141 Å²	141	80%	0.804	76%	0.756	S	S	*	*			trans	-99.4	164.1	-162.8	-104.3	-90	0	0	0	117.7
475	N	32.8	Very low	32.9	Very low	142 Å²	142	139 Å²	139	76%	0.759	76%	0.759	S	S	*	*			trans	69.1	141	155.3	-71.4	-19.1	0	0	0	117.8
476	S	30.8	Very low	32.9	Very low	98 Å²	98	142.8 Å²	142.8	69%	0.685	77%	0.767	S	S	*	*			cis	178	-163.6	9.6	45.7	0	0	0	0	107.4
477	I	34.4	Very low	32.9	Very low	150 Å²	150	146.1 Å²	146.1	77%	0.769	78%	0.784	S	S	*	*			trans	78.5	85.1	167.8	-51.5	-179.5	0	0	0	116.9
478	S	29.9	Very low	33.2	Very low	98 Å²	98	142.7 Å²	142.7	69%	0.685	78%	0.778	S	S	*	*			trans	27.2	136.2	135.1	58.7	0	0	0	0	123.6
479	S	29	Very low	33.5	Very low	108 Å²	108	141.9 Å²	141.9	76%	0.755	76%	0.764	S	S	*	*			trans	61.1	108.7	139.7	62.6	0	0	0	0	120.5
480	S	34.7	Very low	33.8	Very low	122 Å²	122	144.3 Å²	144.3	85%	0.853	77%	0.765	S	S	*	*				-167	173	109.3	50.1	0	0	0	0	112.2
481	S	30.8	Very low	33.8	Very low	110 Å²	110	140.5 Å²	140.5	77%	0.769	76%	0.755	S	S	*	*			trans	-71.5	163.9	-172.9	50.5	0	0	0	0	116.7
482	S	32	Very low	34.2	Very low	110 Å²	110	139 Å²	139	77%	0.769	74%	0.744	S	S	*	*			trans	113.1	114.4	138.4	-156.5	0	0	0	0	119.2
483	S	29.7	Very low	34.2	Very low	113 Å²	113	134.8 Å²	134.8	79%	0.79	72%	0.721	S	S	*	*			trans	60.6	88.9	137	-172.7	0	0	0	0	121.6
484	S	31.6	Very low	34.2	Very low	119 Å²	119	131.4 Å²	131.4	83%	0.832	71%	0.709	S	S	*	*			trans	-163.8	46.9	155.9	49.8	0	0	0	0	115.6
485	D	32.4	Very low	34.6	Very low	142 Å²	142	124.5 Å²	124.5	76%	0.759	69%	0.691	S	S	*	*			trans	-124	35.4	-168.5	-131.9	-8.5	0	0	0	114.6
486	R	36.6	Very low	35	Very low	240 Å²	240	121.5 Å²	121.5	91%	0.906	67%	0.674	S	S	*	*	S	Bend	trans	-97.9	-12.2	-172.1	-83.7	-170.1	175.8	-176.5	0.6	117.3
487	E	34.4	Very low	35.3	Very low	173 Å²	173	119.6 Å²	119.6	81%	0.808	66%	0.656	S	S	*	*	S	Bend	trans	-109.4	-4.1	-170.8	-66.4	-169.5	117.1	0	0	115.7
488	I	39.7	Very low	35.4	Very low	120 Å²	120	118.5 Å²	118.5	62%	0.615	65%	0.651	S	S	*	*	S	Bend	trans	-91	-30.5	-172.8	-61.6	179	0	0	0	113.2
489	D	39.4	Very low	35.6	Very low	96 Å²	96	119.5 Å²	119.5	51%	0.513	65%	0.648	S	S	.	*	H	α-helix	trans	-80.1	-25.4	-170.7	-100.2	-19.9	0	0	0	115	N491 R492 Y493	D489-N491 VanDerWaalsContact C-N 3.33Å; D489-N491 PolarHBondContact O-N 3.25Å; D489-R492 PolarHBondContact O-N 2.77Å; D489-Y493 PolarHBondContact O-N 3.04Å
490	Q	38.2	Very low	36	Very low	150 Å²	150	116.5 Å²	116.5	70%	0.701	63%	0.625	S	S	*	*	H	α-helix	trans	-63.7	-36.7	-179.2	-73.6	-176.1	-12.1	0	0	112.8	R492 Y493	Q490-R492 VanDerWaalsContact C-N 3.3Å; Q490-R492 PolarHBondContact O-N 3.13Å; Q490-Y493 WeakPolarHBondContact O-CB 3.16Å; Q490-Y493 PolarHBondContact O-N 3.13Å
491	N	36.2	Very low	35.8	Very low	126 Å²	126	117.3 Å²	117.3	67%	0.674	62%	0.62	S	S	*	*	H	α-helix	trans	-70	-24.6	178.6	-78.4	-45.5	0	0	0	113.2	D489	D489-N491 VanDerWaalsContact C-N 3.33Å; D489-N491 PolarHBondContact O-N 3.25Å
492	R	40.4	Very low	35.7	Very low	151 Å²	151	116.5 Å²	116.5	57%	0.57	61%	0.607	S	S	*	*	H	α-helix	trans	-69.2	-39.8	169.9	-76.2	-174.3	169.6	-152.3	-2.8	111.6	D489 Q490 N494 S495	D489-R492 PolarHBondContact O-N 2.77Å; Q490-R492 VanDerWaalsContact C-N 3.3Å; Q490-R492 PolarHBondContact O-N 3.13Å; R492-N494 VanDerWaalsContact C-N 3.33Å; R492-N494 PolarHBondContact O-N 3.05Å; R492-S495 WeakPolarHBondContact O-CB 3.31Å; R492-S495 PolarHBondContact O-N 2.84Å; R492-S495 VanDerWaalsContact O-N 3.07Å; R492-S495 PolarHBondContact O-OG 3.11Å
493	Y	38.6	Very low	35.6	Very low	86 Å²	86	116.5 Å²	116.5	34%	0.337	61%	0.607	S	S	.	*	H	α-helix	trans	-60.5	-41.5	-175.7	-138.6	-89	0	0	0	112.7	T138 P139 D489 Q490 S495 I496	T138-Y493 PolarHBondContact O-OH 2.9Å; P139-Y493 WeakPolarHBondContact CA-OH 3.42Å; P139-Y493 HydrophobicContact CB-CE2 4Å; D489-Y493 PolarHBondContact O-N 3.04Å; Q490-Y493 WeakPolarHBondContact O-CB 3.16Å; Q490-Y493 PolarHBondContact O-N 3.13Å; Y493-S495 VanDerWaalsContact C-N 3.29Å; Y493-S495 PolarHBondContact O-N 3.02Å; Y493-I496 PolarHBondContact O-N 3.13Å
494	N	36.8	Very low	35.6	Very low	100 Å²	100	119.7 Å²	119.7	54%	0.535	61%	0.607	S	S	.	*	H	α-helix	trans	-65.8	-27.8	176.8	-71.5	-29.5	0	0	0	113.7	R492 I496	R492-N494 VanDerWaalsContact C-N 3.33Å; R492-N494 PolarHBondContact O-N 3.05Å; N494-I496 VanDerWaalsContact C-N 3.34Å; N494-I496 PolarHBondContact O-N 2.98Å
495	S	37.4	Very low	35.4	Very low	61 Å²	61	117.7 Å²	117.7	43%	0.427	59%	0.593	S	S	.	*	H	α-helix	trans	-71.7	-25.4	178.8	77.1	0	0	0	0	113.8	R492 Y493	R492-S495 WeakPolarHBondContact O-CB 3.31Å; R492-S495 PolarHBondContact O-N 2.84Å; R492-S495 VanDerWaalsContact O-N 3.07Å; R492-S495 PolarHBondContact O-OG 3.11Å; Y493-S495 VanDerWaalsContact C-N 3.29Å; Y493-S495 PolarHBondContact O-N 3.02Å
496	I	42.3	Very low	35.2	Very low	79 Å²	79	120.7 Å²	120.7	41%	0.405	59%	0.594	S	S	.	*	H	α-helix	trans	-75.5	-43.3	178.1	-63.2	173.4	0	0	0	110.2	Y493 N494 L498 L499	Y493-I496 PolarHBondContact O-N 3.13Å; N494-I496 VanDerWaalsContact C-N 3.34Å; N494-I496 PolarHBondContact O-N 2.98Å; I496-L498 PolarHBondContact O-N 3.42Å; I496-L498 VanDerWaalsContact O-N 3.15Å; I496-L499 PolarHBondContact O-N 2.98Å; I496-L499 VanDerWaalsContact O-N 3.07Å
497	N	37.1	Very low	34.8	Very low	57 Å²	57	114.6 Å²	114.6	31%	0.305	58%	0.579	S	S	.	*	H	α-helix	trans	-67.8	-12.1	-180	-72.4	-28.4	0	0	0	114.6	T500 N501	N497-T500 PolarHBondContact O-OG1 3.15Å; N497-N501 PolarHBondContact O-ND2 3.42Å
498	L	36.3	Very low	34.4	Very low	128 Å²	128	117.5 Å²	117.5	67%	0.67	58%	0.584	S	S	*	*	H	α-helix	trans	-89.7	-6.8	174	-72.6	168.7	0	0	0	113.9	I496	I496-L498 PolarHBondContact O-N 3.42Å; I496-L498 VanDerWaalsContact O-N 3.15Å
499	L	33.7	Very low	33.9	Very low	118 Å²	118	119.4 Å²	119.4	62%	0.618	58%	0.584	S	S	*	*	H	α-helix	trans	-96.8	-33.7	173.6	-73.2	162.3	0	0	0	112.3	I496	I496-L499 PolarHBondContact O-N 2.98Å; I496-L499 VanDerWaalsContact O-N 3.07Å
500	T	37.9	Very low	33.4	Very low	45 Å²	45	122.9 Å²	122.9	28%	0.276	60%	0.597	S	S	.	*	H	α-helix	trans	-70.1	-31.6	179.1	52.9	0	0	0	0	113.5	N497 N502 S503	N497-T500 PolarHBondContact O-OG1 3.15Å; T500-N502 PolarHBondContact O-N 2.95Å; T500-N502 VanDerWaalsContact O-N 3.08Å; T500-S503 PolarHBondContact O-OG 3.18Å
501	N	30.3	Very low	33	Very low	139 Å²	139	124.1 Å²	124.1	74%	0.743	60%	0.6	S	S	*	*	T	Hydrogen-bonded Turn	trans	-76.3	13.4	-177.8	-81.9	-63.4	0	0	0	115.5	N497	N497-N501 PolarHBondContact O-ND2 3.42Å
502	N	29.5	Very low	32.7	Very low	93 Å²	93	125.5 Å²	125.5	50%	0.497	61%	0.607	S	S	.	*	T	Hydrogen-bonded Turn	trans	-111.3	32	172.5	-154.3	27.7	0	0	0	112.2	T500 K504	T500-N502 PolarHBondContact O-N 2.95Å; T500-N502 VanDerWaalsContact O-N 3.08Å; N502-K504 PolarHBondContact O-N 3Å
503	S	28.7	Very low	32.2	Very low	110 Å²	110	126 Å²	126	77%	0.769	62%	0.62	S	S	*	*			trans	-69.3	58.6	-174.7	-72.2	0	0	0	0	114.6	T500 S505	T500-S503 PolarHBondContact O-OG 3.18Å; S503-S505 VanDerWaalsContact C-N 3.34Å; S503-S505 PolarHBondContact O-N 2.68Å; S503-S505 VanDerWaalsContact O-N 3.1Å
504	K	29.4	Very low	31.8	Very low	181 Å²	181	129.1 Å²	129.1	79%	0.787	64%	0.643	S	S	*	*			trans	-79	84	164.9	-74.9	-175.8	179.4	175.5	0	110.3	N502	N502-K504 PolarHBondContact O-N 3Å
505	S	27.5	Very low	31.5	Very low	77 Å²	77	131.9 Å²	131.9	54%	0.538	66%	0.656	S	S	.	*			trans	47.5	95.5	149.6	-162.3	0	0	0	0	117.3	S503 N507	S503-S505 VanDerWaalsContact C-N 3.34Å; S503-S505 PolarHBondContact O-N 2.68Å; S503-S505 VanDerWaalsContact O-N 3.1Å; S505-N507 PolarHBondContact O-N 3.36Å; S505-N507 VanDerWaalsContact OG-CB 3.24Å; S505-N507 WeakPolarHBondContact OG-CB 3.24Å; S505-N507 PolarHBondContact OG-ND2 2.77Å; S505-N507 PolarHBondContact OG-OD1 3.1Å
506	R	29.5	Very low	31.2	Very low	204 Å²	204	134.5 Å²	134.5	77%	0.77	67%	0.674	S	S	*	*			trans	-70.1	46.9	158.5	-83.3	-176	170.7	172.4	-3.5	110.7	D64 Y508	D64-R506 IonicContact OD1-CZ 3.15Å; D64-R506 IonicContact OD1-NH1 2.85Å; D64-R506 PolarHBondContact OD1-NH1 2.57Å; D64-R506 IonicContact OD1-NH2 3.18Å; D64-R506 PolarHBondContact OD1-NH2 3.46Å; D64-R506 IonicContact OD2-NH1 2.94Å; D64-R506 PolarHBondContact OD2-NH1 3Å; R506-Y508 PolarHBondContact O-N 3.26Å; R506-Y508 VanDerWaalsContact O-N 3.1Å
507	N	27.1	Very low	30.6	Very low	113 Å²	113	136.9 Å²	136.9	60%	0.604	70%	0.698	S	S	*	*			trans	-81.3	82.7	174	-84	10.1	0	0	0	110.5	S505	S505-N507 PolarHBondContact O-N 3.36Å; S505-N507 VanDerWaalsContact OG-CB 3.24Å; S505-N507 WeakPolarHBondContact OG-CB 3.24Å; S505-N507 PolarHBondContact OG-ND2 2.77Å; S505-N507 PolarHBondContact OG-OD1 3.1Å
508	Y	26.1	Very low	30.4	Very low	234 Å²	234	140.3 Å²	140.3	92%	0.918	73%	0.727	S	S	*	*			trans	-126.8	37.2	174.5	-108.9	-80.1	0	0	0	113	R506	R506-Y508 PolarHBondContact O-N 3.26Å; R506-Y508 VanDerWaalsContact O-N 3.1Å
509	R	29.8	Very low	30.2	Very low	159 Å²	159	138 Å²	138	60%	0.6	73%	0.734	S	S	*	*			trans	-153.5	73.8	167.8	-168.2	166.9	173.8	172.2	-4	111.2	Y261 R263	Y261-R509 PolarHBondContact O-NH1 3.44Å; Y261-R509 PolarHBondContact O-NH2 2.85Å; R263-R509 PolarHBondContact O-NH1 2.94Å
510	Q	27.9	Very low	30.3	Very low	169 Å²	169	137.9 Å²	137.9	79%	0.79	74%	0.743	S	S	*	*			trans	-154.3	73	177.8	-126.6	175.2	0.3	0	0	112
511	K	29.8	Very low	30.3	Very low	176 Å²	176	145.2 Å²	145.2	77%	0.765	77%	0.774	S	S	*	*	S	Bend	trans	172.9	95.3	157.1	-103.8	-178.6	178.7	-169.5	0	108.8
512	L	30.8	Very low	30.7	Very low	156 Å²	156	145.7 Å²	145.7	82%	0.817	78%	0.782	S	S	*	*	S	Bend	trans	161.2	80.2	165.8	-95.6	168.1	0	0	0	105.9
513	N	30	Very low	31.1	Very low	160 Å²	160	144.5 Å²	144.5	86%	0.856	79%	0.792	S	S	*	*			trans	-178.4	49.9	165.3	-100.9	8.4	0	0	0	109.2
514	D	30.2	Very low	31.5	Very low	152 Å²	152	146.8 Å²	146.8	81%	0.813	80%	0.796	S	S	*	*			trans	-144.2	45.4	-179	-69.4	-66.5	0	0	0	110.3
515	I	31.4	Very low	31.9	Very low	158 Å²	158	142.9 Å²	142.9	81%	0.81	79%	0.791	S	S	*	*			trans	-137.8	76.7	174.3	-50.7	180	0	0	0	109
516	S	29.3	Very low	32.2	Very low	116 Å²	116	144.9 Å²	144.9	81%	0.811	81%	0.805	S	S	*	*			trans	-160.9	149.7	166.8	-73.9	0	0	0	0	107.8
517	S	31.4	Very low	32.6	Very low	130 Å²	130	140 Å²	140	91%	0.909	80%	0.803	S	S	*	*			trans	65.2	76.3	179.9	-55.5	0	0	0	0	117.1
518	S	32.2	Very low	33.2	Very low	128 Å²	128	140.2 Å²	140.2	90%	0.895	81%	0.813	S	S	*	*			trans	-154.2	129.6	139.1	55	0	0	0	0	109.5
519	G	31.9	Very low	34	Very low	80 Å²	80	134.7 Å²	134.7	83%	0.825	81%	0.806	S	S	*	*			trans	172.5	25.3	-170.7	0	0	0	0	0	119.6
520	S	36.2	Very low	34.3	Very low	116 Å²	116	131.7 Å²	131.7	81%	0.811	81%	0.809	S	S	*	*			trans	-165.4	94.7	170.3	57.5	0	0	0	0	113.2
521	E	37.3	Very low	34.9	Very low	199 Å²	199	132.2 Å²	132.2	93%	0.93	81%	0.808	S	S	*	*			trans	-143.2	121.3	160.7	-78.9	-164.8	156.5	0	0	111.9
522	T	40	Very low	35.1	Very low	148 Å²	148	131.8 Å²	131.8	91%	0.908	81%	0.809	S	S	*	*			trans	-150.6	129	163.3	50.1	0	0	0	0	105.2
523	G	35.9	Very low	35.1	Very low	69 Å²	69	131.3 Å²	131.3	71%	0.711	81%	0.806	S	S	*	*			cis	-167.8	-140.8	-0.1	0	0	0	0	0	110.7
524	D	37.6	Very low	35.2	Very low	157 Å²	157	131.3 Å²	131.3	84%	0.84	80%	0.804	S	S	*	*			trans	68.7	83.1	158.9	-59.8	-4.2	0	0	0	120.9
525	S	37.4	Very low	35.1	Very low	100 Å²	100	128.9 Å²	128.9	70%	0.699	80%	0.799	S	S	*	*				64.4	116.4	117.6	65.9	0	0	0	0	123.3
526	S	35.3	Very low	35.1	Very low	118 Å²	118	127.9 Å²	127.9	83%	0.825	80%	0.8	S	S	*	*			trans	67.9	146.1	139.6	75.7	0	0	0	0	119.2
527	S	37.8	Very low	35.1	Very low	103 Å²	103	130.8 Å²	130.8	72%	0.72	80%	0.8	S	S	*	*			cis	-156.4	147.4	23.4	60.5	0	0	0	0	115.7
528	S	39.5	Very low	35	Very low	117 Å²	117	130.2 Å²	130.2	82%	0.818	79%	0.787	S	S	*	*			trans	67.3	153.7	143.6	-63.3	0	0	0	0	123.9
529	P	43	Very low	34.9	Very low	118 Å²	118	134.2 Å²	134.2	77%	0.766	78%	0.783	S	S	*	*			trans	-138.5	179.6	-159.8	42.8	-23.4	0	0	0	116.9
530	S	36	Very low	34.8	Very low	95 Å²	95	140.5 Å²	140.5	66%	0.664	78%	0.782	S	S	*	*			trans	-167.8	126.4	144	-94.2	0	0	0	0	116
531	K	39.3	Very low	34.6	Very low	180 Å²	180	142.7 Å²	142.7	78%	0.783	78%	0.776	S	S	*	*			trans	62.7	145.5	134	-61.9	169.3	-171	175.7	0	119.2
532	H	35.1	Very low	34.3	Very low	167 Å²	167	140.3 Å²	140.3	77%	0.773	77%	0.77	S	S	*	*			cis	-141.8	160.9	2.4	-134.6	-74.8	0	0	0	111.8
533	I	30.2	Very low	33.9	Very low	146 Å²	146	144.7 Å²	144.7	75%	0.749	77%	0.772	S	S	*	*			trans	-97.7	149.2	-175.2	-59.8	158.4	0	0	0	111
534	I	33.5	Very low	33.9	Very low	160 Å²	160	148.7 Å²	148.7	82%	0.821	78%	0.776	S	S	*	*				-177.4	154.9	129.1	-91.4	156.1	0	0	0	112.2
535	S	28	Very low	33.8	Very low	101 Å²	101	148.6 Å²	148.6	71%	0.706	78%	0.776	S	S	*	*			trans	-81.4	-178	-174.9	47.9	0	0	0	0	112.9
536	V	30.9	Very low	33.7	Very low	138 Å²	138	153.9 Å²	153.9	84%	0.836	79%	0.786	S	S	*	*			cis	-156.2	170.4	47.4	177.4	0	0	0	0	112.7
537	H	29.9	Very low	33.6	Very low	177 Å²	177	160.3 Å²	160.3	82%	0.819	79%	0.793	S	S	*	*			trans	-56.3	143.6	-176.4	-97.1	28.7	0	0	0	121.8
538	D	28.9	Very low	33.6	Very low	118 Å²	118	163.6 Å²	163.6	63%	0.631	79%	0.794	S	S	*	*				84.7	152.3	125.7	-155.5	24	0	0	0	123.7
539	R	28.6	Very low	33.5	Very low	211 Å²	211	165.2 Å²	165.2	80%	0.796	79%	0.788	S	S	*	*			trans	75.7	84.3	160.2	-82.1	161.8	-146.6	-142.3	3.2	124.1
540	R	30.3	Very low	33.4	Very low	213 Å²	213	165.8 Å²	165.8	80%	0.804	78%	0.783	S	S	*	*				44.6	121	112.1	-80.8	-176.2	166.8	171.9	1.7	122.5
541	K	32.8	Very low	33.8	Very low	162 Å²	162	166.4 Å²	166.4	70%	0.704	79%	0.785	S	S	*	*				105.7	112.8	119	-81.1	-177.6	174	-172.1	0	123.1
542	N	30.6	Very low	33.7	Very low	148 Å²	148	168.9 Å²	168.9	79%	0.791	79%	0.79	S	S	*	*				64.5	130.4	129.4	-70.9	51.3	0	0	0	123.1
543	Y	31.5	Very low	33.9	Very low	241 Å²	241	165.6 Å²	165.6	95%	0.945	79%	0.786	S	S	*	*			trans	-80.3	177.8	166	-95	-102.7	0	0	0	114.3
544	N	34.9	Very low	34.3	Very low	152 Å²	152	163 Å²	163	81%	0.813	78%	0.781	S	S	*	*			trans	-134.1	171.6	-155.2	-154.2	-3.7	0	0	0	114.9
545	N	36.4	Very low	34.6	Very low	156 Å²	156	160.2 Å²	160.2	83%	0.834	78%	0.775	S	S	*	*			trans	-74.6	171.9	-171.7	-71.9	-32.4	0	0	0	116.4
546	K	34.5	Very low	35.2	Very low	210 Å²	210	162.9 Å²	162.9	91%	0.913	78%	0.776	S	S	*	*			trans	-132.8	125.6	164.3	-99.6	-177.2	176.7	175.2	0	113.3
547	R	33.4	Very low	35.5	Very low	254 Å²	254	163.6 Å²	163.6	96%	0.958	78%	0.775	S	S	*	*			trans	-168.4	161.7	151.2	-109.3	-177.7	179.3	-164.1	-1.4	110.3
548	K	38	Very low	35.9	Very low	171 Å²	171	159.1 Å²	159.1	74%	0.743	76%	0.764	S	S	*	*			trans	-125.9	176.5	175.4	-65	-172.9	-179.8	-178.4	0	108.9
549	H	38.3	Very low	36.3	Very low	151 Å²	151	161.7 Å²	161.7	70%	0.699	77%	0.772	S	S	*	*			cis	-112.2	171.6	3.2	-90.6	-111.9	0	0	0	111
550	I	39.6	Very low	36.5	Very low	130 Å²	130	156.7 Å²	156.7	67%	0.667	77%	0.765	S	S	*	*			cis	88.7	133.8	29.2	-78.2	165.1	0	0	0	114
551	P	45.6	Very low	36.6	Very low	108 Å²	108	151.7 Å²	151.7	70%	0.701	76%	0.763	S	S	*	*				-149.4	-144.1	-125.1	45.6	-23.5	0	0	0	115.8
552	R	35.8	Very low	36.7	Very low	233 Å²	233	148.2 Å²	148.2	88%	0.879	76%	0.759	S	S	*	*			trans	110.2	147.1	164.6	-70.6	-177.4	171.2	178.6	-4.3	115.4
553	S	39.5	Very low	36.9	Very low	98 Å²	98	150.1 Å²	150.1	69%	0.685	76%	0.76	S	S	*	*			cis	-162.6	159.1	-2.5	37.2	0	0	0	0	113
554	S	38.7	Very low	37	Very low	92 Å²	92	142.9 Å²	142.9	64%	0.643	75%	0.745	S	S	*	*			trans	24.5	153.4	145.9	63.4	0	0	0	0	121.6
555	S	40.8	Very low	37.1	Very low	100 Å²	100	143.3 Å²	143.3	70%	0.699	75%	0.747	S	S	*	*			cis	-169.9	-166.9	8.6	25.6	0	0	0	0	109.9
556	E	39.7	Very low	36.9	Very low	157 Å²	157	144.3 Å²	144.3	73%	0.734	75%	0.747	S	S	*	*				-168.5	174.7	-65.4	-91.1	128.1	-144.4	0	0	108.4
557	D	37.7	Very low	37.2	Very low	154 Å²	154	138 Å²	138	82%	0.824	73%	0.728	S	S	*	*			trans	67	157.7	171.7	-81.1	-38.2	0	0	0	121.2
558	S	38.2	Very low	37.1	Very low	82 Å²	82	135.5 Å²	135.5	57%	0.573	72%	0.718	S	S	*	*			cis	-170.7	154.4	-31	-115.9	0	0	0	0	113.5
559	Q	37.9	Very low	37	Very low	172 Å²	172	136.3 Å²	136.3	80%	0.804	72%	0.722	S	S	*	*			trans	64.9	160.4	153.4	-64.7	175.5	47.6	0	0	119.8
560	T	32.1	Very low	36.7	Very low	107 Å²	107	134.3 Å²	134.3	66%	0.656	73%	0.725	S	S	*	*			cis	-165.3	162.1	-20.9	29.1	0	0	0	0	111.2
561	S	33.6	Very low	36.8	Very low	108 Å²	108	133.3 Å²	133.3	76%	0.755	73%	0.727	S	S	*	*			trans	65.1	156.7	149.2	52.9	0	0	0	0	119.8
562	S	34.5	Very low	36.3	Very low	88 Å²	88	133.9 Å²	133.9	62%	0.615	73%	0.729	S	S	*	*			cis	-166.5	175.7	-11.3	40	0	0	0	0	111.2
563	F	33.5	Very low	36.2	Very low	188 Å²	188	130.4 Å²	130.4	83%	0.825	72%	0.722	S	S	*	*			trans	69.3	156	170.7	-60.8	-81.9	0	0	0	117.8
564	S	35.2	Very low	36	Very low	90 Å²	90	134.4 Å²	134.4	63%	0.629	73%	0.729	S	S	*	*			cis	177.7	153	-42.7	-100.9	0	0	0	0	109.5
565	D	35.3	Very low	35.8	Very low	160 Å²	160	136.6 Å²	136.6	86%	0.856	73%	0.734	S	S	*	*			trans	109.1	144.9	153.7	-58.6	-23.8	0	0	0	120.2
566	E	33	Very low	35.5	Very low	178 Å²	178	137.2 Å²	137.2	83%	0.832	74%	0.736	S	S	*	*			trans	-140	-162.7	-173.8	-132.7	-146	146.9	0	0	105.8
567	P	40.1	Very low	35.4	Very low	78 Å²	78	136.8 Å²	136.8	51%	0.506	74%	0.743	S	S	.	*			cis	-135.9	-171.7	-13.6	27.8	-3	0	0	0	114.6
568	R	32.5	Very low	35.1	Very low	201 Å²	201	138.3 Å²	138.3	76%	0.758	74%	0.743	S	S	*	*			trans	72.5	152.2	160.8	-37.6	-176.1	-173	-170.2	0.6	115.7
569	F	34.7	Very low	34.7	Very low	188 Å²	188	140.5 Å²	140.5	83%	0.825	75%	0.753	S	S	*	*			cis	-140.4	172.8	20.3	-98	-85.6	0	0	0	113.4
570	S	31.6	Very low	34.6	Very low	108 Å²	108	142.7 Å²	142.7	76%	0.755	76%	0.76	S	S	*	*			trans	-131.8	-170.4	175.8	-28.9	0	0	0	0	109.3
571	P	42	Very low	34.6	Very low	110 Å²	110	143.1 Å²	143.1	71%	0.714	77%	0.767	S	S	*	*			cis	-129.5	-167.7	-35.1	32.3	-11.9	0	0	0	111.6
572	T	35.1	Very low	34.7	Very low	119 Å²	119	144.2 Å²	144.2	73%	0.73	77%	0.765	S	S	*	*				160.9	160.1	124.1	44.3	0	0	0	0	115.7
573	H	35.2	Very low	34.5	Very low	160 Å²	160	151.6 Å²	151.6	74%	0.741	78%	0.779	S	S	*	*			trans	48.7	116.1	157.4	-69.7	-66.3	0	0	0	122.5
574	H	35.6	Very low	34.6	Very low	182 Å²	182	152.4 Å²	152.4	84%	0.843	78%	0.776	S	S	*	*				-161.3	173.1	92.9	-126.4	61.6	0	0	0	114
575	N	34.2	Very low	34.6	Very low	138 Å²	138	156.8 Å²	156.8	74%	0.738	79%	0.787	S	S	*	*			trans	-95.2	163.3	-161.5	-96.3	-32.8	0	0	0	116.4
576	P	32.8	Very low	34.4	Very low	113 Å²	113	157.8 Å²	157.8	73%	0.734	79%	0.791	S	S	*	*			trans	-90.5	159.1	179.8	36.9	-35.7	0	0	0	114.1
577	V	37.5	Very low	34.4	Very low	148 Å²	148	154.1 Å²	154.1	90%	0.897	79%	0.785	S	S	*	*			trans	-126.7	143.1	170.2	178.9	0	0	0	0	110.2
578	K	32.8	Very low	34.3	Very low	187 Å²	187	155.9 Å²	155.9	81%	0.813	80%	0.797	S	S	*	*			trans	-99.1	146.1	-170.6	-68.3	179.4	176.7	174.8	0	113.7
579	T	30.1	Very low	34.3	Very low	128 Å²	128	152 Å²	152	79%	0.785	80%	0.797	S	S	*	*			trans	42.4	125.2	142.3	59.4	0	0	0	0	120.9
580	K	35.2	Very low	34	Very low	217 Å²	217	152.4 Å²	152.4	94%	0.943	80%	0.795	S	S	*	*				-122.1	148	126.4	-88	-171.2	174.3	-179.3	0	109.9
581	S	32.5	Very low	34	Very low	116 Å²	116	151.8 Å²	151.8	81%	0.811	80%	0.796	S	S	*	*			trans	-96.1	145.9	-174	53.5	0	0	0	0	112.1
582	D	35.1	Very low	33.6	Very low	132 Å²	132	153.5 Å²	153.5	71%	0.706	79%	0.789	S	S	*	*			trans	-136.8	129.4	161.3	-152.7	-24.6	0	0	0	109.4	R584	D582-R584 IonicContact OD1-NE 2.78Å; D582-R584 IonicContact OD2-NH2 2.72Å
583	R	30.7	Very low	33.4	Very low	243 Å²	243	155.5 Å²	155.5	92%	0.917	78%	0.783	S	S	*	*			trans	-99.1	102.2	-171.9	-80.6	179.6	169.3	177.2	-3.3	110.1
584	R	35.7	Very low	33.1	Very low	204 Å²	204	155.5 Å²	155.5	77%	0.77	79%	0.786	S	S	*	*			trans	-139.5	120.1	168.2	-59.7	-173	-161.3	-152.5	4.3	112.6	D582	D582-R584 IonicContact OD1-NE 2.78Å; D582-R584 IonicContact OD2-NH2 2.72Å
585	H	35.6	Very low	32.9	Very low	182 Å²	182	151.7 Å²	151.7	84%	0.843	77%	0.771	S	S	*	*			trans	35.2	103.4	162.6	-61.7	-83	0	0	0	119.3	S587	H585-S587 PolarHBondContact O-N 3.13Å; H585-S587 VanDerWaalsContact O-N 3.1Å
586	L	31	Very low	32.7	Very low	182 Å²	182	155.3 Å²	155.3	95%	0.953	78%	0.776	S	S	*	*			trans	-71.9	92	163.3	-80.4	156.9	0	0	0	111.3
587	S	32	Very low	32.8	Very low	101 Å²	101	157.4 Å²	157.4	71%	0.706	78%	0.781	S	S	*	*	P	Polyproline II helix	trans	-73.1	129.7	163.5	-66.1	0	0	0	0	110.4	H585	H585-S587 PolarHBondContact O-N 3.13Å; H585-S587 VanDerWaalsContact O-N 3.1Å
588	P	37.5	Very low	32.4	Very low	115 Å²	115	157 Å²	157	75%	0.747	77%	0.768	S	S	*	*	P	Polyproline II helix	trans	-60.8	144.8	179.1	-26.4	35.7	0	0	0	113.6
589	P	32.6	Very low	32.6	Very low	119 Å²	119	153.9 Å²	153.9	77%	0.773	77%	0.769	S	S	*	*	P	Polyproline II helix	trans	-81.3	128.1	-167.4	-13.5	30.5	0	0	0	114.7	A591	P589-A591 VanDerWaalsContact C-N 3.32Å; P589-A591 PolarHBondContact O-N 3.19Å
590	Y	30.1	Very low	32.8	Very low	197 Å²	197	156.2 Å²	156.2	77%	0.773	77%	0.771	S	S	*	*			trans	46.8	26.3	133.2	-113.6	-75.7	0	0	0	121.5	Y592	Y590-Y592 PolarHBondContact O-N 3.37Å
591	A	30.6	Very low	32.6	Very low	94 Å²	94	155.7 Å²	155.7	78%	0.777	77%	0.768	S	S	*	*			trans	-66.8	-17.1	174.4	0	0	0	0	0	114.6	P589 R593	P589-A591 VanDerWaalsContact C-N 3.32Å; P589-A591 PolarHBondContact O-N 3.19Å; A591-R593 VanDerWaalsContact C-N 3.34Å; A591-R593 PolarHBondContact O-N 2.84Å
592	Y	32.8	Very low	32.8	Very low	146 Å²	146	155.8 Å²	155.8	57%	0.573	77%	0.769	S	S	*	*			trans	-84.1	64.4	-177.3	-88.7	-72.9	0	0	0	113.7	P72 Q73 V74 Y590	P72-Y592 HydrophobicContact CB-CE1 4.33Å; Q73-Y592 HydrophobicContact CB-CE1 4.25Å; Q73-Y592 PolarHBondContact N-OH 3.32Å; V74-Y592 WeakPolarHBondContact CG2-OH 3.4Å; V74-Y592 PolarHBondContact N-OH 3.17Å; Y590-Y592 PolarHBondContact O-N 3.37Å
593	R	30.8	Very low	32.7	Very low	161 Å²	161	158.8 Å²	158.8	61%	0.608	78%	0.776	S	S	*	*			trans	-151.3	88.1	169.4	-156.5	174.8	-175.4	127.8	8.2	114.9	A591 D595	A591-R593 VanDerWaalsContact C-N 3.34Å; A591-R593 PolarHBondContact O-N 2.84Å; R593-D595 WeakPolarHBondContact CD-OD2 3.15Å; R593-D595 WeakPolarHBondContact CG-OD2 3.44Å; R593-D595 IonicContact CZ-OD1 2.69Å; R593-D595 VanDerWaalsContact NE-CG 3.27Å; R593-D595 IonicContact NE-OD1 2.7Å; R593-D595 PolarHBondContact NE-OD1 2.96Å; R593-D595 IonicContact NE-OD2 2.74Å; R593-D595 PolarHBondContact NE-OD2 3.02Å; R593-D595 IonicContact NH2-OD1 3.44Å; R593-D595 PolarHBondContact O-N 3Å; R593-D595 VanDerWaalsContact O-N 3.13Å
594	M	30.3	Very low	33.1	Very low	160 Å²	160	156.6 Å²	156.6	79%	0.788	78%	0.775	S	S	*	*			trans	-79.3	82.3	163.4	-76.1	-71	176.8	0	0	110.1	Y596	M594-Y596 HydrophobicContact CB-CE2 4.38Å; M594-Y596 PolarHBondContact O-N 2.94Å
595	D	30.6	Very low	33	Very low	102 Å²	102	158.4 Å²	158.4	55%	0.545	78%	0.782	S	S	.	*			trans	-70.5	95.7	173.5	-78.6	-43.3	0	0	0	110.6	R593 N597	R593-D595 WeakPolarHBondContact CD-OD2 3.15Å; R593-D595 WeakPolarHBondContact CG-OD2 3.44Å; R593-D595 IonicContact CZ-OD1 2.69Å; R593-D595 VanDerWaalsContact NE-CG 3.27Å; R593-D595 IonicContact NE-OD1 2.7Å; R593-D595 PolarHBondContact NE-OD1 2.96Å; R593-D595 IonicContact NE-OD2 2.74Å; R593-D595 PolarHBondContact NE-OD2 3.02Å; R593-D595 IonicContact NH2-OD1 3.44Å; R593-D595 PolarHBondContact O-N 3Å; R593-D595 VanDerWaalsContact O-N 3.13Å; D595-N597 VanDerWaalsContact C-N 3.31Å; D595-N597 PolarHBondContact O-N 3.28Å
596	Y	31.3	Very low	33.1	Very low	215 Å²	215	154.9 Å²	154.9	84%	0.843	78%	0.778	S	S	*	*			trans	-67.1	81.9	175.3	-86.5	-85.3	0	0	0	112	M594 K598	M594-Y596 HydrophobicContact CB-CE2 4.38Å; M594-Y596 PolarHBondContact O-N 2.94Å; Y596-K598 PolarHBondContact O-N 3.37Å
597	N	34.5	Very low	33.3	Very low	157 Å²	157	151 Å²	151	84%	0.84	77%	0.766	S	S	*	*			trans	-64.1	103.1	180	-102.5	-33.6	0	0	0	112.5	D595 S599	D595-N597 VanDerWaalsContact C-N 3.31Å; D595-N597 PolarHBondContact O-N 3.28Å; N597-S599 PolarHBondContact O-N 3.32Å; N597-S599 VanDerWaalsContact O-N 3.12Å
598	K	29.3	Very low	33.6	Very low	140 Å²	140	153.1 Å²	153.1	61%	0.609	77%	0.769	S	S	*	*			trans	-85.9	78.6	-175	-163.7	175.3	-173.6	177.1	0	110.6	Y596 H600	Y596-K598 PolarHBondContact O-N 3.37Å; K598-H600 PolarHBondContact O-N 3.12Å
599	S	36.2	Very low	33.5	Very low	120 Å²	120	158.7 Å²	158.7	84%	0.839	78%	0.775	S	S	*	*			trans	-53.5	125.8	-173.3	-174.8	0	0	0	0	114	N597	N597-S599 PolarHBondContact O-N 3.32Å; N597-S599 VanDerWaalsContact O-N 3.12Å
600	H	35.1	Very low	33.7	Very low	177 Å²	177	157.8 Å²	157.8	82%	0.819	77%	0.771	S	S	*	*			trans	-74.9	154.4	177.9	-81.2	-124.7	0	0	0	112	K598	K598-H600 PolarHBondContact O-N 3.12Å
601	K	31.1	Very low	34.2	Very low	207 Å²	207	153 Å²	153	90%	0.9	77%	0.772	S	S	*	*			trans	-107.6	115.1	163.6	-76.3	-176	173.8	-178.3	0	110
602	S	35.7	Very low	34.9	Very low	117 Å²	117	153.9 Å²	153.9	82%	0.818	77%	0.77	S	S	*	*			trans	-94.9	168.7	155	62.5	0	0	0	0	110
603	K	32.2	Very low	35.2	Very low	195 Å²	195	154.7 Å²	154.7	85%	0.848	79%	0.785	S	S	*	*			trans	-128.9	142.2	174.3	-59	172.8	-175.7	169.7	0	108
604	H	39.3	Very low	35.6	Very low	197 Å²	197	150 Å²	150	91%	0.912	79%	0.787	S	S	*	*			trans	-135	159	156.2	-99.8	-92.3	0	0	0	110.4
605	R	34	Very low	36.1	Very low	242 Å²	242	151.3 Å²	151.3	91%	0.913	79%	0.791	S	S	*	*			trans	-157.8	140	-168.2	-177.3	-171.2	-174.7	-140.7	2.9	111
606	S	38.3	Very low	36.5	Very low	109 Å²	109	151.2 Å²	151.2	76%	0.762	80%	0.798	S	S	*	*			trans	-133.3	137.8	159.5	33.3	0	0	0	0	107
607	S	35.6	Very low	36.8	Very low	100 Å²	100	144.6 Å²	144.6	70%	0.699	80%	0.796	S	S	*	*				72	128.9	67.1	-131.9	0	0	0	0	111
608	L	38.7	Very low	37	Very low	146 Å²	146	148.2 Å²	148.2	76%	0.764	80%	0.797	S	S	*	*			cis	-137.6	152.8	28.6	-78.8	161.3	0	0	0	111.6
609	R	34.1	Very low	37.4	Very low	232 Å²	232	148.6 Å²	148.6	88%	0.875	80%	0.804	S	S	*	*				58.1	138.8	96.2	-115.4	-171.3	-168.3	-160	3.7	114.5
610	S	36.7	Very low	37.5	Very low	99 Å²	99	150.1 Å²	150.1	69%	0.692	80%	0.802	S	S	*	*			cis	-156.1	149.6	10.5	-36.9	0	0	0	0	110.6
611	A	40.1	Very low	37.4	Very low	96 Å²	96	150.6 Å²	150.6	79%	0.793	80%	0.797	S	S	*	*				123.4	158.7	99.5	0	0	0	0	0	112.2
612	P	46.9	Very low	37.7	Very low	113 Å²	113	146.4 Å²	146.4	73%	0.734	78%	0.78	S	S	*	*			trans	-139.9	-171.7	-154.3	42.5	-22.8	0	0	0	118.7
613	N	38.6	Very low	37.9	Very low	163 Å²	163	147.6 Å²	147.6	87%	0.872	77%	0.773	S	S	*	*			trans	123.6	144.2	160.5	-64.3	-11.3	0	0	0	113.8
614	G	39.7	Very low	38.1	Very low	64 Å²	64	142.7 Å²	142.7	66%	0.66	76%	0.763	S	S	*	*			cis	-180	171.3	-7.7	0	0	0	0	0	113.8
615	E	39.7	Very low	38.1	Very low	187 Å²	187	139.8 Å²	139.8	87%	0.874	75%	0.754	S	S	*	*			trans	68.3	155.8	156.9	-58.7	-143.2	88	0	0	121.6
616	S	38.7	Very low	38.3	Very low	100 Å²	100	135.2 Å²	135.2	70%	0.699	74%	0.743	S	S	*	*			cis	-166.5	147.6	-22.4	-97.8	0	0	0	0	114.2
617	G	39.1	Very low	38.3	Very low	76 Å²	76	140.4 Å²	140.4	78%	0.784	75%	0.746	S	S	*	*			trans	76.9	158.6	160.4	0	0	0	0	0	119
618	R	37.8	Very low	38.3	Very low	233 Å²	233	142.3 Å²	142.3	88%	0.879	75%	0.748	S	S	*	*			cis	-154.2	160	-14.5	-79.9	-173.7	179.8	179.7	0.1	106.4
619	I	37.6	Very low	38.3	Very low	147 Å²	147	141.8 Å²	141.8	75%	0.754	75%	0.75	S	S	*	*			cis	79	124.1	33.7	-56	168.7	0	0	0	111.3
620	L	38	Very low	38.4	Very low	152 Å²	152	135.3 Å²	135.3	80%	0.796	74%	0.741	S	S	*	*			cis	-109.4	-123.1	26.1	-83.3	94.8	0	0	0	117.8
621	R	34.1	Very low	38.6	Very low	188 Å²	188	135.4 Å²	135.4	71%	0.709	74%	0.741	S	S	*	*				177.8	169.5	-123.3	-162.7	-165.7	170.8	-144	5.4	112.9
622	E	37.1	Very low	38.5	Very low	118 Å²	118	140.2 Å²	140.2	55%	0.551	74%	0.739	S	S	*	*			trans	80.8	154.3	157.5	-52.1	-169.2	-125.9	0	0	119
623	H	39	Very low	38.3	Very low	142 Å²	142	141.5 Å²	141.5	66%	0.657	74%	0.735	S	S	*	*			cis	-163.4	155	-21.4	-112.7	137.8	0	0	0	114.7
624	S	37.6	Very low	38.6	Very low	92 Å²	92	140.4 Å²	140.4	64%	0.643	72%	0.724	S	S	*	*			trans	68	127.8	139.6	-60.3	0	0	0	0	127.2
625	N	38.2	Very low	38.9	Very low	136 Å²	136	143.2 Å²	143.2	73%	0.727	72%	0.724	S	S	*	*				109.4	130.8	123.9	-83.5	-10.6	0	0	0	126.3
626	H	39.6	Very low	39.2	Very low	146 Å²	146	141.1 Å²	141.1	68%	0.676	71%	0.714	S	S	*	*			trans	77.7	117.3	142	-77.1	-46.8	0	0	0	126.4
627	R	37.6	Very low	39.7	Very low	218 Å²	218	143.3 Å²	143.3	82%	0.823	71%	0.713	S	S	*	*				58.5	157.5	127	-75.9	-171.8	171.7	-175.7	-1	121.4
628	L	35.9	Very low	40.2	Very low	141 Å²	141	150.3 Å²	150.3	74%	0.738	72%	0.715	S	S	*	*			cis	-177.6	160.5	-34.1	-128.5	-176.9	0	0	0	108.5
629	V	39	Very low	40.9	Very low	134 Å²	134	154.6 Å²	154.6	81%	0.812	73%	0.732	S	S	*	*			trans	70.4	155.1	168.2	-178.7	0	0	0	0	115.7
630	S	36.2	Very low	41.1	Very low	97 Å²	97	155 Å²	155	68%	0.678	73%	0.731	S	S	*	*			cis	-177.4	157.8	-40.5	-170.5	0	0	0	0	109.9
631	S	39.2	Very low	41.2	Very low	101 Å²	101	155.1 Å²	155.1	71%	0.706	73%	0.727	S	S	*	*			trans	65.4	158.9	166.2	-88.9	0	0	0	0	117.9
632	R	38.4	Very low	41.6	Very low	197 Å²	197	153.3 Å²	153.3	74%	0.743	73%	0.728	S	S	*	*			cis	-166.7	163.5	-19.6	-122	179.4	-174.2	-165.6	5.1	109.8
633	H	43	Very low	41.9	Very low	140 Å²	140	155.4 Å²	155.4	65%	0.648	74%	0.738	S	S	*	*			trans	67.5	160.3	163.1	-61.3	-36.1	0	0	0	116.6
634	H	44.1	Very low	42.1	Very low	140 Å²	140	156.2 Å²	156.2	65%	0.648	74%	0.744	S	S	*	*			cis	-148.2	156.7	5.4	-121.9	-41.1	0	0	0	110.5
635	D	46.1	Very low	42.4	Very low	123 Å²	123	160.5 Å²	160.5	66%	0.658	75%	0.75	S	S	*	*			trans	52.9	159.3	134.5	-67.2	11.2	0	0	0	123.6
636	H	47.3	Very low	42.7	Very low	142 Å²	142	162.2 Å²	162.2	66%	0.657	75%	0.752	S	S	*	*			cis	-163.6	151.4	-37.1	-140.5	-74.6	0	0	0	109.3
637	H	49.3	Very low	42.9	Very low	147 Å²	147	163.5 Å²	163.5	68%	0.681	76%	0.758	S	S	*	*			trans	54	132.8	155.5	-85.2	-26.7	0	0	0	125
638	R	48.4	Very low	43.4	Very low	222 Å²	222	158.9 Å²	158.9	84%	0.838	75%	0.752	S	S	*	*			trans	57.8	111.1	137.5	-69.8	-177.7	169.5	-171.3	-2.6	119.9
639	R	53.3	Low	44	Very low	323 Å²	323	160.5 Å²	160.5	100%	1.219	75%	0.754	S	S	*	*				-130.2	0	86.9	-100.3	-175.2	178.1	-171.1	-0.7	110.4

Retrieved 639 of 639 residues in 113.7 ms (Link to these results)

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